A0A077ZBM4_TRITR Loading...

BTB and BACK and Kelch 1 domain containing protei n

AlphaFold DB , UniProt , Accession A0A077ZBM4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 595 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	34.7	Very low	34.3	Very low	241 Å²	241	148.5 Å²	148.5	100%	1.187	82%	0.824	S	S	*	*				0	131	0	-86.3	-171.7	-92.3	0	0	107.3
2	S	34.7	Very low	34.6	Very low	125 Å²	125	151.7 Å²	151.7	87%	0.874	83%	0.827	S	S	*	*			trans	50.5	106.9	-179.3	65.9	0	0	0	0	119.4
3	V	30.1	Very low	35.3	Very low	148 Å²	148	145.8 Å²	145.8	90%	0.897	80%	0.804	S	S	*	*			trans	-71.6	144.1	153.1	177.9	0	0	0	0	109.1
4	G	35.7	Very low	35.5	Very low	64 Å²	64	142.6 Å²	142.6	66%	0.66	79%	0.791	S	S	*	*			trans	-155.2	103.6	157.4	0	0	0	0	0	107.6
5	E	34.2	Very low	36.2	Very low	188 Å²	188	140.7 Å²	140.7	88%	0.879	78%	0.784	S	S	*	*				60	93.6	111.4	-71	-178	162.8	0	0	111
6	M	31	Very low	36.4	Very low	153 Å²	153	137.4 Å²	137.4	75%	0.754	78%	0.78	S	S	*	*				54.3	90.6	70.1	-146.8	-171.9	82.5	0	0	113.6	L8	M6-L8 HydrophobicContact CE-CD1 4.3Å; M6-L8 HydrophobicContact SD-CD1 4.42Å
7	D	34.2	Very low	36.9	Very low	172 Å²	172	138.6 Å²	138.6	92%	0.92	78%	0.784	S	S	*	*			trans	-118.8	109.7	150	-85.5	-33.5	0	0	0	108.1
8	L	34.4	Very low	37.3	Very low	129 Å²	129	134.9 Å²	134.9	68%	0.675	78%	0.782	S	S	*	*			trans	-89.1	134.1	157.9	-75.8	156	0	0	0	105.9	M6	M6-L8 HydrophobicContact CE-CD1 4.3Å; M6-L8 HydrophobicContact SD-CD1 4.42Å
9	D	35.7	Very low	37.2	Very low	156 Å²	156	133.2 Å²	133.2	83%	0.834	79%	0.785	S	S	*	*			trans	167.2	105.7	134.9	-85.9	-17.5	0	0	0	110
10	D	35.2	Very low	37.6	Very low	156 Å²	156	132 Å²	132	83%	0.834	78%	0.784	S	S	*	*			trans	175.9	100	130.6	-102.2	-21.3	0	0	0	108.7
11	D	37.5	Very low	38.1	Very low	102 Å²	102	132.5 Å²	132.5	55%	0.545	79%	0.788	S	S	.	*			trans	-166.7	72.9	158.6	-100.8	-24.6	0	0	0	111.9	R32	D11-R32 IonicContact OD1-CZ 2.89Å; D11-R32 VanDerWaalsContact OD1-CZ 3.31Å; D11-R32 IonicContact OD1-NE 2.81Å; D11-R32 IonicContact OD1-NH1 3.48Å; D11-R32 PolarHBondContact OD1-NH1 2.89Å; D11-R32 IonicContact OD1-NH2 3.97Å; D11-R32 VanDerWaalsContact OD2-CD 3.26Å; D11-R32 WeakPolarHBondContact OD2-CD 2.79Å; D11-R32 IonicContact OD2-CZ 3.48Å; D11-R32 IonicContact OD2-NE 3.61Å; D11-R32 IonicContact OD2-NH1 3.01Å; D11-R32 PolarHBondContact OD2-NH1 3.47Å
12	Q	38.3	Very low	38.9	Very low	186 Å²	186	126.7 Å²	126.7	87%	0.869	77%	0.767	S	S	*	*			trans	-123.8	91.3	154.4	-72.1	-170.4	10.2	0	0	108.2	V14	Q12-V14 PolarHBondContact O-N 3.47Å
13	S	42.8	Very low	39.6	Very low	75 Å²	75	124.9 Å²	124.9	52%	0.524	77%	0.768	S	S	.	*			trans	-87.4	105.3	167.8	58.2	0	0	0	0	109.7	V15	S13-V15 PolarHBondContact O-N 3.34Å
14	V	38.2	Very low	40.7	Very low	102 Å²	102	125.1 Å²	125.1	62%	0.618	76%	0.764	S	S	*	*			trans	-82.5	106.4	165.5	177.6	0	0	0	0	107.2	Q12 A16 F27	Q12-V14 PolarHBondContact O-N 3.47Å; V14-A16 PolarHBondContact O-N 2.93Å; V14-F27 HydrophobicContact CG1-CE2 4.32Å
15	V	46.3	Very low	41.9	Very low	114 Å²	114	130.7 Å²	130.7	69%	0.691	78%	0.778	S	S	*	*			trans	-89.2	100.2	167.4	-172.2	0	0	0	0	106.8	S13	S13-V15 PolarHBondContact O-N 3.34Å
16	A	39.7	Very low	43.9	Very low	87 Å²	87	127.2 Å²	127.2	72%	0.719	77%	0.774	S	S	*	*			trans	-87.1	107.2	170	0	0	0	0	0	108.1	V14 G18	V14-A16 PolarHBondContact O-N 2.93Å; A16-G18 PolarHBondContact O-N 3.25Å
17	D	44.1	Very low	46.3	Very low	158 Å²	158	126.5 Å²	126.5	85%	0.845	77%	0.767	S	S	*	*			trans	-67.7	127.4	171.5	-96.3	-22.4	0	0	0	110	A19	D17-A19 PolarHBondContact O-N 2.87Å
18	G	43.9	Very low	48.5	Very low	72 Å²	72	123.6 Å²	123.6	74%	0.742	76%	0.756	S	S	*	*			trans	-66.8	127.1	-173.1	0	0	0	0	0	113.5	A16	A16-G18 PolarHBondContact O-N 3.25Å
19	A	37.1	Very low	50.9	Low	103 Å²	103	124.7 Å²	124.7	85%	0.851	76%	0.755	S	S	*	*			trans	43.4	94.6	143.1	0	0	0	0	0	118.2	D17	D17-A19 PolarHBondContact O-N 2.87Å
20	S	43.5	Very low	53	Low	108 Å²	108	121.9 Å²	121.9	76%	0.755	75%	0.747	S	S	*	*			trans	-126	127.9	139.5	78.9	0	0	0	0	109.6	T22	S20-T22 VanDerWaalsContact C-N 3.32Å; S20-T22 PolarHBondContact O-N 3.44Å
21	T	48.7	Very low	55.5	Low	143 Å²	143	116 Å²	116	88%	0.877	72%	0.717	S	S	*	*			trans	-76.9	72.1	-173	44.6	0	0	0	0	111.7
22	T	52.1	Low	57.7	Low	120 Å²	120	117.8 Å²	117.8	74%	0.736	72%	0.717	S	S	*	*	S	Bend	trans	-163.2	101.5	159.4	42.2	0	0	0	0	110.2	S20 D24	S20-T22 VanDerWaalsContact C-N 3.32Å; S20-T22 PolarHBondContact O-N 3.44Å; T22-D24 VanDerWaalsContact C-N 3.32Å; T22-D24 PolarHBondContact O-N 2.89Å
23	G	48.7	Very low	60.1	Low	87 Å²	87	118.4 Å²	118.4	90%	0.897	71%	0.711	S	S	*	*	S	Bend	trans	69.1	-29.2	139.9	0	0	0	0	0	122
24	D	53.2	Low	62.3	Low	153 Å²	153	119 Å²	119	82%	0.818	71%	0.708	S	S	*	*			trans	-107.7	100.7	-176.6	-93.6	-23.3	0	0	0	111.2	T22 S26	T22-D24 VanDerWaalsContact C-N 3.32Å; T22-D24 PolarHBondContact O-N 2.89Å; D24-S26 VanDerWaalsContact C-N 3.35Å; D24-S26 PolarHBondContact O-N 3.37Å; D24-S26 VanDerWaalsContact O-N 3.14Å
25	L	60.6	Low	64.5	Low	181 Å²	181	121.2 Å²	121.2	95%	0.948	71%	0.71	S	S	*	*			trans	-76.2	87.3	163.6	-82	155.9	0	0	0	108.1
26	S	76.9	Confident	66.4	Low	115 Å²	115	120.6 Å²	120.6	80%	0.804	70%	0.702	S	S	*	*			trans	-81.8	135.2	164.2	56	0	0	0	0	109.7	D24	D24-S26 VanDerWaalsContact C-N 3.35Å; D24-S26 PolarHBondContact O-N 3.37Å; D24-S26 VanDerWaalsContact O-N 3.14Å
27	F	80.6	Confident	68.9	Low	138 Å²	138	120 Å²	120	61%	0.605	69%	0.686	S	S	*	*			trans	-125.1	127.9	172.6	165.6	-102.8	0	0	0	108.2	V14 F29	V14-F27 HydrophobicContact CG1-CE2 4.32Å; F27-F29 HydrophobicContact CD1-CB 4.32Å; F27-F29 HydrophobicContact CE1-CB 3.6Å; F27-F29 HydrophobicContact CE1-CD2 4.07Å; F27-F29 HydrophobicContact CE1-CG 4.33Å; F27-F29 HydrophobicContact CZ-CB 4.23Å; F27-F29 HydrophobicContact CZ-CD2 4.23Å
28	T	80.4	Confident	71.1	Confident	111 Å²	111	115 Å²	115	68%	0.681	66%	0.66	S	S	*	*			trans	-95.8	111.5	172.4	-57.8	0	0	0	0	108.5	C30	T28-C30 PolarHBondContact O-N 3.1Å
29	F	85.5	Confident	73.3	Confident	152 Å²	152	113.4 Å²	113.4	67%	0.667	64%	0.64	S	S	*	*			trans	-77.5	115.6	172.2	178.9	-109.7	0	0	0	110.2	F27 S31	F27-F29 HydrophobicContact CD1-CB 4.32Å; F27-F29 HydrophobicContact CE1-CB 3.6Å; F27-F29 HydrophobicContact CE1-CD2 4.07Å; F27-F29 HydrophobicContact CE1-CG 4.33Å; F27-F29 HydrophobicContact CZ-CB 4.23Å; F27-F29 HydrophobicContact CZ-CD2 4.23Å; F29-S31 VanDerWaalsContact CE1-CB 3.44Å
30	C	80.6	Confident	75.9	Confident	97 Å²	97	115 Å²	115	66%	0.655	63%	0.627	S	S	*	*			trans	-105.9	122.2	172.3	-66.6	0	0	0	0	109.6	T28	T28-C30 PolarHBondContact O-N 3.1Å
31	S	86.3	Confident	78.2	Confident	31 Å²	31	115.9 Å²	115.9	22%	0.217	61%	0.614	C	S	.	*			trans	-118.7	98.3	179.5	169.7	0	0	0	0	110.7	F29 R33 L34 F35	F29-S31 VanDerWaalsContact CE1-CB 3.44Å; S31-R33 PolarHBondContact O-N 3Å; S31-L34 WeakPolarHBondContact O-CB 3.47Å; S31-L34 PolarHBondContact O-N 3.15Å; S31-L34 PolarHBondContact OG-N 2.86Å; S31-L34 VanDerWaalsContact OG-N 3.13Å; S31-F35 WeakPolarHBondContact O-CD2 3.4Å
32	R	85.1	Confident	80.3	Confident	140 Å²	140	112.7 Å²	112.7	53%	0.528	59%	0.59	S	S	.	*	H	α-helix	trans	-53.9	-40.7	170.5	-71.4	-173.1	-176.8	-176.5	5.8	111.4	D11 L34 F35 D36	D11-R32 IonicContact OD1-CZ 2.89Å; D11-R32 VanDerWaalsContact OD1-CZ 3.31Å; D11-R32 IonicContact OD1-NE 2.81Å; D11-R32 IonicContact OD1-NH1 3.48Å; D11-R32 PolarHBondContact OD1-NH1 2.89Å; D11-R32 IonicContact OD1-NH2 3.97Å; D11-R32 VanDerWaalsContact OD2-CD 3.26Å; D11-R32 WeakPolarHBondContact OD2-CD 2.79Å; D11-R32 IonicContact OD2-CZ 3.48Å; D11-R32 IonicContact OD2-NE 3.61Å; D11-R32 IonicContact OD2-NH1 3.01Å; D11-R32 PolarHBondContact OD2-NH1 3.47Å; R32-L34 PolarHBondContact O-N 3.27Å; R32-F35 WeakPolarHBondContact O-CB 3.29Å; R32-F35 PolarHBondContact O-N 3.11Å; R32-D36 PolarHBondContact O-N 3.27Å
33	R	88.4	Confident	82.3	Confident	200 Å²	200	108.9 Å²	108.9	76%	0.755	56%	0.564	S	S	*	*	H	α-helix	trans	-53.2	-29.3	173.6	-174.1	178.6	179.8	-176.9	2.8	114.5	S31 L37	S31-R33 PolarHBondContact O-N 3Å; R33-L37 VanDerWaalsContact O-CB 3.26Å; R33-L37 WeakPolarHBondContact O-CB 3.28Å; R33-L37 PolarHBondContact O-N 3.38Å
34	L	87.8	Confident	84.5	Confident	86 Å²	86	109.8 Å²	109.8	45%	0.45	54%	0.543	S	S	.	.	H	α-helix	trans	-70.7	-38.8	178.7	178.8	62.6	0	0	0	110.4	S31 R32 L37 N38	S31-L34 WeakPolarHBondContact O-CB 3.47Å; S31-L34 PolarHBondContact O-N 3.15Å; S31-L34 PolarHBondContact OG-N 2.86Å; S31-L34 VanDerWaalsContact OG-N 3.13Å; R32-L34 PolarHBondContact O-N 3.27Å; L34-L37 PolarHBondContact O-N 3.25Å; L34-N38 VanDerWaalsContact O-CB 3.28Å; L34-N38 WeakPolarHBondContact O-CB 3.43Å; L34-N38 PolarHBondContact O-N 3.17Å; L34-N38 PolarHBondContact O-ND2 3.13Å
35	F	85.3	Confident	86.5	Confident	150 Å²	150	105.8 Å²	105.8	66%	0.658	52%	0.519	S	S	*	.	H	α-helix	trans	-64.5	-47.4	176.5	-64.5	-82.1	0	0	0	110.8	S31 R32 L37 N38 A39	S31-F35 WeakPolarHBondContact O-CD2 3.4Å; R32-F35 WeakPolarHBondContact O-CB 3.29Å; R32-F35 PolarHBondContact O-N 3.11Å; F35-L37 VanDerWaalsContact C-N 3.33Å; F35-L37 PolarHBondContact O-N 3.5Å; F35-N38 PolarHBondContact O-N 2.95Å; F35-N38 VanDerWaalsContact O-N 3.17Å; F35-A39 PolarHBondContact O-N 2.84Å
36	D	86.6	Confident	88.1	Confident	100 Å²	100	98.3 Å²	98.3	54%	0.535	48%	0.478	S	S	.	.	H	α-helix	trans	-61.1	-41.7	176.9	-55.7	-29.4	0	0	0	112.2	R32 A39 K40	R32-D36 PolarHBondContact O-N 3.27Å; D36-A39 PolarHBondContact O-N 3.44Å; D36-K40 WeakPolarHBondContact O-CG 3.22Å; D36-K40 PolarHBondContact O-N 3.15Å
37	L	90.9	Very high	88.9	Confident	74 Å²	74	98.7 Å²	98.7	39%	0.387	47%	0.467	S	S	.	.	H	α-helix	trans	-67.7	-37.9	177.8	-173.5	66.6	0	0	0	111.6	R33 L34 F35 R41	R33-L37 VanDerWaalsContact O-CB 3.26Å; R33-L37 WeakPolarHBondContact O-CB 3.28Å; R33-L37 PolarHBondContact O-N 3.38Å; L34-L37 PolarHBondContact O-N 3.25Å; F35-L37 VanDerWaalsContact C-N 3.33Å; F35-L37 PolarHBondContact O-N 3.5Å; L37-R41 VanDerWaalsContact O-CG 3.28Å; L37-R41 WeakPolarHBondContact O-CG 3.4Å; L37-R41 PolarHBondContact O-N 2.94Å
38	N	90.8	Very high	89.6	Confident	54 Å²	54	96.9 Å²	96.9	29%	0.289	46%	0.461	S	S	.	.	H	α-helix	trans	-66.9	-42.8	175.9	-74.9	-15.7	0	0	0	111.1	L34 F35 K40 R41 M42	L34-N38 VanDerWaalsContact O-CB 3.28Å; L34-N38 WeakPolarHBondContact O-CB 3.43Å; L34-N38 PolarHBondContact O-N 3.17Å; L34-N38 PolarHBondContact O-ND2 3.13Å; F35-N38 PolarHBondContact O-N 2.95Å; F35-N38 VanDerWaalsContact O-N 3.17Å; N38-K40 PolarHBondContact O-N 3.04Å; N38-R41 WeakPolarHBondContact O-CB 3.48Å; N38-R41 PolarHBondContact O-N 2.79Å; N38-R41 VanDerWaalsContact O-N 3.13Å; N38-M42 WeakPolarHBondContact O-CG 3.44Å; N38-M42 PolarHBondContact O-N 2.89Å
39	A	89.8	Confident	90.3	Very high	39 Å²	39	96 Å²	96	32%	0.322	45%	0.449	S	S	.	.	H	α-helix	trans	-57.4	-49.1	173.8	0	0	0	0	0	111.1	F35 D36 R41 M42 Q43	F35-A39 PolarHBondContact O-N 2.84Å; D36-A39 PolarHBondContact O-N 3.44Å; A39-R41 VanDerWaalsContact C-N 3.28Å; A39-R41 PolarHBondContact O-N 3.43Å; A39-M42 PolarHBondContact O-N 2.83Å; A39-M42 VanDerWaalsContact O-N 3.11Å; A39-Q43 WeakPolarHBondContact O-CG 3.36Å; A39-Q43 PolarHBondContact O-N 3.35Å
40	K	92	Very high	90.7	Very high	135 Å²	135	92 Å²	92	59%	0.587	43%	0.434	S	S	*	.	H	α-helix	trans	-59.4	-34.6	174.9	-73.1	177.8	179.7	178.3	0	113.6	D36 N38 K44	D36-K40 WeakPolarHBondContact O-CG 3.22Å; D36-K40 PolarHBondContact O-N 3.15Å; N38-K40 PolarHBondContact O-N 3.04Å; K40-K44 PolarHBondContact O-N 2.93Å; K40-K44 VanDerWaalsContact O-N 3.15Å
41	R	92.8	Very high	91.3	Very high	127 Å²	127	94.5 Å²	94.5	48%	0.479	43%	0.434	S	S	.	.	H	α-helix	trans	-71.7	-40.7	174.9	-74.6	170.8	177.4	-177.1	-1.2	111.9	L37 N38 A39 Q43 K44 F45	L37-R41 VanDerWaalsContact O-CG 3.28Å; L37-R41 WeakPolarHBondContact O-CG 3.4Å; L37-R41 PolarHBondContact O-N 2.94Å; N38-R41 WeakPolarHBondContact O-CB 3.48Å; N38-R41 PolarHBondContact O-N 2.79Å; N38-R41 VanDerWaalsContact O-N 3.13Å; A39-R41 VanDerWaalsContact C-N 3.28Å; A39-R41 PolarHBondContact O-N 3.43Å; R41-Q43 VanDerWaalsContact C-N 3.35Å; R41-K44 PolarHBondContact O-N 2.64Å; R41-F45 HydrophobicContact CB-CE2 4.35Å; R41-F45 HydrophobicContact CB-CZ 4.48Å; R41-F45 WeakPolarHBondContact O-CD2 3.42Å; R41-F45 WeakPolarHBondContact O-CG 3.24Å; R41-F45 PolarHBondContact O-N 3.25Å
42	M	92.8	Very high	91.7	Very high	76 Å²	76	94.8 Å²	94.8	37%	0.374	44%	0.436	S	S	.	.	H	α-helix	trans	-63.3	-41.4	175.6	-69.7	174	-176.2	0	0	111.3	N38 A39 K44 F45 Y46 V69 Y111	N38-M42 WeakPolarHBondContact O-CG 3.44Å; N38-M42 PolarHBondContact O-N 2.89Å; A39-M42 PolarHBondContact O-N 2.83Å; A39-M42 VanDerWaalsContact O-N 3.11Å; M42-K44 PolarHBondContact O-N 3.17Å; M42-F45 PolarHBondContact O-N 3.35Å; M42-Y46 PolarHBondContact O-N 3.21Å; M42-V69 HydrophobicContact SD-CG2 4.1Å; M42-Y111 HydrophobicContact CB-CD1 4.4Å
43	Q	93.8	Very high	92.1	Very high	40 Å²	40	92 Å²	92	19%	0.187	43%	0.431	C	S	.	.	H	α-helix	trans	-55.1	-51.6	171.2	-70.6	164.7	3.6	0	0	110.8	A39 R41 F45 Y46 E47 Y111 Y112	A39-Q43 WeakPolarHBondContact O-CG 3.36Å; A39-Q43 PolarHBondContact O-N 3.35Å; R41-Q43 VanDerWaalsContact C-N 3.35Å; Q43-F45 PolarHBondContact O-N 3.03Å; Q43-Y46 WeakPolarHBondContact O-CB 3.28Å; Q43-Y46 PolarHBondContact O-N 2.82Å; Q43-Y46 VanDerWaalsContact O-N 3.17Å; Q43-E47 WeakPolarHBondContact O-CG 3.23Å; Q43-E47 PolarHBondContact O-N 2.87Å; Q43-Y111 VanDerWaalsContact CG-O 3.24Å; Q43-Y111 WeakPolarHBondContact CG-O 3.45Å; Q43-Y111 PolarHBondContact NE2-O 3.31Å; Q43-Y112 HydrophobicContact CG-CD1 4.4Å; Q43-Y112 HydrophobicContact CG-CD2 4.49Å; Q43-Y112 HydrophobicContact CG-CE1 4.35Å; Q43-Y112 HydrophobicContact CG-CE2 4.44Å; Q43-Y112 HydrophobicContact CG-CG 4.49Å
44	K	94.5	Very high	92.4	Very high	106 Å²	106	82.6 Å²	82.6	46%	0.461	40%	0.396	S	S	.	.	H	α-helix	trans	-59.3	-42	176.9	-176.3	178.7	176	179.8	0	112.9	K40 R41 M42 Y46 E47 E48	K40-K44 PolarHBondContact O-N 2.93Å; K40-K44 VanDerWaalsContact O-N 3.15Å; R41-K44 PolarHBondContact O-N 2.64Å; M42-K44 PolarHBondContact O-N 3.17Å; K44-Y46 VanDerWaalsContact C-N 3.31Å; K44-Y46 PolarHBondContact O-N 3.46Å; K44-E47 PolarHBondContact O-N 3.02Å; K44-E48 WeakPolarHBondContact CE-OE1 3.48Å; K44-E48 WeakPolarHBondContact CE-OE2 3.34Å; K44-E48 HydrophobicContact CG-CG 4.39Å; K44-E48 IonicContact NZ-OE1 3.47Å; K44-E48 PolarHBondContact NZ-OE1 3.28Å; K44-E48 WeakPolarHBondContact O-CB 3.41Å; K44-E48 WeakPolarHBondContact O-CG 3.26Å; K44-E48 PolarHBondContact O-N 3.38Å
45	F	95.4	Very high	92.7	Very high	70 Å²	70	78.8 Å²	78.8	31%	0.307	38%	0.376	S	S	.	.	H	α-helix	trans	-64	-37.8	177.4	-63.8	-28.6	0	0	0	112.1	R41 M42 Q43 Q49 L50 F51	R41-F45 HydrophobicContact CB-CE2 4.35Å; R41-F45 HydrophobicContact CB-CZ 4.48Å; R41-F45 WeakPolarHBondContact O-CD2 3.42Å; R41-F45 WeakPolarHBondContact O-CG 3.24Å; R41-F45 PolarHBondContact O-N 3.25Å; M42-F45 PolarHBondContact O-N 3.35Å; Q43-F45 PolarHBondContact O-N 3.03Å; F45-Q49 PolarHBondContact O-N 3.02Å; F45-L50 HydrophobicContact CB-CB 4.47Å; F45-L50 HydrophobicContact CD1-CD1 4.3Å; F45-L50 PolarHBondContact O-N 2.88Å; F45-F51 HydrophobicContact CD1-CD2 4.31Å; F45-F51 HydrophobicContact CD1-CE2 4.13Å; F45-F51 HydrophobicContact CD2-CD2 4.26Å; F45-F51 HydrophobicContact CE1-CE2 4.08Å; F45-F51 HydrophobicContact CE2-CE2 4.49Å; F45-F51 HydrophobicContact CG-CD2 4.13Å; F45-F51 HydrophobicContact CG-CE2 4.38Å; F45-F51 HydrophobicContact CZ-CE2 4.26Å
46	Y	94.7	Very high	93.2	Very high	23 Å²	23	71.6 Å²	71.6	9%	0.09	35%	0.345	C	S	.	.	H	α-helix	trans	-64.6	-47	173.2	177.6	-105.8	0	0	0	112	M42 Q43 K44 E48 Q49 N64 V107 I108 Y111	M42-Y46 PolarHBondContact O-N 3.21Å; Q43-Y46 WeakPolarHBondContact O-CB 3.28Å; Q43-Y46 PolarHBondContact O-N 2.82Å; Q43-Y46 VanDerWaalsContact O-N 3.17Å; K44-Y46 VanDerWaalsContact C-N 3.31Å; K44-Y46 PolarHBondContact O-N 3.46Å; Y46-E48 PolarHBondContact O-N 2.9Å; Y46-Q49 PolarHBondContact O-N 3.46Å; Y46-Q49 VanDerWaalsContact O-N 3.1Å; Y46-Q49 PolarHBondContact O-NE2 3.36Å; Y46-N64 VanDerWaalsContact CE2-O 3.23Å; Y46-N64 WeakPolarHBondContact CE2-O 3.23Å; Y46-V107 HydrophobicContact CE2-CG1 4.03Å; Y46-I108 HydrophobicContact CE1-CG1 4.16Å; Y46-Y111 HydrophobicContact CD1-CD2 4.13Å; Y46-Y111 HydrophobicContact CD1-CE2 4.36Å; Y46-Y111 HydrophobicContact CD1-CG 4.42Å; Y46-Y111 AromaticContact CD2-CD2 3.98Å; Y46-Y111 HydrophobicContact CD2-CD2 3.98Å; Y46-Y111 HydrophobicContact CD2-CE1 4.13Å; Y46-Y111 AromaticContact CD2-CE2 3.37Å; Y46-Y111 HydrophobicContact CD2-CE2 3.37Å; Y46-Y111 AromaticContact CD2-CZ 3.46Å; Y46-Y111 VanDerWaalsContact CD2-CZ 3.46Å; Y46-Y111 HydrophobicContact CE1-CD2 4.44Å; Y46-Y111 HydrophobicContact CE2-CD2 4.27Å; Y46-Y111 AromaticContact CE2-CE2 3.68Å; Y46-Y111 HydrophobicContact CE2-CE2 3.68Å; Y46-Y111 HydrophobicContact CG-CD1 4.23Å; Y46-Y111 AromaticContact CG-CD2 3.89Å; Y46-Y111 HydrophobicContact CG-CD2 3.89Å; Y46-Y111 HydrophobicContact CG-CE1 4.08Å; Y46-Y111 AromaticContact CG-CE2 3.75Å; Y46-Y111 HydrophobicContact CG-CE2 3.75Å; Y46-Y111 HydrophobicContact CG-CG 4.15Å; Y46-Y111 AromaticContact CG-CZ 3.84Å
47	E	93.7	Very high	93.6	Very high	124 Å²	124	68 Å²	68	58%	0.579	33%	0.327	S	S	*	.	H	α-helix	trans	-60	-43.6	176.9	-69.8	176.3	160.1	0	0	112.8	Q43 K44 Q49 Y112	Q43-E47 WeakPolarHBondContact O-CG 3.23Å; Q43-E47 PolarHBondContact O-N 2.87Å; K44-E47 PolarHBondContact O-N 3.02Å; E47-Q49 PolarHBondContact O-N 2.86Å; E47-Y112 PolarHBondContact OE1-OH 3.48Å
48	E	95.4	Very high	93.7	Very high	99 Å²	99	64.5 Å²	64.5	46%	0.463	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-0.4	178.5	-65.9	-179.6	166.5	0	0	112.9	K44 Y46 L50	K44-E48 WeakPolarHBondContact CE-OE1 3.48Å; K44-E48 WeakPolarHBondContact CE-OE2 3.34Å; K44-E48 HydrophobicContact CG-CG 4.39Å; K44-E48 IonicContact NZ-OE1 3.47Å; K44-E48 PolarHBondContact NZ-OE1 3.28Å; K44-E48 WeakPolarHBondContact O-CB 3.41Å; K44-E48 WeakPolarHBondContact O-CG 3.26Å; K44-E48 PolarHBondContact O-N 3.38Å; Y46-E48 PolarHBondContact O-N 2.9Å; E48-L50 HydrophobicContact CB-CD1 3.94Å; E48-L50 HydrophobicContact CB-CG 3.82Å; E48-L50 PolarHBondContact O-N 3.19Å; E48-L50 VanDerWaalsContact OE2-CD1 3.29Å; E48-L50 WeakPolarHBondContact OE2-CD1 3.28Å
49	Q	94.9	Very high	93.8	Very high	92 Å²	92	69 Å²	69	43%	0.43	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	34	-177.6	-59.3	-74.7	-66	0	0	113.1	F45 Y46 E47 N64	F45-Q49 PolarHBondContact O-N 3.02Å; Y46-Q49 PolarHBondContact O-N 3.46Å; Y46-Q49 VanDerWaalsContact O-N 3.1Å; Y46-Q49 PolarHBondContact O-NE2 3.36Å; E47-Q49 PolarHBondContact O-N 2.86Å; Q49-N64 VanDerWaalsContact OE1-CB 3.31Å; Q49-N64 PolarHBondContact OE1-ND2 2.95Å
50	L	93.9	Very high	93.7	Very high	69 Å²	69	70.2 Å²	70.2	36%	0.361	34%	0.344	S	S	.	.			trans	-90.6	138.1	179.2	-64	177.7	0	0	0	110.3	F45 E48 C52 H66	F45-L50 HydrophobicContact CB-CB 4.47Å; F45-L50 HydrophobicContact CD1-CD1 4.3Å; F45-L50 PolarHBondContact O-N 2.88Å; E48-L50 HydrophobicContact CB-CD1 3.94Å; E48-L50 HydrophobicContact CB-CG 3.82Å; E48-L50 PolarHBondContact O-N 3.19Å; E48-L50 VanDerWaalsContact OE2-CD1 3.29Å; E48-L50 WeakPolarHBondContact OE2-CD1 3.28Å; L50-C52 PolarHBondContact O-N 2.74Å; L50-C52 VanDerWaalsContact O-N 3.15Å; L50-H66 PolarHBondContact O-CE1 3.5Å; L50-H66 PolarHBondContact O-NE2 2.83Å
51	F	93.1	Very high	93.9	Very high	149 Å²	149	69.8 Å²	69.8	65%	0.654	34%	0.339	S	S	*	.	S	Bend	trans	63.5	8.5	175.2	-43.3	-67.9	0	0	0	116.7	F45 D53 H66	F45-F51 HydrophobicContact CD1-CD2 4.31Å; F45-F51 HydrophobicContact CD1-CE2 4.13Å; F45-F51 HydrophobicContact CD2-CD2 4.26Å; F45-F51 HydrophobicContact CE1-CE2 4.08Å; F45-F51 HydrophobicContact CE2-CE2 4.49Å; F45-F51 HydrophobicContact CG-CD2 4.13Å; F45-F51 HydrophobicContact CG-CE2 4.38Å; F45-F51 HydrophobicContact CZ-CE2 4.26Å; F51-D53 PolarHBondContact O-N 3.21Å; F51-H66 VanDerWaalsContact C-CD2 3.49Å; F51-H66 VanDerWaalsContact C-NE2 3.3Å; F51-H66 PolarHBondContact O-CD2 2.9Å
52	C	93.5	Very high	94	Very high	37 Å²	37	70.5 Å²	70.5	25%	0.25	34%	0.342	C	S	.	.			trans	-58.5	122.6	172.3	-61	0	0	0	0	110.5	L50 N64 A65 H66	L50-C52 PolarHBondContact O-N 2.74Å; L50-C52 VanDerWaalsContact O-N 3.15Å; C52-N64 HydrophobicContact CB-CB 3.82Å; C52-A65 CarbonylContact C-O 3.55Å; C52-A65 VanDerWaalsContact CA-O 3.28Å; C52-A65 WeakPolarHBondContact CA-O 3.34Å; C52-A65 WeakPolarHBondContact CB-O 3.33Å; C52-H66 PolarHBondContact N-NE2 2.91Å
53	D	93.9	Very high	94.1	Very high	81 Å²	81	67.2 Å²	67.2	43%	0.433	33%	0.326	S	S	.	.			trans	-117.1	5.6	-173.2	63.7	-6.1	0	0	0	112.8	F51 A65 H66 R67	F51-D53 PolarHBondContact O-N 3.21Å; D53-A65 PolarHBondContact N-O 3.32Å; D53-A65 VanDerWaalsContact N-O 3.08Å; D53-H66 VanDerWaalsContact OD1-CA 3.3Å; D53-H66 WeakPolarHBondContact OD1-CA 3.43Å; D53-R67 PolarHBondContact O-NE 2.97Å; D53-R67 WeakPolarHBondContact OD1-CG 3.3Å; D53-R67 PolarHBondContact OD1-N 3.25Å
54	V	94.4	Very high	94.2	Very high	4 Å²	4	68.2 Å²	68.2	2%	0.024	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	145.6	171.6	64.2	0	0	0	0	110.9	L56 N64 A65 R67 L70 F81 V93	V54-L56 HydrophobicContact CG2-CD2 4.19Å; V54-N64 CarbonylContact O-C 3.51Å; V54-N64 WeakPolarHBondContact O-CA 3.37Å; V54-A65 HydrophobicContact CG1-CB 4.25Å; V54-A65 WeakPolarHBondContact CG1-O 3.29Å; V54-A65 PolarHBondContact N-O 3.36Å; V54-A65 PolarHBondContact O-N 2.91Å; V54-R67 HydrophobicContact CB-CG 3.78Å; V54-R67 HydrophobicContact CG1-CG 3.75Å; V54-L70 HydrophobicContact CG1-CD1 4.24Å; V54-F81 HydrophobicContact CG1-CZ 4.32Å; V54-F81 HydrophobicContact CG2-CE1 4.24Å; V54-F81 HydrophobicContact CG2-CZ 4.24Å; V54-V93 HydrophobicContact CG2-CG2 3.86Å
55	C	95.2	Very high	94.3	Very high	5 Å²	5	63.1 Å²	63.1	3%	0.034	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	111.9	171.7	172.5	0	0	0	0	109	R62 I63 A91 E92 V93	C55-R62 PolarHBondContact SG-NE 3.08Å; C55-R62 VanDerWaalsContact SG-NE 3.43Å; C55-I63 CarbonylContact C-O 3.55Å; C55-I63 WeakPolarHBondContact CA-O 3.49Å; C55-A91 PolarHBondContact N-O 3.24Å; C55-E92 HydrophobicContact CB-CG 4.11Å; C55-E92 CarbonylContact O-C 3.59Å; C55-E92 VanDerWaalsContact O-CA 3.27Å; C55-E92 WeakPolarHBondContact O-CA 3.35Å; C55-V93 PolarHBondContact O-N 2.93Å
56	L	95.2	Very high	94.3	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	133.5	172	-53.2	-177.3	0	0	0	109	V54 I63 L70 F77 V93 M95 L103 V107	V54-L56 HydrophobicContact CG2-CD2 4.19Å; L56-I63 HydrophobicContact CB-CB 4.48Å; L56-I63 PolarHBondContact N-O 3.34Å; L56-I63 PolarHBondContact O-N 2.84Å; L56-L70 HydrophobicContact CD1-CD1 4.03Å; L56-L70 HydrophobicContact CG-CD1 4.48Å; L56-F77 HydrophobicContact CD1-CE1 4.15Å; L56-F77 HydrophobicContact CD1-CZ 3.88Å; L56-F77 HydrophobicContact CD2-CE1 4.2Å; L56-V93 CarbonylContact C-O 3.58Å; L56-V93 WeakPolarHBondContact CA-O 3.14Å; L56-V93 HydrophobicContact CD2-CB 3.93Å; L56-V93 HydrophobicContact CD2-CG1 4.35Å; L56-M95 HydrophobicContact CB-CG 4.37Å; L56-L103 HydrophobicContact CB-CD2 4.1Å; L56-L103 HydrophobicContact CD1-CD1 4.21Å; L56-L103 HydrophobicContact CD1-CD2 4.33Å; L56-L103 HydrophobicContact CD1-CG 4.44Å; L56-V107 HydrophobicContact CD1-CG2 3.79Å
57	V	94.7	Very high	94.3	Very high	24 Å²	24	61.6 Å²	61.6	15%	0.145	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	114.4	-179.3	-173.4	0	0	0	0	109	R61 R62 E92 V93 E94 M95	V57-R61 WeakPolarHBondContact CA-O 3.44Å; V57-R62 HydrophobicContact CG2-CG 4.23Å; V57-E92 HydrophobicContact CG2-CB 4.42Å; V57-V93 PolarHBondContact N-O 3.16Å; V57-E94 WeakPolarHBondContact O-CA 3.37Å; V57-M95 PolarHBondContact O-N 3.38Å
58	A	93.6	Very high	94.3	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	129.8	176.4	0	0	0	0	0	108.6	G60 R61 M95 A100 L103	A58-G60 PolarHBondContact O-N 3.47Å; A58-R61 PolarHBondContact N-O 3.08Å; A58-R61 WeakPolarHBondContact O-CA 3.45Å; A58-R61 WeakPolarHBondContact O-CB 3.47Å; A58-R61 PolarHBondContact O-N 2.93Å; A58-M95 HydrophobicContact CB-CB 4.28Å; A58-A100 HydrophobicContact CB-CB 4.19Å; A58-A100 WeakPolarHBondContact O-CB 3.3Å; A58-L103 HydrophobicContact CB-CD2 3.68Å
59	E	92	Very high	94.3	Very high	148 Å²	148	57.9 Å²	57.9	69%	0.692	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	34.6	-177.9	-56.5	-176.2	123.6	0	0	114.1	R61 A100	E59-R61 PolarHBondContact O-N 3.26Å; E59-A100 HydrophobicContact CB-CB 4.36Å; E59-A100 PolarHBondContact OE2-N 3.27Å; E59-A100 VanDerWaalsContact OE2-N 3.13Å
60	G	89.1	Confident	94.4	Very high	66 Å²	66	53.5 Å²	53.5	68%	0.68	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	-6.8	-176.3	0	0	0	0	0	115.4	A58	A58-G60 PolarHBondContact O-N 3.47Å
61	R	94.5	Very high	94.4	Very high	125 Å²	125	51.4 Å²	51.4	47%	0.472	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	137	169.8	-169.3	177.6	-64.3	-174.3	3.5	109.5	V57 A58 E59 A100 E104	V57-R61 WeakPolarHBondContact CA-O 3.44Å; A58-R61 PolarHBondContact N-O 3.08Å; A58-R61 WeakPolarHBondContact O-CA 3.45Å; A58-R61 WeakPolarHBondContact O-CB 3.47Å; A58-R61 PolarHBondContact O-N 2.93Å; E59-R61 PolarHBondContact O-N 3.26Å; R61-A100 HydrophobicContact CB-CB 3.69Å; R61-A100 HydrophobicContact CG-CB 4.37Å; R61-E104 IonicContact CZ-OE2 3.72Å; R61-E104 IonicContact NH1-OE2 3.3Å; R61-E104 PolarHBondContact NH1-OE2 3.4Å
62	R	95.3	Very high	94.5	Very high	143 Å²	143	48.4 Å²	48.4	54%	0.54	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.6	-178.7	-66.6	-177.6	62.5	151.5	7	110.1	C55 V57 E92	C55-R62 PolarHBondContact SG-NE 3.08Å; C55-R62 VanDerWaalsContact SG-NE 3.43Å; V57-R62 HydrophobicContact CG2-CG 4.23Å; R62-E92 IonicContact CZ-OE1 2.68Å; R62-E92 IonicContact NH1-OE1 3.97Å; R62-E92 PolarHBondContact NH1-OE1 3.11Å; R62-E92 IonicContact NH2-OE1 3.66Å; R62-E92 PolarHBondContact NH2-OE1 2.89Å
63	I	95.6	Very high	94.5	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.036	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	105.7	-178.5	-55.3	163.1	0	0	0	108	C55 L56 L103 E104 V107	C55-I63 CarbonylContact C-O 3.55Å; C55-I63 WeakPolarHBondContact CA-O 3.49Å; L56-I63 HydrophobicContact CB-CB 4.48Å; L56-I63 PolarHBondContact N-O 3.34Å; L56-I63 PolarHBondContact O-N 2.84Å; I63-L103 HydrophobicContact CD1-CB 4.22Å; I63-L103 HydrophobicContact CD1-CD2 4.01Å; I63-L103 HydrophobicContact CD1-CG 3.99Å; I63-E104 HydrophobicContact CD1-CB 3.81Å; I63-E104 HydrophobicContact CD1-CG 4.49Å; I63-E104 HydrophobicContact CG1-CB 4.46Å; I63-V107 HydrophobicContact CG2-CB 4.39Å; I63-V107 HydrophobicContact CG2-CG1 4.1Å; I63-V107 HydrophobicContact CG2-CG2 4.35Å
64	N	96.4	Very high	94.6	Very high	60 Å²	60	44.8 Å²	44.8	32%	0.321	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	137.2	176.4	-57.1	-43.4	0	0	0	110.1	Y46 Q49 C52 V54	Y46-N64 VanDerWaalsContact CE2-O 3.23Å; Y46-N64 WeakPolarHBondContact CE2-O 3.23Å; Q49-N64 VanDerWaalsContact OE1-CB 3.31Å; Q49-N64 PolarHBondContact OE1-ND2 2.95Å; C52-N64 HydrophobicContact CB-CB 3.82Å; V54-N64 CarbonylContact O-C 3.51Å; V54-N64 WeakPolarHBondContact O-CA 3.37Å
65	A	96.4	Very high	94.6	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	-179.1	-179.3	0	0	0	0	0	111.5	C52 D53 V54 L70 V107 Y111	C52-A65 CarbonylContact C-O 3.55Å; C52-A65 VanDerWaalsContact CA-O 3.28Å; C52-A65 WeakPolarHBondContact CA-O 3.34Å; C52-A65 WeakPolarHBondContact CB-O 3.33Å; D53-A65 PolarHBondContact N-O 3.32Å; D53-A65 VanDerWaalsContact N-O 3.08Å; V54-A65 HydrophobicContact CG1-CB 4.25Å; V54-A65 WeakPolarHBondContact CG1-O 3.29Å; V54-A65 PolarHBondContact N-O 3.36Å; V54-A65 PolarHBondContact O-N 2.91Å; A65-L70 HydrophobicContact CB-CD1 3.82Å; A65-L70 HydrophobicContact CB-CG 4.24Å; A65-V107 HydrophobicContact CB-CG1 4.11Å; A65-Y111 WeakPolarHBondContact CA-OH 3.37Å
66	H	95.8	Very high	94.5	Very high	23 Å²	23	53.8 Å²	53.8	11%	0.106	29%	0.291	C	S	.	.			trans	-108.7	123.2	177.2	-58.7	87.3	0	0	0	110	L50 F51 C52 D53 L68 V69 L70 Y111	L50-H66 PolarHBondContact O-CE1 3.5Å; L50-H66 PolarHBondContact O-NE2 2.83Å; F51-H66 VanDerWaalsContact C-CD2 3.49Å; F51-H66 VanDerWaalsContact C-NE2 3.3Å; F51-H66 PolarHBondContact O-CD2 2.9Å; C52-H66 PolarHBondContact N-NE2 2.91Å; D53-H66 VanDerWaalsContact OD1-CA 3.3Å; D53-H66 WeakPolarHBondContact OD1-CA 3.43Å; H66-L68 PolarHBondContact O-N 3.09Å; H66-V69 HydrophobicContact CB-CB 4.2Å; H66-V69 HydrophobicContact CB-CG2 3.93Å; H66-V69 PolarHBondContact O-N 3.01Å; H66-V69 VanDerWaalsContact O-N 3.11Å; H66-L70 PolarHBondContact O-N 2.81Å; H66-L70 VanDerWaalsContact O-N 3.1Å; H66-Y111 PolarHBondContact N-OH 2.86Å; H66-Y111 AromaticContact ND1-CE1 3.58Å; H66-Y111 AromaticContact ND1-CZ 3.63Å; H66-Y111 PolarHBondContact ND1-OH 3.35Å
67	R	94.3	Very high	94.5	Very high	38 Å²	38	53.9 Å²	53.9	14%	0.143	29%	0.291	C	S	.	.	H	α-helix	trans	-53	-41.3	177.3	-72.4	166	167.5	-91.5	-0.4	112	D53 V54 A71 F81 E87 S88 S90	D53-R67 PolarHBondContact O-NE 2.97Å; D53-R67 WeakPolarHBondContact OD1-CG 3.3Å; D53-R67 PolarHBondContact OD1-N 3.25Å; V54-R67 HydrophobicContact CB-CG 3.78Å; V54-R67 HydrophobicContact CG1-CG 3.75Å; R67-A71 WeakPolarHBondContact O-CB 3.42Å; R67-A71 PolarHBondContact O-N 2.85Å; R67-F81 HydrophobicContact CB-CD2 3.88Å; R67-F81 HydrophobicContact CB-CE2 4.13Å; R67-F81 HydrophobicContact CB-CG 4.28Å; R67-F81 HydrophobicContact CG-CD1 4.25Å; R67-F81 HydrophobicContact CG-CD2 4.04Å; R67-F81 HydrophobicContact CG-CE1 4.23Å; R67-F81 HydrophobicContact CG-CE2 4.04Å; R67-F81 HydrophobicContact CG-CG 4.15Å; R67-F81 HydrophobicContact CG-CZ 4.14Å; R67-E87 PolarHBondContact NH2-O 2.82Å; R67-S88 VanDerWaalsContact CZ-O 3.29Å; R67-S88 PolarHBondContact NH1-O 3.43Å; R67-S88 PolarHBondContact NH2-O 3.41Å; R67-S90 PolarHBondContact NH2-O 3.4Å
68	L	93.9	Very high	94.4	Very high	129 Å²	129	54.7 Å²	54.7	68%	0.675	30%	0.298	S	S	*	.	H	α-helix	trans	-62.7	-44.1	179.7	-179.1	64.7	0	0	0	112.3	H66 A72	H66-L68 PolarHBondContact O-N 3.09Å; L68-A72 WeakPolarHBondContact O-CB 3.27Å; L68-A72 PolarHBondContact O-N 3.16Å
69	V	95.3	Very high	94.3	Very high	16 Å²	16	57.4 Å²	57.4	10%	0.097	32%	0.32	C	S	.	.	H	α-helix	trans	-68.6	-46	-178.4	176.7	0	0	0	0	110	M42 H66 A72 A73 C110 Y111	M42-V69 HydrophobicContact SD-CG2 4.1Å; H66-V69 HydrophobicContact CB-CB 4.2Å; H66-V69 HydrophobicContact CB-CG2 3.93Å; H66-V69 PolarHBondContact O-N 3.01Å; H66-V69 VanDerWaalsContact O-N 3.11Å; V69-A72 PolarHBondContact O-N 3.41Å; V69-A73 PolarHBondContact O-N 3.05Å; V69-A73 VanDerWaalsContact O-N 3.13Å; V69-C110 HydrophobicContact CG1-CB 4.09Å; V69-C110 VanDerWaalsContact CG1-O 3.27Å; V69-C110 WeakPolarHBondContact CG1-O 3.39Å; V69-Y111 HydrophobicContact CB-CE1 3.96Å; V69-Y111 HydrophobicContact CG1-CD1 3.86Å; V69-Y111 HydrophobicContact CG1-CD2 4.44Å; V69-Y111 HydrophobicContact CG1-CE1 3.73Å; V69-Y111 HydrophobicContact CG1-CE2 4.31Å; V69-Y111 HydrophobicContact CG1-CG 4.21Å; V69-Y111 HydrophobicContact CG2-CD1 4.34Å; V69-Y111 HydrophobicContact CG2-CE1 3.78Å
70	L	95.8	Very high	94.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-46.3	177.5	-66.5	-177.6	0	0	0	112.2	V54 L56 A65 H66 A72 A73 S74 F77 F81 V107 C110	V54-L70 HydrophobicContact CG1-CD1 4.24Å; L56-L70 HydrophobicContact CD1-CD1 4.03Å; L56-L70 HydrophobicContact CG-CD1 4.48Å; A65-L70 HydrophobicContact CB-CD1 3.82Å; A65-L70 HydrophobicContact CB-CG 4.24Å; H66-L70 PolarHBondContact O-N 2.81Å; H66-L70 VanDerWaalsContact O-N 3.1Å; L70-A72 VanDerWaalsContact C-N 3.3Å; L70-A72 PolarHBondContact O-N 3.25Å; L70-A73 PolarHBondContact O-N 3.22Å; L70-S74 WeakPolarHBondContact O-CB 3.34Å; L70-S74 PolarHBondContact O-N 3.48Å; L70-F77 HydrophobicContact CB-CB 3.94Å; L70-F77 HydrophobicContact CB-CD2 3.85Å; L70-F77 HydrophobicContact CB-CG 3.89Å; L70-F77 HydrophobicContact CD2-CD2 4.29Å; L70-F77 HydrophobicContact CD2-CE2 4.22Å; L70-F77 HydrophobicContact CG-CD2 4.45Å; L70-F81 HydrophobicContact CB-CE2 3.92Å; L70-F81 HydrophobicContact CD1-CE2 4.17Å; L70-F81 HydrophobicContact CD1-CZ 4.29Å; L70-V107 HydrophobicContact CD2-CG1 4.39Å; L70-V107 HydrophobicContact CD2-CG2 4.21Å; L70-C110 HydrophobicContact CD2-CB 4.2Å
71	A	94.9	Very high	94.4	Very high	24 Å²	24	49.7 Å²	49.7	20%	0.198	27%	0.267	C	S	.	.	H	α-helix	trans	-66.3	-29.8	177.5	0	0	0	0	0	113.5	R67 S78 F81	R67-A71 WeakPolarHBondContact O-CB 3.42Å; R67-A71 PolarHBondContact O-N 2.85Å; A71-S78 WeakPolarHBondContact O-CB 3.43Å; A71-F81 HydrophobicContact CB-CD2 4.22Å
72	A	94.4	Very high	94.1	Very high	86 Å²	86	48.8 Å²	48.8	71%	0.711	28%	0.276	S	S	*	.	H	α-helix	trans	-73.4	-31.5	176.1	0	0	0	0	0	112.4	L68 V69 L70	L68-A72 WeakPolarHBondContact O-CB 3.27Å; L68-A72 PolarHBondContact O-N 3.16Å; V69-A72 PolarHBondContact O-N 3.41Å; L70-A72 VanDerWaalsContact C-N 3.3Å; L70-A72 PolarHBondContact O-N 3.25Å
73	A	94.6	Very high	93.5	Very high	42 Å²	42	43.5 Å²	43.5	35%	0.347	26%	0.26	S	S	.	.	H	α-helix	trans	-90.4	-25.4	-177.2	0	0	0	0	0	113.9	V69 L70 C110 L134	V69-A73 PolarHBondContact O-N 3.05Å; V69-A73 VanDerWaalsContact O-N 3.13Å; L70-A73 PolarHBondContact O-N 3.22Å; A73-C110 HydrophobicContact CB-CB 3.87Å; A73-C110 VanDerWaalsContact CB-SG 3.57Å; A73-L134 HydrophobicContact CB-CD2 4.43Å; A73-L134 VanDerWaalsContact O-CD2 3.3Å; A73-L134 WeakPolarHBondContact O-CD2 3.33Å
74	S	96.2	Very high	92.5	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.007	30%	0.303	C	S	.	.			trans	-136.1	127.1	-169.8	155.6	0	0	0	0	111.6	L70 Y76 F77 S78 L132	L70-S74 WeakPolarHBondContact O-CB 3.34Å; L70-S74 PolarHBondContact O-N 3.48Å; S74-Y76 VanDerWaalsContact C-N 3.25Å; S74-Y76 PolarHBondContact O-N 3.13Å; S74-Y76 PolarHBondContact OG-N 3.13Å; S74-F77 PolarHBondContact O-N 2.96Å; S74-F77 WeakPolarHBondContact OG-CD2 3.41Å; S74-F77 PolarHBondContact OG-N 3.3Å; S74-F77 VanDerWaalsContact OG-N 3.13Å; S74-S78 WeakPolarHBondContact O-CB 3.44Å; S74-S78 PolarHBondContact O-N 2.93Å; S74-L132 WeakPolarHBondContact CB-O 3.45Å; S74-L132 PolarHBondContact OG-O 3.29Å
75	D	93.7	Very high	91.2	Very high	113 Å²	113	56.9 Å²	56.9	60%	0.604	32%	0.319	S	S	*	.	H	α-helix	trans	-63.8	-32.4	175.2	-75.2	-29.2	0	0	0	112.1	S78 A79 Q133	D75-S78 WeakPolarHBondContact O-CB 3.27Å; D75-S78 PolarHBondContact O-N 3.34Å; D75-A79 WeakPolarHBondContact O-CB 3.26Å; D75-A79 PolarHBondContact O-N 3.02Å; D75-Q133 VanDerWaalsContact C-OE1 3.31Å; D75-Q133 HydrophobicContact CB-CB 4.01Å
76	Y	93.9	Very high	89.7	Confident	84 Å²	84	67.4 Å²	67.4	33%	0.329	36%	0.359	S	S	.	.	H	α-helix	trans	-62.1	-51.3	175.3	173.6	-90.3	0	0	0	110.8	S74 S78 A79 L80 M95 L132	S74-Y76 VanDerWaalsContact C-N 3.25Å; S74-Y76 PolarHBondContact O-N 3.13Å; S74-Y76 PolarHBondContact OG-N 3.13Å; Y76-S78 VanDerWaalsContact C-N 3.33Å; Y76-S78 PolarHBondContact O-N 3.13Å; Y76-A79 PolarHBondContact O-N 3.11Å; Y76-L80 HydrophobicContact CE1-CD2 4.19Å; Y76-L80 WeakPolarHBondContact O-CB 3.16Å; Y76-L80 PolarHBondContact O-N 3.23Å; Y76-M95 HydrophobicContact CE1-CE 4.07Å; Y76-L132 WeakPolarHBondContact CB-O 3.21Å; Y76-L132 HydrophobicContact CD1-CD2 3.68Å; Y76-L132 HydrophobicContact CE1-CD2 3.87Å; Y76-L132 HydrophobicContact CG-CD2 4.25Å
77	F	94	Very high	88.2	Confident	2 Å²	2	70.6 Å²	70.6	1%	0.009	37%	0.374	C	S	.	.	H	α-helix	trans	-68.6	-34.1	178.9	-72.7	-54.6	0	0	0	111.8	L56 L70 S74 L80 F81 M95 L132	L56-F77 HydrophobicContact CD1-CE1 4.15Å; L56-F77 HydrophobicContact CD1-CZ 3.88Å; L56-F77 HydrophobicContact CD2-CE1 4.2Å; L70-F77 HydrophobicContact CB-CB 3.94Å; L70-F77 HydrophobicContact CB-CD2 3.85Å; L70-F77 HydrophobicContact CB-CG 3.89Å; L70-F77 HydrophobicContact CD2-CD2 4.29Å; L70-F77 HydrophobicContact CD2-CE2 4.22Å; L70-F77 HydrophobicContact CG-CD2 4.45Å; S74-F77 PolarHBondContact O-N 2.96Å; S74-F77 WeakPolarHBondContact OG-CD2 3.41Å; S74-F77 PolarHBondContact OG-N 3.3Å; S74-F77 VanDerWaalsContact OG-N 3.13Å; F77-L80 HydrophobicContact CD1-CD2 4.15Å; F77-L80 PolarHBondContact O-N 2.63Å; F77-F81 HydrophobicContact CB-CD2 4.16Å; F77-F81 HydrophobicContact CB-CE2 3.83Å; F77-F81 AromaticContact CD1-CE2 3.97Å; F77-F81 HydrophobicContact CD1-CE2 3.97Å; F77-F81 AromaticContact CD1-CZ 3.89Å; F77-F81 HydrophobicContact CD1-CZ 3.89Å; F77-F81 HydrophobicContact CG-CE2 4.18Å; F77-F81 WeakPolarHBondContact O-CB 3.49Å; F77-F81 WeakPolarHBondContact O-CD2 3.29Å; F77-F81 VanDerWaalsContact O-CG 3.29Å; F77-F81 WeakPolarHBondContact O-CG 3.39Å; F77-F81 PolarHBondContact O-N 3.25Å; F77-M95 HydrophobicContact CE1-CE 4.14Å; F77-M95 HydrophobicContact CZ-CE 4.14Å; F77-L132 HydrophobicContact CE2-CD1 4.06Å; F77-L132 HydrophobicContact CE2-CD2 4.22Å; F77-L132 HydrophobicContact CZ-CD1 4.16Å; F77-L132 HydrophobicContact CZ-CD2 3.92Å
78	S	93.2	Very high	87.1	Confident	41 Å²	41	69.3 Å²	69.3	29%	0.287	37%	0.37	S	S	.	.	H	α-helix	trans	-58.1	-51.3	171.6	-170.1	0	0	0	0	111	A71 S74 D75 Y76 L80 T82	A71-S78 WeakPolarHBondContact O-CB 3.43Å; S74-S78 WeakPolarHBondContact O-CB 3.44Å; S74-S78 PolarHBondContact O-N 2.93Å; D75-S78 WeakPolarHBondContact O-CB 3.27Å; D75-S78 PolarHBondContact O-N 3.34Å; Y76-S78 VanDerWaalsContact C-N 3.33Å; Y76-S78 PolarHBondContact O-N 3.13Å; S78-L80 PolarHBondContact O-N 2.86Å; S78-T82 VanDerWaalsContact O-CB 3.31Å; S78-T82 WeakPolarHBondContact O-CB 3.23Å; S78-T82 WeakPolarHBondContact O-CG2 3.47Å; S78-T82 PolarHBondContact O-N 3.1Å; S78-T82 PolarHBondContact O-OG1 2.68Å
79	A	92.1	Very high	86.2	Confident	57 Å²	57	70 Å²	70	47%	0.471	38%	0.375	S	S	.	.	H	α-helix	trans	-61.7	-46	176.1	0	0	0	0	0	111.8	D75 Y76 F81 T82 S83	D75-A79 WeakPolarHBondContact O-CB 3.26Å; D75-A79 PolarHBondContact O-N 3.02Å; Y76-A79 PolarHBondContact O-N 3.11Å; A79-F81 PolarHBondContact O-N 3.14Å; A79-T82 PolarHBondContact O-OG1 3.41Å; A79-S83 VanDerWaalsContact O-CB 3.27Å; A79-S83 WeakPolarHBondContact O-CB 3.2Å; A79-S83 PolarHBondContact O-N 2.97Å
80	L	91.3	Very high	85.6	Confident	26 Å²	26	71.4 Å²	71.4	14%	0.136	39%	0.385	C	S	.	.	H	α-helix	trans	-57.8	-49.7	179.9	-176.3	66.9	0	0	0	111.7	Y76 F77 S78 S83 E87 S88 V93	Y76-L80 HydrophobicContact CE1-CD2 4.19Å; Y76-L80 WeakPolarHBondContact O-CB 3.16Å; Y76-L80 PolarHBondContact O-N 3.23Å; F77-L80 HydrophobicContact CD1-CD2 4.15Å; F77-L80 PolarHBondContact O-N 2.63Å; S78-L80 PolarHBondContact O-N 2.86Å; L80-S83 PolarHBondContact O-OG 2.82Å; L80-E87 HydrophobicContact CD1-CB 3.82Å; L80-E87 HydrophobicContact CD1-CG 4.47Å; L80-S88 WeakPolarHBondContact O-CB 3.44Å; L80-V93 HydrophobicContact CD2-CG1 3.95Å
81	F	91	Very high	85.1	Confident	27 Å²	27	74.9 Å²	74.9	12%	0.118	41%	0.414	C	S	.	.	H	α-helix	trans	-82.4	-21.9	-174	-59.1	-34.4	0	0	0	114.2	V54 R67 L70 A71 F77 A79 V93	V54-F81 HydrophobicContact CG1-CZ 4.32Å; V54-F81 HydrophobicContact CG2-CE1 4.24Å; V54-F81 HydrophobicContact CG2-CZ 4.24Å; R67-F81 HydrophobicContact CB-CD2 3.88Å; R67-F81 HydrophobicContact CB-CE2 4.13Å; R67-F81 HydrophobicContact CB-CG 4.28Å; R67-F81 HydrophobicContact CG-CD1 4.25Å; R67-F81 HydrophobicContact CG-CD2 4.04Å; R67-F81 HydrophobicContact CG-CE1 4.23Å; R67-F81 HydrophobicContact CG-CE2 4.04Å; R67-F81 HydrophobicContact CG-CG 4.15Å; R67-F81 HydrophobicContact CG-CZ 4.14Å; L70-F81 HydrophobicContact CB-CE2 3.92Å; L70-F81 HydrophobicContact CD1-CE2 4.17Å; L70-F81 HydrophobicContact CD1-CZ 4.29Å; A71-F81 HydrophobicContact CB-CD2 4.22Å; F77-F81 HydrophobicContact CB-CD2 4.16Å; F77-F81 HydrophobicContact CB-CE2 3.83Å; F77-F81 AromaticContact CD1-CE2 3.97Å; F77-F81 HydrophobicContact CD1-CE2 3.97Å; F77-F81 AromaticContact CD1-CZ 3.89Å; F77-F81 HydrophobicContact CD1-CZ 3.89Å; F77-F81 HydrophobicContact CG-CE2 4.18Å; F77-F81 WeakPolarHBondContact O-CB 3.49Å; F77-F81 WeakPolarHBondContact O-CD2 3.29Å; F77-F81 VanDerWaalsContact O-CG 3.29Å; F77-F81 WeakPolarHBondContact O-CG 3.39Å; F77-F81 PolarHBondContact O-N 3.25Å; A79-F81 PolarHBondContact O-N 3.14Å; F81-V93 HydrophobicContact CE1-CG2 4.37Å
82	T	88.1	Confident	85	Confident	106 Å²	106	78.1 Å²	78.1	65%	0.65	43%	0.425	S	S	*	.	H	α-helix	trans	-90.7	-8.8	172.1	62.8	0	0	0	0	113.7	S78 A79	S78-T82 VanDerWaalsContact O-CB 3.31Å; S78-T82 WeakPolarHBondContact O-CB 3.23Å; S78-T82 WeakPolarHBondContact O-CG2 3.47Å; S78-T82 PolarHBondContact O-N 3.1Å; S78-T82 PolarHBondContact O-OG1 2.68Å; A79-T82 PolarHBondContact O-OG1 3.41Å
83	S	82.9	Confident	84.8	Confident	31 Å²	31	74.5 Å²	74.5	22%	0.217	39%	0.394	C	S	.	.	S	Bend	trans	-64.3	155.4	176.9	76.3	0	0	0	0	111.6	A79 L80 M85 S88	A79-S83 VanDerWaalsContact O-CB 3.27Å; A79-S83 WeakPolarHBondContact O-CB 3.2Å; A79-S83 PolarHBondContact O-N 2.97Å; L80-S83 PolarHBondContact O-OG 2.82Å; S83-M85 PolarHBondContact O-N 3.25Å; S83-M85 PolarHBondContact OG-N 3.49Å; S83-S88 WeakPolarHBondContact O-CB 3.44Å; S83-S88 PolarHBondContact O-OG 2.87Å
84	K	73.5	Confident	84.7	Confident	217 Å²	217	78.5 Å²	78.5	94%	0.943	41%	0.405	S	S	*	.	S	Bend	trans	-87.1	17.5	170.7	-65	-175.4	-179.9	177.9	0	112.6
85	M	69.7	Low	84.4	Confident	132 Å²	132	78.9 Å²	78.9	65%	0.65	41%	0.407	S	S	*	.	S	Bend	trans	-87	172.8	-176.9	-59.3	-168.5	179.1	0	0	111.5	S83 E87 S88	S83-M85 PolarHBondContact O-N 3.25Å; S83-M85 PolarHBondContact OG-N 3.49Å; M85-E87 VanDerWaalsContact C-N 3.27Å; M85-E87 VanDerWaalsContact CB-OE2 3.28Å; M85-E87 WeakPolarHBondContact CB-OE2 3.47Å; M85-E87 PolarHBondContact O-N 2.71Å; M85-S88 PolarHBondContact O-N 3.35Å; M85-S88 PolarHBondContact O-OG 2.98Å
86	R	64.4	Low	84.2	Confident	221 Å²	221	80 Å²	80	83%	0.834	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-67.7	-33.6	-171.3	-168.6	177.8	-176.3	-178.6	-0.7	111.7	S88 N89 S90	R86-S88 PolarHBondContact O-N 3.14Å; R86-N89 PolarHBondContact O-N 3.25Å; R86-S90 PolarHBondContact O-N 3.08Å
87	E	65.4	Low	83.9	Confident	90 Å²	90	83.6 Å²	83.6	42%	0.421	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-62	-31	178.8	-60.9	74.8	-164.7	0	0	111.2	R67 L80 M85 N89 S90	R67-E87 PolarHBondContact NH2-O 2.82Å; L80-E87 HydrophobicContact CD1-CB 3.82Å; L80-E87 HydrophobicContact CD1-CG 4.47Å; M85-E87 VanDerWaalsContact C-N 3.27Å; M85-E87 VanDerWaalsContact CB-OE2 3.28Å; M85-E87 WeakPolarHBondContact CB-OE2 3.47Å; M85-E87 PolarHBondContact O-N 2.71Å; E87-N89 PolarHBondContact O-N 2.62Å; E87-N89 VanDerWaalsContact O-N 3.15Å; E87-S90 PolarHBondContact O-N 2.8Å; E87-S90 VanDerWaalsContact O-N 3.14Å
88	S	71.5	Confident	83.8	Confident	10 Å²	10	84 Å²	84	7%	0.07	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-65.6	-21	-179.5	75.2	0	0	0	0	113.5	R67 L80 S83 M85 R86	R67-S88 VanDerWaalsContact CZ-O 3.29Å; R67-S88 PolarHBondContact NH1-O 3.43Å; R67-S88 PolarHBondContact NH2-O 3.41Å; L80-S88 WeakPolarHBondContact O-CB 3.44Å; S83-S88 WeakPolarHBondContact O-CB 3.44Å; S83-S88 PolarHBondContact O-OG 2.87Å; M85-S88 PolarHBondContact O-N 3.35Å; M85-S88 PolarHBondContact O-OG 2.98Å; R86-S88 PolarHBondContact O-N 3.14Å
89	N	74.6	Confident	83.8	Confident	145 Å²	145	85.6 Å²	85.6	78%	0.775	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-113.7	4	175.1	-64.5	-58.3	0	0	0	113.6	R86 E87	R86-N89 PolarHBondContact O-N 3.25Å; E87-N89 PolarHBondContact O-N 2.62Å; E87-N89 VanDerWaalsContact O-N 3.15Å
90	S	81.6	Confident	83.9	Confident	45 Å²	45	83 Å²	83	32%	0.315	42%	0.416	S	S	.	.			trans	-75.9	132.1	-178.9	-166.6	0	0	0	0	111.2	R67 R86 E87 E92	R67-S90 PolarHBondContact NH2-O 3.4Å; R86-S90 PolarHBondContact O-N 3.08Å; E87-S90 PolarHBondContact O-N 2.8Å; E87-S90 VanDerWaalsContact O-N 3.14Å; S90-E92 VanDerWaalsContact CB-O 3.29Å; S90-E92 WeakPolarHBondContact CB-O 3.29Å; S90-E92 PolarHBondContact O-N 3Å; S90-E92 PolarHBondContact OG-N 3.06Å; S90-E92 PolarHBondContact OG-O 3.39Å
91	A	86.5	Confident	84	Confident	72 Å²	72	82.5 Å²	82.5	60%	0.595	42%	0.416	S	S	*	.	S	Bend	trans	-68.2	-24.8	172.8	0	0	0	0	0	111.9	C55	C55-A91 PolarHBondContact N-O 3.24Å
92	E	91.5	Very high	84.2	Confident	93 Å²	93	81.3 Å²	81.3	44%	0.435	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.2	178.3	-66.9	-179.7	-169.1	0	0	110.1	C55 V57 R62 S90	C55-E92 HydrophobicContact CB-CG 4.11Å; C55-E92 CarbonylContact O-C 3.59Å; C55-E92 VanDerWaalsContact O-CA 3.27Å; C55-E92 WeakPolarHBondContact O-CA 3.35Å; V57-E92 HydrophobicContact CG2-CB 4.42Å; R62-E92 IonicContact CZ-OE1 2.68Å; R62-E92 IonicContact NH1-OE1 3.97Å; R62-E92 PolarHBondContact NH1-OE1 3.11Å; R62-E92 IonicContact NH2-OE1 3.66Å; R62-E92 PolarHBondContact NH2-OE1 2.89Å; S90-E92 VanDerWaalsContact CB-O 3.29Å; S90-E92 WeakPolarHBondContact CB-O 3.29Å; S90-E92 PolarHBondContact O-N 3Å; S90-E92 PolarHBondContact OG-N 3.06Å; S90-E92 PolarHBondContact OG-O 3.39Å
93	V	91.6	Very high	84.6	Confident	9 Å²	9	76.3 Å²	76.3	6%	0.055	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	115.5	177.2	178.1	0	0	0	0	108.1	V54 C55 L56 V57 L80 F81 M95	V54-V93 HydrophobicContact CG2-CG2 3.86Å; C55-V93 PolarHBondContact O-N 2.93Å; L56-V93 CarbonylContact C-O 3.58Å; L56-V93 WeakPolarHBondContact CA-O 3.14Å; L56-V93 HydrophobicContact CD2-CB 3.93Å; L56-V93 HydrophobicContact CD2-CG1 4.35Å; V57-V93 PolarHBondContact N-O 3.16Å; L80-V93 HydrophobicContact CD2-CG1 3.95Å; F81-V93 HydrophobicContact CE1-CG2 4.37Å; V93-M95 HydrophobicContact CG1-SD 3.95Å
94	E	91.5	Very high	85.2	Confident	126 Å²	126	77.9 Å²	77.9	59%	0.589	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	122.6	178.4	-164	171.6	-171.5	0	0	110	V57 F96	V57-E94 WeakPolarHBondContact O-CA 3.37Å; E94-F96 HydrophobicContact CB-CE2 4.08Å; E94-F96 HydrophobicContact CB-CZ 3.98Å; E94-F96 VanDerWaalsContact CD-CE1 3.4Å; E94-F96 HydrophobicContact CG-CD1 4.39Å; E94-F96 HydrophobicContact CG-CE1 3.77Å; E94-F96 HydrophobicContact CG-CE2 4.09Å; E94-F96 HydrophobicContact CG-CZ 3.61Å; E94-F96 WeakPolarHBondContact OE1-CE1 3.47Å; E94-F96 VanDerWaalsContact OE2-CZ 3.29Å; E94-F96 WeakPolarHBondContact OE2-CZ 3.45Å
95	M	91	Very high	86.3	Confident	10 Å²	10	69.6 Å²	69.6	5%	0.049	35%	0.352	C	S	.	.			trans	-102.9	100.9	-178.3	-60.8	-61.1	-77	0	0	108.2	L56 V57 A58 Y76 F77 V93 I98 L103 L132	L56-M95 HydrophobicContact CB-CG 4.37Å; V57-M95 PolarHBondContact O-N 3.38Å; A58-M95 HydrophobicContact CB-CB 4.28Å; Y76-M95 HydrophobicContact CE1-CE 4.07Å; F77-M95 HydrophobicContact CE1-CE 4.14Å; F77-M95 HydrophobicContact CZ-CE 4.14Å; V93-M95 HydrophobicContact CG1-SD 3.95Å; M95-I98 HydrophobicContact CB-CD1 4.32Å; M95-I98 HydrophobicContact CE-CD1 3.77Å; M95-L103 HydrophobicContact CB-CD2 4.03Å; M95-L103 HydrophobicContact CE-CD1 4.41Å; M95-L103 HydrophobicContact CG-CD2 3.8Å; M95-L132 HydrophobicContact CE-CD2 3.51Å
96	F	88.3	Confident	87.6	Confident	137 Å²	137	63.4 Å²	63.4	60%	0.601	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	145.8	-179.3	-60.2	-78.2	0	0	0	111.1	E94 I98	E94-F96 HydrophobicContact CB-CE2 4.08Å; E94-F96 HydrophobicContact CB-CZ 3.98Å; E94-F96 VanDerWaalsContact CD-CE1 3.4Å; E94-F96 HydrophobicContact CG-CD1 4.39Å; E94-F96 HydrophobicContact CG-CE1 3.77Å; E94-F96 HydrophobicContact CG-CE2 4.09Å; E94-F96 HydrophobicContact CG-CZ 3.61Å; E94-F96 WeakPolarHBondContact OE1-CE1 3.47Å; E94-F96 VanDerWaalsContact OE2-CZ 3.29Å; E94-F96 WeakPolarHBondContact OE2-CZ 3.45Å; F96-I98 PolarHBondContact O-N 3.29Å
97	N	87.5	Confident	89.1	Confident	159 Å²	159	52.9 Å²	52.9	85%	0.85	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	25.6	176.4	-53.8	-27.5	0	0	0	115.4
