A0A087Y6J7_POEFO Loading...

Selenoprotein N

AlphaFold DB , UniProt , Accession A0A087Y6J7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 558 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	39	Very low	33.6	Very low	245 Å²	245	137.1 Å²	137.1	100%	1.207	80%	0.8	S	S	*	*				0	81.9	0	-59.9	-168.7	-165.5	0	0	105.5
2	A	31.2	Very low	33.2	Very low	97 Å²	97	143.7 Å²	143.7	80%	0.802	80%	0.802	S	S	*	*				77.3	94.3	101.1	0	0	0	0	0	109.6
3	A	31.4	Very low	32.8	Very low	88 Å²	88	140.6 Å²	140.6	73%	0.727	81%	0.806	S	S	*	*				90.4	129	87.4	0	0	0	0	0	108.9
4	D	31	Very low	32.8	Very low	160 Å²	160	147.9 Å²	147.9	86%	0.856	81%	0.814	S	S	*	*				-148.2	135.5	68.1	-96.6	-28	0	0	0	114.3
5	V	34.8	Very low	32.6	Very low	129 Å²	129	144.7 Å²	144.7	78%	0.782	81%	0.806	S	S	*	*			trans	-119.6	160.3	154.3	170.1	0	0	0	0	105.4
6	D	34.6	Very low	32.3	Very low	132 Å²	132	144.1 Å²	144.1	71%	0.706	81%	0.808	S	S	*	*			trans	94.4	125.7	157.5	-122.1	15.1	0	0	0	113.5
7	K	34	Very low	32.1	Very low	176 Å²	176	139.7 Å²	139.7	77%	0.765	80%	0.802	S	S	*	*				-173.7	165.4	50.1	-92.1	165.4	-172.6	172.8	0	106.3
8	S	27.9	Very low	32.1	Very low	111 Å²	111	142.3 Å²	142.3	78%	0.776	81%	0.805	S	S	*	*			cis	-173.6	148.2	23.1	32.2	0	0	0	0	108.8
9	S	31.1	Very low	32.1	Very low	110 Å²	110	141 Å²	141	77%	0.769	81%	0.806	S	S	*	*			trans	-65.9	-171.8	164.7	50.6	0	0	0	0	112.5
10	P	45.7	Very low	32	Very low	109 Å²	109	137.7 Å²	137.7	71%	0.708	81%	0.805	S	S	*	*			cis	-151.3	-179.1	15.4	41.7	-18	0	0	0	119.3
11	E	29.2	Very low	32.3	Very low	151 Å²	151	140.7 Å²	140.7	71%	0.706	81%	0.811	S	S	*	*			trans	72.4	127.9	139	-85.6	-172.8	-178.1	0	0	126.3
12	R	28.2	Very low	32.1	Very low	216 Å²	216	140.7 Å²	140.7	82%	0.815	80%	0.798	S	S	*	*			trans	62	122	136.5	-76	175	173.9	175.9	-0.2	120.8
13	A	29	Very low	32.6	Very low	104 Å²	104	141.7 Å²	141.7	86%	0.86	80%	0.798	S	S	*	*				170.9	151.9	92	0	0	0	0	0	112.6
14	R	31.5	Very low	33.1	Very low	243 Å²	243	143.3 Å²	143.3	92%	0.917	80%	0.801	S	S	*	*			trans	-74.7	151.5	175.7	-71.4	169.9	165.9	168.2	-5.4	112.1
15	S	29.8	Very low	33.4	Very low	100 Å²	100	138.9 Å²	138.9	70%	0.699	79%	0.794	S	S	*	*				130.2	137.8	121.5	95.4	0	0	0	0	115.8
16	T	28.4	Very low	33.9	Very low	135 Å²	135	143.5 Å²	143.5	83%	0.828	80%	0.799	S	S	*	*			trans	55.6	123.3	145.4	55	0	0	0	0	117.2
17	G	29.4	Very low	34.6	Very low	69 Å²	69	139.7 Å²	139.7	71%	0.711	79%	0.791	S	S	*	*			cis	139.2	141.1	31.8	0	0	0	0	0	107.2
18	H	30.9	Very low	35.4	Very low	186 Å²	186	135 Å²	135	86%	0.861	79%	0.785	S	S	*	*			trans	81	116.7	160.4	-79.6	44.9	0	0	0	122.2
19	S	32.8	Very low	36.4	Very low	118 Å²	118	140.9 Å²	140.9	83%	0.825	79%	0.79	S	S	*	*			trans	62.6	112.4	134.8	67	0	0	0	0	120.6
20	G	30.3	Very low	37.3	Very low	75 Å²	75	143.1 Å²	143.1	77%	0.773	79%	0.786	S	S	*	*			trans	-162.4	93.1	155.4	0	0	0	0	0	110.2	R22	G20-R22 PolarHBondContact O-N 2.96Å
21	Q	37.6	Very low	37.8	Very low	201 Å²	201	146.9 Å²	146.9	94%	0.939	79%	0.787	S	S	*	*			trans	-52.4	126.6	170.2	-76.5	169.9	-55.1	0	0	110.7
22	R	35.8	Very low	38.9	Very low	245 Å²	245	141.7 Å²	141.7	93%	0.925	77%	0.774	S	S	*	*			trans	-135.1	121.1	151.3	-82.8	-171.4	174.7	175	-1.2	109.1	G20	G20-R22 PolarHBondContact O-N 2.96Å
23	S	40.3	Very low	40.3	Very low	117 Å²	117	133 Å²	133	82%	0.818	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-55.2	135.6	-178.1	-31.7	0	0	0	0	112.1
24	P	41.8	Very low	41.8	Very low	122 Å²	122	133.7 Å²	133.7	79%	0.792	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-79.1	126.8	168.9	15.8	-4.2	0	0	0	109.8	Y26	P24-Y26 PolarHBondContact O-N 3.2Å
25	G	37.7	Very low	43.2	Very low	67 Å²	67	131.3 Å²	131.3	69%	0.691	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-60.4	127.5	175.7	0	0	0	0	0	111.8	G27	G25-G27 PolarHBondContact O-N 3.02Å
26	Y	46.3	Very low	44.8	Very low	226 Å²	226	130.7 Å²	130.7	89%	0.886	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	12.7	179	-106.9	-100.3	0	0	0	115.7	P24	P24-Y26 PolarHBondContact O-N 3.2Å
27	G	49.5	Very low	46.5	Very low	52 Å²	52	129.9 Å²	129.9	54%	0.536	71%	0.711	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.4	-14.2	-171.4	0	0	0	0	0	116.5	G25	G25-G27 PolarHBondContact O-N 3.02Å
28	A	50.1	Low	48.2	Very low	79 Å²	79	131.1 Å²	131.1	65%	0.653	70%	0.701	S	S	*	*	S	Bend	trans	-93.8	-27.2	-172.2	0	0	0	0	0	114	G32	A28-G32 PolarHBondContact O-N 2.77Å
29	W	47.9	Very low	49.8	Very low	234 Å²	234	124.6 Å²	124.6	89%	0.886	68%	0.679	S	S	*	*	H	α-helix	trans	-79	-33.9	-174.7	-148.7	54.6	0	0	0	112.9	R31 G32 G33	W29-R31 PolarHBondContact O-N 2.7Å; W29-G32 PolarHBondContact O-N 2.76Å; W29-G33 PolarHBondContact O-N 2.91Å; W29-G33 VanDerWaalsContact O-N 3.09Å
30	F	51.7	Low	51.6	Low	156 Å²	156	123.8 Å²	123.8	68%	0.684	67%	0.669	S	S	*	*	H	α-helix	trans	-69.2	-30.6	176.2	-97.2	-81.8	0	0	0	113.6	M34	F30-M34 VanDerWaalsContact O-CB 3.24Å; F30-M34 WeakPolarHBondContact O-CB 3.45Å; F30-M34 PolarHBondContact O-N 3.48Å
31	R	54.6	Low	53.3	Low	189 Å²	189	123.6 Å²	123.6	71%	0.713	66%	0.655	S	S	*	*	H	α-helix	trans	-73.6	-44	174.9	-74.4	-174	-175.3	-157.3	0.9	111.2	W29 M34 W35	W29-R31 PolarHBondContact O-N 2.7Å; R31-M34 PolarHBondContact O-N 3.23Å; R31-W35 PolarHBondContact O-N 2.62Å; R31-W35 VanDerWaalsContact O-N 3.09Å
32	G	53.1	Low	54.9	Low	42 Å²	42	117.3 Å²	117.3	43%	0.433	63%	0.631	S	S	.	*	H	α-helix	trans	-61.1	-48.3	177.8	0	0	0	0	0	113.1	A28 W29 M34 W35 T36	A28-G32 PolarHBondContact O-N 2.77Å; W29-G32 PolarHBondContact O-N 2.76Å; G32-M34 PolarHBondContact O-N 3.06Å; G32-W35 PolarHBondContact O-N 3.08Å; G32-T36 PolarHBondContact O-N 3.34Å; G32-T36 VanDerWaalsContact O-N 3.07Å; G32-T36 PolarHBondContact O-OG1 2.89Å
33	G	57.9	Low	56.7	Low	33 Å²	33	110.6 Å²	110.6	34%	0.34	62%	0.617	S	S	.	*	H	α-helix	trans	-64	-35.9	179.2	0	0	0	0	0	114	W29 T36 L37	W29-G33 PolarHBondContact O-N 2.91Å; W29-G33 VanDerWaalsContact O-N 3.09Å; G33-T36 VanDerWaalsContact CA-OG1 3.3Å; G33-T36 WeakPolarHBondContact CA-OG1 3.47Å; G33-T36 PolarHBondContact O-OG1 3.08Å; G33-L37 WeakPolarHBondContact O-CB 3.43Å; G33-L37 PolarHBondContact O-N 3.44Å
34	M	60.3	Low	58.2	Low	119 Å²	119	108.9 Å²	108.9	59%	0.586	60%	0.602	S	S	*	*	H	α-helix	trans	-74	-34.9	178.5	-167	145.1	66.6	0	0	112.4	F30 R31 G32 L38	F30-M34 VanDerWaalsContact O-CB 3.24Å; F30-M34 WeakPolarHBondContact O-CB 3.45Å; F30-M34 PolarHBondContact O-N 3.48Å; R31-M34 PolarHBondContact O-N 3.23Å; G32-M34 PolarHBondContact O-N 3.06Å; M34-L38 HydrophobicContact CG-CD1 4.3Å; M34-L38 VanDerWaalsContact O-CB 3.31Å; M34-L38 WeakPolarHBondContact O-CB 3.5Å; M34-L38 PolarHBondContact O-N 3.21Å
35	W	61.4	Low	59.7	Low	193 Å²	193	109 Å²	109	73%	0.731	60%	0.596	S	S	*	*	H	α-helix	trans	-69	-37.4	172.8	-86.1	98	0	0	0	112.6	R31 G32 L38 A39	R31-W35 PolarHBondContact O-N 2.62Å; R31-W35 VanDerWaalsContact O-N 3.09Å; G32-W35 PolarHBondContact O-N 3.08Å; W35-L38 PolarHBondContact O-N 3.24Å; W35-A39 WeakPolarHBondContact O-CB 3.28Å; W35-A39 PolarHBondContact O-N 2.86Å
36	T	63.8	Low	61.6	Low	86 Å²	86	108.4 Å²	108.4	53%	0.528	59%	0.585	S	S	.	*	H	α-helix	trans	-68.3	-39.6	173	43	0	0	0	0	112.4	G32 G33 A39 V40	G32-T36 PolarHBondContact O-N 3.34Å; G32-T36 VanDerWaalsContact O-N 3.07Å; G32-T36 PolarHBondContact O-OG1 2.89Å; G33-T36 VanDerWaalsContact CA-OG1 3.3Å; G33-T36 WeakPolarHBondContact CA-OG1 3.47Å; G33-T36 PolarHBondContact O-OG1 3.08Å; T36-A39 PolarHBondContact O-N 3.49Å; T36-V40 WeakPolarHBondContact O-CB 3.34Å; T36-V40 WeakPolarHBondContact O-CG2 3.37Å; T36-V40 PolarHBondContact O-N 3.42Å
37	L	62.6	Low	62.9	Low	119 Å²	119	99.5 Å²	99.5	62%	0.623	56%	0.561	S	S	*	*	H	α-helix	trans	-65.4	-41.4	173.7	-94.4	157.3	0	0	0	112	G33 V40 C41	G33-L37 WeakPolarHBondContact O-CB 3.43Å; G33-L37 PolarHBondContact O-N 3.44Å; L37-V40 PolarHBondContact O-N 3.37Å; L37-C41 PolarHBondContact O-N 2.94Å; L37-C41 PolarHBondContact O-SG 3.38Å; L37-C41 VanDerWaalsContact O-SG 3.38Å
38	L	65.9	Low	64.2	Low	94 Å²	94	104 Å²	104	49%	0.492	57%	0.566	S	S	.	*	H	α-helix	trans	-60.4	-46.2	173.2	-94.3	153.1	0	0	0	111.5	M34 W35 C41 T42	M34-L38 HydrophobicContact CG-CD1 4.3Å; M34-L38 VanDerWaalsContact O-CB 3.31Å; M34-L38 WeakPolarHBondContact O-CB 3.5Å; M34-L38 PolarHBondContact O-N 3.21Å; W35-L38 PolarHBondContact O-N 3.24Å; L38-C41 PolarHBondContact O-N 2.9Å; L38-T42 WeakPolarHBondContact O-CB 3.25Å; L38-T42 WeakPolarHBondContact O-CG2 3.34Å; L38-T42 PolarHBondContact O-N 3.01Å; L38-T42 PolarHBondContact O-OG1 2.93Å
39	A	63.7	Low	65.6	Low	49 Å²	49	102.1 Å²	102.1	41%	0.405	56%	0.555	S	S	.	*	H	α-helix	trans	-63.6	-40.7	176.8	0	0	0	0	0	112.7	W35 T36 C41 T42 V43	W35-A39 WeakPolarHBondContact O-CB 3.28Å; W35-A39 PolarHBondContact O-N 2.86Å; T36-A39 PolarHBondContact O-N 3.49Å; A39-C41 VanDerWaalsContact C-N 3.28Å; A39-C41 PolarHBondContact O-N 2.87Å; A39-T42 WeakPolarHBondContact CA-OG1 3.23Å; A39-T42 PolarHBondContact O-N 3.18Å; A39-T42 PolarHBondContact O-OG1 3.38Å; A39-V43 WeakPolarHBondContact O-CB 3.31Å; A39-V43 VanDerWaalsContact O-CG2 3.27Å; A39-V43 WeakPolarHBondContact O-CG2 3.27Å; A39-V43 PolarHBondContact O-N 3.41Å; A39-V43 VanDerWaalsContact O-N 3.1Å
40	V	70.4	Confident	67	Low	101 Å²	101	95.7 Å²	95.7	61%	0.612	54%	0.537	S	S	*	.	H	α-helix	trans	-66.6	-28.6	177.1	170.2	0	0	0	0	111.9	T36 L37 P44	T36-V40 WeakPolarHBondContact O-CB 3.34Å; T36-V40 WeakPolarHBondContact O-CG2 3.37Å; T36-V40 PolarHBondContact O-N 3.42Å; L37-V40 PolarHBondContact O-N 3.37Å; V40-P44 WeakPolarHBondContact O-CD 3.08Å; V40-P44 WeakPolarHBondContact O-CG 3.35Å
41	C	67.1	Low	68.2	Low	71 Å²	71	94.8 Å²	94.8	48%	0.48	53%	0.532	S	S	.	.	H	α-helix	trans	-88.2	-33.7	174.9	-67.9	0	0	0	0	113.4	L37 L38 A39 P44 L45	L37-C41 PolarHBondContact O-N 2.94Å; L37-C41 PolarHBondContact O-SG 3.38Å; L37-C41 VanDerWaalsContact O-SG 3.38Å; L38-C41 PolarHBondContact O-N 2.9Å; A39-C41 VanDerWaalsContact C-N 3.28Å; A39-C41 PolarHBondContact O-N 2.87Å; C41-P44 WeakPolarHBondContact O-CD 3.17Å; C41-L45 VanDerWaalsContact O-CD1 3.31Å; C41-L45 WeakPolarHBondContact O-CD1 3.38Å; C41-L45 VanDerWaalsContact O-CG 3.23Å; C41-L45 WeakPolarHBondContact O-CG 3.47Å; C41-L45 PolarHBondContact O-N 3.09Å
42	T	71.5	Confident	69.4	Low	70 Å²	70	93.8 Å²	93.8	43%	0.429	53%	0.53	S	S	.	.	H	α-helix	trans	-77.6	-33.7	-177.2	53.7	0	0	0	0	113.2	L38 A39 L45 A46	L38-T42 WeakPolarHBondContact O-CB 3.25Å; L38-T42 WeakPolarHBondContact O-CG2 3.34Å; L38-T42 PolarHBondContact O-N 3.01Å; L38-T42 PolarHBondContact O-OG1 2.93Å; A39-T42 WeakPolarHBondContact CA-OG1 3.23Å; A39-T42 PolarHBondContact O-N 3.18Å; A39-T42 PolarHBondContact O-OG1 3.38Å; T42-L45 PolarHBondContact O-N 3.13Å; T42-A46 VanDerWaalsContact O-CB 3.29Å; T42-A46 WeakPolarHBondContact O-CB 3.45Å; T42-A46 PolarHBondContact O-N 3.14Å
43	V	72.1	Confident	70.6	Confident	104 Å²	104	98.6 Å²	98.6	63%	0.63	54%	0.536	S	S	*	.	H	α-helix	trans	-64.6	-46	178.3	172.7	0	0	0	0	112.3	A39 L45 A46 G47	A39-V43 WeakPolarHBondContact O-CB 3.31Å; A39-V43 VanDerWaalsContact O-CG2 3.27Å; A39-V43 WeakPolarHBondContact O-CG2 3.27Å; A39-V43 PolarHBondContact O-N 3.41Å; A39-V43 VanDerWaalsContact O-N 3.1Å; V43-L45 PolarHBondContact O-N 3.18Å; V43-A46 PolarHBondContact O-N 3.03Å; V43-G47 PolarHBondContact O-N 3.46Å
44	P	71.9	Confident	71.5	Confident	80 Å²	80	102.4 Å²	102.4	52%	0.519	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-37.4	173.5	-21.5	32.5	0	0	0	113.1	V40 C41 G47 F48	V40-P44 WeakPolarHBondContact O-CD 3.08Å; V40-P44 WeakPolarHBondContact O-CG 3.35Å; C41-P44 WeakPolarHBondContact O-CD 3.17Å; P44-G47 PolarHBondContact O-N 3Å; P44-F48 WeakPolarHBondContact O-CB 3.22Å; P44-F48 PolarHBondContact O-N 3.04Å
45	L	74.9	Confident	72.1	Confident	125 Å²	125	99.7 Å²	99.7	65%	0.654	54%	0.538	S	S	*	.	H	α-helix	trans	-67.4	-39.7	177.2	-74.2	170	0	0	0	111.9	C41 T42 V43 F48 G49	C41-L45 VanDerWaalsContact O-CD1 3.31Å; C41-L45 WeakPolarHBondContact O-CD1 3.38Å; C41-L45 VanDerWaalsContact O-CG 3.23Å; C41-L45 WeakPolarHBondContact O-CG 3.47Å; C41-L45 PolarHBondContact O-N 3.09Å; T42-L45 PolarHBondContact O-N 3.13Å; V43-L45 PolarHBondContact O-N 3.18Å; L45-F48 PolarHBondContact O-N 3.01Å; L45-G49 PolarHBondContact O-N 3.37Å
46	A	76.3	Confident	72.7	Confident	55 Å²	55	93 Å²	93	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-66.4	-42.8	173.1	0	0	0	0	0	111.2	T42 V43 F48 G49 I50	T42-A46 VanDerWaalsContact O-CB 3.29Å; T42-A46 WeakPolarHBondContact O-CB 3.45Å; T42-A46 PolarHBondContact O-N 3.14Å; V43-A46 PolarHBondContact O-N 3.03Å; A46-F48 VanDerWaalsContact C-N 3.34Å; A46-F48 PolarHBondContact O-N 3.33Å; A46-G49 PolarHBondContact O-N 3.37Å; A46-I50 VanDerWaalsContact O-CG1 3.28Å; A46-I50 WeakPolarHBondContact O-CG1 3.39Å; A46-I50 PolarHBondContact O-N 2.81Å
47	G	74.7	Confident	73.3	Confident	38 Å²	38	91.9 Å²	91.9	39%	0.392	51%	0.509	S	S	.	.	H	α-helix	trans	-60.8	-40.7	173.8	0	0	0	0	0	112.7	V43 P44 I50 K51	V43-G47 PolarHBondContact O-N 3.46Å; P44-G47 PolarHBondContact O-N 3Å; G47-I50 PolarHBondContact O-N 3.04Å; G47-K51 VanDerWaalsContact O-CB 3.32Å; G47-K51 WeakPolarHBondContact O-CB 3.2Å; G47-K51 PolarHBondContact O-N 3.4Å
48	F	76.8	Confident	73.8	Confident	147 Å²	147	89.5 Å²	89.5	65%	0.645	50%	0.496	S	S	*	.	H	α-helix	trans	-67.3	-39.6	175.2	-161	-91.1	0	0	0	111.8	P44 L45 A46 K51 Y52	P44-F48 WeakPolarHBondContact O-CB 3.22Å; P44-F48 PolarHBondContact O-N 3.04Å; L45-F48 PolarHBondContact O-N 3.01Å; A46-F48 VanDerWaalsContact C-N 3.34Å; A46-F48 PolarHBondContact O-N 3.33Å; F48-K51 PolarHBondContact O-N 3.28Å; F48-Y52 VanDerWaalsContact O-CB 3.25Å; F48-Y52 WeakPolarHBondContact O-CB 3.26Å; F48-Y52 PolarHBondContact O-N 3.23Å
49	G	78.5	Confident	74.2	Confident	40 Å²	40	90.3 Å²	90.3	41%	0.412	50%	0.501	S	S	.	.	H	α-helix	trans	-64.1	-42.6	174.6	0	0	0	0	0	113.1	L45 A46 Y52 Y53	L45-G49 PolarHBondContact O-N 3.37Å; A46-G49 PolarHBondContact O-N 3.37Å; G49-Y52 PolarHBondContact O-N 3.4Å; G49-Y53 WeakPolarHBondContact O-CB 3.49Å; G49-Y53 PolarHBondContact O-N 2.75Å
50	I	78.5	Confident	74.6	Confident	99 Å²	99	95.6 Å²	95.6	51%	0.508	51%	0.51	S	S	.	.	H	α-helix	trans	-65.3	-46.2	175.7	-68	164.8	0	0	0	110.3	A46 G47 Y52 Y53 Q54	A46-I50 VanDerWaalsContact O-CG1 3.28Å; A46-I50 WeakPolarHBondContact O-CG1 3.39Å; A46-I50 PolarHBondContact O-N 2.81Å; G47-I50 PolarHBondContact O-N 3.04Å; I50-Y52 PolarHBondContact O-N 3.01Å; I50-Y53 PolarHBondContact O-N 3.39Å; I50-Q54 HydrophobicContact CG2-CG 4.42Å; I50-Q54 WeakPolarHBondContact O-CB 3.39Å; I50-Q54 WeakPolarHBondContact O-CG 3.24Å; I50-Q54 PolarHBondContact O-N 2.88Å
51	K	76.9	Confident	74.6	Confident	136 Å²	136	95 Å²	95	59%	0.591	50%	0.497	S	S	*	.	H	α-helix	trans	-60.4	-45.5	176.6	-173.9	178.1	-178.8	177.9	0	111.4	G47 F48 Y53 Q54 S55	G47-K51 VanDerWaalsContact O-CB 3.32Å; G47-K51 WeakPolarHBondContact O-CB 3.2Å; G47-K51 PolarHBondContact O-N 3.4Å; F48-K51 PolarHBondContact O-N 3.28Å; K51-Y53 VanDerWaalsContact C-N 3.34Å; K51-Y53 PolarHBondContact O-N 2.93Å; K51-Q54 PolarHBondContact O-N 3.37Å; K51-S55 WeakPolarHBondContact O-CB 3.31Å; K51-S55 PolarHBondContact O-N 2.89Å; K51-S55 PolarHBondContact O-OG 3.49Å
52	Y	79.2	Confident	74.7	Confident	168 Å²	168	95.6 Å²	95.6	66%	0.659	49%	0.493	S	S	*	.	H	α-helix	trans	-62.6	-41.6	177.5	-173.5	-94.8	0	0	0	111.8	F48 G49 I50 S55 S56	F48-Y52 VanDerWaalsContact O-CB 3.25Å; F48-Y52 WeakPolarHBondContact O-CB 3.26Å; F48-Y52 PolarHBondContact O-N 3.23Å; G49-Y52 PolarHBondContact O-N 3.4Å; I50-Y52 PolarHBondContact O-N 3.01Å; Y52-S55 PolarHBondContact O-N 3.47Å; Y52-S56 WeakPolarHBondContact O-CB 3.3Å; Y52-S56 PolarHBondContact O-N 3.42Å; Y52-S56 PolarHBondContact O-OG 3.25Å
53	Y	78.6	Confident	74.8	Confident	143 Å²	143	98.3 Å²	98.3	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-62.6	-47.1	175.4	-177.3	-100.8	0	0	0	111.8	G49 I50 K51 S56 Q57	G49-Y53 WeakPolarHBondContact O-CB 3.49Å; G49-Y53 PolarHBondContact O-N 2.75Å; I50-Y53 PolarHBondContact O-N 3.39Å; K51-Y53 VanDerWaalsContact C-N 3.34Å; K51-Y53 PolarHBondContact O-N 2.93Å; Y53-S56 PolarHBondContact O-N 2.86Å; Y53-S56 PolarHBondContact O-OG 3.41Å; Y53-Q57 HydrophobicContact CD1-CG 4.34Å; Y53-Q57 HydrophobicContact CE1-CG 3.96Å; Y53-Q57 WeakPolarHBondContact O-CB 3.4Å; Y53-Q57 WeakPolarHBondContact O-CG 3.3Å; Y53-Q57 PolarHBondContact O-N 2.91Å; Y53-Q57 PolarHBondContact OH-NE2 3.38Å
54	Q	75.5	Confident	74.9	Confident	113 Å²	113	97.9 Å²	97.9	53%	0.528	49%	0.491	S	S	.	.	H	α-helix	trans	-60.7	-45.9	175.7	-73.9	173.1	-22.5	0	0	111.8	I50 K51 S56 Q57 L58	I50-Q54 HydrophobicContact CG2-CG 4.42Å; I50-Q54 WeakPolarHBondContact O-CB 3.39Å; I50-Q54 WeakPolarHBondContact O-CG 3.24Å; I50-Q54 PolarHBondContact O-N 2.88Å; K51-Q54 PolarHBondContact O-N 3.37Å; Q54-S56 VanDerWaalsContact C-N 3.33Å; Q54-S56 PolarHBondContact O-N 3.08Å; Q54-Q57 WeakPolarHBondContact O-CB 3.45Å; Q54-Q57 PolarHBondContact O-N 3.29Å; Q54-L58 WeakPolarHBondContact O-CG 3.46Å; Q54-L58 PolarHBondContact O-N 3.18Å
55	S	73.9	Confident	74.4	Confident	63 Å²	63	94.9 Å²	94.9	44%	0.441	47%	0.474	S	S	.	.	H	α-helix	trans	-62.8	-38.3	176.3	-61.8	0	0	0	0	112.4	K51 Y52 L58 L59	K51-S55 WeakPolarHBondContact O-CB 3.31Å; K51-S55 PolarHBondContact O-N 2.89Å; K51-S55 PolarHBondContact O-OG 3.49Å; Y52-S55 PolarHBondContact O-N 3.47Å; S55-L58 PolarHBondContact O-N 3.37Å; S55-L59 WeakPolarHBondContact O-CB 3.43Å; S55-L59 PolarHBondContact O-N 3.41Å
56	S	73.3	Confident	74.1	Confident	51 Å²	51	91.3 Å²	91.3	36%	0.357	46%	0.457	S	S	.	.	H	α-helix	trans	-68.9	-35.2	176.3	72.5	0	0	0	0	113	Y52 Y53 Q54 R60	Y52-S56 WeakPolarHBondContact O-CB 3.3Å; Y52-S56 PolarHBondContact O-N 3.42Å; Y52-S56 PolarHBondContact O-OG 3.25Å; Y53-S56 PolarHBondContact O-N 2.86Å; Y53-S56 PolarHBondContact O-OG 3.41Å; Q54-S56 VanDerWaalsContact C-N 3.33Å; Q54-S56 PolarHBondContact O-N 3.08Å; S56-R60 WeakPolarHBondContact O-CB 3.22Å; S56-R60 PolarHBondContact O-N 2.75Å; S56-R60 VanDerWaalsContact O-N 3.13Å
57	Q	77.1	Confident	73.8	Confident	63 Å²	63	96.8 Å²	96.8	29%	0.294	47%	0.473	S	S	.	.	H	α-helix	trans	-66.6	-47.1	173.6	-81.1	-86.3	-18.8	0	0	111	Y53 Q54 L59 R60 R61	Y53-Q57 HydrophobicContact CD1-CG 4.34Å; Y53-Q57 HydrophobicContact CE1-CG 3.96Å; Y53-Q57 WeakPolarHBondContact O-CB 3.4Å; Y53-Q57 WeakPolarHBondContact O-CG 3.3Å; Y53-Q57 PolarHBondContact O-N 2.91Å; Y53-Q57 PolarHBondContact OH-NE2 3.38Å; Q54-Q57 WeakPolarHBondContact O-CB 3.45Å; Q54-Q57 PolarHBondContact O-N 3.29Å; Q57-L59 PolarHBondContact O-N 2.8Å; Q57-R60 PolarHBondContact O-N 3.29Å; Q57-R61 WeakPolarHBondContact O-CB 3.36Å; Q57-R61 VanDerWaalsContact O-CG 3.25Å; Q57-R61 WeakPolarHBondContact O-CG 3.48Å; Q57-R61 PolarHBondContact O-N 2.86Å
58	L	72.4	Confident	73.5	Confident	69 Å²	69	100.5 Å²	100.5	36%	0.361	49%	0.488	S	S	.	.	H	α-helix	trans	-60.9	-43.6	177.1	-75.8	168.7	0	0	0	111.8	Q54 S55 R60 R61 H62 L86	Q54-L58 WeakPolarHBondContact O-CG 3.46Å; Q54-L58 PolarHBondContact O-N 3.18Å; S55-L58 PolarHBondContact O-N 3.37Å; L58-R60 PolarHBondContact O-N 3.4Å; L58-R61 PolarHBondContact O-N 2.9Å; L58-H62 VanDerWaalsContact O-CB 3.28Å; L58-H62 WeakPolarHBondContact O-CB 3.44Å; L58-H62 PolarHBondContact O-N 3.48Å; L58-L86 HydrophobicContact CD2-CD1 4.41Å
59	L	74.3	Confident	72.8	Confident	111 Å²	111	97.7 Å²	97.7	58%	0.581	48%	0.48	S	S	*	.	H	α-helix	trans	-63.1	-43.3	178.9	-166.7	72.6	0	0	0	111.8	S55 Q57 H62 E63	S55-L59 WeakPolarHBondContact O-CB 3.43Å; S55-L59 PolarHBondContact O-N 3.41Å; Q57-L59 PolarHBondContact O-N 2.8Å; L59-H62 WeakPolarHBondContact O-CB 3.39Å; L59-H62 PolarHBondContact O-N 3.34Å; L59-E63 WeakPolarHBondContact O-CG 3.49Å; L59-E63 PolarHBondContact O-N 3.17Å
60	R	73.9	Confident	72.2	Confident	160 Å²	160	97.4 Å²	97.4	60%	0.604	48%	0.476	S	S	*	.	H	α-helix	trans	-66.5	-40.1	178.1	-171.2	175.6	172.6	164.1	2.7	112.2	S56 Q57 L58 E63 E64	S56-R60 WeakPolarHBondContact O-CB 3.22Å; S56-R60 PolarHBondContact O-N 2.75Å; S56-R60 VanDerWaalsContact O-N 3.13Å; Q57-R60 PolarHBondContact O-N 3.29Å; L58-R60 PolarHBondContact O-N 3.4Å; R60-E63 PolarHBondContact O-N 3.32Å; R60-E64 IonicContact NE-OE1 3.25Å; R60-E64 WeakPolarHBondContact O-CG 3.44Å; R60-E64 PolarHBondContact O-N 3.33Å
61	R	70.3	Confident	71.2	Confident	88 Å²	88	98 Å²	98	33%	0.332	48%	0.484	S	S	.	.	H	α-helix	trans	-66.4	-38.4	174.6	-72.5	174.8	-169.2	-172.3	0.3	112	Q57 L58 E64 A65 L86	Q57-R61 WeakPolarHBondContact O-CB 3.36Å; Q57-R61 VanDerWaalsContact O-CG 3.25Å; Q57-R61 WeakPolarHBondContact O-CG 3.48Å; Q57-R61 PolarHBondContact O-N 2.86Å; L58-R61 PolarHBondContact O-N 2.9Å; R61-E64 PolarHBondContact O-N 3.3Å; R61-A65 WeakPolarHBondContact O-CB 3.47Å; R61-A65 PolarHBondContact O-N 3.48Å; R61-L86 HydrophobicContact CB-CD1 3.86Å
62	H	68.9	Low	69.9	Low	85 Å²	85	99.5 Å²	99.5	39%	0.394	49%	0.493	S	S	.	.	H	α-helix	trans	-61.3	-46	174.1	-179.9	-78.2	0	0	0	110.7	L58 L59 E64 A65 V66 L86	L58-H62 VanDerWaalsContact O-CB 3.28Å; L58-H62 WeakPolarHBondContact O-CB 3.44Å; L58-H62 PolarHBondContact O-N 3.48Å; L59-H62 WeakPolarHBondContact O-CB 3.39Å; L59-H62 PolarHBondContact O-N 3.34Å; H62-E64 PolarHBondContact O-N 3.04Å; H62-A65 PolarHBondContact O-N 2.95Å; H62-V66 VanDerWaalsContact O-CG2 3.26Å; H62-V66 WeakPolarHBondContact O-CG2 3.4Å; H62-V66 PolarHBondContact O-N 3.49Å; H62-L86 HydrophobicContact CB-CD1 4.08Å
63	E	73.1	Confident	69.1	Low	126 Å²	126	92.4 Å²	92.4	59%	0.589	47%	0.472	S	S	*	.	H	α-helix	trans	-59.6	-45.1	174.3	-74.3	177.6	179.4	0	0	112.4	L59 R60 Q67	L59-E63 WeakPolarHBondContact O-CG 3.49Å; L59-E63 PolarHBondContact O-N 3.17Å; R60-E63 PolarHBondContact O-N 3.32Å; E63-Q67 WeakPolarHBondContact O-CB 3.39Å; E63-Q67 PolarHBondContact O-N 3.39Å
64	E	73.4	Confident	68.5	Low	95 Å²	95	86.5 Å²	86.5	44%	0.444	45%	0.45	S	S	.	.	H	α-helix	trans	-64	-40.9	176.7	-72.3	171.3	-170.1	0	0	111.6	R60 R61 H62 Q67 T68	R60-E64 IonicContact NE-OE1 3.25Å; R60-E64 WeakPolarHBondContact O-CG 3.44Å; R60-E64 PolarHBondContact O-N 3.33Å; R61-E64 PolarHBondContact O-N 3.3Å; H62-E64 PolarHBondContact O-N 3.04Å; E64-Q67 PolarHBondContact O-N 2.78Å; E64-T68 WeakPolarHBondContact O-CB 3.48Å; E64-T68 PolarHBondContact O-N 3.07Å; E64-T68 PolarHBondContact O-OG1 2.86Å
65	A	62.7	Low	67.7	Low	18 Å²	18	87.3 Å²	87.3	15%	0.149	45%	0.452	C	S	.	.	H	α-helix	trans	-69.2	-41	179.3	0	0	0	0	0	112.1	R61 H62 Q67 T68 L69 L74	R61-A65 WeakPolarHBondContact O-CB 3.47Å; R61-A65 PolarHBondContact O-N 3.48Å; H62-A65 PolarHBondContact O-N 2.95Å; A65-Q67 VanDerWaalsContact C-N 3.28Å; A65-Q67 PolarHBondContact O-N 3.09Å; A65-T68 PolarHBondContact O-N 3.49Å; A65-L69 WeakPolarHBondContact O-CB 3.38Å; A65-L69 PolarHBondContact O-N 3.42Å; A65-L74 HydrophobicContact CB-CD1 3.49Å; A65-L74 VanDerWaalsContact CB-CD1 3.49Å
66	V	67.5	Low	67.2	Low	49 Å²	49	89 Å²	89	30%	0.297	46%	0.456	S	S	.	.	H	α-helix	trans	-57.4	-43.5	170	172.9	0	0	0	0	110.7	H62 T68 G70 V71 L74	H62-V66 VanDerWaalsContact O-CG2 3.26Å; H62-V66 WeakPolarHBondContact O-CG2 3.4Å; H62-V66 PolarHBondContact O-N 3.49Å; V66-T68 VanDerWaalsContact C-N 3.34Å; V66-T68 PolarHBondContact O-N 3.28Å; V66-G70 VanDerWaalsContact O-CA 3.31Å; V66-G70 WeakPolarHBondContact O-CA 3.35Å; V66-G70 PolarHBondContact O-N 3.43Å; V66-G70 VanDerWaalsContact O-N 3.16Å; V66-V71 HydrophobicContact CG1-CG1 4.36Å; V66-L74 HydrophobicContact CG2-CD2 3.5Å; V66-L74 VanDerWaalsContact CG2-CD2 3.5Å
67	Q	70.9	Confident	67.1	Low	170 Å²	170	88.8 Å²	88.8	79%	0.794	45%	0.448	S	S	*	.	H	α-helix	trans	-69.4	-31.3	-177.2	-167.7	176.6	13.1	0	0	112.8	E63 E64 A65	E63-Q67 WeakPolarHBondContact O-CB 3.39Å; E63-Q67 PolarHBondContact O-N 3.39Å; E64-Q67 PolarHBondContact O-N 2.78Å; A65-Q67 VanDerWaalsContact C-N 3.28Å; A65-Q67 PolarHBondContact O-N 3.09Å
68	T	68.5	Low	66.5	Low	117 Å²	117	88.3 Å²	88.3	72%	0.718	45%	0.452	S	S	*	.	H	α-helix	trans	-95.2	-42	-172.5	-37.5	0	0	0	0	113.1	E64 A65 V66	E64-T68 WeakPolarHBondContact O-CB 3.48Å; E64-T68 PolarHBondContact O-N 3.07Å; E64-T68 PolarHBondContact O-OG1 2.86Å; A65-T68 PolarHBondContact O-N 3.49Å; V66-T68 VanDerWaalsContact C-N 3.34Å; V66-T68 PolarHBondContact O-N 3.28Å
69	L	61.9	Low	66.2	Low	88 Å²	88	88.1 Å²	88.1	46%	0.461	46%	0.456	S	S	.	.	H	α-helix	trans	-96.7	-13	-175.4	-66.6	164.7	0	0	0	112.6	A65 G73 F77	A65-L69 WeakPolarHBondContact O-CB 3.38Å; A65-L69 PolarHBondContact O-N 3.42Å; L69-G73 WeakPolarHBondContact O-CA 3.47Å; L69-G73 PolarHBondContact O-N 2.99Å; L69-F77 HydrophobicContact CD1-CB 4.25Å; L69-F77 HydrophobicContact CD1-CD2 4.15Å; L69-F77 HydrophobicContact CD1-CG 4.3Å
70	G	65.6	Low	65.9	Low	33 Å²	33	84 Å²	84	34%	0.34	44%	0.435	S	S	.	.	H	α-helix	trans	70.3	169.5	-165.5	0	0	0	0	0	111.8	V66 E72 G73 L74	V66-G70 VanDerWaalsContact O-CA 3.31Å; V66-G70 WeakPolarHBondContact O-CA 3.35Å; V66-G70 PolarHBondContact O-N 3.43Å; V66-G70 VanDerWaalsContact O-N 3.16Å; G70-E72 VanDerWaalsContact C-N 3.28Å; G70-E72 PolarHBondContact O-N 3.45Å; G70-G73 PolarHBondContact O-N 2.86Å; G70-L74 PolarHBondContact O-N 3.33Å
71	V	57	Low	65.8	Low	112 Å²	112	76.6 Å²	76.6	68%	0.679	41%	0.407	S	S	*	.	H	α-helix	trans	-63.3	-33.5	-177.3	-70.7	0	0	0	0	112.9	V66 F75	V66-V71 HydrophobicContact CG1-CG1 4.36Å; V71-F75 PolarHBondContact O-N 3.1Å
72	E	50.6	Low	65.8	Low	167 Å²	167	77.6 Å²	77.6	78%	0.78	42%	0.423	S	S	*	.	H	α-helix	trans	-74.4	-40.4	176.6	-64.4	-178.1	172.8	0	0	112.4	G70 L74 F75 L76	G70-E72 VanDerWaalsContact C-N 3.28Å; G70-E72 PolarHBondContact O-N 3.45Å; E72-L74 VanDerWaalsContact C-N 3.34Å; E72-F75 PolarHBondContact O-N 3.4Å; E72-L76 PolarHBondContact O-N 3.02Å
73	G	62.6	Low	66.1	Low	20 Å²	20	78.3 Å²	78.3	21%	0.206	43%	0.43	C	S	.	.	H	α-helix	trans	-69.9	-32.2	177.4	0	0	0	0	0	112.5	L69 G70 F77	L69-G73 WeakPolarHBondContact O-CA 3.47Å; L69-G73 PolarHBondContact O-N 2.99Å; G70-G73 PolarHBondContact O-N 2.86Å; G73-F77 VanDerWaalsContact O-CB 3.28Å; G73-F77 WeakPolarHBondContact O-CB 3.05Å; G73-F77 PolarHBondContact O-N 3.03Å
74	L	66.1	Low	65.8	Low	19 Å²	19	78.9 Å²	78.9	10%	0.099	43%	0.432	C	S	.	.	H	α-helix	trans	-66.2	-40.5	171	-175.4	71.8	0	0	0	111.8	A65 V66 G70 E72 F77 S78 L86	A65-L74 HydrophobicContact CB-CD1 3.49Å; A65-L74 VanDerWaalsContact CB-CD1 3.49Å; V66-L74 HydrophobicContact CG2-CD2 3.5Å; V66-L74 VanDerWaalsContact CG2-CD2 3.5Å; G70-L74 PolarHBondContact O-N 3.33Å; E72-L74 VanDerWaalsContact C-N 3.34Å; L74-F77 PolarHBondContact O-N 3.05Å; L74-S78 WeakPolarHBondContact O-CB 3.36Å; L74-S78 PolarHBondContact O-N 3.19Å; L74-S78 PolarHBondContact O-OG 2.93Å; L74-L86 HydrophobicContact CD1-CD2 4.37Å
75	F	58.8	Low	66	Low	129 Å²	129	77.1 Å²	77.1	57%	0.566	43%	0.426	S	S	*	.	H	α-helix	trans	-62.8	-44.7	176.7	175.5	-96.4	0	0	0	111.9	V71 E72 F77 S78 S79 F198	V71-F75 PolarHBondContact O-N 3.1Å; E72-F75 PolarHBondContact O-N 3.4Å; F75-F77 VanDerWaalsContact C-N 3.31Å; F75-F77 PolarHBondContact O-N 3.47Å; F75-S78 PolarHBondContact O-N 3.33Å; F75-S78 PolarHBondContact O-OG 2.78Å; F75-S78 VanDerWaalsContact O-OG 3.07Å; F75-S79 WeakPolarHBondContact O-CB 3.38Å; F75-S79 PolarHBondContact O-N 3.41Å; F75-F198 HydrophobicContact CE1-CZ 4.35Å
76	L	62.3	Low	66.2	Low	100 Å²	100	77.8 Å²	77.8	52%	0.524	43%	0.427	S	S	.	.	H	α-helix	trans	-61.5	-43	174.4	-178.7	64.3	0	0	0	111	E72 S79 L80	E72-L76 PolarHBondContact O-N 3.02Å; L76-S79 PolarHBondContact O-N 3.06Å; L76-S79 PolarHBondContact O-OG 2.99Å; L76-L80 HydrophobicContact CG-CD1 4.4Å; L76-L80 VanDerWaalsContact O-CD1 3.23Å; L76-L80 WeakPolarHBondContact O-CD1 3.36Å; L76-L80 WeakPolarHBondContact O-CG 3.42Å
77	F	70.7	Confident	66.5	Low	45 Å²	45	82.5 Å²	82.5	20%	0.197	44%	0.44	C	S	.	.	H	α-helix	trans	-63.4	-47.2	178.2	-169.3	-81.3	0	0	0	112.2	L69 G73 L74 F75 S79 L80 D81 L86 L88	L69-F77 HydrophobicContact CD1-CB 4.25Å; L69-F77 HydrophobicContact CD1-CD2 4.15Å; L69-F77 HydrophobicContact CD1-CG 4.3Å; G73-F77 VanDerWaalsContact O-CB 3.28Å; G73-F77 WeakPolarHBondContact O-CB 3.05Å; G73-F77 PolarHBondContact O-N 3.03Å; L74-F77 PolarHBondContact O-N 3.05Å; F75-F77 VanDerWaalsContact C-N 3.31Å; F75-F77 PolarHBondContact O-N 3.47Å; F77-S79 VanDerWaalsContact C-N 3.28Å; F77-S79 PolarHBondContact O-N 2.83Å; F77-L80 PolarHBondContact O-N 2.86Å; F77-L80 VanDerWaalsContact O-N 3.15Å; F77-D81 HydrophobicContact CD1-CB 4.46Å; F77-D81 HydrophobicContact CE1-CB 4.4Å; F77-D81 WeakPolarHBondContact O-CB 3.31Å; F77-D81 PolarHBondContact O-N 2.88Å; F77-L86 WeakPolarHBondContact CE1-O 3.37Å; F77-L86 WeakPolarHBondContact CZ-O 3.33Å; F77-L88 HydrophobicContact CD2-CD1 3.56Å; F77-L88 HydrophobicContact CD2-CG 3.96Å; F77-L88 HydrophobicContact CE1-CG 4.19Å; F77-L88 HydrophobicContact CE2-CB 4.37Å; F77-L88 HydrophobicContact CE2-CD1 3.56Å; F77-L88 HydrophobicContact CE2-CG 3.58Å; F77-L88 HydrophobicContact CG-CD1 4.25Å; F77-L88 HydrophobicContact CG-CG 4.45Å; F77-L88 HydrophobicContact CZ-CB 4.44Å; F77-L88 HydrophobicContact CZ-CD1 4.23Å; F77-L88 HydrophobicContact CZ-CG 3.72Å
78	S	65.7	Low	66.6	Low	53 Å²	53	76.5 Å²	76.5	37%	0.371	41%	0.413	S	S	.	.	H	α-helix	trans	-69	-24.7	179.1	65.8	0	0	0	0	113.5	L74 F75 L80	L74-S78 WeakPolarHBondContact O-CB 3.36Å; L74-S78 PolarHBondContact O-N 3.19Å; L74-S78 PolarHBondContact O-OG 2.93Å; F75-S78 PolarHBondContact O-N 3.33Å; F75-S78 PolarHBondContact O-OG 2.78Å; F75-S78 VanDerWaalsContact O-OG 3.07Å; S78-L80 PolarHBondContact O-N 3.5Å
79	S	65.8	Low	67	Low	65 Å²	65	72.8 Å²	72.8	46%	0.455	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-17.3	174.2	75.4	0	0	0	0	113.6	F75 L76 F77	F75-S79 WeakPolarHBondContact O-CB 3.38Å; F75-S79 PolarHBondContact O-N 3.41Å; L76-S79 PolarHBondContact O-N 3.06Å; L76-S79 PolarHBondContact O-OG 2.99Å; F77-S79 VanDerWaalsContact C-N 3.28Å; F77-S79 PolarHBondContact O-N 2.83Å
80	L	67.8	Low	67.4	Low	26 Å²	26	74.2 Å²	74.2	14%	0.136	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-30.6	-178.2	-60.4	158.6	0	0	0	111.6	L76 F77 S78 T82 L88 E92 I96	L76-L80 HydrophobicContact CG-CD1 4.4Å; L76-L80 VanDerWaalsContact O-CD1 3.23Å; L76-L80 WeakPolarHBondContact O-CD1 3.36Å; L76-L80 WeakPolarHBondContact O-CG 3.42Å; F77-L80 PolarHBondContact O-N 2.86Å; F77-L80 VanDerWaalsContact O-N 3.15Å; S78-L80 PolarHBondContact O-N 3.5Å; L80-T82 PolarHBondContact O-N 2.88Å; L80-T82 VanDerWaalsContact O-N 3.1Å; L80-T82 PolarHBondContact O-OG1 2.81Å; L80-L88 HydrophobicContact CB-CD1 4.43Å; L80-L88 HydrophobicContact CB-CD2 3.39Å; L80-L88 HydrophobicContact CD1-CD1 4.1Å; L80-E92 VanDerWaalsContact O-CB 3.31Å; L80-E92 WeakPolarHBondContact O-CB 3.31Å; L80-E92 WeakPolarHBondContact O-CG 3.41Å; L80-I96 HydrophobicContact CD1-CD1 3.23Å; L80-I96 HydrophobicContact CD1-CG1 4.29Å; L80-I96 HydrophobicContact CD2-CD1 3.61Å; L80-I96 HydrophobicContact CD2-CG1 3.8Å; L80-I96 HydrophobicContact CG-CD1 4Å
81	D	72.1	Confident	67.6	Low	4 Å²	4	79.4 Å²	79.4	2%	0.021	42%	0.422	C	S	.	.			trans	-72.3	92.9	175.8	176	8.4	0	0	0	110.2	F77 H84 D85 L86 L88	F77-D81 HydrophobicContact CD1-CB 4.46Å; F77-D81 HydrophobicContact CE1-CB 4.4Å; F77-D81 WeakPolarHBondContact O-CB 3.31Å; F77-D81 PolarHBondContact O-N 2.88Å; D81-H84 PolarHBondContact O-CE1 3.22Å; D81-H84 PolarHBondContact O-ND1 2.97Å; D81-H84 WeakPolarHBondContact OD1-CA 3.17Å; D81-H84 PolarHBondContact OD1-N 2.79Å; D81-H84 WeakPolarHBondContact OD2-CA 3.38Å; D81-D85 PolarHBondContact OD1-N 3.2Å; D81-D85 VanDerWaalsContact OD1-N 3.16Å; D81-D85 PolarHBondContact OD2-N 3.39Å; D81-L86 WeakPolarHBondContact OD2-CA 3.5Å; D81-L86 PolarHBondContact OD2-N 3.24Å; D81-L88 HydrophobicContact CB-CD2 4.09Å
82	T	69.6	Low	68.4	Low	109 Å²	109	75 Å²	75	67%	0.669	40%	0.395	S	S	*	.	S	Bend	trans	-80.7	-30	-173	-54.4	0	0	0	0	111.4	L80 E92	L80-T82 PolarHBondContact O-N 2.88Å; L80-T82 VanDerWaalsContact O-N 3.1Å; L80-T82 PolarHBondContact O-OG1 2.81Å; T82-E92 PolarHBondContact N-OE1 2.96Å
83	D	74.7	Confident	69.5	Low	100 Å²	100	71.4 Å²	71.4	54%	0.535	38%	0.376	S	S	.	.	S	Bend	trans	-92.1	-2.9	177.4	73.7	11	0	0	0	114.1	D85 E92	D83-D85 VanDerWaalsContact C-N 3.26Å; D83-D85 PolarHBondContact O-N 3.41Å; D83-D85 WeakPolarHBondContact OD1-CB 3.39Å; D83-D85 PolarHBondContact OD1-N 3.23Å; D83-E92 PolarHBondContact N-OE1 3.25Å
84	H	66.9	Low	69.7	Low	137 Å²	137	76.9 Å²	76.9	63%	0.634	39%	0.391	S	S	*	.			trans	61.7	31.4	173	-56	-10.7	0	0	0	112.9	D81 L86	D81-H84 PolarHBondContact O-CE1 3.22Å; D81-H84 PolarHBondContact O-ND1 2.97Å; D81-H84 WeakPolarHBondContact OD1-CA 3.17Å; D81-H84 PolarHBondContact OD1-N 2.79Å; D81-H84 WeakPolarHBondContact OD2-CA 3.38Å; H84-L86 VanDerWaalsContact C-N 3.34Å
85	D	77.1	Confident	69.5	Low	59 Å²	59	79.5 Å²	79.5	32%	0.316	41%	0.409	S	S	.	.	S	Bend	trans	-90.5	0.1	-178.9	85	-12.3	0	0	0	113.9	D81 D83 Y87	D81-D85 PolarHBondContact OD1-N 3.2Å; D81-D85 VanDerWaalsContact OD1-N 3.16Å; D81-D85 PolarHBondContact OD2-N 3.39Å; D83-D85 VanDerWaalsContact C-N 3.26Å; D83-D85 PolarHBondContact O-N 3.41Å; D83-D85 WeakPolarHBondContact OD1-CB 3.39Å; D83-D85 PolarHBondContact OD1-N 3.23Å; D85-Y87 PolarHBondContact O-N 2.92Å; D85-Y87 VanDerWaalsContact OD1-CA 3.32Å; D85-Y87 WeakPolarHBondContact OD1-CA 2.91Å; D85-Y87 VanDerWaalsContact OD1-CB 3.25Å; D85-Y87 WeakPolarHBondContact OD1-CB 3.09Å; D85-Y87 PolarHBondContact OD1-N 3.25Å
86	L	68.6	Low	69.8	Low	32 Å²	32	75.3 Å²	75.3	17%	0.168	39%	0.392	C	S	.	.	S	Bend	trans	61	26.6	-174.2	-64.4	169.3	0	0	0	113.5	L58 R61 H62 L74 F77 D81 H84	L58-L86 HydrophobicContact CD2-CD1 4.41Å; R61-L86 HydrophobicContact CB-CD1 3.86Å; H62-L86 HydrophobicContact CB-CD1 4.08Å; L74-L86 HydrophobicContact CD1-CD2 4.37Å; F77-L86 WeakPolarHBondContact CE1-O 3.37Å; F77-L86 WeakPolarHBondContact CZ-O 3.33Å; D81-L86 WeakPolarHBondContact OD2-CA 3.5Å; D81-L86 PolarHBondContact OD2-N 3.24Å; H84-L86 VanDerWaalsContact C-N 3.34Å
87	Y	73.3	Confident	69.8	Low	147 Å²	147	72 Å²	72	58%	0.576	38%	0.38	S	S	*	.			trans	-117.7	155.6	163.7	-86.9	-94.2	0	0	0	110	D85	D85-Y87 PolarHBondContact O-N 2.92Å; D85-Y87 VanDerWaalsContact OD1-CA 3.32Å; D85-Y87 WeakPolarHBondContact OD1-CA 2.91Å; D85-Y87 VanDerWaalsContact OD1-CB 3.25Å; D85-Y87 WeakPolarHBondContact OD1-CB 3.09Å; D85-Y87 PolarHBondContact OD1-N 3.25Å
88	L	72.8	Confident	69.5	Low	44 Å²	44	72.9 Å²	72.9	23%	0.23	38%	0.384	C	S	.	.			trans	-108	107.7	167.2	-70.4	173.1	0	0	0	108	F77 L80 D81 E92 F93	F77-L88 HydrophobicContact CD2-CD1 3.56Å; F77-L88 HydrophobicContact CD2-CG 3.96Å; F77-L88 HydrophobicContact CE1-CG 4.19Å; F77-L88 HydrophobicContact CE2-CB 4.37Å; F77-L88 HydrophobicContact CE2-CD1 3.56Å; F77-L88 HydrophobicContact CE2-CG 3.58Å; F77-L88 HydrophobicContact CG-CD1 4.25Å; F77-L88 HydrophobicContact CG-CG 4.45Å; F77-L88 HydrophobicContact CZ-CB 4.44Å; F77-L88 HydrophobicContact CZ-CD1 4.23Å; F77-L88 HydrophobicContact CZ-CG 3.72Å; L80-L88 HydrophobicContact CB-CD1 4.43Å; L80-L88 HydrophobicContact CB-CD2 3.39Å; L80-L88 HydrophobicContact CD1-CD1 4.1Å; D81-L88 HydrophobicContact CB-CD2 4.09Å; L88-E92 HydrophobicContact CD2-CB 4.11Å; L88-F93 HydrophobicContact CD1-CD2 4.36Å
89	S	76.3	Confident	69.1	Low	40 Å²	40	78.7 Å²	78.7	28%	0.28	40%	0.403	S	S	.	.			trans	-64.7	158	169.9	67.4	0	0	0	0	110.5	E91 E92 F93	S89-E91 PolarHBondContact O-N 2.88Å; S89-E92 VanDerWaalsContact CB-OE2 3.31Å; S89-E92 WeakPolarHBondContact CB-OE2 3.37Å; S89-E92 PolarHBondContact N-OE2 3.29Å; S89-E92 PolarHBondContact O-N 3.16Å; S89-E92 VanDerWaalsContact O-N 3.15Å; S89-E92 VanDerWaalsContact OG-CD 3.29Å; S89-E92 VanDerWaalsContact OG-CG 3.31Å; S89-E92 WeakPolarHBondContact OG-CG 3.31Å; S89-E92 PolarHBondContact OG-N 3.12Å; S89-E92 PolarHBondContact OG-OE2 3.14Å; S89-F93 PolarHBondContact O-N 2.92Å
90	P	70.5	Confident	68.7	Low	118 Å²	118	82 Å²	82	77%	0.766	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.6	171.9	-25.6	35	0	0	0	114	R94	P90-R94 PolarHBondContact O-N 3.31Å
91	E	70.4	Confident	68.2	Low	142 Å²	142	85.1 Å²	85.1	66%	0.664	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-43	177.2	-61.7	-176	174.1	0	0	111.4	S89 F93 R94	S89-E91 PolarHBondContact O-N 2.88Å; E91-F93 VanDerWaalsContact C-N 3.35Å; E91-R94 WeakPolarHBondContact O-CB 3.49Å; E91-R94 PolarHBondContact O-N 3.5Å
92	E	72.8	Confident	67	Low	20 Å²	20	88 Å²	88	9%	0.093	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-29.8	176.2	-72.9	163.4	144.2	0	0	113.1	L80 T82 D83 L88 S89 R94 P95	L80-E92 VanDerWaalsContact O-CB 3.31Å; L80-E92 WeakPolarHBondContact O-CB 3.31Å; L80-E92 WeakPolarHBondContact O-CG 3.41Å; T82-E92 PolarHBondContact N-OE1 2.96Å; D83-E92 PolarHBondContact N-OE1 3.25Å; L88-E92 HydrophobicContact CD2-CB 4.11Å; S89-E92 VanDerWaalsContact CB-OE2 3.31Å; S89-E92 WeakPolarHBondContact CB-OE2 3.37Å; S89-E92 PolarHBondContact N-OE2 3.29Å; S89-E92 PolarHBondContact O-N 3.16Å; S89-E92 VanDerWaalsContact O-N 3.15Å; S89-E92 VanDerWaalsContact OG-CD 3.29Å; S89-E92 VanDerWaalsContact OG-CG 3.31Å; S89-E92 WeakPolarHBondContact OG-CG 3.31Å; S89-E92 PolarHBondContact OG-N 3.12Å; S89-E92 PolarHBondContact OG-OE2 3.14Å; E92-R94 VanDerWaalsContact C-N 3.29Å; E92-P95 WeakPolarHBondContact O-CD 3.14Å
93	F	74.6	Confident	66	Low	90 Å²	90	88.6 Å²	88.6	40%	0.395	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-12	174.8	-164.9	-102.8	0	0	0	113.2	L88 S89 E91 P95 I96 A97	L88-F93 HydrophobicContact CD1-CD2 4.36Å; S89-F93 PolarHBondContact O-N 2.92Å; E91-F93 VanDerWaalsContact C-N 3.35Å; F93-P95 VanDerWaalsContact C-CD 3.4Å; F93-I96 HydrophobicContact CD2-CB 4.49Å; F93-I96 HydrophobicContact CE2-CB 4.27Å; F93-I96 HydrophobicContact CE2-CG2 3.92Å; F93-I96 HydrophobicContact CZ-CB 4.45Å; F93-I96 HydrophobicContact CZ-CG2 3.87Å; F93-I96 PolarHBondContact O-N 3.36Å; F93-A97 HydrophobicContact CD1-CB 4Å; F93-A97 HydrophobicContact CE1-CB 4.1Å; F93-A97 PolarHBondContact O-N 2.89Å
94	R	66.4	Low	64.5	Low	135 Å²	135	88.7 Å²	88.7	51%	0.509	47%	0.467	S	S	.	.	H	α-helix	trans	-53	-46	-177.8	-170.1	-174.4	-60.9	178.7	3.6	113.9	P90 E91 E92 I96 A97 E98	P90-R94 PolarHBondContact O-N 3.31Å; E91-R94 WeakPolarHBondContact O-CB 3.49Å; E91-R94 PolarHBondContact O-N 3.5Å; E92-R94 VanDerWaalsContact C-N 3.29Å; R94-I96 VanDerWaalsContact C-N 3.27Å; R94-I96 PolarHBondContact O-N 3.09Å; R94-A97 PolarHBondContact O-N 3.04Å; R94-E98 HydrophobicContact CG-CG 4.28Å; R94-E98 WeakPolarHBondContact CG-OE1 3.49Å; R94-E98 WeakPolarHBondContact O-CB 3.43Å; R94-E98 VanDerWaalsContact O-CG 3.31Å; R94-E98 WeakPolarHBondContact O-CG 3.45Å; R94-E98 PolarHBondContact O-N 3.07Å
95	P	61.5	Low	63.3	Low	75 Å²	75	84.5 Å²	84.5	49%	0.487	46%	0.456	S	S	.	.	H	α-helix	trans	-63.5	-33.6	-177.6	-18.4	31.8	0	0	0	112.7	E92 F93 K99	E92-P95 WeakPolarHBondContact O-CD 3.14Å; F93-P95 VanDerWaalsContact C-CD 3.4Å; P95-K99 WeakPolarHBondContact O-CB 3.47Å; P95-K99 PolarHBondContact O-N 3.5Å
96	I	66.1	Low	61.4	Low	40 Å²	40	87 Å²	87	21%	0.205	48%	0.476	C	S	.	.	H	α-helix	trans	-77	-42	176.6	-68.1	-167.1	0	0	0	110.8	L80 F93 R94 E98 K99 L100	L80-I96 HydrophobicContact CD1-CD1 3.23Å; L80-I96 HydrophobicContact CD1-CG1 4.29Å; L80-I96 HydrophobicContact CD2-CD1 3.61Å; L80-I96 HydrophobicContact CD2-CG1 3.8Å; L80-I96 HydrophobicContact CG-CD1 4Å; F93-I96 HydrophobicContact CD2-CB 4.49Å; F93-I96 HydrophobicContact CE2-CB 4.27Å; F93-I96 HydrophobicContact CE2-CG2 3.92Å; F93-I96 HydrophobicContact CZ-CB 4.45Å; F93-I96 HydrophobicContact CZ-CG2 3.87Å; F93-I96 PolarHBondContact O-N 3.36Å; R94-I96 VanDerWaalsContact C-N 3.27Å; R94-I96 PolarHBondContact O-N 3.09Å; I96-E98 VanDerWaalsContact C-N 3.34Å; I96-E98 PolarHBondContact O-N 2.9Å; I96-K99 PolarHBondContact O-N 3.38Å; I96-L100 HydrophobicContact CG2-CD1 3.54Å; I96-L100 HydrophobicContact CG2-CG 4.08Å; I96-L100 WeakPolarHBondContact O-CB 3.48Å; I96-L100 WeakPolarHBondContact O-CG 3.37Å; I96-L100 PolarHBondContact O-N 3.37Å
97	A	62.5	Low	60	Low	32 Å²	32	90.9 Å²	90.9	26%	0.264	50%	0.501	S	S	.	.	H	α-helix	trans	-59.9	-43.8	176.5	0	0	0	0	0	111.6	F93 R94 K99 L100 T101	F93-A97 HydrophobicContact CD1-CB 4Å; F93-A97 HydrophobicContact CE1-CB 4.1Å; F93-A97 PolarHBondContact O-N 2.89Å; R94-A97 PolarHBondContact O-N 3.04Å; A97-K99 VanDerWaalsContact C-N 3.29Å; A97-K99 PolarHBondContact O-N 2.98Å; A97-L100 PolarHBondContact O-N 3.4Å; A97-T101 WeakPolarHBondContact O-CB 3.4Å; A97-T101 WeakPolarHBondContact O-CG2 3.26Å; A97-T101 PolarHBondContact O-N 3.39Å; A97-T101 PolarHBondContact O-OG1 3.25Å
98	E	64.1	Low	58.3	Low	62 Å²	62	91 Å²	91	29%	0.29	51%	0.512	S	S	.	.	H	α-helix	trans	-60.3	-38.8	175.2	-72.9	173.1	176	0	0	111.7	R94 I96 G102	R94-E98 HydrophobicContact CG-CG 4.28Å; R94-E98 WeakPolarHBondContact CG-OE1 3.49Å; R94-E98 WeakPolarHBondContact O-CB 3.43Å; R94-E98 VanDerWaalsContact O-CG 3.31Å; R94-E98 WeakPolarHBondContact O-CG 3.45Å; R94-E98 PolarHBondContact O-N 3.07Å; I96-E98 VanDerWaalsContact C-N 3.34Å; I96-E98 PolarHBondContact O-N 2.9Å; E98-G102 WeakPolarHBondContact O-CA 3.38Å; E98-G102 PolarHBondContact O-N 2.92Å
