ZN689_RAT Loading...

Zinc finger protein 689

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession Q99PJ7, Species RAT (Rattus norvegicus, Rat), Gene Znf689, Length 500 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.1	Very low	37.5	Very low	243 Å²	243	150.7 Å²	150.7	100%	1.197	88%	0.878	S	S	*	*				0	106.7	0	-71.8	175	172.4	0	0	107.2
2	A	40	Very low	37.1	Very low	98 Å²	98	146.3 Å²	146.3	81%	0.81	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-69.3	141.4	174.9	0	0	0	0	0	109.3
3	P	41.5	Very low	37	Very low	117 Å²	117	145.1 Å²	145.1	76%	0.76	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-70.9	154.4	-179.8	30	-32.8	0	0	0	111.2
4	P	38.7	Very low	36.6	Very low	122 Å²	122	139.6 Å²	139.6	79%	0.792	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-83.2	146.9	-161	32.7	-34.6	0	0	0	113.5
5	S	33.9	Very low	36.3	Very low	128 Å²	128	143.3 Å²	143.3	90%	0.895	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-74.5	131.1	166.3	-54.2	0	0	0	0	110.2
6	A	42.6	Very low	36	Very low	94 Å²	94	143.1 Å²	143.1	78%	0.777	86%	0.861	S	S	*	*			trans	-130.2	154.2	176	0	0	0	0	0	109.7
7	P	40.4	Very low	35.8	Very low	128 Å²	128	138.8 Å²	138.8	83%	0.831	85%	0.853	S	S	*	*	P	Polyproline II helix		-103.3	165.9	-121.3	34.7	-31.5	0	0	0	116.3	L9	P7-L9 PolarHBondContact O-N 3.49Å
8	L	32	Very low	35.9	Very low	174 Å²	174	137.8 Å²	137.8	91%	0.911	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-52.9	118.3	172.3	-75.4	156.7	0	0	0	111.8
9	L	41.2	Very low	35.8	Very low	173 Å²	173	137.4 Å²	137.4	91%	0.906	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-92.5	118.7	164.8	-160.3	78.5	0	0	0	108.3	P7	P7-L9 PolarHBondContact O-N 3.49Å
10	E	33.4	Very low	35.8	Very low	188 Å²	188	143.1 Å²	143.1	88%	0.879	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-61.3	150.7	-178.6	-77.8	-162.2	108	0	0	114
11	Q	29.2	Very low	36	Very low	193 Å²	193	147.9 Å²	147.9	90%	0.902	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-80.6	139.1	-179.9	-64.7	172	-12	0	0	110.8
12	A	32.8	Very low	36.1	Very low	98 Å²	98	148.2 Å²	148.2	81%	0.81	84%	0.843	S	S	*	*			trans	-121.4	148.9	159.4	0	0	0	0	0	110.2
13	P	34.6	Very low	36.1	Very low	130 Å²	130	146.9 Å²	146.9	84%	0.844	84%	0.839	S	S	*	*			trans	-110.8	157.7	-148.9	37.3	-26.8	0	0	0	114.8
14	G	31.4	Very low	36.3	Very low	68 Å²	68	152.9 Å²	152.9	70%	0.701	85%	0.846	S	S	*	*			trans	95.1	90.6	145.3	0	0	0	0	0	116.8
15	E	32.9	Very low	36.8	Very low	195 Å²	195	158.4 Å²	158.4	91%	0.911	85%	0.851	S	S	*	*			trans	-132.2	127.3	153.3	-90.5	-73.5	134.4	0	0	108.4
16	V	31.6	Very low	37.8	Very low	141 Å²	141	158.2 Å²	158.2	86%	0.855	85%	0.847	S	S	*	*			trans	-102.4	128.5	-166.7	173.5	0	0	0	0	110.5
17	G	33.1	Very low	38.9	Very low	70 Å²	70	162.8 Å²	162.8	72%	0.722	84%	0.844	S	S	*	*			trans	89.3	163.1	158.7	0	0	0	0	0	116.4
18	P	36.3	Very low	40.3	Very low	121 Å²	121	159.9 Å²	159.9	79%	0.786	83%	0.83	S	S	*	*			cis	-132.3	155.6	13	36.5	-17.5	0	0	0	116.9
19	T	34.8	Very low	42.5	Very low	130 Å²	130	156.4 Å²	156.4	80%	0.798	81%	0.812	S	S	*	*			trans	19.9	114.1	154	53.9	0	0	0	0	121.3	R21	T19-R21 PolarHBondContact O-N 3.28Å; T19-R21 VanDerWaalsContact O-N 3.13Å
20	R	35.4	Very low	44.6	Very low	251 Å²	251	154 Å²	154	95%	0.947	80%	0.795	S	S	*	*			trans	-48.8	105.5	161.8	-82.4	175	158	-170.9	-4.4	112.7	R22	R20-R22 PolarHBondContact O-N 3.14Å
21	R	40.1	Very low	47.2	Very low	243 Å²	243	145.9 Å²	145.9	92%	0.917	76%	0.756	S	S	*	*			trans	-71.5	119.3	154.8	-79.7	-173	175.1	-151.7	-1	108.4	T19 G23	T19-R21 PolarHBondContact O-N 3.28Å; T19-R21 VanDerWaalsContact O-N 3.13Å; R21-G23 PolarHBondContact O-N 3.34Å
22	R	42.7	Very low	49.8	Very low	251 Å²	251	138.9 Å²	138.9	95%	0.947	73%	0.732	S	S	*	*			trans	-53.4	103.5	173.2	-73.8	-179	177.9	-156.7	-0.6	109.2	R20 R24	R20-R22 PolarHBondContact O-N 3.14Å; R22-R24 PolarHBondContact O-N 3.48Å
23	G	39.4	Very low	52.3	Low	70 Å²	70	138.2 Å²	138.2	72%	0.722	72%	0.715	S	S	*	*			trans	-56.9	121.5	176.2	0	0	0	0	0	109.8	R21 R25	R21-G23 PolarHBondContact O-N 3.34Å; G23-R25 PolarHBondContact O-N 2.88Å; G23-R25 VanDerWaalsContact O-N 3.11Å
24	R	46.6	Very low	54.7	Low	243 Å²	243	135 Å²	135	92%	0.917	69%	0.693	S	S	*	*			trans	-62.6	113.1	173.2	-156.6	176.3	-167.8	-132.8	4.4	106.7	R22	R22-R24 PolarHBondContact O-N 3.48Å
25	R	47.7	Very low	57.5	Low	238 Å²	238	132.5 Å²	132.5	90%	0.898	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-51.8	134.8	179.1	-99.2	-175.2	171.7	-143.7	0.3	109.5	G23 R27	G23-R25 PolarHBondContact O-N 2.88Å; G23-R25 VanDerWaalsContact O-N 3.11Å; R25-R27 PolarHBondContact O-N 3.26Å
26	P	55.6	Low	60.2	Low	123 Å²	123	127 Å²	127	80%	0.799	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-52.5	138.1	177	-25.8	33.8	0	0	0	111.1	A28	P26-A28 PolarHBondContact O-N 3.32Å
27	R	64.9	Low	62.9	Low	191 Å²	191	122.4 Å²	122.4	72%	0.721	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-57.7	124.3	176.3	177.9	178.1	165.7	-167.7	-9.5	108.6	R25 L29	R25-R27 PolarHBondContact O-N 3.26Å; R27-L29 PolarHBondContact O-N 3.06Å
28	A	71.6	Confident	65.4	Low	66 Å²	66	121.2 Å²	121.2	55%	0.545	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-57.4	129.3	177.2	0	0	0	0	0	110.4	P26	P26-A28 PolarHBondContact O-N 3.32Å
29	L	78	Confident	67.5	Low	102 Å²	102	117 Å²	117	53%	0.534	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-63.6	129.5	176	-71.3	168.8	0	0	0	109.2	R27	R27-L29 PolarHBondContact O-N 3.06Å
30	K	84.6	Confident	69.6	Low	123 Å²	123	114.1 Å²	114.1	54%	0.535	55%	0.546	S	S	.	.			trans	-106.7	158.6	177.5	-59.1	-175.5	179.9	-174	0	109.9	A32 D33	K30-A32 PolarHBondContact O-N 2.91Å; K30-D33 PolarHBondContact N-OD2 3.43Å; K30-D33 WeakPolarHBondContact O-CB 3.49Å; K30-D33 PolarHBondContact O-N 3.24Å
31	F	87.1	Confident	71.8	Confident	16 Å²	16	108 Å²	108	7%	0.07	53%	0.527	C	S	.	.	H	α-helix	trans	-54.6	-39.1	175.7	-179	-100.5	0	0	0	113.2	D33 V34 A35 T61 Y62 L65 P75 L77 I78	F31-D33 PolarHBondContact O-N 3.19Å; F31-D33 VanDerWaalsContact O-N 3.14Å; F31-V34 WeakPolarHBondContact O-CG2 3.5Å; F31-V34 PolarHBondContact O-N 3.44Å; F31-V34 VanDerWaalsContact O-N 3.07Å; F31-A35 HydrophobicContact CD1-CB 3.77Å; F31-A35 HydrophobicContact CE1-CB 3.43Å; F31-A35 VanDerWaalsContact CE1-CB 3.43Å; F31-A35 HydrophobicContact CE2-CB 4.22Å; F31-A35 HydrophobicContact CG-CB 4.34Å; F31-A35 HydrophobicContact CZ-CB 3.67Å; F31-A35 VanDerWaalsContact O-CB 3.22Å; F31-A35 WeakPolarHBondContact O-CB 3.24Å; F31-A35 PolarHBondContact O-N 2.92Å; F31-T61 HydrophobicContact CE2-CG2 4.33Å; F31-Y62 AromaticContact CD2-CD2 3.96Å; F31-Y62 HydrophobicContact CD2-CD2 3.96Å; F31-Y62 HydrophobicContact CD2-CG 4.48Å; F31-Y62 HydrophobicContact CE2-CD2 4.44Å; F31-Y62 HydrophobicContact CG-CD2 4.34Å; F31-L65 HydrophobicContact CB-CD1 3.68Å; F31-L65 HydrophobicContact CD2-CD1 3.81Å; F31-L65 HydrophobicContact CG-CD1 4.24Å; F31-P75 HydrophobicContact CB-CG 3.93Å; F31-P75 HydrophobicContact CD1-CB 3.69Å; F31-P75 HydrophobicContact CD1-CG 3.28Å; F31-P75 HydrophobicContact CD2-CG 4.47Å; F31-P75 HydrophobicContact CE1-CB 3.89Å; F31-P75 HydrophobicContact CE1-CG 3.82Å; F31-P75 HydrophobicContact CG-CG 3.65Å; F31-L77 HydrophobicContact CE1-CD2 4.03Å; F31-L77 HydrophobicContact CZ-CD2 4.25Å; F31-I78 HydrophobicContact CE1-CD1 4.34Å; F31-I78 HydrophobicContact CE1-CG1 4.21Å; F31-I78 HydrophobicContact CE2-CD1 3.94Å; F31-I78 HydrophobicContact CE2-CG1 4.29Å; F31-I78 HydrophobicContact CZ-CD1 3.55Å; F31-I78 HydrophobicContact CZ-CG1 3.86Å