98	I	92.8	Very high	90.5	Very high	10 Å²	10	51.5 Å²	51.5	5%	0.051	28%	0.277	C	S	.	.			trans	-121.7	128.3	176.3	-65	170.4	0	0	0	108.6	M95 F96 A100 L103 V128 L132	M95-I98 HydrophobicContact CB-CD1 4.32Å; M95-I98 HydrophobicContact CE-CD1 3.77Å; F96-I98 PolarHBondContact O-N 3.29Å; I98-A100 PolarHBondContact O-N 3.46Å; I98-L103 HydrophobicContact CG2-CB 3.79Å; I98-L103 HydrophobicContact CG2-CD1 4.48Å; I98-V128 HydrophobicContact CD1-CG1 4.1Å; I98-V128 HydrophobicContact CG1-CG1 4.16Å; I98-V128 HydrophobicContact CG1-CG2 4.32Å; I98-V128 HydrophobicContact CG2-CB 4.46Å; I98-V128 HydrophobicContact CG2-CG1 3.6Å; I98-V128 HydrophobicContact CG2-CG2 3.91Å; I98-L132 HydrophobicContact CD1-CD2 4.43Å
99	E	92.2	Very high	91.7	Very high	75 Å²	75	52.6 Å²	52.6	35%	0.35	28%	0.28	S	S	.	.			trans	-64.5	132.9	173.3	-166.5	-157	143.1	0	0	110.1	G101 I102 L103 E124	E99-G101 VanDerWaalsContact C-N 3.26Å; E99-G101 PolarHBondContact O-N 3.46Å; E99-I102 HydrophobicContact CB-CB 4.44Å; E99-I102 HydrophobicContact CB-CG1 4.16Å; E99-I102 PolarHBondContact O-N 3.44Å; E99-L103 PolarHBondContact O-N 2.78Å; E99-L103 VanDerWaalsContact O-N 3.08Å; E99-E124 VanDerWaalsContact OE2-OE2 3.13Å
100	A	94.2	Very high	92.7	Very high	3 Å²	3	46.7 Å²	46.7	3%	0.025	25%	0.249	C	C	.	.	H	α-helix	trans	-58.8	-35.8	-177	0	0	0	0	0	113.7	A58 E59 R61 I98 E104	A58-A100 HydrophobicContact CB-CB 4.19Å; A58-A100 WeakPolarHBondContact O-CB 3.3Å; E59-A100 HydrophobicContact CB-CB 4.36Å; E59-A100 PolarHBondContact OE2-N 3.27Å; E59-A100 VanDerWaalsContact OE2-N 3.13Å; R61-A100 HydrophobicContact CB-CB 3.69Å; R61-A100 HydrophobicContact CG-CB 4.37Å; I98-A100 PolarHBondContact O-N 3.46Å; A100-E104 WeakPolarHBondContact O-CB 3.39Å; A100-E104 PolarHBondContact O-N 3.28Å
101	G	94.4	Very high	93.4	Very high	14 Å²	14	45 Å²	45	14%	0.144	24%	0.236	C	C	.	.	H	α-helix	trans	-69.6	-38.2	-179.4	0	0	0	0	0	113.6	E99 T105	E99-G101 VanDerWaalsContact C-N 3.26Å; E99-G101 PolarHBondContact O-N 3.46Å; G101-T105 PolarHBondContact O-N 3.49Å; G101-T105 VanDerWaalsContact O-N 3.09Å; G101-T105 PolarHBondContact O-OG1 2.91Å
102	I	95.4	Very high	93.7	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-69.1	-44.9	176.1	-61.4	-62.4	0	0	0	110.2	E99 E104 T105 L106 R121 E124 L125 V128	E99-I102 HydrophobicContact CB-CB 4.44Å; E99-I102 HydrophobicContact CB-CG1 4.16Å; E99-I102 PolarHBondContact O-N 3.44Å; I102-E104 VanDerWaalsContact C-N 3.33Å; I102-E104 PolarHBondContact O-N 3.42Å; I102-T105 WeakPolarHBondContact O-CB 3.49Å; I102-T105 PolarHBondContact O-N 3.3Å; I102-T105 VanDerWaalsContact O-N 3.16Å; I102-L106 HydrophobicContact CG2-CD1 4.07Å; I102-L106 WeakPolarHBondContact O-CG 3.42Å; I102-L106 PolarHBondContact O-N 3.45Å; I102-R121 HydrophobicContact CD1-CB 4.32Å; I102-E124 HydrophobicContact CD1-CB 4.16Å; I102-E124 HydrophobicContact CG1-CB 4.12Å; I102-L125 HydrophobicContact CD1-CB 4.49Å; I102-L125 HydrophobicContact CG2-CD1 3.86Å; I102-V128 HydrophobicContact CB-CG2 4.48Å; I102-V128 HydrophobicContact CG2-CB 3.74Å; I102-V128 HydrophobicContact CG2-CG1 4.18Å; I102-V128 HydrophobicContact CG2-CG2 3.73Å
103	L	96.4	Very high	93.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-45.7	175.8	-176.2	60.9	0	0	0	111.8	L56 A58 I63 M95 I98 E99 T105 L106 V107 L132	L56-L103 HydrophobicContact CB-CD2 4.1Å; L56-L103 HydrophobicContact CD1-CD1 4.21Å; L56-L103 HydrophobicContact CD1-CD2 4.33Å; L56-L103 HydrophobicContact CD1-CG 4.44Å; A58-L103 HydrophobicContact CB-CD2 3.68Å; I63-L103 HydrophobicContact CD1-CB 4.22Å; I63-L103 HydrophobicContact CD1-CD2 4.01Å; I63-L103 HydrophobicContact CD1-CG 3.99Å; M95-L103 HydrophobicContact CB-CD2 4.03Å; M95-L103 HydrophobicContact CE-CD1 4.41Å; M95-L103 HydrophobicContact CG-CD2 3.8Å; I98-L103 HydrophobicContact CG2-CB 3.79Å; I98-L103 HydrophobicContact CG2-CD1 4.48Å; E99-L103 PolarHBondContact O-N 2.78Å; E99-L103 VanDerWaalsContact O-N 3.08Å; L103-T105 VanDerWaalsContact C-N 3.3Å; L103-T105 PolarHBondContact O-N 3.13Å; L103-L106 PolarHBondContact O-N 3.39Å; L103-V107 HydrophobicContact CD1-CG2 4.43Å; L103-V107 HydrophobicContact CG-CG2 4.47Å; L103-V107 VanDerWaalsContact O-CG2 3.29Å; L103-V107 WeakPolarHBondContact O-CG2 3.29Å; L103-V107 PolarHBondContact O-N 3.35Å; L103-L132 HydrophobicContact CD1-CD1 3.88Å
104	E	95.3	Very high	93.8	Very high	64 Å²	64	50.8 Å²	50.8	30%	0.299	26%	0.262	S	S	.	.	H	α-helix	trans	-59.5	-41.7	177.1	-172.3	167.5	-161	0	0	111.4	R61 I63 A100 I102 L106 V107 I108	R61-E104 IonicContact CZ-OE2 3.72Å; R61-E104 IonicContact NH1-OE2 3.3Å; R61-E104 PolarHBondContact NH1-OE2 3.4Å; I63-E104 HydrophobicContact CD1-CB 3.81Å; I63-E104 HydrophobicContact CD1-CG 4.49Å; I63-E104 HydrophobicContact CG1-CB 4.46Å; A100-E104 WeakPolarHBondContact O-CB 3.39Å; A100-E104 PolarHBondContact O-N 3.28Å; I102-E104 VanDerWaalsContact C-N 3.33Å; I102-E104 PolarHBondContact O-N 3.42Å; E104-L106 PolarHBondContact O-N 2.99Å; E104-V107 PolarHBondContact O-N 2.9Å; E104-I108 HydrophobicContact CG-CD1 4.18Å; E104-I108 WeakPolarHBondContact O-CB 3.38Å; E104-I108 VanDerWaalsContact O-CG1 3.23Å; E104-I108 WeakPolarHBondContact O-CG1 3.5Å; E104-I108 PolarHBondContact O-N 2.8Å
105	T	95.9	Very high	93.9	Very high	43 Å²	43	46.6 Å²	46.6	26%	0.264	24%	0.243	S	C	.	.	H	α-helix	trans	-62.6	-43.1	176.3	-55.7	0	0	0	0	112	G101 I102 L103 I108 Y109 I115 L125	G101-T105 PolarHBondContact O-N 3.49Å; G101-T105 VanDerWaalsContact O-N 3.09Å; G101-T105 PolarHBondContact O-OG1 2.91Å; I102-T105 WeakPolarHBondContact O-CB 3.49Å; I102-T105 PolarHBondContact O-N 3.3Å; I102-T105 VanDerWaalsContact O-N 3.16Å; L103-T105 VanDerWaalsContact C-N 3.3Å; L103-T105 PolarHBondContact O-N 3.13Å; T105-I108 PolarHBondContact O-N 3.38Å; T105-Y109 PolarHBondContact O-N 2.84Å; T105-I115 HydrophobicContact CG2-CD1 4.21Å; T105-I115 HydrophobicContact CG2-CG1 4.01Å; T105-L125 HydrophobicContact CG2-CD1 4.49Å
106	L	97.1	Very high	94.1	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-70.6	-35.5	178	-67.6	168.7	0	0	0	112.3	I102 L103 E104 Y109 C110 I115 L125 V128 A129 L132 L134 V137	I102-L106 HydrophobicContact CG2-CD1 4.07Å; I102-L106 WeakPolarHBondContact O-CG 3.42Å; I102-L106 PolarHBondContact O-N 3.45Å; L103-L106 PolarHBondContact O-N 3.39Å; E104-L106 PolarHBondContact O-N 2.99Å; L106-Y109 WeakPolarHBondContact O-CB 2.96Å; L106-Y109 PolarHBondContact O-N 2.76Å; L106-C110 PolarHBondContact O-N 3.38Å; L106-C110 VanDerWaalsContact O-N 3.14Å; L106-C110 PolarHBondContact O-SG 3.3Å; L106-I115 HydrophobicContact CD2-CD1 3.82Å; L106-L125 HydrophobicContact CD1-CD1 4.23Å; L106-L125 HydrophobicContact CD2-CD1 3.61Å; L106-L125 HydrophobicContact CD2-CG 4.44Å; L106-L125 HydrophobicContact CG-CD1 3.76Å; L106-V128 HydrophobicContact CD1-CB 3.8Å; L106-V128 HydrophobicContact CD1-CG1 3.42Å; L106-V128 VanDerWaalsContact CD1-CG1 3.42Å; L106-A129 HydrophobicContact CD1-CB 4.47Å; L106-A129 HydrophobicContact CD2-CB 4.07Å; L106-L132 HydrophobicContact CD1-CD1 4.04Å; L106-L134 HydrophobicContact CB-CD1 4.05Å; L106-L134 HydrophobicContact CD1-CD1 4.47Å; L106-L134 HydrophobicContact CD2-CD1 3.8Å; L106-L134 HydrophobicContact CG-CD1 4.32Å; L106-V137 HydrophobicContact CD2-CG1 3.92Å; L106-V137 HydrophobicContact CD2-CG2 4.49Å
107	V	96.2	Very high	94.4	Very high	1 Å²	1	48 Å²	48	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-44.8	171.8	170.8	0	0	0	0	110.3	Y46 L56 I63 A65 L70 L103 E104 Y109 C110 Y111	Y46-V107 HydrophobicContact CE2-CG1 4.03Å; L56-V107 HydrophobicContact CD1-CG2 3.79Å; I63-V107 HydrophobicContact CG2-CB 4.39Å; I63-V107 HydrophobicContact CG2-CG1 4.1Å; I63-V107 HydrophobicContact CG2-CG2 4.35Å; A65-V107 HydrophobicContact CB-CG1 4.11Å; L70-V107 HydrophobicContact CD2-CG1 4.39Å; L70-V107 HydrophobicContact CD2-CG2 4.21Å; L103-V107 HydrophobicContact CD1-CG2 4.43Å; L103-V107 HydrophobicContact CG-CG2 4.47Å; L103-V107 VanDerWaalsContact O-CG2 3.29Å; L103-V107 WeakPolarHBondContact O-CG2 3.29Å; L103-V107 PolarHBondContact O-N 3.35Å; E104-V107 PolarHBondContact O-N 2.9Å; V107-Y109 VanDerWaalsContact C-N 3.32Å; V107-Y109 PolarHBondContact O-N 3.25Å; V107-C110 WeakPolarHBondContact O-CB 3.16Å; V107-C110 PolarHBondContact O-N 2.98Å; V107-C110 VanDerWaalsContact O-N 3.16Å; V107-Y111 HydrophobicContact CG1-CD2 4.48Å; V107-Y111 HydrophobicContact CG1-CE2 3.91Å; V107-Y111 WeakPolarHBondContact O-CD2 3.36Å
108	I	95.4	Very high	94.6	Very high	61 Å²	61	42.5 Å²	42.5	31%	0.313	23%	0.229	S	C	.	.	H	α-helix	trans	-59.2	-44.4	174.8	-70.5	165.8	0	0	0	110.1	Y46 E104 T105 C110 Y111 Y112	Y46-I108 HydrophobicContact CE1-CG1 4.16Å; E104-I108 HydrophobicContact CG-CD1 4.18Å; E104-I108 WeakPolarHBondContact O-CB 3.38Å; E104-I108 VanDerWaalsContact O-CG1 3.23Å; E104-I108 WeakPolarHBondContact O-CG1 3.5Å; E104-I108 PolarHBondContact O-N 2.8Å; T105-I108 PolarHBondContact O-N 3.38Å; I108-C110 VanDerWaalsContact C-N 3.25Å; I108-C110 PolarHBondContact O-N 3.28Å; I108-Y111 PolarHBondContact O-N 3.15Å; I108-Y112 HydrophobicContact CG2-CD2 3.57Å; I108-Y112 HydrophobicContact CG2-CE2 4.01Å; I108-Y112 HydrophobicContact CG2-CG 4.31Å; I108-Y112 WeakPolarHBondContact O-CD2 3.41Å; I108-Y112 PolarHBondContact O-N 2.97Å
109	Y	96.5	Very high	94.3	Very high	33 Å²	33	48 Å²	48	13%	0.129	25%	0.254	C	S	.	.	H	α-helix	trans	-53.1	-42.1	175	167.6	-98.2	0	0	0	112.2	T105 L106 V107 Y111 Y112 G113 I115 L134 V137	T105-Y109 PolarHBondContact O-N 2.84Å; L106-Y109 WeakPolarHBondContact O-CB 2.96Å; L106-Y109 PolarHBondContact O-N 2.76Å; V107-Y109 VanDerWaalsContact C-N 3.32Å; V107-Y109 PolarHBondContact O-N 3.25Å; Y109-Y111 PolarHBondContact O-N 3.44Å; Y109-Y111 VanDerWaalsContact O-N 3.08Å; Y109-Y112 PolarHBondContact O-N 3.38Å; Y109-G113 WeakPolarHBondContact O-CA 3.39Å; Y109-G113 PolarHBondContact O-N 3.29Å; Y109-I115 HydrophobicContact CD2-CB 3.87Å; Y109-I115 HydrophobicContact CD2-CG2 4.29Å; Y109-I115 HydrophobicContact CG-CB 4.47Å; Y109-I115 HydrophobicContact CG-CD1 4.37Å; Y109-L134 HydrophobicContact CE1-CD2 4.35Å; Y109-V137 HydrophobicContact CD1-CG2 3.54Å; Y109-V137 HydrophobicContact CD2-CG2 4.14Å; Y109-V137 HydrophobicContact CE1-CG2 3.24Å; Y109-V137 HydrophobicContact CE2-CG2 3.86Å; Y109-V137 HydrophobicContact CG-CG2 3.97Å; Y109-V137 VanDerWaalsContact CZ-CG2 3.4Å
110	C	96.1	Very high	94.2	Very high	20 Å²	20	49.1 Å²	49.1	14%	0.135	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-20.9	177.1	-61.1	0	0	0	0	114.2	V69 L70 A73 L106 V107 I108	V69-C110 HydrophobicContact CG1-CB 4.09Å; V69-C110 VanDerWaalsContact CG1-O 3.27Å; V69-C110 WeakPolarHBondContact CG1-O 3.39Å; L70-C110 HydrophobicContact CD2-CB 4.2Å; A73-C110 HydrophobicContact CB-CB 3.87Å; A73-C110 VanDerWaalsContact CB-SG 3.57Å; L106-C110 PolarHBondContact O-N 3.38Å; L106-C110 VanDerWaalsContact O-N 3.14Å; L106-C110 PolarHBondContact O-SG 3.3Å; V107-C110 WeakPolarHBondContact O-CB 3.16Å; V107-C110 PolarHBondContact O-N 2.98Å; V107-C110 VanDerWaalsContact O-N 3.16Å; I108-C110 VanDerWaalsContact C-N 3.25Å; I108-C110 PolarHBondContact O-N 3.28Å
111	Y	94.9	Very high	94.1	Very high	11 Å²	11	55 Å²	55	4%	0.043	29%	0.292	C	S	.	.	H	α-helix	trans	-98.1	-35.1	175.1	-66.1	-86.7	0	0	0	113.5	M42 Q43 Y46 A65 H66 V69 V107 I108 Y109	M42-Y111 HydrophobicContact CB-CD1 4.4Å; Q43-Y111 VanDerWaalsContact CG-O 3.24Å; Q43-Y111 WeakPolarHBondContact CG-O 3.45Å; Q43-Y111 PolarHBondContact NE2-O 3.31Å; Y46-Y111 HydrophobicContact CD1-CD2 4.13Å; Y46-Y111 HydrophobicContact CD1-CE2 4.36Å; Y46-Y111 HydrophobicContact CD1-CG 4.42Å; Y46-Y111 AromaticContact CD2-CD2 3.98Å; Y46-Y111 HydrophobicContact CD2-CD2 3.98Å; Y46-Y111 HydrophobicContact CD2-CE1 4.13Å; Y46-Y111 AromaticContact CD2-CE2 3.37Å; Y46-Y111 HydrophobicContact CD2-CE2 3.37Å; Y46-Y111 AromaticContact CD2-CZ 3.46Å; Y46-Y111 VanDerWaalsContact CD2-CZ 3.46Å; Y46-Y111 HydrophobicContact CE1-CD2 4.44Å; Y46-Y111 HydrophobicContact CE2-CD2 4.27Å; Y46-Y111 AromaticContact CE2-CE2 3.68Å; Y46-Y111 HydrophobicContact CE2-CE2 3.68Å; Y46-Y111 HydrophobicContact CG-CD1 4.23Å; Y46-Y111 AromaticContact CG-CD2 3.89Å; Y46-Y111 HydrophobicContact CG-CD2 3.89Å; Y46-Y111 HydrophobicContact CG-CE1 4.08Å; Y46-Y111 AromaticContact CG-CE2 3.75Å; Y46-Y111 HydrophobicContact CG-CE2 3.75Å; Y46-Y111 HydrophobicContact CG-CG 4.15Å; Y46-Y111 AromaticContact CG-CZ 3.84Å; A65-Y111 WeakPolarHBondContact CA-OH 3.37Å; H66-Y111 PolarHBondContact N-OH 2.86Å; H66-Y111 AromaticContact ND1-CE1 3.58Å; H66-Y111 AromaticContact ND1-CZ 3.63Å; H66-Y111 PolarHBondContact ND1-OH 3.35Å; V69-Y111 HydrophobicContact CB-CE1 3.96Å; V69-Y111 HydrophobicContact CG1-CD1 3.86Å; V69-Y111 HydrophobicContact CG1-CD2 4.44Å; V69-Y111 HydrophobicContact CG1-CE1 3.73Å; V69-Y111 HydrophobicContact CG1-CE2 4.31Å; V69-Y111 HydrophobicContact CG1-CG 4.21Å; V69-Y111 HydrophobicContact CG2-CD1 4.34Å; V69-Y111 HydrophobicContact CG2-CE1 3.78Å; V107-Y111 HydrophobicContact CG1-CD2 4.48Å; V107-Y111 HydrophobicContact CG1-CE2 3.91Å; V107-Y111 WeakPolarHBondContact O-CD2 3.36Å; I108-Y111 PolarHBondContact O-N 3.15Å; Y109-Y111 PolarHBondContact O-N 3.44Å; Y109-Y111 VanDerWaalsContact O-N 3.08Å
112	Y	92.9	Very high	94	Very high	83 Å²	83	54.4 Å²	54.4	33%	0.325	29%	0.285	S	S	.	.	H	α-helix	trans	-96.5	-26.9	-171.4	-75.7	-95	0	0	0	113.4	Q43 E47 I108 Y109 E114	Q43-Y112 HydrophobicContact CG-CD1 4.4Å; Q43-Y112 HydrophobicContact CG-CD2 4.49Å; Q43-Y112 HydrophobicContact CG-CE1 4.35Å; Q43-Y112 HydrophobicContact CG-CE2 4.44Å; Q43-Y112 HydrophobicContact CG-CG 4.49Å; E47-Y112 PolarHBondContact OE1-OH 3.48Å; I108-Y112 HydrophobicContact CG2-CD2 3.57Å; I108-Y112 HydrophobicContact CG2-CE2 4.01Å; I108-Y112 HydrophobicContact CG2-CG 4.31Å; I108-Y112 WeakPolarHBondContact O-CD2 3.41Å; I108-Y112 PolarHBondContact O-N 2.97Å; Y109-Y112 PolarHBondContact O-N 3.38Å; Y112-E114 PolarHBondContact O-N 3.1Å
113	G	92.4	Very high	93.8	Very high	56 Å²	56	58.8 Å²	58.8	58%	0.577	31%	0.306	S	S	*	.	S	Bend	trans	68.8	12	-171.8	0	0	0	0	0	113.5	Y109	Y109-G113 WeakPolarHBondContact O-CA 3.39Å; Y109-G113 PolarHBondContact O-N 3.29Å
114	E	92.9	Very high	93.6	Very high	155 Å²	155	63.1 Å²	63.1	72%	0.724	33%	0.326	S	S	*	.			trans	-128.2	139.4	-178.3	-66.6	-179.2	-176.8	0	0	109.3	Y112	Y112-E114 PolarHBondContact O-N 3.1Å
115	I	95.1	Very high	93.6	Very high	38 Å²	38	60.3 Å²	60.3	20%	0.195	31%	0.313	C	S	.	.			trans	-139.9	132.4	178.7	-160.7	162	0	0	0	110.5	T105 L106 Y109 L117 L125 V137	T105-I115 HydrophobicContact CG2-CD1 4.21Å; T105-I115 HydrophobicContact CG2-CG1 4.01Å; L106-I115 HydrophobicContact CD2-CD1 3.82Å; Y109-I115 HydrophobicContact CD2-CB 3.87Å; Y109-I115 HydrophobicContact CD2-CG2 4.29Å; Y109-I115 HydrophobicContact CG-CB 4.47Å; Y109-I115 HydrophobicContact CG-CD1 4.37Å; I115-L117 HydrophobicContact CG2-CD2 4.03Å; I115-L117 HydrophobicContact CG2-CG 4.47Å; I115-L125 HydrophobicContact CD1-CD1 3.93Å; I115-L125 HydrophobicContact CD1-CD2 3.81Å; I115-L125 HydrophobicContact CD1-CG 4.26Å; I115-L125 HydrophobicContact CG1-CD2 4.14Å; I115-V137 HydrophobicContact CD1-CG1 3.84Å; I115-V137 HydrophobicContact CD1-CG2 4.44Å
116	L	94	Very high	93.4	Very high	141 Å²	141	58.3 Å²	58.3	74%	0.738	30%	0.301	S	S	*	.			trans	-86.1	115.7	177.4	178.4	65.5	0	0	0	109.4	T118	L116-T118 HydrophobicContact CD2-CG2 4.28Å; L116-T118 HydrophobicContact CG-CG2 4.08Å
117	L	94.1	Very high	93.2	Very high	35 Å²	35	60.6 Å²	60.6	18%	0.183	31%	0.313	C	S	.	.			trans	-94	129.4	175.3	-54.9	-177.6	0	0	0	110.4	I115 L125 A140 C141 F144	I115-L117 HydrophobicContact CG2-CD2 4.03Å; I115-L117 HydrophobicContact CG2-CG 4.47Å; L117-L125 HydrophobicContact CD2-CD2 3.47Å; L117-L125 VanDerWaalsContact CD2-CD2 3.47Å; L117-A140 HydrophobicContact CD1-CB 4.14Å; L117-A140 WeakPolarHBondContact CD1-O 3.47Å; L117-C141 VanDerWaalsContact CD2-SG 3.55Å; L117-F144 HydrophobicContact CB-CD2 3.95Å; L117-F144 HydrophobicContact CB-CE2 4.25Å; L117-F144 HydrophobicContact CB-CG 4.1Å; L117-F144 HydrophobicContact CD1-CB 3.78Å; L117-F144 HydrophobicContact CD1-CD2 4.4Å; L117-F144 HydrophobicContact CD1-CG 4.21Å
118	T	92.6	Very high	93.2	Very high	45 Å²	45	60.8 Å²	60.8	28%	0.276	31%	0.314	S	S	.	.			trans	-133.5	144.5	178.5	63.1	0	0	0	0	110.1	L116 S120 R121 V122	L116-T118 HydrophobicContact CD2-CG2 4.28Å; L116-T118 HydrophobicContact CG-CG2 4.08Å; T118-S120 PolarHBondContact O-N 2.58Å; T118-S120 VanDerWaalsContact O-N 3.11Å; T118-R121 PolarHBondContact O-N 3Å; T118-V122 WeakPolarHBondContact O-CB 3.33Å; T118-V122 PolarHBondContact O-N 2.96Å
119	E	86.9	Confident	93.1	Very high	126 Å²	126	57.9 Å²	57.9	59%	0.589	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-34.8	179.7	-65.7	179.4	177.5	0	0	112.8	R121 F144 R148	E119-R121 VanDerWaalsContact C-N 3.33Å; E119-R121 PolarHBondContact O-N 3.01Å; E119-F144 HydrophobicContact CG-CE1 4.09Å; E119-F144 HydrophobicContact CG-CZ 4.03Å; E119-R148 WeakPolarHBondContact OE1-CD 3.28Å; E119-R148 IonicContact OE1-CZ 2.64Å; E119-R148 IonicContact OE1-NE 3.25Å; E119-R148 IonicContact OE1-NH1 3.16Å; E119-R148 PolarHBondContact OE1-NH1 3.36Å
120	S	89.7	Confident	93	Very high	97 Å²	97	58.2 Å²	58.2	68%	0.678	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-9.6	-177.8	61	0	0	0	0	115.6	T118	T118-S120 PolarHBondContact O-N 2.58Å; T118-S120 VanDerWaalsContact O-N 3.11Å
121	R	90.8	Very high	92.8	Very high	126 Å²	126	61.1 Å²	61.1	48%	0.475	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.3	-10.9	-173.4	-70.1	-176.3	172.5	-178.2	-4.3	114.4	I102 T118 E119 E123 E124 L125	I102-R121 HydrophobicContact CD1-CB 4.32Å; T118-R121 PolarHBondContact O-N 3Å; E119-R121 VanDerWaalsContact C-N 3.33Å; E119-R121 PolarHBondContact O-N 3.01Å; R121-E123 VanDerWaalsContact C-N 3.27Å; R121-E123 PolarHBondContact O-N 3.38Å; R121-E124 PolarHBondContact O-N 3.46Å; R121-L125 VanDerWaalsContact O-CB 3.23Å; R121-L125 WeakPolarHBondContact O-CB 3.43Å; R121-L125 PolarHBondContact O-N 3.5Å
122	V	92.7	Very high	92.7	Very high	2 Å²	2	60.7 Å²	60.7	1%	0.012	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-32.8	-171.5	62.6	0	0	0	0	112.8	T118 L126 C141 F144 L145	T118-V122 WeakPolarHBondContact O-CB 3.33Å; T118-V122 PolarHBondContact O-N 2.96Å; V122-L126 VanDerWaalsContact O-CB 3.27Å; V122-L126 WeakPolarHBondContact O-CB 3.38Å; V122-L126 PolarHBondContact O-N 2.88Å; V122-C141 HydrophobicContact CG2-CB 3.85Å; V122-F144 HydrophobicContact CB-CD1 4.15Å; V122-F144 HydrophobicContact CB-CE1 4.34Å; V122-F144 HydrophobicContact CG1-CD1 4.12Å; V122-F144 HydrophobicContact CG1-CE1 4.14Å; V122-F144 HydrophobicContact CG2-CD1 3.87Å; V122-L145 HydrophobicContact CG1-CD2 3.57Å; V122-L145 HydrophobicContact CG1-CG 4.16Å; V122-L145 HydrophobicContact CG2-CD2 4.45Å; V122-L145 HydrophobicContact CG2-CG 4.12Å
123	E	91.3	Very high	92.8	Very high	95 Å²	95	61.6 Å²	61.6	44%	0.444	32%	0.324	S	S	.	.	H	α-helix	trans	-67.6	-52.8	177.4	-65.5	-179.7	-170.7	0	0	111.3	R121 L125 L126 D127 F160	R121-E123 VanDerWaalsContact C-N 3.27Å; R121-E123 PolarHBondContact O-N 3.38Å; E123-L125 VanDerWaalsContact C-N 3.26Å; E123-L125 PolarHBondContact O-N 3.36Å; E123-L126 PolarHBondContact O-N 3.44Å; E123-D127 PolarHBondContact O-N 3.41Å; E123-F160 HydrophobicContact CB-CE2 4.23Å; E123-F160 HydrophobicContact CB-CZ 4.22Å; E123-F160 WeakPolarHBondContact O-CZ 3.43Å
124	E	92.4	Very high	92.9	Very high	92 Å²	92	59.1 Å²	59.1	43%	0.43	30%	0.297	S	S	.	.	H	α-helix	trans	-59.5	-39	175.6	-63.7	166.2	-161.3	0	0	111.5	E99 I102 R121 V128	E99-E124 VanDerWaalsContact OE2-OE2 3.13Å; I102-E124 HydrophobicContact CD1-CB 4.16Å; I102-E124 HydrophobicContact CG1-CB 4.12Å; R121-E124 PolarHBondContact O-N 3.46Å; E124-V128 VanDerWaalsContact O-CG2 3.32Å; E124-V128 WeakPolarHBondContact O-CG2 3.4Å; E124-V128 PolarHBondContact O-N 2.88Å; E124-V128 VanDerWaalsContact O-N 3.12Å
125	L	95	Very high	92.9	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-65.1	-43.3	176.4	-172.8	65.7	0	0	0	112.3	I102 T105 L106 I115 L117 R121 E123 A129	I102-L125 HydrophobicContact CD1-CB 4.49Å; I102-L125 HydrophobicContact CG2-CD1 3.86Å; T105-L125 HydrophobicContact CG2-CD1 4.49Å; L106-L125 HydrophobicContact CD1-CD1 4.23Å; L106-L125 HydrophobicContact CD2-CD1 3.61Å; L106-L125 HydrophobicContact CD2-CG 4.44Å; L106-L125 HydrophobicContact CG-CD1 3.76Å; I115-L125 HydrophobicContact CD1-CD1 3.93Å; I115-L125 HydrophobicContact CD1-CD2 3.81Å; I115-L125 HydrophobicContact CD1-CG 4.26Å; I115-L125 HydrophobicContact CG1-CD2 4.14Å; L117-L125 HydrophobicContact CD2-CD2 3.47Å; L117-L125 VanDerWaalsContact CD2-CD2 3.47Å; R121-L125 VanDerWaalsContact O-CB 3.23Å; R121-L125 WeakPolarHBondContact O-CB 3.43Å; R121-L125 PolarHBondContact O-N 3.5Å; E123-L125 VanDerWaalsContact C-N 3.26Å; E123-L125 PolarHBondContact O-N 3.36Å; L125-A129 WeakPolarHBondContact O-CB 3.32Å; L125-A129 PolarHBondContact O-N 3.41Å
126	L	93.4	Very high	92.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.1	-41.3	178.6	-173.8	150.3	0	0	0	111.3	V122 E123 A129 S130 C141 L145 F160 H164	V122-L126 VanDerWaalsContact O-CB 3.27Å; V122-L126 WeakPolarHBondContact O-CB 3.38Å; V122-L126 PolarHBondContact O-N 2.88Å; E123-L126 PolarHBondContact O-N 3.44Å; L126-A129 PolarHBondContact O-N 3.36Å; L126-S130 VanDerWaalsContact O-CB 3.28Å; L126-S130 WeakPolarHBondContact O-CB 3.11Å; L126-S130 PolarHBondContact O-N 3.3Å; L126-C141 HydrophobicContact CB-CB 3.83Å; L126-C141 HydrophobicContact CD1-CB 3.61Å; L126-C141 HydrophobicContact CG-CB 4.04Å; L126-L145 HydrophobicContact CD1-CD1 4.2Å; L126-F160 HydrophobicContact CB-CE1 3.9Å; L126-F160 HydrophobicContact CB-CZ 3.95Å; L126-F160 HydrophobicContact CD1-CE1 4.03Å; L126-F160 HydrophobicContact CD2-CD1 4.31Å; L126-F160 HydrophobicContact CD2-CE1 3.26Å; L126-F160 HydrophobicContact CD2-CZ 3.56Å; L126-F160 HydrophobicContact CG-CE1 3.88Å; L126-F160 HydrophobicContact CG-CZ 4.26Å; L126-H164 HydrophobicContact CD2-CB 4.08Å
127	D	92.9	Very high	92.9	Very high	51 Å²	51	53.6 Å²	53.6	27%	0.273	28%	0.28	S	S	.	.	H	α-helix	trans	-58.1	-55.1	176.2	175.5	28.3	0	0	0	110.5	E123 A129 S130 Q131 F160 H164	E123-D127 PolarHBondContact O-N 3.41Å; D127-A129 PolarHBondContact O-N 2.86Å; D127-S130 WeakPolarHBondContact O-CB 3.21Å; D127-S130 PolarHBondContact O-N 3.17Å; D127-Q131 VanDerWaalsContact CG-NE2 3.28Å; D127-Q131 WeakPolarHBondContact O-CG 3.4Å; D127-Q131 PolarHBondContact O-N 3.33Å; D127-Q131 PolarHBondContact OD1-NE2 3.12Å; D127-Q131 PolarHBondContact OD2-NE2 3.33Å; D127-F160 HydrophobicContact CB-CE2 4.43Å; D127-F160 HydrophobicContact CB-CZ 4.4Å; D127-H164 WeakPolarHBondContact CB-NE2 3.28Å; D127-H164 IonicContact OD1-CD2 3.74Å; D127-H164 IonicContact OD1-NE2 2.63Å; D127-H164 PolarHBondContact OD1-NE2 2.87Å
128	V	94.6	Very high	92.9	Very high	5 Å²	5	53.1 Å²	53.1	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-65.8	-39.4	-179.5	-177	0	0	0	0	111.5	I98 I102 L106 E124 S130 Q131 L132	I98-V128 HydrophobicContact CD1-CG1 4.1Å; I98-V128 HydrophobicContact CG1-CG1 4.16Å; I98-V128 HydrophobicContact CG1-CG2 4.32Å; I98-V128 HydrophobicContact CG2-CB 4.46Å; I98-V128 HydrophobicContact CG2-CG1 3.6Å; I98-V128 HydrophobicContact CG2-CG2 3.91Å; I102-V128 HydrophobicContact CB-CG2 4.48Å; I102-V128 HydrophobicContact CG2-CB 3.74Å; I102-V128 HydrophobicContact CG2-CG1 4.18Å; I102-V128 HydrophobicContact CG2-CG2 3.73Å; L106-V128 HydrophobicContact CD1-CB 3.8Å; L106-V128 HydrophobicContact CD1-CG1 3.42Å; L106-V128 VanDerWaalsContact CD1-CG1 3.42Å; E124-V128 VanDerWaalsContact O-CG2 3.32Å; E124-V128 WeakPolarHBondContact O-CG2 3.4Å; E124-V128 PolarHBondContact O-N 2.88Å; E124-V128 VanDerWaalsContact O-N 3.12Å; V128-S130 VanDerWaalsContact C-N 3.29Å; V128-S130 PolarHBondContact O-N 2.99Å; V128-Q131 PolarHBondContact O-N 3.45Å; V128-L132 HydrophobicContact CG1-CD1 3.87Å; V128-L132 HydrophobicContact CG1-CG 4.16Å; V128-L132 WeakPolarHBondContact O-CB 3.46Å; V128-L132 VanDerWaalsContact O-CG 3.28Å; V128-L132 WeakPolarHBondContact O-CG 3.27Å; V128-L132 PolarHBondContact O-N 3.24Å
129	A	94.9	Very high	93	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.9	-37.8	175.9	0	0	0	0	0	112.2	L106 L125 L126 D127 L132 Q133 L134 V137 V138	L106-A129 HydrophobicContact CD1-CB 4.47Å; L106-A129 HydrophobicContact CD2-CB 4.07Å; L125-A129 WeakPolarHBondContact O-CB 3.32Å; L125-A129 PolarHBondContact O-N 3.41Å; L126-A129 PolarHBondContact O-N 3.36Å; D127-A129 PolarHBondContact O-N 2.86Å; A129-L132 CarbonylContact O-C 3.45Å; A129-L132 PolarHBondContact O-N 2.95Å; A129-Q133 PolarHBondContact O-N 2.83Å; A129-L134 HydrophobicContact CB-CB 4.3Å; A129-L134 PolarHBondContact O-N 3.14Å; A129-V137 HydrophobicContact CB-CB 4Å; A129-V137 HydrophobicContact CB-CG1 3.7Å; A129-V138 HydrophobicContact CB-CG2 3.98Å
130	S	92.6	Very high	93.4	Very high	39 Å²	39	53.5 Å²	53.5	27%	0.273	28%	0.283	S	S	.	.	H	α-helix	trans	-66.1	-46.4	174.9	-173.4	0	0	0	0	111.3	L126 D127 V128 L132 Q133	L126-S130 VanDerWaalsContact O-CB 3.28Å; L126-S130 WeakPolarHBondContact O-CB 3.11Å; L126-S130 PolarHBondContact O-N 3.3Å; D127-S130 WeakPolarHBondContact O-CB 3.21Å; D127-S130 PolarHBondContact O-N 3.17Å; V128-S130 VanDerWaalsContact C-N 3.29Å; V128-S130 PolarHBondContact O-N 2.99Å; S130-L132 VanDerWaalsContact C-N 3.3Å; S130-L132 PolarHBondContact O-N 2.79Å; S130-Q133 PolarHBondContact O-N 3.33Å
131	Q	92.5	Very high	93.6	Very high	82 Å²	82	48.9 Å²	48.9	38%	0.383	25%	0.251	S	S	.	.	H	α-helix	trans	-59.6	-39.7	175.3	-68	179.2	40.5	0	0	112.4	D127 V128 Q133	D127-Q131 VanDerWaalsContact CG-NE2 3.28Å; D127-Q131 WeakPolarHBondContact O-CG 3.4Å; D127-Q131 PolarHBondContact O-N 3.33Å; D127-Q131 PolarHBondContact OD1-NE2 3.12Å; D127-Q131 PolarHBondContact OD2-NE2 3.33Å; V128-Q131 PolarHBondContact O-N 3.45Å; Q131-Q133 VanDerWaalsContact C-N 3.27Å; Q131-Q133 PolarHBondContact O-N 2.81Å
132	L	94	Very high	93.8	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	5	177.3	-59.9	-177.2	0	0	0	113.4	S74 Y76 F77 M95 I98 L103 L106 V128 A129 S130 L134	S74-L132 WeakPolarHBondContact CB-O 3.45Å; S74-L132 PolarHBondContact OG-O 3.29Å; Y76-L132 WeakPolarHBondContact CB-O 3.21Å; Y76-L132 HydrophobicContact CD1-CD2 3.68Å; Y76-L132 HydrophobicContact CE1-CD2 3.87Å; Y76-L132 HydrophobicContact CG-CD2 4.25Å; F77-L132 HydrophobicContact CE2-CD1 4.06Å; F77-L132 HydrophobicContact CE2-CD2 4.22Å; F77-L132 HydrophobicContact CZ-CD1 4.16Å; F77-L132 HydrophobicContact CZ-CD2 3.92Å; M95-L132 HydrophobicContact CE-CD2 3.51Å; I98-L132 HydrophobicContact CD1-CD2 4.43Å; L103-L132 HydrophobicContact CD1-CD1 3.88Å; L106-L132 HydrophobicContact CD1-CD1 4.04Å; V128-L132 HydrophobicContact CG1-CD1 3.87Å; V128-L132 HydrophobicContact CG1-CG 4.16Å; V128-L132 WeakPolarHBondContact O-CB 3.46Å; V128-L132 VanDerWaalsContact O-CG 3.28Å; V128-L132 WeakPolarHBondContact O-CG 3.27Å; V128-L132 PolarHBondContact O-N 3.24Å; A129-L132 CarbonylContact O-C 3.45Å; A129-L132 PolarHBondContact O-N 2.95Å; S130-L132 VanDerWaalsContact C-N 3.3Å; S130-L132 PolarHBondContact O-N 2.79Å; L132-L134 VanDerWaalsContact C-N 3.29Å; L132-L134 HydrophobicContact CB-CD1 4.24Å; L132-L134 HydrophobicContact CB-CG 4.32Å; L132-L134 PolarHBondContact O-N 2.92Å
133	Q	94.4	Very high	93.9	Very high	102 Å²	102	47.5 Å²	47.5	48%	0.477	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	42.1	178.1	-55.4	-175.2	-51.3	0	0	113.5	D75 A129 S130 Q131 A135	D75-Q133 VanDerWaalsContact C-OE1 3.31Å; D75-Q133 HydrophobicContact CB-CB 4.01Å; A129-Q133 PolarHBondContact O-N 2.83Å; S130-Q133 PolarHBondContact O-N 3.33Å; Q131-Q133 VanDerWaalsContact C-N 3.27Å; Q131-Q133 PolarHBondContact O-N 2.81Å; Q133-A135 PolarHBondContact O-N 3.47Å
134	L	95	Very high	94.1	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.021	24%	0.239	C	C	.	.			trans	-92.3	78.5	174.5	-71	169	0	0	0	109.9	A73 L106 Y109 A129 L132 E136 V137 V138	A73-L134 HydrophobicContact CB-CD2 4.43Å; A73-L134 VanDerWaalsContact O-CD2 3.3Å; A73-L134 WeakPolarHBondContact O-CD2 3.33Å; L106-L134 HydrophobicContact CB-CD1 4.05Å; L106-L134 HydrophobicContact CD1-CD1 4.47Å; L106-L134 HydrophobicContact CD2-CD1 3.8Å; L106-L134 HydrophobicContact CG-CD1 4.32Å; Y109-L134 HydrophobicContact CE1-CD2 4.35Å; A129-L134 HydrophobicContact CB-CB 4.3Å; A129-L134 PolarHBondContact O-N 3.14Å; L132-L134 VanDerWaalsContact C-N 3.29Å; L132-L134 HydrophobicContact CB-CD1 4.24Å; L132-L134 HydrophobicContact CB-CG 4.32Å; L132-L134 PolarHBondContact O-N 2.92Å; L134-E136 PolarHBondContact O-N 3.5Å; L134-V137 HydrophobicContact CB-CB 4.13Å; L134-V137 HydrophobicContact CB-CG2 4.08Å; L134-V137 PolarHBondContact O-N 3.32Å; L134-V137 VanDerWaalsContact O-N 3.1Å; L134-V138 WeakPolarHBondContact O-CG2 3.31Å; L134-V138 PolarHBondContact O-N 3.33Å
135	A	92.8	Very high	94.2	Very high	75 Å²	75	40.9 Å²	40.9	62%	0.62	22%	0.22	S	C	*	.	H	α-helix	trans	-56.1	-44.6	-169.5	0	0	0	0	0	114.4	Q133 V137 V138 E139	Q133-A135 PolarHBondContact O-N 3.47Å; A135-V137 VanDerWaalsContact C-N 3.3Å; A135-V137 PolarHBondContact O-N 3.3Å; A135-V138 PolarHBondContact O-N 3.44Å; A135-E139 PolarHBondContact O-N 3.4Å
136	E	94.3	Very high	94.2	Very high	142 Å²	142	44.5 Å²	44.5	66%	0.664	24%	0.236	S	C	*	.	H	α-helix	trans	-64.5	-33.7	179.5	-67.9	-173.6	-148.1	0	0	112.5	L134 A140	L134-E136 PolarHBondContact O-N 3.5Å; E136-A140 WeakPolarHBondContact O-CB 3.27Å; E136-A140 PolarHBondContact O-N 2.67Å
137	V	95.2	Very high	94.3	Very high	1 Å²	1	51 Å²	51	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-71.1	-41.6	175.5	-178.1	0	0	0	0	110.4	L106 Y109 I115 A129 L134 A135 E139 A140 C141	L106-V137 HydrophobicContact CD2-CG1 3.92Å; L106-V137 HydrophobicContact CD2-CG2 4.49Å; Y109-V137 HydrophobicContact CD1-CG2 3.54Å; Y109-V137 HydrophobicContact CD2-CG2 4.14Å; Y109-V137 HydrophobicContact CE1-CG2 3.24Å; Y109-V137 HydrophobicContact CE2-CG2 3.86Å; Y109-V137 HydrophobicContact CG-CG2 3.97Å; Y109-V137 VanDerWaalsContact CZ-CG2 3.4Å; I115-V137 HydrophobicContact CD1-CG1 3.84Å; I115-V137 HydrophobicContact CD1-CG2 4.44Å; A129-V137 HydrophobicContact CB-CB 4Å; A129-V137 HydrophobicContact CB-CG1 3.7Å; L134-V137 HydrophobicContact CB-CB 4.13Å; L134-V137 HydrophobicContact CB-CG2 4.08Å; L134-V137 PolarHBondContact O-N 3.32Å; L134-V137 VanDerWaalsContact O-N 3.1Å; A135-V137 VanDerWaalsContact C-N 3.3Å; A135-V137 PolarHBondContact O-N 3.3Å; V137-E139 VanDerWaalsContact C-N 3.3Å; V137-E139 PolarHBondContact O-N 2.85Å; V137-A140 PolarHBondContact O-N 3.5Å; V137-C141 WeakPolarHBondContact O-CB 3.45Å; V137-C141 PolarHBondContact O-N 2.85Å; V137-C141 PolarHBondContact O-SG 2.96Å
138	V	93.8	Very high	94.3	Very high	24 Å²	24	54.8 Å²	54.8	15%	0.145	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-42.6	175.3	174.8	0	0	0	0	110.7	A129 L134 A135 S142	A129-V138 HydrophobicContact CB-CG2 3.98Å; L134-V138 WeakPolarHBondContact O-CG2 3.31Å; L134-V138 PolarHBondContact O-N 3.33Å; A135-V138 PolarHBondContact O-N 3.44Å; V138-S142 VanDerWaalsContact O-CB 3.26Å; V138-S142 WeakPolarHBondContact O-CB 3.36Å; V138-S142 PolarHBondContact O-N 3.38Å; V138-S142 PolarHBondContact O-OG 3.03Å
139	E	93.5	Very high	94.3	Very high	139 Å²	139	55.7 Å²	55.7	65%	0.65	28%	0.281	S	S	*	.	H	α-helix	trans	-64	-46.7	175.9	-173.3	172.9	-171.6	0	0	111.8	A135 V137 C141 S142 E143	A135-E139 PolarHBondContact O-N 3.4Å; V137-E139 VanDerWaalsContact C-N 3.3Å; V137-E139 PolarHBondContact O-N 2.85Å; E139-C141 PolarHBondContact O-N 3.2Å; E139-S142 WeakPolarHBondContact O-CB 3.35Å; E139-S142 PolarHBondContact O-N 3.5Å; E139-E143 PolarHBondContact O-N 2.9Å
140	A	95.2	Very high	94.4	Very high	40 Å²	40	60.3 Å²	60.3	33%	0.331	30%	0.303	S	S	.	.	H	α-helix	trans	-62.3	-44.6	178.2	0	0	0	0	0	112.5	L117 E136 V137 S142 E143 F144	L117-A140 HydrophobicContact CD1-CB 4.14Å; L117-A140 WeakPolarHBondContact CD1-O 3.47Å; E136-A140 WeakPolarHBondContact O-CB 3.27Å; E136-A140 PolarHBondContact O-N 2.67Å; V137-A140 PolarHBondContact O-N 3.5Å; A140-S142 VanDerWaalsContact C-N 3.33Å; A140-S142 PolarHBondContact O-N 2.94Å; A140-E143 PolarHBondContact O-N 3.21Å; A140-F144 WeakPolarHBondContact O-CB 3.26Å; A140-F144 PolarHBondContact O-N 3.43Å
141	C	94.8	Very high	94.6	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.6	-40.2	174.3	-71.5	0	0	0	0	111.5	L117 V122 L126 V137 E139 F144 L145	L117-C141 VanDerWaalsContact CD2-SG 3.55Å; V122-C141 HydrophobicContact CG2-CB 3.85Å; L126-C141 HydrophobicContact CB-CB 3.83Å; L126-C141 HydrophobicContact CD1-CB 3.61Å; L126-C141 HydrophobicContact CG-CB 4.04Å; V137-C141 WeakPolarHBondContact O-CB 3.45Å; V137-C141 PolarHBondContact O-N 2.85Å; V137-C141 PolarHBondContact O-SG 2.96Å; E139-C141 PolarHBondContact O-N 3.2Å; C141-F144 PolarHBondContact O-N 3.18Å; C141-L145 WeakPolarHBondContact O-CG 3.49Å; C141-L145 PolarHBondContact O-N 3.06Å
142	S	94.5	Very high	94.8	Very high	17 Å²	17	57.1 Å²	57.1	12%	0.119	29%	0.289	C	S	.	.	H	α-helix	trans	-64.2	-44.7	178	-65.1	0	0	0	0	112.1	V138 E139 A140 F144 L145 K146	V138-S142 VanDerWaalsContact O-CB 3.26Å; V138-S142 WeakPolarHBondContact O-CB 3.36Å; V138-S142 PolarHBondContact O-N 3.38Å; V138-S142 PolarHBondContact O-OG 3.03Å; E139-S142 WeakPolarHBondContact O-CB 3.35Å; E139-S142 PolarHBondContact O-N 3.5Å; A140-S142 VanDerWaalsContact C-N 3.33Å; A140-S142 PolarHBondContact O-N 2.94Å; S142-F144 VanDerWaalsContact C-N 3.34Å; S142-L145 PolarHBondContact O-N 2.89Å; S142-K146 WeakPolarHBondContact O-CB 3.28Å; S142-K146 PolarHBondContact O-N 3.03Å
143	E	94.7	Very high	94.8	Very high	82 Å²	82	59 Å²	59	38%	0.383	30%	0.3	S	S	.	.	H	α-helix	trans	-66.6	-37.1	177.3	-174.4	54.4	-145.2	0	0	111.4	E139 A140 K146 Q147	E139-E143 PolarHBondContact O-N 2.9Å; A140-E143 PolarHBondContact O-N 3.21Å; E143-K146 PolarHBondContact O-N 3.46Å; E143-K146 IonicContact OE2-NZ 3.42Å; E143-Q147 WeakPolarHBondContact O-CG 3.44Å; E143-Q147 PolarHBondContact O-N 3.47Å; E143-Q147 PolarHBondContact OE1-NE2 2.75Å
144	F	95.2	Very high	94.9	Very high	41 Å²	41	54.2 Å²	54.2	18%	0.18	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-47	173.3	-177.1	-90.9	0	0	0	112.3	L117 E119 V122 A140 C141 S142 Q147 R148	L117-F144 HydrophobicContact CB-CD2 3.95Å; L117-F144 HydrophobicContact CB-CE2 4.25Å; L117-F144 HydrophobicContact CB-CG 4.1Å; L117-F144 HydrophobicContact CD1-CB 3.78Å; L117-F144 HydrophobicContact CD1-CD2 4.4Å; L117-F144 HydrophobicContact CD1-CG 4.21Å; E119-F144 HydrophobicContact CG-CE1 4.09Å; E119-F144 HydrophobicContact CG-CZ 4.03Å; V122-F144 HydrophobicContact CB-CD1 4.15Å; V122-F144 HydrophobicContact CB-CE1 4.34Å; V122-F144 HydrophobicContact CG1-CD1 4.12Å; V122-F144 HydrophobicContact CG1-CE1 4.14Å; V122-F144 HydrophobicContact CG2-CD1 3.87Å; A140-F144 WeakPolarHBondContact O-CB 3.26Å; A140-F144 PolarHBondContact O-N 3.43Å; C141-F144 PolarHBondContact O-N 3.18Å; S142-F144 VanDerWaalsContact C-N 3.34Å; F144-Q147 PolarHBondContact O-N 2.95Å; F144-R148 HydrophobicContact CE1-CG 4.34Å; F144-R148 WeakPolarHBondContact O-CG 3.39Å; F144-R148 PolarHBondContact O-N 2.91Å
145	L	95.3	Very high	95	Very high	7 Å²	7	54.2 Å²	54.2	4%	0.037	28%	0.277	C	S	.	.	H	α-helix	trans	-63.8	-40.7	177.7	-76.1	173.9	0	0	0	112.1	V122 L126 C141 S142 Q147 R148 L149 I157 F160 L169	V122-L145 HydrophobicContact CG1-CD2 3.57Å; V122-L145 HydrophobicContact CG1-CG 4.16Å; V122-L145 HydrophobicContact CG2-CD2 4.45Å; V122-L145 HydrophobicContact CG2-CG 4.12Å; L126-L145 HydrophobicContact CD1-CD1 4.2Å; C141-L145 WeakPolarHBondContact O-CG 3.49Å; C141-L145 PolarHBondContact O-N 3.06Å; S142-L145 PolarHBondContact O-N 2.89Å; L145-Q147 VanDerWaalsContact C-N 3.3Å; L145-Q147 PolarHBondContact O-N 3.37Å; L145-R148 CarbonylContact O-C 3.57Å; L145-R148 PolarHBondContact O-N 2.88Å; L145-L149 PolarHBondContact O-N 2.82Å; L145-I157 HydrophobicContact CB-CG2 4.42Å; L145-I157 HydrophobicContact CD2-CD1 4.15Å; L145-I157 HydrophobicContact CD2-CG1 4.28Å; L145-F160 HydrophobicContact CD1-CD1 4.42Å; L145-F160 HydrophobicContact CD1-CE1 4.33Å; L145-L169 HydrophobicContact CB-CD1 3.9Å; L145-L169 HydrophobicContact CB-CD2 4.11Å; L145-L169 HydrophobicContact CD1-CD2 3.77Å
146	K	94.8	Very high	95	Very high	82 Å²	82	51.9 Å²	51.9	36%	0.357	26%	0.26	S	S	.	.	H	α-helix	trans	-58.6	-40	177.1	-177.8	179.9	172.4	-167.2	0	112.6	S142 E143 R148 L169 A172	S142-K146 WeakPolarHBondContact O-CB 3.28Å; S142-K146 PolarHBondContact O-N 3.03Å; E143-K146 PolarHBondContact O-N 3.46Å; E143-K146 IonicContact OE2-NZ 3.42Å; K146-R148 PolarHBondContact O-N 2.96Å; K146-L169 HydrophobicContact CB-CD1 4.12Å; K146-A172 HydrophobicContact CD-CB 4.07Å; K146-A172 HydrophobicContact CG-CB 3.92Å
147	Q	94.4	Very high	95	Very high	137 Å²	137	45.3 Å²	45.3	64%	0.64	23%	0.23	S	C	*	.	H	α-helix	trans	-71.4	-13.8	176.8	-67.9	174.1	19	0	0	113.6	E143 F144 L145	E143-Q147 WeakPolarHBondContact O-CG 3.44Å; E143-Q147 PolarHBondContact O-N 3.47Å; E143-Q147 PolarHBondContact OE1-NE2 2.75Å; F144-Q147 PolarHBondContact O-N 2.95Å; L145-Q147 VanDerWaalsContact C-N 3.3Å; L145-Q147 PolarHBondContact O-N 3.37Å
148	R	93.3	Very high	95	Very high	130 Å²	130	46.2 Å²	46.2	49%	0.491	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	12	-177.1	-62.7	-65.8	175.5	174.3	-4.3	113.7	E119 F144 L145 K146 H150 N153	E119-R148 WeakPolarHBondContact OE1-CD 3.28Å; E119-R148 IonicContact OE1-CZ 2.64Å; E119-R148 IonicContact OE1-NE 3.25Å; E119-R148 IonicContact OE1-NH1 3.16Å; E119-R148 PolarHBondContact OE1-NH1 3.36Å; F144-R148 HydrophobicContact CE1-CG 4.34Å; F144-R148 WeakPolarHBondContact O-CG 3.39Å; F144-R148 PolarHBondContact O-N 2.91Å; L145-R148 CarbonylContact O-C 3.57Å; L145-R148 PolarHBondContact O-N 2.88Å; K146-R148 PolarHBondContact O-N 2.96Å; R148-H150 PolarHBondContact O-N 3.18Å; R148-N153 PolarHBondContact O-ND2 3.25Å
149	L	95.5	Very high	95	Very high	24 Å²	24	48.2 Å²	48.2	13%	0.126	25%	0.248	C	C	.	.			trans	-58.5	125.6	173.4	-73.9	168.8	0	0	0	110.8	L145 I157 A172 A173 Y176	L145-L149 PolarHBondContact O-N 2.82Å; L149-I157 HydrophobicContact CD2-CB 4.16Å; L149-I157 HydrophobicContact CD2-CD1 3.94Å; L149-I157 HydrophobicContact CD2-CG2 3.91Å; L149-A172 HydrophobicContact CD1-CB 4.33Å; L149-A173 HydrophobicContact CD2-CB 3.87Å; L149-Y176 HydrophobicContact CB-CD1 4.45Å; L149-Y176 HydrophobicContact CB-CD2 3.78Å; L149-Y176 HydrophobicContact CB-CE2 4.04Å; L149-Y176 HydrophobicContact CB-CG 4Å; L149-Y176 HydrophobicContact CD1-CD2 4.43Å; L149-Y176 HydrophobicContact CD1-CG 4.41Å
150	H	96.8	Very high	94.9	Very high	97 Å²	97	43 Å²	43	45%	0.449	22%	0.223	S	C	.	.			trans	-141.2	153.6	-179.1	-174.4	-98.7	0	0	0	108.4	R148 S152 N153 S154 Y176	R148-H150 PolarHBondContact O-N 3.18Å; H150-S152 PolarHBondContact ND1-N 3.31Å; H150-S152 PolarHBondContact ND1-OG 3.25Å; H150-S152 PolarHBondContact O-N 2.86Å; H150-N153 WeakPolarHBondContact CA-OD1 3.16Å; H150-N153 PolarHBondContact N-OD1 3.05Å; H150-N153 PolarHBondContact O-N 2.79Å; H150-N153 PolarHBondContact O-OD1 3.4Å; H150-S154 VanDerWaalsContact O-CB 3.26Å; H150-S154 WeakPolarHBondContact O-CB 3.49Å; H150-S154 PolarHBondContact O-N 2.88Å; H150-S154 PolarHBondContact O-OG 3.35Å; H150-Y176 WeakPolarHBondContact CA-OH 3.31Å
151	P	96.5	Very high	94.8	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.019	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-29.7	-177.1	-27.2	38.8	0	0	0	112.8	S154 Y176 E183 V184 Q187	P151-S154 PolarHBondContact O-OG 2.91Å; P151-Y176 WeakPolarHBondContact CD-OH 3.25Å; P151-Y176 HydrophobicContact CG-CE1 4.18Å; P151-E183 HydrophobicContact CB-CB 3.91Å; P151-E183 HydrophobicContact CG-CB 3.87Å; P151-V184 HydrophobicContact CB-CG2 3.95Å; P151-Q187 HydrophobicContact CB-CG 4.09Å; P151-Q187 WeakPolarHBondContact O-CG 3.2Å
152	S	95.9	Very high	94.7	Very high	50 Å²	50	46.5 Å²	46.5	35%	0.35	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-12.5	-178.3	71.4	0	0	0	0	116.1	H150 E189	H150-S152 PolarHBondContact ND1-N 3.31Å; H150-S152 PolarHBondContact ND1-OG 3.25Å; H150-S152 PolarHBondContact O-N 2.86Å; S152-E189 WeakPolarHBondContact O-CG 3.42Å
153	N	94.9	Very high	94.5	Very high	43 Å²	43	49.8 Å²	49.8	23%	0.23	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-8.9	-179.7	68	11.7	0	0	0	113.5	R148 H150 L155 G156 I157 E189	R148-N153 PolarHBondContact O-ND2 3.25Å; H150-N153 WeakPolarHBondContact CA-OD1 3.16Å; H150-N153 PolarHBondContact N-OD1 3.05Å; H150-N153 PolarHBondContact O-N 2.79Å; H150-N153 PolarHBondContact O-OD1 3.4Å; N153-L155 VanDerWaalsContact C-N 3.32Å; N153-L155 PolarHBondContact O-N 3.32Å; N153-G156 PolarHBondContact O-N 3Å; N153-I157 HydrophobicContact CB-CD1 4.24Å; N153-I157 WeakPolarHBondContact O-CG1 3.48Å; N153-I157 PolarHBondContact O-N 3.43Å; N153-E189 WeakPolarHBondContact CA-OE1 3.29Å; N153-E189 VanDerWaalsContact CA-OE2 3.28Å; N153-E189 WeakPolarHBondContact CA-OE2 3.19Å
154	S	96.5	Very high	94.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-30.1	-170.6	60.1	0	0	0	0	114	H150 P151 R158 V177 E189	H150-S154 VanDerWaalsContact O-CB 3.26Å; H150-S154 WeakPolarHBondContact O-CB 3.49Å; H150-S154 PolarHBondContact O-N 2.88Å; H150-S154 PolarHBondContact O-OG 3.35Å; P151-S154 PolarHBondContact O-OG 2.91Å; S154-R158 VanDerWaalsContact O-CB 3.25Å; S154-R158 WeakPolarHBondContact O-CB 3.34Å; S154-R158 PolarHBondContact O-N 2.97Å; S154-V177 WeakPolarHBondContact OG-CG2 3.23Å; S154-E189 PolarHBondContact N-OE2 3.37Å
155	L	96.2	Very high	93.8	Very high	5 Å²	5	48.7 Å²	48.7	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-76.9	-40.1	177.4	-69.9	169.2	0	0	0	110.5	N153 R158 S159 V177 V184 E189 F190 L193 L201	N153-L155 VanDerWaalsContact C-N 3.32Å; N153-L155 PolarHBondContact O-N 3.32Å; L155-R158 PolarHBondContact O-N 2.91Å; L155-S159 PolarHBondContact O-N 3.28Å; L155-V177 HydrophobicContact CD2-CG1 3.85Å; L155-V177 HydrophobicContact CD2-CG2 3.91Å; L155-V177 HydrophobicContact CG-CG2 4.33Å; L155-V184 HydrophobicContact CD1-CG1 3.58Å; L155-V184 HydrophobicContact CD2-CG1 4.26Å; L155-V184 HydrophobicContact CG-CG1 3.74Å; L155-E189 HydrophobicContact CB-CB 4.04Å; L155-E189 WeakPolarHBondContact CB-OE2 3.31Å; L155-E189 HydrophobicContact CD1-CB 4.08Å; L155-E189 PolarHBondContact N-OE2 3.47Å; L155-E189 VanDerWaalsContact N-OE2 3.07Å; L155-F190 HydrophobicContact CD1-CB 3.83Å; L155-F190 HydrophobicContact CD1-CD2 4.38Å; L155-L193 HydrophobicContact CD1-CD1 3.94Å; L155-L193 HydrophobicContact CD1-CG 4.35Å; L155-L193 HydrophobicContact CD2-CD1 4.19Å; L155-L201 HydrophobicContact CD2-CD2 4.22Å
156	G	93.7	Very high	93.6	Very high	26 Å²	26	49 Å²	49	27%	0.268	27%	0.269	S	S	.	.	H	α-helix	trans	-58.7	-53.1	172.3	0	0	0	0	0	111.5	N153 R158 S159 F160 E189	N153-G156 PolarHBondContact O-N 3Å; G156-R158 VanDerWaalsContact C-N 3.29Å; G156-R158 PolarHBondContact O-N 3.06Å; G156-S159 PolarHBondContact O-N 3.49Å; G156-F160 VanDerWaalsContact O-CB 3.23Å; G156-F160 WeakPolarHBondContact O-CB 3.28Å; G156-F160 PolarHBondContact O-N 3.07Å; G156-E189 PolarHBondContact N-OE2 3.43Å
157	I	94.8	Very high	93.5	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.015	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-39.3	177.4	-67.4	170	0	0	0	111.3	L145 L149 N153 F160 A161 L169 A173	L145-I157 HydrophobicContact CB-CG2 4.42Å; L145-I157 HydrophobicContact CD2-CD1 4.15Å; L145-I157 HydrophobicContact CD2-CG1 4.28Å; L149-I157 HydrophobicContact CD2-CB 4.16Å; L149-I157 HydrophobicContact CD2-CD1 3.94Å; L149-I157 HydrophobicContact CD2-CG2 3.91Å; N153-I157 HydrophobicContact CB-CD1 4.24Å; N153-I157 WeakPolarHBondContact O-CG1 3.48Å; N153-I157 PolarHBondContact O-N 3.43Å; I157-F160 PolarHBondContact O-N 2.96Å; I157-A161 VanDerWaalsContact O-CB 3.28Å; I157-A161 WeakPolarHBondContact O-CB 3.44Å; I157-A161 PolarHBondContact O-N 3.24Å; I157-L169 HydrophobicContact CG2-CD1 3.76Å; I157-L169 HydrophobicContact CG2-CD2 4.07Å; I157-L169 HydrophobicContact CG2-CG 3.95Å; I157-A173 HydrophobicContact CG2-CB 4.15Å
158	R	95.2	Very high	93.4	Very high	21 Å²	21	48.3 Å²	48.3	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-61.6	-52.4	176.2	-174.7	-177.3	105.5	-169.2	-2	111.8	S154 L155 G156 F160 A161 E162 F170 A173	S154-R158 VanDerWaalsContact O-CB 3.25Å; S154-R158 WeakPolarHBondContact O-CB 3.34Å; S154-R158 PolarHBondContact O-N 2.97Å; L155-R158 PolarHBondContact O-N 2.91Å; G156-R158 VanDerWaalsContact C-N 3.29Å; G156-R158 PolarHBondContact O-N 3.06Å; R158-F160 VanDerWaalsContact C-N 3.29Å; R158-F160 PolarHBondContact O-N 3.36Å; R158-A161 PolarHBondContact O-N 2.97Å; R158-E162 PolarHBondContact O-N 3.48Å; R158-F170 HydrophobicContact CG-CD2 3.79Å; R158-F170 HydrophobicContact CG-CE2 3.7Å; R158-A173 HydrophobicContact CB-CB 3.86Å; R158-A173 HydrophobicContact CG-CB 4.43Å
159	S	93	Very high	93.5	Very high	65 Å²	65	42.1 Å²	42.1	46%	0.455	25%	0.253	S	S	.	.	H	α-helix	trans	-62.4	-39.5	-180	-177.6	0	0	0	0	111.4	L155 G156 E162 S163	L155-S159 PolarHBondContact O-N 3.28Å; G156-S159 PolarHBondContact O-N 3.49Å; S159-E162 PolarHBondContact O-N 3.41Å; S159-S163 PolarHBondContact O-N 3.25Å; S159-S163 PolarHBondContact O-OG 3.11Å
160	F	91.2	Very high	93.5	Very high	31 Å²	31	43.8 Å²	43.8	14%	0.136	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-43.7	176	-177.4	-98.2	0	0	0	112.5	E123 L126 D127 L145 G156 I157 R158 E162 S163 H164	E123-F160 HydrophobicContact CB-CE2 4.23Å; E123-F160 HydrophobicContact CB-CZ 4.22Å; E123-F160 WeakPolarHBondContact O-CZ 3.43Å; L126-F160 HydrophobicContact CB-CE1 3.9Å; L126-F160 HydrophobicContact CB-CZ 3.95Å; L126-F160 HydrophobicContact CD1-CE1 4.03Å; L126-F160 HydrophobicContact CD2-CD1 4.31Å; L126-F160 HydrophobicContact CD2-CE1 3.26Å; L126-F160 HydrophobicContact CD2-CZ 3.56Å; L126-F160 HydrophobicContact CG-CE1 3.88Å; L126-F160 HydrophobicContact CG-CZ 4.26Å; D127-F160 HydrophobicContact CB-CE2 4.43Å; D127-F160 HydrophobicContact CB-CZ 4.4Å; L145-F160 HydrophobicContact CD1-CD1 4.42Å; L145-F160 HydrophobicContact CD1-CE1 4.33Å; G156-F160 VanDerWaalsContact O-CB 3.23Å; G156-F160 WeakPolarHBondContact O-CB 3.28Å; G156-F160 PolarHBondContact O-N 3.07Å; I157-F160 PolarHBondContact O-N 2.96Å; R158-F160 VanDerWaalsContact C-N 3.29Å; R158-F160 PolarHBondContact O-N 3.36Å; F160-E162 VanDerWaalsContact C-N 3.33Å; F160-E162 PolarHBondContact O-N 3.46Å; F160-S163 PolarHBondContact O-N 3.3Å; F160-S163 PolarHBondContact O-OG 3.08Å; F160-H164 AromaticContact CD2-CE1 3.54Å; F160-H164 AromaticContact CD2-ND1 3.76Å; F160-H164 AromaticContact CE2-CE1 3.16Å; F160-H164 WeakPolarHBondContact CE2-CE1 3.38Å; F160-H164 AromaticContact CE2-ND1 3.64Å; F160-H164 AromaticContact CE2-NE2 3.9Å; F160-H164 AromaticContact CZ-CE1 3.61Å; F160-H164 AromaticContact CZ-ND1 3.8Å; F160-H164 PolarHBondContact O-N 3.35Å; F160-H164 PolarHBondContact O-ND1 3.3Å
161	A	93.8	Very high	93.5	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.008	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-37.9	177.2	0	0	0	0	0	112.3	I157 R158 G165 C166 L169 F170	I157-A161 VanDerWaalsContact O-CB 3.28Å; I157-A161 WeakPolarHBondContact O-CB 3.44Å; I157-A161 PolarHBondContact O-N 3.24Å; R158-A161 PolarHBondContact O-N 2.97Å; A161-G165 PolarHBondContact O-N 2.96Å; A161-G165 VanDerWaalsContact O-N 3.14Å; A161-C166 HydrophobicContact CB-CB 4.2Å; A161-C166 PolarHBondContact O-N 2.86Å; A161-L169 HydrophobicContact CB-CB 3.93Å; A161-L169 HydrophobicContact CB-CD2 3.87Å; A161-L169 HydrophobicContact CB-CG 3.75Å; A161-F170 HydrophobicContact CB-CB 3.83Å