99	K	57.1	Low	56.6	Low	176 Å²	176	96.2 Å²	96.2	77%	0.765	54%	0.539	S	S	*	.	H	α-helix	trans	-76.8	-32.1	-179.8	-155.8	171.8	-173.4	178.1	0	113.6	P95 I96 A97	P95-K99 WeakPolarHBondContact O-CB 3.47Å; P95-K99 PolarHBondContact O-N 3.5Å; I96-K99 PolarHBondContact O-N 3.38Å; A97-K99 VanDerWaalsContact C-N 3.29Å; A97-K99 PolarHBondContact O-N 2.98Å
100	L	57.9	Low	55.1	Low	135 Å²	135	99.3 Å²	99.3	71%	0.707	55%	0.549	S	S	*	.	H	α-helix	trans	-83.6	-34.6	178.5	-74.8	174	0	0	0	113.1	I96 A97	I96-L100 HydrophobicContact CG2-CD1 3.54Å; I96-L100 HydrophobicContact CG2-CG 4.08Å; I96-L100 WeakPolarHBondContact O-CB 3.48Å; I96-L100 WeakPolarHBondContact O-CG 3.37Å; I96-L100 PolarHBondContact O-N 3.37Å; A97-L100 PolarHBondContact O-N 3.4Å
101	T	56.1	Low	54.1	Low	90 Å²	90	99.9 Å²	99.9	55%	0.552	54%	0.541	S	S	*	.	H	α-helix	trans	-91.2	-15.5	-178.9	62.8	0	0	0	0	112.8	A97 I103	A97-T101 WeakPolarHBondContact O-CB 3.4Å; A97-T101 WeakPolarHBondContact O-CG2 3.26Å; A97-T101 PolarHBondContact O-N 3.39Å; A97-T101 PolarHBondContact O-OG1 3.25Å; T101-I103 PolarHBondContact O-N 2.87Å; T101-I103 VanDerWaalsContact O-N 3.16Å
102	G	47.2	Very low	52.8	Low	64 Å²	64	99.6 Å²	99.6	66%	0.66	54%	0.544	S	S	*	.			trans	67.1	7.3	-176.6	0	0	0	0	0	113.5	E98 T104	E98-G102 WeakPolarHBondContact O-CA 3.38Å; E98-G102 PolarHBondContact O-N 2.92Å; G102-T104 PolarHBondContact O-N 3.37Å
103	I	48.2	Very low	51.8	Low	122 Å²	122	103.3 Å²	103.3	63%	0.626	57%	0.568	S	S	*	*			trans	-98.5	90.8	177	-56.1	169.5	0	0	0	105.8	T101 A105	T101-I103 PolarHBondContact O-N 2.87Å; T101-I103 VanDerWaalsContact O-N 3.16Å; I103-A105 PolarHBondContact O-N 3.09Å
104	T	45	Very low	50.7	Low	102 Å²	102	106.2 Å²	106.2	63%	0.626	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-59.8	127.1	161.5	-34.3	0	0	0	0	106.2	G102	G102-T104 PolarHBondContact O-N 3.37Å
105	A	40.4	Very low	50.2	Low	49 Å²	49	105.1 Å²	105.1	41%	0.405	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-50.7	146	162.4	0	0	0	0	0	107.6	I103 V107	I103-A105 PolarHBondContact O-N 3.09Å; A105-V107 PolarHBondContact O-N 2.87Å
106	P	36.9	Very low	50.2	Low	112 Å²	112	106 Å²	106	73%	0.727	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-54	118	169.5	6.3	-0.8	0	0	0	105.6	D108	P106-D108 PolarHBondContact O-N 3.14Å
107	V	40.8	Very low	50	Low	114 Å²	114	109.3 Å²	109.3	69%	0.691	62%	0.615	S	S	*	*			trans	-42.3	120	158	177.8	0	0	0	0	103.4	A105 L109	A105-V107 PolarHBondContact O-N 2.87Å; V107-L109 PolarHBondContact O-N 3.13Å
108	D	36.9	Very low	50	Low	150 Å²	150	113.4 Å²	113.4	80%	0.802	63%	0.633	S	S	*	*			trans	-37.8	113.2	172.4	-86.8	-37	0	0	0	105.1	P106 E110	P106-D108 PolarHBondContact O-N 3.14Å; D108-E110 PolarHBondContact O-N 2.95Å
109	L	37.8	Very low	50.5	Low	153 Å²	153	111.3 Å²	111.3	80%	0.801	63%	0.628	S	S	*	*			trans	-54.8	94.6	-175.1	-79	152.9	0	0	0	104.7	V107 E111	V107-L109 PolarHBondContact O-N 3.13Å; L109-E111 PolarHBondContact O-N 3.35Å
110	E	44.9	Very low	51.8	Low	104 Å²	104	105.3 Å²	105.3	49%	0.486	60%	0.603	S	S	.	*			trans	-58.5	113.6	174.4	-79.7	-164.9	150.3	0	0	102.5	D108 D112 K215	D108-E110 PolarHBondContact O-N 2.95Å; E110-D112 PolarHBondContact O-N 3.4Å; E110-K215 WeakPolarHBondContact OE1-CE 3.28Å; E110-K215 IonicContact OE1-NZ 2.93Å; E110-K215 PolarHBondContact OE1-NZ 2.83Å
111	E	48.2	Very low	53.2	Low	130 Å²	130	100 Å²	100	61%	0.607	58%	0.575	S	S	*	*			trans	-20.8	114.1	-174.7	-67.4	172.7	160.3	0	0	110.4	L109 V113 R173	L109-E111 PolarHBondContact O-N 3.35Å; E111-V113 PolarHBondContact O-N 2.92Å; E111-R173 IonicContact OE2-CZ 2.74Å; E111-R173 VanDerWaalsContact OE2-CZ 3.24Å; E111-R173 IonicContact OE2-NH1 3.89Å; E111-R173 PolarHBondContact OE2-NH1 2.72Å; E111-R173 IonicContact OE2-NH2 2.83Å; E111-R173 PolarHBondContact OE2-NH2 3.37Å
112	D	43.8	Very low	54.8	Low	136 Å²	136	95.7 Å²	95.7	73%	0.727	55%	0.549	S	S	*	.			trans	-36.9	123.5	171.6	-75.6	-45.1	0	0	0	107.6	E110 I114	E110-D112 PolarHBondContact O-N 3.4Å; D112-I114 VanDerWaalsContact C-N 3.26Å; D112-I114 WeakPolarHBondContact O-CG1 3.21Å; D112-I114 PolarHBondContact O-N 3.39Å
113	V	51.5	Low	56.8	Low	99 Å²	99	94.3 Å²	94.3	60%	0.6	53%	0.528	S	S	*	.			trans	-52.5	101.2	174.4	176.7	0	0	0	0	105.8	E111 D115 H171	E111-V113 PolarHBondContact O-N 2.92Å; V113-D115 PolarHBondContact O-N 3.29Å; V113-H171 WeakPolarHBondContact CG1-CD2 3.48Å; V113-H171 WeakPolarHBondContact CG1-NE2 3.37Å
114	I	51.3	Low	59	Low	151 Å²	151	88.5 Å²	88.5	77%	0.774	50%	0.498	S	S	*	.			trans	-70.9	93.7	178	-54.9	177.6	0	0	0	103.2	D112 D116	D112-I114 VanDerWaalsContact C-N 3.26Å; D112-I114 WeakPolarHBondContact O-CG1 3.21Å; D112-I114 PolarHBondContact O-N 3.39Å; I114-D116 PolarHBondContact O-N 2.71Å
115	D	55	Low	61.4	Low	111 Å²	111	88.1 Å²	88.1	59%	0.594	49%	0.49	S	S	*	.			trans	-59	90.9	162.8	-98.5	-24.6	0	0	0	105.2	V113 P117 H171	V113-D115 PolarHBondContact O-N 3.29Å; D115-P117 WeakPolarHBondContact O-CD 3.47Å; D115-H171 IonicContact OD1-NE2 3.95Å
116	D	62.2	Low	64	Low	93 Å²	93	86.2 Å²	86.2	50%	0.497	47%	0.474	S	S	.	.			trans	-73.4	107.2	166.1	-177.1	-1.6	0	0	0	106	I114 N118 G119	I114-D116 PolarHBondContact O-N 2.71Å; D116-N118 PolarHBondContact O-N 3.1Å; D116-N118 VanDerWaalsContact O-N 3.07Å; D116-N118 PolarHBondContact OD1-N 3.02Å; D116-G119 PolarHBondContact O-N 3.45Å
117	P	62.2	Low	66.7	Low	110 Å²	110	83.1 Å²	83.1	71%	0.714	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-15.8	179.7	27.5	-34.6	0	0	0	112.5	D115	D115-P117 WeakPolarHBondContact O-CD 3.47Å
118	N	62.9	Low	69.2	Low	118 Å²	118	78.7 Å²	78.7	63%	0.631	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	2.7	174.4	-64.4	-17	0	0	0	113	D116	D116-N118 PolarHBondContact O-N 3.1Å; D116-N118 VanDerWaalsContact O-N 3.07Å; D116-N118 PolarHBondContact OD1-N 3.02Å
119	G	73.8	Confident	71.9	Confident	19 Å²	19	77 Å²	77	20%	0.196	41%	0.412	C	S	.	.	S	Bend	trans	-67	159.9	178.8	0	0	0	0	0	112.6	D116	D116-G119 PolarHBondContact O-N 3.45Å
120	E	84.5	Confident	74.3	Confident	50 Å²	50	72.3 Å²	72.3	23%	0.234	39%	0.391	C	S	.	.			trans	-70.1	146	176.8	-58.8	-170.1	168.2	0	0	111.7	P168 A169 H292 S340 T341 P342	E120-P168 WeakPolarHBondContact O-CA 3.41Å; E120-A169 HydrophobicContact CB-CB 4.08Å; E120-A169 WeakPolarHBondContact O-CB 3.43Å; E120-A169 PolarHBondContact O-N 3.2Å; E120-H292 IonicContact OE1-ND1 2.71Å; E120-H292 PolarHBondContact OE1-ND1 2.97Å; E120-H292 IonicContact OE2-CE1 3.15Å; E120-H292 IonicContact OE2-CG 3.76Å; E120-H292 IonicContact OE2-ND1 3.46Å; E120-H292 PolarHBondContact OE2-ND1 3.42Å; E120-S340 WeakPolarHBondContact OE2-CB 3.47Å; E120-S340 PolarHBondContact OE2-OG 3.39Å; E120-T341 CarbonylContact C-O 3.56Å; E120-T341 VanDerWaalsContact CA-O 3.3Å; E120-T341 WeakPolarHBondContact CA-O 3.23Å; E120-P342 HydrophobicContact CG-CB 4.33Å
121	T	87.2	Confident	76.5	Confident	22 Å²	22	68.1 Å²	68.1	14%	0.135	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136.7	176.3	63.4	0	0	0	0	111	F167 S340 T341 R356	T121-F167 CarbonylContact C-O 3.58Å; T121-F167 WeakPolarHBondContact CA-O 3.41Å; T121-S340 WeakPolarHBondContact O-CA 3.11Å; T121-T341 PolarHBondContact N-O 2.78Å; T121-T341 PolarHBondContact O-N 3.23Å; T121-R356 PolarHBondContact OG1-NH1 3.32Å; T121-R356 PolarHBondContact OG1-NH2 2.85Å
122	L	89.4	Confident	78.3	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	126.6	174.7	-173.4	72.1	0	0	0	109.2	L124 S166 F167 F172 V293 F296 G338	L122-L124 HydrophobicContact CD2-CD2 3.71Å; L122-L124 HydrophobicContact CD2-CG 4.36Å; L122-L124 HydrophobicContact CG-CD2 4Å; L122-S166 CarbonylContact O-C 3.58Å; L122-S166 WeakPolarHBondContact O-CA 3.41Å; L122-F167 PolarHBondContact N-O 2.9Å; L122-F167 PolarHBondContact O-N 2.9Å; L122-F172 HydrophobicContact CB-CE2 4.36Å; L122-F172 HydrophobicContact CD2-CE1 4.46Å; L122-F172 HydrophobicContact CD2-CE2 3.83Å; L122-F172 HydrophobicContact CD2-CZ 3.73Å; L122-V293 HydrophobicContact CD1-CB 4.45Å; L122-V293 HydrophobicContact CD1-CG1 4.35Å; L122-V293 HydrophobicContact CD2-CB 4.23Å; L122-V293 HydrophobicContact CD2-CG1 3.76Å; L122-F296 HydrophobicContact CD2-CB 3.83Å; L122-F296 HydrophobicContact CD2-CG 4.44Å; L122-G338 WeakPolarHBondContact CD1-O 3.45Å
123	V	90.4	Very high	80.3	Confident	36 Å²	36	62.2 Å²	62.2	22%	0.218	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.9	174.7	-172.6	0	0	0	0	109.4	S336 I337	V123-S336 WeakPolarHBondContact O-CA 2.93Å; V123-I337 HydrophobicContact CB-CD1 4.13Å; V123-I337 HydrophobicContact CG1-CD1 3.55Å; V123-I337 HydrophobicContact CG1-CG1 4.34Å; V123-I337 PolarHBondContact O-N 3.21Å
124	L	93.8	Very high	81.8	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.2	177.2	-60.1	-176.5	0	0	0	110.5	L122 S164 S165 F167 F172 L222 M225 F296 R335	L122-L124 HydrophobicContact CD2-CD2 3.71Å; L122-L124 HydrophobicContact CD2-CG 4.36Å; L122-L124 HydrophobicContact CG-CD2 4Å; L124-S164 VanDerWaalsContact O-CA 3.27Å; L124-S164 WeakPolarHBondContact O-CA 3.43Å; L124-S164 PolarHBondContact O-OG 3.24Å; L124-S165 PolarHBondContact N-O 3.31Å; L124-S165 PolarHBondContact O-N 3.16Å; L124-F167 HydrophobicContact CB-CE2 4.48Å; L124-F167 HydrophobicContact CD1-CD2 3.77Å; L124-F167 HydrophobicContact CD1-CE2 3.87Å; L124-F167 HydrophobicContact CG-CD2 4.11Å; L124-F167 HydrophobicContact CG-CE2 4.39Å; L124-F172 HydrophobicContact CD1-CZ 4.42Å; L124-L222 HydrophobicContact CD1-CD2 3.31Å; L124-M225 HydrophobicContact CB-CE 4.25Å; L124-M225 HydrophobicContact CB-SD 4.43Å; L124-F296 HydrophobicContact CD1-CD1 3.9Å; L124-F296 HydrophobicContact CD1-CE1 3.94Å; L124-F296 HydrophobicContact CD2-CB 4.12Å; L124-F296 HydrophobicContact CD2-CD1 3.61Å; L124-F296 HydrophobicContact CD2-CE1 4.44Å; L124-F296 HydrophobicContact CD2-CG 4.17Å; L124-F296 HydrophobicContact CG-CD1 4.44Å; L124-R335 WeakPolarHBondContact CA-O 2.81Å
125	E	95.1	Very high	83.3	Confident	94 Å²	94	59 Å²	59	44%	0.439	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.3	170.6	-71.1	-176.8	164	0	0	110.4	P163 L334 R335 I337	E125-P163 CarbonylContact C-O 3.55Å; E125-P163 WeakPolarHBondContact CA-O 3.22Å; E125-L334 VanDerWaalsContact O-CA 3.3Å; E125-L334 WeakPolarHBondContact O-CA 3.15Å; E125-R335 PolarHBondContact N-O 2.82Å; E125-R335 PolarHBondContact O-N 2.89Å; E125-I337 HydrophobicContact CG-CD1 3.64Å; E125-I337 HydrophobicContact CG-CG1 3.63Å; E125-I337 VanDerWaalsContact OE1-CD1 3.27Å; E125-I337 WeakPolarHBondContact OE1-CD1 3.45Å
126	A	95.1	Very high	84.4	Confident	9 Å²	9	53.8 Å²	53.8	7%	0.074	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.1	174	0	0	0	0	0	110.4	P160 P163 M225 F226 E333 L334	A126-P160 HydrophobicContact CB-CB 3.73Å; A126-P160 HydrophobicContact CB-CG 3.97Å; A126-P163 PolarHBondContact N-O 3.06Å; A126-M225 HydrophobicContact CB-CB 4.48Å; A126-M225 HydrophobicContact CB-CE 4.19Å; A126-F226 HydrophobicContact CB-CD1 4.31Å; A126-F226 HydrophobicContact CB-CE1 4.11Å; A126-E333 WeakPolarHBondContact CA-O 3.46Å; A126-L334 HydrophobicContact CB-CD2 3.48Å; A126-L334 VanDerWaalsContact CB-CD2 3.48Å
127	S	94.1	Very high	84.9	Confident	47 Å²	47	52.3 Å²	52.3	33%	0.329	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.3	173.1	-70.6	0	0	0	0	110	L332 E333	S127-L332 WeakPolarHBondContact O-CA 3.38Å; S127-E333 PolarHBondContact N-O 3.05Å; S127-E333 PolarHBondContact O-N 2.98Å
128	M	93.8	Very high	85.6	Confident	21 Å²	21	50.3 Å²	50.3	10%	0.103	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	138.8	-178.4	-178.5	-177.3	171.3	0	0	110.6	W157 Q331 L332	M128-W157 HydrophobicContact CE-CD2 3.5Å; M128-W157 VanDerWaalsContact CE-CD2 3.5Å; M128-W157 HydrophobicContact CE-CE3 3.92Å; M128-W157 HydrophobicContact CE-CG 3.81Å; M128-W157 HydrophobicContact CE-CH2 4.4Å; M128-W157 HydrophobicContact CE-CZ2 4.01Å; M128-W157 HydrophobicContact CE-CZ3 4.35Å; M128-W157 WeakPolarHBondContact CE-O 3.16Å; M128-W157 HydrophobicContact SD-CD2 4.35Å; M128-W157 HydrophobicContact SD-CZ2 4.18Å; M128-Q331 CarbonylContact C-O 3.53Å; M128-Q331 WeakPolarHBondContact CA-O 3.27Å; M128-L332 HydrophobicContact CB-CD1 3.98Å; M128-L332 HydrophobicContact CG-CD1 3.67Å; M128-L332 HydrophobicContact SD-CD1 4.02Å
129	K	92.4	Very high	86.1	Confident	113 Å²	113	45.7 Å²	45.7	49%	0.491	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.2	161.4	-71.8	174.7	-179.3	165	0	108.1	L329 P330 Q331	K129-L329 WeakPolarHBondContact O-CD1 3.3Å; K129-P330 HydrophobicContact CB-CB 4.24Å; K129-P330 HydrophobicContact CB-CG 4.49Å; K129-P330 HydrophobicContact CD-CB 4.33Å; K129-Q331 HydrophobicContact CB-CB 3.96Å; K129-Q331 HydrophobicContact CD-CB 3.99Å; K129-Q331 HydrophobicContact CG-CB 3.98Å; K129-Q331 PolarHBondContact N-O 2.6Å
130	P	89.9	Confident	85.9	Confident	56 Å²	56	54.1 Å²	54.1	36%	0.364	28%	0.277	S	S	.	.			trans	-61.6	157.1	-178.1	25.5	-33.5	0	0	0	111.8	P330	P130-P330 WeakPolarHBondContact O-CD 3.48Å
131	L	89.2	Confident	84.8	Confident	15 Å²	15	56.8 Å²	56.8	8%	0.079	29%	0.293	C	S	.	.			trans	-60.7	139.2	176.5	-177.3	138.1	0	0	0	110.8	L133 M136 L154 F275 V308 M310 L329	L131-L133 HydrophobicContact CD2-CD2 4.36Å; L131-L133 PolarHBondContact O-N 3.22Å; L131-M136 HydrophobicContact CD2-CG 3.98Å; L131-M136 HydrophobicContact CD2-SD 4.06Å; L131-L154 HydrophobicContact CB-CD1 4.36Å; L131-L154 HydrophobicContact CD2-CD2 4.39Å; L131-F275 HydrophobicContact CB-CE2 4.41Å; L131-F275 HydrophobicContact CD1-CE2 3.87Å; L131-F275 HydrophobicContact CD1-CZ 4.38Å; L131-V308 HydrophobicContact CD1-CB 3.95Å; L131-V308 HydrophobicContact CD1-CG1 3.91Å; L131-V308 HydrophobicContact CD1-CG2 4.46Å; L131-M310 HydrophobicContact CD1-CE 3.9Å; L131-M310 HydrophobicContact CD1-SD 3.92Å; L131-M310 HydrophobicContact CD2-CE 4.16Å; L131-M310 HydrophobicContact CD2-SD 4.25Å; L131-L329 HydrophobicContact CB-CD1 4.13Å
132	L	87.6	Confident	83.7	Confident	88 Å²	88	58.6 Å²	58.6	46%	0.461	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-77.2	106.8	176.7	-60.6	-175.8	0	0	0	109.4	D134 S135 Y328 P330	L132-D134 PolarHBondContact O-N 3.41Å; L132-S135 WeakPolarHBondContact O-CB 3.49Å; L132-S135 PolarHBondContact O-N 2.94Å; L132-S135 PolarHBondContact O-OG 2.8Å; L132-Y328 HydrophobicContact CD1-CD1 3.86Å; L132-Y328 HydrophobicContact CD1-CE1 4.34Å; L132-Y328 HydrophobicContact CG-CD1 4.34Å; L132-Y328 PolarHBondContact N-O 2.99Å; L132-P330 HydrophobicContact CD1-CG 4.23Å; L132-P330 HydrophobicContact CD2-CG 4.18Å; L132-P330 HydrophobicContact CG-CG 3.9Å
133	L	84.6	Confident	82.8	Confident	55 Å²	55	60.3 Å²	60.3	29%	0.288	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-59	-32.4	-179	-64.6	178.1	0	0	0	112.6	L131 S135 M136 S139 F143 L154	L131-L133 HydrophobicContact CD2-CD2 4.36Å; L131-L133 PolarHBondContact O-N 3.22Å; L133-S135 PolarHBondContact O-N 3.37Å; L133-M136 HydrophobicContact CD2-SD 3.82Å; L133-M136 VanDerWaalsContact O-CB 3.25Å; L133-M136 WeakPolarHBondContact O-CB 3.29Å; L133-M136 WeakPolarHBondContact O-CG 3.23Å; L133-M136 PolarHBondContact O-N 2.95Å; L133-M136 VanDerWaalsContact O-N 3.12Å; L133-S139 VanDerWaalsContact O-CB 3.22Å; L133-S139 WeakPolarHBondContact O-CB 3.48Å; L133-S139 PolarHBondContact O-OG 2.95Å; L133-F143 HydrophobicContact CB-CZ 4.32Å; L133-L154 HydrophobicContact CD2-CD2 3.72Å; L133-L154 HydrophobicContact CD2-CG 4.37Å
134	D	83.7	Confident	81.2	Confident	149 Å²	149	65.7 Å²	65.7	80%	0.797	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-68.6	-14.6	177.9	-57.7	-22.6	0	0	0	113.3	L132 M136 S139	L132-D134 PolarHBondContact O-N 3.41Å; D134-M136 VanDerWaalsContact C-N 3.33Å; D134-S139 PolarHBondContact O-OG 3.2Å
135	S	81.5	Confident	79.6	Confident	33 Å²	33	69.3 Å²	69.3	23%	0.231	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-78.7	-19.3	174.3	71.4	0	0	0	0	112.9	L132 L133 Y328	L132-S135 WeakPolarHBondContact O-CB 3.49Å; L132-S135 PolarHBondContact O-N 2.94Å; L132-S135 PolarHBondContact O-OG 2.8Å; L133-S135 PolarHBondContact O-N 3.37Å; S135-Y328 PolarHBondContact OG-N 3.01Å
136	M	79.6	Confident	78.4	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	37%	0.373	C	S	.	.	S	Bend	trans	-68.7	138.8	-178.9	-66.8	-179.6	68	0	0	110.8	L131 L133 D134 K138 S139 F143 L154 M310 W312 D325	L131-M136 HydrophobicContact CD2-CG 3.98Å; L131-M136 HydrophobicContact CD2-SD 4.06Å; L133-M136 HydrophobicContact CD2-SD 3.82Å; L133-M136 VanDerWaalsContact O-CB 3.25Å; L133-M136 WeakPolarHBondContact O-CB 3.29Å; L133-M136 WeakPolarHBondContact O-CG 3.23Å; L133-M136 PolarHBondContact O-N 2.95Å; L133-M136 VanDerWaalsContact O-N 3.12Å; D134-M136 VanDerWaalsContact C-N 3.33Å; M136-K138 VanDerWaalsContact C-N 3.28Å; M136-K138 PolarHBondContact O-N 2.93Å; M136-S139 WeakPolarHBondContact O-CB 3.15Å; M136-S139 PolarHBondContact O-N 2.93Å; M136-S139 VanDerWaalsContact O-N 3.17Å; M136-S139 PolarHBondContact O-OG 3.27Å; M136-F143 HydrophobicContact CB-CE1 4.44Å; M136-F143 HydrophobicContact CE-CE1 3.94Å; M136-F143 HydrophobicContact SD-CE1 3.93Å; M136-F143 HydrophobicContact SD-CZ 4.09Å; M136-L154 HydrophobicContact SD-CD2 4.17Å; M136-M310 HydrophobicContact CE-CE 3.82Å; M136-M310 HydrophobicContact CE-SD 4.15Å; M136-M310 HydrophobicContact CG-CE 3.81Å; M136-M310 HydrophobicContact SD-CE 4.02Å; M136-M310 HydrophobicContact SD-SD 4.35Å; M136-W312 HydrophobicContact CE-CH2 4.32Å; M136-W312 HydrophobicContact CE-CZ3 4.4Å; M136-D325 WeakPolarHBondContact CB-OD2 3.31Å; M136-D325 HydrophobicContact CE-CB 4.1Å; M136-D325 WeakPolarHBondContact CE-OD2 3.26Å
137	T	73	Confident	77.1	Confident	63 Å²	63	67.9 Å²	67.9	39%	0.387	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-63.9	-39.3	-178.8	-52.8	0	0	0	0	110.7	S139 R140 D325	T137-S139 PolarHBondContact O-N 2.86Å; T137-R140 PolarHBondContact O-N 2.85Å; T137-D325 WeakPolarHBondContact CB-OD1 3.42Å; T137-D325 PolarHBondContact N-OD1 3.42Å; T137-D325 PolarHBondContact N-OD2 3.04Å; T137-D325 PolarHBondContact OG1-OD1 2.97Å
138	K	75.2	Confident	76	Confident	67 Å²	67	72.6 Å²	72.6	29%	0.291	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-72	-13.7	-179.4	-59	-80.7	175.2	153.3	0	113.4	M136 R140 F143 E323 D325	M136-K138 VanDerWaalsContact C-N 3.28Å; M136-K138 PolarHBondContact O-N 2.93Å; K138-R140 VanDerWaalsContact C-N 3.25Å; K138-R140 PolarHBondContact O-N 3.35Å; K138-F143 HydrophobicContact CB-CD1 4.33Å; K138-F143 WeakPolarHBondContact O-CA 3.33Å; K138-F143 PolarHBondContact O-N 2.82Å; K138-F143 VanDerWaalsContact O-N 3.15Å; K138-E323 WeakPolarHBondContact CE-OE2 3.1Å; K138-E323 IonicContact NZ-OE2 3.24Å; K138-E323 PolarHBondContact NZ-OE2 3.45Å; K138-D325 VanDerWaalsContact CB-OD2 3.22Å; K138-D325 WeakPolarHBondContact CB-OD2 3.14Å; K138-D325 HydrophobicContact CG-CB 4.31Å; K138-D325 WeakPolarHBondContact CG-OD2 3.44Å; K138-D325 PolarHBondContact N-OD2 3.49Å
139	S	74.7	Confident	75.2	Confident	21 Å²	21	74.3 Å²	74.3	15%	0.147	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-68.2	-26.3	176.4	74	0	0	0	0	112.7	L133 D134 M136 T137 D141 G142	L133-S139 VanDerWaalsContact O-CB 3.22Å; L133-S139 WeakPolarHBondContact O-CB 3.48Å; L133-S139 PolarHBondContact O-OG 2.95Å; D134-S139 PolarHBondContact O-OG 3.2Å; M136-S139 WeakPolarHBondContact O-CB 3.15Å; M136-S139 PolarHBondContact O-N 2.93Å; M136-S139 VanDerWaalsContact O-N 3.17Å; M136-S139 PolarHBondContact O-OG 3.27Å; T137-S139 PolarHBondContact O-N 2.86Å; S139-D141 PolarHBondContact O-N 2.93Å; S139-G142 WeakPolarHBondContact O-CA 3.34Å; S139-G142 PolarHBondContact O-N 3.42Å
140	R	68.4	Low	74.5	Confident	196 Å²	196	69.3 Å²	69.3	74%	0.74	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-62.2	-32.8	-179.6	-68.8	-178.4	165.8	-167	-6.5	112.7	T137 K138 G142	T137-R140 PolarHBondContact O-N 2.85Å; K138-R140 VanDerWaalsContact C-N 3.25Å; K138-R140 PolarHBondContact O-N 3.35Å; R140-G142 PolarHBondContact O-N 3.11Å
141	D	63.1	Low	74.1	Confident	107 Å²	107	66.7 Å²	66.7	57%	0.572	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-89.5	15.8	174.8	-59.4	-40.1	0	0	0	112	S139 F143 L144	S139-D141 PolarHBondContact O-N 2.93Å; D141-F143 PolarHBondContact O-N 3.46Å; D141-L144 HydrophobicContact CB-CB 4.38Å; D141-L144 HydrophobicContact CB-CD1 4.47Å; D141-L144 WeakPolarHBondContact O-CB 3.35Å; D141-L144 WeakPolarHBondContact O-CD1 3.33Å; D141-L144 WeakPolarHBondContact O-CG 3.23Å; D141-L144 PolarHBondContact O-N 3.35Å; D141-L144 VanDerWaalsContact O-N 3.13Å
142	G	62.4	Low	73.8	Confident	60 Å²	60	67.9 Å²	67.9	62%	0.619	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	25.9	-176.3	0	0	0	0	0	113.6	S139 R140 L144	S139-G142 WeakPolarHBondContact O-CA 3.34Å; S139-G142 PolarHBondContact O-N 3.42Å; R140-G142 PolarHBondContact O-N 3.11Å; G142-L144 PolarHBondContact O-N 3.17Å
143	F	71.1	Confident	73.6	Confident	35 Å²	35	63.9 Å²	63.9	15%	0.154	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	28.8	-172.2	-58.8	-79.3	0	0	0	114	L133 M136 K138 D141 G145 V146 L151	L133-F143 HydrophobicContact CB-CZ 4.32Å; M136-F143 HydrophobicContact CB-CE1 4.44Å; M136-F143 HydrophobicContact CE-CE1 3.94Å; M136-F143 HydrophobicContact SD-CE1 3.93Å; M136-F143 HydrophobicContact SD-CZ 4.09Å; K138-F143 HydrophobicContact CB-CD1 4.33Å; K138-F143 WeakPolarHBondContact O-CA 3.33Å; K138-F143 PolarHBondContact O-N 2.82Å; K138-F143 VanDerWaalsContact O-N 3.15Å; D141-F143 PolarHBondContact O-N 3.46Å; F143-G145 PolarHBondContact O-N 3.02Å; F143-G145 VanDerWaalsContact O-N 3.15Å; F143-V146 HydrophobicContact CB-CB 4.22Å; F143-V146 HydrophobicContact CB-CG2 4.48Å; F143-V146 PolarHBondContact O-N 3.22Å; F143-L151 HydrophobicContact CD1-CD1 3.79Å; F143-L151 HydrophobicContact CE1-CD1 3.83Å; F143-L151 HydrophobicContact CG-CD1 4.33Å; F143-L151 HydrophobicContact CZ-CD1 4.4Å
144	L	56.3	Low	73.7	Confident	150 Å²	150	61.9 Å²	61.9	79%	0.785	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	120.7	172.2	-78.9	164.5	0	0	0	110.4	D141 G142	D141-L144 HydrophobicContact CB-CB 4.38Å; D141-L144 HydrophobicContact CB-CD1 4.47Å; D141-L144 WeakPolarHBondContact O-CB 3.35Å; D141-L144 WeakPolarHBondContact O-CD1 3.33Å; D141-L144 WeakPolarHBondContact O-CG 3.23Å; D141-L144 PolarHBondContact O-N 3.35Å; D141-L144 VanDerWaalsContact O-N 3.13Å; G142-L144 PolarHBondContact O-N 3.17Å
145	G	61.1	Low	73.8	Confident	76 Å²	76	59.5 Å²	59.5	78%	0.784	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.5	-12.4	-177.9	0	0	0	0	0	115.3	F143	F143-G145 PolarHBondContact O-N 3.02Å; F143-G145 VanDerWaalsContact O-N 3.15Å
146	V	69.8	Low	74.2	Confident	22 Å²	22	62 Å²	62	13%	0.133	36%	0.356	C	S	.	.			trans	-94.8	123.5	175.7	-173.4	0	0	0	0	109.9	F143 L151 W312	F143-V146 HydrophobicContact CB-CB 4.22Å; F143-V146 HydrophobicContact CB-CG2 4.48Å; F143-V146 PolarHBondContact O-N 3.22Å; V146-L151 HydrophobicContact CG1-CD1 4.01Å; V146-L151 HydrophobicContact CG1-CD2 4.27Å; V146-L151 HydrophobicContact CG1-CG 3.84Å; V146-W312 HydrophobicContact CG1-CZ2 3.96Å; V146-W312 HydrophobicContact CG2-CZ2 3.88Å
147	S	68.1	Low	74.7	Confident	51 Å²	51	62.8 Å²	62.8	36%	0.357	36%	0.359	S	S	.	.			trans	-67.1	140.5	177.5	86.1	0	0	0	0	110.9	S149 S150	S147-S149 PolarHBondContact O-N 3.24Å; S147-S149 VanDerWaalsContact O-N 3.15Å; S147-S149 PolarHBondContact OG-OG 3.12Å; S147-S150 WeakPolarHBondContact O-CB 3.48Å; S147-S150 PolarHBondContact O-N 3.38Å; S147-S150 PolarHBondContact OG-N 2.82Å; S147-S150 VanDerWaalsContact OG-N 3.14Å; S147-S150 PolarHBondContact OG-OG 3.27Å
148	H	70.9	Confident	75.5	Confident	146 Å²	146	62.6 Å²	62.6	68%	0.676	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.8	176.5	-115.5	-99.5	0	0	0	112.7	R155	H148-R155 PolarHBondContact CE1-NH1 2.82Å; H148-R155 PolarHBondContact ND1-NH1 3.39Å; H148-R155 VanDerWaalsContact ND1-NH1 3.15Å
149	S	75.6	Confident	76.2	Confident	57 Å²	57	65.9 Å²	65.9	40%	0.399	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-31.8	175.1	35.8	0	0	0	0	113.4	S147 L151 S152	S147-S149 PolarHBondContact O-N 3.24Å; S147-S149 VanDerWaalsContact O-N 3.15Å; S147-S149 PolarHBondContact OG-OG 3.12Å; S149-L151 VanDerWaalsContact C-N 3.34Å; S149-L151 PolarHBondContact O-N 3.1Å; S149-S152 WeakPolarHBondContact O-CB 3.48Å; S149-S152 PolarHBondContact O-N 3.46Å; S149-S152 PolarHBondContact O-OG 2.89Å
150	S	78.3	Confident	77.1	Confident	7 Å²	7	66 Å²	66	5%	0.049	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-40.3	-178.3	-63.4	0	0	0	0	112	S147 S152 N266 F273	S147-S150 WeakPolarHBondContact O-CB 3.48Å; S147-S150 PolarHBondContact O-N 3.38Å; S147-S150 PolarHBondContact OG-N 2.82Å; S147-S150 VanDerWaalsContact OG-N 3.14Å; S147-S150 PolarHBondContact OG-OG 3.27Å; S150-S152 VanDerWaalsContact C-N 3.34Å; S150-N266 PolarHBondContact O-ND2 3.07Å; S150-F273 WeakPolarHBondContact O-CD2 3.44Å
151	L	81.8	Confident	78.2	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	10.2	-178.6	-57.4	-178.4	0	0	0	113.5	F143 V146 S149 G153 L154 R155 F273	F143-L151 HydrophobicContact CD1-CD1 3.79Å; F143-L151 HydrophobicContact CE1-CD1 3.83Å; F143-L151 HydrophobicContact CG-CD1 4.33Å; F143-L151 HydrophobicContact CZ-CD1 4.4Å; V146-L151 HydrophobicContact CG1-CD1 4.01Å; V146-L151 HydrophobicContact CG1-CD2 4.27Å; V146-L151 HydrophobicContact CG1-CG 3.84Å; S149-L151 VanDerWaalsContact C-N 3.34Å; S149-L151 PolarHBondContact O-N 3.1Å; L151-G153 PolarHBondContact O-N 3.38Å; L151-L154 PolarHBondContact O-N 2.84Å; L151-R155 WeakPolarHBondContact O-CG 3.26Å; L151-R155 PolarHBondContact O-N 3.41Å; L151-F273 HydrophobicContact CD2-CD2 4.29Å; L151-F273 HydrophobicContact CD2-CE2 3.51Å; L151-F273 HydrophobicContact CD2-CZ 4.28Å
152	S	84.1	Confident	79.6	Confident	40 Å²	40	57.8 Å²	57.8	28%	0.28	35%	0.352	S	S	.	.	H	α-helix	trans	-62	-44.4	-174.2	60.1	0	0	0	0	112.7	S149 S150 R155 S156 N266 N270	S149-S152 WeakPolarHBondContact O-CB 3.48Å; S149-S152 PolarHBondContact O-N 3.46Å; S149-S152 PolarHBondContact O-OG 2.89Å; S150-S152 VanDerWaalsContact C-N 3.34Å; S152-R155 PolarHBondContact O-N 3.5Å; S152-S156 PolarHBondContact O-N 2.88Å; S152-S156 PolarHBondContact O-OG 3.41Å; S152-N266 PolarHBondContact OG-OD1 2.83Å; S152-N270 PolarHBondContact OG-ND2 3.01Å; S152-N270 VanDerWaalsContact OG-ND2 3.11Å
153	G	83.1	Confident	81	Confident	5 Å²	5	59 Å²	59	5%	0.052	35%	0.349	C	S	.	.	H	α-helix	trans	-64.4	-37.4	176.7	0	0	0	0	0	113.3	L151 S156 W157 N266	L151-G153 PolarHBondContact O-N 3.38Å; G153-S156 PolarHBondContact O-OG 3.16Å; G153-S156 VanDerWaalsContact O-OG 3.05Å; G153-W157 WeakPolarHBondContact O-CB 3.3Å; G153-W157 PolarHBondContact O-N 3.01Å; G153-W157 VanDerWaalsContact O-N 3.12Å; G153-N266 VanDerWaalsContact CA-OD1 3.28Å; G153-N266 WeakPolarHBondContact CA-OD1 3.25Å; G153-N266 PolarHBondContact N-OD1 3.45Å
154	L	85.8	Confident	82.1	Confident	12 Å²	12	60.1 Å²	60.1	6%	0.063	36%	0.361	C	S	.	.	H	α-helix	trans	-66.9	-40.3	175.6	-175	66.4	0	0	0	111.8	L131 L133 M136 L151 L265 F273 F275 M310	L131-L154 HydrophobicContact CB-CD1 4.36Å; L131-L154 HydrophobicContact CD2-CD2 4.39Å; L133-L154 HydrophobicContact CD2-CD2 3.72Å; L133-L154 HydrophobicContact CD2-CG 4.37Å; M136-L154 HydrophobicContact SD-CD2 4.17Å; L151-L154 PolarHBondContact O-N 2.84Å; L154-L265 HydrophobicContact CB-CD1 4.29Å; L154-L265 HydrophobicContact CD1-CD1 4.08Å; L154-F273 HydrophobicContact CB-CE1 4.28Å; L154-F273 HydrophobicContact CB-CZ 4.23Å; L154-F273 HydrophobicContact CD1-CE1 4.47Å; L154-F273 HydrophobicContact CD2-CZ 4.07Å; L154-F275 HydrophobicContact CD1-CD2 3.87Å; L154-F275 HydrophobicContact CD1-CE2 3.84Å; L154-M310 HydrophobicContact CD1-SD 4.36Å; L154-M310 HydrophobicContact CD2-SD 3.81Å
155	R	86.3	Confident	83.8	Confident	99 Å²	99	54.6 Å²	54.6	37%	0.374	34%	0.335	S	S	.	.	H	α-helix	trans	-72.7	-28.7	179.7	-69.6	176.2	-174.6	-166.3	4.8	113.2	H148 L151 S152	H148-R155 PolarHBondContact CE1-NH1 2.82Å; H148-R155 PolarHBondContact ND1-NH1 3.39Å; H148-R155 VanDerWaalsContact ND1-NH1 3.15Å; L151-R155 WeakPolarHBondContact O-CG 3.26Å; L151-R155 PolarHBondContact O-N 3.41Å; S152-R155 PolarHBondContact O-N 3.5Å
156	S	88.9	Confident	85.1	Confident	87 Å²	87	53.6 Å²	53.6	61%	0.608	32%	0.316	S	S	*	.	H	α-helix	trans	-81.2	-28.5	177.3	62.5	0	0	0	0	112.5	S152 G153 T158	S152-S156 PolarHBondContact O-N 2.88Å; S152-S156 PolarHBondContact O-OG 3.41Å; G153-S156 PolarHBondContact O-OG 3.16Å; G153-S156 VanDerWaalsContact O-OG 3.05Å; S156-T158 PolarHBondContact O-N 3.43Å
157	W	91.1	Very high	86	Confident	16 Å²	16	53.3 Å²	53.3	6%	0.061	31%	0.313	C	S	.	.			trans	-79.3	87.3	-178.1	-167.6	34.7	0	0	0	112.2	M128 G153 F226 H227 F263 L265 F275	M128-W157 HydrophobicContact CE-CD2 3.5Å; M128-W157 VanDerWaalsContact CE-CD2 3.5Å; M128-W157 HydrophobicContact CE-CE3 3.92Å; M128-W157 HydrophobicContact CE-CG 3.81Å; M128-W157 HydrophobicContact CE-CH2 4.4Å; M128-W157 HydrophobicContact CE-CZ2 4.01Å; M128-W157 HydrophobicContact CE-CZ3 4.35Å; M128-W157 WeakPolarHBondContact CE-O 3.16Å; M128-W157 HydrophobicContact SD-CD2 4.35Å; M128-W157 HydrophobicContact SD-CZ2 4.18Å; G153-W157 WeakPolarHBondContact O-CB 3.3Å; G153-W157 PolarHBondContact O-N 3.01Å; G153-W157 VanDerWaalsContact O-N 3.12Å; W157-F226 HydrophobicContact CZ2-CB 4.17Å; W157-F226 PolarHBondContact NE1-O 2.93Å; W157-F226 VanDerWaalsContact NE1-O 3.09Å; W157-H227 HydrophobicContact CZ2-CB 3.92Å; W157-F263 HydrophobicContact CH2-CD2 4.21Å; W157-F263 HydrophobicContact CH2-CG 4.27Å; W157-L265 HydrophobicContact CD2-CD2 3.93Å; W157-L265 HydrophobicContact CE3-CD1 3.67Å; W157-L265 HydrophobicContact CE3-CD2 3.51Å; W157-L265 HydrophobicContact CE3-CG 4.26Å; W157-L265 HydrophobicContact CH2-CD2 4.45Å; W157-L265 HydrophobicContact CZ3-CD1 4.15Å; W157-L265 HydrophobicContact CZ3-CD2 3.8Å; W157-F275 HydrophobicContact CE3-CE2 4.49Å; W157-F275 HydrophobicContact CH2-CD1 4.01Å; W157-F275 AromaticContact CH2-CE1 3.9Å; W157-F275 HydrophobicContact CH2-CE1 3.9Å; W157-F275 HydrophobicContact CH2-CZ 4.39Å; W157-F275 AromaticContact CZ3-CD1 3.56Å; W157-F275 HydrophobicContact CZ3-CD1 3.56Å; W157-F275 AromaticContact CZ3-CD2 3.98Å; W157-F275 HydrophobicContact CZ3-CD2 3.98Å; W157-F275 AromaticContact CZ3-CE1 3.54Å; W157-F275 HydrophobicContact CZ3-CE1 3.54Å; W157-F275 AromaticContact CZ3-CE2 3.93Å; W157-F275 HydrophobicContact CZ3-CE2 3.93Å; W157-F275 AromaticContact CZ3-CG 3.78Å; W157-F275 HydrophobicContact CZ3-CG 3.78Å; W157-F275 AromaticContact CZ3-CZ 3.71Å; W157-F275 HydrophobicContact CZ3-CZ 3.71Å
158	T	88.9	Confident	87.1	Confident	59 Å²	59	52.7 Å²	52.7	36%	0.362	31%	0.308	S	S	.	.			trans	-112.6	-19.5	-176	50.9	0	0	0	0	114	S156	S156-T158 PolarHBondContact O-N 3.43Å
159	H	91.3	Very high	87.9	Confident	136 Å²	136	45.8 Å²	45.8	63%	0.63	28%	0.276	S	S	*	.	S	Bend	trans	-141.2	155.8	-175.2	-62.6	86.2	0	0	0	109
160	P	92.3	Very high	88.3	Confident	23 Å²	23	45.2 Å²	45.2	15%	0.149	28%	0.279	C	S	.	.			trans	-63.4	147.9	175	29.2	-35.3	0	0	0	110.6	A126 I162 P163 M225 F226	A126-P160 HydrophobicContact CB-CB 3.73Å; A126-P160 HydrophobicContact CB-CG 3.97Å; P160-I162 VanDerWaalsContact C-N 3.3Å; P160-I162 PolarHBondContact O-N 2.97Å; P160-P163 HydrophobicContact CG-CB 4.35Å; P160-M225 WeakPolarHBondContact CB-O 3.39Å; P160-F226 HydrophobicContact CB-CD1 4.38Å
161	A	92.1	Very high	88.7	Confident	56 Å²	56	47.1 Å²	47.1	46%	0.463	29%	0.287	S	S	.	.	S	Bend	trans	-61.8	-37.6	175.8	0	0	0	0	0	112.6	M225 F226	A161-M225 PolarHBondContact N-O 3.44Å; A161-F226 PolarHBondContact N-O 2.84Å
162	I	93.3	Very high	89.1	Confident	76 Å²	76	47.1 Å²	47.1	39%	0.39	29%	0.287	S	S	.	.			trans	-132	105.9	178.4	-53.7	174.1	0	0	0	107.9	P160 S164 M225	P160-I162 VanDerWaalsContact C-N 3.3Å; P160-I162 PolarHBondContact O-N 2.97Å; I162-S164 VanDerWaalsContact C-N 3.35Å; I162-S164 VanDerWaalsContact CG2-O 3.31Å; I162-S164 WeakPolarHBondContact CG2-O 3.4Å; I162-S164 PolarHBondContact O-N 3.2Å; I162-M225 HydrophobicContact CB-CB 4.37Å; I162-M225 HydrophobicContact CB-CG 4.46Å; I162-M225 PolarHBondContact N-O 2.85Å
163	P	91.7	Very high	89.3	Confident	85 Å²	85	51.9 Å²	51.9	55%	0.552	30%	0.299	S	S	*	.	S	Bend	trans	-72.3	-25.7	-174.8	27.6	-34.6	0	0	0	113.5	E125 A126 P160	E125-P163 CarbonylContact C-O 3.55Å; E125-P163 WeakPolarHBondContact CA-O 3.22Å; A126-P163 PolarHBondContact N-O 3.06Å; P160-P163 HydrophobicContact CG-CB 4.35Å
164	S	93.1	Very high	89.6	Confident	59 Å²	59	53.2 Å²	53.2	41%	0.413	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	138.3	176.8	-177.7	0	0	0	0	111	L124 I162	L124-S164 VanDerWaalsContact O-CA 3.27Å; L124-S164 WeakPolarHBondContact O-CA 3.43Å; L124-S164 PolarHBondContact O-OG 3.24Å; I162-S164 VanDerWaalsContact C-N 3.35Å; I162-S164 VanDerWaalsContact CG2-O 3.31Å; I162-S164 WeakPolarHBondContact CG2-O 3.4Å; I162-S164 PolarHBondContact O-N 3.2Å
165	S	91.8	Very high	89.8	Confident	34 Å²	34	52.6 Å²	52.6	24%	0.238	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	151.3	178.1	-172.3	0	0	0	0	111.2	L124	L124-S165 PolarHBondContact N-O 3.31Å; L124-S165 PolarHBondContact O-N 3.16Å
166	S	89.6	Confident	89.9	Confident	55 Å²	55	49.5 Å²	49.5	39%	0.385	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.1	175.1	-64.2	0	0	0	0	110.5	L122 R356	L122-S166 CarbonylContact O-C 3.58Å; L122-S166 WeakPolarHBondContact O-CA 3.41Å; S166-R356 PolarHBondContact OG-NH2 2.73Å
167	F	89.4	Confident	89.9	Confident	15 Å²	15	46.4 Å²	46.4	7%	0.066	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	137.9	178.4	-64.2	-85.3	0	0	0	110.6	T121 L122 L124 F172 L218 L222 M225	T121-F167 CarbonylContact C-O 3.58Å; T121-F167 WeakPolarHBondContact CA-O 3.41Å; L122-F167 PolarHBondContact N-O 2.9Å; L122-F167 PolarHBondContact O-N 2.9Å; L124-F167 HydrophobicContact CB-CE2 4.48Å; L124-F167 HydrophobicContact CD1-CD2 3.77Å; L124-F167 HydrophobicContact CD1-CE2 3.87Å; L124-F167 HydrophobicContact CG-CD2 4.11Å; L124-F167 HydrophobicContact CG-CE2 4.39Å; F167-F172 HydrophobicContact CB-CE2 3.91Å; F167-F172 HydrophobicContact CB-CZ 4.26Å; F167-L218 HydrophobicContact CD1-CD1 4.38Å; F167-L222 HydrophobicContact CD2-CD2 4.27Å; F167-L222 HydrophobicContact CE1-CD2 4.49Å; F167-L222 HydrophobicContact CE2-CD2 3.92Å; F167-L222 HydrophobicContact CZ-CD2 4.03Å; F167-M225 HydrophobicContact CE2-SD 3.62Å; F167-M225 HydrophobicContact CZ-CG 4.39Å; F167-M225 HydrophobicContact CZ-SD 3.85Å
168	P	89.6	Confident	89.7	Confident	38 Å²	38	48.5 Å²	48.5	25%	0.247	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	136.5	170.6	-22.5	34.2	0	0	0	111.5	E120 G170 H171	E120-P168 WeakPolarHBondContact O-CA 3.41Å; P168-G170 PolarHBondContact O-N 2.85Å; P168-H171 WeakPolarHBondContact O-CB 3.06Å; P168-H171 PolarHBondContact O-N 3.08Å; P168-H171 VanDerWaalsContact O-N 3.12Å
169	A	87.3	Confident	89.3	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.008	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-58.3	-37.4	178.9	0	0	0	0	0	111.8	E120 H171 F172 A290 S291 V293	E120-A169 HydrophobicContact CB-CB 4.08Å; E120-A169 WeakPolarHBondContact O-CB 3.43Å; E120-A169 PolarHBondContact O-N 3.2Å; A169-H171 PolarHBondContact O-N 3.33Å; A169-H171 VanDerWaalsContact O-N 3.12Å; A169-F172 WeakPolarHBondContact O-CB 3.35Å; A169-F172 PolarHBondContact O-N 2.81Å; A169-A290 CarbonylContact C-O 3.6Å; A169-S291 VanDerWaalsContact CB-O 3.31Å; A169-S291 WeakPolarHBondContact CB-O 3.21Å; A169-V293 HydrophobicContact CB-CG2 4.18Å
170	G	84.8	Confident	88.6	Confident	45 Å²	45	53 Å²	53	46%	0.464	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-59	-24.6	178	0	0	0	0	0	114.4	P168 F172 R173	P168-G170 PolarHBondContact O-N 2.85Å; G170-F172 PolarHBondContact O-N 3.17Å; G170-R173 WeakPolarHBondContact O-CB 3.5Å; G170-R173 PolarHBondContact O-N 3.21Å
171	H	87.8	Confident	88	Confident	48 Å²	48	55.6 Å²	55.6	22%	0.222	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-65	-31.2	175.8	-69	-165.6	0	0	0	111.6	V113 D115 P168 A169 R173 V174 L218	V113-H171 WeakPolarHBondContact CG1-CD2 3.48Å; V113-H171 WeakPolarHBondContact CG1-NE2 3.37Å; D115-H171 IonicContact OD1-NE2 3.95Å; P168-H171 WeakPolarHBondContact O-CB 3.06Å; P168-H171 PolarHBondContact O-N 3.08Å; P168-H171 VanDerWaalsContact O-N 3.12Å; A169-H171 PolarHBondContact O-N 3.33Å; A169-H171 VanDerWaalsContact O-N 3.12Å; H171-R173 PolarHBondContact O-N 3.33Å; H171-R173 VanDerWaalsContact O-N 3.14Å; H171-V174 WeakPolarHBondContact O-CG2 3.21Å; H171-V174 PolarHBondContact O-N 2.9Å; H171-L218 HydrophobicContact CB-CD1 4.01Å; H171-L218 HydrophobicContact CB-CD2 4.44Å; H171-L218 WeakPolarHBondContact O-CD2 3.27Å
172	F	88.9	Confident	87.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-73.1	-1.7	-179.2	-65.1	-90.1	0	0	0	113.4	L122 L124 F167 A169 G170 V174 F175 L218 L222 I284 I286 V293 F296	L122-F172 HydrophobicContact CB-CE2 4.36Å; L122-F172 HydrophobicContact CD2-CE1 4.46Å; L122-F172 HydrophobicContact CD2-CE2 3.83Å; L122-F172 HydrophobicContact CD2-CZ 3.73Å; L124-F172 HydrophobicContact CD1-CZ 4.42Å; F167-F172 HydrophobicContact CB-CE2 3.91Å; F167-F172 HydrophobicContact CB-CZ 4.26Å; A169-F172 WeakPolarHBondContact O-CB 3.35Å; A169-F172 PolarHBondContact O-N 2.81Å; G170-F172 PolarHBondContact O-N 3.17Å; F172-V174 PolarHBondContact O-N 3.44Å; F172-F175 HydrophobicContact CB-CD2 4.45Å; F172-F175 HydrophobicContact CD1-CD2 4.07Å; F172-F175 HydrophobicContact CD1-CE2 4.01Å; F172-F175 PolarHBondContact O-N 3.36Å; F172-L218 HydrophobicContact CD1-CD2 3.95Å; F172-L218 HydrophobicContact CE1-CD2 4.32Å; F172-L218 HydrophobicContact CG-CD2 4.26Å; F172-L218 HydrophobicContact CZ-CD1 4.49Å; F172-L222 HydrophobicContact CE1-CD1 4.47Å; F172-I284 HydrophobicContact CB-CD1 3.86Å; F172-I284 HydrophobicContact CD1-CD1 3.57Å; F172-I284 HydrophobicContact CE1-CD1 4.44Å; F172-I284 HydrophobicContact CG-CD1 3.98Å; F172-I286 HydrophobicContact CB-CD1 3.66Å; F172-V293 HydrophobicContact CB-CG2 3.9Å; F172-V293 HydrophobicContact CD2-CG2 3.86Å; F172-V293 HydrophobicContact CG-CG2 3.97Å; F172-F296 HydrophobicContact CD1-CD2 4.11Å; F172-F296 HydrophobicContact CD1-CE2 4.14Å; F172-F296 AromaticContact CE1-CD2 3.61Å; F172-F296 HydrophobicContact CE1-CD2 3.61Å; F172-F296 AromaticContact CE1-CE2 3.6Å; F172-F296 HydrophobicContact CE1-CE2 3.6Å; F172-F296 HydrophobicContact CE1-CG 4.26Å; F172-F296 HydrophobicContact CE1-CZ 4.24Å
173	R	89.4	Confident	87.1	Confident	141 Å²	141	59.4 Å²	59.4	53%	0.532	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-53.2	-25.9	169.5	-171.4	174	174.2	-159	-8.8	112.8	E111 G170 H171 F175 L176 A290	E111-R173 IonicContact OE2-CZ 2.74Å; E111-R173 VanDerWaalsContact OE2-CZ 3.24Å; E111-R173 IonicContact OE2-NH1 3.89Å; E111-R173 PolarHBondContact OE2-NH1 2.72Å; E111-R173 IonicContact OE2-NH2 2.83Å; E111-R173 PolarHBondContact OE2-NH2 3.37Å; G170-R173 WeakPolarHBondContact O-CB 3.5Å; G170-R173 PolarHBondContact O-N 3.21Å; H171-R173 PolarHBondContact O-N 3.33Å; H171-R173 VanDerWaalsContact O-N 3.14Å; R173-F175 PolarHBondContact O-N 3.27Å; R173-F175 VanDerWaalsContact O-N 3.17Å; R173-L176 HydrophobicContact CG-CD1 3.96Å; R173-L176 HydrophobicContact CG-CG 4.49Å; R173-L176 WeakPolarHBondContact O-CB 3.36Å; R173-L176 PolarHBondContact O-N 3.05Å; R173-A290 HydrophobicContact CB-CB 3.62Å; R173-A290 HydrophobicContact CG-CB 4.01Å
174	V	88.3	Confident	86.9	Confident	32 Å²	32	57 Å²	57	19%	0.194	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-53.4	-31.2	173.4	173.8	0	0	0	0	112.8	H171 F172 V190 K215	H171-V174 WeakPolarHBondContact O-CG2 3.21Å; H171-V174 PolarHBondContact O-N 2.9Å; F172-V174 PolarHBondContact O-N 3.44Å; V174-V190 HydrophobicContact CG1-CG1 3.44Å; V174-V190 VanDerWaalsContact CG1-CG1 3.44Å; V174-K215 HydrophobicContact CG1-CB 3.64Å; V174-K215 HydrophobicContact CG1-CD 4.21Å; V174-K215 HydrophobicContact CG1-CG 3.78Å; V174-K215 HydrophobicContact CG2-CB 4.38Å; V174-K215 HydrophobicContact CG2-CG 4.15Å
175	F	89.7	Confident	86.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-86	-0.4	178.8	-66.5	-72.9	0	0	0	113.9	F172 R173 W188 V190 L218 I255 F257 I284 F296	F172-F175 HydrophobicContact CB-CD2 4.45Å; F172-F175 HydrophobicContact CD1-CD2 4.07Å; F172-F175 HydrophobicContact CD1-CE2 4.01Å; F172-F175 PolarHBondContact O-N 3.36Å; R173-F175 PolarHBondContact O-N 3.27Å; R173-F175 VanDerWaalsContact O-N 3.17Å; F175-W188 WeakPolarHBondContact O-CZ2 3.35Å; F175-V190 HydrophobicContact CD1-CG2 4.46Å; F175-L218 HydrophobicContact CD2-CD2 4.33Å; F175-L218 HydrophobicContact CE2-CD2 3.8Å; F175-I255 WeakPolarHBondContact O-CD1 3.46Å; F175-F257 HydrophobicContact CD1-CB 4.4Å; F175-F257 HydrophobicContact CD1-CD1 4.08Å; F175-F257 HydrophobicContact CD1-CD2 4.47Å; F175-F257 HydrophobicContact CD1-CE1 4.49Å; F175-F257 HydrophobicContact CD1-CG 4.07Å; F175-F257 HydrophobicContact CE1-CB 4.3Å; F175-F257 AromaticContact CE1-CD1 3.96Å; F175-F257 HydrophobicContact CE1-CD1 3.96Å; F175-F257 AromaticContact CE1-CD2 3.66Å; F175-F257 HydrophobicContact CE1-CD2 3.66Å; F175-F257 HydrophobicContact CE1-CE1 4.15Å; F175-F257 AromaticContact CE1-CE2 3.85Å; F175-F257 HydrophobicContact CE1-CE2 3.85Å; F175-F257 AromaticContact CE1-CG 3.7Å; F175-F257 HydrophobicContact CE1-CG 3.7Å; F175-F257 HydrophobicContact CE1-CZ 4.1Å; F175-F257 HydrophobicContact CZ-CD2 4.22Å; F175-F257 HydrophobicContact CZ-CE1 4.34Å; F175-F257 AromaticContact CZ-CE2 3.93Å; F175-F257 HydrophobicContact CZ-CE2 3.93Å; F175-F257 AromaticContact CZ-CZ 4Å; F175-F257 HydrophobicContact CZ-CZ 4Å; F175-I284 HydrophobicContact CB-CG2 4.36Å; F175-I284 HydrophobicContact CD2-CD1 4.2Å; F175-I284 HydrophobicContact CG-CG2 4.49Å; F175-F296 HydrophobicContact CE2-CE2 4.5Å