32	A	85.4	Confident	74.1	Confident	47 Å²	47	100.8 Å²	100.8	39%	0.388	50%	0.504	S	S	.	.	H	α-helix	trans	-62	-19.9	176	0	0	0	0	0	114.2	K30	K30-A32 PolarHBondContact O-N 2.91Å
33	D	83.7	Confident	76.2	Confident	84 Å²	84	89.1 Å²	89.1	45%	0.449	46%	0.46	S	S	.	.	H	α-helix	trans	-80.4	-19.2	177.6	-57.4	-48.4	0	0	0	112.1	K30 F31	K30-D33 PolarHBondContact N-OD2 3.43Å; K30-D33 WeakPolarHBondContact O-CB 3.49Å; K30-D33 PolarHBondContact O-N 3.24Å; F31-D33 PolarHBondContact O-N 3.19Å; F31-D33 VanDerWaalsContact O-N 3.14Å
34	V	86.5	Confident	78.3	Confident	63 Å²	63	88.2 Å²	88.2	38%	0.382	45%	0.451	S	S	.	.	H	α-helix	trans	-119.4	-17	-177	-64.8	0	0	0	0	113.9	F31 T61 L65	F31-V34 WeakPolarHBondContact O-CG2 3.5Å; F31-V34 PolarHBondContact O-N 3.44Å; F31-V34 VanDerWaalsContact O-N 3.07Å; V34-T61 HydrophobicContact CB-CG2 4.17Å; V34-T61 HydrophobicContact CG2-CG2 3.59Å; V34-L65 HydrophobicContact CG2-CD1 3.82Å; V34-L65 HydrophobicContact CG2-CG 4.45Å
35	A	89.1	Confident	80.4	Confident	14 Å²	14	84.2 Å²	84.2	12%	0.116	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-71.5	139.8	179.7	0	0	0	0	0	111.6	F31 Y37 M58	F31-A35 HydrophobicContact CD1-CB 3.77Å; F31-A35 HydrophobicContact CE1-CB 3.43Å; F31-A35 VanDerWaalsContact CE1-CB 3.43Å; F31-A35 HydrophobicContact CE2-CB 4.22Å; F31-A35 HydrophobicContact CG-CB 4.34Å; F31-A35 HydrophobicContact CZ-CB 3.67Å; F31-A35 VanDerWaalsContact O-CB 3.22Å; F31-A35 WeakPolarHBondContact O-CB 3.24Å; F31-A35 PolarHBondContact O-N 2.92Å; A35-Y37 HydrophobicContact CB-CD2 4.47Å; A35-Y37 HydrophobicContact CB-CE2 3.8Å; A35-M58 HydrophobicContact CB-SD 4.35Å
36	V	90	Very high	82.3	Confident	79 Å²	79	74.2 Å²	74.2	48%	0.479	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-98.6	118.1	171.9	178.4	0	0	0	0	107.7	Y54 M58	V36-Y54 HydrophobicContact CB-CE2 4.41Å; V36-Y54 WeakPolarHBondContact O-CE2 3.49Å; V36-Y54 VanDerWaalsContact O-CZ 3.29Å; V36-Y54 PolarHBondContact O-OH 3.03Å; V36-M58 HydrophobicContact CB-CE 4.3Å; V36-M58 HydrophobicContact CB-SD 4.48Å; V36-M58 HydrophobicContact CG2-CE 4.4Å
37	Y	87.8	Confident	83.9	Confident	46 Å²	46	77.1 Å²	77.1	18%	0.18	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-97.1	140.1	177	-63.1	-84.4	0	0	0	110.1	A35 L77 A92 D94	A35-Y37 HydrophobicContact CB-CD2 4.47Å; A35-Y37 HydrophobicContact CB-CE2 3.8Å; Y37-L77 HydrophobicContact CD1-CD2 4.02Å; Y37-L77 HydrophobicContact CE1-CB 4.37Å; Y37-L77 HydrophobicContact CE1-CD2 3.79Å; Y37-A92 VanDerWaalsContact CD1-O 3.29Å; Y37-A92 WeakPolarHBondContact CD1-O 3.48Å; Y37-D94 HydrophobicContact CD1-CB 4.32Å; Y37-D94 HydrophobicContact CD2-CB 3.84Å; Y37-D94 HydrophobicContact CE2-CB 4.33Å; Y37-D94 HydrophobicContact CG-CB 3.84Å
38	F	86.4	Confident	85	Confident	45 Å²	45	72.3 Å²	72.3	20%	0.197	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-103.9	148.5	169.5	-75.1	-68.5	0	0	0	110	E42 W43 L46 Y54 W88	F38-E42 HydrophobicContact CB-CB 4.34Å; F38-E42 HydrophobicContact CD1-CB 3.76Å; F38-E42 HydrophobicContact CG-CB 4.49Å; F38-W43 HydrophobicContact CB-CB 4.4Å; F38-W43 HydrophobicContact CB-CE3 4.35Å; F38-W43 AromaticContact CD2-CE3 3.93Å; F38-W43 HydrophobicContact CD2-CE3 3.93Å; F38-W43 HydrophobicContact CD2-CZ3 4.17Å; F38-W43 HydrophobicContact CG-CE3 4.39Å; F38-L46 HydrophobicContact CD1-CD1 4.47Å; F38-L46 HydrophobicContact CD2-CD1 3.98Å; F38-L46 HydrophobicContact CE1-CD1 4.26Å; F38-L46 HydrophobicContact CE2-CD1 3.72Å; F38-L46 HydrophobicContact CG-CD1 4.34Å; F38-L46 HydrophobicContact CZ-CD1 3.88Å; F38-L46 HydrophobicContact CZ-CD2 4.42Å; F38-Y54 AromaticContact CD2-CD2 3.99Å; F38-Y54 HydrophobicContact CD2-CD2 3.99Å; F38-Y54 HydrophobicContact CD2-CE1 4.34Å; F38-Y54 AromaticContact CD2-CE2 3.71Å; F38-Y54 HydrophobicContact CD2-CE2 3.71Å; F38-Y54 HydrophobicContact CD2-CG 4.38Å; F38-Y54 AromaticContact CD2-CZ 3.88Å; F38-Y54 AromaticContact CE2-CD2 3.44Å; F38-Y54 HydrophobicContact CE2-CD2 3.44Å; F38-Y54 VanDerWaalsContact CE2-CD2 3.44Å; F38-Y54 AromaticContact CE2-CE2 3.55Å; F38-Y54 HydrophobicContact CE2-CE2 3.55Å; F38-Y54 AromaticContact CE2-CG 3.98Å; F38-Y54 HydrophobicContact CE2-CG 3.98Å; F38-W88 HydrophobicContact CB-CH2 4.22Å; F38-W88 HydrophobicContact CB-CZ3 4.39Å; F38-W88 WeakPolarHBondContact O-CH2 3.46Å; F38-W88 WeakPolarHBondContact O-CZ2 3.45Å
39	S	80.5	Confident	85.9	Confident	32 Å²	32	72.8 Å²	72.8	22%	0.224	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-75.5	161.3	160.8	63.8	0	0	0	0	110.6	E41 E42 W43	S39-E41 PolarHBondContact O-N 3.27Å; S39-E42 WeakPolarHBondContact CB-OE2 3.23Å; S39-E42 PolarHBondContact N-OE2 3.39Å; S39-E42 PolarHBondContact O-N 3.05Å; S39-E42 VanDerWaalsContact O-N 3.16Å; S39-E42 WeakPolarHBondContact OG-CB 3.4Å; S39-E42 VanDerWaalsContact OG-CD 3.23Å; S39-E42 VanDerWaalsContact OG-CG 3.22Å; S39-E42 WeakPolarHBondContact OG-CG 3.45Å; S39-E42 PolarHBondContact OG-N 3.32Å; S39-E42 PolarHBondContact OG-OE2 2.98Å; S39-W43 WeakPolarHBondContact O-CB 3.23Å; S39-W43 PolarHBondContact O-N 3.35Å
40	S	79.4	Confident	86.5	Confident	70 Å²	70	72.2 Å²	72.2	49%	0.49	39%	0.387	S	S	.	.	H	α-helix	trans	-53.7	-38.9	175	-176.9	0	0	0	0	112.6	G44 W88	S40-G44 PolarHBondContact O-N 2.71Å; S40-W88 VanDerWaalsContact CB-CD1 3.42Å
41	E	80.8	Confident	86.8	Confident	121 Å²	121	68.2 Å²	68.2	57%	0.565	37%	0.369	S	S	*	.	H	α-helix	trans	-71.7	-40	-179.5	-159.4	-165.2	-163.5	0	0	112.1	S39 G44 R45	S39-E41 PolarHBondContact O-N 3.27Å; E41-G44 PolarHBondContact O-N 2.83Å; E41-R45 WeakPolarHBondContact O-CG 3.27Å; E41-R45 PolarHBondContact O-N 3.35Å; E41-R45 IonicContact OE1-CZ 3.37Å; E41-R45 IonicContact OE1-NH1 3.96Å; E41-R45 IonicContact OE1-NH2 2.85Å; E41-R45 PolarHBondContact OE1-NH2 3.48Å; E41-R45 IonicContact OE2-CZ 3.06Å; E41-R45 IonicContact OE2-NH1 3.17Å; E41-R45 PolarHBondContact OE2-NH1 3.07Å; E41-R45 IonicContact OE2-NH2 2.94Å; E41-R45 PolarHBondContact OE2-NH2 2.86Å