162	E	93.3	Very high	93.4	Very high	112 Å²	112	46.1 Å²	46.1	52%	0.523	27%	0.273	S	S	.	.	H	α-helix	trans	-63.7	-45.9	176.1	-170.8	168.3	-155.2	0	0	111.8	R158 S159 F160 H164 G165 F170	R158-E162 PolarHBondContact O-N 3.48Å; S159-E162 PolarHBondContact O-N 3.41Å; F160-E162 VanDerWaalsContact C-N 3.33Å; F160-E162 PolarHBondContact O-N 3.46Å; E162-H164 VanDerWaalsContact C-N 3.3Å; E162-H164 PolarHBondContact O-N 2.91Å; E162-G165 PolarHBondContact O-N 3.46Å; E162-F170 HydrophobicContact CB-CD2 3.73Å; E162-F170 HydrophobicContact CB-CE2 3.84Å; E162-F170 HydrophobicContact CG-CD2 4.36Å; E162-F170 HydrophobicContact CG-CE2 4.09Å
163	S	89.9	Confident	93.5	Very high	86 Å²	86	43.8 Å²	43.8	60%	0.601	26%	0.257	S	S	*	.	H	α-helix	trans	-67.2	-28.1	-178.8	64.5	0	0	0	0	113.8	S159 F160	S159-S163 PolarHBondContact O-N 3.25Å; S159-S163 PolarHBondContact O-OG 3.11Å; F160-S163 PolarHBondContact O-N 3.3Å; F160-S163 PolarHBondContact O-OG 3.08Å
164	H	87.8	Confident	93.5	Very high	42 Å²	42	44 Å²	44	19%	0.194	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	4	178.4	-63.3	83	0	0	0	113.9	L126 D127 F160 E162 C166	L126-H164 HydrophobicContact CD2-CB 4.08Å; D127-H164 WeakPolarHBondContact CB-NE2 3.28Å; D127-H164 IonicContact OD1-CD2 3.74Å; D127-H164 IonicContact OD1-NE2 2.63Å; D127-H164 PolarHBondContact OD1-NE2 2.87Å; F160-H164 AromaticContact CD2-CE1 3.54Å; F160-H164 AromaticContact CD2-ND1 3.76Å; F160-H164 AromaticContact CE2-CE1 3.16Å; F160-H164 WeakPolarHBondContact CE2-CE1 3.38Å; F160-H164 AromaticContact CE2-ND1 3.64Å; F160-H164 AromaticContact CE2-NE2 3.9Å; F160-H164 AromaticContact CZ-CE1 3.61Å; F160-H164 AromaticContact CZ-ND1 3.8Å; F160-H164 PolarHBondContact O-N 3.35Å; F160-H164 PolarHBondContact O-ND1 3.3Å; E162-H164 VanDerWaalsContact C-N 3.3Å; E162-H164 PolarHBondContact O-N 2.91Å; H164-C166 PolarHBondContact O-N 3.35Å
165	G	87.8	Confident	93.4	Very high	57 Å²	57	46.8 Å²	46.8	59%	0.588	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	21.7	-179.5	0	0	0	0	0	114.6	A161 E162 T167	A161-G165 PolarHBondContact O-N 2.96Å; A161-G165 VanDerWaalsContact O-N 3.14Å; E162-G165 PolarHBondContact O-N 3.46Å; G165-T167 PolarHBondContact O-N 2.87Å
166	C	90.1	Very high	93.4	Very high	13 Å²	13	49.3 Å²	49.3	9%	0.088	29%	0.286	C	S	.	.			trans	-81	78.2	178.9	-66.4	0	0	0	0	110.4	A161 H164 I168 L169 F170	A161-C166 HydrophobicContact CB-CB 4.2Å; A161-C166 PolarHBondContact O-N 2.86Å; H164-C166 PolarHBondContact O-N 3.35Å; C166-I168 PolarHBondContact O-N 3.35Å; C166-L169 HydrophobicContact CB-CB 4.13Å; C166-L169 PolarHBondContact O-N 3.36Å; C166-F170 WeakPolarHBondContact O-CB 3.35Å; C166-F170 PolarHBondContact O-N 3.3Å
167	T	92.9	Very high	93.5	Very high	92 Å²	92	48 Å²	48	56%	0.564	27%	0.273	S	S	*	.	H	α-helix	trans	-57.5	-44.4	-171.6	54.7	0	0	0	0	113.9	G165 L169 F170 E171	G165-T167 PolarHBondContact O-N 2.87Å; T167-L169 PolarHBondContact O-N 3.48Å; T167-F170 PolarHBondContact O-N 3.14Å; T167-E171 WeakPolarHBondContact O-CG 3.41Å; T167-E171 PolarHBondContact O-N 3.29Å
168	I	93	Very high	93.5	Very high	113 Å²	113	49 Å²	49	58%	0.579	28%	0.278	S	S	*	.	H	α-helix	trans	-63.4	-43	-179.3	-63.1	170.6	0	0	0	111.2	C166 A172	C166-I168 PolarHBondContact O-N 3.35Å; I168-A172 WeakPolarHBondContact O-CB 3.4Å; I168-A172 PolarHBondContact O-N 3.23Å; I168-A172 VanDerWaalsContact O-N 3.11Å
169	L	95.1	Very high	93.4	Very high	1 Å²	1	50 Å²	50	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-68.2	-41.6	177.4	-179.8	60.6	0	0	0	110.9	L145 K146 I157 A161 C166 T167 A172 A173	L145-L169 HydrophobicContact CB-CD1 3.9Å; L145-L169 HydrophobicContact CB-CD2 4.11Å; L145-L169 HydrophobicContact CD1-CD2 3.77Å; K146-L169 HydrophobicContact CB-CD1 4.12Å; I157-L169 HydrophobicContact CG2-CD1 3.76Å; I157-L169 HydrophobicContact CG2-CD2 4.07Å; I157-L169 HydrophobicContact CG2-CG 3.95Å; A161-L169 HydrophobicContact CB-CB 3.93Å; A161-L169 HydrophobicContact CB-CD2 3.87Å; A161-L169 HydrophobicContact CB-CG 3.75Å; C166-L169 HydrophobicContact CB-CB 4.13Å; C166-L169 PolarHBondContact O-N 3.36Å; T167-L169 PolarHBondContact O-N 3.48Å; L169-A172 PolarHBondContact O-N 3.39Å; L169-A173 VanDerWaalsContact O-CB 3.31Å; L169-A173 WeakPolarHBondContact O-CB 3.46Å; L169-A173 PolarHBondContact O-N 2.88Å
170	F	96	Very high	93.5	Very high	58 Å²	58	49 Å²	49	25%	0.254	28%	0.275	S	S	.	.	H	α-helix	trans	-59.5	-49	176.8	174.9	-97.2	0	0	0	111.6	R158 A161 E162 C166 T167 A172 A173 Q174	R158-F170 HydrophobicContact CG-CD2 3.79Å; R158-F170 HydrophobicContact CG-CE2 3.7Å; A161-F170 HydrophobicContact CB-CB 3.83Å; E162-F170 HydrophobicContact CB-CD2 3.73Å; E162-F170 HydrophobicContact CB-CE2 3.84Å; E162-F170 HydrophobicContact CG-CD2 4.36Å; E162-F170 HydrophobicContact CG-CE2 4.09Å; C166-F170 WeakPolarHBondContact O-CB 3.35Å; C166-F170 PolarHBondContact O-N 3.3Å; T167-F170 PolarHBondContact O-N 3.14Å; F170-A172 VanDerWaalsContact C-N 3.35Å; F170-A172 PolarHBondContact O-N 3.43Å; F170-A173 PolarHBondContact O-N 3.48Å; F170-Q174 WeakPolarHBondContact O-CB 3.41Å; F170-Q174 PolarHBondContact O-N 3.04Å
171	E	95.3	Very high	93.8	Very high	129 Å²	129	47.6 Å²	47.6	60%	0.603	27%	0.268	S	S	*	.	H	α-helix	trans	-61.5	-42.2	178.1	-73.7	176	-176.3	0	0	111.8	T167 S175	T167-E171 WeakPolarHBondContact O-CG 3.41Å; T167-E171 PolarHBondContact O-N 3.29Å; E171-S175 VanDerWaalsContact O-CB 3.29Å; E171-S175 WeakPolarHBondContact O-CB 3.28Å; E171-S175 PolarHBondContact O-N 2.95Å
172	A	95.7	Very high	93.9	Very high	21 Å²	21	50.4 Å²	50.4	17%	0.174	28%	0.282	C	S	.	.	H	α-helix	trans	-64.7	-45.9	176.8	0	0	0	0	0	112.2	K146 L149 I168 L169 F170 S175 Y176	K146-A172 HydrophobicContact CD-CB 4.07Å; K146-A172 HydrophobicContact CG-CB 3.92Å; L149-A172 HydrophobicContact CD1-CB 4.33Å; I168-A172 WeakPolarHBondContact O-CB 3.4Å; I168-A172 PolarHBondContact O-N 3.23Å; I168-A172 VanDerWaalsContact O-N 3.11Å; L169-A172 PolarHBondContact O-N 3.39Å; F170-A172 VanDerWaalsContact C-N 3.35Å; F170-A172 PolarHBondContact O-N 3.43Å; A172-S175 PolarHBondContact O-N 2.9Å; A172-Y176 WeakPolarHBondContact O-CB 3.43Å; A172-Y176 PolarHBondContact O-N 3.3Å
173	A	97	Very high	94.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-42.9	177.7	0	0	0	0	0	111.6	L149 I157 R158 L169 F170 Y176 V177	L149-A173 HydrophobicContact CD2-CB 3.87Å; I157-A173 HydrophobicContact CG2-CB 4.15Å; R158-A173 HydrophobicContact CB-CB 3.86Å; R158-A173 HydrophobicContact CG-CB 4.43Å; L169-A173 VanDerWaalsContact O-CB 3.31Å; L169-A173 WeakPolarHBondContact O-CB 3.46Å; L169-A173 PolarHBondContact O-N 2.88Å; F170-A173 PolarHBondContact O-N 3.48Å; A173-Y176 WeakPolarHBondContact O-CB 3.43Å; A173-Y176 PolarHBondContact O-N 3.38Å; A173-V177 VanDerWaalsContact O-CG2 3.31Å; A173-V177 WeakPolarHBondContact O-CG2 3.43Å; A173-V177 PolarHBondContact O-N 2.96Å
174	Q	95	Very high	94.4	Very high	47 Å²	47	46.3 Å²	46.3	22%	0.22	25%	0.253	C	S	.	.	H	α-helix	trans	-61.2	-46.6	175.5	176.6	64.4	-6.1	0	0	111.4	F170 Y176 V177 I178	F170-Q174 WeakPolarHBondContact O-CB 3.41Å; F170-Q174 PolarHBondContact O-N 3.04Å; Q174-Y176 VanDerWaalsContact C-N 3.29Å; Q174-Y176 PolarHBondContact O-N 3.23Å; Q174-V177 PolarHBondContact O-N 3.36Å; Q174-I178 HydrophobicContact CG-CD1 4Å; Q174-I178 WeakPolarHBondContact O-CB 3.26Å; Q174-I178 VanDerWaalsContact O-CG1 3.28Å; Q174-I178 WeakPolarHBondContact O-CG1 3.31Å; Q174-I178 PolarHBondContact O-N 3.39Å
175	S	94.1	Very high	94.8	Very high	60 Å²	60	45.1 Å²	45.1	42%	0.42	25%	0.248	S	C	.	.	H	α-helix	trans	-60	-40.8	175.3	-172.3	0	0	0	0	111.6	E171 A172 N179	E171-S175 VanDerWaalsContact O-CB 3.29Å; E171-S175 WeakPolarHBondContact O-CB 3.28Å; E171-S175 PolarHBondContact O-N 2.95Å; A172-S175 PolarHBondContact O-N 2.9Å; S175-N179 VanDerWaalsContact O-CB 3.31Å; S175-N179 WeakPolarHBondContact O-CB 3.46Å; S175-N179 PolarHBondContact O-N 3.15Å; S175-N179 PolarHBondContact O-ND2 2.89Å; S175-N179 PolarHBondContact OG-ND2 2.97Å
176	Y	96.4	Very high	95.2	Very high	57 Å²	57	48.3 Å²	48.3	22%	0.224	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-47.5	176	-170.7	-81.1	0	0	0	112.3	L149 H150 P151 A172 A173 Q174 I178 N179 N180	L149-Y176 HydrophobicContact CB-CD1 4.45Å; L149-Y176 HydrophobicContact CB-CD2 3.78Å; L149-Y176 HydrophobicContact CB-CE2 4.04Å; L149-Y176 HydrophobicContact CB-CG 4Å; L149-Y176 HydrophobicContact CD1-CD2 4.43Å; L149-Y176 HydrophobicContact CD1-CG 4.41Å; H150-Y176 WeakPolarHBondContact CA-OH 3.31Å; P151-Y176 WeakPolarHBondContact CD-OH 3.25Å; P151-Y176 HydrophobicContact CG-CE1 4.18Å; A172-Y176 WeakPolarHBondContact O-CB 3.43Å; A172-Y176 PolarHBondContact O-N 3.3Å; A173-Y176 WeakPolarHBondContact O-CB 3.43Å; A173-Y176 PolarHBondContact O-N 3.38Å; Q174-Y176 VanDerWaalsContact C-N 3.29Å; Q174-Y176 PolarHBondContact O-N 3.23Å; Y176-I178 PolarHBondContact O-N 3.02Å; Y176-N179 PolarHBondContact O-N 3.44Å; Y176-N180 HydrophobicContact CE1-CB 4.21Å; Y176-N180 WeakPolarHBondContact O-CB 3.44Å; Y176-N180 PolarHBondContact O-N 3.5Å; Y176-N180 PolarHBondContact O-ND2 3.08Å
177	V	96.9	Very high	95.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-46.4	178.6	168.1	0	0	0	0	110.8	S154 L155 A173 Q174 N180 F181 V184 L201	S154-V177 WeakPolarHBondContact OG-CG2 3.23Å; L155-V177 HydrophobicContact CD2-CG1 3.85Å; L155-V177 HydrophobicContact CD2-CG2 3.91Å; L155-V177 HydrophobicContact CG-CG2 4.33Å; A173-V177 VanDerWaalsContact O-CG2 3.31Å; A173-V177 WeakPolarHBondContact O-CG2 3.43Å; A173-V177 PolarHBondContact O-N 2.96Å; Q174-V177 PolarHBondContact O-N 3.36Å; V177-N180 CarbonylContact O-C 3.57Å; V177-F181 WeakPolarHBondContact O-CA 3.49Å; V177-F181 WeakPolarHBondContact O-CB 3.39Å; V177-F181 PolarHBondContact O-N 3.17Å; V177-V184 HydrophobicContact CG1-CG1 4.42Å; V177-L201 HydrophobicContact CG1-CD1 3.7Å; V177-L201 HydrophobicContact CG1-CD2 4.13Å
178	I	94.3	Very high	95.6	Very high	22 Å²	22	52.7 Å²	52.7	11%	0.113	26%	0.264	C	S	.	.	H	α-helix	trans	-61.2	-50.1	178.7	-72.7	175.9	0	0	0	110.8	Q174 Y176 N180 D206 N208 L324	Q174-I178 HydrophobicContact CG-CD1 4Å; Q174-I178 WeakPolarHBondContact O-CB 3.26Å; Q174-I178 VanDerWaalsContact O-CG1 3.28Å; Q174-I178 WeakPolarHBondContact O-CG1 3.31Å; Q174-I178 PolarHBondContact O-N 3.39Å; Y176-I178 PolarHBondContact O-N 3.02Å; I178-N180 VanDerWaalsContact C-N 3.32Å; I178-N180 PolarHBondContact O-N 3.03Å; I178-D206 HydrophobicContact CG2-CB 3.96Å; I178-D206 WeakPolarHBondContact CG2-O 3.42Å; I178-N208 WeakPolarHBondContact O-CB 3.49Å; I178-N208 PolarHBondContact O-N 3.05Å; I178-L324 HydrophobicContact CG2-CD1 4.34Å
179	N	93.3	Very high	95.8	Very high	42 Å²	42	49.7 Å²	49.7	23%	0.225	25%	0.248	C	C	.	.	H	α-helix	trans	-69.2	-27.6	-176	-77.5	-50.7	0	0	0	113.7	S175 Y176 N208	S175-N179 VanDerWaalsContact O-CB 3.31Å; S175-N179 WeakPolarHBondContact O-CB 3.46Å; S175-N179 PolarHBondContact O-N 3.15Å; S175-N179 PolarHBondContact O-ND2 2.89Å; S175-N179 PolarHBondContact OG-ND2 2.97Å; Y176-N179 PolarHBondContact O-N 3.44Å; N179-N208 WeakPolarHBondContact O-CB 3.29Å; N179-N208 PolarHBondContact O-ND2 3.33Å
180	N	95.5	Very high	95.9	Very high	46 Å²	46	49.7 Å²	49.7	25%	0.246	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	23.2	-177.1	-55.3	-74.4	0	0	0	112.4	Y176 V177 I178 M182 E183 V184	Y176-N180 HydrophobicContact CE1-CB 4.21Å; Y176-N180 WeakPolarHBondContact O-CB 3.44Å; Y176-N180 PolarHBondContact O-N 3.5Å; Y176-N180 PolarHBondContact O-ND2 3.08Å; V177-N180 CarbonylContact O-C 3.57Å; I178-N180 VanDerWaalsContact C-N 3.32Å; I178-N180 PolarHBondContact O-N 3.03Å; N180-M182 VanDerWaalsContact C-N 3.28Å; N180-M182 PolarHBondContact O-N 3.25Å; N180-M182 VanDerWaalsContact O-N 3.15Å; N180-E183 PolarHBondContact O-N 2.8Å; N180-V184 HydrophobicContact CB-CG2 4.45Å; N180-V184 WeakPolarHBondContact O-CG2 3.41Å; N180-V184 PolarHBondContact O-N 2.86Å
181	F	96.7	Very high	95.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-53.7	-40.8	-170.9	177.7	-102.4	0	0	0	113.6	V177 E183 V184 M185 F190 L201 L202 I207 V209 A218	V177-F181 WeakPolarHBondContact O-CA 3.49Å; V177-F181 WeakPolarHBondContact O-CB 3.39Å; V177-F181 PolarHBondContact O-N 3.17Å; F181-E183 PolarHBondContact O-N 3.28Å; F181-V184 PolarHBondContact O-N 3.33Å; F181-V184 VanDerWaalsContact O-N 3.17Å; F181-M185 HydrophobicContact CE1-CB 4.33Å; F181-M185 HydrophobicContact CE1-SD 4.02Å; F181-M185 HydrophobicContact CE2-CB 4.28Å; F181-M185 HydrophobicContact CZ-CB 3.99Å; F181-M185 WeakPolarHBondContact O-CB 3.37Å; F181-M185 WeakPolarHBondContact O-CG 3.49Å; F181-M185 PolarHBondContact O-N 3.42Å; F181-F190 HydrophobicContact CE2-CE2 4.22Å; F181-F190 HydrophobicContact CZ-CE2 4.49Å; F181-L201 HydrophobicContact CD2-CD1 4.14Å; F181-L201 HydrophobicContact CD2-CD2 3.91Å; F181-L201 HydrophobicContact CD2-CG 3.99Å; F181-L201 HydrophobicContact CE2-CD1 4.36Å; F181-L201 HydrophobicContact CE2-CD2 3.56Å; F181-L201 HydrophobicContact CE2-CG 3.7Å; F181-L202 HydrophobicContact CE1-CD2 4.16Å; F181-L202 HydrophobicContact CE2-CD2 4.12Å; F181-L202 HydrophobicContact CZ-CD2 3.4Å; F181-L202 VanDerWaalsContact CZ-CD2 3.4Å; F181-I207 HydrophobicContact CB-CB 4.33Å; F181-I207 HydrophobicContact CD1-CB 4.31Å; F181-I207 HydrophobicContact CD1-CD1 4.19Å; F181-I207 HydrophobicContact CE1-CD1 4.09Å; F181-I207 HydrophobicContact CG-CB 4.17Å; F181-V209 HydrophobicContact CD1-CG1 3.56Å; F181-V209 HydrophobicContact CE1-CG1 3.9Å; F181-A218 HydrophobicContact CZ-CB 4.24Å
182	M	95.6	Very high	95.9	Very high	61 Å²	61	47.9 Å²	47.9	30%	0.3	24%	0.244	S	C	.	.	H	α-helix	trans	-58.6	-31	176	-74.7	-177.9	-69.3	0	0	113.8	N180 M185 N186 N208 T210 V214	N180-M182 VanDerWaalsContact C-N 3.28Å; N180-M182 PolarHBondContact O-N 3.25Å; N180-M182 VanDerWaalsContact O-N 3.15Å; M182-M185 WeakPolarHBondContact O-CG 3.37Å; M182-N186 PolarHBondContact O-ND2 3.31Å; M182-N208 WeakPolarHBondContact CG-O 3.25Å; M182-T210 HydrophobicContact CE-CG2 4.23Å; M182-T210 HydrophobicContact SD-CG2 3.91Å; M182-V214 HydrophobicContact CG-CG1 4.16Å
183	E	96.7	Very high	95.9	Very high	112 Å²	112	48 Å²	48	52%	0.523	24%	0.242	S	C	.	.	H	α-helix	trans	-83.8	-39.5	174.7	-66.5	-179.3	-128.8	0	0	111.3	P151 N180 F181 N186 Q187	P151-E183 HydrophobicContact CB-CB 3.91Å; P151-E183 HydrophobicContact CG-CB 3.87Å; N180-E183 PolarHBondContact O-N 2.8Å; F181-E183 PolarHBondContact O-N 3.28Å; E183-N186 PolarHBondContact O-N 3.32Å; E183-Q187 WeakPolarHBondContact O-CG 3.17Å; E183-Q187 PolarHBondContact O-NE2 2.82Å
184	V	97	Very high	95.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-42.3	-179.3	174.2	0	0	0	0	111.8	P151 L155 V177 N180 F181 N186 Q187	P151-V184 HydrophobicContact CB-CG2 3.95Å; L155-V184 HydrophobicContact CD1-CG1 3.58Å; L155-V184 HydrophobicContact CD2-CG1 4.26Å; L155-V184 HydrophobicContact CG-CG1 3.74Å; V177-V184 HydrophobicContact CG1-CG1 4.42Å; N180-V184 HydrophobicContact CB-CG2 4.45Å; N180-V184 WeakPolarHBondContact O-CG2 3.41Å; N180-V184 PolarHBondContact O-N 2.86Å; F181-V184 PolarHBondContact O-N 3.33Å; F181-V184 VanDerWaalsContact O-N 3.17Å; V184-N186 PolarHBondContact O-N 3.14Å; V184-N186 VanDerWaalsContact O-N 3.08Å; V184-Q187 WeakPolarHBondContact O-CB 3.32Å; V184-Q187 PolarHBondContact O-N 3.32Å
185	M	95.8	Very high	95.9	Very high	16 Å²	16	50.2 Å²	50.2	8%	0.079	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.8	-179.1	67.4	174.3	-79	0	0	113.5	F181 M182 F190 V214 A218	F181-M185 HydrophobicContact CE1-CB 4.33Å; F181-M185 HydrophobicContact CE1-SD 4.02Å; F181-M185 HydrophobicContact CE2-CB 4.28Å; F181-M185 HydrophobicContact CZ-CB 3.99Å; F181-M185 WeakPolarHBondContact O-CB 3.37Å; F181-M185 WeakPolarHBondContact O-CG 3.49Å; F181-M185 PolarHBondContact O-N 3.42Å; M182-M185 WeakPolarHBondContact O-CG 3.37Å; M185-F190 HydrophobicContact CB-CD1 4.33Å; M185-F190 HydrophobicContact CB-CE1 4.41Å; M185-F190 HydrophobicContact CB-CG 4.47Å; M185-F190 WeakPolarHBondContact O-CD1 3.39Å; M185-V214 HydrophobicContact CE-CG1 4.29Å; M185-V214 HydrophobicContact SD-CG1 3.52Å; M185-V214 VanDerWaalsContact SD-CG1 3.52Å; M185-A218 HydrophobicContact CB-CB 4.48Å; M185-A218 VanDerWaalsContact CE-CA 3.49Å; M185-A218 HydrophobicContact CE-CB 3.46Å; M185-A218 VanDerWaalsContact CE-CB 3.46Å; M185-A218 HydrophobicContact SD-CB 4.14Å
186	N	95.7	Very high	96.1	Very high	124 Å²	124	53.4 Å²	53.4	66%	0.663	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-0	177.5	-70.5	-54.2	0	0	0	113.2	M182 E183 V184	M182-N186 PolarHBondContact O-ND2 3.31Å; E183-N186 PolarHBondContact O-N 3.32Å; V184-N186 PolarHBondContact O-N 3.14Å; V184-N186 VanDerWaalsContact O-N 3.08Å
187	Q	97.3	Very high	96	Very high	57 Å²	57	52.6 Å²	52.6	27%	0.266	27%	0.265	S	S	.	.	S	Bend	trans	-96.3	158.6	-178.2	-53.6	-58.4	-38.7	0	0	112.1	P151 E183 V184 E189 F190	P151-Q187 HydrophobicContact CB-CG 4.09Å; P151-Q187 WeakPolarHBondContact O-CG 3.2Å; E183-Q187 WeakPolarHBondContact O-CG 3.17Å; E183-Q187 PolarHBondContact O-NE2 2.82Å; V184-Q187 WeakPolarHBondContact O-CB 3.32Å; V184-Q187 PolarHBondContact O-N 3.32Å; Q187-E189 VanDerWaalsContact C-N 3.32Å; Q187-E189 PolarHBondContact O-N 3.34Å; Q187-F190 PolarHBondContact O-N 2.76Å
188	Q	95.8	Very high	96	Very high	141 Å²	141	52.6 Å²	52.6	66%	0.659	27%	0.265	S	S	*	.	H	α-helix	trans	-61.5	-37.7	-178.3	-174.2	173.6	-4.8	0	0	112.7	F190 L191 L192	Q188-F190 VanDerWaalsContact C-N 3.26Å; Q188-F190 PolarHBondContact O-N 3.5Å; Q188-L191 PolarHBondContact O-N 2.81Å; Q188-L191 VanDerWaalsContact O-N 3.08Å; Q188-L192 HydrophobicContact CG-CD1 4.18Å; Q188-L192 HydrophobicContact CG-CG 4.43Å; Q188-L192 WeakPolarHBondContact O-CG 3.37Å; Q188-L192 PolarHBondContact O-N 2.88Å
189	E	95.7	Very high	96.1	Very high	50 Å²	50	54.6 Å²	54.6	23%	0.234	27%	0.271	C	S	.	.	H	α-helix	trans	-58.3	-37.4	-179.9	-66.4	-167.2	153.5	0	0	112.8	S152 N153 S154 L155 G156 Q187 L191 L192 L193	S152-E189 WeakPolarHBondContact O-CG 3.42Å; N153-E189 WeakPolarHBondContact CA-OE1 3.29Å; N153-E189 VanDerWaalsContact CA-OE2 3.28Å; N153-E189 WeakPolarHBondContact CA-OE2 3.19Å; S154-E189 PolarHBondContact N-OE2 3.37Å; L155-E189 HydrophobicContact CB-CB 4.04Å; L155-E189 WeakPolarHBondContact CB-OE2 3.31Å; L155-E189 HydrophobicContact CD1-CB 4.08Å; L155-E189 PolarHBondContact N-OE2 3.47Å; L155-E189 VanDerWaalsContact N-OE2 3.07Å; G156-E189 PolarHBondContact N-OE2 3.43Å; Q187-E189 VanDerWaalsContact C-N 3.32Å; Q187-E189 PolarHBondContact O-N 3.34Å; E189-L191 VanDerWaalsContact C-N 3.32Å; E189-L191 PolarHBondContact O-N 2.94Å; E189-L192 PolarHBondContact O-N 3.41Å; E189-L192 VanDerWaalsContact O-N 3.14Å; E189-L193 PolarHBondContact O-N 3.06Å
190	F	97.2	Very high	96.2	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.2	-41.3	177.1	177.8	-102.5	0	0	0	111.6	L155 F181 M185 Q187 Q188 L192 L193 V198 L201 A218 W222	L155-F190 HydrophobicContact CD1-CB 3.83Å; L155-F190 HydrophobicContact CD1-CD2 4.38Å; F181-F190 HydrophobicContact CE2-CE2 4.22Å; F181-F190 HydrophobicContact CZ-CE2 4.49Å; M185-F190 HydrophobicContact CB-CD1 4.33Å; M185-F190 HydrophobicContact CB-CE1 4.41Å; M185-F190 HydrophobicContact CB-CG 4.47Å; M185-F190 WeakPolarHBondContact O-CD1 3.39Å; Q187-F190 PolarHBondContact O-N 2.76Å; Q188-F190 VanDerWaalsContact C-N 3.26Å; Q188-F190 PolarHBondContact O-N 3.5Å; F190-L192 PolarHBondContact O-N 3.3Å; F190-L193 HydrophobicContact CD2-CD1 4.01Å; F190-L193 WeakPolarHBondContact O-CB 3.45Å; F190-L193 PolarHBondContact O-N 3.38Å; F190-V198 HydrophobicContact CE2-CG1 4.39Å; F190-V198 HydrophobicContact CE2-CG2 4.45Å; F190-V198 HydrophobicContact CZ-CG1 4.17Å; F190-L201 HydrophobicContact CD2-CD2 4.26Å; F190-L201 HydrophobicContact CE2-CD2 4.16Å; F190-A218 HydrophobicContact CE1-CB 4.29Å; F190-A218 HydrophobicContact CZ-CB 4.07Å; F190-W222 HydrophobicContact CE1-CB 4.02Å
191	L	96.2	Very high	96.2	Very high	42 Å²	42	54.2 Å²	54.2	22%	0.22	27%	0.269	C	S	.	.	H	α-helix	trans	-68.4	-21.4	178.2	-58.1	179.6	0	0	0	112.7	Q188 E189 H225 R230	Q188-L191 PolarHBondContact O-N 2.81Å; Q188-L191 VanDerWaalsContact O-N 3.08Å; E189-L191 VanDerWaalsContact C-N 3.32Å; E189-L191 PolarHBondContact O-N 2.94Å; L191-H225 HydrophobicContact CB-CB 4.34Å; L191-H225 HydrophobicContact CD2-CB 4.39Å; L191-R230 VanDerWaalsContact O-CZ 3.25Å; L191-R230 PolarHBondContact O-NH1 3.33Å; L191-R230 PolarHBondContact O-NH2 3.27Å
192	L	95.8	Very high	96.2	Very high	108 Å²	108	54.2 Å²	54.2	57%	0.565	27%	0.269	S	S	*	.	H	α-helix	trans	-88.8	-11.7	179.4	-64.8	176.5	0	0	0	113.7	Q188 E189 F190	Q188-L192 HydrophobicContact CG-CD1 4.18Å; Q188-L192 HydrophobicContact CG-CG 4.43Å; Q188-L192 WeakPolarHBondContact O-CG 3.37Å; Q188-L192 PolarHBondContact O-N 2.88Å; E189-L192 PolarHBondContact O-N 3.41Å; E189-L192 VanDerWaalsContact O-N 3.14Å; F190-L192 PolarHBondContact O-N 3.3Å
193	L	96.1	Very high	96.1	Very high	23 Å²	23	52.3 Å²	52.3	12%	0.12	26%	0.262	C	S	.	.	S	Bend	trans	-60.4	149.6	175.8	-66.3	-179.7	0	0	0	112	L155 E189 F190 D197 V198 W222	L155-L193 HydrophobicContact CD1-CD1 3.94Å; L155-L193 HydrophobicContact CD1-CG 4.35Å; L155-L193 HydrophobicContact CD2-CD1 4.19Å; E189-L193 PolarHBondContact O-N 3.06Å; F190-L193 HydrophobicContact CD2-CD1 4.01Å; F190-L193 WeakPolarHBondContact O-CB 3.45Å; F190-L193 PolarHBondContact O-N 3.38Å; L193-D197 HydrophobicContact CB-CB 4.22Å; L193-D197 HydrophobicContact CD1-CB 4.41Å; L193-D197 HydrophobicContact CD2-CB 4.2Å; L193-V198 HydrophobicContact CB-CG2 3.67Å; L193-V198 HydrophobicContact CD1-CG2 4.18Å; L193-W222 WeakPolarHBondContact O-CZ2 3.28Å; L193-W222 PolarHBondContact O-NE1 3.48Å
194	N	95.6	Very high	95.9	Very high	82 Å²	82	48.4 Å²	48.4	44%	0.439	25%	0.246	S	C	.	.			trans	-75.2	168.3	169.3	68.3	55.4	0	0	0	111.1	E196 D197 V198	N194-E196 VanDerWaalsContact C-N 3.28Å; N194-E196 PolarHBondContact O-N 3.44Å; N194-E196 WeakPolarHBondContact OD1-CB 3.39Å; N194-E196 PolarHBondContact OD1-N 3.29Å; N194-D197 VanDerWaalsContact CG-OD2 3.31Å; N194-D197 PolarHBondContact ND2-OD2 2.91Å; N194-D197 PolarHBondContact O-N 2.9Å; N194-D197 PolarHBondContact OD1-N 3.04Å; N194-D197 PolarHBondContact OD1-OD2 2.8Å; N194-V198 WeakPolarHBondContact O-CG2 3.45Å; N194-V198 PolarHBondContact O-N 2.88Å; N194-V198 VanDerWaalsContact O-N 3.16Å
195	A	96.7	Very high	95.7	Very high	12 Å²	12	50.7 Å²	50.7	10%	0.099	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-32.2	-175.9	0	0	0	0	0	113.8	Y199 W222 H233	A195-Y199 WeakPolarHBondContact O-CB 3.18Å; A195-Y199 PolarHBondContact O-N 3.41Å; A195-W222 HydrophobicContact CB-CH2 3.82Å; A195-W222 HydrophobicContact CB-CZ2 4.36Å; A195-H233 HydrophobicContact CB-CB 4.13Å
196	E	96.6	Very high	95.6	Very high	127 Å²	127	52.3 Å²	52.3	59%	0.593	27%	0.268	S	S	*	.	H	α-helix	trans	-72.7	-43.3	-179	-175.1	169.6	-171	0	0	111.1	N194 V198 Y199 N200	N194-E196 VanDerWaalsContact C-N 3.28Å; N194-E196 PolarHBondContact O-N 3.44Å; N194-E196 WeakPolarHBondContact OD1-CB 3.39Å; N194-E196 PolarHBondContact OD1-N 3.29Å; E196-V198 PolarHBondContact O-N 2.99Å; E196-Y199 WeakPolarHBondContact O-CB 3.43Å; E196-Y199 PolarHBondContact O-N 2.85Å; E196-N200 WeakPolarHBondContact O-CB 3.37Å; E196-N200 PolarHBondContact O-N 3.37Å; E196-N200 PolarHBondContact O-ND2 2.99Å
197	D	95.2	Very high	95.5	Very high	40 Å²	40	46.4 Å²	46.4	21%	0.214	24%	0.236	C	C	.	.	H	α-helix	trans	-64.3	-40.6	176.5	-71.7	-34.7	0	0	0	112.2	L193 N194 N200 L201	L193-D197 HydrophobicContact CB-CB 4.22Å; L193-D197 HydrophobicContact CD1-CB 4.41Å; L193-D197 HydrophobicContact CD2-CB 4.2Å; N194-D197 VanDerWaalsContact CG-OD2 3.31Å; N194-D197 PolarHBondContact ND2-OD2 2.91Å; N194-D197 PolarHBondContact O-N 2.9Å; N194-D197 PolarHBondContact OD1-N 3.04Å; N194-D197 PolarHBondContact OD1-OD2 2.8Å; D197-N200 PolarHBondContact O-N 3.29Å; D197-L201 WeakPolarHBondContact O-CB 3.38Å; D197-L201 PolarHBondContact O-N 3.45Å
198	V	97.1	Very high	95.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-46.6	173.3	177	0	0	0	0	110.2	F190 L193 N194 E196 N200 L201 L202 W222 L237	F190-V198 HydrophobicContact CE2-CG1 4.39Å; F190-V198 HydrophobicContact CE2-CG2 4.45Å; F190-V198 HydrophobicContact CZ-CG1 4.17Å; L193-V198 HydrophobicContact CB-CG2 3.67Å; L193-V198 HydrophobicContact CD1-CG2 4.18Å; N194-V198 WeakPolarHBondContact O-CG2 3.45Å; N194-V198 PolarHBondContact O-N 2.88Å; N194-V198 VanDerWaalsContact O-N 3.16Å; E196-V198 PolarHBondContact O-N 2.99Å; V198-N200 PolarHBondContact O-N 2.97Å; V198-L201 PolarHBondContact O-N 3.41Å; V198-L202 HydrophobicContact CG1-CD1 3.64Å; V198-L202 HydrophobicContact CG1-CG 4.02Å; V198-L202 WeakPolarHBondContact O-CB 3.47Å; V198-L202 VanDerWaalsContact O-CG 3.25Å; V198-L202 WeakPolarHBondContact O-CG 3.46Å; V198-L202 PolarHBondContact O-N 3.41Å; V198-W222 HydrophobicContact CG2-CD2 4.15Å; V198-W222 HydrophobicContact CG2-CG 4.01Å; V198-W222 HydrophobicContact CG2-CZ2 4.47Å; V198-L237 HydrophobicContact CB-CD2 4.17Å; V198-L237 HydrophobicContact CG1-CD1 4.39Å; V198-L237 HydrophobicContact CG1-CD2 3.85Å
199	Y	97.1	Very high	95.3	Very high	63 Å²	63	39.1 Å²	39.1	25%	0.247	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-46.2	177.4	178.2	-93.1	0	0	0	112.2	A195 E196 L201 L202 S203 F236 S239 A240	A195-Y199 WeakPolarHBondContact O-CB 3.18Å; A195-Y199 PolarHBondContact O-N 3.41Å; E196-Y199 WeakPolarHBondContact O-CB 3.43Å; E196-Y199 PolarHBondContact O-N 2.85Å; Y199-L201 VanDerWaalsContact C-N 3.3Å; Y199-L201 PolarHBondContact O-N 2.93Å; Y199-L202 PolarHBondContact O-N 2.73Å; Y199-S203 WeakPolarHBondContact O-CB 3.21Å; Y199-S203 PolarHBondContact O-N 3.48Å; Y199-S203 PolarHBondContact O-OG 2.96Å; Y199-F236 HydrophobicContact CD1-CE1 4.35Å; Y199-F236 HydrophobicContact CD1-CE2 4.19Å; Y199-F236 AromaticContact CD1-CZ 3.65Å; Y199-F236 HydrophobicContact CD1-CZ 3.65Å; Y199-F236 HydrophobicContact CD2-CD1 4.24Å; Y199-F236 HydrophobicContact CD2-CD2 4.23Å; Y199-F236 AromaticContact CD2-CE1 3.86Å; Y199-F236 HydrophobicContact CD2-CE1 3.86Å; Y199-F236 AromaticContact CD2-CE2 3.83Å; Y199-F236 HydrophobicContact CD2-CE2 3.83Å; Y199-F236 HydrophobicContact CD2-CG 4.42Å; Y199-F236 AromaticContact CD2-CZ 3.63Å; Y199-F236 HydrophobicContact CD2-CZ 3.63Å; Y199-F236 WeakPolarHBondContact CD2-O 3.33Å; Y199-F236 HydrophobicContact CE1-CE2 4.33Å; Y199-F236 HydrophobicContact CE1-CZ 4.23Å; Y199-F236 HydrophobicContact CE2-CD2 4.35Å; Y199-F236 AromaticContact CE2-CE2 3.98Å; Y199-F236 HydrophobicContact CE2-CE2 3.98Å; Y199-F236 HydrophobicContact CE2-CZ 4.21Å; Y199-F236 WeakPolarHBondContact CE2-O 3.31Å; Y199-F236 HydrophobicContact CG-CD1 4.4Å; Y199-F236 AromaticContact CG-CE1 3.6Å; Y199-F236 HydrophobicContact CG-CE1 3.6Å; Y199-F236 AromaticContact CG-CE2 3.94Å; Y199-F236 HydrophobicContact CG-CE2 3.94Å; Y199-F236 AromaticContact CG-CZ 3.31Å; Y199-F236 HydrophobicContact CG-CZ 3.31Å; Y199-S239 WeakPolarHBondContact CE2-OG 3.41Å; Y199-A240 HydrophobicContact CD2-CB 3.98Å; Y199-A240 HydrophobicContact CE2-CB 3.92Å
200	N	94.9	Very high	95	Very high	78 Å²	78	39.6 Å²	39.6	42%	0.417	21%	0.21	S	C	.	.	H	α-helix	trans	-61.4	-40.3	179.5	-72.2	-24	0	0	0	111.3	E196 D197 V198 S203	E196-N200 WeakPolarHBondContact O-CB 3.37Å; E196-N200 PolarHBondContact O-N 3.37Å; E196-N200 PolarHBondContact O-ND2 2.99Å; D197-N200 PolarHBondContact O-N 3.29Å; V198-N200 PolarHBondContact O-N 2.97Å; N200-S203 PolarHBondContact O-OG 2.79Å
201	L	95.6	Very high	94.7	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-67.5	-50.3	175.2	-175.9	55.4	0	0	0	111.8	L155 V177 F181 F190 D197 V198 Y199 S203 C204 I207	L155-L201 HydrophobicContact CD2-CD2 4.22Å; V177-L201 HydrophobicContact CG1-CD1 3.7Å; V177-L201 HydrophobicContact CG1-CD2 4.13Å; F181-L201 HydrophobicContact CD2-CD1 4.14Å; F181-L201 HydrophobicContact CD2-CD2 3.91Å; F181-L201 HydrophobicContact CD2-CG 3.99Å; F181-L201 HydrophobicContact CE2-CD1 4.36Å; F181-L201 HydrophobicContact CE2-CD2 3.56Å; F181-L201 HydrophobicContact CE2-CG 3.7Å; F190-L201 HydrophobicContact CD2-CD2 4.26Å; F190-L201 HydrophobicContact CE2-CD2 4.16Å; D197-L201 WeakPolarHBondContact O-CB 3.38Å; D197-L201 PolarHBondContact O-N 3.45Å; V198-L201 PolarHBondContact O-N 3.41Å; Y199-L201 VanDerWaalsContact C-N 3.3Å; Y199-L201 PolarHBondContact O-N 2.93Å; L201-S203 VanDerWaalsContact C-N 3.32Å; L201-S203 PolarHBondContact O-N 3Å; L201-C204 WeakPolarHBondContact O-CB 3.45Å; L201-C204 PolarHBondContact O-N 2.88Å; L201-I207 HydrophobicContact CD1-CG2 4Å; L201-I207 WeakPolarHBondContact O-CG2 3.42Å
202	L	96	Very high	94.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-72.4	-22.4	-177.1	-62.9	-175.7	0	0	0	113.8	F181 V198 Y199 V215 A218 I219 A240 R296	F181-L202 HydrophobicContact CE1-CD2 4.16Å; F181-L202 HydrophobicContact CE2-CD2 4.12Å; F181-L202 HydrophobicContact CZ-CD2 3.4Å; F181-L202 VanDerWaalsContact CZ-CD2 3.4Å; V198-L202 HydrophobicContact CG1-CD1 3.64Å; V198-L202 HydrophobicContact CG1-CG 4.02Å; V198-L202 WeakPolarHBondContact O-CB 3.47Å; V198-L202 VanDerWaalsContact O-CG 3.25Å; V198-L202 WeakPolarHBondContact O-CG 3.46Å; V198-L202 PolarHBondContact O-N 3.41Å; Y199-L202 PolarHBondContact O-N 2.73Å; L202-V215 HydrophobicContact CB-CG1 4.38Å; L202-V215 HydrophobicContact CD2-CG1 4.23Å; L202-A218 HydrophobicContact CD2-CB 4.11Å; L202-I219 HydrophobicContact CD1-CD1 4.14Å; L202-I219 HydrophobicContact CD1-CG1 3.38Å; L202-A240 HydrophobicContact CB-CB 4.09Å; L202-R296 VanDerWaalsContact O-CZ 3.25Å; L202-R296 PolarHBondContact O-NH1 3.16Å; L202-R296 PolarHBondContact O-NH2 3.48Å
203	S	93.9	Very high	94.5	Very high	21 Å²	21	37.2 Å²	37.2	15%	0.147	20%	0.196	C	C	.	.	H	α-helix	trans	-84.1	-11.9	177.8	65.6	0	0	0	0	113.4	Y199 N200 L201 R242	Y199-S203 WeakPolarHBondContact O-CB 3.21Å; Y199-S203 PolarHBondContact O-N 3.48Å; Y199-S203 PolarHBondContact O-OG 2.96Å; N200-S203 PolarHBondContact O-OG 2.79Å; L201-S203 VanDerWaalsContact C-N 3.32Å; L201-S203 PolarHBondContact O-N 3Å; S203-R242 PolarHBondContact O-NH2 3.4Å
204	C	93.4	Very high	94.5	Very high	30 Å²	30	37.1 Å²	37.1	20%	0.203	20%	0.196	C	C	.	.			trans	-70.2	127.8	179.6	-179.8	0	0	0	0	111.9	L201 D206 I207 R296	L201-C204 WeakPolarHBondContact O-CB 3.45Å; L201-C204 PolarHBondContact O-N 2.88Å; C204-D206 PolarHBondContact O-N 2.9Å; C204-I207 HydrophobicContact CB-CG2 4.05Å; C204-R296 PolarHBondContact O-NH1 3.3Å
205	D	91.4	Very high	94.5	Very high	48 Å²	48	33.2 Å²	33.2	26%	0.257	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-13.1	-177.3	-66.2	-29.2	0	0	0	113.4	R242 R296 K297	D205-R242 IonicContact OD1-CZ 3.56Å; D205-R242 IonicContact OD1-NE 3.55Å; D205-R242 IonicContact OD1-NH2 3.29Å; D205-R242 PolarHBondContact OD1-NH2 2.99Å; D205-R296 VanDerWaalsContact O-CA 3.3Å; D205-R296 WeakPolarHBondContact O-CA 3.41Å; D205-R296 WeakPolarHBondContact O-CB 3.45Å; D205-K297 PolarHBondContact O-N 3.12Å
206	D	93.4	Very high	94.5	Very high	51 Å²	51	32.7 Å²	32.7	27%	0.273	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99	-4.2	-174	-63.4	-27.5	0	0	0	113.2	I178 C204 N208 K297 L324	I178-D206 HydrophobicContact CG2-CB 3.96Å; I178-D206 WeakPolarHBondContact CG2-O 3.42Å; C204-D206 PolarHBondContact O-N 2.9Å; D206-N208 PolarHBondContact O-N 3.38Å; D206-K297 WeakPolarHBondContact OD1-CD 3.3Å; D206-K297 WeakPolarHBondContact OD1-CE 3.4Å; D206-K297 IonicContact OD1-NZ 2.85Å; D206-K297 PolarHBondContact OD1-NZ 3.42Å; D206-K297 IonicContact OD2-NZ 3.98Å; D206-K297 PolarHBondContact OD2-NZ 2.95Å; D206-L324 HydrophobicContact CB-CD1 4.15Å; D206-L324 WeakPolarHBondContact O-CD1 3.26Å
207	I	94.7	Very high	94.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.			trans	-60.3	135.1	-179.7	62.7	176.4	0	0	0	112	F181 L201 C204 V209 V215 R296 S298	F181-I207 HydrophobicContact CB-CB 4.33Å; F181-I207 HydrophobicContact CD1-CB 4.31Å; F181-I207 HydrophobicContact CD1-CD1 4.19Å; F181-I207 HydrophobicContact CE1-CD1 4.09Å; F181-I207 HydrophobicContact CG-CB 4.17Å; L201-I207 HydrophobicContact CD1-CG2 4Å; L201-I207 WeakPolarHBondContact O-CG2 3.42Å; C204-I207 HydrophobicContact CB-CG2 4.05Å; I207-V209 HydrophobicContact CD1-CG1 4.18Å; I207-V209 HydrophobicContact CG1-CG1 4.27Å; I207-V209 HydrophobicContact CG1-CG2 4.44Å; I207-V209 PolarHBondContact O-N 3.34Å; I207-V209 VanDerWaalsContact O-N 3.08Å; I207-V215 HydrophobicContact CD1-CG2 4.09Å; I207-R296 VanDerWaalsContact CD1-NH1 3.33Å; I207-S298 PolarHBondContact O-OG 3.34Å; I207-S298 VanDerWaalsContact O-OG 3.07Å
208	N	94.2	Very high	94.5	Very high	44 Å²	44	27.6 Å²	27.6	24%	0.235	15%	0.148	C	C	.	.			trans	-76.5	96	178.8	-171.3	12.6	0	0	0	111.1	I178 N179 M182 D206 L324	I178-N208 WeakPolarHBondContact O-CB 3.49Å; I178-N208 PolarHBondContact O-N 3.05Å; N179-N208 WeakPolarHBondContact O-CB 3.29Å; N179-N208 PolarHBondContact O-ND2 3.33Å; M182-N208 WeakPolarHBondContact CG-O 3.25Å; D206-N208 PolarHBondContact O-N 3.38Å; N208-L324 HydrophobicContact CB-CD2 3.58Å
209	V	93.7	Very high	94.5	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	15%	0.148	C	C	.	.			trans	-129	147.5	171.9	-65.1	0	0	0	0	110.7	F181 I207 V214 V215 S298 T299	F181-V209 HydrophobicContact CD1-CG1 3.56Å; F181-V209 HydrophobicContact CE1-CG1 3.9Å; I207-V209 HydrophobicContact CD1-CG1 4.18Å; I207-V209 HydrophobicContact CG1-CG1 4.27Å; I207-V209 HydrophobicContact CG1-CG2 4.44Å; I207-V209 PolarHBondContact O-N 3.34Å; I207-V209 VanDerWaalsContact O-N 3.08Å; V209-V214 HydrophobicContact CB-CB 4.31Å; V209-V214 HydrophobicContact CB-CG1 4.42Å; V209-V214 HydrophobicContact CG1-CB 4.25Å; V209-V214 HydrophobicContact CG1-CG1 3.94Å; V209-V215 HydrophobicContact CG1-CG2 4.12Å; V209-V215 HydrophobicContact CG2-CG2 4.18Å; V209-S298 PolarHBondContact N-OG 2.97Å; V209-S298 VanDerWaalsContact N-OG 3.1Å; V209-S298 VanDerWaalsContact O-CB 3.3Å; V209-S298 WeakPolarHBondContact O-CB 3.32Å; V209-S298 PolarHBondContact O-OG 3.13Å; V209-T299 HydrophobicContact CG2-CG2 4.02Å; V209-T299 WeakPolarHBondContact O-CG2 3.17Å
210	T	90.7	Very high	94.4	Very high	59 Å²	59	26.1 Å²	26.1	36%	0.362	15%	0.146	S	C	.	.	S	Bend	trans	-73.5	-36.7	175.8	48.8	0	0	0	0	112.5	M182	M182-T210 HydrophobicContact CE-CG2 4.23Å; M182-T210 HydrophobicContact SD-CG2 3.91Å
211	E	91.3	Very high	94.5	Very high	75 Å²	75	24.4 Å²	24.4	35%	0.35	14%	0.142	S	C	.	.	S	Bend	trans	-156.6	162.4	-178.5	38.4	169	-151.9	0	0	110.5	T213 V214	E211-T213 WeakPolarHBondContact CG-OG1 3.27Å; E211-T213 PolarHBondContact O-N 3.44Å; E211-T213 PolarHBondContact OE1-OG1 3.07Å; E211-V214 HydrophobicContact CG-CG2 4.42Å; E211-V214 WeakPolarHBondContact O-CB 3.43Å; E211-V214 PolarHBondContact O-N 3.04Å
212	E	93.5	Very high	94.6	Very high	9 Å²	9	24.6 Å²	24.6	4%	0.042	14%	0.143	C	C	.	.	H	α-helix	trans	-66.1	-17.4	-179.9	-74.7	-63.7	128.4	0	0	113.8	V214 V215 F216 L241 R242 L245 L246 R296	E212-V214 PolarHBondContact O-N 2.85Å; E212-V215 WeakPolarHBondContact O-CB 3.22Å; E212-V215 PolarHBondContact O-N 3.47Å; E212-V215 VanDerWaalsContact O-N 3.11Å; E212-F216 PolarHBondContact O-N 3.17Å; E212-F216 VanDerWaalsContact O-N 3.11Å; E212-L241 HydrophobicContact CB-CD1 4.28Å; E212-L241 WeakPolarHBondContact O-CD1 3.48Å; E212-R242 VanDerWaalsContact CD-CB 3.46Å; E212-R242 HydrophobicContact CG-CB 3.82Å; E212-R242 HydrophobicContact CG-CG 4.37Å; E212-R242 WeakPolarHBondContact OE2-CB 3.39Å; E212-R242 WeakPolarHBondContact OE2-CG 3.49Å; E212-R242 PolarHBondContact OE2-N 3.44Å; E212-L245 HydrophobicContact CG-CB 4.39Å; E212-L246 HydrophobicContact CB-CD2 3.52Å; E212-L246 HydrophobicContact CB-CG 3.93Å; E212-R296 VanDerWaalsContact OE1-CD 3.31Å; E212-R296 WeakPolarHBondContact OE1-CD 3.5Å; E212-R296 IonicContact OE1-CZ 3.65Å; E212-R296 IonicContact OE1-NE 3.35Å; E212-R296 PolarHBondContact OE1-NE 3.47Å; E212-R296 IonicContact OE1-NH2 2.73Å; E212-R296 IonicContact OE2-CZ 3.09Å; E212-R296 IonicContact OE2-NE 3.44Å; E212-R296 IonicContact OE2-NH2 3.81Å; E212-R296 PolarHBondContact OE2-NH2 2.9Å
213	T	94.1	Very high	94.6	Very high	16 Å²	16	24.7 Å²	24.7	10%	0.098	14%	0.143	C	C	.	.	H	α-helix	trans	-58.7	-36.7	174.7	58.3	0	0	0	0	111	E211 V215 F216 D217 L246 F250	E211-T213 WeakPolarHBondContact CG-OG1 3.27Å; E211-T213 PolarHBondContact O-N 3.44Å; E211-T213 PolarHBondContact OE1-OG1 3.07Å; T213-V215 VanDerWaalsContact C-N 3.32Å; T213-V215 PolarHBondContact O-N 2.88Å; T213-F216 WeakPolarHBondContact O-CB 3.27Å; T213-F216 PolarHBondContact O-N 3.26Å; T213-D217 PolarHBondContact O-N 2.86Å; T213-L246 HydrophobicContact CG2-CD2 3.76Å; T213-F250 HydrophobicContact CG2-CD1 4.28Å; T213-F250 HydrophobicContact CG2-CD2 3.62Å; T213-F250 HydrophobicContact CG2-CE1 4.16Å; T213-F250 HydrophobicContact CG2-CE2 3.47Å; T213-F250 VanDerWaalsContact CG2-CE2 3.47Å; T213-F250 HydrophobicContact CG2-CG 4.03Å; T213-F250 HydrophobicContact CG2-CZ 3.75Å
214	V	95.1	Very high	94.6	Very high	22 Å²	22	27.2 Å²	27.2	13%	0.133	17%	0.165	C	C	.	.	H	α-helix	trans	-62.9	-39	176.2	178.9	0	0	0	0	111.2	M182 M185 V209 E211 E212 D217 A218	M182-V214 HydrophobicContact CG-CG1 4.16Å; M185-V214 HydrophobicContact CE-CG1 4.29Å; M185-V214 HydrophobicContact SD-CG1 3.52Å; M185-V214 VanDerWaalsContact SD-CG1 3.52Å; V209-V214 HydrophobicContact CB-CB 4.31Å; V209-V214 HydrophobicContact CB-CG1 4.42Å; V209-V214 HydrophobicContact CG1-CB 4.25Å; V209-V214 HydrophobicContact CG1-CG1 3.94Å; E211-V214 HydrophobicContact CG-CG2 4.42Å; E211-V214 WeakPolarHBondContact O-CB 3.43Å; E211-V214 PolarHBondContact O-N 3.04Å; E212-V214 PolarHBondContact O-N 2.85Å; V214-D217 PolarHBondContact O-N 2.83Å; V214-A218 PolarHBondContact O-N 2.96Å
215	V	96.1	Very high	94.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.4	-42.3	176.2	-179.7	0	0	0	0	110.1	L202 I207 V209 E212 T213 A218 I219 L241	L202-V215 HydrophobicContact CB-CG1 4.38Å; L202-V215 HydrophobicContact CD2-CG1 4.23Å; I207-V215 HydrophobicContact CD1-CG2 4.09Å; V209-V215 HydrophobicContact CG1-CG2 4.12Å; V209-V215 HydrophobicContact CG2-CG2 4.18Å; E212-V215 WeakPolarHBondContact O-CB 3.22Å; E212-V215 PolarHBondContact O-N 3.47Å; E212-V215 VanDerWaalsContact O-N 3.11Å; T213-V215 VanDerWaalsContact C-N 3.32Å; T213-V215 PolarHBondContact O-N 2.88Å; V215-A218 WeakPolarHBondContact O-CB 3.34Å; V215-A218 PolarHBondContact O-N 2.93Å; V215-I219 HydrophobicContact CG1-CD1 4.44Å; V215-I219 WeakPolarHBondContact O-CG1 3.33Å; V215-I219 PolarHBondContact O-N 3.09Å; V215-L241 HydrophobicContact CB-CD1 3.88Å; V215-L241 HydrophobicContact CG1-CD1 3.89Å
216	F	96.1	Very high	94.9	Very high	1 Å²	1	31 Å²	31	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-62.8	-44.5	174.1	-179.2	-101.7	0	0	0	111.7	E212 T213 A218 I219 T220 L238 L241 F250 R254 I255	E212-F216 PolarHBondContact O-N 3.17Å; E212-F216 VanDerWaalsContact O-N 3.11Å; T213-F216 WeakPolarHBondContact O-CB 3.27Å; T213-F216 PolarHBondContact O-N 3.26Å; F216-A218 VanDerWaalsContact C-N 3.29Å; F216-A218 PolarHBondContact O-N 3.06Å; F216-I219 WeakPolarHBondContact O-CB 3.46Å; F216-I219 PolarHBondContact O-N 2.84Å; F216-T220 HydrophobicContact CD1-CG2 4.14Å; F216-T220 HydrophobicContact CE1-CG2 3.72Å; F216-T220 HydrophobicContact CE2-CG2 4.21Å; F216-T220 HydrophobicContact CZ-CG2 3.76Å; F216-T220 WeakPolarHBondContact O-CG2 3.39Å; F216-T220 PolarHBondContact O-N 3.4Å; F216-T220 PolarHBondContact O-OG1 2.79Å; F216-L238 HydrophobicContact CD2-CD1 4.21Å; F216-L238 HydrophobicContact CE2-CD1 4.22Å; F216-L241 HydrophobicContact CB-CD1 4.09Å; F216-L241 HydrophobicContact CB-CD2 4.24Å; F216-L241 HydrophobicContact CD2-CD2 3.96Å; F216-F250 HydrophobicContact CB-CE1 4.25Å; F216-F250 HydrophobicContact CB-CZ 4.37Å; F216-F250 AromaticContact CD1-CE1 3.92Å; F216-F250 HydrophobicContact CD1-CE1 3.92Å; F216-F250 AromaticContact CD1-CZ 3.77Å; F216-F250 HydrophobicContact CD1-CZ 3.77Å; F216-F250 HydrophobicContact CE1-CZ 4.47Å; F216-F250 HydrophobicContact CG-CE1 4.14Å; F216-F250 HydrophobicContact CG-CZ 4.32Å; F216-R254 HydrophobicContact CE1-CB 4.18Å; F216-I255 HydrophobicContact CD2-CD1 4.24Å; F216-I255 HydrophobicContact CD2-CG1 4.1Å; F216-I255 HydrophobicContact CE2-CD1 4.35Å; F216-I255 HydrophobicContact CE2-CG1 3.78Å; F216-I255 HydrophobicContact CZ-CG1 4.01Å
217	D	95.6	Very high	94.9	Very high	59 Å²	59	32.4 Å²	32.4	32%	0.316	19%	0.188	S	C	.	.	H	α-helix	trans	-60.5	-40	176.6	-70.8	-24.4	0	0	0	111	T213 V214 I219 T220 A221 R254	T213-D217 PolarHBondContact O-N 2.86Å; V214-D217 PolarHBondContact O-N 2.83Å; D217-I219 PolarHBondContact O-N 2.95Å; D217-T220 WeakPolarHBondContact CA-OG1 3.29Å; D217-T220 PolarHBondContact O-N 3.46Å; D217-T220 PolarHBondContact O-OG1 2.88Å; D217-A221 WeakPolarHBondContact O-CB 3.08Å; D217-A221 PolarHBondContact O-N 3.02Å; D217-R254 IonicContact OD1-CZ 3.28Å; D217-R254 IonicContact OD1-NH2 3.06Å; D217-R254 PolarHBondContact OD1-NH2 3.48Å
218	A	97.2	Very high	94.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-44.7	173.8	0	0	0	0	0	112.8	F181 M185 F190 L202 V214 V215 F216 A221 W222	F181-A218 HydrophobicContact CZ-CB 4.24Å; M185-A218 HydrophobicContact CB-CB 4.48Å; M185-A218 VanDerWaalsContact CE-CA 3.49Å; M185-A218 HydrophobicContact CE-CB 3.46Å; M185-A218 VanDerWaalsContact CE-CB 3.46Å; M185-A218 HydrophobicContact SD-CB 4.14Å; F190-A218 HydrophobicContact CE1-CB 4.29Å; F190-A218 HydrophobicContact CZ-CB 4.07Å; L202-A218 HydrophobicContact CD2-CB 4.11Å; V214-A218 PolarHBondContact O-N 2.96Å; V215-A218 WeakPolarHBondContact O-CB 3.34Å; V215-A218 PolarHBondContact O-N 2.93Å; F216-A218 VanDerWaalsContact C-N 3.29Å; F216-A218 PolarHBondContact O-N 3.06Å; A218-A221 PolarHBondContact O-N 2.89Å; A218-W222 PolarHBondContact O-N 3.05Å
219	I	96.7	Very high	94.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-48.9	175.5	-66.5	166.6	0	0	0	109.9	L202 V215 F216 D217 A221 W222 L223 L237 L241	L202-I219 HydrophobicContact CD1-CD1 4.14Å; L202-I219 HydrophobicContact CD1-CG1 3.38Å; V215-I219 HydrophobicContact CG1-CD1 4.44Å; V215-I219 WeakPolarHBondContact O-CG1 3.33Å; V215-I219 PolarHBondContact O-N 3.09Å; F216-I219 WeakPolarHBondContact O-CB 3.46Å; F216-I219 PolarHBondContact O-N 2.84Å; D217-I219 PolarHBondContact O-N 2.95Å; I219-A221 PolarHBondContact O-N 2.97Å; I219-W222 PolarHBondContact O-N 2.87Å; I219-L223 HydrophobicContact CG2-CD1 3.64Å; I219-L223 HydrophobicContact CG2-CG 4.42Å; I219-L223 WeakPolarHBondContact O-CB 3.4Å; I219-L223 WeakPolarHBondContact O-CD1 2.83Å; I219-L223 VanDerWaalsContact O-CG 3.25Å; I219-L223 WeakPolarHBondContact O-CG 3.4Å; I219-L223 PolarHBondContact O-N 3.43Å; I219-L237 WeakPolarHBondContact CD1-O 3.41Å; I219-L237 HydrophobicContact CG1-CB 4.33Å; I219-L237 HydrophobicContact CG2-CB 4.01Å; I219-L237 HydrophobicContact CG2-CD1 4.43Å; I219-L241 HydrophobicContact CD1-CB 4.43Å
220	T	95.3	Very high	95	Very high	33 Å²	33	42.7 Å²	42.7	20%	0.202	24%	0.241	C	C	.	.	H	α-helix	trans	-65.3	-38.8	-178.4	62.2	0	0	0	0	112.7	F216 D217 L223 A224	F216-T220 HydrophobicContact CD1-CG2 4.14Å; F216-T220 HydrophobicContact CE1-CG2 3.72Å; F216-T220 HydrophobicContact CE2-CG2 4.21Å; F216-T220 HydrophobicContact CZ-CG2 3.76Å; F216-T220 WeakPolarHBondContact O-CG2 3.39Å; F216-T220 PolarHBondContact O-N 3.4Å; F216-T220 PolarHBondContact O-OG1 2.79Å; D217-T220 WeakPolarHBondContact CA-OG1 3.29Å; D217-T220 PolarHBondContact O-N 3.46Å; D217-T220 PolarHBondContact O-OG1 2.88Å; T220-L223 PolarHBondContact O-N 3.38Å; T220-A224 VanDerWaalsContact O-CB 3.29Å; T220-A224 WeakPolarHBondContact O-CB 3.46Å; T220-A224 PolarHBondContact O-N 3.49Å
221	A	96	Very high	95.2	Very high	42 Å²	42	43.4 Å²	43.4	35%	0.347	24%	0.239	S	C	.	.	H	α-helix	trans	-64.5	-44.6	176.9	0	0	0	0	0	111.9	D217 A218 I219 A224 H225	D217-A221 WeakPolarHBondContact O-CB 3.08Å; D217-A221 PolarHBondContact O-N 3.02Å; A218-A221 PolarHBondContact O-N 2.89Å; I219-A221 PolarHBondContact O-N 2.97Å; A221-A224 PolarHBondContact O-N 2.88Å; A221-H225 PolarHBondContact O-N 3.29Å
222	W	97.7	Very high	95.3	Very high	5 Å²	5	44.6 Å²	44.6	2%	0.019	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-40.9	177.5	-175.6	88.7	0	0	0	112.3	F190 L193 A195 V198 A218 I219 H225 R230 H233 L237	F190-W222 HydrophobicContact CE1-CB 4.02Å; L193-W222 WeakPolarHBondContact O-CZ2 3.28Å; L193-W222 PolarHBondContact O-NE1 3.48Å; A195-W222 HydrophobicContact CB-CH2 3.82Å; A195-W222 HydrophobicContact CB-CZ2 4.36Å; V198-W222 HydrophobicContact CG2-CD2 4.15Å; V198-W222 HydrophobicContact CG2-CG 4.01Å; V198-W222 HydrophobicContact CG2-CZ2 4.47Å; A218-W222 PolarHBondContact O-N 3.05Å; I219-W222 PolarHBondContact O-N 2.87Å; W222-H225 PolarHBondContact O-N 2.94Å; W222-R230 HydrophobicContact CE3-CB 4.33Å; W222-R230 HydrophobicContact CE3-CG 4.41Å; W222-R230 HydrophobicContact CH2-CB 4.04Å; W222-R230 HydrophobicContact CH2-CG 3.64Å; W222-R230 HydrophobicContact CZ2-CG 4.22Å; W222-R230 HydrophobicContact CZ3-CB 3.67Å; W222-R230 HydrophobicContact CZ3-CG 3.76Å; W222-R230 VanDerWaalsContact O-CD 3.32Å; W222-R230 WeakPolarHBondContact O-CD 3.44Å; W222-R230 PolarHBondContact O-NH1 3.08Å; W222-H233 HydrophobicContact CZ3-CB 4.38Å; W222-L237 HydrophobicContact CD2-CD1 4.4Å; W222-L237 HydrophobicContact CE3-CD1 3.5Å; W222-L237 HydrophobicContact CZ3-CD1 3.61Å
223	L	95.9	Very high	95.3	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-39.4	175.6	-70.7	164.1	0	0	0	112.1	I219 T220 H225 D226 L227 R230 F234 L237 L260	I219-L223 HydrophobicContact CG2-CD1 3.64Å; I219-L223 HydrophobicContact CG2-CG 4.42Å; I219-L223 WeakPolarHBondContact O-CB 3.4Å; I219-L223 WeakPolarHBondContact O-CD1 2.83Å; I219-L223 VanDerWaalsContact O-CG 3.25Å; I219-L223 WeakPolarHBondContact O-CG 3.4Å; I219-L223 PolarHBondContact O-N 3.43Å; T220-L223 PolarHBondContact O-N 3.38Å; L223-H225 PolarHBondContact O-N 3.08Å; L223-D226 CarbonylContact O-C 3.58Å; L223-D226 PolarHBondContact O-N 2.9Å; L223-L227 WeakPolarHBondContact O-CA 3.48Å; L223-L227 PolarHBondContact O-N 3.01Å; L223-R230 HydrophobicContact CD2-CB 4.01Å; L223-R230 VanDerWaalsContact CD2-O 3.27Å; L223-R230 WeakPolarHBondContact CD2-O 2.96Å; L223-F234 HydrophobicContact CD1-CD2 3.52Å; L223-F234 HydrophobicContact CD1-CE2 4.16Å; L223-L237 HydrophobicContact CD2-CD1 4.47Å; L223-L260 HydrophobicContact CD1-CD1 4.33Å
224	A	95.5	Very high	95.4	Very high	74 Å²	74	46.7 Å²	46.7	61%	0.612	26%	0.26	S	S	*	.	H	α-helix	trans	-65.7	-25.2	-178	0	0	0	0	0	113.5	T220 A221 D226	T220-A224 VanDerWaalsContact O-CB 3.29Å; T220-A224 WeakPolarHBondContact O-CB 3.46Å; T220-A224 PolarHBondContact O-N 3.49Å; A221-A224 PolarHBondContact O-N 2.88Å; A224-D226 VanDerWaalsContact C-N 3.35Å; A224-D226 PolarHBondContact O-N 3.38Å
225	H	95.7	Very high	95.3	Very high	94 Å²	94	49.1 Å²	49.1	44%	0.435	27%	0.269	S	S	.	.	H	α-helix	trans	-64.8	-35.2	179.9	-173.9	74.7	0	0	0	113.3	L191 A221 W222 L223	L191-H225 HydrophobicContact CB-CB 4.34Å; L191-H225 HydrophobicContact CD2-CB 4.39Å; A221-H225 PolarHBondContact O-N 3.29Å; W222-H225 PolarHBondContact O-N 2.94Å; L223-H225 PolarHBondContact O-N 3.08Å