176	L	89.2	Confident	86.3	Confident	33 Å²	33	55.5 Å²	55.5	17%	0.173	31%	0.312	C	S	.	.	S	Bend	trans	-72.1	146	177.5	-69	-175.3	0	0	0	111.6	R173 Y253 I286 K288 A290	R173-L176 HydrophobicContact CG-CD1 3.96Å; R173-L176 HydrophobicContact CG-CG 4.49Å; R173-L176 WeakPolarHBondContact O-CB 3.36Å; R173-L176 PolarHBondContact O-N 3.05Å; L176-Y253 HydrophobicContact CD2-CD2 4.18Å; L176-I286 HydrophobicContact CD2-CG2 3.93Å; L176-K288 WeakPolarHBondContact CD1-O 3.44Å; L176-A290 HydrophobicContact CD1-CB 3.92Å; L176-A290 HydrophobicContact CG-CB 4.34Å
177	P	88.6	Confident	86.3	Confident	23 Å²	23	53.7 Å²	53.7	15%	0.149	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-65.8	145.9	178.5	25.7	-34	0	0	0	112.5	K181 W188 I245 Y253	P177-K181 WeakPolarHBondContact CB-O 3.45Å; P177-W188 HydrophobicContact CB-CE3 4.47Å; P177-W188 HydrophobicContact CB-CH2 3.93Å; P177-W188 HydrophobicContact CB-CZ2 4.02Å; P177-W188 HydrophobicContact CB-CZ3 4.16Å; P177-I245 HydrophobicContact CB-CD1 4.04Å; P177-I245 HydrophobicContact CG-CD1 3.99Å; P177-Y253 HydrophobicContact CG-CD2 4.47Å; P177-Y253 HydrophobicContact CG-CE2 4.07Å
178	P	86.9	Confident	86.4	Confident	60 Å²	60	53.6 Å²	53.6	39%	0.39	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-69.1	161.8	172.7	30.5	-35	0	0	0	111.5	G180 K181 W188	P178-G180 PolarHBondContact O-N 3.43Å; P178-G180 VanDerWaalsContact O-N 3.14Å; P178-K181 HydrophobicContact CG-CB 4.32Å; P178-K181 HydrophobicContact CG-CD 4.04Å; P178-K181 HydrophobicContact CG-CG 4.39Å; P178-K181 PolarHBondContact O-N 3.29Å; P178-W188 HydrophobicContact CG-CB 4.18Å; P178-W188 HydrophobicContact CG-CG 4.1Å
179	K	81.6	Confident	86.4	Confident	219 Å²	219	56.4 Å²	56.4	95%	0.952	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	120.7	178.5	-65.2	-179	-178.6	175.4	0	110.2
180	G	75.7	Confident	86.4	Confident	71 Å²	71	56.9 Å²	56.9	73%	0.732	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.1	-2.8	177.7	0	0	0	0	0	116	P178	P178-G180 PolarHBondContact O-N 3.43Å; P178-G180 VanDerWaalsContact O-N 3.14Å
181	K	78.9	Confident	86.4	Confident	76 Å²	76	55.2 Å²	55.2	33%	0.33	29%	0.289	S	S	.	.			trans	-116.4	74.8	175.4	-72.1	-170.5	176.5	-173.6	0	111.3	P177 P178 D186 A187 W188 I245	P177-K181 WeakPolarHBondContact CB-O 3.45Å; P178-K181 HydrophobicContact CG-CB 4.32Å; P178-K181 HydrophobicContact CG-CD 4.04Å; P178-K181 HydrophobicContact CG-CG 4.39Å; P178-K181 PolarHBondContact O-N 3.29Å; K181-D186 VanDerWaalsContact C-OD2 3.31Å; K181-D186 VanDerWaalsContact CA-OD2 3.26Å; K181-D186 WeakPolarHBondContact CA-OD2 3.46Å; K181-D186 HydrophobicContact CB-CB 3.94Å; K181-D186 HydrophobicContact CG-CB 4.32Å; K181-A187 PolarHBondContact NZ-O 3.28Å; K181-W188 HydrophobicContact CD-CB 3.87Å; K181-I245 WeakPolarHBondContact O-CD1 3.28Å
182	T	80.8	Confident	86.2	Confident	77 Å²	77	56.4 Å²	56.4	47%	0.472	30%	0.302	S	S	.	.			trans	-113.3	-3.9	-172.6	52.1	0	0	0	0	113.4	D186	T182-D186 PolarHBondContact N-OD2 3.49Å
183	E	85.5	Confident	85.5	Confident	135 Å²	135	58.7 Å²	58.7	63%	0.631	32%	0.319	S	S	*	.	S	Bend	trans	-90.6	144.5	-177.8	-61.1	-168.3	169	0	0	110.5	G185 D186	E183-G185 PolarHBondContact O-N 2.9Å; E183-D186 PolarHBondContact N-OD2 3.32Å; E183-D186 VanDerWaalsContact N-OD2 3.1Å; E183-D186 WeakPolarHBondContact O-CB 3.16Å; E183-D186 PolarHBondContact O-N 2.67Å; E183-D186 VanDerWaalsContact O-N 3.16Å
184	P	87.3	Confident	84.4	Confident	35 Å²	35	58.4 Å²	58.4	23%	0.227	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	135.1	171	-22.8	33.5	0	0	0	111.3	I245 S374 I376	P184-I245 CarbonylContact C-O 3.6Å; P184-I245 VanDerWaalsContact CA-O 3.3Å; P184-I245 WeakPolarHBondContact CA-O 3.44Å; P184-I245 HydrophobicContact CB-CG2 4.46Å; P184-I245 HydrophobicContact CG-CG2 4.48Å; P184-S374 WeakPolarHBondContact CG-OG 3.48Å; P184-I376 HydrophobicContact CB-CG1 4.38Å; P184-I376 HydrophobicContact CB-CG2 4.06Å
185	G	85.6	Confident	83.2	Confident	12 Å²	12	58.5 Å²	58.5	12%	0.124	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.1	-14.5	-174.5	0	0	0	0	0	114.4	E183 A187 I245	E183-G185 PolarHBondContact O-N 2.9Å; G185-A187 PolarHBondContact O-N 2.61Å; G185-A187 VanDerWaalsContact O-N 3.17Å; G185-I245 PolarHBondContact N-O 2.9Å
186	D	86.9	Confident	81.4	Confident	49 Å²	49	62 Å²	62	26%	0.262	34%	0.342	S	S	.	.			trans	-66.7	115.3	173.2	-76.2	-28.2	0	0	0	110.3	K181 T182 E183 W188 C244 I245	K181-D186 VanDerWaalsContact C-OD2 3.31Å; K181-D186 VanDerWaalsContact CA-OD2 3.26Å; K181-D186 WeakPolarHBondContact CA-OD2 3.46Å; K181-D186 HydrophobicContact CB-CB 3.94Å; K181-D186 HydrophobicContact CG-CB 4.32Å; T182-D186 PolarHBondContact N-OD2 3.49Å; E183-D186 PolarHBondContact N-OD2 3.32Å; E183-D186 VanDerWaalsContact N-OD2 3.1Å; E183-D186 WeakPolarHBondContact O-CB 3.16Å; E183-D186 PolarHBondContact O-N 2.67Å; E183-D186 VanDerWaalsContact O-N 3.16Å; D186-W188 VanDerWaalsContact O-CE3 3.29Å; D186-W188 VanDerWaalsContact O-CZ3 3.22Å; D186-W188 WeakPolarHBondContact O-CZ3 3.42Å; D186-C244 WeakPolarHBondContact O-CA 3.29Å; D186-I245 PolarHBondContact O-N 2.97Å
187	A	89.9	Confident	79.5	Confident	17 Å²	17	68.4 Å²	68.4	14%	0.14	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	143	174.6	0	0	0	0	0	111.9	K181 G185 V242 A243 C244 T388	K181-A187 PolarHBondContact NZ-O 3.28Å; G185-A187 PolarHBondContact O-N 2.61Å; G185-A187 VanDerWaalsContact O-N 3.17Å; A187-V242 HydrophobicContact CB-CG1 4.2Å; A187-A243 CarbonylContact C-O 3.52Å; A187-A243 VanDerWaalsContact CA-O 3.25Å; A187-A243 WeakPolarHBondContact CA-O 3.46Å; A187-C244 HydrophobicContact CB-CB 4.32Å; A187-T388 WeakPolarHBondContact CB-OG1 3.46Å
188	W	91.4	Very high	77.1	Confident	13 Å²	13	74.9 Å²	74.9	5%	0.049	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	156	175.2	69.4	98.7	0	0	0	112.9	F175 P177 P178 K181 D186 V190 V242 A243 I245 I255	F175-W188 WeakPolarHBondContact O-CZ2 3.35Å; P177-W188 HydrophobicContact CB-CE3 4.47Å; P177-W188 HydrophobicContact CB-CH2 3.93Å; P177-W188 HydrophobicContact CB-CZ2 4.02Å; P177-W188 HydrophobicContact CB-CZ3 4.16Å; P178-W188 HydrophobicContact CG-CB 4.18Å; P178-W188 HydrophobicContact CG-CG 4.1Å; K181-W188 HydrophobicContact CD-CB 3.87Å; D186-W188 VanDerWaalsContact O-CE3 3.29Å; D186-W188 VanDerWaalsContact O-CZ3 3.22Å; D186-W188 WeakPolarHBondContact O-CZ3 3.42Å; W188-V190 PolarHBondContact O-N 2.92Å; W188-V242 CarbonylContact O-C 3.57Å; W188-V242 WeakPolarHBondContact O-CA 3.45Å; W188-V242 WeakPolarHBondContact O-CG1 3.44Å; W188-A243 HydrophobicContact CD2-CB 4.29Å; W188-A243 VanDerWaalsContact CE3-O 3.32Å; W188-A243 HydrophobicContact CH2-CB 3.93Å; W188-A243 HydrophobicContact CZ2-CB 3.54Å; W188-A243 HydrophobicContact CZ3-CB 4.45Å; W188-A243 PolarHBondContact N-O 2.73Å; W188-A243 PolarHBondContact O-N 3.46Å; W188-I245 HydrophobicContact CH2-CG1 3.84Å; W188-I245 HydrophobicContact CZ3-CD1 4.37Å; W188-I245 HydrophobicContact CZ3-CG1 3.75Å; W188-I255 HydrophobicContact CH2-CD1 4.26Å; W188-I255 HydrophobicContact CH2-CG2 3.97Å; W188-I255 HydrophobicContact CZ2-CD1 4.45Å; W188-I255 HydrophobicContact CZ2-CG2 4.31Å
189	W	89.1	Confident	75.2	Confident	98 Å²	98	75.4 Å²	75.4	37%	0.371	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	118	172.9	-65.7	96.7	0	0	0	109.7	Q239 V242 T388 F389	W189-Q239 WeakPolarHBondContact CZ3-O 3.43Å; W189-V242 HydrophobicContact CD2-CG2 3.65Å; W189-V242 HydrophobicContact CE3-CG2 3.37Å; W189-V242 HydrophobicContact CG-CG2 4.47Å; W189-V242 HydrophobicContact CH2-CG2 3.66Å; W189-V242 HydrophobicContact CZ2-CG2 3.91Å; W189-V242 HydrophobicContact CZ3-CG2 3.39Å; W189-T388 HydrophobicContact CZ2-CG2 4.01Å; W189-F389 AromaticContact CH2-CD1 3.57Å; W189-F389 HydrophobicContact CH2-CD1 3.57Å; W189-F389 AromaticContact CH2-CE1 3.6Å; W189-F389 HydrophobicContact CH2-CE1 3.6Å; W189-F389 HydrophobicContact CH2-CG 4.37Å; W189-F389 HydrophobicContact CH2-CZ 4.41Å; W189-F389 AromaticContact CZ3-CD1 3.96Å; W189-F389 HydrophobicContact CZ3-CD1 3.96Å; W189-F389 AromaticContact CZ3-CE1 3.46Å; W189-F389 HydrophobicContact CZ3-CE1 3.46Å; W189-F389 VanDerWaalsContact CZ3-CE1 3.46Å; W189-F389 HydrophobicContact CZ3-CZ 4.04Å
190	V	87.4	Confident	73.9	Confident	10 Å²	10	66.3 Å²	66.3	6%	0.061	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-44	168	-179.7	0	0	0	0	109.2	V174 F175 W188 K215 T241 A243	V174-V190 HydrophobicContact CG1-CG1 3.44Å; V174-V190 VanDerWaalsContact CG1-CG1 3.44Å; F175-V190 HydrophobicContact CD1-CG2 4.46Å; W188-V190 PolarHBondContact O-N 2.92Å; V190-K215 WeakPolarHBondContact O-CD 3.43Å; V190-T241 HydrophobicContact CB-CG2 3.9Å; V190-T241 HydrophobicContact CG1-CG2 4.46Å; V190-T241 HydrophobicContact CG2-CG2 4.18Å; V190-T241 PolarHBondContact N-O 3.37Å; V190-A243 HydrophobicContact CG2-CB 3.6Å
191	I	85.9	Confident	73.2	Confident	10 Å²	10	70.2 Å²	70.2	5%	0.051	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	115.8	172.6	-57	177.4	0	0	0	106.5	K215 E216 I219 I232 G240 T241	I191-K215 HydrophobicContact CG1-CB 4.36Å; I191-E216 HydrophobicContact CD1-CB 4.38Å; I191-E216 HydrophobicContact CD1-CG 3.76Å; I191-E216 HydrophobicContact CG1-CG 4.46Å; I191-E216 HydrophobicContact CG2-CG 4.25Å; I191-I219 HydrophobicContact CD1-CB 4.48Å; I191-I219 HydrophobicContact CD1-CD1 3.46Å; I191-I219 VanDerWaalsContact CD1-CD1 3.46Å; I191-I219 HydrophobicContact CD1-CG1 4.13Å; I191-I219 HydrophobicContact CG1-CD1 4.28Å; I191-I232 HydrophobicContact CD1-CG2 3.83Å; I191-G240 CarbonylContact O-C 3.51Å; I191-G240 VanDerWaalsContact O-CA 3.25Å; I191-G240 WeakPolarHBondContact O-CA 3.35Å; I191-T241 PolarHBondContact N-O 3.13Å; I191-T241 PolarHBondContact O-N 3.03Å
192	S	82.3	Confident	72.6	Confident	73 Å²	73	69 Å²	69	51%	0.51	36%	0.362	S	S	.	.			trans	-77.8	155.7	178.8	-57.4	0	0	0	0	111.6
193	S	75.1	Confident	72	Confident	49 Å²	49	69.1 Å²	69.1	34%	0.343	36%	0.364	S	S	.	.			trans	-63.6	138.2	168.9	179.5	0	0	0	0	110.7	L195	S193-L195 PolarHBondContact OG-N 2.96Å; S193-L195 VanDerWaalsContact OG-N 3.17Å
194	E	67.3	Low	71.4	Confident	134 Å²	134	64.6 Å²	64.6	63%	0.626	34%	0.344	S	S	*	.			trans	-98.1	-6.6	169.3	-74	-176.4	169.5	0	0	112.2	N196 K233	E194-N196 PolarHBondContact O-N 3.09Å; E194-K233 HydrophobicContact CG-CD 4.42Å; E194-K233 IonicContact OE1-NZ 3.07Å; E194-K233 PolarHBondContact OE1-NZ 2.82Å; E194-K233 WeakPolarHBondContact OE2-CD 3.39Å; E194-K233 VanDerWaalsContact OE2-CE 3.3Å; E194-K233 WeakPolarHBondContact OE2-CE 3.4Å; E194-K233 IonicContact OE2-NZ 3.26Å; E194-K233 PolarHBondContact OE2-NZ 2.87Å
195	L	62.6	Low	70.8	Confident	34 Å²	34	65.7 Å²	65.7	18%	0.178	35%	0.348	C	S	.	.			trans	-71.4	127	173.5	-66.5	171.3	0	0	0	109.7	S193 A237 Q239	S193-L195 PolarHBondContact OG-N 2.96Å; S193-L195 VanDerWaalsContact OG-N 3.17Å; L195-A237 HydrophobicContact CD1-CB 4.09Å; L195-Q239 VanDerWaalsContact CD1-CD 3.43Å; L195-Q239 HydrophobicContact CD1-CG 3.84Å; L195-Q239 VanDerWaalsContact CG-CD 3.43Å; L195-Q239 HydrophobicContact CG-CG 4.35Å
196	N	52.1	Low	70.4	Confident	75 Å²	75	67.3 Å²	67.3	40%	0.401	35%	0.35	S	S	.	.			trans	-117.1	169.3	163.1	65.1	29.9	0	0	0	110.1	E194 F198 T199 G200	E194-N196 PolarHBondContact O-N 3.09Å; N196-F198 PolarHBondContact O-N 2.96Å; N196-F198 WeakPolarHBondContact OD1-CA 3.4Å; N196-F198 WeakPolarHBondContact OD1-CB 3.26Å; N196-F198 PolarHBondContact OD1-N 3.44Å; N196-T199 PolarHBondContact N-OG1 3.34Å; N196-T199 PolarHBondContact O-N 3.15Å; N196-T199 VanDerWaalsContact O-N 3.1Å; N196-T199 PolarHBondContact O-OG1 3.25Å; N196-T199 WeakPolarHBondContact OD1-CG2 3.23Å; N196-T199 PolarHBondContact OD1-N 3.3Å; N196-T199 PolarHBondContact OD1-OG1 3.14Å; N196-T199 VanDerWaalsContact OD1-OG1 3.06Å; N196-G200 PolarHBondContact O-N 2.89Å; N196-G200 VanDerWaalsContact O-N 3.13Å
197	I	48.5	Very low	70.1	Confident	166 Å²	166	67.3 Å²	67.3	85%	0.851	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-25.7	-179.9	-50.3	169.6	0	0	0	111.5
198	F	37.7	Very low	69.8	Low	160 Å²	160	72.6 Å²	72.6	70%	0.702	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-25.3	-178.2	-57.1	-76.4	0	0	0	114.3	F75 N196	F75-F198 HydrophobicContact CE1-CZ 4.35Å; N196-F198 PolarHBondContact O-N 2.96Å; N196-F198 WeakPolarHBondContact OD1-CA 3.4Å; N196-F198 WeakPolarHBondContact OD1-CB 3.26Å; N196-F198 PolarHBondContact OD1-N 3.44Å
199	T	48.4	Very low	69.6	Low	70 Å²	70	73.4 Å²	73.4	43%	0.429	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-29.3	179.1	52.4	0	0	0	0	112.7	N196 Y201	N196-T199 PolarHBondContact N-OG1 3.34Å; N196-T199 PolarHBondContact O-N 3.15Å; N196-T199 VanDerWaalsContact O-N 3.1Å; N196-T199 PolarHBondContact O-OG1 3.25Å; N196-T199 WeakPolarHBondContact OD1-CG2 3.23Å; N196-T199 PolarHBondContact OD1-N 3.3Å; N196-T199 PolarHBondContact OD1-OG1 3.14Å; N196-T199 VanDerWaalsContact OD1-OG1 3.06Å; T199-Y201 PolarHBondContact O-N 2.87Å
200	G	53	Low	69.3	Low	29 Å²	29	72.4 Å²	72.4	30%	0.299	38%	0.381	S	S	.	.			trans	66.1	-50.6	170.1	0	0	0	0	0	117.3	N196	N196-G200 PolarHBondContact O-N 2.89Å; N196-G200 VanDerWaalsContact O-N 3.13Å
201	Y	61.9	Low	69.1	Low	152 Å²	152	77.7 Å²	77.7	60%	0.596	41%	0.414	S	S	*	.			trans	-165.7	152.9	-176	49.4	-88.1	0	0	0	112.2	T199	T199-Y201 PolarHBondContact O-N 2.87Å
202	L	66.4	Low	69	Low	52 Å²	52	78.7 Å²	78.7	27%	0.272	42%	0.421	S	S	.	.			trans	-87.4	151.9	171.8	-59.9	172.9	0	0	0	111	R235	L202-R235 HydrophobicContact CB-CB 4.42Å; L202-R235 HydrophobicContact CB-CG 4.16Å; L202-R235 PolarHBondContact N-O 2.75Å
203	P	68	Low	69	Low	79 Å²	79	82.9 Å²	82.9	51%	0.513	43%	0.43	S	S	.	.			trans	-67	146.2	-175.5	24.9	-33	0	0	0	113.1	R206	P203-R206 HydrophobicContact CG-CG 4.09Å; P203-R206 PolarHBondContact O-NE 2.99Å; P203-R206 VanDerWaalsContact O-NE 3.08Å
204	N	73.3	Confident	69.5	Low	40 Å²	40	83 Å²	83	21%	0.214	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-19	-177.6	-61.6	-37.2	0	0	0	114	R206 R235 W274 L313 M322	N204-R206 PolarHBondContact O-N 3.03Å; N204-R235 WeakPolarHBondContact OD1-CD 3.49Å; N204-R235 PolarHBondContact OD1-NH1 3.29Å; N204-W274 WeakPolarHBondContact O-CZ2 3.33Å; N204-W274 PolarHBondContact O-NE1 2.8Å; N204-L313 HydrophobicContact CB-CD1 4.06Å; N204-M322 HydrophobicContact CB-CE 4.05Å; N204-M322 WeakPolarHBondContact ND2-CE 3.5Å
205	N	73	Confident	70.2	Confident	57 Å²	57	80.4 Å²	80.4	31%	0.305	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	25.9	-173.7	-69.1	-9.4	0	0	0	114.2	L313 E318	N205-L313 WeakPolarHBondContact OD1-CD1 3.44Å; N205-E318 WeakPolarHBondContact ND2-CG 2.96Å; N205-E318 PolarHBondContact ND2-OE1 2.96Å
206	R	79.1	Confident	71.4	Confident	47 Å²	47	80 Å²	80	18%	0.177	42%	0.423	C	S	.	.			trans	-89.4	124.6	177.7	-63.3	-177.2	-64.8	151.4	11.1	109.4	P203 N204 F231 E262 W274	P203-R206 HydrophobicContact CG-CG 4.09Å; P203-R206 PolarHBondContact O-NE 2.99Å; P203-R206 VanDerWaalsContact O-NE 3.08Å; N204-R206 PolarHBondContact O-N 3.03Å; R206-F231 HydrophobicContact CB-CE1 4.02Å; R206-F231 HydrophobicContact CB-CZ 4.03Å; R206-E262 IonicContact NH2-OE1 3.6Å; R206-E262 PolarHBondContact NH2-OE1 3.27Å; R206-W274 HydrophobicContact CB-CH2 4.02Å; R206-W274 HydrophobicContact CB-CZ2 4.09Å; R206-W274 VanDerWaalsContact O-CZ2 3.26Å; R206-W274 WeakPolarHBondContact O-CZ2 3.33Å
207	Y	79.9	Confident	73.2	Confident	49 Å²	49	79.6 Å²	79.6	19%	0.192	42%	0.423	C	S	.	.			trans	-98.3	-31.2	175.3	-73.7	-96.5	0	0	0	112.4	R229 V268 N270 P272	Y207-R229 VanDerWaalsContact O-CD 3.23Å; Y207-R229 WeakPolarHBondContact O-CD 3.48Å; Y207-V268 HydrophobicContact CD1-CG2 3.98Å; Y207-V268 HydrophobicContact CD2-CG2 4.4Å; Y207-V268 HydrophobicContact CE1-CG2 3.73Å; Y207-V268 HydrophobicContact CE2-CG2 4.16Å; Y207-V268 HydrophobicContact CG-CG2 4.3Å; Y207-N270 WeakPolarHBondContact CE1-O 3.33Å; Y207-N270 PolarHBondContact OH-O 2.99Å; Y207-N270 VanDerWaalsContact OH-O 3.14Å; Y207-P272 HydrophobicContact CD2-CG 4.38Å; Y207-P272 HydrophobicContact CE1-CG 4.04Å; Y207-P272 HydrophobicContact CE2-CG 3.82Å; Y207-P272 WeakPolarHBondContact OH-CD 3.47Å
208	H	84.3	Confident	75.2	Confident	127 Å²	127	72 Å²	72	59%	0.588	38%	0.384	S	S	*	.	S	Bend	trans	-118.3	139.4	-176.7	-59.2	-66.6	0	0	0	110.8	F231	H208-F231 VanDerWaalsContact O-CZ 3.27Å; H208-F231 WeakPolarHBondContact O-CZ 3.3Å
209	P	85.5	Confident	77.7	Confident	30 Å²	30	64.4 Å²	64.4	20%	0.195	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-65.6	149.1	175.5	28.7	-34.2	0	0	0	110.7	A230 F231	P209-A230 WeakPolarHBondContact CB-O 3.25Å; P209-F231 HydrophobicContact CB-CD1 4.21Å; P209-F231 HydrophobicContact CB-CD2 4.09Å; P209-F231 HydrophobicContact CB-CE1 4.28Å; P209-F231 HydrophobicContact CB-CE2 4.13Å; P209-F231 HydrophobicContact CB-CG 4.13Å; P209-F231 HydrophobicContact CB-CZ 4.24Å
210	P	84.2	Confident	79.8	Confident	78 Å²	78	62.6 Å²	62.6	51%	0.506	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-63	152.9	170	29.4	-34.2	0	0	0	110.1
211	T	82.5	Confident	81.6	Confident	121 Å²	121	63.3 Å²	63.3	74%	0.742	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-60	122.1	175.9	-50.5	0	0	0	0	109.9
212	P	84.1	Confident	83.1	Confident	31 Å²	31	56.1 Å²	56.1	20%	0.201	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-66.3	144.4	-178.7	28.3	-35.4	0	0	0	110.7	E216 V217 H220	P212-E216 HydrophobicContact CB-CB 3.94Å; P212-V217 HydrophobicContact CB-CG2 4.19Å; P212-V217 HydrophobicContact CG-CG2 4.36Å; P212-H220 HydrophobicContact CB-CB 3.87Å; P212-H220 HydrophobicContact CG-CB 3.99Å
213	K	82.6	Confident	84.4	Confident	160 Å²	160	53.7 Å²	53.7	70%	0.696	30%	0.297	S	S	*	.			trans	-127.5	143	179.6	-63.3	-178.4	-177.5	178.2	0	111.5	K215 E216	K213-K215 PolarHBondContact O-N 2.71Å; K213-E216 PolarHBondContact N-OE2 3.36Å; K213-E216 WeakPolarHBondContact O-CB 3.41Å; K213-E216 PolarHBondContact O-N 2.93Å; K213-E216 VanDerWaalsContact O-N 3.17Å
214	G	84.1	Confident	85.6	Confident	52 Å²	52	50.8 Å²	50.8	54%	0.536	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	-126	177.7	0	0	0	0	0	112.7	E216 V217	G214-E216 PolarHBondContact O-N 3.45Å; G214-E216 VanDerWaalsContact O-N 3.14Å; G214-V217 WeakPolarHBondContact O-CB 3.42Å; G214-V217 VanDerWaalsContact O-CG2 3.32Å; G214-V217 WeakPolarHBondContact O-CG2 2.99Å; G214-V217 PolarHBondContact O-N 2.71Å; G214-V217 VanDerWaalsContact O-N 3.12Å
215	K	83.7	Confident	86.6	Confident	80 Å²	80	49 Å²	49	35%	0.348	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-23.8	-179.9	-65.2	176.9	-175.2	147.7	0	114.9	E110 V174 V190 I191 K213 V217	E110-K215 WeakPolarHBondContact OE1-CE 3.28Å; E110-K215 IonicContact OE1-NZ 2.93Å; E110-K215 PolarHBondContact OE1-NZ 2.83Å; V174-K215 HydrophobicContact CG1-CB 3.64Å; V174-K215 HydrophobicContact CG1-CD 4.21Å; V174-K215 HydrophobicContact CG1-CG 3.78Å; V174-K215 HydrophobicContact CG2-CB 4.38Å; V174-K215 HydrophobicContact CG2-CG 4.15Å; V190-K215 WeakPolarHBondContact O-CD 3.43Å; I191-K215 HydrophobicContact CG1-CB 4.36Å; K213-K215 PolarHBondContact O-N 2.71Å; K215-V217 PolarHBondContact O-N 2.74Å
216	E	87.1	Confident	87.5	Confident	25 Å²	25	46.3 Å²	46.3	12%	0.117	25%	0.254	C	S	.	.	H	α-helix	trans	-67.8	-24.2	178.1	-69.1	167.4	-169.5	0	0	113	I191 P212 K213 G214 L218 I219 H220 I232 K233	I191-E216 HydrophobicContact CD1-CB 4.38Å; I191-E216 HydrophobicContact CD1-CG 3.76Å; I191-E216 HydrophobicContact CG1-CG 4.46Å; I191-E216 HydrophobicContact CG2-CG 4.25Å; P212-E216 HydrophobicContact CB-CB 3.94Å; K213-E216 PolarHBondContact N-OE2 3.36Å; K213-E216 WeakPolarHBondContact O-CB 3.41Å; K213-E216 PolarHBondContact O-N 2.93Å; K213-E216 VanDerWaalsContact O-N 3.17Å; G214-E216 PolarHBondContact O-N 3.45Å; G214-E216 VanDerWaalsContact O-N 3.14Å; E216-L218 PolarHBondContact O-N 3.38Å; E216-I219 PolarHBondContact O-N 2.78Å; E216-H220 VanDerWaalsContact O-CB 3.23Å; E216-H220 WeakPolarHBondContact O-CB 3.32Å; E216-H220 PolarHBondContact O-N 3.13Å; E216-I232 HydrophobicContact CG-CG2 4.27Å; E216-K233 WeakPolarHBondContact OE1-CE 3.25Å; E216-K233 IonicContact OE1-NZ 3.8Å; E216-K233 PolarHBondContact OE1-NZ 2.94Å
217	V	89.4	Confident	88.2	Confident	66 Å²	66	45 Å²	45	40%	0.4	25%	0.251	S	S	.	.	H	α-helix	trans	-61.5	-45.7	-173.7	176.3	0	0	0	0	111.1	P212 G214 K215 S221	P212-V217 HydrophobicContact CB-CG2 4.19Å; P212-V217 HydrophobicContact CG-CG2 4.36Å; G214-V217 WeakPolarHBondContact O-CB 3.42Å; G214-V217 VanDerWaalsContact O-CG2 3.32Å; G214-V217 WeakPolarHBondContact O-CG2 2.99Å; G214-V217 PolarHBondContact O-N 2.71Å; G214-V217 VanDerWaalsContact O-N 3.12Å; K215-V217 PolarHBondContact O-N 2.74Å; V217-S221 WeakPolarHBondContact O-CB 3.3Å; V217-S221 PolarHBondContact O-N 3.24Å; V217-S221 PolarHBondContact O-OG 2.93Å
218	L	90.2	Very high	88.6	Confident	7 Å²	7	46.5 Å²	46.5	4%	0.037	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-50.4	176.3	176.3	63	0	0	0	111.4	F167 H171 F172 F175 E216 H220 S221 L222	F167-L218 HydrophobicContact CD1-CD1 4.38Å; H171-L218 HydrophobicContact CB-CD1 4.01Å; H171-L218 HydrophobicContact CB-CD2 4.44Å; H171-L218 WeakPolarHBondContact O-CD2 3.27Å; F172-L218 HydrophobicContact CD1-CD2 3.95Å; F172-L218 HydrophobicContact CE1-CD2 4.32Å; F172-L218 HydrophobicContact CG-CD2 4.26Å; F172-L218 HydrophobicContact CZ-CD1 4.49Å; F175-L218 HydrophobicContact CD2-CD2 4.33Å; F175-L218 HydrophobicContact CE2-CD2 3.8Å; E216-L218 PolarHBondContact O-N 3.38Å; L218-H220 VanDerWaalsContact C-N 3.33Å; L218-H220 PolarHBondContact O-N 3.23Å; L218-S221 PolarHBondContact O-N 3.44Å; L218-S221 VanDerWaalsContact O-N 3.09Å; L218-L222 HydrophobicContact CD1-CD1 4.16Å; L218-L222 HydrophobicContact CD1-CG 4.16Å; L218-L222 HydrophobicContact CG-CD1 4Å; L218-L222 HydrophobicContact CG-CG 4.42Å; L218-L222 WeakPolarHBondContact O-CG 3.42Å; L218-L222 PolarHBondContact O-N 3.31Å
219	I	91.6	Very high	88.9	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.5	-42.2	-176.4	-55	-163.2	0	0	0	110.8	I191 E216 S221 L222 L223 I232 T241 I259	I191-I219 HydrophobicContact CD1-CB 4.48Å; I191-I219 HydrophobicContact CD1-CD1 3.46Å; I191-I219 VanDerWaalsContact CD1-CD1 3.46Å; I191-I219 HydrophobicContact CD1-CG1 4.13Å; I191-I219 HydrophobicContact CG1-CD1 4.28Å; E216-I219 PolarHBondContact O-N 2.78Å; I219-S221 VanDerWaalsContact C-N 3.3Å; I219-S221 PolarHBondContact O-N 2.89Å; I219-L222 PolarHBondContact O-N 3.41Å; I219-L223 HydrophobicContact CG2-CD1 4.15Å; I219-L223 HydrophobicContact CG2-CG 4.34Å; I219-L223 WeakPolarHBondContact O-CG 3.26Å; I219-L223 PolarHBondContact O-N 3.42Å; I219-I232 HydrophobicContact CB-CD1 4.32Å; I219-I232 HydrophobicContact CG2-CD1 3.76Å; I219-I232 HydrophobicContact CG2-CG2 4.41Å; I219-T241 HydrophobicContact CD1-CG2 3.94Å; I219-T241 WeakPolarHBondContact CD1-OG1 3.47Å; I219-I259 HydrophobicContact CD1-CD1 4.12Å; I219-I259 HydrophobicContact CD1-CG1 4.49Å; I219-I259 HydrophobicContact CG2-CD1 3.84Å; I219-I259 HydrophobicContact CG2-CG2 4.04Å
220	H	92.2	Very high	89.1	Confident	33 Å²	33	40.5 Å²	40.5	15%	0.153	24%	0.235	C	C	.	.	H	α-helix	trans	-59.4	-42.7	173.9	-179.9	-84.7	0	0	0	111.3	P212 E216 L218 L223 S224 A230 I232	P212-H220 HydrophobicContact CB-CB 3.87Å; P212-H220 HydrophobicContact CG-CB 3.99Å; E216-H220 VanDerWaalsContact O-CB 3.23Å; E216-H220 WeakPolarHBondContact O-CB 3.32Å; E216-H220 PolarHBondContact O-N 3.13Å; L218-H220 VanDerWaalsContact C-N 3.33Å; L218-H220 PolarHBondContact O-N 3.23Å; H220-L223 PolarHBondContact O-N 2.86Å; H220-S224 PolarHBondContact CE1-OG 2.9Å; H220-S224 PolarHBondContact ND1-OG 3.24Å; H220-S224 WeakPolarHBondContact O-CB 3.35Å; H220-S224 PolarHBondContact O-N 2.97Å; H220-S224 PolarHBondContact O-OG 3.09Å; H220-A230 PolarHBondContact CD2-O 2.74Å; H220-I232 HydrophobicContact CB-CD1 4.13Å; H220-I232 HydrophobicContact CB-CG1 3.9Å
221	S	91.2	Very high	89.4	Confident	44 Å²	44	36.9 Å²	36.9	31%	0.308	21%	0.211	S	C	.	.	H	α-helix	trans	-67.4	-38.5	-179.1	-55.7	0	0	0	0	111.9	V217 L218 I219	V217-S221 WeakPolarHBondContact O-CB 3.3Å; V217-S221 PolarHBondContact O-N 3.24Å; V217-S221 PolarHBondContact O-OG 2.93Å; L218-S221 PolarHBondContact O-N 3.44Å; L218-S221 VanDerWaalsContact O-N 3.09Å; I219-S221 VanDerWaalsContact C-N 3.3Å; I219-S221 PolarHBondContact O-N 2.89Å
222	L	93.1	Very high	89.6	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-64.1	-51.7	173.8	-68	171	0	0	0	111.3	L124 F167 F172 L218 I219 S224 M225 F296 L334	L124-L222 HydrophobicContact CD1-CD2 3.31Å; F167-L222 HydrophobicContact CD2-CD2 4.27Å; F167-L222 HydrophobicContact CE1-CD2 4.49Å; F167-L222 HydrophobicContact CE2-CD2 3.92Å; F167-L222 HydrophobicContact CZ-CD2 4.03Å; F172-L222 HydrophobicContact CE1-CD1 4.47Å; L218-L222 HydrophobicContact CD1-CD1 4.16Å; L218-L222 HydrophobicContact CD1-CG 4.16Å; L218-L222 HydrophobicContact CG-CD1 4Å; L218-L222 HydrophobicContact CG-CG 4.42Å; L218-L222 WeakPolarHBondContact O-CG 3.42Å; L218-L222 PolarHBondContact O-N 3.31Å; I219-L222 PolarHBondContact O-N 3.41Å; L222-S224 VanDerWaalsContact C-N 3.28Å; L222-S224 PolarHBondContact O-N 2.9Å; L222-M225 VanDerWaalsContact O-CB 3.25Å; L222-M225 WeakPolarHBondContact O-CB 3.34Å; L222-M225 WeakPolarHBondContact O-CG 3.07Å; L222-M225 PolarHBondContact O-N 3.27Å; L222-M225 VanDerWaalsContact O-N 3.15Å; L222-F296 HydrophobicContact CD1-CE2 4.46Å; L222-F296 HydrophobicContact CD1-CZ 3.84Å; L222-F296 HydrophobicContact CD2-CE1 4.44Å; L222-F296 HydrophobicContact CD2-CZ 4.44Å; L222-L334 HydrophobicContact CB-CD1 3.97Å; L222-L334 HydrophobicContact CD2-CD1 4.2Å
223	L	93.4	Very high	89.5	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-69.4	-27.3	-178.8	-63.7	-175.3	0	0	0	112.7	I219 H220 M225 F226 H227 A230 I232 I259 A261 F263 F280 L298	I219-L223 HydrophobicContact CG2-CD1 4.15Å; I219-L223 HydrophobicContact CG2-CG 4.34Å; I219-L223 WeakPolarHBondContact O-CG 3.26Å; I219-L223 PolarHBondContact O-N 3.42Å; H220-L223 PolarHBondContact O-N 2.86Å; L223-M225 PolarHBondContact O-N 3.46Å; L223-F226 HydrophobicContact CD2-CD2 4.33Å; L223-F226 HydrophobicContact CD2-CE2 4.36Å; L223-F226 WeakPolarHBondContact O-CB 3.41Å; L223-F226 PolarHBondContact O-N 3.47Å; L223-H227 PolarHBondContact O-N 3.46Å; L223-A230 HydrophobicContact CB-CB 3.73Å; L223-I232 HydrophobicContact CD1-CD1 3.65Å; L223-I232 HydrophobicContact CG-CD1 4.45Å; L223-I259 HydrophobicContact CD1-CG2 4.46Å; L223-A261 HydrophobicContact CD1-CB 3.37Å; L223-F263 HydrophobicContact CB-CE1 4.29Å; L223-F263 HydrophobicContact CB-CZ 4.31Å; L223-F263 HydrophobicContact CD2-CZ 4.49Å; L223-F280 HydrophobicContact CD2-CD1 4.37Å; L223-F280 HydrophobicContact CD2-CD2 4.46Å; L223-F280 HydrophobicContact CD2-CE1 4.12Å; L223-F280 HydrophobicContact CD2-CE2 4.22Å; L223-F280 HydrophobicContact CD2-CZ 4.04Å; L223-L298 HydrophobicContact CD2-CD2 4.12Å
224	S	93.4	Very high	89.3	Confident	19 Å²	19	23.9 Å²	23.9	13%	0.133	14%	0.142	C	C	.	.	H	α-helix	trans	-64.5	-20	174.1	-67.2	0	0	0	0	113.1	H220 L222 F226 H227	H220-S224 PolarHBondContact CE1-OG 2.9Å; H220-S224 PolarHBondContact ND1-OG 3.24Å; H220-S224 WeakPolarHBondContact O-CB 3.35Å; H220-S224 PolarHBondContact O-N 2.97Å; H220-S224 PolarHBondContact O-OG 3.09Å; L222-S224 VanDerWaalsContact C-N 3.28Å; L222-S224 PolarHBondContact O-N 2.9Å; S224-F226 PolarHBondContact O-N 3.48Å; S224-H227 WeakPolarHBondContact CA-O 3.42Å; S224-H227 PolarHBondContact O-N 3.48Å
225	M	93.8	Very high	88.9	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-32.6	170.3	-63.8	179.4	65.4	0	0	111.8	L124 A126 P160 A161 I162 F167 L222 L223 L334	L124-M225 HydrophobicContact CB-CE 4.25Å; L124-M225 HydrophobicContact CB-SD 4.43Å; A126-M225 HydrophobicContact CB-CB 4.48Å; A126-M225 HydrophobicContact CB-CE 4.19Å; P160-M225 WeakPolarHBondContact CB-O 3.39Å; A161-M225 PolarHBondContact N-O 3.44Å; I162-M225 HydrophobicContact CB-CB 4.37Å; I162-M225 HydrophobicContact CB-CG 4.46Å; I162-M225 PolarHBondContact N-O 2.85Å; F167-M225 HydrophobicContact CE2-SD 3.62Å; F167-M225 HydrophobicContact CZ-CG 4.39Å; F167-M225 HydrophobicContact CZ-SD 3.85Å; L222-M225 VanDerWaalsContact O-CB 3.25Å; L222-M225 WeakPolarHBondContact O-CB 3.34Å; L222-M225 WeakPolarHBondContact O-CG 3.07Å; L222-M225 PolarHBondContact O-N 3.27Å; L222-M225 VanDerWaalsContact O-N 3.15Å; L223-M225 PolarHBondContact O-N 3.46Å; M225-L334 HydrophobicContact CB-CD2 4.25Å; M225-L334 HydrophobicContact CE-CD2 4.25Å; M225-L334 HydrophobicContact SD-CD1 4.27Å; M225-L334 HydrophobicContact SD-CD2 4.17Å
226	F	93.1	Very high	88.3	Confident	1 Å²	1	18.6 Å²	18.6	0%	0.004	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-49.2	175.9	-61.1	-59.2	0	0	0	112.1	A126 W157 P160 A161 L223 S224 F263 F280 L332 L334	A126-F226 HydrophobicContact CB-CD1 4.31Å; A126-F226 HydrophobicContact CB-CE1 4.11Å; W157-F226 HydrophobicContact CZ2-CB 4.17Å; W157-F226 PolarHBondContact NE1-O 2.93Å; W157-F226 VanDerWaalsContact NE1-O 3.09Å; P160-F226 HydrophobicContact CB-CD1 4.38Å; A161-F226 PolarHBondContact N-O 2.84Å; L223-F226 HydrophobicContact CD2-CD2 4.33Å; L223-F226 HydrophobicContact CD2-CE2 4.36Å; L223-F226 WeakPolarHBondContact O-CB 3.41Å; L223-F226 PolarHBondContact O-N 3.47Å; S224-F226 PolarHBondContact O-N 3.48Å; F226-F263 HydrophobicContact CB-CE1 4.4Å; F226-F263 HydrophobicContact CD2-CZ 4.49Å; F226-F280 HydrophobicContact CE2-CE1 4.14Å; F226-L332 HydrophobicContact CB-CD1 4.3Å; F226-L332 HydrophobicContact CD1-CD1 3.3Å; F226-L332 HydrophobicContact CD1-CG 3.98Å; F226-L332 HydrophobicContact CD2-CD1 4.37Å; F226-L332 HydrophobicContact CD2-CD2 4.5Å; F226-L332 HydrophobicContact CD2-CG 4.37Å; F226-L332 HydrophobicContact CE1-CD1 3.48Å; F226-L332 VanDerWaalsContact CE1-CD1 3.48Å; F226-L332 HydrophobicContact CE1-CG 3.78Å; F226-L332 HydrophobicContact CE2-CG 4.18Å; F226-L332 HydrophobicContact CG-CD1 3.77Å; F226-L332 HydrophobicContact CG-CG 4.25Å; F226-L332 HydrophobicContact CZ-CD1 4.08Å; F226-L332 HydrophobicContact CZ-CG 3.86Å; F226-L334 HydrophobicContact CD1-CD2 4.33Å; F226-L334 HydrophobicContact CE1-CD2 3.6Å; F226-L334 HydrophobicContact CE1-CG 4.21Å; F226-L334 HydrophobicContact CE2-CD1 4.16Å; F226-L334 HydrophobicContact CE2-CD2 3.85Å; F226-L334 HydrophobicContact CE2-CG 3.73Å; F226-L334 HydrophobicContact CZ-CD1 4.35Å; F226-L334 HydrophobicContact CZ-CD2 3.35Å; F226-L334 HydrophobicContact CZ-CG 3.44Å; F226-L334 VanDerWaalsContact CZ-CG 3.44Å
227	H	92.4	Very high	87.3	Confident	21 Å²	21	18.1 Å²	18.1	10%	0.097	11%	0.105	C	C	.	.			trans	-154.1	135.2	-178.7	-171	-89.6	0	0	0	110.9	W157 L223 S224 R229 F263 Q264	W157-H227 HydrophobicContact CZ2-CB 3.92Å; L223-H227 PolarHBondContact O-N 3.46Å; S224-H227 WeakPolarHBondContact CA-O 3.42Å; S224-H227 PolarHBondContact O-N 3.48Å; H227-R229 PolarHBondContact ND1-N 2.7Å; H227-R229 PolarHBondContact O-N 2.93Å; H227-F263 HydrophobicContact CB-CD1 3.8Å; H227-F263 HydrophobicContact CB-CE1 4.25Å; H227-Q264 PolarHBondContact CE1-O 3.17Å; H227-Q264 PolarHBondContact ND1-O 3.47Å
228	P	88.7	Confident	86.4	Confident	80 Å²	80	15.3 Å²	15.3	52%	0.519	9%	0.088	S	C	.	.	S	Bend	trans	-65.5	-12.7	-172.3	26.5	-37.2	0	0	0	115
229	R	90.7	Very high	85.8	Confident	31 Å²	31	15.1 Å²	15.1	12%	0.117	9%	0.086	C	C	.	.			trans	-112.8	62.1	-179.8	-65	177.4	-77	170.1	10.4	110.8	Y207 H227 Q264 L265 N266 D267	Y207-R229 VanDerWaalsContact O-CD 3.23Å; Y207-R229 WeakPolarHBondContact O-CD 3.48Å; H227-R229 PolarHBondContact ND1-N 2.7Å; H227-R229 PolarHBondContact O-N 2.93Å; R229-Q264 HydrophobicContact CB-CB 4.44Å; R229-Q264 PolarHBondContact NE-O 3.38Å; R229-Q264 PolarHBondContact O-N 3.1Å; R229-Q264 VanDerWaalsContact O-N 3.16Å; R229-L265 PolarHBondContact NH2-O 3.27Å; R229-N266 VanDerWaalsContact NH1-C 3.32Å; R229-N266 PolarHBondContact NH1-O 3.25Å; R229-D267 IonicContact NH1-OD1 3.68Å
230	A	90.6	Very high	85.5	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	123.7	174.9	0	0	0	0	0	110.1	P209 H220 L223 F263	P209-A230 WeakPolarHBondContact CB-O 3.25Å; H220-A230 PolarHBondContact CD2-O 2.74Å; L223-A230 HydrophobicContact CB-CB 3.73Å; A230-F263 HydrophobicContact CB-CD1 3.87Å; A230-F263 HydrophobicContact CB-CE1 3.62Å
231	F	88.9	Confident	85.4	Confident	1 Å²	1	13.5 Å²	13.5	0%	0.004	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	111.2	175.1	-74.3	-108.1	0	0	0	108.7	R206 H208 P209 K233 A261 E262 Q264 W274	R206-F231 HydrophobicContact CB-CE1 4.02Å; R206-F231 HydrophobicContact CB-CZ 4.03Å; H208-F231 VanDerWaalsContact O-CZ 3.27Å; H208-F231 WeakPolarHBondContact O-CZ 3.3Å; P209-F231 HydrophobicContact CB-CD1 4.21Å; P209-F231 HydrophobicContact CB-CD2 4.09Å; P209-F231 HydrophobicContact CB-CE1 4.28Å; P209-F231 HydrophobicContact CB-CE2 4.13Å; P209-F231 HydrophobicContact CB-CG 4.13Å; P209-F231 HydrophobicContact CB-CZ 4.24Å; F231-K233 VanDerWaalsContact C-N 3.28Å; F231-K233 PolarHBondContact O-N 3.19Å; F231-A261 WeakPolarHBondContact O-CA 3.42Å; F231-A261 WeakPolarHBondContact O-CB 3.21Å; F231-E262 HydrophobicContact CB-CG 3.53Å; F231-E262 WeakPolarHBondContact CB-O 3.22Å; F231-E262 HydrophobicContact CG-CG 4.24Å; F231-E262 PolarHBondContact N-O 3.02Å; F231-E262 PolarHBondContact O-N 2.84Å; F231-Q264 HydrophobicContact CD2-CB 4.29Å; F231-Q264 HydrophobicContact CE2-CB 3.69Å; F231-W274 HydrophobicContact CD1-CH2 4.26Å; F231-W274 HydrophobicContact CD1-CZ3 4.24Å; F231-W274 HydrophobicContact CD2-CH2 4.24Å; F231-W274 AromaticContact CD2-CZ3 3.73Å; F231-W274 HydrophobicContact CD2-CZ3 3.73Å; F231-W274 AromaticContact CE1-CH2 3.88Å; F231-W274 HydrophobicContact CE1-CH2 3.88Å; F231-W274 HydrophobicContact CE1-CZ3 4.26Å; F231-W274 AromaticContact CE2-CH2 3.87Å; F231-W274 HydrophobicContact CE2-CH2 3.87Å; F231-W274 AromaticContact CE2-CZ3 3.77Å; F231-W274 HydrophobicContact CE2-CZ3 3.77Å; F231-W274 HydrophobicContact CG-CH2 4.43Å; F231-W274 AromaticContact CG-CZ3 3.98Å; F231-W274 HydrophobicContact CG-CZ3 3.98Å; F231-W274 AromaticContact CZ-CH2 3.66Å; F231-W274 HydrophobicContact CZ-CH2 3.66Å; F231-W274 HydrophobicContact CZ-CZ3 4.03Å
232	I	86.8	Confident	85.4	Confident	9 Å²	9	11.4 Å²	11.4	5%	0.046	7%	0.065	C	C	.	.	S	Bend	trans	-68.3	-31.2	178.6	-56	-45.7	0	0	0	112	I191 E216 I219 H220 L223 H260	I191-I232 HydrophobicContact CD1-CG2 3.83Å; E216-I232 HydrophobicContact CG-CG2 4.27Å; I219-I232 HydrophobicContact CB-CD1 4.32Å; I219-I232 HydrophobicContact CG2-CD1 3.76Å; I219-I232 HydrophobicContact CG2-CG2 4.41Å; H220-I232 HydrophobicContact CB-CD1 4.13Å; H220-I232 HydrophobicContact CB-CG1 3.9Å; L223-I232 HydrophobicContact CD1-CD1 3.65Å; L223-I232 HydrophobicContact CG-CD1 4.45Å; I232-H260 VanDerWaalsContact O-O 3.05Å
233	K	82.9	Confident	85.4	Confident	24 Å²	24	11.4 Å²	11.4	10%	0.104	6%	0.064	C	C	.	.	S	Bend	trans	-104.3	100.9	174.2	-69.3	169.2	174.1	156	0	108.3	E194 E216 F231	E194-K233 HydrophobicContact CG-CD 4.42Å; E194-K233 IonicContact OE1-NZ 3.07Å; E194-K233 PolarHBondContact OE1-NZ 2.82Å; E194-K233 WeakPolarHBondContact OE2-CD 3.39Å; E194-K233 VanDerWaalsContact OE2-CE 3.3Å; E194-K233 WeakPolarHBondContact OE2-CE 3.4Å; E194-K233 IonicContact OE2-NZ 3.26Å; E194-K233 PolarHBondContact OE2-NZ 2.87Å; E216-K233 WeakPolarHBondContact OE1-CE 3.25Å; E216-K233 IonicContact OE1-NZ 3.8Å; E216-K233 PolarHBondContact OE1-NZ 2.94Å; F231-K233 VanDerWaalsContact C-N 3.28Å; F231-K233 PolarHBondContact O-N 3.19Å
234	S	78.1	Confident	85.4	Confident	7 Å²	7	11.4 Å²	11.4	5%	0.049	6%	0.064	C	C	.	.			trans	-56.6	155.5	175.8	47.5	0	0	0	0	111.6	F236 P238 Q239 E262	S234-F236 WeakPolarHBondContact CB-O 3.45Å; S234-F236 PolarHBondContact O-N 3.42Å; S234-F236 VanDerWaalsContact O-N 3.14Å; S234-F236 PolarHBondContact OG-O 2.86Å; S234-P238 PolarHBondContact OG-O 2.88Å; S234-Q239 PolarHBondContact O-NE2 2.93Å; S234-Q239 WeakPolarHBondContact OG-CG 3.39Å; S234-E262 VanDerWaalsContact CA-CD 3.49Å; S234-E262 WeakPolarHBondContact CA-OE1 3.49Å
235	R	75.4	Confident	85.4	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.058	C	C	.	.	S	Bend	trans	-61.7	-24.7	177.5	-75.8	169.9	-62.7	128.6	10	113.8	L202 N204 E262 W274 E311	L202-R235 HydrophobicContact CB-CB 4.42Å; L202-R235 HydrophobicContact CB-CG 4.16Å; L202-R235 PolarHBondContact N-O 2.75Å; N204-R235 WeakPolarHBondContact OD1-CD 3.49Å; N204-R235 PolarHBondContact OD1-NH1 3.29Å; R235-E262 WeakPolarHBondContact CG-OE1 3.49Å; R235-E262 IonicContact CZ-OE2 3.08Å; R235-E262 PolarHBondContact N-OE1 3.2Å; R235-E262 PolarHBondContact N-OE2 3.13Å; R235-E262 VanDerWaalsContact N-OE2 3.13Å; R235-E262 IonicContact NE-OE2 3.61Å; R235-E262 PolarHBondContact NE-OE2 3.33Å; R235-E262 VanDerWaalsContact NE-OE2 3.08Å; R235-E262 IonicContact NH2-OE2 3.26Å; R235-W274 VanDerWaalsContact CZ-CG 3.41Å; R235-W274 VanDerWaalsContact NE-CD2 3.27Å; R235-W274 VanDerWaalsContact NH2-CB 3.3Å; R235-W274 VanDerWaalsContact NH2-CG 3.29Å; R235-E311 IonicContact CZ-OE1 2.83Å; R235-E311 IonicContact CZ-OE2 2.73Å; R235-E311 IonicContact NH1-OE1 2.63Å; R235-E311 IonicContact NH1-OE2 2.86Å; R235-E311 PolarHBondContact NH1-OE2 2.84Å; R235-E311 IonicContact NH2-OE1 2.62Å; R235-E311 PolarHBondContact NH2-OE1 2.87Å; R235-E311 IonicContact NH2-OE2 2.92Å; R235-E311 PolarHBondContact NH2-OE2 3.02Å
236	F	70.8	Confident	85.4	Confident	21 Å²	21	12.7 Å²	12.7	9%	0.092	7%	0.066	C	C	.	.	S	Bend	trans	-131.6	154.4	-171.3	-50.3	-60.9	0	0	0	110.3	S234 M429	S234-F236 WeakPolarHBondContact CB-O 3.45Å; S234-F236 PolarHBondContact O-N 3.42Å; S234-F236 VanDerWaalsContact O-N 3.14Å; S234-F236 PolarHBondContact OG-O 2.86Å; F236-M429 HydrophobicContact CD2-CE 3.17Å; F236-M429 HydrophobicContact CE1-CE 4.48Å; F236-M429 HydrophobicContact CE2-CE 2.96Å; F236-M429 HydrophobicContact CG-CE 4.04Å; F236-M429 HydrophobicContact CZ-CE 3.68Å
237	A	66.7	Low	85.3	Confident	15 Å²	15	12.6 Å²	12.6	12%	0.124	7%	0.066	C	C	.	.	S	Bend	trans	-75.3	155.8	176.2	0	0	0	0	0	110.7	L195 R438 E439	L195-A237 HydrophobicContact CD1-CB 4.09Å; A237-R438 PolarHBondContact O-NH1 2.8Å; A237-R438 PolarHBondContact O-NH2 2.79Å; A237-E439 WeakPolarHBondContact CB-OE1 3.49Å
238	P	71.5	Confident	85.3	Confident	7 Å²	7	12.3 Å²	12.3	5%	0.045	7%	0.066	C	C	.	.	S	Bend	cis	-70.6	137.6	2.6	31.3	-37.8	0	0	0	111.3	S234 H260 F389 Y390 R438	S234-P238 PolarHBondContact OG-O 2.88Å; P238-H260 HydrophobicContact CG-CB 4.43Å; P238-H260 VanDerWaalsContact CG-CE1 3.41Å; P238-H260 WeakPolarHBondContact CG-CE1 3.14Å; P238-H260 WeakPolarHBondContact CG-ND1 3.38Å; P238-H260 WeakPolarHBondContact CG-NE2 3.34Å; P238-H260 VanDerWaalsContact O-CB 3.28Å; P238-H260 WeakPolarHBondContact O-CB 3.47Å; P238-F389 HydrophobicContact CB-CD1 3.51Å; P238-F389 HydrophobicContact CB-CE1 4.03Å; P238-F389 HydrophobicContact CB-CG 4.38Å; P238-F389 HydrophobicContact CG-CD1 4.46Å; P238-Y390 HydrophobicContact CB-CE1 4.4Å; P238-Y390 HydrophobicContact CG-CE1 4.08Å; P238-Y390 WeakPolarHBondContact CG-OH 3.39Å; P238-R438 VanDerWaalsContact CD-NH1 3.28Å; P238-R438 VanDerWaalsContact N-NH2 3.18Å
239	Q	77.5	Confident	85.3	Confident	2 Å²	2	8.9 Å²	8.9	1%	0.009	4%	0.044	C	C	.	.			trans	-109.1	149.7	171.3	-80.6	-173	-2.7	0	0	109.7	W189 L195 S234	W189-Q239 WeakPolarHBondContact CZ3-O 3.43Å; L195-Q239 VanDerWaalsContact CD1-CD 3.43Å; L195-Q239 HydrophobicContact CD1-CG 3.84Å; L195-Q239 VanDerWaalsContact CG-CD 3.43Å; L195-Q239 HydrophobicContact CG-CG 4.35Å; S234-Q239 PolarHBondContact O-NE2 2.93Å; S234-Q239 WeakPolarHBondContact OG-CG 3.39Å
240	G	83.7	Confident	85.1	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	100.1	-163.3	166.4	0	0	0	0	0	113.7	I191 H260	I191-G240 CarbonylContact O-C 3.51Å; I191-G240 VanDerWaalsContact O-CA 3.25Å; I191-G240 WeakPolarHBondContact O-CA 3.35Å; G240-H260 PolarHBondContact O-N 2.59Å; G240-H260 VanDerWaalsContact O-N 3.14Å
