A0A087WQQ0_MOUSE Loading...

Predicted gene 28557

AlphaFold DB , UniProt , Accession A0A087WQQ0, Species MOUSE (Mus musculus, Mouse), Gene Gm28557, Length 336 aa.

Structure Viewer

Loading PAE data...

(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	37.9	Very low	34.8	Very low	237 Å²	237	157.2 Å²	157.2	100%	1.167	80%	0.797	S	S	*	*				0	139	0	-82.2	-169	-83.8	0	0	107.4
2	L	33.9	Very low	34.8	Very low	144 Å²	144	150.3 Å²	150.3	75%	0.754	80%	0.795	S	S	*	*			trans	67.7	75.6	177.4	-65.7	158.7	0	0	0	116.5
3	E	31.1	Very low	34.8	Very low	187 Å²	187	152.2 Å²	152.2	87%	0.874	79%	0.793	S	S	*	*			trans	-171.1	85.2	149.3	-108.8	169.4	-150.4	0	0	108.2
4	N	35.8	Very low	34.8	Very low	147 Å²	147	149.1 Å²	149.1	79%	0.786	79%	0.791	S	S	*	*			trans	179.6	30.4	159.6	-92.1	-25.8	0	0	0	111.7
5	F	33.3	Very low	35.3	Very low	136 Å²	136	151.1 Å²	151.1	60%	0.596	79%	0.79	S	S	*	*			trans	-95.7	6.4	177	-97	-85.2	0	0	0	113.7	L8	F5-L8 HydrophobicContact CE1-CD1 4.49Å
6	S	30.9	Very low	35.6	Very low	99 Å²	99	146.4 Å²	146.4	69%	0.692	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-4.8	-177.4	54.6	0	0	0	0	115.2
7	H	36.7	Very low	36.1	Very low	174 Å²	174	146.4 Å²	146.4	81%	0.806	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	8.8	179.8	-83.9	-71.7	0	0	0	115.6
8	L	39.3	Very low	36.5	Very low	133 Å²	133	143.2 Å²	143.2	70%	0.696	76%	0.755	S	S	*	*	S	Bend	trans	-105.6	16.3	-177	-80.2	168.8	0	0	0	115.4	F5	F5-L8 HydrophobicContact CE1-CD1 4.49Å
9	V	33.9	Very low	36.9	Very low	123 Å²	123	142.1 Å²	142.1	75%	0.745	75%	0.749	S	S	*	*			trans	-100.3	1	-177	-174.5	0	0	0	0	114.2
10	F	34.6	Very low	37.4	Very low	203 Å²	203	140.7 Å²	140.7	89%	0.89	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	10	-175.1	-103.8	-81.1	0	0	0	117.4
11	L	35.6	Very low	38	Very low	146 Å²	146	137.5 Å²	137.5	76%	0.764	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.7	17.8	174.9	-72.4	177.4	0	0	0	115.6	F13	L11-F13 VanDerWaalsContact C-N 3.3Å; L11-F13 HydrophobicContact CB-CD2 4.39Å; L11-F13 WeakPolarHBondContact O-CD2 3.26Å; L11-F13 WeakPolarHBondContact O-CE2 3.37Å; L11-F13 PolarHBondContact O-N 3.12Å; L11-F13 VanDerWaalsContact O-N 3.08Å
12	G	34.9	Very low	38.4	Very low	74 Å²	74	135.7 Å²	135.7	76%	0.763	71%	0.708	S	S	*	*			trans	58.9	29.4	162.8	0	0	0	0	0	117
13	F	34.2	Very low	38.9	Very low	175 Å²	175	132.7 Å²	132.7	77%	0.768	69%	0.689	S	S	*	*			trans	-110.9	105	173.1	-70	-74.6	0	0	0	110.2	L11	L11-F13 VanDerWaalsContact C-N 3.3Å; L11-F13 HydrophobicContact CB-CD2 4.39Å; L11-F13 WeakPolarHBondContact O-CD2 3.26Å; L11-F13 WeakPolarHBondContact O-CE2 3.37Å; L11-F13 PolarHBondContact O-N 3.12Å; L11-F13 VanDerWaalsContact O-N 3.08Å
14	S	34.6	Very low	39.5	Very low	110 Å²	110	128.3 Å²	128.3	77%	0.769	67%	0.671	S	S	*	*			trans	-83.4	107.2	168.7	37.8	0	0	0	0	109.3
15	F	43.1	Very low	40	Very low	178 Å²	178	126.7 Å²	126.7	78%	0.781	66%	0.659	S	S	*	*			trans	-133.3	140.5	160.5	-78.7	-77	0	0	0	111.4
16	S	39.9	Very low	40.5	Very low	76 Å²	76	127.9 Å²	127.9	53%	0.531	66%	0.664	S	S	.	*			trans	-71.6	139	-168.3	54	0	0	0	0	111.7	P18 L19	S16-P18 WeakPolarHBondContact O-CD 3.43Å; S16-L19 PolarHBondContact O-N 2.76Å
17	K	43.5	Very low	41	Very low	147 Å²	147	125.4 Å²	125.4	64%	0.639	64%	0.643	S	S	*	*	H	α-helix	trans	-43.7	-29.6	175.4	-67.9	174.3	178.1	173	0	116.3	L19	K17-L19 PolarHBondContact O-N 3.31Å
18	P	43.9	Very low	41.2	Very low	88 Å²	88	122.5 Å²	122.5	57%	0.571	63%	0.63	S	S	*	*	H	α-helix	trans	-68.5	-31.6	-175.4	-21.9	34	0	0	0	115.9	S16 R22	S16-P18 WeakPolarHBondContact O-CD 3.43Å; P18-R22 PolarHBondContact O-N 3.1Å
19	L	44.4	Very low	41.2	Very low	123 Å²	123	122.9 Å²	122.9	64%	0.644	63%	0.628	S	S	*	*	H	α-helix	trans	-74.2	-29.8	-177.8	-74.2	173.7	0	0	0	112.6	S16 K17 F23	S16-L19 PolarHBondContact O-N 2.76Å; K17-L19 PolarHBondContact O-N 3.31Å; L19-F23 WeakPolarHBondContact O-CB 3.41Å; L19-F23 PolarHBondContact O-N 3.39Å
20	L	46.8	Very low	41.4	Very low	114 Å²	114	123.2 Å²	123.2	60%	0.597	62%	0.624	S	S	*	*	H	α-helix	trans	-71.7	-38.3	177.9	-162	76.4	0	0	0	111.6	F23 L24	L20-F23 PolarHBondContact O-N 3.25Å; L20-L24 VanDerWaalsContact O-CG 3.29Å; L20-L24 WeakPolarHBondContact O-CG 3.46Å; L20-L24 PolarHBondContact O-N 2.85Å
21	V	50.3	Low	41.9	Very low	74 Å²	74	121.5 Å²	121.5	45%	0.448	61%	0.612	S	S	.	*	H	α-helix	trans	-68.3	-45.8	179	177.4	0	0	0	0	111.1	F23 L24 E25	V21-F23 VanDerWaalsContact C-N 3.26Å; V21-F23 PolarHBondContact O-N 3.48Å; V21-L24 PolarHBondContact O-N 3.29Å; V21-L24 VanDerWaalsContact O-N 3.09Å; V21-E25 PolarHBondContact O-N 3.26Å
22	R	45	Very low	41.9	Very low	198 Å²	198	119.3 Å²	119.3	75%	0.747	60%	0.601	S	S	*	*	H	α-helix	trans	-62.5	-31.1	175	-83	-170.3	160.2	-179.8	-3.6	113.4	P18 K26	P18-R22 PolarHBondContact O-N 3.1Å; R22-K26 PolarHBondContact O-N 3.09Å
23	F	44.2	Very low	42.1	Very low	81 Å²	81	121.3 Å²	121.3	36%	0.355	60%	0.598	S	S	.	*	H	α-helix	trans	-72.2	-35.2	174.2	-172.9	-96.6	0	0	0	112.4	L19 L20 V21 N27	L19-F23 WeakPolarHBondContact O-CB 3.41Å; L19-F23 PolarHBondContact O-N 3.39Å; L20-F23 PolarHBondContact O-N 3.25Å; V21-F23 VanDerWaalsContact C-N 3.26Å; V21-F23 PolarHBondContact O-N 3.48Å; F23-N27 WeakPolarHBondContact CD1-ND2 3.16Å; F23-N27 WeakPolarHBondContact CE1-ND2 3.18Å; F23-N27 VanDerWaalsContact CZ-ND2 3.3Å; F23-N27 WeakPolarHBondContact CZ-ND2 3.41Å; F23-N27 PolarHBondContact O-N 3.15Å; F23-N27 PolarHBondContact O-ND2 3.11Å
24	L	44.5	Very low	42.2	Very low	96 Å²	96	121.3 Å²	121.3	50%	0.503	60%	0.598	S	S	.	*	H	α-helix	trans	-70	-44.2	176.5	-71.3	169.8	0	0	0	111.6	L20 V21 K26 N27 Q28	L20-L24 VanDerWaalsContact O-CG 3.29Å; L20-L24 WeakPolarHBondContact O-CG 3.46Å; L20-L24 PolarHBondContact O-N 2.85Å; V21-L24 PolarHBondContact O-N 3.29Å; V21-L24 VanDerWaalsContact O-N 3.09Å; L24-K26 PolarHBondContact O-N 3.02Å; L24-N27 PolarHBondContact O-N 3.3Å; L24-Q28 VanDerWaalsContact O-CB 3.31Å; L24-Q28 WeakPolarHBondContact O-CB 3.41Å; L24-Q28 PolarHBondContact O-N 3.38Å
25	E	45.7	Very low	42.5	Very low	113 Å²	113	128 Å²	128	53%	0.528	61%	0.606	S	S	.	*	H	α-helix	trans	-61.5	-44.3	177.7	-72.1	173.3	164.3	0	0	111.5	V21 N27 Q28 E29	V21-E25 PolarHBondContact O-N 3.26Å; E25-N27 VanDerWaalsContact C-N 3.33Å; E25-N27 PolarHBondContact O-N 2.75Å; E25-Q28 PolarHBondContact O-N 3.11Å; E25-E29 WeakPolarHBondContact O-CG 3.36Å; E25-E29 PolarHBondContact O-N 3.49Å
26	K	43.7	Very low	41.9	Very low	161 Å²	161	127.8 Å²	127.8	70%	0.7	61%	0.605	S	S	*	*	H	α-helix	trans	-66.7	-30.4	178.3	-161.4	171.3	-173.8	174.4	0	113.6	R22 L24 L30	R22-K26 PolarHBondContact O-N 3.09Å; L24-K26 PolarHBondContact O-N 3.02Å; K26-L30 PolarHBondContact O-N 3.44Å
27	N	41.8	Very low	41.8	Very low	46 Å²	46	128.9 Å²	128.9	25%	0.246	62%	0.619	C	S	.	*	H	α-helix	trans	-83.3	-23.4	174.9	-79.9	-71.1	0	0	0	113	F23 L24 E25 R31	F23-N27 WeakPolarHBondContact CD1-ND2 3.16Å; F23-N27 WeakPolarHBondContact CE1-ND2 3.18Å; F23-N27 VanDerWaalsContact CZ-ND2 3.3Å; F23-N27 WeakPolarHBondContact CZ-ND2 3.41Å; F23-N27 PolarHBondContact O-N 3.15Å; F23-N27 PolarHBondContact O-ND2 3.11Å; L24-N27 PolarHBondContact O-N 3.3Å; E25-N27 VanDerWaalsContact C-N 3.33Å; E25-N27 PolarHBondContact O-N 2.75Å; N27-R31 WeakPolarHBondContact O-CB 3.45Å; N27-R31 VanDerWaalsContact O-CG 3.23Å; N27-R31 WeakPolarHBondContact O-CG 3.48Å; N27-R31 PolarHBondContact O-N 3.14Å
28	Q	41.8	Very low	41.2	Very low	114 Å²	114	125.5 Å²	125.5	53%	0.533	62%	0.619	S	S	.	*	H	α-helix	trans	-76.1	-37.4	174.7	-159.9	168.5	3.5	0	0	110.8	L24 E25 L30 R31 N32	L24-Q28 VanDerWaalsContact O-CB 3.31Å; L24-Q28 WeakPolarHBondContact O-CB 3.41Å; L24-Q28 PolarHBondContact O-N 3.38Å; E25-Q28 PolarHBondContact O-N 3.11Å; Q28-L30 PolarHBondContact O-N 2.8Å; Q28-R31 CarbonylContact O-C 3.54Å; Q28-R31 PolarHBondContact O-N 2.95Å; Q28-R31 VanDerWaalsContact O-N 3.17Å; Q28-N32 VanDerWaalsContact O-CB 3.24Å; Q28-N32 WeakPolarHBondContact O-CB 3.49Å; Q28-N32 PolarHBondContact O-N 3.16Å
29	E	38.8	Very low	41	Very low	141 Å²	141	128 Å²	128	66%	0.659	63%	0.633	S	S	*	*	H	α-helix	trans	-63.9	-37.2	170.7	-68.1	-58.5	121.9	0	0	112.5	E25 N32	E25-E29 WeakPolarHBondContact O-CG 3.36Å; E25-E29 PolarHBondContact O-N 3.49Å; E29-N32 PolarHBondContact O-N 3Å
30	L	38.9	Very low	40.7	Very low	129 Å²	129	128 Å²	128	68%	0.675	64%	0.637	S	S	*	*	H	α-helix	trans	-74.2	-22.7	172.8	-78.8	164.8	0	0	0	113.7	K26 Q28	K26-L30 PolarHBondContact O-N 3.44Å; Q28-L30 PolarHBondContact O-N 2.8Å
31	R	43.8	Very low	40.6	Very low	167 Å²	167	127.8 Å²	127.8	63%	0.63	64%	0.643	S	S	*	*	H	α-helix	trans	-86	-20.2	172.9	-75.4	178.2	-165.6	-168.8	6.7	112.7	N27 Q28	N27-R31 WeakPolarHBondContact O-CB 3.45Å; N27-R31 VanDerWaalsContact O-CG 3.23Å; N27-R31 WeakPolarHBondContact O-CG 3.48Å; N27-R31 PolarHBondContact O-N 3.14Å; Q28-R31 CarbonylContact O-C 3.54Å; Q28-R31 PolarHBondContact O-N 2.95Å; Q28-R31 VanDerWaalsContact O-N 3.17Å
32	N	36.4	Very low	40.6	Very low	100 Å²	100	136.3 Å²	136.3	54%	0.535	67%	0.667	S	S	.	*			trans	-106.8	28.9	-177.3	-72.6	-19.8	0	0	0	114	Q28 E29 K34	Q28-N32 VanDerWaalsContact O-CB 3.24Å; Q28-N32 WeakPolarHBondContact O-CB 3.49Å; Q28-N32 PolarHBondContact O-N 3.16Å; E29-N32 PolarHBondContact O-N 3Å; N32-K34 PolarHBondContact O-N 2.87Å
33	V	38	Very low	41.2	Very low	116 Å²	116	129.7 Å²	129.7	70%	0.703	66%	0.66	S	S	*	*	S	Bend	trans	-66.5	93.2	151.1	-179.3	0	0	0	0	106.3	R35	V33-R35 PolarHBondContact O-N 3.07Å
34	K	37.1	Very low	42.5	Very low	176 Å²	176	134.9 Å²	134.9	77%	0.765	68%	0.683	S	S	*	*			trans	-35.2	107.9	170.7	-73.7	175	177.1	173.8	0	108.6	N32 K36	N32-K34 PolarHBondContact O-N 2.87Å; K34-K36 HydrophobicContact CB-CG 4.4Å; K34-K36 PolarHBondContact O-N 3.09Å
35	R	41.1	Very low	44.4	Very low	249 Å²	249	136.3 Å²	136.3	94%	0.94	69%	0.685	S	S	*	*			trans	-64.4	81	146.7	-74.6	-177.1	179.4	174.5	0.1	105.2	V33 A37	V33-R35 PolarHBondContact O-N 3.07Å; R35-A37 PolarHBondContact O-N 2.89Å; R35-A37 VanDerWaalsContact O-N 3.09Å
36	K	30.2	Very low	46.4	Very low	174 Å²	174	135 Å²	135	76%	0.757	69%	0.686	S	S	*	*			trans	-51.4	118.9	150.8	-75	-174.9	176.5	-178.3	0	103.7	K34 A38	K34-K36 HydrophobicContact CB-CG 4.4Å; K34-K36 PolarHBondContact O-N 3.09Å; K36-A38 PolarHBondContact O-N 3.02Å
37	A	38.1	Very low	48.5	Very low	99 Å²	99	132 Å²	132	82%	0.818	67%	0.671	S	S	*	*			trans	-62.3	80	168.2	0	0	0	0	0	107.1	R35 T39	R35-A37 PolarHBondContact O-N 2.89Å; R35-A37 VanDerWaalsContact O-N 3.09Å; A37-T39 PolarHBondContact O-N 3.18Å
38	A	31.1	Very low	50.8	Low	77 Å²	77	136.8 Å²	136.8	64%	0.636	69%	0.689	S	S	*	*			trans	-68.4	110	154.1	0	0	0	0	0	104.3	K36 V40	K36-A38 PolarHBondContact O-N 3.02Å; A38-V40 PolarHBondContact O-N 3.23Å
39	T	38.7	Very low	53.2	Low	141 Å²	141	131.5 Å²	131.5	87%	0.865	67%	0.665	S	S	*	*			trans	-57.3	83.4	162	31.4	0	0	0	0	108.1	A37	A37-T39 PolarHBondContact O-N 3.18Å
40	V	38.3	Very low	55.6	Low	121 Å²	121	134.9 Å²	134.9	73%	0.733	68%	0.678	S	S	*	*			trans	-68.7	129.2	169.9	-179.7	0	0	0	0	106.9	A38 R42	A38-V40 PolarHBondContact O-N 3.23Å; V40-R42 PolarHBondContact O-N 2.97Å
41	P	44.5	Very low	57.9	Low	111 Å²	111	134.7 Å²	134.7	72%	0.721	67%	0.673	S	S	*	*			trans	-55.4	141.5	177.7	-20.4	30.5	0	0	0	110	G43	P41-G43 VanDerWaalsContact C-N 3.31Å; P41-G43 PolarHBondContact O-N 2.06Å
42	R	50.2	Low	60.1	Low	253 Å²	253	129.3 Å²	129.3	96%	0.955	66%	0.66	S	S	*	*			trans	-52.2	97.4	169.1	-91.8	179.2	177.3	-159.5	-0.1	108.7	V40 K44	V40-R42 PolarHBondContact O-N 2.97Å; R42-K44 PolarHBondContact O-N 2.75Å; R42-K44 VanDerWaalsContact O-N 3.08Å
43	G	58.4	Low	62.5	Low	59 Å²	59	127.2 Å²	127.2	61%	0.608	66%	0.662	S	S	*	*			trans	-59.2	115.2	173.8	0	0	0	0	0	108.3	P41 K45	P41-G43 VanDerWaalsContact C-N 3.31Å; P41-G43 PolarHBondContact O-N 2.06Å; G43-K45 PolarHBondContact O-N 2.87Å
44	K	71.6	Confident	64.9	Low	190 Å²	190	127.6 Å²	127.6	83%	0.826	66%	0.655	S	S	*	*			trans	-51.4	130.4	173.7	-67	-179.3	178.8	179.5	0	107.6	R42 P46	R42-K44 PolarHBondContact O-N 2.75Å; R42-K44 VanDerWaalsContact O-N 3.08Å; K44-P46 WeakPolarHBondContact O-CD 3.09Å
45	K	84.6	Confident	67.5	Low	125 Å²	125	120.9 Å²	120.9	54%	0.543	63%	0.632	S	S	.	*			trans	-105.5	75.3	173.4	-66.8	-177.4	178.9	-175.7	0	108.7	G43 Y47 A55 F56	G43-K45 PolarHBondContact O-N 2.87Å; K45-Y47 VanDerWaalsContact C-N 3.25Å; K45-Y47 PolarHBondContact O-N 3.47Å; K45-A55 HydrophobicContact CB-CB 3.74Å; K45-A55 HydrophobicContact CD-CB 4.25Å; K45-A55 WeakPolarHBondContact CD-O 3.36Å; K45-F56 CarbonylContact C-O 3.59Å; K45-F56 VanDerWaalsContact CA-O 3.3Å; K45-F56 WeakPolarHBondContact CA-O 3.33Å
46	P	86.8	Confident	69.8	Low	85 Å²	85	110.7 Å²	110.7	55%	0.552	59%	0.594	S	S	*	*			trans	-71.6	-21.4	-170.4	28.8	-35	0	0	0	112.7	K44 K48	K44-P46 WeakPolarHBondContact O-CD 3.09Å; P46-K48 PolarHBondContact O-N 2.84Å
47	Y	89.3	Confident	72.8	Confident	98 Å²	98	105.5 Å²	105.5	38%	0.384	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.1	102.8	-174.1	-56.4	-75.4	0	0	0	110.7	K45 A55 F56 S59	K45-Y47 VanDerWaalsContact C-N 3.25Å; K45-Y47 PolarHBondContact O-N 3.47Å; Y47-A55 CarbonylContact O-C 3.45Å; Y47-A55 WeakPolarHBondContact O-CA 3.27Å; Y47-F56 PolarHBondContact N-O 3.25Å; Y47-F56 PolarHBondContact O-N 2.91Å; Y47-S59 VanDerWaalsContact CD2-N 3.27Å
48	K	89.3	Confident	75.3	Confident	147 Å²	147	107.4 Å²	107.4	64%	0.639	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102.7	135.1	-179.5	-64	-178	-178.1	177.8	0	111.6	P46 K54 A55	P46-K48 PolarHBondContact O-N 2.84Å; K48-K54 CarbonylContact C-O 3.34Å; K48-K54 WeakPolarHBondContact CA-O 3.22Å; K48-A55 HydrophobicContact CG-CB 3.96Å
49	C	92	Very high	78.1	Confident	3 Å²	3	106.6 Å²	106.6	2%	0.02	56%	0.564	C	S	.	*			trans	-73.5	124.6	168.1	-179.4	0	0	0	0	109.2	E51 C52 G53 K54 F56 L62 H65	C49-E51 VanDerWaalsContact C-N 3.33Å; C49-C52 VanDerWaalsContact SG-SG 3.65Å; C49-G53 WeakPolarHBondContact O-CA 3.42Å; C49-G53 PolarHBondContact O-N 3.06Å; C49-K54 WeakPolarHBondContact CB-O 3.29Å; C49-K54 PolarHBondContact N-O 3.12Å; C49-F56 HydrophobicContact CB-CE2 4.24Å; C49-L62 HydrophobicContact CB-CD1 3.69Å; C49-H65 PolarHBondContact SG-NE2 2.79Å; C49-H65 VanDerWaalsContact SG-NE2 3.37Å
50	K	89.4	Confident	80.5	Confident	213 Å²	213	103.4 Å²	103.4	93%	0.926	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-27.7	179.8	-65.9	-175.6	178.9	-178.9	0	112.6
51	E	87.9	Confident	82.9	Confident	125 Å²	125	100.4 Å²	100.4	58%	0.584	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-38.4	-175.6	-64.9	-175.9	-137.9	0	0	113.9	C49 H69	C49-E51 VanDerWaalsContact C-N 3.33Å; E51-H69 IonicContact OE1-CG 3.45Å; E51-H69 WeakPolarHBondContact OE2-CB 3.47Å; E51-H69 IonicContact OE2-CE1 2.72Å; E51-H69 IonicContact OE2-CG 3.8Å; E51-H69 IonicContact OE2-ND1 3.46Å; E51-H69 PolarHBondContact OE2-ND1 2.56Å
52	C	88.8	Confident	85.1	Confident	53 Å²	53	96.3 Å²	96.3	36%	0.358	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	7	-179	69.9	0	0	0	0	114.6	C49 K54 H65 H69	C49-C52 VanDerWaalsContact SG-SG 3.65Å; C52-K54 PolarHBondContact O-N 3.43Å; C52-H65 VanDerWaalsContact SG-CE1 3.53Å; C52-H65 PolarHBondContact SG-NE2 3.26Å; C52-H69 PolarHBondContact SG-NE2 3.36Å
53	G	86.6	Confident	87	Confident	56 Å²	56	88.1 Å²	88.1	58%	0.577	48%	0.479	S	S	*	.			trans	69.5	-1.7	176.9	0	0	0	0	0	115.6	C49	C49-G53 WeakPolarHBondContact O-CA 3.42Å; C49-G53 PolarHBondContact O-N 3.06Å
54	K	88.4	Confident	88.5	Confident	125 Å²	125	89.1 Å²	89.1	54%	0.543	47%	0.468	S	S	.	.			trans	-66.7	134.6	-177.7	-72.7	-179.6	-176.8	171.9	0	111.6	K48 C49 C52 F56	K48-K54 CarbonylContact C-O 3.34Å; K48-K54 WeakPolarHBondContact CA-O 3.22Å; C49-K54 WeakPolarHBondContact CB-O 3.29Å; C49-K54 PolarHBondContact N-O 3.12Å; C52-K54 PolarHBondContact O-N 3.43Å; K54-F56 HydrophobicContact CB-CE2 3.83Å; K54-F56 HydrophobicContact CB-CZ 3.84Å; K54-F56 WeakPolarHBondContact O-CE2 3.3Å
55	A	91.8	Very high	89.3	Confident	34 Å²	34	80.9 Å²	80.9	28%	0.281	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	141.3	179.3	0	0	0	0	0	112.1	K45 Y47 K48	K45-A55 HydrophobicContact CB-CB 3.74Å; K45-A55 HydrophobicContact CD-CB 4.25Å; K45-A55 WeakPolarHBondContact CD-O 3.36Å; Y47-A55 CarbonylContact O-C 3.45Å; Y47-A55 WeakPolarHBondContact O-CA 3.27Å; K48-A55 HydrophobicContact CG-CB 3.96Å
56	F	90.8	Very high	89.5	Confident	35 Å²	35	77.8 Å²	77.8	15%	0.154	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	149.6	-176.9	-56.8	-85.4	0	0	0	111	K45 Y47 C49 K54 V61 L62 H65	K45-F56 CarbonylContact C-O 3.59Å; K45-F56 VanDerWaalsContact CA-O 3.3Å; K45-F56 WeakPolarHBondContact CA-O 3.33Å; Y47-F56 PolarHBondContact N-O 3.25Å; Y47-F56 PolarHBondContact O-N 2.91Å; C49-F56 HydrophobicContact CB-CE2 4.24Å; K54-F56 HydrophobicContact CB-CE2 3.83Å; K54-F56 HydrophobicContact CB-CZ 3.84Å; K54-F56 WeakPolarHBondContact O-CE2 3.3Å; F56-V61 HydrophobicContact CB-CB 4.4Å; F56-V61 HydrophobicContact CB-CG1 4.46Å; F56-V61 HydrophobicContact CD1-CB 4.35Å; F56-V61 HydrophobicContact CD1-CG1 3.56Å; F56-V61 HydrophobicContact CE1-CG1 4.2Å; F56-V61 HydrophobicContact CG-CG1 4.28Å; F56-L62 HydrophobicContact CB-CB 4.3Å; F56-L62 HydrophobicContact CD2-CB 3.87Å; F56-L62 HydrophobicContact CD2-CD1 3.67Å; F56-L62 HydrophobicContact CD2-CG 4.35Å; F56-L62 HydrophobicContact CE2-CD1 3.78Å; F56-L62 HydrophobicContact CG-CB 4.28Å; F56-H65 HydrophobicContact CE1-CB 4Å; F56-H65 HydrophobicContact CE2-CB 3.96Å; F56-H65 AromaticContact CE2-CD2 3.37Å; F56-H65 WeakPolarHBondContact CE2-CD2 2.98Å; F56-H65 AromaticContact CE2-CG 3.64Å; F56-H65 HydrophobicContact CZ-CB 3.53Å; F56-H65 AromaticContact CZ-CD2 3.42Å; F56-H65 VanDerWaalsContact CZ-CD2 3.42Å; F56-H65 WeakPolarHBondContact CZ-CD2 3.26Å; F56-H65 AromaticContact CZ-CG 3.21Å; F56-H65 AromaticContact CZ-ND1 3.68Å; F56-H65 AromaticContact CZ-NE2 3.93Å
57	A	91.5	Very high	89.7	Confident	65 Å²	65	76.1 Å²	76.1	54%	0.537	40%	0.404	S	S	.	.	S	Bend	trans	-76.5	-23.8	-179.8	0	0	0	0	0	113
58	K	92	Very high	89.6	Confident	139 Å²	139	77.4 Å²	77.4	60%	0.604	42%	0.416	S	S	*	.	S	Bend	trans	-132.5	144.3	-177.6	-62.3	-177.1	179.3	-175.2	0	110.1	S60 V61 L62	K58-S60 VanDerWaalsContact C-N 3.32Å; K58-S60 PolarHBondContact O-N 3.34Å; K58-V61 HydrophobicContact CB-CG2 4.12Å; K58-V61 PolarHBondContact O-N 3.28Å; K58-L62 PolarHBondContact O-N 2.74Å
59	S	90.3	Very high	89.5	Confident	61 Å²	61	73.5 Å²	73.5	43%	0.427	40%	0.4	S	S	.	.	H	α-helix	trans	-60.3	-41.6	176.5	55.6	0	0	0	0	111.5	Y47 V61 L62 T63	Y47-S59 VanDerWaalsContact CD2-N 3.27Å; S59-V61 PolarHBondContact O-N 3.24Å; S59-L62 CarbonylContact O-C 3.55Å; S59-L62 WeakPolarHBondContact O-CA 3.33Å; S59-L62 WeakPolarHBondContact O-CB 3.44Å; S59-L62 PolarHBondContact O-N 3.29Å; S59-T63 PolarHBondContact O-N 3.32Å; S59-T63 PolarHBondContact O-OG1 3.37Å; S59-T63 VanDerWaalsContact O-OG1 3.1Å
60	S	89.3	Confident	89.3	Confident	74 Å²	74	77.1 Å²	77.1	52%	0.517	42%	0.422	S	S	.	.	H	α-helix	trans	-57.8	-35.3	178.3	57.8	0	0	0	0	113.6	K58 Q64	K58-S60 VanDerWaalsContact C-N 3.32Å; K58-S60 PolarHBondContact O-N 3.34Å; S60-Q64 VanDerWaalsContact O-CB 3.3Å; S60-Q64 WeakPolarHBondContact O-CB 3.46Å; S60-Q64 PolarHBondContact O-N 3.27Å
61	V	88.6	Confident	89.2	Confident	57 Å²	57	69.1 Å²	69.1	35%	0.345	40%	0.4	S	S	.	.	H	α-helix	trans	-74.5	-35.5	176.4	-176.2	0	0	0	0	110.8	F56 K58 S59 H65	F56-V61 HydrophobicContact CB-CB 4.4Å; F56-V61 HydrophobicContact CB-CG1 4.46Å; F56-V61 HydrophobicContact CD1-CB 4.35Å; F56-V61 HydrophobicContact CD1-CG1 3.56Å; F56-V61 HydrophobicContact CE1-CG1 4.2Å; F56-V61 HydrophobicContact CG-CG1 4.28Å; K58-V61 HydrophobicContact CB-CG2 4.12Å; K58-V61 PolarHBondContact O-N 3.28Å; S59-V61 PolarHBondContact O-N 3.24Å; V61-H65 VanDerWaalsContact O-CB 3.29Å; V61-H65 WeakPolarHBondContact O-CB 3.5Å; V61-H65 PolarHBondContact O-N 2.79Å
62	L	90.6	Very high	89.3	Confident	25 Å²	25	68.3 Å²	68.3	13%	0.131	40%	0.397	C	S	.	.	H	α-helix	trans	-63.7	-48.8	170.9	172.6	62.5	0	0	0	110.7	C49 F56 K58 S59 Q64 H65 L66	C49-L62 HydrophobicContact CB-CD1 3.69Å; F56-L62 HydrophobicContact CB-CB 4.3Å; F56-L62 HydrophobicContact CD2-CB 3.87Å; F56-L62 HydrophobicContact CD2-CD1 3.67Å; F56-L62 HydrophobicContact CD2-CG 4.35Å; F56-L62 HydrophobicContact CE2-CD1 3.78Å; F56-L62 HydrophobicContact CG-CB 4.28Å; K58-L62 PolarHBondContact O-N 2.74Å; S59-L62 CarbonylContact O-C 3.55Å; S59-L62 WeakPolarHBondContact O-CA 3.33Å; S59-L62 WeakPolarHBondContact O-CB 3.44Å; S59-L62 PolarHBondContact O-N 3.29Å; L62-Q64 VanDerWaalsContact C-N 3.28Å; L62-Q64 PolarHBondContact O-N 2.59Å; L62-H65 CarbonylContact O-C 3.53Å; L62-H65 WeakPolarHBondContact O-CA 3.32Å; L62-H65 WeakPolarHBondContact O-CB 3.28Å; L62-H65 PolarHBondContact O-N 3.03Å; L62-L66 HydrophobicContact CD1-CD2 4.37Å; L62-L66 HydrophobicContact CD1-CG 4.3Å; L62-L66 WeakPolarHBondContact O-CG 3.28Å; L62-L66 PolarHBondContact O-N 3.46Å
63	T	88.6	Confident	89.5	Confident	81 Å²	81	71.7 Å²	71.7	50%	0.497	41%	0.405	S	S	.	.	H	α-helix	trans	-56.6	-43.8	176.6	-53.3	0	0	0	0	111.4	S59 H65 L66	S59-T63 PolarHBondContact O-N 3.32Å; S59-T63 PolarHBondContact O-OG1 3.37Å; S59-T63 VanDerWaalsContact O-OG1 3.1Å; T63-H65 VanDerWaalsContact C-N 3.33Å; T63-H65 PolarHBondContact O-N 3.3Å; T63-L66 PolarHBondContact O-N 3.31Å
64	Q	89.6	Confident	89.7	Confident	80 Å²	80	72.4 Å²	72.4	37%	0.374	40%	0.399	S	S	.	.	H	α-helix	trans	-61.5	-42	174	-178.3	-178.8	80.5	0	0	112.1	S60 L62 R67 L86	S60-Q64 VanDerWaalsContact O-CB 3.3Å; S60-Q64 WeakPolarHBondContact O-CB 3.46Å; S60-Q64 PolarHBondContact O-N 3.27Å; L62-Q64 VanDerWaalsContact C-N 3.28Å; L62-Q64 PolarHBondContact O-N 2.59Å; Q64-R67 WeakPolarHBondContact O-CB 3.44Å; Q64-R67 PolarHBondContact O-N 3.48Å; Q64-L86 HydrophobicContact CG-CD2 3.13Å; Q64-L86 HydrophobicContact CG-CG 4.49Å