226	D	95	Very high	95.2	Very high	64 Å²	64	53 Å²	53	34%	0.342	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.2	63.6	176.3	-175	13	0	0	0	110.7	L223 A224 E229 R230	L223-D226 CarbonylContact O-C 3.58Å; L223-D226 PolarHBondContact O-N 2.9Å; A224-D226 VanDerWaalsContact C-N 3.35Å; A224-D226 PolarHBondContact O-N 3.38Å; D226-E229 PolarHBondContact O-N 3.2Å; D226-R230 HydrophobicContact CB-CG 4.08Å; D226-R230 WeakPolarHBondContact O-CB 3.2Å; D226-R230 VanDerWaalsContact O-CG 3.22Å; D226-R230 WeakPolarHBondContact O-CG 3.38Å; D226-R230 PolarHBondContact O-N 3.07Å
227	L	93.8	Very high	95.2	Very high	80 Å²	80	52.9 Å²	52.9	42%	0.419	29%	0.286	S	S	.	.	H	α-helix	trans	-54	-42.4	-173.1	-173.8	67.3	0	0	0	114.5	L223 E229 K231 L260	L223-L227 WeakPolarHBondContact O-CA 3.48Å; L223-L227 PolarHBondContact O-N 3.01Å; L227-E229 PolarHBondContact O-N 3.4Å; L227-K231 HydrophobicContact CD1-CB 4.46Å; L227-K231 VanDerWaalsContact O-CB 3.27Å; L227-K231 WeakPolarHBondContact O-CB 3.25Å; L227-K231 WeakPolarHBondContact O-CG 3.4Å; L227-K231 PolarHBondContact O-N 3.26Å; L227-L260 HydrophobicContact CD1-CD1 3.89Å; L227-L260 HydrophobicContact CD1-CD2 4.28Å; L227-L260 HydrophobicContact CD1-CG 4.45Å
228	P	94.1	Very high	95.1	Very high	93 Å²	93	50.1 Å²	50.1	60%	0.604	27%	0.271	S	S	*	.	H	α-helix	trans	-59.2	-44.5	-178	-25.1	36.2	0	0	0	113.6
229	E	94.1	Very high	94.9	Very high	138 Å²	138	51.3 Å²	51.3	65%	0.645	28%	0.279	S	S	*	.	H	α-helix	trans	-84.5	-34.8	-179.6	-64	-58.7	130.7	0	0	111.6	D226 L227 V232	D226-E229 PolarHBondContact O-N 3.2Å; L227-E229 PolarHBondContact O-N 3.4Å; E229-V232 WeakPolarHBondContact O-CG2 3.3Å
230	R	95.4	Very high	94.8	Very high	30 Å²	30	51.3 Å²	51.3	11%	0.113	28%	0.279	C	S	.	.	H	α-helix	trans	-85.9	-18.6	-171.5	-65	178.9	178.4	-168.8	-3.6	114.8	L191 W222 L223 D226 V232 H233	L191-R230 VanDerWaalsContact O-CZ 3.25Å; L191-R230 PolarHBondContact O-NH1 3.33Å; L191-R230 PolarHBondContact O-NH2 3.27Å; W222-R230 HydrophobicContact CE3-CB 4.33Å; W222-R230 HydrophobicContact CE3-CG 4.41Å; W222-R230 HydrophobicContact CH2-CB 4.04Å; W222-R230 HydrophobicContact CH2-CG 3.64Å; W222-R230 HydrophobicContact CZ2-CG 4.22Å; W222-R230 HydrophobicContact CZ3-CB 3.67Å; W222-R230 HydrophobicContact CZ3-CG 3.76Å; W222-R230 VanDerWaalsContact O-CD 3.32Å; W222-R230 WeakPolarHBondContact O-CD 3.44Å; W222-R230 PolarHBondContact O-NH1 3.08Å; L223-R230 HydrophobicContact CD2-CB 4.01Å; L223-R230 VanDerWaalsContact CD2-O 3.27Å; L223-R230 WeakPolarHBondContact CD2-O 2.96Å; D226-R230 HydrophobicContact CB-CG 4.08Å; D226-R230 WeakPolarHBondContact O-CB 3.2Å; D226-R230 VanDerWaalsContact O-CG 3.22Å; D226-R230 WeakPolarHBondContact O-CG 3.38Å; D226-R230 PolarHBondContact O-N 3.07Å; R230-V232 PolarHBondContact O-N 3.1Å; R230-H233 WeakPolarHBondContact O-CB 3.35Å; R230-H233 PolarHBondContact O-N 2.66Å
231	K	93.9	Very high	94.8	Very high	74 Å²	74	49.7 Å²	49.7	32%	0.322	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-57	-26.1	-178.6	65	176.3	-167.4	151.3	0	114	L227 H233 F234 L260 E263	L227-K231 HydrophobicContact CD1-CB 4.46Å; L227-K231 VanDerWaalsContact O-CB 3.27Å; L227-K231 WeakPolarHBondContact O-CB 3.25Å; L227-K231 WeakPolarHBondContact O-CG 3.4Å; L227-K231 PolarHBondContact O-N 3.26Å; K231-H233 PolarHBondContact O-N 2.63Å; K231-F234 VanDerWaalsContact O-CB 3.31Å; K231-F234 WeakPolarHBondContact O-CB 3.11Å; K231-F234 PolarHBondContact O-N 2.8Å; K231-L260 HydrophobicContact CB-CD1 4.05Å; K231-L260 HydrophobicContact CB-CD2 3.82Å; K231-L260 HydrophobicContact CD-CD2 4.47Å; K231-E263 IonicContact NZ-OE1 3.31Å; K231-E263 IonicContact NZ-OE2 3.5Å; K231-E263 PolarHBondContact NZ-OE2 2.99Å; K231-E263 VanDerWaalsContact NZ-OE2 3.09Å
232	V	93.6	Very high	94.6	Very high	100 Å²	100	48 Å²	48	61%	0.606	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-64.4	-21.9	176.3	-56.6	0	0	0	0	112.8	E229 R230	E229-V232 WeakPolarHBondContact O-CG2 3.3Å; R230-V232 PolarHBondContact O-N 3.1Å
233	H	95.2	Very high	94.4	Very high	68 Å²	68	47.8 Å²	47.8	32%	0.315	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-92	2.2	179	-58.3	-64.2	0	0	0	113.4	A195 W222 R230 K231 E235 F236 L237	A195-H233 HydrophobicContact CB-CB 4.13Å; W222-H233 HydrophobicContact CZ3-CB 4.38Å; R230-H233 WeakPolarHBondContact O-CB 3.35Å; R230-H233 PolarHBondContact O-N 2.66Å; K231-H233 PolarHBondContact O-N 2.63Å; H233-E235 PolarHBondContact O-N 3.32Å; H233-F236 PolarHBondContact O-N 3.4Å; H233-L237 HydrophobicContact CB-CG 4.49Å; H233-L237 WeakPolarHBondContact O-CG 3.13Å; H233-L237 PolarHBondContact O-N 2.75Å
234	F	94.6	Very high	94.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-57.3	-50.9	-175.3	-178.4	-116.9	0	0	0	112.6	L223 K231 F236 L237 L238 H258 L260 L261	L223-F234 HydrophobicContact CD1-CD2 3.52Å; L223-F234 HydrophobicContact CD1-CE2 4.16Å; K231-F234 VanDerWaalsContact O-CB 3.31Å; K231-F234 WeakPolarHBondContact O-CB 3.11Å; K231-F234 PolarHBondContact O-N 2.8Å; F234-F236 VanDerWaalsContact C-N 3.34Å; F234-F236 PolarHBondContact O-N 2.91Å; F234-L237 PolarHBondContact O-N 3.34Å; F234-L238 HydrophobicContact CE1-CD2 4.26Å; F234-L238 HydrophobicContact CZ-CD2 4.26Å; F234-L238 VanDerWaalsContact O-CB 3.22Å; F234-L238 WeakPolarHBondContact O-CB 3.39Å; F234-L238 PolarHBondContact O-N 2.85Å; F234-H258 AromaticContact CE2-CE1 3.83Å; F234-H258 AromaticContact CE2-ND1 3.69Å; F234-H258 HydrophobicContact CZ-CB 4.4Å; F234-H258 AromaticContact CZ-ND1 3.53Å; F234-L260 HydrophobicContact CB-CB 4.43Å; F234-L260 HydrophobicContact CB-CD1 4.11Å; F234-L260 HydrophobicContact CD1-CB 3.73Å; F234-L260 HydrophobicContact CD2-CB 4.22Å; F234-L260 HydrophobicContact CD2-CD1 3.95Å; F234-L260 HydrophobicContact CE1-CB 3.95Å; F234-L260 HydrophobicContact CE2-CB 4.41Å; F234-L260 HydrophobicContact CG-CB 3.86Å; F234-L260 HydrophobicContact CG-CD1 4.02Å; F234-L260 HydrophobicContact CZ-CB 4.29Å; F234-L261 HydrophobicContact CE1-CB 4.45Å; F234-L261 HydrophobicContact CE1-CD1 4.21Å
235	E	93.8	Very high	93.8	Very high	73 Å²	73	46.2 Å²	46.2	34%	0.341	24%	0.235	S	C	.	.	H	α-helix	trans	-59.2	-45.6	177.5	-174.1	-157.2	132.9	0	0	111.7	H233 L238 S239 Q266 F270	H233-E235 PolarHBondContact O-N 3.32Å; E235-L238 PolarHBondContact O-N 3.4Å; E235-S239 PolarHBondContact O-N 3.3Å; E235-Q266 VanDerWaalsContact CD-CB 3.5Å; E235-Q266 HydrophobicContact CG-CB 4.05Å; E235-Q266 HydrophobicContact CG-CG 4.19Å; E235-Q266 VanDerWaalsContact OE1-CG 3.29Å; E235-Q266 WeakPolarHBondContact OE1-CG 3.32Å; E235-Q266 WeakPolarHBondContact OE2-CB 3.49Å; E235-F270 HydrophobicContact CG-CE2 4.24Å
236	F	94.6	Very high	93.6	Very high	81 Å²	81	42 Å²	42	36%	0.355	22%	0.215	S	C	.	.	H	α-helix	trans	-60.8	-49	-178.4	176.1	-116.6	0	0	0	111.7	Y199 H233 F234 S239	Y199-F236 HydrophobicContact CD1-CE1 4.35Å; Y199-F236 HydrophobicContact CD1-CE2 4.19Å; Y199-F236 AromaticContact CD1-CZ 3.65Å; Y199-F236 HydrophobicContact CD1-CZ 3.65Å; Y199-F236 HydrophobicContact CD2-CD1 4.24Å; Y199-F236 HydrophobicContact CD2-CD2 4.23Å; Y199-F236 AromaticContact CD2-CE1 3.86Å; Y199-F236 HydrophobicContact CD2-CE1 3.86Å; Y199-F236 AromaticContact CD2-CE2 3.83Å; Y199-F236 HydrophobicContact CD2-CE2 3.83Å; Y199-F236 HydrophobicContact CD2-CG 4.42Å; Y199-F236 AromaticContact CD2-CZ 3.63Å; Y199-F236 HydrophobicContact CD2-CZ 3.63Å; Y199-F236 WeakPolarHBondContact CD2-O 3.33Å; Y199-F236 HydrophobicContact CE1-CE2 4.33Å; Y199-F236 HydrophobicContact CE1-CZ 4.23Å; Y199-F236 HydrophobicContact CE2-CD2 4.35Å; Y199-F236 AromaticContact CE2-CE2 3.98Å; Y199-F236 HydrophobicContact CE2-CE2 3.98Å; Y199-F236 HydrophobicContact CE2-CZ 4.21Å; Y199-F236 WeakPolarHBondContact CE2-O 3.31Å; Y199-F236 HydrophobicContact CG-CD1 4.4Å; Y199-F236 AromaticContact CG-CE1 3.6Å; Y199-F236 HydrophobicContact CG-CE1 3.6Å; Y199-F236 AromaticContact CG-CE2 3.94Å; Y199-F236 HydrophobicContact CG-CE2 3.94Å; Y199-F236 AromaticContact CG-CZ 3.31Å; Y199-F236 HydrophobicContact CG-CZ 3.31Å; H233-F236 PolarHBondContact O-N 3.4Å; F234-F236 VanDerWaalsContact C-N 3.34Å; F234-F236 PolarHBondContact O-N 2.91Å; F236-S239 WeakPolarHBondContact O-CB 3.38Å; F236-S239 PolarHBondContact O-N 2.78Å; F236-S239 PolarHBondContact O-OG 2.82Å
237	L	95.6	Very high	93.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-68.6	-38.1	177.8	-67.1	-179.6	0	0	0	112.3	V198 I219 W222 L223 H233 F234 S239 A240	V198-L237 HydrophobicContact CB-CD2 4.17Å; V198-L237 HydrophobicContact CG1-CD1 4.39Å; V198-L237 HydrophobicContact CG1-CD2 3.85Å; I219-L237 WeakPolarHBondContact CD1-O 3.41Å; I219-L237 HydrophobicContact CG1-CB 4.33Å; I219-L237 HydrophobicContact CG2-CB 4.01Å; I219-L237 HydrophobicContact CG2-CD1 4.43Å; W222-L237 HydrophobicContact CD2-CD1 4.4Å; W222-L237 HydrophobicContact CE3-CD1 3.5Å; W222-L237 HydrophobicContact CZ3-CD1 3.61Å; L223-L237 HydrophobicContact CD2-CD1 4.47Å; H233-L237 HydrophobicContact CB-CG 4.49Å; H233-L237 WeakPolarHBondContact O-CG 3.13Å; H233-L237 PolarHBondContact O-N 2.75Å; F234-L237 PolarHBondContact O-N 3.34Å; L237-S239 PolarHBondContact O-N 3.46Å; L237-A240 VanDerWaalsContact O-CB 3.32Å; L237-A240 WeakPolarHBondContact O-CB 3.35Å; L237-A240 PolarHBondContact O-N 3.22Å
238	L	94.2	Very high	93.3	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-26.3	177.2	-162.3	68	0	0	0	111.9	F216 F234 E235 A240 L241 M243 C267 F270	F216-L238 HydrophobicContact CD2-CD1 4.21Å; F216-L238 HydrophobicContact CE2-CD1 4.22Å; F234-L238 HydrophobicContact CE1-CD2 4.26Å; F234-L238 HydrophobicContact CZ-CD2 4.26Å; F234-L238 VanDerWaalsContact O-CB 3.22Å; F234-L238 WeakPolarHBondContact O-CB 3.39Å; F234-L238 PolarHBondContact O-N 2.85Å; E235-L238 PolarHBondContact O-N 3.4Å; L238-A240 PolarHBondContact O-N 3Å; L238-L241 HydrophobicContact CD1-CD2 3.78Å; L238-L241 VanDerWaalsContact O-CB 3.3Å; L238-L241 WeakPolarHBondContact O-CB 3.47Å; L238-L241 PolarHBondContact O-N 2.64Å; L238-L241 VanDerWaalsContact O-N 3.17Å; L238-M243 HydrophobicContact CD1-CE 4.03Å; L238-M243 HydrophobicContact CD2-CE 3.87Å; L238-M243 HydrophobicContact CG-CE 3.81Å; L238-C267 HydrophobicContact CD2-CB 3.91Å; L238-F270 HydrophobicContact CD2-CD2 4.37Å
239	S	92.8	Very high	93.3	Very high	24 Å²	24	40.2 Å²	40.2	17%	0.168	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.8	174.3	83.3	0	0	0	0	114.1	Y199 E235 F236 L237	Y199-S239 WeakPolarHBondContact CE2-OG 3.41Å; E235-S239 PolarHBondContact O-N 3.3Å; F236-S239 WeakPolarHBondContact O-CB 3.38Å; F236-S239 PolarHBondContact O-N 2.78Å; F236-S239 PolarHBondContact O-OG 2.82Å; L237-S239 PolarHBondContact O-N 3.46Å
240	A	94.2	Very high	93.2	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-24.7	173.4	0	0	0	0	0	113	Y199 L202 L237 L238 R242	Y199-A240 HydrophobicContact CD2-CB 3.98Å; Y199-A240 HydrophobicContact CE2-CB 3.92Å; L202-A240 HydrophobicContact CB-CB 4.09Å; L237-A240 VanDerWaalsContact O-CB 3.32Å; L237-A240 WeakPolarHBondContact O-CB 3.35Å; L237-A240 PolarHBondContact O-N 3.22Å; L238-A240 PolarHBondContact O-N 3Å; A240-R242 PolarHBondContact O-NH1 3.33Å
241	L	94.8	Very high	93.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.	S	Bend	trans	-67.7	134	-179.4	-173	65.6	0	0	0	111.1	E212 V215 F216 I219 L238 M243 L246 I255	E212-L241 HydrophobicContact CB-CD1 4.28Å; E212-L241 WeakPolarHBondContact O-CD1 3.48Å; V215-L241 HydrophobicContact CB-CD1 3.88Å; V215-L241 HydrophobicContact CG1-CD1 3.89Å; F216-L241 HydrophobicContact CB-CD1 4.09Å; F216-L241 HydrophobicContact CB-CD2 4.24Å; F216-L241 HydrophobicContact CD2-CD2 3.96Å; I219-L241 HydrophobicContact CD1-CB 4.43Å; L238-L241 HydrophobicContact CD1-CD2 3.78Å; L238-L241 VanDerWaalsContact O-CB 3.3Å; L238-L241 WeakPolarHBondContact O-CB 3.47Å; L238-L241 PolarHBondContact O-N 2.64Å; L238-L241 VanDerWaalsContact O-N 3.17Å; L241-M243 HydrophobicContact CD2-CE 4.26Å; L241-M243 PolarHBondContact O-N 3.11Å; L241-L246 HydrophobicContact CD1-CD1 4.39Å; L241-L246 HydrophobicContact CD2-CD1 3.83Å; L241-L246 HydrophobicContact CG-CD1 4.16Å; L241-I255 HydrophobicContact CD2-CD1 3.85Å
242	R	92.8	Very high	93.1	Very high	5 Å²	5	31.4 Å²	31.4	2%	0.019	18%	0.176	C	C	.	.			trans	-81.6	61.7	174.7	-46.4	-57.9	-172.9	-136.4	7.2	109.9	S203 D205 E212 A240 P244 L245 K291 R292	S203-R242 PolarHBondContact O-NH2 3.4Å; D205-R242 IonicContact OD1-CZ 3.56Å; D205-R242 IonicContact OD1-NE 3.55Å; D205-R242 IonicContact OD1-NH2 3.29Å; D205-R242 PolarHBondContact OD1-NH2 2.99Å; E212-R242 VanDerWaalsContact CD-CB 3.46Å; E212-R242 HydrophobicContact CG-CB 3.82Å; E212-R242 HydrophobicContact CG-CG 4.37Å; E212-R242 WeakPolarHBondContact OE2-CB 3.39Å; E212-R242 WeakPolarHBondContact OE2-CG 3.49Å; E212-R242 PolarHBondContact OE2-N 3.44Å; A240-R242 PolarHBondContact O-NH1 3.33Å; R242-P244 VanDerWaalsContact C-N 3.34Å; R242-L245 HydrophobicContact CB-CB 4.34Å; R242-L245 HydrophobicContact CB-CD1 3.74Å; R242-L245 HydrophobicContact CB-CG 4.06Å; R242-L245 HydrophobicContact CG-CD1 4.4Å; R242-L245 WeakPolarHBondContact O-CA 3.47Å; R242-L245 WeakPolarHBondContact O-CB 3.38Å; R242-L245 PolarHBondContact O-N 3.11Å; R242-K291 VanDerWaalsContact CD-O 3.24Å; R242-K291 WeakPolarHBondContact CD-O 3.36Å; R242-K291 PolarHBondContact NE-O 2.92Å; R242-K291 VanDerWaalsContact NE-O 3.13Å; R242-R292 WeakPolarHBondContact CA-O 3.31Å; R242-R292 WeakPolarHBondContact CB-O 3.4Å
243	M	92.4	Very high	93	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-52.5	-38.8	-170.9	-165.6	179.1	-67.1	0	0	114.8	L238 L241 L245 L246 I251 I255 F270 I271 A274	L238-M243 HydrophobicContact CD1-CE 4.03Å; L238-M243 HydrophobicContact CD2-CE 3.87Å; L238-M243 HydrophobicContact CG-CE 3.81Å; L241-M243 HydrophobicContact CD2-CE 4.26Å; L241-M243 PolarHBondContact O-N 3.11Å; M243-L245 PolarHBondContact O-N 3.18Å; M243-L245 VanDerWaalsContact O-N 3.11Å; M243-L246 HydrophobicContact CG-CD1 4.34Å; M243-L246 WeakPolarHBondContact O-CB 3.31Å; M243-L246 PolarHBondContact O-N 3.48Å; M243-L246 VanDerWaalsContact O-N 3.11Å; M243-I251 HydrophobicContact CG-CD1 4.33Å; M243-I251 HydrophobicContact CG-CG1 4.38Å; M243-I255 HydrophobicContact CE-CD1 4.11Å; M243-I255 HydrophobicContact CE-CG2 3.93Å; M243-I255 HydrophobicContact CG-CD1 4.3Å; M243-F270 HydrophobicContact CE-CB 3.93Å; M243-F270 VanDerWaalsContact SD-C 3.57Å; M243-F270 HydrophobicContact SD-CB 3.92Å; M243-I271 HydrophobicContact CE-CG1 4.43Å; M243-I271 HydrophobicContact SD-CB 4.36Å; M243-I271 HydrophobicContact SD-CG1 3.75Å; M243-A274 HydrophobicContact CB-CB 4.31Å; M243-A274 HydrophobicContact CG-CB 3.84Å; M243-A274 HydrophobicContact SD-CB 4.34Å
244	P	90.2	Very high	92.9	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-61.2	-14.7	173.9	-23.4	34.4	0	0	0	115.4	R242 A274 F277 H278 L289	R242-P244 VanDerWaalsContact C-N 3.34Å; P244-A274 HydrophobicContact CG-CB 4.35Å; P244-F277 HydrophobicContact CB-CB 4.04Å; P244-F277 HydrophobicContact CB-CD1 3.89Å; P244-F277 HydrophobicContact CB-CE1 4.48Å; P244-F277 HydrophobicContact CB-CG 3.91Å; P244-F277 WeakPolarHBondContact O-CD1 3.42Å; P244-F277 WeakPolarHBondContact O-CE1 3.44Å; P244-H278 PolarHBondContact O-CE1 3.25Å; P244-H278 PolarHBondContact O-NE2 3.22Å; P244-L289 HydrophobicContact CB-CD1 3.79Å; P244-L289 HydrophobicContact CB-CD2 4.42Å; P244-L289 HydrophobicContact CG-CD1 3.9Å; P244-L289 HydrophobicContact CG-CD2 3.79Å; P244-L289 HydrophobicContact CG-CG 4.43Å
245	L	88.9	Confident	92.8	Very high	44 Å²	44	34 Å²	34	23%	0.23	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-97.5	-1.1	179.2	-52.3	-177.3	0	0	0	112.8	E212 R242 M243 P295	E212-L245 HydrophobicContact CG-CB 4.39Å; R242-L245 HydrophobicContact CB-CB 4.34Å; R242-L245 HydrophobicContact CB-CD1 3.74Å; R242-L245 HydrophobicContact CB-CG 4.06Å; R242-L245 HydrophobicContact CG-CD1 4.4Å; R242-L245 WeakPolarHBondContact O-CA 3.47Å; R242-L245 WeakPolarHBondContact O-CB 3.38Å; R242-L245 PolarHBondContact O-N 3.11Å; M243-L245 PolarHBondContact O-N 3.18Å; M243-L245 VanDerWaalsContact O-N 3.11Å; L245-P295 VanDerWaalsContact CD1-CA 3.41Å; L245-P295 HydrophobicContact CD1-CB 3.81Å
246	L	91.9	Very high	92.7	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.021	18%	0.182	C	C	.	.	S	Bend	trans	-81.1	154.7	172.4	-71.7	168	0	0	0	110.9	E212 T213 L241 M243 F250 I251 I255 H278	E212-L246 HydrophobicContact CB-CD2 3.52Å; E212-L246 HydrophobicContact CB-CG 3.93Å; T213-L246 HydrophobicContact CG2-CD2 3.76Å; L241-L246 HydrophobicContact CD1-CD1 4.39Å; L241-L246 HydrophobicContact CD2-CD1 3.83Å; L241-L246 HydrophobicContact CG-CD1 4.16Å; M243-L246 HydrophobicContact CG-CD1 4.34Å; M243-L246 WeakPolarHBondContact O-CB 3.31Å; M243-L246 PolarHBondContact O-N 3.48Å; M243-L246 VanDerWaalsContact O-N 3.11Å; L246-F250 HydrophobicContact CD1-CD1 4.05Å; L246-F250 HydrophobicContact CD1-CE1 4.24Å; L246-F250 HydrophobicContact CD2-CD1 3.9Å; L246-F250 HydrophobicContact CD2-CE1 4.1Å; L246-F250 HydrophobicContact CG-CD1 4.42Å; L246-I251 HydrophobicContact CB-CD1 4.15Å; L246-I251 HydrophobicContact CB-CG1 3.82Å; L246-I251 HydrophobicContact CD1-CG1 4.44Å; L246-I255 HydrophobicContact CD1-CD1 3.53Å; L246-H278 PolarHBondContact O-CE1 2.89Å; L246-H278 PolarHBondContact O-NE2 3.15Å
247	A	91	Very high	92.5	Very high	41 Å²	41	36.1 Å²	36.1	34%	0.339	20%	0.195	S	C	.	.			trans	-67	139.4	172.7	0	0	0	0	0	110.8	N249 F250 I251	A247-N249 VanDerWaalsContact C-N 3.25Å; A247-N249 WeakPolarHBondContact CB-OD1 3.23Å; A247-N249 PolarHBondContact O-N 2.94Å; A247-F250 HydrophobicContact CB-CB 4.45Å; A247-F250 WeakPolarHBondContact O-CB 3.28Å; A247-F250 PolarHBondContact O-N 3.39Å; A247-I251 PolarHBondContact O-N 3.18Å; A247-I251 VanDerWaalsContact O-N 3.15Å
248	P	91.7	Very high	92.3	Very high	58 Å²	58	38 Å²	38	38%	0.377	20%	0.203	S	C	.	.	H	α-helix	trans	-55.7	-36.1	-177.3	-28.9	34.7	0	0	0	114.7	I251 A252 H278	P248-I251 PolarHBondContact O-N 3.09Å; P248-A252 PolarHBondContact O-N 2.93Å; P248-A252 VanDerWaalsContact O-N 3.08Å; P248-H278 HydrophobicContact CG-CB 4.27Å
249	N	92.7	Very high	92.1	Very high	101 Å²	101	42.7 Å²	42.7	54%	0.54	23%	0.234	S	C	.	.	H	α-helix	trans	-66	-39.2	175.3	60.4	-29.2	0	0	0	112.1	A247 I251 A252 D253	A247-N249 VanDerWaalsContact C-N 3.25Å; A247-N249 WeakPolarHBondContact CB-OD1 3.23Å; A247-N249 PolarHBondContact O-N 2.94Å; N249-I251 VanDerWaalsContact C-N 3.34Å; N249-I251 PolarHBondContact O-N 3.23Å; N249-A252 PolarHBondContact O-N 3.44Å; N249-D253 VanDerWaalsContact O-CB 3.24Å; N249-D253 WeakPolarHBondContact O-CB 3.49Å; N249-D253 PolarHBondContact O-N 3.27Å
250	F	93.4	Very high	91.9	Very high	29 Å²	29	42.1 Å²	42.1	13%	0.127	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-42.4	175.5	-173	-85	0	0	0	111.4	T213 F216 L246 A247 R254 I255	T213-F250 HydrophobicContact CG2-CD1 4.28Å; T213-F250 HydrophobicContact CG2-CD2 3.62Å; T213-F250 HydrophobicContact CG2-CE1 4.16Å; T213-F250 HydrophobicContact CG2-CE2 3.47Å; T213-F250 VanDerWaalsContact CG2-CE2 3.47Å; T213-F250 HydrophobicContact CG2-CG 4.03Å; T213-F250 HydrophobicContact CG2-CZ 3.75Å; F216-F250 HydrophobicContact CB-CE1 4.25Å; F216-F250 HydrophobicContact CB-CZ 4.37Å; F216-F250 AromaticContact CD1-CE1 3.92Å; F216-F250 HydrophobicContact CD1-CE1 3.92Å; F216-F250 AromaticContact CD1-CZ 3.77Å; F216-F250 HydrophobicContact CD1-CZ 3.77Å; F216-F250 HydrophobicContact CE1-CZ 4.47Å; F216-F250 HydrophobicContact CG-CE1 4.14Å; F216-F250 HydrophobicContact CG-CZ 4.32Å; L246-F250 HydrophobicContact CD1-CD1 4.05Å; L246-F250 HydrophobicContact CD1-CE1 4.24Å; L246-F250 HydrophobicContact CD2-CD1 3.9Å; L246-F250 HydrophobicContact CD2-CE1 4.1Å; L246-F250 HydrophobicContact CG-CD1 4.42Å; A247-F250 HydrophobicContact CB-CB 4.45Å; A247-F250 WeakPolarHBondContact O-CB 3.28Å; A247-F250 PolarHBondContact O-N 3.39Å; F250-R254 HydrophobicContact CD1-CB 4.39Å; F250-R254 HydrophobicContact CD2-CG 4.11Å; F250-R254 HydrophobicContact CE1-CB 4.16Å; F250-R254 HydrophobicContact CE2-CB 4.35Å; F250-R254 HydrophobicContact CE2-CG 3.95Å; F250-R254 HydrophobicContact CZ-CB 4.14Å; F250-R254 HydrophobicContact CZ-CG 4.23Å; F250-R254 WeakPolarHBondContact O-CB 3.3Å; F250-R254 PolarHBondContact O-N 3.07Å; F250-I255 HydrophobicContact CD1-CD1 4.38Å; F250-I255 HydrophobicContact CD1-CG1 4.4Å; F250-I255 HydrophobicContact CE1-CD1 4.32Å; F250-I255 HydrophobicContact CE1-CG1 4.26Å
251	I	93.3	Very high	91.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.229	C	C	.	.	I	π-helix	trans	-59	-51.7	176.5	-60.5	169.4	0	0	0	110	M243 L246 A247 P248 N249 I255 E256 I271 A274 Y275	M243-I251 HydrophobicContact CG-CD1 4.33Å; M243-I251 HydrophobicContact CG-CG1 4.38Å; L246-I251 HydrophobicContact CB-CD1 4.15Å; L246-I251 HydrophobicContact CB-CG1 3.82Å; L246-I251 HydrophobicContact CD1-CG1 4.44Å; A247-I251 PolarHBondContact O-N 3.18Å; A247-I251 VanDerWaalsContact O-N 3.15Å; P248-I251 PolarHBondContact O-N 3.09Å; N249-I251 VanDerWaalsContact C-N 3.34Å; N249-I251 PolarHBondContact O-N 3.23Å; I251-I255 WeakPolarHBondContact O-CA 3.5Å; I251-I255 WeakPolarHBondContact O-CB 3.4Å; I251-I255 PolarHBondContact O-N 3.13Å; I251-I255 VanDerWaalsContact O-N 3.12Å; I251-E256 PolarHBondContact O-N 3.3Å; I251-I271 HydrophobicContact CG2-CG1 4.48Å; I251-I271 HydrophobicContact CG2-CG2 4.07Å; I251-A274 HydrophobicContact CD1-CB 3.82Å; I251-Y275 HydrophobicContact CB-CE1 4.3Å; I251-Y275 HydrophobicContact CG2-CE1 4Å
252	A	92.6	Very high	90.9	Very high	29 Å²	29	46.6 Å²	46.6	24%	0.24	26%	0.26	C	S	.	.	I	π-helix	trans	-63.3	-46	-179.5	0	0	0	0	0	112.6	P248 N249 E256 N257	P248-A252 PolarHBondContact O-N 2.93Å; P248-A252 VanDerWaalsContact O-N 3.08Å; N249-A252 PolarHBondContact O-N 3.44Å; A252-E256 WeakPolarHBondContact O-CB 3.47Å; A252-N257 PolarHBondContact O-ND2 3.03Å
253	D	92.8	Very high	90.2	Very high	107 Å²	107	51.9 Å²	51.9	57%	0.572	29%	0.285	S	S	*	.	I	π-helix	trans	-79.4	-39.8	-170.3	-67.3	-22.5	0	0	0	112.5	N249 N257	N249-D253 VanDerWaalsContact O-CB 3.24Å; N249-D253 WeakPolarHBondContact O-CB 3.49Å; N249-D253 PolarHBondContact O-N 3.27Å; D253-N257 PolarHBondContact O-ND2 2.95Å
254	R	92.7	Very high	89.8	Confident	116 Å²	116	53.1 Å²	53.1	44%	0.438	29%	0.292	S	S	.	.	I	π-helix	trans	-106.1	-37.1	-170.2	-64.1	-74.5	-66.7	-82.9	-7.5	113.8	F216 D217 F250	F216-R254 HydrophobicContact CE1-CB 4.18Å; D217-R254 IonicContact OD1-CZ 3.28Å; D217-R254 IonicContact OD1-NH2 3.06Å; D217-R254 PolarHBondContact OD1-NH2 3.48Å; F250-R254 HydrophobicContact CD1-CB 4.39Å; F250-R254 HydrophobicContact CD2-CG 4.11Å; F250-R254 HydrophobicContact CE1-CB 4.16Å; F250-R254 HydrophobicContact CE2-CB 4.35Å; F250-R254 HydrophobicContact CE2-CG 3.95Å; F250-R254 HydrophobicContact CZ-CB 4.14Å; F250-R254 HydrophobicContact CZ-CG 4.23Å; F250-R254 WeakPolarHBondContact O-CB 3.3Å; F250-R254 PolarHBondContact O-N 3.07Å
255	I	92.9	Very high	89.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.33	C	S	.	.	I	π-helix	trans	-90.6	-51	-175.5	-54.6	-174.6	0	0	0	110.5	F216 L241 M243 L246 F250 I251 N257 H258 I271	F216-I255 HydrophobicContact CD2-CD1 4.24Å; F216-I255 HydrophobicContact CD2-CG1 4.1Å; F216-I255 HydrophobicContact CE2-CD1 4.35Å; F216-I255 HydrophobicContact CE2-CG1 3.78Å; F216-I255 HydrophobicContact CZ-CG1 4.01Å; L241-I255 HydrophobicContact CD2-CD1 3.85Å; M243-I255 HydrophobicContact CE-CD1 4.11Å; M243-I255 HydrophobicContact CE-CG2 3.93Å; M243-I255 HydrophobicContact CG-CD1 4.3Å; L246-I255 HydrophobicContact CD1-CD1 3.53Å; F250-I255 HydrophobicContact CD1-CD1 4.38Å; F250-I255 HydrophobicContact CD1-CG1 4.4Å; F250-I255 HydrophobicContact CE1-CD1 4.32Å; F250-I255 HydrophobicContact CE1-CG1 4.26Å; I251-I255 WeakPolarHBondContact O-CA 3.5Å; I251-I255 WeakPolarHBondContact O-CB 3.4Å; I251-I255 PolarHBondContact O-N 3.13Å; I251-I255 VanDerWaalsContact O-N 3.12Å; I255-N257 VanDerWaalsContact C-N 3.26Å; I255-N257 PolarHBondContact O-N 3.41Å; I255-H258 VanDerWaalsContact O-CB 3.28Å; I255-H258 WeakPolarHBondContact O-CB 3.38Å; I255-H258 PolarHBondContact O-N 3.14Å; I255-H258 VanDerWaalsContact O-N 3.09Å; I255-I271 HydrophobicContact CG2-CD1 4.24Å; I255-I271 HydrophobicContact CG2-CG1 4.38Å
256	E	91.2	Very high	89.3	Confident	81 Å²	81	62.5 Å²	62.5	38%	0.379	33%	0.334	S	S	.	.	I	π-helix	trans	-63.2	-34.2	-178	-163.8	171.5	163.3	0	0	112.2	I251 A252 L261 I271 Y275	I251-E256 PolarHBondContact O-N 3.3Å; A252-E256 WeakPolarHBondContact O-CB 3.47Å; E256-L261 HydrophobicContact CG-CD2 4.49Å; E256-L261 VanDerWaalsContact O-CD2 3.28Å; E256-L261 WeakPolarHBondContact O-CD2 3.46Å; E256-I271 HydrophobicContact CB-CD1 4.49Å; E256-Y275 PolarHBondContact OE2-OH 3.12Å
257	N	90	Very high	89.2	Confident	117 Å²	117	62.3 Å²	62.3	63%	0.626	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	3.5	177.1	-63.2	-44.7	0	0	0	114.2	A252 D253 I255	A252-N257 PolarHBondContact O-ND2 3.03Å; D253-N257 PolarHBondContact O-ND2 2.95Å; I255-N257 VanDerWaalsContact C-N 3.26Å; I255-N257 PolarHBondContact O-N 3.41Å
258	H	91.7	Very high	89.1	Confident	39 Å²	39	65.1 Å²	65.1	18%	0.181	34%	0.336	C	S	.	.			trans	-68.8	130.6	-178.2	-167.4	-89.1	0	0	0	110.8	F234 I255 L260 L261	F234-H258 AromaticContact CE2-CE1 3.83Å; F234-H258 AromaticContact CE2-ND1 3.69Å; F234-H258 HydrophobicContact CZ-CB 4.4Å; F234-H258 AromaticContact CZ-ND1 3.53Å; I255-H258 VanDerWaalsContact O-CB 3.28Å; I255-H258 WeakPolarHBondContact O-CB 3.38Å; I255-H258 PolarHBondContact O-N 3.14Å; I255-H258 VanDerWaalsContact O-N 3.09Å; H258-L260 VanDerWaalsContact C-N 3.28Å; H258-L260 PolarHBondContact ND1-N 3.07Å; H258-L260 PolarHBondContact O-N 3.43Å; H258-L260 VanDerWaalsContact O-N 3.13Å; H258-L261 VanDerWaalsContact O-CB 3.23Å; H258-L261 WeakPolarHBondContact O-CB 3.24Å; H258-L261 PolarHBondContact O-N 3.49Å
259	P	90	Very high	89	Confident	100 Å²	100	67.5 Å²	67.5	65%	0.649	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-54.7	-39	-173.7	-28.8	35	0	0	0	114.8	L261 S262	P259-L261 PolarHBondContact O-N 3.29Å; P259-S262 PolarHBondContact O-OG 2.86Å
260	L	89.6	Confident	88.9	Confident	12 Å²	12	63.3 Å²	63.3	6%	0.063	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-71.5	-12.3	-179.8	-60	-177	0	0	0	114.3	L223 L227 K231 F234 H258 S262 E263 N264	L223-L260 HydrophobicContact CD1-CD1 4.33Å; L227-L260 HydrophobicContact CD1-CD1 3.89Å; L227-L260 HydrophobicContact CD1-CD2 4.28Å; L227-L260 HydrophobicContact CD1-CG 4.45Å; K231-L260 HydrophobicContact CB-CD1 4.05Å; K231-L260 HydrophobicContact CB-CD2 3.82Å; K231-L260 HydrophobicContact CD-CD2 4.47Å; F234-L260 HydrophobicContact CB-CB 4.43Å; F234-L260 HydrophobicContact CB-CD1 4.11Å; F234-L260 HydrophobicContact CD1-CB 3.73Å; F234-L260 HydrophobicContact CD2-CB 4.22Å; F234-L260 HydrophobicContact CD2-CD1 3.95Å; F234-L260 HydrophobicContact CE1-CB 3.95Å; F234-L260 HydrophobicContact CE2-CB 4.41Å; F234-L260 HydrophobicContact CG-CB 3.86Å; F234-L260 HydrophobicContact CG-CD1 4.02Å; F234-L260 HydrophobicContact CZ-CB 4.29Å; H258-L260 VanDerWaalsContact C-N 3.28Å; H258-L260 PolarHBondContact ND1-N 3.07Å; H258-L260 PolarHBondContact O-N 3.43Å; H258-L260 VanDerWaalsContact O-N 3.13Å; L260-S262 VanDerWaalsContact C-N 3.34Å; L260-E263 PolarHBondContact O-N 3.33Å; L260-N264 PolarHBondContact O-ND2 3.2Å
261	L	87.1	Confident	88.8	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-68.2	-37.5	179.5	-166	80.1	0	0	0	111.5	F234 E256 H258 P259 E263 N264 C267 Y268 I271	F234-L261 HydrophobicContact CE1-CB 4.45Å; F234-L261 HydrophobicContact CE1-CD1 4.21Å; E256-L261 HydrophobicContact CG-CD2 4.49Å; E256-L261 VanDerWaalsContact O-CD2 3.28Å; E256-L261 WeakPolarHBondContact O-CD2 3.46Å; H258-L261 VanDerWaalsContact O-CB 3.23Å; H258-L261 WeakPolarHBondContact O-CB 3.24Å; H258-L261 PolarHBondContact O-N 3.49Å; P259-L261 PolarHBondContact O-N 3.29Å; L261-E263 PolarHBondContact O-N 2.65Å; L261-E263 VanDerWaalsContact O-N 3.13Å; L261-N264 CarbonylContact O-C 3.59Å; L261-N264 PolarHBondContact O-N 2.94Å; L261-C267 HydrophobicContact CD1-CB 3.29Å; L261-C267 HydrophobicContact CG-CB 4.42Å; L261-Y268 HydrophobicContact CD2-CD1 4.49Å; L261-Y268 HydrophobicContact CD2-CE1 3.88Å; L261-Y268 HydrophobicContact CD2-CE2 4.35Å; L261-Y268 HydrophobicContact CG-CE2 4.2Å; L261-I271 HydrophobicContact CD1-CD1 4Å; L261-I271 HydrophobicContact CD2-CD1 3.66Å; L261-I271 HydrophobicContact CG-CD1 4.46Å
262	S	80	Confident	88.6	Confident	93 Å²	93	67.1 Å²	67.1	65%	0.65	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-59.4	-24.7	178.8	66.5	0	0	0	0	113.5	P259 L260	P259-S262 PolarHBondContact O-OG 2.86Å; L260-S262 VanDerWaalsContact C-N 3.34Å
263	E	78.9	Confident	88.4	Confident	116 Å²	116	67.6 Å²	67.6	54%	0.542	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-86.5	-14.8	178	-60.8	-174.3	-168.3	0	0	112.7	K231 L260 L261	K231-E263 IonicContact NZ-OE1 3.31Å; K231-E263 IonicContact NZ-OE2 3.5Å; K231-E263 PolarHBondContact NZ-OE2 2.99Å; K231-E263 VanDerWaalsContact NZ-OE2 3.09Å; L260-E263 PolarHBondContact O-N 3.33Å; L261-E263 PolarHBondContact O-N 2.65Å; L261-E263 VanDerWaalsContact O-N 3.13Å
264	N	83.8	Confident	88.3	Confident	28 Å²	28	62.5 Å²	62.5	15%	0.15	31%	0.31	C	S	.	.			trans	-125.1	89.1	-170.2	-68.7	-78.8	0	0	0	112.3	L260 L261 Q266 C267	L260-N264 PolarHBondContact O-ND2 3.2Å; L261-N264 CarbonylContact O-C 3.59Å; L261-N264 PolarHBondContact O-N 2.94Å; N264-Q266 PolarHBondContact O-N 2.8Å; N264-Q266 VanDerWaalsContact O-N 3.15Å; N264-C267 HydrophobicContact CB-CB 4.33Å; N264-C267 VanDerWaalsContact CB-SG 3.58Å; N264-C267 WeakPolarHBondContact O-CB 3.38Å; N264-C267 PolarHBondContact O-N 3.25Å; N264-C267 VanDerWaalsContact O-N 3.14Å
265	Q	82.4	Confident	88.2	Confident	172 Å²	172	59.7 Å²	59.7	80%	0.804	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-30.8	180	-69.6	-173.1	-5.4	0	0	113.5	C267 Y268	Q265-C267 VanDerWaalsContact C-N 3.3Å; Q265-C267 PolarHBondContact O-N 2.88Å; Q265-Y268 WeakPolarHBondContact O-CB 3.12Å; Q265-Y268 PolarHBondContact O-N 3.13Å
266	Q	85.1	Confident	87.9	Confident	69 Å²	69	65.9 Å²	65.9	32%	0.322	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-29.4	-178.3	-168.2	59.9	14.2	0	0	112.4	E235 N264 Y268 Q269	E235-Q266 VanDerWaalsContact CD-CB 3.5Å; E235-Q266 HydrophobicContact CG-CB 4.05Å; E235-Q266 HydrophobicContact CG-CG 4.19Å; E235-Q266 VanDerWaalsContact OE1-CG 3.29Å; E235-Q266 WeakPolarHBondContact OE1-CG 3.32Å; E235-Q266 WeakPolarHBondContact OE2-CB 3.49Å; N264-Q266 PolarHBondContact O-N 2.8Å; N264-Q266 VanDerWaalsContact O-N 3.15Å; Q266-Y268 PolarHBondContact O-N 2.76Å; Q266-Q269 VanDerWaalsContact NE2-CD 3.34Å; Q266-Q269 VanDerWaalsContact O-CB 3.29Å; Q266-Q269 WeakPolarHBondContact O-CB 3.48Å; Q266-Q269 PolarHBondContact O-N 2.82Å
267	C	89.5	Confident	87.6	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-29.3	176.2	-64.8	0	0	0	0	112.6	L238 L261 N264 Q265 Q269 F270 I271	L238-C267 HydrophobicContact CD2-CB 3.91Å; L261-C267 HydrophobicContact CD1-CB 3.29Å; L261-C267 HydrophobicContact CG-CB 4.42Å; N264-C267 HydrophobicContact CB-CB 4.33Å; N264-C267 VanDerWaalsContact CB-SG 3.58Å; N264-C267 WeakPolarHBondContact O-CB 3.38Å; N264-C267 PolarHBondContact O-N 3.25Å; N264-C267 VanDerWaalsContact O-N 3.14Å; Q265-C267 VanDerWaalsContact C-N 3.3Å; Q265-C267 PolarHBondContact O-N 2.88Å; C267-Q269 PolarHBondContact O-N 2.79Å; C267-F270 WeakPolarHBondContact O-CB 3.36Å; C267-F270 PolarHBondContact O-N 2.79Å; C267-F270 VanDerWaalsContact O-N 3.12Å; C267-I271 PolarHBondContact O-N 2.81Å
268	Y	90.2	Very high	87.3	Confident	100 Å²	100	59.6 Å²	59.6	39%	0.392	29%	0.293	S	S	.	.	H	α-helix	trans	-63.6	-26	173.7	-74	-80.4	0	0	0	112.5	L261 Q265 Q266 F270 I271 L272	L261-Y268 HydrophobicContact CD2-CD1 4.49Å; L261-Y268 HydrophobicContact CD2-CE1 3.88Å; L261-Y268 HydrophobicContact CD2-CE2 4.35Å; L261-Y268 HydrophobicContact CG-CE2 4.2Å; Q265-Y268 WeakPolarHBondContact O-CB 3.12Å; Q265-Y268 PolarHBondContact O-N 3.13Å; Q266-Y268 PolarHBondContact O-N 2.76Å; Y268-F270 VanDerWaalsContact C-N 3.34Å; Y268-I271 HydrophobicContact CD1-CD1 4.49Å; Y268-I271 PolarHBondContact O-N 3.31Å; Y268-L272 WeakPolarHBondContact O-CB 3.5Å; Y268-L272 VanDerWaalsContact O-CG 3.24Å; Y268-L272 WeakPolarHBondContact O-CG 3.38Å; Y268-L272 PolarHBondContact O-N 3.47Å
269	Q	89.7	Confident	87	Confident	107 Å²	107	64.3 Å²	64.3	50%	0.5	32%	0.319	S	S	.	.	H	α-helix	trans	-66.1	-38.1	174.1	-60.7	-171.9	2.7	0	0	111.4	Q266 C267 L272 E273	Q266-Q269 VanDerWaalsContact NE2-CD 3.34Å; Q266-Q269 VanDerWaalsContact O-CB 3.29Å; Q266-Q269 WeakPolarHBondContact O-CB 3.48Å; Q266-Q269 PolarHBondContact O-N 2.82Å; C267-Q269 PolarHBondContact O-N 2.79Å; Q269-L272 PolarHBondContact O-N 2.7Å; Q269-E273 WeakPolarHBondContact O-CB 3.07Å; Q269-E273 PolarHBondContact O-N 3.48Å
270	F	90.2	Very high	86.6	Confident	14 Å²	14	62.6 Å²	62.6	6%	0.061	30%	0.304	C	S	.	.	H	α-helix	trans	-66	-41.1	175.8	-54.2	-38.9	0	0	0	111.8	E235 L238 M243 C267 Y268 E273 A274 R292	E235-F270 HydrophobicContact CG-CE2 4.24Å; L238-F270 HydrophobicContact CD2-CD2 4.37Å; M243-F270 HydrophobicContact CE-CB 3.93Å; M243-F270 VanDerWaalsContact SD-C 3.57Å; M243-F270 HydrophobicContact SD-CB 3.92Å; C267-F270 WeakPolarHBondContact O-CB 3.36Å; C267-F270 PolarHBondContact O-N 2.79Å; C267-F270 VanDerWaalsContact O-N 3.12Å; Y268-F270 VanDerWaalsContact C-N 3.34Å; F270-E273 WeakPolarHBondContact O-CB 3.44Å; F270-E273 PolarHBondContact O-N 2.91Å; F270-A274 PolarHBondContact O-N 2.82Å; F270-R292 VanDerWaalsContact CE1-NH1 3.33Å
271	I	91.8	Very high	85.7	Confident	5 Å²	5	64.5 Å²	64.5	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-64.2	-45.6	176.7	-64	172.3	0	0	0	110.7	M243 I251 I255 E256 L261 C267 Y268 E273 A274 Y275	M243-I271 HydrophobicContact CE-CG1 4.43Å; M243-I271 HydrophobicContact SD-CB 4.36Å; M243-I271 HydrophobicContact SD-CG1 3.75Å; I251-I271 HydrophobicContact CG2-CG1 4.48Å; I251-I271 HydrophobicContact CG2-CG2 4.07Å; I255-I271 HydrophobicContact CG2-CD1 4.24Å; I255-I271 HydrophobicContact CG2-CG1 4.38Å; E256-I271 HydrophobicContact CB-CD1 4.49Å; L261-I271 HydrophobicContact CD1-CD1 4Å; L261-I271 HydrophobicContact CD2-CD1 3.66Å; L261-I271 HydrophobicContact CG-CD1 4.46Å; C267-I271 PolarHBondContact O-N 2.81Å; Y268-I271 HydrophobicContact CD1-CD1 4.49Å; Y268-I271 PolarHBondContact O-N 3.31Å; I271-E273 VanDerWaalsContact C-N 3.32Å; I271-E273 PolarHBondContact O-N 2.86Å; I271-A274 PolarHBondContact O-N 2.8Å; I271-Y275 HydrophobicContact CG2-CD2 3.7Å; I271-Y275 HydrophobicContact CG2-CE2 3.35Å; I271-Y275 PolarHBondContact O-N 3.46Å
272	L	89.3	Confident	84.6	Confident	103 Å²	103	72.4 Å²	72.4	54%	0.539	35%	0.354	S	S	.	.	H	α-helix	trans	-62.7	-38.5	177	-73.2	171	0	0	0	112.3	Y268 Q269 K276	Y268-L272 WeakPolarHBondContact O-CB 3.5Å; Y268-L272 VanDerWaalsContact O-CG 3.24Å; Y268-L272 WeakPolarHBondContact O-CG 3.38Å; Y268-L272 PolarHBondContact O-N 3.47Å; Q269-L272 PolarHBondContact O-N 2.7Å; L272-K276 WeakPolarHBondContact O-CB 3.12Å; L272-K276 VanDerWaalsContact O-CG 3.28Å; L272-K276 WeakPolarHBondContact O-CG 3.5Å; L272-K276 PolarHBondContact O-N 3Å
273	E	88.3	Confident	84	Confident	39 Å²	39	72.3 Å²	72.3	18%	0.182	34%	0.343	C	S	.	.	H	α-helix	trans	-61.5	-47.2	173.6	179.9	-178.7	125.3	0	0	111.3	Q269 F270 I271 K276 F277 L289 R292	Q269-E273 WeakPolarHBondContact O-CB 3.07Å; Q269-E273 PolarHBondContact O-N 3.48Å; F270-E273 WeakPolarHBondContact O-CB 3.44Å; F270-E273 PolarHBondContact O-N 2.91Å; I271-E273 VanDerWaalsContact C-N 3.32Å; I271-E273 PolarHBondContact O-N 2.86Å; E273-K276 PolarHBondContact O-N 2.94Å; E273-F277 PolarHBondContact O-N 2.83Å; E273-F277 VanDerWaalsContact O-N 3.11Å; E273-L289 HydrophobicContact CG-CD2 3.35Å; E273-L289 VanDerWaalsContact OE1-CD2 3.29Å; E273-L289 WeakPolarHBondContact OE1-CD2 3.3Å; E273-R292 IonicContact OE1-CZ 3.27Å; E273-R292 IonicContact OE1-NE 3.71Å; E273-R292 PolarHBondContact OE1-NE 3.39Å; E273-R292 IonicContact OE1-NH2 2.96Å; E273-R292 PolarHBondContact OE1-NH2 2.85Å; E273-R292 IonicContact OE2-CZ 3.87Å; E273-R292 IonicContact OE2-NE 2.63Å; E273-R292 IonicContact OE2-NH2 3.69Å; E273-R292 PolarHBondContact OE2-NH2 3.48Å
274	A	89.8	Confident	83.6	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-63	-46.9	177.4	0	0	0	0	0	112.1	M243 P244 I251 F270 I271 K276 F277 H278	M243-A274 HydrophobicContact CB-CB 4.31Å; M243-A274 HydrophobicContact CG-CB 3.84Å; M243-A274 HydrophobicContact SD-CB 4.34Å; P244-A274 HydrophobicContact CG-CB 4.35Å; I251-A274 HydrophobicContact CD1-CB 3.82Å; F270-A274 PolarHBondContact O-N 2.82Å; I271-A274 PolarHBondContact O-N 2.8Å; A274-K276 VanDerWaalsContact C-N 3.34Å; A274-K276 PolarHBondContact O-N 3.09Å; A274-F277 WeakPolarHBondContact O-CB 3.23Å; A274-F277 PolarHBondContact O-N 3.26Å; A274-F277 VanDerWaalsContact O-N 3.12Å; A274-H278 PolarHBondContact O-CD2 2.88Å; A274-H278 PolarHBondContact O-N 2.7Å; A274-H278 VanDerWaalsContact O-N 3.12Å
275	Y	89.8	Confident	82.6	Confident	57 Å²	57	73.8 Å²	73.8	22%	0.224	35%	0.346	C	S	.	.	H	α-helix	trans	-61.8	-39.2	176.3	-71.5	-33.3	0	0	0	112.5	I251 E256 I271 F277 H278 L279	I251-Y275 HydrophobicContact CB-CE1 4.3Å; I251-Y275 HydrophobicContact CG2-CE1 4Å; E256-Y275 PolarHBondContact OE2-OH 3.12Å; I271-Y275 HydrophobicContact CG2-CD2 3.7Å; I271-Y275 HydrophobicContact CG2-CE2 3.35Å; I271-Y275 PolarHBondContact O-N 3.46Å; Y275-F277 VanDerWaalsContact C-N 3.3Å; Y275-F277 PolarHBondContact O-N 3.22Å; Y275-H278 PolarHBondContact O-N 2.75Å; Y275-L279 VanDerWaalsContact O-CB 3.3Å; Y275-L279 WeakPolarHBondContact O-CB 3.12Å; Y275-L279 WeakPolarHBondContact O-CD1 3.43Å; Y275-L279 WeakPolarHBondContact O-CG 3.49Å; Y275-L279 PolarHBondContact O-N 2.98Å
276	K	87.1	Confident	81.6	Confident	131 Å²	131	70.8 Å²	70.8	57%	0.57	34%	0.335	S	S	*	.	H	α-helix	trans	-59	-41.1	173.6	-78.2	174.4	-178.6	178.5	0	112.2	L272 E273 A274 H278 L279 I280	L272-K276 WeakPolarHBondContact O-CB 3.12Å; L272-K276 VanDerWaalsContact O-CG 3.28Å; L272-K276 WeakPolarHBondContact O-CG 3.5Å; L272-K276 PolarHBondContact O-N 3Å; E273-K276 PolarHBondContact O-N 2.94Å; A274-K276 VanDerWaalsContact C-N 3.34Å; A274-K276 PolarHBondContact O-N 3.09Å; K276-H278 VanDerWaalsContact C-N 3.34Å; K276-H278 PolarHBondContact O-N 3.34Å; K276-L279 PolarHBondContact O-N 3.05Å; K276-I280 PolarHBondContact O-N 2.87Å
277	F	84.5	Confident	80.7	Confident	29 Å²	29	69.7 Å²	69.7	13%	0.127	33%	0.333	C	S	.	.	H	α-helix	trans	-62.9	-37.8	177.3	179.9	-96.5	0	0	0	112.9	P244 E273 A274 Y275 R284 L289	P244-F277 HydrophobicContact CB-CB 4.04Å; P244-F277 HydrophobicContact CB-CD1 3.89Å; P244-F277 HydrophobicContact CB-CE1 4.48Å; P244-F277 HydrophobicContact CB-CG 3.91Å; P244-F277 WeakPolarHBondContact O-CD1 3.42Å; P244-F277 WeakPolarHBondContact O-CE1 3.44Å; E273-F277 PolarHBondContact O-N 2.83Å; E273-F277 VanDerWaalsContact O-N 3.11Å; A274-F277 WeakPolarHBondContact O-CB 3.23Å; A274-F277 PolarHBondContact O-N 3.26Å; A274-F277 VanDerWaalsContact O-N 3.12Å; Y275-F277 VanDerWaalsContact C-N 3.3Å; Y275-F277 PolarHBondContact O-N 3.22Å; F277-R284 HydrophobicContact CD2-CB 4.2Å; F277-R284 HydrophobicContact CD2-CG 3.69Å; F277-R284 HydrophobicContact CE2-CB 3.87Å; F277-R284 HydrophobicContact CE2-CG 3.55Å; F277-R284 HydrophobicContact CG-CG 4.37Å; F277-R284 HydrophobicContact CZ-CG 4.09Å; F277-R284 PolarHBondContact O-NE 2.9Å; F277-L289 HydrophobicContact CD2-CD1 3.41Å; F277-L289 VanDerWaalsContact CD2-CD1 3.41Å; F277-L289 HydrophobicContact CD2-CG 4.47Å; F277-L289 HydrophobicContact CE2-CD1 3.7Å; F277-L289 HydrophobicContact CG-CD1 4.07Å
278	H	85.1	Confident	79.6	Confident	37 Å²	37	81.2 Å²	81.2	17%	0.171	38%	0.376	C	S	.	.	H	α-helix	trans	-77.1	-35.4	175.8	-67	-68.8	0	0	0	113.7	P244 L246 P248 A274 Y275 K276	P244-H278 PolarHBondContact O-CE1 3.25Å; P244-H278 PolarHBondContact O-NE2 3.22Å; L246-H278 PolarHBondContact O-CE1 2.89Å; L246-H278 PolarHBondContact O-NE2 3.15Å; P248-H278 HydrophobicContact CG-CB 4.27Å; A274-H278 PolarHBondContact O-CD2 2.88Å; A274-H278 PolarHBondContact O-N 2.7Å; A274-H278 VanDerWaalsContact O-N 3.12Å; Y275-H278 PolarHBondContact O-N 2.75Å; K276-H278 VanDerWaalsContact C-N 3.34Å; K276-H278 PolarHBondContact O-N 3.34Å
279	L	85.5	Confident	78.6	Confident	137 Å²	137	77.2 Å²	77.2	72%	0.717	36%	0.362	S	S	*	.	H	α-helix	trans	-76.6	-23.4	-174.1	-73.5	169.7	0	0	0	113.8	Y275 K276	Y275-L279 VanDerWaalsContact O-CB 3.3Å; Y275-L279 WeakPolarHBondContact O-CB 3.12Å; Y275-L279 WeakPolarHBondContact O-CD1 3.43Å; Y275-L279 WeakPolarHBondContact O-CG 3.49Å; Y275-L279 PolarHBondContact O-N 2.98Å; K276-L279 PolarHBondContact O-N 3.05Å
280	I	80.7	Confident	77.9	Confident	64 Å²	64	74.6 Å²	74.6	33%	0.328	36%	0.364	S	S	.	.			trans	-131.7	71.1	-176.1	-37.9	177.5	0	0	0	110.9	K276 E282 Q283 R284	K276-I280 PolarHBondContact O-N 2.87Å; I280-E282 VanDerWaalsContact C-N 3.25Å; I280-E282 PolarHBondContact O-N 2.86Å; I280-Q283 HydrophobicContact CB-CB 4.2Å; I280-Q283 HydrophobicContact CG2-CB 3.57Å; I280-Q283 HydrophobicContact CG2-CG 3.51Å; I280-Q283 PolarHBondContact O-N 2.96Å; I280-R284 PolarHBondContact O-N 3.14Å
281	P	69.8	Low	77.3	Confident	52 Å²	52	80.3 Å²	80.3	34%	0.338	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-52.9	-42.9	-178.9	-26.2	35	0	0	0	113.1	Q283 R284	P281-Q283 PolarHBondContact O-N 3.1Å; P281-Q283 VanDerWaalsContact O-N 3.11Å; P281-R284 WeakPolarHBondContact O-CB 3.42Å; P281-R284 VanDerWaalsContact O-CG 3.25Å; P281-R284 WeakPolarHBondContact O-CG 3.14Å; P281-R284 PolarHBondContact O-N 3.41Å; P281-R284 VanDerWaalsContact O-N 3.09Å
282	E	64.2	Low	76.9	Confident	167 Å²	167	82.9 Å²	82.9	78%	0.78	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-58.1	-26.1	179	-62.1	163.3	-172.9	0	0	113.1	I280 H285	I280-E282 VanDerWaalsContact C-N 3.25Å; I280-E282 PolarHBondContact O-N 2.86Å; E282-H285 PolarHBondContact O-CE1 3.3Å; E282-H285 PolarHBondContact O-ND1 2.68Å; E282-H285 VanDerWaalsContact O-ND1 3.12Å
283	Q	68.4	Low	76.5	Confident	92 Å²	92	78.7 Å²	78.7	43%	0.43	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-108	9.6	-177.8	-64	-176.6	1.5	0	0	113	I280 P281 H285 L286 V287	I280-Q283 HydrophobicContact CB-CB 4.2Å; I280-Q283 HydrophobicContact CG2-CB 3.57Å; I280-Q283 HydrophobicContact CG2-CG 3.51Å; I280-Q283 PolarHBondContact O-N 2.96Å; P281-Q283 PolarHBondContact O-N 3.1Å; P281-Q283 VanDerWaalsContact O-N 3.11Å; Q283-H285 PolarHBondContact O-N 3.02Å; Q283-H285 VanDerWaalsContact O-N 3.16Å; Q283-L286 HydrophobicContact CB-CB 4.46Å; Q283-L286 HydrophobicContact CB-CD1 4Å; Q283-L286 HydrophobicContact CB-CG 4.41Å; Q283-L286 HydrophobicContact CG-CD1 3.92Å; Q283-L286 WeakPolarHBondContact O-CA 3.38Å; Q283-L286 VanDerWaalsContact O-CB 3.3Å; Q283-L286 WeakPolarHBondContact O-CB 3.38Å; Q283-L286 PolarHBondContact O-N 3.29Å; Q283-V287 PolarHBondContact O-N 3.24Å
284	R	71.1	Confident	76.3	Confident	61 Å²	61	80.7 Å²	80.7	23%	0.23	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-53.2	-39.2	178.9	-76.5	174.7	177.4	167.9	2.5	112.6	F277 I280 P281 L286 V287 Y595	F277-R284 HydrophobicContact CD2-CB 4.2Å; F277-R284 HydrophobicContact CD2-CG 3.69Å; F277-R284 HydrophobicContact CE2-CB 3.87Å; F277-R284 HydrophobicContact CE2-CG 3.55Å; F277-R284 HydrophobicContact CG-CG 4.37Å; F277-R284 HydrophobicContact CZ-CG 4.09Å; F277-R284 PolarHBondContact O-NE 2.9Å; I280-R284 PolarHBondContact O-N 3.14Å; P281-R284 WeakPolarHBondContact O-CB 3.42Å; P281-R284 VanDerWaalsContact O-CG 3.25Å; P281-R284 WeakPolarHBondContact O-CG 3.14Å; P281-R284 PolarHBondContact O-N 3.41Å; P281-R284 VanDerWaalsContact O-N 3.09Å; R284-L286 PolarHBondContact O-N 3.4Å; R284-V287 PolarHBondContact O-N 2.92Å; R284-Y595 PolarHBondContact NH1-O 3.17Å
285	H	62.6	Low	76.3	Confident	114 Å²	114	82.1 Å²	82.1	53%	0.528	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-63.3	-22.5	176.2	68	-86	0	0	0	113.6	E282 Q283	E282-H285 PolarHBondContact O-CE1 3.3Å; E282-H285 PolarHBondContact O-ND1 2.68Å; E282-H285 VanDerWaalsContact O-ND1 3.12Å; Q283-H285 PolarHBondContact O-N 3.02Å; Q283-H285 VanDerWaalsContact O-N 3.16Å
286	L	61.9	Low	76.4	Confident	109 Å²	109	79.4 Å²	79.4	57%	0.571	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-84.6	-21.8	175.4	-56.6	178.1	0	0	0	112.4	Q283 R284 R288	Q283-L286 HydrophobicContact CB-CB 4.46Å; Q283-L286 HydrophobicContact CB-CD1 4Å; Q283-L286 HydrophobicContact CB-CG 4.41Å; Q283-L286 HydrophobicContact CG-CD1 3.92Å; Q283-L286 WeakPolarHBondContact O-CA 3.38Å; Q283-L286 VanDerWaalsContact O-CB 3.3Å; Q283-L286 WeakPolarHBondContact O-CB 3.38Å; Q283-L286 PolarHBondContact O-N 3.29Å; R284-L286 PolarHBondContact O-N 3.4Å; L286-R288 PolarHBondContact O-N 3.05Å
287	V	65.1	Low	76.6	Confident	45 Å²	45	76.1 Å²	76.1	27%	0.273	37%	0.37	S	S	.	.	S	Bend	trans	-79.6	103.3	179.2	-168.1	0	0	0	0	108.8	Q283 R284 L289	Q283-V287 PolarHBondContact O-N 3.24Å; R284-V287 PolarHBondContact O-N 2.92Å; V287-L289 VanDerWaalsContact C-N 3.26Å; V287-L289 HydrophobicContact CB-CD2 4.43Å; V287-L289 HydrophobicContact CB-CG 4.3Å; V287-L289 HydrophobicContact CG1-CD2 3.42Å; V287-L289 VanDerWaalsContact CG1-CD2 3.42Å; V287-L289 HydrophobicContact CG1-CG 3.77Å; V287-L289 PolarHBondContact O-N 3.3Å
288	R	65.9	Low	77	Confident	242 Å²	242	75.4 Å²	75.4	91%	0.913	37%	0.369	S	S	*	.			trans	-73.2	79.9	174.2	-67.6	-173.6	179.8	-174.1	-0.7	110.7	L286 G290	L286-R288 PolarHBondContact O-N 3.05Å; R288-G290 PolarHBondContact O-N 2.63Å
289	L	68.8	Low	77.3	Confident	16 Å²	16	74.6 Å²	74.6	8%	0.084	37%	0.366	C	S	.	.			trans	-74.8	-11.6	178.7	-64.1	178.5	0	0	0	113.7	P244 E273 F277 V287 K291 R292	P244-L289 HydrophobicContact CB-CD1 3.79Å; P244-L289 HydrophobicContact CB-CD2 4.42Å; P244-L289 HydrophobicContact CG-CD1 3.9Å; P244-L289 HydrophobicContact CG-CD2 3.79Å; P244-L289 HydrophobicContact CG-CG 4.43Å; E273-L289 HydrophobicContact CG-CD2 3.35Å; E273-L289 VanDerWaalsContact OE1-CD2 3.29Å; E273-L289 WeakPolarHBondContact OE1-CD2 3.3Å; F277-L289 HydrophobicContact CD2-CD1 3.41Å; F277-L289 VanDerWaalsContact CD2-CD1 3.41Å; F277-L289 HydrophobicContact CD2-CG 4.47Å; F277-L289 HydrophobicContact CE2-CD1 3.7Å; F277-L289 HydrophobicContact CG-CD1 4.07Å; V287-L289 VanDerWaalsContact C-N 3.26Å; V287-L289 HydrophobicContact CB-CD2 4.43Å; V287-L289 HydrophobicContact CB-CG 4.3Å; V287-L289 HydrophobicContact CG1-CD2 3.42Å; V287-L289 VanDerWaalsContact CG1-CD2 3.42Å; V287-L289 HydrophobicContact CG1-CG 3.77Å; V287-L289 PolarHBondContact O-N 3.3Å; L289-K291 PolarHBondContact O-N 3.35Å; L289-R292 PolarHBondContact O-N 2.95Å; L289-R292 VanDerWaalsContact O-N 3.14Å
290	G	76.1	Confident	77.5	Confident	53 Å²	53	69.1 Å²	69.1	55%	0.546	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	54.9	-136.1	-174.2	0	0	0	0	0	111	R288 R292 G293	R288-G290 PolarHBondContact O-N 2.63Å; G290-R292 VanDerWaalsContact C-N 3.29Å; G290-R292 PolarHBondContact O-N 2.85Å; G290-G293 PolarHBondContact O-N 3.17Å