42	E	87.6	Confident	86.9	Confident	92 Å²	92	70.8 Å²	70.8	43%	0.43	39%	0.386	S	S	.	.	H	α-helix	trans	-67.1	-43.1	175.3	-70.2	164.1	142.1	0	0	111.3	F38 S39 G44 R45 L46	F38-E42 HydrophobicContact CB-CB 4.34Å; F38-E42 HydrophobicContact CD1-CB 3.76Å; F38-E42 HydrophobicContact CG-CB 4.49Å; S39-E42 WeakPolarHBondContact CB-OE2 3.23Å; S39-E42 PolarHBondContact N-OE2 3.39Å; S39-E42 PolarHBondContact O-N 3.05Å; S39-E42 VanDerWaalsContact O-N 3.16Å; S39-E42 WeakPolarHBondContact OG-CB 3.4Å; S39-E42 VanDerWaalsContact OG-CD 3.23Å; S39-E42 VanDerWaalsContact OG-CG 3.22Å; S39-E42 WeakPolarHBondContact OG-CG 3.45Å; S39-E42 PolarHBondContact OG-N 3.32Å; S39-E42 PolarHBondContact OG-OE2 2.98Å; E42-G44 VanDerWaalsContact C-N 3.29Å; E42-G44 PolarHBondContact O-N 2.8Å; E42-R45 WeakPolarHBondContact O-CB 3.43Å; E42-R45 PolarHBondContact O-N 3.07Å; E42-L46 PolarHBondContact O-N 2.97Å
43	W	86.6	Confident	87.2	Confident	6 Å²	6	73.8 Å²	73.8	2%	0.023	40%	0.395	C	S	.	.	H	α-helix	trans	-58.4	-41.4	175.2	-172.8	-103.7	0	0	0	112	F38 S39 R45 L46 R51 Y54 W80 D86 W88	F38-W43 HydrophobicContact CB-CB 4.4Å; F38-W43 HydrophobicContact CB-CE3 4.35Å; F38-W43 AromaticContact CD2-CE3 3.93Å; F38-W43 HydrophobicContact CD2-CE3 3.93Å; F38-W43 HydrophobicContact CD2-CZ3 4.17Å; F38-W43 HydrophobicContact CG-CE3 4.39Å; S39-W43 WeakPolarHBondContact O-CB 3.23Å; S39-W43 PolarHBondContact O-N 3.35Å; W43-R45 PolarHBondContact O-N 3.06Å; W43-L46 HydrophobicContact CD2-CD1 4.48Å; W43-L46 HydrophobicContact CE3-CD1 3.7Å; W43-L46 HydrophobicContact CZ3-CD1 3.97Å; W43-L46 PolarHBondContact O-N 3.36Å; W43-R51 HydrophobicContact CD2-CG 4.39Å; W43-R51 HydrophobicContact CH2-CB 3.74Å; W43-R51 HydrophobicContact CH2-CG 3.84Å; W43-R51 HydrophobicContact CZ2-CB 3.77Å; W43-R51 HydrophobicContact CZ2-CG 3.66Å; W43-R51 HydrophobicContact CZ3-CB 4.48Å; W43-R51 HydrophobicContact CZ3-CG 4.27Å; W43-R51 PolarHBondContact O-NE 3.21Å; W43-R51 VanDerWaalsContact O-NE 3.07Å; W43-R51 PolarHBondContact O-NH2 2.81Å; W43-Y54 HydrophobicContact CE3-CD1 4.48Å; W43-Y54 AromaticContact CH2-CD1 3.66Å; W43-Y54 HydrophobicContact CH2-CD1 3.66Å; W43-Y54 HydrophobicContact CH2-CE1 4.19Å; W43-Y54 AromaticContact CZ3-CD1 3.3Å; W43-Y54 HydrophobicContact CZ3-CD1 3.3Å; W43-Y54 AromaticContact CZ3-CE1 3.66Å; W43-Y54 HydrophobicContact CZ3-CE1 3.66Å; W43-Y54 AromaticContact CZ3-CG 3.96Å; W43-Y54 HydrophobicContact CZ3-CG 3.96Å; W43-W80 HydrophobicContact CD2-CH2 4.19Å; W43-W80 AromaticContact CE2-CH2 3.66Å; W43-W80 AromaticContact CH2-CH2 3.97Å; W43-W80 HydrophobicContact CH2-CH2 3.97Å; W43-W80 HydrophobicContact CH2-CZ3 4.34Å; W43-W80 AromaticContact CZ2-CH2 3.54Å; W43-W80 HydrophobicContact CZ2-CH2 3.54Å; W43-W80 HydrophobicContact CZ2-CZ2 4.36Å; W43-W80 HydrophobicContact CZ2-CZ3 4.34Å; W43-W80 HydrophobicContact CZ3-CH2 4.46Å; W43-D86 PolarHBondContact NE1-O 3.35Å; W43-W88 HydrophobicContact CB-CD2 4.26Å; W43-W88 HydrophobicContact CB-CE3 3.62Å; W43-W88 HydrophobicContact CB-CZ3 3.91Å; W43-W88 AromaticContact CD1-CE3 3.68Å; W43-W88 AromaticContact CD2-CE3 3.82Å; W43-W88 HydrophobicContact CD2-CE3 3.82Å; W43-W88 AromaticContact CD2-CZ3 3.88Å; W43-W88 HydrophobicContact CD2-CZ3 3.88Å; W43-W88 HydrophobicContact CE3-CE3 4.44Å; W43-W88 HydrophobicContact CE3-CZ3 4.04Å; W43-W88 HydrophobicContact CG-CD2 4.34Å; W43-W88 AromaticContact CG-CE3 3.4Å; W43-W88 HydrophobicContact CG-CE3 3.4Å; W43-W88 VanDerWaalsContact CG-CE3 3.4Å; W43-W88 AromaticContact CG-CZ3 3.83Å; W43-W88 HydrophobicContact CG-CZ3 3.83Å
44	G	84.7	Confident	87.7	Confident	51 Å²	51	70.6 Å²	70.6	53%	0.526	38%	0.377	S	S	.	.	H	α-helix	trans	-61.2	-29	175	0	0	0	0	0	113.9	S40 E41 E42 R51	S40-G44 PolarHBondContact O-N 2.71Å; E41-G44 PolarHBondContact O-N 2.83Å; E42-G44 VanDerWaalsContact C-N 3.29Å; E42-G44 PolarHBondContact O-N 2.8Å; G44-R51 PolarHBondContact O-NH2 3.24Å; G44-R51 VanDerWaalsContact O-NH2 3.14Å
45	R	89.5	Confident	87.8	Confident	160 Å²	160	68.5 Å²	68.5	60%	0.604	36%	0.362	S	S	*	.	H	α-helix	trans	-84.1	-16.4	178.5	-68.8	174.7	178.9	123.3	1.2	114	E41 E42 W43	E41-R45 WeakPolarHBondContact O-CG 3.27Å; E41-R45 PolarHBondContact O-N 3.35Å; E41-R45 IonicContact OE1-CZ 3.37Å; E41-R45 IonicContact OE1-NH1 3.96Å; E41-R45 IonicContact OE1-NH2 2.85Å; E41-R45 PolarHBondContact OE1-NH2 3.48Å; E41-R45 IonicContact OE2-CZ 3.06Å; E41-R45 IonicContact OE2-NH1 3.17Å; E41-R45 PolarHBondContact OE2-NH1 3.07Å; E41-R45 IonicContact OE2-NH2 2.94Å; E41-R45 PolarHBondContact OE2-NH2 2.86Å; E42-R45 WeakPolarHBondContact O-CB 3.43Å; E42-R45 PolarHBondContact O-N 3.07Å; W43-R45 PolarHBondContact O-N 3.06Å
46	L	88.3	Confident	87.9	Confident	27 Å²	27	71.6 Å²	71.6	14%	0.141	38%	0.376	C	S	.	.	S	Bend	trans	-70	137.7	177.9	-66.3	176.6	0	0	0	111.1	F38 E42 W43 Q50 R51	F38-L46 HydrophobicContact CD1-CD1 4.47Å; F38-L46 HydrophobicContact CD2-CD1 3.98Å; F38-L46 HydrophobicContact CE1-CD1 4.26Å; F38-L46 HydrophobicContact CE2-CD1 3.72Å; F38-L46 HydrophobicContact CG-CD1 4.34Å; F38-L46 HydrophobicContact CZ-CD1 3.88Å; F38-L46 HydrophobicContact CZ-CD2 4.42Å; E42-L46 PolarHBondContact O-N 2.97Å; W43-L46 HydrophobicContact CD2-CD1 4.48Å; W43-L46 HydrophobicContact CE3-CD1 3.7Å; W43-L46 HydrophobicContact CZ3-CD1 3.97Å; W43-L46 PolarHBondContact O-N 3.36Å; L46-Q50 HydrophobicContact CB-CB 4.23Å; L46-Q50 HydrophobicContact CD2-CB 4.12Å; L46-R51 HydrophobicContact CB-CG 3.79Å; L46-R51 HydrophobicContact CD1-CG 4.4Å; L46-R51 PolarHBondContact O-NE 2.98Å; L46-R51 PolarHBondContact O-NH2 3.45Å
47	R	89.9	Confident	88.1	Confident	184 Å²	184	70.7 Å²	70.7	69%	0.694	37%	0.371	S	S	*	.			trans	-69.4	154.5	169.6	-69.4	-174.9	-116.4	-128.6	-0.8	110.4	A49 Q50 R51	R47-A49 VanDerWaalsContact C-N 3.27Å; R47-A49 PolarHBondContact O-N 3.33Å; R47-A49 VanDerWaalsContact O-N 3.16Å; R47-Q50 HydrophobicContact CB-CG 4.42Å; R47-Q50 WeakPolarHBondContact O-CA 3.01Å; R47-Q50 WeakPolarHBondContact O-CB 3.49Å; R47-Q50 PolarHBondContact O-N 3.01Å; R47-R51 PolarHBondContact O-N 3Å
48	P	88.3	Confident	88.4	Confident	90 Å²	90	68.8 Å²	68.8	58%	0.584	36%	0.364	S	S	*	.	H	α-helix	trans	-48.7	-45.2	177.6	-29.8	35.6	0	0	0	113.7	Q50 R51 T52	P48-Q50 VanDerWaalsContact C-N 3.32Å; P48-Q50 PolarHBondContact O-N 2.92Å; P48-R51 WeakPolarHBondContact O-CB 3.42Å; P48-R51 PolarHBondContact O-N 2.88Å; P48-R51 VanDerWaalsContact O-N 3.13Å; P48-T52 PolarHBondContact O-N 3.15Å; P48-T52 PolarHBondContact O-OG1 3.22Å
49	A	88.8	Confident	88.6	Confident	77 Å²	77	70.4 Å²	70.4	64%	0.636	37%	0.369	S	S	*	.	H	α-helix	trans	-61.8	-34.4	177.2	0	0	0	0	0	114	R47 L53	R47-A49 VanDerWaalsContact C-N 3.27Å; R47-A49 PolarHBondContact O-N 3.33Å; R47-A49 VanDerWaalsContact O-N 3.16Å; A49-L53 WeakPolarHBondContact O-CB 3.43Å; A49-L53 PolarHBondContact O-N 3.23Å