65	H	89.3	Confident	89.9	Confident	17 Å²	17	70 Å²	70	8%	0.079	39%	0.388	C	S	.	.	H	α-helix	trans	-65.6	-36.5	177.9	164.8	68.4	0	0	0	112.9	C49 C52 F56 V61 L62 T63 R67 I68 H69	C49-H65 PolarHBondContact SG-NE2 2.79Å; C49-H65 VanDerWaalsContact SG-NE2 3.37Å; C52-H65 VanDerWaalsContact SG-CE1 3.53Å; C52-H65 PolarHBondContact SG-NE2 3.26Å; F56-H65 HydrophobicContact CE1-CB 4Å; F56-H65 HydrophobicContact CE2-CB 3.96Å; F56-H65 AromaticContact CE2-CD2 3.37Å; F56-H65 WeakPolarHBondContact CE2-CD2 2.98Å; F56-H65 AromaticContact CE2-CG 3.64Å; F56-H65 HydrophobicContact CZ-CB 3.53Å; F56-H65 AromaticContact CZ-CD2 3.42Å; F56-H65 VanDerWaalsContact CZ-CD2 3.42Å; F56-H65 WeakPolarHBondContact CZ-CD2 3.26Å; F56-H65 AromaticContact CZ-CG 3.21Å; F56-H65 AromaticContact CZ-ND1 3.68Å; F56-H65 AromaticContact CZ-NE2 3.93Å; V61-H65 VanDerWaalsContact O-CB 3.29Å; V61-H65 WeakPolarHBondContact O-CB 3.5Å; V61-H65 PolarHBondContact O-N 2.79Å; L62-H65 CarbonylContact O-C 3.53Å; L62-H65 WeakPolarHBondContact O-CA 3.32Å; L62-H65 WeakPolarHBondContact O-CB 3.28Å; L62-H65 PolarHBondContact O-N 3.03Å; T63-H65 VanDerWaalsContact C-N 3.33Å; T63-H65 PolarHBondContact O-N 3.3Å; H65-R67 PolarHBondContact O-N 3.46Å; H65-R67 VanDerWaalsContact O-N 3.12Å; H65-I68 VanDerWaalsContact O-CB 3.29Å; H65-I68 WeakPolarHBondContact O-CB 3.36Å; H65-I68 WeakPolarHBondContact O-CG1 3.26Å; H65-I68 PolarHBondContact O-N 3.3Å; H65-H69 AromaticContact CE1-NE2 3.63Å; H65-H69 AromaticContact NE2-CD2 3.82Å; H65-H69 AromaticContact NE2-NE2 3.38Å; H65-H69 PolarHBondContact NE2-NE2 3.5Å
66	L	89.1	Confident	89.9	Confident	60 Å²	60	72 Å²	72	31%	0.314	40%	0.396	S	S	.	.	H	α-helix	trans	-58.5	-24.8	177.5	-69	175.5	0	0	0	112.6	L62 T63 I68 H69 T70	L62-L66 HydrophobicContact CD1-CD2 4.37Å; L62-L66 HydrophobicContact CD1-CG 4.3Å; L62-L66 WeakPolarHBondContact O-CG 3.28Å; L62-L66 PolarHBondContact O-N 3.46Å; T63-L66 PolarHBondContact O-N 3.31Å; L66-I68 PolarHBondContact O-N 3.29Å; L66-I68 VanDerWaalsContact O-N 3.14Å; L66-H69 WeakPolarHBondContact O-CA 3.48Å; L66-H69 WeakPolarHBondContact O-CB 3.31Å; L66-H69 PolarHBondContact O-N 2.97Å; L66-T70 PolarHBondContact O-N 3.19Å; L66-T70 PolarHBondContact O-OG1 2.87Å
67	R	90.3	Very high	90	Very high	50 Å²	50	70.3 Å²	70.3	19%	0.189	39%	0.389	C	S	.	.	H	α-helix	trans	-62.6	-20.2	173.8	-58.7	-179.7	-172.9	-173.7	-5.4	114	Q64 H65 H69 T70 G71 E72 S85	Q64-R67 WeakPolarHBondContact O-CB 3.44Å; Q64-R67 PolarHBondContact O-N 3.48Å; H65-R67 PolarHBondContact O-N 3.46Å; H65-R67 VanDerWaalsContact O-N 3.12Å; R67-H69 VanDerWaalsContact C-N 3.27Å; R67-T70 WeakPolarHBondContact CA-OG1 3.23Å; R67-G71 WeakPolarHBondContact O-CA 3.43Å; R67-G71 PolarHBondContact O-N 2.85Å; R67-E72 HydrophobicContact CB-CB 4.38Å; R67-E72 HydrophobicContact CG-CB 4.23Å; R67-S85 PolarHBondContact NH1-O 3.16Å
68	I	87.1	Confident	90	Very high	125 Å²	125	73.5 Å²	73.5	64%	0.641	40%	0.397	S	S	*	.	H	α-helix	trans	-68.8	-33.3	173.1	-59.5	177.1	0	0	0	110.4	H65 L66	H65-I68 VanDerWaalsContact O-CB 3.29Å; H65-I68 WeakPolarHBondContact O-CB 3.36Å; H65-I68 WeakPolarHBondContact O-CG1 3.26Å; H65-I68 PolarHBondContact O-N 3.3Å; L66-I68 PolarHBondContact O-N 3.29Å; L66-I68 VanDerWaalsContact O-N 3.14Å
69	H	87.9	Confident	89.9	Confident	66 Å²	66	72.6 Å²	72.6	31%	0.306	40%	0.397	S	S	.	.	H	α-helix	trans	-83.3	-47.3	-178.9	-68.6	-79.2	0	0	0	111.7	E51 C52 H65 L66 R67 G71	E51-H69 IonicContact OE1-CG 3.45Å; E51-H69 WeakPolarHBondContact OE2-CB 3.47Å; E51-H69 IonicContact OE2-CE1 2.72Å; E51-H69 IonicContact OE2-CG 3.8Å; E51-H69 IonicContact OE2-ND1 3.46Å; E51-H69 PolarHBondContact OE2-ND1 2.56Å; C52-H69 PolarHBondContact SG-NE2 3.36Å; H65-H69 AromaticContact CE1-NE2 3.63Å; H65-H69 AromaticContact NE2-CD2 3.82Å; H65-H69 AromaticContact NE2-NE2 3.38Å; H65-H69 PolarHBondContact NE2-NE2 3.5Å; L66-H69 WeakPolarHBondContact O-CA 3.48Å; L66-H69 WeakPolarHBondContact O-CB 3.31Å; L66-H69 PolarHBondContact O-N 2.97Å; R67-H69 VanDerWaalsContact C-N 3.27Å; H69-G71 VanDerWaalsContact C-N 3.28Å; H69-G71 PolarHBondContact O-N 3.1Å
70	T	87.8	Confident	89.9	Confident	79 Å²	79	71.9 Å²	71.9	49%	0.485	39%	0.392	S	S	.	.	H	α-helix	trans	-75.7	-17.2	179.7	63.8	0	0	0	0	113.2	L66 R67 E72	L66-T70 PolarHBondContact O-N 3.19Å; L66-T70 PolarHBondContact O-OG1 2.87Å; R67-T70 WeakPolarHBondContact CA-OG1 3.23Å; T70-E72 PolarHBondContact O-N 3.44Å; T70-E72 WeakPolarHBondContact OG1-CB 3.35Å; T70-E72 WeakPolarHBondContact OG1-CG 3.48Å; T70-E72 PolarHBondContact OG1-N 3.05Å
71	G	87.2	Confident	89.9	Confident	45 Å²	45	74.8 Å²	74.8	46%	0.464	40%	0.401	S	S	.	.			trans	72.6	5.1	-174.4	0	0	0	0	0	114.1	R67 H69 K73	R67-G71 WeakPolarHBondContact O-CA 3.43Å; R67-G71 PolarHBondContact O-N 2.85Å; H69-G71 VanDerWaalsContact C-N 3.28Å; H69-G71 PolarHBondContact O-N 3.1Å; G71-K73 PolarHBondContact O-N 3.04Å
72	E	90.3	Very high	89.9	Confident	108 Å²	108	78 Å²	78	51%	0.505	41%	0.411	S	S	.	.			trans	-57.7	128.8	179.8	-79	176.8	-167.7	0	0	112.2	R67 T70	R67-E72 HydrophobicContact CB-CB 4.38Å; R67-E72 HydrophobicContact CG-CB 4.23Å; T70-E72 PolarHBondContact O-N 3.44Å; T70-E72 WeakPolarHBondContact OG1-CB 3.35Å; T70-E72 WeakPolarHBondContact OG1-CG 3.48Å; T70-E72 PolarHBondContact OG1-N 3.05Å
73	K	91.5	Very high	90	Very high	124 Å²	124	78.6 Å²	78.6	54%	0.539	42%	0.419	S	S	.	.			trans	-130.5	75.8	178.3	-70.6	168.7	-179	-179.4	0	110.4	G71 Y75 A83 F84	G71-K73 PolarHBondContact O-N 3.04Å; K73-Y75 PolarHBondContact O-N 2.98Å; K73-Y75 VanDerWaalsContact O-N 3.14Å; K73-A83 HydrophobicContact CB-CB 3.54Å; K73-A83 HydrophobicContact CD-CB 4.24Å; K73-A83 WeakPolarHBondContact CD-O 3.3Å; K73-F84 CarbonylContact C-O 3.58Å; K73-F84 VanDerWaalsContact CA-O 3.27Å; K73-F84 WeakPolarHBondContact CA-O 3.41Å
74	P	91.2	Very high	90.1	Very high	70 Å²	70	76.4 Å²	76.4	46%	0.455	40%	0.403	S	S	.	.			trans	-69.1	-12.9	-171.3	-21	34.8	0	0	0	114.8
75	Y	92.8	Very high	90.2	Very high	76 Å²	76	74.1 Å²	74.1	30%	0.298	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	102.4	-172.7	-53.1	-73.6	0	0	0	110.4	K73 A83 F84 S85 P87	K73-Y75 PolarHBondContact O-N 2.98Å; K73-Y75 VanDerWaalsContact O-N 3.14Å; Y75-A83 CarbonylContact O-C 3.55Å; Y75-A83 WeakPolarHBondContact O-CA 3.13Å; Y75-F84 WeakPolarHBondContact CD2-O 3.46Å; Y75-F84 PolarHBondContact N-O 3.48Å; Y75-F84 VanDerWaalsContact N-O 3.12Å; Y75-F84 PolarHBondContact O-N 2.95Å; Y75-S85 WeakPolarHBondContact CE2-O 3.39Å; Y75-P87 HydrophobicContact CD1-CB 4.24Å; Y75-P87 HydrophobicContact CD1-CG 4.3Å; Y75-P87 HydrophobicContact CD2-CG 4.34Å; Y75-P87 HydrophobicContact CE1-CB 4.12Å; Y75-P87 HydrophobicContact CE1-CG 3.73Å; Y75-P87 HydrophobicContact CE2-CB 4.47Å; Y75-P87 HydrophobicContact CE2-CG 3.75Å; Y75-P87 VanDerWaalsContact CZ-CG 3.43Å
76	T	92.1	Very high	90.2	Very high	74 Å²	74	74.7 Å²	74.7	45%	0.454	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	149.4	179.2	48.1	0	0	0	0	111.7	K82 A83 L90	T76-K82 CarbonylContact C-O 3.55Å; T76-A83 HydrophobicContact CG2-CB 4.03Å; T76-L90 WeakPolarHBondContact O-CD2 3.31Å
77	C	92.6	Very high	90.2	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	40%	0.404	C	S	.	.			trans	-95.3	117.3	172.8	178.2	0	0	0	0	110	I79 C80 D81 K82 F84 L90 H97	C77-I79 PolarHBondContact O-N 3.37Å; C77-C80 PolarHBondContact O-N 3.46Å; C77-D81 VanDerWaalsContact O-CA 3.27Å; C77-D81 WeakPolarHBondContact O-CA 3.16Å; C77-D81 PolarHBondContact O-N 2.83Å; C77-K82 WeakPolarHBondContact CB-O 3.48Å; C77-K82 PolarHBondContact N-O 2.71Å; C77-F84 HydrophobicContact CB-CE2 4.29Å; C77-L90 HydrophobicContact CB-CD1 3.62Å; C77-H97 PolarHBondContact SG-NE2 3.49Å
78	D	91.4	Very high	90	Very high	133 Å²	133	75.8 Å²	75.8	71%	0.711	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-10.3	-176.2	-46.1	-38.2	0	0	0	114.5
79	I	90.2	Very high	90.1	Very high	119 Å²	119	73.3 Å²	73.3	61%	0.61	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-30.3	-178.4	-60.3	172.9	0	0	0	112.1	C77 H97	C77-I79 PolarHBondContact O-N 3.37Å; I79-H97 HydrophobicContact CD1-CB 3.63Å; I79-H97 HydrophobicContact CG2-CB 4.27Å
80	C	89.9	Confident	90.2	Very high	47 Å²	47	71.2 Å²	71.2	32%	0.318	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.1	16.6	-175.8	70.4	0	0	0	0	114.6	C77 K82 H93 H97	C77-C80 PolarHBondContact O-N 3.46Å; C80-K82 PolarHBondContact O-N 2.97Å; C80-H93 PolarHBondContact SG-NE2 3.12Å; C80-H97 PolarHBondContact SG-CE1 3.42Å; C80-H97 PolarHBondContact SG-NE2 3.38Å
81	D	89.3	Confident	90.2	Very high	134 Å²	134	72.2 Å²	72.2	72%	0.717	40%	0.395	S	S	*	.			trans	55.1	12.1	176.8	-55.8	-46	0	0	0	115.5	C77 A83	C77-D81 VanDerWaalsContact O-CA 3.27Å; C77-D81 WeakPolarHBondContact O-CA 3.16Å; C77-D81 PolarHBondContact O-N 2.83Å; D81-A83 PolarHBondContact O-N 3.36Å
82	K	90	Very high	90.2	Very high	126 Å²	126	72.9 Å²	72.9	55%	0.548	39%	0.388	S	S	.	.			trans	-71.2	127.1	177.2	-75.5	-175.6	-176.7	179.4	0	110.5	T76 C77 C80 F84	T76-K82 CarbonylContact C-O 3.55Å; C77-K82 WeakPolarHBondContact CB-O 3.48Å; C77-K82 PolarHBondContact N-O 2.71Å; C80-K82 PolarHBondContact O-N 2.97Å; K82-F84 HydrophobicContact CB-CE2 3.93Å; K82-F84 HydrophobicContact CB-CZ 3.93Å; K82-F84 WeakPolarHBondContact O-CD2 3.48Å; K82-F84 VanDerWaalsContact O-CE2 3.23Å; K82-F84 WeakPolarHBondContact O-CE2 2.91Å
83	A	92	Very high	90.1	Very high	36 Å²	36	68.8 Å²	68.8	30%	0.298	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	144	179	0	0	0	0	0	112.5	K73 Y75 T76 D81	K73-A83 HydrophobicContact CB-CB 3.54Å; K73-A83 HydrophobicContact CD-CB 4.24Å; K73-A83 WeakPolarHBondContact CD-O 3.3Å; Y75-A83 CarbonylContact O-C 3.55Å; Y75-A83 WeakPolarHBondContact O-CA 3.13Å; T76-A83 HydrophobicContact CG2-CB 4.03Å; D81-A83 PolarHBondContact O-N 3.36Å
84	F	91.2	Very high	89.9	Confident	35 Å²	35	66 Å²	66	15%	0.154	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	149.6	-179.5	-56.9	-83.8	0	0	0	111.2	K73 Y75 C77 K82 L86 I89 L90 H93	K73-F84 CarbonylContact C-O 3.58Å; K73-F84 VanDerWaalsContact CA-O 3.27Å; K73-F84 WeakPolarHBondContact CA-O 3.41Å; Y75-F84 WeakPolarHBondContact CD2-O 3.46Å; Y75-F84 PolarHBondContact N-O 3.48Å; Y75-F84 VanDerWaalsContact N-O 3.12Å; Y75-F84 PolarHBondContact O-N 2.95Å; C77-F84 HydrophobicContact CB-CE2 4.29Å; K82-F84 HydrophobicContact CB-CE2 3.93Å; K82-F84 HydrophobicContact CB-CZ 3.93Å; K82-F84 WeakPolarHBondContact O-CD2 3.48Å; K82-F84 VanDerWaalsContact O-CE2 3.23Å; K82-F84 WeakPolarHBondContact O-CE2 2.91Å; F84-L86 VanDerWaalsContact C-N 3.35Å; F84-I89 HydrophobicContact CB-CB 4.41Å; F84-I89 HydrophobicContact CB-CG2 4.37Å; F84-I89 HydrophobicContact CD1-CB 4.33Å; F84-I89 HydrophobicContact CD1-CG2 3.42Å; F84-I89 VanDerWaalsContact CD1-CG2 3.42Å; F84-I89 HydrophobicContact CE1-CG2 4.02Å; F84-I89 HydrophobicContact CG-CG2 4.11Å; F84-L90 HydrophobicContact CB-CB 4.31Å; F84-L90 HydrophobicContact CD2-CB 3.83Å; F84-L90 HydrophobicContact CD2-CD1 3.69Å; F84-L90 HydrophobicContact CD2-CG 4.35Å; F84-L90 HydrophobicContact CE2-CD1 3.83Å; F84-L90 HydrophobicContact CG-CB 4.28Å; F84-H93 HydrophobicContact CE1-CB 4.05Å; F84-H93 HydrophobicContact CE2-CB 3.87Å; F84-H93 AromaticContact CE2-CD2 3.43Å; F84-H93 VanDerWaalsContact CE2-CD2 3.43Å; F84-H93 WeakPolarHBondContact CE2-CD2 3.14Å; F84-H93 AromaticContact CE2-CG 3.61Å; F84-H93 HydrophobicContact CZ-CB 3.49Å; F84-H93 VanDerWaalsContact CZ-CB 3.49Å; F84-H93 AromaticContact CZ-CD2 3.47Å; F84-H93 VanDerWaalsContact CZ-CD2 3.47Å; F84-H93 WeakPolarHBondContact CZ-CD2 3.27Å; F84-H93 AromaticContact CZ-CG 3.2Å; F84-H93 AromaticContact CZ-ND1 3.62Å
85	S	90.4	Very high	89.7	Confident	32 Å²	32	65.2 Å²	65.2	22%	0.224	35%	0.347	C	S	.	.	S	Bend	trans	-77.7	-22	178.3	53.6	0	0	0	0	112.9	R67 Y75	R67-S85 PolarHBondContact NH1-O 3.16Å; Y75-S85 WeakPolarHBondContact CE2-O 3.39Å
86	L	89.4	Confident	89.3	Confident	30 Å²	30	66.4 Å²	66.4	16%	0.157	36%	0.358	C	S	.	.	S	Bend	trans	-126.2	143.4	-177.7	-49.5	-168.7	0	0	0	112.3	Q64 F84 S88 I89 L90	Q64-L86 HydrophobicContact CG-CD2 3.13Å; Q64-L86 HydrophobicContact CG-CG 4.49Å; F84-L86 VanDerWaalsContact C-N 3.35Å; L86-S88 VanDerWaalsContact C-N 3.32Å; L86-S88 PolarHBondContact O-N 2.91Å; L86-I89 HydrophobicContact CB-CB 4.31Å; L86-I89 HydrophobicContact CB-CD1 3.94Å; L86-I89 HydrophobicContact CB-CG1 3.92Å; L86-I89 HydrophobicContact CD1-CD1 3.78Å; L86-I89 HydrophobicContact CD1-CG1 4.16Å; L86-I89 HydrophobicContact CG-CD1 3.77Å; L86-I89 HydrophobicContact CG-CG1 4.25Å; L86-I89 PolarHBondContact O-N 3.31Å; L86-L90 PolarHBondContact O-N 3.15Å
87	P	88.9	Confident	89	Confident	63 Å²	63	66.1 Å²	66.1	41%	0.409	35%	0.351	S	S	.	.	H	α-helix	trans	-65.8	-36.1	175.6	-1.9	12.2	0	0	0	112.1	Y75 I89 L90 H91	Y75-P87 HydrophobicContact CD1-CB 4.24Å; Y75-P87 HydrophobicContact CD1-CG 4.3Å; Y75-P87 HydrophobicContact CD2-CG 4.34Å; Y75-P87 HydrophobicContact CE1-CB 4.12Å; Y75-P87 HydrophobicContact CE1-CG 3.73Å; Y75-P87 HydrophobicContact CE2-CB 4.47Å; Y75-P87 HydrophobicContact CE2-CG 3.75Å; Y75-P87 VanDerWaalsContact CZ-CG 3.43Å; P87-I89 VanDerWaalsContact C-N 3.27Å; P87-I89 PolarHBondContact O-N 3.47Å; P87-L90 PolarHBondContact O-N 2.8Å; P87-H91 WeakPolarHBondContact O-CB 3.49Å; P87-H91 PolarHBondContact O-N 3.27Å
88	S	87.6	Confident	88.6	Confident	69 Å²	69	70.1 Å²	70.1	48%	0.483	38%	0.375	S	S	.	.	H	α-helix	trans	-64.1	-31.9	178.7	56.7	0	0	0	0	112.9	L86 N92	L86-S88 VanDerWaalsContact C-N 3.32Å; L86-S88 PolarHBondContact O-N 2.91Å; S88-N92 VanDerWaalsContact O-CG 3.31Å; S88-N92 PolarHBondContact O-N 3.03Å; S88-N92 VanDerWaalsContact O-N 3.12Å; S88-N92 PolarHBondContact O-ND2 2.89Å
89	I	87.8	Confident	88	Confident	74 Å²	74	66 Å²	66	38%	0.379	37%	0.365	S	S	.	.	H	α-helix	trans	-73.5	-42.7	175.3	-60.7	174.8	0	0	0	109.9	F84 L86 P87 N92 H93	F84-I89 HydrophobicContact CB-CB 4.41Å; F84-I89 HydrophobicContact CB-CG2 4.37Å; F84-I89 HydrophobicContact CD1-CB 4.33Å; F84-I89 HydrophobicContact CD1-CG2 3.42Å; F84-I89 VanDerWaalsContact CD1-CG2 3.42Å; F84-I89 HydrophobicContact CE1-CG2 4.02Å; F84-I89 HydrophobicContact CG-CG2 4.11Å; L86-I89 HydrophobicContact CB-CB 4.31Å; L86-I89 HydrophobicContact CB-CD1 3.94Å; L86-I89 HydrophobicContact CB-CG1 3.92Å; L86-I89 HydrophobicContact CD1-CD1 3.78Å; L86-I89 HydrophobicContact CD1-CG1 4.16Å; L86-I89 HydrophobicContact CG-CD1 3.77Å; L86-I89 HydrophobicContact CG-CG1 4.25Å; L86-I89 PolarHBondContact O-N 3.31Å; P87-I89 VanDerWaalsContact C-N 3.27Å; P87-I89 PolarHBondContact O-N 3.47Å; I89-N92 PolarHBondContact O-N 3.21Å; I89-H93 WeakPolarHBondContact O-CB 3.47Å; I89-H93 PolarHBondContact O-N 3.13Å
90	L	90.5	Very high	87.6	Confident	21 Å²	21	66.3 Å²	66.3	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-57.8	-48.2	173	171.6	62.4	0	0	0	111.1	T76 C77 F84 L86 P87 N92 H93 Q94	T76-L90 WeakPolarHBondContact O-CD2 3.31Å; C77-L90 HydrophobicContact CB-CD1 3.62Å; F84-L90 HydrophobicContact CB-CB 4.31Å; F84-L90 HydrophobicContact CD2-CB 3.83Å; F84-L90 HydrophobicContact CD2-CD1 3.69Å; F84-L90 HydrophobicContact CD2-CG 4.35Å; F84-L90 HydrophobicContact CE2-CD1 3.83Å; F84-L90 HydrophobicContact CG-CB 4.28Å; L86-L90 PolarHBondContact O-N 3.15Å; P87-L90 PolarHBondContact O-N 2.8Å; L90-N92 VanDerWaalsContact C-N 3.32Å; L90-N92 PolarHBondContact O-N 3.35Å; L90-H93 CarbonylContact O-C 3.47Å; L90-H93 WeakPolarHBondContact O-CA 2.98Å; L90-H93 WeakPolarHBondContact O-CB 3.42Å; L90-H93 PolarHBondContact O-N 2.89Å; L90-Q94 HydrophobicContact CD1-CG 4.07Å; L90-Q94 HydrophobicContact CG-CG 4.42Å; L90-Q94 WeakPolarHBondContact O-CG 3.48Å; L90-Q94 PolarHBondContact O-N 3.43Å
91	H	88.4	Confident	87.5	Confident	100 Å²	100	69.7 Å²	69.7	46%	0.463	37%	0.373	S	S	.	.	H	α-helix	trans	-58.5	-43.2	178.4	178.2	72.6	0	0	0	112.2	P87 H93 Q94 K95	P87-H91 WeakPolarHBondContact O-CB 3.49Å; P87-H91 PolarHBondContact O-N 3.27Å; H91-H93 VanDerWaalsContact C-N 3.32Å; H91-H93 PolarHBondContact O-N 3.35Å; H91-Q94 PolarHBondContact O-N 3.45Å; H91-K95 VanDerWaalsContact NE2-CE 3.3Å; H91-K95 WeakPolarHBondContact NE2-CE 3.5Å; H91-K95 PolarHBondContact NE2-NZ 3.39Å
92	N	85.8	Confident	87.3	Confident	60 Å²	60	67.2 Å²	67.2	32%	0.321	36%	0.364	S	S	.	.	H	α-helix	trans	-67.7	-33.4	174.8	-72.5	-27.2	0	0	0	112.5	S88 I89 L90 L113 M114	S88-N92 VanDerWaalsContact O-CG 3.31Å; S88-N92 PolarHBondContact O-N 3.03Å; S88-N92 VanDerWaalsContact O-N 3.12Å; S88-N92 PolarHBondContact O-ND2 2.89Å; I89-N92 PolarHBondContact O-N 3.21Å; L90-N92 VanDerWaalsContact C-N 3.32Å; L90-N92 PolarHBondContact O-N 3.35Å; N92-L113 WeakPolarHBondContact O-CD2 3.47Å; N92-M114 HydrophobicContact CB-SD 4.11Å; N92-M114 PolarHBondContact OD1-SD 2.79Å
93	H	88.4	Confident	87.4	Confident	21 Å²	21	65.1 Å²	65.1	10%	0.097	35%	0.353	C	S	.	.	H	α-helix	trans	-67.1	-40.9	174.5	169.7	71.8	0	0	0	112.2	C80 F84 I89 L90 H91 K95 I96 H97	C80-H93 PolarHBondContact SG-NE2 3.12Å; F84-H93 HydrophobicContact CE1-CB 4.05Å; F84-H93 HydrophobicContact CE2-CB 3.87Å; F84-H93 AromaticContact CE2-CD2 3.43Å; F84-H93 VanDerWaalsContact CE2-CD2 3.43Å; F84-H93 WeakPolarHBondContact CE2-CD2 3.14Å; F84-H93 AromaticContact CE2-CG 3.61Å; F84-H93 HydrophobicContact CZ-CB 3.49Å; F84-H93 VanDerWaalsContact CZ-CB 3.49Å; F84-H93 AromaticContact CZ-CD2 3.47Å; F84-H93 VanDerWaalsContact CZ-CD2 3.47Å; F84-H93 WeakPolarHBondContact CZ-CD2 3.27Å; F84-H93 AromaticContact CZ-CG 3.2Å; F84-H93 AromaticContact CZ-ND1 3.62Å; I89-H93 WeakPolarHBondContact O-CB 3.47Å; I89-H93 PolarHBondContact O-N 3.13Å; L90-H93 CarbonylContact O-C 3.47Å; L90-H93 WeakPolarHBondContact O-CA 2.98Å; L90-H93 WeakPolarHBondContact O-CB 3.42Å; L90-H93 PolarHBondContact O-N 2.89Å; H91-H93 VanDerWaalsContact C-N 3.32Å; H91-H93 PolarHBondContact O-N 3.35Å; H93-K95 PolarHBondContact O-N 2.86Å; H93-I96 WeakPolarHBondContact O-CB 3.47Å; H93-I96 VanDerWaalsContact O-CG1 3.25Å; H93-I96 WeakPolarHBondContact O-CG1 3.37Å; H93-I96 PolarHBondContact O-N 2.77Å; H93-H97 AromaticContact CD2-NE2 3.85Å; H93-H97 AromaticContact CE1-NE2 3.77Å; H93-H97 AromaticContact NE2-CE1 3.87Å; H93-H97 AromaticContact NE2-NE2 3.12Å; H93-H97 PolarHBondContact NE2-NE2 3.24Å; H93-H97 VanDerWaalsContact NE2-NE2 3.12Å
94	Q	87.4	Confident	87.3	Confident	66 Å²	66	69.8 Å²	69.8	31%	0.308	37%	0.367	S	S	.	.	H	α-helix	trans	-58.9	-32.5	-179.5	-76.3	171.2	-35.9	0	0	112.7	L90 H91 I96 H97	L90-Q94 HydrophobicContact CD1-CG 4.07Å; L90-Q94 HydrophobicContact CG-CG 4.42Å; L90-Q94 WeakPolarHBondContact O-CG 3.48Å; L90-Q94 PolarHBondContact O-N 3.43Å; H91-Q94 PolarHBondContact O-N 3.45Å; Q94-I96 PolarHBondContact O-N 2.9Å; Q94-I96 VanDerWaalsContact O-N 3.1Å; Q94-H97 WeakPolarHBondContact O-CB 3.44Å; Q94-H97 PolarHBondContact O-N 3.32Å
95	K	86.6	Confident	87.3	Confident	53 Å²	53	68.1 Å²	68.1	23%	0.23	36%	0.36	C	S	.	.	H	α-helix	trans	-59.2	-22	173.8	-64.1	173.8	-178.1	173.1	0	113.2	H91 H93 H97 T98 G99 L113 M114	H91-K95 VanDerWaalsContact NE2-CE 3.3Å; H91-K95 WeakPolarHBondContact NE2-CE 3.5Å; H91-K95 PolarHBondContact NE2-NZ 3.39Å; H93-K95 PolarHBondContact O-N 2.86Å; K95-H97 VanDerWaalsContact C-N 3.28Å; K95-H97 PolarHBondContact O-N 3.35Å; K95-T98 PolarHBondContact O-OG1 3.17Å; K95-T98 VanDerWaalsContact O-OG1 3.06Å; K95-G99 PolarHBondContact O-N 2.73Å; K95-L113 HydrophobicContact CB-CD1 3.74Å; K95-L113 HydrophobicContact CB-CD2 4.01Å; K95-L113 HydrophobicContact CB-CG 3.93Å; K95-L113 WeakPolarHBondContact O-CD1 3.35Å; K95-M114 HydrophobicContact CD-CE 3.63Å
96	I	85.7	Confident	87.3	Confident	102 Å²	102	74 Å²	74	52%	0.523	38%	0.384	S	S	.	.	H	α-helix	trans	-65.8	-35.6	175.4	-58.2	175.6	0	0	0	110.5	H93 Q94 G99 L113	H93-I96 WeakPolarHBondContact O-CB 3.47Å; H93-I96 VanDerWaalsContact O-CG1 3.25Å; H93-I96 WeakPolarHBondContact O-CG1 3.37Å; H93-I96 PolarHBondContact O-N 2.77Å; Q94-I96 PolarHBondContact O-N 2.9Å; Q94-I96 VanDerWaalsContact O-N 3.1Å; I96-G99 PolarHBondContact O-N 3.32Å; I96-L113 HydrophobicContact CG1-CD1 4.41Å; I96-L113 HydrophobicContact CG1-CD2 4.15Å
97	H	86.3	Confident	87.2	Confident	67 Å²	67	76.9 Å²	76.9	31%	0.31	40%	0.402	S	S	.	.	H	α-helix	trans	-75.5	-32.9	-179	-58.7	-55.4	0	0	0	112.5	C77 I79 C80 H93 Q94 K95 G99	C77-H97 PolarHBondContact SG-NE2 3.49Å; I79-H97 HydrophobicContact CD1-CB 3.63Å; I79-H97 HydrophobicContact CG2-CB 4.27Å; C80-H97 PolarHBondContact SG-CE1 3.42Å; C80-H97 PolarHBondContact SG-NE2 3.38Å; H93-H97 AromaticContact CD2-NE2 3.85Å; H93-H97 AromaticContact CE1-NE2 3.77Å; H93-H97 AromaticContact NE2-CE1 3.87Å; H93-H97 AromaticContact NE2-NE2 3.12Å; H93-H97 PolarHBondContact NE2-NE2 3.24Å; H93-H97 VanDerWaalsContact NE2-NE2 3.12Å; Q94-H97 WeakPolarHBondContact O-CB 3.44Å; Q94-H97 PolarHBondContact O-N 3.32Å; K95-H97 VanDerWaalsContact C-N 3.28Å; K95-H97 PolarHBondContact O-N 3.35Å; H97-G99 PolarHBondContact O-N 3.49Å
98	T	83.3	Confident	87.2	Confident	84 Å²	84	76.5 Å²	76.5	52%	0.515	40%	0.4	S	S	.	.	H	α-helix	trans	-72.9	-19.9	174.5	67.5	0	0	0	0	112.2	K95 E100	K95-T98 PolarHBondContact O-OG1 3.17Å; K95-T98 VanDerWaalsContact O-OG1 3.06Å; T98-E100 PolarHBondContact O-N 3.38Å; T98-E100 PolarHBondContact OG1-N 3.5Å
99	G	79.6	Confident	87.1	Confident	47 Å²	47	75.9 Å²	75.9	49%	0.485	41%	0.405	S	S	.	.			trans	68.7	-0.4	-176.8	0	0	0	0	0	113.9	K95 I96 H97 K101	K95-G99 PolarHBondContact O-N 2.73Å; I96-G99 PolarHBondContact O-N 3.32Å; H97-G99 PolarHBondContact O-N 3.49Å; G99-K101 PolarHBondContact O-N 3.44Å
100	E	80.8	Confident	87.2	Confident	126 Å²	126	78.5 Å²	78.5	59%	0.589	41%	0.414	S	S	*	.			trans	-64.6	129	-179.7	-68.9	-175.7	164.7	0	0	110.5	T98 P102 L113	T98-E100 PolarHBondContact O-N 3.38Å; T98-E100 PolarHBondContact OG1-N 3.5Å; E100-P102 WeakPolarHBondContact O-CD 3.46Å; E100-L113 WeakPolarHBondContact O-CD1 3.41Å
101	K	87	Confident	87.2	Confident	117 Å²	117	79.1 Å²	79.1	51%	0.509	42%	0.422	S	S	.	.			trans	-124.7	78.6	176.6	-67.4	176.1	-171.9	173.9	0	108.8	G99 Y103 A111 F112	G99-K101 PolarHBondContact O-N 3.44Å; K101-Y103 PolarHBondContact O-N 3.47Å; K101-A111 HydrophobicContact CB-CB 3.48Å; K101-A111 VanDerWaalsContact CB-CB 3.48Å; K101-A111 HydrophobicContact CD-CB 4.18Å; K101-A111 WeakPolarHBondContact CD-O 3.44Å; K101-A111 HydrophobicContact CG-CB 4.48Å; K101-F112 CarbonylContact C-O 3.31Å; K101-F112 VanDerWaalsContact C-O 3.31Å; K101-F112 WeakPolarHBondContact CA-O 3.43Å