241	T	90.3	Very high	84.9	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	125.9	-173.4	-60.8	0	0	0	0	109.5	V190 I191 I219 R258 I259	V190-T241 HydrophobicContact CB-CG2 3.9Å; V190-T241 HydrophobicContact CG1-CG2 4.46Å; V190-T241 HydrophobicContact CG2-CG2 4.18Å; V190-T241 PolarHBondContact N-O 3.37Å; I191-T241 PolarHBondContact N-O 3.13Å; I191-T241 PolarHBondContact O-N 3.03Å; I219-T241 HydrophobicContact CD1-CG2 3.94Å; I219-T241 WeakPolarHBondContact CD1-OG1 3.47Å; T241-R258 VanDerWaalsContact CA-O 3.29Å; T241-R258 WeakPolarHBondContact CA-O 3.44Å; T241-I259 HydrophobicContact CG2-CD1 4.5Å; T241-I259 HydrophobicContact CG2-CG1 3.67Å
242	V	91.5	Very high	85	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	138	174.1	-178.5	0	0	0	0	108.4	A187 W188 W189 F257 R258 L385 T388 F389	A187-V242 HydrophobicContact CB-CG1 4.2Å; W188-V242 CarbonylContact O-C 3.57Å; W188-V242 WeakPolarHBondContact O-CA 3.45Å; W188-V242 WeakPolarHBondContact O-CG1 3.44Å; W189-V242 HydrophobicContact CD2-CG2 3.65Å; W189-V242 HydrophobicContact CE3-CG2 3.37Å; W189-V242 HydrophobicContact CG-CG2 4.47Å; W189-V242 HydrophobicContact CH2-CG2 3.66Å; W189-V242 HydrophobicContact CZ2-CG2 3.91Å; W189-V242 HydrophobicContact CZ3-CG2 3.39Å; V242-F257 CarbonylContact O-C 3.46Å; V242-F257 VanDerWaalsContact O-CA 3.24Å; V242-F257 WeakPolarHBondContact O-CA 3.38Å; V242-F257 WeakPolarHBondContact O-CB 3.36Å; V242-R258 PolarHBondContact N-O 3.13Å; V242-R258 PolarHBondContact O-N 2.87Å; V242-L385 HydrophobicContact CB-CD2 4.07Å; V242-L385 HydrophobicContact CG1-CD2 3.58Å; V242-T388 HydrophobicContact CB-CG2 4.49Å; V242-T388 HydrophobicContact CG1-CG2 3.7Å; V242-T388 HydrophobicContact CG2-CG2 3.89Å; V242-F389 HydrophobicContact CB-CD2 4.12Å; V242-F389 HydrophobicContact CB-CE2 3.51Å; V242-F389 HydrophobicContact CB-CZ 3.94Å; V242-F389 HydrophobicContact CG2-CD1 4.33Å; V242-F389 HydrophobicContact CG2-CD2 3.85Å; V242-F389 HydrophobicContact CG2-CE1 3.95Å; V242-F389 HydrophobicContact CG2-CE2 3.4Å; V242-F389 HydrophobicContact CG2-CG 4.3Å; V242-F389 HydrophobicContact CG2-CZ 3.46Å; V242-F389 VanDerWaalsContact CG2-CZ 3.46Å
243	A	93.3	Very high	85.3	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	153.9	172.9	0	0	0	0	0	110.4	A187 W188 V190 I255 V256 F257	A187-A243 CarbonylContact C-O 3.52Å; A187-A243 VanDerWaalsContact CA-O 3.25Å; A187-A243 WeakPolarHBondContact CA-O 3.46Å; W188-A243 HydrophobicContact CD2-CB 4.29Å; W188-A243 VanDerWaalsContact CE3-O 3.32Å; W188-A243 HydrophobicContact CH2-CB 3.93Å; W188-A243 HydrophobicContact CZ2-CB 3.54Å; W188-A243 HydrophobicContact CZ3-CB 4.45Å; W188-A243 PolarHBondContact N-O 2.73Å; W188-A243 PolarHBondContact O-N 3.46Å; V190-A243 HydrophobicContact CG2-CB 3.6Å; A243-I255 HydrophobicContact CB-CG2 3.83Å; A243-V256 CarbonylContact C-O 3.53Å; A243-V256 WeakPolarHBondContact CA-O 3.18Å; A243-F257 HydrophobicContact CB-CB 3.89Å
244	C	93.5	Very high	85.8	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	136.7	179.6	178.7	0	0	0	0	109.5	D186 A187 R246 I255 V256 L385	D186-C244 WeakPolarHBondContact O-CA 3.29Å; A187-C244 HydrophobicContact CB-CB 4.32Å; C244-R246 PolarHBondContact O-N 2.93Å; C244-I255 WeakPolarHBondContact O-CA 3.49Å; C244-V256 PolarHBondContact N-O 2.65Å; C244-V256 PolarHBondContact O-N 3.25Å; C244-L385 HydrophobicContact CB-CD2 3.59Å; C244-L385 HydrophobicContact CB-CG 3.89Å
245	I	93.2	Very high	86.5	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	116.4	173.8	-63	166.2	0	0	0	108	P177 K181 P184 G185 D186 W188 Y253	P177-I245 HydrophobicContact CB-CD1 4.04Å; P177-I245 HydrophobicContact CG-CD1 3.99Å; K181-I245 WeakPolarHBondContact O-CD1 3.28Å; P184-I245 CarbonylContact C-O 3.6Å; P184-I245 VanDerWaalsContact CA-O 3.3Å; P184-I245 WeakPolarHBondContact CA-O 3.44Å; P184-I245 HydrophobicContact CB-CG2 4.46Å; P184-I245 HydrophobicContact CG-CG2 4.48Å; G185-I245 PolarHBondContact N-O 2.9Å; D186-I245 PolarHBondContact O-N 2.97Å; W188-I245 HydrophobicContact CH2-CG1 3.84Å; W188-I245 HydrophobicContact CZ3-CD1 4.37Å; W188-I245 HydrophobicContact CZ3-CG1 3.75Å; I245-Y253 HydrophobicContact CD1-CE1 4.5Å; I245-Y253 HydrophobicContact CG2-CD1 4.4Å
246	R	93.6	Very high	87.5	Confident	47 Å²	47	22.7 Å²	22.7	18%	0.177	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-42.8	173.2	-172.9	-166.5	75.7	77	-5.5	111.4	C244 D254 V256 A375 I376 A381	C244-R246 PolarHBondContact O-N 2.93Å; R246-D254 IonicContact CZ-OD2 2.66Å; R246-D254 PolarHBondContact N-O 2.89Å; R246-D254 VanDerWaalsContact NE-CG 3.25Å; R246-D254 IonicContact NE-OD1 2.77Å; R246-D254 PolarHBondContact NE-OD1 2.8Å; R246-D254 IonicContact NE-OD2 3.45Å; R246-D254 PolarHBondContact NE-OD2 3.3Å; R246-D254 IonicContact NH2-OD2 3.41Å; R246-D254 PolarHBondContact NH2-OD2 3.31Å; R246-V256 HydrophobicContact CB-CG2 3.82Å; R246-V256 HydrophobicContact CG-CG2 4.24Å; R246-A375 CarbonylContact O-C 3.57Å; R246-A375 WeakPolarHBondContact O-CA 3.17Å; R246-I376 HydrophobicContact CG-CG1 4.27Å; R246-I376 VanDerWaalsContact O-CG1 3.26Å; R246-I376 WeakPolarHBondContact O-CG1 3.04Å; R246-I376 PolarHBondContact O-N 2.72Å; R246-A381 HydrophobicContact CB-CB 4.31Å; R246-A381 HydrophobicContact CG-CB 4.17Å
247	A	91.1	Very high	88.6	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	151.1	178.2	0	0	0	0	0	111.5	D254 W372 S374 A375	A247-D254 HydrophobicContact CB-CB 3.95Å; A247-D254 PolarHBondContact N-O 3.12Å; A247-D254 PolarHBondContact O-N 3.01Å; A247-W372 HydrophobicContact CB-CB 4.41Å; A247-W372 HydrophobicContact CB-CD2 3.65Å; A247-W372 HydrophobicContact CB-CE3 3.49Å; A247-W372 VanDerWaalsContact CB-CE3 3.49Å; A247-W372 HydrophobicContact CB-CG 4.05Å; A247-W372 HydrophobicContact CB-CZ3 4.03Å; A247-S374 CarbonylContact C-O 3.6Å; A247-S374 VanDerWaalsContact CA-O 3.25Å; A247-S374 WeakPolarHBondContact CA-O 3.15Å; A247-S374 WeakPolarHBondContact CB-O 3.47Å; A247-A375 HydrophobicContact CB-CB 3.74Å
248	S	92.1	Very high	89.8	Confident	14 Å²	14	21.2 Å²	21.2	10%	0.098	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	134.6	180	-175	0	0	0	0	109.8	Y253 T373 S374	S248-Y253 WeakPolarHBondContact OG-CE1 3.42Å; S248-T373 PolarHBondContact O-N 2.55Å; S248-S374 PolarHBondContact N-O 2.95Å; S248-S374 PolarHBondContact O-N 2.89Å
249	S	89.4	Confident	90.7	Very high	9 Å²	9	20.9 Å²	20.9	6%	0.063	10%	0.097	C	C	.	.			trans	-122.6	-178.4	172.5	-174.3	0	0	0	0	108.7	F251 Y252 K288 P371	S249-F251 VanDerWaalsContact C-N 3.3Å; S249-F251 PolarHBondContact O-N 2.76Å; S249-Y252 PolarHBondContact N-O 3.26Å; S249-K288 WeakPolarHBondContact O-CE 3.5Å; S249-K288 PolarHBondContact O-NZ 3.16Å; S249-P371 WeakPolarHBondContact CB-O 3.41Å; S249-P371 PolarHBondContact OG-O 3.17Å
250	D	86.4	Confident	91.2	Very high	114 Å²	114	21 Å²	21	61%	0.61	10%	0.097	S	C	*	.	S	Bend	trans	-65.2	-37.9	177.6	-68.1	-25.7	0	0	0	111.3	K288	D250-K288 WeakPolarHBondContact O-CD 3.2Å; D250-K288 VanDerWaalsContact O-CE 3.3Å; D250-K288 WeakPolarHBondContact O-CE 3.43Å; D250-K288 PolarHBondContact O-NZ 3.13Å
251	F	87.2	Confident	91.5	Very high	157 Å²	157	21 Å²	21	69%	0.689	10%	0.097	S	C	*	.	S	Bend	trans	-109.8	-23.1	-174.2	-60.8	-78	0	0	0	115.1	S249 S287 K288	S249-F251 VanDerWaalsContact C-N 3.3Å; S249-F251 PolarHBondContact O-N 2.76Å; F251-S287 WeakPolarHBondContact O-CA 3.46Å; F251-K288 PolarHBondContact O-N 2.77Å
252	Y	90.1	Very high	91.5	Very high	59 Å²	59	21 Å²	21	23%	0.231	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.4	-172.4	-65.8	-77.7	0	0	0	112.9	S249 V285 I286 H292 I370	S249-Y252 PolarHBondContact N-O 3.26Å; Y252-V285 HydrophobicContact CD1-CG1 4.35Å; Y252-I286 WeakPolarHBondContact CA-O 3.22Å; Y252-H292 AromaticContact CE1-CD2 3.99Å; Y252-I370 HydrophobicContact CD2-CD1 3.92Å; Y252-I370 HydrophobicContact CD2-CG1 4.42Å; Y252-I370 HydrophobicContact CD2-CG2 4.39Å; Y252-I370 HydrophobicContact CE2-CD1 4.46Å; Y252-I370 HydrophobicContact CG-CD1 4.03Å
253	Y	92.2	Very high	91.5	Very high	24 Å²	24	21 Å²	21	9%	0.094	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	138.6	160.8	-68.3	-58.2	0	0	0	109.9	L176 P177 I245 S248 V285 I286 K288	L176-Y253 HydrophobicContact CD2-CD2 4.18Å; P177-Y253 HydrophobicContact CG-CD2 4.47Å; P177-Y253 HydrophobicContact CG-CE2 4.07Å; I245-Y253 HydrophobicContact CD1-CE1 4.5Å; I245-Y253 HydrophobicContact CG2-CD1 4.4Å; S248-Y253 WeakPolarHBondContact OG-CE1 3.42Å; Y253-V285 WeakPolarHBondContact O-CA 3.34Å; Y253-I286 PolarHBondContact N-O 3.26Å; Y253-I286 PolarHBondContact O-N 3.35Å; Y253-K288 HydrophobicContact CD2-CB 4.42Å; Y253-K288 HydrophobicContact CD2-CG 3.81Å; Y253-K288 HydrophobicContact CE1-CD 4.49Å; Y253-K288 HydrophobicContact CE2-CB 4.04Å; Y253-K288 HydrophobicContact CE2-CD 3.93Å; Y253-K288 HydrophobicContact CE2-CG 3.49Å; Y253-K288 VanDerWaalsContact CE2-CG 3.49Å; Y253-K288 HydrophobicContact CG-CG 4.48Å
254	D	93.3	Very high	91.3	Very high	8 Å²	8	21 Å²	21	4%	0.043	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	114.3	161	-169.7	-31	0	0	0	108.3	R246 A247 N283 V285 W372	R246-D254 IonicContact CZ-OD2 2.66Å; R246-D254 PolarHBondContact N-O 2.89Å; R246-D254 VanDerWaalsContact NE-CG 3.25Å; R246-D254 IonicContact NE-OD1 2.77Å; R246-D254 PolarHBondContact NE-OD1 2.8Å; R246-D254 IonicContact NE-OD2 3.45Å; R246-D254 PolarHBondContact NE-OD2 3.3Å; R246-D254 IonicContact NH2-OD2 3.41Å; R246-D254 PolarHBondContact NH2-OD2 3.31Å; A247-D254 HydrophobicContact CB-CB 3.95Å; A247-D254 PolarHBondContact N-O 3.12Å; A247-D254 PolarHBondContact O-N 3.01Å; D254-N283 PolarHBondContact OD1-ND2 3.12Å; D254-V285 HydrophobicContact CB-CG2 4.4Å; D254-W372 HydrophobicContact CB-CH2 3.65Å; D254-W372 HydrophobicContact CB-CZ2 4.15Å; D254-W372 HydrophobicContact CB-CZ3 3.99Å
255	I	94.3	Very high	91.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	123.9	-173.5	-55.4	-179.4	0	0	0	108	F175 W188 A243 C244 I284 I286	F175-I255 WeakPolarHBondContact O-CD1 3.46Å; W188-I255 HydrophobicContact CH2-CD1 4.26Å; W188-I255 HydrophobicContact CH2-CG2 3.97Å; W188-I255 HydrophobicContact CZ2-CD1 4.45Å; W188-I255 HydrophobicContact CZ2-CG2 4.31Å; A243-I255 HydrophobicContact CB-CG2 3.83Å; C244-I255 WeakPolarHBondContact O-CA 3.49Å; I255-I284 HydrophobicContact CB-CG2 3.83Å; I255-I284 HydrophobicContact CG2-CG2 4.44Å; I255-I284 PolarHBondContact N-O 2.96Å; I255-I284 PolarHBondContact O-N 2.92Å; I255-I286 HydrophobicContact CD1-CG2 4.17Å
256	V	95.2	Very high	90.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	134.5	169.8	-177	0	0	0	0	106.9	A243 C244 R246 G282 A381 L385	A243-V256 CarbonylContact C-O 3.53Å; A243-V256 WeakPolarHBondContact CA-O 3.18Å; C244-V256 PolarHBondContact N-O 2.65Å; C244-V256 PolarHBondContact O-N 3.25Å; R246-V256 HydrophobicContact CB-CG2 3.82Å; R246-V256 HydrophobicContact CG-CG2 4.24Å; V256-G282 CarbonylContact C-O 3.53Å; V256-G282 WeakPolarHBondContact CA-O 3.42Å; V256-G282 WeakPolarHBondContact CG1-O 3.34Å; V256-A381 HydrophobicContact CG2-CB 4.46Å; V256-L385 HydrophobicContact CB-CD1 4.23Å; V256-L385 HydrophobicContact CG1-CD1 3.67Å
257	F	94.2	Very high	90.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	163	-178.8	63.5	-89.4	0	0	0	110.9	F175 V242 A243 I259 G282 I284 F296 L298	F175-F257 HydrophobicContact CD1-CB 4.4Å; F175-F257 HydrophobicContact CD1-CD1 4.08Å; F175-F257 HydrophobicContact CD1-CD2 4.47Å; F175-F257 HydrophobicContact CD1-CE1 4.49Å; F175-F257 HydrophobicContact CD1-CG 4.07Å; F175-F257 HydrophobicContact CE1-CB 4.3Å; F175-F257 AromaticContact CE1-CD1 3.96Å; F175-F257 HydrophobicContact CE1-CD1 3.96Å; F175-F257 AromaticContact CE1-CD2 3.66Å; F175-F257 HydrophobicContact CE1-CD2 3.66Å; F175-F257 HydrophobicContact CE1-CE1 4.15Å; F175-F257 AromaticContact CE1-CE2 3.85Å; F175-F257 HydrophobicContact CE1-CE2 3.85Å; F175-F257 AromaticContact CE1-CG 3.7Å; F175-F257 HydrophobicContact CE1-CG 3.7Å; F175-F257 HydrophobicContact CE1-CZ 4.1Å; F175-F257 HydrophobicContact CZ-CD2 4.22Å; F175-F257 HydrophobicContact CZ-CE1 4.34Å; F175-F257 AromaticContact CZ-CE2 3.93Å; F175-F257 HydrophobicContact CZ-CE2 3.93Å; F175-F257 AromaticContact CZ-CZ 4Å; F175-F257 HydrophobicContact CZ-CZ 4Å; V242-F257 CarbonylContact O-C 3.46Å; V242-F257 VanDerWaalsContact O-CA 3.24Å; V242-F257 WeakPolarHBondContact O-CA 3.38Å; V242-F257 WeakPolarHBondContact O-CB 3.36Å; A243-F257 HydrophobicContact CB-CB 3.89Å; F257-I259 HydrophobicContact CD2-CD1 3.91Å; F257-I259 HydrophobicContact CD2-CG1 3.92Å; F257-I259 HydrophobicContact CE2-CD1 3.64Å; F257-I259 HydrophobicContact CE2-CG1 4.15Å; F257-G282 VanDerWaalsContact CZ-CA 3.49Å; F257-G282 PolarHBondContact N-O 3.14Å; F257-G282 WeakPolarHBondContact O-CA 3.47Å; F257-G282 PolarHBondContact O-N 3.43Å; F257-I284 HydrophobicContact CD1-CG2 4.03Å; F257-I284 HydrophobicContact CE1-CB 4.07Å; F257-I284 HydrophobicContact CE1-CG2 3.9Å; F257-F296 HydrophobicContact CE1-CE2 4.11Å; F257-F296 AromaticContact CZ-CE2 3.66Å; F257-F296 HydrophobicContact CZ-CE2 3.66Å; F257-F296 AromaticContact CZ-CZ 3.96Å; F257-F296 HydrophobicContact CZ-CZ 3.96Å; F257-L298 HydrophobicContact CE2-CD1 3.69Å; F257-L298 HydrophobicContact CZ-CD1 4.16Å
258	R	91.4	Very high	89.9	Confident	5 Å²	5	27.8 Å²	27.8	2%	0.019	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	132.9	-177.6	174.7	171.2	150.9	-178.6	-17.3	110.7	T241 V242 H260 Q279 F280 L385 F389 D425	T241-R258 VanDerWaalsContact CA-O 3.29Å; T241-R258 WeakPolarHBondContact CA-O 3.44Å; V242-R258 PolarHBondContact N-O 3.13Å; V242-R258 PolarHBondContact O-N 2.87Å; R258-H260 VanDerWaalsContact CZ-NE2 3.33Å; R258-H260 PolarHBondContact NE-NE2 2.77Å; R258-H260 PolarHBondContact NH2-CE1 2.63Å; R258-H260 VanDerWaalsContact NH2-CE1 3.32Å; R258-H260 PolarHBondContact NH2-NE2 2.94Å; R258-Q279 HydrophobicContact CG-CB 4.32Å; R258-F280 VanDerWaalsContact CA-O 3.28Å; R258-F280 WeakPolarHBondContact CA-O 3.33Å; R258-L385 HydrophobicContact CB-CD1 4.31Å; R258-F389 HydrophobicContact CB-CE2 3.99Å; R258-F389 HydrophobicContact CG-CD2 4.38Å; R258-F389 HydrophobicContact CG-CE2 3.83Å; R258-D425 IonicContact CZ-OD1 2.75Å; R258-D425 VanDerWaalsContact CZ-OD1 3.26Å; R258-D425 IonicContact CZ-OD2 3.63Å; R258-D425 VanDerWaalsContact NH1-CG 3.3Å; R258-D425 IonicContact NH1-OD1 3.37Å; R258-D425 IonicContact NH1-OD2 3.94Å; R258-D425 PolarHBondContact NH1-OD2 2.79Å; R258-D425 IonicContact NH2-OD1 2.85Å; R258-D425 PolarHBondContact NH2-OD1 3.02Å; R258-D425 IonicContact NH2-OD2 3.5Å; R258-D425 PolarHBondContact NH2-OD2 3.18Å
259	I	91.3	Very high	89.4	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.4	-174.7	-53.1	171.8	0	0	0	108.6	I219 L223 T241 F257 A261 F280 L298	I219-I259 HydrophobicContact CD1-CD1 4.12Å; I219-I259 HydrophobicContact CD1-CG1 4.49Å; I219-I259 HydrophobicContact CG2-CD1 3.84Å; I219-I259 HydrophobicContact CG2-CG2 4.04Å; L223-I259 HydrophobicContact CD1-CG2 4.46Å; T241-I259 HydrophobicContact CG2-CD1 4.5Å; T241-I259 HydrophobicContact CG2-CG1 3.67Å; F257-I259 HydrophobicContact CD2-CD1 3.91Å; F257-I259 HydrophobicContact CD2-CG1 3.92Å; F257-I259 HydrophobicContact CE2-CD1 3.64Å; F257-I259 HydrophobicContact CE2-CG1 4.15Å; I259-A261 HydrophobicContact CG2-CB 4.29Å; I259-F280 HydrophobicContact CB-CB 4.06Å; I259-F280 PolarHBondContact N-O 3.11Å; I259-F280 PolarHBondContact O-N 2.99Å; I259-L298 HydrophobicContact CD1-CD1 4.22Å
260	H	88.9	Confident	89	Confident	3 Å²	3	34.6 Å²	34.6	1%	0.014	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	121.7	164.8	-70.7	-85.3	0	0	0	109.2	I232 P238 G240 R258 G278 F389 D425	I232-H260 VanDerWaalsContact O-O 3.05Å; P238-H260 HydrophobicContact CG-CB 4.43Å; P238-H260 VanDerWaalsContact CG-CE1 3.41Å; P238-H260 WeakPolarHBondContact CG-CE1 3.14Å; P238-H260 WeakPolarHBondContact CG-ND1 3.38Å; P238-H260 WeakPolarHBondContact CG-NE2 3.34Å; P238-H260 VanDerWaalsContact O-CB 3.28Å; P238-H260 WeakPolarHBondContact O-CB 3.47Å; G240-H260 PolarHBondContact O-N 2.59Å; G240-H260 VanDerWaalsContact O-N 3.14Å; R258-H260 VanDerWaalsContact CZ-NE2 3.33Å; R258-H260 PolarHBondContact NE-NE2 2.77Å; R258-H260 PolarHBondContact NH2-CE1 2.63Å; R258-H260 VanDerWaalsContact NH2-CE1 3.32Å; R258-H260 PolarHBondContact NH2-NE2 2.94Å; H260-G278 PolarHBondContact CE1-O 3.32Å; H260-G278 PolarHBondContact ND1-O 2.76Å; H260-F389 AromaticContact CD2-CD1 3.97Å; H260-F389 AromaticContact CD2-CE1 3.55Å; H260-F389 AromaticContact CD2-CZ 3.6Å; H260-D425 IonicContact CE1-OD1 2.92Å; H260-D425 PolarHBondContact CE1-OD1 2.57Å; H260-D425 IonicContact NE2-OD1 2.61Å
261	A	89.1	Confident	88.8	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.008	17%	0.171	C	C	.	.			trans	-148.5	156.6	-179.5	0	0	0	0	0	109.2	L223 F231 I259 F280	L223-A261 HydrophobicContact CD1-CB 3.37Å; F231-A261 WeakPolarHBondContact O-CA 3.42Å; F231-A261 WeakPolarHBondContact O-CB 3.21Å; I259-A261 HydrophobicContact CG2-CB 4.29Å; A261-F280 HydrophobicContact CB-CE2 4.44Å
262	E	90.3	Very high	88.7	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	154.8	178	67.4	-172.5	166.2	0	0	110.1	R206 F231 S234 R235 W274 T276	R206-E262 IonicContact NH2-OE1 3.6Å; R206-E262 PolarHBondContact NH2-OE1 3.27Å; F231-E262 HydrophobicContact CB-CG 3.53Å; F231-E262 WeakPolarHBondContact CB-O 3.22Å; F231-E262 HydrophobicContact CG-CG 4.24Å; F231-E262 PolarHBondContact N-O 3.02Å; F231-E262 PolarHBondContact O-N 2.84Å; S234-E262 VanDerWaalsContact CA-CD 3.49Å; S234-E262 WeakPolarHBondContact CA-OE1 3.49Å; R235-E262 WeakPolarHBondContact CG-OE1 3.49Å; R235-E262 IonicContact CZ-OE2 3.08Å; R235-E262 PolarHBondContact N-OE1 3.2Å; R235-E262 PolarHBondContact N-OE2 3.13Å; R235-E262 VanDerWaalsContact N-OE2 3.13Å; R235-E262 IonicContact NE-OE2 3.61Å; R235-E262 PolarHBondContact NE-OE2 3.33Å; R235-E262 VanDerWaalsContact NE-OE2 3.08Å; R235-E262 IonicContact NH2-OE2 3.26Å; E262-W274 HydrophobicContact CB-CE3 4.41Å; E262-W274 VanDerWaalsContact CD-CE3 3.49Å; E262-W274 VanDerWaalsContact CD-CZ3 3.41Å; E262-W274 HydrophobicContact CG-CE3 3.81Å; E262-W274 HydrophobicContact CG-CZ3 3.77Å; E262-W274 WeakPolarHBondContact OE1-CZ3 3.16Å; E262-T276 HydrophobicContact CB-CG2 4.33Å
263	F	91	Very high	88.5	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	144	174.9	-59.6	-88	0	0	0	110	W157 L223 F226 H227 A230 L265 W274 F275 P277 F280	W157-F263 HydrophobicContact CH2-CD2 4.21Å; W157-F263 HydrophobicContact CH2-CG 4.27Å; L223-F263 HydrophobicContact CB-CE1 4.29Å; L223-F263 HydrophobicContact CB-CZ 4.31Å; L223-F263 HydrophobicContact CD2-CZ 4.49Å; F226-F263 HydrophobicContact CB-CE1 4.4Å; F226-F263 HydrophobicContact CD2-CZ 4.49Å; H227-F263 HydrophobicContact CB-CD1 3.8Å; H227-F263 HydrophobicContact CB-CE1 4.25Å; A230-F263 HydrophobicContact CB-CD1 3.87Å; A230-F263 HydrophobicContact CB-CE1 3.62Å; F263-L265 HydrophobicContact CB-CD2 4.11Å; F263-W274 CarbonylContact O-C 3.57Å; F263-W274 WeakPolarHBondContact O-CA 3.28Å; F263-F275 HydrophobicContact CB-CB 4.34Å; F263-F275 HydrophobicContact CD2-CD1 4.13Å; F263-F275 PolarHBondContact N-O 2.95Å; F263-F275 PolarHBondContact O-N 3.49Å; F263-P277 HydrophobicContact CD2-CG 4.29Å; F263-P277 HydrophobicContact CE2-CG 3.98Å; F263-F280 AromaticContact CE2-CE2 3.96Å; F263-F280 HydrophobicContact CE2-CE2 3.96Å; F263-F280 AromaticContact CE2-CZ 3.66Å; F263-F280 HydrophobicContact CE2-CZ 3.66Å; F263-F280 HydrophobicContact CZ-CE2 4.34Å; F263-F280 AromaticContact CZ-CZ 3.88Å; F263-F280 HydrophobicContact CZ-CZ 3.88Å
264	Q	90.3	Very high	88.3	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	118.9	172.3	-161.1	-76.1	-0.8	0	0	108	H227 R229 F231 N266 F273 W274	H227-Q264 PolarHBondContact CE1-O 3.17Å; H227-Q264 PolarHBondContact ND1-O 3.47Å; R229-Q264 HydrophobicContact CB-CB 4.44Å; R229-Q264 PolarHBondContact NE-O 3.38Å; R229-Q264 PolarHBondContact O-N 3.1Å; R229-Q264 VanDerWaalsContact O-N 3.16Å; F231-Q264 HydrophobicContact CD2-CB 4.29Å; F231-Q264 HydrophobicContact CE2-CB 3.69Å; Q264-N266 PolarHBondContact NE2-O 2.89Å; Q264-N266 PolarHBondContact OE1-O 3.49Å; Q264-F273 CarbonylContact C-O 3.4Å; Q264-F273 WeakPolarHBondContact CA-O 3.3Å; Q264-W274 HydrophobicContact CB-CE3 4.23Å; Q264-W274 HydrophobicContact CB-CH2 4.44Å; Q264-W274 HydrophobicContact CB-CZ3 4.08Å; Q264-W274 HydrophobicContact CG-CD2 4.44Å; Q264-W274 HydrophobicContact CG-CE3 4.39Å; Q264-W274 HydrophobicContact CG-CH2 4.3Å; Q264-W274 HydrophobicContact CG-CZ2 4.35Å; Q264-W274 HydrophobicContact CG-CZ3 4.33Å
265	L	89.5	Confident	88.1	Confident	7 Å²	7	21.6 Å²	21.6	4%	0.037	12%	0.121	C	C	.	.			trans	-100.1	-26.8	-169.9	-56.4	-173.2	0	0	0	114.7	L154 W157 R229 F263 F273 F275	L154-L265 HydrophobicContact CB-CD1 4.29Å; L154-L265 HydrophobicContact CD1-CD1 4.08Å; W157-L265 HydrophobicContact CD2-CD2 3.93Å; W157-L265 HydrophobicContact CE3-CD1 3.67Å; W157-L265 HydrophobicContact CE3-CD2 3.51Å; W157-L265 HydrophobicContact CE3-CG 4.26Å; W157-L265 HydrophobicContact CH2-CD2 4.45Å; W157-L265 HydrophobicContact CZ3-CD1 4.15Å; W157-L265 HydrophobicContact CZ3-CD2 3.8Å; R229-L265 PolarHBondContact NH2-O 3.27Å; F263-L265 HydrophobicContact CB-CD2 4.11Å; L265-F273 HydrophobicContact CB-CD1 4.09Å; L265-F273 HydrophobicContact CD1-CD1 3.81Å; L265-F273 HydrophobicContact CD1-CE1 3.94Å; L265-F273 HydrophobicContact CG-CD1 4.06Å; L265-F273 PolarHBondContact N-O 3.39Å; L265-F275 HydrophobicContact CD1-CB 3.87Å; L265-F275 HydrophobicContact CD1-CD2 4.06Å; L265-F275 HydrophobicContact CD1-CG 4.23Å; L265-F275 HydrophobicContact CD2-CB 4.47Å; L265-F275 HydrophobicContact CG-CB 4.01Å
266	N	87.1	Confident	87.8	Confident	2 Å²	2	22 Å²	22	1%	0.011	12%	0.123	C	C	.	.			trans	-96.5	144.2	-175.3	-79.8	-5.4	0	0	0	112.2	S150 S152 G153 R229 Q264 N270 F271 F273	S150-N266 PolarHBondContact O-ND2 3.07Å; S152-N266 PolarHBondContact OG-OD1 2.83Å; G153-N266 VanDerWaalsContact CA-OD1 3.28Å; G153-N266 WeakPolarHBondContact CA-OD1 3.25Å; G153-N266 PolarHBondContact N-OD1 3.45Å; R229-N266 VanDerWaalsContact NH1-C 3.32Å; R229-N266 PolarHBondContact NH1-O 3.25Å; Q264-N266 PolarHBondContact NE2-O 2.89Å; Q264-N266 PolarHBondContact OE1-O 3.49Å; N266-N270 HydrophobicContact CB-CB 4.14Å; N266-F271 WeakPolarHBondContact CB-O 3.23Å; N266-F271 PolarHBondContact ND2-O 3.36Å; N266-F273 HydrophobicContact CB-CB 4.03Å; N266-F273 WeakPolarHBondContact ND2-CB 3.23Å
267	D	83.1	Confident	87.5	Confident	81 Å²	81	22 Å²	22	43%	0.433	12%	0.123	S	C	.	.			trans	-113	161.3	172	-157.1	4.9	0	0	0	111.4	R229 N270	R229-D267 IonicContact NH1-OD1 3.68Å; D267-N270 WeakPolarHBondContact O-CB 3.44Å; D267-N270 PolarHBondContact O-N 2.92Å
268	V	81.1	Confident	86.8	Confident	99 Å²	99	22 Å²	22	60%	0.6	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	129.8	174.3	-179.3	0	0	0	0	108.4	Y207	Y207-V268 HydrophobicContact CD1-CG2 3.98Å; Y207-V268 HydrophobicContact CD2-CG2 4.4Å; Y207-V268 HydrophobicContact CE1-CG2 3.73Å; Y207-V268 HydrophobicContact CE2-CG2 4.16Å; Y207-V268 HydrophobicContact CG-CG2 4.3Å
269	P	81	Confident	86.6	Confident	119 Å²	119	23.3 Å²	23.3	77%	0.773	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	cis	-92	0.2	18.5	37.1	-37.8	0	0	0	116
270	N	82	Confident	86.6	Confident	47 Å²	47	23.3 Å²	23.3	25%	0.251	13%	0.13	S	C	.	.	S	Bend	trans	-76.1	145.4	179.2	-64.3	-34.9	0	0	0	110.2	S152 Y207 N266 D267	S152-N270 PolarHBondContact OG-ND2 3.01Å; S152-N270 VanDerWaalsContact OG-ND2 3.11Å; Y207-N270 WeakPolarHBondContact CE1-O 3.33Å; Y207-N270 PolarHBondContact OH-O 2.99Å; Y207-N270 VanDerWaalsContact OH-O 3.14Å; N266-N270 HydrophobicContact CB-CB 4.14Å; D267-N270 WeakPolarHBondContact O-CB 3.44Å; D267-N270 PolarHBondContact O-N 2.92Å
271	F	82.4	Confident	86.7	Confident	87 Å²	87	23.7 Å²	23.7	38%	0.382	13%	0.133	S	C	.	.	P	Polyproline II helix	trans	-64.3	153.5	175.3	-70.6	-73.5	0	0	0	112	N266 F273 L313 G315	N266-F271 WeakPolarHBondContact CB-O 3.23Å; N266-F271 PolarHBondContact ND2-O 3.36Å; F271-F273 PolarHBondContact O-N 2.97Å; F271-L313 HydrophobicContact CB-CB 4.05Å; F271-L313 VanDerWaalsContact CB-O 3.25Å; F271-L313 WeakPolarHBondContact CB-O 3.28Å; F271-L313 HydrophobicContact CG-CB 4.46Å; F271-G315 WeakPolarHBondContact CE1-O 3.43Å; F271-G315 WeakPolarHBondContact CE2-O 3.48Å; F271-G315 WeakPolarHBondContact CZ-O 3.34Å
272	P	84.1	Confident	86.9	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-55.8	135.4	179.7	-24	34.7	0	0	0	112.1	Y207 W312 L313	Y207-P272 HydrophobicContact CD2-CG 4.38Å; Y207-P272 HydrophobicContact CE1-CG 4.04Å; Y207-P272 HydrophobicContact CE2-CG 3.82Å; Y207-P272 WeakPolarHBondContact OH-CD 3.47Å; P272-W312 WeakPolarHBondContact O-CA 3.34Å; P272-L313 HydrophobicContact CG-CD1 4.32Å; P272-L313 PolarHBondContact O-N 3.34Å
273	F	87.6	Confident	87.2	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	115.1	171.3	-174.7	-75.9	0	0	0	107.1	S150 L151 L154 Q264 L265 N266 F271 F275 M310 W312	S150-F273 WeakPolarHBondContact O-CD2 3.44Å; L151-F273 HydrophobicContact CD2-CD2 4.29Å; L151-F273 HydrophobicContact CD2-CE2 3.51Å; L151-F273 HydrophobicContact CD2-CZ 4.28Å; L154-F273 HydrophobicContact CB-CE1 4.28Å; L154-F273 HydrophobicContact CB-CZ 4.23Å; L154-F273 HydrophobicContact CD1-CE1 4.47Å; L154-F273 HydrophobicContact CD2-CZ 4.07Å; Q264-F273 CarbonylContact C-O 3.4Å; Q264-F273 WeakPolarHBondContact CA-O 3.3Å; L265-F273 HydrophobicContact CB-CD1 4.09Å; L265-F273 HydrophobicContact CD1-CD1 3.81Å; L265-F273 HydrophobicContact CD1-CE1 3.94Å; L265-F273 HydrophobicContact CG-CD1 4.06Å; L265-F273 PolarHBondContact N-O 3.39Å; N266-F273 HydrophobicContact CB-CB 4.03Å; N266-F273 WeakPolarHBondContact ND2-CB 3.23Å; F271-F273 PolarHBondContact O-N 2.97Å; F273-F275 HydrophobicContact CE1-CB 4.32Å; F273-F275 HydrophobicContact CE1-CD2 4.5Å; F273-M310 HydrophobicContact CE1-CB 4.27Å; F273-M310 HydrophobicContact CE1-CG 4.02Å; F273-M310 HydrophobicContact CE1-SD 4.4Å; F273-M310 HydrophobicContact CZ-CB 3.83Å; F273-M310 HydrophobicContact CZ-CG 3.84Å; F273-M310 HydrophobicContact CZ-SD 3.91Å; F273-W312 HydrophobicContact CB-CB 4.32Å; F273-W312 HydrophobicContact CD2-CB 3.52Å; F273-W312 HydrophobicContact CD2-CD2 4.15Å; F273-W312 HydrophobicContact CD2-CE3 4.07Å; F273-W312 AromaticContact CD2-CG 3.97Å; F273-W312 HydrophobicContact CD2-CG 3.97Å; F273-W312 HydrophobicContact CE2-CB 4.12Å; F273-W312 AromaticContact CE2-CD2 3.86Å; F273-W312 HydrophobicContact CE2-CD2 3.86Å; F273-W312 AromaticContact CE2-CE3 3.41Å; F273-W312 HydrophobicContact CE2-CE3 3.41Å; F273-W312 VanDerWaalsContact CE2-CE3 3.41Å; F273-W312 HydrophobicContact CE2-CG 4.18Å; F273-W312 HydrophobicContact CE2-CZ3 4.15Å; F273-W312 HydrophobicContact CG-CB 4.23Å; F273-W312 HydrophobicContact CZ-CE3 4.12Å
274	W	87.8	Confident	87.3	Confident	1 Å²	1	24.8 Å²	24.8	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.3	179.3	-63.9	98.3	0	0	0	109.2	N204 R206 F231 R235 E262 F263 Q264 M310 E311	N204-W274 WeakPolarHBondContact O-CZ2 3.33Å; N204-W274 PolarHBondContact O-NE1 2.8Å; R206-W274 HydrophobicContact CB-CH2 4.02Å; R206-W274 HydrophobicContact CB-CZ2 4.09Å; R206-W274 VanDerWaalsContact O-CZ2 3.26Å; R206-W274 WeakPolarHBondContact O-CZ2 3.33Å; F231-W274 HydrophobicContact CD1-CH2 4.26Å; F231-W274 HydrophobicContact CD1-CZ3 4.24Å; F231-W274 HydrophobicContact CD2-CH2 4.24Å; F231-W274 AromaticContact CD2-CZ3 3.73Å; F231-W274 HydrophobicContact CD2-CZ3 3.73Å; F231-W274 AromaticContact CE1-CH2 3.88Å; F231-W274 HydrophobicContact CE1-CH2 3.88Å; F231-W274 HydrophobicContact CE1-CZ3 4.26Å; F231-W274 AromaticContact CE2-CH2 3.87Å; F231-W274 HydrophobicContact CE2-CH2 3.87Å; F231-W274 AromaticContact CE2-CZ3 3.77Å; F231-W274 HydrophobicContact CE2-CZ3 3.77Å; F231-W274 HydrophobicContact CG-CH2 4.43Å; F231-W274 AromaticContact CG-CZ3 3.98Å; F231-W274 HydrophobicContact CG-CZ3 3.98Å; F231-W274 AromaticContact CZ-CH2 3.66Å; F231-W274 HydrophobicContact CZ-CH2 3.66Å; F231-W274 HydrophobicContact CZ-CZ3 4.03Å; R235-W274 VanDerWaalsContact CZ-CG 3.41Å; R235-W274 VanDerWaalsContact NE-CD2 3.27Å; R235-W274 VanDerWaalsContact NH2-CB 3.3Å; R235-W274 VanDerWaalsContact NH2-CG 3.29Å; E262-W274 HydrophobicContact CB-CE3 4.41Å; E262-W274 VanDerWaalsContact CD-CE3 3.49Å; E262-W274 VanDerWaalsContact CD-CZ3 3.41Å; E262-W274 HydrophobicContact CG-CE3 3.81Å; E262-W274 HydrophobicContact CG-CZ3 3.77Å; E262-W274 WeakPolarHBondContact OE1-CZ3 3.16Å; F263-W274 CarbonylContact O-C 3.57Å; F263-W274 WeakPolarHBondContact O-CA 3.28Å; Q264-W274 HydrophobicContact CB-CE3 4.23Å; Q264-W274 HydrophobicContact CB-CH2 4.44Å; Q264-W274 HydrophobicContact CB-CZ3 4.08Å; Q264-W274 HydrophobicContact CG-CD2 4.44Å; Q264-W274 HydrophobicContact CG-CE3 4.39Å; Q264-W274 HydrophobicContact CG-CH2 4.3Å; Q264-W274 HydrophobicContact CG-CZ2 4.35Å; Q264-W274 HydrophobicContact CG-CZ3 4.33Å; W274-M310 WeakPolarHBondContact O-CA 3.4Å; W274-E311 HydrophobicContact CB-CB 4.28Å; W274-E311 PolarHBondContact N-O 3.33Å; W274-E311 PolarHBondContact O-N 2.85Å
275	F	88.9	Confident	87.5	Confident	1 Å²	1	25.3 Å²	25.3	0%	0.004	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	112.5	177	-177.9	-79.3	0	0	0	107.6	L131 L154 W157 F263 L265 F273 P277 V308 M310 L329	L131-F275 HydrophobicContact CB-CE2 4.41Å; L131-F275 HydrophobicContact CD1-CE2 3.87Å; L131-F275 HydrophobicContact CD1-CZ 4.38Å; L154-F275 HydrophobicContact CD1-CD2 3.87Å; L154-F275 HydrophobicContact CD1-CE2 3.84Å; W157-F275 HydrophobicContact CE3-CE2 4.49Å; W157-F275 HydrophobicContact CH2-CD1 4.01Å; W157-F275 AromaticContact CH2-CE1 3.9Å; W157-F275 HydrophobicContact CH2-CE1 3.9Å; W157-F275 HydrophobicContact CH2-CZ 4.39Å; W157-F275 AromaticContact CZ3-CD1 3.56Å; W157-F275 HydrophobicContact CZ3-CD1 3.56Å; W157-F275 AromaticContact CZ3-CD2 3.98Å; W157-F275 HydrophobicContact CZ3-CD2 3.98Å; W157-F275 AromaticContact CZ3-CE1 3.54Å; W157-F275 HydrophobicContact CZ3-CE1 3.54Å; W157-F275 AromaticContact CZ3-CE2 3.93Å; W157-F275 HydrophobicContact CZ3-CE2 3.93Å; W157-F275 AromaticContact CZ3-CG 3.78Å; W157-F275 HydrophobicContact CZ3-CG 3.78Å; W157-F275 AromaticContact CZ3-CZ 3.71Å; W157-F275 HydrophobicContact CZ3-CZ 3.71Å; F263-F275 HydrophobicContact CB-CB 4.34Å; F263-F275 HydrophobicContact CD2-CD1 4.13Å; F263-F275 PolarHBondContact N-O 2.95Å; F263-F275 PolarHBondContact O-N 3.49Å; L265-F275 HydrophobicContact CD1-CB 3.87Å; L265-F275 HydrophobicContact CD1-CD2 4.06Å; L265-F275 HydrophobicContact CD1-CG 4.23Å; L265-F275 HydrophobicContact CD2-CB 4.47Å; L265-F275 HydrophobicContact CG-CB 4.01Å; F273-F275 HydrophobicContact CE1-CB 4.32Å; F273-F275 HydrophobicContact CE1-CD2 4.5Å; F275-P277 HydrophobicContact CD1-CG 4.17Å; F275-P277 HydrophobicContact CE1-CG 3.94Å; F275-V308 HydrophobicContact CD1-CG1 4.03Å; F275-V308 HydrophobicContact CD2-CG1 3.8Å; F275-V308 HydrophobicContact CE1-CG1 3.68Å; F275-V308 HydrophobicContact CE1-CG2 4.05Å; F275-V308 HydrophobicContact CE2-CG1 3.48Å; F275-V308 VanDerWaalsContact CE2-CG1 3.48Å; F275-V308 HydrophobicContact CG-CG1 4.09Å; F275-V308 HydrophobicContact CZ-CB 4.22Å; F275-V308 HydrophobicContact CZ-CG1 3.41Å; F275-V308 VanDerWaalsContact CZ-CG1 3.41Å; F275-V308 HydrophobicContact CZ-CG2 3.8Å; F275-M310 HydrophobicContact CD2-CG 4.12Å; F275-M310 HydrophobicContact CD2-SD 4.47Å; F275-L329 HydrophobicContact CE1-CD2 4.34Å; F275-L329 HydrophobicContact CZ-CD1 4.31Å; F275-L329 HydrophobicContact CZ-CD2 4.05Å
276	T	88	Confident	87.6	Confident	7 Å²	7	25 Å²	25	4%	0.043	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	100.9	-172.1	-54.5	0	0	0	0	108.8	E262 D309 C428	E262-T276 HydrophobicContact CB-CG2 4.33Å; T276-D309 PolarHBondContact N-O 3.43Å; T276-D309 PolarHBondContact O-N 3.25Å; T276-C428 HydrophobicContact CG2-CB 4Å
277	P	87.8	Confident	87.8	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.006	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	141.5	167.9	-22.7	35.7	0	0	0	110.1	F263 F275 Q279 F280 V300	F263-P277 HydrophobicContact CD2-CG 4.29Å; F263-P277 HydrophobicContact CE2-CG 3.98Å; F275-P277 HydrophobicContact CD1-CG 4.17Å; F275-P277 HydrophobicContact CE1-CG 3.94Å; P277-Q279 VanDerWaalsContact C-N 3.35Å; P277-Q279 PolarHBondContact O-N 3.1Å; P277-F280 HydrophobicContact CB-CD2 4.46Å; P277-F280 HydrophobicContact CB-CE2 3.91Å; P277-F280 HydrophobicContact CB-CZ 4.16Å; P277-F280 HydrophobicContact CG-CE2 3.67Å; P277-F280 HydrophobicContact CG-CZ 3.72Å; P277-V300 HydrophobicContact CB-CG1 4.29Å; P277-V300 HydrophobicContact CB-CG2 3.92Å; P277-V300 HydrophobicContact CG-CG2 4.43Å
278	G	80.1	Confident	88.1	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.01	14%	0.138	C	C	.	.	S	Bend	trans	-61.3	-43	-178.6	0	0	0	0	0	112.9	H260 N307 D425	H260-G278 PolarHBondContact CE1-O 3.32Å; H260-G278 PolarHBondContact ND1-O 2.76Å; G278-N307 PolarHBondContact N-O 2.92Å; G278-D425 CarbonylContact C-O 3.32Å; G278-D425 WeakPolarHBondContact CA-O 3.5Å
279	Q	86.5	Confident	88.3	Confident	32 Å²	32	25.6 Å²	25.6	15%	0.15	14%	0.136	C	C	.	.			trans	-157	153.3	166.4	67.1	-178.4	32.1	0	0	111.7	R258 P277 T281 P301 D425	R258-Q279 HydrophobicContact CG-CB 4.32Å; P277-Q279 VanDerWaalsContact C-N 3.35Å; P277-Q279 PolarHBondContact O-N 3.1Å; Q279-T281 PolarHBondContact NE2-OG1 3.24Å; Q279-P301 HydrophobicContact CG-CG 3.96Å; Q279-P301 VanDerWaalsContact O-CD 3.3Å; Q279-P301 WeakPolarHBondContact O-CD 3.22Å; Q279-D425 HydrophobicContact CB-CB 4.1Å; Q279-D425 HydrophobicContact CG-CB 4.09Å; Q279-D425 PolarHBondContact OE1-OD2 3.36Å; Q279-D425 VanDerWaalsContact OE1-OD2 3.11Å
280	F	90.9	Very high	88.5	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.7	159.7	-72.8	-84.8	0	0	0	109.5	L223 F226 R258 I259 A261 F263 P277 L298 V300 L332	L223-F280 HydrophobicContact CD2-CD1 4.37Å; L223-F280 HydrophobicContact CD2-CD2 4.46Å; L223-F280 HydrophobicContact CD2-CE1 4.12Å; L223-F280 HydrophobicContact CD2-CE2 4.22Å; L223-F280 HydrophobicContact CD2-CZ 4.04Å; F226-F280 HydrophobicContact CE2-CE1 4.14Å; R258-F280 VanDerWaalsContact CA-O 3.28Å; R258-F280 WeakPolarHBondContact CA-O 3.33Å; I259-F280 HydrophobicContact CB-CB 4.06Å; I259-F280 PolarHBondContact N-O 3.11Å; I259-F280 PolarHBondContact O-N 2.99Å; A261-F280 HydrophobicContact CB-CE2 4.44Å; F263-F280 AromaticContact CE2-CE2 3.96Å; F263-F280 HydrophobicContact CE2-CE2 3.96Å; F263-F280 AromaticContact CE2-CZ 3.66Å; F263-F280 HydrophobicContact CE2-CZ 3.66Å; F263-F280 HydrophobicContact CZ-CE2 4.34Å; F263-F280 AromaticContact CZ-CZ 3.88Å; F263-F280 HydrophobicContact CZ-CZ 3.88Å; P277-F280 HydrophobicContact CB-CD2 4.46Å; P277-F280 HydrophobicContact CB-CE2 3.91Å; P277-F280 HydrophobicContact CB-CZ 4.16Å; P277-F280 HydrophobicContact CG-CE2 3.67Å; P277-F280 HydrophobicContact CG-CZ 3.72Å; F280-L298 HydrophobicContact CB-CD1 3.82Å; F280-L298 HydrophobicContact CB-CG 4.48Å; F280-L298 HydrophobicContact CD1-CG 4.32Å; F280-V300 HydrophobicContact CD1-CG2 3.65Å; F280-V300 HydrophobicContact CE1-CG2 3.41Å; F280-V300 VanDerWaalsContact CE1-CG2 3.41Å; F280-V300 HydrophobicContact CG-CG2 4.37Å; F280-V300 HydrophobicContact CZ-CG2 3.95Å; F280-L332 HydrophobicContact CE1-CD2 3.82Å; F280-L332 HydrophobicContact CE1-CG 4.46Å; F280-L332 HydrophobicContact CZ-CD2 3.91Å
281	T	92.8	Very high	88.7	Confident	11 Å²	11	20.6 Å²	20.6	7%	0.067	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	126.6	175.2	-55.3	0	0	0	0	109.3	Q279 L298 Y299 P301	Q279-T281 PolarHBondContact NE2-OG1 3.24Å; T281-L298 CarbonylContact O-C 3.51Å; T281-L298 WeakPolarHBondContact O-CA 3.35Å; T281-Y299 HydrophobicContact CG2-CE1 4.04Å; T281-Y299 PolarHBondContact N-O 3.36Å; T281-Y299 WeakPolarHBondContact O-CD1 3.44Å; T281-Y299 PolarHBondContact O-N 2.95Å; T281-P301 WeakPolarHBondContact OG1-CG 3.4Å
282	G	93.2	Very high	89	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145.5	-176.8	0	0	0	0	0	112.5	V256 F257 H297	V256-G282 CarbonylContact C-O 3.53Å; V256-G282 WeakPolarHBondContact CA-O 3.42Å; V256-G282 WeakPolarHBondContact CG1-O 3.34Å; F257-G282 VanDerWaalsContact CZ-CA 3.49Å; F257-G282 PolarHBondContact N-O 3.14Å; F257-G282 WeakPolarHBondContact O-CA 3.47Å; F257-G282 PolarHBondContact O-N 3.43Å; G282-H297 CarbonylContact C-O 3.6Å; G282-H297 VanDerWaalsContact CA-O 3.23Å; G282-H297 WeakPolarHBondContact CA-O 3.44Å
283	N	95	Very high	89.2	Confident	25 Å²	25	18.1 Å²	18.1	13%	0.134	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	128.9	169.6	176.2	-102.3	0	0	0	109	D254 H295 F296 H297	D254-N283 PolarHBondContact OD1-ND2 3.12Å; N283-H295 PolarHBondContact OD1-ND1 3.28Å; N283-H295 VanDerWaalsContact OD1-ND1 3.14Å; N283-F296 WeakPolarHBondContact O-CA 3.05Å; N283-H297 PolarHBondContact N-O 3.29Å; N283-H297 PolarHBondContact O-N 3.07Å
284	I	94.6	Very high	89.3	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	132.4	176.3	-172.6	177.1	0	0	0	110.3	F172 F175 I255 F257 I286 V293 H295 F296	F172-I284 HydrophobicContact CB-CD1 3.86Å; F172-I284 HydrophobicContact CD1-CD1 3.57Å; F172-I284 HydrophobicContact CE1-CD1 4.44Å; F172-I284 HydrophobicContact CG-CD1 3.98Å; F175-I284 HydrophobicContact CB-CG2 4.36Å; F175-I284 HydrophobicContact CD2-CD1 4.2Å; F175-I284 HydrophobicContact CG-CG2 4.49Å; I255-I284 HydrophobicContact CB-CG2 3.83Å; I255-I284 HydrophobicContact CG2-CG2 4.44Å; I255-I284 PolarHBondContact N-O 2.96Å; I255-I284 PolarHBondContact O-N 2.92Å; F257-I284 HydrophobicContact CD1-CG2 4.03Å; F257-I284 HydrophobicContact CE1-CB 4.07Å; F257-I284 HydrophobicContact CE1-CG2 3.9Å; I284-I286 HydrophobicContact CD1-CB 4.23Å; I284-I286 HydrophobicContact CD1-CD1 4.29Å; I284-I286 HydrophobicContact CG1-CB 4.23Å; I284-V293 HydrophobicContact CD1-CG1 4.09Å; I284-V293 HydrophobicContact CG1-CG1 3.98Å; I284-H295 WeakPolarHBondContact CA-O 3.37Å; I284-F296 HydrophobicContact CB-CD2 4.07Å; I284-F296 HydrophobicContact CD1-CD2 3.98Å; I284-F296 HydrophobicContact CG1-CD2 4.02Å
285	V	93.3	Very high	89.4	Confident	11 Å²	11	23.6 Å²	23.6	7%	0.067	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	110	168.5	-178.6	0	0	0	0	107.8	Y252 Y253 D254 R294 H295 I370 W372	Y252-V285 HydrophobicContact CD1-CG1 4.35Å; Y253-V285 WeakPolarHBondContact O-CA 3.34Å; D254-V285 HydrophobicContact CB-CG2 4.4Å; V285-R294 HydrophobicContact CB-CB 4.25Å; V285-R294 HydrophobicContact CG1-CB 4.04Å; V285-R294 PolarHBondContact O-N 2.92Å; V285-H295 HydrophobicContact CB-CB 4.11Å; V285-H295 HydrophobicContact CG2-CB 4.13Å; V285-H295 PolarHBondContact N-O 2.9Å; V285-I370 HydrophobicContact CG1-CD1 3.83Å; V285-W372 HydrophobicContact CG1-CH2 4.13Å
286	I	92.9	Very high	89.7	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.4	-172.9	-167.7	170.3	0	0	0	110.8	F172 L176 Y252 Y253 I255 I284 A290 V293	F172-I286 HydrophobicContact CB-CD1 3.66Å; L176-I286 HydrophobicContact CD2-CG2 3.93Å; Y252-I286 WeakPolarHBondContact CA-O 3.22Å; Y253-I286 PolarHBondContact N-O 3.26Å; Y253-I286 PolarHBondContact O-N 3.35Å; I255-I286 HydrophobicContact CD1-CG2 4.17Å; I284-I286 HydrophobicContact CD1-CB 4.23Å; I284-I286 HydrophobicContact CD1-CD1 4.29Å; I284-I286 HydrophobicContact CG1-CB 4.23Å; I286-A290 HydrophobicContact CD1-CB 3.74Å; I286-A290 HydrophobicContact CG1-CB 4.38Å; I286-V293 HydrophobicContact CD1-CG2 4.04Å; I286-V293 HydrophobicContact CG1-CG2 4Å
287	S	90.9	Very high	90.1	Very high	7 Å²	7	25.2 Å²	25.2	5%	0.049	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	150.1	169.4	51.1	0	0	0	0	111.5	F251 D289 A290 S291 H292	F251-S287 WeakPolarHBondContact O-CA 3.46Å; S287-D289 WeakPolarHBondContact CB-OD1 3.41Å; S287-D289 PolarHBondContact O-N 2.85Å; S287-D289 VanDerWaalsContact O-N 3.16Å; S287-D289 PolarHBondContact OG-OD1 3.05Å; S287-A290 PolarHBondContact O-N 2.77Å; S287-A290 PolarHBondContact OG-N 3.12Å; S287-S291 PolarHBondContact OG-N 2.58Å; S287-S291 VanDerWaalsContact OG-N 3.09Å; S287-S291 PolarHBondContact OG-OG 3.4Å; S287-H292 WeakPolarHBondContact CB-O 3.36Å; S287-H292 PolarHBondContact N-O 3.32Å; S287-H292 PolarHBondContact OG-N 3.48Å; S287-H292 PolarHBondContact OG-O 2.89Å
288	K	88.4	Confident	90.4	Very high	80 Å²	80	25.1 Å²	25.1	35%	0.348	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.5	-178.2	-65.3	-166.5	175.2	160.6	0	114.4	L176 S249 D250 F251 Y253	L176-K288 WeakPolarHBondContact CD1-O 3.44Å; S249-K288 WeakPolarHBondContact O-CE 3.5Å; S249-K288 PolarHBondContact O-NZ 3.16Å; D250-K288 WeakPolarHBondContact O-CD 3.2Å; D250-K288 VanDerWaalsContact O-CE 3.3Å; D250-K288 WeakPolarHBondContact O-CE 3.43Å; D250-K288 PolarHBondContact O-NZ 3.13Å; F251-K288 PolarHBondContact O-N 2.77Å; Y253-K288 HydrophobicContact CD2-CB 4.42Å; Y253-K288 HydrophobicContact CD2-CG 3.81Å; Y253-K288 HydrophobicContact CE1-CD 4.49Å; Y253-K288 HydrophobicContact CE2-CB 4.04Å; Y253-K288 HydrophobicContact CE2-CD 3.93Å; Y253-K288 HydrophobicContact CE2-CG 3.49Å; Y253-K288 VanDerWaalsContact CE2-CG 3.49Å; Y253-K288 HydrophobicContact CG-CG 4.48Å