50	Q	91.8	Very high	89	Confident	89 Å²	89	74.9 Å²	74.9	42%	0.416	39%	0.386	S	S	.	.	H	α-helix	trans	-72.5	-36.1	175.9	-64.8	176.6	-70.8	0	0	111.3	L46 R47 P48 Y54	L46-Q50 HydrophobicContact CB-CB 4.23Å; L46-Q50 HydrophobicContact CD2-CB 4.12Å; R47-Q50 HydrophobicContact CB-CG 4.42Å; R47-Q50 WeakPolarHBondContact O-CA 3.01Å; R47-Q50 WeakPolarHBondContact O-CB 3.49Å; R47-Q50 PolarHBondContact O-N 3.01Å; P48-Q50 VanDerWaalsContact C-N 3.32Å; P48-Q50 PolarHBondContact O-N 2.92Å; Q50-Y54 WeakPolarHBondContact O-CB 3.1Å; Q50-Y54 PolarHBondContact O-N 3.41Å
51	R	90.7	Very high	89.5	Confident	39 Å²	39	72.9 Å²	72.9	15%	0.147	37%	0.371	C	S	.	.	H	α-helix	trans	-62.9	-46.5	173.4	-64.7	-178.7	-175.2	134.7	4.5	110.4	W43 G44 L46 R47 P48 Y54 R55	W43-R51 HydrophobicContact CD2-CG 4.39Å; W43-R51 HydrophobicContact CH2-CB 3.74Å; W43-R51 HydrophobicContact CH2-CG 3.84Å; W43-R51 HydrophobicContact CZ2-CB 3.77Å; W43-R51 HydrophobicContact CZ2-CG 3.66Å; W43-R51 HydrophobicContact CZ3-CB 4.48Å; W43-R51 HydrophobicContact CZ3-CG 4.27Å; W43-R51 PolarHBondContact O-NE 3.21Å; W43-R51 VanDerWaalsContact O-NE 3.07Å; W43-R51 PolarHBondContact O-NH2 2.81Å; G44-R51 PolarHBondContact O-NH2 3.24Å; G44-R51 VanDerWaalsContact O-NH2 3.14Å; L46-R51 HydrophobicContact CB-CG 3.79Å; L46-R51 HydrophobicContact CD1-CG 4.4Å; L46-R51 PolarHBondContact O-NE 2.98Å; L46-R51 PolarHBondContact O-NH2 3.45Å; R47-R51 PolarHBondContact O-N 3Å; P48-R51 WeakPolarHBondContact O-CB 3.42Å; P48-R51 PolarHBondContact O-N 2.88Å; P48-R51 VanDerWaalsContact O-N 3.13Å; R51-Y54 WeakPolarHBondContact O-CB 3.46Å; R51-Y54 PolarHBondContact O-N 3.12Å; R51-R55 WeakPolarHBondContact O-CG 3.42Å; R51-R55 PolarHBondContact O-N 3.27Å
52	T	89.5	Confident	90	Very high	71 Å²	71	69.5 Å²	69.5	44%	0.436	35%	0.353	S	S	.	.	H	α-helix	trans	-56.5	-53.2	174.8	-54.8	0	0	0	0	111.5	P48 Y54 R55 D56	P48-T52 PolarHBondContact O-N 3.15Å; P48-T52 PolarHBondContact O-OG1 3.22Å; T52-Y54 VanDerWaalsContact C-N 3.27Å; T52-Y54 PolarHBondContact O-N 3.08Å; T52-R55 WeakPolarHBondContact O-CA 3.24Å; T52-R55 WeakPolarHBondContact O-CB 3.26Å; T52-R55 PolarHBondContact O-N 3.06Å; T52-D56 PolarHBondContact O-N 2.99Å; T52-D56 VanDerWaalsContact O-N 3.07Å
53	L	91.8	Very high	90	Very high	109 Å²	109	67.1 Å²	67.1	57%	0.571	35%	0.354	S	S	*	.	H	α-helix	trans	-57.3	-41.4	178	-179.4	64.7	0	0	0	112.1	A49 R55 D56 V57	A49-L53 WeakPolarHBondContact O-CB 3.43Å; A49-L53 PolarHBondContact O-N 3.23Å; L53-R55 VanDerWaalsContact C-N 3.34Å; L53-R55 PolarHBondContact O-N 2.97Å; L53-D56 PolarHBondContact O-N 2.72Å; L53-V57 HydrophobicContact CD1-CG2 4.12Å; L53-V57 HydrophobicContact CG-CG2 4.28Å; L53-V57 VanDerWaalsContact O-CG2 3.27Å; L53-V57 WeakPolarHBondContact O-CG2 3.49Å; L53-V57 PolarHBondContact O-N 2.9Å
54	Y	92.8	Very high	90	Very high	18 Å²	18	71.7 Å²	71.7	7%	0.071	38%	0.378	C	S	.	.	H	α-helix	trans	-61.4	-41.6	175.5	173	-98.4	0	0	0	112.4	V36 F38 W43 Q50 R51 T52 D56 V57 M58 L81	V36-Y54 HydrophobicContact CB-CE2 4.41Å; V36-Y54 WeakPolarHBondContact O-CE2 3.49Å; V36-Y54 VanDerWaalsContact O-CZ 3.29Å; V36-Y54 PolarHBondContact O-OH 3.03Å; F38-Y54 AromaticContact CD2-CD2 3.99Å; F38-Y54 HydrophobicContact CD2-CD2 3.99Å; F38-Y54 HydrophobicContact CD2-CE1 4.34Å; F38-Y54 AromaticContact CD2-CE2 3.71Å; F38-Y54 HydrophobicContact CD2-CE2 3.71Å; F38-Y54 HydrophobicContact CD2-CG 4.38Å; F38-Y54 AromaticContact CD2-CZ 3.88Å; F38-Y54 AromaticContact CE2-CD2 3.44Å; F38-Y54 HydrophobicContact CE2-CD2 3.44Å; F38-Y54 VanDerWaalsContact CE2-CD2 3.44Å; F38-Y54 AromaticContact CE2-CE2 3.55Å; F38-Y54 HydrophobicContact CE2-CE2 3.55Å; F38-Y54 AromaticContact CE2-CG 3.98Å; F38-Y54 HydrophobicContact CE2-CG 3.98Å; W43-Y54 HydrophobicContact CE3-CD1 4.48Å; W43-Y54 AromaticContact CH2-CD1 3.66Å; W43-Y54 HydrophobicContact CH2-CD1 3.66Å; W43-Y54 HydrophobicContact CH2-CE1 4.19Å; W43-Y54 AromaticContact CZ3-CD1 3.3Å; W43-Y54 HydrophobicContact CZ3-CD1 3.3Å; W43-Y54 AromaticContact CZ3-CE1 3.66Å; W43-Y54 HydrophobicContact CZ3-CE1 3.66Å; W43-Y54 AromaticContact CZ3-CG 3.96Å; W43-Y54 HydrophobicContact CZ3-CG 3.96Å; Q50-Y54 WeakPolarHBondContact O-CB 3.1Å; Q50-Y54 PolarHBondContact O-N 3.41Å; R51-Y54 WeakPolarHBondContact O-CB 3.46Å; R51-Y54 PolarHBondContact O-N 3.12Å; T52-Y54 VanDerWaalsContact C-N 3.27Å; T52-Y54 PolarHBondContact O-N 3.08Å; Y54-D56 VanDerWaalsContact C-N 3.29Å; Y54-D56 PolarHBondContact O-N 3.36Å; Y54-V57 PolarHBondContact O-N 3.33Å; Y54-M58 HydrophobicContact CD1-CG 4.34Å; Y54-M58 HydrophobicContact CD2-CG 3.84Å; Y54-M58 HydrophobicContact CE1-CG 4Å; Y54-M58 HydrophobicContact CE2-CE 4.44Å; Y54-M58 HydrophobicContact CE2-CG 3.43Å; Y54-M58 VanDerWaalsContact CE2-CG 3.43Å; Y54-M58 HydrophobicContact CE2-SD 3.91Å; Y54-M58 HydrophobicContact CG-CG 4.31Å; Y54-M58 WeakPolarHBondContact O-CB 3.45Å; Y54-M58 WeakPolarHBondContact O-CG 3.5Å; Y54-M58 PolarHBondContact O-N 3.31Å; Y54-L81 HydrophobicContact CD1-CD2 4.01Å; Y54-L81 HydrophobicContact CE1-CD1 4.2Å; Y54-L81 HydrophobicContact CE1-CD2 3.91Å
55	R	90.4	Very high	90	Very high	18 Å²	18	69.7 Å²	69.7	7%	0.068	36%	0.356	C	S	.	.	H	α-helix	trans	-58.1	-46.9	175.9	-50.5	-152.3	166.7	88.7	-4.8	110.2	R51 T52 L53 R59 L81 T85 D86	R51-R55 WeakPolarHBondContact O-CG 3.42Å; R51-R55 PolarHBondContact O-N 3.27Å; T52-R55 WeakPolarHBondContact O-CA 3.24Å; T52-R55 WeakPolarHBondContact O-CB 3.26Å; T52-R55 PolarHBondContact O-N 3.06Å; L53-R55 VanDerWaalsContact C-N 3.34Å; L53-R55 PolarHBondContact O-N 2.97Å; R55-R59 WeakPolarHBondContact O-CB 3.14Å; R55-R59 VanDerWaalsContact O-CG 3.23Å; R55-R59 WeakPolarHBondContact O-CG 3.28Å; R55-R59 PolarHBondContact O-N 3.36Å; R55-R59 VanDerWaalsContact O-N 3.07Å; R55-L81 HydrophobicContact CB-CD2 4.13Å; R55-L81 HydrophobicContact CG-CD2 3.77Å; R55-T85 PolarHBondContact NH2-O 2.81Å; R55-D86 IonicContact CZ-OD1 3.56Å; R55-D86 IonicContact NH1-OD1 4Å; R55-D86 IonicContact NH2-OD1 3.62Å; R55-D86 PolarHBondContact NH2-OD1 2.81Å
56	D	90.7	Very high	89.7	Confident	79 Å²	79	63.9 Å²	63.9	42%	0.422	35%	0.345	S	S	.	.	H	α-helix	trans	-63.7	-50.3	-178	-60.6	-25.5	0	0	0	111.2	T52 L53 Y54 M58 R59 E60	T52-D56 PolarHBondContact O-N 2.99Å; T52-D56 VanDerWaalsContact O-N 3.07Å; L53-D56 PolarHBondContact O-N 2.72Å; Y54-D56 VanDerWaalsContact C-N 3.29Å; Y54-D56 PolarHBondContact O-N 3.36Å; D56-M58 PolarHBondContact O-N 3.07Å; D56-R59 PolarHBondContact O-N 3.42Å; D56-E60 WeakPolarHBondContact O-CB 3.47Å; D56-E60 PolarHBondContact O-N 3.01Å
57	V	94.7	Very high	89.2	Confident	61 Å²	61	66.9 Å²	66.9	37%	0.37	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-42.5	-178.8	174.6	0	0	0	0	111.8	L53 Y54 E60 T61	L53-V57 HydrophobicContact CD1-CG2 4.12Å; L53-V57 HydrophobicContact CG-CG2 4.28Å; L53-V57 VanDerWaalsContact O-CG2 3.27Å; L53-V57 WeakPolarHBondContact O-CG2 3.49Å; L53-V57 PolarHBondContact O-N 2.9Å; Y54-V57 PolarHBondContact O-N 3.33Å; V57-E60 PolarHBondContact O-N 3.42Å; V57-T61 WeakPolarHBondContact O-CB 3.42Å; V57-T61 PolarHBondContact O-N 3.15Å; V57-T61 PolarHBondContact O-OG1 3.46Å