102	P	87	Confident	87.2	Confident	83 Å²	83	76.3 Å²	76.3	54%	0.539	41%	0.409	S	S	.	.			trans	-64.3	-24.7	-171.9	-22.1	34.1	0	0	0	113.1	E100 K104	E100-P102 WeakPolarHBondContact O-CD 3.46Å; P102-K104 PolarHBondContact O-N 3.3Å
103	Y	90.7	Very high	87.3	Confident	81 Å²	81	75.2 Å²	75.2	32%	0.318	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	95.3	-171	-54.9	-78.2	0	0	0	110.5	K101 A111 F112 L113 P115	K101-Y103 PolarHBondContact O-N 3.47Å; Y103-A111 CarbonylContact O-C 3.53Å; Y103-A111 WeakPolarHBondContact O-CA 3.44Å; Y103-F112 PolarHBondContact N-O 3.16Å; Y103-F112 PolarHBondContact O-N 3.31Å; Y103-L113 VanDerWaalsContact CD2-O 3.25Å; Y103-L113 WeakPolarHBondContact CD2-O 3.27Å; Y103-L113 WeakPolarHBondContact CE2-O 3.25Å; Y103-P115 HydrophobicContact CD1-CB 3.98Å; Y103-P115 HydrophobicContact CD1-CG 4.12Å; Y103-P115 HydrophobicContact CE1-CB 3.86Å; Y103-P115 HydrophobicContact CE1-CG 3.55Å; Y103-P115 VanDerWaalsContact CE2-CD 3.45Å; Y103-P115 HydrophobicContact CE2-CG 3.99Å; Y103-P115 HydrophobicContact CG-CB 4.46Å; Y103-P115 VanDerWaalsContact CZ-CD 3.49Å; Y103-P115 VanDerWaalsContact CZ-CG 3.47Å
104	K	90.8	Very high	87.2	Confident	134 Å²	134	75.7 Å²	75.7	58%	0.583	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	143.4	179.4	-65.1	179.8	-177.5	175.5	0	111.6	P102 A111 L118	P102-K104 PolarHBondContact O-N 3.3Å; K104-A111 HydrophobicContact CG-CB 3.96Å; K104-L118 WeakPolarHBondContact O-CD2 3.28Å
105	C	89.9	Confident	87.1	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.007	41%	0.408	C	S	.	.			trans	-87.9	113.5	171.5	-178.2	0	0	0	0	109.3	V107 C108 G109 K110 F112 L118 H125	C105-V107 PolarHBondContact O-N 2.7Å; C105-V107 VanDerWaalsContact O-N 3.16Å; C105-C108 PolarHBondContact O-N 3.32Å; C105-G109 VanDerWaalsContact O-CA 3.23Å; C105-G109 WeakPolarHBondContact O-CA 3.22Å; C105-G109 PolarHBondContact O-N 3.07Å; C105-K110 WeakPolarHBondContact CB-O 3.08Å; C105-K110 PolarHBondContact N-O 3.47Å; C105-F112 HydrophobicContact CB-CE2 4.23Å; C105-L118 HydrophobicContact CB-CD1 3.61Å; C105-H125 PolarHBondContact SG-NE2 2.95Å
106	E	90.6	Very high	87.1	Confident	156 Å²	156	76.3 Å²	76.3	73%	0.729	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-24.9	179.2	-57	-51.4	133.1	0	0	113.7
107	V	87.9	Confident	87.1	Confident	90 Å²	90	74.2 Å²	74.2	55%	0.545	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-35.6	-177.1	-178.2	0	0	0	0	112.5	C105 H125	C105-V107 PolarHBondContact O-N 2.7Å; C105-V107 VanDerWaalsContact O-N 3.16Å; V107-H125 HydrophobicContact CG1-CB 4.24Å
108	C	88.3	Confident	87.3	Confident	54 Å²	54	72 Å²	72	37%	0.365	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133	6.6	-172.7	73.3	0	0	0	0	114.4	C105 K110 H121	C105-C108 PolarHBondContact O-N 3.32Å; C108-K110 PolarHBondContact O-N 3.38Å; C108-H121 PolarHBondContact SG-NE2 2.76Å
109	G	86.6	Confident	87.5	Confident	57 Å²	57	71.5 Å²	71.5	59%	0.588	40%	0.401	S	S	*	.			trans	68.8	-3.2	-179.1	0	0	0	0	0	115.4	C105 A111	C105-G109 VanDerWaalsContact O-CA 3.23Å; C105-G109 WeakPolarHBondContact O-CA 3.22Å; C105-G109 PolarHBondContact O-N 3.07Å; G109-A111 PolarHBondContact O-N 2.77Å
110	K	89	Confident	87.7	Confident	128 Å²	128	72.4 Å²	72.4	56%	0.557	40%	0.395	S	S	*	.			trans	-66.4	129.2	-177.7	-75.3	-176.4	180	177.4	0	111.3	C105 C108 F112	C105-K110 WeakPolarHBondContact CB-O 3.08Å; C105-K110 PolarHBondContact N-O 3.47Å; C108-K110 PolarHBondContact O-N 3.38Å; K110-F112 HydrophobicContact CB-CE2 3.87Å; K110-F112 HydrophobicContact CB-CZ 4.03Å; K110-F112 WeakPolarHBondContact O-CD2 3.26Å; K110-F112 VanDerWaalsContact O-CE2 3.28Å; K110-F112 WeakPolarHBondContact O-CE2 3.5Å
111	A	90.6	Very high	88	Confident	35 Å²	35	67.3 Å²	67.3	29%	0.289	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	143.7	179.5	0	0	0	0	0	111.9	K101 Y103 K104 G109	K101-A111 HydrophobicContact CB-CB 3.48Å; K101-A111 VanDerWaalsContact CB-CB 3.48Å; K101-A111 HydrophobicContact CD-CB 4.18Å; K101-A111 WeakPolarHBondContact CD-O 3.44Å; K101-A111 HydrophobicContact CG-CB 4.48Å; Y103-A111 CarbonylContact O-C 3.53Å; Y103-A111 WeakPolarHBondContact O-CA 3.44Å; K104-A111 HydrophobicContact CG-CB 3.96Å; G109-A111 PolarHBondContact O-N 2.77Å
112	F	88.8	Confident	87.9	Confident	40 Å²	40	63.9 Å²	63.9	18%	0.175	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.4	-177.6	-61.5	-88.7	0	0	0	111	K101 Y103 C105 K110 L118 H121	K101-F112 CarbonylContact C-O 3.31Å; K101-F112 VanDerWaalsContact C-O 3.31Å; K101-F112 WeakPolarHBondContact CA-O 3.43Å; Y103-F112 PolarHBondContact N-O 3.16Å; Y103-F112 PolarHBondContact O-N 3.31Å; C105-F112 HydrophobicContact CB-CE2 4.23Å; K110-F112 HydrophobicContact CB-CE2 3.87Å; K110-F112 HydrophobicContact CB-CZ 4.03Å; K110-F112 WeakPolarHBondContact O-CD2 3.26Å; K110-F112 VanDerWaalsContact O-CE2 3.28Å; K110-F112 WeakPolarHBondContact O-CE2 3.5Å; F112-L118 HydrophobicContact CB-CB 4.19Å; F112-L118 HydrophobicContact CD2-CB 3.89Å; F112-L118 HydrophobicContact CD2-CD1 3.66Å; F112-L118 HydrophobicContact CD2-CG 4.36Å; F112-L118 HydrophobicContact CE2-CD1 3.86Å; F112-L118 HydrophobicContact CG-CB 4.16Å; F112-H121 HydrophobicContact CE1-CB 3.82Å; F112-H121 HydrophobicContact CE2-CB 3.88Å; F112-H121 AromaticContact CE2-CD2 3.43Å; F112-H121 VanDerWaalsContact CE2-CD2 3.43Å; F112-H121 WeakPolarHBondContact CE2-CD2 3.1Å; F112-H121 AromaticContact CE2-CG 3.62Å; F112-H121 HydrophobicContact CZ-CB 3.39Å; F112-H121 AromaticContact CZ-CD2 3.43Å; F112-H121 VanDerWaalsContact CZ-CD2 3.43Å; F112-H121 WeakPolarHBondContact CZ-CD2 3.45Å; F112-H121 AromaticContact CZ-CG 3.13Å; F112-H121 AromaticContact CZ-ND1 3.58Å; F112-H121 AromaticContact CZ-NE2 3.99Å
113	L	87.6	Confident	87.8	Confident	37 Å²	37	62.3 Å²	62.3	19%	0.194	34%	0.342	C	S	.	.	S	Bend	trans	-72	-36.5	177.9	-161.9	100.4	0	0	0	111.7	N92 K95 I96 E100 Y103	N92-L113 WeakPolarHBondContact O-CD2 3.47Å; K95-L113 HydrophobicContact CB-CD1 3.74Å; K95-L113 HydrophobicContact CB-CD2 4.01Å; K95-L113 HydrophobicContact CB-CG 3.93Å; K95-L113 WeakPolarHBondContact O-CD1 3.35Å; I96-L113 HydrophobicContact CG1-CD1 4.41Å; I96-L113 HydrophobicContact CG1-CD2 4.15Å; E100-L113 WeakPolarHBondContact O-CD1 3.41Å; Y103-L113 VanDerWaalsContact CD2-O 3.25Å; Y103-L113 WeakPolarHBondContact CD2-O 3.27Å; Y103-L113 WeakPolarHBondContact CE2-O 3.25Å
114	M	86.2	Confident	87.5	Confident	31 Å²	31	63.5 Å²	63.5	15%	0.153	35%	0.353	C	S	.	.	S	Bend	trans	-124.3	145	-171.5	-63.9	-75.7	93.6	0	0	111.7	N92 K95 S116 T117 L118	N92-M114 HydrophobicContact CB-SD 4.11Å; N92-M114 PolarHBondContact OD1-SD 2.79Å; K95-M114 HydrophobicContact CD-CE 3.63Å; M114-S116 VanDerWaalsContact C-N 3.33Å; M114-S116 PolarHBondContact O-N 3.24Å; M114-T117 HydrophobicContact CB-CG2 4.22Å; M114-T117 PolarHBondContact N-OG1 3.16Å; M114-T117 PolarHBondContact O-N 3.37Å; M114-T117 PolarHBondContact O-OG1 3.18Å; M114-L118 PolarHBondContact O-N 3.32Å
115	P	86.7	Confident	87.2	Confident	58 Å²	58	60.7 Å²	60.7	38%	0.377	34%	0.341	S	S	.	.	H	α-helix	trans	-62	-41.5	178.1	-2	7.9	0	0	0	112	Y103 T117 L118 T119	Y103-P115 HydrophobicContact CD1-CB 3.98Å; Y103-P115 HydrophobicContact CD1-CG 4.12Å; Y103-P115 HydrophobicContact CE1-CB 3.86Å; Y103-P115 HydrophobicContact CE1-CG 3.55Å; Y103-P115 VanDerWaalsContact CE2-CD 3.45Å; Y103-P115 HydrophobicContact CE2-CG 3.99Å; Y103-P115 HydrophobicContact CG-CB 4.46Å; Y103-P115 VanDerWaalsContact CZ-CD 3.49Å; Y103-P115 VanDerWaalsContact CZ-CG 3.47Å; P115-T117 PolarHBondContact O-N 3.36Å; P115-L118 WeakPolarHBondContact O-CB 3.3Å; P115-L118 PolarHBondContact O-N 3.06Å; P115-T119 PolarHBondContact O-N 3.09Å; P115-T119 PolarHBondContact O-OG1 3.07Å; P115-T119 VanDerWaalsContact O-OG1 3.1Å
116	S	85.5	Confident	86.8	Confident	74 Å²	74	64 Å²	64	52%	0.517	36%	0.362	S	S	.	.	H	α-helix	trans	-58.9	-36.1	178.6	58.1	0	0	0	0	112.8	M114 T119 N120	M114-S116 VanDerWaalsContact C-N 3.33Å; M114-S116 PolarHBondContact O-N 3.24Å; S116-T119 PolarHBondContact O-N 3.2Å; S116-N120 WeakPolarHBondContact O-CB 3.38Å; S116-N120 PolarHBondContact O-N 2.8Å; S116-N120 PolarHBondContact O-ND2 2.96Å
117	T	87.1	Confident	86.2	Confident	58 Å²	58	58.9 Å²	58.9	36%	0.356	35%	0.351	S	S	.	.	H	α-helix	trans	-70.9	-37.2	176.1	55.4	0	0	0	0	112.2	M114 P115 H121	M114-T117 HydrophobicContact CB-CG2 4.22Å; M114-T117 PolarHBondContact N-OG1 3.16Å; M114-T117 PolarHBondContact O-N 3.37Å; M114-T117 PolarHBondContact O-OG1 3.18Å; P115-T117 PolarHBondContact O-N 3.36Å; T117-H121 WeakPolarHBondContact O-CB 3.22Å; T117-H121 PolarHBondContact O-N 3.18Å
118	L	89.3	Confident	85.7	Confident	20 Å²	20	59.1 Å²	59.1	11%	0.105	35%	0.346	C	S	.	.	H	α-helix	trans	-64	-46.6	171.5	171.5	62.7	0	0	0	111.1	K104 C105 F112 M114 P115 N120 H121 Q122	K104-L118 WeakPolarHBondContact O-CD2 3.28Å; C105-L118 HydrophobicContact CB-CD1 3.61Å; F112-L118 HydrophobicContact CB-CB 4.19Å; F112-L118 HydrophobicContact CD2-CB 3.89Å; F112-L118 HydrophobicContact CD2-CD1 3.66Å; F112-L118 HydrophobicContact CD2-CG 4.36Å; F112-L118 HydrophobicContact CE2-CD1 3.86Å; F112-L118 HydrophobicContact CG-CB 4.16Å; M114-L118 PolarHBondContact O-N 3.32Å; P115-L118 WeakPolarHBondContact O-CB 3.3Å; P115-L118 PolarHBondContact O-N 3.06Å; L118-N120 VanDerWaalsContact C-N 3.31Å; L118-N120 PolarHBondContact O-N 2.97Å; L118-H121 CarbonylContact O-C 3.58Å; L118-H121 WeakPolarHBondContact O-CA 3.5Å; L118-H121 WeakPolarHBondContact O-CB 3.32Å; L118-H121 PolarHBondContact O-N 2.84Å; L118-H121 VanDerWaalsContact O-N 3.08Å; L118-Q122 HydrophobicContact CD1-CG 4.07Å; L118-Q122 HydrophobicContact CG-CG 4.4Å; L118-Q122 WeakPolarHBondContact O-CG 3.29Å; L118-Q122 PolarHBondContact O-N 2.88Å
119	T	87.5	Confident	85.6	Confident	74 Å²	74	61.5 Å²	61.5	45%	0.454	35%	0.35	S	S	.	.	H	α-helix	trans	-59.1	-42.9	178.2	-54.5	0	0	0	0	111.7	P115 S116 H121 Q122	P115-T119 PolarHBondContact O-N 3.09Å; P115-T119 PolarHBondContact O-OG1 3.07Å; P115-T119 VanDerWaalsContact O-OG1 3.1Å; S116-T119 PolarHBondContact O-N 3.2Å; T119-H121 VanDerWaalsContact C-N 3.34Å; T119-Q122 PolarHBondContact O-N 3.07Å
120	N	84.6	Confident	85.6	Confident	66 Å²	66	62.5 Å²	62.5	35%	0.353	35%	0.346	S	S	.	.	H	α-helix	trans	-67.5	-36	175.7	-74.1	-23.7	0	0	0	112.2	S116 L118 K123 M142	S116-N120 WeakPolarHBondContact O-CB 3.38Å; S116-N120 PolarHBondContact O-N 2.8Å; S116-N120 PolarHBondContact O-ND2 2.96Å; L118-N120 VanDerWaalsContact C-N 3.31Å; L118-N120 PolarHBondContact O-N 2.97Å; N120-K123 PolarHBondContact OD1-NZ 3.12Å; N120-M142 HydrophobicContact CB-CE 4.24Å; N120-M142 HydrophobicContact CB-SD 4.07Å; N120-M142 VanDerWaalsContact CG-SD 3.6Å; N120-M142 WeakPolarHBondContact OD1-CE 3.39Å
121	H	86.8	Confident	85.6	Confident	19 Å²	19	60 Å²	60	9%	0.088	33%	0.334	C	S	.	.	H	α-helix	trans	-64.8	-41.6	173.9	170.9	70.9	0	0	0	112.6	C108 F112 T117 L118 T119 K123 I124 H125	C108-H121 PolarHBondContact SG-NE2 2.76Å; F112-H121 HydrophobicContact CE1-CB 3.82Å; F112-H121 HydrophobicContact CE2-CB 3.88Å; F112-H121 AromaticContact CE2-CD2 3.43Å; F112-H121 VanDerWaalsContact CE2-CD2 3.43Å; F112-H121 WeakPolarHBondContact CE2-CD2 3.1Å; F112-H121 AromaticContact CE2-CG 3.62Å; F112-H121 HydrophobicContact CZ-CB 3.39Å; F112-H121 AromaticContact CZ-CD2 3.43Å; F112-H121 VanDerWaalsContact CZ-CD2 3.43Å; F112-H121 WeakPolarHBondContact CZ-CD2 3.45Å; F112-H121 AromaticContact CZ-CG 3.13Å; F112-H121 AromaticContact CZ-ND1 3.58Å; F112-H121 AromaticContact CZ-NE2 3.99Å; T117-H121 WeakPolarHBondContact O-CB 3.22Å; T117-H121 PolarHBondContact O-N 3.18Å; L118-H121 CarbonylContact O-C 3.58Å; L118-H121 WeakPolarHBondContact O-CA 3.5Å; L118-H121 WeakPolarHBondContact O-CB 3.32Å; L118-H121 PolarHBondContact O-N 2.84Å; L118-H121 VanDerWaalsContact O-N 3.08Å; T119-H121 VanDerWaalsContact C-N 3.34Å; H121-K123 PolarHBondContact O-N 2.94Å; H121-K123 VanDerWaalsContact O-N 3.16Å; H121-I124 WeakPolarHBondContact O-CB 3.42Å; H121-I124 WeakPolarHBondContact O-CG1 3.31Å; H121-I124 PolarHBondContact O-N 2.84Å; H121-H125 AromaticContact CD2-NE2 3.81Å; H121-H125 AromaticContact CE1-NE2 3.77Å; H121-H125 AromaticContact NE2-CD2 3.99Å; H121-H125 AromaticContact NE2-CE1 3.83Å; H121-H125 AromaticContact NE2-NE2 3.07Å; H121-H125 PolarHBondContact NE2-NE2 2.82Å
122	Q	85.4	Confident	85.6	Confident	46 Å²	46	64.7 Å²	64.7	22%	0.215	35%	0.348	C	S	.	.	H	α-helix	trans	-58.7	-29.2	-179.2	-76.7	171.3	-28.5	0	0	112.8	L118 T119 I124 H125 T126	L118-Q122 HydrophobicContact CD1-CG 4.07Å; L118-Q122 HydrophobicContact CG-CG 4.4Å; L118-Q122 WeakPolarHBondContact O-CG 3.29Å; L118-Q122 PolarHBondContact O-N 2.88Å; T119-Q122 PolarHBondContact O-N 3.07Å; Q122-I124 PolarHBondContact O-N 3.45Å; Q122-I124 VanDerWaalsContact O-N 3.15Å; Q122-H125 PolarHBondContact O-N 2.92Å; Q122-T126 PolarHBondContact O-N 3.19Å
123	K	84.9	Confident	85.6	Confident	49 Å²	49	62.9 Å²	62.9	21%	0.213	34%	0.34	C	S	.	.	H	α-helix	trans	-60.8	-21.2	173.7	-63.5	173	-179.5	172.1	0	113.4	N120 H121 H125 T126 G127 L141 M142	N120-K123 PolarHBondContact OD1-NZ 3.12Å; H121-K123 PolarHBondContact O-N 2.94Å; H121-K123 VanDerWaalsContact O-N 3.16Å; K123-H125 VanDerWaalsContact C-N 3.32Å; K123-T126 PolarHBondContact O-OG1 3.32Å; K123-G127 PolarHBondContact O-N 2.72Å; K123-L141 HydrophobicContact CB-CD2 3.95Å; K123-L141 WeakPolarHBondContact O-CD2 3.5Å; K123-M142 HydrophobicContact CD-CE 3.56Å
124	I	83.8	Confident	85.8	Confident	106 Å²	106	69.2 Å²	69.2	54%	0.544	37%	0.368	S	S	.	.	H	α-helix	trans	-67.6	-37.1	174.7	-59.9	171.8	0	0	0	110.4	H121 Q122 G127 L141	H121-I124 WeakPolarHBondContact O-CB 3.42Å; H121-I124 WeakPolarHBondContact O-CG1 3.31Å; H121-I124 PolarHBondContact O-N 2.84Å; Q122-I124 PolarHBondContact O-N 3.45Å; Q122-I124 VanDerWaalsContact O-N 3.15Å; I124-G127 PolarHBondContact O-N 3.46Å; I124-L141 HydrophobicContact CB-CD2 4.38Å; I124-L141 HydrophobicContact CG1-CD2 3.79Å
125	H	83.3	Confident	85.9	Confident	75 Å²	75	72.9 Å²	72.9	35%	0.347	39%	0.392	S	S	.	.	H	α-helix	trans	-75.7	-32.4	-178.8	-60	-52.8	0	0	0	112.5	C105 V107 H121 Q122 K123 G127	C105-H125 PolarHBondContact SG-NE2 2.95Å; V107-H125 HydrophobicContact CG1-CB 4.24Å; H121-H125 AromaticContact CD2-NE2 3.81Å; H121-H125 AromaticContact CE1-NE2 3.77Å; H121-H125 AromaticContact NE2-CD2 3.99Å; H121-H125 AromaticContact NE2-CE1 3.83Å; H121-H125 AromaticContact NE2-NE2 3.07Å; H121-H125 PolarHBondContact NE2-NE2 2.82Å; Q122-H125 PolarHBondContact O-N 2.92Å; K123-H125 VanDerWaalsContact C-N 3.32Å; H125-G127 VanDerWaalsContact C-N 3.26Å; H125-G127 PolarHBondContact O-N 2.97Å
126	T	82.3	Confident	86	Confident	72 Å²	72	72.8 Å²	72.8	44%	0.442	39%	0.392	S	S	.	.	H	α-helix	trans	-75.7	-19	175.9	64.2	0	0	0	0	112.3	Q122 K123 E128	Q122-T126 PolarHBondContact O-N 3.19Å; K123-T126 PolarHBondContact O-OG1 3.32Å; T126-E128 PolarHBondContact O-N 3.23Å; T126-E128 VanDerWaalsContact O-N 3.07Å; T126-E128 WeakPolarHBondContact OG1-CB 3.4Å; T126-E128 PolarHBondContact OG1-N 3.43Å
127	G	78	Confident	86	Confident	48 Å²	48	71.9 Å²	71.9	50%	0.495	40%	0.395	S	S	.	.			trans	66.3	2.4	-172.8	0	0	0	0	0	113.7	K123 I124 H125 K129	K123-G127 PolarHBondContact O-N 2.72Å; I124-G127 PolarHBondContact O-N 3.46Å; H125-G127 VanDerWaalsContact C-N 3.26Å; H125-G127 PolarHBondContact O-N 2.97Å; G127-K129 PolarHBondContact O-N 2.9Å
128	E	78.6	Confident	86.1	Confident	94 Å²	94	75.4 Å²	75.4	44%	0.439	41%	0.405	S	S	.	.			trans	-64	123.5	178.7	-71.2	179.7	167.8	0	0	109.4	T126 P130	T126-E128 PolarHBondContact O-N 3.23Å; T126-E128 VanDerWaalsContact O-N 3.07Å; T126-E128 WeakPolarHBondContact OG1-CB 3.4Å; T126-E128 PolarHBondContact OG1-N 3.43Å; E128-P130 WeakPolarHBondContact O-CD 3.37Å
129	K	85.1	Confident	86	Confident	104 Å²	104	76 Å²	76	45%	0.452	41%	0.413	S	S	.	.			trans	-120.9	80.2	175.8	-68	176.1	-176.5	-178.7	0	108.7	G127 Y131 A139 F140 L141	G127-K129 PolarHBondContact O-N 2.9Å; K129-Y131 PolarHBondContact O-N 3.19Å; K129-A139 HydrophobicContact CB-CB 3.45Å; K129-A139 VanDerWaalsContact CB-CB 3.45Å; K129-A139 HydrophobicContact CD-CB 4.09Å; K129-A139 WeakPolarHBondContact CD-O 3.49Å; K129-A139 HydrophobicContact CG-CB 4.41Å; K129-F140 CarbonylContact C-O 3.59Å; K129-F140 VanDerWaalsContact C-O 3.29Å; K129-F140 VanDerWaalsContact CA-O 3.3Å; K129-F140 WeakPolarHBondContact CA-O 3.43Å; K129-L141 HydrophobicContact CD-CD1 4.44Å; K129-L141 HydrophobicContact CG-CD1 3.95Å; K129-L141 HydrophobicContact CG-CG 4.04Å
130	P	85.8	Confident	86	Confident	78 Å²	78	74.3 Å²	74.3	51%	0.506	40%	0.399	S	S	.	.			trans	-67	-21.6	-171.1	-19.7	32.9	0	0	0	113.2	E128	E128-P130 WeakPolarHBondContact O-CD 3.37Å
131	Y	89.8	Confident	86.1	Confident	77 Å²	77	73.4 Å²	73.4	30%	0.302	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	97	-171	-55.8	-79.5	0	0	0	109.7	K129 A139 F140 L141 P143	K129-Y131 PolarHBondContact O-N 3.19Å; Y131-A139 CarbonylContact O-C 3.54Å; Y131-A139 WeakPolarHBondContact O-CA 3.36Å; Y131-F140 PolarHBondContact N-O 3.05Å; Y131-F140 PolarHBondContact O-N 3.24Å; Y131-L141 VanDerWaalsContact CD2-O 3.27Å; Y131-L141 WeakPolarHBondContact CD2-O 3.38Å; Y131-L141 WeakPolarHBondContact CE2-O 3.32Å; Y131-P143 HydrophobicContact CD1-CB 3.81Å; Y131-P143 HydrophobicContact CD1-CG 4.11Å; Y131-P143 HydrophobicContact CE1-CB 3.7Å; Y131-P143 HydrophobicContact CE1-CG 3.54Å; Y131-P143 VanDerWaalsContact CE2-CD 3.46Å; Y131-P143 HydrophobicContact CE2-CG 4.05Å; Y131-P143 HydrophobicContact CG-CB 4.35Å; Y131-P143 VanDerWaalsContact CZ-CD 3.46Å; Y131-P143 VanDerWaalsContact CZ-CG 3.49Å
132	K	89.8	Confident	86	Confident	133 Å²	133	74.2 Å²	74.2	58%	0.578	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	143.9	179.6	-63.7	-176.4	-177.6	178.2	0	111.1	A139 L146	K132-A139 HydrophobicContact CG-CB 3.95Å; K132-L146 WeakPolarHBondContact O-CD2 3.38Å
133	C	90.5	Very high	86.1	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.007	41%	0.406	C	S	.	.			trans	-87.3	116.6	170.3	-179.1	0	0	0	0	108.9	V135 C136 G137 K138 F140 L146 H153	C133-V135 PolarHBondContact O-N 3.32Å; C133-C136 PolarHBondContact O-N 3.08Å; C133-G137 WeakPolarHBondContact O-CA 3.46Å; C133-G137 PolarHBondContact O-N 2.95Å; C133-K138 WeakPolarHBondContact CB-O 3.45Å; C133-K138 PolarHBondContact N-O 2.88Å; C133-F140 HydrophobicContact CB-CE2 4.24Å; C133-L146 HydrophobicContact CB-CD1 3.61Å; C133-H153 VanDerWaalsContact SG-CD2 3.56Å; C133-H153 PolarHBondContact SG-NE2 3.43Å
134	E	91.2	Very high	86	Confident	170 Å²	170	76.5 Å²	76.5	79%	0.794	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.2	-180	-57	-51.5	133	0	0	113.1
135	V	88.1	Confident	86.1	Confident	108 Å²	108	74.5 Å²	74.5	66%	0.655	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-37.1	-176.9	-178.1	0	0	0	0	112.7	C133 H153	C133-V135 PolarHBondContact O-N 3.32Å; V135-H153 HydrophobicContact CG1-CB 4.18Å; V135-H153 HydrophobicContact CG2-CB 4.5Å
136	C	88.4	Confident	86.4	Confident	56 Å²	56	71.9 Å²	71.9	38%	0.378	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	6.4	-172.7	73.4	0	0	0	0	114.4	C133 K138 H149 H153	C133-C136 PolarHBondContact O-N 3.08Å; C136-K138 PolarHBondContact O-N 3.46Å; C136-H149 PolarHBondContact SG-NE2 3.08Å; C136-H153 PolarHBondContact SG-NE2 3.27Å; C136-H153 VanDerWaalsContact SG-NE2 3.42Å
137	G	85.9	Confident	86.6	Confident	55 Å²	55	72.1 Å²	72.1	57%	0.567	41%	0.407	S	S	*	.			trans	68.4	-3.1	-179.3	0	0	0	0	0	115.3	C133 A139	C133-G137 WeakPolarHBondContact O-CA 3.46Å; C133-G137 PolarHBondContact O-N 2.95Å; G137-A139 PolarHBondContact O-N 3.44Å
138	K	88.4	Confident	86.9	Confident	132 Å²	132	72.8 Å²	72.8	57%	0.574	40%	0.399	S	S	*	.			trans	-65.9	129.1	-178.3	-75.4	-177.4	-179.2	174.5	0	111.1	C133 C136 F140	C133-K138 WeakPolarHBondContact CB-O 3.45Å; C133-K138 PolarHBondContact N-O 2.88Å; C136-K138 PolarHBondContact O-N 3.46Å; K138-F140 HydrophobicContact CB-CE2 3.91Å; K138-F140 HydrophobicContact CB-CZ 4.06Å; K138-F140 WeakPolarHBondContact O-CD2 3.33Å; K138-F140 VanDerWaalsContact O-CE2 3.28Å; K138-F140 WeakPolarHBondContact O-CE2 3.21Å
139	A	88.8	Confident	87.2	Confident	32 Å²	32	69.2 Å²	69.2	26%	0.264	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	146.1	179.1	0	0	0	0	0	112	K129 Y131 K132 G137	K129-A139 HydrophobicContact CB-CB 3.45Å; K129-A139 VanDerWaalsContact CB-CB 3.45Å; K129-A139 HydrophobicContact CD-CB 4.09Å; K129-A139 WeakPolarHBondContact CD-O 3.49Å; K129-A139 HydrophobicContact CG-CB 4.41Å; Y131-A139 CarbonylContact O-C 3.54Å; Y131-A139 WeakPolarHBondContact O-CA 3.36Å; K132-A139 HydrophobicContact CG-CB 3.95Å; G137-A139 PolarHBondContact O-N 3.44Å
140	F	86.9	Confident	87.3	Confident	40 Å²	40	67.9 Å²	67.9	18%	0.175	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	151.6	-177.7	-60.7	-88.9	0	0	0	110.9	K129 Y131 C133 K138 L146 H149	K129-F140 CarbonylContact C-O 3.59Å; K129-F140 VanDerWaalsContact C-O 3.29Å; K129-F140 VanDerWaalsContact CA-O 3.3Å; K129-F140 WeakPolarHBondContact CA-O 3.43Å; Y131-F140 PolarHBondContact N-O 3.05Å; Y131-F140 PolarHBondContact O-N 3.24Å; C133-F140 HydrophobicContact CB-CE2 4.24Å; K138-F140 HydrophobicContact CB-CE2 3.91Å; K138-F140 HydrophobicContact CB-CZ 4.06Å; K138-F140 WeakPolarHBondContact O-CD2 3.33Å; K138-F140 VanDerWaalsContact O-CE2 3.28Å; K138-F140 WeakPolarHBondContact O-CE2 3.21Å; F140-L146 HydrophobicContact CB-CB 4.23Å; F140-L146 HydrophobicContact CD2-CB 3.89Å; F140-L146 HydrophobicContact CD2-CD1 3.68Å; F140-L146 HydrophobicContact CD2-CG 4.39Å; F140-L146 HydrophobicContact CE2-CD1 3.87Å; F140-L146 HydrophobicContact CG-CB 4.2Å; F140-H149 HydrophobicContact CE1-CB 3.84Å; F140-H149 HydrophobicContact CE2-CB 3.88Å; F140-H149 AromaticContact CE2-CD2 3.39Å; F140-H149 WeakPolarHBondContact CE2-CD2 3.48Å; F140-H149 AromaticContact CE2-CG 3.61Å; F140-H149 HydrophobicContact CZ-CB 3.4Å; F140-H149 VanDerWaalsContact CZ-CB 3.4Å; F140-H149 AromaticContact CZ-CD2 3.39Å; F140-H149 WeakPolarHBondContact CZ-CD2 3.5Å; F140-H149 AromaticContact CZ-CG 3.13Å; F140-H149 AromaticContact CZ-ND1 3.6Å; F140-H149 AromaticContact CZ-NE2 3.94Å