291	K	77.8	Confident	78	Confident	134 Å²	134	66.4 Å²	66.4	58%	0.583	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-63.3	-30.4	177.5	-68.6	-170.4	175.9	-172.1	0	113.4	R242 L289 G293 R294	R242-K291 VanDerWaalsContact CD-O 3.24Å; R242-K291 WeakPolarHBondContact CD-O 3.36Å; R242-K291 PolarHBondContact NE-O 2.92Å; R242-K291 VanDerWaalsContact NE-O 3.13Å; L289-K291 PolarHBondContact O-N 3.35Å; K291-G293 PolarHBondContact O-N 3.44Å; K291-R294 PolarHBondContact O-N 3.15Å; K291-R294 VanDerWaalsContact O-N 3.09Å
292	R	83.9	Confident	79.1	Confident	59 Å²	59	65.7 Å²	65.7	22%	0.223	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-66.9	-21.8	-177.2	-72.8	-167.6	-65.2	-99.4	3.1	114	R242 F270 E273 L289 G290	R242-R292 WeakPolarHBondContact CA-O 3.31Å; R242-R292 WeakPolarHBondContact CB-O 3.4Å; F270-R292 VanDerWaalsContact CE1-NH1 3.33Å; E273-R292 IonicContact OE1-CZ 3.27Å; E273-R292 IonicContact OE1-NE 3.71Å; E273-R292 PolarHBondContact OE1-NE 3.39Å; E273-R292 IonicContact OE1-NH2 2.96Å; E273-R292 PolarHBondContact OE1-NH2 2.85Å; E273-R292 IonicContact OE2-CZ 3.87Å; E273-R292 IonicContact OE2-NE 2.63Å; E273-R292 IonicContact OE2-NH2 3.69Å; E273-R292 PolarHBondContact OE2-NH2 3.48Å; L289-R292 PolarHBondContact O-N 2.95Å; L289-R292 VanDerWaalsContact O-N 3.14Å; G290-R292 VanDerWaalsContact C-N 3.29Å; G290-R292 PolarHBondContact O-N 2.85Å
293	G	80.3	Confident	80.6	Confident	15 Å²	15	57.8 Å²	57.8	16%	0.155	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-94	-2.2	175.7	0	0	0	0	0	114.1	G290 K291	G290-G293 PolarHBondContact O-N 3.17Å; K291-G293 PolarHBondContact O-N 3.44Å
294	R	84.6	Confident	82	Confident	80 Å²	80	54.8 Å²	54.8	30%	0.302	27%	0.269	S	S	.	.	S	Bend	trans	-89.2	118.7	179.4	-61.3	-170.1	175.6	-171.1	-7.6	109	K291 I540 S563	K291-R294 PolarHBondContact O-N 3.15Å; K291-R294 VanDerWaalsContact O-N 3.09Å; R294-I540 HydrophobicContact CB-CD1 4.42Å; R294-I540 HydrophobicContact CG-CD1 3.9Å; R294-S563 PolarHBondContact NH2-OG 3.27Å; R294-S563 VanDerWaalsContact NH2-OG 3.15Å
295	P	89	Confident	83.3	Confident	30 Å²	30	51.9 Å²	51.9	20%	0.195	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-66.3	147.5	174	28.7	-33.6	0	0	0	110.2	L245 V300 I540	L245-P295 VanDerWaalsContact CD1-CA 3.41Å; L245-P295 HydrophobicContact CD1-CB 3.81Å; P295-V300 HydrophobicContact CB-CG1 3.68Å; P295-V300 HydrophobicContact CG-CG1 3.57Å; P295-I540 HydrophobicContact CG-CG2 4.31Å
296	R	92	Very high	84.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-70.1	150.9	174.2	-60.5	-176.4	-164.7	-88.6	-3.5	110.4	L202 C204 D205 I207 E212 S298 T299 V300	L202-R296 VanDerWaalsContact O-CZ 3.25Å; L202-R296 PolarHBondContact O-NH1 3.16Å; L202-R296 PolarHBondContact O-NH2 3.48Å; C204-R296 PolarHBondContact O-NH1 3.3Å; D205-R296 VanDerWaalsContact O-CA 3.3Å; D205-R296 WeakPolarHBondContact O-CA 3.41Å; D205-R296 WeakPolarHBondContact O-CB 3.45Å; I207-R296 VanDerWaalsContact CD1-NH1 3.33Å; E212-R296 VanDerWaalsContact OE1-CD 3.31Å; E212-R296 WeakPolarHBondContact OE1-CD 3.5Å; E212-R296 IonicContact OE1-CZ 3.65Å; E212-R296 IonicContact OE1-NE 3.35Å; E212-R296 PolarHBondContact OE1-NE 3.47Å; E212-R296 IonicContact OE1-NH2 2.73Å; E212-R296 IonicContact OE2-CZ 3.09Å; E212-R296 IonicContact OE2-NE 3.44Å; E212-R296 IonicContact OE2-NH2 3.81Å; E212-R296 PolarHBondContact OE2-NH2 2.9Å; R296-S298 PolarHBondContact O-N 2.91Å; R296-S298 VanDerWaalsContact O-N 3.12Å; R296-T299 HydrophobicContact CB-CG2 4.32Å; R296-T299 PolarHBondContact N-OG1 3.15Å; R296-T299 PolarHBondContact O-N 3.09Å; R296-T299 PolarHBondContact O-OG1 3.08Å; R296-T299 VanDerWaalsContact O-OG1 3.05Å; R296-V300 PolarHBondContact O-N 3.47Å
297	K	92	Very high	86.6	Confident	62 Å²	62	41.3 Å²	41.3	27%	0.27	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.7	-179.7	-64	-167.3	-173.1	138.6	0	113.2	D205 D206 T299 V300 F323 L324	D205-K297 PolarHBondContact O-N 3.12Å; D206-K297 WeakPolarHBondContact OD1-CD 3.3Å; D206-K297 WeakPolarHBondContact OD1-CE 3.4Å; D206-K297 IonicContact OD1-NZ 2.85Å; D206-K297 PolarHBondContact OD1-NZ 3.42Å; D206-K297 IonicContact OD2-NZ 3.98Å; D206-K297 PolarHBondContact OD2-NZ 2.95Å; K297-T299 VanDerWaalsContact C-N 3.33Å; K297-V300 WeakPolarHBondContact O-CG2 3.41Å; K297-F323 HydrophobicContact CB-CD1 3.89Å; K297-F323 HydrophobicContact CB-CE1 4.43Å; K297-F323 HydrophobicContact CB-CG 4.26Å; K297-F323 HydrophobicContact CD-CD1 4.08Å; K297-F323 HydrophobicContact CD-CD2 4.19Å; K297-F323 HydrophobicContact CD-CE1 4.08Å; K297-F323 HydrophobicContact CD-CE2 4.18Å; K297-F323 HydrophobicContact CD-CG 4.17Å; K297-F323 HydrophobicContact CD-CZ 4.14Å; K297-F323 HydrophobicContact CG-CD1 3.71Å; K297-F323 HydrophobicContact CG-CE1 3.75Å; K297-F323 HydrophobicContact CG-CG 4.24Å; K297-F323 HydrophobicContact CG-CZ 4.29Å; K297-L324 HydrophobicContact CB-CB 4.17Å
298	S	92.1	Very high	88.1	Confident	15 Å²	15	39.2 Å²	39.2	11%	0.105	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-18.4	177.5	67.5	0	0	0	0	114	I207 V209 R296 T587	I207-S298 PolarHBondContact O-OG 3.34Å; I207-S298 VanDerWaalsContact O-OG 3.07Å; V209-S298 PolarHBondContact N-OG 2.97Å; V209-S298 VanDerWaalsContact N-OG 3.1Å; V209-S298 VanDerWaalsContact O-CB 3.3Å; V209-S298 WeakPolarHBondContact O-CB 3.32Å; V209-S298 PolarHBondContact O-OG 3.13Å; R296-S298 PolarHBondContact O-N 2.91Å; R296-S298 VanDerWaalsContact O-N 3.12Å; S298-T587 PolarHBondContact O-OG1 3.04Å
299	T	91	Very high	89.6	Confident	20 Å²	20	30.2 Å²	30.2	12%	0.123	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-14.8	-172.5	64.6	0	0	0	0	114	V209 R296 K297 G301 T587	V209-T299 HydrophobicContact CG2-CG2 4.02Å; V209-T299 WeakPolarHBondContact O-CG2 3.17Å; R296-T299 HydrophobicContact CB-CG2 4.32Å; R296-T299 PolarHBondContact N-OG1 3.15Å; R296-T299 PolarHBondContact O-N 3.09Å; R296-T299 PolarHBondContact O-OG1 3.08Å; R296-T299 VanDerWaalsContact O-OG1 3.05Å; K297-T299 VanDerWaalsContact C-N 3.33Å; T299-G301 PolarHBondContact O-N 2.86Å; T299-T587 PolarHBondContact O-OG1 3.36Å
300	V	90.7	Very high	90.8	Very high	22 Å²	22	30 Å²	30	13%	0.133	16%	0.161	C	C	.	.	S	Bend	trans	-72.4	-10.8	-176.8	-64.2	0	0	0	0	115.1	P295 R296 K297 F323 L538 G539	P295-V300 HydrophobicContact CB-CG1 3.68Å; P295-V300 HydrophobicContact CG-CG1 3.57Å; R296-V300 PolarHBondContact O-N 3.47Å; K297-V300 WeakPolarHBondContact O-CG2 3.41Å; V300-F323 HydrophobicContact CG2-CB 4.38Å; V300-F323 HydrophobicContact CG2-CD1 3.83Å; V300-L538 HydrophobicContact CB-CD1 4.08Å; V300-L538 HydrophobicContact CB-CG 4.15Å; V300-L538 HydrophobicContact CG2-CD1 3.83Å; V300-L538 HydrophobicContact CG2-CD2 4.18Å; V300-L538 HydrophobicContact CG2-CG 3.72Å; V300-L538 WeakPolarHBondContact O-CD1 3.44Å; V300-G539 VanDerWaalsContact CG1-CA 3.45Å
301	G	90.2	Very high	91.7	Very high	6 Å²	6	31.9 Å²	31.9	6%	0.062	17%	0.166	C	C	.	.			trans	98	-165.9	-178	0	0	0	0	0	114.2	T299 V585 T587	T299-G301 PolarHBondContact O-N 2.86Å; G301-V585 CarbonylContact C-O 3.49Å; G301-V585 WeakPolarHBondContact CA-O 3.33Å; G301-T587 WeakPolarHBondContact CA-OG1 3.49Å; G301-T587 PolarHBondContact N-OG1 3.16Å; G301-T587 VanDerWaalsContact N-OG1 3.09Å
302	T	92.9	Very high	92.4	Very high	37 Å²	37	30.6 Å²	30.6	23%	0.227	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	137.2	-170.5	-63.5	0	0	0	0	109.8	Y304 C320 V585	T302-Y304 HydrophobicContact CG2-CD2 4.44Å; T302-Y304 HydrophobicContact CG2-CE2 3.92Å; T302-C320 WeakPolarHBondContact CG2-SG 3.35Å; T302-V585 PolarHBondContact N-O 2.85Å; T302-V585 PolarHBondContact O-N 3.43Å
303	V	96.7	Very high	92.8	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.7	179.5	-173.8	0	0	0	0	110.1	C320 Y321 W328 L538 L582 A583 V584	V303-C320 CarbonylContact O-C 3.59Å; V303-C320 WeakPolarHBondContact O-CA 3.47Å; V303-Y321 HydrophobicContact CG2-CD1 4.5Å; V303-Y321 PolarHBondContact N-O 2.94Å; V303-Y321 PolarHBondContact O-N 2.88Å; V303-W328 HydrophobicContact CG1-CH2 4.45Å; V303-L538 HydrophobicContact CG2-CB 4.39Å; V303-L538 HydrophobicContact CG2-CD1 3.9Å; V303-L538 HydrophobicContact CG2-CD2 3.79Å; V303-L538 HydrophobicContact CG2-CG 4.25Å; V303-L582 HydrophobicContact CG1-CB 4.1Å; V303-L582 HydrophobicContact CG1-CD1 4.45Å; V303-L582 HydrophobicContact CG1-CD2 4.05Å; V303-L582 HydrophobicContact CG1-CG 4.41Å; V303-A583 CarbonylContact C-O 3.49Å; V303-A583 WeakPolarHBondContact CA-O 3.09Å; V303-V584 HydrophobicContact CG2-CG2 4.28Å
304	Y	97.2	Very high	93.4	Very high	29 Å²	29	34.9 Å²	34.9	11%	0.114	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.4	170.5	-66.3	-96.3	0	0	0	109.8	T302 I318 E319 C320 V331 I350 W368 L582 A583 V585	T302-Y304 HydrophobicContact CG2-CD2 4.44Å; T302-Y304 HydrophobicContact CG2-CE2 3.92Å; Y304-I318 HydrophobicContact CD1-CG2 4.06Å; Y304-E319 CarbonylContact C-O 3.51Å; Y304-E319 WeakPolarHBondContact CA-O 3.39Å; Y304-C320 HydrophobicContact CD1-CB 4.14Å; Y304-C320 HydrophobicContact CE1-CB 4.1Å; Y304-V331 HydrophobicContact CD1-CG2 4.11Å; Y304-V331 HydrophobicContact CE1-CG2 3.97Å; Y304-I350 HydrophobicContact CD2-CD1 4.4Å; Y304-I350 HydrophobicContact CG-CD1 4.37Å; Y304-W368 AromaticContact CD1-CH2 3.66Å; Y304-W368 HydrophobicContact CD1-CH2 3.66Å; Y304-W368 AromaticContact CD1-CZ3 3.79Å; Y304-W368 HydrophobicContact CD1-CZ3 3.79Å; Y304-W368 AromaticContact CE1-CH2 3.75Å; Y304-W368 HydrophobicContact CE1-CH2 3.75Å; Y304-W368 HydrophobicContact CE1-CZ3 4.2Å; Y304-W368 HydrophobicContact CG-CZ3 4.34Å; Y304-L582 CarbonylContact O-C 3.58Å; Y304-L582 VanDerWaalsContact O-CA 3.25Å; Y304-L582 WeakPolarHBondContact O-CA 3.43Å; Y304-A583 PolarHBondContact N-O 2.96Å; Y304-A583 PolarHBondContact O-N 2.83Å; Y304-V585 HydrophobicContact CD2-CB 4.38Å; Y304-V585 HydrophobicContact CD2-CG2 3.72Å; Y304-V585 HydrophobicContact CE2-CB 3.91Å; Y304-V585 HydrophobicContact CE2-CG2 3.51Å
305	C	98	Very high	93.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	116.1	176.1	-173.8	0	0	0	0	110.2	I318 E319 W328 L573 L582	C305-I318 WeakPolarHBondContact O-CA 3.34Å; C305-E319 PolarHBondContact N-O 3.06Å; C305-E319 PolarHBondContact O-N 2.88Å; C305-E319 VanDerWaalsContact O-N 3.13Å; C305-W328 HydrophobicContact CB-CH2 4.04Å; C305-W328 HydrophobicContact CB-CZ3 3.67Å; C305-L573 HydrophobicContact CB-CD2 4.27Å; C305-L582 HydrophobicContact CB-CD2 3.67Å
306	L	97.6	Very high	94.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	136.1	-173.5	-63.1	89	0	0	0	111.3	I318 F341 I350 I352 W368 A580 C581	L306-I318 HydrophobicContact CD1-CG2 4.5Å; L306-I318 HydrophobicContact CD2-CD1 3.83Å; L306-I318 HydrophobicContact CD2-CG1 4.24Å; L306-I318 HydrophobicContact CG-CD1 4.2Å; L306-I318 HydrophobicContact CG-CG1 4.08Å; L306-I318 HydrophobicContact CG-CG2 4.04Å; L306-F341 HydrophobicContact CB-CE2 4.43Å; L306-F341 HydrophobicContact CB-CZ 4.29Å; L306-I350 HydrophobicContact CD2-CG2 4.09Å; L306-I352 HydrophobicContact CD2-CD1 4.08Å; L306-I352 HydrophobicContact CD2-CG1 4.48Å; L306-W368 HydrophobicContact CD2-CE3 4.26Å; L306-A580 WeakPolarHBondContact O-CA 3.48Å; L306-C581 PolarHBondContact N-O 2.94Å; L306-C581 PolarHBondContact O-N 2.76Å
307	G	96.6	Very high	94.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.			trans	62.8	-149.2	171.4	0	0	0	0	0	114.5	A315 M334 R577 A580	G307-A315 WeakPolarHBondContact CA-O 3.28Å; G307-M334 VanDerWaalsContact CA-CE 3.49Å; G307-R577 WeakPolarHBondContact O-CD 3.44Å; G307-R577 PolarHBondContact O-NH1 2.73Å; G307-A580 WeakPolarHBondContact O-CB 3.16Å
308	G	96.6	Very high	94.6	Very high	1 Å²	1	31 Å²	31	1%	0.01	17%	0.171	C	C	.	.			trans	93.2	160.3	-171.2	0	0	0	0	0	113.1	G314 A315 L339 A578	G308-G314 WeakPolarHBondContact O-CA 3.49Å; G308-A315 PolarHBondContact O-N 3.28Å; G308-L339 WeakPolarHBondContact O-CD2 3.22Å; G308-A578 CarbonylContact C-O 3.56Å; G308-A578 VanDerWaalsContact CA-O 3.28Å; G308-A578 WeakPolarHBondContact CA-O 3.28Å
309	M	96.7	Very high	94.9	Very high	54 Å²	54	30.3 Å²	30.3	27%	0.266	17%	0.166	S	C	.	.	B	Isolated β-bridge	trans	-83.6	124.9	174.1	-174.8	75	-177.8	0	0	109.1	K313 L339 Y553 R577 A578	M309-K313 HydrophobicContact CE-CB 4.07Å; M309-K313 HydrophobicContact CE-CG 4.21Å; M309-L339 HydrophobicContact CB-CD2 4.37Å; M309-L339 HydrophobicContact SD-CD1 3.93Å; M309-L339 HydrophobicContact SD-CD2 4.49Å; M309-Y553 HydrophobicContact CB-CE1 3.93Å; M309-Y553 HydrophobicContact CG-CE1 3.67Å; M309-Y553 HydrophobicContact CG-CE2 4.22Å; M309-Y553 VanDerWaalsContact CG-CZ 3.4Å; M309-Y553 WeakPolarHBondContact CG-OH 3.36Å; M309-Y553 WeakPolarHBondContact O-CD1 3.32Å; M309-Y553 WeakPolarHBondContact O-CE1 3.47Å; M309-R577 CarbonylContact O-C 3.6Å; M309-R577 VanDerWaalsContact O-CA 3.24Å; M309-R577 WeakPolarHBondContact O-CA 3.33Å; M309-A578 PolarHBondContact N-O 3.45Å; M309-A578 PolarHBondContact O-N 2.92Å
310	D	95.4	Very high	95.1	Very high	10 Å²	10	30.2 Å²	30.2	5%	0.053	17%	0.166	C	C	.	.			trans	-117.7	-175.3	174.4	67.4	-3.9	0	0	0	110.4	N312 K313 G314 A315 Y553 V575 G576	D310-N312 PolarHBondContact O-N 3.24Å; D310-N312 VanDerWaalsContact O-N 3.16Å; D310-N312 VanDerWaalsContact OD1-CA 3.31Å; D310-N312 WeakPolarHBondContact OD1-CA 3.37Å; D310-N312 PolarHBondContact OD1-N 3.2Å; D310-K313 PolarHBondContact O-N 3.48Å; D310-K313 VanDerWaalsContact O-N 3.15Å; D310-K313 PolarHBondContact OD1-N 3.01Å; D310-K313 VanDerWaalsContact OD1-N 3.09Å; D310-G314 VanDerWaalsContact OD1-C 3.31Å; D310-G314 WeakPolarHBondContact OD1-CA 3.45Å; D310-G314 PolarHBondContact OD1-N 2.81Å; D310-A315 HydrophobicContact CB-CB 4.27Å; D310-A315 WeakPolarHBondContact OD2-CA 3.45Å; D310-Y553 VanDerWaalsContact C-CD2 3.42Å; D310-Y553 WeakPolarHBondContact O-CE2 3.38Å; D310-V575 HydrophobicContact CB-CG1 4.02Å; D310-G576 WeakPolarHBondContact CB-O 3.24Å
311	S	94.2	Very high	95.4	Very high	94 Å²	94	29.2 Å²	29.2	66%	0.657	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.3	174.4	55.3	0	0	0	0	113.5
312	N	92.6	Very high	95.5	Very high	107 Å²	107	31.4 Å²	31.4	57%	0.572	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	18	179.1	-64.8	-45.7	0	0	0	113.7	D310 G314 R337	D310-N312 PolarHBondContact O-N 3.24Å; D310-N312 VanDerWaalsContact O-N 3.16Å; D310-N312 VanDerWaalsContact OD1-CA 3.31Å; D310-N312 WeakPolarHBondContact OD1-CA 3.37Å; D310-N312 PolarHBondContact OD1-N 3.2Å; N312-G314 VanDerWaalsContact C-N 3.33Å; N312-G314 PolarHBondContact O-N 2.84Å; N312-R337 PolarHBondContact O-NH1 3.45Å
313	K	91.6	Very high	95.5	Very high	162 Å²	162	30.3 Å²	30.3	70%	0.704	16%	0.162	S	C	*	.	S	Bend	trans	68.4	22	178.2	-52	-179.1	-179.8	177.7	0	115.8	M309 D310	M309-K313 HydrophobicContact CE-CB 4.07Å; M309-K313 HydrophobicContact CE-CG 4.21Å; D310-K313 PolarHBondContact O-N 3.48Å; D310-K313 VanDerWaalsContact O-N 3.15Å; D310-K313 PolarHBondContact OD1-N 3.01Å; D310-K313 VanDerWaalsContact OD1-N 3.09Å
314	G	93.9	Very high	95.3	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.01	17%	0.167	C	C	.	.	S	Bend	trans	142.3	116.9	171.9	0	0	0	0	0	111.6	G308 D310 N312 R337	G308-G314 WeakPolarHBondContact O-CA 3.49Å; D310-G314 VanDerWaalsContact OD1-C 3.31Å; D310-G314 WeakPolarHBondContact OD1-CA 3.45Å; D310-G314 PolarHBondContact OD1-N 2.81Å; N312-G314 VanDerWaalsContact C-N 3.33Å; N312-G314 PolarHBondContact O-N 2.84Å; G314-R337 PolarHBondContact O-NH1 2.86Å
315	A	95.1	Very high	95	Very high	3 Å²	3	35.2 Å²	35.2	3%	0.025	19%	0.185	C	C	.	.			trans	-70.9	128.8	179.1	0	0	0	0	0	110.2	G307 G308 D310 M334	G307-A315 WeakPolarHBondContact CA-O 3.28Å; G308-A315 PolarHBondContact O-N 3.28Å; D310-A315 HydrophobicContact CB-CB 4.27Å; D310-A315 WeakPolarHBondContact OD2-CA 3.45Å; A315-M334 WeakPolarHBondContact O-CE 3.44Å
316	Q	95	Very high	94.8	Very high	58 Å²	58	38.6 Å²	38.6	27%	0.271	20%	0.203	S	C	.	.			trans	-101.6	-26.9	172.1	-64.2	-176	-93.2	0	0	112.2	I318 C333 M334 R337	Q316-I318 PolarHBondContact O-N 2.96Å; Q316-C333 CarbonylContact O-C 3.56Å; Q316-C333 WeakPolarHBondContact O-CA 3.31Å; Q316-M334 PolarHBondContact NE2-O 3.14Å; Q316-M334 PolarHBondContact O-N 3.06Å; Q316-R337 VanDerWaalsContact CD-CG 3.44Å; Q316-R337 HydrophobicContact CG-CG 3.55Å
317	A	95.6	Very high	94.7	Very high	29 Å²	29	42.8 Å²	42.8	24%	0.24	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	129	178.9	0	0	0	0	0	110.7	R577	A317-R577 PolarHBondContact O-NH1 3Å; A317-R577 PolarHBondContact O-NH2 3.19Å
318	I	97	Very high	94.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	119	170	-59.7	176.8	0	0	0	106.8	Y304 C305 L306 Q316 V331 A332 M334 W368 W375	Y304-I318 HydrophobicContact CD1-CG2 4.06Å; C305-I318 WeakPolarHBondContact O-CA 3.34Å; L306-I318 HydrophobicContact CD1-CG2 4.5Å; L306-I318 HydrophobicContact CD2-CD1 3.83Å; L306-I318 HydrophobicContact CD2-CG1 4.24Å; L306-I318 HydrophobicContact CG-CD1 4.2Å; L306-I318 HydrophobicContact CG-CG1 4.08Å; L306-I318 HydrophobicContact CG-CG2 4.04Å; Q316-I318 PolarHBondContact O-N 2.96Å; I318-V331 HydrophobicContact CB-CG2 4.47Å; I318-V331 HydrophobicContact CG2-CG2 4.05Å; I318-V331 WeakPolarHBondContact O-CG2 3.49Å; I318-V331 PolarHBondContact O-N 3.29Å; I318-A332 HydrophobicContact CB-CB 4.29Å; I318-A332 HydrophobicContact CD1-CB 4.17Å; I318-A332 PolarHBondContact N-O 3.37Å; I318-M334 HydrophobicContact CD1-CG 4.2Å; I318-M334 HydrophobicContact CG1-CG 4.24Å; I318-W368 HydrophobicContact CD1-CD2 4.08Å; I318-W368 HydrophobicContact CD1-CE3 3.95Å; I318-W368 HydrophobicContact CD1-CH2 4.05Å; I318-W368 HydrophobicContact CD1-CZ2 4.15Å; I318-W368 HydrophobicContact CD1-CZ3 3.94Å; I318-W368 HydrophobicContact CG2-CH2 3.79Å; I318-W368 HydrophobicContact CG2-CZ3 3.9Å; I318-W375 HydrophobicContact CD1-CH2 4.07Å; I318-W375 HydrophobicContact CD1-CZ2 3.75Å
319	E	97.3	Very high	94.7	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.009	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	144	177.6	-62.9	-179.2	-147	0	0	109.8	Y304 C305 W328 N329 L573 C574 V575 R577	Y304-E319 CarbonylContact C-O 3.51Å; Y304-E319 WeakPolarHBondContact CA-O 3.39Å; C305-E319 PolarHBondContact N-O 3.06Å; C305-E319 PolarHBondContact O-N 2.88Å; C305-E319 VanDerWaalsContact O-N 3.13Å; E319-W328 HydrophobicContact CB-CE3 3.74Å; E319-W328 HydrophobicContact CB-CZ3 4.23Å; E319-N329 CarbonylContact C-O 3.57Å; E319-N329 WeakPolarHBondContact CA-O 3.49Å; E319-L573 WeakPolarHBondContact OE2-CD2 3.44Å; E319-C574 PolarHBondContact OE2-N 2.71Å; E319-V575 PolarHBondContact OE1-N 2.8Å; E319-V575 VanDerWaalsContact OE1-N 3.14Å; E319-R577 IonicContact OE1-CZ 3.6Å; E319-R577 IonicContact OE1-NE 3.77Å; E319-R577 IonicContact OE1-NH2 3.93Å; E319-R577 PolarHBondContact OE1-NH2 2.75Å
320	C	96	Very high	94.6	Very high	17 Å²	17	48.6 Å²	48.6	12%	0.115	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	126.3	-175.8	170.7	0	0	0	0	109.3	T302 V303 Y304 W328 N329 V331	T302-C320 WeakPolarHBondContact CG2-SG 3.35Å; V303-C320 CarbonylContact O-C 3.59Å; V303-C320 WeakPolarHBondContact O-CA 3.47Å; Y304-C320 HydrophobicContact CD1-CB 4.14Å; Y304-C320 HydrophobicContact CE1-CB 4.1Å; C320-W328 CarbonylContact O-C 3.45Å; C320-W328 WeakPolarHBondContact O-CA 3.08Å; C320-N329 PolarHBondContact N-O 3.21Å; C320-N329 PolarHBondContact O-N 3Å; C320-V331 HydrophobicContact CB-CB 4.28Å; C320-V331 HydrophobicContact CB-CG1 3.52Å; C320-V331 HydrophobicContact CB-CG2 3.72Å
321	Y	97.3	Very high	94.6	Very high	1 Å²	1	51.4 Å²	51.4	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.6	-178.4	-177	-120.1	0	0	0	111.8	V303 F323 N326 E327 W328 L538 F543 K571	V303-Y321 HydrophobicContact CG2-CD1 4.5Å; V303-Y321 PolarHBondContact N-O 2.94Å; V303-Y321 PolarHBondContact O-N 2.88Å; Y321-F323 HydrophobicContact CD1-CB 4.47Å; Y321-F323 HydrophobicContact CE1-CB 3.92Å; Y321-F323 AromaticContact CE1-CD2 3.8Å; Y321-F323 HydrophobicContact CE1-CD2 3.8Å; Y321-F323 HydrophobicContact CE1-CG 4.2Å; Y321-F323 WeakPolarHBondContact OH-CD2 3.24Å; Y321-N326 PolarHBondContact OH-OD1 3.4Å; Y321-E327 WeakPolarHBondContact CA-O 3.49Å; Y321-E327 WeakPolarHBondContact CD2-O 3.27Å; Y321-W328 AromaticContact CD2-CD1 3.69Å; Y321-W328 AromaticContact CD2-CD2 3.86Å; Y321-W328 HydrophobicContact CD2-CD2 3.86Å; Y321-W328 AromaticContact CD2-CE2 3.52Å; Y321-W328 AromaticContact CD2-CG 3.98Å; Y321-W328 HydrophobicContact CD2-CG 3.98Å; Y321-W328 HydrophobicContact CD2-CZ2 4.07Å; Y321-W328 AromaticContact CD2-NE1 3.38Å; Y321-W328 AromaticContact CE2-NE1 3.86Å; Y321-W328 HydrophobicContact CG-CD2 4.15Å; Y321-W328 AromaticContact CG-CE2 3.77Å; Y321-W328 HydrophobicContact CG-CH2 4.3Å; Y321-W328 AromaticContact CG-CZ2 3.86Å; Y321-W328 HydrophobicContact CG-CZ2 3.86Å; Y321-L538 HydrophobicContact CD1-CD2 4.37Å; Y321-L538 HydrophobicContact CE1-CD2 4.4Å; Y321-F543 HydrophobicContact CD1-CE1 4.5Å; Y321-F543 AromaticContact CE1-CE1 3.72Å; Y321-F543 HydrophobicContact CE1-CE1 3.72Å; Y321-F543 HydrophobicContact CE1-CZ 4.18Å; Y321-K571 HydrophobicContact CE2-CB 4.2Å
322	N	92.6	Very high	94.7	Very high	53 Å²	53	47.4 Å²	47.4	28%	0.283	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	113.1	169.3	-175.6	-50.6	0	0	0	109.2	L324 K325 N326 E327	N322-L324 WeakPolarHBondContact OD1-CB 3.24Å; N322-L324 PolarHBondContact OD1-N 2.9Å; N322-L324 VanDerWaalsContact OD1-N 3.08Å; N322-K325 HydrophobicContact CB-CB 4.29Å; N322-K325 PolarHBondContact OD1-N 2.75Å; N322-N326 WeakPolarHBondContact O-CA 3.3Å; N322-N326 PolarHBondContact O-N 3.01Å; N322-E327 PolarHBondContact N-O 3.01Å; N322-E327 PolarHBondContact O-N 2.78Å
323	F	93.2	Very high	94.8	Very high	14 Å²	14	46.1 Å²	46.1	6%	0.061	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-33.3	-175	-171.1	-151.3	0	0	0	113.4	K297 V300 Y321 N326 L538 H541 F543	K297-F323 HydrophobicContact CB-CD1 3.89Å; K297-F323 HydrophobicContact CB-CE1 4.43Å; K297-F323 HydrophobicContact CB-CG 4.26Å; K297-F323 HydrophobicContact CD-CD1 4.08Å; K297-F323 HydrophobicContact CD-CD2 4.19Å; K297-F323 HydrophobicContact CD-CE1 4.08Å; K297-F323 HydrophobicContact CD-CE2 4.18Å; K297-F323 HydrophobicContact CD-CG 4.17Å; K297-F323 HydrophobicContact CD-CZ 4.14Å; K297-F323 HydrophobicContact CG-CD1 3.71Å; K297-F323 HydrophobicContact CG-CE1 3.75Å; K297-F323 HydrophobicContact CG-CG 4.24Å; K297-F323 HydrophobicContact CG-CZ 4.29Å; V300-F323 HydrophobicContact CG2-CB 4.38Å; V300-F323 HydrophobicContact CG2-CD1 3.83Å; Y321-F323 HydrophobicContact CD1-CB 4.47Å; Y321-F323 HydrophobicContact CE1-CB 3.92Å; Y321-F323 AromaticContact CE1-CD2 3.8Å; Y321-F323 HydrophobicContact CE1-CD2 3.8Å; Y321-F323 HydrophobicContact CE1-CG 4.2Å; Y321-F323 WeakPolarHBondContact OH-CD2 3.24Å; F323-N326 PolarHBondContact O-N 3.01Å; F323-L538 HydrophobicContact CB-CD2 3.82Å; F323-L538 HydrophobicContact CD1-CD2 4.1Å; F323-L538 HydrophobicContact CG-CD2 4.01Å; F323-H541 AromaticContact CE1-CD2 3.97Å; F323-H541 AromaticContact CZ-CD2 3.92Å; F323-F543 HydrophobicContact CD2-CZ 4.03Å; F323-F543 HydrophobicContact CE1-CZ 4.48Å; F323-F543 AromaticContact CE2-CZ 3.78Å; F323-F543 HydrophobicContact CE2-CZ 3.78Å; F323-F543 HydrophobicContact CG-CZ 4.49Å; F323-F543 HydrophobicContact CZ-CZ 4.01Å
324	L	91.4	Very high	95	Very high	20 Å²	20	38.7 Å²	38.7	11%	0.105	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-52.5	175.3	167.6	59.7	0	0	0	111	I178 D206 N208 K297 N322 N326	I178-L324 HydrophobicContact CG2-CD1 4.34Å; D206-L324 HydrophobicContact CB-CD1 4.15Å; D206-L324 WeakPolarHBondContact O-CD1 3.26Å; N208-L324 HydrophobicContact CB-CD2 3.58Å; K297-L324 HydrophobicContact CB-CB 4.17Å; N322-L324 WeakPolarHBondContact OD1-CB 3.24Å; N322-L324 PolarHBondContact OD1-N 2.9Å; N322-L324 VanDerWaalsContact OD1-N 3.08Å; L324-N326 VanDerWaalsContact C-N 3.26Å; L324-N326 PolarHBondContact O-N 2.93Å
325	K	91	Very high	94.9	Very high	114 Å²	114	42 Å²	42	50%	0.496	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-15.8	-178.6	-63.5	-174.5	177.2	-174.2	0	113	N322 E327	N322-K325 HydrophobicContact CB-CB 4.29Å; N322-K325 PolarHBondContact OD1-N 2.75Å; K325-E327 HydrophobicContact CB-CB 4.26Å; K325-E327 HydrophobicContact CB-CG 4.25Å
326	N	94.3	Very high	94.7	Very high	70 Å²	70	47.8 Å²	47.8	37%	0.374	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	52.2	-172.4	-169	28.7	0	0	0	111.4	Y321 N322 F323 L324 K571	Y321-N326 PolarHBondContact OH-OD1 3.4Å; N322-N326 WeakPolarHBondContact O-CA 3.3Å; N322-N326 PolarHBondContact O-N 3.01Å; F323-N326 PolarHBondContact O-N 3.01Å; L324-N326 VanDerWaalsContact C-N 3.26Å; L324-N326 PolarHBondContact O-N 2.93Å; N326-K571 WeakPolarHBondContact O-CB 3.3Å; N326-K571 VanDerWaalsContact O-CG 3.3Å; N326-K571 WeakPolarHBondContact O-CG 3.49Å; N326-K571 VanDerWaalsContact OD1-CB 3.24Å; N326-K571 WeakPolarHBondContact OD1-CB 3.44Å; N326-K571 PolarHBondContact OD1-N 3.41Å
327	E	95.5	Very high	94.7	Very high	89 Å²	89	50.4 Å²	50.4	42%	0.416	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140.2	-173.8	-76.6	175.8	172.2	0	0	111.7	Y321 N322 K325	Y321-E327 WeakPolarHBondContact CA-O 3.49Å; Y321-E327 WeakPolarHBondContact CD2-O 3.27Å; N322-E327 PolarHBondContact N-O 3.01Å; N322-E327 PolarHBondContact O-N 2.78Å; K325-E327 HydrophobicContact CB-CB 4.26Å; K325-E327 HydrophobicContact CB-CG 4.25Å
328	W	97.4	Very high	94.7	Very high	16 Å²	16	49.3 Å²	49.3	6%	0.061	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.3	167.8	-71.1	93	0	0	0	109.9	V303 C305 E319 C320 Y321 V545 V557 K571 L573	V303-W328 HydrophobicContact CG1-CH2 4.45Å; C305-W328 HydrophobicContact CB-CH2 4.04Å; C305-W328 HydrophobicContact CB-CZ3 3.67Å; E319-W328 HydrophobicContact CB-CE3 3.74Å; E319-W328 HydrophobicContact CB-CZ3 4.23Å; C320-W328 CarbonylContact O-C 3.45Å; C320-W328 WeakPolarHBondContact O-CA 3.08Å; Y321-W328 AromaticContact CD2-CD1 3.69Å; Y321-W328 AromaticContact CD2-CD2 3.86Å; Y321-W328 HydrophobicContact CD2-CD2 3.86Å; Y321-W328 AromaticContact CD2-CE2 3.52Å; Y321-W328 AromaticContact CD2-CG 3.98Å; Y321-W328 HydrophobicContact CD2-CG 3.98Å; Y321-W328 HydrophobicContact CD2-CZ2 4.07Å; Y321-W328 AromaticContact CD2-NE1 3.38Å; Y321-W328 AromaticContact CE2-NE1 3.86Å; Y321-W328 HydrophobicContact CG-CD2 4.15Å; Y321-W328 AromaticContact CG-CE2 3.77Å; Y321-W328 HydrophobicContact CG-CH2 4.3Å; Y321-W328 AromaticContact CG-CZ2 3.86Å; Y321-W328 HydrophobicContact CG-CZ2 3.86Å; W328-V545 HydrophobicContact CH2-CG1 4.37Å; W328-V545 HydrophobicContact CZ2-CG1 4.39Å; W328-V545 HydrophobicContact CZ2-CG2 4.44Å; W328-V557 HydrophobicContact CZ2-CG2 4.03Å; W328-K571 VanDerWaalsContact CD1-O 3.24Å; W328-K571 PolarHBondContact NE1-O 2.96Å; W328-L573 HydrophobicContact CD2-CD2 3.74Å; W328-L573 HydrophobicContact CE3-CD2 3.75Å; W328-L573 HydrophobicContact CG-CD2 4.48Å; W328-L573 HydrophobicContact CH2-CD2 3.72Å; W328-L573 HydrophobicContact CZ2-CD2 3.71Å; W328-L573 HydrophobicContact CZ3-CD2 3.74Å
329	N	95.9	Very high	94.7	Very high	86 Å²	86	50.5 Å²	50.5	46%	0.46	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	134.8	176.2	-67.6	-73.2	0	0	0	110	E319 C320 V331	E319-N329 CarbonylContact C-O 3.57Å; E319-N329 WeakPolarHBondContact CA-O 3.49Å; C320-N329 PolarHBondContact N-O 3.21Å; C320-N329 PolarHBondContact O-N 3Å; N329-V331 PolarHBondContact O-N 3.09Å
330	A	95.4	Very high	94.7	Very high	75 Å²	75	53.4 Å²	53.4	62%	0.62	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	120.6	169.2	0	0	0	0	0	109.2
331	V	95	Very high	94.8	Very high	68 Å²	68	53 Å²	53	41%	0.412	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-27	-171.5	-69.9	0	0	0	0	114	Y304 I318 C320 N329 W368	Y304-V331 HydrophobicContact CD1-CG2 4.11Å; Y304-V331 HydrophobicContact CE1-CG2 3.97Å; I318-V331 HydrophobicContact CB-CG2 4.47Å; I318-V331 HydrophobicContact CG2-CG2 4.05Å; I318-V331 WeakPolarHBondContact O-CG2 3.49Å; I318-V331 PolarHBondContact O-N 3.29Å; C320-V331 HydrophobicContact CB-CB 4.28Å; C320-V331 HydrophobicContact CB-CG1 3.52Å; C320-V331 HydrophobicContact CB-CG2 3.72Å; N329-V331 PolarHBondContact O-N 3.09Å; V331-W368 HydrophobicContact CG2-CH2 4.42Å
332	A	95.7	Very high	94.8	Very high	10 Å²	10	53.3 Å²	53.3	8%	0.083	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	175.6	-178.4	0	0	0	0	0	110.8	I318 W368 D373	I318-A332 HydrophobicContact CB-CB 4.29Å; I318-A332 HydrophobicContact CD1-CB 4.17Å; I318-A332 PolarHBondContact N-O 3.37Å; A332-W368 HydrophobicContact CB-CH2 4.22Å; A332-W368 HydrophobicContact CB-CZ2 3.41Å; A332-W368 VanDerWaalsContact CB-CZ2 3.41Å; A332-D373 WeakPolarHBondContact CB-OD1 3.38Å
333	C	95.4	Very high	95.1	Very high	81 Å²	81	51.9 Å²	51.9	55%	0.547	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.6	174.5	-76.2	0	0	0	0	111.1	Q316	Q316-C333 CarbonylContact O-C 3.56Å; Q316-C333 WeakPolarHBondContact O-CA 3.31Å
334	M	95	Very high	95.2	Very high	5 Å²	5	51.3 Å²	51.3	3%	0.025	27%	0.269	C	S	.	.			trans	-63.2	134.5	169.8	-64.8	-171.4	-64.1	0	0	110.3	G307 A315 Q316 I318 R336 F341 I352 W375	G307-M334 VanDerWaalsContact CA-CE 3.49Å; A315-M334 WeakPolarHBondContact O-CE 3.44Å; Q316-M334 PolarHBondContact NE2-O 3.14Å; Q316-M334 PolarHBondContact O-N 3.06Å; I318-M334 HydrophobicContact CD1-CG 4.2Å; I318-M334 HydrophobicContact CG1-CG 4.24Å; M334-R336 PolarHBondContact O-N 3.13Å; M334-R336 VanDerWaalsContact O-N 3.07Å; M334-F341 HydrophobicContact CE-CE1 4.15Å; M334-F341 HydrophobicContact CE-CZ 4.32Å; M334-F341 HydrophobicContact SD-CE1 3.96Å; M334-F341 HydrophobicContact SD-CZ 3.83Å; M334-I352 HydrophobicContact CG-CD1 4.13Å; M334-I352 HydrophobicContact SD-CD1 3.65Å; M334-W375 HydrophobicContact CB-CH2 4.4Å; M334-W375 HydrophobicContact CG-CH2 3.93Å; M334-W375 HydrophobicContact CG-CZ2 4.35Å
335	P	92.8	Very high	95.3	Very high	70 Å²	70	53 Å²	53	46%	0.455	28%	0.276	S	S	.	.	S	Bend	trans	-58.1	-28.2	-176.3	-27.3	34	0	0	0	114.3	W375	P335-W375 HydrophobicContact CG-CB 4.19Å; P335-W375 HydrophobicContact CG-CD2 3.68Å; P335-W375 HydrophobicContact CG-CE3 4.11Å; P335-W375 HydrophobicContact CG-CG 3.7Å
336	R	90.9	Very high	95.2	Very high	126 Å²	126	49.2 Å²	49.2	48%	0.475	26%	0.261	S	S	.	.	S	Bend	trans	-138.9	157.5	179.8	-72	-178.7	-78.2	-104.2	-3.2	110.6	M334 R338 E366	M334-R336 PolarHBondContact O-N 3.13Å; M334-R336 VanDerWaalsContact O-N 3.07Å; R336-R338 PolarHBondContact O-N 3.25Å; R336-E366 IonicContact CZ-OE1 2.95Å; R336-E366 IonicContact NE-OE1 2.68Å; R336-E366 IonicContact NH2-OE1 3.39Å; R336-E366 PolarHBondContact NH2-OE1 2.79Å
337	R	93.6	Very high	94.7	Very high	112 Å²	112	52.9 Å²	52.9	42%	0.423	28%	0.281	S	S	.	.			trans	-70	130.5	169.5	-71.1	-179.2	-159.4	-112.9	9.7	109.2	N312 G314 Q316	N312-R337 PolarHBondContact O-NH1 3.45Å; G314-R337 PolarHBondContact O-NH1 2.86Å; Q316-R337 VanDerWaalsContact CD-CG 3.44Å; Q316-R337 HydrophobicContact CG-CG 3.55Å
338	R	96.3	Very high	94.2	Very high	7 Å²	7	52.7 Å²	52.7	3%	0.026	28%	0.28	C	S	.	.			trans	-147	132.3	-179.9	-164.5	175.7	174.7	178.9	-8.1	107.7	R336 F341 I352 G354 R356 L362 T364 E366	R336-R338 PolarHBondContact O-N 3.25Å; R338-F341 HydrophobicContact CB-CD1 3.98Å; R338-F341 HydrophobicContact CB-CE1 4.26Å; R338-F341 HydrophobicContact CG-CB 4.44Å; R338-F341 HydrophobicContact CG-CD1 3.8Å; R338-F341 VanDerWaalsContact O-CE1 3.27Å; R338-F341 WeakPolarHBondContact O-CE1 3.35Å; R338-I352 VanDerWaalsContact CZ-CG2 3.49Å; R338-I352 PolarHBondContact NH1-O 3.39Å; R338-I352 PolarHBondContact NH2-O 3.44Å; R338-G354 PolarHBondContact NE-O 3.11Å; R338-G354 PolarHBondContact NH2-O 3.28Å; R338-R356 WeakPolarHBondContact CA-O 3.48Å; R338-L362 HydrophobicContact CG-CD1 4Å; R338-T364 PolarHBondContact NH2-O 2.95Å; R338-E366 IonicContact NH1-OE2 3.09Å; R338-E366 PolarHBondContact NH1-OE2 2.8Å
339	L	96.8	Very high	94	Very high	25 Å²	25	54.1 Å²	54.1	13%	0.131	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	154.3	-178.4	-65.4	176.6	0	0	0	110.6	G308 M309 F341 G355 R356	G308-L339 WeakPolarHBondContact O-CD2 3.22Å; M309-L339 HydrophobicContact CB-CD2 4.37Å; M309-L339 HydrophobicContact SD-CD1 3.93Å; M309-L339 HydrophobicContact SD-CD2 4.49Å; L339-F341 PolarHBondContact O-N 3.15Å; L339-F341 VanDerWaalsContact O-N 3.08Å; L339-G355 CarbonylContact O-C 3.53Å; L339-G355 WeakPolarHBondContact O-CA 3.41Å; L339-R356 HydrophobicContact CB-CG 4Å; L339-R356 PolarHBondContact N-O 3.14Å; L339-R356 PolarHBondContact O-N 3.43Å
340	Q	97	Very high	94.1	Very high	62 Å²	62	50 Å²	50	29%	0.29	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.1	31.2	171.7	-52.6	178.3	-56.3	0	0	113.5	G355 R356 H386 G387	Q340-G355 WeakPolarHBondContact O-CA 3.36Å; Q340-R356 VanDerWaalsContact OE1-CD 3.26Å; Q340-R356 VanDerWaalsContact OE1-NH1 3.14Å; Q340-H386 HydrophobicContact CB-CB 4.31Å; Q340-H386 PolarHBondContact OE1-CD2 2.86Å; Q340-G387 PolarHBondContact O-N 2.94Å
341	F	98	Very high	94.2	Very high	10 Å²	10	47.2 Å²	47.2	4%	0.044	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	168.2	167.5	57.3	-99.3	0	0	0	109.5	L306 M334 R338 L339 I343 I352 I353 C581	L306-F341 HydrophobicContact CB-CE2 4.43Å; L306-F341 HydrophobicContact CB-CZ 4.29Å; M334-F341 HydrophobicContact CE-CE1 4.15Å; M334-F341 HydrophobicContact CE-CZ 4.32Å; M334-F341 HydrophobicContact SD-CE1 3.96Å; M334-F341 HydrophobicContact SD-CZ 3.83Å; R338-F341 HydrophobicContact CB-CD1 3.98Å; R338-F341 HydrophobicContact CB-CE1 4.26Å; R338-F341 HydrophobicContact CG-CB 4.44Å; R338-F341 HydrophobicContact CG-CD1 3.8Å; R338-F341 VanDerWaalsContact O-CE1 3.27Å; R338-F341 WeakPolarHBondContact O-CE1 3.35Å; L339-F341 PolarHBondContact O-N 3.15Å; L339-F341 VanDerWaalsContact O-N 3.08Å; F341-I343 HydrophobicContact CD2-CG2 3.81Å; F341-I343 HydrophobicContact CE2-CG2 3.61Å; F341-I352 HydrophobicContact CB-CG2 3.86Å; F341-I352 HydrophobicContact CD1-CG2 4.01Å; F341-I352 HydrophobicContact CD2-CG2 3.46Å; F341-I352 VanDerWaalsContact CD2-CG2 3.46Å; F341-I352 HydrophobicContact CE1-CG2 4.36Å; F341-I352 HydrophobicContact CE2-CG2 3.86Å; F341-I352 HydrophobicContact CG-CG2 3.51Å; F341-I352 HydrophobicContact CZ-CG2 4.28Å; F341-I353 WeakPolarHBondContact CA-O 3.15Å; F341-I353 WeakPolarHBondContact CB-O 3.35Å; F341-C581 HydrophobicContact CE2-CB 4.25Å; F341-C581 PolarHBondContact O-SG 3.04Å
342	G	98	Very high	94.3	Very high	6 Å²	6	44 Å²	44	6%	0.062	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	165.9	164.3	0	0	0	0	0	109.9	I353	G342-I353 PolarHBondContact N-O 3.11Å; G342-I353 PolarHBondContact O-N 3.26Å
343	I	97.7	Very high	94.4	Very high	23 Å²	23	43.5 Å²	43.5	12%	0.118	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	151.6	177.4	67.3	176.8	0	0	0	111.8	F341 I350 L351 I352 V390 C581 L582 A583	F341-I343 HydrophobicContact CD2-CG2 3.81Å; F341-I343 HydrophobicContact CE2-CG2 3.61Å; I343-I350 HydrophobicContact CB-CG2 4.49Å; I343-L351 CarbonylContact C-O 3.54Å; I343-L351 WeakPolarHBondContact CA-O 3.49Å; I343-I352 HydrophobicContact CG2-CG1 4.48Å; I343-V390 WeakPolarHBondContact O-CG1 3.25Å; I343-C581 HydrophobicContact CB-CB 4.23Å; I343-C581 HydrophobicContact CD1-CB 3.43Å; I343-C581 VanDerWaalsContact CD1-CB 3.43Å; I343-C581 HydrophobicContact CG1-CB 3.63Å; I343-C581 HydrophobicContact CG2-CB 3.65Å; I343-L582 VanDerWaalsContact CD1-C 3.41Å; I343-L582 WeakPolarHBondContact CD1-O 3.35Å; I343-A583 HydrophobicContact CD1-CB 4.11Å
344	A	96.7	Very high	94.5	Very high	3 Å²	3	39.7 Å²	39.7	3%	0.025	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	139.4	168.6	0	0	0	0	0	108.7	L351 I353 V390 V392 I397	A344-L351 HydrophobicContact CB-CB 4.45Å; A344-L351 PolarHBondContact N-O 3.27Å; A344-L351 PolarHBondContact O-N 3.42Å; A344-I353 HydrophobicContact CB-CD1 3.86Å; A344-V390 HydrophobicContact CB-CG1 3.92Å; A344-V392 HydrophobicContact CB-CG2 3.67Å; A344-I397 HydrophobicContact CB-CB 4.48Å; A344-I397 HydrophobicContact CB-CD1 3.93Å; A344-I397 HydrophobicContact CB-CG1 4.03Å; A344-I397 HydrophobicContact CB-CG2 3.69Å
345	Q	93.6	Very high	94.7	Very high	56 Å²	56	39.4 Å²	39.4	26%	0.262	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.3	172.6	-177.4	177.6	-18.8	0	0	108.1	V584	Q345-V584 PolarHBondContact NE2-O 2.82Å; Q345-V584 PolarHBondContact OE1-O 3.31Å
346	L	88.6	Confident	94.8	Very high	33 Å²	33	40.2 Å²	40.2	17%	0.173	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	124.8	174.6	-75	177.7	0	0	0	108.2	E348 M349 L351 V392 I397	L346-E348 PolarHBondContact O-N 2.97Å; L346-E348 VanDerWaalsContact O-N 3.15Å; L346-M349 PolarHBondContact N-O 3.12Å; L346-M349 PolarHBondContact O-N 3.35Å; L346-L351 HydrophobicContact CB-CD1 4.43Å; L346-V392 HydrophobicContact CD2-CG1 3.79Å; L346-V392 HydrophobicContact CD2-CG2 4.37Å; L346-I397 HydrophobicContact CD1-CD1 3.61Å; L346-I397 HydrophobicContact CD1-CG1 3.73Å; L346-I397 HydrophobicContact CG-CD1 4.44Å; L346-I397 HydrophobicContact CG-CG1 4.36Å
347	D	84.2	Confident	94.9	Very high	147 Å²	147	38 Å²	38	79%	0.786	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	-117.5	-178.2	-54.6	-43.4	0	0	0	111.8
348	E	85.2	Confident	94.7	Very high	85 Å²	85	35.5 Å²	35.5	40%	0.397	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	15.1	-179.9	-55.3	-171	176.1	0	0	112.9	L346 Y370 R371	L346-E348 PolarHBondContact O-N 2.97Å; L346-E348 VanDerWaalsContact O-N 3.15Å; E348-Y370 HydrophobicContact CB-CE1 4.42Å; E348-Y370 VanDerWaalsContact O-CD1 3.23Å; E348-Y370 WeakPolarHBondContact O-CD1 3.24Å; E348-Y370 WeakPolarHBondContact O-CE1 3.34Å; E348-R371 IonicContact OE1-CZ 2.78Å; E348-R371 IonicContact OE1-NH1 3.72Å; E348-R371 PolarHBondContact OE1-NH1 2.82Å; E348-R371 IonicContact OE1-NH2 3.75Å; E348-R371 PolarHBondContact OE1-NH2 2.79Å; E348-R371 IonicContact OE2-CZ 3.89Å; E348-R371 IonicContact OE2-NE 3.05Å; E348-R371 IonicContact OE2-NH1 3.91Å; E348-R371 PolarHBondContact OE2-NH1 3.08Å
349	M	93.2	Very high	94.4	Very high	47 Å²	47	44 Å²	44	23%	0.232	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.7	-175.2	-57.7	-61.9	-66.5	0	0	112.1	L346 L351 C367 W368 D369	L346-M349 PolarHBondContact N-O 3.12Å; L346-M349 PolarHBondContact O-N 3.35Å; M349-L351 HydrophobicContact CB-CD1 3.87Å; M349-C367 HydrophobicContact CE-CB 3.59Å; M349-W368 WeakPolarHBondContact CA-O 3.1Å; M349-W368 VanDerWaalsContact CE-C 3.47Å; M349-D369 HydrophobicContact CE-CB 3.97Å; M349-D369 VanDerWaalsContact SD-CA 3.56Å; M349-D369 HydrophobicContact SD-CB 3.6Å; M349-D369 VanDerWaalsContact SD-CB 3.6Å
350	I	96.5	Very high	94.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.8	166.4	-63.7	166.4	0	0	0	108.1	Y304 L306 I343 W368 Y370 A583	Y304-I350 HydrophobicContact CD2-CD1 4.4Å; Y304-I350 HydrophobicContact CG-CD1 4.37Å; L306-I350 HydrophobicContact CD2-CG2 4.09Å; I343-I350 HydrophobicContact CB-CG2 4.49Å; I350-W368 HydrophobicContact CB-CE3 4.25Å; I350-W368 HydrophobicContact CD1-CE3 3.9Å; I350-W368 HydrophobicContact CD1-CZ3 3.84Å; I350-W368 PolarHBondContact N-O 2.64Å; I350-W368 PolarHBondContact O-N 2.79Å; I350-Y370 HydrophobicContact CD1-CD1 4.21Å; I350-Y370 HydrophobicContact CG1-CD1 4.27Å; I350-A583 HydrophobicContact CD1-CB 3.56Å; I350-A583 HydrophobicContact CG1-CB 3.94Å; I350-A583 HydrophobicContact CG2-CB 4.43Å
351	L	97.2	Very high	94.4	Very high	16 Å²	16	47.7 Å²	47.7	8%	0.084	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.8	-178.3	-72.5	75.6	0	0	0	110.1	I343 A344 L346 M349 I353 V365 E366 C367 I397	I343-L351 CarbonylContact C-O 3.54Å; I343-L351 WeakPolarHBondContact CA-O 3.49Å; A344-L351 HydrophobicContact CB-CB 4.45Å; A344-L351 PolarHBondContact N-O 3.27Å; A344-L351 PolarHBondContact O-N 3.42Å; L346-L351 HydrophobicContact CB-CD1 4.43Å; M349-L351 HydrophobicContact CB-CD1 3.87Å; L351-I353 HydrophobicContact CB-CD1 4.18Å; L351-I353 HydrophobicContact CB-CG1 4.28Å; L351-V365 HydrophobicContact CB-CG1 4.27Å; L351-V365 HydrophobicContact CD2-CG1 4.07Å; L351-V365 HydrophobicContact CG-CG1 4.45Å; L351-E366 CarbonylContact C-O 3.57Å; L351-E366 WeakPolarHBondContact CA-O 3.41Å; L351-C367 HydrophobicContact CG-CB 4.28Å; L351-I397 HydrophobicContact CD2-CD1 3.71Å
352	I	97.6	Very high	94.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	114.1	174.5	-55.3	-171.1	0	0	0	109	L306 M334 R338 F341 I343 V365 E366 W375	L306-I352 HydrophobicContact CD2-CD1 4.08Å; L306-I352 HydrophobicContact CD2-CG1 4.48Å; M334-I352 HydrophobicContact CG-CD1 4.13Å; M334-I352 HydrophobicContact SD-CD1 3.65Å; R338-I352 VanDerWaalsContact CZ-CG2 3.49Å; R338-I352 PolarHBondContact NH1-O 3.39Å; R338-I352 PolarHBondContact NH2-O 3.44Å; F341-I352 HydrophobicContact CB-CG2 3.86Å; F341-I352 HydrophobicContact CD1-CG2 4.01Å; F341-I352 HydrophobicContact CD2-CG2 3.46Å; F341-I352 VanDerWaalsContact CD2-CG2 3.46Å; F341-I352 HydrophobicContact CE1-CG2 4.36Å; F341-I352 HydrophobicContact CE2-CG2 3.86Å; F341-I352 HydrophobicContact CG-CG2 3.51Å; F341-I352 HydrophobicContact CZ-CG2 4.28Å; I343-I352 HydrophobicContact CG2-CG1 4.48Å; I352-V365 WeakPolarHBondContact O-CA 3.42Å; I352-E366 PolarHBondContact N-O 2.87Å; I352-E366 PolarHBondContact O-N 3.2Å; I352-W375 HydrophobicContact CD1-CH2 3.67Å; I352-W375 HydrophobicContact CD1-CZ3 3.66Å; I352-W375 HydrophobicContact CG1-CZ3 4.34Å
353	I	98.3	Very high	94.4	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.9	-166.6	-62	157.1	0	0	0	110.5	F341 G342 A344 L351 V365 M381 L388 V390 I397 W420	F341-I353 WeakPolarHBondContact CA-O 3.15Å; F341-I353 WeakPolarHBondContact CB-O 3.35Å; G342-I353 PolarHBondContact N-O 3.11Å; G342-I353 PolarHBondContact O-N 3.26Å; A344-I353 HydrophobicContact CB-CD1 3.86Å; L351-I353 HydrophobicContact CB-CD1 4.18Å; L351-I353 HydrophobicContact CB-CG1 4.28Å; I353-V365 HydrophobicContact CB-CG2 4.43Å; I353-V365 HydrophobicContact CG1-CG1 3.87Å; I353-V365 HydrophobicContact CG1-CG2 4Å; I353-V365 HydrophobicContact CG2-CG2 4.23Å; I353-M381 HydrophobicContact CG2-CE 3.89Å; I353-M381 HydrophobicContact CG2-CG 4.16Å; I353-M381 HydrophobicContact CG2-SD 3.42Å; I353-M381 WeakPolarHBondContact CG2-SD 3.38Å; I353-L388 HydrophobicContact CG2-CD1 4.29Å; I353-V390 HydrophobicContact CB-CG2 4.29Å; I353-V390 HydrophobicContact CD1-CG1 3.82Å; I353-V390 HydrophobicContact CG2-CG2 4.36Å; I353-I397 HydrophobicContact CD1-CD1 4.31Å; I353-I397 HydrophobicContact CD1-CG2 3.7Å; I353-W420 HydrophobicContact CD1-CH2 4.2Å; I353-W420 HydrophobicContact CD1-CZ2 4.48Å; I353-W420 HydrophobicContact CG2-CH2 4.03Å; I353-W420 HydrophobicContact CG2-CZ2 4.21Å
354	G	98.2	Very high	94.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	67.7	-134.1	177.9	0	0	0	0	0	115.5	R338 T364 M381 R385	R338-G354 PolarHBondContact NE-O 3.11Å; R338-G354 PolarHBondContact NH2-O 3.28Å; G354-T364 PolarHBondContact N-O 2.66Å; G354-M381 VanDerWaalsContact CA-CE 3.42Å; G354-R385 CarbonylContact C-O 3.57Å; G354-R385 VanDerWaalsContact C-O 3.3Å; G354-R385 VanDerWaalsContact CA-O 3.25Å; G354-R385 WeakPolarHBondContact CA-O 3.2Å
355	G	97.9	Very high	94.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.9	-168.8	-175.1	0	0	0	0	0	114.5	L339 Q340 L362 R385	L339-G355 CarbonylContact O-C 3.53Å; L339-G355 WeakPolarHBondContact O-CA 3.41Å; Q340-G355 WeakPolarHBondContact O-CA 3.36Å; G355-L362 WeakPolarHBondContact O-CB 3.29Å; G355-L362 PolarHBondContact O-N 2.9Å; G355-R385 PolarHBondContact N-O 3.29Å
356	R	96.1	Very high	94.6	Very high	86 Å²	86	49.1 Å²	49.1	33%	0.325	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	144.3	-177.1	65.9	179.9	-173.1	-171.2	0	111.9	R338 L339 Q340 K360 H386	R338-R356 WeakPolarHBondContact CA-O 3.48Å; L339-R356 HydrophobicContact CB-CG 4Å; L339-R356 PolarHBondContact N-O 3.14Å; L339-R356 PolarHBondContact O-N 3.43Å; Q340-R356 VanDerWaalsContact OE1-CD 3.26Å; Q340-R356 VanDerWaalsContact OE1-NH1 3.14Å; R356-K360 WeakPolarHBondContact CA-O 3.48Å; R356-K360 WeakPolarHBondContact CB-O 3.48Å; R356-H386 HydrophobicContact CB-CB 4.07Å; R356-H386 HydrophobicContact CG-CB 4.46Å
357	D	92.7	Very high	95	Very high	80 Å²	80	48.2 Å²	48.2	43%	0.428	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	104	167.7	-179.5	9.3	0	0	0	107.8	L359 K360 L362	D357-L359 PolarHBondContact O-N 2.97Å; D357-K360 PolarHBondContact N-O 2.84Å; D357-K360 WeakPolarHBondContact O-CB 3.38Å; D357-K360 PolarHBondContact O-N 3.15Å; D357-L362 HydrophobicContact CB-CD1 4.17Å; D357-L362 HydrophobicContact CB-CD2 4.4Å
358	G	89.4	Confident	95.6	Very high	59 Å²	59	41.4 Å²	41.4	61%	0.608	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	-117.9	-168.5	0	0	0	0	0	112.2
359	L	89.6	Confident	96	Very high	185 Å²	185	38.1 Å²	38.1	97%	0.969	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-9.2	178.1	-63.4	176.9	0	0	0	113.4	D357	D357-L359 PolarHBondContact O-N 2.97Å
360	K	96	Very high	95.9	Very high	144 Å²	144	37.4 Å²	37.4	63%	0.626	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	117.3	-175.3	-174.8	-178	177.5	-175.9	0	110.4	R356 D357 L362	R356-K360 WeakPolarHBondContact CA-O 3.48Å; R356-K360 WeakPolarHBondContact CB-O 3.48Å; D357-K360 PolarHBondContact N-O 2.84Å; D357-K360 WeakPolarHBondContact O-CB 3.38Å; D357-K360 PolarHBondContact O-N 3.15Å; K360-L362 HydrophobicContact CD-CD2 4.06Å; K360-L362 HydrophobicContact CG-CD2 4.11Å
361	T	97.7	Very high	95.6	Very high	21 Å²	21	43.5 Å²	43.5	13%	0.129	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	138.4	165.4	-48.7	0	0	0	0	110.1	A384 R385 H386 H403 D404	T361-A384 HydrophobicContact CG2-CB 3.74Å; T361-R385 VanDerWaalsContact CG2-C 3.48Å; T361-R385 VanDerWaalsContact CG2-N 3.32Å; T361-H386 HydrophobicContact CG2-CB 4.17Å; T361-H386 PolarHBondContact OG1-ND1 3.2Å; T361-H403 WeakPolarHBondContact CG2-O 3.39Å; T361-D404 VanDerWaalsContact CB-O 3.28Å; T361-D404 WeakPolarHBondContact CB-O 3.29Å; T361-D404 PolarHBondContact OG1-O 3.32Å; T361-D404 VanDerWaalsContact OG1-O 3.05Å
362	L	97.9	Very high	95.4	Very high	19 Å²	19	52.3 Å²	52.3	10%	0.099	26%	0.257	C	S	.	.			trans	-108.7	145.2	-172.1	-56	175.2	0	0	0	112.4	R338 G355 D357 K360 A384 R385	R338-L362 HydrophobicContact CG-CD1 4Å; G355-L362 WeakPolarHBondContact O-CB 3.29Å; G355-L362 PolarHBondContact O-N 2.9Å; D357-L362 HydrophobicContact CB-CD1 4.17Å; D357-L362 HydrophobicContact CB-CD2 4.4Å; K360-L362 HydrophobicContact CD-CD2 4.06Å; K360-L362 HydrophobicContact CG-CD2 4.11Å; L362-A384 WeakPolarHBondContact O-CA 3.34Å; L362-R385 PolarHBondContact O-N 2.97Å
363	T	98.2	Very high	95.2	Very high	47 Å²	47	56.3 Å²	56.3	29%	0.288	28%	0.279	S	S	.	.			trans	-95.6	-13.5	164.9	50.9	0	0	0	0	112.3	S380 M381 A384	T363-S380 CarbonylContact O-C 3.47Å; T363-S380 WeakPolarHBondContact O-CA 3.09Å; T363-S380 WeakPolarHBondContact O-CB 3.42Å; T363-M381 WeakPolarHBondContact CB-O 3.47Å; T363-M381 PolarHBondContact O-N 3.13Å; T363-A384 HydrophobicContact CG2-CB 3.85Å
364	T	97.9	Very high	95	Very high	46 Å²	46	60.8 Å²	60.8	28%	0.282	30%	0.303	S	S	.	.			trans	-68.9	150.9	-164.7	51.5	0	0	0	0	112.5	R338 G354	R338-T364 PolarHBondContact NH2-O 2.95Å; G354-T364 PolarHBondContact N-O 2.66Å