58	M	93.3	Very high	88.8	Confident	6 Å²	6	63.9 Å²	63.9	3%	0.03	37%	0.371	C	S	.	.	H	α-helix	trans	-70.7	-35.7	179.8	-68.9	-63.4	98.5	0	0	112.5	A35 V36 Y54 D56 Y62 I78 L81	A35-M58 HydrophobicContact CB-SD 4.35Å; V36-M58 HydrophobicContact CB-CE 4.3Å; V36-M58 HydrophobicContact CB-SD 4.48Å; V36-M58 HydrophobicContact CG2-CE 4.4Å; Y54-M58 HydrophobicContact CD1-CG 4.34Å; Y54-M58 HydrophobicContact CD2-CG 3.84Å; Y54-M58 HydrophobicContact CE1-CG 4Å; Y54-M58 HydrophobicContact CE2-CE 4.44Å; Y54-M58 HydrophobicContact CE2-CG 3.43Å; Y54-M58 VanDerWaalsContact CE2-CG 3.43Å; Y54-M58 HydrophobicContact CE2-SD 3.91Å; Y54-M58 HydrophobicContact CG-CG 4.31Å; Y54-M58 WeakPolarHBondContact O-CB 3.45Å; Y54-M58 WeakPolarHBondContact O-CG 3.5Å; Y54-M58 PolarHBondContact O-N 3.31Å; D56-M58 PolarHBondContact O-N 3.07Å; M58-Y62 PolarHBondContact O-N 3.13Å; M58-Y62 VanDerWaalsContact O-N 3.08Å; M58-I78 HydrophobicContact CB-CD1 4.38Å; M58-I78 WeakPolarHBondContact O-CD1 3.35Å; M58-L81 HydrophobicContact CB-CD1 3.53Å; M58-L81 HydrophobicContact CG-CD1 4.16Å
59	R	89.6	Confident	88.4	Confident	78 Å²	78	63 Å²	63	29%	0.294	38%	0.379	S	S	.	.	H	α-helix	trans	-64.9	-45.8	173.1	-73.8	174.7	-171	170.1	6	111.4	R55 D56 Y62 G63 L81 N84	R55-R59 WeakPolarHBondContact O-CB 3.14Å; R55-R59 VanDerWaalsContact O-CG 3.23Å; R55-R59 WeakPolarHBondContact O-CG 3.28Å; R55-R59 PolarHBondContact O-N 3.36Å; R55-R59 VanDerWaalsContact O-N 3.07Å; D56-R59 PolarHBondContact O-N 3.42Å; R59-Y62 PolarHBondContact O-N 3.27Å; R59-G63 PolarHBondContact O-N 2.91Å; R59-L81 PolarHBondContact NH2-O 3.17Å; R59-N84 PolarHBondContact NH2-OD1 3.22Å
60	E	90.5	Very high	87.7	Confident	126 Å²	126	61.3 Å²	61.3	59%	0.589	36%	0.362	S	S	*	.	H	α-helix	trans	-61.2	-45	176.5	-173.6	177.7	179.4	0	0	111.1	D56 V57 Y62 G63 L64	D56-E60 WeakPolarHBondContact O-CB 3.47Å; D56-E60 PolarHBondContact O-N 3.01Å; V57-E60 PolarHBondContact O-N 3.42Å; E60-Y62 VanDerWaalsContact C-N 3.3Å; E60-Y62 PolarHBondContact O-N 3.31Å; E60-G63 WeakPolarHBondContact O-CA 3.22Å; E60-G63 PolarHBondContact O-N 3.45Å; E60-G63 VanDerWaalsContact O-N 3.08Å; E60-L64 HydrophobicContact CG-CD1 4.42Å; E60-L64 WeakPolarHBondContact O-CG 3.39Å; E60-L64 PolarHBondContact O-N 3.08Å
61	T	90.2	Very high	86.7	Confident	29 Å²	29	59.3 Å²	59.3	18%	0.178	36%	0.36	C	S	.	.	H	α-helix	trans	-57.3	-42.5	176.5	-58.2	0	0	0	0	111.8	F31 V34 V57 L64 L65	F31-T61 HydrophobicContact CE2-CG2 4.33Å; V34-T61 HydrophobicContact CB-CG2 4.17Å; V34-T61 HydrophobicContact CG2-CG2 3.59Å; V57-T61 WeakPolarHBondContact O-CB 3.42Å; V57-T61 PolarHBondContact O-N 3.15Å; V57-T61 PolarHBondContact O-OG1 3.46Å; T61-L64 PolarHBondContact O-N 3.38Å; T61-L65 PolarHBondContact O-N 3.49Å
62	Y	90.4	Very high	86	Confident	49 Å²	49	59.7 Å²	59.7	19%	0.192	38%	0.376	C	S	.	.	H	α-helix	trans	-67.1	-40.1	175.7	-178.3	-111.8	0	0	0	112.3	F31 M58 R59 E60 L64 L65 G66 G72 K74 P75 I78	F31-Y62 AromaticContact CD2-CD2 3.96Å; F31-Y62 HydrophobicContact CD2-CD2 3.96Å; F31-Y62 HydrophobicContact CD2-CG 4.48Å; F31-Y62 HydrophobicContact CE2-CD2 4.44Å; F31-Y62 HydrophobicContact CG-CD2 4.34Å; M58-Y62 PolarHBondContact O-N 3.13Å; M58-Y62 VanDerWaalsContact O-N 3.08Å; R59-Y62 PolarHBondContact O-N 3.27Å; E60-Y62 VanDerWaalsContact C-N 3.3Å; E60-Y62 PolarHBondContact O-N 3.31Å; Y62-L64 PolarHBondContact O-N 3.3Å; Y62-L65 PolarHBondContact O-N 2.94Å; Y62-G66 PolarHBondContact O-N 3.46Å; Y62-G66 VanDerWaalsContact O-N 3.12Å; Y62-G72 PolarHBondContact OH-O 3.46Å; Y62-K74 HydrophobicContact CE1-CG 4.39Å; Y62-K74 WeakPolarHBondContact OH-CA 3.37Å; Y62-P75 HydrophobicContact CD2-CG 4.12Å; Y62-P75 HydrophobicContact CE2-CG 4.08Å; Y62-I78 HydrophobicContact CD1-CG1 4.31Å; Y62-I78 HydrophobicContact CD1-CG2 4.12Å; Y62-I78 HydrophobicContact CD2-CG1 4.31Å; Y62-I78 HydrophobicContact CG-CD1 4.31Å; Y62-I78 HydrophobicContact CG-CG1 3.92Å
63	G	87.9	Confident	85.5	Confident	43 Å²	43	62.3 Å²	62.3	44%	0.443	39%	0.394	S	S	.	.	H	α-helix	trans	-59.5	-43	173.8	0	0	0	0	0	113	R59 E60 L65 G66 A67	R59-G63 PolarHBondContact O-N 2.91Å; E60-G63 WeakPolarHBondContact O-CA 3.22Å; E60-G63 PolarHBondContact O-N 3.45Å; E60-G63 VanDerWaalsContact O-N 3.08Å; G63-L65 VanDerWaalsContact C-N 3.35Å; G63-L65 PolarHBondContact O-N 3.41Å; G63-G66 WeakPolarHBondContact O-CA 3.18Å; G63-G66 PolarHBondContact O-N 3.41Å; G63-A67 PolarHBondContact O-N 3.28Å
64	L	87.1	Confident	85.1	Confident	101 Å²	101	61.7 Å²	61.7	53%	0.529	39%	0.387	S	S	.	.	H	α-helix	trans	-62.1	-39.5	176.7	-70.3	172.9	0	0	0	112.3	E60 T61 Y62 G66 A67 L68	E60-L64 HydrophobicContact CG-CD1 4.42Å; E60-L64 WeakPolarHBondContact O-CG 3.39Å; E60-L64 PolarHBondContact O-N 3.08Å; T61-L64 PolarHBondContact O-N 3.38Å; Y62-L64 PolarHBondContact O-N 3.3Å; L64-G66 VanDerWaalsContact C-N 3.28Å; L64-G66 PolarHBondContact O-N 3.4Å; L64-A67 PolarHBondContact O-N 2.8Å; L64-L68 WeakPolarHBondContact O-CG 3.44Å; L64-L68 PolarHBondContact O-N 2.81Å
65	L	84.8	Confident	84.8	Confident	10 Å²	10	62 Å²	62	5%	0.052	39%	0.391	C	S	.	.	H	α-helix	trans	-65.1	-33.9	173.5	-69.4	173.7	0	0	0	112.3	F31 V34 T61 Y62 G63 L68 G69 C70 A71	F31-L65 HydrophobicContact CB-CD1 3.68Å; F31-L65 HydrophobicContact CD2-CD1 3.81Å; F31-L65 HydrophobicContact CG-CD1 4.24Å; V34-L65 HydrophobicContact CG2-CD1 3.82Å; V34-L65 HydrophobicContact CG2-CG 4.45Å; T61-L65 PolarHBondContact O-N 3.49Å; Y62-L65 PolarHBondContact O-N 2.94Å; G63-L65 VanDerWaalsContact C-N 3.35Å; G63-L65 PolarHBondContact O-N 3.41Å; L65-L68 PolarHBondContact O-N 2.94Å; L65-G69 PolarHBondContact O-N 3.05Å; L65-C70 HydrophobicContact CD2-CB 4.23Å; L65-C70 CarbonylContact O-C 3.45Å; L65-C70 WeakPolarHBondContact O-CA 3.41Å; L65-C70 PolarHBondContact O-N 3.07Å; L65-A71 PolarHBondContact O-N 3.14Å; L65-A71 VanDerWaalsContact O-N 3.12Å
66	G	83.3	Confident	84.5	Confident	38 Å²	38	63.7 Å²	63.7	39%	0.392	41%	0.409	S	S	.	.	H	α-helix	trans	-59.8	-49.1	170.5	0	0	0	0	0	112.3	Y62 G63 L64 L68 G69	Y62-G66 PolarHBondContact O-N 3.46Å; Y62-G66 VanDerWaalsContact O-N 3.12Å; G63-G66 WeakPolarHBondContact O-CA 3.18Å; G63-G66 PolarHBondContact O-N 3.41Å; L64-G66 VanDerWaalsContact C-N 3.28Å; L64-G66 PolarHBondContact O-N 3.4Å; G66-L68 PolarHBondContact O-N 3.25Å; G66-G69 PolarHBondContact O-N 2.87Å
67	A	77.7	Confident	84.3	Confident	89 Å²	89	60 Å²	60	74%	0.736	39%	0.39	S	S	*	.	H	α-helix	trans	-61.2	-30.6	176.9	0	0	0	0	0	113	G63 L64 G69	G63-A67 PolarHBondContact O-N 3.28Å; L64-A67 PolarHBondContact O-N 2.8Å; A67-G69 VanDerWaalsContact C-N 3.27Å; A67-G69 PolarHBondContact O-N 3.02Å