141	L	86.5	Confident	87.2	Confident	47 Å²	47	66.2 Å²	66.2	25%	0.246	36%	0.363	C	S	.	.	S	Bend	trans	-76.4	-32.1	178	-72.3	95.5	0	0	0	112.2	K123 I124 K129 Y131	K123-L141 HydrophobicContact CB-CD2 3.95Å; K123-L141 WeakPolarHBondContact O-CD2 3.5Å; I124-L141 HydrophobicContact CB-CD2 4.38Å; I124-L141 HydrophobicContact CG1-CD2 3.79Å; K129-L141 HydrophobicContact CD-CD1 4.44Å; K129-L141 HydrophobicContact CG-CD1 3.95Å; K129-L141 HydrophobicContact CG-CG 4.04Å; Y131-L141 VanDerWaalsContact CD2-O 3.27Å; Y131-L141 WeakPolarHBondContact CD2-O 3.38Å; Y131-L141 WeakPolarHBondContact CE2-O 3.32Å
142	M	85.3	Confident	86.9	Confident	36 Å²	36	68.1 Å²	68.1	18%	0.177	38%	0.377	C	S	.	.	S	Bend	trans	-121.7	145.8	-175	-62.9	-74.9	93.8	0	0	111.5	N120 K123 S144 T145 L146	N120-M142 HydrophobicContact CB-CE 4.24Å; N120-M142 HydrophobicContact CB-SD 4.07Å; N120-M142 VanDerWaalsContact CG-SD 3.6Å; N120-M142 WeakPolarHBondContact OD1-CE 3.39Å; K123-M142 HydrophobicContact CD-CE 3.56Å; M142-S144 VanDerWaalsContact C-N 3.35Å; M142-S144 PolarHBondContact O-N 3.32Å; M142-T145 HydrophobicContact CB-CG2 4.27Å; M142-T145 PolarHBondContact N-OG1 3.4Å; M142-T145 PolarHBondContact O-N 3.41Å; M142-T145 PolarHBondContact O-OG1 2.82Å; M142-L146 PolarHBondContact O-N 2.94Å
143	P	86.3	Confident	86.6	Confident	58 Å²	58	65.3 Å²	65.3	38%	0.377	37%	0.366	S	S	.	.	H	α-helix	trans	-64.5	-40.1	177.1	5.3	-0.8	0	0	0	111.8	Y131 T145 L146 T147	Y131-P143 HydrophobicContact CD1-CB 3.81Å; Y131-P143 HydrophobicContact CD1-CG 4.11Å; Y131-P143 HydrophobicContact CE1-CB 3.7Å; Y131-P143 HydrophobicContact CE1-CG 3.54Å; Y131-P143 VanDerWaalsContact CE2-CD 3.46Å; Y131-P143 HydrophobicContact CE2-CG 4.05Å; Y131-P143 HydrophobicContact CG-CB 4.35Å; Y131-P143 VanDerWaalsContact CZ-CD 3.46Å; Y131-P143 VanDerWaalsContact CZ-CG 3.49Å; P143-T145 PolarHBondContact O-N 2.91Å; P143-L146 WeakPolarHBondContact O-CA 3.19Å; P143-L146 WeakPolarHBondContact O-CB 3.25Å; P143-L146 PolarHBondContact O-N 3.14Å; P143-T147 PolarHBondContact O-N 3.11Å; P143-T147 PolarHBondContact O-OG1 3.34Å; P143-T147 VanDerWaalsContact O-OG1 3.13Å
144	S	83.8	Confident	86.3	Confident	84 Å²	84	69.3 Å²	69.3	59%	0.587	39%	0.39	S	S	*	.	H	α-helix	trans	-58.8	-36.2	177.9	55.1	0	0	0	0	112.8	M142 N148	M142-S144 VanDerWaalsContact C-N 3.35Å; M142-S144 PolarHBondContact O-N 3.32Å; S144-N148 PolarHBondContact O-N 3.5Å
145	T	86.1	Confident	85.8	Confident	64 Å²	64	63.4 Å²	63.4	39%	0.393	38%	0.375	S	S	.	.	H	α-helix	trans	-71.1	-35.2	175.6	51.9	0	0	0	0	112.5	M142 P143 H149	M142-T145 HydrophobicContact CB-CG2 4.27Å; M142-T145 PolarHBondContact N-OG1 3.4Å; M142-T145 PolarHBondContact O-N 3.41Å; M142-T145 PolarHBondContact O-OG1 2.82Å; P143-T145 PolarHBondContact O-N 2.91Å; T145-H149 WeakPolarHBondContact O-CB 3.3Å; T145-H149 PolarHBondContact O-N 3.19Å
146	L	89	Confident	85.4	Confident	20 Å²	20	63.6 Å²	63.6	11%	0.105	37%	0.369	C	S	.	.	H	α-helix	trans	-65.4	-47.3	171.9	170.6	62.8	0	0	0	110.8	K132 C133 F140 M142 P143 N148 H149 Q150	K132-L146 WeakPolarHBondContact O-CD2 3.38Å; C133-L146 HydrophobicContact CB-CD1 3.61Å; F140-L146 HydrophobicContact CB-CB 4.23Å; F140-L146 HydrophobicContact CD2-CB 3.89Å; F140-L146 HydrophobicContact CD2-CD1 3.68Å; F140-L146 HydrophobicContact CD2-CG 4.39Å; F140-L146 HydrophobicContact CE2-CD1 3.87Å; F140-L146 HydrophobicContact CG-CB 4.2Å; M142-L146 PolarHBondContact O-N 2.94Å; P143-L146 WeakPolarHBondContact O-CA 3.19Å; P143-L146 WeakPolarHBondContact O-CB 3.25Å; P143-L146 PolarHBondContact O-N 3.14Å; L146-N148 VanDerWaalsContact C-N 3.32Å; L146-N148 PolarHBondContact O-N 3.28Å; L146-H149 CarbonylContact O-C 3.29Å; L146-H149 WeakPolarHBondContact O-CA 3.46Å; L146-H149 WeakPolarHBondContact O-CB 3.28Å; L146-H149 PolarHBondContact O-N 3.46Å; L146-Q150 HydrophobicContact CD1-CG 4.06Å; L146-Q150 HydrophobicContact CG-CG 4.4Å; L146-Q150 WeakPolarHBondContact O-CG 3.36Å; L146-Q150 PolarHBondContact O-N 2.92Å
147	T	86.8	Confident	85.3	Confident	77 Å²	77	66.3 Å²	66.3	47%	0.472	37%	0.374	S	S	.	.	H	α-helix	trans	-58.3	-44.6	178	-54.5	0	0	0	0	111.4	P143 H149 Q150	P143-T147 PolarHBondContact O-N 3.11Å; P143-T147 PolarHBondContact O-OG1 3.34Å; P143-T147 VanDerWaalsContact O-OG1 3.13Å; T147-H149 VanDerWaalsContact C-N 3.29Å; T147-H149 PolarHBondContact O-N 3.17Å; T147-Q150 PolarHBondContact O-N 3.47Å
148	N	83.2	Confident	85.3	Confident	62 Å²	62	67.7 Å²	67.7	33%	0.332	37%	0.373	S	S	.	.	H	α-helix	trans	-66.5	-32.9	176	-169.5	65.5	0	0	0	112.5	S144 L146	S144-N148 PolarHBondContact O-N 3.5Å; L146-N148 VanDerWaalsContact C-N 3.32Å; L146-N148 PolarHBondContact O-N 3.28Å
149	H	86.5	Confident	85.3	Confident	19 Å²	19	65.2 Å²	65.2	9%	0.088	36%	0.361	C	S	.	.	H	α-helix	trans	-68.2	-40.4	174.2	170.3	70.3	0	0	0	112.6	C136 F140 T145 L146 T147 K151 I152 H153	C136-H149 PolarHBondContact SG-NE2 3.08Å; F140-H149 HydrophobicContact CE1-CB 3.84Å; F140-H149 HydrophobicContact CE2-CB 3.88Å; F140-H149 AromaticContact CE2-CD2 3.39Å; F140-H149 WeakPolarHBondContact CE2-CD2 3.48Å; F140-H149 AromaticContact CE2-CG 3.61Å; F140-H149 HydrophobicContact CZ-CB 3.4Å; F140-H149 VanDerWaalsContact CZ-CB 3.4Å; F140-H149 AromaticContact CZ-CD2 3.39Å; F140-H149 WeakPolarHBondContact CZ-CD2 3.5Å; F140-H149 AromaticContact CZ-CG 3.13Å; F140-H149 AromaticContact CZ-ND1 3.6Å; F140-H149 AromaticContact CZ-NE2 3.94Å; T145-H149 WeakPolarHBondContact O-CB 3.3Å; T145-H149 PolarHBondContact O-N 3.19Å; L146-H149 CarbonylContact O-C 3.29Å; L146-H149 WeakPolarHBondContact O-CA 3.46Å; L146-H149 WeakPolarHBondContact O-CB 3.28Å; L146-H149 PolarHBondContact O-N 3.46Å; T147-H149 VanDerWaalsContact C-N 3.29Å; T147-H149 PolarHBondContact O-N 3.17Å; H149-K151 PolarHBondContact O-N 3.1Å; H149-I152 VanDerWaalsContact O-CB 3.23Å; H149-I152 WeakPolarHBondContact O-CB 2.98Å; H149-I152 WeakPolarHBondContact O-CG1 3.5Å; H149-I152 PolarHBondContact O-N 3.39Å; H149-H153 AromaticContact CD2-NE2 3.84Å; H149-H153 AromaticContact CE1-NE2 3.68Å; H149-H153 AromaticContact NE2-CD2 3.94Å; H149-H153 AromaticContact NE2-CE1 3.89Å; H149-H153 AromaticContact NE2-NE2 3.06Å; H149-H153 PolarHBondContact NE2-NE2 3.19Å
150	Q	86.4	Confident	85.4	Confident	76 Å²	76	67.9 Å²	67.9	36%	0.355	37%	0.368	S	S	.	.	H	α-helix	trans	-58.5	-30.4	-179.7	-76.7	171.3	-40.1	0	0	112.5	L146 T147 I152 H153 T154	L146-Q150 HydrophobicContact CD1-CG 4.06Å; L146-Q150 HydrophobicContact CG-CG 4.4Å; L146-Q150 WeakPolarHBondContact O-CG 3.36Å; L146-Q150 PolarHBondContact O-N 2.92Å; T147-Q150 PolarHBondContact O-N 3.47Å; Q150-I152 PolarHBondContact O-N 3.26Å; Q150-I152 VanDerWaalsContact O-N 3.1Å; Q150-H153 PolarHBondContact O-N 3.2Å; Q150-T154 PolarHBondContact O-N 3.47Å
151	K	84.6	Confident	85.7	Confident	44 Å²	44	66.2 Å²	66.2	19%	0.191	36%	0.361	C	S	.	.	H	α-helix	trans	-57.9	-22.2	172.7	-64.2	179.9	178.5	-179.7	0	114.4	H149 H153 T154 G155 E156 S169	H149-K151 PolarHBondContact O-N 3.1Å; K151-H153 VanDerWaalsContact C-N 3.33Å; K151-T154 WeakPolarHBondContact CA-OG1 3.4Å; K151-T154 PolarHBondContact O-OG1 3.46Å; K151-G155 WeakPolarHBondContact O-CA 3.5Å; K151-G155 PolarHBondContact O-N 2.73Å; K151-G155 VanDerWaalsContact O-N 3.08Å; K151-E156 PolarHBondContact O-N 2.95Å; K151-S169 WeakPolarHBondContact CD-O 3.4Å; K151-S169 PolarHBondContact NZ-O 2.98Å
152	I	83.1	Confident	85.9	Confident	116 Å²	116	73.2 Å²	73.2	60%	0.595	39%	0.393	S	S	*	.	H	α-helix	trans	-69.6	-36	175.3	-59.8	174.1	0	0	0	110.4	H149 Q150	H149-I152 VanDerWaalsContact O-CB 3.23Å; H149-I152 WeakPolarHBondContact O-CB 2.98Å; H149-I152 WeakPolarHBondContact O-CG1 3.5Å; H149-I152 PolarHBondContact O-N 3.39Å; Q150-I152 PolarHBondContact O-N 3.26Å; Q150-I152 VanDerWaalsContact O-N 3.1Å
153	H	83.6	Confident	86.2	Confident	74 Å²	74	76.7 Å²	76.7	34%	0.343	42%	0.415	S	S	.	.	H	α-helix	trans	-79.2	-38.1	-179.4	-58.7	-54	0	0	0	112	C133 V135 C136 H149 Q150 K151 G155	C133-H153 VanDerWaalsContact SG-CD2 3.56Å; C133-H153 PolarHBondContact SG-NE2 3.43Å; V135-H153 HydrophobicContact CG1-CB 4.18Å; V135-H153 HydrophobicContact CG2-CB 4.5Å; C136-H153 PolarHBondContact SG-NE2 3.27Å; C136-H153 VanDerWaalsContact SG-NE2 3.42Å; H149-H153 AromaticContact CD2-NE2 3.84Å; H149-H153 AromaticContact CE1-NE2 3.68Å; H149-H153 AromaticContact NE2-CD2 3.94Å; H149-H153 AromaticContact NE2-CE1 3.89Å; H149-H153 AromaticContact NE2-NE2 3.06Å; H149-H153 PolarHBondContact NE2-NE2 3.19Å; Q150-H153 PolarHBondContact O-N 3.2Å; K151-H153 VanDerWaalsContact C-N 3.33Å; H153-G155 PolarHBondContact O-N 3.21Å
154	T	83	Confident	86.5	Confident	86 Å²	86	76.5 Å²	76.5	53%	0.528	42%	0.415	S	S	.	.	H	α-helix	trans	-76.7	-14.8	176.4	61.6	0	0	0	0	112.7	Q150 K151 E156	Q150-T154 PolarHBondContact O-N 3.47Å; K151-T154 WeakPolarHBondContact CA-OG1 3.4Å; K151-T154 PolarHBondContact O-OG1 3.46Å; T154-E156 PolarHBondContact O-N 2.94Å; T154-E156 WeakPolarHBondContact OG1-CB 3.25Å; T154-E156 WeakPolarHBondContact OG1-CG 3.43Å; T154-E156 PolarHBondContact OG1-N 2.84Å
155	G	80.9	Confident	86.8	Confident	46 Å²	46	74.4 Å²	74.4	47%	0.474	41%	0.406	S	S	.	.			trans	69.4	4.2	-172.2	0	0	0	0	0	113.6	K151 H153 K157	K151-G155 WeakPolarHBondContact O-CA 3.5Å; K151-G155 PolarHBondContact O-N 2.73Å; K151-G155 VanDerWaalsContact O-N 3.08Å; H153-G155 PolarHBondContact O-N 3.21Å; G155-K157 PolarHBondContact O-N 2.83Å
156	E	80.8	Confident	87	Confident	111 Å²	111	77.3 Å²	77.3	52%	0.519	41%	0.413	S	S	.	.			trans	-61	111.8	179.9	-77.4	178.4	-169.8	0	0	110.7	K151 T154	K151-E156 PolarHBondContact O-N 2.95Å; T154-E156 PolarHBondContact O-N 2.94Å; T154-E156 WeakPolarHBondContact OG1-CB 3.25Å; T154-E156 WeakPolarHBondContact OG1-CG 3.43Å; T154-E156 PolarHBondContact OG1-N 2.84Å
157	K	84.9	Confident	87	Confident	113 Å²	113	81.2 Å²	81.2	49%	0.491	43%	0.43	S	S	.	.			trans	-126.6	78.9	174.6	-67.3	173.3	178.7	-177.9	0	108.5	G155 Y159 K167 F168	G155-K157 PolarHBondContact O-N 2.83Å; K157-Y159 PolarHBondContact O-N 3.43Å; K157-Y159 VanDerWaalsContact O-N 3.08Å; K157-K167 HydrophobicContact CB-CB 3.38Å; K157-K167 HydrophobicContact CD-CB 3.73Å; K157-K167 WeakPolarHBondContact CD-O 3.23Å; K157-K167 HydrophobicContact CG-CB 4.2Å; K157-F168 CarbonylContact C-O 3.53Å; K157-F168 VanDerWaalsContact C-O 3.29Å; K157-F168 VanDerWaalsContact CA-O 3.23Å; K157-F168 WeakPolarHBondContact CA-O 3.21Å
158	P	85.5	Confident	87	Confident	85 Å²	85	79.6 Å²	79.6	55%	0.552	42%	0.416	S	S	*	.			trans	-64.9	-16.1	-171.6	-20.8	33.3	0	0	0	113.8
159	Y	88.8	Confident	87.1	Confident	80 Å²	80	78 Å²	78	31%	0.314	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	103.7	-174.3	-52.3	-80.7	0	0	0	109.5	K157 K167 F168 P171 F174	K157-Y159 PolarHBondContact O-N 3.43Å; K157-Y159 VanDerWaalsContact O-N 3.08Å; Y159-K167 CarbonylContact O-C 3.52Å; Y159-K167 VanDerWaalsContact O-CA 3.3Å; Y159-K167 WeakPolarHBondContact O-CA 3.5Å; Y159-F168 WeakPolarHBondContact CD2-O 3.42Å; Y159-F168 PolarHBondContact N-O 3.42Å; Y159-F168 PolarHBondContact O-N 3.13Å; Y159-P171 HydrophobicContact CD1-CB 4.26Å; Y159-P171 HydrophobicContact CE1-CB 3.7Å; Y159-P171 HydrophobicContact CE1-CG 4.46Å; Y159-P171 HydrophobicContact CE2-CB 4.13Å; Y159-P171 HydrophobicContact CE2-CG 4.26Å; Y159-F174 HydrophobicContact CD1-CD1 4.4Å; Y159-F174 HydrophobicContact CG-CB 4.31Å
160	E	91.8	Very high	87	Confident	88 Å²	88	77.7 Å²	77.7	41%	0.411	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	135.2	-179.7	179.7	158.7	-159.3	0	0	111.1	K167 F174	E160-K167 HydrophobicContact CB-CG 4.13Å; E160-K167 VanDerWaalsContact CD-CE 3.48Å; E160-K167 VanDerWaalsContact CD-NZ 3.32Å; E160-K167 HydrophobicContact CG-CD 4.49Å; E160-K167 HydrophobicContact CG-CG 4.01Å; E160-K167 VanDerWaalsContact OE1-CE 3.29Å; E160-K167 WeakPolarHBondContact OE1-CE 3.43Å; E160-K167 IonicContact OE1-NZ 4Å; E160-K167 PolarHBondContact OE1-NZ 3.16Å; E160-K167 VanDerWaalsContact OE2-CE 3.3Å; E160-K167 WeakPolarHBondContact OE2-CE 3.45Å; E160-K167 IonicContact OE2-NZ 3.88Å; E160-K167 PolarHBondContact OE2-NZ 3.31Å; E160-F174 WeakPolarHBondContact O-CE2 3.5Å; E160-F174 WeakPolarHBondContact O-CZ 3.15Å
161	C	92.6	Very high	86.9	Confident	5 Å²	5	77.1 Å²	77.1	3%	0.034	41%	0.413	C	S	.	.			trans	-85	112.8	172.7	-178.6	0	0	0	0	109.7	V163 C164 G165 K166 F174 H177 H181	C161-V163 PolarHBondContact O-N 3.43Å; C161-C164 PolarHBondContact O-N 2.82Å; C161-G165 WeakPolarHBondContact O-CA 3.32Å; C161-G165 PolarHBondContact O-N 3.27Å; C161-K166 WeakPolarHBondContact CB-O 3.32Å; C161-K166 PolarHBondContact N-O 2.9Å; C161-F174 HydrophobicContact CB-CE2 3.97Å; C161-H177 WeakPolarHBondContact CB-NE2 3.2Å; C161-H177 PolarHBondContact SG-NE2 3.46Å; C161-H181 PolarHBondContact SG-NE2 3.15Å
162	E	92.1	Very high	86.9	Confident	194 Å²	194	77.6 Å²	77.6	91%	0.907	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.9	179.1	-63.1	176.6	176	0	0	112.8
163	V	91.4	Very high	87.1	Confident	108 Å²	108	75.4 Å²	75.4	66%	0.655	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-31.8	-178.1	-174.3	0	0	0	0	112.9	C161 H181	C161-V163 PolarHBondContact O-N 3.43Å; V163-H181 HydrophobicContact CG1-CB 4.45Å; V163-H181 WeakPolarHBondContact CG1-ND1 3.42Å
164	C	92.6	Very high	87.5	Confident	55 Å²	55	73.6 Å²	73.6	37%	0.372	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.3	8.1	-175.6	71.7	0	0	0	0	115.6	C161 K166 H177 H181	C161-C164 PolarHBondContact O-N 2.82Å; C164-K166 PolarHBondContact O-N 3.28Å; C164-K166 VanDerWaalsContact O-N 3.07Å; C164-H177 PolarHBondContact SG-NE2 3.4Å; C164-H181 PolarHBondContact SG-NE2 3.36Å; C164-H181 VanDerWaalsContact SG-NE2 3.38Å
165	G	89.3	Confident	87.8	Confident	39 Å²	39	72.7 Å²	72.7	40%	0.402	40%	0.4	S	S	.	.			trans	65.5	4.8	-179.1	0	0	0	0	0	115.1	C161 K167	C161-G165 WeakPolarHBondContact O-CA 3.32Å; C161-G165 PolarHBondContact O-N 3.27Å; G165-K167 PolarHBondContact O-N 3.22Å
166	K	90.1	Very high	88.2	Confident	125 Å²	125	75.1 Å²	75.1	54%	0.543	40%	0.398	S	S	.	.			trans	-72	127.5	-178.3	-78	-178.2	-177.6	169.2	0	110.6	C161 C164 F168	C161-K166 WeakPolarHBondContact CB-O 3.32Å; C161-K166 PolarHBondContact N-O 2.9Å; C164-K166 PolarHBondContact O-N 3.28Å; C164-K166 VanDerWaalsContact O-N 3.07Å; K166-F168 HydrophobicContact CB-CE2 3.78Å; K166-F168 HydrophobicContact CB-CZ 4.02Å; K166-F168 WeakPolarHBondContact O-CD2 3.28Å; K166-F168 VanDerWaalsContact O-CE2 3.28Å; K166-F168 WeakPolarHBondContact O-CE2 3.44Å
167	K	89.8	Confident	88.7	Confident	103 Å²	103	70.9 Å²	70.9	45%	0.448	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	144.3	178.5	-42.3	-167	-168.7	-136.9	0	112.3	K157 Y159 E160 G165	K157-K167 HydrophobicContact CB-CB 3.38Å; K157-K167 HydrophobicContact CD-CB 3.73Å; K157-K167 WeakPolarHBondContact CD-O 3.23Å; K157-K167 HydrophobicContact CG-CB 4.2Å; Y159-K167 CarbonylContact O-C 3.52Å; Y159-K167 VanDerWaalsContact O-CA 3.3Å; Y159-K167 WeakPolarHBondContact O-CA 3.5Å; E160-K167 HydrophobicContact CB-CG 4.13Å; E160-K167 VanDerWaalsContact CD-CE 3.48Å; E160-K167 VanDerWaalsContact CD-NZ 3.32Å; E160-K167 HydrophobicContact CG-CD 4.49Å; E160-K167 HydrophobicContact CG-CG 4.01Å; E160-K167 VanDerWaalsContact OE1-CE 3.29Å; E160-K167 WeakPolarHBondContact OE1-CE 3.43Å; E160-K167 IonicContact OE1-NZ 4Å; E160-K167 PolarHBondContact OE1-NZ 3.16Å; E160-K167 VanDerWaalsContact OE2-CE 3.3Å; E160-K167 WeakPolarHBondContact OE2-CE 3.45Å; E160-K167 IonicContact OE2-NZ 3.88Å; E160-K167 PolarHBondContact OE2-NZ 3.31Å; G165-K167 PolarHBondContact O-N 3.22Å
168	F	86.9	Confident	89	Confident	42 Å²	42	69.5 Å²	69.5	18%	0.184	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145.1	-177	-58.8	-95.9	0	0	0	110.8	K157 Y159 K166 D173 F174 H177	K157-F168 CarbonylContact C-O 3.53Å; K157-F168 VanDerWaalsContact C-O 3.29Å; K157-F168 VanDerWaalsContact CA-O 3.23Å; K157-F168 WeakPolarHBondContact CA-O 3.21Å; Y159-F168 WeakPolarHBondContact CD2-O 3.42Å; Y159-F168 PolarHBondContact N-O 3.42Å; Y159-F168 PolarHBondContact O-N 3.13Å; K166-F168 HydrophobicContact CB-CE2 3.78Å; K166-F168 HydrophobicContact CB-CZ 4.02Å; K166-F168 WeakPolarHBondContact O-CD2 3.28Å; K166-F168 VanDerWaalsContact O-CE2 3.28Å; K166-F168 WeakPolarHBondContact O-CE2 3.44Å; F168-D173 HydrophobicContact CD1-CB 4.21Å; F168-F174 HydrophobicContact CB-CB 4.05Å; F168-F174 HydrophobicContact CD2-CB 4.18Å; F168-F174 AromaticContact CD2-CD2 3.65Å; F168-F174 HydrophobicContact CD2-CD2 3.65Å; F168-F174 HydrophobicContact CD2-CG 4.4Å; F168-F174 HydrophobicContact CE2-CD2 4.11Å; F168-F174 HydrophobicContact CG-CB 4.15Å; F168-F174 HydrophobicContact CG-CD2 4.44Å; F168-H177 HydrophobicContact CE1-CB 3.75Å; F168-H177 AromaticContact CE1-CG 4Å; F168-H177 HydrophobicContact CE2-CB 3.95Å; F168-H177 AromaticContact CE2-CD2 3.19Å; F168-H177 WeakPolarHBondContact CE2-CD2 3.2Å; F168-H177 AromaticContact CE2-CG 3.61Å; F168-H177 AromaticContact CE2-NE2 3.84Å; F168-H177 HydrophobicContact CZ-CB 3.38Å; F168-H177 AromaticContact CZ-CD2 3.25Å; F168-H177 WeakPolarHBondContact CZ-CD2 3.33Å; F168-H177 AromaticContact CZ-CG 3.13Å; F168-H177 AromaticContact CZ-ND1 3.74Å; F168-H177 AromaticContact CZ-NE2 3.85Å
169	S	85.1	Confident	89.4	Confident	30 Å²	30	67.8 Å²	67.8	21%	0.21	36%	0.356	C	S	.	.	S	Bend	trans	-86.1	-18	177.8	55.1	0	0	0	0	113.3	K151	K151-S169 WeakPolarHBondContact CD-O 3.4Å; K151-S169 PolarHBondContact NZ-O 2.98Å
170	S	83.1	Confident	89.5	Confident	12 Å²	12	68.8 Å²	68.8	8%	0.084	37%	0.37	C	S	.	.	S	Bend	trans	-122.7	139.5	-178.7	97.1	0	0	0	0	111.3	A172 D173 F174	S170-A172 VanDerWaalsContact C-N 3.32Å; S170-A172 PolarHBondContact O-N 3.42Å; S170-D173 PolarHBondContact O-N 3.07Å; S170-D173 VanDerWaalsContact OG-CB 3.32Å; S170-D173 WeakPolarHBondContact OG-CB 3.41Å; S170-D173 PolarHBondContact OG-N 2.95Å; S170-D173 VanDerWaalsContact OG-N 3.12Å; S170-D173 PolarHBondContact OG-OD2 3.1Å; S170-F174 PolarHBondContact O-N 3.38Å
171	P	84.5	Confident	89.4	Confident	63 Å²	63	68.2 Å²	68.2	41%	0.409	37%	0.367	S	S	.	.	H	α-helix	trans	-66.8	-36.3	177.9	23.5	-29.7	0	0	0	111.5	Y159 D173 F174 T175	Y159-P171 HydrophobicContact CD1-CB 4.26Å; Y159-P171 HydrophobicContact CE1-CB 3.7Å; Y159-P171 HydrophobicContact CE1-CG 4.46Å; Y159-P171 HydrophobicContact CE2-CB 4.13Å; Y159-P171 HydrophobicContact CE2-CG 4.26Å; P171-D173 VanDerWaalsContact C-N 3.31Å; P171-D173 PolarHBondContact O-N 2.83Å; P171-F174 WeakPolarHBondContact O-CB 3.23Å; P171-F174 PolarHBondContact O-N 3.49Å; P171-T175 PolarHBondContact O-N 2.86Å; P171-T175 PolarHBondContact O-OG1 3.12Å; P171-T175 VanDerWaalsContact O-OG1 3.1Å
172	A	85.6	Confident	89.3	Confident	55 Å²	55	72.1 Å²	72.1	46%	0.455	39%	0.391	S	S	.	.	H	α-helix	trans	-64	-36.4	-179.4	0	0	0	0	0	112.5	S170 K176	S170-A172 VanDerWaalsContact C-N 3.32Å; S170-A172 PolarHBondContact O-N 3.42Å; A172-K176 WeakPolarHBondContact O-CE 3.39Å; A172-K176 VanDerWaalsContact O-CG 3.24Å; A172-K176 WeakPolarHBondContact O-CG 3.34Å; A172-K176 PolarHBondContact O-N 3.39Å
173	D	87.2	Confident	89.1	Confident	70 Å²	70	65 Å²	65	37%	0.374	37%	0.369	S	S	.	.	H	α-helix	trans	-77.6	-33	177.1	-60.9	-37.6	0	0	0	111.6	F168 S170 P171 K176 H177	F168-D173 HydrophobicContact CD1-CB 4.21Å; S170-D173 PolarHBondContact O-N 3.07Å; S170-D173 VanDerWaalsContact OG-CB 3.32Å; S170-D173 WeakPolarHBondContact OG-CB 3.41Å; S170-D173 PolarHBondContact OG-N 2.95Å; S170-D173 VanDerWaalsContact OG-N 3.12Å; S170-D173 PolarHBondContact OG-OD2 3.1Å; P171-D173 VanDerWaalsContact C-N 3.31Å; P171-D173 PolarHBondContact O-N 2.83Å; D173-K176 PolarHBondContact O-N 3.31Å; D173-K176 IonicContact OD1-NZ 3.29Å; D173-K176 PolarHBondContact OD1-NZ 3.15Å; D173-H177 WeakPolarHBondContact O-CB 3.26Å; D173-H177 PolarHBondContact O-N 3.27Å
174	F	90.6	Very high	89.1	Confident	35 Å²	35	65 Å²	65	15%	0.154	36%	0.362	C	S	.	.	H	α-helix	trans	-59.7	-51.5	170.3	177.5	-118.9	0	0	0	112	Y159 E160 C161 F168 S170 P171 K176 H177 Q178	Y159-F174 HydrophobicContact CD1-CD1 4.4Å; Y159-F174 HydrophobicContact CG-CB 4.31Å; E160-F174 WeakPolarHBondContact O-CE2 3.5Å; E160-F174 WeakPolarHBondContact O-CZ 3.15Å; C161-F174 HydrophobicContact CB-CE2 3.97Å; F168-F174 HydrophobicContact CB-CB 4.05Å; F168-F174 HydrophobicContact CD2-CB 4.18Å; F168-F174 AromaticContact CD2-CD2 3.65Å; F168-F174 HydrophobicContact CD2-CD2 3.65Å; F168-F174 HydrophobicContact CD2-CG 4.4Å; F168-F174 HydrophobicContact CE2-CD2 4.11Å; F168-F174 HydrophobicContact CG-CB 4.15Å; F168-F174 HydrophobicContact CG-CD2 4.44Å; S170-F174 PolarHBondContact O-N 3.38Å; P171-F174 WeakPolarHBondContact O-CB 3.23Å; P171-F174 PolarHBondContact O-N 3.49Å; F174-K176 VanDerWaalsContact C-N 3.31Å; F174-K176 PolarHBondContact O-N 3.06Å; F174-H177 WeakPolarHBondContact O-CA 3.36Å; F174-H177 WeakPolarHBondContact O-CB 3Å; F174-H177 PolarHBondContact O-N 3.35Å; F174-Q178 HydrophobicContact CD2-CG 4.49Å; F174-Q178 HydrophobicContact CE1-CG 4.28Å; F174-Q178 HydrophobicContact CE2-CG 4.12Å; F174-Q178 HydrophobicContact CZ-CG 4.02Å; F174-Q178 PolarHBondContact O-N 3.17Å
175	T	89.7	Confident	89.1	Confident	68 Å²	68	67.7 Å²	67.7	42%	0.417	37%	0.368	S	S	.	.	H	α-helix	trans	-59.9	-39.7	177.7	-55	0	0	0	0	112.3	P171 H177 Q178	P171-T175 PolarHBondContact O-N 2.86Å; P171-T175 PolarHBondContact O-OG1 3.12Å; P171-T175 VanDerWaalsContact O-OG1 3.1Å; T175-H177 VanDerWaalsContact C-N 3.29Å; T175-H177 PolarHBondContact O-N 3.46Å; T175-Q178 PolarHBondContact O-N 2.68Å
176	K	90.1	Very high	89.1	Confident	97 Å²	97	69.3 Å²	69.3	42%	0.422	37%	0.371	S	S	.	.	H	α-helix	trans	-63.8	-36.9	173.9	-71.1	168.9	-154.1	155.9	0	111.8	A172 D173 F174 R179	A172-K176 WeakPolarHBondContact O-CE 3.39Å; A172-K176 VanDerWaalsContact O-CG 3.24Å; A172-K176 WeakPolarHBondContact O-CG 3.34Å; A172-K176 PolarHBondContact O-N 3.39Å; D173-K176 PolarHBondContact O-N 3.31Å; D173-K176 IonicContact OD1-NZ 3.29Å; D173-K176 PolarHBondContact OD1-NZ 3.15Å; F174-K176 VanDerWaalsContact C-N 3.31Å; F174-K176 PolarHBondContact O-N 3.06Å; K176-R179 WeakPolarHBondContact O-CB 3.26Å