365	V	97.7	Very high	94.9	Very high	4 Å²	4	63.4 Å²	63.4	2%	0.024	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.4	170.4	-179.2	0	0	0	0	107.9	L351 I352 I353 G378 V379 W420	L351-V365 HydrophobicContact CB-CG1 4.27Å; L351-V365 HydrophobicContact CD2-CG1 4.07Å; L351-V365 HydrophobicContact CG-CG1 4.45Å; I352-V365 WeakPolarHBondContact O-CA 3.42Å; I353-V365 HydrophobicContact CB-CG2 4.43Å; I353-V365 HydrophobicContact CG1-CG1 3.87Å; I353-V365 HydrophobicContact CG1-CG2 4Å; I353-V365 HydrophobicContact CG2-CG2 4.23Å; V365-G378 PolarHBondContact O-N 3.02Å; V365-V379 WeakPolarHBondContact CG2-O 3.13Å; V365-W420 HydrophobicContact CG2-CZ2 4Å
366	E	96.7	Very high	94.8	Very high	12 Å²	12	66.6 Å²	66.6	6%	0.056	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.4	175.8	-69.5	171.8	155.2	0	0	107.5	R336 R338 L351 I352 W375 T376 H377	R336-E366 IonicContact CZ-OE1 2.95Å; R336-E366 IonicContact NE-OE1 2.68Å; R336-E366 IonicContact NH2-OE1 3.39Å; R336-E366 PolarHBondContact NH2-OE1 2.79Å; R338-E366 IonicContact NH1-OE2 3.09Å; R338-E366 PolarHBondContact NH1-OE2 2.8Å; L351-E366 CarbonylContact C-O 3.57Å; L351-E366 WeakPolarHBondContact CA-O 3.41Å; I352-E366 PolarHBondContact N-O 2.87Å; I352-E366 PolarHBondContact O-N 3.2Å; E366-W375 HydrophobicContact CB-CE3 4.31Å; E366-W375 HydrophobicContact CB-CZ3 4.39Å; E366-T376 WeakPolarHBondContact CA-O 3.49Å; E366-H377 IonicContact OE1-CE1 3.78Å
367	C	96.3	Very high	94.8	Very high	15 Å²	15	69.3 Å²	69.3	10%	0.101	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.9	-176.2	-48.5	0	0	0	0	108.6	M349 L351 W375 T376	M349-C367 HydrophobicContact CE-CB 3.59Å; L351-C367 HydrophobicContact CG-CB 4.28Å; C367-W375 WeakPolarHBondContact O-CA 3.47Å; C367-T376 WeakPolarHBondContact CB-OG1 3.22Å; C367-T376 PolarHBondContact N-O 2.85Å; C367-T376 PolarHBondContact O-N 2.68Å; C367-T376 PolarHBondContact O-OG1 2.87Å
368	W	96.8	Very high	95	Very high	4 Å²	4	66.7 Å²	66.7	2%	0.015	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.3	179.2	-178.9	47.1	0	0	0	110.3	Y304 L306 I318 V331 A332 M349 I350 Y370 D373 D374 W375	Y304-W368 AromaticContact CD1-CH2 3.66Å; Y304-W368 HydrophobicContact CD1-CH2 3.66Å; Y304-W368 AromaticContact CD1-CZ3 3.79Å; Y304-W368 HydrophobicContact CD1-CZ3 3.79Å; Y304-W368 AromaticContact CE1-CH2 3.75Å; Y304-W368 HydrophobicContact CE1-CH2 3.75Å; Y304-W368 HydrophobicContact CE1-CZ3 4.2Å; Y304-W368 HydrophobicContact CG-CZ3 4.34Å; L306-W368 HydrophobicContact CD2-CE3 4.26Å; I318-W368 HydrophobicContact CD1-CD2 4.08Å; I318-W368 HydrophobicContact CD1-CE3 3.95Å; I318-W368 HydrophobicContact CD1-CH2 4.05Å; I318-W368 HydrophobicContact CD1-CZ2 4.15Å; I318-W368 HydrophobicContact CD1-CZ3 3.94Å; I318-W368 HydrophobicContact CG2-CH2 3.79Å; I318-W368 HydrophobicContact CG2-CZ3 3.9Å; V331-W368 HydrophobicContact CG2-CH2 4.42Å; A332-W368 HydrophobicContact CB-CH2 4.22Å; A332-W368 HydrophobicContact CB-CZ2 3.41Å; A332-W368 VanDerWaalsContact CB-CZ2 3.41Å; M349-W368 WeakPolarHBondContact CA-O 3.1Å; M349-W368 VanDerWaalsContact CE-C 3.47Å; I350-W368 HydrophobicContact CB-CE3 4.25Å; I350-W368 HydrophobicContact CD1-CE3 3.9Å; I350-W368 HydrophobicContact CD1-CZ3 3.84Å; I350-W368 PolarHBondContact N-O 2.64Å; I350-W368 PolarHBondContact O-N 2.79Å; W368-Y370 PolarHBondContact O-N 2.95Å; W368-D373 PolarHBondContact NE1-OD1 2.73Å; W368-D374 WeakPolarHBondContact CA-O 3.5Å; W368-W375 HydrophobicContact CB-CD2 4.1Å; W368-W375 HydrophobicContact CB-CE3 3.91Å; W368-W375 HydrophobicContact CB-CH2 3.74Å; W368-W375 HydrophobicContact CB-CZ2 3.93Å; W368-W375 HydrophobicContact CB-CZ3 3.73Å; W368-W375 AromaticContact CD1-CD1 3.88Å; W368-W375 AromaticContact CD1-CD2 3.83Å; W368-W375 AromaticContact CD1-CE2 3.27Å; W368-W375 AromaticContact CD1-CZ2 3.54Å; W368-W375 AromaticContact CD1-NE1 3.32Å; W368-W375 VanDerWaalsContact CD1-NE1 3.32Å; W368-W375 HydrophobicContact CD2-CH2 4.45Å; W368-W375 HydrophobicContact CD2-CZ2 4.09Å; W368-W375 HydrophobicContact CG-CD2 4.19Å; W368-W375 AromaticContact CG-CE2 3.73Å; W368-W375 HydrophobicContact CG-CE3 4.44Å; W368-W375 AromaticContact CG-CH2 3.88Å; W368-W375 HydrophobicContact CG-CH2 3.88Å; W368-W375 AromaticContact CG-CZ2 3.58Å; W368-W375 HydrophobicContact CG-CZ2 3.58Å; W368-W375 HydrophobicContact CG-CZ3 4.31Å; W368-W375 AromaticContact NE1-CE2 3.88Å; W368-W375 AromaticContact NE1-CZ2 3.99Å; W368-W375 AromaticContact NE1-NE1 3.64Å
369	D	94.5	Very high	95.3	Very high	16 Å²	16	67.2 Å²	67.2	9%	0.086	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	99.1	167.8	-177.7	-30.5	0	0	0	107.2	M349 R371 R372 D373 D374	M349-D369 HydrophobicContact CE-CB 3.97Å; M349-D369 VanDerWaalsContact SD-CA 3.56Å; M349-D369 HydrophobicContact SD-CB 3.6Å; M349-D369 VanDerWaalsContact SD-CB 3.6Å; D369-R371 PolarHBondContact O-N 3.2Å; D369-R371 WeakPolarHBondContact OD1-CB 3.43Å; D369-R371 PolarHBondContact OD1-N 2.97Å; D369-R372 HydrophobicContact CB-CB 4.36Å; D369-R372 PolarHBondContact O-N 2.99Å; D369-R372 PolarHBondContact OD1-N 3Å; D369-R372 VanDerWaalsContact OD2-CD 3.31Å; D369-R372 WeakPolarHBondContact OD2-CD 3.14Å; D369-R372 WeakPolarHBondContact OD2-CG 3.49Å; D369-R372 IonicContact OD2-NE 3.4Å; D369-R372 IonicContact OD2-NH1 3.54Å; D369-D373 VanDerWaalsContact O-CA 3.29Å; D369-D373 WeakPolarHBondContact O-CA 3.19Å; D369-D373 PolarHBondContact O-N 2.83Å; D369-D374 PolarHBondContact N-O 3.03Å; D369-D374 PolarHBondContact O-N 2.85Å
370	Y	90.9	Very high	95.7	Very high	32 Å²	32	61.1 Å²	61.1	13%	0.125	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.5	-174.7	64.2	-96.7	0	0	0	113.2	E348 I350 W368 V585	E348-Y370 HydrophobicContact CB-CE1 4.42Å; E348-Y370 VanDerWaalsContact O-CD1 3.23Å; E348-Y370 WeakPolarHBondContact O-CD1 3.24Å; E348-Y370 WeakPolarHBondContact O-CE1 3.34Å; I350-Y370 HydrophobicContact CD1-CD1 4.21Å; I350-Y370 HydrophobicContact CG1-CD1 4.27Å; W368-Y370 PolarHBondContact O-N 2.95Å; Y370-V585 HydrophobicContact CD1-CG2 4.38Å; Y370-V585 HydrophobicContact CE1-CG1 4.42Å; Y370-V585 HydrophobicContact CE1-CG2 4.05Å; Y370-V585 HydrophobicContact CE2-CG1 3.69Å; Y370-V585 HydrophobicContact CE2-CG2 4.25Å; Y370-V585 WeakPolarHBondContact OH-CG1 3.3Å
371	R	90.1	Very high	95.9	Very high	128 Å²	128	54.6 Å²	54.6	48%	0.483	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-36.2	177.5	-62.9	-172.6	178.6	172.9	6	112.1	E348 D369	E348-R371 IonicContact OE1-CZ 2.78Å; E348-R371 IonicContact OE1-NH1 3.72Å; E348-R371 PolarHBondContact OE1-NH1 2.82Å; E348-R371 IonicContact OE1-NH2 3.75Å; E348-R371 PolarHBondContact OE1-NH2 2.79Å; E348-R371 IonicContact OE2-CZ 3.89Å; E348-R371 IonicContact OE2-NE 3.05Å; E348-R371 IonicContact OE2-NH1 3.91Å; E348-R371 PolarHBondContact OE2-NH1 3.08Å; D369-R371 PolarHBondContact O-N 3.2Å; D369-R371 WeakPolarHBondContact OD1-CB 3.43Å; D369-R371 PolarHBondContact OD1-N 2.97Å
372	R	92.9	Very high	95.9	Very high	201 Å²	201	58.9 Å²	58.9	76%	0.758	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-11.1	180	-61.9	-174.5	178.1	141	-3.1	113.8	D369 D374	D369-R372 HydrophobicContact CB-CB 4.36Å; D369-R372 PolarHBondContact O-N 2.99Å; D369-R372 PolarHBondContact OD1-N 3Å; D369-R372 VanDerWaalsContact OD2-CD 3.31Å; D369-R372 WeakPolarHBondContact OD2-CD 3.14Å; D369-R372 WeakPolarHBondContact OD2-CG 3.49Å; D369-R372 IonicContact OD2-NE 3.4Å; D369-R372 IonicContact OD2-NH1 3.54Å; R372-D374 VanDerWaalsContact C-N 3.29Å; R372-D374 HydrophobicContact CB-CB 4.37Å; R372-D374 PolarHBondContact O-N 3.16Å
373	D	93	Very high	95.9	Very high	84 Å²	84	59.9 Å²	59.9	45%	0.449	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	46.2	-168.6	-166.7	31.1	0	0	0	112.5	A332 W368 D369	A332-D373 WeakPolarHBondContact CB-OD1 3.38Å; W368-D373 PolarHBondContact NE1-OD1 2.73Å; D369-D373 VanDerWaalsContact O-CA 3.29Å; D369-D373 WeakPolarHBondContact O-CA 3.19Å; D369-D373 PolarHBondContact O-N 2.83Å
374	D	95.1	Very high	95.9	Very high	94 Å²	94	58.8 Å²	58.8	50%	0.503	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	144.8	178.9	-166.6	23.6	0	0	0	111.6	W368 D369 R372	W368-D374 WeakPolarHBondContact CA-O 3.5Å; D369-D374 PolarHBondContact N-O 3.03Å; D369-D374 PolarHBondContact O-N 2.85Å; R372-D374 VanDerWaalsContact C-N 3.29Å; R372-D374 HydrophobicContact CB-CB 4.37Å; R372-D374 PolarHBondContact O-N 3.16Å
375	W	96.4	Very high	95.9	Very high	54 Å²	54	56.6 Å²	56.6	21%	0.205	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124	-175.6	-70.7	83.2	0	0	0	110.6	I318 M334 P335 I352 E366 C367 W368	I318-W375 HydrophobicContact CD1-CH2 4.07Å; I318-W375 HydrophobicContact CD1-CZ2 3.75Å; M334-W375 HydrophobicContact CB-CH2 4.4Å; M334-W375 HydrophobicContact CG-CH2 3.93Å; M334-W375 HydrophobicContact CG-CZ2 4.35Å; P335-W375 HydrophobicContact CG-CB 4.19Å; P335-W375 HydrophobicContact CG-CD2 3.68Å; P335-W375 HydrophobicContact CG-CE3 4.11Å; P335-W375 HydrophobicContact CG-CG 3.7Å; I352-W375 HydrophobicContact CD1-CH2 3.67Å; I352-W375 HydrophobicContact CD1-CZ3 3.66Å; I352-W375 HydrophobicContact CG1-CZ3 4.34Å; E366-W375 HydrophobicContact CB-CE3 4.31Å; E366-W375 HydrophobicContact CB-CZ3 4.39Å; C367-W375 WeakPolarHBondContact O-CA 3.47Å; W368-W375 HydrophobicContact CB-CD2 4.1Å; W368-W375 HydrophobicContact CB-CE3 3.91Å; W368-W375 HydrophobicContact CB-CH2 3.74Å; W368-W375 HydrophobicContact CB-CZ2 3.93Å; W368-W375 HydrophobicContact CB-CZ3 3.73Å; W368-W375 AromaticContact CD1-CD1 3.88Å; W368-W375 AromaticContact CD1-CD2 3.83Å; W368-W375 AromaticContact CD1-CE2 3.27Å; W368-W375 AromaticContact CD1-CZ2 3.54Å; W368-W375 AromaticContact CD1-NE1 3.32Å; W368-W375 VanDerWaalsContact CD1-NE1 3.32Å; W368-W375 HydrophobicContact CD2-CH2 4.45Å; W368-W375 HydrophobicContact CD2-CZ2 4.09Å; W368-W375 HydrophobicContact CG-CD2 4.19Å; W368-W375 AromaticContact CG-CE2 3.73Å; W368-W375 HydrophobicContact CG-CE3 4.44Å; W368-W375 AromaticContact CG-CH2 3.88Å; W368-W375 HydrophobicContact CG-CH2 3.88Å; W368-W375 AromaticContact CG-CZ2 3.58Å; W368-W375 HydrophobicContact CG-CZ2 3.58Å; W368-W375 HydrophobicContact CG-CZ3 4.31Å; W368-W375 AromaticContact NE1-CE2 3.88Å; W368-W375 AromaticContact NE1-CZ2 3.99Å; W368-W375 AromaticContact NE1-NE1 3.64Å
376	T	96	Very high	95.9	Very high	68 Å²	68	57.8 Å²	57.8	42%	0.417	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	164.6	176.7	57.6	0	0	0	0	111.2	E366 C367	E366-T376 WeakPolarHBondContact CA-O 3.49Å; C367-T376 WeakPolarHBondContact CB-OG1 3.22Å; C367-T376 PolarHBondContact N-O 2.85Å; C367-T376 PolarHBondContact O-N 2.68Å; C367-T376 PolarHBondContact O-OG1 2.87Å
377	H	96	Very high	95.9	Very high	143 Å²	143	57.5 Å²	57.5	66%	0.662	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	129.1	175.8	-72.6	-60	0	0	0	110.6	E366	E366-H377 IonicContact OE1-CE1 3.78Å
378	G	95.5	Very high	96	Very high	25 Å²	25	57.4 Å²	57.4	26%	0.258	29%	0.292	S	S	.	.			trans	-89.3	177.3	172.3	0	0	0	0	0	112.7	V365 S380	V365-G378 PolarHBondContact O-N 3.02Å; G378-S380 PolarHBondContact O-N 2.68Å
379	V	97	Very high	96.1	Very high	70 Å²	70	57.5 Å²	57.5	42%	0.424	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-67.6	126.4	173.2	-175.3	0	0	0	0	109.1	V365 F415 W420	V365-V379 WeakPolarHBondContact CG2-O 3.13Å; V379-F415 HydrophobicContact CB-CE2 3.84Å; V379-F415 HydrophobicContact CB-CZ 4.38Å; V379-F415 HydrophobicContact CG1-CE2 4.38Å; V379-F415 HydrophobicContact CG2-CE2 3.98Å; V379-F415 HydrophobicContact CG2-CZ 4.19Å; V379-W420 PolarHBondContact O-NE1 3.01Å
380	S	98.1	Very high	96.3	Very high	56 Å²	56	57.8 Å²	57.8	39%	0.392	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-72.5	145.7	179.7	-63.2	0	0	0	0	111.8	T363 G378 W420	T363-S380 CarbonylContact O-C 3.47Å; T363-S380 WeakPolarHBondContact O-CA 3.09Å; T363-S380 WeakPolarHBondContact O-CB 3.42Å; G378-S380 PolarHBondContact O-N 2.68Å; S380-W420 VanDerWaalsContact C-CD1 3.49Å
381	M	98.4	Very high	96.6	Very high	7 Å²	7	56.9 Å²	56.9	3%	0.034	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-62.8	158.5	172.4	-63.5	-178.2	-63.1	0	0	111.3	I353 G354 T363 R385 L388 A399 W420	I353-M381 HydrophobicContact CG2-CE 3.89Å; I353-M381 HydrophobicContact CG2-CG 4.16Å; I353-M381 HydrophobicContact CG2-SD 3.42Å; I353-M381 WeakPolarHBondContact CG2-SD 3.38Å; G354-M381 VanDerWaalsContact CA-CE 3.42Å; T363-M381 WeakPolarHBondContact CB-O 3.47Å; T363-M381 PolarHBondContact O-N 3.13Å; M381-R385 HydrophobicContact CE-CB 4.07Å; M381-R385 HydrophobicContact CE-CG 4.31Å; M381-L388 HydrophobicContact CE-CD1 4.22Å; M381-L388 HydrophobicContact SD-CD1 4.21Å; M381-A399 HydrophobicContact SD-CB 3.57Å; M381-A399 VanDerWaalsContact SD-CB 3.57Å; M381-W420 HydrophobicContact CB-CD2 4.43Å; M381-W420 HydrophobicContact CB-CG 4.46Å; M381-W420 HydrophobicContact CG-CD2 3.77Å; M381-W420 HydrophobicContact CG-CE3 4.1Å; M381-W420 HydrophobicContact CG-CG 4.27Å; M381-W420 HydrophobicContact CG-CH2 4.2Å; M381-W420 HydrophobicContact CG-CZ2 3.88Å; M381-W420 HydrophobicContact CG-CZ3 4.3Å
382	N	97.8	Very high	96.9	Very high	112 Å²	112	51.7 Å²	51.7	60%	0.599	28%	0.276	S	S	*	.	S	Bend	trans	-73	-36.5	174.6	-55	-74.2	0	0	0	111.3	E413 W420	N382-E413 WeakPolarHBondContact CA-OE2 3.28Å; N382-E413 VanDerWaalsContact CB-OE2 3.22Å; N382-E413 WeakPolarHBondContact CB-OE2 3.17Å; N382-E413 PolarHBondContact N-OE2 2.89Å; N382-E413 PolarHBondContact ND2-OE2 3.43Å; N382-W420 WeakPolarHBondContact ND2-CB 3.42Å; N382-W420 PolarHBondContact ND2-O 2.65Å
383	T	97.8	Very high	97	Very high	40 Å²	40	42.4 Å²	42.4	25%	0.245	24%	0.242	C	C	.	.	S	Bend	trans	-107.5	137.1	-179.3	-45.9	0	0	0	0	110.6	R385 D404 L409 E413	T383-R385 HydrophobicContact CG2-CG 4.44Å; T383-D404 HydrophobicContact CG2-CB 4.48Å; T383-L409 HydrophobicContact CG2-CD1 3.96Å; T383-E413 WeakPolarHBondContact CB-OE1 3.44Å; T383-E413 PolarHBondContact N-OE1 3.03Å; T383-E413 VanDerWaalsContact N-OE1 3.1Å; T383-E413 PolarHBondContact OG1-OE1 2.73Å
384	A	98.4	Very high	96.9	Very high	24 Å²	24	44.2 Å²	44.2	20%	0.198	25%	0.251	C	S	.	.			trans	-71	132.7	171	0	0	0	0	0	108.6	T361 L362 T363 D404	T361-A384 HydrophobicContact CG2-CB 3.74Å; L362-A384 WeakPolarHBondContact O-CA 3.34Å; T363-A384 HydrophobicContact CG2-CB 3.85Å; A384-D404 VanDerWaalsContact O-CA 3.25Å; A384-D404 WeakPolarHBondContact O-CA 3.25Å; A384-D404 WeakPolarHBondContact O-CB 3.41Å
385	R	98.6	Very high	96.7	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.256	C	S	.	.			trans	-142.9	129.4	-175.3	-61.5	173.1	-175.9	-87.5	-3.8	111.2	G354 G355 T361 L362 M381 T383 L388 G401 H403 L409 S411 E413	G354-R385 CarbonylContact C-O 3.57Å; G354-R385 VanDerWaalsContact C-O 3.3Å; G354-R385 VanDerWaalsContact CA-O 3.25Å; G354-R385 WeakPolarHBondContact CA-O 3.2Å; G355-R385 PolarHBondContact N-O 3.29Å; T361-R385 VanDerWaalsContact CG2-C 3.48Å; T361-R385 VanDerWaalsContact CG2-N 3.32Å; L362-R385 PolarHBondContact O-N 2.97Å; M381-R385 HydrophobicContact CE-CB 4.07Å; M381-R385 HydrophobicContact CE-CG 4.31Å; T383-R385 HydrophobicContact CG2-CG 4.44Å; R385-L388 HydrophobicContact CB-CB 4.11Å; R385-L388 HydrophobicContact CB-CD1 3.78Å; R385-L388 HydrophobicContact CB-CG 4.44Å; R385-G401 PolarHBondContact NH1-O 3.41Å; R385-H403 WeakPolarHBondContact CA-O 3.48Å; R385-L409 HydrophobicContact CG-CD1 3.85Å; R385-S411 PolarHBondContact NH1-O 3.25Å; R385-S411 PolarHBondContact NH1-OG 2.76Å; R385-S411 PolarHBondContact NH2-OG 3.31Å; R385-E413 IonicContact CZ-OE1 2.7Å; R385-E413 IonicContact NE-OE1 3.87Å; R385-E413 PolarHBondContact NE-OE1 3.44Å; R385-E413 VanDerWaalsContact NE-OE1 3.09Å; R385-E413 IonicContact NH2-OE1 3.47Å; R385-E413 PolarHBondContact NH2-OE1 2.82Å
386	H	97.8	Very high	96.7	Very high	28 Å²	28	43.7 Å²	43.7	13%	0.13	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-125.3	156	163.2	71.1	-96.1	0	0	0	110.8	Q340 R356 T361 L388 G402 H403	Q340-H386 HydrophobicContact CB-CB 4.31Å; Q340-H386 PolarHBondContact OE1-CD2 2.86Å; R356-H386 HydrophobicContact CB-CB 4.07Å; R356-H386 HydrophobicContact CG-CB 4.46Å; T361-H386 HydrophobicContact CG2-CB 4.17Å; T361-H386 PolarHBondContact OG1-ND1 3.2Å; H386-L388 PolarHBondContact O-N 3.26Å; H386-G402 CarbonylContact O-C 3.59Å; H386-G402 VanDerWaalsContact O-CA 3.28Å; H386-G402 WeakPolarHBondContact O-CA 3.27Å; H386-H403 AromaticContact CE1-CG 3.85Å; H386-H403 AromaticContact CE1-ND1 3.53Å; H386-H403 PolarHBondContact N-O 2.83Å; H386-H403 PolarHBondContact ND1-O 2.81Å; H386-H403 VanDerWaalsContact ND1-O 3.16Å; H386-H403 PolarHBondContact O-N 2.87Å
387	G	97.2	Very high	96.7	Very high	7 Å²	7	40.4 Å²	40.4	7%	0.072	23%	0.234	C	C	.	.	S	Bend	trans	61.9	27.4	-172.8	0	0	0	0	0	112.4	Q340 S431 S432	Q340-G387 PolarHBondContact O-N 2.94Å; G387-S431 CarbonylContact O-C 3.56Å; G387-S432 PolarHBondContact O-N 3.11Å
388	L	98.4	Very high	96.9	Very high	13 Å²	13	34 Å²	34	7%	0.068	20%	0.204	C	C	.	.			trans	-81.1	156.3	178.7	75.8	178	0	0	0	111.4	I353 M381 R385 H386 V390 A399	I353-L388 HydrophobicContact CG2-CD1 4.29Å; M381-L388 HydrophobicContact CE-CD1 4.22Å; M381-L388 HydrophobicContact SD-CD1 4.21Å; R385-L388 HydrophobicContact CB-CB 4.11Å; R385-L388 HydrophobicContact CB-CD1 3.78Å; R385-L388 HydrophobicContact CB-CG 4.44Å; H386-L388 PolarHBondContact O-N 3.26Å; L388-V390 HydrophobicContact CD1-CG2 3.94Å; L388-V390 HydrophobicContact CG-CG2 3.94Å; L388-A399 HydrophobicContact CD1-CB 4.18Å
389	G	98.2	Very high	97	Very high	5 Å²	5	32.9 Å²	32.9	5%	0.052	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	142.9	162.8	0	0	0	0	0	110.8	I400	G389-I400 PolarHBondContact N-O 3.42Å; G389-I400 PolarHBondContact O-N 3.34Å
390	V	98.5	Very high	97.1	Very high	22 Å²	22	29.5 Å²	29.5	13%	0.133	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.4	172.4	178.7	0	0	0	0	109.2	I343 A344 I353 L388 I397 Y398	I343-V390 WeakPolarHBondContact O-CG1 3.25Å; A344-V390 HydrophobicContact CB-CG1 3.92Å; I353-V390 HydrophobicContact CB-CG2 4.29Å; I353-V390 HydrophobicContact CD1-CG1 3.82Å; I353-V390 HydrophobicContact CG2-CG2 4.36Å; L388-V390 HydrophobicContact CD1-CG2 3.94Å; L388-V390 HydrophobicContact CG-CG2 3.94Å; V390-I397 HydrophobicContact CG1-CG2 3.76Å; V390-Y398 VanDerWaalsContact CA-O 3.27Å; V390-Y398 WeakPolarHBondContact CA-O 3.28Å
391	C	97.7	Very high	97.1	Very high	13 Å²	13	26.9 Å²	26.9	9%	0.088	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	163.4	171.8	66.1	0	0	0	0	111.4	I397 Y398 V435 V437	C391-I397 WeakPolarHBondContact O-CA 3.49Å; C391-Y398 PolarHBondContact N-O 3.46Å; C391-Y398 PolarHBondContact O-N 3.19Å; C391-V435 HydrophobicContact CB-CG1 3.71Å; C391-V437 HydrophobicContact CB-CG2 3.71Å
392	V	96.6	Very high	97.1	Very high	19 Å²	19	26.5 Å²	26.5	12%	0.115	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	133.1	171.3	-179.2	0	0	0	0	108.2	A344 L346 V396 I397	A344-V392 HydrophobicContact CB-CG2 3.67Å; L346-V392 HydrophobicContact CD2-CG1 3.79Å; L346-V392 HydrophobicContact CD2-CG2 4.37Å; V392-V396 WeakPolarHBondContact CA-O 3.44Å; V392-I397 HydrophobicContact CG2-CG1 4.35Å
393	L	95.4	Very high	97.1	Very high	7 Å²	7	23.2 Å²	23.2	4%	0.037	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	121.7	173.5	169.3	59.8	0	0	0	108.4	N395 V396 Y398 V437 G440 I442 P462	L393-N395 PolarHBondContact O-N 2.83Å; L393-V396 PolarHBondContact N-O 3.38Å; L393-V396 WeakPolarHBondContact O-CB 3.41Å; L393-V396 PolarHBondContact O-N 2.87Å; L393-V396 VanDerWaalsContact O-N 3.1Å; L393-Y398 HydrophobicContact CB-CD2 4.42Å; L393-Y398 HydrophobicContact CB-CE2 3.95Å; L393-V437 HydrophobicContact CB-CG1 4.22Å; L393-V437 HydrophobicContact CB-CG2 4.37Å; L393-V437 HydrophobicContact CD1-CG1 3.74Å; L393-V437 HydrophobicContact CG-CG1 4.39Å; L393-G440 WeakPolarHBondContact CD2-O 3.27Å; L393-I442 HydrophobicContact CB-CG1 4.45Å; L393-I442 HydrophobicContact CD2-CD1 4.04Å; L393-I442 HydrophobicContact CD2-CG1 3.58Å; L393-P462 HydrophobicContact CD2-CG 3.92Å
394	N	90.7	Very high	97	Very high	121 Å²	121	23.3 Å²	23.3	65%	0.647	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	47	-176.8	-57.6	-32.3	0	0	0	112.6	V396	N394-V396 PolarHBondContact O-N 2.85Å; N394-V396 VanDerWaalsContact O-N 3.11Å
395	N	90.8	Very high	96.8	Very high	112 Å²	112	24.1 Å²	24.1	60%	0.599	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	16.9	-175.7	-63	-16.9	0	0	0	115.4	L393	L393-N395 PolarHBondContact O-N 2.83Å
396	V	95.1	Very high	96.6	Very high	25 Å²	25	35.2 Å²	35.2	15%	0.152	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.5	175.4	176.8	0	0	0	0	108.6	V392 L393 N394 Y398 R414 F415	V392-V396 WeakPolarHBondContact CA-O 3.44Å; L393-V396 PolarHBondContact N-O 3.38Å; L393-V396 WeakPolarHBondContact O-CB 3.41Å; L393-V396 PolarHBondContact O-N 2.87Å; L393-V396 VanDerWaalsContact O-N 3.1Å; N394-V396 PolarHBondContact O-N 2.85Å; N394-V396 VanDerWaalsContact O-N 3.11Å; V396-Y398 HydrophobicContact CB-CE2 3.83Å; V396-Y398 HydrophobicContact CG1-CD2 4.24Å; V396-Y398 HydrophobicContact CG1-CE2 3.6Å; V396-Y398 WeakPolarHBondContact O-CD2 3.42Å; V396-Y398 WeakPolarHBondContact O-CE2 3.18Å; V396-R414 HydrophobicContact CG1-CB 3.94Å; V396-R414 HydrophobicContact CG1-CG 4.4Å; V396-F415 WeakPolarHBondContact CG1-O 3.16Å
397	I	97.6	Very high	96.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	137.9	176.9	-47.2	173.7	0	0	0	109.3	A344 L346 L351 I353 V390 C391 V392 R414 F415 W420	A344-I397 HydrophobicContact CB-CB 4.48Å; A344-I397 HydrophobicContact CB-CD1 3.93Å; A344-I397 HydrophobicContact CB-CG1 4.03Å; A344-I397 HydrophobicContact CB-CG2 3.69Å; L346-I397 HydrophobicContact CD1-CD1 3.61Å; L346-I397 HydrophobicContact CD1-CG1 3.73Å; L346-I397 HydrophobicContact CG-CD1 4.44Å; L346-I397 HydrophobicContact CG-CG1 4.36Å; L351-I397 HydrophobicContact CD2-CD1 3.71Å; I353-I397 HydrophobicContact CD1-CD1 4.31Å; I353-I397 HydrophobicContact CD1-CG2 3.7Å; V390-I397 HydrophobicContact CG1-CG2 3.76Å; C391-I397 WeakPolarHBondContact O-CA 3.49Å; V392-I397 HydrophobicContact CG2-CG1 4.35Å; I397-R414 CarbonylContact O-C 3.57Å; I397-R414 WeakPolarHBondContact O-CA 3.5Å; I397-F415 HydrophobicContact CB-CB 4.13Å; I397-F415 HydrophobicContact CD1-CD1 4.01Å; I397-F415 HydrophobicContact CG1-CD1 4.49Å; I397-F415 PolarHBondContact N-O 3.47Å; I397-F415 PolarHBondContact O-N 2.96Å; I397-W420 HydrophobicContact CB-CH2 4.31Å; I397-W420 HydrophobicContact CG2-CH2 3.97Å
398	Y	98.4	Very high	96.5	Very high	9 Å²	9	37.5 Å²	37.5	4%	0.035	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.6	173.4	-63.8	-102.3	0	0	0	109.6	V390 C391 L393 V396 V412 E413 R414 I423 I442 Y460	V390-Y398 VanDerWaalsContact CA-O 3.27Å; V390-Y398 WeakPolarHBondContact CA-O 3.28Å; C391-Y398 PolarHBondContact N-O 3.46Å; C391-Y398 PolarHBondContact O-N 3.19Å; L393-Y398 HydrophobicContact CB-CD2 4.42Å; L393-Y398 HydrophobicContact CB-CE2 3.95Å; V396-Y398 HydrophobicContact CB-CE2 3.83Å; V396-Y398 HydrophobicContact CG1-CD2 4.24Å; V396-Y398 HydrophobicContact CG1-CE2 3.6Å; V396-Y398 WeakPolarHBondContact O-CD2 3.42Å; V396-Y398 WeakPolarHBondContact O-CE2 3.18Å; Y398-V412 HydrophobicContact CD1-CG1 4.5Å; Y398-E413 CarbonylContact C-O 3.54Å; Y398-E413 WeakPolarHBondContact CA-O 3.36Å; Y398-R414 HydrophobicContact CD1-CB 3.79Å; Y398-R414 HydrophobicContact CE1-CB 3.78Å; Y398-R414 HydrophobicContact CG-CB 4.38Å; Y398-I423 HydrophobicContact CD1-CD1 3.81Å; Y398-I423 HydrophobicContact CE1-CD1 3.79Å; Y398-I442 HydrophobicContact CD1-CD1 3.64Å; Y398-I442 HydrophobicContact CD2-CD1 3.57Å; Y398-I442 HydrophobicContact CE1-CD1 3.88Å; Y398-I442 HydrophobicContact CE2-CD1 3.84Å; Y398-I442 HydrophobicContact CG-CD1 3.48Å; Y398-I442 VanDerWaalsContact CG-CD1 3.48Å; Y398-Y460 HydrophobicContact CE1-CE1 4.06Å
399	A	98.6	Very high	96.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	110.6	171.9	0	0	0	0	0	108.7	M381 L388 V412 E413 W420	M381-A399 HydrophobicContact SD-CB 3.57Å; M381-A399 VanDerWaalsContact SD-CB 3.57Å; L388-A399 HydrophobicContact CD1-CB 4.18Å; A399-V412 WeakPolarHBondContact O-CA 3.5Å; A399-E413 PolarHBondContact N-O 2.88Å; A399-E413 PolarHBondContact O-N 3Å; A399-W420 HydrophobicContact CB-CE3 4.4Å; A399-W420 HydrophobicContact CB-CH2 4.13Å; A399-W420 HydrophobicContact CB-CZ3 3.62Å
400	I	98.7	Very high	96.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.8	-162	-61.5	157.8	0	0	0	110.1	G389 V412 M426 V435 I442 V444 W467	G389-I400 PolarHBondContact N-O 3.42Å; G389-I400 PolarHBondContact O-N 3.34Å; I400-V412 HydrophobicContact CB-CG1 4.41Å; I400-V412 HydrophobicContact CB-CG2 4.38Å; I400-V412 HydrophobicContact CG1-CG1 3.63Å; I400-V412 HydrophobicContact CG1-CG2 4.33Å; I400-V412 HydrophobicContact CG2-CG2 3.98Å; I400-M426 HydrophobicContact CG2-CE 3.91Å; I400-M426 HydrophobicContact CG2-SD 3.53Å; I400-M426 VanDerWaalsContact CG2-SD 3.53Å; I400-V435 HydrophobicContact CD1-CG1 3.81Å; I400-V435 HydrophobicContact CD1-CG2 4.15Å; I400-I442 HydrophobicContact CD1-CG2 3.67Å; I400-V444 HydrophobicContact CD1-CG2 4.49Å; I400-V444 HydrophobicContact CG2-CG1 4.45Å; I400-V444 HydrophobicContact CG2-CG2 3.67Å; I400-W467 HydrophobicContact CG2-CH2 4.48Å
401	G	98.5	Very high	96.5	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.			trans	58.6	-136.3	176.2	0	0	0	0	0	113	R385 L409 S411	R385-G401 PolarHBondContact NH1-O 3.41Å; G401-L409 VanDerWaalsContact CA-O 3.29Å; G401-L409 WeakPolarHBondContact CA-O 3.47Å; G401-S411 PolarHBondContact N-O 3.11Å; G401-S411 VanDerWaalsContact N-O 3.09Å
402	G	98.2	Very high	96.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.			trans	92.2	-160.6	-172.8	0	0	0	0	0	112.4	H386 C408 L409 R430	H386-G402 CarbonylContact O-C 3.59Å; H386-G402 VanDerWaalsContact O-CA 3.28Å; H386-G402 WeakPolarHBondContact O-CA 3.27Å; G402-C408 CarbonylContact O-C 3.54Å; G402-C408 WeakPolarHBondContact O-CA 3.5Å; G402-L409 PolarHBondContact O-N 3.46Å; G402-R430 PolarHBondContact N-O 2.88Å
403	H	97.4	Very high	96.6	Very high	43 Å²	43	36.6 Å²	36.6	20%	0.199	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-131.4	133.2	179.4	-166.9	-74.7	0	0	0	109.3	T361 R385 H386 G405 W406 S407	T361-H403 WeakPolarHBondContact CG2-O 3.39Å; R385-H403 WeakPolarHBondContact CA-O 3.48Å; H386-H403 AromaticContact CE1-CG 3.85Å; H386-H403 AromaticContact CE1-ND1 3.53Å; H386-H403 PolarHBondContact N-O 2.83Å; H386-H403 PolarHBondContact ND1-O 2.81Å; H386-H403 VanDerWaalsContact ND1-O 3.16Å; H386-H403 PolarHBondContact O-N 2.87Å; H403-G405 WeakPolarHBondContact ND1-CA 3.4Å; H403-G405 PolarHBondContact ND1-N 3.06Å; H403-W406 PolarHBondContact CE1-N 3.12Å; H403-W406 VanDerWaalsContact CE1-N 3.34Å; H403-S407 WeakPolarHBondContact CA-O 3.44Å; H403-S407 PolarHBondContact CD2-O 2.74Å; H403-S407 PolarHBondContact CE1-N 3.29Å
404	D	96.9	Very high	96.7	Very high	41 Å²	41	39.9 Å²	39.9	22%	0.219	21%	0.209	C	C	.	.			trans	-86.8	-15.4	-176.8	60	2.7	0	0	0	114	T361 T383 A384 W406 S407 L409	T361-D404 VanDerWaalsContact CB-O 3.28Å; T361-D404 WeakPolarHBondContact CB-O 3.29Å; T361-D404 PolarHBondContact OG1-O 3.32Å; T361-D404 VanDerWaalsContact OG1-O 3.05Å; T383-D404 HydrophobicContact CG2-CB 4.48Å; A384-D404 VanDerWaalsContact O-CA 3.25Å; A384-D404 WeakPolarHBondContact O-CA 3.25Å; A384-D404 WeakPolarHBondContact O-CB 3.41Å; D404-W406 WeakPolarHBondContact OD1-CA 3.42Å; D404-W406 WeakPolarHBondContact OD1-CB 3.19Å; D404-W406 PolarHBondContact OD1-N 3.49Å; D404-S407 PolarHBondContact N-O 2.73Å; D404-S407 PolarHBondContact OD1-N 3.23Å; D404-L409 HydrophobicContact CB-CD1 4.13Å; D404-L409 HydrophobicContact CB-CD2 4.11Å; D404-L409 HydrophobicContact CB-CG 4.41Å
405	G	93.8	Very high	97	Very high	41 Å²	41	35.5 Å²	35.5	42%	0.423	18%	0.184	S	C	.	.	S	Bend	trans	120.7	-13.3	-173	0	0	0	0	0	112.2	H403	H403-G405 WeakPolarHBondContact ND1-CA 3.4Å; H403-G405 PolarHBondContact ND1-N 3.06Å
406	W	93.5	Very high	96.9	Very high	234 Å²	234	33.5 Å²	33.5	89%	0.886	17%	0.173	S	C	*	.	S	Bend	trans	-120.4	-43.5	178.8	-56.8	98	0	0	0	112.6	H403 D404	H403-W406 PolarHBondContact CE1-N 3.12Å; H403-W406 VanDerWaalsContact CE1-N 3.34Å; D404-W406 WeakPolarHBondContact OD1-CA 3.42Å; D404-W406 WeakPolarHBondContact OD1-CB 3.19Å; D404-W406 PolarHBondContact OD1-N 3.49Å
407	S	95.4	Very high	96.7	Very high	59 Å²	59	34.9 Å²	34.9	41%	0.413	19%	0.193	S	C	.	.	S	Bend	trans	-148.3	160.2	-174.7	65.2	0	0	0	0	113	H403 D404	H403-S407 WeakPolarHBondContact CA-O 3.44Å; H403-S407 PolarHBondContact CD2-O 2.74Å; H403-S407 PolarHBondContact CE1-N 3.29Å; D404-S407 PolarHBondContact N-O 2.73Å; D404-S407 PolarHBondContact OD1-N 3.23Å
408	C	97.3	Very high	96.4	Very high	24 Å²	24	45.1 Å²	45.1	16%	0.162	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-70.5	143.4	166.6	-65.9	0	0	0	0	109.7	G402 P429 S431 D449	G402-C408 CarbonylContact O-C 3.54Å; G402-C408 WeakPolarHBondContact O-CA 3.5Å; C408-P429 HydrophobicContact CB-CB 4.21Å; C408-P429 WeakPolarHBondContact O-CB 3.43Å; C408-S431 PolarHBondContact SG-OG 3.17Å; C408-D449 HydrophobicContact CB-CB 4.37Å
409	L	98.2	Very high	96.3	Very high	16 Å²	16	47.2 Å²	47.2	8%	0.084	25%	0.247	C	C	.	.			trans	-105.8	137.6	-171.7	-58.2	173.9	0	0	0	111	T383 R385 G401 G402 D404 P429 R430	T383-L409 HydrophobicContact CG2-CD1 3.96Å; R385-L409 HydrophobicContact CG-CD1 3.85Å; G401-L409 VanDerWaalsContact CA-O 3.29Å; G401-L409 WeakPolarHBondContact CA-O 3.47Å; G402-L409 PolarHBondContact O-N 3.46Å; D404-L409 HydrophobicContact CB-CD1 4.13Å; D404-L409 HydrophobicContact CB-CD2 4.11Å; D404-L409 HydrophobicContact CB-CG 4.41Å; L409-P429 WeakPolarHBondContact O-CA 3.19Å; L409-R430 PolarHBondContact O-N 3.12Å
410	A	98.2	Very high	96.3	Very high	17 Å²	17	47.8 Å²	47.8	14%	0.14	25%	0.249	C	C	.	.			trans	-91	-15.9	162.7	0	0	0	0	0	112	D425 M426 P429	A410-D425 HydrophobicContact CB-CB 4.27Å; A410-M426 HydrophobicContact CB-CB 4.38Å; A410-M426 WeakPolarHBondContact CB-O 3.39Å; A410-M426 PolarHBondContact O-N 3.38Å; A410-P429 HydrophobicContact CB-CB 4.24Å; A410-P429 HydrophobicContact CB-CG 4.07Å
411	S	98.5	Very high	96.3	Very high	18 Å²	18	50.7 Å²	50.7	13%	0.126	26%	0.264	C	S	.	.			trans	-68.7	147.5	-173.1	63.5	0	0	0	0	112.7	R385 G401 D425	R385-S411 PolarHBondContact NH1-O 3.25Å; R385-S411 PolarHBondContact NH1-OG 2.76Å; R385-S411 PolarHBondContact NH2-OG 3.31Å; G401-S411 PolarHBondContact N-O 3.11Å; G401-S411 VanDerWaalsContact N-O 3.09Å; S411-D425 VanDerWaalsContact CA-OD1 3.3Å; S411-D425 WeakPolarHBondContact CA-OD1 3.37Å
412	V	98.7	Very high	96.2	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	133.1	179.7	-176.5	0	0	0	0	109.5	Y398 A399 I400 L422 I423 M426 W467	Y398-V412 HydrophobicContact CD1-CG1 4.5Å; A399-V412 WeakPolarHBondContact O-CA 3.5Å; I400-V412 HydrophobicContact CB-CG1 4.41Å; I400-V412 HydrophobicContact CB-CG2 4.38Å; I400-V412 HydrophobicContact CG1-CG1 3.63Å; I400-V412 HydrophobicContact CG1-CG2 4.33Å; I400-V412 HydrophobicContact CG2-CG2 3.98Å; V412-L422 WeakPolarHBondContact O-CD1 3.48Å; V412-I423 HydrophobicContact CB-CD1 4.21Å; V412-I423 HydrophobicContact CB-CG1 3.78Å; V412-I423 HydrophobicContact CG1-CD1 3.7Å; V412-I423 HydrophobicContact CG1-CG1 3.77Å; V412-I423 WeakPolarHBondContact O-CG1 3.29Å; V412-I423 PolarHBondContact O-N 3.35Å; V412-M426 HydrophobicContact CG2-CG 4.07Å; V412-W467 HydrophobicContact CG2-CZ2 3.85Å
413	E	98.4	Very high	96.2	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	139.4	174.7	-67.7	174.7	-115.3	0	0	109.5	N382 T383 R385 Y398 A399 W420 I421 L422	N382-E413 WeakPolarHBondContact CA-OE2 3.28Å; N382-E413 VanDerWaalsContact CB-OE2 3.22Å; N382-E413 WeakPolarHBondContact CB-OE2 3.17Å; N382-E413 PolarHBondContact N-OE2 2.89Å; N382-E413 PolarHBondContact ND2-OE2 3.43Å; T383-E413 WeakPolarHBondContact CB-OE1 3.44Å; T383-E413 PolarHBondContact N-OE1 3.03Å; T383-E413 VanDerWaalsContact N-OE1 3.1Å; T383-E413 PolarHBondContact OG1-OE1 2.73Å; R385-E413 IonicContact CZ-OE1 2.7Å; R385-E413 IonicContact NE-OE1 3.87Å; R385-E413 PolarHBondContact NE-OE1 3.44Å; R385-E413 VanDerWaalsContact NE-OE1 3.09Å; R385-E413 IonicContact NH2-OE1 3.47Å; R385-E413 PolarHBondContact NH2-OE1 2.82Å; Y398-E413 CarbonylContact C-O 3.54Å; Y398-E413 WeakPolarHBondContact CA-O 3.36Å; A399-E413 PolarHBondContact N-O 2.88Å; A399-E413 PolarHBondContact O-N 3Å; E413-W420 HydrophobicContact CB-CE3 3.85Å; E413-I421 CarbonylContact C-O 3.56Å; E413-I421 WeakPolarHBondContact CA-O 3.37Å; E413-L422 HydrophobicContact CG-CD1 4.19Å
414	R	97.5	Very high	96.2	Very high	77 Å²	77	57.3 Å²	57.3	29%	0.291	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	140.8	171.3	74.6	175.9	-177.7	137	5.1	111.1	V396 I397 Y398 W420 I421 I423	V396-R414 HydrophobicContact CG1-CB 3.94Å; V396-R414 HydrophobicContact CG1-CG 4.4Å; I397-R414 CarbonylContact O-C 3.57Å; I397-R414 WeakPolarHBondContact O-CA 3.5Å; Y398-R414 HydrophobicContact CD1-CB 3.79Å; Y398-R414 HydrophobicContact CE1-CB 3.78Å; Y398-R414 HydrophobicContact CG-CB 4.38Å; R414-W420 CarbonylContact O-C 3.58Å; R414-W420 WeakPolarHBondContact O-CA 3.24Å; R414-I421 HydrophobicContact CG-CB 4.37Å; R414-I421 PolarHBondContact N-O 3.47Å; R414-I421 PolarHBondContact O-N 2.81Å; R414-I423 HydrophobicContact CB-CG2 4.42Å; R414-I423 HydrophobicContact CG-CG2 3.78Å
415	F	97.2	Very high	96.3	Very high	29 Å²	29	59.6 Å²	59.6	13%	0.127	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	117.8	174.2	-177.1	-114.2	0	0	0	110.2	V379 V396 I397 G417 S419 W420	V379-F415 HydrophobicContact CB-CE2 3.84Å; V379-F415 HydrophobicContact CB-CZ 4.38Å; V379-F415 HydrophobicContact CG1-CE2 4.38Å; V379-F415 HydrophobicContact CG2-CE2 3.98Å; V379-F415 HydrophobicContact CG2-CZ 4.19Å; V396-F415 WeakPolarHBondContact CG1-O 3.16Å; I397-F415 HydrophobicContact CB-CB 4.13Å; I397-F415 HydrophobicContact CD1-CD1 4.01Å; I397-F415 HydrophobicContact CG1-CD1 4.49Å; I397-F415 PolarHBondContact N-O 3.47Å; I397-F415 PolarHBondContact O-N 2.96Å; F415-G417 VanDerWaalsContact C-N 3.33Å; F415-G417 VanDerWaalsContact CE1-CA 3.4Å; F415-S419 WeakPolarHBondContact CD2-O 3.3Å; F415-W420 HydrophobicContact CB-CD2 3.81Å; F415-W420 HydrophobicContact CB-CE3 3.79Å; F415-W420 HydrophobicContact CB-CH2 3.87Å; F415-W420 HydrophobicContact CB-CZ2 3.88Å; F415-W420 HydrophobicContact CB-CZ3 3.83Å; F415-W420 AromaticContact CD2-CD1 3.92Å; F415-W420 HydrophobicContact CD2-CD2 4.2Å; F415-W420 AromaticContact CD2-CE2 3.99Å; F415-W420 HydrophobicContact CD2-CG 4.18Å; F415-W420 AromaticContact CD2-NE1 3.81Å; F415-W420 HydrophobicContact CG-CD2 4.39Å; F415-W420 HydrophobicContact CG-CZ2 4.3Å
416	D	89.4	Confident	96.5	Very high	69 Å²	69	58 Å²	58	37%	0.369	30%	0.298	S	S	.	.			trans	-91.9	12.9	-176.9	70.3	-6.2	0	0	0	114.1	R418 S419	D416-R418 WeakPolarHBondContact OD1-CA 3.28Å; D416-R418 PolarHBondContact OD1-N 2.95Å; D416-S419 PolarHBondContact N-O 2.86Å; D416-S419 PolarHBondContact OD1-N 2.76Å
417	G	90	Very high	96.7	Very high	55 Å²	55	52.9 Å²	52.9	57%	0.567	28%	0.282	S	S	*	.	S	Bend	trans	91.6	-10.7	-172.3	0	0	0	0	0	114.1	F415	F415-G417 VanDerWaalsContact C-N 3.33Å; F415-G417 VanDerWaalsContact CE1-CA 3.4Å
418	R	92.8	Very high	96.7	Very high	215 Å²	215	51.6 Å²	51.6	81%	0.811	27%	0.272	S	S	*	.	S	Bend	trans	-125.8	-43.2	178.5	-63.6	-178.9	179.9	176.9	0.9	113.1	D416	D416-R418 WeakPolarHBondContact OD1-CA 3.28Å; D416-R418 PolarHBondContact OD1-N 2.95Å
419	S	96.1	Very high	96.8	Very high	52 Å²	52	52.9 Å²	52.9	36%	0.364	28%	0.28	S	S	.	.			trans	-148.4	156.1	-174.9	61.7	0	0	0	0	112.1	F415 D416	F415-S419 WeakPolarHBondContact CD2-O 3.3Å; D416-S419 PolarHBondContact N-O 2.86Å; D416-S419 PolarHBondContact OD1-N 2.76Å
420	W	98.2	Very high	96.7	Very high	13 Å²	13	52.1 Å²	52.1	5%	0.049	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	126.1	170.6	-69.1	92.2	0	0	0	109.5	I353 V365 V379 S380 M381 N382 I397 A399 E413 R414 F415	I353-W420 HydrophobicContact CD1-CH2 4.2Å; I353-W420 HydrophobicContact CD1-CZ2 4.48Å; I353-W420 HydrophobicContact CG2-CH2 4.03Å; I353-W420 HydrophobicContact CG2-CZ2 4.21Å; V365-W420 HydrophobicContact CG2-CZ2 4Å; V379-W420 PolarHBondContact O-NE1 3.01Å; S380-W420 VanDerWaalsContact C-CD1 3.49Å; M381-W420 HydrophobicContact CB-CD2 4.43Å; M381-W420 HydrophobicContact CB-CG 4.46Å; M381-W420 HydrophobicContact CG-CD2 3.77Å; M381-W420 HydrophobicContact CG-CE3 4.1Å; M381-W420 HydrophobicContact CG-CG 4.27Å; M381-W420 HydrophobicContact CG-CH2 4.2Å; M381-W420 HydrophobicContact CG-CZ2 3.88Å; M381-W420 HydrophobicContact CG-CZ3 4.3Å; N382-W420 WeakPolarHBondContact ND2-CB 3.42Å; N382-W420 PolarHBondContact ND2-O 2.65Å; I397-W420 HydrophobicContact CB-CH2 4.31Å; I397-W420 HydrophobicContact CG2-CH2 3.97Å; A399-W420 HydrophobicContact CB-CE3 4.4Å; A399-W420 HydrophobicContact CB-CH2 4.13Å; A399-W420 HydrophobicContact CB-CZ3 3.62Å; E413-W420 HydrophobicContact CB-CE3 3.85Å; R414-W420 CarbonylContact O-C 3.58Å; R414-W420 WeakPolarHBondContact O-CA 3.24Å; F415-W420 HydrophobicContact CB-CD2 3.81Å; F415-W420 HydrophobicContact CB-CE3 3.79Å; F415-W420 HydrophobicContact CB-CH2 3.87Å; F415-W420 HydrophobicContact CB-CZ2 3.88Å; F415-W420 HydrophobicContact CB-CZ3 3.83Å; F415-W420 AromaticContact CD2-CD1 3.92Å; F415-W420 HydrophobicContact CD2-CD2 4.2Å; F415-W420 AromaticContact CD2-CE2 3.99Å; F415-W420 HydrophobicContact CD2-CG 4.18Å; F415-W420 AromaticContact CD2-NE1 3.81Å; F415-W420 HydrophobicContact CG-CD2 4.39Å; F415-W420 HydrophobicContact CG-CZ2 4.3Å
421	I	97.9	Very high	96.7	Very high	61 Å²	61	51.9 Å²	51.9	31%	0.313	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.9	-177.6	-57.4	170.5	0	0	0	108.4	E413 R414	E413-I421 CarbonylContact C-O 3.56Å; E413-I421 WeakPolarHBondContact CA-O 3.37Å; R414-I421 HydrophobicContact CG-CB 4.37Å; R414-I421 PolarHBondContact N-O 3.47Å; R414-I421 PolarHBondContact O-N 2.81Å
422	L	97.7	Very high	96.6	Very high	105 Å²	105	52.3 Å²	52.3	55%	0.55	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	131.9	172.4	-171.5	73.7	0	0	0	110	V412 E413	V412-L422 WeakPolarHBondContact O-CD1 3.48Å; E413-L422 HydrophobicContact CG-CD1 4.19Å
423	I	97.5	Very high	96.5	Very high	25 Å²	25	52.9 Å²	52.9	13%	0.128	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	-177.2	175.5	65.3	171.4	0	0	0	110.5	Y398 V412 R414 D425 Y460	Y398-I423 HydrophobicContact CD1-CD1 3.81Å; Y398-I423 HydrophobicContact CE1-CD1 3.79Å; V412-I423 HydrophobicContact CB-CD1 4.21Å; V412-I423 HydrophobicContact CB-CG1 3.78Å; V412-I423 HydrophobicContact CG1-CD1 3.7Å; V412-I423 HydrophobicContact CG1-CG1 3.77Å; V412-I423 WeakPolarHBondContact O-CG1 3.29Å; V412-I423 PolarHBondContact O-N 3.35Å; R414-I423 HydrophobicContact CB-CG2 4.42Å; R414-I423 HydrophobicContact CG-CG2 3.78Å; I423-D425 PolarHBondContact O-N 3.28Å; I423-Y460 HydrophobicContact CD1-CE1 4.15Å; I423-Y460 HydrophobicContact CD1-CE2 4.26Å
424	S	97.2	Very high	96.5	Very high	51 Å²	51	53.2 Å²	53.2	36%	0.357	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-47.8	127.7	178.6	-55.7	0	0	0	0	112.1	H465 W467	S424-H465 PolarHBondContact OG-O 2.86Å; S424-W467 PolarHBondContact O-NE1 2.93Å
425	D	98.3	Very high	96.5	Very high	89 Å²	89	50.7 Å²	50.7	48%	0.476	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-66.4	148.1	175	-68.8	-10.1	0	0	0	111.1	A410 S411 I423	A410-D425 HydrophobicContact CB-CB 4.27Å; S411-D425 VanDerWaalsContact CA-OD1 3.3Å; S411-D425 WeakPolarHBondContact CA-OD1 3.37Å; I423-D425 PolarHBondContact O-N 3.28Å
426	M	98.3	Very high	96.5	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.039	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-62	160.5	164.7	-65.3	-178.2	-62.7	0	0	110.7	I400 A410 V412 V444 E458 W467	I400-M426 HydrophobicContact CG2-CE 3.91Å; I400-M426 HydrophobicContact CG2-SD 3.53Å; I400-M426 VanDerWaalsContact CG2-SD 3.53Å; A410-M426 HydrophobicContact CB-CB 4.38Å; A410-M426 WeakPolarHBondContact CB-O 3.39Å; A410-M426 PolarHBondContact O-N 3.38Å; V412-M426 HydrophobicContact CG2-CG 4.07Å; M426-V444 HydrophobicContact SD-CB 4.14Å; M426-V444 HydrophobicContact SD-CG1 3.84Å; M426-V444 HydrophobicContact SD-CG2 3.91Å; M426-E458 WeakPolarHBondContact CB-OE2 3.4Å; M426-W467 HydrophobicContact CG-CD2 4.04Å; M426-W467 HydrophobicContact CG-CE3 4.23Å; M426-W467 HydrophobicContact CG-CH2 3.89Å; M426-W467 HydrophobicContact CG-CZ2 3.69Å; M426-W467 HydrophobicContact CG-CZ3 4.14Å; M426-W467 HydrophobicContact SD-CH2 4.28Å
427	F	97.8	Very high	96.9	Very high	126 Å²	126	48.5 Å²	48.5	55%	0.553	27%	0.269	S	S	*	.	S	Bend	trans	-70.6	-35.3	173.3	-63	-69.2	0	0	0	112.4	E458 W467 M469	F427-E458 WeakPolarHBondContact CB-OE2 3.31Å; F427-E458 HydrophobicContact CD2-CG 4.47Å; F427-E458 WeakPolarHBondContact CD2-OE2 3.31Å; F427-E458 PolarHBondContact N-OE2 3.11Å; F427-W467 HydrophobicContact CD2-CB 4.07Å; F427-W467 HydrophobicContact CE2-CB 3.62Å; F427-W467 VanDerWaalsContact CE2-O 3.3Å; F427-W467 WeakPolarHBondContact CE2-O 3.25Å; F427-W467 HydrophobicContact CZ-CB 4.23Å; F427-W467 WeakPolarHBondContact CZ-O 3.27Å; F427-M469 HydrophobicContact CB-SD 4.37Å; F427-M469 HydrophobicContact CD2-CG 4.21Å; F427-M469 HydrophobicContact CD2-SD 3.79Å; F427-M469 HydrophobicContact CE2-CG 4.43Å; F427-M469 HydrophobicContact CG-SD 4.39Å
428	V	96.6	Very high	97.2	Very high	33 Å²	33	46.5 Å²	46.5	20%	0.2	25%	0.245	C	C	.	.	S	Bend	trans	-118	126.1	-176.4	-176.1	0	0	0	0	109.9	R430 H454 E458	V428-R430 HydrophobicContact CB-CG 4.39Å; V428-R430 HydrophobicContact CG1-CG 4.1Å; V428-R430 WeakPolarHBondContact O-CG 3.14Å; V428-R430 PolarHBondContact O-N 3.12Å; V428-H454 VanDerWaalsContact CG1-CE1 3.49Å; V428-H454 WeakPolarHBondContact CG1-CE1 3.5Å; V428-E458 WeakPolarHBondContact CB-OE1 3.32Å; V428-E458 PolarHBondContact N-OE1 3.44Å
429	P	97.7	Very high	97.2	Very high	51 Å²	51	42 Å²	42	33%	0.331	24%	0.237	S	C	.	.			trans	-65.8	129.8	170.7	-16.6	28.8	0	0	0	111.2	C408 L409 A410 D449	C408-P429 HydrophobicContact CB-CB 4.21Å; C408-P429 WeakPolarHBondContact O-CB 3.43Å; L409-P429 WeakPolarHBondContact O-CA 3.19Å; A410-P429 HydrophobicContact CB-CB 4.24Å; A410-P429 HydrophobicContact CB-CG 4.07Å; P429-D449 WeakPolarHBondContact O-CB 3.47Å
430	R	97.5	Very high	97.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.238	C	C	.	.			trans	-142.9	142.1	-172.8	-61.5	161.2	-168.9	-100.1	3.4	111.7	G402 L409 V428 C433 G446 S456 E458	G402-R430 PolarHBondContact N-O 2.88Å; L409-R430 PolarHBondContact O-N 3.12Å; V428-R430 HydrophobicContact CB-CG 4.39Å; V428-R430 HydrophobicContact CG1-CG 4.1Å; V428-R430 WeakPolarHBondContact O-CG 3.14Å; V428-R430 PolarHBondContact O-N 3.12Å; R430-C433 HydrophobicContact CB-CB 4.39Å; R430-G446 WeakPolarHBondContact CD-O 3.28Å; R430-G446 PolarHBondContact NH1-O 2.85Å; R430-S456 PolarHBondContact NH1-O 2.57Å; R430-S456 PolarHBondContact NH1-OG 3Å; R430-S456 PolarHBondContact NH2-OG 2.7Å; R430-E458 IonicContact CZ-OE1 3.3Å; R430-E458 VanDerWaalsContact CZ-OE1 3.3Å; R430-E458 IonicContact NE-OE1 3Å; R430-E458 PolarHBondContact NE-OE1 2.79Å; R430-E458 IonicContact NH2-OE1 2.75Å; R430-E458 PolarHBondContact NH2-OE1 2.94Å
431	S	97.2	Very high	97.2	Very high	12 Å²	12	44.1 Å²	44.1	8%	0.084	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-122.2	159.5	162.6	65	0	0	0	0	110.3	G387 C408 C433 G447 R448	G387-S431 CarbonylContact O-C 3.56Å; C408-S431 PolarHBondContact SG-OG 3.17Å; S431-C433 PolarHBondContact O-N 2.99Å; S431-C433 VanDerWaalsContact O-N 3.13Å; S431-G447 CarbonylContact O-C 3.51Å; S431-G447 VanDerWaalsContact O-CA 3.29Å; S431-G447 WeakPolarHBondContact O-CA 3.48Å; S431-R448 PolarHBondContact N-O 3.5Å; S431-R448 PolarHBondContact O-N 3.05Å; S431-R448 PolarHBondContact OG-O 3.16Å
432	S	96	Very high	97.2	Very high	26 Å²	26	41.2 Å²	41.2	18%	0.182	24%	0.236	C	C	.	.	S	Bend	trans	51.9	35.2	-178.9	-57	0	0	0	0	113.2	G387 G447 S479	G387-S432 PolarHBondContact O-N 3.11Å; S432-G447 WeakPolarHBondContact O-CA 3.44Å; S432-S479 WeakPolarHBondContact O-CA 3.29Å; S432-S479 PolarHBondContact O-N 3.21Å
433	C	97.3	Very high	97.2	Very high	13 Å²	13	36.9 Å²	36.9	9%	0.088	21%	0.212	C	C	.	.			trans	-80.5	158.3	170.4	55.7	0	0	0	0	110.6	R430 S431 V444	R430-C433 HydrophobicContact CB-CB 4.39Å; S431-C433 PolarHBondContact O-N 2.99Å; S431-C433 VanDerWaalsContact O-N 3.13Å; C433-V444 HydrophobicContact CB-CG1 3.88Å
434	G	97.8	Very high	97.3	Very high	7 Å²	7	35.7 Å²	35.7	7%	0.072	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	151.2	165.1	0	0	0	0	0	110.5	V445	G434-V445 PolarHBondContact N-O 2.93Å; G434-V445 PolarHBondContact O-N 3.06Å
435	V	98.3	Very high	97.4	Very high	25 Å²	25	33.2 Å²	33.2	15%	0.152	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.6	176.7	179.9	0	0	0	0	109.2	C391 I400 I442 Y443 V444	C391-V435 HydrophobicContact CB-CG1 3.71Å; I400-V435 HydrophobicContact CD1-CG1 3.81Å; I400-V435 HydrophobicContact CD1-CG2 4.15Å; V435-I442 HydrophobicContact CG1-CG2 3.71Å; V435-Y443 CarbonylContact C-O 3.52Å; V435-Y443 VanDerWaalsContact CA-O 3.28Å; V435-Y443 WeakPolarHBondContact CA-O 3.25Å; V435-V444 HydrophobicContact CG2-CG2 4.36Å
436	A	98.1	Very high	97.3	Very high	5 Å²	5	29 Å²	29	4%	0.041	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	149.5	175.5	0	0	0	0	0	110.3	Y443 V482 V484 I489	A436-Y443 PolarHBondContact N-O 3.1Å; A436-Y443 PolarHBondContact O-N 3.37Å; A436-V482 HydrophobicContact CB-CG1 3.83Å; A436-V484 HydrophobicContact CB-CG2 3.57Å; A436-I489 HydrophobicContact CB-CD1 4.18Å; A436-I489 HydrophobicContact CB-CG1 4.16Å; A436-I489 HydrophobicContact CB-CG2 3.94Å
437	V	97.7	Very high	97.2	Very high	47 Å²	47	28.6 Å²	28.6	29%	0.285	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.5	169.6	176.6	0	0	0	0	107.8	C391 L393 K441 I442	C391-V437 HydrophobicContact CB-CG2 3.71Å; L393-V437 HydrophobicContact CB-CG1 4.22Å; L393-V437 HydrophobicContact CB-CG2 4.37Å; L393-V437 HydrophobicContact CD1-CG1 3.74Å; L393-V437 HydrophobicContact CG-CG1 4.39Å; V437-K441 WeakPolarHBondContact CA-O 3.5Å; V437-I442 HydrophobicContact CG2-CG1 4.35Å
438	L	95.9	Very high	97.1	Very high	13 Å²	13	27 Å²	27	7%	0.068	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	136.9	-178.7	177.2	60.6	0	0	0	109.2	G440 K441 Y443 V484 G487 I489 P515	L438-G440 PolarHBondContact O-N 2.77Å; L438-G440 VanDerWaalsContact O-N 3.16Å; L438-K441 PolarHBondContact N-O 2.91Å; L438-K441 PolarHBondContact O-N 2.78Å; L438-Y443 HydrophobicContact CB-CD2 4.31Å; L438-Y443 HydrophobicContact CB-CE2 4.05Å; L438-V484 HydrophobicContact CB-CG1 4.42Å; L438-V484 HydrophobicContact CD1-CG1 3.87Å; L438-G487 WeakPolarHBondContact CD2-O 3.43Å; L438-I489 HydrophobicContact CB-CD1 4.45Å; L438-I489 HydrophobicContact CB-CG1 4.36Å; L438-I489 HydrophobicContact CD2-CD1 4.12Å; L438-I489 HydrophobicContact CD2-CG1 3.64Å; L438-P515 HydrophobicContact CD2-CG 3.44Å; L438-P515 VanDerWaalsContact CD2-CG 3.44Å; L438-P515 HydrophobicContact CG-CG 4.39Å
439	D	92.8	Very high	96.9	Very high	120 Å²	120	27.1 Å²	27.1	64%	0.642	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	41.4	179.4	-56.3	-24.9	0	0	0	113.6	K441	D439-K441 VanDerWaalsContact C-N 3.27Å; D439-K441 PolarHBondContact O-N 3.29Å
440	G	94.9	Very high	96.3	Very high	37 Å²	37	28.8 Å²	28.8	38%	0.381	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	15.1	179.5	0	0	0	0	0	115.1	L393 L438 P462	L393-G440 WeakPolarHBondContact CD2-O 3.27Å; L438-G440 PolarHBondContact O-N 2.77Å; L438-G440 VanDerWaalsContact O-N 3.16Å; G440-P462 VanDerWaalsContact O-CD 3.27Å; G440-P462 WeakPolarHBondContact O-CD 3.42Å; G440-P462 VanDerWaalsContact O-CG 3.31Å; G440-P462 WeakPolarHBondContact O-CG 3.25Å