289	D	85.3	Confident	91.1	Very high	107 Å²	107	28.6 Å²	28.6	57%	0.572	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	0.3	176.2	63.1	-7	0	0	0	113	S287 S291	S287-D289 WeakPolarHBondContact CB-OD1 3.41Å; S287-D289 PolarHBondContact O-N 2.85Å; S287-D289 VanDerWaalsContact O-N 3.16Å; S287-D289 PolarHBondContact OG-OD1 3.05Å; D289-S291 PolarHBondContact O-N 3.41Å; D289-S291 WeakPolarHBondContact OD1-CB 3.38Å; D289-S291 PolarHBondContact OD1-N 2.95Å; D289-S291 VanDerWaalsContact OD1-N 3.14Å; D289-S291 PolarHBondContact OD1-OG 3.22Å; D289-S291 PolarHBondContact OD2-OG 2.88Å; D289-S291 VanDerWaalsContact OD2-OG 3.12Å
290	A	85.9	Confident	91.3	Very high	3 Å²	3	27.4 Å²	27.4	3%	0.025	14%	0.135	C	C	.	.	S	Bend	trans	57.8	21	-174.6	0	0	0	0	0	114.9	A169 R173 L176 I286 S287	A169-A290 CarbonylContact C-O 3.6Å; R173-A290 HydrophobicContact CB-CB 3.62Å; R173-A290 HydrophobicContact CG-CB 4.01Å; L176-A290 HydrophobicContact CD1-CB 3.92Å; L176-A290 HydrophobicContact CG-CB 4.34Å; I286-A290 HydrophobicContact CD1-CB 3.74Å; I286-A290 HydrophobicContact CG1-CB 4.38Å; S287-A290 PolarHBondContact O-N 2.77Å; S287-A290 PolarHBondContact OG-N 3.12Å
291	S	85.5	Confident	91.2	Very high	59 Å²	59	28.2 Å²	28.2	41%	0.413	14%	0.141	S	C	.	.	S	Bend	trans	-72.1	-35.7	175.6	61.5	0	0	0	0	112.5	A169 S287 D289	A169-S291 VanDerWaalsContact CB-O 3.31Å; A169-S291 WeakPolarHBondContact CB-O 3.21Å; S287-S291 PolarHBondContact OG-N 2.58Å; S287-S291 VanDerWaalsContact OG-N 3.09Å; S287-S291 PolarHBondContact OG-OG 3.4Å; D289-S291 PolarHBondContact O-N 3.41Å; D289-S291 WeakPolarHBondContact OD1-CB 3.38Å; D289-S291 PolarHBondContact OD1-N 2.95Å; D289-S291 VanDerWaalsContact OD1-N 3.14Å; D289-S291 PolarHBondContact OD1-OG 3.22Å; D289-S291 PolarHBondContact OD2-OG 2.88Å; D289-S291 VanDerWaalsContact OD2-OG 3.12Å
292	H	88.4	Confident	90.8	Very high	35 Å²	35	30.4 Å²	30.4	16%	0.162	16%	0.156	C	C	.	.			trans	-129.5	133.3	-175.2	-173.4	82.2	0	0	0	111.8	E120 Y252 S287 S340	E120-H292 IonicContact OE1-ND1 2.71Å; E120-H292 PolarHBondContact OE1-ND1 2.97Å; E120-H292 IonicContact OE2-CE1 3.15Å; E120-H292 IonicContact OE2-CG 3.76Å; E120-H292 IonicContact OE2-ND1 3.46Å; E120-H292 PolarHBondContact OE2-ND1 3.42Å; Y252-H292 AromaticContact CE1-CD2 3.99Å; S287-H292 WeakPolarHBondContact CB-O 3.36Å; S287-H292 PolarHBondContact N-O 3.32Å; S287-H292 PolarHBondContact OG-N 3.48Å; S287-H292 PolarHBondContact OG-O 2.89Å; H292-S340 WeakPolarHBondContact CA-OG 3.47Å; H292-S340 PolarHBondContact CE1-O 3.4Å; H292-S340 VanDerWaalsContact CE1-O 3.27Å; H292-S340 PolarHBondContact ND1-OG 3.19Å
293	V	90.1	Very high	90.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	114.6	171.5	-178.8	0	0	0	0	108.6	L122 A169 F172 I284 I286 F296 P339 S340	L122-V293 HydrophobicContact CD1-CB 4.45Å; L122-V293 HydrophobicContact CD1-CG1 4.35Å; L122-V293 HydrophobicContact CD2-CB 4.23Å; L122-V293 HydrophobicContact CD2-CG1 3.76Å; A169-V293 HydrophobicContact CB-CG2 4.18Å; F172-V293 HydrophobicContact CB-CG2 3.9Å; F172-V293 HydrophobicContact CD2-CG2 3.86Å; F172-V293 HydrophobicContact CG-CG2 3.97Å; I284-V293 HydrophobicContact CD1-CG1 4.09Å; I284-V293 HydrophobicContact CG1-CG1 3.98Å; I286-V293 HydrophobicContact CD1-CG2 4.04Å; I286-V293 HydrophobicContact CG1-CG2 4Å; V293-F296 HydrophobicContact CG1-CB 4.46Å; V293-P339 CarbonylContact O-C 3.57Å; V293-P339 WeakPolarHBondContact O-CA 3.39Å; V293-S340 PolarHBondContact N-OG 3.38Å; V293-S340 PolarHBondContact O-N 3.42Å; V293-S340 PolarHBondContact O-OG 2.64Å
294	R	88.3	Confident	89	Confident	53 Å²	53	39 Å²	39	20%	0.2	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-38.2	-175.7	-178	178.3	170.9	145.4	-2.5	112.9	V285 P339 E368	V285-R294 HydrophobicContact CB-CB 4.25Å; V285-R294 HydrophobicContact CG1-CB 4.04Å; V285-R294 PolarHBondContact O-N 2.92Å; R294-P339 WeakPolarHBondContact O-CA 3.45Å; R294-E368 VanDerWaalsContact CZ-O 3.22Å; R294-E368 PolarHBondContact NH1-O 3.21Å; R294-E368 PolarHBondContact NH2-O 2.9Å
295	H	91.4	Very high	87.8	Confident	63 Å²	63	42.8 Å²	42.8	29%	0.292	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	136.6	-175.8	178.3	-105.1	0	0	0	109.4	N283 I284 V285	N283-H295 PolarHBondContact OD1-ND1 3.28Å; N283-H295 VanDerWaalsContact OD1-ND1 3.14Å; I284-H295 WeakPolarHBondContact CA-O 3.37Å; V285-H295 HydrophobicContact CB-CB 4.11Å; V285-H295 HydrophobicContact CG2-CB 4.13Å; V285-H295 PolarHBondContact N-O 2.9Å
296	F	94.6	Very high	87	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	128.6	171.9	-177.7	-89.9	0	0	0	109.9	L122 L124 F172 F175 L222 F257 N283 I284 V293 L298 L334 S336	L122-F296 HydrophobicContact CD2-CB 3.83Å; L122-F296 HydrophobicContact CD2-CG 4.44Å; L124-F296 HydrophobicContact CD1-CD1 3.9Å; L124-F296 HydrophobicContact CD1-CE1 3.94Å; L124-F296 HydrophobicContact CD2-CB 4.12Å; L124-F296 HydrophobicContact CD2-CD1 3.61Å; L124-F296 HydrophobicContact CD2-CE1 4.44Å; L124-F296 HydrophobicContact CD2-CG 4.17Å; L124-F296 HydrophobicContact CG-CD1 4.44Å; F172-F296 HydrophobicContact CD1-CD2 4.11Å; F172-F296 HydrophobicContact CD1-CE2 4.14Å; F172-F296 AromaticContact CE1-CD2 3.61Å; F172-F296 HydrophobicContact CE1-CD2 3.61Å; F172-F296 AromaticContact CE1-CE2 3.6Å; F172-F296 HydrophobicContact CE1-CE2 3.6Å; F172-F296 HydrophobicContact CE1-CG 4.26Å; F172-F296 HydrophobicContact CE1-CZ 4.24Å; F175-F296 HydrophobicContact CE2-CE2 4.5Å; L222-F296 HydrophobicContact CD1-CE2 4.46Å; L222-F296 HydrophobicContact CD1-CZ 3.84Å; L222-F296 HydrophobicContact CD2-CE1 4.44Å; L222-F296 HydrophobicContact CD2-CZ 4.44Å; F257-F296 HydrophobicContact CE1-CE2 4.11Å; F257-F296 AromaticContact CZ-CE2 3.66Å; F257-F296 HydrophobicContact CZ-CE2 3.66Å; F257-F296 AromaticContact CZ-CZ 3.96Å; F257-F296 HydrophobicContact CZ-CZ 3.96Å; N283-F296 WeakPolarHBondContact O-CA 3.05Å; I284-F296 HydrophobicContact CB-CD2 4.07Å; I284-F296 HydrophobicContact CD1-CD2 3.98Å; I284-F296 HydrophobicContact CG1-CD2 4.02Å; V293-F296 HydrophobicContact CG1-CB 4.46Å; F296-L298 HydrophobicContact CE1-CB 3.84Å; F296-L298 HydrophobicContact CZ-CB 4.02Å; F296-L334 HydrophobicContact CE1-CB 4.32Å; F296-S336 PolarHBondContact N-OG 3.17Å; F296-S336 PolarHBondContact O-N 3.04Å; F296-S336 PolarHBondContact O-OG 3.24Å
297	H	95.6	Very high	86.5	Confident	41 Å²	41	43.9 Å²	43.9	19%	0.19	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	127.7	176	-176.2	-141.3	0	0	0	109.5	G282 N283 Y299 E333 L334	G282-H297 CarbonylContact C-O 3.6Å; G282-H297 VanDerWaalsContact CA-O 3.23Å; G282-H297 WeakPolarHBondContact CA-O 3.44Å; N283-H297 PolarHBondContact N-O 3.29Å; N283-H297 PolarHBondContact O-N 3.07Å; H297-Y299 AromaticContact CE1-CD1 3.14Å; H297-Y299 WeakPolarHBondContact CE1-CD1 3.24Å; H297-Y299 AromaticContact CE1-CE1 3.59Å; H297-Y299 AromaticContact CE1-CG 3.77Å; H297-Y299 AromaticContact ND1-CD1 3.47Å; H297-Y299 WeakPolarHBondContact ND1-CD1 3.34Å; H297-Y299 AromaticContact ND1-CE1 3.7Å; H297-Y299 AromaticContact NE2-CD1 3.66Å; H297-E333 IonicContact NE2-OE2 3.6Å; H297-L334 WeakPolarHBondContact CA-O 3.32Å
298	L	95.7	Very high	86.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	124.4	176.4	178.9	66.4	0	0	0	108.2	L223 F257 I259 F280 T281 F296 E333 L334	L223-L298 HydrophobicContact CD2-CD2 4.12Å; F257-L298 HydrophobicContact CE2-CD1 3.69Å; F257-L298 HydrophobicContact CZ-CD1 4.16Å; I259-L298 HydrophobicContact CD1-CD1 4.22Å; F280-L298 HydrophobicContact CB-CD1 3.82Å; F280-L298 HydrophobicContact CB-CG 4.48Å; F280-L298 HydrophobicContact CD1-CG 4.32Å; T281-L298 CarbonylContact O-C 3.51Å; T281-L298 WeakPolarHBondContact O-CA 3.35Å; F296-L298 HydrophobicContact CE1-CB 3.84Å; F296-L298 HydrophobicContact CZ-CB 4.02Å; L298-E333 CarbonylContact O-C 3.5Å; L298-E333 WeakPolarHBondContact O-CA 3.3Å; L298-L334 HydrophobicContact CB-CB 4.24Å; L298-L334 HydrophobicContact CD2-CD1 4.06Å; L298-L334 PolarHBondContact N-O 2.83Å; L298-L334 PolarHBondContact O-N 3.27Å
299	Y	94.4	Very high	86	Confident	74 Å²	74	39.8 Å²	39.8	29%	0.29	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	156.8	-177.2	67.1	-78.5	0	0	0	112.5	T281 H297 P301 L332	T281-Y299 HydrophobicContact CG2-CE1 4.04Å; T281-Y299 PolarHBondContact N-O 3.36Å; T281-Y299 WeakPolarHBondContact O-CD1 3.44Å; T281-Y299 PolarHBondContact O-N 2.95Å; H297-Y299 AromaticContact CE1-CD1 3.14Å; H297-Y299 WeakPolarHBondContact CE1-CD1 3.24Å; H297-Y299 AromaticContact CE1-CE1 3.59Å; H297-Y299 AromaticContact CE1-CG 3.77Å; H297-Y299 AromaticContact ND1-CD1 3.47Å; H297-Y299 WeakPolarHBondContact ND1-CD1 3.34Å; H297-Y299 AromaticContact ND1-CE1 3.7Å; H297-Y299 AromaticContact NE2-CD1 3.66Å; Y299-P301 HydrophobicContact CD2-CG 4.5Å; Y299-P301 HydrophobicContact CE2-CB 4.31Å; Y299-P301 HydrophobicContact CE2-CG 4.11Å; Y299-P301 WeakPolarHBondContact O-CD 3.33Å; Y299-L332 CarbonylContact C-O 3.48Å; Y299-L332 WeakPolarHBondContact CA-O 3.41Å
300	V	91	Very high	85.9	Confident	6 Å²	6	34.7 Å²	34.7	4%	0.036	18%	0.183	C	C	.	.			trans	-85.9	119.3	166.1	-179.2	0	0	0	0	108.3	P277 F280 S302 N307 L332	P277-V300 HydrophobicContact CB-CG1 4.29Å; P277-V300 HydrophobicContact CB-CG2 3.92Å; P277-V300 HydrophobicContact CG-CG2 4.43Å; F280-V300 HydrophobicContact CD1-CG2 3.65Å; F280-V300 HydrophobicContact CE1-CG2 3.41Å; F280-V300 VanDerWaalsContact CE1-CG2 3.41Å; F280-V300 HydrophobicContact CG-CG2 4.37Å; F280-V300 HydrophobicContact CZ-CG2 3.95Å; V300-S302 PolarHBondContact O-N 3.31Å; V300-N307 HydrophobicContact CG1-CB 4.44Å; V300-L332 HydrophobicContact CB-CB 4.33Å; V300-L332 HydrophobicContact CG2-CB 3.99Å; V300-L332 HydrophobicContact CG2-CD2 3.82Å; V300-L332 HydrophobicContact CG2-CG 4.31Å; V300-L332 PolarHBondContact N-O 3.46Å
301	P	87.5	Confident	85.8	Confident	17 Å²	17	34.7 Å²	34.7	11%	0.11	18%	0.182	C	C	.	.			trans	-58.8	135.7	178.1	-24.6	34.8	0	0	0	112.4	Q279 T281 Y299 N307	Q279-P301 HydrophobicContact CG-CG 3.96Å; Q279-P301 VanDerWaalsContact O-CD 3.3Å; Q279-P301 WeakPolarHBondContact O-CD 3.22Å; T281-P301 WeakPolarHBondContact OG1-CG 3.4Å; Y299-P301 HydrophobicContact CD2-CG 4.5Å; Y299-P301 HydrophobicContact CE2-CB 4.31Å; Y299-P301 HydrophobicContact CE2-CG 4.11Å; Y299-P301 WeakPolarHBondContact O-CD 3.33Å; P301-N307 WeakPolarHBondContact O-CB 3.46Å; P301-N307 PolarHBondContact O-ND2 2.89Å
302	S	83.8	Confident	85.7	Confident	57 Å²	57	32 Å²	32	40%	0.399	16%	0.163	S	C	.	.			trans	-114.6	13.9	178.3	55.4	0	0	0	0	112.8	V300 R304	V300-S302 PolarHBondContact O-N 3.31Å; S302-R304 PolarHBondContact O-N 3.45Å
303	N	78.9	Confident	85.2	Confident	132 Å²	132	30.8 Å²	30.8	71%	0.706	16%	0.158	S	C	*	.	S	Bend	trans	-70	-14.6	177.6	62.7	-23.2	0	0	0	113.6
304	R	71.7	Confident	84.2	Confident	74 Å²	74	34.8 Å²	34.8	28%	0.279	17%	0.174	S	C	.	.	S	Bend	trans	-109.3	153.2	-177.5	-73.7	156.1	166.7	-140.6	-4.6	110.3	S302 L306 Y328 D424 Q426	S302-R304 PolarHBondContact O-N 3.45Å; R304-L306 PolarHBondContact O-N 3.47Å; R304-Y328 VanDerWaalsContact O-CE2 3.3Å; R304-Y328 WeakPolarHBondContact O-CE2 3.42Å; R304-D424 IonicContact CZ-OD1 3.77Å; R304-D424 IonicContact CZ-OD2 3.36Å; R304-D424 VanDerWaalsContact CZ-OD2 3.25Å; R304-D424 IonicContact NH1-OD1 3.9Å; R304-D424 PolarHBondContact NH1-OD1 2.72Å; R304-D424 IonicContact NH1-OD2 2.81Å; R304-D424 PolarHBondContact NH1-OD2 2.9Å; R304-D424 IonicContact NH2-OD2 2.76Å; R304-D424 PolarHBondContact NH2-OD2 3.02Å; R304-Q426 HydrophobicContact CB-CG 4.14Å; R304-Q426 HydrophobicContact CG-CG 4.19Å; R304-Q426 VanDerWaalsContact CZ-NE2 3.32Å; R304-Q426 VanDerWaalsContact NH1-CG 3.3Å; R304-Q426 VanDerWaalsContact NH1-NE2 3.19Å
305	S	69.9	Low	82.9	Confident	80 Å²	80	34.1 Å²	34.1	56%	0.559	18%	0.183	S	C	*	.	S	Bend	trans	-67.9	-20.7	-176.6	68.9	0	0	0	0	113.8	Y328	S305-Y328 WeakPolarHBondContact O-CD2 3.47Å
306	L	76.6	Confident	81.1	Confident	27 Å²	27	36.1 Å²	36.1	14%	0.141	21%	0.211	C	C	.	.			trans	-139.6	137.1	177.6	-63.4	173.1	0	0	0	107.6	R304 I326	R304-L306 PolarHBondContact O-N 3.47Å; L306-I326 HydrophobicContact CB-CG2 3.76Å; L306-I326 HydrophobicContact CD1-CB 4.46Å; L306-I326 HydrophobicContact CD1-CG2 3.88Å; L306-I326 HydrophobicContact CD2-CG2 4.2Å; L306-I326 HydrophobicContact CG-CG2 4.15Å
307	N	83.3	Confident	78.9	Confident	6 Å²	6	38.9 Å²	38.9	3%	0.032	23%	0.23	C	C	.	.			trans	-148.1	3.5	-175.5	66.1	-10.7	0	0	0	114.1	G278 V300 P301 G327 L329	G278-N307 PolarHBondContact N-O 2.92Å; V300-N307 HydrophobicContact CG1-CB 4.44Å; P301-N307 WeakPolarHBondContact O-CB 3.46Å; P301-N307 PolarHBondContact O-ND2 2.89Å; N307-G327 PolarHBondContact N-O 3.14Å; N307-G327 VanDerWaalsContact N-O 3.13Å; N307-L329 PolarHBondContact ND2-O 3.47Å; N307-L329 PolarHBondContact OD1-N 2.89Å
308	V	84.4	Confident	76.7	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	138.1	177.9	174.8	0	0	0	0	110.1	L131 F275 M310 I326 G327 L329	L131-V308 HydrophobicContact CD1-CB 3.95Å; L131-V308 HydrophobicContact CD1-CG1 3.91Å; L131-V308 HydrophobicContact CD1-CG2 4.46Å; F275-V308 HydrophobicContact CD1-CG1 4.03Å; F275-V308 HydrophobicContact CD2-CG1 3.8Å; F275-V308 HydrophobicContact CE1-CG1 3.68Å; F275-V308 HydrophobicContact CE1-CG2 4.05Å; F275-V308 HydrophobicContact CE2-CG1 3.48Å; F275-V308 VanDerWaalsContact CE2-CG1 3.48Å; F275-V308 HydrophobicContact CG-CG1 4.09Å; F275-V308 HydrophobicContact CZ-CB 4.22Å; F275-V308 HydrophobicContact CZ-CG1 3.41Å; F275-V308 VanDerWaalsContact CZ-CG1 3.41Å; F275-V308 HydrophobicContact CZ-CG2 3.8Å; V308-M310 HydrophobicContact CG1-CG 4.2Å; V308-I326 WeakPolarHBondContact O-CA 3.42Å; V308-I326 VanDerWaalsContact O-CG2 3.3Å; V308-I326 WeakPolarHBondContact O-CG2 3.46Å; V308-G327 PolarHBondContact N-O 2.74Å; V308-G327 VanDerWaalsContact N-O 3.16Å; V308-G327 PolarHBondContact O-N 3.18Å; V308-L329 HydrophobicContact CG2-CB 3.5Å; V308-L329 HydrophobicContact CG2-CD2 3.98Å; V308-L329 HydrophobicContact CG2-CG 4.37Å
309	D	82.8	Confident	74.3	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.011	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	142	176.8	-175.2	16.4	0	0	0	110.2	T276 M429	T276-D309 PolarHBondContact N-O 3.43Å; T276-D309 PolarHBondContact O-N 3.25Å; D309-M429 WeakPolarHBondContact OD2-CA 3.25Å; D309-M429 WeakPolarHBondContact OD2-CB 3.32Å; D309-M429 WeakPolarHBondContact OD2-CG 3.32Å; D309-M429 PolarHBondContact OD2-N 2.83Å
310	M	84.7	Confident	72.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	130.3	-172.9	-69.5	169.6	-72	0	0	110.5	L131 M136 L154 F273 W274 F275 V308 W312 V324 D325	L131-M310 HydrophobicContact CD1-CE 3.9Å; L131-M310 HydrophobicContact CD1-SD 3.92Å; L131-M310 HydrophobicContact CD2-CE 4.16Å; L131-M310 HydrophobicContact CD2-SD 4.25Å; M136-M310 HydrophobicContact CE-CE 3.82Å; M136-M310 HydrophobicContact CE-SD 4.15Å; M136-M310 HydrophobicContact CG-CE 3.81Å; M136-M310 HydrophobicContact SD-CE 4.02Å; M136-M310 HydrophobicContact SD-SD 4.35Å; L154-M310 HydrophobicContact CD1-SD 4.36Å; L154-M310 HydrophobicContact CD2-SD 3.81Å; F273-M310 HydrophobicContact CE1-CB 4.27Å; F273-M310 HydrophobicContact CE1-CG 4.02Å; F273-M310 HydrophobicContact CE1-SD 4.4Å; F273-M310 HydrophobicContact CZ-CB 3.83Å; F273-M310 HydrophobicContact CZ-CG 3.84Å; F273-M310 HydrophobicContact CZ-SD 3.91Å; W274-M310 WeakPolarHBondContact O-CA 3.4Å; F275-M310 HydrophobicContact CD2-CG 4.12Å; F275-M310 HydrophobicContact CD2-SD 4.47Å; V308-M310 HydrophobicContact CG1-CG 4.2Å; M310-W312 HydrophobicContact CB-CE3 4.47Å; M310-W312 HydrophobicContact CB-CZ3 4.22Å; M310-V324 CarbonylContact O-C 3.59Å; M310-V324 WeakPolarHBondContact O-CA 3.36Å; M310-D325 PolarHBondContact N-O 3.25Å; M310-D325 PolarHBondContact O-N 2.91Å
311	E	83.2	Confident	71	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.009	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	137.1	175.8	-60.5	163.2	-115.4	0	0	109.8	R235 W274 M322 E323 V324 M429	R235-E311 IonicContact CZ-OE1 2.83Å; R235-E311 IonicContact CZ-OE2 2.73Å; R235-E311 IonicContact NH1-OE1 2.63Å; R235-E311 IonicContact NH1-OE2 2.86Å; R235-E311 PolarHBondContact NH1-OE2 2.84Å; R235-E311 IonicContact NH2-OE1 2.62Å; R235-E311 PolarHBondContact NH2-OE1 2.87Å; R235-E311 IonicContact NH2-OE2 2.92Å; R235-E311 PolarHBondContact NH2-OE2 3.02Å; W274-E311 HydrophobicContact CB-CB 4.28Å; W274-E311 PolarHBondContact N-O 3.33Å; W274-E311 PolarHBondContact O-N 2.85Å; E311-M322 HydrophobicContact CB-CG 4.46Å; E311-M322 HydrophobicContact CB-SD 4.44Å; E311-M322 VanDerWaalsContact OE2-SD 3.38Å; E311-E323 VanDerWaalsContact CA-O 3.31Å; E311-E323 WeakPolarHBondContact CA-O 3.48Å; E311-V324 HydrophobicContact CG-CG1 4.03Å; E311-M429 VanDerWaalsContact CD-SD 3.59Å; E311-M429 HydrophobicContact CG-CE 4.29Å; E311-M429 HydrophobicContact CG-CG 4.22Å; E311-M429 HydrophobicContact CG-SD 4.1Å; E311-M429 WeakPolarHBondContact OE1-CE 3.49Å; E311-M429 WeakPolarHBondContact OE2-CE 3.5Å
312	W	83.2	Confident	70.3	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	145.8	173	63.6	88.8	0	0	0	111.8	M136 V146 P272 F273 M310 E323 D325	M136-W312 HydrophobicContact CE-CH2 4.32Å; M136-W312 HydrophobicContact CE-CZ3 4.4Å; V146-W312 HydrophobicContact CG1-CZ2 3.96Å; V146-W312 HydrophobicContact CG2-CZ2 3.88Å; P272-W312 WeakPolarHBondContact O-CA 3.34Å; F273-W312 HydrophobicContact CB-CB 4.32Å; F273-W312 HydrophobicContact CD2-CB 3.52Å; F273-W312 HydrophobicContact CD2-CD2 4.15Å; F273-W312 HydrophobicContact CD2-CE3 4.07Å; F273-W312 AromaticContact CD2-CG 3.97Å; F273-W312 HydrophobicContact CD2-CG 3.97Å; F273-W312 HydrophobicContact CE2-CB 4.12Å; F273-W312 AromaticContact CE2-CD2 3.86Å; F273-W312 HydrophobicContact CE2-CD2 3.86Å; F273-W312 AromaticContact CE2-CE3 3.41Å; F273-W312 HydrophobicContact CE2-CE3 3.41Å; F273-W312 VanDerWaalsContact CE2-CE3 3.41Å; F273-W312 HydrophobicContact CE2-CG 4.18Å; F273-W312 HydrophobicContact CE2-CZ3 4.15Å; F273-W312 HydrophobicContact CG-CB 4.23Å; F273-W312 HydrophobicContact CZ-CE3 4.12Å; M310-W312 HydrophobicContact CB-CE3 4.47Å; M310-W312 HydrophobicContact CB-CZ3 4.22Å; W312-E323 HydrophobicContact CD2-CB 3.97Å; W312-E323 VanDerWaalsContact CE2-CB 3.41Å; W312-E323 HydrophobicContact CE3-CB 4.49Å; W312-E323 HydrophobicContact CG-CB 4.47Å; W312-E323 HydrophobicContact CH2-CB 4.08Å; W312-E323 HydrophobicContact CZ2-CB 3.48Å; W312-E323 VanDerWaalsContact CZ2-CB 3.48Å; W312-E323 HydrophobicContact CZ2-CG 3.96Å; W312-E323 PolarHBondContact N-O 3.46Å; W312-E323 PolarHBondContact O-N 3.27Å; W312-D325 HydrophobicContact CH2-CB 3.85Å; W312-D325 HydrophobicContact CZ3-CB 3.88Å
313	L	77.9	Confident	69.9	Low	10 Å²	10	52.9 Å²	52.9	5%	0.052	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	143.8	175	-65.4	170.4	0	0	0	109.6	N204 N205 F271 P272 N321 M322	N204-L313 HydrophobicContact CB-CD1 4.06Å; N205-L313 WeakPolarHBondContact OD1-CD1 3.44Å; F271-L313 HydrophobicContact CB-CB 4.05Å; F271-L313 VanDerWaalsContact CB-O 3.25Å; F271-L313 WeakPolarHBondContact CB-O 3.28Å; F271-L313 HydrophobicContact CG-CB 4.46Å; P272-L313 HydrophobicContact CG-CD1 4.32Å; P272-L313 PolarHBondContact O-N 3.34Å; L313-N321 WeakPolarHBondContact CA-O 3.23Å; L313-M322 HydrophobicContact CD2-CB 4.06Å; L313-M322 HydrophobicContact CD2-CE 3.85Å; L313-M322 HydrophobicContact CD2-CG 4.48Å
314	Y	69.8	Low	69.9	Low	85 Å²	85	48.3 Å²	48.3	33%	0.333	29%	0.29	S	S	.	.			trans	-138.2	139.3	174.7	67.1	-77.9	0	0	0	111.9	N321 E323	Y314-N321 HydrophobicContact CD1-CB 4.01Å; Y314-N321 WeakPolarHBondContact CD1-O 3.41Å; Y314-N321 HydrophobicContact CD2-CB 4.19Å; Y314-N321 HydrophobicContact CE1-CB 3.84Å; Y314-N321 WeakPolarHBondContact CE1-O 3.28Å; Y314-N321 HydrophobicContact CE2-CB 4.07Å; Y314-N321 HydrophobicContact CG-CB 4.17Å; Y314-N321 PolarHBondContact N-O 3.33Å; Y314-N321 WeakPolarHBondContact O-CB 3.49Å; Y314-N321 PolarHBondContact O-ND2 2.94Å; Y314-N321 VanDerWaalsContact O-ND2 3.08Å; Y314-E323 HydrophobicContact CD1-CB 4.35Å; Y314-E323 HydrophobicContact CD1-CG 3.71Å; Y314-E323 HydrophobicContact CE1-CB 4.26Å; Y314-E323 HydrophobicContact CE1-CG 3.46Å; Y314-E323 VanDerWaalsContact CE1-CG 3.46Å; Y314-E323 PolarHBondContact OH-OE1 2.88Å
315	G	60.5	Low	70.2	Confident	38 Å²	38	44.8 Å²	44.8	39%	0.392	28%	0.277	S	S	.	.	S	Bend	trans	81.8	174	-178.7	0	0	0	0	0	114.6	F271 S317	F271-G315 WeakPolarHBondContact CE1-O 3.43Å; F271-G315 WeakPolarHBondContact CE2-O 3.48Å; F271-G315 WeakPolarHBondContact CZ-O 3.34Å; G315-S317 PolarHBondContact O-N 3.27Å
316	A	52.5	Low	70.7	Confident	106 Å²	106	41.3 Å²	41.3	88%	0.876	25%	0.253	S	S	*	.	S	Bend	trans	-82.6	-3	-162.3	0	0	0	0	0	116.3
317	S	49.3	Very low	70.9	Confident	58 Å²	58	40 Å²	40	41%	0.406	25%	0.246	S	C	.	.			trans	-119.2	131.3	-175.6	55.8	0	0	0	0	112.6	G315 S319	G315-S317 PolarHBondContact O-N 3.27Å; S317-S319 VanDerWaalsContact C-N 3.31Å; S317-S319 PolarHBondContact O-N 2.73Å
318	E	49.6	Very low	71.1	Confident	148 Å²	148	42.5 Å²	42.5	69%	0.692	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-16	-171.1	-55.3	-175.2	149.7	0	0	115.3	N205	N205-E318 WeakPolarHBondContact ND2-CG 2.96Å; N205-E318 PolarHBondContact ND2-OE1 2.96Å
319	S	46	Very low	71.3	Confident	117 Å²	117	42.5 Å²	42.5	82%	0.818	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-7.5	-162.6	54.9	0	0	0	0	116.9	S317	S317-S319 VanDerWaalsContact C-N 3.31Å; S317-S319 PolarHBondContact O-N 2.73Å
320	S	49.8	Very low	71.6	Confident	81 Å²	81	43.9 Å²	43.9	57%	0.566	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.5	-2.3	-169.3	65.3	0	0	0	0	116.9
321	N	65.3	Low	72	Confident	41 Å²	41	46.1 Å²	46.1	22%	0.219	28%	0.275	C	S	.	.			trans	-130.6	63.6	-168.8	-55.5	-10.4	0	0	0	111.1	L313 Y314	L313-N321 WeakPolarHBondContact CA-O 3.23Å; Y314-N321 HydrophobicContact CD1-CB 4.01Å; Y314-N321 WeakPolarHBondContact CD1-O 3.41Å; Y314-N321 HydrophobicContact CD2-CB 4.19Å; Y314-N321 HydrophobicContact CE1-CB 3.84Å; Y314-N321 WeakPolarHBondContact CE1-O 3.28Å; Y314-N321 HydrophobicContact CE2-CB 4.07Å; Y314-N321 HydrophobicContact CG-CB 4.17Å; Y314-N321 PolarHBondContact N-O 3.33Å; Y314-N321 WeakPolarHBondContact O-CB 3.49Å; Y314-N321 PolarHBondContact O-ND2 2.94Å; Y314-N321 VanDerWaalsContact O-ND2 3.08Å
322	M	72.9	Confident	72.5	Confident	62 Å²	62	46.1 Å²	46.1	31%	0.305	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	122.8	171.4	-179.8	176.3	-78.5	0	0	108.1	N204 E311 L313 V324	N204-M322 HydrophobicContact CB-CE 4.05Å; N204-M322 WeakPolarHBondContact ND2-CE 3.5Å; E311-M322 HydrophobicContact CB-CG 4.46Å; E311-M322 HydrophobicContact CB-SD 4.44Å; E311-M322 VanDerWaalsContact OE2-SD 3.38Å; L313-M322 HydrophobicContact CD2-CB 4.06Å; L313-M322 HydrophobicContact CD2-CE 3.85Å; L313-M322 HydrophobicContact CD2-CG 4.48Å; M322-V324 HydrophobicContact CG-CG1 4.41Å
323	E	76.3	Confident	73	Confident	39 Å²	39	48.4 Å²	48.4	18%	0.182	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	147.5	166.2	-76.9	-61.1	158.5	0	0	109	K138 E311 W312 Y314	K138-E323 WeakPolarHBondContact CE-OE2 3.1Å; K138-E323 IonicContact NZ-OE2 3.24Å; K138-E323 PolarHBondContact NZ-OE2 3.45Å; E311-E323 VanDerWaalsContact CA-O 3.31Å; E311-E323 WeakPolarHBondContact CA-O 3.48Å; W312-E323 HydrophobicContact CD2-CB 3.97Å; W312-E323 VanDerWaalsContact CE2-CB 3.41Å; W312-E323 HydrophobicContact CE3-CB 4.49Å; W312-E323 HydrophobicContact CG-CB 4.47Å; W312-E323 HydrophobicContact CH2-CB 4.08Å; W312-E323 HydrophobicContact CZ2-CB 3.48Å; W312-E323 VanDerWaalsContact CZ2-CB 3.48Å; W312-E323 HydrophobicContact CZ2-CG 3.96Å; W312-E323 PolarHBondContact N-O 3.46Å; W312-E323 PolarHBondContact O-N 3.27Å; Y314-E323 HydrophobicContact CD1-CB 4.35Å; Y314-E323 HydrophobicContact CD1-CG 3.71Å; Y314-E323 HydrophobicContact CE1-CB 4.26Å; Y314-E323 HydrophobicContact CE1-CG 3.46Å; Y314-E323 VanDerWaalsContact CE1-CG 3.46Å; Y314-E323 PolarHBondContact OH-OE1 2.88Å
324	V	78.1	Confident	73.9	Confident	36 Å²	36	47.9 Å²	47.9	22%	0.218	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	141.1	173.9	-52.8	0	0	0	0	109.1	M310 E311 M322 W420 M429	M310-V324 CarbonylContact O-C 3.59Å; M310-V324 WeakPolarHBondContact O-CA 3.36Å; E311-V324 HydrophobicContact CG-CG1 4.03Å; M322-V324 HydrophobicContact CG-CG1 4.41Å; V324-W420 HydrophobicContact CG2-CZ3 4.36Å; V324-M429 HydrophobicContact CG1-SD 4.45Å
325	D	77.8	Confident	75.1	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	158	172.3	-154.6	-7.3	0	0	0	110.4	M136 T137 K138 M310 W312	M136-D325 WeakPolarHBondContact CB-OD2 3.31Å; M136-D325 HydrophobicContact CE-CB 4.1Å; M136-D325 WeakPolarHBondContact CE-OD2 3.26Å; T137-D325 WeakPolarHBondContact CB-OD1 3.42Å; T137-D325 PolarHBondContact N-OD1 3.42Å; T137-D325 PolarHBondContact N-OD2 3.04Å; T137-D325 PolarHBondContact OG1-OD1 2.97Å; K138-D325 VanDerWaalsContact CB-OD2 3.22Å; K138-D325 WeakPolarHBondContact CB-OD2 3.14Å; K138-D325 HydrophobicContact CG-CB 4.31Å; K138-D325 WeakPolarHBondContact CG-OD2 3.44Å; K138-D325 PolarHBondContact N-OD2 3.49Å; M310-D325 PolarHBondContact N-O 3.25Å; M310-D325 PolarHBondContact O-N 2.91Å; W312-D325 HydrophobicContact CH2-CB 3.85Å; W312-D325 HydrophobicContact CZ3-CB 3.88Å
326	I	79.8	Confident	76.6	Confident	7 Å²	7	49.9 Å²	49.9	4%	0.036	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	140	-178.8	-54.4	170	0	0	0	107.6	L306 V308 W420	L306-I326 HydrophobicContact CB-CG2 3.76Å; L306-I326 HydrophobicContact CD1-CB 4.46Å; L306-I326 HydrophobicContact CD1-CG2 3.88Å; L306-I326 HydrophobicContact CD2-CG2 4.2Å; L306-I326 HydrophobicContact CG-CG2 4.15Å; V308-I326 WeakPolarHBondContact O-CA 3.42Å; V308-I326 VanDerWaalsContact O-CG2 3.3Å; V308-I326 WeakPolarHBondContact O-CG2 3.46Å; I326-W420 HydrophobicContact CD1-CE3 4.31Å; I326-W420 HydrophobicContact CD1-CH2 4.4Å; I326-W420 HydrophobicContact CD1-CZ3 3.83Å; I326-W420 HydrophobicContact CG1-CZ3 4.25Å
327	G	82.9	Confident	78.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	-178.8	-179.4	0	0	0	0	0	113.7	N307 V308	N307-G327 PolarHBondContact N-O 3.14Å; N307-G327 VanDerWaalsContact N-O 3.13Å; V308-G327 PolarHBondContact N-O 2.74Å; V308-G327 VanDerWaalsContact N-O 3.16Å; V308-G327 PolarHBondContact O-N 3.18Å
328	Y	86.4	Confident	79.8	Confident	57 Å²	57	47.8 Å²	47.8	22%	0.224	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-117.2	120.9	-179.1	179.5	-101.7	0	0	0	111.5	L132 S135 R304 S305 P330	L132-Y328 HydrophobicContact CD1-CD1 3.86Å; L132-Y328 HydrophobicContact CD1-CE1 4.34Å; L132-Y328 HydrophobicContact CG-CD1 4.34Å; L132-Y328 PolarHBondContact N-O 2.99Å; S135-Y328 PolarHBondContact OG-N 3.01Å; R304-Y328 VanDerWaalsContact O-CE2 3.3Å; R304-Y328 WeakPolarHBondContact O-CE2 3.42Å; S305-Y328 WeakPolarHBondContact O-CD2 3.47Å; Y328-P330 HydrophobicContact CD1-CG 4.12Å; Y328-P330 HydrophobicContact CE1-CB 4.02Å; Y328-P330 HydrophobicContact CE1-CG 3.84Å
329	L	88.9	Confident	81.5	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	22%	0.224	C	C	.	.			trans	-102.7	113.3	173.6	-174.2	69.8	0	0	0	109.6	K129 L131 F275 N307 V308 Q331 L332	K129-L329 WeakPolarHBondContact O-CD1 3.3Å; L131-L329 HydrophobicContact CB-CD1 4.13Å; F275-L329 HydrophobicContact CE1-CD2 4.34Å; F275-L329 HydrophobicContact CZ-CD1 4.31Å; F275-L329 HydrophobicContact CZ-CD2 4.05Å; N307-L329 PolarHBondContact ND2-O 3.47Å; N307-L329 PolarHBondContact OD1-N 2.89Å; V308-L329 HydrophobicContact CG2-CB 3.5Å; V308-L329 HydrophobicContact CG2-CD2 3.98Å; V308-L329 HydrophobicContact CG2-CG 4.37Å; L329-Q331 PolarHBondContact O-N 2.91Å; L329-L332 HydrophobicContact CD2-CB 3.55Å; L329-L332 HydrophobicContact CD2-CD2 3.9Å; L329-L332 HydrophobicContact CD2-CG 4.26Å; L329-L332 HydrophobicContact CG-CB 4.4Å
330	P	89.1	Confident	83.4	Confident	31 Å²	31	36 Å²	36	20%	0.201	19%	0.186	C	C	.	.	S	Bend	trans	-68.6	-35	-175.4	-21.6	32.6	0	0	0	114.4	K129 P130 L132 Y328	K129-P330 HydrophobicContact CB-CB 4.24Å; K129-P330 HydrophobicContact CB-CG 4.49Å; K129-P330 HydrophobicContact CD-CB 4.33Å; P130-P330 WeakPolarHBondContact O-CD 3.48Å; L132-P330 HydrophobicContact CD1-CG 4.23Å; L132-P330 HydrophobicContact CD2-CG 4.18Å; L132-P330 HydrophobicContact CG-CG 3.9Å; Y328-P330 HydrophobicContact CD1-CG 4.12Å; Y328-P330 HydrophobicContact CE1-CB 4.02Å; Y328-P330 HydrophobicContact CE1-CG 3.84Å
331	Q	92.1	Very high	84.9	Confident	47 Å²	47	33.9 Å²	33.9	22%	0.22	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	127.6	-174.8	-170.6	177.2	19	0	0	111.2	M128 K129 L329 E333	M128-Q331 CarbonylContact C-O 3.53Å; M128-Q331 WeakPolarHBondContact CA-O 3.27Å; K129-Q331 HydrophobicContact CB-CB 3.96Å; K129-Q331 HydrophobicContact CD-CB 3.99Å; K129-Q331 HydrophobicContact CG-CB 3.98Å; K129-Q331 PolarHBondContact N-O 2.6Å; L329-Q331 PolarHBondContact O-N 2.91Å; Q331-E333 HydrophobicContact CG-CG 4.25Å; Q331-E333 PolarHBondContact NE2-OE1 3.29Å
332	L	93.6	Very high	85.5	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	102.6	166.9	-173	72.6	0	0	0	107.3	S127 M128 F226 F280 Y299 V300 L329	S127-L332 WeakPolarHBondContact O-CA 3.38Å; M128-L332 HydrophobicContact CB-CD1 3.98Å; M128-L332 HydrophobicContact CG-CD1 3.67Å; M128-L332 HydrophobicContact SD-CD1 4.02Å; F226-L332 HydrophobicContact CB-CD1 4.3Å; F226-L332 HydrophobicContact CD1-CD1 3.3Å; F226-L332 HydrophobicContact CD1-CG 3.98Å; F226-L332 HydrophobicContact CD2-CD1 4.37Å; F226-L332 HydrophobicContact CD2-CD2 4.5Å; F226-L332 HydrophobicContact CD2-CG 4.37Å; F226-L332 HydrophobicContact CE1-CD1 3.48Å; F226-L332 VanDerWaalsContact CE1-CD1 3.48Å; F226-L332 HydrophobicContact CE1-CG 3.78Å; F226-L332 HydrophobicContact CE2-CG 4.18Å; F226-L332 HydrophobicContact CG-CD1 3.77Å; F226-L332 HydrophobicContact CG-CG 4.25Å; F226-L332 HydrophobicContact CZ-CD1 4.08Å; F226-L332 HydrophobicContact CZ-CG 3.86Å; F280-L332 HydrophobicContact CE1-CD2 3.82Å; F280-L332 HydrophobicContact CE1-CG 4.46Å; F280-L332 HydrophobicContact CZ-CD2 3.91Å; Y299-L332 CarbonylContact C-O 3.48Å; Y299-L332 WeakPolarHBondContact CA-O 3.41Å; V300-L332 HydrophobicContact CB-CB 4.33Å; V300-L332 HydrophobicContact CG2-CB 3.99Å; V300-L332 HydrophobicContact CG2-CD2 3.82Å; V300-L332 HydrophobicContact CG2-CG 4.31Å; V300-L332 PolarHBondContact N-O 3.46Å; L329-L332 HydrophobicContact CD2-CB 3.55Å; L329-L332 HydrophobicContact CD2-CD2 3.9Å; L329-L332 HydrophobicContact CD2-CG 4.26Å; L329-L332 HydrophobicContact CG-CB 4.4Å
333	E	95.2	Very high	85.1	Confident	49 Å²	49	33 Å²	33	23%	0.229	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	147.5	-172.6	67.3	-171.1	-175.5	0	0	113	A126 S127 H297 L298 Q331	A126-E333 WeakPolarHBondContact CA-O 3.46Å; S127-E333 PolarHBondContact N-O 3.05Å; S127-E333 PolarHBondContact O-N 2.98Å; H297-E333 IonicContact NE2-OE2 3.6Å; L298-E333 CarbonylContact O-C 3.5Å; L298-E333 WeakPolarHBondContact O-CA 3.3Å; Q331-E333 HydrophobicContact CG-CG 4.25Å; Q331-E333 PolarHBondContact NE2-OE1 3.29Å
334	L	95.3	Very high	84.5	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.2	166.3	-55.1	-178.7	0	0	0	108.2	E125 A126 L222 M225 F226 F296 H297 L298	E125-L334 VanDerWaalsContact O-CA 3.3Å; E125-L334 WeakPolarHBondContact O-CA 3.15Å; A126-L334 HydrophobicContact CB-CD2 3.48Å; A126-L334 VanDerWaalsContact CB-CD2 3.48Å; L222-L334 HydrophobicContact CB-CD1 3.97Å; L222-L334 HydrophobicContact CD2-CD1 4.2Å; M225-L334 HydrophobicContact CB-CD2 4.25Å; M225-L334 HydrophobicContact CE-CD2 4.25Å; M225-L334 HydrophobicContact SD-CD1 4.27Å; M225-L334 HydrophobicContact SD-CD2 4.17Å; F226-L334 HydrophobicContact CD1-CD2 4.33Å; F226-L334 HydrophobicContact CE1-CD2 3.6Å; F226-L334 HydrophobicContact CE1-CG 4.21Å; F226-L334 HydrophobicContact CE2-CD1 4.16Å; F226-L334 HydrophobicContact CE2-CD2 3.85Å; F226-L334 HydrophobicContact CE2-CG 3.73Å; F226-L334 HydrophobicContact CZ-CD1 4.35Å; F226-L334 HydrophobicContact CZ-CD2 3.35Å; F226-L334 HydrophobicContact CZ-CG 3.44Å; F226-L334 VanDerWaalsContact CZ-CG 3.44Å; F296-L334 HydrophobicContact CE1-CB 4.32Å; H297-L334 WeakPolarHBondContact CA-O 3.32Å; L298-L334 HydrophobicContact CB-CB 4.24Å; L298-L334 HydrophobicContact CD2-CD1 4.06Å; L298-L334 PolarHBondContact N-O 2.83Å; L298-L334 PolarHBondContact O-N 3.27Å
335	R	95.4	Very high	83.8	Confident	155 Å²	155	34.6 Å²	34.6	59%	0.585	18%	0.181	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	137.7	179.1	-172.9	176.5	175.6	178.8	-0.7	110.9	L124 E125	L124-R335 WeakPolarHBondContact CA-O 2.81Å; E125-R335 PolarHBondContact N-O 2.82Å; E125-R335 PolarHBondContact O-N 2.89Å
336	S	92.2	Very high	83.1	Confident	9 Å²	9	38.6 Å²	38.6	6%	0.063	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	130.7	169.3	58.5	0	0	0	0	110.8	V123 F296 G338	V123-S336 WeakPolarHBondContact O-CA 2.93Å; F296-S336 PolarHBondContact N-OG 3.17Å; F296-S336 PolarHBondContact O-N 3.04Å; F296-S336 PolarHBondContact O-OG 3.24Å; S336-G338 PolarHBondContact O-N 3.04Å
337	I	85.9	Confident	82.1	Confident	102 Å²	102	41.7 Å²	41.7	52%	0.523	22%	0.222	S	C	.	.	S	Bend	trans	-66.6	-31.9	175.8	-53.2	176.6	0	0	0	110.7	V123 E125	V123-I337 HydrophobicContact CB-CD1 4.13Å; V123-I337 HydrophobicContact CG1-CD1 3.55Å; V123-I337 HydrophobicContact CG1-CG1 4.34Å; V123-I337 PolarHBondContact O-N 3.21Å; E125-I337 HydrophobicContact CG-CD1 3.64Å; E125-I337 HydrophobicContact CG-CG1 3.63Å; E125-I337 VanDerWaalsContact OE1-CD1 3.27Å; E125-I337 WeakPolarHBondContact OE1-CD1 3.45Å
338	G	82.8	Confident	81	Confident	18 Å²	18	51 Å²	51	19%	0.186	27%	0.266	C	S	.	.	S	Bend	trans	-167.7	-172.1	179.1	0	0	0	0	0	110.8	L122 S336	L122-G338 WeakPolarHBondContact CD1-O 3.45Å; S336-G338 PolarHBondContact O-N 3.04Å
339	P	86.1	Confident	79.7	Confident	16 Å²	16	54.7 Å²	54.7	10%	0.104	29%	0.289	C	S	.	.	S	Bend	trans	-64.6	163.1	174	30.2	-35.1	0	0	0	111.3	V293 R294 F365	V293-P339 CarbonylContact O-C 3.57Å; V293-P339 WeakPolarHBondContact O-CA 3.39Å; R294-P339 WeakPolarHBondContact O-CA 3.45Å; P339-F365 HydrophobicContact CG-CB 4.3Å; P339-F365 HydrophobicContact CG-CD1 3.79Å; P339-F365 HydrophobicContact CG-CD2 3.88Å; P339-F365 HydrophobicContact CG-CE1 4.11Å; P339-F365 HydrophobicContact CG-CE2 4.19Å; P339-F365 HydrophobicContact CG-CG 3.69Å; P339-F365 HydrophobicContact CG-CZ 4.32Å
340	S	85.1	Confident	78.3	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.021	32%	0.315	C	S	.	.			trans	-62.4	141.4	171.1	56	0	0	0	0	110	E120 T121 H292 V293	E120-S340 WeakPolarHBondContact OE2-CB 3.47Å; E120-S340 PolarHBondContact OE2-OG 3.39Å; T121-S340 WeakPolarHBondContact O-CA 3.11Å; H292-S340 WeakPolarHBondContact CA-OG 3.47Å; H292-S340 PolarHBondContact CE1-O 3.4Å; H292-S340 VanDerWaalsContact CE1-O 3.27Å; H292-S340 PolarHBondContact ND1-OG 3.19Å; V293-S340 PolarHBondContact N-OG 3.38Å; V293-S340 PolarHBondContact O-N 3.42Å; V293-S340 PolarHBondContact O-OG 2.64Å
341	T	81.3	Confident	76.9	Confident	35 Å²	35	60.4 Å²	60.4	22%	0.215	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-126.1	139.9	-176.5	48.6	0	0	0	0	110.1	E120 T121 F365	E120-T341 CarbonylContact C-O 3.56Å; E120-T341 VanDerWaalsContact CA-O 3.3Å; E120-T341 WeakPolarHBondContact CA-O 3.23Å; T121-T341 PolarHBondContact N-O 2.78Å; T121-T341 PolarHBondContact O-N 3.23Å; T341-F365 HydrophobicContact CG2-CE1 4.24Å; T341-F365 HydrophobicContact CG2-CE2 3.93Å; T341-F365 HydrophobicContact CG2-CZ 3.36Å
342	P	77.6	Confident	75.4	Confident	50 Å²	50	62.3 Å²	62.3	33%	0.325	35%	0.345	S	S	.	.			trans	-65.3	151.5	175	28.7	-34.3	0	0	0	110.1	E120 V344 I345	E120-P342 HydrophobicContact CG-CB 4.33Å; P342-V344 PolarHBondContact O-N 2.87Å; P342-I345 HydrophobicContact CG-CG1 3.97Å
343	S	65.4	Low	73.8	Confident	35 Å²	35	67.2 Å²	67.2	25%	0.245	37%	0.37	C	S	.	.	S	Bend	trans	-65.7	-22.7	178.6	54.2	0	0	0	0	113.3
344	V	63.7	Low	72	Confident	64 Å²	64	66.6 Å²	66.6	39%	0.388	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	120.7	175.6	-175.3	0	0	0	0	108.4	P342 V346 V352	P342-V344 PolarHBondContact O-N 2.87Å; V344-V346 HydrophobicContact CG1-CG1 4.04Å; V344-V352 HydrophobicContact CG1-CB 4.42Å; V344-V352 HydrophobicContact CG1-CG1 3.85Å; V344-V352 HydrophobicContact CG1-CG2 3.87Å
345	I	62.9	Low	69.9	Low	44 Å²	44	69.2 Å²	69.2	23%	0.226	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	122.1	172.1	-60.2	172.3	0	0	0	107.3	P342 V352 I353 D354 I363	P342-I345 HydrophobicContact CG-CG1 3.97Å; I345-V352 CarbonylContact O-C 3.58Å; I345-I353 HydrophobicContact CG2-CB 4.17Å; I345-I353 HydrophobicContact CG2-CD1 4.28Å; I345-I353 PolarHBondContact O-N 2.83Å; I345-D354 HydrophobicContact CB-CB 4.37Å; I345-D354 HydrophobicContact CD1-CB 4.31Å; I345-D354 PolarHBondContact N-O 3.47Å; I345-D354 VanDerWaalsContact N-O 3.09Å; I345-D354 PolarHBondContact O-N 2.99Å; I345-I363 HydrophobicContact CD1-CD1 3.3Å
346	V	63.1	Low	67.9	Low	85 Å²	85	69 Å²	69	52%	0.515	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	145	176.7	-66	0	0	0	0	110.9	V344 N351 V352	V344-V346 HydrophobicContact CG1-CG1 4.04Å; V346-N351 CarbonylContact C-O 3.58Å; V346-N351 VanDerWaalsContact CA-O 3.27Å; V346-N351 WeakPolarHBondContact CA-O 3.39Å; V346-V352 HydrophobicContact CG1-CG2 4.44Å
347	D	58.5	Low	65.7	Low	72 Å²	72	74.8 Å²	74.8	39%	0.385	42%	0.417	S	S	.	.			trans	-72.2	168.9	171.8	-160	0.3	0	0	0	111.4	D349 G350 N351 I353	D347-D349 PolarHBondContact O-N 3.1Å; D347-D349 VanDerWaalsContact O-N 3.1Å; D347-G350 PolarHBondContact O-N 3.34Å; D347-N351 HydrophobicContact CB-CB 4.38Å; D347-N351 PolarHBondContact N-O 3.14Å; D347-I353 VanDerWaalsContact CA-CD1 3.43Å; D347-I353 HydrophobicContact CB-CD1 3.6Å; D347-I353 HydrophobicContact CB-CG1 3.73Å
348	E	59.4	Low	63.9	Low	196 Å²	196	73.9 Å²	73.9	92%	0.916	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-27	173.1	-68.9	-171.1	160.1	0	0	112.2
349	D	60.3	Low	62.1	Low	134 Å²	134	84.6 Å²	84.6	72%	0.717	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	2.6	176	-69	-37.9	0	0	0	114.2	D347 N351	D347-D349 PolarHBondContact O-N 3.1Å; D347-D349 VanDerWaalsContact O-N 3.1Å; D349-N351 VanDerWaalsContact C-N 3.33Å; D349-N351 PolarHBondContact O-N 3.21Å
350	G	59.4	Low	60.2	Low	52 Å²	52	86.9 Å²	86.9	54%	0.536	48%	0.483	S	S	.	.	S	Bend	trans	78.1	11.8	-179.7	0	0	0	0	0	115	D347	D347-G350 PolarHBondContact O-N 3.34Å
351	N	60.5	Low	58.4	Low	100 Å²	100	95.2 Å²	95.2	54%	0.535	52%	0.522	S	S	.	.			trans	-81.3	137.4	175.5	-63.3	-49.1	0	0	0	110.4	V346 D347 D349 I353	V346-N351 CarbonylContact C-O 3.58Å; V346-N351 VanDerWaalsContact CA-O 3.27Å; V346-N351 WeakPolarHBondContact CA-O 3.39Å; D347-N351 HydrophobicContact CB-CB 4.38Å; D347-N351 PolarHBondContact N-O 3.14Å; D349-N351 VanDerWaalsContact C-N 3.33Å; D349-N351 PolarHBondContact O-N 3.21Å; N351-I353 PolarHBondContact O-N 3.31Å; N351-I353 VanDerWaalsContact O-N 3.17Å
352	V	60.1	Low	57	Low	88 Å²	88	99.5 Å²	99.5	53%	0.533	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.4	112.7	177.2	-179.8	0	0	0	0	109.5	V344 I345 V346	V344-V352 HydrophobicContact CG1-CB 4.42Å; V344-V352 HydrophobicContact CG1-CG1 3.85Å; V344-V352 HydrophobicContact CG1-CG2 3.87Å; I345-V352 CarbonylContact O-C 3.58Å; V346-V352 HydrophobicContact CG1-CG2 4.44Å
353	I	59.7	Low	55.9	Low	104 Å²	104	101 Å²	101	53%	0.533	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.5	-42.6	176.8	-61.6	172.9	0	0	0	110	I345 D347 N351	I345-I353 HydrophobicContact CG2-CB 4.17Å; I345-I353 HydrophobicContact CG2-CD1 4.28Å; I345-I353 PolarHBondContact O-N 2.83Å; D347-I353 VanDerWaalsContact CA-CD1 3.43Å; D347-I353 HydrophobicContact CB-CD1 3.6Å; D347-I353 HydrophobicContact CB-CG1 3.73Å; N351-I353 PolarHBondContact O-N 3.31Å; N351-I353 VanDerWaalsContact O-N 3.17Å
354	D	56.6	Low	55.1	Low	36 Å²	36	108.1 Å²	108.1	19%	0.193	58%	0.584	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-146.4	131	-180	-159.9	10.6	0	0	0	110.8	I345 S360	I345-D354 HydrophobicContact CB-CB 4.37Å; I345-D354 HydrophobicContact CD1-CB 4.31Å; I345-D354 PolarHBondContact N-O 3.47Å; I345-D354 VanDerWaalsContact N-O 3.09Å; I345-D354 PolarHBondContact O-N 2.99Å; D354-S360 WeakPolarHBondContact OD1-CB 3.47Å; D354-S360 PolarHBondContact OD1-OG 3.07Å
355	S	51.9	Low	54.7	Low	55 Å²	55	108.9 Å²	108.9	39%	0.385	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.8	138.4	168.6	58.3	0	0	0	0	105.6	D357	S355-D357 PolarHBondContact O-N 3.3Å
356	R	53.7	Low	54.3	Low	150 Å²	150	113.2 Å²	113.2	57%	0.566	61%	0.611	S	S	*	*	S	Bend	trans	-56.8	26.1	-172.2	-128.2	175.9	179.8	-177.5	-1.1	117.1	T121 S166 G358	T121-R356 PolarHBondContact OG1-NH1 3.32Å; T121-R356 PolarHBondContact OG1-NH2 2.85Å; S166-R356 PolarHBondContact OG-NH2 2.73Å; R356-G358 PolarHBondContact O-N 3.24Å; R356-G358 VanDerWaalsContact O-N 3.14Å