177	H	91.9	Very high	89.3	Confident	22 Å²	22	67.1 Å²	67.1	10%	0.102	36%	0.36	C	S	.	.	H	α-helix	trans	-69.5	-38.8	179	167.2	64.2	0	0	0	112.4	C161 C164 F168 D173 F174 T175 R179 V180 H181	C161-H177 WeakPolarHBondContact CB-NE2 3.2Å; C161-H177 PolarHBondContact SG-NE2 3.46Å; C164-H177 PolarHBondContact SG-NE2 3.4Å; F168-H177 HydrophobicContact CE1-CB 3.75Å; F168-H177 AromaticContact CE1-CG 4Å; F168-H177 HydrophobicContact CE2-CB 3.95Å; F168-H177 AromaticContact CE2-CD2 3.19Å; F168-H177 WeakPolarHBondContact CE2-CD2 3.2Å; F168-H177 AromaticContact CE2-CG 3.61Å; F168-H177 AromaticContact CE2-NE2 3.84Å; F168-H177 HydrophobicContact CZ-CB 3.38Å; F168-H177 AromaticContact CZ-CD2 3.25Å; F168-H177 WeakPolarHBondContact CZ-CD2 3.33Å; F168-H177 AromaticContact CZ-CG 3.13Å; F168-H177 AromaticContact CZ-ND1 3.74Å; F168-H177 AromaticContact CZ-NE2 3.85Å; D173-H177 WeakPolarHBondContact O-CB 3.26Å; D173-H177 PolarHBondContact O-N 3.27Å; F174-H177 WeakPolarHBondContact O-CA 3.36Å; F174-H177 WeakPolarHBondContact O-CB 3Å; F174-H177 PolarHBondContact O-N 3.35Å; T175-H177 VanDerWaalsContact C-N 3.29Å; T175-H177 PolarHBondContact O-N 3.46Å; H177-R179 PolarHBondContact O-N 3.06Å; H177-R179 VanDerWaalsContact O-N 3.07Å; H177-V180 WeakPolarHBondContact O-CB 3.33Å; H177-V180 WeakPolarHBondContact O-CG2 3.37Å; H177-V180 PolarHBondContact O-N 3.18Å; H177-H181 AromaticContact CE1-NE2 3.47Å; H177-H181 PolarHBondContact CE1-NE2 3.48Å; H177-H181 AromaticContact NE2-CD2 3.97Å; H177-H181 AromaticContact NE2-NE2 3.44Å; H177-H181 PolarHBondContact NE2-NE2 3.1Å
178	Q	91.3	Very high	89.4	Confident	84 Å²	84	68.4 Å²	68.4	39%	0.393	37%	0.366	S	S	.	.	H	α-helix	trans	-53.5	-32.7	177.5	-71.7	178.5	-62.1	0	0	112.4	F174 T175 V180 H181 T182	F174-Q178 HydrophobicContact CD2-CG 4.49Å; F174-Q178 HydrophobicContact CE1-CG 4.28Å; F174-Q178 HydrophobicContact CE2-CG 4.12Å; F174-Q178 HydrophobicContact CZ-CG 4.02Å; F174-Q178 PolarHBondContact O-N 3.17Å; T175-Q178 PolarHBondContact O-N 2.68Å; Q178-V180 PolarHBondContact O-N 3.32Å; Q178-V180 VanDerWaalsContact O-N 3.12Å; Q178-H181 PolarHBondContact O-N 3.02Å; Q178-T182 PolarHBondContact O-N 3.18Å
179	R	92.4	Very high	89.8	Confident	48 Å²	48	66.4 Å²	66.4	18%	0.181	36%	0.357	C	S	.	.	H	α-helix	trans	-62	-18.2	175.2	-60.2	-179.6	-175.4	160.7	1.9	114.9	K176 H177 H181 T182 G183 E184 S197	K176-R179 WeakPolarHBondContact O-CB 3.26Å; H177-R179 PolarHBondContact O-N 3.06Å; H177-R179 VanDerWaalsContact O-N 3.07Å; R179-H181 VanDerWaalsContact C-N 3.28Å; R179-T182 WeakPolarHBondContact CA-OG1 3.49Å; R179-G183 WeakPolarHBondContact O-CA 3.44Å; R179-G183 PolarHBondContact O-N 3.43Å; R179-E184 HydrophobicContact CB-CB 4.39Å; R179-E184 HydrophobicContact CG-CB 4.22Å; R179-S197 WeakPolarHBondContact CD-O 3.4Å; R179-S197 PolarHBondContact NH1-O 3.3Å
180	V	90.6	Very high	90.1	Very high	101 Å²	101	71 Å²	71	61%	0.612	38%	0.375	S	S	*	.	H	α-helix	trans	-67.7	-34.4	173	178.3	0	0	0	0	110.5	H177 Q178	H177-V180 WeakPolarHBondContact O-CB 3.33Å; H177-V180 WeakPolarHBondContact O-CG2 3.37Å; H177-V180 PolarHBondContact O-N 3.18Å; Q178-V180 PolarHBondContact O-N 3.32Å; Q178-V180 VanDerWaalsContact O-N 3.12Å
181	H	90.9	Very high	90.5	Very high	76 Å²	76	76.5 Å²	76.5	35%	0.352	40%	0.4	S	S	.	.	H	α-helix	trans	-85.1	-42.7	-179.9	-62.6	-65.5	0	0	0	111.9	C161 V163 C164 H177 Q178 R179 G183	C161-H181 PolarHBondContact SG-NE2 3.15Å; V163-H181 HydrophobicContact CG1-CB 4.45Å; V163-H181 WeakPolarHBondContact CG1-ND1 3.42Å; C164-H181 PolarHBondContact SG-NE2 3.36Å; C164-H181 VanDerWaalsContact SG-NE2 3.38Å; H177-H181 AromaticContact CE1-NE2 3.47Å; H177-H181 PolarHBondContact CE1-NE2 3.48Å; H177-H181 AromaticContact NE2-CD2 3.97Å; H177-H181 AromaticContact NE2-NE2 3.44Å; H177-H181 PolarHBondContact NE2-NE2 3.1Å; Q178-H181 PolarHBondContact O-N 3.02Å; R179-H181 VanDerWaalsContact C-N 3.28Å; H181-G183 PolarHBondContact O-N 2.85Å
182	T	89.5	Confident	91	Very high	87 Å²	87	76.2 Å²	76.2	53%	0.534	40%	0.398	S	S	.	.	H	α-helix	trans	-75.4	-15.5	178.8	65.3	0	0	0	0	113.1	Q178 R179 E184	Q178-T182 PolarHBondContact O-N 3.18Å; R179-T182 WeakPolarHBondContact CA-OG1 3.49Å; T182-E184 PolarHBondContact O-N 3.02Å; T182-E184 WeakPolarHBondContact OG1-CB 3.24Å; T182-E184 WeakPolarHBondContact OG1-CG 3.31Å; T182-E184 PolarHBondContact OG1-N 3.34Å
183	G	89	Confident	91.3	Very high	44 Å²	44	79.7 Å²	79.7	45%	0.454	40%	0.403	S	S	.	.			trans	70.6	3.7	-174.3	0	0	0	0	0	114	R179 H181 K185	R179-G183 WeakPolarHBondContact O-CA 3.44Å; R179-G183 PolarHBondContact O-N 3.43Å; H181-G183 PolarHBondContact O-N 2.85Å; G183-K185 WeakPolarHBondContact O-CG 3.42Å; G183-K185 PolarHBondContact O-N 2.83Å
184	E	91.1	Very high	91.5	Very high	108 Å²	108	81.9 Å²	81.9	51%	0.505	41%	0.409	S	S	.	.			trans	-58	127.4	-179.4	-80	-178.6	-169.6	0	0	112	R179 T182	R179-E184 HydrophobicContact CB-CB 4.39Å; R179-E184 HydrophobicContact CG-CB 4.22Å; T182-E184 PolarHBondContact O-N 3.02Å; T182-E184 WeakPolarHBondContact OG1-CB 3.24Å; T182-E184 WeakPolarHBondContact OG1-CG 3.31Å; T182-E184 PolarHBondContact OG1-N 3.34Å
185	K	91.9	Very high	91.7	Very high	113 Å²	113	82.9 Å²	82.9	49%	0.491	42%	0.419	S	S	.	.			trans	-131	76.4	178.1	-69.5	170.9	-171.8	170.3	0	110.6	G183 Y187 P195 F196	G183-K185 WeakPolarHBondContact O-CG 3.42Å; G183-K185 PolarHBondContact O-N 2.83Å; K185-Y187 PolarHBondContact O-N 2.98Å; K185-P195 HydrophobicContact CB-CB 3.65Å; K185-P195 HydrophobicContact CB-CG 4.38Å; K185-P195 HydrophobicContact CD-CB 4.09Å; K185-P195 HydrophobicContact CD-CG 3.94Å; K185-F196 CarbonylContact C-O 3.21Å; K185-F196 VanDerWaalsContact C-O 3.24Å; K185-F196 VanDerWaalsContact CA-O 3.25Å; K185-F196 WeakPolarHBondContact CA-O 3.34Å
186	P	90.8	Very high	91.7	Very high	73 Å²	73	81.1 Å²	81.1	47%	0.474	41%	0.406	S	S	.	.			trans	-66.3	-21.3	-172	-21.2	33.8	0	0	0	113.9
187	Y	92.9	Very high	91.7	Very high	79 Å²	79	78.2 Å²	78.2	31%	0.31	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	112.6	-172.7	-53	-82.7	0	0	0	110	K185 P195 F196 N198 L199	K185-Y187 PolarHBondContact O-N 2.98Å; Y187-P195 CarbonylContact O-C 3.48Å; Y187-F196 PolarHBondContact N-O 3.06Å; Y187-F196 VanDerWaalsContact N-O 3.16Å; Y187-F196 PolarHBondContact O-N 3.15Å; Y187-N198 VanDerWaalsContact CD2-CA 3.45Å; Y187-L199 HydrophobicContact CD1-CB 4.34Å; Y187-L199 HydrophobicContact CD1-CD1 4.03Å; Y187-L199 HydrophobicContact CE1-CB 4.22Å; Y187-L199 HydrophobicContact CE1-CD1 4.37Å
188	K	93.5	Very high	91.6	Very high	129 Å²	129	79.5 Å²	79.5	56%	0.561	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	143.5	177.3	-61.4	-177.4	-177.4	177	0	110.3	P195 L202	K188-P195 HydrophobicContact CG-CB 4.34Å; K188-L202 WeakPolarHBondContact O-CD2 3.47Å
189	C	93.7	Very high	91.5	Very high	0 Å²	0	80.5 Å²	80.5	0%	0	41%	0.413	C	S	.	.			trans	-75.3	129.9	168	178.7	0	0	0	0	109.2	E191 C192 K193 K194 F196 L202 H209	C189-E191 VanDerWaalsContact C-N 3.31Å; C189-E191 PolarHBondContact O-N 3.3Å; C189-C192 VanDerWaalsContact SG-SG 3.68Å; C189-K193 WeakPolarHBondContact O-CA 3.39Å; C189-K193 PolarHBondContact O-N 3.26Å; C189-K194 PolarHBondContact N-O 3.38Å; C189-F196 HydrophobicContact CB-CE2 4.15Å; C189-L202 HydrophobicContact CB-CD1 3.65Å; C189-H209 PolarHBondContact SG-NE2 3.42Å; C189-H209 VanDerWaalsContact SG-NE2 3.36Å
190	E	92.9	Very high	91.3	Very high	128 Å²	128	82.6 Å²	82.6	60%	0.598	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-31.8	-179.2	-65.9	-50.4	141.2	0	0	113.4	K193	E190-K193 WeakPolarHBondContact O-CE 3.48Å; E190-K193 PolarHBondContact O-NZ 2.77Å; E190-K193 IonicContact OE2-NZ 2.71Å; E190-K193 PolarHBondContact OE2-NZ 3.41Å
191	E	91.5	Very high	91.3	Very high	127 Å²	127	78.3 Å²	78.3	59%	0.593	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-41.8	-174.5	-62.9	173.4	-121	0	0	112.9	C189 H209	C189-E191 VanDerWaalsContact C-N 3.31Å; C189-E191 PolarHBondContact O-N 3.3Å; E191-H209 IonicContact OE1-CD2 3.17Å; E191-H209 IonicContact OE1-CG 3.38Å; E191-H209 WeakPolarHBondContact OE2-CB 3.44Å; E191-H209 IonicContact OE2-CD2 3.08Å; E191-H209 IonicContact OE2-CG 3.96Å; E191-H209 IonicContact OE2-ND1 3.66Å
192	C	93.1	Very high	91.4	Very high	57 Å²	57	75.3 Å²	75.3	39%	0.385	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	5.7	-178.7	67.7	0	0	0	0	114.6	C189 K194 H205 H209	C189-C192 VanDerWaalsContact SG-SG 3.68Å; C192-K194 PolarHBondContact O-N 3.36Å; C192-K194 WeakPolarHBondContact SG-CB 3.43Å; C192-H205 PolarHBondContact SG-NE2 3.19Å; C192-H209 PolarHBondContact SG-NE2 3.46Å; C192-H209 VanDerWaalsContact SG-NE2 3.42Å
193	K	92.8	Very high	91.5	Very high	127 Å²	127	74.8 Å²	74.8	55%	0.552	40%	0.396	S	S	*	.			trans	55.4	9.5	-178.7	-55.1	-60	176.6	179.4	0	115.1	C189 E190	C189-K193 WeakPolarHBondContact O-CA 3.39Å; C189-K193 PolarHBondContact O-N 3.26Å; E190-K193 WeakPolarHBondContact O-CE 3.48Å; E190-K193 PolarHBondContact O-NZ 2.77Å; E190-K193 IonicContact OE2-NZ 2.71Å; E190-K193 PolarHBondContact OE2-NZ 3.41Å
194	K	92.1	Very high	91.5	Very high	117 Å²	117	78.8 Å²	78.8	51%	0.509	40%	0.398	S	S	.	.			trans	-64.9	129.2	179.6	-168.7	167.7	-174.2	165.5	0	110.4	C189 C192 F196	C189-K194 PolarHBondContact N-O 3.38Å; C192-K194 PolarHBondContact O-N 3.36Å; C192-K194 WeakPolarHBondContact SG-CB 3.43Å; K194-F196 HydrophobicContact CB-CE2 4.04Å; K194-F196 HydrophobicContact CB-CZ 4.29Å; K194-F196 HydrophobicContact CD-CZ 4.11Å; K194-F196 HydrophobicContact CG-CE2 4.14Å; K194-F196 HydrophobicContact CG-CZ 4.01Å; K194-F196 VanDerWaalsContact O-CD2 3.26Å; K194-F196 WeakPolarHBondContact O-CD2 3.36Å; K194-F196 WeakPolarHBondContact O-CE2 3.44Å
195	P	93.2	Very high	91.5	Very high	56 Å²	56	74.9 Å²	74.9	36%	0.364	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	147	-175.5	37.1	-37.8	0	0	0	112.2	K185 Y187 K188	K185-P195 HydrophobicContact CB-CB 3.65Å; K185-P195 HydrophobicContact CB-CG 4.38Å; K185-P195 HydrophobicContact CD-CB 4.09Å; K185-P195 HydrophobicContact CD-CG 3.94Å; Y187-P195 CarbonylContact O-C 3.48Å; K188-P195 HydrophobicContact CG-CB 4.34Å
196	F	91.5	Very high	91.5	Very high	30 Å²	30	74 Å²	74	13%	0.132	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	146	-178.6	-62.7	-87.1	0	0	0	111.6	K185 Y187 C189 K194 A201 L202 H205	K185-F196 CarbonylContact C-O 3.21Å; K185-F196 VanDerWaalsContact C-O 3.24Å; K185-F196 VanDerWaalsContact CA-O 3.25Å; K185-F196 WeakPolarHBondContact CA-O 3.34Å; Y187-F196 PolarHBondContact N-O 3.06Å; Y187-F196 VanDerWaalsContact N-O 3.16Å; Y187-F196 PolarHBondContact O-N 3.15Å; C189-F196 HydrophobicContact CB-CE2 4.15Å; K194-F196 HydrophobicContact CB-CE2 4.04Å; K194-F196 HydrophobicContact CB-CZ 4.29Å; K194-F196 HydrophobicContact CD-CZ 4.11Å; K194-F196 HydrophobicContact CG-CE2 4.14Å; K194-F196 HydrophobicContact CG-CZ 4.01Å; K194-F196 VanDerWaalsContact O-CD2 3.26Å; K194-F196 WeakPolarHBondContact O-CD2 3.36Å; K194-F196 WeakPolarHBondContact O-CE2 3.44Å; F196-A201 HydrophobicContact CB-CB 4.36Å; F196-A201 HydrophobicContact CD1-CB 3.96Å; F196-L202 HydrophobicContact CB-CB 4.15Å; F196-L202 HydrophobicContact CD2-CB 3.95Å; F196-L202 HydrophobicContact CD2-CD1 3.72Å; F196-L202 HydrophobicContact CD2-CG 4.4Å; F196-L202 HydrophobicContact CE2-CD1 3.9Å; F196-L202 HydrophobicContact CG-CB 4.08Å; F196-H205 HydrophobicContact CE1-CB 3.68Å; F196-H205 AromaticContact CE1-CG 3.92Å; F196-H205 HydrophobicContact CE2-CB 4.02Å; F196-H205 AromaticContact CE2-CD2 3.33Å; F196-H205 WeakPolarHBondContact CE2-CD2 3.39Å; F196-H205 AromaticContact CE2-CG 3.76Å; F196-H205 AromaticContact CE2-NE2 3.97Å; F196-H205 HydrophobicContact CZ-CB 3.37Å; F196-H205 AromaticContact CZ-CD2 3.2Å; F196-H205 WeakPolarHBondContact CZ-CD2 3.39Å; F196-H205 AromaticContact CZ-CG 3.14Å; F196-H205 AromaticContact CZ-ND1 3.75Å; F196-H205 AromaticContact CZ-NE2 3.77Å
197	S	89.9	Confident	91.4	Very high	37 Å²	37	71.9 Å²	71.9	26%	0.259	36%	0.361	S	S	.	.	S	Bend	trans	-78.3	-17.9	-179	56.9	0	0	0	0	114.1	R179	R179-S197 WeakPolarHBondContact CD-O 3.4Å; R179-S197 PolarHBondContact NH1-O 3.3Å
198	N	88.8	Confident	91.2	Very high	49 Å²	49	72.9 Å²	72.9	26%	0.262	38%	0.375	S	S	.	.	S	Bend	trans	-149.8	157.3	176.5	61.9	68.7	0	0	0	112.8	Y187 S200 A201 L202	Y187-N198 VanDerWaalsContact CD2-CA 3.45Å; N198-S200 VanDerWaalsContact C-N 3.34Å; N198-S200 PolarHBondContact O-N 3.02Å; N198-S200 PolarHBondContact OD1-N 3.03Å; N198-A201 PolarHBondContact O-N 3.02Å; N198-A201 VanDerWaalsContact OD1-CB 3.26Å; N198-A201 WeakPolarHBondContact OD1-CB 3.45Å; N198-A201 PolarHBondContact OD1-N 3.28Å; N198-L202 PolarHBondContact O-N 3.38Å
199	L	89.5	Confident	91	Very high	105 Å²	105	70 Å²	70	55%	0.55	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-35.6	-177.4	-170	69.4	0	0	0	113	Y187 A201 L202 S203	Y187-L199 HydrophobicContact CD1-CB 4.34Å; Y187-L199 HydrophobicContact CD1-CD1 4.03Å; Y187-L199 HydrophobicContact CE1-CB 4.22Å; Y187-L199 HydrophobicContact CE1-CD1 4.37Å; L199-A201 VanDerWaalsContact C-N 3.33Å; L199-A201 PolarHBondContact O-N 2.8Å; L199-L202 HydrophobicContact CD1-CD2 4.38Å; L199-L202 PolarHBondContact O-N 3Å; L199-S203 WeakPolarHBondContact O-CB 3.19Å; L199-S203 PolarHBondContact O-N 3.42Å
200	S	88.9	Confident	90.8	Very high	91 Å²	91	74.2 Å²	74.2	64%	0.636	39%	0.39	S	S	*	.	H	α-helix	trans	-64.6	-37.9	178.1	-54.6	0	0	0	0	112	N198 R204	N198-S200 VanDerWaalsContact C-N 3.34Å; N198-S200 PolarHBondContact O-N 3.02Å; N198-S200 PolarHBondContact OD1-N 3.03Å; S200-R204 VanDerWaalsContact O-CB 3.31Å; S200-R204 WeakPolarHBondContact O-CB 3.37Å; S200-R204 PolarHBondContact O-N 3.42Å
201	A	90.2	Very high	90.4	Very high	12 Å²	12	70.3 Å²	70.3	10%	0.099	38%	0.384	C	S	.	.	H	α-helix	trans	-66.5	-42	174.6	0	0	0	0	0	111.5	F196 N198 L199 H205	F196-A201 HydrophobicContact CB-CB 4.36Å; F196-A201 HydrophobicContact CD1-CB 3.96Å; N198-A201 PolarHBondContact O-N 3.02Å; N198-A201 VanDerWaalsContact OD1-CB 3.26Å; N198-A201 WeakPolarHBondContact OD1-CB 3.45Å; N198-A201 PolarHBondContact OD1-N 3.28Å; L199-A201 VanDerWaalsContact C-N 3.33Å; L199-A201 PolarHBondContact O-N 2.8Å; A201-H205 WeakPolarHBondContact O-CB 3.02Å; A201-H205 PolarHBondContact O-N 3.33Å
202	L	93.3	Very high	90.3	Very high	13 Å²	13	68 Å²	68	7%	0.068	37%	0.374	C	S	.	.	H	α-helix	trans	-62.6	-50.1	173.7	171.7	59.1	0	0	0	111.6	K188 C189 F196 N198 L199 R204 H205 K206	K188-L202 WeakPolarHBondContact O-CD2 3.47Å; C189-L202 HydrophobicContact CB-CD1 3.65Å; F196-L202 HydrophobicContact CB-CB 4.15Å; F196-L202 HydrophobicContact CD2-CB 3.95Å; F196-L202 HydrophobicContact CD2-CD1 3.72Å; F196-L202 HydrophobicContact CD2-CG 4.4Å; F196-L202 HydrophobicContact CE2-CD1 3.9Å; F196-L202 HydrophobicContact CG-CB 4.08Å; N198-L202 PolarHBondContact O-N 3.38Å; L199-L202 HydrophobicContact CD1-CD2 4.38Å; L199-L202 PolarHBondContact O-N 3Å; L202-R204 VanDerWaalsContact C-N 3.29Å; L202-R204 PolarHBondContact O-N 3.08Å; L202-H205 CarbonylContact O-C 3.58Å; L202-H205 WeakPolarHBondContact O-CA 3.37Å; L202-H205 WeakPolarHBondContact O-CB 3.18Å; L202-H205 PolarHBondContact O-N 3.1Å; L202-K206 HydrophobicContact CD1-CG 4.35Å; L202-K206 PolarHBondContact O-N 3.34Å
203	S	90.4	Very high	90.1	Very high	75 Å²	75	71.5 Å²	71.5	52%	0.524	38%	0.382	S	S	.	.	H	α-helix	trans	-57	-43.2	178.5	173.7	0	0	0	0	111.7	L199 H205 K206	L199-S203 WeakPolarHBondContact O-CB 3.19Å; L199-S203 PolarHBondContact O-N 3.42Å; S203-H205 VanDerWaalsContact C-N 3.29Å; S203-H205 PolarHBondContact O-N 3.39Å; S203-K206 PolarHBondContact O-N 2.92Å
204	R	89.8	Confident	90	Very high	128 Å²	128	73.1 Å²	73.1	48%	0.483	39%	0.385	S	S	.	.	H	α-helix	trans	-65.5	-31.8	174	-178.7	175	64.7	-149.7	-3.6	113.1	S200 L202 R226	S200-R204 VanDerWaalsContact O-CB 3.31Å; S200-R204 WeakPolarHBondContact O-CB 3.37Å; S200-R204 PolarHBondContact O-N 3.42Å; L202-R204 VanDerWaalsContact C-N 3.29Å; L202-R204 PolarHBondContact O-N 3.08Å; R204-R226 VanDerWaalsContact CD-CZ 3.49Å
205	H	91.8	Very high	90	Very high	26 Å²	26	71.9 Å²	71.9	12%	0.12	38%	0.377	C	S	.	.	H	α-helix	trans	-73	-35.7	176.8	169	66.9	0	0	0	112.2	C192 F196 A201 L202 S203 V207 V208 H209	C192-H205 PolarHBondContact SG-NE2 3.19Å; F196-H205 HydrophobicContact CE1-CB 3.68Å; F196-H205 AromaticContact CE1-CG 3.92Å; F196-H205 HydrophobicContact CE2-CB 4.02Å; F196-H205 AromaticContact CE2-CD2 3.33Å; F196-H205 WeakPolarHBondContact CE2-CD2 3.39Å; F196-H205 AromaticContact CE2-CG 3.76Å; F196-H205 AromaticContact CE2-NE2 3.97Å; F196-H205 HydrophobicContact CZ-CB 3.37Å; F196-H205 AromaticContact CZ-CD2 3.2Å; F196-H205 WeakPolarHBondContact CZ-CD2 3.39Å; F196-H205 AromaticContact CZ-CG 3.14Å; F196-H205 AromaticContact CZ-ND1 3.75Å; F196-H205 AromaticContact CZ-NE2 3.77Å; A201-H205 WeakPolarHBondContact O-CB 3.02Å; A201-H205 PolarHBondContact O-N 3.33Å; L202-H205 CarbonylContact O-C 3.58Å; L202-H205 WeakPolarHBondContact O-CA 3.37Å; L202-H205 WeakPolarHBondContact O-CB 3.18Å; L202-H205 PolarHBondContact O-N 3.1Å; S203-H205 VanDerWaalsContact C-N 3.29Å; S203-H205 PolarHBondContact O-N 3.39Å; H205-V207 PolarHBondContact O-N 3.34Å; H205-V208 WeakPolarHBondContact O-CB 3.48Å; H205-V208 WeakPolarHBondContact O-CG2 3.15Å; H205-V208 PolarHBondContact O-N 2.76Å; H205-H209 AromaticContact CD2-NE2 4Å; H205-H209 AromaticContact CE1-NE2 3.82Å; H205-H209 AromaticContact NE2-NE2 3.31Å; H205-H209 PolarHBondContact NE2-NE2 3.48Å
206	K	90.2	Very high	90	Very high	96 Å²	96	73 Å²	73	42%	0.417	38%	0.384	S	S	.	.	H	α-helix	trans	-54.5	-29.8	177.2	-71.1	-172.8	173.1	-165.8	0	113.3	L202 S203 V208 H209 T210	L202-K206 HydrophobicContact CD1-CG 4.35Å; L202-K206 PolarHBondContact O-N 3.34Å; S203-K206 PolarHBondContact O-N 2.92Å; K206-V208 PolarHBondContact O-N 2.92Å; K206-V208 VanDerWaalsContact O-N 3.15Å; K206-H209 PolarHBondContact O-N 3.35Å; K206-T210 PolarHBondContact O-N 2.99Å
207	V	89.9	Confident	90.1	Very high	27 Å²	27	71.7 Å²	71.7	16%	0.164	38%	0.378	C	S	.	.	H	α-helix	trans	-60.5	-22.5	174.3	-172.9	0	0	0	0	113.1	H205 H209 T210 G211 E212	H205-V207 PolarHBondContact O-N 3.34Å; V207-H209 VanDerWaalsContact C-N 3.34Å; V207-T210 PolarHBondContact O-OG1 3.22Å; V207-G211 PolarHBondContact O-N 3.38Å; V207-G211 VanDerWaalsContact O-N 3.1Å; V207-E212 HydrophobicContact CG1-CB 4.25Å; V207-E212 WeakPolarHBondContact CG1-O 3.33Å
208	V	89.2	Confident	90.2	Very high	100 Å²	100	78.1 Å²	78.1	61%	0.606	40%	0.404	S	S	*	.	H	α-helix	trans	-68	-37	174.7	179.2	0	0	0	0	110.9	H205 K206	H205-V208 WeakPolarHBondContact O-CB 3.48Å; H205-V208 WeakPolarHBondContact O-CG2 3.15Å; H205-V208 PolarHBondContact O-N 2.76Å; K206-V208 PolarHBondContact O-N 2.92Å; K206-V208 VanDerWaalsContact O-N 3.15Å
209	H	89.6	Confident	90.2	Very high	68 Å²	68	83.5 Å²	83.5	32%	0.315	43%	0.425	S	S	.	.	H	α-helix	trans	-75.6	-40	179.7	-62.5	-61.4	0	0	0	112.2	C189 E191 C192 H205 K206 V207 G211	C189-H209 PolarHBondContact SG-NE2 3.42Å; C189-H209 VanDerWaalsContact SG-NE2 3.36Å; E191-H209 IonicContact OE1-CD2 3.17Å; E191-H209 IonicContact OE1-CG 3.38Å; E191-H209 WeakPolarHBondContact OE2-CB 3.44Å; E191-H209 IonicContact OE2-CD2 3.08Å; E191-H209 IonicContact OE2-CG 3.96Å; E191-H209 IonicContact OE2-ND1 3.66Å; C192-H209 PolarHBondContact SG-NE2 3.46Å; C192-H209 VanDerWaalsContact SG-NE2 3.42Å; H205-H209 AromaticContact CD2-NE2 4Å; H205-H209 AromaticContact CE1-NE2 3.82Å; H205-H209 AromaticContact NE2-NE2 3.31Å; H205-H209 PolarHBondContact NE2-NE2 3.48Å; K206-H209 PolarHBondContact O-N 3.35Å; V207-H209 VanDerWaalsContact C-N 3.34Å; H209-G211 PolarHBondContact O-N 2.95Å
210	T	87.8	Confident	90.4	Very high	89 Å²	89	81.1 Å²	81.1	55%	0.546	42%	0.416	S	S	.	.	H	α-helix	trans	-74.8	-15.9	177.6	65.7	0	0	0	0	113.1	K206 V207 E212	K206-T210 PolarHBondContact O-N 2.99Å; V207-T210 PolarHBondContact O-OG1 3.22Å; T210-E212 PolarHBondContact O-N 2.76Å; T210-E212 VanDerWaalsContact O-N 3.08Å; T210-E212 WeakPolarHBondContact OG1-CB 3.43Å; T210-E212 PolarHBondContact OG1-N 3.25Å
211	G	85.8	Confident	90.5	Very high	47 Å²	47	79.5 Å²	79.5	49%	0.485	41%	0.414	S	S	.	.			trans	64.7	8.8	-174.9	0	0	0	0	0	114.2	V207 H209 K213	V207-G211 PolarHBondContact O-N 3.38Å; V207-G211 VanDerWaalsContact O-N 3.1Å; H209-G211 PolarHBondContact O-N 2.95Å; G211-K213 PolarHBondContact O-N 3.14Å
212	E	89.2	Confident	90.6	Very high	79 Å²	79	84.8 Å²	84.8	37%	0.369	44%	0.435	S	S	.	.			trans	-67.9	124.1	-169.2	-164.5	-171	165.1	0	0	111.5	V207 T210 R214	V207-E212 HydrophobicContact CG1-CB 4.25Å; V207-E212 WeakPolarHBondContact CG1-O 3.33Å; T210-E212 PolarHBondContact O-N 2.76Å; T210-E212 VanDerWaalsContact O-N 3.08Å; T210-E212 WeakPolarHBondContact OG1-CB 3.43Å; T210-E212 PolarHBondContact OG1-N 3.25Å; E212-R214 HydrophobicContact CG-CG 3.98Å; E212-R214 WeakPolarHBondContact OE1-CD 3.16Å; E212-R214 VanDerWaalsContact OE1-CG 3.3Å; E212-R214 WeakPolarHBondContact OE1-CG 3.4Å; E212-R214 IonicContact OE1-CZ 3.89Å; E212-R214 IonicContact OE1-NE 3.32Å; E212-R214 PolarHBondContact OE1-NE 3.02Å; E212-R214 IonicContact OE1-NH2 2.7Å; E212-R214 PolarHBondContact OE1-NH2 2.78Å; E212-R214 IonicContact OE2-CZ 3.46Å; E212-R214 IonicContact OE2-NE 3.46Å; E212-R214 PolarHBondContact OE2-NE 2.81Å; E212-R214 IonicContact OE2-NH2 2.7Å; E212-R214 PolarHBondContact OE2-NH2 2.98Å
213	K	88.9	Confident	90.6	Very high	130 Å²	130	85.9 Å²	85.9	57%	0.565	45%	0.446	S	S	*	.			trans	-117.6	79.2	-178.5	-69	171.7	-178.7	177.6	0	110.8	G211 Y215 A223 Y224	G211-K213 PolarHBondContact O-N 3.14Å; K213-Y215 PolarHBondContact O-N 3.03Å; K213-A223 HydrophobicContact CB-CB 3.57Å; K213-A223 HydrophobicContact CD-CB 3.98Å; K213-A223 HydrophobicContact CG-CB 4.38Å; K213-Y224 CarbonylContact C-O 3.41Å; K213-Y224 WeakPolarHBondContact CA-O 3.31Å