441	K	97.8	Very high	95.7	Very high	72 Å²	72	32.5 Å²	32.5	31%	0.313	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	157.9	-179.4	-62.1	-179.9	-173.4	176.7	0	111.4	V437 L438 D439 Y443 Y460 D461	V437-K441 WeakPolarHBondContact CA-O 3.5Å; L438-K441 PolarHBondContact N-O 2.91Å; L438-K441 PolarHBondContact O-N 2.78Å; D439-K441 VanDerWaalsContact C-N 3.27Å; D439-K441 PolarHBondContact O-N 3.29Å; K441-Y443 HydrophobicContact CB-CE2 3.91Å; K441-Y460 WeakPolarHBondContact CA-O 3.28Å; K441-Y460 WeakPolarHBondContact CB-O 3.19Å; K441-D461 HydrophobicContact CD-CB 4.42Å; K441-D461 VanDerWaalsContact CE-OD2 3.29Å; K441-D461 WeakPolarHBondContact CE-OD2 3.42Å; K441-D461 HydrophobicContact CG-CB 4.47Å; K441-D461 IonicContact NZ-OD2 3.71Å
442	I	98.6	Very high	95.4	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.5	179.2	-53.4	174.7	0	0	0	109	L393 Y398 I400 V435 V437 C459 Y460	L393-I442 HydrophobicContact CB-CG1 4.45Å; L393-I442 HydrophobicContact CD2-CD1 4.04Å; L393-I442 HydrophobicContact CD2-CG1 3.58Å; Y398-I442 HydrophobicContact CD1-CD1 3.64Å; Y398-I442 HydrophobicContact CD2-CD1 3.57Å; Y398-I442 HydrophobicContact CE1-CD1 3.88Å; Y398-I442 HydrophobicContact CE2-CD1 3.84Å; Y398-I442 HydrophobicContact CG-CD1 3.48Å; Y398-I442 VanDerWaalsContact CG-CD1 3.48Å; I400-I442 HydrophobicContact CD1-CG2 3.67Å; V435-I442 HydrophobicContact CG1-CG2 3.71Å; V437-I442 HydrophobicContact CG2-CG1 4.35Å; I442-C459 CarbonylContact O-C 3.3Å; I442-C459 VanDerWaalsContact O-CA 3.3Å; I442-C459 WeakPolarHBondContact O-CA 3.4Å; I442-Y460 HydrophobicContact CD1-CD1 4.05Å; I442-Y460 HydrophobicContact CG1-CD1 4.46Å; I442-Y460 PolarHBondContact N-O 2.97Å; I442-Y460 PolarHBondContact O-N 2.98Å
443	Y	98.7	Very high	95.3	Very high	13 Å²	13	31.7 Å²	31.7	5%	0.051	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.4	177.1	-66.7	-100.1	0	0	0	110.1	V435 A436 L438 K441 V457 E458 C459 I489 Y513	V435-Y443 CarbonylContact C-O 3.52Å; V435-Y443 VanDerWaalsContact CA-O 3.28Å; V435-Y443 WeakPolarHBondContact CA-O 3.25Å; A436-Y443 PolarHBondContact N-O 3.1Å; A436-Y443 PolarHBondContact O-N 3.37Å; L438-Y443 HydrophobicContact CB-CD2 4.31Å; L438-Y443 HydrophobicContact CB-CE2 4.05Å; K441-Y443 HydrophobicContact CB-CE2 3.91Å; Y443-V457 HydrophobicContact CD1-CG1 4.47Å; Y443-E458 CarbonylContact C-O 3.6Å; Y443-E458 WeakPolarHBondContact CA-O 3.46Å; Y443-C459 HydrophobicContact CD1-CB 3.91Å; Y443-C459 HydrophobicContact CE1-CB 3.79Å; Y443-I489 HydrophobicContact CD1-CD1 3.63Å; Y443-I489 HydrophobicContact CD2-CD1 3.48Å; Y443-I489 VanDerWaalsContact CD2-CD1 3.48Å; Y443-I489 HydrophobicContact CE1-CD1 4.14Å; Y443-I489 HydrophobicContact CE2-CD1 4.01Å; Y443-I489 HydrophobicContact CG-CD1 3.26Å; Y443-Y513 HydrophobicContact CD1-CE1 4.37Å; Y443-Y513 AromaticContact CE1-CE1 3.83Å; Y443-Y513 HydrophobicContact CE1-CE1 3.83Å
444	V	98.7	Very high	95.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	117	176	-175.6	0	0	0	0	108.3	I400 M426 C433 V435 V457 E458 W467	I400-V444 HydrophobicContact CD1-CG2 4.49Å; I400-V444 HydrophobicContact CG2-CG1 4.45Å; I400-V444 HydrophobicContact CG2-CG2 3.67Å; M426-V444 HydrophobicContact SD-CB 4.14Å; M426-V444 HydrophobicContact SD-CG1 3.84Å; M426-V444 HydrophobicContact SD-CG2 3.91Å; C433-V444 HydrophobicContact CB-CG1 3.88Å; V435-V444 HydrophobicContact CG2-CG2 4.36Å; V444-V457 VanDerWaalsContact O-CA 3.32Å; V444-V457 WeakPolarHBondContact O-CA 3.45Å; V444-E458 PolarHBondContact N-O 3.33Å; V444-E458 PolarHBondContact O-N 2.83Å; V444-W467 HydrophobicContact CB-CZ3 4.33Å; V444-W467 HydrophobicContact CG2-CH2 3.52Å; V444-W467 HydrophobicContact CG2-CZ3 3.55Å
445	V	98.6	Very high	95.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	123	-166	179.3	0	0	0	0	109.5	G434 G447 V457 M473 V480 V482 I489 A491 W520	G434-V445 PolarHBondContact N-O 2.93Å; G434-V445 PolarHBondContact O-N 3.06Å; V445-G447 PolarHBondContact O-N 3.42Å; V445-V457 HydrophobicContact CG1-CG2 4.27Å; V445-V457 HydrophobicContact CG2-CG1 4.01Å; V445-M473 HydrophobicContact CG1-CE 3.87Å; V445-M473 HydrophobicContact CG1-CG 4.42Å; V445-M473 HydrophobicContact CG1-SD 3.41Å; V445-M473 WeakPolarHBondContact CG1-SD 3.44Å; V445-V480 WeakPolarHBondContact O-CG1 3.5Å; V445-V482 HydrophobicContact CB-CG2 3.93Å; V445-V482 HydrophobicContact CG1-CG2 4Å; V445-V482 HydrophobicContact CG2-CG1 4.23Å; V445-V482 HydrophobicContact CG2-CG2 4.44Å; V445-I489 HydrophobicContact CG2-CG2 4.31Å; V445-A491 HydrophobicContact CG1-CB 4.19Å; V445-W520 HydrophobicContact CG1-CH2 4.16Å; V445-W520 HydrophobicContact CG1-CZ2 4.32Å
446	G	97.7	Very high	95.2	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.213	C	C	.	.			trans	61.5	-132.3	173.8	0	0	0	0	0	113.3	R430 H454 S456	R430-G446 WeakPolarHBondContact CD-O 3.28Å; R430-G446 PolarHBondContact NH1-O 2.85Å; G446-H454 WeakPolarHBondContact CA-O 3.22Å; G446-S456 PolarHBondContact N-O 3.18Å
447	G	96.6	Very high	95.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.211	C	C	.	.			trans	89.7	-165.8	-172.5	0	0	0	0	0	112.3	S431 S432 V445 C453 H454 R477	S431-G447 CarbonylContact O-C 3.51Å; S431-G447 VanDerWaalsContact O-CA 3.29Å; S431-G447 WeakPolarHBondContact O-CA 3.48Å; S432-G447 WeakPolarHBondContact O-CA 3.44Å; V445-G447 PolarHBondContact O-N 3.42Å; G447-C453 CarbonylContact O-C 3.51Å; G447-C453 WeakPolarHBondContact O-CA 3.38Å; G447-H454 PolarHBondContact O-N 3.38Å; G447-R477 PolarHBondContact N-O 2.76Å
448	R	94.5	Very high	95.2	Very high	92 Å²	92	32.6 Å²	32.6	35%	0.347	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-146.4	156.2	-178.5	69.7	-178.5	-55.3	170.7	8.2	112.6	S431 G452	S431-R448 PolarHBondContact N-O 3.5Å; S431-R448 PolarHBondContact O-N 3.05Å; S431-R448 PolarHBondContact OG-O 3.16Å; R448-G452 WeakPolarHBondContact CA-O 3.48Å; R448-G452 WeakPolarHBondContact CB-O 3.27Å
449	D	91.7	Very high	95.4	Very high	36 Å²	36	32.2 Å²	32.2	19%	0.193	20%	0.196	C	C	.	.			trans	-124.9	-164.5	168	68.7	5.2	0	0	0	110.8	C408 P429 S451 G452 H454	C408-D449 HydrophobicContact CB-CB 4.37Å; P429-D449 WeakPolarHBondContact O-CB 3.47Å; D449-S451 VanDerWaalsContact CG-OG 3.28Å; D449-S451 PolarHBondContact O-N 3.15Å; D449-S451 VanDerWaalsContact OD1-CA 3.28Å; D449-S451 WeakPolarHBondContact OD1-CA 3.37Å; D449-S451 VanDerWaalsContact OD1-CB 3.32Å; D449-S451 WeakPolarHBondContact OD1-CB 3.31Å; D449-S451 PolarHBondContact OD1-N 2.77Å; D449-S451 PolarHBondContact OD1-OG 2.82Å; D449-S451 PolarHBondContact OD2-OG 2.82Å; D449-G452 PolarHBondContact N-O 3.28Å; D449-G452 PolarHBondContact OD1-N 2.82Å; D449-H454 VanDerWaalsContact CG-CE1 3.43Å; D449-H454 VanDerWaalsContact CG-NE2 3.29Å; D449-H454 IonicContact OD1-CE1 3.78Å; D449-H454 IonicContact OD1-NE2 3.73Å; D449-H454 IonicContact OD2-CE1 3.3Å; D449-H454 PolarHBondContact OD2-CE1 2.57Å; D449-H454 VanDerWaalsContact OD2-CE1 3.3Å; D449-H454 IonicContact OD2-NE2 3.51Å
450	G	85.2	Confident	95.6	Very high	85 Å²	85	26.6 Å²	26.6	88%	0.876	17%	0.166	S	C	*	.	S	Bend	trans	-67.5	-15	175	0	0	0	0	0	114.1
451	S	86.6	Confident	95.8	Very high	79 Å²	79	26.4 Å²	26.4	55%	0.552	16%	0.156	S	C	*	.	S	Bend	trans	-97.4	-23.3	-178.5	79.5	0	0	0	0	113.6	D449 A499	D449-S451 VanDerWaalsContact CG-OG 3.28Å; D449-S451 PolarHBondContact O-N 3.15Å; D449-S451 VanDerWaalsContact OD1-CA 3.28Å; D449-S451 WeakPolarHBondContact OD1-CA 3.37Å; D449-S451 VanDerWaalsContact OD1-CB 3.32Å; D449-S451 WeakPolarHBondContact OD1-CB 3.31Å; D449-S451 PolarHBondContact OD1-N 2.77Å; D449-S451 PolarHBondContact OD1-OG 2.82Å; D449-S451 PolarHBondContact OD2-OG 2.82Å; S451-A499 VanDerWaalsContact O-CB 3.26Å; S451-A499 WeakPolarHBondContact O-CB 3.27Å
452	G	90.7	Very high	95.6	Very high	10 Å²	10	23.9 Å²	23.9	10%	0.103	15%	0.147	C	C	.	.			trans	151.7	-164.8	176.2	0	0	0	0	0	113.8	R448 D449	R448-G452 WeakPolarHBondContact CA-O 3.48Å; R448-G452 WeakPolarHBondContact CB-O 3.27Å; D449-G452 PolarHBondContact N-O 3.28Å; D449-G452 PolarHBondContact OD1-N 2.82Å
453	C	94.3	Very high	95.4	Very high	11 Å²	11	29.4 Å²	29.4	7%	0.074	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-81.6	143.9	175.7	-61.6	0	0	0	0	111	G447 H476 T495	G447-C453 CarbonylContact O-C 3.51Å; G447-C453 WeakPolarHBondContact O-CA 3.38Å; C453-H476 HydrophobicContact CB-CB 4.01Å; C453-H476 PolarHBondContact O-ND1 2.78Å; C453-T495 PolarHBondContact SG-O 3.21Å; C453-T495 VanDerWaalsContact SG-O 3.35Å
454	H	95.3	Very high	95.3	Very high	24 Å²	24	32.3 Å²	32.3	11%	0.111	20%	0.204	C	C	.	.			trans	-97.6	147.4	177.1	-58.8	-68.3	0	0	0	111.8	V428 G446 G447 D449 R477	V428-H454 VanDerWaalsContact CG1-CE1 3.49Å; V428-H454 WeakPolarHBondContact CG1-CE1 3.5Å; G446-H454 WeakPolarHBondContact CA-O 3.22Å; G447-H454 PolarHBondContact O-N 3.38Å; D449-H454 VanDerWaalsContact CG-CE1 3.43Å; D449-H454 VanDerWaalsContact CG-NE2 3.29Å; D449-H454 IonicContact OD1-CE1 3.78Å; D449-H454 IonicContact OD1-NE2 3.73Å; D449-H454 IonicContact OD2-CE1 3.3Å; D449-H454 PolarHBondContact OD2-CE1 2.57Å; D449-H454 VanDerWaalsContact OD2-CE1 3.3Å; D449-H454 IonicContact OD2-NE2 3.51Å; H454-R477 PolarHBondContact O-N 2.98Å
455	K	96.5	Very high	95.2	Very high	76 Å²	76	37.2 Å²	37.2	33%	0.33	23%	0.227	S	C	.	.			trans	-101.4	-11.8	163.5	61.1	174.3	176.3	131.9	0	112.8	D472 M473 K475	K455-D472 HydrophobicContact CD-CB 4Å; K455-D472 WeakPolarHBondContact CE-OD2 3.1Å; K455-D472 HydrophobicContact CG-CB 4.08Å; K455-D472 IonicContact NZ-OD2 2.73Å; K455-D472 PolarHBondContact NZ-OD2 2.73Å; K455-M473 HydrophobicContact CB-CB 4.32Å; K455-M473 WeakPolarHBondContact O-CB 3.4Å; K455-M473 PolarHBondContact O-N 2.87Å; K455-K475 WeakPolarHBondContact CB-O 3.45Å
456	S	98	Very high	95.1	Very high	15 Å²	15	45.8 Å²	45.8	11%	0.105	26%	0.259	C	S	.	.			trans	-74.9	152.6	-174.9	52.1	0	0	0	0	112.2	R430 G446 D472	R430-S456 PolarHBondContact NH1-O 2.57Å; R430-S456 PolarHBondContact NH1-OG 3Å; R430-S456 PolarHBondContact NH2-OG 2.7Å; G446-S456 PolarHBondContact N-O 3.18Å; S456-D472 VanDerWaalsContact CA-OD1 3.3Å; S456-D472 WeakPolarHBondContact CA-OD1 3.43Å
457	V	98.6	Very high	95.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136.1	-176.9	-178.4	0	0	0	0	108.4	Y443 V444 V445 C470 M473 W520	Y443-V457 HydrophobicContact CD1-CG1 4.47Å; V444-V457 VanDerWaalsContact O-CA 3.32Å; V444-V457 WeakPolarHBondContact O-CA 3.45Å; V445-V457 HydrophobicContact CG1-CG2 4.27Å; V445-V457 HydrophobicContact CG2-CG1 4.01Å; V457-C470 HydrophobicContact CB-CB 4.01Å; V457-C470 HydrophobicContact CG1-CB 3.97Å; V457-C470 PolarHBondContact O-N 2.82Å; V457-M473 HydrophobicContact CG2-CG 4.14Å; V457-W520 HydrophobicContact CG2-CZ2 3.77Å
458	E	98.6	Very high	95.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.6	-179.9	-63.7	-178.9	-125.8	0	0	110.1	M426 F427 V428 R430 Y443 V444 W467 T468 M469	M426-E458 WeakPolarHBondContact CB-OE2 3.4Å; F427-E458 WeakPolarHBondContact CB-OE2 3.31Å; F427-E458 HydrophobicContact CD2-CG 4.47Å; F427-E458 WeakPolarHBondContact CD2-OE2 3.31Å; F427-E458 PolarHBondContact N-OE2 3.11Å; V428-E458 WeakPolarHBondContact CB-OE1 3.32Å; V428-E458 PolarHBondContact N-OE1 3.44Å; R430-E458 IonicContact CZ-OE1 3.3Å; R430-E458 VanDerWaalsContact CZ-OE1 3.3Å; R430-E458 IonicContact NE-OE1 3Å; R430-E458 PolarHBondContact NE-OE1 2.79Å; R430-E458 IonicContact NH2-OE1 2.75Å; R430-E458 PolarHBondContact NH2-OE1 2.94Å; Y443-E458 CarbonylContact C-O 3.6Å; Y443-E458 WeakPolarHBondContact CA-O 3.46Å; V444-E458 PolarHBondContact N-O 3.33Å; V444-E458 PolarHBondContact O-N 2.83Å; E458-W467 HydrophobicContact CB-CE3 3.72Å; E458-W467 HydrophobicContact CB-CZ3 4.07Å; E458-T468 CarbonylContact C-O 3.48Å; E458-T468 WeakPolarHBondContact CA-O 3.46Å; E458-M469 HydrophobicContact CG-CE 4.43Å; E458-M469 HydrophobicContact CG-SD 3.68Å
459	C	98.6	Very high	95.4	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.034	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	124	179.8	173.3	0	0	0	0	109.9	I442 Y443 W467 T468 C470	I442-C459 CarbonylContact O-C 3.3Å; I442-C459 VanDerWaalsContact O-CA 3.3Å; I442-C459 WeakPolarHBondContact O-CA 3.4Å; Y443-C459 HydrophobicContact CD1-CB 3.91Å; Y443-C459 HydrophobicContact CE1-CB 3.79Å; C459-W467 CarbonylContact O-C 3.47Å; C459-W467 VanDerWaalsContact O-CA 3.28Å; C459-W467 WeakPolarHBondContact O-CA 3.3Å; C459-T468 PolarHBondContact N-O 3.39Å; C459-T468 PolarHBondContact O-N 3.25Å; C459-T468 PolarHBondContact O-OG1 3.42Å; C459-C470 VanDerWaalsContact CB-SG 3.5Å
460	Y	98.6	Very high	95.7	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	125.2	172	178	-103.9	0	0	0	110.6	Y398 I423 K441 I442 P462 H465 R466 W467	Y398-Y460 HydrophobicContact CE1-CE1 4.06Å; I423-Y460 HydrophobicContact CD1-CE1 4.15Å; I423-Y460 HydrophobicContact CD1-CE2 4.26Å; K441-Y460 WeakPolarHBondContact CA-O 3.28Å; K441-Y460 WeakPolarHBondContact CB-O 3.19Å; I442-Y460 HydrophobicContact CD1-CD1 4.05Å; I442-Y460 HydrophobicContact CG1-CD1 4.46Å; I442-Y460 PolarHBondContact N-O 2.97Å; I442-Y460 PolarHBondContact O-N 2.98Å; Y460-P462 HydrophobicContact CE1-CB 3.98Å; Y460-H465 PolarHBondContact OH-ND1 3.1Å; Y460-H465 VanDerWaalsContact OH-ND1 3.15Å; Y460-R466 WeakPolarHBondContact CA-O 3.39Å; Y460-W467 HydrophobicContact CD2-CD2 4.11Å; Y460-W467 AromaticContact CD2-CE2 3.74Å; Y460-W467 HydrophobicContact CD2-CG 4.25Å; Y460-W467 HydrophobicContact CD2-CZ2 4.16Å; Y460-W467 AromaticContact CD2-NE1 3.68Å; Y460-W467 HydrophobicContact CG-CD2 4.38Å; Y460-W467 HydrophobicContact CG-CH2 4.43Å; Y460-W467 HydrophobicContact CG-CZ2 4.04Å
461	D	97.3	Very high	96.4	Very high	33 Å²	33	46.6 Å²	46.6	18%	0.176	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	111.1	173.5	-176.3	-38.6	0	0	0	109.3	K441 C463 T464 H465 R466	K441-D461 HydrophobicContact CD-CB 4.42Å; K441-D461 VanDerWaalsContact CE-OD2 3.29Å; K441-D461 WeakPolarHBondContact CE-OD2 3.42Å; K441-D461 HydrophobicContact CG-CB 4.47Å; K441-D461 IonicContact NZ-OD2 3.71Å; D461-C463 PolarHBondContact O-N 3.09Å; D461-C463 WeakPolarHBondContact OD1-CA 3.37Å; D461-C463 WeakPolarHBondContact OD1-CB 3.37Å; D461-C463 PolarHBondContact OD1-N 3.16Å; D461-T464 WeakPolarHBondContact CB-OG1 3.43Å; D461-T464 PolarHBondContact O-N 3.24Å; D461-T464 PolarHBondContact O-OG1 3.11Å; D461-T464 PolarHBondContact OD1-N 3.06Å; D461-H465 WeakPolarHBondContact O-CA 3.4Å; D461-H465 PolarHBondContact O-N 3.35Å; D461-R466 PolarHBondContact N-O 3.3Å
462	P	95.1	Very high	96.9	Very high	20 Å²	20	46 Å²	46	13%	0.13	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-19.2	-177.7	30.9	-38.7	0	0	0	113.5	L393 G440 Y460 H465	L393-P462 HydrophobicContact CD2-CG 3.92Å; G440-P462 VanDerWaalsContact O-CD 3.27Å; G440-P462 WeakPolarHBondContact O-CD 3.42Å; G440-P462 VanDerWaalsContact O-CG 3.31Å; G440-P462 WeakPolarHBondContact O-CG 3.25Å; Y460-P462 HydrophobicContact CE1-CB 3.98Å; P462-H465 PolarHBondContact O-CE1 3.33Å; P462-H465 VanDerWaalsContact O-CE1 3.22Å; P462-H465 PolarHBondContact O-ND1 3.19Å
463	C	94.8	Very high	97.3	Very high	116 Å²	116	45.8 Å²	45.8	78%	0.784	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-30.5	176.7	-61.3	0	0	0	0	111.6	D461	D461-C463 PolarHBondContact O-N 3.09Å; D461-C463 WeakPolarHBondContact OD1-CA 3.37Å; D461-C463 WeakPolarHBondContact OD1-CB 3.37Å; D461-C463 PolarHBondContact OD1-N 3.16Å
464	T	96.3	Very high	97.4	Very high	74 Å²	74	49.5 Å²	49.5	45%	0.454	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-11.6	179.6	69.8	0	0	0	0	113.9	D461 R466	D461-T464 WeakPolarHBondContact CB-OG1 3.43Å; D461-T464 PolarHBondContact O-N 3.24Å; D461-T464 PolarHBondContact O-OG1 3.11Å; D461-T464 PolarHBondContact OD1-N 3.06Å; T464-R466 WeakPolarHBondContact O-CG 3.46Å; T464-R466 PolarHBondContact O-N 3.24Å
465	H	95.3	Very high	97.3	Very high	104 Å²	104	52 Å²	52	48%	0.481	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	30.2	-173.4	-57	-62.6	0	0	0	113.9	S424 Y460 D461 P462	S424-H465 PolarHBondContact OG-O 2.86Å; Y460-H465 PolarHBondContact OH-ND1 3.1Å; Y460-H465 VanDerWaalsContact OH-ND1 3.15Å; D461-H465 WeakPolarHBondContact O-CA 3.4Å; D461-H465 PolarHBondContact O-N 3.35Å; P462-H465 PolarHBondContact O-CE1 3.33Å; P462-H465 VanDerWaalsContact O-CE1 3.22Å; P462-H465 PolarHBondContact O-ND1 3.19Å
466	R	97.7	Very high	97.2	Very high	179 Å²	179	51.7 Å²	51.7	68%	0.675	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	144.2	-175.4	-70.2	175.8	-178	-141.5	-0.6	111.7	Y460 D461 T464	Y460-R466 WeakPolarHBondContact CA-O 3.39Å; D461-R466 PolarHBondContact N-O 3.3Å; T464-R466 WeakPolarHBondContact O-CG 3.46Å; T464-R466 PolarHBondContact O-N 3.24Å
467	W	98.5	Very high	97.1	Very high	15 Å²	15	51 Å²	51	6%	0.057	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	143.7	164.1	-67.2	95	0	0	0	110.1	I400 V412 S424 M426 F427 V444 E458 C459 Y460	I400-W467 HydrophobicContact CG2-CH2 4.48Å; V412-W467 HydrophobicContact CG2-CZ2 3.85Å; S424-W467 PolarHBondContact O-NE1 2.93Å; M426-W467 HydrophobicContact CG-CD2 4.04Å; M426-W467 HydrophobicContact CG-CE3 4.23Å; M426-W467 HydrophobicContact CG-CH2 3.89Å; M426-W467 HydrophobicContact CG-CZ2 3.69Å; M426-W467 HydrophobicContact CG-CZ3 4.14Å; M426-W467 HydrophobicContact SD-CH2 4.28Å; F427-W467 HydrophobicContact CD2-CB 4.07Å; F427-W467 HydrophobicContact CE2-CB 3.62Å; F427-W467 VanDerWaalsContact CE2-O 3.3Å; F427-W467 WeakPolarHBondContact CE2-O 3.25Å; F427-W467 HydrophobicContact CZ-CB 4.23Å; F427-W467 WeakPolarHBondContact CZ-O 3.27Å; V444-W467 HydrophobicContact CB-CZ3 4.33Å; V444-W467 HydrophobicContact CG2-CH2 3.52Å; V444-W467 HydrophobicContact CG2-CZ3 3.55Å; E458-W467 HydrophobicContact CB-CE3 3.72Å; E458-W467 HydrophobicContact CB-CZ3 4.07Å; C459-W467 CarbonylContact O-C 3.47Å; C459-W467 VanDerWaalsContact O-CA 3.28Å; C459-W467 WeakPolarHBondContact O-CA 3.3Å; Y460-W467 HydrophobicContact CD2-CD2 4.11Å; Y460-W467 AromaticContact CD2-CE2 3.74Å; Y460-W467 HydrophobicContact CD2-CG 4.25Å; Y460-W467 HydrophobicContact CD2-CZ2 4.16Å; Y460-W467 AromaticContact CD2-NE1 3.68Å; Y460-W467 HydrophobicContact CG-CD2 4.38Å; Y460-W467 HydrophobicContact CG-CH2 4.43Å; Y460-W467 HydrophobicContact CG-CZ2 4.04Å
468	T	98.3	Very high	96.9	Very high	78 Å²	78	51 Å²	51	48%	0.479	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	151.5	168.8	57.2	0	0	0	0	109.8	E458 C459	E458-T468 CarbonylContact C-O 3.48Å; E458-T468 WeakPolarHBondContact CA-O 3.46Å; C459-T468 PolarHBondContact N-O 3.39Å; C459-T468 PolarHBondContact O-N 3.25Å; C459-T468 PolarHBondContact O-OG1 3.42Å
469	M	98.2	Very high	96.8	Very high	94 Å²	94	52.5 Å²	52.5	46%	0.463	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	133.1	172.7	-63.5	-64.2	-60.2	0	0	109.7	F427 E458	F427-M469 HydrophobicContact CB-SD 4.37Å; F427-M469 HydrophobicContact CD2-CG 4.21Å; F427-M469 HydrophobicContact CD2-SD 3.79Å; F427-M469 HydrophobicContact CE2-CG 4.43Å; F427-M469 HydrophobicContact CG-SD 4.39Å; E458-M469 HydrophobicContact CG-CE 4.43Å; E458-M469 HydrophobicContact CG-SD 3.68Å
470	C	98.3	Very high	96.7	Very high	17 Å²	17	52.8 Å²	52.8	12%	0.115	28%	0.278	C	S	.	.			trans	-96.7	177	168.7	-63.2	0	0	0	0	110.4	V457 C459 Y513	V457-C470 HydrophobicContact CB-CB 4.01Å; V457-C470 HydrophobicContact CG1-CB 3.97Å; V457-C470 PolarHBondContact O-N 2.82Å; C459-C470 VanDerWaalsContact CB-SG 3.5Å; C470-Y513 HydrophobicContact CB-CE2 4.38Å
471	A	98.3	Very high	96.7	Very high	27 Å²	27	52.8 Å²	52.8	22%	0.223	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-58.8	138.9	171.9	0	0	0	0	0	111.6	Y513 N518 W520	A471-Y513 HydrophobicContact CB-CE2 4.34Å; A471-N518 WeakPolarHBondContact CB-O 3.32Å; A471-N518 WeakPolarHBondContact CB-OD1 3.23Å; A471-N518 PolarHBondContact N-OD1 3.12Å; A471-W520 PolarHBondContact O-NE1 3.19Å
472	D	98.4	Very high	96.8	Very high	67 Å²	67	52 Å²	52	36%	0.358	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-65	142.5	174.3	-75.4	-13.3	0	0	0	110.8	K455 S456	K455-D472 HydrophobicContact CD-CB 4Å; K455-D472 WeakPolarHBondContact CE-OD2 3.1Å; K455-D472 HydrophobicContact CG-CB 4.08Å; K455-D472 IonicContact NZ-OD2 2.73Å; K455-D472 PolarHBondContact NZ-OD2 2.73Å; S456-D472 VanDerWaalsContact CA-OD1 3.3Å; S456-D472 WeakPolarHBondContact CA-OD1 3.43Å
473	M	98.2	Very high	96.9	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.025	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-59	160.1	164.2	-72.7	-175	-62.3	0	0	111.7	V445 K455 V457 K475 R477 A491 E511 W520	V445-M473 HydrophobicContact CG1-CE 3.87Å; V445-M473 HydrophobicContact CG1-CG 4.42Å; V445-M473 HydrophobicContact CG1-SD 3.41Å; V445-M473 WeakPolarHBondContact CG1-SD 3.44Å; K455-M473 HydrophobicContact CB-CB 4.32Å; K455-M473 WeakPolarHBondContact O-CB 3.4Å; K455-M473 PolarHBondContact O-N 2.87Å; V457-M473 HydrophobicContact CG2-CG 4.14Å; M473-K475 VanDerWaalsContact C-N 3.25Å; M473-K475 PolarHBondContact O-N 2.88Å; M473-R477 HydrophobicContact CE-CB 4.11Å; M473-R477 HydrophobicContact CE-CG 4.27Å; M473-R477 HydrophobicContact SD-CG 4.46Å; M473-A491 HydrophobicContact SD-CB 3.73Å; M473-E511 WeakPolarHBondContact CB-OE1 3.36Å; M473-W520 HydrophobicContact CG-CD2 3.98Å; M473-W520 HydrophobicContact CG-CE3 4.38Å; M473-W520 HydrophobicContact CG-CH2 4.12Å; M473-W520 HydrophobicContact CG-CZ2 3.7Å; M473-W520 HydrophobicContact CG-CZ3 4.44Å; M473-W520 HydrophobicContact SD-CH2 4.43Å; M473-W520 HydrophobicContact SD-CZ2 4.45Å
474	N	96.7	Very high	97	Very high	88 Å²	88	47.7 Å²	47.7	47%	0.471	25%	0.247	S	C	.	.	S	Bend	trans	-73.3	-18.8	175.7	-64.1	-82.9	0	0	0	112.9	E511	N474-E511 VanDerWaalsContact CB-OE2 3.29Å; N474-E511 WeakPolarHBondContact CB-OE2 3.48Å; N474-E511 PolarHBondContact N-OE2 2.82Å; N474-E511 PolarHBondContact ND2-OE2 2.74Å
475	K	93.3	Very high	96.9	Very high	77 Å²	77	44.3 Å²	44.3	34%	0.335	23%	0.226	S	C	.	.	S	Bend	trans	-128.6	149.4	-177.9	-57.8	-63	179.8	-162.8	0	111.2	K455 M473 R477 F507	K455-K475 WeakPolarHBondContact CB-O 3.45Å; M473-K475 VanDerWaalsContact C-N 3.25Å; M473-K475 PolarHBondContact O-N 2.88Å; K475-R477 HydrophobicContact CB-CG 4.01Å; K475-R477 PolarHBondContact O-N 3.34Å; K475-F507 HydrophobicContact CB-CE2 4.13Å; K475-F507 HydrophobicContact CB-CZ 4.26Å; K475-F507 HydrophobicContact CD-CE1 4.15Å; K475-F507 HydrophobicContact CD-CZ 4.27Å; K475-F507 HydrophobicContact CG-CE1 4.49Å; K475-F507 HydrophobicContact CG-CZ 4.46Å
476	H	94.4	Very high	96.5	Very high	69 Å²	69	42.8 Å²	42.8	32%	0.319	22%	0.222	S	C	.	.			trans	-77.7	116.4	166.7	-71.6	-108.5	0	0	0	109	C453 E496 F507	C453-H476 HydrophobicContact CB-CB 4.01Å; C453-H476 PolarHBondContact O-ND1 2.78Å; H476-E496 HydrophobicContact CB-CG 4.33Å; H476-E496 IonicContact CD2-OE1 3.98Å; H476-F507 WeakPolarHBondContact O-CE2 3.44Å
477	R	96.1	Very high	96.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.205	C	C	.	.			trans	-126.3	107.8	-173.3	-55.7	-179.1	-176.1	-109.7	12	112.1	G447 H454 M473 K475 V480 G493 T495 F507 S509 E511	G447-R477 PolarHBondContact N-O 2.76Å; H454-R477 PolarHBondContact O-N 2.98Å; M473-R477 HydrophobicContact CE-CB 4.11Å; M473-R477 HydrophobicContact CE-CG 4.27Å; M473-R477 HydrophobicContact SD-CG 4.46Å; K475-R477 HydrophobicContact CB-CG 4.01Å; K475-R477 PolarHBondContact O-N 3.34Å; R477-V480 HydrophobicContact CB-CB 3.81Å; R477-V480 HydrophobicContact CB-CG2 3.98Å; R477-G493 PolarHBondContact NH1-O 2.82Å; R477-T495 WeakPolarHBondContact CA-O 3.28Å; R477-F507 HydrophobicContact CG-CD2 4.37Å; R477-S509 PolarHBondContact NH1-O 3.27Å; R477-S509 PolarHBondContact NH2-O 3.09Å; R477-S509 VanDerWaalsContact NH2-O 3.14Å; R477-S509 PolarHBondContact NH2-OG 3.44Å; R477-E511 IonicContact CZ-OE1 3.69Å; R477-E511 VanDerWaalsContact CZ-OE1 3.27Å; R477-E511 IonicContact NE-OE1 3.58Å; R477-E511 PolarHBondContact NE-OE1 2.99Å; R477-E511 IonicContact NH2-OE1 2.7Å; R477-E511 PolarHBondContact NH2-OE1 3.43Å
478	G	94	Very high	96.1	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.01	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-92.4	150.9	161.2	0	0	0	0	0	111.2	V480 G494 T495	G478-V480 PolarHBondContact O-N 3.45Å; G478-G494 CarbonylContact O-C 3.54Å; G478-G494 WeakPolarHBondContact O-CA 3.35Å; G478-T495 PolarHBondContact N-O 2.78Å; G478-T495 PolarHBondContact O-N 2.98Å
479	S	95.8	Very high	96.1	Very high	31 Å²	31	32.8 Å²	32.8	22%	0.217	19%	0.186	C	C	.	.	S	Bend	trans	54.2	39.2	-175.9	-53	0	0	0	0	112.2	S432 G532	S432-S479 WeakPolarHBondContact O-CA 3.29Å; S432-S479 PolarHBondContact O-N 3.21Å; S479-G532 PolarHBondContact O-N 3.15Å
480	V	97.6	Very high	96.1	Very high	11 Å²	11	28.3 Å²	28.3	7%	0.067	16%	0.164	C	C	.	.			trans	-74.9	136.5	-178.2	60.6	0	0	0	0	110.4	V445 R477 G478 V482 A491	V445-V480 WeakPolarHBondContact O-CG1 3.5Å; R477-V480 HydrophobicContact CB-CB 3.81Å; R477-V480 HydrophobicContact CB-CG2 3.98Å; G478-V480 PolarHBondContact O-N 3.45Å; V480-V482 HydrophobicContact CG1-CG2 4.01Å; V480-V482 HydrophobicContact CG2-CG2 4Å; V480-A491 HydrophobicContact CG2-CB 4.01Å
481	G	98.2	Very high	96.1	Very high	3 Å²	3	27.5 Å²	27.5	3%	0.031	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	132.8	168.4	0	0	0	0	0	109.6	L492 I533	G481-L492 PolarHBondContact N-O 3.25Å; G481-L492 PolarHBondContact O-N 2.8Å; G481-I533 WeakPolarHBondContact CA-O 3.4Å
482	V	98.6	Very high	96.1	Very high	17 Å²	17	26.2 Å²	26.2	10%	0.103	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	136.1	-176.9	176.4	0	0	0	0	110.6	A436 V445 V480 I489 Y490	A436-V482 HydrophobicContact CB-CG1 3.83Å; V445-V482 HydrophobicContact CB-CG2 3.93Å; V445-V482 HydrophobicContact CG1-CG2 4Å; V445-V482 HydrophobicContact CG2-CG1 4.23Å; V445-V482 HydrophobicContact CG2-CG2 4.44Å; V480-V482 HydrophobicContact CG1-CG2 4.01Å; V480-V482 HydrophobicContact CG2-CG2 4Å; V482-I489 HydrophobicContact CG1-CG2 3.73Å; V482-Y490 VanDerWaalsContact CA-O 3.27Å; V482-Y490 WeakPolarHBondContact CA-O 3.33Å
483	G	97.9	Very high	96.1	Very high	9 Å²	9	23 Å²	23	9%	0.093	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	175.4	174.6	0	0	0	0	0	112.1	Y490	G483-Y490 PolarHBondContact N-O 3.13Å; G483-Y490 PolarHBondContact O-N 2.72Å
484	V	96.9	Very high	96	Very high	35 Å²	35	22.8 Å²	22.8	21%	0.212	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.3	-173.4	178.1	0	0	0	0	109.5	A436 L438 F488 I489 T537	A436-V484 HydrophobicContact CB-CG2 3.57Å; L438-V484 HydrophobicContact CB-CG1 4.42Å; L438-V484 HydrophobicContact CD1-CG1 3.87Å; V484-F488 VanDerWaalsContact CA-O 3.31Å; V484-F488 WeakPolarHBondContact CA-O 3.25Å; V484-I489 HydrophobicContact CG2-CG1 4.28Å; V484-T537 PolarHBondContact O-OG1 2.93Å
485	L	94.2	Very high	95.8	Very high	4 Å²	4	18.8 Å²	18.8	2%	0.021	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	130.1	177	177.4	68.8	0	0	0	109.1	G487 F488 Y490 T537 I540 L542 Y560 E562	L485-G487 VanDerWaalsContact C-N 3.29Å; L485-G487 PolarHBondContact O-N 3.42Å; L485-F488 PolarHBondContact N-O 3.05Å; L485-F488 PolarHBondContact O-N 3.38Å; L485-Y490 HydrophobicContact CB-CD2 4.09Å; L485-Y490 HydrophobicContact CB-CE2 3.68Å; L485-Y490 HydrophobicContact CG-CE2 4.48Å; L485-T537 HydrophobicContact CD1-CG2 3.94Å; L485-I540 WeakPolarHBondContact CD1-O 3.29Å; L485-L542 HydrophobicContact CD2-CB 4.14Å; L485-Y560 HydrophobicContact CD2-CD1 4.08Å; L485-E562 HydrophobicContact CD2-CB 4.16Å
486	N	88	Confident	95.7	Very high	71 Å²	71	18.2 Å²	18.2	38%	0.38	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	41	174.1	-63.6	-22.9	0	0	0	115.1	F488 E562	N486-F488 WeakPolarHBondContact O-CD2 3.38Å; N486-F488 WeakPolarHBondContact O-CE2 3.43Å; N486-E562 VanDerWaalsContact CB-OE2 3.31Å; N486-E562 WeakPolarHBondContact CB-OE2 3.34Å; N486-E562 PolarHBondContact ND2-OE2 3.29Å
487	G	90.5	Very high	95.1	Very high	32 Å²	32	15.5 Å²	15.5	33%	0.33	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	10.8	178.4	0	0	0	0	0	114.7	L438 L485	L438-G487 WeakPolarHBondContact CD2-O 3.43Å; L485-G487 VanDerWaalsContact C-N 3.29Å; L485-G487 PolarHBondContact O-N 3.42Å
488	F	95.7	Very high	93.8	Very high	30 Å²	30	18.6 Å²	18.6	13%	0.132	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	152.5	178	-57.1	-82.8	0	0	0	111.8	V484 L485 N486 Y490 R512 Y513 D514	V484-F488 VanDerWaalsContact CA-O 3.31Å; V484-F488 WeakPolarHBondContact CA-O 3.25Å; L485-F488 PolarHBondContact N-O 3.05Å; L485-F488 PolarHBondContact O-N 3.38Å; N486-F488 WeakPolarHBondContact O-CD2 3.38Å; N486-F488 WeakPolarHBondContact O-CE2 3.43Å; F488-Y490 HydrophobicContact CB-CD2 4.36Å; F488-Y490 HydrophobicContact CB-CE2 3.8Å; F488-R512 HydrophobicContact CB-CG 3.42Å; F488-R512 VanDerWaalsContact CB-CG 3.42Å; F488-R512 HydrophobicContact CD1-CG 4.09Å; F488-R512 HydrophobicContact CG-CG 3.85Å; F488-Y513 WeakPolarHBondContact CA-O 3.39Å; F488-Y513 WeakPolarHBondContact CB-O 3.44Å; F488-D514 HydrophobicContact CD1-CB 3.94Å; F488-D514 HydrophobicContact CE1-CB 3.8Å
489	I	98.3	Very high	92.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	130.3	173.2	-57.2	170.4	0	0	0	108.8	A436 L438 Y443 V445 V482 V484 R512 Y513 W520	A436-I489 HydrophobicContact CB-CD1 4.18Å; A436-I489 HydrophobicContact CB-CG1 4.16Å; A436-I489 HydrophobicContact CB-CG2 3.94Å; L438-I489 HydrophobicContact CB-CD1 4.45Å; L438-I489 HydrophobicContact CB-CG1 4.36Å; L438-I489 HydrophobicContact CD2-CD1 4.12Å; L438-I489 HydrophobicContact CD2-CG1 3.64Å; Y443-I489 HydrophobicContact CD1-CD1 3.63Å; Y443-I489 HydrophobicContact CD2-CD1 3.48Å; Y443-I489 VanDerWaalsContact CD2-CD1 3.48Å; Y443-I489 HydrophobicContact CE1-CD1 4.14Å; Y443-I489 HydrophobicContact CE2-CD1 4.01Å; Y443-I489 HydrophobicContact CG-CD1 3.26Å; V445-I489 HydrophobicContact CG2-CG2 4.31Å; V482-I489 HydrophobicContact CG1-CG2 3.73Å; V484-I489 HydrophobicContact CG2-CG1 4.28Å; I489-R512 CarbonylContact O-C 3.57Å; I489-R512 WeakPolarHBondContact O-CA 3.5Å; I489-Y513 HydrophobicContact CD1-CD1 4.07Å; I489-Y513 PolarHBondContact N-O 3.14Å; I489-Y513 VanDerWaalsContact N-O 3.17Å; I489-Y513 PolarHBondContact O-N 2.75Å; I489-W520 HydrophobicContact CG2-CH2 4.32Å
490	Y	98.6	Very high	90.9	Very high	0 Å²	0	25 Å²	25	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134	179.1	-71.3	-104	0	0	0	110.3	V482 G483 L485 F488 V510 E511 R512 V523 L542 Y560 E562	V482-Y490 VanDerWaalsContact CA-O 3.27Å; V482-Y490 WeakPolarHBondContact CA-O 3.33Å; G483-Y490 PolarHBondContact N-O 3.13Å; G483-Y490 PolarHBondContact O-N 2.72Å; L485-Y490 HydrophobicContact CB-CD2 4.09Å; L485-Y490 HydrophobicContact CB-CE2 3.68Å; L485-Y490 HydrophobicContact CG-CE2 4.48Å; F488-Y490 HydrophobicContact CB-CD2 4.36Å; F488-Y490 HydrophobicContact CB-CE2 3.8Å; Y490-V510 HydrophobicContact CD1-CG1 4.2Å; Y490-E511 CarbonylContact C-O 3.44Å; Y490-E511 WeakPolarHBondContact CA-O 3.48Å; Y490-R512 HydrophobicContact CD1-CB 4.01Å; Y490-R512 HydrophobicContact CD1-CG 4.14Å; Y490-R512 HydrophobicContact CD2-CG 4.19Å; Y490-R512 HydrophobicContact CE1-CB 3.84Å; Y490-R512 HydrophobicContact CE1-CG 3.77Å; Y490-R512 HydrophobicContact CE2-CG 3.8Å; Y490-R512 HydrophobicContact CG-CG 4.35Å; Y490-R512 WeakPolarHBondContact OH-CD 3.32Å; Y490-V523 HydrophobicContact CD1-CG2 4.33Å; Y490-V523 HydrophobicContact CE1-CG2 4.25Å; Y490-L542 HydrophobicContact CD1-CD2 4.19Å; Y490-L542 HydrophobicContact CD2-CD2 4.24Å; Y490-L542 HydrophobicContact CG-CD2 3.74Å; Y490-Y560 HydrophobicContact CE1-CD1 4.21Å; Y490-Y560 AromaticContact CE1-CE1 3.69Å; Y490-Y560 HydrophobicContact CE1-CE1 3.69Å; Y490-E562 PolarHBondContact OH-OE1 3.04Å
491	A	98.6	Very high	89.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	115.1	174.6	0	0	0	0	0	110.5	V445 M473 V480 V510 E511 W520	V445-A491 HydrophobicContact CG1-CB 4.19Å; M473-A491 HydrophobicContact SD-CB 3.73Å; V480-A491 HydrophobicContact CG2-CB 4.01Å; A491-V510 WeakPolarHBondContact O-CA 3.09Å; A491-E511 HydrophobicContact CB-CG 3.97Å; A491-E511 PolarHBondContact N-O 2.87Å; A491-E511 PolarHBondContact O-N 3.4Å; A491-E511 VanDerWaalsContact O-N 3.08Å; A491-W520 HydrophobicContact CB-CH2 3.9Å; A491-W520 HydrophobicContact CB-CZ3 3.73Å
492	L	98.3	Very high	87.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.3	-168.4	-69.8	67.5	0	0	0	110.5	G481 G494 V510 L526 I533 V535 L542 A544 W567	G481-L492 PolarHBondContact N-O 3.25Å; G481-L492 PolarHBondContact O-N 2.8Å; L492-G494 PolarHBondContact O-N 2.82Å; L492-V510 HydrophobicContact CB-CG2 4.5Å; L492-V510 HydrophobicContact CD1-CG1 3.99Å; L492-V510 HydrophobicContact CG-CG1 3.9Å; L492-V510 HydrophobicContact CG-CG2 4.11Å; L492-L526 HydrophobicContact CB-CD1 4.5Å; L492-I533 HydrophobicContact CB-CD1 4.27Å; L492-V535 HydrophobicContact CB-CG2 4.49Å; L492-V535 HydrophobicContact CD1-CG1 4.5Å; L492-V535 HydrophobicContact CD2-CG1 4.27Å; L492-V535 HydrophobicContact CD2-CG2 3.83Å; L492-L542 HydrophobicContact CD1-CD2 3.86Å; L492-L542 HydrophobicContact CD2-CD2 4.3Å; L492-A544 HydrophobicContact CD2-CB 3.83Å; L492-W567 HydrophobicContact CD2-CH2 3.46Å; L492-W567 VanDerWaalsContact CD2-CH2 3.46Å; L492-W567 HydrophobicContact CD2-CZ2 3.94Å; L492-W567 HydrophobicContact CD2-CZ3 4.44Å; L492-W567 HydrophobicContact CG-CH2 4.32Å; L492-W567 HydrophobicContact CG-CZ2 4.33Å
493	G	97.5	Very high	86.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	26%	0.263	C	S	.	.			trans	49.4	-132.3	171.7	0	0	0	0	0	114.5	R477 F507 S509	R477-G493 PolarHBondContact NH1-O 2.82Å; G493-F507 VanDerWaalsContact CA-O 3.23Å; G493-F507 WeakPolarHBondContact CA-O 3.36Å; G493-S509 PolarHBondContact N-O 2.93Å
494	G	96.2	Very high	85.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	27%	0.274	C	S	.	.			trans	85.5	-173.1	-175.3	0	0	0	0	0	112.5	G478 L492 R506 F507 R530	G478-G494 CarbonylContact O-C 3.54Å; G478-G494 WeakPolarHBondContact O-CA 3.35Å; L492-G494 PolarHBondContact O-N 2.82Å; G494-R506 WeakPolarHBondContact O-CA 3.13Å; G494-F507 PolarHBondContact O-N 2.75Å; G494-R530 PolarHBondContact N-O 2.97Å
495	T	93.4	Very high	85.4	Confident	4 Å²	4	48.3 Å²	48.3	3%	0.025	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	153	-176.5	64.9	0	0	0	0	114	C453 R477 G478 V504 K505 R506 D531	C453-T495 PolarHBondContact SG-O 3.21Å; C453-T495 VanDerWaalsContact SG-O 3.35Å; R477-T495 WeakPolarHBondContact CA-O 3.28Å; G478-T495 PolarHBondContact N-O 2.78Å; G478-T495 PolarHBondContact O-N 2.98Å; T495-V504 HydrophobicContact CG2-CG1 3.49Å; T495-V504 VanDerWaalsContact CG2-CG1 3.49Å; T495-K505 CarbonylContact C-O 3.56Å; T495-K505 WeakPolarHBondContact CA-O 3.34Å; T495-R506 HydrophobicContact CG2-CG 3.72Å; T495-D531 HydrophobicContact CG2-CB 3.31Å
496	E	90	Very high	85.4	Confident	65 Å²	65	51 Å²	51	30%	0.304	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	116.4	159.8	-178	169.6	-134.3	0	0	108.3	H476 K505 F507	H476-E496 HydrophobicContact CB-CG 4.33Å; H476-E496 IonicContact CD2-OE1 3.98Å; E496-K505 PolarHBondContact N-O 2.98Å; E496-K505 PolarHBondContact O-N 2.91Å; E496-K505 VanDerWaalsContact O-N 3.15Å; E496-F507 HydrophobicContact CB-CE2 3.72Å; E496-F507 HydrophobicContact CB-CZ 3.56Å
497	S	82.2	Confident	85.8	Confident	13 Å²	13	48 Å²	48	9%	0.091	28%	0.282	C	S	.	.			trans	-122.1	95.6	173.1	-60.1	0	0	0	0	108.3
498	P	70.3	Confident	86.1	Confident	65 Å²	65	53.1 Å²	53.1	42%	0.422	29%	0.291	S	S	.	.			trans	-60.5	141.8	173.9	-18.7	30.6	0	0	0	110.2	G500 N501	P498-G500 PolarHBondContact O-N 3.08Å; P498-G500 VanDerWaalsContact O-N 3.16Å; P498-N501 HydrophobicContact CB-CB 4.3Å; P498-N501 HydrophobicContact CG-CB 4.44Å; P498-N501 PolarHBondContact O-N 2.82Å; P498-N501 VanDerWaalsContact O-N 3.13Å
499	A	64.3	Low	86.3	Confident	79 Å²	79	52.3 Å²	52.3	65%	0.653	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	125.4	171	0	0	0	0	0	110.4	S451	S451-A499 VanDerWaalsContact O-CB 3.26Å; S451-A499 WeakPolarHBondContact O-CB 3.27Å
500	G	63.3	Low	86.3	Confident	87 Å²	87	52.3 Å²	52.3	90%	0.897	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	2.8	177.8	0	0	0	0	0	116.3	P498	P498-G500 PolarHBondContact O-N 3.08Å; P498-G500 VanDerWaalsContact O-N 3.16Å
501	N	64.7	Low	86.3	Confident	83 Å²	83	52.3 Å²	52.3	44%	0.444	29%	0.289	S	S	.	.			trans	-118.6	132.2	175.1	-164.8	-12.2	0	0	0	111.9	P498 N503	P498-N501 HydrophobicContact CB-CB 4.3Å; P498-N501 HydrophobicContact CG-CB 4.44Å; P498-N501 PolarHBondContact O-N 2.82Å; P498-N501 VanDerWaalsContact O-N 3.13Å; N501-N503 PolarHBondContact OD1-N 2.9Å
502	H	64.3	Low	86.2	Confident	181 Å²	181	55.1 Å²	55.1	84%	0.838	30%	0.3	S	S	*	.			trans	-86	-8.4	177.4	-62	-62.2	0	0	0	113.6	V504	H502-V504 VanDerWaalsContact C-N 3.32Å; H502-V504 PolarHBondContact O-N 2.96Å
503	N	71.6	Confident	86.2	Confident	129 Å²	129	55.4 Å²	55.4	69%	0.69	30%	0.301	S	S	*	.			trans	-76.4	84	175.2	-78	-5.6	0	0	0	110.8	N501 K505	N501-N503 PolarHBondContact OD1-N 2.9Å; N503-K505 PolarHBondContact O-N 2.86Å
504	V	82.9	Confident	86.2	Confident	51 Å²	51	56.8 Å²	56.8	31%	0.309	31%	0.308	S	S	.	.			trans	-73.3	109.3	175.8	-177.5	0	0	0	0	109.5	T495 H502	T495-V504 HydrophobicContact CG2-CG1 3.49Å; T495-V504 VanDerWaalsContact CG2-CG1 3.49Å; H502-V504 VanDerWaalsContact C-N 3.32Å; H502-V504 PolarHBondContact O-N 2.96Å
505	K	90.5	Very high	86.1	Confident	120 Å²	120	58.2 Å²	58.2	52%	0.522	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	123.4	174.2	-176.4	175.1	-179.7	177.2	0	109.4	T495 E496 N503 F507	T495-K505 CarbonylContact C-O 3.56Å; T495-K505 WeakPolarHBondContact CA-O 3.34Å; E496-K505 PolarHBondContact N-O 2.98Å; E496-K505 PolarHBondContact O-N 2.91Å; E496-K505 VanDerWaalsContact O-N 3.15Å; N503-K505 PolarHBondContact O-N 2.86Å; K505-F507 HydrophobicContact CD-CE1 3.78Å; K505-F507 HydrophobicContact CD-CZ 4.4Å; K505-F507 HydrophobicContact CG-CD1 4.46Å; K505-F507 HydrophobicContact CG-CE1 4.04Å
506	R	94.4	Very high	86.2	Confident	60 Å²	60	63 Å²	63	23%	0.226	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	135.5	172.8	-76	164.9	178.8	79.7	17.1	110.4	G494 T495 D531 Y548 N549 G550	G494-R506 WeakPolarHBondContact O-CA 3.13Å; T495-R506 HydrophobicContact CG2-CG 3.72Å; R506-D531 HydrophobicContact CG-CB 4.47Å; R506-D531 IonicContact CZ-OD1 2.79Å; R506-D531 IonicContact NE-OD1 3.96Å; R506-D531 PolarHBondContact NE-OD1 3.09Å; R506-D531 IonicContact NH2-OD1 3.78Å; R506-D531 PolarHBondContact NH2-OD1 2.86Å; R506-D531 VanDerWaalsContact NH2-OD1 3.12Å; R506-Y548 VanDerWaalsContact CD-O 3.3Å; R506-Y548 WeakPolarHBondContact CD-O 3.13Å; R506-Y548 PolarHBondContact NE-O 2.81Å; R506-Y548 VanDerWaalsContact NH2-CD1 3.29Å; R506-N549 VanDerWaalsContact CD-O 3.25Å; R506-N549 WeakPolarHBondContact CD-O 3.3Å; R506-G550 VanDerWaalsContact CZ-CA 3.49Å
507	F	96.4	Very high	86.5	Confident	8 Å²	8	65.3 Å²	65.3	4%	0.035	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-95.3	138.7	-177.7	-61.6	-60.5	0	0	0	111.6	K475 H476 R477 G493 G494 E496 K505 G529 R530	K475-F507 HydrophobicContact CB-CE2 4.13Å; K475-F507 HydrophobicContact CB-CZ 4.26Å; K475-F507 HydrophobicContact CD-CE1 4.15Å; K475-F507 HydrophobicContact CD-CZ 4.27Å; K475-F507 HydrophobicContact CG-CE1 4.49Å; K475-F507 HydrophobicContact CG-CZ 4.46Å; H476-F507 WeakPolarHBondContact O-CE2 3.44Å; R477-F507 HydrophobicContact CG-CD2 4.37Å; G493-F507 VanDerWaalsContact CA-O 3.23Å; G493-F507 WeakPolarHBondContact CA-O 3.36Å; G494-F507 PolarHBondContact O-N 2.75Å; E496-F507 HydrophobicContact CB-CE2 3.72Å; E496-F507 HydrophobicContact CB-CZ 3.56Å; K505-F507 HydrophobicContact CD-CE1 3.78Å; K505-F507 HydrophobicContact CD-CZ 4.4Å; K505-F507 HydrophobicContact CG-CD1 4.46Å; K505-F507 HydrophobicContact CG-CE1 4.04Å; F507-G529 WeakPolarHBondContact O-CA 3.35Å; F507-R530 PolarHBondContact O-N 2.83Å
508	R	97.6	Very high	87.2	Confident	141 Å²	141	68.5 Å²	68.5	53%	0.532	38%	0.381	S	S	.	.			trans	-84.6	-22.2	159	65.1	174.6	70.7	177.3	-0.8	111.8	D525 L526	R508-D525 HydrophobicContact CB-CB 4.26Å; R508-D525 WeakPolarHBondContact CD-OD2 3.43Å; R508-D525 HydrophobicContact CG-CB 3.86Å; R508-D525 WeakPolarHBondContact CG-OD2 3.46Å; R508-L526 WeakPolarHBondContact O-CB 3.47Å; R508-L526 PolarHBondContact O-N 3.33Å
509	S	98	Very high	88.5	Confident	13 Å²	13	70.6 Å²	70.6	9%	0.091	39%	0.385	C	S	.	.			trans	-67.3	139.5	-167.8	54.8	0	0	0	0	112.4	R477 G493 D525	R477-S509 PolarHBondContact NH1-O 3.27Å; R477-S509 PolarHBondContact NH2-O 3.09Å; R477-S509 VanDerWaalsContact NH2-O 3.14Å; R477-S509 PolarHBondContact NH2-OG 3.44Å; G493-S509 PolarHBondContact N-O 2.93Å; S509-D525 VanDerWaalsContact CA-OD1 3.25Å; S509-D525 WeakPolarHBondContact CA-OD1 3.19Å
510	V	98.5	Very high	90.2	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	139.5	173.1	-174.4	0	0	0	0	108.2	Y490 A491 L492 V523 L526 W567	Y490-V510 HydrophobicContact CD1-CG1 4.2Å; A491-V510 WeakPolarHBondContact O-CA 3.09Å; L492-V510 HydrophobicContact CB-CG2 4.5Å; L492-V510 HydrophobicContact CD1-CG1 3.99Å; L492-V510 HydrophobicContact CG-CG1 3.9Å; L492-V510 HydrophobicContact CG-CG2 4.11Å; V510-V523 HydrophobicContact CB-CG2 3.71Å; V510-V523 HydrophobicContact CG1-CG2 3.54Å; V510-V523 PolarHBondContact O-N 2.84Å; V510-L526 HydrophobicContact CG2-CD1 4.35Å; V510-L526 HydrophobicContact CG2-CD2 4.47Å; V510-L526 HydrophobicContact CG2-CG 3.86Å; V510-W567 HydrophobicContact CG1-CZ2 4.36Å; V510-W567 HydrophobicContact CG2-CZ2 3.93Å
511	E	98.3	Very high	91.8	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	147.1	173.7	57.5	-166.2	142.8	0	0	110.7	M473 N474 R477 Y490 A491 W520 T521 L522	M473-E511 WeakPolarHBondContact CB-OE1 3.36Å; N474-E511 VanDerWaalsContact CB-OE2 3.29Å; N474-E511 WeakPolarHBondContact CB-OE2 3.48Å; N474-E511 PolarHBondContact N-OE2 2.82Å; N474-E511 PolarHBondContact ND2-OE2 2.74Å; R477-E511 IonicContact CZ-OE1 3.69Å; R477-E511 VanDerWaalsContact CZ-OE1 3.27Å; R477-E511 IonicContact NE-OE1 3.58Å; R477-E511 PolarHBondContact NE-OE1 2.99Å; R477-E511 IonicContact NH2-OE1 2.7Å; R477-E511 PolarHBondContact NH2-OE1 3.43Å; Y490-E511 CarbonylContact C-O 3.44Å; Y490-E511 WeakPolarHBondContact CA-O 3.48Å; A491-E511 HydrophobicContact CB-CG 3.97Å; A491-E511 PolarHBondContact N-O 2.87Å; A491-E511 PolarHBondContact O-N 3.4Å; A491-E511 VanDerWaalsContact O-N 3.08Å; E511-W520 HydrophobicContact CB-CE3 3.92Å; E511-W520 HydrophobicContact CG-CD2 4.34Å; E511-W520 HydrophobicContact CG-CE3 3.51Å; E511-W520 HydrophobicContact CG-CZ3 3.85Å; E511-W520 WeakPolarHBondContact O-CZ3 3.44Å; E511-T521 CarbonylContact C-O 3.46Å; E511-T521 VanDerWaalsContact CA-O 3.3Å; E511-T521 WeakPolarHBondContact CA-O 3.48Å; E511-L522 HydrophobicContact CB-CD2 4.19Å
512	R	98	Very high	93.4	Very high	58 Å²	58	67.2 Å²	67.2	22%	0.219	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.1	-176.8	-175.2	-172.9	78.8	179.9	-1.1	109.8	F488 I489 Y490 W520 T521 V523 E562	F488-R512 HydrophobicContact CB-CG 3.42Å; F488-R512 VanDerWaalsContact CB-CG 3.42Å; F488-R512 HydrophobicContact CD1-CG 4.09Å; F488-R512 HydrophobicContact CG-CG 3.85Å; I489-R512 CarbonylContact O-C 3.57Å; I489-R512 WeakPolarHBondContact O-CA 3.5Å; Y490-R512 HydrophobicContact CD1-CB 4.01Å; Y490-R512 HydrophobicContact CD1-CG 4.14Å; Y490-R512 HydrophobicContact CD2-CG 4.19Å; Y490-R512 HydrophobicContact CE1-CB 3.84Å; Y490-R512 HydrophobicContact CE1-CG 3.77Å; Y490-R512 HydrophobicContact CE2-CG 3.8Å; Y490-R512 HydrophobicContact CG-CG 4.35Å; Y490-R512 WeakPolarHBondContact OH-CD 3.32Å; R512-W520 VanDerWaalsContact C-CE3 3.49Å; R512-W520 CarbonylContact O-C 3.46Å; R512-W520 WeakPolarHBondContact O-CA 3.48Å; R512-T521 PolarHBondContact N-O 3.03Å; R512-T521 PolarHBondContact O-N 2.79Å; R512-V523 HydrophobicContact CB-CG1 3.9Å; R512-E562 IonicContact NH1-OE1 2.73Å; R512-E562 PolarHBondContact NH1-OE1 2.87Å
513	Y	98.5	Very high	95	Very high	7 Å²	7	59.6 Å²	59.6	3%	0.027	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128	175.8	179.3	-109.8	0	0	0	110.9	Y443 C470 A471 F488 I489 P515 N518 Q519 W520	Y443-Y513 HydrophobicContact CD1-CE1 4.37Å; Y443-Y513 AromaticContact CE1-CE1 3.83Å; Y443-Y513 HydrophobicContact CE1-CE1 3.83Å; C470-Y513 HydrophobicContact CB-CE2 4.38Å; A471-Y513 HydrophobicContact CB-CE2 4.34Å; F488-Y513 WeakPolarHBondContact CA-O 3.39Å; F488-Y513 WeakPolarHBondContact CB-O 3.44Å; I489-Y513 HydrophobicContact CD1-CD1 4.07Å; I489-Y513 PolarHBondContact N-O 3.14Å; I489-Y513 VanDerWaalsContact N-O 3.17Å; I489-Y513 PolarHBondContact O-N 2.75Å; Y513-P515 HydrophobicContact CD1-CG 4.07Å; Y513-P515 HydrophobicContact CE1-CB 3.97Å; Y513-P515 HydrophobicContact CE1-CG 3.95Å; Y513-N518 PolarHBondContact OH-OD1 3.17Å; Y513-Q519 WeakPolarHBondContact CA-O 3.42Å; Y513-W520 AromaticContact CD2-CD1 3.79Å; Y513-W520 HydrophobicContact CD2-CD2 4.06Å; Y513-W520 AromaticContact CD2-CE2 3.68Å; Y513-W520 HydrophobicContact CD2-CG 4.13Å; Y513-W520 HydrophobicContact CD2-CZ2 4.2Å; Y513-W520 AromaticContact CD2-NE1 3.49Å; Y513-W520 HydrophobicContact CG-CD2 4.29Å; Y513-W520 AromaticContact CG-CE2 3.92Å; Y513-W520 HydrophobicContact CG-CH2 4.48Å; Y513-W520 HydrophobicContact CG-CZ2 4.02Å
514	D	96.4	Very high	96.3	Very high	28 Å²	28	54.5 Å²	54.5	15%	0.15	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	110.3	169.6	-175	-29.4	0	0	0	109.3	F488 S516 L517 N518 Q519	F488-D514 HydrophobicContact CD1-CB 3.94Å; F488-D514 HydrophobicContact CE1-CB 3.8Å; D514-S516 VanDerWaalsContact C-N 3.25Å; D514-S516 PolarHBondContact O-N 2.96Å; D514-S516 WeakPolarHBondContact OD1-CA 3.31Å; D514-S516 VanDerWaalsContact OD1-CB 3.3Å; D514-S516 WeakPolarHBondContact OD1-CB 3.27Å; D514-S516 PolarHBondContact OD1-N 2.94Å; D514-S516 PolarHBondContact OD1-OG 2.79Å; D514-L517 HydrophobicContact CB-CB 4.18Å; D514-L517 HydrophobicContact CB-CD1 4.5Å; D514-L517 HydrophobicContact CB-CG 4.45Å; D514-L517 PolarHBondContact O-N 2.92Å; D514-L517 PolarHBondContact OD1-N 3.17Å; D514-L517 WeakPolarHBondContact OD2-CD1 3.42Å; D514-L517 WeakPolarHBondContact OD2-CG 3.3Å; D514-N518 WeakPolarHBondContact O-CA 3.21Å; D514-N518 PolarHBondContact O-N 2.99Å; D514-Q519 PolarHBondContact N-O 3.01Å; D514-Q519 PolarHBondContact O-N 2.96Å
515	P	95	Very high	97	Very high	30 Å²	30	55.9 Å²	55.9	20%	0.195	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-28.3	178.3	-19.2	30.4	0	0	0	114	L438 Y513	L438-P515 HydrophobicContact CD2-CG 3.44Å; L438-P515 VanDerWaalsContact CD2-CG 3.44Å; L438-P515 HydrophobicContact CG-CG 4.39Å; Y513-P515 HydrophobicContact CD1-CG 4.07Å; Y513-P515 HydrophobicContact CE1-CB 3.97Å; Y513-P515 HydrophobicContact CE1-CG 3.95Å
516	S	94	Very high	97.4	Very high	104 Å²	104	50.3 Å²	50.3	73%	0.727	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-34	-178.9	77.8	0	0	0	0	111.9	D514	D514-S516 VanDerWaalsContact C-N 3.25Å; D514-S516 PolarHBondContact O-N 2.96Å; D514-S516 WeakPolarHBondContact OD1-CA 3.31Å; D514-S516 VanDerWaalsContact OD1-CB 3.3Å; D514-S516 WeakPolarHBondContact OD1-CB 3.27Å; D514-S516 PolarHBondContact OD1-N 2.94Å; D514-S516 PolarHBondContact OD1-OG 2.79Å