357	D	46.3	Very low	54.1	Low	132 Å²	132	115.3 Å²	115.3	71%	0.706	61%	0.613	S	S	*	*	S	Bend	trans	-81.4	49.5	172.8	-82.6	-10.2	0	0	0	112.1	S355 R359	S355-D357 PolarHBondContact O-N 3.3Å; D357-R359 WeakPolarHBondContact O-CB 3.25Å; D357-R359 PolarHBondContact O-N 3.4Å
358	G	47	Very low	54.2	Low	82 Å²	82	119.6 Å²	119.6	85%	0.845	63%	0.631	S	S	*	*	S	Bend	trans	43.9	14.4	155.1	0	0	0	0	0	121.1	R356	R356-G358 PolarHBondContact O-N 3.24Å; R356-G358 VanDerWaalsContact O-N 3.14Å
359	R	44.5	Very low	54.8	Low	244 Å²	244	119.1 Å²	119.1	92%	0.921	63%	0.629	S	S	*	*			trans	-117.1	-7.9	-173.9	-92.5	-176.5	167.3	-176.9	-2.2	113.3	D357	D357-R359 WeakPolarHBondContact O-CB 3.25Å; D357-R359 PolarHBondContact O-N 3.4Å
360	S	48.1	Very low	55.7	Low	64 Å²	64	113.9 Å²	113.9	45%	0.448	60%	0.6	S	S	.	*	S	Bend	trans	-89.9	142.7	-176.7	-32.5	0	0	0	0	110.7	D354	D354-S360 WeakPolarHBondContact OD1-CB 3.47Å; D354-S360 PolarHBondContact OD1-OG 3.07Å
361	E	45.9	Very low	56.7	Low	177 Å²	177	116.3 Å²	116.3	83%	0.827	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-61.9	142.6	171.3	-68.2	-174.4	163.7	0	0	110.1	I363	E361-I363 PolarHBondContact O-N 2.83Å
362	P	52.2	Low	58	Low	126 Å²	126	115.4 Å²	115.4	82%	0.818	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-62.4	121.7	-178.6	24.3	-31.9	0	0	0	110.2	Q364	P362-Q364 PolarHBondContact O-N 3.12Å; P362-Q364 VanDerWaalsContact O-N 3.12Å
363	I	55.4	Low	59.2	Low	82 Å²	82	116.1 Å²	116.1	42%	0.421	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-59.9	116.6	177.2	-59.9	172.5	0	0	0	108.5	I345 E361 F365	I345-I363 HydrophobicContact CD1-CD1 3.3Å; E361-I363 PolarHBondContact O-N 2.83Å; I363-F365 HydrophobicContact CB-CE2 4.31Å; I363-F365 HydrophobicContact CB-CZ 4.28Å; I363-F365 HydrophobicContact CG2-CE1 4.16Å; I363-F365 HydrophobicContact CG2-CE2 4.26Å; I363-F365 HydrophobicContact CG2-CZ 3.97Å; I363-F365 WeakPolarHBondContact O-CD2 3.39Å; I363-F365 PolarHBondContact O-N 3.31Å
364	Q	47.8	Very low	60.5	Low	183 Å²	183	113.4 Å²	113.4	86%	0.855	59%	0.591	S	S	*	*			trans	-82.7	102.6	175.7	-170.9	173	8.3	0	0	109	P362 V366	P362-Q364 PolarHBondContact O-N 3.12Å; P362-Q364 VanDerWaalsContact O-N 3.12Å; Q364-V366 PolarHBondContact O-N 3.43Å
365	F	55.9	Low	62.2	Low	81 Å²	81	114.6 Å²	114.6	36%	0.355	61%	0.606	S	S	.	*			trans	-69	125	176.4	-65.7	-81.5	0	0	0	110.8	P339 T341 I363 F367	P339-F365 HydrophobicContact CG-CB 4.3Å; P339-F365 HydrophobicContact CG-CD1 3.79Å; P339-F365 HydrophobicContact CG-CD2 3.88Å; P339-F365 HydrophobicContact CG-CE1 4.11Å; P339-F365 HydrophobicContact CG-CE2 4.19Å; P339-F365 HydrophobicContact CG-CG 3.69Å; P339-F365 HydrophobicContact CG-CZ 4.32Å; T341-F365 HydrophobicContact CG2-CE1 4.24Å; T341-F365 HydrophobicContact CG2-CE2 3.93Å; T341-F365 HydrophobicContact CG2-CZ 3.36Å; I363-F365 HydrophobicContact CB-CE2 4.31Å; I363-F365 HydrophobicContact CB-CZ 4.28Å; I363-F365 HydrophobicContact CG2-CE1 4.16Å; I363-F365 HydrophobicContact CG2-CE2 4.26Å; I363-F365 HydrophobicContact CG2-CZ 3.97Å; I363-F365 WeakPolarHBondContact O-CD2 3.39Å; I363-F365 PolarHBondContact O-N 3.31Å; F365-F367 HydrophobicContact CB-CZ 4.49Å
366	V	54.2	Low	64.1	Low	134 Å²	134	113.3 Å²	113.3	81%	0.812	59%	0.594	S	S	*	*			trans	-87.5	116.3	168.5	-179.7	0	0	0	0	107.4	Q364 E368	Q364-V366 PolarHBondContact O-N 3.43Å; V366-E368 PolarHBondContact O-N 3.23Å
367	F	58.4	Low	65.8	Low	129 Å²	129	108.5 Å²	108.5	57%	0.566	58%	0.584	S	S	*	*			trans	-81.5	108.6	-176.9	-60	-78	0	0	0	110.5	F365	F365-F367 HydrophobicContact CB-CZ 4.49Å
368	E	60.8	Low	67.7	Low	163 Å²	163	105.4 Å²	105.4	76%	0.762	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-75	126.6	166.1	-69.5	-172.7	167.3	0	0	109.9	R294 V366 I370	R294-E368 VanDerWaalsContact CZ-O 3.22Å; R294-E368 PolarHBondContact NH1-O 3.21Å; R294-E368 PolarHBondContact NH2-O 2.9Å; V366-E368 PolarHBondContact O-N 3.23Å; E368-I370 PolarHBondContact O-N 2.88Å
369	E	71.9	Confident	69.7	Low	186 Å²	186	108 Å²	108	87%	0.869	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-58.9	128.3	176.6	-70.4	-175.8	173.5	0	0	110.6	P371	E369-P371 WeakPolarHBondContact O-CD 3.22Å
370	I	78.2	Confident	71.7	Confident	23 Å²	23	100.8 Å²	100.8	12%	0.118	53%	0.532	C	S	.	.	P	Polyproline II helix	trans	-75.3	122.8	178.6	-59.9	175.5	0	0	0	108.2	Y252 V285 E368 W372	Y252-I370 HydrophobicContact CD2-CD1 3.92Å; Y252-I370 HydrophobicContact CD2-CG1 4.42Å; Y252-I370 HydrophobicContact CD2-CG2 4.39Å; Y252-I370 HydrophobicContact CE2-CD1 4.46Å; Y252-I370 HydrophobicContact CG-CD1 4.03Å; V285-I370 HydrophobicContact CG1-CD1 3.83Å; E368-I370 PolarHBondContact O-N 2.88Å; I370-W372 HydrophobicContact CB-CH2 4.36Å; I370-W372 HydrophobicContact CB-CZ2 3.9Å; I370-W372 HydrophobicContact CD1-CH2 3.92Å; I370-W372 HydrophobicContact CD1-CZ2 3.89Å; I370-W372 HydrophobicContact CG1-CZ2 4.45Å; I370-W372 HydrophobicContact CG2-CD2 4.06Å; I370-W372 HydrophobicContact CG2-CE3 4.1Å; I370-W372 HydrophobicContact CG2-CH2 4.01Å; I370-W372 HydrophobicContact CG2-CZ2 3.97Å; I370-W372 HydrophobicContact CG2-CZ3 4.08Å; I370-W372 PolarHBondContact O-N 3.12Å; I370-W372 PolarHBondContact O-NE1 2.97Å
371	P	81.8	Confident	73.7	Confident	103 Å²	103	97.8 Å²	97.8	67%	0.669	51%	0.51	S	S	*	.			trans	-71.9	110.9	168.2	29.3	-31.7	0	0	0	109.1	S249 E369	S249-P371 WeakPolarHBondContact CB-O 3.41Å; S249-P371 PolarHBondContact OG-O 3.17Å; E369-P371 WeakPolarHBondContact O-CD 3.22Å
372	W	87.7	Confident	75.6	Confident	82 Å²	82	91 Å²	91	31%	0.311	48%	0.483	S	S	.	.			trans	-83.8	125.6	175.9	-58.8	106.9	0	0	0	110.2	A247 D254 V285 I370 A375	A247-W372 HydrophobicContact CB-CB 4.41Å; A247-W372 HydrophobicContact CB-CD2 3.65Å; A247-W372 HydrophobicContact CB-CE3 3.49Å; A247-W372 VanDerWaalsContact CB-CE3 3.49Å; A247-W372 HydrophobicContact CB-CG 4.05Å; A247-W372 HydrophobicContact CB-CZ3 4.03Å; D254-W372 HydrophobicContact CB-CH2 3.65Å; D254-W372 HydrophobicContact CB-CZ2 4.15Å; D254-W372 HydrophobicContact CB-CZ3 3.99Å; V285-W372 HydrophobicContact CG1-CH2 4.13Å; I370-W372 HydrophobicContact CB-CH2 4.36Å; I370-W372 HydrophobicContact CB-CZ2 3.9Å; I370-W372 HydrophobicContact CD1-CH2 3.92Å; I370-W372 HydrophobicContact CD1-CZ2 3.89Å; I370-W372 HydrophobicContact CG1-CZ2 4.45Å; I370-W372 HydrophobicContact CG2-CD2 4.06Å; I370-W372 HydrophobicContact CG2-CE3 4.1Å; I370-W372 HydrophobicContact CG2-CH2 4.01Å; I370-W372 HydrophobicContact CG2-CZ2 3.97Å; I370-W372 HydrophobicContact CG2-CZ3 4.08Å; I370-W372 PolarHBondContact O-N 3.12Å; I370-W372 PolarHBondContact O-NE1 2.97Å; W372-A375 HydrophobicContact CB-CB 4.44Å
373	T	86	Confident	77.2	Confident	103 Å²	103	89.4 Å²	89.4	63%	0.632	46%	0.464	S	S	*	.	S	Bend	trans	-75.5	-36.5	177.1	-51.7	0	0	0	0	110.6	S248	S248-T373 PolarHBondContact O-N 2.55Å
374	S	86.3	Confident	78.8	Confident	47 Å²	47	88.7 Å²	88.7	33%	0.329	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	140.2	176.3	57.5	0	0	0	0	110	P184 A247 S248	P184-S374 WeakPolarHBondContact CG-OG 3.48Å; A247-S374 CarbonylContact C-O 3.6Å; A247-S374 VanDerWaalsContact CA-O 3.25Å; A247-S374 WeakPolarHBondContact CA-O 3.15Å; A247-S374 WeakPolarHBondContact CB-O 3.47Å; S248-S374 PolarHBondContact N-O 2.95Å; S248-S374 PolarHBondContact O-N 2.89Å
375	A	91.6	Very high	80.7	Confident	61 Å²	61	80.2 Å²	80.2	50%	0.504	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	143.5	-178.6	0	0	0	0	0	111	R246 A247 W372	R246-A375 CarbonylContact O-C 3.57Å; R246-A375 WeakPolarHBondContact O-CA 3.17Å; A247-A375 HydrophobicContact CB-CB 3.74Å; W372-A375 HydrophobicContact CB-CB 4.44Å
376	I	91.7	Very high	82.1	Confident	27 Å²	27	78.6 Å²	78.6	14%	0.138	41%	0.413	C	S	.	.			trans	-108.1	165.6	167.3	56.7	166.3	0	0	0	110.2	P184 R246 E380 A381	P184-I376 HydrophobicContact CB-CG1 4.38Å; P184-I376 HydrophobicContact CB-CG2 4.06Å; R246-I376 HydrophobicContact CG-CG1 4.27Å; R246-I376 VanDerWaalsContact O-CG1 3.26Å; R246-I376 WeakPolarHBondContact O-CG1 3.04Å; R246-I376 PolarHBondContact O-N 2.72Å; I376-E380 HydrophobicContact CB-CB 4.46Å; I376-E380 HydrophobicContact CB-CG 4.4Å; I376-E380 HydrophobicContact CD1-CG 4.41Å; I376-A381 HydrophobicContact CD1-CB 3.7Å; I376-A381 HydrophobicContact CG1-CB 4.29Å
377	S	90.9	Very high	83.5	Confident	50 Å²	50	73.6 Å²	73.6	35%	0.35	38%	0.383	S	S	.	.			trans	-70.3	159.5	176.7	101.2	0	0	0	0	111.3	E379 E380 A381	S377-E379 VanDerWaalsContact C-N 3.27Å; S377-E379 VanDerWaalsContact CB-OE2 3.31Å; S377-E379 WeakPolarHBondContact CB-OE2 3.34Å; S377-E379 PolarHBondContact O-N 2.84Å; S377-E379 PolarHBondContact OG-N 2.88Å; S377-E379 PolarHBondContact OG-OE2 2.82Å; S377-E380 PolarHBondContact O-N 2.91Å; S377-E380 PolarHBondContact OG-N 2.84Å; S377-E380 VanDerWaalsContact OG-N 3.1Å; S377-A381 PolarHBondContact O-N 2.92Å
378	Q	86.1	Confident	84.7	Confident	66 Å²	66	69.5 Å²	69.5	31%	0.308	37%	0.368	S	S	.	.	H	α-helix	trans	-64.9	-36.6	177.5	-174	65.2	25.8	0	0	111.1	S382	Q378-S382 WeakPolarHBondContact O-CB 3.45Å; Q378-S382 PolarHBondContact O-N 3.27Å; Q378-S382 PolarHBondContact O-OG 3.13Å
379	E	87.1	Confident	85.5	Confident	137 Å²	137	62.4 Å²	62.4	64%	0.64	34%	0.335	S	S	*	.	H	α-helix	trans	-66.7	-42.6	177.9	-56.8	74.1	-158.9	0	0	110.9	S377 S382 H383	S377-E379 VanDerWaalsContact C-N 3.27Å; S377-E379 VanDerWaalsContact CB-OE2 3.31Å; S377-E379 WeakPolarHBondContact CB-OE2 3.34Å; S377-E379 PolarHBondContact O-N 2.84Å; S377-E379 PolarHBondContact OG-N 2.88Å; S377-E379 PolarHBondContact OG-OE2 2.82Å; E379-S382 PolarHBondContact O-N 2.82Å; E379-H383 WeakPolarHBondContact O-CB 3.48Å; E379-H383 PolarHBondContact O-N 2.88Å
380	E	88.4	Confident	85.8	Confident	93 Å²	93	53.6 Å²	53.6	44%	0.435	29%	0.294	S	S	.	.	H	α-helix	trans	-64.5	-46.1	176.9	-172.8	170	-159.2	0	0	111.1	I376 S377 S382 H383 H384	I376-E380 HydrophobicContact CB-CB 4.46Å; I376-E380 HydrophobicContact CB-CG 4.4Å; I376-E380 HydrophobicContact CD1-CG 4.41Å; S377-E380 PolarHBondContact O-N 2.91Å; S377-E380 PolarHBondContact OG-N 2.84Å; S377-E380 VanDerWaalsContact OG-N 3.1Å; E380-S382 VanDerWaalsContact C-N 3.3Å; E380-S382 PolarHBondContact O-N 3.37Å; E380-H383 WeakPolarHBondContact O-CB 3.34Å; E380-H383 PolarHBondContact O-N 3.06Å; E380-H383 VanDerWaalsContact O-N 3.15Å; E380-H384 PolarHBondContact O-CD2 2.94Å; E380-H384 PolarHBondContact O-N 2.71Å
381	A	88.5	Confident	85.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.8	-41.9	175	0	0	0	0	0	111.8	R246 V256 I376 S377 H383 H384 L385	R246-A381 HydrophobicContact CB-CB 4.31Å; R246-A381 HydrophobicContact CG-CB 4.17Å; V256-A381 HydrophobicContact CG2-CB 4.46Å; I376-A381 HydrophobicContact CD1-CB 3.7Å; I376-A381 HydrophobicContact CG1-CB 4.29Å; S377-A381 PolarHBondContact O-N 2.92Å; A381-H383 VanDerWaalsContact C-N 3.35Å; A381-H384 PolarHBondContact O-N 3.24Å; A381-L385 WeakPolarHBondContact O-CG 3.25Å; A381-L385 PolarHBondContact O-N 3.15Å; A381-L385 VanDerWaalsContact O-N 3.09Å
382	S	86.6	Confident	85.1	Confident	35 Å²	35	49 Å²	49	25%	0.245	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-40	176.6	-57.1	0	0	0	0	111.4	Q378 E379 E380 L385 E386	Q378-S382 WeakPolarHBondContact O-CB 3.45Å; Q378-S382 PolarHBondContact O-N 3.27Å; Q378-S382 PolarHBondContact O-OG 3.13Å; E379-S382 PolarHBondContact O-N 2.82Å; E380-S382 VanDerWaalsContact C-N 3.3Å; E380-S382 PolarHBondContact O-N 3.37Å; S382-L385 PolarHBondContact O-N 3.36Å; S382-E386 WeakPolarHBondContact O-CB 3.38Å; S382-E386 WeakPolarHBondContact O-CG 3.36Å; S382-E386 PolarHBondContact O-N 3.37Å
383	H	86.5	Confident	84.5	Confident	93 Å²	93	46.2 Å²	46.2	43%	0.431	26%	0.255	S	S	.	.	H	α-helix	trans	-63.2	-42.6	175.2	-176.8	66	0	0	0	112.1	E379 E380 A381 L385 E386 V387	E379-H383 WeakPolarHBondContact O-CB 3.48Å; E379-H383 PolarHBondContact O-N 2.88Å; E380-H383 WeakPolarHBondContact O-CB 3.34Å; E380-H383 PolarHBondContact O-N 3.06Å; E380-H383 VanDerWaalsContact O-N 3.15Å; A381-H383 VanDerWaalsContact C-N 3.35Å; H383-L385 VanDerWaalsContact C-N 3.34Å; H383-L385 PolarHBondContact O-N 3.13Å; H383-E386 PolarHBondContact O-N 3.47Å; H383-V387 WeakPolarHBondContact O-CB 3.17Å; H383-V387 WeakPolarHBondContact O-CG2 3.4Å; H383-V387 PolarHBondContact O-N 3.2Å
384	H	87.9	Confident	84	Confident	66 Å²	66	48 Å²	48	31%	0.306	25%	0.254	S	S	.	.	H	α-helix	trans	-60.9	-41.2	174.7	-76.5	-71.4	0	0	0	112.6	E380 A381 T388	E380-H384 PolarHBondContact O-CD2 2.94Å; E380-H384 PolarHBondContact O-N 2.71Å; A381-H384 PolarHBondContact O-N 3.24Å; H384-T388 WeakPolarHBondContact O-CB 3.28Å; H384-T388 PolarHBondContact O-N 3.48Å; H384-T388 VanDerWaalsContact O-N 3.14Å; H384-T388 PolarHBondContact O-OG1 3.16Å
385	L	87.8	Confident	83.4	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.026	24%	0.242	C	C	.	.	H	α-helix	trans	-63.6	-45.8	174.3	-67.7	173.4	0	0	0	111.4	V242 C244 V256 R258 A381 S382 H383 T388 F389	V242-L385 HydrophobicContact CB-CD2 4.07Å; V242-L385 HydrophobicContact CG1-CD2 3.58Å; C244-L385 HydrophobicContact CB-CD2 3.59Å; C244-L385 HydrophobicContact CB-CG 3.89Å; V256-L385 HydrophobicContact CB-CD1 4.23Å; V256-L385 HydrophobicContact CG1-CD1 3.67Å; R258-L385 HydrophobicContact CB-CD1 4.31Å; A381-L385 WeakPolarHBondContact O-CG 3.25Å; A381-L385 PolarHBondContact O-N 3.15Å; A381-L385 VanDerWaalsContact O-N 3.09Å; S382-L385 PolarHBondContact O-N 3.36Å; H383-L385 VanDerWaalsContact C-N 3.34Å; H383-L385 PolarHBondContact O-N 3.13Å; L385-T388 PolarHBondContact O-N 3.35Å; L385-F389 WeakPolarHBondContact O-CD2 3.5Å; L385-F389 PolarHBondContact O-N 2.99Å; L385-F389 VanDerWaalsContact O-N 3.12Å
386	E	84.8	Confident	82.7	Confident	47 Å²	47	47.5 Å²	47.5	22%	0.22	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-46.7	178.2	-79.6	-177.6	-157.4	0	0	112.3	S382 H383 T388 F389 Y390 K393	S382-E386 WeakPolarHBondContact O-CB 3.38Å; S382-E386 WeakPolarHBondContact O-CG 3.36Å; S382-E386 PolarHBondContact O-N 3.37Å; H383-E386 PolarHBondContact O-N 3.47Å; E386-T388 PolarHBondContact O-N 3.26Å; E386-F389 PolarHBondContact O-N 3.35Å; E386-Y390 WeakPolarHBondContact O-CA 3.26Å; E386-Y390 VanDerWaalsContact O-CB 3.29Å; E386-Y390 WeakPolarHBondContact O-CB 3.41Å; E386-Y390 PolarHBondContact O-N 2.84Å; E386-K393 HydrophobicContact CB-CD 4.08Å; E386-K393 IonicContact OE2-NZ 3.05Å; E386-K393 PolarHBondContact OE2-NZ 3.39Å
387	V	84.1	Confident	82	Confident	30 Å²	30	48 Å²	48	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-65.1	-30.1	178.8	169.7	0	0	0	0	111.8	H383 Y390 K393 K394	H383-V387 WeakPolarHBondContact O-CB 3.17Å; H383-V387 WeakPolarHBondContact O-CG2 3.4Å; H383-V387 PolarHBondContact O-N 3.2Å; V387-Y390 CarbonylContact O-C 3.57Å; V387-Y390 VanDerWaalsContact O-C 3.32Å; V387-K393 HydrophobicContact CG2-CB 4.34Å; V387-K394 HydrophobicContact CG1-CG 3.66Å
388	T	83.7	Confident	81.5	Confident	42 Å²	42	48 Å²	48	26%	0.258	24%	0.24	S	C	.	.	H	α-helix	trans	-70.5	-40.3	176.3	-56	0	0	0	0	111.5	A187 W189 V242 H384 L385 E386	A187-T388 WeakPolarHBondContact CB-OG1 3.46Å; W189-T388 HydrophobicContact CZ2-CG2 4.01Å; V242-T388 HydrophobicContact CB-CG2 4.49Å; V242-T388 HydrophobicContact CG1-CG2 3.7Å; V242-T388 HydrophobicContact CG2-CG2 3.89Å; H384-T388 WeakPolarHBondContact O-CB 3.28Å; H384-T388 PolarHBondContact O-N 3.48Å; H384-T388 VanDerWaalsContact O-N 3.14Å; H384-T388 PolarHBondContact O-OG1 3.16Å; L385-T388 PolarHBondContact O-N 3.35Å; E386-T388 PolarHBondContact O-N 3.26Å
389	F	77.3	Confident	81.4	Confident	14 Å²	14	48.2 Å²	48.2	6%	0.061	25%	0.248	C	C	.	.	H	α-helix	trans	-76	-32.6	174	-84.9	-68.2	0	0	0	113.2	W189 P238 V242 R258 H260 L385 E386	W189-F389 AromaticContact CH2-CD1 3.57Å; W189-F389 HydrophobicContact CH2-CD1 3.57Å; W189-F389 AromaticContact CH2-CE1 3.6Å; W189-F389 HydrophobicContact CH2-CE1 3.6Å; W189-F389 HydrophobicContact CH2-CG 4.37Å; W189-F389 HydrophobicContact CH2-CZ 4.41Å; W189-F389 AromaticContact CZ3-CD1 3.96Å; W189-F389 HydrophobicContact CZ3-CD1 3.96Å; W189-F389 AromaticContact CZ3-CE1 3.46Å; W189-F389 HydrophobicContact CZ3-CE1 3.46Å; W189-F389 VanDerWaalsContact CZ3-CE1 3.46Å; W189-F389 HydrophobicContact CZ3-CZ 4.04Å; P238-F389 HydrophobicContact CB-CD1 3.51Å; P238-F389 HydrophobicContact CB-CE1 4.03Å; P238-F389 HydrophobicContact CB-CG 4.38Å; P238-F389 HydrophobicContact CG-CD1 4.46Å; V242-F389 HydrophobicContact CB-CD2 4.12Å; V242-F389 HydrophobicContact CB-CE2 3.51Å; V242-F389 HydrophobicContact CB-CZ 3.94Å; V242-F389 HydrophobicContact CG2-CD1 4.33Å; V242-F389 HydrophobicContact CG2-CD2 3.85Å; V242-F389 HydrophobicContact CG2-CE1 3.95Å; V242-F389 HydrophobicContact CG2-CE2 3.4Å; V242-F389 HydrophobicContact CG2-CG 4.3Å; V242-F389 HydrophobicContact CG2-CZ 3.46Å; V242-F389 VanDerWaalsContact CG2-CZ 3.46Å; R258-F389 HydrophobicContact CB-CE2 3.99Å; R258-F389 HydrophobicContact CG-CD2 4.38Å; R258-F389 HydrophobicContact CG-CE2 3.83Å; H260-F389 AromaticContact CD2-CD1 3.97Å; H260-F389 AromaticContact CD2-CE1 3.55Å; H260-F389 AromaticContact CD2-CZ 3.6Å; L385-F389 WeakPolarHBondContact O-CD2 3.5Å; L385-F389 PolarHBondContact O-N 2.99Å; L385-F389 VanDerWaalsContact O-N 3.12Å; E386-F389 PolarHBondContact O-N 3.35Å
390	Y	78.1	Confident	81.1	Confident	1 Å²	1	42 Å²	42	0%	0.004	22%	0.219	C	C	.	.			trans	-130.7	85.8	-172.2	-59.7	-50.8	0	0	0	110.5	P238 E386 V387 F392 K393 D425 R438	P238-Y390 HydrophobicContact CB-CE1 4.4Å; P238-Y390 HydrophobicContact CG-CE1 4.08Å; P238-Y390 WeakPolarHBondContact CG-OH 3.39Å; E386-Y390 WeakPolarHBondContact O-CA 3.26Å; E386-Y390 VanDerWaalsContact O-CB 3.29Å; E386-Y390 WeakPolarHBondContact O-CB 3.41Å; E386-Y390 PolarHBondContact O-N 2.84Å; V387-Y390 CarbonylContact O-C 3.57Å; V387-Y390 VanDerWaalsContact O-C 3.32Å; Y390-F392 VanDerWaalsContact CB-CE1 3.45Å; Y390-F392 AromaticContact CD1-CE1 3.72Å; Y390-F392 HydrophobicContact CD1-CE1 3.72Å; Y390-F392 HydrophobicContact CG-CD1 4.47Å; Y390-F392 AromaticContact CG-CE1 3.72Å; Y390-F392 HydrophobicContact CG-CE1 3.72Å; Y390-F392 HydrophobicContact CG-CZ 4.32Å; Y390-F392 PolarHBondContact O-N 3.34Å; Y390-K393 HydrophobicContact CD2-CD 4.11Å; Y390-K393 WeakPolarHBondContact O-CB 3.36Å; Y390-K393 PolarHBondContact O-N 2.98Å; Y390-D425 WeakPolarHBondContact CE2-OD1 3.43Å; Y390-D425 WeakPolarHBondContact CE2-OD2 3.35Å; Y390-D425 VanDerWaalsContact CZ-OD1 3.28Å; Y390-D425 PolarHBondContact OH-OD1 3.32Å; Y390-R438 HydrophobicContact CD1-CG 4.44Å
391	P	74.4	Confident	80.8	Confident	27 Å²	27	38.8 Å²	38.8	18%	0.175	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-56.3	-26.5	179.2	-28.1	36.6	0	0	0	113.7	K393 K394 E443	P391-K393 VanDerWaalsContact C-N 3.27Å; P391-K393 PolarHBondContact O-N 3.49Å; P391-K394 WeakPolarHBondContact O-CB 3.49Å; P391-K394 WeakPolarHBondContact O-CD 3.36Å; P391-K394 WeakPolarHBondContact O-CG 3.31Å; P391-K394 PolarHBondContact O-N 2.9Å; P391-E443 HydrophobicContact CB-CG 4.01Å; P391-E443 HydrophobicContact CG-CG 4.03Å
392	F	71.2	Confident	80.6	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.009	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-64.8	-28.4	177.2	75.6	-90.2	0	0	0	113.5	Y390 K394 V395 Y397 R438 L442 L448	Y390-F392 VanDerWaalsContact CB-CE1 3.45Å; Y390-F392 AromaticContact CD1-CE1 3.72Å; Y390-F392 HydrophobicContact CD1-CE1 3.72Å; Y390-F392 HydrophobicContact CG-CD1 4.47Å; Y390-F392 AromaticContact CG-CE1 3.72Å; Y390-F392 HydrophobicContact CG-CE1 3.72Å; Y390-F392 HydrophobicContact CG-CZ 4.32Å; Y390-F392 PolarHBondContact O-N 3.34Å; F392-K394 PolarHBondContact O-N 2.83Å; F392-V395 PolarHBondContact O-N 2.76Å; F392-V395 VanDerWaalsContact O-N 3.16Å; F392-Y397 HydrophobicContact CD2-CD2 4.46Å; F392-Y397 AromaticContact CD2-CE2 3.66Å; F392-Y397 HydrophobicContact CD2-CE2 3.66Å; F392-Y397 AromaticContact CD2-CZ 3.89Å; F392-Y397 HydrophobicContact CE2-CE2 4.26Å; F392-Y397 WeakPolarHBondContact O-CE2 3.29Å; F392-R438 HydrophobicContact CD1-CG 3.68Å; F392-R438 HydrophobicContact CE1-CG 3.35Å; F392-R438 HydrophobicContact CZ-CG 4.26Å; F392-L442 HydrophobicContact CB-CB 3.69Å; F392-L442 WeakPolarHBondContact CB-O 3.4Å; F392-L442 HydrophobicContact CG-CB 4.21Å; F392-L448 HydrophobicContact CB-CD2 4.37Å
393	K	75.9	Confident	80.4	Confident	24 Å²	24	42 Å²	42	10%	0.104	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-68.5	-0.7	176	-72.3	-172.3	169.7	-172.8	0	113.9	E386 V387 Y390 P391 V395 D424	E386-K393 HydrophobicContact CB-CD 4.08Å; E386-K393 IonicContact OE2-NZ 3.05Å; E386-K393 PolarHBondContact OE2-NZ 3.39Å; V387-K393 HydrophobicContact CG2-CB 4.34Å; Y390-K393 HydrophobicContact CD2-CD 4.11Å; Y390-K393 WeakPolarHBondContact O-CB 3.36Å; Y390-K393 PolarHBondContact O-N 2.98Å; P391-K393 VanDerWaalsContact C-N 3.27Å; P391-K393 PolarHBondContact O-N 3.49Å; K393-V395 PolarHBondContact O-N 3.43Å; K393-D424 IonicContact NZ-OD2 2.7Å
394	K	74.5	Confident	80.2	Confident	141 Å²	141	37.6 Å²	37.6	61%	0.613	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-60	-25.6	165.5	-70.7	174.3	-175.1	173.2	0	112.3	V387 P391 F392	V387-K394 HydrophobicContact CG1-CG 3.66Å; P391-K394 WeakPolarHBondContact O-CB 3.49Å; P391-K394 WeakPolarHBondContact O-CD 3.36Å; P391-K394 WeakPolarHBondContact O-CG 3.31Å; P391-K394 PolarHBondContact O-N 2.9Å; F392-K394 PolarHBondContact O-N 2.83Å
395	V	74.7	Confident	80	Confident	11 Å²	11	40.7 Å²	40.7	7%	0.067	21%	0.213	C	C	.	.	S	Bend	trans	-92.6	134.4	172.1	176.9	0	0	0	0	108.6	F392 K393 Y397 L448 N452	F392-V395 PolarHBondContact O-N 2.76Å; F392-V395 VanDerWaalsContact O-N 3.16Å; K393-V395 PolarHBondContact O-N 3.43Å; V395-Y397 HydrophobicContact CB-CE2 4.29Å; V395-Y397 WeakPolarHBondContact O-CD2 3.45Å; V395-Y397 WeakPolarHBondContact O-CE2 3.25Å; V395-Y397 PolarHBondContact O-N 3.21Å; V395-L448 HydrophobicContact CB-CD2 4.41Å; V395-L448 HydrophobicContact CG2-CB 4.21Å; V395-L448 HydrophobicContact CG2-CD2 3.61Å; V395-N452 HydrophobicContact CG2-CB 4.5Å
396	P	76.1	Confident	79.8	Confident	86 Å²	86	46.5 Å²	46.5	56%	0.558	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-68	120.1	176.9	27.3	-33.4	0	0	0	109.9
397	Y	78.3	Confident	79.7	Confident	37 Å²	37	44.3 Å²	44.3	15%	0.145	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	118.7	168.1	-70.8	-97.8	0	0	0	108.2	F392 V395 S457 W459	F392-Y397 HydrophobicContact CD2-CD2 4.46Å; F392-Y397 AromaticContact CD2-CE2 3.66Å; F392-Y397 HydrophobicContact CD2-CE2 3.66Å; F392-Y397 AromaticContact CD2-CZ 3.89Å; F392-Y397 HydrophobicContact CE2-CE2 4.26Å; F392-Y397 WeakPolarHBondContact O-CE2 3.29Å; V395-Y397 HydrophobicContact CB-CE2 4.29Å; V395-Y397 WeakPolarHBondContact O-CD2 3.45Å; V395-Y397 WeakPolarHBondContact O-CE2 3.25Å; V395-Y397 PolarHBondContact O-N 3.21Å; Y397-S457 WeakPolarHBondContact CA-O 3.49Å; Y397-W459 AromaticContact CD1-CD1 3.63Å; Y397-W459 AromaticContact CG-CD1 3.79Å
398	L	80.6	Confident	79.6	Confident	50 Å²	50	49 Å²	49	26%	0.262	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	153.5	-178.6	-62.9	177.2	0	0	0	110.8	E402 A403 R406 I456 S457 S458	L398-E402 HydrophobicContact CB-CB 4.31Å; L398-A403 HydrophobicContact CB-CB 4.08Å; L398-R406 HydrophobicContact CD1-CB 3.96Å; L398-R406 HydrophobicContact CD1-CG 4.11Å; L398-I456 HydrophobicContact CD1-CG2 4.06Å; L398-S457 PolarHBondContact N-O 3.05Å; L398-S458 PolarHBondContact O-OG 3.07Å
399	P	83.9	Confident	79.6	Confident	72 Å²	72	50.8 Å²	50.8	47%	0.468	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-54.3	150.1	166.9	-23.2	33.3	0	0	0	111.2	A401 E402 A403	P399-A401 VanDerWaalsContact C-N 3.34Å; P399-A401 PolarHBondContact O-N 3.16Å; P399-E402 HydrophobicContact CB-CG 4.46Å; P399-E402 HydrophobicContact CG-CG 4.45Å; P399-E402 PolarHBondContact O-N 3.12Å; P399-E402 VanDerWaalsContact O-N 3.08Å; P399-A403 WeakPolarHBondContact O-CB 3.33Å; P399-A403 PolarHBondContact O-N 3.46Å
400	F	80.7	Confident	79.9	Confident	5 Å²	5	53.2 Å²	53.2	2%	0.022	27%	0.271	C	S	.	.	H	α-helix	trans	-47.1	-52.2	-174.4	-170.9	-103.1	0	0	0	113.3	A403 F404 S460 L465 M468 K480 A481 H484	F400-A403 PolarHBondContact O-N 3.14Å; F400-F404 HydrophobicContact CD1-CD2 4.32Å; F400-F404 HydrophobicContact CD1-CE2 4.26Å; F400-F404 HydrophobicContact CD2-CD2 4.48Å; F400-F404 AromaticContact CD2-CE2 3.81Å; F400-F404 HydrophobicContact CD2-CE2 3.81Å; F400-F404 HydrophobicContact CE1-CD2 4.16Å; F400-F404 AromaticContact CE1-CE2 3.88Å; F400-F404 HydrophobicContact CE1-CE2 3.88Å; F400-F404 HydrophobicContact CE2-CD2 4.36Å; F400-F404 AromaticContact CE2-CE2 3.42Å; F400-F404 HydrophobicContact CE2-CE2 3.42Å; F400-F404 VanDerWaalsContact CE2-CE2 3.42Å; F400-F404 HydrophobicContact CE2-CZ 4.17Å; F400-F404 HydrophobicContact CG-CD2 4.48Å; F400-F404 HydrophobicContact CG-CE2 4.23Å; F400-F404 HydrophobicContact CZ-CD2 4.19Å; F400-F404 AromaticContact CZ-CE2 3.45Å; F400-F404 HydrophobicContact CZ-CE2 3.45Å; F400-F404 VanDerWaalsContact CZ-CE2 3.45Å; F400-F404 HydrophobicContact CZ-CZ 4.18Å; F400-F404 WeakPolarHBondContact O-CD2 3.36Å; F400-F404 PolarHBondContact O-N 3.09Å; F400-S460 WeakPolarHBondContact CB-OG 3.35Å; F400-S460 WeakPolarHBondContact CD2-OG 3.42Å; F400-L465 HydrophobicContact CD1-CD2 3.81Å; F400-L465 HydrophobicContact CD2-CD2 3.8Å; F400-L465 HydrophobicContact CE1-CD2 3.82Å; F400-L465 HydrophobicContact CE2-CD2 3.76Å; F400-L465 HydrophobicContact CG-CD2 3.8Å; F400-L465 HydrophobicContact CZ-CD2 3.78Å; F400-M468 HydrophobicContact CB-SD 4.46Å; F400-M468 HydrophobicContact CD1-SD 4.11Å; F400-K480 HydrophobicContact CE1-CB 4.19Å; F400-K480 HydrophobicContact CZ-CB 4.34Å; F400-A481 HydrophobicContact CE1-CB 4.48Å; F400-H484 AromaticContact CE2-CD2 3.89Å; F400-H484 AromaticContact CZ-ND1 3.97Å
401	A	81.8	Confident	80	Confident	26 Å²	26	62.3 Å²	62.3	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-48.8	-179.1	0	0	0	0	0	112.5	P399 A403 F404 E405 L477	P399-A401 VanDerWaalsContact C-N 3.34Å; P399-A401 PolarHBondContact O-N 3.16Å; A401-A403 VanDerWaalsContact C-N 3.3Å; A401-A403 PolarHBondContact O-N 3.24Å; A401-F404 PolarHBondContact O-N 3.36Å; A401-E405 PolarHBondContact O-N 3.44Å; A401-L477 HydrophobicContact CB-CD1 3.9Å; A401-L477 HydrophobicContact CB-CD2 4Å
402	E	83.4	Confident	80.4	Confident	103 Å²	103	63.8 Å²	63.8	48%	0.481	31%	0.314	S	S	.	.	H	α-helix	trans	-64.3	-34.7	-179.7	-65.3	-178.8	-161.2	0	0	112.1	L398 P399 F404 E405 R406	L398-E402 HydrophobicContact CB-CB 4.31Å; P399-E402 HydrophobicContact CB-CG 4.46Å; P399-E402 HydrophobicContact CG-CG 4.45Å; P399-E402 PolarHBondContact O-N 3.12Å; P399-E402 VanDerWaalsContact O-N 3.08Å; E402-F404 PolarHBondContact O-N 3.16Å; E402-E405 PolarHBondContact O-N 2.69Å; E402-R406 VanDerWaalsContact O-CB 3.23Å; E402-R406 WeakPolarHBondContact O-CB 3.41Å; E402-R406 PolarHBondContact O-N 3.02Å
403	A	83.4	Confident	81	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-42.6	177.9	0	0	0	0	0	111.8	L398 P399 F400 A401 A407 I456	L398-A403 HydrophobicContact CB-CB 4.08Å; P399-A403 WeakPolarHBondContact O-CB 3.33Å; P399-A403 PolarHBondContact O-N 3.46Å; F400-A403 PolarHBondContact O-N 3.14Å; A401-A403 VanDerWaalsContact C-N 3.3Å; A401-A403 PolarHBondContact O-N 3.24Å; A403-A407 WeakPolarHBondContact O-CB 3.4Å; A403-A407 PolarHBondContact O-N 2.86Å; A403-I456 HydrophobicContact CB-CG2 4.1Å
404	F	82.3	Confident	81.4	Confident	1 Å²	1	63.1 Å²	63.1	0%	0.004	31%	0.311	C	S	.	.	H	α-helix	trans	-71.4	-40.4	177.5	-77.4	-77.7	0	0	0	112.6	F400 A401 E402 R406 A407 E408 V414 K480 H484 A497	F400-F404 HydrophobicContact CD1-CD2 4.32Å; F400-F404 HydrophobicContact CD1-CE2 4.26Å; F400-F404 HydrophobicContact CD2-CD2 4.48Å; F400-F404 AromaticContact CD2-CE2 3.81Å; F400-F404 HydrophobicContact CD2-CE2 3.81Å; F400-F404 HydrophobicContact CE1-CD2 4.16Å; F400-F404 AromaticContact CE1-CE2 3.88Å; F400-F404 HydrophobicContact CE1-CE2 3.88Å; F400-F404 HydrophobicContact CE2-CD2 4.36Å; F400-F404 AromaticContact CE2-CE2 3.42Å; F400-F404 HydrophobicContact CE2-CE2 3.42Å; F400-F404 VanDerWaalsContact CE2-CE2 3.42Å; F400-F404 HydrophobicContact CE2-CZ 4.17Å; F400-F404 HydrophobicContact CG-CD2 4.48Å; F400-F404 HydrophobicContact CG-CE2 4.23Å; F400-F404 HydrophobicContact CZ-CD2 4.19Å; F400-F404 AromaticContact CZ-CE2 3.45Å; F400-F404 HydrophobicContact CZ-CE2 3.45Å; F400-F404 VanDerWaalsContact CZ-CE2 3.45Å; F400-F404 HydrophobicContact CZ-CZ 4.18Å; F400-F404 WeakPolarHBondContact O-CD2 3.36Å; F400-F404 PolarHBondContact O-N 3.09Å; A401-F404 PolarHBondContact O-N 3.36Å; E402-F404 PolarHBondContact O-N 3.16Å; F404-R406 VanDerWaalsContact C-N 3.32Å; F404-R406 PolarHBondContact O-N 2.8Å; F404-A407 PolarHBondContact O-N 2.98Å; F404-E408 WeakPolarHBondContact O-CB 3.48Å; F404-E408 PolarHBondContact O-N 3.49Å; F404-V414 HydrophobicContact CD1-CG2 3.76Å; F404-V414 HydrophobicContact CE1-CB 4.02Å; F404-V414 HydrophobicContact CE1-CG1 4.23Å; F404-V414 HydrophobicContact CE1-CG2 3.74Å; F404-V414 HydrophobicContact CE2-CG1 4.32Å; F404-V414 HydrophobicContact CG-CG2 4.35Å; F404-V414 HydrophobicContact CZ-CB 4.23Å; F404-V414 HydrophobicContact CZ-CG1 3.95Å; F404-V414 HydrophobicContact CZ-CG2 4.29Å; F404-K480 HydrophobicContact CB-CD 4.41Å; F404-K480 HydrophobicContact CD1-CD 4.15Å; F404-K480 HydrophobicContact CD2-CD 4.36Å; F404-K480 HydrophobicContact CG-CD 4.03Å; F404-H484 AromaticContact CZ-CE1 3.51Å; F404-H484 AromaticContact CZ-NE2 3.57Å; F404-A497 HydrophobicContact CE1-CB 4.25Å; F404-A497 HydrophobicContact CZ-CB 4.41Å
405	E	83.6	Confident	81.9	Confident	130 Å²	130	56.4 Å²	56.4	61%	0.607	28%	0.282	S	S	*	.	H	α-helix	trans	-61.4	-44	175	-70.4	-178.4	-178.2	0	0	111.1	A401 E402 E408 S409	A401-E405 PolarHBondContact O-N 3.44Å; E402-E405 PolarHBondContact O-N 2.69Å; E405-E408 PolarHBondContact O-N 3.06Å; E405-S409 PolarHBondContact O-N 2.8Å
406	R	83.6	Confident	82.3	Confident	128 Å²	128	55.9 Å²	55.9	48%	0.483	28%	0.279	S	S	.	.	H	α-helix	trans	-66.6	-43	178.2	-166.1	69.3	-177.7	-179.8	3.3	111.5	L398 E402 F404 E408 S409 E410 I456	L398-R406 HydrophobicContact CD1-CB 3.96Å; L398-R406 HydrophobicContact CD1-CG 4.11Å; E402-R406 VanDerWaalsContact O-CB 3.23Å; E402-R406 WeakPolarHBondContact O-CB 3.41Å; E402-R406 PolarHBondContact O-N 3.02Å; F404-R406 VanDerWaalsContact C-N 3.32Å; F404-R406 PolarHBondContact O-N 2.8Å; R406-E408 VanDerWaalsContact C-N 3.3Å; R406-E408 PolarHBondContact O-N 3.17Å; R406-S409 PolarHBondContact O-N 2.66Å; R406-S409 PolarHBondContact O-OG 3.41Å; R406-E410 HydrophobicContact CG-CG 4.46Å; R406-E410 IonicContact CZ-OE1 2.63Å; R406-E410 IonicContact NE-OE1 2.57Å; R406-E410 PolarHBondContact NE-OE1 2.83Å; R406-E410 IonicContact NH2-OE1 3.02Å; R406-E410 PolarHBondContact NH2-OE1 3.14Å; R406-E410 WeakPolarHBondContact O-CB 3.43Å; R406-E410 PolarHBondContact O-N 3.24Å; R406-I456 HydrophobicContact CB-CG2 4.45Å; R406-I456 HydrophobicContact CG-CD1 4.18Å
407	A	82.5	Confident	82.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-37	176.8	0	0	0	0	0	112.6	A403 F404 K411 K412 V414 I456 P499	A403-A407 WeakPolarHBondContact O-CB 3.4Å; A403-A407 PolarHBondContact O-N 2.86Å; F404-A407 PolarHBondContact O-N 2.98Å; A407-K411 VanDerWaalsContact O-CA 3.28Å; A407-K411 WeakPolarHBondContact O-CA 3.33Å; A407-K411 PolarHBondContact O-N 3.23Å; A407-K412 PolarHBondContact O-N 2.93Å; A407-K412 VanDerWaalsContact O-N 3.08Å; A407-V414 HydrophobicContact CB-CG2 3.31Å; A407-I456 HydrophobicContact CB-CB 4.29Å; A407-I456 HydrophobicContact CB-CG1 4.04Å; A407-P499 HydrophobicContact CB-CB 4.43Å; A407-P499 HydrophobicContact CB-CG 4.28Å
408	E	81.9	Confident	82.5	Confident	129 Å²	129	50.1 Å²	50.1	60%	0.603	25%	0.246	S	C	*	.	H	α-helix	trans	-66.2	-43.7	173.9	-171.2	170.7	-166.5	0	0	111.4	F404 E405 R406 K411 P499	F404-E408 WeakPolarHBondContact O-CB 3.48Å; F404-E408 PolarHBondContact O-N 3.49Å; E405-E408 PolarHBondContact O-N 3.06Å; R406-E408 VanDerWaalsContact C-N 3.3Å; R406-E408 PolarHBondContact O-N 3.17Å; E408-K411 PolarHBondContact O-N 2.96Å; E408-P499 HydrophobicContact CB-CB 4.06Å
409	S	84.2	Confident	82.2	Confident	79 Å²	79	47.8 Å²	47.8	55%	0.552	23%	0.234	S	C	*	.	H	α-helix	trans	-65.8	-40.1	178.5	76.6	0	0	0	0	113.4	E405 R406	E405-S409 PolarHBondContact O-N 2.8Å; R406-S409 PolarHBondContact O-N 2.66Å; R406-S409 PolarHBondContact O-OG 3.41Å
410	E	81.8	Confident	81.3	Confident	66 Å²	66	47.9 Å²	47.9	31%	0.308	23%	0.225	S	C	.	.	H	α-helix	trans	-91.1	-5.4	-177.8	-65.1	-166.5	-170.1	0	0	113.1	R406 K412	R406-E410 HydrophobicContact CG-CG 4.46Å; R406-E410 IonicContact CZ-OE1 2.63Å; R406-E410 IonicContact NE-OE1 2.57Å; R406-E410 PolarHBondContact NE-OE1 2.83Å; R406-E410 IonicContact NH2-OE1 3.02Å; R406-E410 PolarHBondContact NH2-OE1 3.14Å; R406-E410 WeakPolarHBondContact O-CB 3.43Å; R406-E410 PolarHBondContact O-N 3.24Å; E410-K412 HydrophobicContact CB-CD 4.11Å; E410-K412 HydrophobicContact CB-CG 4.11Å; E410-K412 PolarHBondContact O-N 2.55Å; E410-K412 WeakPolarHBondContact OE2-CD 3.36Å; E410-K412 VanDerWaalsContact OE2-CE 3.31Å; E410-K412 WeakPolarHBondContact OE2-CE 3.36Å; E410-K412 IonicContact OE2-NZ 3.11Å; E410-K412 PolarHBondContact OE2-NZ 3.17Å
411	K	81.2	Confident	80.3	Confident	191 Å²	191	47.9 Å²	47.9	83%	0.83	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	40.6	-173.2	-58.9	-178.7	179.3	-179.4	0	112.9	A407 E408	A407-K411 VanDerWaalsContact O-CA 3.28Å; A407-K411 WeakPolarHBondContact O-CA 3.33Å; A407-K411 PolarHBondContact O-N 3.23Å; E408-K411 PolarHBondContact O-N 2.96Å
412	K	83.9	Confident	79.1	Confident	59 Å²	59	46.8 Å²	46.8	26%	0.257	22%	0.217	S	C	.	.			trans	-105.6	162.7	177.5	-73.3	179.3	-179.3	167.2	0	110.6	A407 E410 I456 P499	A407-K412 PolarHBondContact O-N 2.93Å; A407-K412 VanDerWaalsContact O-N 3.08Å; E410-K412 HydrophobicContact CB-CD 4.11Å; E410-K412 HydrophobicContact CB-CG 4.11Å; E410-K412 PolarHBondContact O-N 2.55Å; E410-K412 WeakPolarHBondContact OE2-CD 3.36Å; E410-K412 VanDerWaalsContact OE2-CE 3.31Å; E410-K412 WeakPolarHBondContact OE2-CE 3.36Å; E410-K412 IonicContact OE2-NZ 3.11Å; E410-K412 PolarHBondContact OE2-NZ 3.17Å; K412-I456 HydrophobicContact CB-CG1 4.11Å; K412-I456 HydrophobicContact CD-CD1 4Å; K412-I456 HydrophobicContact CD-CG1 4.39Å; K412-P499 WeakPolarHBondContact O-CG 3.47Å
413	L	83.3	Confident	77.8	Confident	12 Å²	12	42 Å²	42	6%	0.063	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	153.1	173.1	-61.5	-176.5	0	0	0	110.7	F455 I456 V496 L498 L549 A552	L413-F455 HydrophobicContact CB-CD1 3.6Å; L413-F455 HydrophobicContact CB-CE1 3.73Å; L413-F455 HydrophobicContact CD1-CE1 3.86Å; L413-F455 HydrophobicContact CD1-CZ 4.48Å; L413-F455 HydrophobicContact CG-CE1 4.4Å; L413-F455 CarbonylContact O-C 3.49Å; L413-F455 VanDerWaalsContact O-CA 3.27Å; L413-F455 WeakPolarHBondContact O-CA 3.27Å; L413-I456 PolarHBondContact O-N 3Å; L413-V496 HydrophobicContact CB-CG1 4.5Å; L413-V496 HydrophobicContact CD1-CG1 4.05Å; L413-L498 HydrophobicContact CD2-CD2 3.55Å; L413-L498 HydrophobicContact CD2-CG 4.48Å; L413-L549 HydrophobicContact CD1-CD2 3.64Å; L413-L549 HydrophobicContact CD1-CG 4.39Å; L413-L549 HydrophobicContact CG-CD2 4.42Å; L413-A552 HydrophobicContact CD1-CB 3.59Å; L413-A552 HydrophobicContact CD2-CB 3.83Å; L413-A552 HydrophobicContact CG-CB 4.34Å
414	V	83.6	Confident	76.5	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124.4	172.1	-178.6	0	0	0	0	108.7	F404 A407 I456 V496 A497	F404-V414 HydrophobicContact CD1-CG2 3.76Å; F404-V414 HydrophobicContact CE1-CB 4.02Å; F404-V414 HydrophobicContact CE1-CG1 4.23Å; F404-V414 HydrophobicContact CE1-CG2 3.74Å; F404-V414 HydrophobicContact CE2-CG1 4.32Å; F404-V414 HydrophobicContact CG-CG2 4.35Å; F404-V414 HydrophobicContact CZ-CB 4.23Å; F404-V414 HydrophobicContact CZ-CG1 3.95Å; F404-V414 HydrophobicContact CZ-CG2 4.29Å; A407-V414 HydrophobicContact CB-CG2 3.31Å; V414-I456 WeakPolarHBondContact CA-O 3.27Å; V414-V496 WeakPolarHBondContact O-CA 3.39Å; V414-A497 HydrophobicContact CB-CB 4.5Å; V414-A497 PolarHBondContact N-O 3.37Å; V414-A497 PolarHBondContact O-N 3.13Å
415	H	84.8	Confident	75.2	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	107.3	166.5	174.6	-110.2	0	0	0	108	L451 F455 I456 S457 S458 Y541	H415-L451 HydrophobicContact CB-CD2 3.98Å; H415-F455 HydrophobicContact CB-CB 3.95Å; H415-F455 HydrophobicContact CB-CD1 4.01Å; H415-F455 HydrophobicContact CB-CG 4.17Å; H415-I456 PolarHBondContact N-O 2.67Å; H415-S457 CarbonylContact O-C 3.58Å; H415-S457 WeakPolarHBondContact O-CA 3.3Å; H415-S458 PolarHBondContact O-N 3.29Å; H415-Y541 PolarHBondContact CE1-OH 2.69Å; H415-Y541 AromaticContact NE2-CZ 3.82Å; H415-Y541 PolarHBondContact NE2-OH 2.99Å
416	S	82.7	Confident	73.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.7	-175.1	-175.7	0	0	0	0	110.6	S458 L495	S416-S458 CarbonylContact C-O 3.51Å; S416-S458 WeakPolarHBondContact CA-O 3.47Å; S416-L495 PolarHBondContact N-O 3.13Å; S416-L495 WeakPolarHBondContact O-CA 3.37Å; S416-L495 WeakPolarHBondContact O-CB 3.4Å; S416-L495 PolarHBondContact O-N 3.08Å
417	I	81.7	Confident	71.8	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.01	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	120.8	171.9	-48.2	174.3	0	0	0	108.7	L419 L423 L442 S458 W459 S460 V492 M494	I417-L419 HydrophobicContact CG2-CD1 4.31Å; I417-L419 HydrophobicContact CG2-CD2 3.84Å; I417-L419 HydrophobicContact CG2-CG 3.95Å; I417-L423 HydrophobicContact CB-CD1 4.07Å; I417-L423 HydrophobicContact CD1-CD1 3.83Å; I417-L423 HydrophobicContact CG2-CD1 3.96Å; I417-L442 HydrophobicContact CD1-CD1 3.92Å; I417-L442 HydrophobicContact CD1-CD2 4.34Å; I417-S458 PolarHBondContact N-O 3.2Å; I417-W459 HydrophobicContact CB-CB 4.2Å; I417-W459 WeakPolarHBondContact O-CA 3.37Å; I417-S460 PolarHBondContact O-N 2.96Å; I417-V492 HydrophobicContact CG2-CG1 3.98Å; I417-M494 HydrophobicContact CG2-CG 4.25Å
418	L	77.3	Confident	70.2	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.9	-175.9	-154.4	146.4	0	0	0	109.5	V462 L465 H484 Y488 V492 E493 L495	L418-V462 HydrophobicContact CD2-CB 4.46Å; L418-V462 HydrophobicContact CD2-CG2 3.48Å; L418-V462 VanDerWaalsContact CD2-CG2 3.48Å; L418-L465 HydrophobicContact CD1-CD1 3.14Å; L418-L465 HydrophobicContact CD2-CD1 4.34Å; L418-L465 HydrophobicContact CG-CD1 3.67Å; L418-H484 HydrophobicContact CD1-CB 3.69Å; L418-Y488 HydrophobicContact CB-CD2 4.38Å; L418-Y488 HydrophobicContact CD2-CD1 4.38Å; L418-Y488 HydrophobicContact CD2-CD2 3.17Å; L418-Y488 HydrophobicContact CD2-CE2 3.72Å; L418-Y488 HydrophobicContact CD2-CG 3.54Å; L418-Y488 HydrophobicContact CG-CD2 4.33Å; L418-V492 WeakPolarHBondContact O-CA 3.49Å; L418-E493 PolarHBondContact N-O 2.67Å; L418-E493 PolarHBondContact O-N 3.42Å; L418-L495 HydrophobicContact CB-CD1 4.31Å; L418-L495 HydrophobicContact CD1-CD1 4.1Å
419	L	74.4	Confident	68.4	Low	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146.1	-166.3	-47.6	129.2	0	0	0	111.9	I417 G421 L423 W459 S460 L461 V462 V492	I417-L419 HydrophobicContact CG2-CD1 4.31Å; I417-L419 HydrophobicContact CG2-CD2 3.84Å; I417-L419 HydrophobicContact CG2-CG 3.95Å; L419-G421 WeakPolarHBondContact CB-O 3.34Å; L419-L423 HydrophobicContact CD1-CB 4.09Å; L419-L423 HydrophobicContact CD1-CD1 3.44Å; L419-L423 VanDerWaalsContact CD1-CD1 3.44Å; L419-L423 HydrophobicContact CD1-CG 3.4Å; L419-L423 HydrophobicContact CD2-CD1 4Å; L419-L423 HydrophobicContact CD2-CD2 3.92Å; L419-L423 HydrophobicContact CD2-CG 3.56Å; L419-L423 HydrophobicContact CG-CD1 4.24Å; L419-L423 HydrophobicContact CG-CG 4.09Å; L419-W459 HydrophobicContact CD1-CB 4.13Å; L419-W459 HydrophobicContact CD1-CE3 3.96Å; L419-S460 PolarHBondContact N-O 3.3Å; L419-S460 VanDerWaalsContact N-O 3.11Å; L419-L461 WeakPolarHBondContact O-CA 3.43Å; L419-V462 WeakPolarHBondContact O-CG2 2.92Å; L419-V462 PolarHBondContact O-N 3.17Å; L419-V492 HydrophobicContact CD2-CB 4.2Å; L419-V492 HydrophobicContact CD2-CG1 3.57Å; L419-V492 HydrophobicContact CD2-CG2 3.67Å; L419-V492 HydrophobicContact CG-CG1 4.41Å
420	W	65.3	Low	66.3	Low	75 Å²	75	23.1 Å²	23.1	28%	0.284	11%	0.106	S	C	.	.	S	Bend	trans	-70.7	-40.9	168.6	-170.7	74.3	0	0	0	113	V324 I326 Y488 F490 P491	V324-W420 HydrophobicContact CG2-CZ3 4.36Å; I326-W420 HydrophobicContact CD1-CE3 4.31Å; I326-W420 HydrophobicContact CD1-CH2 4.4Å; I326-W420 HydrophobicContact CD1-CZ3 3.83Å; I326-W420 HydrophobicContact CG1-CZ3 4.25Å; W420-Y488 WeakPolarHBondContact CB-OH 3.45Å; W420-F490 HydrophobicContact CB-CD2 4.37Å; W420-F490 HydrophobicContact CB-CE2 4.21Å; W420-F490 HydrophobicContact CD2-CE2 4.04Å; W420-F490 HydrophobicContact CG-CD2 4.24Å; W420-F490 AromaticContact CG-CE2 3.88Å; W420-F490 HydrophobicContact CG-CE2 3.88Å; W420-P491 PolarHBondContact N-O 3.1Å; W420-P491 VanDerWaalsContact N-O 3.13Å