214	R	90.3	Very high	90.6	Very high	161 Å²	161	84.6 Å²	84.6	61%	0.608	43%	0.43	S	S	*	.			trans	-68	-13.8	-175.3	-59	-179.1	-170.1	172.6	4.1	115.3	E212 Y224	E212-R214 HydrophobicContact CG-CG 3.98Å; E212-R214 WeakPolarHBondContact OE1-CD 3.16Å; E212-R214 VanDerWaalsContact OE1-CG 3.3Å; E212-R214 WeakPolarHBondContact OE1-CG 3.4Å; E212-R214 IonicContact OE1-CZ 3.89Å; E212-R214 IonicContact OE1-NE 3.32Å; E212-R214 PolarHBondContact OE1-NE 3.02Å; E212-R214 IonicContact OE1-NH2 2.7Å; E212-R214 PolarHBondContact OE1-NH2 2.78Å; E212-R214 IonicContact OE2-CZ 3.46Å; E212-R214 IonicContact OE2-NE 3.46Å; E212-R214 PolarHBondContact OE2-NE 2.81Å; E212-R214 IonicContact OE2-NH2 2.7Å; E212-R214 PolarHBondContact OE2-NH2 2.98Å; R214-Y224 PolarHBondContact N-O 2.79Å
215	Y	92.5	Very high	90.6	Very high	90 Å²	90	80.9 Å²	80.9	35%	0.353	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	97.5	-171.1	-57.7	-79.2	0	0	0	110.5	K213 A223 Y224 S227	K213-Y215 PolarHBondContact O-N 3.03Å; Y215-A223 CarbonylContact O-C 3.51Å; Y215-A223 WeakPolarHBondContact O-CA 3.25Å; Y215-Y224 WeakPolarHBondContact CB-O 3.35Å; Y215-Y224 PolarHBondContact N-O 2.8Å; Y215-Y224 PolarHBondContact O-N 3.03Å; Y215-S227 VanDerWaalsContact CD2-N 3.3Å; Y215-S227 VanDerWaalsContact CE2-N 3.33Å
216	T	91.8	Very high	90.5	Very high	81 Å²	81	83 Å²	83	50%	0.497	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	143.7	-179.2	50.2	0	0	0	0	111.8	A223 L230	T216-A223 HydrophobicContact CG2-CB 3.82Å; T216-L230 VanDerWaalsContact O-CD2 3.31Å; T216-L230 WeakPolarHBondContact O-CD2 3.34Å
217	C	94.2	Very high	90.5	Very high	2 Å²	2	81.3 Å²	81.3	1%	0.014	43%	0.431	C	S	.	.			trans	-87.7	114.5	170.9	-173.5	0	0	0	0	109.7	K219 C220 G221 K222 L230 H237	C217-K219 PolarHBondContact O-N 3.37Å; C217-C220 PolarHBondContact O-N 3.25Å; C217-G221 VanDerWaalsContact O-CA 3.25Å; C217-G221 WeakPolarHBondContact O-CA 3.45Å; C217-G221 PolarHBondContact O-N 3.37Å; C217-K222 WeakPolarHBondContact CB-O 3.39Å; C217-K222 PolarHBondContact N-O 2.87Å; C217-L230 HydrophobicContact CB-CD1 3.61Å; C217-H237 PolarHBondContact SG-NE2 3.12Å
218	E	91.8	Very high	90.4	Very high	171 Å²	171	85.3 Å²	85.3	80%	0.799	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-33.1	177.6	-68.7	154.9	-159.4	0	0	112.9
219	K	89.7	Confident	90.4	Very high	163 Å²	163	82.7 Å²	82.7	71%	0.709	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-30.2	-177	-70.5	-168.2	174.2	-168.6	0	114.6	C217 H237	C217-K219 PolarHBondContact O-N 3.37Å; K219-H237 HydrophobicContact CD-CB 4.02Å
220	C	93.3	Very high	90.6	Very high	54 Å²	54	80.3 Å²	80.3	37%	0.365	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.7	8.9	-173.5	71.7	0	0	0	0	114.5	C217 K222 H233 H237	C217-C220 PolarHBondContact O-N 3.25Å; C220-K222 PolarHBondContact O-N 3.13Å; C220-H233 PolarHBondContact SG-NE2 3.19Å; C220-H237 PolarHBondContact SG-NE2 3.5Å; C220-H237 VanDerWaalsContact SG-NE2 3.36Å
221	G	90.7	Very high	90.6	Very high	58 Å²	58	79.5 Å²	79.5	60%	0.598	41%	0.412	S	S	*	.			trans	69.3	-8.5	-179.8	0	0	0	0	0	115.5	C217 A223	C217-G221 VanDerWaalsContact O-CA 3.25Å; C217-G221 WeakPolarHBondContact O-CA 3.45Å; C217-G221 PolarHBondContact O-N 3.37Å; G221-A223 PolarHBondContact O-N 3.24Å
222	K	92.1	Very high	90.7	Very high	122 Å²	122	83.1 Å²	83.1	53%	0.53	41%	0.411	S	S	.	.			trans	-62.5	125.3	-176.1	-73.1	-178.4	179.9	177.3	0	111.6	C217 C220 Y224	C217-K222 WeakPolarHBondContact CB-O 3.39Å; C217-K222 PolarHBondContact N-O 2.87Å; C220-K222 PolarHBondContact O-N 3.13Å; K222-Y224 HydrophobicContact CB-CE2 3.9Å; K222-Y224 WeakPolarHBondContact O-CE2 3.33Å
223	A	92.9	Very high	90.7	Very high	36 Å²	36	80.8 Å²	80.8	30%	0.298	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	143.7	-178.7	0	0	0	0	0	112.4	K213 Y215 T216 G221	K213-A223 HydrophobicContact CB-CB 3.57Å; K213-A223 HydrophobicContact CD-CB 3.98Å; K213-A223 HydrophobicContact CG-CB 4.38Å; Y215-A223 CarbonylContact O-C 3.51Å; Y215-A223 WeakPolarHBondContact O-CA 3.25Å; T216-A223 HydrophobicContact CG2-CB 3.82Å; G221-A223 PolarHBondContact O-N 3.24Å
224	Y	91.6	Very high	90.7	Very high	49 Å²	49	79 Å²	79	19%	0.192	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	146.6	-177.9	-59.3	-87.4	0	0	0	110.4	K213 R214 Y215 K222 R226 H229 L230 H233	K213-Y224 CarbonylContact C-O 3.41Å; K213-Y224 WeakPolarHBondContact CA-O 3.31Å; R214-Y224 PolarHBondContact N-O 2.79Å; Y215-Y224 WeakPolarHBondContact CB-O 3.35Å; Y215-Y224 PolarHBondContact N-O 2.8Å; Y215-Y224 PolarHBondContact O-N 3.03Å; K222-Y224 HydrophobicContact CB-CE2 3.9Å; K222-Y224 WeakPolarHBondContact O-CE2 3.33Å; Y224-R226 VanDerWaalsContact C-N 3.26Å; Y224-R226 PolarHBondContact O-N 3.48Å; Y224-H229 HydrophobicContact CD1-CB 3.74Å; Y224-H229 HydrophobicContact CG-CB 4.09Å; Y224-L230 HydrophobicContact CD2-CB 3.88Å; Y224-L230 HydrophobicContact CD2-CD1 3.89Å; Y224-L230 HydrophobicContact CD2-CG 4.49Å; Y224-L230 HydrophobicContact CE2-CD1 4.04Å; Y224-L230 HydrophobicContact CG-CB 4.34Å; Y224-H233 HydrophobicContact CE1-CB 4.27Å; Y224-H233 HydrophobicContact CE2-CB 3.92Å; Y224-H233 AromaticContact CE2-CD2 3.47Å; Y224-H233 VanDerWaalsContact CE2-CD2 3.47Å; Y224-H233 WeakPolarHBondContact CE2-CD2 3.42Å; Y224-H233 AromaticContact CE2-CG 3.78Å; Y224-H233 AromaticContact CZ-CD2 3.65Å; Y224-H233 AromaticContact CZ-CG 3.51Å; Y224-H233 WeakPolarHBondContact OH-CB 3.49Å; Y224-H233 PolarHBondContact OH-CD2 3.02Å; Y224-H233 PolarHBondContact OH-CE1 3.38Å; Y224-H233 PolarHBondContact OH-ND1 2.87Å; Y224-H233 PolarHBondContact OH-NE2 3.14Å
225	S	89.9	Confident	90.4	Very high	49 Å²	49	75.6 Å²	75.6	34%	0.343	38%	0.382	S	S	.	.	S	Bend	trans	-76.9	-12	174.7	55.1	0	0	0	0	113.5
226	R	88.7	Confident	90	Very high	72 Å²	72	73.9 Å²	73.9	27%	0.272	39%	0.386	S	S	.	.	S	Bend	trans	-136.7	138.5	-176.4	-55.4	-171.5	-174.4	170.7	-3.2	111.5	R204 Y224 Y228 H229 L230	R204-R226 VanDerWaalsContact CD-CZ 3.49Å; Y224-R226 VanDerWaalsContact C-N 3.26Å; Y224-R226 PolarHBondContact O-N 3.48Å; R226-Y228 HydrophobicContact CB-CD1 3.89Å; R226-Y228 HydrophobicContact CB-CE1 3.83Å; R226-Y228 HydrophobicContact CG-CE1 4.21Å; R226-Y228 PolarHBondContact NH1-OH 3.35Å; R226-Y228 PolarHBondContact O-N 3.4Å; R226-H229 HydrophobicContact CB-CB 4.48Å; R226-H229 WeakPolarHBondContact O-CB 3.48Å; R226-H229 PolarHBondContact O-N 3.12Å; R226-H229 VanDerWaalsContact O-N 3.15Å; R226-L230 PolarHBondContact O-N 3.37Å
227	S	90.3	Very high	89.7	Confident	60 Å²	60	73.4 Å²	73.4	42%	0.42	38%	0.379	S	S	.	.	H	α-helix	trans	-58.2	-44.8	179.2	58.1	0	0	0	0	112.5	Y215 H229 L230 S231	Y215-S227 VanDerWaalsContact CD2-N 3.3Å; Y215-S227 VanDerWaalsContact CE2-N 3.33Å; S227-H229 VanDerWaalsContact C-N 3.26Å; S227-H229 PolarHBondContact O-N 3.17Å; S227-L230 WeakPolarHBondContact O-CA 3.28Å; S227-L230 WeakPolarHBondContact O-CB 3.21Å; S227-L230 PolarHBondContact O-N 2.88Å; S227-S231 PolarHBondContact O-N 2.95Å; S227-S231 PolarHBondContact O-OG 2.78Å
228	Y	88.4	Confident	89.1	Confident	111 Å²	111	76.2 Å²	76.2	44%	0.435	40%	0.398	S	S	.	.	H	α-helix	trans	-64.8	-28.9	-179.6	81.7	-96.4	0	0	0	112.9	R226 R232	R226-Y228 HydrophobicContact CB-CD1 3.89Å; R226-Y228 HydrophobicContact CB-CE1 3.83Å; R226-Y228 HydrophobicContact CG-CE1 4.21Å; R226-Y228 PolarHBondContact NH1-OH 3.35Å; R226-Y228 PolarHBondContact O-N 3.4Å; Y228-R232 WeakPolarHBondContact O-CB 3.27Å; Y228-R232 PolarHBondContact O-N 3.43Å
229	H	90	Very high	88.4	Confident	45 Å²	45	70 Å²	70	21%	0.208	38%	0.38	C	S	.	.	H	α-helix	trans	-67	-42	173.1	-74.1	170.6	0	0	0	110.9	Y224 R226 S227 R232 H233	Y224-H229 HydrophobicContact CD1-CB 3.74Å; Y224-H229 HydrophobicContact CG-CB 4.09Å; R226-H229 HydrophobicContact CB-CB 4.48Å; R226-H229 WeakPolarHBondContact O-CB 3.48Å; R226-H229 PolarHBondContact O-N 3.12Å; R226-H229 VanDerWaalsContact O-N 3.15Å; S227-H229 VanDerWaalsContact C-N 3.26Å; S227-H229 PolarHBondContact O-N 3.17Å; H229-R232 PolarHBondContact O-N 2.72Å; H229-H233 WeakPolarHBondContact O-CB 3.35Å; H229-H233 PolarHBondContact O-N 3.14Å
230	L	92.1	Very high	87.8	Confident	17 Å²	17	68.7 Å²	68.7	9%	0.089	38%	0.377	C	S	.	.	H	α-helix	trans	-63	-48.3	172.9	173.7	62.9	0	0	0	111.2	T216 C217 Y224 R226 S227 R232 H233 K234	T216-L230 VanDerWaalsContact O-CD2 3.31Å; T216-L230 WeakPolarHBondContact O-CD2 3.34Å; C217-L230 HydrophobicContact CB-CD1 3.61Å; Y224-L230 HydrophobicContact CD2-CB 3.88Å; Y224-L230 HydrophobicContact CD2-CD1 3.89Å; Y224-L230 HydrophobicContact CD2-CG 4.49Å; Y224-L230 HydrophobicContact CE2-CD1 4.04Å; Y224-L230 HydrophobicContact CG-CB 4.34Å; R226-L230 PolarHBondContact O-N 3.37Å; S227-L230 WeakPolarHBondContact O-CA 3.28Å; S227-L230 WeakPolarHBondContact O-CB 3.21Å; S227-L230 PolarHBondContact O-N 2.88Å; L230-R232 VanDerWaalsContact C-N 3.27Å; L230-R232 PolarHBondContact O-N 3.37Å; L230-H233 CarbonylContact O-C 3.57Å; L230-H233 WeakPolarHBondContact O-CB 3.47Å; L230-H233 PolarHBondContact O-N 3.25Å; L230-H233 VanDerWaalsContact O-N 3.11Å; L230-K234 HydrophobicContact CD1-CG 4.18Å; L230-K234 HydrophobicContact CG-CD 4.48Å; L230-K234 HydrophobicContact CG-CG 4.45Å; L230-K234 WeakPolarHBondContact O-CG 3.27Å; L230-K234 PolarHBondContact O-N 2.74Å
231	S	88.6	Confident	87.3	Confident	73 Å²	73	70.5 Å²	70.5	51%	0.51	38%	0.378	S	S	.	.	H	α-helix	trans	-57.6	-41.8	177.6	-56.6	0	0	0	0	111.8	S227 K234 K235	S227-S231 PolarHBondContact O-N 2.95Å; S227-S231 PolarHBondContact O-OG 2.78Å; S231-K234 PolarHBondContact O-N 3.46Å; S231-K235 PolarHBondContact O-N 2.7Å
232	R	87.4	Confident	87	Confident	123 Å²	123	71.7 Å²	71.7	46%	0.464	38%	0.377	S	S	.	.	H	α-helix	trans	-62.6	-47.7	174.7	-169.3	174.1	66.4	-176.3	-0.7	111	Y228 H229 L230 K234 K235 Y254	Y228-R232 WeakPolarHBondContact O-CB 3.27Å; Y228-R232 PolarHBondContact O-N 3.43Å; H229-R232 PolarHBondContact O-N 2.72Å; L230-R232 VanDerWaalsContact C-N 3.27Å; L230-R232 PolarHBondContact O-N 3.37Å; R232-K234 VanDerWaalsContact C-N 3.33Å; R232-K234 PolarHBondContact O-N 3.35Å; R232-K235 WeakPolarHBondContact O-CB 3.49Å; R232-K235 PolarHBondContact O-N 3.45Å; R232-Y254 HydrophobicContact CG-CE1 3.57Å; R232-Y254 HydrophobicContact CG-CE2 4.03Å; R232-Y254 WeakPolarHBondContact CG-OH 3.5Å; R232-Y254 PolarHBondContact O-OH 2.97Å
233	H	89.4	Confident	86.9	Confident	30 Å²	30	70 Å²	70	14%	0.139	37%	0.368	C	S	.	.	H	α-helix	trans	-60.5	-40.2	176.8	170.6	65.1	0	0	0	113.1	C220 Y224 H229 L230 K235 A236 H237	C220-H233 PolarHBondContact SG-NE2 3.19Å; Y224-H233 HydrophobicContact CE1-CB 4.27Å; Y224-H233 HydrophobicContact CE2-CB 3.92Å; Y224-H233 AromaticContact CE2-CD2 3.47Å; Y224-H233 VanDerWaalsContact CE2-CD2 3.47Å; Y224-H233 WeakPolarHBondContact CE2-CD2 3.42Å; Y224-H233 AromaticContact CE2-CG 3.78Å; Y224-H233 AromaticContact CZ-CD2 3.65Å; Y224-H233 AromaticContact CZ-CG 3.51Å; Y224-H233 WeakPolarHBondContact OH-CB 3.49Å; Y224-H233 PolarHBondContact OH-CD2 3.02Å; Y224-H233 PolarHBondContact OH-CE1 3.38Å; Y224-H233 PolarHBondContact OH-ND1 2.87Å; Y224-H233 PolarHBondContact OH-NE2 3.14Å; H229-H233 WeakPolarHBondContact O-CB 3.35Å; H229-H233 PolarHBondContact O-N 3.14Å; L230-H233 CarbonylContact O-C 3.57Å; L230-H233 WeakPolarHBondContact O-CB 3.47Å; L230-H233 PolarHBondContact O-N 3.25Å; L230-H233 VanDerWaalsContact O-N 3.11Å; H233-K235 PolarHBondContact O-N 2.67Å; H233-K235 VanDerWaalsContact O-N 3.14Å; H233-A236 VanDerWaalsContact O-CB 3.28Å; H233-A236 WeakPolarHBondContact O-CB 3.37Å; H233-A236 PolarHBondContact O-N 3.46Å; H233-H237 AromaticContact CD2-NE2 3.9Å; H233-H237 AromaticContact CE1-NE2 3.47Å; H233-H237 PolarHBondContact CE1-NE2 3.28Å; H233-H237 AromaticContact NE2-CD2 3.92Å; H233-H237 AromaticContact NE2-NE2 3.15Å; H233-H237 PolarHBondContact NE2-NE2 3.21Å; H233-H237 VanDerWaalsContact NE2-NE2 3.15Å
234	K	88.4	Confident	86.7	Confident	92 Å²	92	74.7 Å²	74.7	40%	0.4	38%	0.382	S	S	.	.	H	α-helix	trans	-56.6	-30	176.9	-75	-173	176.5	-166.5	0	112.5	L230 S231 R232 A236 H237 S238	L230-K234 HydrophobicContact CD1-CG 4.18Å; L230-K234 HydrophobicContact CG-CD 4.48Å; L230-K234 HydrophobicContact CG-CG 4.45Å; L230-K234 WeakPolarHBondContact O-CG 3.27Å; L230-K234 PolarHBondContact O-N 2.74Å; S231-K234 PolarHBondContact O-N 3.46Å; R232-K234 VanDerWaalsContact C-N 3.33Å; R232-K234 PolarHBondContact O-N 3.35Å; K234-A236 VanDerWaalsContact C-N 3.29Å; K234-A236 PolarHBondContact O-N 3.24Å; K234-H237 WeakPolarHBondContact O-CB 3.48Å; K234-H237 PolarHBondContact O-N 2.81Å; K234-S238 PolarHBondContact O-N 3.25Å
235	K	85.6	Confident	86.8	Confident	89 Å²	89	72.4 Å²	72.4	39%	0.387	37%	0.373	S	S	.	.	H	α-helix	trans	-63.9	-32	174.9	-67	-172.5	174.6	-166.6	0	113.4	S231 R232 H233 H237 S238 G239 Y254	S231-K235 PolarHBondContact O-N 2.7Å; R232-K235 WeakPolarHBondContact O-CB 3.49Å; R232-K235 PolarHBondContact O-N 3.45Å; H233-K235 PolarHBondContact O-N 2.67Å; H233-K235 VanDerWaalsContact O-N 3.14Å; K235-H237 VanDerWaalsContact C-N 3.29Å; K235-H237 PolarHBondContact O-N 3.01Å; K235-S238 WeakPolarHBondContact CA-OG 3.38Å; K235-S238 PolarHBondContact O-N 2.86Å; K235-S238 PolarHBondContact O-OG 3.12Å; K235-G239 PolarHBondContact O-N 3.49Å; K235-Y254 HydrophobicContact CD-CE1 3.91Å
236	A	84.1	Confident	86.8	Confident	54 Å²	54	79.7 Å²	79.7	45%	0.446	40%	0.398	S	S	.	.	H	α-helix	trans	-63.7	-36.8	175.8	0	0	0	0	0	111.5	H233 K234 G239	H233-A236 VanDerWaalsContact O-CB 3.28Å; H233-A236 WeakPolarHBondContact O-CB 3.37Å; H233-A236 PolarHBondContact O-N 3.46Å; K234-A236 VanDerWaalsContact C-N 3.29Å; K234-A236 PolarHBondContact O-N 3.24Å; A236-G239 PolarHBondContact O-N 2.74Å
237	H	85.4	Confident	86.8	Confident	72 Å²	72	82.2 Å²	82.2	33%	0.333	41%	0.413	S	S	.	.	H	α-helix	trans	-69.8	-32.1	174.6	-66	-57.7	0	0	0	113.4	C217 K219 C220 H233 K234 K235 G239	C217-H237 PolarHBondContact SG-NE2 3.12Å; K219-H237 HydrophobicContact CD-CB 4.02Å; C220-H237 PolarHBondContact SG-NE2 3.5Å; C220-H237 VanDerWaalsContact SG-NE2 3.36Å; H233-H237 AromaticContact CD2-NE2 3.9Å; H233-H237 AromaticContact CE1-NE2 3.47Å; H233-H237 PolarHBondContact CE1-NE2 3.28Å; H233-H237 AromaticContact NE2-CD2 3.92Å; H233-H237 AromaticContact NE2-NE2 3.15Å; H233-H237 PolarHBondContact NE2-NE2 3.21Å; H233-H237 VanDerWaalsContact NE2-NE2 3.15Å; K234-H237 WeakPolarHBondContact O-CB 3.48Å; K234-H237 PolarHBondContact O-N 2.81Å; K235-H237 VanDerWaalsContact C-N 3.29Å; K235-H237 PolarHBondContact O-N 3.01Å; H237-G239 VanDerWaalsContact C-N 3.28Å
238	S	81.1	Confident	86.8	Confident	60 Å²	60	82 Å²	82	42%	0.42	41%	0.411	S	S	.	.	H	α-helix	trans	-76.7	-14.6	179.4	63.5	0	0	0	0	113.8	K234 K235 Q240	K234-S238 PolarHBondContact O-N 3.25Å; K235-S238 WeakPolarHBondContact CA-OG 3.38Å; K235-S238 PolarHBondContact O-N 2.86Å; K235-S238 PolarHBondContact O-OG 3.12Å; S238-Q240 PolarHBondContact O-N 2.81Å
239	G	76.5	Confident	86.8	Confident	41 Å²	41	78.1 Å²	78.1	42%	0.423	41%	0.405	S	S	.	.			trans	64.6	-3.9	-174.4	0	0	0	0	0	115.1	K235 A236 H237 K241	K235-G239 PolarHBondContact O-N 3.49Å; A236-G239 PolarHBondContact O-N 2.74Å; H237-G239 VanDerWaalsContact C-N 3.28Å; G239-K241 PolarHBondContact O-N 3.1Å
240	Q	77.2	Confident	86.7	Confident	136 Å²	136	82 Å²	82	64%	0.636	42%	0.422	S	S	*	.			trans	-67.7	94.9	-176.6	-79	-175	-16.8	0	0	111.7	S238 Y253	S238-Q240 PolarHBondContact O-N 2.81Å; Q240-Y253 WeakPolarHBondContact O-CD1 3.37Å
241	K	82.4	Confident	86.6	Confident	91 Å²	91	85.3 Å²	85.3	40%	0.396	44%	0.438	S	S	.	.			trans	-88.9	109.3	166.6	-64.7	172.2	173.3	-172.9	0	107.9	G239 M251 F252 Y253	G239-K241 PolarHBondContact O-N 3.1Å; K241-M251 HydrophobicContact CB-CB 3.76Å; K241-M251 HydrophobicContact CB-CE 4.47Å; K241-M251 HydrophobicContact CD-CB 3.8Å; K241-M251 WeakPolarHBondContact CD-O 3.48Å; K241-M251 HydrophobicContact CG-CB 4.41Å; K241-M251 WeakPolarHBondContact O-CE 3.46Å; K241-F252 CarbonylContact C-O 3.55Å; K241-F252 WeakPolarHBondContact CA-O 3.37Å; K241-Y253 HydrophobicContact CD-CE2 4.33Å; K241-Y253 VanDerWaalsContact CE-CE2 3.49Å; K241-Y253 HydrophobicContact CG-CD1 3.83Å; K241-Y253 HydrophobicContact CG-CD2 4.11Å; K241-Y253 HydrophobicContact CG-CE1 3.64Å; K241-Y253 HydrophobicContact CG-CE2 3.93Å; K241-Y253 HydrophobicContact CG-CG 4.06Å
242	S	85.4	Confident	86.5	Confident	83 Å²	83	83.8 Å²	83.8	58%	0.58	42%	0.422	S	S	*	.			trans	-97.5	-7.9	-175.4	-50.3	0	0	0	0	113.6	F252	S242-F252 PolarHBondContact N-O 2.91Å; S242-F252 VanDerWaalsContact N-O 3.16Å
243	Y	88.8	Confident	86.4	Confident	86 Å²	86	81.1 Å²	81.1	34%	0.337	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	106.9	-171.4	-60.3	-80.5	0	0	0	110.6	M251 F252 Y253	Y243-M251 CarbonylContact O-C 3.58Å; Y243-M251 WeakPolarHBondContact O-CA 3.29Å; Y243-F252 PolarHBondContact N-O 3.34Å; Y243-F252 VanDerWaalsContact N-O 3.09Å; Y243-F252 PolarHBondContact O-N 3.22Å; Y243-Y253 WeakPolarHBondContact CD2-O 3.4Å; Y243-Y253 WeakPolarHBondContact CE2-O 3.4Å
244	K	90.1	Very high	86.2	Confident	136 Å²	136	82.2 Å²	82.2	59%	0.591	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	131.8	179.9	-169.1	175.3	175.9	-177.6	0	111.2	M251	K244-M251 HydrophobicContact CB-SD 3.46Å; K244-M251 WeakPolarHBondContact CB-SD 3.3Å; K244-M251 HydrophobicContact CD-SD 4.11Å; K244-M251 HydrophobicContact CG-SD 3.64Å
245	C	92.6	Very high	86.1	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	42%	0.415	C	S	.	.			trans	-71.7	127.7	165.7	179.1	0	0	0	0	109.7	G249 K250 F252 L258	C245-G249 WeakPolarHBondContact O-CA 3.37Å; C245-G249 PolarHBondContact O-N 2.82Å; C245-K250 HydrophobicContact CB-CB 4.48Å; C245-K250 WeakPolarHBondContact CB-O 3.43Å; C245-K250 PolarHBondContact N-O 2.99Å; C245-F252 HydrophobicContact CB-CE2 4.31Å; C245-L258 HydrophobicContact CB-CD1 3.64Å
246	K	89.5	Confident	86.2	Confident	202 Å²	202	79.8 Å²	79.8	88%	0.878	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-33.1	-179.1	-66.3	-175	177.9	-176.4	0	112.6
247	E	88.8	Confident	86.4	Confident	126 Å²	126	79.1 Å²	79.1	59%	0.589	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-46.7	-176	-68.5	151.7	161.8	0	0	112.4	H265	E247-H265 WeakPolarHBondContact OE2-CB 3.36Å; E247-H265 IonicContact OE2-CD2 3.72Å; E247-H265 PolarHBondContact OE2-CD2 2.99Å; E247-H265 IonicContact OE2-CG 3.98Å; E247-H265 IonicContact OE2-NE2 2.77Å
248	C	91.1	Very high	86.6	Confident	54 Å²	54	76.7 Å²	76.7	37%	0.365	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	2.5	-174.3	75.3	0	0	0	0	114.5	K250 H261	C248-K250 PolarHBondContact O-N 3.48Å; C248-K250 VanDerWaalsContact SG-CG 3.56Å; C248-H261 PolarHBondContact SG-NE2 3.41Å
249	G	87.9	Confident	86.9	Confident	31 Å²	31	80.8 Å²	80.8	32%	0.32	41%	0.41	S	S	.	.			trans	71.2	-4.3	178.9	0	0	0	0	0	115.9	C245	C245-G249 WeakPolarHBondContact O-CA 3.37Å; C245-G249 PolarHBondContact O-N 2.82Å
250	K	89.2	Confident	87.4	Confident	127 Å²	127	83.9 Å²	83.9	55%	0.552	41%	0.409	S	S	*	.			trans	-60.4	138.4	-178.9	-75	178.9	-177.9	173.5	0	111.9	C245 C248 F252	C245-K250 HydrophobicContact CB-CB 4.48Å; C245-K250 WeakPolarHBondContact CB-O 3.43Å; C245-K250 PolarHBondContact N-O 2.99Å; C248-K250 PolarHBondContact O-N 3.48Å; C248-K250 VanDerWaalsContact SG-CG 3.56Å; K250-F252 HydrophobicContact CB-CE2 3.78Å; K250-F252 HydrophobicContact CB-CZ 4.02Å; K250-F252 WeakPolarHBondContact O-CE2 3.42Å
251	M	88.9	Confident	87.9	Confident	86 Å²	86	78.2 Å²	78.2	42%	0.424	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	137.7	-175.5	-65	-77.1	-83.3	0	0	111.3	K241 Y243 K244	K241-M251 HydrophobicContact CB-CB 3.76Å; K241-M251 HydrophobicContact CB-CE 4.47Å; K241-M251 HydrophobicContact CD-CB 3.8Å; K241-M251 WeakPolarHBondContact CD-O 3.48Å; K241-M251 HydrophobicContact CG-CB 4.41Å; K241-M251 WeakPolarHBondContact O-CE 3.46Å; Y243-M251 CarbonylContact O-C 3.58Å; Y243-M251 WeakPolarHBondContact O-CA 3.29Å; K244-M251 HydrophobicContact CB-SD 3.46Å; K244-M251 WeakPolarHBondContact CB-SD 3.3Å; K244-M251 HydrophobicContact CD-SD 4.11Å; K244-M251 HydrophobicContact CG-SD 3.64Å
252	F	87.5	Confident	88.1	Confident	40 Å²	40	77.3 Å²	77.3	18%	0.175	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	152.6	-177	-60.8	-89.7	0	0	0	111.9	K241 S242 Y243 C245 K250 D257 L258 H261	K241-F252 CarbonylContact C-O 3.55Å; K241-F252 WeakPolarHBondContact CA-O 3.37Å; S242-F252 PolarHBondContact N-O 2.91Å; S242-F252 VanDerWaalsContact N-O 3.16Å; Y243-F252 PolarHBondContact N-O 3.34Å; Y243-F252 VanDerWaalsContact N-O 3.09Å; Y243-F252 PolarHBondContact O-N 3.22Å; C245-F252 HydrophobicContact CB-CE2 4.31Å; K250-F252 HydrophobicContact CB-CE2 3.78Å; K250-F252 HydrophobicContact CB-CZ 4.02Å; K250-F252 WeakPolarHBondContact O-CE2 3.42Å; F252-D257 HydrophobicContact CB-CB 4.25Å; F252-D257 HydrophobicContact CD1-CB 3.81Å; F252-D257 HydrophobicContact CG-CB 4.33Å; F252-L258 HydrophobicContact CB-CB 4.3Å; F252-L258 HydrophobicContact CD2-CB 3.97Å; F252-L258 HydrophobicContact CD2-CD1 3.81Å; F252-L258 HydrophobicContact CD2-CG 4.48Å; F252-L258 HydrophobicContact CE2-CD1 3.96Å; F252-L258 HydrophobicContact CG-CB 4.23Å; F252-H261 HydrophobicContact CE1-CB 3.82Å; F252-H261 HydrophobicContact CE2-CB 3.95Å; F252-H261 AromaticContact CE2-CD2 3.46Å; F252-H261 VanDerWaalsContact CE2-CD2 3.46Å; F252-H261 WeakPolarHBondContact CE2-CD2 3.47Å; F252-H261 AromaticContact CE2-CG 3.7Å; F252-H261 HydrophobicContact CZ-CB 3.38Å; F252-H261 AromaticContact CZ-CD2 3.41Å; F252-H261 VanDerWaalsContact CZ-CD2 3.41Å; F252-H261 WeakPolarHBondContact CZ-CD2 3.23Å; F252-H261 AromaticContact CZ-CG 3.17Å; F252-H261 AromaticContact CZ-ND1 3.74Å
253	Y	84.2	Confident	88.2	Confident	67 Å²	67	76.4 Å²	76.4	26%	0.263	36%	0.363	S	S	.	.	S	Bend	trans	-77.9	-27	177.1	-66.4	-78.8	0	0	0	113.2	Q240 K241 Y243	Q240-Y253 WeakPolarHBondContact O-CD1 3.37Å; K241-Y253 HydrophobicContact CD-CE2 4.33Å; K241-Y253 VanDerWaalsContact CE-CE2 3.49Å; K241-Y253 HydrophobicContact CG-CD1 3.83Å; K241-Y253 HydrophobicContact CG-CD2 4.11Å; K241-Y253 HydrophobicContact CG-CE1 3.64Å; K241-Y253 HydrophobicContact CG-CE2 3.93Å; K241-Y253 HydrophobicContact CG-CG 4.06Å; Y243-Y253 WeakPolarHBondContact CD2-O 3.4Å; Y243-Y253 WeakPolarHBondContact CE2-O 3.4Å