517	L	96.5	Very high	97.5	Very high	115 Å²	115	50.7 Å²	50.7	60%	0.602	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-12.9	177.4	-59.2	-179.2	0	0	0	113	D514 Q519	D514-L517 HydrophobicContact CB-CB 4.18Å; D514-L517 HydrophobicContact CB-CD1 4.5Å; D514-L517 HydrophobicContact CB-CG 4.45Å; D514-L517 PolarHBondContact O-N 2.92Å; D514-L517 PolarHBondContact OD1-N 3.17Å; D514-L517 WeakPolarHBondContact OD2-CD1 3.42Å; D514-L517 WeakPolarHBondContact OD2-CG 3.3Å; L517-Q519 VanDerWaalsContact C-N 3.29Å; L517-Q519 HydrophobicContact CB-CB 4.16Å; L517-Q519 PolarHBondContact O-N 2.86Å
518	N	97.5	Very high	97.5	Very high	79 Å²	79	52.6 Å²	52.6	42%	0.422	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	52	-169.9	-175	33	0	0	0	111	A471 Y513 D514	A471-N518 WeakPolarHBondContact CB-O 3.32Å; A471-N518 WeakPolarHBondContact CB-OD1 3.23Å; A471-N518 PolarHBondContact N-OD1 3.12Å; Y513-N518 PolarHBondContact OH-OD1 3.17Å; D514-N518 WeakPolarHBondContact O-CA 3.21Å; D514-N518 PolarHBondContact O-N 2.99Å
519	Q	98.4	Very high	97.5	Very high	109 Å²	109	46.9 Å²	46.9	51%	0.509	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	141.5	-173.8	-176	174.6	-8.8	0	0	112	Y513 D514 L517	Y513-Q519 WeakPolarHBondContact CA-O 3.42Å; D514-Q519 PolarHBondContact N-O 3.01Å; D514-Q519 PolarHBondContact O-N 2.96Å; L517-Q519 VanDerWaalsContact C-N 3.29Å; L517-Q519 HydrophobicContact CB-CB 4.16Å; L517-Q519 PolarHBondContact O-N 2.86Å
520	W	98.5	Very high	97.4	Very high	14 Å²	14	46.3 Å²	46.3	5%	0.053	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	136.6	170.3	-69.6	92.6	0	0	0	111.5	V445 V457 A471 M473 I489 A491 E511 R512 Y513	V445-W520 HydrophobicContact CG1-CH2 4.16Å; V445-W520 HydrophobicContact CG1-CZ2 4.32Å; V457-W520 HydrophobicContact CG2-CZ2 3.77Å; A471-W520 PolarHBondContact O-NE1 3.19Å; M473-W520 HydrophobicContact CG-CD2 3.98Å; M473-W520 HydrophobicContact CG-CE3 4.38Å; M473-W520 HydrophobicContact CG-CH2 4.12Å; M473-W520 HydrophobicContact CG-CZ2 3.7Å; M473-W520 HydrophobicContact CG-CZ3 4.44Å; M473-W520 HydrophobicContact SD-CH2 4.43Å; M473-W520 HydrophobicContact SD-CZ2 4.45Å; I489-W520 HydrophobicContact CG2-CH2 4.32Å; A491-W520 HydrophobicContact CB-CH2 3.9Å; A491-W520 HydrophobicContact CB-CZ3 3.73Å; E511-W520 HydrophobicContact CB-CE3 3.92Å; E511-W520 HydrophobicContact CG-CD2 4.34Å; E511-W520 HydrophobicContact CG-CE3 3.51Å; E511-W520 HydrophobicContact CG-CZ3 3.85Å; E511-W520 WeakPolarHBondContact O-CZ3 3.44Å; R512-W520 VanDerWaalsContact C-CE3 3.49Å; R512-W520 CarbonylContact O-C 3.46Å; R512-W520 WeakPolarHBondContact O-CA 3.48Å; Y513-W520 AromaticContact CD2-CD1 3.79Å; Y513-W520 HydrophobicContact CD2-CD2 4.06Å; Y513-W520 AromaticContact CD2-CE2 3.68Å; Y513-W520 HydrophobicContact CD2-CG 4.13Å; Y513-W520 HydrophobicContact CD2-CZ2 4.2Å; Y513-W520 AromaticContact CD2-NE1 3.49Å; Y513-W520 HydrophobicContact CG-CD2 4.29Å; Y513-W520 AromaticContact CG-CE2 3.92Å; Y513-W520 HydrophobicContact CG-CH2 4.48Å; Y513-W520 HydrophobicContact CG-CZ2 4.02Å
521	T	98	Very high	97.3	Very high	67 Å²	67	47.2 Å²	47.2	41%	0.411	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.3	176.3	-60	0	0	0	0	109.6	E511 R512	E511-T521 CarbonylContact C-O 3.46Å; E511-T521 VanDerWaalsContact CA-O 3.3Å; E511-T521 WeakPolarHBondContact CA-O 3.48Å; R512-T521 PolarHBondContact N-O 3.03Å; R512-T521 PolarHBondContact O-N 2.79Å
522	L	98	Very high	97.3	Very high	98 Å²	98	47.8 Å²	47.8	51%	0.513	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	135.2	173.8	-69.2	168.2	0	0	0	110	E511	E511-L522 HydrophobicContact CB-CD2 4.19Å
523	V	97.9	Very high	97.3	Very high	20 Å²	20	45.5 Å²	45.5	12%	0.121	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	-175.3	174.5	-60.5	0	0	0	0	109	Y490 V510 R512 D525 N565	Y490-V523 HydrophobicContact CD1-CG2 4.33Å; Y490-V523 HydrophobicContact CE1-CG2 4.25Å; V510-V523 HydrophobicContact CB-CG2 3.71Å; V510-V523 HydrophobicContact CG1-CG2 3.54Å; V510-V523 PolarHBondContact O-N 2.84Å; R512-V523 HydrophobicContact CB-CG1 3.9Å; V523-D525 PolarHBondContact O-N 2.95Å; V523-N565 WeakPolarHBondContact CB-OD1 3.35Å
524	A	98.3	Very high	97.3	Very high	23 Å²	23	45.4 Å²	45.4	19%	0.19	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-53.3	136.8	-178.8	0	0	0	0	0	113.4	Y560 N565 W567	A524-Y560 HydrophobicContact CB-CE2 4.33Å; A524-N565 WeakPolarHBondContact CB-O 3.4Å; A524-N565 PolarHBondContact N-OD1 3.16Å; A524-W567 PolarHBondContact O-NE1 3.33Å
525	D	98.5	Very high	97.3	Very high	80 Å²	80	45.2 Å²	45.2	43%	0.428	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-71.1	148.4	177.6	-73.3	-14.4	0	0	0	110.7	R508 S509 V523 W567	R508-D525 HydrophobicContact CB-CB 4.26Å; R508-D525 WeakPolarHBondContact CD-OD2 3.43Å; R508-D525 HydrophobicContact CG-CB 3.86Å; R508-D525 WeakPolarHBondContact CG-OD2 3.46Å; S509-D525 VanDerWaalsContact CA-OD1 3.25Å; S509-D525 WeakPolarHBondContact CA-OD1 3.19Å; V523-D525 PolarHBondContact O-N 2.95Å; D525-W567 VanDerWaalsContact O-CD1 3.26Å
526	L	98.3	Very high	97.5	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.016	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-61.5	156.2	164.1	-64.3	164.7	0	0	0	110.4	L492 R508 V510 M528 I533 A544 W567	L492-L526 HydrophobicContact CB-CD1 4.5Å; R508-L526 WeakPolarHBondContact O-CB 3.47Å; R508-L526 PolarHBondContact O-N 3.33Å; V510-L526 HydrophobicContact CG2-CD1 4.35Å; V510-L526 HydrophobicContact CG2-CD2 4.47Å; V510-L526 HydrophobicContact CG2-CG 3.86Å; L526-M528 PolarHBondContact O-N 3.12Å; L526-M528 VanDerWaalsContact O-N 3.12Å; L526-I533 HydrophobicContact CD1-CD1 3.54Å; L526-A544 HydrophobicContact CD2-CB 3.92Å; L526-W567 HydrophobicContact CD2-CD2 3.8Å; L526-W567 HydrophobicContact CD2-CE3 3.94Å; L526-W567 HydrophobicContact CD2-CG 4.46Å; L526-W567 HydrophobicContact CD2-CH2 4Å; L526-W567 HydrophobicContact CD2-CZ2 3.83Å; L526-W567 HydrophobicContact CD2-CZ3 4.03Å
527	S	97.2	Very high	97.5	Very high	68 Å²	68	41.5 Å²	41.5	48%	0.476	24%	0.239	S	C	.	.	S	Bend	trans	-58.9	-26.1	176.3	56.9	0	0	0	0	113.8	R556 E558	S527-R556 WeakPolarHBondContact OG-CD 3.41Å; S527-E558 WeakPolarHBondContact CB-OE2 3.41Å; S527-E558 PolarHBondContact N-OE2 3.16Å; S527-E558 PolarHBondContact OG-OE1 2.99Å; S527-E558 PolarHBondContact OG-OE2 3.03Å
528	M	96.5	Very high	97.4	Very high	48 Å²	48	36.1 Å²	36.1	24%	0.236	21%	0.21	C	C	.	.	S	Bend	trans	-146.1	160.8	178.4	66.8	175.4	67.1	0	0	113.5	L526 R530 N549 E554	L526-M528 PolarHBondContact O-N 3.12Å; L526-M528 VanDerWaalsContact O-N 3.12Å; M528-R530 HydrophobicContact CG-CG 4.4Å; M528-N549 HydrophobicContact SD-CB 4.38Å; M528-E554 VanDerWaalsContact SD-CD 3.56Å; M528-E554 HydrophobicContact SD-CG 3.85Å
529	G	96.7	Very high	97	Very high	21 Å²	21	34 Å²	34	22%	0.216	21%	0.208	C	C	.	.			trans	-82.9	120	175.2	0	0	0	0	0	112	F507	F507-G529 WeakPolarHBondContact O-CA 3.35Å
530	R	96.9	Very high	96.4	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.194	C	C	.	.			trans	-149.9	153.8	-177.3	51.5	-177.2	-177.9	164.5	-3.2	112.6	G494 F507 M528 I533 A544 G546 Y548 R556 E558	G494-R530 PolarHBondContact N-O 2.97Å; F507-R530 PolarHBondContact O-N 2.83Å; M528-R530 HydrophobicContact CG-CG 4.4Å; R530-I533 HydrophobicContact CG-CD1 3.72Å; R530-I533 HydrophobicContact CG-CG1 3.82Å; R530-A544 PolarHBondContact NH2-O 2.84Å; R530-A544 VanDerWaalsContact NH2-O 3.16Å; R530-G546 WeakPolarHBondContact CD-O 3.19Å; R530-G546 PolarHBondContact NH1-O 3.38Å; R530-Y548 VanDerWaalsContact CA-O 3.27Å; R530-Y548 WeakPolarHBondContact CA-O 3.3Å; R530-R556 PolarHBondContact NH1-O 2.83Å; R530-E558 IonicContact CZ-OE1 3.32Å; R530-E558 IonicContact NE-OE1 2.96Å; R530-E558 IonicContact NH2-OE1 3.54Å; R530-E558 PolarHBondContact NH2-OE1 2.93Å
531	D	96.5	Very high	96.2	Very high	20 Å²	20	31.5 Å²	31.5	11%	0.107	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-123.5	161.6	177.6	77.4	-76.1	0	0	0	113	T495 R506 I533 G547 Y548	T495-D531 HydrophobicContact CG2-CB 3.31Å; R506-D531 HydrophobicContact CG-CB 4.47Å; R506-D531 IonicContact CZ-OD1 2.79Å; R506-D531 IonicContact NE-OD1 3.96Å; R506-D531 PolarHBondContact NE-OD1 3.09Å; R506-D531 IonicContact NH2-OD1 3.78Å; R506-D531 PolarHBondContact NH2-OD1 2.86Å; R506-D531 VanDerWaalsContact NH2-OD1 3.12Å; D531-I533 VanDerWaalsContact C-N 3.27Å; D531-I533 PolarHBondContact O-N 3.28Å; D531-G547 CarbonylContact O-C 3.59Å; D531-G547 WeakPolarHBondContact O-CA 3.4Å; D531-Y548 PolarHBondContact N-O 3.03Å; D531-Y548 PolarHBondContact O-N 2.73Å
532	G	96.8	Very high	96.1	Very high	11 Å²	11	28.3 Å²	28.3	11%	0.113	18%	0.177	C	C	.	.	S	Bend	trans	65.2	34.5	-173.6	0	0	0	0	0	112.2	S479 G579	S479-G532 PolarHBondContact O-N 3.15Å; G532-G579 PolarHBondContact O-N 2.93Å
533	I	98.2	Very high	96.2	Very high	10 Å²	10	23.7 Å²	23.7	5%	0.051	15%	0.153	C	C	.	.			trans	-71.2	129.9	175.7	-53.3	172	0	0	0	108	G481 L492 L526 R530 D531 V535 A544	G481-I533 WeakPolarHBondContact CA-O 3.4Å; L492-I533 HydrophobicContact CB-CD1 4.27Å; L526-I533 HydrophobicContact CD1-CD1 3.54Å; R530-I533 HydrophobicContact CG-CD1 3.72Å; R530-I533 HydrophobicContact CG-CG1 3.82Å; D531-I533 VanDerWaalsContact C-N 3.27Å; D531-I533 PolarHBondContact O-N 3.28Å; I533-V535 HydrophobicContact CG2-CG2 3.98Å; I533-A544 HydrophobicContact CG2-CB 3.85Å
534	A	98.4	Very high	96.2	Very high	6 Å²	6	22.8 Å²	22.8	5%	0.05	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	134.3	170	0	0	0	0	0	108.9	V545 A580 L582	A534-V545 HydrophobicContact CB-CB 4.37Å; A534-V545 PolarHBondContact N-O 2.96Å; A534-V545 PolarHBondContact O-N 2.96Å; A534-A580 HydrophobicContact CB-CB 4.25Å; A534-A580 VanDerWaalsContact CB-O 3.27Å; A534-A580 WeakPolarHBondContact CB-O 3.12Å; A534-L582 HydrophobicContact CB-CD1 3.94Å; A534-L582 HydrophobicContact CB-CD2 4.12Å; A534-L582 HydrophobicContact CB-CG 3.69Å
535	V	98.4	Very high	96.2	Very high	24 Å²	24	21.8 Å²	21.8	15%	0.145	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	135.3	-171.8	-176.7	0	0	0	0	110.2	L492 I533 L542 F543	L492-V535 HydrophobicContact CB-CG2 4.49Å; L492-V535 HydrophobicContact CD1-CG1 4.5Å; L492-V535 HydrophobicContact CD2-CG1 4.27Å; L492-V535 HydrophobicContact CD2-CG2 3.83Å; I533-V535 HydrophobicContact CG2-CG2 3.98Å; V535-L542 HydrophobicContact CG1-CD1 3.64Å; V535-L542 HydrophobicContact CG1-CD2 4.23Å; V535-L542 HydrophobicContact CG1-CG 3.88Å; V535-F543 VanDerWaalsContact CA-O 3.28Å; V535-F543 WeakPolarHBondContact CA-O 3.38Å; V535-F543 WeakPolarHBondContact CG1-O 3.44Å
536	C	97.4	Very high	96.2	Very high	11 Å²	11	18 Å²	18	7%	0.074	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	162.1	172.5	69.1	0	0	0	0	110.9	F543 L582 V584	C536-F543 PolarHBondContact N-O 2.81Å; C536-F543 PolarHBondContact O-N 3.35Å; C536-L582 HydrophobicContact CB-CB 3.87Å; C536-L582 HydrophobicContact CB-CD1 3.8Å; C536-L582 HydrophobicContact CB-CG 4.5Å; C536-L582 VanDerWaalsContact SG-CD1 3.56Å; C536-V584 HydrophobicContact CB-CG2 3.7Å
537	T	95.8	Very high	96.2	Very high	45 Å²	45	17.9 Å²	17.9	28%	0.276	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.8	172.7	-56.1	0	0	0	0	108.5	V484 L485 H541 L542	V484-T537 PolarHBondContact O-OG1 2.93Å; L485-T537 HydrophobicContact CD1-CG2 3.94Å; T537-H541 WeakPolarHBondContact CA-O 3.46Å; T537-L542 WeakPolarHBondContact OG1-CD1 3.41Å
538	L	93.3	Very high	96.2	Very high	2 Å²	2	17.6 Å²	17.6	1%	0.01	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	109.3	179	-176.5	71.4	0	0	0	108.2	V300 V303 Y321 F323 I540 H541 F543 V584	V300-L538 HydrophobicContact CB-CD1 4.08Å; V300-L538 HydrophobicContact CB-CG 4.15Å; V300-L538 HydrophobicContact CG2-CD1 3.83Å; V300-L538 HydrophobicContact CG2-CD2 4.18Å; V300-L538 HydrophobicContact CG2-CG 3.72Å; V300-L538 WeakPolarHBondContact O-CD1 3.44Å; V303-L538 HydrophobicContact CG2-CB 4.39Å; V303-L538 HydrophobicContact CG2-CD1 3.9Å; V303-L538 HydrophobicContact CG2-CD2 3.79Å; V303-L538 HydrophobicContact CG2-CG 4.25Å; Y321-L538 HydrophobicContact CD1-CD2 4.37Å; Y321-L538 HydrophobicContact CE1-CD2 4.4Å; F323-L538 HydrophobicContact CB-CD2 3.82Å; F323-L538 HydrophobicContact CD1-CD2 4.1Å; F323-L538 HydrophobicContact CG-CD2 4.01Å; L538-I540 PolarHBondContact O-N 2.9Å; L538-H541 PolarHBondContact N-O 3.01Å; L538-H541 PolarHBondContact O-N 2.82Å; L538-F543 HydrophobicContact CB-CD2 3.79Å; L538-F543 HydrophobicContact CB-CE2 3.65Å; L538-F543 HydrophobicContact CD2-CE2 3.91Å; L538-F543 HydrophobicContact CD2-CZ 3.97Å; L538-F543 HydrophobicContact CG-CE2 4.3Å; L538-V584 HydrophobicContact CD1-CG1 3.73Å
539	G	88.1	Confident	96.1	Very high	35 Å²	35	17.3 Å²	17.3	36%	0.361	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	-121.7	-168.9	0	0	0	0	0	111.4	V300	V300-G539 VanDerWaalsContact CG1-CA 3.45Å
540	I	87.3	Confident	95.9	Very high	44 Å²	44	17.7 Å²	17.7	23%	0.226	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	9.8	-179.7	60.3	156.7	0	0	0	113.4	R294 P295 L485 L538	R294-I540 HydrophobicContact CB-CD1 4.42Å; R294-I540 HydrophobicContact CG-CD1 3.9Å; P295-I540 HydrophobicContact CG-CG2 4.31Å; L485-I540 WeakPolarHBondContact CD1-O 3.29Å; L538-I540 PolarHBondContact O-N 2.9Å
541	H	93.6	Very high	95.7	Very high	25 Å²	25	24.9 Å²	24.9	12%	0.116	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145	-174.5	-58.7	-60.6	0	0	0	111.4	F323 T537 L538 F543 Y559 Y560 D561	F323-H541 AromaticContact CE1-CD2 3.97Å; F323-H541 AromaticContact CZ-CD2 3.92Å; T537-H541 WeakPolarHBondContact CA-O 3.46Å; L538-H541 PolarHBondContact N-O 3.01Å; L538-H541 PolarHBondContact O-N 2.82Å; H541-F543 HydrophobicContact CB-CD2 4.24Å; H541-F543 HydrophobicContact CB-CE2 3.78Å; H541-Y559 HydrophobicContact CB-CD2 4.05Å; H541-Y559 AromaticContact CG-CD2 3.77Å; H541-Y559 AromaticContact ND1-CD2 3.8Å; H541-Y560 WeakPolarHBondContact CA-O 3.36Å; H541-Y560 PolarHBondContact ND1-O 2.59Å; H541-D561 IonicContact CE1-OD2 2.65Å
542	L	97	Very high	95.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	122.8	171.2	-170.5	74.5	0	0	0	109.3	L485 Y490 L492 V535 T537 Y559 Y560 W567	L485-L542 HydrophobicContact CD2-CB 4.14Å; Y490-L542 HydrophobicContact CD1-CD2 4.19Å; Y490-L542 HydrophobicContact CD2-CD2 4.24Å; Y490-L542 HydrophobicContact CG-CD2 3.74Å; L492-L542 HydrophobicContact CD1-CD2 3.86Å; L492-L542 HydrophobicContact CD2-CD2 4.3Å; V535-L542 HydrophobicContact CG1-CD1 3.64Å; V535-L542 HydrophobicContact CG1-CD2 4.23Å; V535-L542 HydrophobicContact CG1-CG 3.88Å; T537-L542 WeakPolarHBondContact OG1-CD1 3.41Å; L542-Y559 CarbonylContact O-C 3.55Å; L542-Y559 VanDerWaalsContact O-CA 3.27Å; L542-Y559 WeakPolarHBondContact O-CA 3.41Å; L542-Y560 PolarHBondContact O-N 3.18Å; L542-W567 HydrophobicContact CD2-CH2 4.43Å; L542-W567 WeakPolarHBondContact O-CZ3 3.43Å
543	F	98.2	Very high	95.7	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.009	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	137.9	-178.4	-79.9	-108	0	0	0	111.5	Y321 F323 V535 C536 L538 H541 V545 V557 E558 Y559 A570	Y321-F543 HydrophobicContact CD1-CE1 4.5Å; Y321-F543 AromaticContact CE1-CE1 3.72Å; Y321-F543 HydrophobicContact CE1-CE1 3.72Å; Y321-F543 HydrophobicContact CE1-CZ 4.18Å; F323-F543 HydrophobicContact CD2-CZ 4.03Å; F323-F543 HydrophobicContact CE1-CZ 4.48Å; F323-F543 AromaticContact CE2-CZ 3.78Å; F323-F543 HydrophobicContact CE2-CZ 3.78Å; F323-F543 HydrophobicContact CG-CZ 4.49Å; F323-F543 HydrophobicContact CZ-CZ 4.01Å; V535-F543 VanDerWaalsContact CA-O 3.28Å; V535-F543 WeakPolarHBondContact CA-O 3.38Å; V535-F543 WeakPolarHBondContact CG1-O 3.44Å; C536-F543 PolarHBondContact N-O 2.81Å; C536-F543 PolarHBondContact O-N 3.35Å; L538-F543 HydrophobicContact CB-CD2 3.79Å; L538-F543 HydrophobicContact CB-CE2 3.65Å; L538-F543 HydrophobicContact CD2-CE2 3.91Å; L538-F543 HydrophobicContact CD2-CZ 3.97Å; L538-F543 HydrophobicContact CG-CE2 4.3Å; H541-F543 HydrophobicContact CB-CD2 4.24Å; H541-F543 HydrophobicContact CB-CE2 3.78Å; F543-V545 HydrophobicContact CB-CG2 4.39Å; F543-V557 HydrophobicContact CD1-CG1 3.91Å; F543-E558 CarbonylContact C-O 3.57Å; F543-E558 WeakPolarHBondContact CA-O 3.2Å; F543-Y559 HydrophobicContact CE1-CD1 4.4Å; F543-Y559 HydrophobicContact CE1-CG 4.38Å; F543-Y559 HydrophobicContact CZ-CD1 4.43Å; F543-Y559 HydrophobicContact CZ-CG 4.15Å; F543-A570 HydrophobicContact CE1-CB 4.3Å
544	A	98.6	Very high	95.7	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	104.7	174.9	0	0	0	0	0	109.6	L492 L526 R530 I533 V557 E558 W567	L492-A544 HydrophobicContact CD2-CB 3.83Å; L526-A544 HydrophobicContact CD2-CB 3.92Å; R530-A544 PolarHBondContact NH2-O 2.84Å; R530-A544 VanDerWaalsContact NH2-O 3.16Å; I533-A544 HydrophobicContact CG2-CB 3.85Å; A544-V557 WeakPolarHBondContact O-CA 3.49Å; A544-E558 PolarHBondContact N-O 2.89Å; A544-E558 PolarHBondContact O-N 3.49Å; A544-W567 HydrophobicContact CB-CH2 4.01Å; A544-W567 HydrophobicContact CB-CZ3 3.66Å
545	V	98.6	Very high	95.7	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.9	-168.6	177.7	0	0	0	0	110.7	W328 A534 F543 V557 L573 L582	W328-V545 HydrophobicContact CH2-CG1 4.37Å; W328-V545 HydrophobicContact CZ2-CG1 4.39Å; W328-V545 HydrophobicContact CZ2-CG2 4.44Å; A534-V545 HydrophobicContact CB-CB 4.37Å; A534-V545 PolarHBondContact N-O 2.96Å; A534-V545 PolarHBondContact O-N 2.96Å; F543-V545 HydrophobicContact CB-CG2 4.39Å; V545-V557 HydrophobicContact CG1-CG2 4.17Å; V545-V557 HydrophobicContact CG2-CG1 3.88Å; V545-V557 HydrophobicContact CG2-CG2 4.33Å; V545-L573 HydrophobicContact CG1-CD1 3.63Å; V545-L573 HydrophobicContact CG1-CD2 3.9Å; V545-L573 HydrophobicContact CG1-CG 3.93Å; V545-L582 HydrophobicContact CB-CD1 3.96Å; V545-L582 HydrophobicContact CB-CD2 4.28Å; V545-L582 HydrophobicContact CG1-CD2 4.18Å; V545-L582 HydrophobicContact CG2-CD1 3.64Å; V545-L582 HydrophobicContact CG2-CD2 4.31Å
546	G	98.2	Very high	95.6	Very high	1 Å²	1	38 Å²	38	1%	0.01	20%	0.198	C	C	.	.			trans	64.1	-143.2	173.3	0	0	0	0	0	114.3	R530 E554 R556	R530-G546 WeakPolarHBondContact CD-O 3.19Å; R530-G546 PolarHBondContact NH1-O 3.38Å; G546-E554 VanDerWaalsContact CA-O 3.26Å; G546-E554 WeakPolarHBondContact CA-O 3.48Å; G546-R556 PolarHBondContact N-O 2.79Å
547	G	97.8	Very high	95.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.			trans	108.4	-177.1	-176.7	0	0	0	0	0	113.1	D531 Y553 E554 R577	D531-G547 CarbonylContact O-C 3.59Å; D531-G547 WeakPolarHBondContact O-CA 3.4Å; G547-Y553 WeakPolarHBondContact O-CA 3.34Å; G547-E554 PolarHBondContact O-N 3.05Å; G547-R577 PolarHBondContact N-O 2.83Å
548	Y	96.9	Very high	95.8	Very high	61 Å²	61	35.6 Å²	35.6	24%	0.239	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-125.1	125.3	-179.6	-178.5	-110.5	0	0	0	109.9	R506 R530 D531 G550 Q552 Y553	R506-Y548 VanDerWaalsContact CD-O 3.3Å; R506-Y548 WeakPolarHBondContact CD-O 3.13Å; R506-Y548 PolarHBondContact NE-O 2.81Å; R506-Y548 VanDerWaalsContact NH2-CD1 3.29Å; R530-Y548 VanDerWaalsContact CA-O 3.27Å; R530-Y548 WeakPolarHBondContact CA-O 3.3Å; D531-Y548 PolarHBondContact N-O 3.03Å; D531-Y548 PolarHBondContact O-N 2.73Å; Y548-G550 PolarHBondContact OH-O 3.48Å; Y548-Q552 WeakPolarHBondContact CD2-O 3.41Å; Y548-Y553 AromaticContact CD2-CD1 3.73Å; Y548-Y553 HydrophobicContact CD2-CD1 3.73Å; Y548-Y553 AromaticContact CD2-CE1 3.78Å; Y548-Y553 HydrophobicContact CD2-CE1 3.78Å; Y548-Y553 HydrophobicContact CD2-CG 4.21Å; Y548-Y553 HydrophobicContact CE2-CE1 4.43Å; Y548-Y553 HydrophobicContact CG-CD1 4.36Å; Y548-Y553 HydrophobicContact CG-CE1 4.31Å
549	N	95.1	Very high	96	Very high	43 Å²	43	37.7 Å²	37.7	23%	0.23	19%	0.191	C	C	.	.			trans	-90	-3.9	-175.3	74.6	3.2	0	0	0	113.5	R506 M528 I551 Q552 E554	R506-N549 VanDerWaalsContact CD-O 3.25Å; R506-N549 WeakPolarHBondContact CD-O 3.3Å; M528-N549 HydrophobicContact SD-CB 4.38Å; N549-I551 WeakPolarHBondContact OD1-CA 3.42Å; N549-I551 WeakPolarHBondContact OD1-CB 3.32Å; N549-I551 PolarHBondContact OD1-N 3.46Å; N549-Q552 PolarHBondContact N-O 3.21Å; N549-Q552 PolarHBondContact OD1-N 2.85Å; N549-Q552 PolarHBondContact OD1-O 2.81Å; N549-E554 HydrophobicContact CB-CG 4.14Å; N549-E554 VanDerWaalsContact CG-OE1 3.3Å; N549-E554 PolarHBondContact ND2-OE1 2.9Å
550	G	92.7	Very high	96.5	Very high	29 Å²	29	36.2 Å²	36.2	30%	0.299	17%	0.174	S	C	.	.	S	Bend	trans	107.2	-17.2	-174.3	0	0	0	0	0	114.4	R506 Y548	R506-G550 VanDerWaalsContact CZ-CA 3.49Å; Y548-G550 PolarHBondContact OH-O 3.48Å
551	I	93.8	Very high	96.6	Very high	150 Å²	150	34.8 Å²	34.8	77%	0.769	17%	0.167	S	C	*	.	S	Bend	trans	-119.5	-47.4	-178.2	-57.3	173.4	0	0	0	110.2	N549	N549-I551 WeakPolarHBondContact OD1-CA 3.42Å; N549-I551 WeakPolarHBondContact OD1-CB 3.32Å; N549-I551 PolarHBondContact OD1-N 3.46Å
552	Q	95.4	Very high	96.4	Very high	109 Å²	109	35.7 Å²	35.7	51%	0.509	17%	0.171	S	C	.	.	S	Bend	trans	-141.7	161.4	-176.3	68.7	-176.7	11.2	0	0	112.2	Y548 N549 E554	Y548-Q552 WeakPolarHBondContact CD2-O 3.41Å; N549-Q552 PolarHBondContact N-O 3.21Å; N549-Q552 PolarHBondContact OD1-N 2.85Å; N549-Q552 PolarHBondContact OD1-O 2.81Å; Q552-E554 WeakPolarHBondContact CG-OE1 3.49Å; Q552-E554 PolarHBondContact NE2-OE1 2.98Å; Q552-E554 VanDerWaalsContact NE2-OE1 3.13Å
553	Y	97.7	Very high	95.9	Very high	69 Å²	69	39.4 Å²	39.4	27%	0.271	20%	0.197	S	C	.	.	B	Isolated β-bridge	trans	-78	126.9	167.9	-58.7	-72.8	0	0	0	108.9	M309 D310 G547 Y548 G576 A578	M309-Y553 HydrophobicContact CB-CE1 3.93Å; M309-Y553 HydrophobicContact CG-CE1 3.67Å; M309-Y553 HydrophobicContact CG-CE2 4.22Å; M309-Y553 VanDerWaalsContact CG-CZ 3.4Å; M309-Y553 WeakPolarHBondContact CG-OH 3.36Å; M309-Y553 WeakPolarHBondContact O-CD1 3.32Å; M309-Y553 WeakPolarHBondContact O-CE1 3.47Å; D310-Y553 VanDerWaalsContact C-CD2 3.42Å; D310-Y553 WeakPolarHBondContact O-CE2 3.38Å; G547-Y553 WeakPolarHBondContact O-CA 3.34Å; Y548-Y553 AromaticContact CD2-CD1 3.73Å; Y548-Y553 HydrophobicContact CD2-CD1 3.73Å; Y548-Y553 AromaticContact CD2-CE1 3.78Å; Y548-Y553 HydrophobicContact CD2-CE1 3.78Å; Y548-Y553 HydrophobicContact CD2-CG 4.21Å; Y548-Y553 HydrophobicContact CE2-CE1 4.43Å; Y548-Y553 HydrophobicContact CG-CD1 4.36Å; Y548-Y553 HydrophobicContact CG-CE1 4.31Å; Y553-G576 WeakPolarHBondContact CB-O 3.3Å; Y553-A578 HydrophobicContact CD1-CB 3.69Å; Y553-A578 HydrophobicContact CE1-CB 4.03Å
554	E	97.6	Very high	95.5	Very high	14 Å²	14	44.5 Å²	44.5	7%	0.065	22%	0.221	C	C	.	.			trans	-85.6	139.4	-172.6	-71	-63.3	144.1	0	0	111.4	M528 G546 G547 N549 Q552 G576 R577	M528-E554 VanDerWaalsContact SD-CD 3.56Å; M528-E554 HydrophobicContact SD-CG 3.85Å; G546-E554 VanDerWaalsContact CA-O 3.26Å; G546-E554 WeakPolarHBondContact CA-O 3.48Å; G547-E554 PolarHBondContact O-N 3.05Å; N549-E554 HydrophobicContact CB-CG 4.14Å; N549-E554 VanDerWaalsContact CG-OE1 3.3Å; N549-E554 PolarHBondContact ND2-OE1 2.9Å; Q552-E554 WeakPolarHBondContact CG-OE1 3.49Å; Q552-E554 PolarHBondContact NE2-OE1 2.98Å; Q552-E554 VanDerWaalsContact NE2-OE1 3.13Å; E554-G576 VanDerWaalsContact O-CA 3.24Å; E554-G576 WeakPolarHBondContact O-CA 3.36Å; E554-R577 PolarHBondContact O-N 2.86Å
555	E	97.6	Very high	95.4	Very high	97 Å²	97	48 Å²	48	45%	0.453	24%	0.24	S	C	.	.			trans	-88.5	-15	168	-68	163.9	-165.1	0	0	111.6	V557 S572 L573 G576	E555-V557 PolarHBondContact O-N 2.85Å; E555-S572 CarbonylContact O-C 3.46Å; E555-S572 VanDerWaalsContact O-CA 3.3Å; E555-S572 WeakPolarHBondContact O-CA 3.3Å; E555-S572 WeakPolarHBondContact O-CB 3.33Å; E555-L573 HydrophobicContact CB-CB 4.44Å; E555-L573 PolarHBondContact O-N 3.3Å; E555-G576 VanDerWaalsContact CG-CA 3.44Å
556	R	98	Very high	95.3	Very high	57 Å²	57	53 Å²	53	22%	0.215	26%	0.263	C	S	.	.			trans	-58	132.8	-171.1	177.7	167.9	-69.7	-83	-18.5	112.6	S527 R530 G546 E558 E569	S527-R556 WeakPolarHBondContact OG-CD 3.41Å; R530-R556 PolarHBondContact NH1-O 2.83Å; G546-R556 PolarHBondContact N-O 2.79Å; R556-E558 HydrophobicContact CG-CG 3.99Å; R556-E569 IonicContact CZ-OE1 2.86Å; R556-E569 IonicContact CZ-OE2 3.12Å; R556-E569 IonicContact NH1-OE1 3.42Å; R556-E569 PolarHBondContact NH1-OE1 3.3Å; R556-E569 IonicContact NH1-OE2 2.73Å; R556-E569 PolarHBondContact NH1-OE2 2.8Å; R556-E569 IonicContact NH2-OE1 2.99Å; R556-E569 PolarHBondContact NH2-OE1 2.76Å; R556-E569 IonicContact NH2-OE2 3.16Å; R556-E569 PolarHBondContact NH2-OE2 3.15Å
557	V	98.4	Very high	95.3	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.2	170.6	-175.3	0	0	0	0	108.8	W328 F543 A544 V545 E555 A570 K571 L573	W328-V557 HydrophobicContact CZ2-CG2 4.03Å; F543-V557 HydrophobicContact CD1-CG1 3.91Å; A544-V557 WeakPolarHBondContact O-CA 3.49Å; V545-V557 HydrophobicContact CG1-CG2 4.17Å; V545-V557 HydrophobicContact CG2-CG1 3.88Å; V545-V557 HydrophobicContact CG2-CG2 4.33Å; E555-V557 PolarHBondContact O-N 2.85Å; V557-A570 HydrophobicContact CB-CB 4.22Å; V557-A570 HydrophobicContact CG1-CB 3.94Å; V557-A570 PolarHBondContact O-N 3.06Å; V557-K571 WeakPolarHBondContact CG2-O 3.49Å; V557-K571 WeakPolarHBondContact CB-O 3.29Å; V557-L573 HydrophobicContact CG2-CG 4.1Å
558	E	98.4	Very high	95.3	Very high	6 Å²	6	57.5 Å²	57.5	3%	0.028	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	147.2	175.5	-63.3	168	-90	0	0	108.7	S527 R530 F543 A544 R556 W567 F568	S527-E558 WeakPolarHBondContact CB-OE2 3.41Å; S527-E558 PolarHBondContact N-OE2 3.16Å; S527-E558 PolarHBondContact OG-OE1 2.99Å; S527-E558 PolarHBondContact OG-OE2 3.03Å; R530-E558 IonicContact CZ-OE1 3.32Å; R530-E558 IonicContact NE-OE1 2.96Å; R530-E558 IonicContact NH2-OE1 3.54Å; R530-E558 PolarHBondContact NH2-OE1 2.93Å; F543-E558 CarbonylContact C-O 3.57Å; F543-E558 WeakPolarHBondContact CA-O 3.2Å; A544-E558 PolarHBondContact N-O 2.89Å; A544-E558 PolarHBondContact O-N 3.49Å; R556-E558 HydrophobicContact CG-CG 3.99Å; E558-W567 HydrophobicContact CB-CE3 3.71Å; E558-W567 HydrophobicContact CB-CZ3 4.33Å; E558-F568 CarbonylContact C-O 3.52Å; E558-F568 WeakPolarHBondContact CA-O 3.29Å
559	Y	97.3	Very high	95.3	Very high	47 Å²	47	60 Å²	60	18%	0.184	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.8	170.6	70.9	-89.2	0	0	0	110.9	H541 L542 F543 W567 F568 A570	H541-Y559 HydrophobicContact CB-CD2 4.05Å; H541-Y559 AromaticContact CG-CD2 3.77Å; H541-Y559 AromaticContact ND1-CD2 3.8Å; L542-Y559 CarbonylContact O-C 3.55Å; L542-Y559 VanDerWaalsContact O-CA 3.27Å; L542-Y559 WeakPolarHBondContact O-CA 3.41Å; F543-Y559 HydrophobicContact CE1-CD1 4.4Å; F543-Y559 HydrophobicContact CE1-CG 4.38Å; F543-Y559 HydrophobicContact CZ-CD1 4.43Å; F543-Y559 HydrophobicContact CZ-CG 4.15Å; Y559-W567 CarbonylContact O-C 3.49Å; Y559-W567 WeakPolarHBondContact O-CA 3.5Å; Y559-W567 VanDerWaalsContact C-CE3 3.49Å; Y559-F568 PolarHBondContact N-O 2.63Å; Y559-F568 WeakPolarHBondContact OH-CB 3.26Å; Y559-F568 PolarHBondContact O-N 3.17Å; Y559-F568 AromaticContact CZ-CG 3.87Å; Y559-F568 HydrophobicContact CG-CB 4.38Å; Y559-F568 HydrophobicContact CE2-CG 4.04Å; Y559-F568 HydrophobicContact CE2-CD2 3.85Å; Y559-F568 HydrophobicContact CE2-CB 3.74Å; Y559-F568 HydrophobicContact CE1-CG 4.47Å; Y559-F568 VanDerWaalsContact CE1-CB 3.43Å; Y559-F568 HydrophobicContact CE1-CB 3.43Å; Y559-F568 HydrophobicContact CD1-CB 3.98Å; Y559-F568 HydrophobicContact CD2-CD2 4.44Å; Y559-F568 HydrophobicContact CD2-CB 4.27Å; Y559-F568 AromaticContact CE2-CD2 3.85Å; Y559-A570 HydrophobicContact CD1-CB 4.05Å
560	Y	97.8	Very high	95.4	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.016	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	130.5	-177.1	179	-110.8	0	0	0	110.8	L485 Y490 A524 H541 L542 E562 N565 E566 W567	L485-Y560 HydrophobicContact CD2-CD1 4.08Å; Y490-Y560 HydrophobicContact CE1-CD1 4.21Å; Y490-Y560 AromaticContact CE1-CE1 3.69Å; Y490-Y560 HydrophobicContact CE1-CE1 3.69Å; A524-Y560 HydrophobicContact CB-CE2 4.33Å; H541-Y560 WeakPolarHBondContact CA-O 3.36Å; H541-Y560 PolarHBondContact ND1-O 2.59Å; L542-Y560 PolarHBondContact O-N 3.18Å; Y560-E562 HydrophobicContact CD1-CB 4.45Å; Y560-E562 HydrophobicContact CE1-CB 3.83Å; Y560-E562 HydrophobicContact CE1-CG 4.22Å; Y560-N565 PolarHBondContact OH-OD1 3.13Å; Y560-E566 WeakPolarHBondContact CA-O 3.46Å; Y560-E566 WeakPolarHBondContact CD2-O 3.49Å; Y560-W567 HydrophobicContact CD2-CD2 4.13Å; Y560-W567 AromaticContact CD2-CE2 3.78Å; Y560-W567 HydrophobicContact CD2-CG 4.27Å; Y560-W567 HydrophobicContact CD2-CZ2 4.2Å; Y560-W567 AromaticContact CD2-NE1 3.72Å; Y560-W567 HydrophobicContact CG-CD2 4.45Å; Y560-W567 HydrophobicContact CG-CH2 4.46Å; Y560-W567 HydrophobicContact CG-CZ2 4.14Å
561	D	90.6	Very high	95.7	Very high	13 Å²	13	62.2 Å²	62.2	7%	0.07	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	112.8	166.3	-168.2	-51.4	0	0	0	109.1	H541 S563 E564 N565 E566 F568	H541-D561 IonicContact CE1-OD2 2.65Å; D561-S563 VanDerWaalsContact C-N 3.26Å; D561-S563 PolarHBondContact OD1-OG 3.25Å; D561-S563 PolarHBondContact OD1-N 3.2Å; D561-S563 WeakPolarHBondContact OD1-CB 3.28Å; D561-S563 WeakPolarHBondContact OD1-CA 3.32Å; D561-S563 VanDerWaalsContact OD1-CB 3.31Å; D561-S563 PolarHBondContact O-N 2.82Å; D561-E564 HydrophobicContact CB-CB 4.41Å; D561-E564 PolarHBondContact O-N 3.22Å; D561-E564 PolarHBondContact OD1-N 2.85Å; D561-N565 WeakPolarHBondContact O-CA 3.48Å; D561-N565 PolarHBondContact O-N 3.41Å; D561-E566 PolarHBondContact N-O 2.74Å; D561-E566 PolarHBondContact O-N 2.96Å; D561-F568 HydrophobicContact CB-CD2 4.29Å; D561-F568 HydrophobicContact CB-CE2 3.85Å
562	E	89.3	Confident	95.9	Very high	44 Å²	44	57 Å²	57	21%	0.206	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-28	-179.7	-172.8	179.5	-139	0	0	112.8	L485 N486 Y490 R512 Y560 E564 N565	L485-E562 HydrophobicContact CD2-CB 4.16Å; N486-E562 VanDerWaalsContact CB-OE2 3.31Å; N486-E562 WeakPolarHBondContact CB-OE2 3.34Å; N486-E562 PolarHBondContact ND2-OE2 3.29Å; Y490-E562 PolarHBondContact OH-OE1 3.04Å; R512-E562 IonicContact NH1-OE1 2.73Å; R512-E562 PolarHBondContact NH1-OE1 2.87Å; Y560-E562 HydrophobicContact CD1-CB 4.45Å; Y560-E562 HydrophobicContact CE1-CB 3.83Å; Y560-E562 HydrophobicContact CE1-CG 4.22Å; E562-E564 VanDerWaalsContact C-N 3.34Å; E562-N565 PolarHBondContact O-N 3.48Å
563	S	86	Confident	96	Very high	79 Å²	79	52 Å²	52	55%	0.552	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-30.4	-179	69.2	0	0	0	0	112.7	R294 D561	R294-S563 PolarHBondContact NH2-OG 3.27Å; R294-S563 VanDerWaalsContact NH2-OG 3.15Å; D561-S563 VanDerWaalsContact C-N 3.26Å; D561-S563 PolarHBondContact OD1-OG 3.25Å; D561-S563 PolarHBondContact OD1-N 3.2Å; D561-S563 WeakPolarHBondContact OD1-CB 3.28Å; D561-S563 WeakPolarHBondContact OD1-CA 3.32Å; D561-S563 VanDerWaalsContact OD1-CB 3.31Å; D561-S563 PolarHBondContact O-N 2.82Å
564	E	90.7	Very high	95.9	Very high	109 Å²	109	52.2 Å²	52.2	51%	0.509	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-17.5	176.3	-58.9	-174.7	-173.6	0	0	111.6	D561 E562 E566 F568	D561-E564 HydrophobicContact CB-CB 4.41Å; D561-E564 PolarHBondContact O-N 3.22Å; D561-E564 PolarHBondContact OD1-N 2.85Å; E562-E564 VanDerWaalsContact C-N 3.34Å; E564-E566 VanDerWaalsContact C-N 3.26Å; E564-E566 HydrophobicContact CB-CB 4.34Å; E564-E566 HydrophobicContact CB-CG 4.49Å; E564-F568 WeakPolarHBondContact OE2-CZ 3.44Å
565	N	95	Very high	95.7	Very high	72 Å²	72	53.8 Å²	53.8	39%	0.385	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	50.8	-169.2	176.1	50.9	0	0	0	110.1	V523 A524 Y560 D561 E562	V523-N565 WeakPolarHBondContact CB-OD1 3.35Å; A524-N565 WeakPolarHBondContact CB-O 3.4Å; A524-N565 PolarHBondContact N-OD1 3.16Å; Y560-N565 PolarHBondContact OH-OD1 3.13Å; D561-N565 WeakPolarHBondContact O-CA 3.48Å; D561-N565 PolarHBondContact O-N 3.41Å; E562-N565 PolarHBondContact O-N 3.48Å
566	E	97.6	Very high	95.6	Very high	109 Å²	109	49.4 Å²	49.4	51%	0.509	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	153.7	-179.9	-70.4	-164.6	175.8	0	0	111.4	Y560 D561 E564 F568	Y560-E566 WeakPolarHBondContact CA-O 3.46Å; Y560-E566 WeakPolarHBondContact CD2-O 3.49Å; D561-E566 PolarHBondContact N-O 2.74Å; D561-E566 PolarHBondContact O-N 2.96Å; E564-E566 VanDerWaalsContact C-N 3.26Å; E564-E566 HydrophobicContact CB-CB 4.34Å; E564-E566 HydrophobicContact CB-CG 4.49Å; E566-F568 HydrophobicContact CB-CE2 3.98Å; E566-F568 HydrophobicContact CB-CZ 4.11Å
567	W	98.2	Very high	95.6	Very high	33 Å²	33	46.8 Å²	46.8	13%	0.125	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	131.9	174.4	-72.4	93.2	0	0	0	109.9	L492 V510 A524 D525 L526 L542 A544 E558 Y559 Y560	L492-W567 HydrophobicContact CD2-CH2 3.46Å; L492-W567 VanDerWaalsContact CD2-CH2 3.46Å; L492-W567 HydrophobicContact CD2-CZ2 3.94Å; L492-W567 HydrophobicContact CD2-CZ3 4.44Å; L492-W567 HydrophobicContact CG-CH2 4.32Å; L492-W567 HydrophobicContact CG-CZ2 4.33Å; V510-W567 HydrophobicContact CG1-CZ2 4.36Å; V510-W567 HydrophobicContact CG2-CZ2 3.93Å; A524-W567 PolarHBondContact O-NE1 3.33Å; D525-W567 VanDerWaalsContact O-CD1 3.26Å; L526-W567 HydrophobicContact CD2-CD2 3.8Å; L526-W567 HydrophobicContact CD2-CE3 3.94Å; L526-W567 HydrophobicContact CD2-CG 4.46Å; L526-W567 HydrophobicContact CD2-CH2 4Å; L526-W567 HydrophobicContact CD2-CZ2 3.83Å; L526-W567 HydrophobicContact CD2-CZ3 4.03Å; L542-W567 HydrophobicContact CD2-CH2 4.43Å; L542-W567 WeakPolarHBondContact O-CZ3 3.43Å; A544-W567 HydrophobicContact CB-CH2 4.01Å; A544-W567 HydrophobicContact CB-CZ3 3.66Å; E558-W567 HydrophobicContact CB-CE3 3.71Å; E558-W567 HydrophobicContact CB-CZ3 4.33Å; Y559-W567 CarbonylContact O-C 3.49Å; Y559-W567 WeakPolarHBondContact O-CA 3.5Å; Y559-W567 VanDerWaalsContact C-CE3 3.49Å; Y560-W567 HydrophobicContact CD2-CD2 4.13Å; Y560-W567 AromaticContact CD2-CE2 3.78Å; Y560-W567 HydrophobicContact CD2-CG 4.27Å; Y560-W567 HydrophobicContact CD2-CZ2 4.2Å; Y560-W567 AromaticContact CD2-NE1 3.72Å; Y560-W567 HydrophobicContact CG-CD2 4.45Å; Y560-W567 HydrophobicContact CG-CH2 4.46Å; Y560-W567 HydrophobicContact CG-CZ2 4.14Å
568	F	97.5	Very high	95.6	Very high	62 Å²	62	47.5 Å²	47.5	27%	0.272	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	146.7	178.4	-64.6	-85.3	0	0	0	110.6	E558 Y559 D561 E564 E566	E558-F568 CarbonylContact C-O 3.52Å; E558-F568 WeakPolarHBondContact CA-O 3.29Å; Y559-F568 PolarHBondContact N-O 2.63Å; Y559-F568 WeakPolarHBondContact OH-CB 3.26Å; Y559-F568 PolarHBondContact O-N 3.17Å; Y559-F568 AromaticContact CZ-CG 3.87Å; Y559-F568 HydrophobicContact CG-CB 4.38Å; Y559-F568 HydrophobicContact CE2-CG 4.04Å; Y559-F568 HydrophobicContact CE2-CD2 3.85Å; Y559-F568 HydrophobicContact CE2-CB 3.74Å; Y559-F568 HydrophobicContact CE1-CG 4.47Å; Y559-F568 VanDerWaalsContact CE1-CB 3.43Å; Y559-F568 HydrophobicContact CE1-CB 3.43Å; Y559-F568 HydrophobicContact CD1-CB 3.98Å; Y559-F568 HydrophobicContact CD2-CD2 4.44Å; Y559-F568 HydrophobicContact CD2-CB 4.27Å; Y559-F568 AromaticContact CE2-CD2 3.85Å; D561-F568 HydrophobicContact CB-CD2 4.29Å; D561-F568 HydrophobicContact CB-CE2 3.85Å; E564-F568 WeakPolarHBondContact OE2-CZ 3.44Å; E566-F568 HydrophobicContact CB-CE2 3.98Å; E566-F568 HydrophobicContact CB-CZ 4.11Å
569	E	97.4	Very high	95.5	Very high	115 Å²	115	48.8 Å²	48.8	54%	0.537	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	128.2	176.8	-172.5	159.5	-175.4	0	0	110.5	R556	R556-E569 IonicContact CZ-OE1 2.86Å; R556-E569 IonicContact CZ-OE2 3.12Å; R556-E569 IonicContact NH1-OE1 3.42Å; R556-E569 PolarHBondContact NH1-OE1 3.3Å; R556-E569 IonicContact NH1-OE2 2.73Å; R556-E569 PolarHBondContact NH1-OE2 2.8Å; R556-E569 IonicContact NH2-OE1 2.99Å; R556-E569 PolarHBondContact NH2-OE1 2.76Å; R556-E569 IonicContact NH2-OE2 3.16Å; R556-E569 PolarHBondContact NH2-OE2 3.15Å
570	A	96.8	Very high	95.5	Very high	6 Å²	6	47.1 Å²	47.1	5%	0.05	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	175.3	167.6	0	0	0	0	0	109.9	F543 V557 Y559 S572	F543-A570 HydrophobicContact CE1-CB 4.3Å; V557-A570 HydrophobicContact CB-CB 4.22Å; V557-A570 HydrophobicContact CG1-CB 3.94Å; V557-A570 PolarHBondContact O-N 3.06Å; Y559-A570 HydrophobicContact CD1-CB 4.05Å; A570-S572 PolarHBondContact O-N 3.24Å
571	K	97.9	Very high	95.5	Very high	112 Å²	112	48 Å²	48	49%	0.487	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-55.4	129.3	174.8	-171.6	73.2	175.1	-173	0	110.7	Y321 N326 W328 V557	Y321-K571 HydrophobicContact CE2-CB 4.2Å; N326-K571 WeakPolarHBondContact O-CB 3.3Å; N326-K571 VanDerWaalsContact O-CG 3.3Å; N326-K571 WeakPolarHBondContact O-CG 3.49Å; N326-K571 VanDerWaalsContact OD1-CB 3.24Å; N326-K571 WeakPolarHBondContact OD1-CB 3.44Å; N326-K571 PolarHBondContact OD1-N 3.41Å; W328-K571 VanDerWaalsContact CD1-O 3.24Å; W328-K571 PolarHBondContact NE1-O 2.96Å; V557-K571 WeakPolarHBondContact CG2-O 3.49Å; V557-K571 WeakPolarHBondContact CB-O 3.29Å
572	S	97.9	Very high	95.9	Very high	40 Å²	40	48.4 Å²	48.4	28%	0.28	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-61.6	148	172.9	-58.7	0	0	0	0	112	E555 A570	E555-S572 CarbonylContact O-C 3.46Å; E555-S572 VanDerWaalsContact O-CA 3.3Å; E555-S572 WeakPolarHBondContact O-CA 3.3Å; E555-S572 WeakPolarHBondContact O-CB 3.33Å; A570-S572 PolarHBondContact O-N 3.24Å
573	L	97.4	Very high	96.2	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.021	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-54.5	155	168	-70	169.7	0	0	0	111	C305 E319 W328 V545 E555 V557 V575 R577	C305-L573 HydrophobicContact CB-CD2 4.27Å; E319-L573 WeakPolarHBondContact OE2-CD2 3.44Å; W328-L573 HydrophobicContact CD2-CD2 3.74Å; W328-L573 HydrophobicContact CE3-CD2 3.75Å; W328-L573 HydrophobicContact CG-CD2 4.48Å; W328-L573 HydrophobicContact CH2-CD2 3.72Å; W328-L573 HydrophobicContact CZ2-CD2 3.71Å; W328-L573 HydrophobicContact CZ3-CD2 3.74Å; V545-L573 HydrophobicContact CG1-CD1 3.63Å; V545-L573 HydrophobicContact CG1-CD2 3.9Å; V545-L573 HydrophobicContact CG1-CG 3.93Å; E555-L573 HydrophobicContact CB-CB 4.44Å; E555-L573 PolarHBondContact O-N 3.3Å; V557-L573 HydrophobicContact CG2-CG 4.1Å; L573-V575 VanDerWaalsContact C-N 3.29Å; L573-R577 HydrophobicContact CD1-CG 3.83Å
574	C	95.6	Very high	96.6	Very high	73 Å²	73	44.5 Å²	44.5	49%	0.493	24%	0.243	S	C	.	.	S	Bend	trans	-68.3	-31.2	172	-56.1	0	0	0	0	112.1	E319	E319-C574 PolarHBondContact OE2-N 2.71Å
575	V	93.9	Very high	96.6	Very high	47 Å²	47	39.9 Å²	39.9	29%	0.285	22%	0.222	S	C	.	.	S	Bend	trans	-135.5	124.9	179.4	-177.7	0	0	0	0	111.1	D310 E319 L573 R577	D310-V575 HydrophobicContact CB-CG1 4.02Å; E319-V575 PolarHBondContact OE1-N 2.8Å; E319-V575 VanDerWaalsContact OE1-N 3.14Å; L573-V575 VanDerWaalsContact C-N 3.29Å; V575-R577 PolarHBondContact O-N 2.84Å; V575-R577 PolarHBondContact O-NE 2.83Å
576	G	97	Very high	96.1	Very high	6 Å²	6	38.6 Å²	38.6	6%	0.062	22%	0.218	C	C	.	.			trans	-64.3	129.7	177.2	0	0	0	0	0	112.2	D310 Y553 E554 E555	D310-G576 WeakPolarHBondContact CB-O 3.24Å; Y553-G576 WeakPolarHBondContact CB-O 3.3Å; E554-G576 VanDerWaalsContact O-CA 3.24Å; E554-G576 WeakPolarHBondContact O-CA 3.36Å; E555-G576 VanDerWaalsContact CG-CA 3.44Å
577	R	97.8	Very high	95.1	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.008	20%	0.204	C	C	.	.			trans	-152.3	147.7	-172	58.8	-174.6	69.8	-161.7	10.3	112.6	G307 M309 A317 E319 G547 E554 L573 V575 A580	G307-R577 WeakPolarHBondContact O-CD 3.44Å; G307-R577 PolarHBondContact O-NH1 2.73Å; M309-R577 CarbonylContact O-C 3.6Å; M309-R577 VanDerWaalsContact O-CA 3.24Å; M309-R577 WeakPolarHBondContact O-CA 3.33Å; A317-R577 PolarHBondContact O-NH1 3Å; A317-R577 PolarHBondContact O-NH2 3.19Å; E319-R577 IonicContact OE1-CZ 3.6Å; E319-R577 IonicContact OE1-NE 3.77Å; E319-R577 IonicContact OE1-NH2 3.93Å; E319-R577 PolarHBondContact OE1-NH2 2.75Å; G547-R577 PolarHBondContact N-O 2.83Å; E554-R577 PolarHBondContact O-N 2.86Å; L573-R577 HydrophobicContact CD1-CG 3.83Å; V575-R577 PolarHBondContact O-N 2.84Å; V575-R577 PolarHBondContact O-NE 2.83Å; R577-A580 HydrophobicContact CG-CB 4.15Å
578	A	97.6	Very high	93.2	Very high	14 Å²	14	40.8 Å²	40.8	12%	0.116	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-124.3	142.5	175.3	0	0	0	0	0	112.6	G308 M309 Y553 A580	G308-A578 CarbonylContact C-O 3.56Å; G308-A578 VanDerWaalsContact CA-O 3.28Å; G308-A578 WeakPolarHBondContact CA-O 3.28Å; M309-A578 PolarHBondContact N-O 3.45Å; M309-A578 PolarHBondContact O-N 2.92Å; Y553-A578 HydrophobicContact CD1-CB 3.69Å; Y553-A578 HydrophobicContact CE1-CB 4.03Å; A578-A580 VanDerWaalsContact C-N 3.32Å
579	G	96.4	Very high	90.8	Very high	34 Å²	34	40.6 Å²	40.6	35%	0.351	25%	0.247	S	C	.	.	S	Bend	trans	70.5	30.4	-176.2	0	0	0	0	0	112.9	G532	G532-G579 PolarHBondContact O-N 2.93Å
580	A	97.7	Very high	88.2	Confident	12 Å²	12	36.3 Å²	36.3	10%	0.099	23%	0.234	C	C	.	.			trans	-74.3	166.2	168.9	0	0	0	0	0	110.6	L306 G307 A534 R577 A578	L306-A580 WeakPolarHBondContact O-CA 3.48Å; G307-A580 WeakPolarHBondContact O-CB 3.16Å; A534-A580 HydrophobicContact CB-CB 4.25Å; A534-A580 VanDerWaalsContact CB-O 3.27Å; A534-A580 WeakPolarHBondContact CB-O 3.12Å; R577-A580 HydrophobicContact CG-CB 4.15Å; A578-A580 VanDerWaalsContact C-N 3.32Å
581	C	97.9	Very high	85.4	Confident	21 Å²	21	40.6 Å²	40.6	14%	0.142	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	147.2	174.2	-57	0	0	0	0	110.5	L306 F341 I343	L306-C581 PolarHBondContact N-O 2.94Å; L306-C581 PolarHBondContact O-N 2.76Å; F341-C581 HydrophobicContact CE2-CB 4.25Å; F341-C581 PolarHBondContact O-SG 3.04Å; I343-C581 HydrophobicContact CB-CB 4.23Å; I343-C581 HydrophobicContact CD1-CB 3.43Å; I343-C581 VanDerWaalsContact CD1-CB 3.43Å; I343-C581 HydrophobicContact CG1-CB 3.63Å; I343-C581 HydrophobicContact CG2-CB 3.65Å
582	L	97.7	Very high	82.5	Confident	23 Å²	23	39.8 Å²	39.8	12%	0.12	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.2	-178.4	-57.3	178.4	0	0	0	111.5	V303 Y304 C305 I343 A534 C536 V545	V303-L582 HydrophobicContact CG1-CB 4.1Å; V303-L582 HydrophobicContact CG1-CD1 4.45Å; V303-L582 HydrophobicContact CG1-CD2 4.05Å; V303-L582 HydrophobicContact CG1-CG 4.41Å; Y304-L582 CarbonylContact O-C 3.58Å; Y304-L582 VanDerWaalsContact O-CA 3.25Å; Y304-L582 WeakPolarHBondContact O-CA 3.43Å; C305-L582 HydrophobicContact CB-CD2 3.67Å; I343-L582 VanDerWaalsContact CD1-C 3.41Å; I343-L582 WeakPolarHBondContact CD1-O 3.35Å; A534-L582 HydrophobicContact CB-CD1 3.94Å; A534-L582 HydrophobicContact CB-CD2 4.12Å; A534-L582 HydrophobicContact CB-CG 3.69Å; C536-L582 HydrophobicContact CB-CB 3.87Å; C536-L582 HydrophobicContact CB-CD1 3.8Å; C536-L582 HydrophobicContact CB-CG 4.5Å; C536-L582 VanDerWaalsContact SG-CD1 3.56Å; V545-L582 HydrophobicContact CB-CD1 3.96Å; V545-L582 HydrophobicContact CB-CD2 4.28Å; V545-L582 HydrophobicContact CG1-CD2 4.18Å; V545-L582 HydrophobicContact CG2-CD1 3.64Å; V545-L582 HydrophobicContact CG2-CD2 4.31Å
583	A	96.2	Very high	79.5	Confident	4 Å²	4	42.9 Å²	42.9	3%	0.033	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	136.9	168.3	0	0	0	0	0	109.4	V303 Y304 I343 I350	V303-A583 CarbonylContact C-O 3.49Å; V303-A583 WeakPolarHBondContact CA-O 3.09Å; Y304-A583 PolarHBondContact N-O 2.96Å; Y304-A583 PolarHBondContact O-N 2.83Å; I343-A583 HydrophobicContact CD1-CB 4.11Å; I350-A583 HydrophobicContact CD1-CB 3.56Å; I350-A583 HydrophobicContact CG1-CB 3.94Å; I350-A583 HydrophobicContact CG2-CB 4.43Å
584	V	94.5	Very high	76.3	Confident	37 Å²	37	48.8 Å²	48.8	22%	0.224	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	107.7	178.7	-176.2	0	0	0	0	108.3	V303 Q345 C536 L538	V303-V584 HydrophobicContact CG2-CG2 4.28Å; Q345-V584 PolarHBondContact NE2-O 2.82Å; Q345-V584 PolarHBondContact OE1-O 3.31Å; C536-V584 HydrophobicContact CB-CG2 3.7Å; L538-V584 HydrophobicContact CD1-CG1 3.73Å
585	V	91.3	Very high	73.2	Confident	12 Å²	12	54.9 Å²	54.9	7%	0.073	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	116.2	178.5	178.2	0	0	0	0	108.5	G301 T302 Y304 Y370	G301-V585 CarbonylContact C-O 3.49Å; G301-V585 WeakPolarHBondContact CA-O 3.33Å; T302-V585 PolarHBondContact N-O 2.85Å; T302-V585 PolarHBondContact O-N 3.43Å; Y304-V585 HydrophobicContact CD2-CB 4.38Å; Y304-V585 HydrophobicContact CD2-CG2 3.72Å; Y304-V585 HydrophobicContact CE2-CB 3.91Å; Y304-V585 HydrophobicContact CE2-CG2 3.51Å; Y370-V585 HydrophobicContact CD1-CG2 4.38Å; Y370-V585 HydrophobicContact CE1-CG1 4.42Å; Y370-V585 HydrophobicContact CE1-CG2 4.05Å; Y370-V585 HydrophobicContact CE2-CG1 3.69Å; Y370-V585 HydrophobicContact CE2-CG2 4.25Å; Y370-V585 WeakPolarHBondContact OH-CG1 3.3Å
586	P	83.4	Confident	72.2	Confident	44 Å²	44	55.3 Å²	55.3	29%	0.286	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-64.1	147.9	178	26.7	-32.8	0	0	0	110.8
587	T	76.4	Confident	70.9	Confident	37 Å²	37	57.9 Å²	57.9	23%	0.227	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-60.1	146.6	169.6	-21.8	0	0	0	0	108.8	S298 T299 G301 G589 G590	S298-T587 PolarHBondContact O-OG1 3.04Å; T299-T587 PolarHBondContact O-OG1 3.36Å; G301-T587 WeakPolarHBondContact CA-OG1 3.49Å; G301-T587 PolarHBondContact N-OG1 3.16Å; G301-T587 VanDerWaalsContact N-OG1 3.09Å; T587-G589 VanDerWaalsContact O-N 3.1Å; T587-G589 PolarHBondContact O-N 2.83Å; T587-G590 PolarHBondContact O-N 3.39Å
588	Q	59.4	Low	69.4	Low	151 Å²	151	61 Å²	61	71%	0.706	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	122.3	176.3	-70.8	-172.4	-7	0	0	109.9
589	G	46.6	Very low	67.7	Low	58 Å²	58	63.8 Å²	63.8	60%	0.598	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.3	-11.7	-175.7	0	0	0	0	0	115.3	T587 L591	T587-G589 VanDerWaalsContact O-N 3.1Å; T587-G589 PolarHBondContact O-N 2.83Å; G589-L591 PolarHBondContact O-N 2.77Å
590	G	42.4	Very low	65.9	Low	25 Å²	25	65.6 Å²	65.6	26%	0.258	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-66.4	126.4	174.1	0	0	0	0	0	111.3	T587 N592	T587-G590 PolarHBondContact O-N 3.39Å; G590-N592 PolarHBondContact O-N 3.33Å; G590-N592 VanDerWaalsContact O-N 3.14Å
591	L	39.3	Very low	63.8	Low	97 Å²	97	69.2 Å²	69.2	51%	0.508	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-51.8	120.2	167.7	-77.5	155.6	0	0	0	108.4	G589 A593	G589-L591 PolarHBondContact O-N 2.77Å; L591-A593 PolarHBondContact O-N 3.43Å
592	N	35.9	Very low	61.3	Low	95 Å²	95	72.6 Å²	72.6	51%	0.508	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-49.7	127	171.6	-79.7	-13.8	0	0	0	108.4	G590 E594	G590-N592 PolarHBondContact O-N 3.33Å; G590-N592 VanDerWaalsContact O-N 3.14Å; N592-E594 PolarHBondContact O-N 2.73Å
593	A	34.9	Very low	58.5	Low	105 Å²	105	76.5 Å²	76.5	87%	0.868	44%	0.436	S	S	*	.	S	Bend	trans	-67.2	16.6	176.3	0	0	0	0	0	113.6	L591 Y595	L591-A593 PolarHBondContact O-N 3.43Å; A593-Y595 VanDerWaalsContact C-N 3.26Å; A593-Y595 PolarHBondContact O-N 2.83Å
594	E	30.2	Very low	55.4	Low	127 Å²	127	82.5 Å²	82.5	59%	0.593	47%	0.47	S	S	*	.			trans	-90.1	36.8	172.5	-68.4	-164.8	152.5	0	0	112.5	N592	N592-E594 PolarHBondContact O-N 2.73Å
595	Y	30.7	Very low	51.9	Low	202 Å²	202	86.6 Å²	86.6	79%	0.792	49%	0.492	S	S	*	.			trans	-129.7	0	170.5	-70	-69.1	0	0	0	113.1	R284 A593	R284-Y595 PolarHBondContact NH1-O 3.17Å; A593-Y595 VanDerWaalsContact C-N 3.26Å; A593-Y595 PolarHBondContact O-N 2.83Å

Retrieved 595 of 595 residues in 126 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).