421	G	60.5	Low	64.4	Low	4 Å²	4	21 Å²	21	4%	0.041	10%	0.1	C	C	.	.	S	Bend	trans	-116.9	158.4	173.7	0	0	0	0	0	110.8	L419 S427 L461	L419-G421 WeakPolarHBondContact CB-O 3.34Å; G421-S427 VanDerWaalsContact C-OG 3.32Å; G421-L461 VanDerWaalsContact C-CD2 3.48Å
422	A	56.3	Low	62.9	Low	3 Å²	3	14 Å²	14	3%	0.025	8%	0.081	C	C	.	.			trans	-64.6	148.6	-178.2	0	0	0	0	0	112.6	D424 Q426 S427 W459 L461	A422-D424 WeakPolarHBondContact CB-OD1 3.31Å; A422-D424 PolarHBondContact O-N 2.91Å; A422-Q426 HydrophobicContact CB-CB 3.6Å; A422-Q426 HydrophobicContact CB-CG 4.24Å; A422-S427 PolarHBondContact N-OG 3.05Å; A422-S427 PolarHBondContact O-OG 2.82Å; A422-W459 HydrophobicContact CB-CH2 4.1Å; A422-W459 HydrophobicContact CB-CZ3 3.9Å; A422-L461 HydrophobicContact CB-CD2 4.2Å
423	L	55.1	Low	61.2	Low	4 Å²	4	11.2 Å²	11.2	2%	0.021	7%	0.07	C	C	.	.	S	Bend	trans	-74.3	-11.8	170.5	-89	165	0	0	0	113	I417 L419 W459	I417-L423 HydrophobicContact CB-CD1 4.07Å; I417-L423 HydrophobicContact CD1-CD1 3.83Å; I417-L423 HydrophobicContact CG2-CD1 3.96Å; L419-L423 HydrophobicContact CD1-CB 4.09Å; L419-L423 HydrophobicContact CD1-CD1 3.44Å; L419-L423 VanDerWaalsContact CD1-CD1 3.44Å; L419-L423 HydrophobicContact CD1-CG 3.4Å; L419-L423 HydrophobicContact CD2-CD1 4Å; L419-L423 HydrophobicContact CD2-CD2 3.92Å; L419-L423 HydrophobicContact CD2-CG 3.56Å; L419-L423 HydrophobicContact CG-CD1 4.24Å; L419-L423 HydrophobicContact CG-CG 4.09Å; L423-W459 HydrophobicContact CB-CD2 4.48Å; L423-W459 HydrophobicContact CD1-CB 3.78Å; L423-W459 HydrophobicContact CD1-CG 4.06Å
424	D	57.8	Low	59.7	Low	4 Å²	4	10.7 Å²	10.7	2%	0.021	7%	0.067	C	C	.	.	S	Bend	trans	-118.1	-162.6	-177.7	76.7	-5.2	0	0	0	111.5	R304 K393 A422 Q426 S427 W459	R304-D424 IonicContact CZ-OD1 3.77Å; R304-D424 IonicContact CZ-OD2 3.36Å; R304-D424 VanDerWaalsContact CZ-OD2 3.25Å; R304-D424 IonicContact NH1-OD1 3.9Å; R304-D424 PolarHBondContact NH1-OD1 2.72Å; R304-D424 IonicContact NH1-OD2 2.81Å; R304-D424 PolarHBondContact NH1-OD2 2.9Å; R304-D424 IonicContact NH2-OD2 2.76Å; R304-D424 PolarHBondContact NH2-OD2 3.02Å; K393-D424 IonicContact NZ-OD2 2.7Å; A422-D424 WeakPolarHBondContact CB-OD1 3.31Å; A422-D424 PolarHBondContact O-N 2.91Å; D424-Q426 PolarHBondContact O-N 2.92Å; D424-S427 PolarHBondContact O-N 3Å; D424-W459 HydrophobicContact CB-CZ2 4.38Å
425	D	54.1	Low	58.7	Low	8 Å²	8	12.4 Å²	12.4	4%	0.043	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	21.6	-168.3	-52.1	-52.6	0	0	0	116.3	R258 H260 G278 Q279 Y390	R258-D425 IonicContact CZ-OD1 2.75Å; R258-D425 VanDerWaalsContact CZ-OD1 3.26Å; R258-D425 IonicContact CZ-OD2 3.63Å; R258-D425 VanDerWaalsContact NH1-CG 3.3Å; R258-D425 IonicContact NH1-OD1 3.37Å; R258-D425 IonicContact NH1-OD2 3.94Å; R258-D425 PolarHBondContact NH1-OD2 2.79Å; R258-D425 IonicContact NH2-OD1 2.85Å; R258-D425 PolarHBondContact NH2-OD1 3.02Å; R258-D425 IonicContact NH2-OD2 3.5Å; R258-D425 PolarHBondContact NH2-OD2 3.18Å; H260-D425 IonicContact CE1-OD1 2.92Å; H260-D425 PolarHBondContact CE1-OD1 2.57Å; H260-D425 IonicContact NE2-OD1 2.61Å; G278-D425 CarbonylContact C-O 3.32Å; G278-D425 WeakPolarHBondContact CA-O 3.5Å; Q279-D425 HydrophobicContact CB-CB 4.1Å; Q279-D425 HydrophobicContact CG-CB 4.09Å; Q279-D425 PolarHBondContact OE1-OD2 3.36Å; Q279-D425 VanDerWaalsContact OE1-OD2 3.11Å; Y390-D425 WeakPolarHBondContact CE2-OD1 3.43Å; Y390-D425 WeakPolarHBondContact CE2-OD2 3.35Å; Y390-D425 VanDerWaalsContact CZ-OD1 3.28Å; Y390-D425 PolarHBondContact OH-OD1 3.32Å
426	Q	48.5	Very low	57.4	Low	18 Å²	18	14.4 Å²	14.4	8%	0.084	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-23.8	168.3	-60.9	174.7	56.7	0	0	112.1	R304 A422 D424	R304-Q426 HydrophobicContact CB-CG 4.14Å; R304-Q426 HydrophobicContact CG-CG 4.19Å; R304-Q426 VanDerWaalsContact CZ-NE2 3.32Å; R304-Q426 VanDerWaalsContact NH1-CG 3.3Å; R304-Q426 VanDerWaalsContact NH1-NE2 3.19Å; A422-Q426 HydrophobicContact CB-CB 3.6Å; A422-Q426 HydrophobicContact CB-CG 4.24Å; D424-Q426 PolarHBondContact O-N 2.92Å
427	S	48.3	Very low	56.4	Low	4 Å²	4	14.5 Å²	14.5	3%	0.028	9%	0.086	C	C	.	.			trans	-152.9	105.1	175.3	51.5	0	0	0	0	109	G421 A422 D424 M429	G421-S427 VanDerWaalsContact C-OG 3.32Å; A422-S427 PolarHBondContact N-OG 3.05Å; A422-S427 PolarHBondContact O-OG 2.82Å; D424-S427 PolarHBondContact O-N 3Å; S427-M429 CarbonylContact O-C 3.6Å; S427-M429 PolarHBondContact O-N 3.05Å; S427-M429 VanDerWaalsContact O-N 3.1Å
428	C	48.1	Very low	55.6	Low	14 Å²	14	15.1 Å²	15.1	10%	0.095	9%	0.088	C	C	.	.	S	Bend	trans	-56.3	-22.1	167.3	-65.7	0	0	0	0	111	T276	T276-C428 HydrophobicContact CG2-CB 4Å
429	M	44.1	Very low	54.8	Low	17 Å²	17	18.1 Å²	18.1	8%	0.084	10%	0.102	C	C	.	.			trans	-92.8	85.9	163.5	-66.8	-97.4	143.7	0	0	112.7	F236 D309 E311 V324 S427 A431	F236-M429 HydrophobicContact CD2-CE 3.17Å; F236-M429 HydrophobicContact CE1-CE 4.48Å; F236-M429 HydrophobicContact CE2-CE 2.96Å; F236-M429 HydrophobicContact CG-CE 4.04Å; F236-M429 HydrophobicContact CZ-CE 3.68Å; D309-M429 WeakPolarHBondContact OD2-CA 3.25Å; D309-M429 WeakPolarHBondContact OD2-CB 3.32Å; D309-M429 WeakPolarHBondContact OD2-CG 3.32Å; D309-M429 PolarHBondContact OD2-N 2.83Å; E311-M429 VanDerWaalsContact CD-SD 3.59Å; E311-M429 HydrophobicContact CG-CE 4.29Å; E311-M429 HydrophobicContact CG-CG 4.22Å; E311-M429 HydrophobicContact CG-SD 4.1Å; E311-M429 WeakPolarHBondContact OE1-CE 3.49Å; E311-M429 WeakPolarHBondContact OE2-CE 3.5Å; V324-M429 HydrophobicContact CG1-SD 4.45Å; S427-M429 CarbonylContact O-C 3.6Å; S427-M429 PolarHBondContact O-N 3.05Å; S427-M429 VanDerWaalsContact O-N 3.1Å; M429-A431 PolarHBondContact O-N 2.8Å
430	S	40.2	Very low	54.2	Low	5 Å²	5	20.1 Å²	20.1	4%	0.035	11%	0.114	C	C	.	.	S	Bend	trans	-77.4	98.7	138.4	56.4	0	0	0	0	106.2	G432 G434 R435	S430-G432 PolarHBondContact O-N 2.77Å; S430-G432 VanDerWaalsContact O-N 3.12Å; S430-G434 VanDerWaalsContact OG-CA 3.28Å; S430-G434 WeakPolarHBondContact OG-CA 3.39Å; S430-G434 PolarHBondContact OG-O 2.98Å; S430-R435 PolarHBondContact O-N 2.76Å; S430-R435 PolarHBondContact OG-N 2.94Å
431	A	42.7	Very low	54.2	Low	22 Å²	22	16.5 Å²	16.5	18%	0.182	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-24.6	111.6	-176.2	0	0	0	0	0	112.9	M429 S433 G434 P491	M429-A431 PolarHBondContact O-N 2.8Å; A431-S433 WeakPolarHBondContact O-CA 3.34Å; A431-S433 PolarHBondContact O-N 3.05Å; A431-S433 PolarHBondContact O-OG 2.76Å; A431-S433 VanDerWaalsContact O-OG 3.07Å; A431-G434 PolarHBondContact O-N 2.81Å; A431-P491 HydrophobicContact CB-CB 3.63Å; A431-P491 HydrophobicContact CB-CG 3.84Å
432	G	49	Very low	54.4	Low	42 Å²	42	16.4 Å²	16.4	43%	0.433	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	37.3	-64.6	176.4	0	0	0	0	0	117	S430 T436	S430-G432 PolarHBondContact O-N 2.77Å; S430-G432 VanDerWaalsContact O-N 3.12Å; G432-T436 PolarHBondContact O-N 3.42Å; G432-T436 PolarHBondContact O-OG1 3.01Å; G432-T436 VanDerWaalsContact O-OG1 3.07Å
433	S	47.2	Very low	54.9	Low	2 Å²	2	20.8 Å²	20.8	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-64.6	-41.6	178.1	70.9	0	0	0	0	117.7	A431 R435 T436 L437 P491 N510 L513	A431-S433 WeakPolarHBondContact O-CA 3.34Å; A431-S433 PolarHBondContact O-N 3.05Å; A431-S433 PolarHBondContact O-OG 2.76Å; A431-S433 VanDerWaalsContact O-OG 3.07Å; S433-R435 VanDerWaalsContact C-N 3.27Å; S433-R435 PolarHBondContact O-N 3.01Å; S433-T436 PolarHBondContact O-N 3.31Å; S433-L437 WeakPolarHBondContact O-CG 3.21Å; S433-L437 PolarHBondContact O-N 2.98Å; S433-L437 VanDerWaalsContact O-N 3.17Å; S433-P491 VanDerWaalsContact OG-CG 3.23Å; S433-P491 WeakPolarHBondContact OG-CG 3.46Å; S433-N510 WeakPolarHBondContact CB-OD1 3.17Å; S433-L513 VanDerWaalsContact CA-CD1 3.44Å
434	G	53.1	Low	55.4	Low	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-68.3	-31.4	176.5	0	0	0	0	0	112.2	S430 A431 L437 R438	S430-G434 VanDerWaalsContact OG-CA 3.28Å; S430-G434 WeakPolarHBondContact OG-CA 3.39Å; S430-G434 PolarHBondContact OG-O 2.98Å; A431-G434 PolarHBondContact O-N 2.81Å; G434-L437 PolarHBondContact O-N 3.06Å; G434-R438 PolarHBondContact O-N 3.15Å
435	R	61.8	Low	55.9	Low	37 Å²	37	25.7 Å²	25.7	14%	0.14	15%	0.154	C	C	.	.	H	α-helix	trans	-64.8	-50.1	176.5	-173.2	-174.8	81.4	-147	8.4	110.7	S430 S433 L437 R438 E439	S430-R435 PolarHBondContact O-N 2.76Å; S430-R435 PolarHBondContact OG-N 2.94Å; S433-R435 VanDerWaalsContact C-N 3.27Å; S433-R435 PolarHBondContact O-N 3.01Å; R435-L437 VanDerWaalsContact C-N 3.29Å; R435-L437 PolarHBondContact O-N 3.01Å; R435-R438 WeakPolarHBondContact O-CB 3.31Å; R435-R438 PolarHBondContact O-N 2.74Å; R435-R438 VanDerWaalsContact O-N 3.13Å; R435-E439 WeakPolarHBondContact CG-OE1 3.38Å; R435-E439 PolarHBondContact O-N 2.61Å; R435-E439 VanDerWaalsContact O-N 3.12Å
436	T	58.6	Low	56.6	Low	41 Å²	41	27.9 Å²	27.9	25%	0.252	17%	0.168	S	C	.	.	H	α-helix	trans	-61.7	-39.2	179.5	-46.7	0	0	0	0	111.4	G432 S433 R438 E439 T440 L513	G432-T436 PolarHBondContact O-N 3.42Å; G432-T436 PolarHBondContact O-OG1 3.01Å; G432-T436 VanDerWaalsContact O-OG1 3.07Å; S433-T436 PolarHBondContact O-N 3.31Å; T436-R438 VanDerWaalsContact C-N 3.28Å; T436-R438 PolarHBondContact O-N 3.46Å; T436-E439 PolarHBondContact O-N 2.99Å; T436-T440 HydrophobicContact CG2-CG2 4.16Å; T436-T440 PolarHBondContact O-N 3.26Å; T436-T440 PolarHBondContact O-OG1 3.34Å; T436-L513 HydrophobicContact CG2-CD1 4.33Å; T436-L513 HydrophobicContact CG2-CD2 3.42Å; T436-L513 VanDerWaalsContact CG2-CD2 3.42Å
437	L	61.2	Low	57.7	Low	2 Å²	2	27 Å²	27	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-60.3	-36.9	175.6	-73.2	170.6	0	0	0	113.2	S433 G434 R435 V441 L442 V492 M494 A509 F512	S433-L437 WeakPolarHBondContact O-CG 3.21Å; S433-L437 PolarHBondContact O-N 2.98Å; S433-L437 VanDerWaalsContact O-N 3.17Å; G434-L437 PolarHBondContact O-N 3.06Å; R435-L437 VanDerWaalsContact C-N 3.29Å; R435-L437 PolarHBondContact O-N 3.01Å; L437-V441 HydrophobicContact CD2-CB 4.44Å; L437-V441 HydrophobicContact CD2-CG2 4.19Å; L437-V441 PolarHBondContact O-N 3.15Å; L437-L442 WeakPolarHBondContact O-CB 3.31Å; L437-L442 WeakPolarHBondContact O-CG 3.43Å; L437-L442 PolarHBondContact O-N 2.71Å; L437-V492 HydrophobicContact CD1-CG1 3.96Å; L437-M494 HydrophobicContact CD1-CE 4.03Å; L437-M494 HydrophobicContact CD1-CG 4.25Å; L437-M494 HydrophobicContact CD1-SD 3.43Å; L437-M494 WeakPolarHBondContact CD1-SD 3.31Å; L437-M494 HydrophobicContact CD2-CE 3.8Å; L437-M494 HydrophobicContact CD2-SD 3.53Å; L437-M494 VanDerWaalsContact CD2-SD 3.53Å; L437-M494 HydrophobicContact CG-SD 4.1Å; L437-A509 HydrophobicContact CD1-CB 3.64Å; L437-F512 HydrophobicContact CD2-CD1 3.75Å; L437-F512 HydrophobicContact CD2-CE1 3.66Å; L437-F512 HydrophobicContact CD2-CZ 4.5Å
438	R	64.8	Low	58.9	Low	16 Å²	16	27.7 Å²	27.7	6%	0.06	17%	0.168	C	C	.	.	H	α-helix	trans	-68.2	-44.1	177.8	-162.2	-168.2	78.7	-147.6	-11.2	112.3	A237 P238 Y390 F392 G434 R435 T436	A237-R438 PolarHBondContact O-NH1 2.8Å; A237-R438 PolarHBondContact O-NH2 2.79Å; P238-R438 VanDerWaalsContact CD-NH1 3.28Å; P238-R438 VanDerWaalsContact N-NH2 3.18Å; Y390-R438 HydrophobicContact CD1-CG 4.44Å; F392-R438 HydrophobicContact CD1-CG 3.68Å; F392-R438 HydrophobicContact CE1-CG 3.35Å; F392-R438 HydrophobicContact CZ-CG 4.26Å; G434-R438 PolarHBondContact O-N 3.15Å; R435-R438 WeakPolarHBondContact O-CB 3.31Å; R435-R438 PolarHBondContact O-N 2.74Å; R435-R438 VanDerWaalsContact O-N 3.13Å; T436-R438 VanDerWaalsContact C-N 3.28Å; T436-R438 PolarHBondContact O-N 3.46Å
439	E	60.6	Low	60.1	Low	62 Å²	62	29.2 Å²	29.2	29%	0.29	18%	0.182	S	C	.	.	H	α-helix	trans	-83.5	-16.7	-172.6	-68.7	172.3	-174	0	0	113.5	A237 R435 T436	A237-E439 WeakPolarHBondContact CB-OE1 3.49Å; R435-E439 WeakPolarHBondContact CG-OE1 3.38Å; R435-E439 PolarHBondContact O-N 2.61Å; R435-E439 VanDerWaalsContact O-N 3.12Å; T436-E439 PolarHBondContact O-N 2.99Å
440	T	60.9	Low	61.5	Low	42 Å²	42	29.8 Å²	29.8	26%	0.258	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-70.9	179.6	67.4	0	0	0	0	111.7	T436 S537	T436-T440 HydrophobicContact CG2-CG2 4.16Å; T436-T440 PolarHBondContact O-N 3.26Å; T436-T440 PolarHBondContact O-OG1 3.34Å; T440-S537 PolarHBondContact OG1-OG 3.04Å
441	V	64.9	Low	63.3	Low	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-47.6	-165.4	176.2	0	0	0	0	112.3	L437 E443 S444 V447 F512 Y541	L437-V441 HydrophobicContact CD2-CB 4.44Å; L437-V441 HydrophobicContact CD2-CG2 4.19Å; L437-V441 PolarHBondContact O-N 3.15Å; V441-E443 VanDerWaalsContact C-N 3.34Å; V441-S444 WeakPolarHBondContact O-CB 3.28Å; V441-S444 PolarHBondContact O-N 2.76Å; V441-S444 PolarHBondContact O-OG 3.03Å; V441-V447 HydrophobicContact CG1-CG2 4.43Å; V441-F512 HydrophobicContact CG2-CE1 3.69Å; V441-F512 HydrophobicContact CG2-CZ 3.49Å; V441-F512 VanDerWaalsContact CG2-CZ 3.49Å; V441-Y541 HydrophobicContact CB-CG 4.46Å; V441-Y541 HydrophobicContact CG1-CD1 3.06Å; V441-Y541 HydrophobicContact CG1-CD2 3.75Å; V441-Y541 HydrophobicContact CG1-CE1 3.53Å; V441-Y541 HydrophobicContact CG1-CE2 4.2Å; V441-Y541 HydrophobicContact CG1-CG 3.12Å
442	L	66.5	Low	65	Low	2 Å²	2	33.5 Å²	33.5	1%	0.01	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-19.7	-173.4	-64.2	177.4	0	0	0	112.7	F392 I417 L437 S444 L448 Y541	F392-L442 HydrophobicContact CB-CB 3.69Å; F392-L442 WeakPolarHBondContact CB-O 3.4Å; F392-L442 HydrophobicContact CG-CB 4.21Å; I417-L442 HydrophobicContact CD1-CD1 3.92Å; I417-L442 HydrophobicContact CD1-CD2 4.34Å; L437-L442 WeakPolarHBondContact O-CB 3.31Å; L437-L442 WeakPolarHBondContact O-CG 3.43Å; L437-L442 PolarHBondContact O-N 2.71Å; L442-S444 VanDerWaalsContact C-N 3.33Å; L442-L448 WeakPolarHBondContact O-CD2 3.2Å; L442-Y541 HydrophobicContact CD2-CE1 4.37Å
443	E	64.8	Low	66.4	Low	95 Å²	95	38.2 Å²	38.2	44%	0.444	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-24.2	171	178.5	164.6	-170.6	0	0	112.3	P391 V441 S445	P391-E443 HydrophobicContact CB-CG 4.01Å; P391-E443 HydrophobicContact CG-CG 4.03Å; V441-E443 VanDerWaalsContact C-N 3.34Å; E443-S445 PolarHBondContact O-N 2.93Å
444	S	66.9	Low	67.7	Low	18 Å²	18	40 Å²	40	13%	0.126	23%	0.225	C	C	.	.			trans	-64.4	127.5	-173.4	76.5	0	0	0	0	112.7	V441 L442 P446 V447 L448 T538	V441-S444 WeakPolarHBondContact O-CB 3.28Å; V441-S444 PolarHBondContact O-N 2.76Å; V441-S444 PolarHBondContact O-OG 3.03Å; L442-S444 VanDerWaalsContact C-N 3.33Å; S444-P446 VanDerWaalsContact C-CD 3.47Å; S444-V447 PolarHBondContact O-N 3.1Å; S444-V447 WeakPolarHBondContact OG-CB 3.31Å; S444-V447 WeakPolarHBondContact OG-CG2 3.23Å; S444-L448 WeakPolarHBondContact O-CG 3.39Å; S444-L448 PolarHBondContact O-N 3.48Å; S444-L448 VanDerWaalsContact O-N 3.09Å; S444-T538 WeakPolarHBondContact OG-CG2 3.23Å
445	S	68.6	Low	69.1	Low	92 Å²	92	40.3 Å²	40.3	64%	0.643	23%	0.226	S	C	*	.	H	α-helix	trans	-59.1	-38.9	-179.5	-65.6	0	0	0	0	114.2	E443 L448 A449	E443-S445 PolarHBondContact O-N 2.93Å; S445-L448 PolarHBondContact O-N 3.32Å; S445-A449 WeakPolarHBondContact O-CB 3.09Å; S445-A449 PolarHBondContact O-N 3.41Å
446	P	68.3	Low	70.1	Confident	54 Å²	54	39.3 Å²	39.3	35%	0.351	22%	0.223	S	C	.	.	H	α-helix	trans	-63.9	-38.7	176.9	-23	34.8	0	0	0	113.5	S444 L450 E534 I542	S444-P446 VanDerWaalsContact C-CD 3.47Å; P446-L450 PolarHBondContact O-N 3.3Å; P446-L450 VanDerWaalsContact O-N 3.13Å; P446-E534 WeakPolarHBondContact CG-OE1 3.41Å; P446-I542 HydrophobicContact CB-CD1 3.98Å
447	V	71.8	Confident	71.3	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.9	-44.7	176.5	172.3	0	0	0	0	110.5	V441 S444 A449 L450 L451 T538 Y541 I542 L545	V441-V447 HydrophobicContact CG1-CG2 4.43Å; S444-V447 PolarHBondContact O-N 3.1Å; S444-V447 WeakPolarHBondContact OG-CB 3.31Å; S444-V447 WeakPolarHBondContact OG-CG2 3.23Å; V447-A449 VanDerWaalsContact C-N 3.3Å; V447-A449 PolarHBondContact O-N 3.16Å; V447-L450 PolarHBondContact O-N 3.15Å; V447-L450 VanDerWaalsContact O-N 3.14Å; V447-L451 HydrophobicContact CG1-CD1 3.86Å; V447-L451 HydrophobicContact CG1-CG 4.19Å; V447-L451 WeakPolarHBondContact O-CB 3.35Å; V447-L451 WeakPolarHBondContact O-CG 3.35Å; V447-L451 PolarHBondContact O-N 3.37Å; V447-T538 HydrophobicContact CG2-CG2 4.09Å; V447-Y541 HydrophobicContact CG1-CD1 3.72Å; V447-Y541 HydrophobicContact CG1-CE1 3.64Å; V447-Y541 HydrophobicContact CG2-CD1 3.98Å; V447-I542 HydrophobicContact CG2-CD1 4.13Å; V447-I542 HydrophobicContact CG2-CG1 3.61Å; V447-L545 HydrophobicContact CG1-CD1 4.25Å
448	L	72.6	Confident	72.3	Confident	18 Å²	18	37.4 Å²	37.4	9%	0.094	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-40.3	177.3	-67.9	171.7	0	0	0	112.2	F392 V395 L442 S444 S445 N452	F392-L448 HydrophobicContact CB-CD2 4.37Å; V395-L448 HydrophobicContact CB-CD2 4.41Å; V395-L448 HydrophobicContact CG2-CB 4.21Å; V395-L448 HydrophobicContact CG2-CD2 3.61Å; L442-L448 WeakPolarHBondContact O-CD2 3.2Å; S444-L448 WeakPolarHBondContact O-CG 3.39Å; S444-L448 PolarHBondContact O-N 3.48Å; S444-L448 VanDerWaalsContact O-N 3.09Å; S445-L448 PolarHBondContact O-N 3.32Å; L448-N452 WeakPolarHBondContact O-CB 3.45Å; L448-N452 PolarHBondContact O-N 2.96Å
449	A	73.1	Confident	73.1	Confident	47 Å²	47	38.8 Å²	38.8	39%	0.388	22%	0.217	S	C	.	.	H	α-helix	trans	-62.9	-42.8	175.2	0	0	0	0	0	112	S445 V447 Q453	S445-A449 WeakPolarHBondContact O-CB 3.09Å; S445-A449 PolarHBondContact O-N 3.41Å; V447-A449 VanDerWaalsContact C-N 3.3Å; V447-A449 PolarHBondContact O-N 3.16Å; A449-Q453 WeakPolarHBondContact O-CB 3.43Å; A449-Q453 WeakPolarHBondContact O-CG 3.27Å; A449-Q453 PolarHBondContact O-N 3.45Å; A449-Q453 VanDerWaalsContact O-N 3.1Å
450	L	74.4	Confident	73.9	Confident	29 Å²	29	36 Å²	36	15%	0.152	20%	0.204	C	C	.	.	H	α-helix	trans	-69.5	-41	-179.6	-168.6	126.3	0	0	0	112.3	P446 V447 Q453 S454 F455 L545 K546	P446-L450 PolarHBondContact O-N 3.3Å; P446-L450 VanDerWaalsContact O-N 3.13Å; V447-L450 PolarHBondContact O-N 3.15Å; V447-L450 VanDerWaalsContact O-N 3.14Å; L450-Q453 PolarHBondContact O-N 2.81Å; L450-S454 PolarHBondContact O-N 3.28Å; L450-F455 HydrophobicContact CD2-CD2 4.24Å; L450-F455 HydrophobicContact CD2-CE2 3.68Å; L450-L545 HydrophobicContact CD2-CB 3.48Å; L450-L545 VanDerWaalsContact CD2-CB 3.48Å; L450-L545 HydrophobicContact CD2-CD1 3.52Å; L450-L545 HydrophobicContact CD2-CG 4.13Å; L450-K546 HydrophobicContact CD1-CG 4.48Å
451	L	77.9	Confident	74.7	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-59.8	-49.4	173.9	-72.6	174.8	0	0	0	110.8	H415 V447 Q453 F455 L545	H415-L451 HydrophobicContact CB-CD2 3.98Å; V447-L451 HydrophobicContact CG1-CD1 3.86Å; V447-L451 HydrophobicContact CG1-CG 4.19Å; V447-L451 WeakPolarHBondContact O-CB 3.35Å; V447-L451 WeakPolarHBondContact O-CG 3.35Å; V447-L451 PolarHBondContact O-N 3.37Å; L451-Q453 VanDerWaalsContact C-N 3.3Å; L451-Q453 PolarHBondContact O-N 3.46Å; L451-F455 HydrophobicContact CD2-CB 4.22Å; L451-F455 HydrophobicContact CD2-CD2 4.28Å; L451-F455 HydrophobicContact CD2-CG 4.37Å; L451-F455 CarbonylContact O-C 3.6Å; L451-F455 WeakPolarHBondContact O-CA 3.45Å; L451-F455 PolarHBondContact O-N 3.42Å; L451-L545 HydrophobicContact CD2-CD1 3.98Å; L451-L545 HydrophobicContact CD2-CD2 4.29Å; L451-L545 HydrophobicContact CG-CD1 4.31Å
452	N	77.8	Confident	75.3	Confident	104 Å²	104	35.3 Å²	35.3	56%	0.556	20%	0.199	S	C	*	.	H	α-helix	trans	-64.5	-32.9	-179.2	-165	19	0	0	0	113.2	V395 L448	V395-N452 HydrophobicContact CG2-CB 4.5Å; L448-N452 WeakPolarHBondContact O-CB 3.45Å; L448-N452 PolarHBondContact O-N 2.96Å
453	Q	78.1	Confident	75.7	Confident	141 Å²	141	40 Å²	40	66%	0.659	22%	0.219	S	C	*	.	H	α-helix	trans	-77.4	-45.3	-179.6	-73.8	174.3	17.5	0	0	113.1	A449 L450 L451	A449-Q453 WeakPolarHBondContact O-CB 3.43Å; A449-Q453 WeakPolarHBondContact O-CG 3.27Å; A449-Q453 PolarHBondContact O-N 3.45Å; A449-Q453 VanDerWaalsContact O-N 3.1Å; L450-Q453 PolarHBondContact O-N 2.81Å; L451-Q453 VanDerWaalsContact C-N 3.3Å; L451-Q453 PolarHBondContact O-N 3.46Å
454	S	76.1	Confident	76.3	Confident	40 Å²	40	39.2 Å²	39.2	28%	0.28	22%	0.216	S	C	.	.	H	α-helix	trans	-116.5	-12.9	-163	-56.2	0	0	0	0	114.8	L450	L450-S454 PolarHBondContact O-N 3.28Å
455	F	80.9	Confident	76.9	Confident	5 Å²	5	38.3 Å²	38.3	2%	0.022	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	156.4	-172.7	-62.6	-89.3	0	0	0	112.2	L413 H415 L450 L451 V496 L545 L549	L413-F455 HydrophobicContact CB-CD1 3.6Å; L413-F455 HydrophobicContact CB-CE1 3.73Å; L413-F455 HydrophobicContact CD1-CE1 3.86Å; L413-F455 HydrophobicContact CD1-CZ 4.48Å; L413-F455 HydrophobicContact CG-CE1 4.4Å; L413-F455 CarbonylContact O-C 3.49Å; L413-F455 VanDerWaalsContact O-CA 3.27Å; L413-F455 WeakPolarHBondContact O-CA 3.27Å; H415-F455 HydrophobicContact CB-CB 3.95Å; H415-F455 HydrophobicContact CB-CD1 4.01Å; H415-F455 HydrophobicContact CB-CG 4.17Å; L450-F455 HydrophobicContact CD2-CD2 4.24Å; L450-F455 HydrophobicContact CD2-CE2 3.68Å; L451-F455 HydrophobicContact CD2-CB 4.22Å; L451-F455 HydrophobicContact CD2-CD2 4.28Å; L451-F455 HydrophobicContact CD2-CG 4.37Å; L451-F455 CarbonylContact O-C 3.6Å; L451-F455 WeakPolarHBondContact O-CA 3.45Å; L451-F455 PolarHBondContact O-N 3.42Å; F455-V496 HydrophobicContact CE1-CG1 3.86Å; F455-V496 HydrophobicContact CE1-CG2 4.36Å; F455-L545 HydrophobicContact CE2-CB 4.17Å; F455-L545 HydrophobicContact CE2-CD2 4.32Å; F455-L545 HydrophobicContact CZ-CB 4.21Å; F455-L545 HydrophobicContact CZ-CD2 4.18Å; F455-L549 HydrophobicContact CE1-CD2 4.39Å; F455-L549 HydrophobicContact CE2-CD1 4.01Å; F455-L549 HydrophobicContact CE2-CD2 4.25Å; F455-L549 HydrophobicContact CE2-CG 4.08Å; F455-L549 HydrophobicContact CZ-CD1 4.08Å; F455-L549 HydrophobicContact CZ-CD2 3.87Å; F455-L549 HydrophobicContact CZ-CG 3.65Å
456	I	83.1	Confident	77.5	Confident	17 Å²	17	38.7 Å²	38.7	9%	0.087	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	119	160.3	-58.4	-58.3	0	0	0	106.7	L398 A403 R406 A407 K412 L413 V414 H415	L398-I456 HydrophobicContact CD1-CG2 4.06Å; A403-I456 HydrophobicContact CB-CG2 4.1Å; R406-I456 HydrophobicContact CB-CG2 4.45Å; R406-I456 HydrophobicContact CG-CD1 4.18Å; A407-I456 HydrophobicContact CB-CB 4.29Å; A407-I456 HydrophobicContact CB-CG1 4.04Å; K412-I456 HydrophobicContact CB-CG1 4.11Å; K412-I456 HydrophobicContact CD-CD1 4Å; K412-I456 HydrophobicContact CD-CG1 4.39Å; L413-I456 PolarHBondContact O-N 3Å; V414-I456 WeakPolarHBondContact CA-O 3.27Å; H415-I456 PolarHBondContact N-O 2.67Å
457	S	83.8	Confident	78.1	Confident	2 Å²	2	41 Å²	41	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	135.5	-176.4	-63.7	0	0	0	0	111.2	Y397 L398 H415	Y397-S457 WeakPolarHBondContact CA-O 3.49Å; L398-S457 PolarHBondContact N-O 3.05Å; H415-S457 CarbonylContact O-C 3.58Å; H415-S457 WeakPolarHBondContact O-CA 3.3Å
458	S	83	Confident	78.5	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.3	173.9	-173.5	0	0	0	0	109.1	L398 H415 S416 I417	L398-S458 PolarHBondContact O-OG 3.07Å; H415-S458 PolarHBondContact O-N 3.29Å; S416-S458 CarbonylContact C-O 3.51Å; S416-S458 WeakPolarHBondContact CA-O 3.47Å; I417-S458 PolarHBondContact N-O 3.2Å
459	W	81.6	Confident	78.8	Confident	46 Å²	46	46.7 Å²	46.7	17%	0.174	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145.8	162.6	64.9	-89.5	0	0	0	109.2	Y397 I417 L419 A422 L423 D424	Y397-W459 AromaticContact CD1-CD1 3.63Å; Y397-W459 AromaticContact CG-CD1 3.79Å; I417-W459 HydrophobicContact CB-CB 4.2Å; I417-W459 WeakPolarHBondContact O-CA 3.37Å; L419-W459 HydrophobicContact CD1-CB 4.13Å; L419-W459 HydrophobicContact CD1-CE3 3.96Å; A422-W459 HydrophobicContact CB-CH2 4.1Å; A422-W459 HydrophobicContact CB-CZ3 3.9Å; L423-W459 HydrophobicContact CB-CD2 4.48Å; L423-W459 HydrophobicContact CD1-CB 3.78Å; L423-W459 HydrophobicContact CD1-CG 4.06Å; D424-W459 HydrophobicContact CB-CZ2 4.38Å
460	S	77.6	Confident	79	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.014	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	148.7	-174.9	-52	0	0	0	0	110.8	F400 I417 L419	F400-S460 WeakPolarHBondContact CB-OG 3.35Å; F400-S460 WeakPolarHBondContact CD2-OG 3.42Å; I417-S460 PolarHBondContact O-N 2.96Å; L419-S460 PolarHBondContact N-O 3.3Å; L419-S460 VanDerWaalsContact N-O 3.11Å
461	L	77.4	Confident	79.2	Confident	15 Å²	15	49.7 Å²	49.7	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	143.4	171.6	-62.9	174.6	0	0	0	110.5	L419 G421 A422 K463 E464 L465	L419-L461 WeakPolarHBondContact O-CA 3.43Å; G421-L461 VanDerWaalsContact C-CD2 3.48Å; A422-L461 HydrophobicContact CB-CD2 4.2Å; L461-K463 PolarHBondContact O-N 3.4Å; L461-E464 HydrophobicContact CB-CB 4.28Å; L461-E464 HydrophobicContact CB-CG 3.97Å; L461-E464 HydrophobicContact CD1-CG 4.44Å; L461-E464 PolarHBondContact N-OE2 2.82Å; L461-E464 WeakPolarHBondContact O-CB 3.3Å; L461-E464 PolarHBondContact O-N 2.73Å; L461-L465 PolarHBondContact O-N 3.06Å; L461-L465 VanDerWaalsContact O-N 3.12Å
462	V	77	Confident	78.8	Confident	14 Å²	14	58.5 Å²	58.5	9%	0.085	30%	0.299	C	S	.	.	H	α-helix	trans	-51.4	-45.7	173.4	174.6	0	0	0	0	110.5	L418 L419 E464 L465 E466 L485 Y488	L418-V462 HydrophobicContact CD2-CB 4.46Å; L418-V462 HydrophobicContact CD2-CG2 3.48Å; L418-V462 VanDerWaalsContact CD2-CG2 3.48Å; L419-V462 WeakPolarHBondContact O-CG2 2.92Å; L419-V462 PolarHBondContact O-N 3.17Å; V462-E464 VanDerWaalsContact C-N 3.31Å; V462-E464 PolarHBondContact O-N 2.86Å; V462-L465 PolarHBondContact O-N 3.5Å; V462-L465 VanDerWaalsContact O-N 3.16Å; V462-E466 HydrophobicContact CG1-CG 4.32Å; V462-E466 WeakPolarHBondContact O-CG 2.96Å; V462-E466 PolarHBondContact O-N 3.1Å; V462-L485 HydrophobicContact CG1-CD2 4.02Å; V462-Y488 HydrophobicContact CG1-CE1 4.48Å; V462-Y488 HydrophobicContact CG2-CD1 3.99Å; V462-Y488 HydrophobicContact CG2-CD2 4.23Å; V462-Y488 HydrophobicContact CG2-CE1 3.54Å; V462-Y488 HydrophobicContact CG2-CE2 3.79Å; V462-Y488 HydrophobicContact CG2-CG 4.3Å; V462-Y488 VanDerWaalsContact CG2-CZ 3.42Å
463	K	75	Confident	78.5	Confident	100 Å²	100	61.4 Å²	61.4	44%	0.435	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-35	179.6	-172.7	177.6	179.9	-177.3	0	113.3	L461 N467	L461-K463 PolarHBondContact O-N 3.4Å; K463-N467 PolarHBondContact O-N 3.34Å; K463-N467 VanDerWaalsContact O-N 3.12Å; K463-N467 PolarHBondContact O-ND2 2.92Å
464	E	77.8	Confident	78.5	Confident	78 Å²	78	58.5 Å²	58.5	36%	0.364	30%	0.299	S	S	.	.	H	α-helix	trans	-68.9	-41.2	176.5	-71.5	172.8	168.6	0	0	110.7	L461 V462 N467 M468	L461-E464 HydrophobicContact CB-CB 4.28Å; L461-E464 HydrophobicContact CB-CG 3.97Å; L461-E464 HydrophobicContact CD1-CG 4.44Å; L461-E464 PolarHBondContact N-OE2 2.82Å; L461-E464 WeakPolarHBondContact O-CB 3.3Å; L461-E464 PolarHBondContact O-N 2.73Å; V462-E464 VanDerWaalsContact C-N 3.31Å; V462-E464 PolarHBondContact O-N 2.86Å; E464-N467 PolarHBondContact O-N 3.06Å; E464-M468 VanDerWaalsContact O-CG 3.3Å; E464-M468 WeakPolarHBondContact O-CG 3.5Å; E464-M468 PolarHBondContact O-N 3.29Å
465	L	79.8	Confident	78.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-69.9	-35.9	177.2	-66.3	175.9	0	0	0	112.7	F400 L418 L461 V462 N467 M468 Q469 A481 H484 L485	F400-L465 HydrophobicContact CD1-CD2 3.81Å; F400-L465 HydrophobicContact CD2-CD2 3.8Å; F400-L465 HydrophobicContact CE1-CD2 3.82Å; F400-L465 HydrophobicContact CE2-CD2 3.76Å; F400-L465 HydrophobicContact CG-CD2 3.8Å; F400-L465 HydrophobicContact CZ-CD2 3.78Å; L418-L465 HydrophobicContact CD1-CD1 3.14Å; L418-L465 HydrophobicContact CD2-CD1 4.34Å; L418-L465 HydrophobicContact CG-CD1 3.67Å; L461-L465 PolarHBondContact O-N 3.06Å; L461-L465 VanDerWaalsContact O-N 3.12Å; V462-L465 PolarHBondContact O-N 3.5Å; V462-L465 VanDerWaalsContact O-N 3.16Å; L465-N467 VanDerWaalsContact C-N 3.32Å; L465-N467 PolarHBondContact O-N 2.85Å; L465-M468 HydrophobicContact CD2-SD 4.23Å; L465-M468 PolarHBondContact O-N 2.98Å; L465-Q469 WeakPolarHBondContact O-CB 3.41Å; L465-Q469 PolarHBondContact O-N 2.81Å; L465-A481 HydrophobicContact CB-CB 4.39Å; L465-A481 HydrophobicContact CD2-CB 4.07Å; L465-H484 HydrophobicContact CD1-CB 4.43Å; L465-L485 HydrophobicContact CB-CD1 4.2Å; L465-L485 HydrophobicContact CB-CD2 4.05Å; L465-L485 HydrophobicContact CB-CG 4.11Å
466	E	81.1	Confident	78.4	Confident	99 Å²	99	64 Å²	64	46%	0.463	34%	0.338	S	S	.	.	H	α-helix	trans	-60.3	-43	171.2	-73.7	175.3	165.9	0	0	111.2	V462 Q469 A470 L485	V462-E466 HydrophobicContact CG1-CG 4.32Å; V462-E466 WeakPolarHBondContact O-CG 2.96Å; V462-E466 PolarHBondContact O-N 3.1Å; E466-Q469 PolarHBondContact O-N 3.34Å; E466-A470 PolarHBondContact O-N 3.12Å; E466-L485 HydrophobicContact CG-CD1 4.21Å; E466-L485 HydrophobicContact CG-CD2 4.48Å
467	N	80.9	Confident	78.2	Confident	103 Å²	103	65 Å²	65	55%	0.551	34%	0.344	S	S	*	.	H	α-helix	trans	-65.8	-40.6	175.7	-68.2	-23.6	0	0	0	111.9	K463 E464 L465 A470 D471	K463-N467 PolarHBondContact O-N 3.34Å; K463-N467 VanDerWaalsContact O-N 3.12Å; K463-N467 PolarHBondContact O-ND2 2.92Å; E464-N467 PolarHBondContact O-N 3.06Å; L465-N467 VanDerWaalsContact C-N 3.32Å; L465-N467 PolarHBondContact O-N 2.85Å; N467-A470 PolarHBondContact O-N 2.81Å; N467-D471 PolarHBondContact O-N 3.14Å; N467-D471 VanDerWaalsContact O-N 3.17Å
468	M	79.4	Confident	78	Confident	62 Å²	62	66 Å²	66	31%	0.305	35%	0.351	S	S	.	.	H	α-helix	trans	-68.8	-32.9	176.6	-70.9	179.1	-168.8	0	0	112.4	F400 E464 L465 A470 D471 A481	F400-M468 HydrophobicContact CB-SD 4.46Å; F400-M468 HydrophobicContact CD1-SD 4.11Å; E464-M468 VanDerWaalsContact O-CG 3.3Å; E464-M468 WeakPolarHBondContact O-CG 3.5Å; E464-M468 PolarHBondContact O-N 3.29Å; L465-M468 HydrophobicContact CD2-SD 4.23Å; L465-M468 PolarHBondContact O-N 2.98Å; M468-A470 VanDerWaalsContact C-N 3.32Å; M468-D471 PolarHBondContact O-N 3.12Å; M468-A481 HydrophobicContact CB-CB 4.27Å
469	Q	79.9	Confident	78	Confident	76 Å²	76	72.1 Å²	72.1	36%	0.355	38%	0.38	S	S	.	.	H	α-helix	trans	-64.4	-41	172.3	-174.7	-176.1	26.1	0	0	110.8	L465 E466 D471 S478 A481 Q482 L485	L465-Q469 WeakPolarHBondContact O-CB 3.41Å; L465-Q469 PolarHBondContact O-N 2.81Å; E466-Q469 PolarHBondContact O-N 3.34Å; Q469-D471 PolarHBondContact O-N 3.17Å; Q469-S478 PolarHBondContact O-OG 3.09Å; Q469-A481 HydrophobicContact CB-CB 4.48Å; Q469-Q482 HydrophobicContact CG-CB 4.43Å; Q469-L485 HydrophobicContact CB-CD1 4.4Å
470	A	77	Confident	78.1	Confident	79 Å²	79	71.3 Å²	71.3	65%	0.653	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-8.8	178	0	0	0	0	0	114	E466 N467 M468 E472	E466-A470 PolarHBondContact O-N 3.12Å; N467-A470 PolarHBondContact O-N 2.81Å; M468-A470 VanDerWaalsContact C-N 3.32Å; A470-E472 PolarHBondContact O-N 3.36Å
471	D	77.8	Confident	78.3	Confident	59 Å²	59	71.2 Å²	71.2	32%	0.316	38%	0.377	S	S	.	.			trans	-81.5	107.4	179.7	-172.3	6.8	0	0	0	111.7	N467 M468 Q469 Q473	N467-D471 PolarHBondContact O-N 3.14Å; N467-D471 VanDerWaalsContact O-N 3.17Å; M468-D471 PolarHBondContact O-N 3.12Å; Q469-D471 PolarHBondContact O-N 3.17Å; D471-Q473 PolarHBondContact O-N 3.32Å; D471-Q473 WeakPolarHBondContact OD1-CB 3.35Å; D471-Q473 WeakPolarHBondContact OD1-CG 3.23Å; D471-Q473 PolarHBondContact OD1-N 2.62Å
472	E	70.4	Confident	78.6	Confident	187 Å²	187	74.3 Å²	74.3	87%	0.874	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.3	178.1	-64.8	-176.2	169.8	0	0	113.4	A470	A470-E472 PolarHBondContact O-N 3.36Å
473	Q	71.2	Confident	78.9	Confident	164 Å²	164	76.2 Å²	76.2	77%	0.766	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-26.6	-175.7	-62	-173.9	16.3	0	0	113.2	D471	D471-Q473 PolarHBondContact O-N 3.32Å; D471-Q473 WeakPolarHBondContact OD1-CB 3.35Å; D471-Q473 WeakPolarHBondContact OD1-CG 3.23Å; D471-Q473 PolarHBondContact OD1-N 2.62Å
474	N	77.2	Confident	79.3	Confident	81 Å²	81	71.4 Å²	71.4	43%	0.433	38%	0.379	S	S	.	.			trans	-128.7	80.2	-177.3	-73.5	-50.1	0	0	0	111.7	A476 L477 S478	N474-A476 PolarHBondContact O-N 2.63Å; N474-L477 HydrophobicContact CB-CB 4.08Å; N474-L477 HydrophobicContact CB-CD1 4.06Å; N474-L477 HydrophobicContact CB-CG 4.35Å; N474-L477 PolarHBondContact O-N 3.17Å; N474-S478 PolarHBondContact O-N 3.17Å
475	P	77.2	Confident	79.5	Confident	98 Å²	98	69.2 Å²	69.2	64%	0.636	37%	0.37	S	S	*	.	H	α-helix	trans	-60.8	-32.6	-175.2	23	-33.4	0	0	0	113	S478 E479	P475-S478 PolarHBondContact O-N 2.78Å; P475-E479 PolarHBondContact O-N 2.83Å
476	A	77.4	Confident	79.7	Confident	61 Å²	61	75.1 Å²	75.1	50%	0.504	40%	0.398	S	S	.	.	H	α-helix	trans	-68.6	-33.8	177.2	0	0	0	0	0	113.1	N474 K480	N474-A476 PolarHBondContact O-N 2.63Å; A476-K480 VanDerWaalsContact O-CG 3.25Å; A476-K480 WeakPolarHBondContact O-CG 3.36Å; A476-K480 PolarHBondContact O-N 3.42Å
477	L	79.9	Confident	79.8	Confident	38 Å²	38	75 Å²	75	20%	0.199	40%	0.396	C	S	.	.	H	α-helix	trans	-78.9	-35.9	175.4	-72.5	173.9	0	0	0	111.2	A401 N474 K480 A481	A401-L477 HydrophobicContact CB-CD1 3.9Å; A401-L477 HydrophobicContact CB-CD2 4Å; N474-L477 HydrophobicContact CB-CB 4.08Å; N474-L477 HydrophobicContact CB-CD1 4.06Å; N474-L477 HydrophobicContact CB-CG 4.35Å; N474-L477 PolarHBondContact O-N 3.17Å; L477-K480 PolarHBondContact O-N 3.29Å; L477-A481 WeakPolarHBondContact O-CB 3.38Å; L477-A481 PolarHBondContact O-N 3.24Å
478	S	80.2	Confident	79.7	Confident	24 Å²	24	72.5 Å²	72.5	17%	0.168	38%	0.379	C	S	.	.	H	α-helix	trans	-59.9	-44.6	174.7	176.1	0	0	0	0	111.8	Q469 N474 P475 A481 Q482	Q469-S478 PolarHBondContact O-OG 3.09Å; N474-S478 PolarHBondContact O-N 3.17Å; P475-S478 PolarHBondContact O-N 2.78Å; S478-A481 PolarHBondContact O-N 3.29Å; S478-Q482 WeakPolarHBondContact O-CB 3.43Å; S478-Q482 PolarHBondContact O-N 3.09Å
479	E	82.9	Confident	79.5	Confident	129 Å²	129	72.5 Å²	72.5	60%	0.603	39%	0.385	S	S	*	.	H	α-helix	trans	-63.2	-43.5	175.3	-173	177.6	-168.5	0	0	112	P475 A481 Q482 L483	P475-E479 PolarHBondContact O-N 2.83Å; E479-A481 PolarHBondContact O-N 2.93Å; E479-Q482 PolarHBondContact O-N 3.42Å; E479-L483 WeakPolarHBondContact O-CG 3.25Å; E479-L483 PolarHBondContact O-N 3.41Å
480	K	83.1	Confident	78.7	Confident	29 Å²	29	74.3 Å²	74.3	13%	0.126	39%	0.392	C	S	.	.	H	α-helix	trans	-61.4	-44.7	175.7	-69.1	-179.6	-171.1	-168.9	0	111.6	F400 F404 A476 L477 L483 H484 P499	F400-K480 HydrophobicContact CE1-CB 4.19Å; F400-K480 HydrophobicContact CZ-CB 4.34Å; F404-K480 HydrophobicContact CB-CD 4.41Å; F404-K480 HydrophobicContact CD1-CD 4.15Å; F404-K480 HydrophobicContact CD2-CD 4.36Å; F404-K480 HydrophobicContact CG-CD 4.03Å; A476-K480 VanDerWaalsContact O-CG 3.25Å; A476-K480 WeakPolarHBondContact O-CG 3.36Å; A476-K480 PolarHBondContact O-N 3.42Å; L477-K480 PolarHBondContact O-N 3.29Å; K480-L483 PolarHBondContact O-N 2.84Å; K480-H484 PolarHBondContact O-N 3.35Å; K480-H484 PolarHBondContact O-ND1 3.29Å; K480-P499 PolarHBondContact NZ-O 2.78Å
481	A	82.1	Confident	78	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-62.7	-42.7	177.5	0	0	0	0	0	111.5	F400 L465 M468 Q469 L477 S478 E479 L483 H484 L485	F400-A481 HydrophobicContact CE1-CB 4.48Å; L465-A481 HydrophobicContact CB-CB 4.39Å; L465-A481 HydrophobicContact CD2-CB 4.07Å; M468-A481 HydrophobicContact CB-CB 4.27Å; Q469-A481 HydrophobicContact CB-CB 4.48Å; L477-A481 WeakPolarHBondContact O-CB 3.38Å; L477-A481 PolarHBondContact O-N 3.24Å; S478-A481 PolarHBondContact O-N 3.29Å; E479-A481 PolarHBondContact O-N 2.93Å; A481-L483 PolarHBondContact O-N 3.44Å; A481-H484 PolarHBondContact O-N 2.82Å; A481-L485 WeakPolarHBondContact O-CG 3.15Å; A481-L485 PolarHBondContact O-N 3.14Å
482	Q	84.3	Confident	77.9	Confident	80 Å²	80	68 Å²	68	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-58.5	-48.6	175.8	179	178.6	-12.3	0	0	111.9	Q469 S478 E479 H484 L485 E486	Q469-Q482 HydrophobicContact CG-CB 4.43Å; S478-Q482 WeakPolarHBondContact O-CB 3.43Å; S478-Q482 PolarHBondContact O-N 3.09Å; E479-Q482 PolarHBondContact O-N 3.42Å; Q482-H484 PolarHBondContact O-N 3.47Å; Q482-L485 PolarHBondContact O-N 2.73Å; Q482-L485 VanDerWaalsContact O-N 3.14Å; Q482-E486 HydrophobicContact CG-CG 4.39Å; Q482-E486 PolarHBondContact NE2-OE1 3.26Å; Q482-E486 WeakPolarHBondContact O-CG 3.33Å; Q482-E486 PolarHBondContact O-N 2.6Å
483	L	83.4	Confident	78.3	Confident	53 Å²	53	59.3 Å²	59.3	28%	0.277	31%	0.307	S	S	.	.	H	α-helix	trans	-57.9	-37.7	179.2	-70.9	171.9	0	0	0	111.9	E479 K480 A481 I503	E479-L483 WeakPolarHBondContact O-CG 3.25Å; E479-L483 PolarHBondContact O-N 3.41Å; K480-L483 PolarHBondContact O-N 2.84Å; A481-L483 PolarHBondContact O-N 3.44Å; L483-I503 WeakPolarHBondContact O-CD1 3.47Å
484	H	82.1	Confident	78.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-71	-40.4	177.4	-72.7	65.3	0	0	0	112.4	F400 F404 L418 L465 K480 A481 Q482 K487 Y488 L495	F400-H484 AromaticContact CE2-CD2 3.89Å; F400-H484 AromaticContact CZ-ND1 3.97Å; F404-H484 AromaticContact CZ-CE1 3.51Å; F404-H484 AromaticContact CZ-NE2 3.57Å; L418-H484 HydrophobicContact CD1-CB 3.69Å; L465-H484 HydrophobicContact CD1-CB 4.43Å; K480-H484 PolarHBondContact O-N 3.35Å; K480-H484 PolarHBondContact O-ND1 3.29Å; A481-H484 PolarHBondContact O-N 2.82Å; Q482-H484 PolarHBondContact O-N 3.47Å; H484-K487 PolarHBondContact O-N 2.64Å; H484-Y488 PolarHBondContact O-N 3.18Å; H484-L495 HydrophobicContact CB-CD1 4.18Å; H484-L495 VanDerWaalsContact CD2-CD1 3.48Å; H484-L495 WeakPolarHBondContact CD2-CD1 3.42Å
485	L	81.8	Confident	79.3	Confident	32 Å²	32	47.7 Å²	47.7	17%	0.168	25%	0.25	C	C	.	.	H	α-helix	trans	-68.1	-34.4	176.9	-71.1	171.9	0	0	0	112.7	V462 L465 E466 Q469 A481 Q482 K487 Y488	V462-L485 HydrophobicContact CG1-CD2 4.02Å; L465-L485 HydrophobicContact CB-CD1 4.2Å; L465-L485 HydrophobicContact CB-CD2 4.05Å; L465-L485 HydrophobicContact CB-CG 4.11Å; E466-L485 HydrophobicContact CG-CD1 4.21Å; E466-L485 HydrophobicContact CG-CD2 4.48Å; Q469-L485 HydrophobicContact CB-CD1 4.4Å; A481-L485 WeakPolarHBondContact O-CG 3.15Å; A481-L485 PolarHBondContact O-N 3.14Å; Q482-L485 PolarHBondContact O-N 2.73Å; Q482-L485 VanDerWaalsContact O-N 3.14Å; L485-K487 PolarHBondContact O-N 2.85Å; L485-Y488 WeakPolarHBondContact O-CB 3.41Å; L485-Y488 PolarHBondContact O-N 2.94Å
486	E	85.1	Confident	79.7	Confident	124 Å²	124	43 Å²	43	58%	0.579	22%	0.22	S	C	*	.	H	α-helix	trans	-62.3	-26.5	177.5	-77.6	178.4	-170.3	0	0	113.5	Q482	Q482-E486 HydrophobicContact CG-CG 4.39Å; Q482-E486 PolarHBondContact NE2-OE1 3.26Å; Q482-E486 WeakPolarHBondContact O-CG 3.33Å; Q482-E486 PolarHBondContact O-N 2.6Å
487	K	82.3	Confident	80	Confident	97 Å²	97	40.1 Å²	40.1	42%	0.422	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-5.6	178.9	-64.9	-57.9	-173.9	179	0	113.8	H484 L485 S489 L495 I503	H484-K487 PolarHBondContact O-N 2.64Å; L485-K487 PolarHBondContact O-N 2.85Å; K487-S489 PolarHBondContact O-N 3.47Å; K487-L495 HydrophobicContact CB-CD2 4.23Å; K487-I503 HydrophobicContact CB-CD1 3.96Å; K487-I503 HydrophobicContact CG-CD1 3.57Å
488	Y	79.6	Confident	80.2	Confident	50 Å²	50	39 Å²	39	20%	0.196	19%	0.19	C	C	.	.			trans	-71.1	129.7	-176.8	176.1	-111.1	0	0	0	111.8	L418 W420 V462 H484 L485 P491 E493	L418-Y488 HydrophobicContact CB-CD2 4.38Å; L418-Y488 HydrophobicContact CD2-CD1 4.38Å; L418-Y488 HydrophobicContact CD2-CD2 3.17Å; L418-Y488 HydrophobicContact CD2-CE2 3.72Å; L418-Y488 HydrophobicContact CD2-CG 3.54Å; L418-Y488 HydrophobicContact CG-CD2 4.33Å; W420-Y488 WeakPolarHBondContact CB-OH 3.45Å; V462-Y488 HydrophobicContact CG1-CE1 4.48Å; V462-Y488 HydrophobicContact CG2-CD1 3.99Å; V462-Y488 HydrophobicContact CG2-CD2 4.23Å; V462-Y488 HydrophobicContact CG2-CE1 3.54Å; V462-Y488 HydrophobicContact CG2-CE2 3.79Å; V462-Y488 HydrophobicContact CG2-CG 4.3Å; V462-Y488 VanDerWaalsContact CG2-CZ 3.42Å; H484-Y488 PolarHBondContact O-N 3.18Å; L485-Y488 WeakPolarHBondContact O-CB 3.41Å; L485-Y488 PolarHBondContact O-N 2.94Å; Y488-P491 PolarHBondContact OH-O 3.15Å; Y488-P491 VanDerWaalsContact OH-O 3.09Å; Y488-E493 HydrophobicContact CD2-CB 3.88Å
489	S	75.1	Confident	80.1	Confident	62 Å²	62	39.1 Å²	39.1	43%	0.434	19%	0.19	S	C	.	.			trans	-124.1	136.8	167.4	173.3	0	0	0	0	109.6	K487 N508	K487-S489 PolarHBondContact O-N 3.47Å; S489-N508 VanDerWaalsContact CB-ND2 3.33Å; S489-N508 WeakPolarHBondContact CB-ND2 3.32Å; S489-N508 PolarHBondContact O-ND2 3.44Å; S489-N508 PolarHBondContact OG-ND2 3.01Å
490	F	62.3	Low	79.8	Confident	114 Å²	114	37.5 Å²	37.5	50%	0.5	19%	0.185	S	C	.	.	S	Bend	trans	-61.5	142.8	-178	178.7	-89.5	0	0	0	111.8	W420	W420-F490 HydrophobicContact CB-CD2 4.37Å; W420-F490 HydrophobicContact CB-CE2 4.21Å; W420-F490 HydrophobicContact CD2-CE2 4.04Å; W420-F490 HydrophobicContact CG-CD2 4.24Å; W420-F490 AromaticContact CG-CE2 3.88Å; W420-F490 HydrophobicContact CG-CE2 3.88Å