68	L	81.5	Confident	84.1	Confident	122 Å²	122	57.2 Å²	57.2	64%	0.639	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	2.9	175.7	-66.5	171.6	0	0	0	114	L64 L65 G66 C70	L64-L68 WeakPolarHBondContact O-CG 3.44Å; L64-L68 PolarHBondContact O-N 2.81Å; L65-L68 PolarHBondContact O-N 2.94Å; G66-L68 PolarHBondContact O-N 3.25Å; L68-C70 HydrophobicContact CB-CB 4.4Å; L68-C70 PolarHBondContact O-N 3.07Å; L68-C70 PolarHBondContact O-SG 3.09Å; L68-C70 VanDerWaalsContact O-SG 3.35Å
69	G	78.4	Confident	83.8	Confident	72 Å²	72	59.3 Å²	59.3	74%	0.742	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	16.9	-174.7	0	0	0	0	0	113.6	L65 G66 A67	L65-G69 PolarHBondContact O-N 3.05Å; G66-G69 PolarHBondContact O-N 2.87Å; A67-G69 VanDerWaalsContact C-N 3.27Å; A67-G69 PolarHBondContact O-N 3.02Å
70	C	74.9	Confident	83.5	Confident	41 Å²	41	55.8 Å²	55.8	28%	0.277	37%	0.372	S	S	.	.			trans	-104.7	4.8	-177.3	-64.7	0	0	0	0	112.6	L65 L68 G72	L65-C70 HydrophobicContact CD2-CB 4.23Å; L65-C70 CarbonylContact O-C 3.45Å; L65-C70 WeakPolarHBondContact O-CA 3.41Å; L65-C70 PolarHBondContact O-N 3.07Å; L68-C70 HydrophobicContact CB-CB 4.4Å; L68-C70 PolarHBondContact O-N 3.07Å; L68-C70 PolarHBondContact O-SG 3.09Å; L68-C70 VanDerWaalsContact O-SG 3.35Å; C70-G72 PolarHBondContact O-N 2.85Å
71	A	70.3	Confident	83.3	Confident	47 Å²	47	49.8 Å²	49.8	39%	0.388	34%	0.344	S	S	.	.			trans	-67.5	107.1	174.9	0	0	0	0	0	110.2	L65	L65-A71 PolarHBondContact O-N 3.14Å; L65-A71 VanDerWaalsContact O-N 3.12Å
72	G	75.4	Confident	83	Confident	47 Å²	47	52.7 Å²	52.7	49%	0.485	36%	0.356	S	S	.	.			trans	-74.3	-166.2	162.4	0	0	0	0	0	111.8	Y62 C70	Y62-G72 PolarHBondContact OH-O 3.46Å; C70-G72 PolarHBondContact O-N 2.85Å
73	P	80.3	Confident	82.6	Confident	125 Å²	125	57.3 Å²	57.3	81%	0.812	37%	0.373	S	S	*	.	S	Bend	trans	-57.5	146.2	173.5	25.3	-33.9	0	0	0	111	P75	P73-P75 VanDerWaalsContact O-CD 3.29Å; P73-P75 WeakPolarHBondContact O-CD 3.25Å; P73-P75 VanDerWaalsContact O-N 3.15Å
74	K	83.8	Confident	82	Confident	97 Å²	97	60.2 Å²	60.2	42%	0.422	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-54.4	117.7	-178	-169.8	176.2	-170.5	165.3	0	111	Y62 I78 E82	Y62-K74 HydrophobicContact CE1-CG 4.39Å; Y62-K74 WeakPolarHBondContact OH-CA 3.37Å; K74-I78 HydrophobicContact CG-CB 4.31Å; K74-I78 HydrophobicContact CG-CG2 4.27Å; K74-E82 WeakPolarHBondContact CE-OE1 3.12Å; K74-E82 WeakPolarHBondContact CE-OE2 3.49Å; K74-E82 IonicContact NZ-OE1 2.74Å; K74-E82 PolarHBondContact NZ-OE1 3.49Å; K74-E82 IonicContact NZ-OE2 3.95Å; K74-E82 PolarHBondContact NZ-OE2 3.15Å
75	P	86	Confident	81.4	Confident	23 Å²	23	58 Å²	58	15%	0.149	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-63.3	143.1	-179.6	-20.7	30.5	0	0	0	111.5	F31 Y62 P73 L77 I78 T79	F31-P75 HydrophobicContact CB-CG 3.93Å; F31-P75 HydrophobicContact CD1-CB 3.69Å; F31-P75 HydrophobicContact CD1-CG 3.28Å; F31-P75 HydrophobicContact CD2-CG 4.47Å; F31-P75 HydrophobicContact CE1-CB 3.89Å; F31-P75 HydrophobicContact CE1-CG 3.82Å; F31-P75 HydrophobicContact CG-CG 3.65Å; Y62-P75 HydrophobicContact CD2-CG 4.12Å; Y62-P75 HydrophobicContact CE2-CG 4.08Å; P73-P75 VanDerWaalsContact O-CD 3.29Å; P73-P75 WeakPolarHBondContact O-CD 3.25Å; P73-P75 VanDerWaalsContact O-N 3.15Å; P75-L77 PolarHBondContact O-N 3.39Å; P75-L77 VanDerWaalsContact O-N 3.16Å; P75-I78 HydrophobicContact CB-CG1 4.26Å; P75-I78 HydrophobicContact CG-CG1 4.14Å; P75-I78 PolarHBondContact O-N 3.39Å; P75-T79 PolarHBondContact O-N 2.86Å; P75-T79 PolarHBondContact O-OG1 3.26Å
76	A	84	Confident	80.9	Confident	54 Å²	54	61.7 Å²	61.7	45%	0.446	39%	0.389	S	S	.	.	H	α-helix	trans	-54.8	-34.8	175.7	0	0	0	0	0	112.5	I78 T79 W80 A91	A76-I78 PolarHBondContact O-N 3.47Å; A76-T79 PolarHBondContact O-N 3.39Å; A76-W80 WeakPolarHBondContact O-CB 3.4Å; A76-W80 PolarHBondContact O-N 2.95Å; A76-A91 HydrophobicContact CB-CB 4.37Å; A76-A91 WeakPolarHBondContact CB-O 3.49Å
77	L	87.3	Confident	80.3	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.016	40%	0.404	C	S	.	.	H	α-helix	trans	-56.9	-45.9	172.8	178.9	64.6	0	0	0	112.2	F31 Y37 P75 W80 L81 A92	F31-L77 HydrophobicContact CE1-CD2 4.03Å; F31-L77 HydrophobicContact CZ-CD2 4.25Å; Y37-L77 HydrophobicContact CD1-CD2 4.02Å; Y37-L77 HydrophobicContact CE1-CB 4.37Å; Y37-L77 HydrophobicContact CE1-CD2 3.79Å; P75-L77 PolarHBondContact O-N 3.39Å; P75-L77 VanDerWaalsContact O-N 3.16Å; L77-W80 HydrophobicContact CD1-CE3 3.95Å; L77-W80 HydrophobicContact CD1-CZ3 4.2Å; L77-W80 PolarHBondContact O-N 3.43Å; L77-L81 HydrophobicContact CD1-CD1 4.26Å; L77-L81 HydrophobicContact CD1-CG 4.26Å; L77-L81 HydrophobicContact CG-CD1 4.06Å; L77-L81 HydrophobicContact CG-CG 4.45Å; L77-L81 WeakPolarHBondContact O-CB 3.41Å; L77-L81 WeakPolarHBondContact O-CG 3.45Å; L77-L81 PolarHBondContact O-N 3.01Å; L77-A92 HydrophobicContact CD1-CB 3.74Å
78	I	88.8	Confident	80.1	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	38%	0.377	C	S	.	.	H	α-helix	trans	-67.6	-43	179.9	-61.6	-60.9	0	0	0	110.5	F31 M58 Y62 K74 P75 A76 W80 L81 E82	F31-I78 HydrophobicContact CE1-CD1 4.34Å; F31-I78 HydrophobicContact CE1-CG1 4.21Å; F31-I78 HydrophobicContact CE2-CD1 3.94Å; F31-I78 HydrophobicContact CE2-CG1 4.29Å; F31-I78 HydrophobicContact CZ-CD1 3.55Å; F31-I78 HydrophobicContact CZ-CG1 3.86Å; M58-I78 HydrophobicContact CB-CD1 4.38Å; M58-I78 WeakPolarHBondContact O-CD1 3.35Å; Y62-I78 HydrophobicContact CD1-CG1 4.31Å; Y62-I78 HydrophobicContact CD1-CG2 4.12Å; Y62-I78 HydrophobicContact CD2-CG1 4.31Å; Y62-I78 HydrophobicContact CG-CD1 4.31Å; Y62-I78 HydrophobicContact CG-CG1 3.92Å; K74-I78 HydrophobicContact CG-CB 4.31Å; K74-I78 HydrophobicContact CG-CG2 4.27Å; P75-I78 HydrophobicContact CB-CG1 4.26Å; P75-I78 HydrophobicContact CG-CG1 4.14Å; P75-I78 PolarHBondContact O-N 3.39Å; A76-I78 PolarHBondContact O-N 3.47Å; I78-W80 VanDerWaalsContact C-N 3.32Å; I78-W80 PolarHBondContact O-N 3.45Å; I78-L81 HydrophobicContact CD1-CD1 4.41Å; I78-L81 PolarHBondContact O-N 2.81Å; I78-E82 WeakPolarHBondContact O-CG 3.17Å; I78-E82 PolarHBondContact O-N 3.41Å
79	T	87.1	Confident	79.7	Confident	51 Å²	51	61.8 Å²	61.8	31%	0.313	36%	0.363	S	S	.	.	H	α-helix	trans	-59.2	-42.1	175.4	-54.5	0	0	0	0	112	P75 A76 R83	P75-T79 PolarHBondContact O-N 2.86Å; P75-T79 PolarHBondContact O-OG1 3.26Å; A76-T79 PolarHBondContact O-N 3.39Å; T79-R83 PolarHBondContact O-N 3.13Å