254	Y	84.8	Confident	87.9	Confident	54 Å²	54	77.5 Å²	77.5	21%	0.212	37%	0.374	C	S	.	.	S	Bend	trans	-133.2	145.4	-175.4	-51.7	-67.3	0	0	0	111.5	R232 K235 S256 D257 L258	R232-Y254 HydrophobicContact CG-CE1 3.57Å; R232-Y254 HydrophobicContact CG-CE2 4.03Å; R232-Y254 WeakPolarHBondContact CG-OH 3.5Å; R232-Y254 PolarHBondContact O-OH 2.97Å; K235-Y254 HydrophobicContact CD-CE1 3.91Å; Y254-S256 PolarHBondContact O-N 3.3Å; Y254-D257 VanDerWaalsContact CD2-OD2 3.28Å; Y254-D257 WeakPolarHBondContact CD2-OD2 3.41Å; Y254-D257 PolarHBondContact O-N 3.36Å; Y254-D257 VanDerWaalsContact O-N 3.16Å; Y254-L258 PolarHBondContact O-N 3.28Å
255	S	87.8	Confident	87.7	Confident	57 Å²	57	74.3 Å²	74.3	40%	0.399	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-31.6	175.1	56.7	0	0	0	0	112.7	D257 L258 K259	S255-D257 VanDerWaalsContact C-N 3.33Å; S255-L258 PolarHBondContact O-N 2.75Å; S255-K259 WeakPolarHBondContact O-CB 3.3Å; S255-K259 WeakPolarHBondContact O-CG 3.42Å; S255-K259 PolarHBondContact O-N 3.26Å
256	S	87.5	Confident	87	Confident	73 Å²	73	77 Å²	77	51%	0.51	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-37.6	175.9	54.9	0	0	0	0	112.7	Y254 R260	Y254-S256 PolarHBondContact O-N 3.3Å; S256-R260 WeakPolarHBondContact O-CB 3.45Å; S256-R260 PolarHBondContact O-N 3.43Å
257	D	87.4	Confident	86.2	Confident	40 Å²	40	75.4 Å²	75.4	21%	0.214	38%	0.375	C	S	.	.	H	α-helix	trans	-72.2	-40.2	178.1	-67.6	-33.2	0	0	0	111	F252 Y254 S255 R260 H261	F252-D257 HydrophobicContact CB-CB 4.25Å; F252-D257 HydrophobicContact CD1-CB 3.81Å; F252-D257 HydrophobicContact CG-CB 4.33Å; Y254-D257 VanDerWaalsContact CD2-OD2 3.28Å; Y254-D257 WeakPolarHBondContact CD2-OD2 3.41Å; Y254-D257 PolarHBondContact O-N 3.36Å; Y254-D257 VanDerWaalsContact O-N 3.16Å; S255-D257 VanDerWaalsContact C-N 3.33Å; D257-R260 PolarHBondContact O-N 3.35Å; D257-R260 IonicContact OD1-CZ 3.85Å; D257-R260 IonicContact OD1-NH2 2.76Å; D257-R260 PolarHBondContact OD1-NH2 3.21Å; D257-H261 VanDerWaalsContact O-CB 3.31Å; D257-H261 WeakPolarHBondContact O-CB 3.45Å; D257-H261 PolarHBondContact O-N 2.97Å
258	L	90.1	Very high	85.7	Confident	21 Å²	21	74.8 Å²	74.8	11%	0.11	37%	0.372	C	S	.	.	H	α-helix	trans	-59.8	-49.3	172.1	173.4	60.3	0	0	0	111.1	C245 F252 Y254 S255 R260 H261 Q262	C245-L258 HydrophobicContact CB-CD1 3.64Å; F252-L258 HydrophobicContact CB-CB 4.3Å; F252-L258 HydrophobicContact CD2-CB 3.97Å; F252-L258 HydrophobicContact CD2-CD1 3.81Å; F252-L258 HydrophobicContact CD2-CG 4.48Å; F252-L258 HydrophobicContact CE2-CD1 3.96Å; F252-L258 HydrophobicContact CG-CB 4.23Å; Y254-L258 PolarHBondContact O-N 3.28Å; S255-L258 PolarHBondContact O-N 2.75Å; L258-R260 VanDerWaalsContact C-N 3.31Å; L258-R260 PolarHBondContact O-N 3.02Å; L258-H261 CarbonylContact O-C 3.59Å; L258-H261 WeakPolarHBondContact O-CA 3.33Å; L258-H261 WeakPolarHBondContact O-CB 3.42Å; L258-H261 PolarHBondContact O-N 3.1Å; L258-Q262 HydrophobicContact CD1-CG 4.05Å; L258-Q262 HydrophobicContact CG-CG 4.43Å; L258-Q262 WeakPolarHBondContact O-CG 3.35Å; L258-Q262 PolarHBondContact O-N 2.9Å
259	K	88	Confident	85.3	Confident	146 Å²	146	79.2 Å²	79.2	64%	0.635	38%	0.382	S	S	*	.	H	α-helix	trans	-57.4	-43	178	-78	-175.2	177.8	-167.2	0	112.4	S255 Q262	S255-K259 WeakPolarHBondContact O-CB 3.3Å; S255-K259 WeakPolarHBondContact O-CG 3.42Å; S255-K259 PolarHBondContact O-N 3.26Å; K259-Q262 PolarHBondContact O-N 3.4Å
260	R	86.1	Confident	85.2	Confident	106 Å²	106	81.2 Å²	81.2	40%	0.4	39%	0.389	S	S	.	.	H	α-helix	trans	-65	-41	174.9	174.7	172.5	52.7	176.7	-3.6	111.5	S256 D257 L258 Q262 R263	S256-R260 WeakPolarHBondContact O-CB 3.45Å; S256-R260 PolarHBondContact O-N 3.43Å; D257-R260 PolarHBondContact O-N 3.35Å; D257-R260 IonicContact OD1-CZ 3.85Å; D257-R260 IonicContact OD1-NH2 2.76Å; D257-R260 PolarHBondContact OD1-NH2 3.21Å; L258-R260 VanDerWaalsContact C-N 3.31Å; L258-R260 PolarHBondContact O-N 3.02Å; R260-Q262 VanDerWaalsContact C-N 3.33Å; R260-Q262 PolarHBondContact O-N 2.84Å; R260-R263 WeakPolarHBondContact O-CB 3.47Å; R260-R263 PolarHBondContact O-N 3.21Å
261	H	87.5	Confident	85	Confident	17 Å²	17	79 Å²	79	8%	0.079	38%	0.378	C	S	.	.	H	α-helix	trans	-63.8	-37.5	177.3	171.4	65.5	0	0	0	112.6	C248 F252 D257 L258 R263 I264 H265	C248-H261 PolarHBondContact SG-NE2 3.41Å; F252-H261 HydrophobicContact CE1-CB 3.82Å; F252-H261 HydrophobicContact CE2-CB 3.95Å; F252-H261 AromaticContact CE2-CD2 3.46Å; F252-H261 VanDerWaalsContact CE2-CD2 3.46Å; F252-H261 WeakPolarHBondContact CE2-CD2 3.47Å; F252-H261 AromaticContact CE2-CG 3.7Å; F252-H261 HydrophobicContact CZ-CB 3.38Å; F252-H261 AromaticContact CZ-CD2 3.41Å; F252-H261 VanDerWaalsContact CZ-CD2 3.41Å; F252-H261 WeakPolarHBondContact CZ-CD2 3.23Å; F252-H261 AromaticContact CZ-CG 3.17Å; F252-H261 AromaticContact CZ-ND1 3.74Å; D257-H261 VanDerWaalsContact O-CB 3.31Å; D257-H261 WeakPolarHBondContact O-CB 3.45Å; D257-H261 PolarHBondContact O-N 2.97Å; L258-H261 CarbonylContact O-C 3.59Å; L258-H261 WeakPolarHBondContact O-CA 3.33Å; L258-H261 WeakPolarHBondContact O-CB 3.42Å; L258-H261 PolarHBondContact O-N 3.1Å; H261-R263 PolarHBondContact O-N 3.29Å; H261-I264 VanDerWaalsContact O-CB 3.27Å; H261-I264 WeakPolarHBondContact O-CB 3.34Å; H261-I264 WeakPolarHBondContact O-CG1 3.38Å; H261-I264 PolarHBondContact O-N 3.49Å; H261-H265 AromaticContact CD2-NE2 3.86Å; H261-H265 AromaticContact CE1-NE2 3.6Å; H261-H265 AromaticContact NE2-CD2 3.97Å; H261-H265 AromaticContact NE2-CE1 3.99Å; H261-H265 AromaticContact NE2-NE2 3.09Å; H261-H265 PolarHBondContact NE2-NE2 3.28Å
262	Q	87.9	Confident	84.8	Confident	71 Å²	71	81.3 Å²	81.3	33%	0.332	39%	0.387	S	S	.	.	H	α-helix	trans	-60.9	-25.5	179.2	-73.8	175.1	-60.9	0	0	113.3	L258 K259 R260 I264 H265 S266	L258-Q262 HydrophobicContact CD1-CG 4.05Å; L258-Q262 HydrophobicContact CG-CG 4.43Å; L258-Q262 WeakPolarHBondContact O-CG 3.35Å; L258-Q262 PolarHBondContact O-N 2.9Å; K259-Q262 PolarHBondContact O-N 3.4Å; R260-Q262 VanDerWaalsContact C-N 3.33Å; R260-Q262 PolarHBondContact O-N 2.84Å; Q262-I264 PolarHBondContact O-N 3.06Å; Q262-I264 VanDerWaalsContact O-N 3.16Å; Q262-H265 PolarHBondContact O-N 3.35Å; Q262-S266 PolarHBondContact O-N 3.43Å; Q262-S266 VanDerWaalsContact O-N 3.14Å; Q262-S266 PolarHBondContact O-OG 2.84Å
263	R	86.4	Confident	84.6	Confident	64 Å²	64	79.7 Å²	79.7	24%	0.242	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-17.9	173.8	-64	180	-176.5	172.6	-5.1	114.3	R260 H261 H265 S266 E268 Y271 P281	R260-R263 WeakPolarHBondContact O-CB 3.47Å; R260-R263 PolarHBondContact O-N 3.21Å; H261-R263 PolarHBondContact O-N 3.29Å; R263-H265 VanDerWaalsContact C-N 3.29Å; R263-S266 WeakPolarHBondContact CA-OG 3.43Å; R263-E268 HydrophobicContact CG-CB 4.45Å; R263-Y271 PolarHBondContact NH1-OH 3.2Å; R263-P281 HydrophobicContact CB-CB 3.98Å; R263-P281 VanDerWaalsContact CD-O 3.31Å; R263-P281 WeakPolarHBondContact CD-O 3.4Å; R263-P281 PolarHBondContact NH1-O 3.25Å
264	I	82.8	Confident	84.3	Confident	109 Å²	109	86 Å²	86	56%	0.559	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-33	173.1	-58.2	176.8	0	0	0	110.1	H261 Q262	H261-I264 VanDerWaalsContact O-CB 3.27Å; H261-I264 WeakPolarHBondContact O-CB 3.34Å; H261-I264 WeakPolarHBondContact O-CG1 3.38Å; H261-I264 PolarHBondContact O-N 3.49Å; Q262-I264 PolarHBondContact O-N 3.06Å; Q262-I264 VanDerWaalsContact O-N 3.16Å
265	H	84.9	Confident	83.8	Confident	69 Å²	69	89.5 Å²	89.5	32%	0.319	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-31	-178.7	-55	-60.2	0	0	0	112.4	E247 H261 Q262 R263 E267	E247-H265 WeakPolarHBondContact OE2-CB 3.36Å; E247-H265 IonicContact OE2-CD2 3.72Å; E247-H265 PolarHBondContact OE2-CD2 2.99Å; E247-H265 IonicContact OE2-CG 3.98Å; E247-H265 IonicContact OE2-NE2 2.77Å; H261-H265 AromaticContact CD2-NE2 3.86Å; H261-H265 AromaticContact CE1-NE2 3.6Å; H261-H265 AromaticContact NE2-CD2 3.97Å; H261-H265 AromaticContact NE2-CE1 3.99Å; H261-H265 AromaticContact NE2-NE2 3.09Å; H261-H265 PolarHBondContact NE2-NE2 3.28Å; Q262-H265 PolarHBondContact O-N 3.35Å; R263-H265 VanDerWaalsContact C-N 3.29Å; H265-E267 VanDerWaalsContact C-N 3.35Å
266	S	79.5	Confident	83.5	Confident	58 Å²	58	89.6 Å²	89.6	41%	0.406	43%	0.431	S	S	.	.	S	Bend	trans	-88.9	6.1	-178.7	65	0	0	0	0	114.8	Q262 R263 E268	Q262-S266 PolarHBondContact O-N 3.43Å; Q262-S266 VanDerWaalsContact O-N 3.14Å; Q262-S266 PolarHBondContact O-OG 2.84Å; R263-S266 WeakPolarHBondContact CA-OG 3.43Å; S266-E268 PolarHBondContact O-N 3.22Å; S266-E268 WeakPolarHBondContact OG-CG 3.42Å
267	E	71.1	Confident	83	Confident	167 Å²	167	88.5 Å²	88.5	78%	0.78	43%	0.431	S	S	*	.			trans	51.3	4.4	-171.5	-61.5	-167.7	162.1	0	0	115.9	H265 R269	H265-E267 VanDerWaalsContact C-N 3.35Å; E267-R269 WeakPolarHBondContact O-CG 3.35Å; E267-R269 PolarHBondContact O-N 3.22Å; E267-R269 VanDerWaalsContact O-N 3.11Å
268	E	79.8	Confident	82.8	Confident	113 Å²	113	92.6 Å²	92.6	53%	0.528	45%	0.447	S	S	.	.			trans	-63.1	114.7	178.5	-73.3	-177.1	-177.8	0	0	110.3	R263 S266 P270	R263-E268 HydrophobicContact CG-CB 4.45Å; S266-E268 PolarHBondContact O-N 3.22Å; S266-E268 WeakPolarHBondContact OG-CG 3.42Å; E268-P270 WeakPolarHBondContact O-CD 3.29Å
269	R	82.2	Confident	82.6	Confident	147 Å²	147	92.8 Å²	92.8	56%	0.555	45%	0.452	S	S	*	.			trans	-123.1	74	177.7	-69.4	167.8	179.4	-134.8	12.6	110.3	E267 Y271 A279 F280 P281	E267-R269 WeakPolarHBondContact O-CG 3.35Å; E267-R269 PolarHBondContact O-N 3.22Å; E267-R269 VanDerWaalsContact O-N 3.11Å; R269-Y271 PolarHBondContact O-N 3.12Å; R269-Y271 VanDerWaalsContact O-N 3.11Å; R269-A279 HydrophobicContact CB-CB 3.53Å; R269-A279 WeakPolarHBondContact CD-O 3.27Å; R269-A279 HydrophobicContact CG-CB 4.45Å; R269-A279 PolarHBondContact NH1-O 3.32Å; R269-A279 VanDerWaalsContact NH1-O 3.1Å; R269-F280 CarbonylContact C-O 3.53Å; R269-F280 WeakPolarHBondContact CA-O 3.3Å; R269-P281 HydrophobicContact CG-CG 4.38Å
270	P	85.2	Confident	82.4	Confident	74 Å²	74	87.5 Å²	87.5	48%	0.481	43%	0.429	S	S	.	.			trans	-74	-4.2	-170.1	-14.6	31	0	0	0	114.1	E268	E268-P270 WeakPolarHBondContact O-CD 3.29Å
271	Y	85.8	Confident	82.2	Confident	80 Å²	80	83.7 Å²	83.7	31%	0.314	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	115.5	-175.8	-49.7	-75.4	0	0	0	110	R263 R269 A279 F280 P281 P283	R263-Y271 PolarHBondContact NH1-OH 3.2Å; R269-Y271 PolarHBondContact O-N 3.12Å; R269-Y271 VanDerWaalsContact O-N 3.11Å; Y271-A279 CarbonylContact O-C 3.24Å; Y271-A279 WeakPolarHBondContact O-CA 3.21Å; Y271-F280 PolarHBondContact N-O 3.49Å; Y271-F280 PolarHBondContact O-N 2.86Å; Y271-P281 WeakPolarHBondContact CE2-O 3.41Å; Y271-P283 HydrophobicContact CD1-CG 3.95Å; Y271-P283 HydrophobicContact CD2-CG 4.16Å; Y271-P283 HydrophobicContact CE1-CG 3.68Å; Y271-P283 VanDerWaalsContact CE2-CD 3.45Å; Y271-P283 HydrophobicContact CE2-CG 3.85Å; Y271-P283 HydrophobicContact CG-CG 4.18Å
272	E	83.6	Confident	81.9	Confident	134 Å²	134	83 Å²	83	63%	0.626	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	146	179.9	-67.8	175.8	-178.9	0	0	110.4	K278 A279	E272-K278 WeakPolarHBondContact CA-O 3.46Å; E272-A279 HydrophobicContact CG-CB 3.91Å
273	C	83.4	Confident	81.8	Confident	6 Å²	6	82.7 Å²	82.7	4%	0.041	42%	0.419	C	S	.	.			trans	-77.1	120.2	168.3	176.4	0	0	0	0	109.4	E275 C276 G277 K278 F280 V286 H293	C273-E275 PolarHBondContact O-N 3.27Å; C273-E275 PolarHBondContact SG-N 3.45Å; C273-C276 PolarHBondContact O-N 3.07Å; C273-C276 VanDerWaalsContact SG-SG 3.65Å; C273-G277 VanDerWaalsContact O-CA 3.26Å; C273-G277 WeakPolarHBondContact O-CA 3.3Å; C273-G277 PolarHBondContact O-N 3.22Å; C273-K278 PolarHBondContact N-O 3.46Å; C273-F280 HydrophobicContact CB-CE2 4.36Å; C273-V286 HydrophobicContact CB-CG1 4.41Å; C273-H293 PolarHBondContact SG-NE2 3.49Å
274	E	79.6	Confident	81.7	Confident	199 Å²	199	83 Å²	83	93%	0.93	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-29.2	178.9	-64.4	178.3	176.9	0	0	113.1
275	E	73.9	Confident	81.7	Confident	129 Å²	129	80.8 Å²	80.8	60%	0.603	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-27.3	-177	-64.6	-174.8	-160.4	0	0	113.7	C273 H293	C273-E275 PolarHBondContact O-N 3.27Å; C273-E275 PolarHBondContact SG-N 3.45Å; E275-H293 WeakPolarHBondContact OE2-CB 3.35Å; E275-H293 IonicContact OE2-CD2 3.1Å; E275-H293 PolarHBondContact OE2-CD2 3.07Å; E275-H293 VanDerWaalsContact OE2-CD2 3.29Å; E275-H293 IonicContact OE2-CG 3.66Å; E275-H293 IonicContact OE2-ND1 3.09Å
276	C	80.3	Confident	81.7	Confident	58 Å²	58	78.6 Å²	78.6	39%	0.392	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.8	2.1	-174.1	74.3	0	0	0	0	115.6	C273 K278 H289 H293	C273-C276 PolarHBondContact O-N 3.07Å; C273-C276 VanDerWaalsContact SG-SG 3.65Å; C276-K278 PolarHBondContact O-N 2.94Å; C276-K278 VanDerWaalsContact O-N 3.12Å; C276-H289 PolarHBondContact SG-NE2 3.14Å; C276-H293 PolarHBondContact SG-CE1 3.44Å
277	G	78.5	Confident	81.8	Confident	50 Å²	50	79.6 Å²	79.6	52%	0.515	42%	0.416	S	S	.	.			trans	70.1	0.8	179.8	0	0	0	0	0	115.4	C273 A279	C273-G277 VanDerWaalsContact O-CA 3.26Å; C273-G277 WeakPolarHBondContact O-CA 3.3Å; C273-G277 PolarHBondContact O-N 3.22Å; G277-A279 PolarHBondContact O-N 2.66Å
278	K	81.8	Confident	82.4	Confident	126 Å²	126	77.8 Å²	77.8	55%	0.548	41%	0.407	S	S	.	.			trans	-65.6	127.6	179.7	-75.7	-177.3	-179.6	179.2	0	111	E272 C273 C276 F280	E272-K278 WeakPolarHBondContact CA-O 3.46Å; C273-K278 PolarHBondContact N-O 3.46Å; C276-K278 PolarHBondContact O-N 2.94Å; C276-K278 VanDerWaalsContact O-N 3.12Å; K278-F280 HydrophobicContact CB-CE2 3.64Å; K278-F280 HydrophobicContact CB-CZ 3.99Å; K278-F280 WeakPolarHBondContact O-CD2 3.33Å; K278-F280 WeakPolarHBondContact O-CE2 3.19Å
279	A	85.9	Confident	82.3	Confident	25 Å²	25	73.7 Å²	73.7	21%	0.207	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	139.3	-178.5	0	0	0	0	0	112.4	R269 Y271 E272 G277	R269-A279 HydrophobicContact CB-CB 3.53Å; R269-A279 WeakPolarHBondContact CD-O 3.27Å; R269-A279 HydrophobicContact CG-CB 4.45Å; R269-A279 PolarHBondContact NH1-O 3.32Å; R269-A279 VanDerWaalsContact NH1-O 3.1Å; Y271-A279 CarbonylContact O-C 3.24Å; Y271-A279 WeakPolarHBondContact O-CA 3.21Å; E272-A279 HydrophobicContact CG-CB 3.91Å; G277-A279 PolarHBondContact O-N 2.66Å
280	F	83.4	Confident	82.1	Confident	36 Å²	36	68.6 Å²	68.6	16%	0.158	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	152.3	-174.8	-63.3	-92.1	0	0	0	113	R269 Y271 C273 K278 S282 D285 V286 H289	R269-F280 CarbonylContact C-O 3.53Å; R269-F280 WeakPolarHBondContact CA-O 3.3Å; Y271-F280 PolarHBondContact N-O 3.49Å; Y271-F280 PolarHBondContact O-N 2.86Å; C273-F280 HydrophobicContact CB-CE2 4.36Å; K278-F280 HydrophobicContact CB-CE2 3.64Å; K278-F280 HydrophobicContact CB-CZ 3.99Å; K278-F280 WeakPolarHBondContact O-CD2 3.33Å; K278-F280 WeakPolarHBondContact O-CE2 3.19Å; F280-S282 PolarHBondContact O-N 3.2Å; F280-D285 HydrophobicContact CB-CB 4.02Å; F280-D285 HydrophobicContact CD1-CB 3.77Å; F280-D285 HydrophobicContact CG-CB 4.18Å; F280-V286 HydrophobicContact CB-CG2 3.75Å; F280-V286 HydrophobicContact CD2-CB 4.39Å; F280-V286 HydrophobicContact CD2-CG2 3.68Å; F280-V286 HydrophobicContact CG-CG2 3.97Å; F280-H289 HydrophobicContact CE1-CB 3.86Å; F280-H289 HydrophobicContact CE2-CB 3.95Å; F280-H289 AromaticContact CE2-CD2 3.43Å; F280-H289 VanDerWaalsContact CE2-CD2 3.43Å; F280-H289 WeakPolarHBondContact CE2-CD2 3.38Å; F280-H289 AromaticContact CE2-CG 3.74Å; F280-H289 HydrophobicContact CZ-CB 3.39Å; F280-H289 AromaticContact CZ-CD2 3.37Å; F280-H289 WeakPolarHBondContact CZ-CD2 3.48Å; F280-H289 AromaticContact CZ-CG 3.21Å; F280-H289 AromaticContact CZ-ND1 3.82Å
281	P	82.1	Confident	81.6	Confident	26 Å²	26	73.4 Å²	73.4	17%	0.169	39%	0.386	C	S	.	.	S	Bend	trans	-72.3	-22.3	178.1	-19.4	33.2	0	0	0	114.7	R263 R269 Y271	R263-P281 HydrophobicContact CB-CB 3.98Å; R263-P281 VanDerWaalsContact CD-O 3.31Å; R263-P281 WeakPolarHBondContact CD-O 3.4Å; R263-P281 PolarHBondContact NH1-O 3.25Å; R269-P281 HydrophobicContact CG-CG 4.38Å; Y271-P281 WeakPolarHBondContact CE2-O 3.41Å
282	S	82.8	Confident	81	Confident	2 Å²	2	74 Å²	74	1%	0.014	40%	0.398	C	S	.	.	S	Bend	trans	-141.4	152.7	-179.8	92.8	0	0	0	0	114.4	F280 S284 D285 V286	F280-S282 PolarHBondContact O-N 3.2Å; S282-S284 PolarHBondContact O-N 3.4Å; S282-D285 VanDerWaalsContact CB-OD2 3.23Å; S282-D285 WeakPolarHBondContact CB-OD2 3.43Å; S282-D285 PolarHBondContact N-OD2 3.5Å; S282-D285 WeakPolarHBondContact O-CB 3.42Å; S282-D285 PolarHBondContact O-N 3.18Å; S282-D285 VanDerWaalsContact O-N 3.13Å; S282-D285 PolarHBondContact OG-N 3.07Å; S282-D285 PolarHBondContact OG-OD2 3.41Å; S282-V286 PolarHBondContact O-N 2.83Å
283	P	84.2	Confident	80.2	Confident	64 Å²	64	69.6 Å²	69.6	42%	0.416	38%	0.378	S	S	.	.	H	α-helix	trans	-65.5	-26.5	179.4	-19	32.2	0	0	0	113.3	Y271 D285 V286 T287	Y271-P283 HydrophobicContact CD1-CG 3.95Å; Y271-P283 HydrophobicContact CD2-CG 4.16Å; Y271-P283 HydrophobicContact CE1-CG 3.68Å; Y271-P283 VanDerWaalsContact CE2-CD 3.45Å; Y271-P283 HydrophobicContact CE2-CG 3.85Å; Y271-P283 HydrophobicContact CG-CG 4.18Å; P283-D285 VanDerWaalsContact C-N 3.3Å; P283-V286 PolarHBondContact O-N 2.9Å; P283-T287 WeakPolarHBondContact O-CB 3.46Å; P283-T287 PolarHBondContact O-N 3.02Å; P283-T287 PolarHBondContact O-OG1 3.08Å
284	S	84.1	Confident	79	Confident	72 Å²	72	76.6 Å²	76.6	50%	0.503	41%	0.407	S	S	.	.	H	α-helix	trans	-66.5	-36.7	176.1	-58.1	0	0	0	0	111.2	S282 T287 Q288	S282-S284 PolarHBondContact O-N 3.4Å; S284-T287 PolarHBondContact O-N 3.28Å; S284-Q288 WeakPolarHBondContact O-CB 3.34Å; S284-Q288 PolarHBondContact O-N 3.28Å
285	D	84.1	Confident	77.9	Confident	61 Å²	61	75.3 Å²	75.3	33%	0.326	39%	0.394	S	S	.	.	H	α-helix	trans	-69.3	-41.1	177.4	-52.1	-44.1	0	0	0	110.4	F280 S282 P283 T287 Q288 H289	F280-D285 HydrophobicContact CB-CB 4.02Å; F280-D285 HydrophobicContact CD1-CB 3.77Å; F280-D285 HydrophobicContact CG-CB 4.18Å; S282-D285 VanDerWaalsContact CB-OD2 3.23Å; S282-D285 WeakPolarHBondContact CB-OD2 3.43Å; S282-D285 PolarHBondContact N-OD2 3.5Å; S282-D285 WeakPolarHBondContact O-CB 3.42Å; S282-D285 PolarHBondContact O-N 3.18Å; S282-D285 VanDerWaalsContact O-N 3.13Å; S282-D285 PolarHBondContact OG-N 3.07Å; S282-D285 PolarHBondContact OG-OD2 3.41Å; P283-D285 VanDerWaalsContact C-N 3.3Å; D285-T287 VanDerWaalsContact C-N 3.35Å; D285-T287 PolarHBondContact O-N 3.42Å; D285-Q288 PolarHBondContact O-N 3.37Å; D285-H289 VanDerWaalsContact O-CB 3.26Å; D285-H289 WeakPolarHBondContact O-CB 3.16Å; D285-H289 PolarHBondContact O-N 3.08Å
286	V	83.9	Confident	76.7	Confident	23 Å²	23	76 Å²	76	14%	0.139	40%	0.399	C	S	.	.	H	α-helix	trans	-59.4	-46	170.5	-175.4	0	0	0	0	110.8	C273 F280 S282 P283 Q288 H289 A290	C273-V286 HydrophobicContact CB-CG1 4.41Å; F280-V286 HydrophobicContact CB-CG2 3.75Å; F280-V286 HydrophobicContact CD2-CB 4.39Å; F280-V286 HydrophobicContact CD2-CG2 3.68Å; F280-V286 HydrophobicContact CG-CG2 3.97Å; S282-V286 PolarHBondContact O-N 2.83Å; P283-V286 PolarHBondContact O-N 2.9Å; V286-Q288 VanDerWaalsContact C-N 3.29Å; V286-Q288 PolarHBondContact O-N 3.16Å; V286-H289 PolarHBondContact O-N 3.08Å; V286-A290 VanDerWaalsContact O-CB 3.26Å; V286-A290 WeakPolarHBondContact O-CB 3.42Å; V286-A290 PolarHBondContact O-N 3.34Å
287	T	83.1	Confident	75.4	Confident	80 Å²	80	77.7 Å²	77.7	49%	0.491	40%	0.4	S	S	.	.	H	α-helix	trans	-64	-36.1	-179.7	-55.1	0	0	0	0	111.6	P283 S284 D285 R291	P283-T287 WeakPolarHBondContact O-CB 3.46Å; P283-T287 PolarHBondContact O-N 3.02Å; P283-T287 PolarHBondContact O-OG1 3.08Å; S284-T287 PolarHBondContact O-N 3.28Å; D285-T287 VanDerWaalsContact C-N 3.35Å; D285-T287 PolarHBondContact O-N 3.42Å; T287-R291 WeakPolarHBondContact O-CG 3.43Å
288	Q	81.9	Confident	74.3	Confident	129 Å²	129	82.1 Å²	82.1	60%	0.603	41%	0.407	S	S	*	.	H	α-helix	trans	-72	-43.2	175.9	-178	170.4	4.2	0	0	111.2	S284 D285 V286 A290 R291	S284-Q288 WeakPolarHBondContact O-CB 3.34Å; S284-Q288 PolarHBondContact O-N 3.28Å; D285-Q288 PolarHBondContact O-N 3.37Å; V286-Q288 VanDerWaalsContact C-N 3.29Å; V286-Q288 PolarHBondContact O-N 3.16Å; Q288-A290 VanDerWaalsContact C-N 3.34Å; Q288-R291 WeakPolarHBondContact O-CB 3.25Å; Q288-R291 PolarHBondContact O-N 3.42Å
289	H	79.5	Confident	73.1	Confident	27 Å²	27	77 Å²	77	13%	0.125	38%	0.384	C	S	.	.	H	α-helix	trans	-62.4	-40.5	174.8	173.5	59.6	0	0	0	111.9	C276 F280 D285 V286 R291 T292 H293	C276-H289 PolarHBondContact SG-NE2 3.14Å; F280-H289 HydrophobicContact CE1-CB 3.86Å; F280-H289 HydrophobicContact CE2-CB 3.95Å; F280-H289 AromaticContact CE2-CD2 3.43Å; F280-H289 VanDerWaalsContact CE2-CD2 3.43Å; F280-H289 WeakPolarHBondContact CE2-CD2 3.38Å; F280-H289 AromaticContact CE2-CG 3.74Å; F280-H289 HydrophobicContact CZ-CB 3.39Å; F280-H289 AromaticContact CZ-CD2 3.37Å; F280-H289 WeakPolarHBondContact CZ-CD2 3.48Å; F280-H289 AromaticContact CZ-CG 3.21Å; F280-H289 AromaticContact CZ-ND1 3.82Å; D285-H289 VanDerWaalsContact O-CB 3.26Å; D285-H289 WeakPolarHBondContact O-CB 3.16Å; D285-H289 PolarHBondContact O-N 3.08Å; V286-H289 PolarHBondContact O-N 3.08Å; H289-R291 PolarHBondContact O-N 3.02Å; H289-T292 PolarHBondContact ND1-OG1 2.74Å; H289-T292 WeakPolarHBondContact O-CA 3.48Å; H289-T292 VanDerWaalsContact O-CB 3.28Å; H289-T292 WeakPolarHBondContact O-CB 3.5Å; H289-T292 PolarHBondContact O-N 3.5Å; H289-T292 PolarHBondContact O-OG1 3.44Å; H289-H293 AromaticContact CD2-CE1 3.98Å; H289-H293 AromaticContact CD2-NE2 3.52Å; H289-H293 AromaticContact CE1-CE1 3.73Å; H289-H293 AromaticContact CE1-NE2 3.98Å; H289-H293 AromaticContact NE2-CE1 3.26Å; H289-H293 PolarHBondContact NE2-CE1 3.06Å; H289-H293 VanDerWaalsContact NE2-CE1 3.26Å; H289-H293 AromaticContact NE2-NE2 3.29Å; H289-H293 PolarHBondContact NE2-NE2 3.38Å
290	A	77	Confident	71.6	Confident	40 Å²	40	79.4 Å²	79.4	33%	0.331	40%	0.396	S	S	.	.	H	α-helix	trans	-59	-24.4	-179.9	0	0	0	0	0	112.7	V286 Q288 T292 H293	V286-A290 VanDerWaalsContact O-CB 3.26Å; V286-A290 WeakPolarHBondContact O-CB 3.42Å; V286-A290 PolarHBondContact O-N 3.34Å; Q288-A290 VanDerWaalsContact C-N 3.34Å; A290-T292 PolarHBondContact O-N 3.15Å; A290-H293 PolarHBondContact O-N 3.28Å