491	P	63.2	Low	79.4	Confident	4 Å²	4	36.1 Å²	36.1	3%	0.026	18%	0.179	C	C	.	.	S	Bend	cis	-99.4	-13.6	-2.2	35.2	-34.1	0	0	0	115.6	W420 A431 S433 Y488 N510	W420-P491 PolarHBondContact N-O 3.1Å; W420-P491 VanDerWaalsContact N-O 3.13Å; A431-P491 HydrophobicContact CB-CB 3.63Å; A431-P491 HydrophobicContact CB-CG 3.84Å; S433-P491 VanDerWaalsContact OG-CG 3.23Å; S433-P491 WeakPolarHBondContact OG-CG 3.46Å; Y488-P491 PolarHBondContact OH-O 3.15Å; Y488-P491 VanDerWaalsContact OH-O 3.09Å; P491-N510 WeakPolarHBondContact CD-ND2 3.41Å
492	V	74.7	Confident	79.4	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	130	-176.9	178.9	0	0	0	0	109.6	I417 L418 L419 L437 N508 A509	I417-V492 HydrophobicContact CG2-CG1 3.98Å; L418-V492 WeakPolarHBondContact O-CA 3.49Å; L419-V492 HydrophobicContact CD2-CB 4.2Å; L419-V492 HydrophobicContact CD2-CG1 3.57Å; L419-V492 HydrophobicContact CD2-CG2 3.67Å; L419-V492 HydrophobicContact CG-CG1 4.41Å; L437-V492 HydrophobicContact CD1-CG1 3.96Å; V492-N508 PolarHBondContact O-ND2 3.37Å; V492-A509 HydrophobicContact CB-CB 3.66Å; V492-A509 HydrophobicContact CG1-CB 3.98Å; V492-A509 WeakPolarHBondContact O-CB 3.45Å; V492-A509 PolarHBondContact O-N 3.34Å
493	E	80.3	Confident	79.3	Confident	4 Å²	4	36.1 Å²	36.1	2%	0.019	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.6	175.6	-165.2	72.7	-158.9	0	0	109.7	L418 Y488 L495 H506 I507 N508	L418-E493 PolarHBondContact N-O 2.67Å; L418-E493 PolarHBondContact O-N 3.42Å; Y488-E493 HydrophobicContact CD2-CB 3.88Å; E493-L495 HydrophobicContact CG-CD2 3.79Å; E493-L495 HydrophobicContact CG-CG 4.24Å; E493-H506 IonicContact OE1-CE1 3.87Å; E493-H506 IonicContact OE1-CG 2.71Å; E493-H506 IonicContact OE1-ND1 3.34Å; E493-H506 PolarHBondContact OE1-ND1 2.84Å; E493-I507 PolarHBondContact OE1-N 2.8Å; E493-N508 PolarHBondContact OE1-N 2.77Å; E493-N508 VanDerWaalsContact OE2-CA 3.23Å; E493-N508 WeakPolarHBondContact OE2-CA 3.34Å; E493-N508 VanDerWaalsContact OE2-CB 3.26Å; E493-N508 WeakPolarHBondContact OE2-CB 3.05Å; E493-N508 PolarHBondContact OE2-ND2 3.09Å
494	M	83.4	Confident	79.3	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126.2	177	-63.1	174.3	-62.7	0	0	108.8	I417 L437 H506 I507 F512 Y541 F544	I417-M494 HydrophobicContact CG2-CG 4.25Å; L437-M494 HydrophobicContact CD1-CE 4.03Å; L437-M494 HydrophobicContact CD1-CG 4.25Å; L437-M494 HydrophobicContact CD1-SD 3.43Å; L437-M494 WeakPolarHBondContact CD1-SD 3.31Å; L437-M494 HydrophobicContact CD2-CE 3.8Å; L437-M494 HydrophobicContact CD2-SD 3.53Å; L437-M494 VanDerWaalsContact CD2-SD 3.53Å; L437-M494 HydrophobicContact CG-SD 4.1Å; M494-H506 CarbonylContact O-C 3.56Å; M494-H506 VanDerWaalsContact O-CA 3.23Å; M494-H506 WeakPolarHBondContact O-CA 3.49Å; M494-I507 HydrophobicContact CB-CG2 4.03Å; M494-I507 HydrophobicContact CE-CG2 3.56Å; M494-I507 PolarHBondContact N-O 3.39Å; M494-I507 PolarHBondContact O-N 3.45Å; M494-F512 HydrophobicContact CE-CB 4.19Å; M494-F512 HydrophobicContact CE-CD1 4.44Å; M494-F512 HydrophobicContact CE-CG 4.13Å; M494-Y541 HydrophobicContact CE-CD2 4.36Å; M494-Y541 HydrophobicContact CE-CE2 4.02Å; M494-Y541 HydrophobicContact SD-CD2 4.25Å; M494-Y541 HydrophobicContact SD-CE2 3.43Å; M494-Y541 WeakPolarHBondContact SD-CE2 3.37Å; M494-F544 HydrophobicContact CB-CE1 4.41Å; M494-F544 HydrophobicContact CB-CZ 4.38Å
495	L	85.4	Confident	79.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.3	-169.4	-56.8	170.5	0	0	0	110.7	S416 L418 H484 K487 E493 I503 H506	S416-L495 PolarHBondContact N-O 3.13Å; S416-L495 WeakPolarHBondContact O-CA 3.37Å; S416-L495 WeakPolarHBondContact O-CB 3.4Å; S416-L495 PolarHBondContact O-N 3.08Å; L418-L495 HydrophobicContact CB-CD1 4.31Å; L418-L495 HydrophobicContact CD1-CD1 4.1Å; H484-L495 HydrophobicContact CB-CD1 4.18Å; H484-L495 VanDerWaalsContact CD2-CD1 3.48Å; H484-L495 WeakPolarHBondContact CD2-CD1 3.42Å; K487-L495 HydrophobicContact CB-CD2 4.23Å; E493-L495 HydrophobicContact CG-CD2 3.79Å; E493-L495 HydrophobicContact CG-CG 4.24Å; L495-I503 HydrophobicContact CD1-CD1 4.49Å; L495-I503 HydrophobicContact CD2-CD1 4.36Å; L495-I503 HydrophobicContact CD2-CG2 4.15Å; L495-H506 HydrophobicContact CD2-CB 3.26Å
496	V	84.6	Confident	79.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.4	165.4	177.3	0	0	0	0	107.6	L413 V414 F455 V504 H505 F544 L545	L413-V496 HydrophobicContact CB-CG1 4.5Å; L413-V496 HydrophobicContact CD1-CG1 4.05Å; V414-V496 WeakPolarHBondContact O-CA 3.39Å; F455-V496 HydrophobicContact CE1-CG1 3.86Å; F455-V496 HydrophobicContact CE1-CG2 4.36Å; V496-V504 PolarHBondContact O-N 3.26Å; V496-H505 HydrophobicContact CB-CB 4.15Å; V496-H505 PolarHBondContact N-O 2.87Å; V496-H505 PolarHBondContact O-N 2.63Å; V496-F544 HydrophobicContact CG2-CE1 3.89Å; V496-F544 HydrophobicContact CG2-CZ 3.85Å; V496-L545 HydrophobicContact CG2-CD2 4.31Å
497	A	84.8	Confident	79.3	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	152	-177.3	0	0	0	0	0	111.9	F404 V414 T502	F404-A497 HydrophobicContact CE1-CB 4.25Å; F404-A497 HydrophobicContact CZ-CB 4.41Å; V414-A497 HydrophobicContact CB-CB 4.5Å; V414-A497 PolarHBondContact N-O 3.37Å; V414-A497 PolarHBondContact O-N 3.13Å; A497-T502 CarbonylContact C-O 3.57Å; A497-T502 VanDerWaalsContact CA-O 3.31Å; A497-T502 WeakPolarHBondContact CA-O 3.37Å
498	L	82.9	Confident	79.2	Confident	14 Å²	14	29.6 Å²	29.6	7%	0.073	15%	0.154	C	C	.	.			trans	-75.5	161.1	167.4	-73.3	170.5	0	0	0	110.3	L413 N500 G501 T502 V504 A552 Y555 I556	L413-L498 HydrophobicContact CD2-CD2 3.55Å; L413-L498 HydrophobicContact CD2-CG 4.48Å; L498-N500 WeakPolarHBondContact CB-OD1 3.26Å; L498-N500 PolarHBondContact O-N 3.25Å; L498-N500 VanDerWaalsContact O-N 3.09Å; L498-G501 PolarHBondContact O-N 3.01Å; L498-T502 PolarHBondContact N-O 3.01Å; L498-V504 HydrophobicContact CD1-CG2 4.17Å; L498-V504 HydrophobicContact CD2-CG2 4.44Å; L498-V504 HydrophobicContact CG-CG2 3.72Å; L498-A552 HydrophobicContact CD2-CB 4.33Å; L498-Y555 HydrophobicContact CD1-CG 4.31Å; L498-I556 HydrophobicContact CD2-CD1 4.43Å; L498-I556 HydrophobicContact CD2-CG1 4.34Å
499	P	79.4	Confident	78.8	Confident	26 Å²	26	27.2 Å²	27.2	17%	0.169	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.8	176.2	-27	35	0	0	0	114.8	A407 E408 K412 K480 G501	A407-P499 HydrophobicContact CB-CB 4.43Å; A407-P499 HydrophobicContact CB-CG 4.28Å; E408-P499 HydrophobicContact CB-CB 4.06Å; K412-P499 WeakPolarHBondContact O-CG 3.47Å; K480-P499 PolarHBondContact NZ-O 2.78Å; P499-G501 PolarHBondContact O-N 3.37Å
500	N	76.5	Confident	78.5	Confident	96 Å²	96	27.5 Å²	27.5	51%	0.513	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-9.9	175.5	70	-7.2	0	0	0	113.5	L498 T502	L498-N500 WeakPolarHBondContact CB-OD1 3.26Å; L498-N500 PolarHBondContact O-N 3.25Å; L498-N500 VanDerWaalsContact O-N 3.09Å; N500-T502 PolarHBondContact ND2-OG1 3.16Å; N500-T502 VanDerWaalsContact ND2-OG1 3.14Å; N500-T502 WeakPolarHBondContact OD1-CB 3.16Å; N500-T502 PolarHBondContact OD1-N 3.5Å; N500-T502 PolarHBondContact OD1-OG1 2.79Å; N500-T502 VanDerWaalsContact OD1-OG1 3.13Å
501	G	74.1	Confident	78.9	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	96.8	-5.6	-177.8	0	0	0	0	0	115.5	L498 P499 I503	L498-G501 PolarHBondContact O-N 3.01Å; P499-G501 PolarHBondContact O-N 3.37Å; G501-I503 PolarHBondContact O-N 3.03Å
502	T	81.6	Confident	79.3	Confident	51 Å²	51	28.4 Å²	28.4	31%	0.313	14%	0.142	S	C	.	.			trans	-68.9	127.3	178	-52.8	0	0	0	0	110.5	A497 L498 N500	A497-T502 CarbonylContact C-O 3.57Å; A497-T502 VanDerWaalsContact CA-O 3.31Å; A497-T502 WeakPolarHBondContact CA-O 3.37Å; L498-T502 PolarHBondContact N-O 3.01Å; N500-T502 PolarHBondContact ND2-OG1 3.16Å; N500-T502 VanDerWaalsContact ND2-OG1 3.14Å; N500-T502 WeakPolarHBondContact OD1-CB 3.16Å; N500-T502 PolarHBondContact OD1-N 3.5Å; N500-T502 PolarHBondContact OD1-OG1 2.79Å; N500-T502 VanDerWaalsContact OD1-OG1 3.13Å
503	I	82.8	Confident	78.9	Confident	29 Å²	29	30 Å²	30	15%	0.149	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	121.9	179.8	-60.7	168.6	0	0	0	109.5	L483 K487 L495 G501 H506	L483-I503 WeakPolarHBondContact O-CD1 3.47Å; K487-I503 HydrophobicContact CB-CD1 3.96Å; K487-I503 HydrophobicContact CG-CD1 3.57Å; L495-I503 HydrophobicContact CD1-CD1 4.49Å; L495-I503 HydrophobicContact CD2-CD1 4.36Å; L495-I503 HydrophobicContact CD2-CG2 4.15Å; G501-I503 PolarHBondContact O-N 3.03Å; I503-H506 HydrophobicContact CG2-CB 4.34Å
504	V	83.6	Confident	78.2	Confident	16 Å²	16	34.7 Å²	34.7	10%	0.097	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-38.8	-178.2	-180	0	0	0	0	110.9	V496 L498 K551 A552 Y555	V496-V504 PolarHBondContact O-N 3.26Å; L498-V504 HydrophobicContact CD1-CG2 4.17Å; L498-V504 HydrophobicContact CD2-CG2 4.44Å; L498-V504 HydrophobicContact CG-CG2 3.72Å; V504-K551 HydrophobicContact CG1-CB 3.38Å; V504-A552 HydrophobicContact CG1-CB 4.19Å; V504-A552 HydrophobicContact CG2-CB 4.4Å; V504-Y555 HydrophobicContact CG1-CD2 4.45Å; V504-Y555 HydrophobicContact CG1-CE2 4.47Å; V504-Y555 HydrophobicContact CG2-CD2 4.41Å
505	H	83.1	Confident	77.2	Confident	30 Å²	30	39.2 Å²	39.2	14%	0.139	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	142.3	179	-153.4	-41.1	0	0	0	109.9	V496 F544 E547 K551	V496-H505 HydrophobicContact CB-CB 4.15Å; V496-H505 PolarHBondContact N-O 2.87Å; V496-H505 PolarHBondContact O-N 2.63Å; H505-F544 HydrophobicContact CB-CE2 4.03Å; H505-F544 AromaticContact CE1-CD2 3.63Å; H505-F544 AromaticContact CE1-CE2 3.84Å; H505-F544 AromaticContact CG-CD2 3.89Å; H505-F544 AromaticContact CG-CE2 3.61Å; H505-F544 AromaticContact ND1-CD2 3.54Å; H505-F544 AromaticContact ND1-CE2 3.26Å; H505-F544 VanDerWaalsContact ND1-CE2 3.26Å; H505-F544 WeakPolarHBondContact ND1-CE2 3.45Å; H505-E547 IonicContact NE2-OE2 3.63Å; H505-E547 PolarHBondContact NE2-OE2 3.11Å; H505-K551 PolarHBondContact CD2-NZ 3.34Å; H505-K551 PolarHBondContact NE2-NZ 3.32Å
506	H	84.8	Confident	75.9	Confident	80 Å²	80	40.3 Å²	40.3	37%	0.37	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	156.2	168.4	70.1	95.5	0	0	0	111	E493 M494 L495 I503	E493-H506 IonicContact OE1-CE1 3.87Å; E493-H506 IonicContact OE1-CG 2.71Å; E493-H506 IonicContact OE1-ND1 3.34Å; E493-H506 PolarHBondContact OE1-ND1 2.84Å; M494-H506 CarbonylContact O-C 3.56Å; M494-H506 VanDerWaalsContact O-CA 3.23Å; M494-H506 WeakPolarHBondContact O-CA 3.49Å; L495-H506 HydrophobicContact CD2-CB 3.26Å; I503-H506 HydrophobicContact CG2-CB 4.34Å
507	I	81.3	Confident	74.5	Confident	20 Å²	20	42.8 Å²	42.8	10%	0.103	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	134.4	170.2	-170.5	170.6	0	0	0	109.6	E493 M494 Y511 F512 F544	E493-I507 PolarHBondContact OE1-N 2.8Å; M494-I507 HydrophobicContact CB-CG2 4.03Å; M494-I507 HydrophobicContact CE-CG2 3.56Å; M494-I507 PolarHBondContact N-O 3.39Å; M494-I507 PolarHBondContact O-N 3.45Å; I507-Y511 HydrophobicContact CD1-CD1 4.32Å; I507-Y511 HydrophobicContact CG1-CD1 4.19Å; I507-F512 HydrophobicContact CD1-CB 3.96Å; I507-F512 HydrophobicContact CD1-CD2 4.15Å; I507-F512 HydrophobicContact CG1-CB 4.26Å; I507-F544 HydrophobicContact CB-CD2 4.12Å; I507-F544 HydrophobicContact CB-CE2 3.94Å; I507-F544 HydrophobicContact CG2-CD1 4.45Å; I507-F544 HydrophobicContact CG2-CD2 3.7Å; I507-F544 HydrophobicContact CG2-CE1 4.31Å; I507-F544 HydrophobicContact CG2-CE2 3.51Å; I507-F544 HydrophobicContact CG2-CG 4.17Å; I507-F544 HydrophobicContact CG2-CZ 3.84Å
508	N	79.9	Confident	72.7	Confident	22 Å²	22	50.3 Å²	50.3	12%	0.118	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	138.9	174.9	-171.4	-94.5	0	0	0	110.8	S489 V492 E493 N510 Y511 F512	S489-N508 VanDerWaalsContact CB-ND2 3.33Å; S489-N508 WeakPolarHBondContact CB-ND2 3.32Å; S489-N508 PolarHBondContact O-ND2 3.44Å; S489-N508 PolarHBondContact OG-ND2 3.01Å; V492-N508 PolarHBondContact O-ND2 3.37Å; E493-N508 PolarHBondContact OE1-N 2.77Å; E493-N508 VanDerWaalsContact OE2-CA 3.23Å; E493-N508 WeakPolarHBondContact OE2-CA 3.34Å; E493-N508 VanDerWaalsContact OE2-CB 3.26Å; E493-N508 WeakPolarHBondContact OE2-CB 3.05Å; E493-N508 PolarHBondContact OE2-ND2 3.09Å; N508-N510 VanDerWaalsContact C-N 3.34Å; N508-N510 PolarHBondContact O-N 2.84Å; N508-N510 WeakPolarHBondContact OD1-CB 3.28Å; N508-N510 PolarHBondContact OD1-N 3.47Å; N508-Y511 PolarHBondContact O-N 2.97Å; N508-F512 WeakPolarHBondContact O-CB 3.33Å; N508-F512 PolarHBondContact O-N 2.88Å
509	A	70.6	Confident	70.5	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65	-33.8	-177.5	0	0	0	0	0	113.3	L437 V492 F512 L513	L437-A509 HydrophobicContact CD1-CB 3.64Å; V492-A509 HydrophobicContact CB-CB 3.66Å; V492-A509 HydrophobicContact CG1-CB 3.98Å; V492-A509 WeakPolarHBondContact O-CB 3.45Å; V492-A509 PolarHBondContact O-N 3.34Å; A509-F512 PolarHBondContact O-N 3.4Å; A509-L513 WeakPolarHBondContact O-CB 3.25Å; A509-L513 VanDerWaalsContact O-CG 3.26Å; A509-L513 WeakPolarHBondContact O-CG 3.35Å; A509-L513 PolarHBondContact O-N 3.05Å
510	N	69.4	Low	68.5	Low	68 Å²	68	60.5 Å²	60.5	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-66.1	-43	175.6	-67.5	-28.7	0	0	0	111.1	S433 P491 N508 L513 D514	S433-N510 WeakPolarHBondContact CB-OD1 3.17Å; P491-N510 WeakPolarHBondContact CD-ND2 3.41Å; N508-N510 VanDerWaalsContact C-N 3.34Å; N508-N510 PolarHBondContact O-N 2.84Å; N508-N510 WeakPolarHBondContact OD1-CB 3.28Å; N508-N510 PolarHBondContact OD1-N 3.47Å; N510-L513 PolarHBondContact O-N 3.23Å; N510-D514 WeakPolarHBondContact O-CB 3.41Å; N510-D514 PolarHBondContact O-N 2.9Å
511	Y	71.1	Confident	66.5	Low	138 Å²	138	63.7 Å²	63.7	54%	0.541	33%	0.327	S	S	.	.	H	α-helix	trans	-65.2	-41.6	177.4	-176.7	-106.5	0	0	0	111.8	I507 N508 L513 D514 Q515	I507-Y511 HydrophobicContact CD1-CD1 4.32Å; I507-Y511 HydrophobicContact CG1-CD1 4.19Å; N508-Y511 PolarHBondContact O-N 2.97Å; Y511-L513 VanDerWaalsContact C-N 3.33Å; Y511-L513 PolarHBondContact O-N 3.3Å; Y511-D514 PolarHBondContact O-N 3.42Å; Y511-Q515 HydrophobicContact CD1-CG 4.46Å; Y511-Q515 VanDerWaalsContact CE1-CD 3.46Å; Y511-Q515 HydrophobicContact CE1-CG 4.15Å; Y511-Q515 WeakPolarHBondContact O-CG 3.31Å; Y511-Q515 PolarHBondContact O-N 2.97Å; Y511-Q515 PolarHBondContact OH-NE2 3.47Å
512	F	70.3	Confident	64.7	Low	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-58.8	-44.8	172.6	172.9	-97.4	0	0	0	111.8	L437 V441 M494 I507 N508 A509 Q515 T516 S537 T540 Y541	L437-F512 HydrophobicContact CD2-CD1 3.75Å; L437-F512 HydrophobicContact CD2-CE1 3.66Å; L437-F512 HydrophobicContact CD2-CZ 4.5Å; V441-F512 HydrophobicContact CG2-CE1 3.69Å; V441-F512 HydrophobicContact CG2-CZ 3.49Å; V441-F512 VanDerWaalsContact CG2-CZ 3.49Å; M494-F512 HydrophobicContact CE-CB 4.19Å; M494-F512 HydrophobicContact CE-CD1 4.44Å; M494-F512 HydrophobicContact CE-CG 4.13Å; I507-F512 HydrophobicContact CD1-CB 3.96Å; I507-F512 HydrophobicContact CD1-CD2 4.15Å; I507-F512 HydrophobicContact CG1-CB 4.26Å; N508-F512 WeakPolarHBondContact O-CB 3.33Å; N508-F512 PolarHBondContact O-N 2.88Å; A509-F512 PolarHBondContact O-N 3.4Å; F512-Q515 PolarHBondContact O-N 3.3Å; F512-T516 HydrophobicContact CD2-CG2 4.33Å; F512-T516 HydrophobicContact CE1-CG2 4.32Å; F512-T516 HydrophobicContact CE2-CG2 3.98Å; F512-T516 HydrophobicContact CZ-CG2 3.97Å; F512-T516 WeakPolarHBondContact O-CB 3.1Å; F512-T516 WeakPolarHBondContact O-CG2 3.18Å; F512-T516 PolarHBondContact O-N 2.95Å; F512-T516 PolarHBondContact O-OG1 3.12Å; F512-S537 VanDerWaalsContact CZ-O 3.28Å; F512-S537 WeakPolarHBondContact CZ-O 3.4Å; F512-T540 HydrophobicContact CD2-CG2 4.05Å; F512-T540 HydrophobicContact CE2-CG2 3.81Å; F512-Y541 HydrophobicContact CE2-CD2 4.38Å
513	L	66.4	Low	62.5	Low	34 Å²	34	76.9 Å²	76.9	18%	0.178	39%	0.388	C	S	.	.	H	α-helix	trans	-67.7	-38.5	177	-71.4	-176.9	0	0	0	112.9	S433 T436 A509 N510 Y511 Q515 T516 A517	S433-L513 VanDerWaalsContact CA-CD1 3.44Å; T436-L513 HydrophobicContact CG2-CD1 4.33Å; T436-L513 HydrophobicContact CG2-CD2 3.42Å; T436-L513 VanDerWaalsContact CG2-CD2 3.42Å; A509-L513 WeakPolarHBondContact O-CB 3.25Å; A509-L513 VanDerWaalsContact O-CG 3.26Å; A509-L513 WeakPolarHBondContact O-CG 3.35Å; A509-L513 PolarHBondContact O-N 3.05Å; N510-L513 PolarHBondContact O-N 3.23Å; Y511-L513 VanDerWaalsContact C-N 3.33Å; Y511-L513 PolarHBondContact O-N 3.3Å; L513-Q515 VanDerWaalsContact C-N 3.28Å; L513-Q515 PolarHBondContact O-N 2.9Å; L513-T516 WeakPolarHBondContact CA-OG1 3.19Å; L513-T516 CarbonylContact O-C 3.59Å; L513-T516 PolarHBondContact O-N 3.49Å; L513-T516 PolarHBondContact O-OG1 3.02Å; L513-A517 WeakPolarHBondContact O-CA 2.84Å; L513-A517 WeakPolarHBondContact O-CB 3.32Å; L513-A517 PolarHBondContact O-N 2.94Å
514	D	65.8	Low	60.1	Low	103 Å²	103	78.7 Å²	78.7	55%	0.551	42%	0.415	S	S	*	.	H	α-helix	trans	-64	-34	174.9	-77.2	-20.5	0	0	0	112.6	N510 Y511	N510-D514 WeakPolarHBondContact O-CB 3.41Å; N510-D514 PolarHBondContact O-N 2.9Å; Y511-D514 PolarHBondContact O-N 3.42Å
515	Q	63.1	Low	57.5	Low	97 Å²	97	81.7 Å²	81.7	45%	0.453	44%	0.441	S	S	.	.	H	α-helix	trans	-72.7	-31.8	175.8	-75.2	-173.9	-20.3	0	0	113.1	Y511 F512 L513	Y511-Q515 HydrophobicContact CD1-CG 4.46Å; Y511-Q515 VanDerWaalsContact CE1-CD 3.46Å; Y511-Q515 HydrophobicContact CE1-CG 4.15Å; Y511-Q515 WeakPolarHBondContact O-CG 3.31Å; Y511-Q515 PolarHBondContact O-N 2.97Å; Y511-Q515 PolarHBondContact OH-NE2 3.47Å; F512-Q515 PolarHBondContact O-N 3.3Å; L513-Q515 VanDerWaalsContact C-N 3.28Å; L513-Q515 PolarHBondContact O-N 2.9Å
516	T	58.8	Low	55	Low	23 Å²	23	86.9 Å²	86.9	14%	0.141	48%	0.475	C	S	.	.	H	α-helix	trans	-98.2	-10.1	-176.3	58.4	0	0	0	0	112.3	F512 L513 M518 T540	F512-T516 HydrophobicContact CD2-CG2 4.33Å; F512-T516 HydrophobicContact CE1-CG2 4.32Å; F512-T516 HydrophobicContact CE2-CG2 3.98Å; F512-T516 HydrophobicContact CZ-CG2 3.97Å; F512-T516 WeakPolarHBondContact O-CB 3.1Å; F512-T516 WeakPolarHBondContact O-CG2 3.18Å; F512-T516 PolarHBondContact O-N 2.95Å; F512-T516 PolarHBondContact O-OG1 3.12Å; L513-T516 WeakPolarHBondContact CA-OG1 3.19Å; L513-T516 CarbonylContact O-C 3.59Å; L513-T516 PolarHBondContact O-N 3.49Å; L513-T516 PolarHBondContact O-OG1 3.02Å; T516-M518 PolarHBondContact O-N 3.08Å; T516-T540 HydrophobicContact CG2-CG2 4.29Å
517	A	54.9	Low	52.6	Low	51 Å²	51	91.2 Å²	91.2	42%	0.421	49%	0.493	S	S	.	.	S	Bend	trans	-65.4	115	173	0	0	0	0	0	109	L513 K519	L513-A517 WeakPolarHBondContact O-CA 2.84Å; L513-A517 WeakPolarHBondContact O-CB 3.32Å; L513-A517 PolarHBondContact O-N 2.94Å; A517-K519 VanDerWaalsContact C-N 3.28Å; A517-K519 PolarHBondContact O-N 3.27Å
518	M	45.6	Very low	50	Low	158 Å²	158	95.1 Å²	95.1	78%	0.778	52%	0.522	S	S	*	.			trans	-61.5	91.1	167.6	-72.9	-100.1	165.5	0	0	108.4	T516 P520 P536	T516-M518 PolarHBondContact O-N 3.08Å; M518-P520 WeakPolarHBondContact O-CD 3.27Å; M518-P536 HydrophobicContact CE-CG 3.78Å
519	K	37.6	Very low	47.7	Very low	126 Å²	126	101.3 Å²	101.3	55%	0.548	55%	0.548	S	S	.	.			trans	-72.8	119.3	169.8	-69.6	-175.5	-176.9	176.6	0	107.5	A517 E521	A517-K519 VanDerWaalsContact C-N 3.28Å; A517-K519 PolarHBondContact O-N 3.27Å; K519-E521 PolarHBondContact O-N 3.43Å
520	P	36.9	Very low	45.7	Very low	128 Å²	128	106.6 Å²	106.6	83%	0.831	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	9.6	179.6	26.5	-32.1	0	0	0	114	M518	M518-P520 WeakPolarHBondContact O-CD 3.27Å
521	E	35.3	Very low	43.8	Very low	164 Å²	164	106.1 Å²	106.1	77%	0.766	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	-11.7	-162.2	-37.1	-163.5	-130.7	0	0	113.7	K519 E523	K519-E521 PolarHBondContact O-N 3.43Å; E521-E523 PolarHBondContact O-N 2.71Å
522	D	36	Very low	42	Very low	120 Å²	120	102.7 Å²	102.7	64%	0.642	60%	0.603	S	S	*	*			trans	-93.4	73	-178.5	-80.8	-33.8	0	0	0	111.7	G524	D522-G524 PolarHBondContact O-N 3.14Å
523	E	35.5	Very low	40.8	Very low	207 Å²	207	112.5 Å²	112.5	97%	0.967	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	15.1	170.5	-73.9	-170.5	151	0	0	114.5	E521	E521-E523 PolarHBondContact O-N 2.71Å
524	G	32.4	Very low	39.9	Very low	68 Å²	68	115 Å²	115	70%	0.701	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.3	-14.3	-168.7	0	0	0	0	0	117	D522 T526	D522-G524 PolarHBondContact O-N 3.14Å; G524-T526 PolarHBondContact O-N 2.96Å
525	A	29.6	Very low	39.6	Very low	78 Å²	78	113.6 Å²	113.6	65%	0.645	65%	0.649	S	S	*	*			trans	-85.1	106.1	-179.1	0	0	0	0	0	109.8	F527	A525-F527 PolarHBondContact O-N 2.76Å
526	T	29.4	Very low	39.7	Very low	140 Å²	140	111.7 Å²	111.7	86%	0.859	65%	0.645	S	S	*	*			trans	-55.7	112.2	174.3	10.4	0	0	0	0	109.7	G524 S528	G524-T526 PolarHBondContact O-N 2.96Å; T526-S528 PolarHBondContact O-N 3.15Å
527	F	34.7	Very low	40	Very low	170 Å²	170	110.9 Å²	110.9	75%	0.746	64%	0.641	S	S	*	*			trans	-48.9	118.2	170.3	-89.7	-92.5	0	0	0	110.8	A525 F529	A525-F527 PolarHBondContact O-N 2.76Å; F527-F529 HydrophobicContact CB-CD2 3.79Å; F527-F529 HydrophobicContact CB-CE2 3.77Å; F527-F529 AromaticContact CD1-CD2 3.79Å; F527-F529 HydrophobicContact CD1-CD2 3.79Å; F527-F529 HydrophobicContact CD1-CE1 4.37Å; F527-F529 AromaticContact CD1-CE2 3.08Å; F527-F529 HydrophobicContact CD1-CE2 3.08Å; F527-F529 AromaticContact CD1-CZ 3.44Å; F527-F529 HydrophobicContact CD1-CZ 3.44Å; F527-F529 VanDerWaalsContact CD1-CZ 3.44Å; F527-F529 AromaticContact CE1-CE2 3.74Å; F527-F529 HydrophobicContact CE1-CE2 3.74Å; F527-F529 AromaticContact CE1-CZ 3.64Å; F527-F529 HydrophobicContact CE1-CZ 3.64Å; F527-F529 HydrophobicContact CG-CD2 4.16Å; F527-F529 AromaticContact CG-CE2 3.62Å; F527-F529 HydrophobicContact CG-CE2 3.62Å; F527-F529 HydrophobicContact CG-CZ 4.38Å
528	S	25.8	Very low	40.7	Very low	102 Å²	102	108.9 Å²	108.9	71%	0.713	62%	0.623	S	S	*	*			trans	-101.6	89.2	165.6	-173.3	0	0	0	0	109.1	T526 S530	T526-S528 PolarHBondContact O-N 3.15Å; S528-S530 VanDerWaalsContact C-N 3.28Å; S528-S530 PolarHBondContact O-N 2.86Å
529	F	33	Very low	41.9	Very low	152 Å²	152	102.9 Å²	102.9	67%	0.667	60%	0.597	S	S	*	*			trans	-78.4	68.2	176.3	-84.1	-79.1	0	0	0	111.8	F527	F527-F529 HydrophobicContact CB-CD2 3.79Å; F527-F529 HydrophobicContact CB-CE2 3.77Å; F527-F529 AromaticContact CD1-CD2 3.79Å; F527-F529 HydrophobicContact CD1-CD2 3.79Å; F527-F529 HydrophobicContact CD1-CE1 4.37Å; F527-F529 AromaticContact CD1-CE2 3.08Å; F527-F529 HydrophobicContact CD1-CE2 3.08Å; F527-F529 AromaticContact CD1-CZ 3.44Å; F527-F529 HydrophobicContact CD1-CZ 3.44Å; F527-F529 VanDerWaalsContact CD1-CZ 3.44Å; F527-F529 AromaticContact CE1-CE2 3.74Å; F527-F529 HydrophobicContact CE1-CE2 3.74Å; F527-F529 AromaticContact CE1-CZ 3.64Å; F527-F529 HydrophobicContact CE1-CZ 3.64Å; F527-F529 HydrophobicContact CG-CD2 4.16Å; F527-F529 AromaticContact CG-CE2 3.62Å; F527-F529 HydrophobicContact CG-CE2 3.62Å; F527-F529 HydrophobicContact CG-CZ 4.38Å
530	S	28.5	Very low	43.6	Very low	111 Å²	111	98.9 Å²	98.9	78%	0.776	58%	0.583	S	S	*	*			trans	-110.7	-7.5	172.7	54.5	0	0	0	0	114.7	S528	S528-S530 VanDerWaalsContact C-N 3.28Å; S528-S530 PolarHBondContact O-N 2.86Å
531	G	28.4	Very low	45.6	Very low	58 Å²	58	92.8 Å²	92.8	60%	0.598	54%	0.544	S	S	*	.	S	Bend	trans	-109.1	140.1	169	0	0	0	0	0	110.3
532	G	33.4	Very low	47.6	Very low	66 Å²	66	85.5 Å²	85.5	68%	0.68	51%	0.51	S	S	*	.			trans	-57.3	169	-179.2	0	0	0	0	0	114.4	E534	G532-E534 PolarHBondContact O-N 2.85Å
533	F	44.8	Very low	49.7	Very low	207 Å²	207	83.8 Å²	83.8	91%	0.908	50%	0.501	S	S	*	.	S	Bend	trans	-62.3	59.1	-179.1	-78.8	-97.1	0	0	0	114.2
534	E	48	Very low	51.9	Low	85 Å²	85	74.4 Å²	74.4	40%	0.397	46%	0.456	S	S	.	.			trans	-101	147.5	165.7	-73.1	178.9	167.2	0	0	109.3	P446 G532 I542	P446-E534 WeakPolarHBondContact CG-OE1 3.41Å; G532-E534 PolarHBondContact O-N 2.85Å; E534-I542 VanDerWaalsContact OE2-CD1 3.23Å; E534-I542 WeakPolarHBondContact OE2-CD1 3.32Å
535	D	60.7	Low	54.3	Low	74 Å²	74	71.1 Å²	71.1	40%	0.396	42%	0.423	S	S	.	.			trans	-43.1	129.9	173.2	168.3	13.3	0	0	0	110.1	S537 T538 S539	D535-S537 VanDerWaalsContact CG-OG 3.3Å; D535-S537 PolarHBondContact O-N 3.19Å; D535-S537 PolarHBondContact OD1-N 3.26Å; D535-S537 PolarHBondContact OD1-OG 3.07Å; D535-S537 PolarHBondContact OD2-OG 2.96Å; D535-T538 WeakPolarHBondContact O-CA 3.36Å; D535-T538 WeakPolarHBondContact O-CB 3.43Å; D535-T538 PolarHBondContact O-N 2.61Å; D535-S539 PolarHBondContact O-N 2.72Å; D535-S539 PolarHBondContact O-OG 3.15Å; D535-S539 VanDerWaalsContact O-OG 3.13Å
536	P	64.2	Low	56.8	Low	57 Å²	57	72.5 Å²	72.5	37%	0.37	41%	0.414	S	S	.	.	H	α-helix	trans	-47.2	-34.3	176.1	-29.1	33.6	0	0	0	113.2	M518 S539 T540	M518-P536 HydrophobicContact CE-CG 3.78Å; P536-S539 WeakPolarHBondContact CA-OG 3.42Å; P536-S539 PolarHBondContact O-OG 2.88Å; P536-S539 VanDerWaalsContact O-OG 3.13Å; P536-T540 WeakPolarHBondContact O-CB 3.36Å; P536-T540 PolarHBondContact O-N 2.98Å; P536-T540 PolarHBondContact O-OG1 2.95Å
537	S	66.4	Low	59.3	Low	6 Å²	6	70.4 Å²	70.4	4%	0.042	40%	0.395	C	S	.	.	H	α-helix	trans	-69.9	-46.7	176.1	89.1	0	0	0	0	112.3	T440 F512 D535 T540 Y541	T440-S537 PolarHBondContact OG1-OG 3.04Å; F512-S537 VanDerWaalsContact CZ-O 3.28Å; F512-S537 WeakPolarHBondContact CZ-O 3.4Å; D535-S537 VanDerWaalsContact CG-OG 3.3Å; D535-S537 PolarHBondContact O-N 3.19Å; D535-S537 PolarHBondContact OD1-N 3.26Å; D535-S537 PolarHBondContact OD1-OG 3.07Å; D535-S537 PolarHBondContact OD2-OG 2.96Å; S537-T540 PolarHBondContact O-N 3.07Å; S537-Y541 WeakPolarHBondContact O-CB 3.21Å; S537-Y541 PolarHBondContact O-N 3.12Å
538	T	68.6	Low	61.4	Low	9 Å²	9	62.3 Å²	62.3	6%	0.055	36%	0.359	C	S	.	.	H	α-helix	trans	-62.2	-46.6	177.7	-64.7	0	0	0	0	111.6	S444 V447 D535 Y541 I542	S444-T538 WeakPolarHBondContact OG-CG2 3.23Å; V447-T538 HydrophobicContact CG2-CG2 4.09Å; D535-T538 WeakPolarHBondContact O-CA 3.36Å; D535-T538 WeakPolarHBondContact O-CB 3.43Å; D535-T538 PolarHBondContact O-N 2.61Å; T538-Y541 PolarHBondContact O-N 2.78Å; T538-I542 HydrophobicContact CG2-CD1 3.83Å; T538-I542 VanDerWaalsContact O-CG1 3.27Å; T538-I542 WeakPolarHBondContact O-CG1 3.43Å; T538-I542 PolarHBondContact O-N 2.63Å
539	S	69.9	Low	64.1	Low	33 Å²	33	59.7 Å²	59.7	23%	0.231	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-41.2	179.4	57.1	0	0	0	0	112.5	D535 P536 Y541 I542 N543	D535-S539 PolarHBondContact O-N 2.72Å; D535-S539 PolarHBondContact O-OG 3.15Å; D535-S539 VanDerWaalsContact O-OG 3.13Å; P536-S539 WeakPolarHBondContact CA-OG 3.42Å; P536-S539 PolarHBondContact O-OG 2.88Å; P536-S539 VanDerWaalsContact O-OG 3.13Å; S539-Y541 VanDerWaalsContact C-N 3.3Å; S539-Y541 PolarHBondContact O-N 3.06Å; S539-I542 PolarHBondContact O-N 3.15Å; S539-N543 WeakPolarHBondContact O-CB 3.02Å; S539-N543 PolarHBondContact O-N 3.14Å; S539-N543 PolarHBondContact O-ND2 3.18Å
540	T	74.8	Confident	66.4	Low	41 Å²	41	56.6 Å²	56.6	25%	0.252	33%	0.33	S	S	.	.	H	α-helix	trans	-61	-40.7	174.2	-60.1	0	0	0	0	111.1	F512 T516 P536 S537 N543 F544	F512-T540 HydrophobicContact CD2-CG2 4.05Å; F512-T540 HydrophobicContact CE2-CG2 3.81Å; T516-T540 HydrophobicContact CG2-CG2 4.29Å; P536-T540 WeakPolarHBondContact O-CB 3.36Å; P536-T540 PolarHBondContact O-N 2.98Å; P536-T540 PolarHBondContact O-OG1 2.95Å; S537-T540 PolarHBondContact O-N 3.07Å; T540-N543 PolarHBondContact O-N 3.25Å; T540-F544 PolarHBondContact O-N 2.7Å
541	Y	77.7	Confident	68.8	Low	1 Å²	1	55 Å²	55	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-71.5	-39	178.4	-166.4	-108.7	0	0	0	113.5	H415 V441 L442 V447 M494 F512 S537 T538 S539 N543 F544 L545	H415-Y541 PolarHBondContact CE1-OH 2.69Å; H415-Y541 AromaticContact NE2-CZ 3.82Å; H415-Y541 PolarHBondContact NE2-OH 2.99Å; V441-Y541 HydrophobicContact CB-CG 4.46Å; V441-Y541 HydrophobicContact CG1-CD1 3.06Å; V441-Y541 HydrophobicContact CG1-CD2 3.75Å; V441-Y541 HydrophobicContact CG1-CE1 3.53Å; V441-Y541 HydrophobicContact CG1-CE2 4.2Å; V441-Y541 HydrophobicContact CG1-CG 3.12Å; L442-Y541 HydrophobicContact CD2-CE1 4.37Å; V447-Y541 HydrophobicContact CG1-CD1 3.72Å; V447-Y541 HydrophobicContact CG1-CE1 3.64Å; V447-Y541 HydrophobicContact CG2-CD1 3.98Å; M494-Y541 HydrophobicContact CE-CD2 4.36Å; M494-Y541 HydrophobicContact CE-CE2 4.02Å; M494-Y541 HydrophobicContact SD-CD2 4.25Å; M494-Y541 HydrophobicContact SD-CE2 3.43Å; M494-Y541 WeakPolarHBondContact SD-CE2 3.37Å; F512-Y541 HydrophobicContact CE2-CD2 4.38Å; S537-Y541 WeakPolarHBondContact O-CB 3.21Å; S537-Y541 PolarHBondContact O-N 3.12Å; T538-Y541 PolarHBondContact O-N 2.78Å; S539-Y541 VanDerWaalsContact C-N 3.3Å; S539-Y541 PolarHBondContact O-N 3.06Å; Y541-N543 VanDerWaalsContact C-N 3.25Å; Y541-N543 PolarHBondContact O-N 3.24Å; Y541-F544 HydrophobicContact CD2-CD1 4.08Å; Y541-F544 AromaticContact CE2-CD1 3.95Å; Y541-F544 HydrophobicContact CE2-CD1 3.95Å; Y541-F544 HydrophobicContact CE2-CE1 4.23Å; Y541-F544 WeakPolarHBondContact O-CB 2.98Å; Y541-F544 PolarHBondContact O-N 3.41Å; Y541-L545 HydrophobicContact CD1-CD1 3.85Å; Y541-L545 HydrophobicContact CD1-CG 4.23Å; Y541-L545 HydrophobicContact CE1-CD1 3.7Å; Y541-L545 HydrophobicContact CE1-CD2 4.48Å; Y541-L545 HydrophobicContact CE1-CG 4.13Å; Y541-L545 WeakPolarHBondContact O-CG 3.4Å; Y541-L545 PolarHBondContact O-N 2.78Å
542	I	78.4	Confident	71.2	Confident	11 Å²	11	52.4 Å²	52.4	6%	0.056	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-40.9	172.2	-70.8	166.5	0	0	0	110.3	P446 V447 E534 T538 S539 L545 K546	P446-I542 HydrophobicContact CB-CD1 3.98Å; V447-I542 HydrophobicContact CG2-CD1 4.13Å; V447-I542 HydrophobicContact CG2-CG1 3.61Å; E534-I542 VanDerWaalsContact OE2-CD1 3.23Å; E534-I542 WeakPolarHBondContact OE2-CD1 3.32Å; T538-I542 HydrophobicContact CG2-CD1 3.83Å; T538-I542 VanDerWaalsContact O-CG1 3.27Å; T538-I542 WeakPolarHBondContact O-CG1 3.43Å; T538-I542 PolarHBondContact O-N 2.63Å; S539-I542 PolarHBondContact O-N 3.15Å; I542-L545 PolarHBondContact O-N 3.35Å; I542-K546 HydrophobicContact CG2-CD 3.92Å; I542-K546 VanDerWaalsContact CG2-CE 3.49Å; I542-K546 HydrophobicContact CG2-CG 4.42Å; I542-K546 WeakPolarHBondContact O-CB 3.16Å; I542-K546 VanDerWaalsContact O-CG 3.31Å; I542-K546 WeakPolarHBondContact O-CG 3.39Å; I542-K546 PolarHBondContact O-N 3.08Å
543	N	79.7	Confident	73.3	Confident	84 Å²	84	55.5 Å²	55.5	45%	0.449	28%	0.277	S	S	.	.	H	α-helix	trans	-63.6	-44.3	175.3	-70.4	-22.7	0	0	0	111.2	S539 T540 Y541 L545 K546 E547	S539-N543 WeakPolarHBondContact O-CB 3.02Å; S539-N543 PolarHBondContact O-N 3.14Å; S539-N543 PolarHBondContact O-ND2 3.18Å; T540-N543 PolarHBondContact O-N 3.25Å; Y541-N543 VanDerWaalsContact C-N 3.25Å; Y541-N543 PolarHBondContact O-N 3.24Å; N543-L545 PolarHBondContact O-N 2.77Å; N543-K546 PolarHBondContact O-N 2.76Å; N543-E547 WeakPolarHBondContact O-CB 3.31Å; N543-E547 WeakPolarHBondContact O-CG 3.42Å; N543-E547 PolarHBondContact O-N 3.29Å
544	F	82.3	Confident	74.5	Confident	9 Å²	9	50.4 Å²	50.4	4%	0.039	26%	0.259	C	S	.	.	H	α-helix	trans	-54.7	-48.1	173	164.1	-100.6	0	0	0	112.4	M494 V496 H505 I507 T540 Y541 E547 G548	M494-F544 HydrophobicContact CB-CE1 4.41Å; M494-F544 HydrophobicContact CB-CZ 4.38Å; V496-F544 HydrophobicContact CG2-CE1 3.89Å; V496-F544 HydrophobicContact CG2-CZ 3.85Å; H505-F544 HydrophobicContact CB-CE2 4.03Å; H505-F544 AromaticContact CE1-CD2 3.63Å; H505-F544 AromaticContact CE1-CE2 3.84Å; H505-F544 AromaticContact CG-CD2 3.89Å; H505-F544 AromaticContact CG-CE2 3.61Å; H505-F544 AromaticContact ND1-CD2 3.54Å; H505-F544 AromaticContact ND1-CE2 3.26Å; H505-F544 VanDerWaalsContact ND1-CE2 3.26Å; H505-F544 WeakPolarHBondContact ND1-CE2 3.45Å; I507-F544 HydrophobicContact CB-CD2 4.12Å; I507-F544 HydrophobicContact CB-CE2 3.94Å; I507-F544 HydrophobicContact CG2-CD1 4.45Å; I507-F544 HydrophobicContact CG2-CD2 3.7Å; I507-F544 HydrophobicContact CG2-CE1 4.31Å; I507-F544 HydrophobicContact CG2-CE2 3.51Å; I507-F544 HydrophobicContact CG2-CG 4.17Å; I507-F544 HydrophobicContact CG2-CZ 3.84Å; T540-F544 PolarHBondContact O-N 2.7Å; Y541-F544 HydrophobicContact CD2-CD1 4.08Å; Y541-F544 AromaticContact CE2-CD1 3.95Å; Y541-F544 HydrophobicContact CE2-CD1 3.95Å; Y541-F544 HydrophobicContact CE2-CE1 4.23Å; Y541-F544 WeakPolarHBondContact O-CB 2.98Å; Y541-F544 PolarHBondContact O-N 3.41Å; F544-E547 PolarHBondContact O-N 3.39Å; F544-G548 PolarHBondContact O-N 3.44Å
545	L	81.4	Confident	75.3	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-65.4	-40.7	178.2	-66.6	175.7	0	0	0	112.1	V447 L450 L451 F455 V496 Y541 I542 N543 G548 L549	V447-L545 HydrophobicContact CG1-CD1 4.25Å; L450-L545 HydrophobicContact CD2-CB 3.48Å; L450-L545 VanDerWaalsContact CD2-CB 3.48Å; L450-L545 HydrophobicContact CD2-CD1 3.52Å; L450-L545 HydrophobicContact CD2-CG 4.13Å; L451-L545 HydrophobicContact CD2-CD1 3.98Å; L451-L545 HydrophobicContact CD2-CD2 4.29Å; L451-L545 HydrophobicContact CG-CD1 4.31Å; F455-L545 HydrophobicContact CE2-CB 4.17Å; F455-L545 HydrophobicContact CE2-CD2 4.32Å; F455-L545 HydrophobicContact CZ-CB 4.21Å; F455-L545 HydrophobicContact CZ-CD2 4.18Å; V496-L545 HydrophobicContact CG2-CD2 4.31Å; Y541-L545 HydrophobicContact CD1-CD1 3.85Å; Y541-L545 HydrophobicContact CD1-CG 4.23Å; Y541-L545 HydrophobicContact CE1-CD1 3.7Å; Y541-L545 HydrophobicContact CE1-CD2 4.48Å; Y541-L545 HydrophobicContact CE1-CG 4.13Å; Y541-L545 WeakPolarHBondContact O-CG 3.4Å; Y541-L545 PolarHBondContact O-N 2.78Å; I542-L545 PolarHBondContact O-N 3.35Å; N543-L545 PolarHBondContact O-N 2.77Å; L545-G548 PolarHBondContact O-N 2.7Å; L545-L549 PolarHBondContact O-N 3.28Å
546	K	82.6	Confident	75.3	Confident	107 Å²	107	54.1 Å²	54.1	47%	0.465	27%	0.273	S	S	.	.	H	α-helix	trans	-66	-41.5	176.2	-75.5	174.3	-179.2	169.1	0	112.2	L450 I542 N543 G548 L549 V550	L450-K546 HydrophobicContact CD1-CG 4.48Å; I542-K546 HydrophobicContact CG2-CD 3.92Å; I542-K546 VanDerWaalsContact CG2-CE 3.49Å; I542-K546 HydrophobicContact CG2-CG 4.42Å; I542-K546 WeakPolarHBondContact O-CB 3.16Å; I542-K546 VanDerWaalsContact O-CG 3.31Å; I542-K546 WeakPolarHBondContact O-CG 3.39Å; I542-K546 PolarHBondContact O-N 3.08Å; N543-K546 PolarHBondContact O-N 2.76Å; K546-G548 VanDerWaalsContact C-N 3.31Å; K546-G548 PolarHBondContact O-N 2.88Å; K546-L549 WeakPolarHBondContact O-CB 3.4Å; K546-L549 PolarHBondContact O-N 3.19Å; K546-V550 WeakPolarHBondContact O-CG2 3.4Å; K546-V550 PolarHBondContact O-N 3.2Å
547	E	82.3	Confident	74.8	Confident	96 Å²	96	57.2 Å²	57.2	45%	0.449	29%	0.291	S	S	.	.	H	α-helix	trans	-62.6	-39.7	174	-77	-172.8	-159	0	0	111.4	H505 N543 F544 L549 V550 K551	H505-E547 IonicContact NE2-OE2 3.63Å; H505-E547 PolarHBondContact NE2-OE2 3.11Å; N543-E547 WeakPolarHBondContact O-CB 3.31Å; N543-E547 WeakPolarHBondContact O-CG 3.42Å; N543-E547 PolarHBondContact O-N 3.29Å; F544-E547 PolarHBondContact O-N 3.39Å; E547-L549 VanDerWaalsContact C-N 3.33Å; E547-L549 PolarHBondContact O-N 2.94Å; E547-V550 PolarHBondContact O-N 2.79Å; E547-K551 WeakPolarHBondContact O-CB 3.49Å; E547-K551 WeakPolarHBondContact O-CG 3.44Å; E547-K551 PolarHBondContact O-N 2.89Å; E547-K551 IonicContact OE2-NZ 3.88Å
548	G	78.9	Confident	73.7	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-56.7	-44.7	171.1	0	0	0	0	0	112.5	F544 L545 K546 V550 A552	F544-G548 PolarHBondContact O-N 3.44Å; L545-G548 PolarHBondContact O-N 2.7Å; K546-G548 VanDerWaalsContact C-N 3.31Å; K546-G548 PolarHBondContact O-N 2.88Å; G548-V550 PolarHBondContact O-N 3.01Å; G548-A552 VanDerWaalsContact O-CB 3.22Å; G548-A552 WeakPolarHBondContact O-CB 3.34Å; G548-A552 PolarHBondContact O-N 3.4Å
549	L	81.6	Confident	73.9	Confident	46 Å²	46	69.9 Å²	69.9	24%	0.241	35%	0.35	C	S	.	.	H	α-helix	trans	-64.8	-37.4	175.9	-72	165.8	0	0	0	113	L413 F455 L545 K546 E547 K553	L413-L549 HydrophobicContact CD1-CD2 3.64Å; L413-L549 HydrophobicContact CD1-CG 4.39Å; L413-L549 HydrophobicContact CG-CD2 4.42Å; F455-L549 HydrophobicContact CE1-CD2 4.39Å; F455-L549 HydrophobicContact CE2-CD1 4.01Å; F455-L549 HydrophobicContact CE2-CD2 4.25Å; F455-L549 HydrophobicContact CE2-CG 4.08Å; F455-L549 HydrophobicContact CZ-CD1 4.08Å; F455-L549 HydrophobicContact CZ-CD2 3.87Å; F455-L549 HydrophobicContact CZ-CG 3.65Å; L545-L549 PolarHBondContact O-N 3.28Å; K546-L549 WeakPolarHBondContact O-CB 3.4Å; K546-L549 PolarHBondContact O-N 3.19Å; E547-L549 VanDerWaalsContact C-N 3.33Å; E547-L549 PolarHBondContact O-N 2.94Å; L549-K553 WeakPolarHBondContact O-CG 3.27Å; L549-K553 PolarHBondContact O-N 2.84Å
550	V	82.9	Confident	74.1	Confident	87 Å²	87	71.8 Å²	71.8	53%	0.527	36%	0.356	S	S	.	.	H	α-helix	trans	-68.7	-51.8	177.5	173.7	0	0	0	0	110.3	K546 E547 G548 A552 K553	K546-V550 WeakPolarHBondContact O-CG2 3.4Å; K546-V550 PolarHBondContact O-N 3.2Å; E547-V550 PolarHBondContact O-N 2.79Å; G548-V550 PolarHBondContact O-N 3.01Å; V550-A552 PolarHBondContact O-N 3.17Å; V550-K553 WeakPolarHBondContact O-CB 3.09Å; V550-K553 PolarHBondContact O-N 3.38Å
551	K	78.9	Confident	74.1	Confident	79 Å²	79	73.6 Å²	73.6	34%	0.343	36%	0.362	S	S	.	.	H	α-helix	trans	-60.2	-34.9	178.7	-71	173.1	-175.1	166.3	0	111.7	V504 H505 E547 K553 D554 Y555	V504-K551 HydrophobicContact CG1-CB 3.38Å; H505-K551 PolarHBondContact CD2-NZ 3.34Å; H505-K551 PolarHBondContact NE2-NZ 3.32Å; E547-K551 WeakPolarHBondContact O-CB 3.49Å; E547-K551 WeakPolarHBondContact O-CG 3.44Å; E547-K551 PolarHBondContact O-N 2.89Å; E547-K551 IonicContact OE2-NZ 3.88Å; K551-K553 VanDerWaalsContact C-N 3.29Å; K551-K553 PolarHBondContact O-N 2.81Å; K551-D554 WeakPolarHBondContact O-CB 3.36Å; K551-D554 PolarHBondContact O-N 3.16Å; K551-Y555 VanDerWaalsContact O-CD2 3.26Å; K551-Y555 WeakPolarHBondContact O-CD2 3.38Å
552	A	77.9	Confident	73.9	Confident	2 Å²	2	77.8 Å²	77.8	2%	0.017	38%	0.383	C	S	.	.	H	α-helix	trans	-65.4	-31.4	176.9	0	0	0	0	0	113	L413 L498 V504 G548 V550 D554 Y555 I556	L413-A552 HydrophobicContact CD1-CB 3.59Å; L413-A552 HydrophobicContact CD2-CB 3.83Å; L413-A552 HydrophobicContact CG-CB 4.34Å; L498-A552 HydrophobicContact CD2-CB 4.33Å; V504-A552 HydrophobicContact CG1-CB 4.19Å; V504-A552 HydrophobicContact CG2-CB 4.4Å; G548-A552 VanDerWaalsContact O-CB 3.22Å; G548-A552 WeakPolarHBondContact O-CB 3.34Å; G548-A552 PolarHBondContact O-N 3.4Å; V550-A552 PolarHBondContact O-N 3.17Å; A552-D554 VanDerWaalsContact C-N 3.28Å; A552-D554 PolarHBondContact O-N 2.65Å; A552-Y555 PolarHBondContact O-N 3.07Å; A552-I556 WeakPolarHBondContact O-CG1 3.33Å; A552-I556 PolarHBondContact O-N 3.47Å; A552-I556 VanDerWaalsContact O-N 3.08Å
553	K	77.1	Confident	73.6	Confident	132 Å²	132	82 Å²	82	57%	0.574	40%	0.403	S	S	*	.	H	α-helix	trans	-61.9	-40.1	175.1	-70.9	173	-177.4	179	0	110.8	L549 V550 K551 Y555 I556 T557	L549-K553 WeakPolarHBondContact O-CG 3.27Å; L549-K553 PolarHBondContact O-N 2.84Å; V550-K553 WeakPolarHBondContact O-CB 3.09Å; V550-K553 PolarHBondContact O-N 3.38Å; K551-K553 VanDerWaalsContact C-N 3.29Å; K551-K553 PolarHBondContact O-N 2.81Å; K553-Y555 PolarHBondContact O-N 3.14Å; K553-I556 PolarHBondContact O-N 2.89Å; K553-T557 PolarHBondContact O-N 2.89Å; K553-T557 PolarHBondContact O-OG1 3.5Å
554	D	71	Confident	73.2	Confident	100 Å²	100	81.9 Å²	81.9	54%	0.535	40%	0.4	S	S	.	.	H	α-helix	trans	-60.1	-32.2	179.4	-60.5	-26.6	0	0	0	112.3	K551 A552	K551-D554 WeakPolarHBondContact O-CB 3.36Å; K551-D554 PolarHBondContact O-N 3.16Å; A552-D554 VanDerWaalsContact C-N 3.28Å; A552-D554 PolarHBondContact O-N 2.65Å
555	Y	64.2	Low	72.5	Confident	117 Å²	117	87.1 Å²	87.1	46%	0.459	43%	0.426	S	S	.	.	H	α-helix	trans	-82.4	-26.4	175.2	-71.6	-79.8	0	0	0	114.2	L498 V504 K551 A552 K553	L498-Y555 HydrophobicContact CD1-CG 4.31Å; V504-Y555 HydrophobicContact CG1-CD2 4.45Å; V504-Y555 HydrophobicContact CG1-CE2 4.47Å; V504-Y555 HydrophobicContact CG2-CD2 4.41Å; K551-Y555 VanDerWaalsContact O-CD2 3.26Å; K551-Y555 WeakPolarHBondContact O-CD2 3.38Å; A552-Y555 PolarHBondContact O-N 3.07Å; K553-Y555 PolarHBondContact O-N 3.14Å
556	I	61.3	Low	71.8	Confident	120 Å²	120	93.8 Å²	93.8	62%	0.615	46%	0.458	S	S	*	.	H	α-helix	trans	-80.8	-21.8	176.7	-66.5	166.3	0	0	0	111.4	L498 A552 K553	L498-I556 HydrophobicContact CD2-CD1 4.43Å; L498-I556 HydrophobicContact CD2-CG1 4.34Å; A552-I556 WeakPolarHBondContact O-CG1 3.33Å; A552-I556 PolarHBondContact O-N 3.47Å; A552-I556 VanDerWaalsContact O-N 3.08Å; K553-I556 PolarHBondContact O-N 2.89Å
557	T	53	Low	70.9	Confident	122 Å²	122	92.7 Å²	92.7	75%	0.748	46%	0.458	S	S	*	.			trans	-91.1	-4.8	177.1	-3.8	0	0	0	0	114.1	K553	K553-T557 PolarHBondContact O-N 2.89Å; K553-T557 PolarHBondContact O-OG1 3.5Å
558	Q	42.3	Very low	69.9	Low	211 Å²	211	92.4 Å²	92.4	99%	0.986	46%	0.459	S	S	*	.			trans	-91.2	0	165	-74	-178.1	5.1	0	0	109.8

Retrieved 558 of 558 residues in 1404.2 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).