80	W	83.3	Confident	78.9	Confident	3 Å²	3	60.5 Å²	60.5	1%	0.011	34%	0.341	C	S	.	.	H	α-helix	trans	-66.3	-45.5	174.9	171.5	77.1	0	0	0	111.8	W43 A76 L77 I78 E82 R83 D87 W88 E89 A92	W43-W80 HydrophobicContact CD2-CH2 4.19Å; W43-W80 AromaticContact CE2-CH2 3.66Å; W43-W80 AromaticContact CH2-CH2 3.97Å; W43-W80 HydrophobicContact CH2-CH2 3.97Å; W43-W80 HydrophobicContact CH2-CZ3 4.34Å; W43-W80 AromaticContact CZ2-CH2 3.54Å; W43-W80 HydrophobicContact CZ2-CH2 3.54Å; W43-W80 HydrophobicContact CZ2-CZ2 4.36Å; W43-W80 HydrophobicContact CZ2-CZ3 4.34Å; W43-W80 HydrophobicContact CZ3-CH2 4.46Å; A76-W80 WeakPolarHBondContact O-CB 3.4Å; A76-W80 PolarHBondContact O-N 2.95Å; L77-W80 HydrophobicContact CD1-CE3 3.95Å; L77-W80 HydrophobicContact CD1-CZ3 4.2Å; L77-W80 PolarHBondContact O-N 3.43Å; I78-W80 VanDerWaalsContact C-N 3.32Å; I78-W80 PolarHBondContact O-N 3.45Å; W80-E82 PolarHBondContact O-N 2.68Å; W80-R83 WeakPolarHBondContact O-CB 3.41Å; W80-R83 PolarHBondContact O-N 3.36Å; W80-R83 VanDerWaalsContact O-N 3.12Å; W80-D87 WeakPolarHBondContact CZ2-O 3.4Å; W80-D87 PolarHBondContact NE1-O 3.03Å; W80-W88 AromaticContact CH2-CE3 3.75Å; W80-W88 HydrophobicContact CH2-CE3 3.75Å; W80-W88 AromaticContact CH2-CZ3 3.79Å; W80-W88 HydrophobicContact CH2-CZ3 3.79Å; W80-W88 HydrophobicContact CZ2-CE3 4.04Å; W80-W88 HydrophobicContact CZ2-CZ3 4.48Å; W80-W88 HydrophobicContact CZ3-CE3 4.48Å; W80-W88 HydrophobicContact CZ3-CZ3 4.13Å; W80-E89 VanDerWaalsContact CD1-CB 3.44Å; W80-E89 HydrophobicContact CG-CB 4.21Å; W80-A92 HydrophobicContact CD2-CB 4.01Å; W80-A92 HydrophobicContact CE3-CB 3.82Å; W80-A92 HydrophobicContact CG-CB 4.35Å; W80-A92 HydrophobicContact CZ3-CB 4.31Å
81	L	86.7	Confident	78.2	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-59.3	-35.8	178.3	-75.1	175.7	0	0	0	112.4	Y54 R55 M58 R59 L77 I78 N84	Y54-L81 HydrophobicContact CD1-CD2 4.01Å; Y54-L81 HydrophobicContact CE1-CD1 4.2Å; Y54-L81 HydrophobicContact CE1-CD2 3.91Å; R55-L81 HydrophobicContact CB-CD2 4.13Å; R55-L81 HydrophobicContact CG-CD2 3.77Å; M58-L81 HydrophobicContact CB-CD1 3.53Å; M58-L81 HydrophobicContact CG-CD1 4.16Å; R59-L81 PolarHBondContact NH2-O 3.17Å; L77-L81 HydrophobicContact CD1-CD1 4.26Å; L77-L81 HydrophobicContact CD1-CG 4.26Å; L77-L81 HydrophobicContact CG-CD1 4.06Å; L77-L81 HydrophobicContact CG-CG 4.45Å; L77-L81 WeakPolarHBondContact O-CB 3.41Å; L77-L81 WeakPolarHBondContact O-CG 3.45Å; L77-L81 PolarHBondContact O-N 3.01Å; I78-L81 HydrophobicContact CD1-CD1 4.41Å; I78-L81 PolarHBondContact O-N 2.81Å; L81-N84 PolarHBondContact O-N 3.5Å; L81-N84 PolarHBondContact O-OD1 3.28Å
82	E	85.1	Confident	78.1	Confident	90 Å²	90	58.1 Å²	58.1	42%	0.421	32%	0.324	S	S	.	.	H	α-helix	trans	-69.5	-27.8	177.3	-76.9	175.4	-173.5	0	0	114.6	K74 I78 W80 N84	K74-E82 WeakPolarHBondContact CE-OE1 3.12Å; K74-E82 WeakPolarHBondContact CE-OE2 3.49Å; K74-E82 IonicContact NZ-OE1 2.74Å; K74-E82 PolarHBondContact NZ-OE1 3.49Å; K74-E82 IonicContact NZ-OE2 3.95Å; K74-E82 PolarHBondContact NZ-OE2 3.15Å; I78-E82 WeakPolarHBondContact O-CG 3.17Å; I78-E82 PolarHBondContact O-N 3.41Å; W80-E82 PolarHBondContact O-N 2.68Å; E82-N84 PolarHBondContact O-N 2.92Å; E82-N84 VanDerWaalsContact O-N 3.12Å
83	R	81.6	Confident	77.9	Confident	147 Å²	147	57 Å²	57	56%	0.555	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.7	174.5	-68.2	172.7	177.8	166.1	-3.7	112.5	T79 W80 T85 E89	T79-R83 PolarHBondContact O-N 3.13Å; W80-R83 WeakPolarHBondContact O-CB 3.41Å; W80-R83 PolarHBondContact O-N 3.36Å; W80-R83 VanDerWaalsContact O-N 3.12Å; R83-T85 HydrophobicContact CB-CG2 4.23Å; R83-T85 PolarHBondContact O-N 2.8Å; R83-T85 VanDerWaalsContact O-N 3.14Å; R83-E89 IonicContact NH1-OE1 2.56Å; R83-E89 IonicContact NH1-OE2 2.72Å; R83-E89 PolarHBondContact NH1-OE2 3.37Å
84	N	73.9	Confident	77.7	Confident	103 Å²	103	53 Å²	53	55%	0.551	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	28.4	-179.5	-70.8	-45.4	0	0	0	113.8	R59 L81 E82	R59-N84 PolarHBondContact NH2-OD1 3.22Å; L81-N84 PolarHBondContact O-N 3.5Å; L81-N84 PolarHBondContact O-OD1 3.28Å; E82-N84 PolarHBondContact O-N 2.92Å; E82-N84 VanDerWaalsContact O-N 3.12Å
85	T	75.3	Confident	77.2	Confident	54 Å²	54	52.1 Å²	52.1	33%	0.331	28%	0.284	S	S	.	.			trans	-85.4	145.6	173.4	58.2	0	0	0	0	110.3	R55 R83	R55-T85 PolarHBondContact NH2-O 2.81Å; R83-T85 HydrophobicContact CB-CG2 4.23Å; R83-T85 PolarHBondContact O-N 2.8Å; R83-T85 VanDerWaalsContact O-N 3.14Å
86	D	73.6	Confident	76.5	Confident	89 Å²	89	57 Å²	57	48%	0.476	30%	0.304	S	S	.	.			trans	-86.1	-12.5	172.4	-82.4	-27	0	0	0	112.6	W43 R55 W88	W43-D86 PolarHBondContact NE1-O 3.35Å; R55-D86 IonicContact CZ-OD1 3.56Å; R55-D86 IonicContact NH1-OD1 4Å; R55-D86 IonicContact NH2-OD1 3.62Å; R55-D86 PolarHBondContact NH2-OD1 2.81Å; D86-W88 PolarHBondContact O-N 2.8Å
87	D	71.2	Confident	75.9	Confident	133 Å²	133	58.3 Å²	58.3	71%	0.711	30%	0.301	S	S	*	.	S	Bend	trans	-68.3	122	176.1	-62.5	-51.9	0	0	0	111.1	W80 E89	W80-D87 WeakPolarHBondContact CZ2-O 3.4Å; W80-D87 PolarHBondContact NE1-O 3.03Å; D87-E89 PolarHBondContact O-N 3Å
88	W	74.4	Confident	75.3	Confident	46 Å²	46	63 Å²	63	17%	0.174	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-71.7	118.7	-179	-179.8	-97.4	0	0	0	111.4	F38 S40 W43 W80 D86 A92 L93	F38-W88 HydrophobicContact CB-CH2 4.22Å; F38-W88 HydrophobicContact CB-CZ3 4.39Å; F38-W88 WeakPolarHBondContact O-CH2 3.46Å; F38-W88 WeakPolarHBondContact O-CZ2 3.45Å; S40-W88 VanDerWaalsContact CB-CD1 3.42Å; W43-W88 HydrophobicContact CB-CD2 4.26Å; W43-W88 HydrophobicContact CB-CE3 3.62Å; W43-W88 HydrophobicContact CB-CZ3 3.91Å; W43-W88 AromaticContact CD1-CE3 3.68Å; W43-W88 AromaticContact CD2-CE3 3.82Å; W43-W88 HydrophobicContact CD2-CE3 3.82Å; W43-W88 AromaticContact CD2-CZ3 3.88Å; W43-W88 HydrophobicContact CD2-CZ3 3.88Å; W43-W88 HydrophobicContact CE3-CE3 4.44Å; W43-W88 HydrophobicContact CE3-CZ3 4.04Å; W43-W88 HydrophobicContact CG-CD2 4.34Å; W43-W88 AromaticContact CG-CE3 3.4Å; W43-W88 HydrophobicContact CG-CE3 3.4Å; W43-W88 VanDerWaalsContact CG-CE3 3.4Å; W43-W88 AromaticContact CG-CZ3 3.83Å; W43-W88 HydrophobicContact CG-CZ3 3.83Å; W80-W88 AromaticContact CH2-CE3 3.75Å; W80-W88 HydrophobicContact CH2-CE3 3.75Å; W80-W88 AromaticContact CH2-CZ3 3.79Å; W80-W88 HydrophobicContact CH2-CZ3 3.79Å; W80-W88 HydrophobicContact CZ2-CE3 4.04Å; W80-W88 HydrophobicContact CZ2-CZ3 4.48Å; W80-W88 HydrophobicContact CZ3-CE3 4.48Å; W80-W88 HydrophobicContact CZ3-CZ3 4.13Å; D86-W88 PolarHBondContact O-N 2.8Å; W88-A92 HydrophobicContact CH2-CB 4.12Å; W88-A92 HydrophobicContact CZ2-CB 4.34Å; W88-A92 HydrophobicContact CZ3-CB 4.47Å; W88-L93 HydrophobicContact CZ2-CD2 3.91Å; W88-L93 HydrophobicContact CZ2-CG 4.32Å
89	E	71.8	Confident	74.6	Confident	72 Å²	72	72.2 Å²	72.2	34%	0.336	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-99.9	127.6	177.7	-163.6	172.8	172.7	0	0	110.6	W80 R83 D87 A91 A92	W80-E89 VanDerWaalsContact CD1-CB 3.44Å; W80-E89 HydrophobicContact CG-CB 4.21Å; R83-E89 IonicContact NH1-OE1 2.56Å; R83-E89 IonicContact NH1-OE2 2.72Å; R83-E89 PolarHBondContact NH1-OE2 3.37Å; D87-E89 PolarHBondContact O-N 3Å; E89-A91 HydrophobicContact CG-CB 4.18Å; E89-A91 PolarHBondContact O-N 2.75Å; E89-A92 VanDerWaalsContact O-CB 3.24Å; E89-A92 WeakPolarHBondContact O-CB 3.48Å; E89-A92 PolarHBondContact O-N 3.23Å