291	R	75.1	Confident	70.2	Confident	175 Å²	175	78.2 Å²	78.2	66%	0.66	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-16.4	173.7	-60.1	171.9	-175	-179.8	-0.7	113.5	T287 Q288 H289	T287-R291 WeakPolarHBondContact O-CG 3.43Å; Q288-R291 WeakPolarHBondContact O-CB 3.25Å; Q288-R291 PolarHBondContact O-N 3.42Å; H289-R291 PolarHBondContact O-N 3.02Å
292	T	72.3	Confident	69.1	Low	92 Å²	92	82.8 Å²	82.8	56%	0.564	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-16.1	178.8	70.1	0	0	0	0	112.3	H289 A290 K294	H289-T292 PolarHBondContact ND1-OG1 2.74Å; H289-T292 WeakPolarHBondContact O-CA 3.48Å; H289-T292 VanDerWaalsContact O-CB 3.28Å; H289-T292 WeakPolarHBondContact O-CB 3.5Å; H289-T292 PolarHBondContact O-N 3.5Å; H289-T292 PolarHBondContact O-OG1 3.44Å; A290-T292 PolarHBondContact O-N 3.15Å; T292-K294 PolarHBondContact O-N 3.4Å
293	H	67.1	Low	67.8	Low	42 Å²	42	89.1 Å²	89.1	19%	0.194	45%	0.445	C	S	.	.	S	Bend	trans	-68.6	120.9	170.2	-58.3	-52.6	0	0	0	109.6	C273 E275 C276 H289 A290 R295	C273-H293 PolarHBondContact SG-NE2 3.49Å; E275-H293 WeakPolarHBondContact OE2-CB 3.35Å; E275-H293 IonicContact OE2-CD2 3.1Å; E275-H293 PolarHBondContact OE2-CD2 3.07Å; E275-H293 VanDerWaalsContact OE2-CD2 3.29Å; E275-H293 IonicContact OE2-CG 3.66Å; E275-H293 IonicContact OE2-ND1 3.09Å; C276-H293 PolarHBondContact SG-CE1 3.44Å; H289-H293 AromaticContact CD2-CE1 3.98Å; H289-H293 AromaticContact CD2-NE2 3.52Å; H289-H293 AromaticContact CE1-CE1 3.73Å; H289-H293 AromaticContact CE1-NE2 3.98Å; H289-H293 AromaticContact NE2-CE1 3.26Å; H289-H293 PolarHBondContact NE2-CE1 3.06Å; H289-H293 VanDerWaalsContact NE2-CE1 3.26Å; H289-H293 AromaticContact NE2-NE2 3.29Å; H289-H293 PolarHBondContact NE2-NE2 3.38Å; A290-H293 PolarHBondContact O-N 3.28Å; H293-R295 PolarHBondContact O-N 3.18Å
294	K	58.9	Low	66.6	Low	153 Å²	153	89.1 Å²	89.1	67%	0.665	45%	0.446	S	S	*	.			trans	-69.4	112.5	173.3	-69.4	176.5	176.1	-178.2	0	107.4	T292 M296	T292-K294 PolarHBondContact O-N 3.4Å; K294-M296 PolarHBondContact O-N 3.19Å
295	R	55.7	Low	65.3	Low	171 Å²	171	88.5 Å²	88.5	65%	0.645	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	105	177.2	-130.4	178.6	176.7	-170.5	-3	109	H293 K297 T312	H293-R295 PolarHBondContact O-N 3.18Å; R295-K297 PolarHBondContact O-N 2.75Å; R295-T312 PolarHBondContact O-N 3.35Å; R295-T312 PolarHBondContact O-OG1 3.26Å
296	M	49.5	Very low	63.7	Low	144 Å²	144	90.7 Å²	90.7	71%	0.709	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	116.4	164.4	-70.2	-161.1	-99.8	0	0	107.6	K294	K294-M296 PolarHBondContact O-N 3.19Å
297	K	53.4	Low	61.9	Low	94 Å²	94	93.7 Å²	93.7	41%	0.409	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	119.6	175.8	-168.3	170.3	174.8	-165.4	0	107.9	R295 Y299 I310	R295-K297 PolarHBondContact O-N 2.75Å; K297-Y299 HydrophobicContact CB-CE2 3.83Å; K297-Y299 HydrophobicContact CD-CE2 4Å; K297-Y299 WeakPolarHBondContact CD-OH 3.43Å; K297-Y299 HydrophobicContact CG-CD2 4.42Å; K297-Y299 HydrophobicContact CG-CE2 3.76Å; K297-Y299 WeakPolarHBondContact O-CD2 3.5Å; K297-I310 PolarHBondContact N-O 2.78Å; K297-I310 VanDerWaalsContact N-O 3.12Å; K297-I310 PolarHBondContact O-N 3.46Å
298	Q	53.8	Low	60.3	Low	142 Å²	142	92.5 Å²	92.5	66%	0.664	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	132.6	174.9	-75.7	175.1	-18.5	0	0	109.4	F308 T309	Q298-F308 WeakPolarHBondContact CA-O 3.43Å; Q298-T309 HydrophobicContact CG-CG2 3.49Å; Q298-T309 VanDerWaalsContact CG-CG2 3.49Å
299	Y	58.1	Low	58.8	Low	18 Å²	18	90 Å²	90	7%	0.071	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.8	173.7	-70	-95.1	0	0	0	107.8	K297 C307 F308 I310	K297-Y299 HydrophobicContact CB-CE2 3.83Å; K297-Y299 HydrophobicContact CD-CE2 4Å; K297-Y299 WeakPolarHBondContact CD-OH 3.43Å; K297-Y299 HydrophobicContact CG-CD2 4.42Å; K297-Y299 HydrophobicContact CG-CE2 3.76Å; K297-Y299 WeakPolarHBondContact O-CD2 3.5Å; Y299-C307 CarbonylContact O-C 3.29Å; Y299-C307 WeakPolarHBondContact O-CA 3.42Å; Y299-F308 HydrophobicContact CG-CZ 4.32Å; Y299-F308 PolarHBondContact N-O 3.16Å; Y299-F308 VanDerWaalsContact O-CD1 3.28Å; Y299-F308 WeakPolarHBondContact O-CD1 3.38Å; Y299-F308 WeakPolarHBondContact O-CE1 3.36Å; Y299-F308 PolarHBondContact O-N 3.35Å; Y299-I310 HydrophobicContact CD2-CB 4.19Å; Y299-I310 HydrophobicContact CD2-CD1 3.55Å; Y299-I310 HydrophobicContact CD2-CG1 3.72Å; Y299-I310 HydrophobicContact CE2-CB 3.99Å; Y299-I310 HydrophobicContact CE2-CD1 3.6Å; Y299-I310 HydrophobicContact CE2-CG1 3.93Å; Y299-I310 HydrophobicContact CG-CD1 4.25Å
300	T	53.4	Low	57.6	Low	76 Å²	76	90.7 Å²	90.7	47%	0.466	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.3	169.5	42	0	0	0	0	108.5	E306 C307	T300-E306 WeakPolarHBondContact CA-O 3.38Å; T300-C307 HydrophobicContact CG2-CB 4.44Å; T300-C307 WeakPolarHBondContact CG2-SG 3.48Å
301	C	55	Low	56.4	Low	11 Å²	11	94.1 Å²	94.1	7%	0.074	48%	0.475	C	S	.	.			trans	-77.3	126.5	168.2	176.9	0	0	0	0	109.3	E303 C304 G305 E306 F336	C301-E303 VanDerWaalsContact C-N 3.26Å; C301-E303 PolarHBondContact O-N 3.1Å; C301-C304 WeakPolarHBondContact CB-SG 3.46Å; C301-G305 VanDerWaalsContact O-CA 3.29Å; C301-G305 WeakPolarHBondContact O-CA 3.02Å; C301-G305 PolarHBondContact O-N 3.05Å; C301-E306 PolarHBondContact N-O 3.36Å; C301-F336 HydrophobicContact CB-CE1 4.05Å
302	D	59	Low	55.2	Low	122 Å²	122	86 Å²	86	65%	0.652	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-18.2	-175.8	-63.3	-37.7	0	0	0	112.6	K325	D302-K325 IonicContact OD2-NZ 3.68Å; D302-K325 PolarHBondContact OD2-NZ 3.39Å
303	E	55.4	Low	54.2	Low	136 Å²	136	84.8 Å²	84.8	64%	0.636	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-39.5	176.3	-71.7	-158.9	172	0	0	114.2	C301 K334	C301-E303 VanDerWaalsContact C-N 3.26Å; C301-E303 PolarHBondContact O-N 3.1Å; E303-K334 IonicContact OE1-NZ 3.1Å; E303-K334 PolarHBondContact OE1-NZ 2.99Å; E303-K334 WeakPolarHBondContact OE2-CD 3.28Å; E303-K334 IonicContact OE2-NZ 3.18Å; E303-K334 PolarHBondContact OE2-NZ 2.87Å
304	C	57.8	Low	53.2	Low	64 Å²	64	90.2 Å²	90.2	43%	0.432	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-5.9	-176.2	74	0	0	0	0	114.3	C301 E306	C301-C304 WeakPolarHBondContact CB-SG 3.46Å; C304-E306 PolarHBondContact O-N 2.78Å
305	G	56.3	Low	52.4	Low	58 Å²	58	87.3 Å²	87.3	60%	0.598	46%	0.459	S	S	*	.			trans	70.8	-4.3	176.2	0	0	0	0	0	115.4	C301	C301-G305 VanDerWaalsContact O-CA 3.29Å; C301-G305 WeakPolarHBondContact O-CA 3.02Å; C301-G305 PolarHBondContact O-N 3.05Å
306	E	50.9	Low	52	Low	108 Å²	108	82.6 Å²	82.6	51%	0.505	45%	0.447	S	S	.	.			trans	-78.6	141.1	-178.7	-70.4	-145.8	150.5	0	0	112.8	T300 C301 C304 R331	T300-E306 WeakPolarHBondContact CA-O 3.38Å; C301-E306 PolarHBondContact N-O 3.36Å; C304-E306 PolarHBondContact O-N 2.78Å; E306-R331 IonicContact OE1-NH1 2.86Å; E306-R331 IonicContact OE2-NH1 2.77Å; E306-R331 PolarHBondContact OE2-NH1 2.77Å; E306-R331 VanDerWaalsContact OE2-NH1 3.09Å
307	C	46.2	Very low	52	Low	85 Å²	85	78.7 Å²	78.7	57%	0.574	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	126.3	174	-62.8	0	0	0	0	109.8	Y299 T300	Y299-C307 CarbonylContact O-C 3.29Å; Y299-C307 WeakPolarHBondContact O-CA 3.42Å; T300-C307 HydrophobicContact CG2-CB 4.44Å; T300-C307 WeakPolarHBondContact CG2-SG 3.48Å
308	F	50.2	Low	51.4	Low	55 Å²	55	83.5 Å²	83.5	24%	0.241	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	147.5	167.6	68.5	-71.6	0	0	0	110.9	Q298 Y299 I310 F336	Q298-F308 WeakPolarHBondContact CA-O 3.43Å; Y299-F308 HydrophobicContact CG-CZ 4.32Å; Y299-F308 PolarHBondContact N-O 3.16Å; Y299-F308 VanDerWaalsContact O-CD1 3.28Å; Y299-F308 WeakPolarHBondContact O-CD1 3.38Å; Y299-F308 WeakPolarHBondContact O-CE1 3.36Å; Y299-F308 PolarHBondContact O-N 3.35Å; F308-I310 HydrophobicContact CD2-CD1 4.38Å; F308-I310 HydrophobicContact CD2-CG1 3.88Å; F308-I310 HydrophobicContact CE2-CD1 3.51Å; F308-I310 HydrophobicContact CE2-CG1 3.5Å; F308-I310 HydrophobicContact CZ-CD1 4.09Å; F308-I310 HydrophobicContact CZ-CG1 4.42Å; F308-F336 HydrophobicContact CD1-CZ 4.29Å; F308-F336 AromaticContact CE1-CE1 3.44Å; F308-F336 HydrophobicContact CE1-CE1 3.44Å; F308-F336 VanDerWaalsContact CE1-CE1 3.44Å; F308-F336 HydrophobicContact CE1-CE2 4.12Å; F308-F336 AromaticContact CE1-CZ 3.07Å; F308-F336 HydrophobicContact CE1-CZ 3.07Å; F308-F336 HydrophobicContact CE2-CZ 4.25Å; F308-F336 AromaticContact CZ-CE1 3.72Å; F308-F336 HydrophobicContact CZ-CE1 3.72Å; F308-F336 AromaticContact CZ-CE2 3.64Å; F308-F336 HydrophobicContact CZ-CE2 3.64Å; F308-F336 AromaticContact CZ-CZ 3.04Å; F308-F336 HydrophobicContact CZ-CZ 3.04Å
309	T	49.6	Very low	50.9	Low	76 Å²	76	82.4 Å²	82.4	47%	0.466	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	117.1	-176.2	47.1	0	0	0	0	110.7	Q298	Q298-T309 HydrophobicContact CG-CG2 3.49Å; Q298-T309 VanDerWaalsContact CG-CG2 3.49Å
310	I	55.3	Low	50.6	Low	43 Å²	43	83.5 Å²	83.5	22%	0.221	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	128	172.7	-53.1	179.4	0	0	0	109.3	K297 Y299 F308 T312 P326	K297-I310 PolarHBondContact N-O 2.78Å; K297-I310 VanDerWaalsContact N-O 3.12Å; K297-I310 PolarHBondContact O-N 3.46Å; Y299-I310 HydrophobicContact CD2-CB 4.19Å; Y299-I310 HydrophobicContact CD2-CD1 3.55Å; Y299-I310 HydrophobicContact CD2-CG1 3.72Å; Y299-I310 HydrophobicContact CE2-CB 3.99Å; Y299-I310 HydrophobicContact CE2-CD1 3.6Å; Y299-I310 HydrophobicContact CE2-CG1 3.93Å; Y299-I310 HydrophobicContact CG-CD1 4.25Å; F308-I310 HydrophobicContact CD2-CD1 4.38Å; F308-I310 HydrophobicContact CD2-CG1 3.88Å; F308-I310 HydrophobicContact CE2-CD1 3.51Å; F308-I310 HydrophobicContact CE2-CG1 3.5Å; F308-I310 HydrophobicContact CZ-CD1 4.09Å; F308-I310 HydrophobicContact CZ-CG1 4.42Å; I310-T312 HydrophobicContact CB-CG2 4.4Å; I310-T312 HydrophobicContact CG2-CG2 4.02Å; I310-T312 PolarHBondContact O-N 3.39Å; I310-P326 HydrophobicContact CD1-CB 4.19Å; I310-P326 HydrophobicContact CD1-CG 3.19Å
311	Q	51.9	Low	50.4	Low	112 Å²	112	90.8 Å²	90.8	52%	0.523	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	91.7	174	-170.5	-179.7	-30.6	0	0	109.6
312	T	49.8	Very low	50	Low	5 Å²	5	97.2 Å²	97.2	3%	0.031	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	115.7	-178.9	58.7	0	0	0	0	111.5	R295 I310 I320	R295-T312 PolarHBondContact O-N 3.35Å; R295-T312 PolarHBondContact O-OG1 3.26Å; I310-T312 HydrophobicContact CB-CG2 4.4Å; I310-T312 HydrophobicContact CG2-CG2 4.02Å; I310-T312 PolarHBondContact O-N 3.39Å; T312-I320 HydrophobicContact CG2-CD1 3.7Å
313	T	50.5	Low	49.5	Very low	66 Å²	66	97.9 Å²	97.9	41%	0.405	50%	0.495	S	S	.	.			trans	-79.4	160.3	164.1	60.5	0	0	0	0	109.8	S315 N316 L317	T313-S315 PolarHBondContact O-N 3.24Å; T313-S315 VanDerWaalsContact O-N 3.15Å; T313-N316 PolarHBondContact O-N 2.79Å; T313-N316 PolarHBondContact OG1-ND2 2.91Å; T313-L317 PolarHBondContact O-N 2.81Å; T313-L317 VanDerWaalsContact O-N 3.16Å
314	F	47.5	Very low	49.5	Very low	156 Å²	156	93.2 Å²	93.2	68%	0.684	48%	0.483	S	S	*	.	H	α-helix	trans	-56.6	-31.4	-179.5	-172.5	-96.9	0	0	0	113.3	L317	F314-L317 PolarHBondContact O-N 3.43Å
315	S	41.8	Very low	49.5	Very low	91 Å²	91	95.1 Å²	95.1	64%	0.636	48%	0.484	S	S	*	.	H	α-helix	trans	-64.3	-39.9	174	-50.5	0	0	0	0	112.3	T313 R318 K319	T313-S315 PolarHBondContact O-N 3.24Å; T313-S315 VanDerWaalsContact O-N 3.15Å; S315-R318 PolarHBondContact O-N 3.17Å; S315-K319 PolarHBondContact O-N 3.06Å
316	N	46.7	Very low	49.5	Very low	73 Å²	73	94.1 Å²	94.1	39%	0.39	47%	0.467	S	S	.	.	H	α-helix	trans	-73.4	-31.5	179.7	-67.3	-8.4	0	0	0	112.2	T313 R318 K319 I320	T313-N316 PolarHBondContact O-N 2.79Å; T313-N316 PolarHBondContact OG1-ND2 2.91Å; N316-R318 VanDerWaalsContact C-N 3.28Å; N316-R318 PolarHBondContact O-N 2.83Å; N316-K319 PolarHBondContact O-N 2.85Å; N316-K319 VanDerWaalsContact O-N 3.17Å; N316-I320 WeakPolarHBondContact O-CB 3.47Å; N316-I320 VanDerWaalsContact O-CG1 3.26Å; N316-I320 WeakPolarHBondContact O-CG1 3.33Å; N316-I320 PolarHBondContact O-N 3.5Å
317	L	48.8	Very low	49.6	Very low	61 Å²	61	93 Å²	93	32%	0.319	47%	0.472	S	S	.	.	H	α-helix	trans	-62	-32.8	174.3	-93.5	153.7	0	0	0	113.2	T313 F314 R321	T313-L317 PolarHBondContact O-N 2.81Å; T313-L317 VanDerWaalsContact O-N 3.16Å; F314-L317 PolarHBondContact O-N 3.43Å; L317-R321 VanDerWaalsContact O-CB 3.31Å; L317-R321 WeakPolarHBondContact O-CB 3.2Å; L317-R321 PolarHBondContact O-N 3.19Å
318	R	41.4	Very low	50	Low	195 Å²	195	93.5 Å²	93.5	74%	0.736	47%	0.465	S	S	*	.	H	α-helix	trans	-73.1	-35.4	176.2	-151.5	179	-172.4	-167.7	0.4	111.3	S315 N316 L322	S315-R318 PolarHBondContact O-N 3.17Å; N316-R318 VanDerWaalsContact C-N 3.28Å; N316-R318 PolarHBondContact O-N 2.83Å; R318-L322 WeakPolarHBondContact O-CD1 3.46Å; R318-L322 WeakPolarHBondContact O-CG 3.25Å; R318-L322 PolarHBondContact O-N 3.46Å
319	K	42.7	Very low	50	Low	119 Å²	119	91.2 Å²	91.2	52%	0.517	46%	0.456	S	S	.	.	H	α-helix	trans	-70.9	-48.9	176.8	-133.4	-171.1	175.5	-165.6	0	112.1	S315 N316 R321 L322 E323	S315-K319 PolarHBondContact O-N 3.06Å; N316-K319 PolarHBondContact O-N 2.85Å; N316-K319 VanDerWaalsContact O-N 3.17Å; K319-R321 PolarHBondContact O-N 2.86Å; K319-L322 CarbonylContact O-C 3.34Å; K319-L322 PolarHBondContact O-N 3.09Å; K319-E323 VanDerWaalsContact CE-OE1 3.25Å; K319-E323 WeakPolarHBondContact CE-OE1 3.47Å; K319-E323 VanDerWaalsContact CE-OE2 3.27Å; K319-E323 WeakPolarHBondContact CE-OE2 3.3Å; K319-E323 WeakPolarHBondContact CG-OE2 2.98Å; K319-E323 IonicContact NZ-OE2 2.87Å; K319-E323 WeakPolarHBondContact O-CB 3.43Å; K319-E323 PolarHBondContact O-N 3.06Å
320	I	53.4	Low	50.1	Low	41 Å²	41	96.1 Å²	96.1	21%	0.21	47%	0.474	C	S	.	.	H	α-helix	trans	-58.9	-33.1	174.9	-66.3	163.2	0	0	0	111.9	T312 N316 L322 G324	T312-I320 HydrophobicContact CG2-CD1 3.7Å; N316-I320 WeakPolarHBondContact O-CB 3.47Å; N316-I320 VanDerWaalsContact O-CG1 3.26Å; N316-I320 WeakPolarHBondContact O-CG1 3.33Å; N316-I320 PolarHBondContact O-N 3.5Å; I320-L322 VanDerWaalsContact C-N 3.32Å; I320-G324 CarbonylContact O-C 3.56Å; I320-G324 WeakPolarHBondContact O-CA 3.42Å; I320-G324 PolarHBondContact O-N 3.27Å; I320-G324 VanDerWaalsContact O-N 3.07Å
321	R	47.8	Very low	49.9	Very low	229 Å²	229	103.5 Å²	103.5	86%	0.864	50%	0.499	S	S	*	.	H	α-helix	trans	-75.8	-19.7	177.6	-160.4	177.5	-166.3	176.7	4.7	113.5	L317 K319	L317-R321 VanDerWaalsContact O-CB 3.31Å; L317-R321 WeakPolarHBondContact O-CB 3.2Å; L317-R321 PolarHBondContact O-N 3.19Å; K319-R321 PolarHBondContact O-N 2.86Å
322	L	47	Very low	50.1	Low	146 Å²	146	100.3 Å²	100.3	76%	0.764	49%	0.489	S	S	*	.	H	α-helix	trans	-99.7	-33.5	178.8	-74.2	165.8	0	0	0	112.2	R318 K319 I320	R318-L322 WeakPolarHBondContact O-CD1 3.46Å; R318-L322 WeakPolarHBondContact O-CG 3.25Å; R318-L322 PolarHBondContact O-N 3.46Å; K319-L322 CarbonylContact O-C 3.34Å; K319-L322 PolarHBondContact O-N 3.09Å; I320-L322 VanDerWaalsContact C-N 3.32Å
323	E	49	Very low	50.4	Low	137 Å²	137	109.8 Å²	109.8	64%	0.64	52%	0.524	S	S	*	.	H	α-helix	trans	-109.1	-9.6	-170.7	-65.1	173.7	-178.2	0	0	113.7	K319	K319-E323 VanDerWaalsContact CE-OE1 3.25Å; K319-E323 WeakPolarHBondContact CE-OE1 3.47Å; K319-E323 VanDerWaalsContact CE-OE2 3.27Å; K319-E323 WeakPolarHBondContact CE-OE2 3.3Å; K319-E323 WeakPolarHBondContact CG-OE2 2.98Å; K319-E323 IonicContact NZ-OE2 2.87Å; K319-E323 WeakPolarHBondContact O-CB 3.43Å; K319-E323 PolarHBondContact O-N 3.06Å
324	G	54.8	Low	50.6	Low	38 Å²	38	111.7 Å²	111.7	39%	0.392	53%	0.526	S	S	.	.			trans	93.1	-175.3	-177.8	0	0	0	0	0	114.1	I320	I320-G324 CarbonylContact O-C 3.56Å; I320-G324 WeakPolarHBondContact O-CA 3.42Å; I320-G324 PolarHBondContact O-N 3.27Å; I320-G324 VanDerWaalsContact O-N 3.07Å
325	K	57.1	Low	50.8	Low	103 Å²	103	110.5 Å²	110.5	45%	0.448	53%	0.527	S	S	.	.	S	Bend	trans	-52.7	157.2	174.5	-72.8	-175.6	-169.5	172.8	0	109.7	D302 S327 F336	D302-K325 IonicContact OD2-NZ 3.68Å; D302-K325 PolarHBondContact OD2-NZ 3.39Å; K325-S327 PolarHBondContact O-N 2.71Å; K325-F336 HydrophobicContact CB-CB 4.01Å; K325-F336 HydrophobicContact CD-CB 3.77Å; K325-F336 HydrophobicContact CD-CG 4.5Å; K325-F336 PolarHBondContact NZ-OXT 3.34Å
326	P	57	Low	51.4	Low	38 Å²	38	109 Å²	109	25%	0.247	51%	0.509	C	S	.	.			trans	-48.2	136.3	167.6	-12.8	20.7	0	0	0	108.7	I310 E328 F336	I310-P326 HydrophobicContact CD1-CB 4.19Å; I310-P326 HydrophobicContact CD1-CG 3.19Å; P326-E328 VanDerWaalsContact C-N 3.27Å; P326-E328 PolarHBondContact O-N 3.09Å; P326-F336 HydrophobicContact CB-CD2 4.44Å; P326-F336 WeakPolarHBondContact O-CB 3.29Å; P326-F336 WeakPolarHBondContact O-CD2 3.21Å
327	S	54.3	Low	51.7	Low	85 Å²	85	110.8 Å²	110.8	59%	0.594	52%	0.515	S	S	*	.	S	Bend	trans	-79.9	-5.1	-169.4	57.5	0	0	0	0	113.5	K325 D335	K325-S327 PolarHBondContact O-N 2.71Å; S327-D335 WeakPolarHBondContact O-CA 3.24Å; S327-D335 WeakPolarHBondContact O-CB 3.31Å
328	E	53.3	Low	51.8	Low	94 Å²	94	113.4 Å²	113.4	44%	0.439	53%	0.525	S	S	.	.	S	Bend	trans	-153.8	129.1	-172.1	-157.7	179.7	163.8	0	0	112.4	P326 E330 R333 K334 F336	P326-E328 VanDerWaalsContact C-N 3.27Å; P326-E328 PolarHBondContact O-N 3.09Å; E328-E330 PolarHBondContact O-N 3.23Å; E328-R333 HydrophobicContact CG-CB 4.45Å; E328-R333 VanDerWaalsContact OE1-CA 3.27Å; E328-R333 WeakPolarHBondContact OE1-CA 3.3Å; E328-R333 WeakPolarHBondContact OE1-CB 3.17Å; E328-R333 WeakPolarHBondContact OE1-CG 3.42Å; E328-K334 WeakPolarHBondContact CA-O 3.48Å; E328-F336 VanDerWaalsContact C-CE2 3.49Å; E328-F336 WeakPolarHBondContact O-CE2 3.41Å
329	C	49.7	Very low	52.4	Low	7 Å²	7	108.8 Å²	108.8	5%	0.047	51%	0.514	C	S	.	.			trans	-69.1	116.9	173.4	164.3	0	0	0	0	110.4	R331 C332 R333 K334 F336	C329-R331 PolarHBondContact O-N 3.4Å; C329-C332 HydrophobicContact CB-CB 4.25Å; C329-C332 WeakPolarHBondContact CB-SG 3.23Å; C329-C332 PolarHBondContact O-N 3.29Å; C329-C332 WeakPolarHBondContact SG-CB 3.23Å; C329-C332 PolarHBondContact SG-N 3.45Å; C329-C332 CovalentContact SG-SG 2.06Å; C329-C332 PolarHBondContact SG-SG 3.28Å; C329-R333 WeakPolarHBondContact O-CA 3.33Å; C329-R333 PolarHBondContact O-N 3.44Å; C329-K334 VanDerWaalsContact CB-O 3.3Å; C329-K334 WeakPolarHBondContact CB-O 3.4Å; C329-K334 PolarHBondContact N-O 3Å; C329-F336 HydrophobicContact CB-CE2 4.08Å; C329-F336 HydrophobicContact CB-CZ 4.03Å
330	E	52.4	Low	53	Low	180 Å²	180	108.2 Å²	108.2	84%	0.841	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-23.7	-174.7	-72.4	-176.4	166.1	0	0	114.5	E328	E328-E330 PolarHBondContact O-N 3.23Å
331	R	50.8	Low	53	Low	197 Å²	197	112.4 Å²	112.4	74%	0.743	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-38.8	179.7	-168.3	172.4	-174.7	172.2	1	113.7	E306 C329	E306-R331 IonicContact OE1-NH1 2.86Å; E306-R331 IonicContact OE2-NH1 2.77Å; E306-R331 PolarHBondContact OE2-NH1 2.77Å; E306-R331 VanDerWaalsContact OE2-NH1 3.09Å; C329-R331 PolarHBondContact O-N 3.4Å
332	C	56.5	Low	53.3	Low	46 Å²	46	104.7 Å²	104.7	31%	0.311	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-6.7	-172.7	59.9	0	0	0	0	113.9	C329 K334	C329-C332 HydrophobicContact CB-CB 4.25Å; C329-C332 WeakPolarHBondContact CB-SG 3.23Å; C329-C332 PolarHBondContact O-N 3.29Å; C329-C332 WeakPolarHBondContact SG-CB 3.23Å; C329-C332 PolarHBondContact SG-N 3.45Å; C329-C332 CovalentContact SG-SG 2.06Å; C329-C332 PolarHBondContact SG-SG 3.28Å; C332-K334 PolarHBondContact O-N 3.48Å; C332-K334 VanDerWaalsContact O-N 3.12Å
333	R	56.3	Low	53.8	Low	203 Å²	203	101.7 Å²	101.7	77%	0.766	49%	0.492	S	S	*	.			trans	49.6	33.2	179.9	-68.9	-160.7	-172.1	170.5	1.9	114.1	E328 C329	E328-R333 HydrophobicContact CG-CB 4.45Å; E328-R333 VanDerWaalsContact OE1-CA 3.27Å; E328-R333 WeakPolarHBondContact OE1-CA 3.3Å; E328-R333 WeakPolarHBondContact OE1-CB 3.17Å; E328-R333 WeakPolarHBondContact OE1-CG 3.42Å; C329-R333 WeakPolarHBondContact O-CA 3.33Å; C329-R333 PolarHBondContact O-N 3.44Å
334	K	53.9	Low	54.1	Low	106 Å²	106	99 Å²	99	46%	0.461	48%	0.481	S	S	.	.			trans	-120.2	149.6	179.9	-76.5	-174	179.4	-171.6	0	110.6	E303 E328 C329 C332	E303-K334 IonicContact OE1-NZ 3.1Å; E303-K334 PolarHBondContact OE1-NZ 2.99Å; E303-K334 WeakPolarHBondContact OE2-CD 3.28Å; E303-K334 IonicContact OE2-NZ 3.18Å; E303-K334 PolarHBondContact OE2-NZ 2.87Å; E328-K334 WeakPolarHBondContact CA-O 3.48Å; C329-K334 VanDerWaalsContact CB-O 3.3Å; C329-K334 WeakPolarHBondContact CB-O 3.4Å; C329-K334 PolarHBondContact N-O 3Å; C332-K334 PolarHBondContact O-N 3.48Å; C332-K334 VanDerWaalsContact O-N 3.12Å
335	D	53.3	Low	54.1	Low	132 Å²	132	104.1 Å²	104.1	71%	0.706	49%	0.488	S	S	*	.			trans	-72.1	150.5	-177.3	-54.5	1.3	0	0	0	112.4	S327	S327-D335 WeakPolarHBondContact O-CA 3.24Å; S327-D335 WeakPolarHBondContact O-CB 3.31Å
336	F	54.3	Low	53.8	Low	58 Å²	58	104.2 Å²	104.2	25%	0.254	49%	0.492	S	S	.	.			trans	-86.7	0	-172.2	-88.4	-80.5	0	0	0	116.7	C301 F308 K325 P326 E328 C329	C301-F336 HydrophobicContact CB-CE1 4.05Å; F308-F336 HydrophobicContact CD1-CZ 4.29Å; F308-F336 AromaticContact CE1-CE1 3.44Å; F308-F336 HydrophobicContact CE1-CE1 3.44Å; F308-F336 VanDerWaalsContact CE1-CE1 3.44Å; F308-F336 HydrophobicContact CE1-CE2 4.12Å; F308-F336 AromaticContact CE1-CZ 3.07Å; F308-F336 HydrophobicContact CE1-CZ 3.07Å; F308-F336 HydrophobicContact CE2-CZ 4.25Å; F308-F336 AromaticContact CZ-CE1 3.72Å; F308-F336 HydrophobicContact CZ-CE1 3.72Å; F308-F336 AromaticContact CZ-CE2 3.64Å; F308-F336 HydrophobicContact CZ-CE2 3.64Å; F308-F336 AromaticContact CZ-CZ 3.04Å; F308-F336 HydrophobicContact CZ-CZ 3.04Å; K325-F336 HydrophobicContact CB-CB 4.01Å; K325-F336 HydrophobicContact CD-CB 3.77Å; K325-F336 HydrophobicContact CD-CG 4.5Å; K325-F336 PolarHBondContact NZ-OXT 3.34Å; P326-F336 HydrophobicContact CB-CD2 4.44Å; P326-F336 WeakPolarHBondContact O-CB 3.29Å; P326-F336 WeakPolarHBondContact O-CD2 3.21Å; E328-F336 VanDerWaalsContact C-CE2 3.49Å; E328-F336 WeakPolarHBondContact O-CE2 3.41Å; C329-F336 HydrophobicContact CB-CE2 4.08Å; C329-F336 HydrophobicContact CB-CZ 4.03Å

Retrieved 336 of 336 residues in 1393.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).