90	P	62.2	Low	73.9	Confident	44 Å²	44	76.9 Å²	76.9	29%	0.286	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-58	-22.6	179	-25.2	33.5	0	0	0	114.3	A92 L93 Y98 W101	P90-A92 PolarHBondContact O-N 3.18Å; P90-L93 HydrophobicContact CB-CD1 4.26Å; P90-L93 VanDerWaalsContact O-CB 3.24Å; P90-L93 WeakPolarHBondContact O-CB 3.45Å; P90-L93 WeakPolarHBondContact O-CD1 3.32Å; P90-L93 VanDerWaalsContact O-CG 3.28Å; P90-L93 WeakPolarHBondContact O-CG 3.41Å; P90-L93 PolarHBondContact O-N 2.8Å; P90-L93 VanDerWaalsContact O-N 3.09Å; P90-Y98 WeakPolarHBondContact O-CD2 3.38Å; P90-W101 HydrophobicContact CB-CD2 4.39Å; P90-W101 HydrophobicContact CB-CE3 4.39Å; P90-W101 HydrophobicContact CB-CH2 4.24Å; P90-W101 HydrophobicContact CB-CZ2 4.22Å; P90-W101 HydrophobicContact CB-CZ3 4.33Å; P90-W101 HydrophobicContact CG-CH2 4.25Å; P90-W101 HydrophobicContact CG-CZ2 4.03Å
91	A	60.2	Low	73.5	Confident	37 Å²	37	81.4 Å²	81.4	31%	0.306	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-66.2	-16	174.5	0	0	0	0	0	113.4	A76 E89 L93	A76-A91 HydrophobicContact CB-CB 4.37Å; A76-A91 WeakPolarHBondContact CB-O 3.49Å; E89-A91 HydrophobicContact CG-CB 4.18Å; E89-A91 PolarHBondContact O-N 2.75Å; A91-L93 VanDerWaalsContact C-N 3.29Å
92	A	67.2	Low	72.9	Confident	1 Å²	1	83.9 Å²	83.9	1%	0.008	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-81.3	-5.4	172.6	0	0	0	0	0	113.2	Y37 L77 W80 W88 E89 P90	Y37-A92 VanDerWaalsContact CD1-O 3.29Å; Y37-A92 WeakPolarHBondContact CD1-O 3.48Å; L77-A92 HydrophobicContact CD1-CB 3.74Å; W80-A92 HydrophobicContact CD2-CB 4.01Å; W80-A92 HydrophobicContact CE3-CB 3.82Å; W80-A92 HydrophobicContact CG-CB 4.35Å; W80-A92 HydrophobicContact CZ3-CB 4.31Å; W88-A92 HydrophobicContact CH2-CB 4.12Å; W88-A92 HydrophobicContact CZ2-CB 4.34Å; W88-A92 HydrophobicContact CZ3-CB 4.47Å; E89-A92 VanDerWaalsContact O-CB 3.24Å; E89-A92 WeakPolarHBondContact O-CB 3.48Å; E89-A92 PolarHBondContact O-N 3.23Å; P90-A92 PolarHBondContact O-N 3.18Å
93	L	71.6	Confident	72.4	Confident	23 Å²	23	83.1 Å²	83.1	12%	0.12	40%	0.399	C	S	.	.	S	Bend	trans	-67	155.7	175.9	-70.3	167.9	0	0	0	111.6	W88 P90 A91 E97 W101	W88-L93 HydrophobicContact CZ2-CD2 3.91Å; W88-L93 HydrophobicContact CZ2-CG 4.32Å; P90-L93 HydrophobicContact CB-CD1 4.26Å; P90-L93 VanDerWaalsContact O-CB 3.24Å; P90-L93 WeakPolarHBondContact O-CB 3.45Å; P90-L93 WeakPolarHBondContact O-CD1 3.32Å; P90-L93 VanDerWaalsContact O-CG 3.28Å; P90-L93 WeakPolarHBondContact O-CG 3.41Å; P90-L93 PolarHBondContact O-N 2.8Å; P90-L93 VanDerWaalsContact O-N 3.09Å; A91-L93 VanDerWaalsContact C-N 3.29Å; L93-E97 HydrophobicContact CB-CB 4.4Å; L93-W101 HydrophobicContact CD1-CB 4.34Å; L93-W101 HydrophobicContact CD1-CG 4.43Å
94	D	77.2	Confident	72	Confident	42 Å²	42	82.1 Å²	82.1	23%	0.225	40%	0.399	C	S	.	.			trans	-51	138.8	167.7	170.4	-91.8	0	0	0	110.3	Y37 Q96 E97 Y98	Y37-D94 HydrophobicContact CD1-CB 4.32Å; Y37-D94 HydrophobicContact CD2-CB 3.84Å; Y37-D94 HydrophobicContact CE2-CB 4.33Å; Y37-D94 HydrophobicContact CG-CB 3.84Å; D94-Q96 PolarHBondContact O-N 3.43Å; D94-Q96 VanDerWaalsContact O-N 3.08Å; D94-Q96 VanDerWaalsContact OD1-CA 3.31Å; D94-Q96 WeakPolarHBondContact OD1-CA 3.17Å; D94-Q96 WeakPolarHBondContact OD1-CB 3.44Å; D94-Q96 PolarHBondContact OD1-N 2.92Å; D94-E97 HydrophobicContact CB-CB 4.21Å; D94-E97 HydrophobicContact CB-CG 4.25Å; D94-E97 CarbonylContact O-C 3.56Å; D94-E97 PolarHBondContact O-N 3.29Å; D94-E97 PolarHBondContact OD1-N 3.19Å; D94-Y98 PolarHBondContact O-N 2.79Å
95	P	73.3	Confident	71.6	Confident	79 Å²	79	81.1 Å²	81.1	51%	0.513	39%	0.391	S	S	.	.	H	α-helix	trans	-54.9	-30.4	-177.8	-29	35.8	0	0	0	115.1	R99	P95-R99 PolarHBondContact O-N 3.39Å
96	Q	71.1	Confident	71.3	Confident	125 Å²	125	87.5 Å²	87.5	58%	0.584	41%	0.41	S	S	*	.	H	α-helix	trans	-75.9	-40.6	176.1	-162.8	179.8	23.5	0	0	111.1	D94 R99 R100	D94-Q96 PolarHBondContact O-N 3.43Å; D94-Q96 VanDerWaalsContact O-N 3.08Å; D94-Q96 VanDerWaalsContact OD1-CA 3.31Å; D94-Q96 WeakPolarHBondContact OD1-CA 3.17Å; D94-Q96 WeakPolarHBondContact OD1-CB 3.44Å; D94-Q96 PolarHBondContact OD1-N 2.92Å; Q96-R99 PolarHBondContact O-N 3.45Å; Q96-R100 WeakPolarHBondContact O-CG 3.38Å; Q96-R100 PolarHBondContact O-N 3.15Å; Q96-R100 VanDerWaalsContact O-N 3.17Å
97	E	70.6	Confident	70.8	Confident	82 Å²	82	90.6 Å²	90.6	38%	0.383	42%	0.419	S	S	.	.	H	α-helix	trans	-67.7	-41.3	174.4	-71.8	-158.6	138.4	0	0	112.7	L93 D94 R99 R100 W101	L93-E97 HydrophobicContact CB-CB 4.4Å; D94-E97 HydrophobicContact CB-CB 4.21Å; D94-E97 HydrophobicContact CB-CG 4.25Å; D94-E97 CarbonylContact O-C 3.56Å; D94-E97 PolarHBondContact O-N 3.29Å; D94-E97 PolarHBondContact OD1-N 3.19Å; E97-R99 VanDerWaalsContact C-N 3.28Å; E97-R99 PolarHBondContact O-N 3.03Å; E97-R100 CarbonylContact O-C 3.51Å; E97-R100 WeakPolarHBondContact O-CA 3.46Å; E97-R100 WeakPolarHBondContact O-CB 3.33Å; E97-R100 PolarHBondContact O-N 3.49Å; E97-W101 WeakPolarHBondContact O-CB 3.44Å; E97-W101 PolarHBondContact O-N 3.47Å
98	Y	74.7	Confident	69.7	Low	102 Å²	102	85.9 Å²	85.9	40%	0.4	40%	0.395	S	S	.	.	H	α-helix	trans	-57.3	-43.1	174.5	-178.1	-104.4	0	0	0	111.1	P90 D94 R100 W101 V102	P90-Y98 WeakPolarHBondContact O-CD2 3.38Å; D94-Y98 PolarHBondContact O-N 2.79Å; Y98-R100 VanDerWaalsContact C-N 3.33Å; Y98-R100 PolarHBondContact O-N 3.08Å; Y98-W101 HydrophobicContact CD2-CE3 4.41Å; Y98-W101 HydrophobicContact CE2-CE3 4.2Å; Y98-W101 HydrophobicContact CE2-CZ3 4.31Å; Y98-W101 PolarHBondContact O-N 3.48Å; Y98-V102 HydrophobicContact CD1-CG2 4.14Å; Y98-V102 HydrophobicContact CE1-CG2 3.71Å; Y98-V102 HydrophobicContact CE2-CG2 4.16Å; Y98-V102 WeakPolarHBondContact O-CG2 3.47Å; Y98-V102 PolarHBondContact O-N 3.47Å
99	R	73.7	Confident	68.1	Low	193 Å²	193	93.2 Å²	93.2	73%	0.728	42%	0.422	S	S	*	.	H	α-helix	trans	-62.3	-39.6	175.7	-168.1	-175.5	-68.7	-148.5	-1.6	112.2	P95 Q96 E97 T103	P95-R99 PolarHBondContact O-N 3.39Å; Q96-R99 PolarHBondContact O-N 3.45Å; E97-R99 VanDerWaalsContact C-N 3.28Å; E97-R99 PolarHBondContact O-N 3.03Å; R99-T103 PolarHBondContact O-N 3.35Å; R99-T103 VanDerWaalsContact O-N 3.12Å; R99-T103 PolarHBondContact O-OG1 2.85Å
100	R	73.8	Confident	66.7	Low	150 Å²	150	94 Å²	94	57%	0.566	43%	0.432	S	S	*	.	H	α-helix	trans	-65.9	-40.8	174.2	-70.3	172.8	178.2	177.3	0.9	111.5	Q96 E97 Y98 T103 F104	Q96-R100 WeakPolarHBondContact O-CG 3.38Å; Q96-R100 PolarHBondContact O-N 3.15Å; Q96-R100 VanDerWaalsContact O-N 3.17Å; E97-R100 CarbonylContact O-C 3.51Å; E97-R100 WeakPolarHBondContact O-CA 3.46Å; E97-R100 WeakPolarHBondContact O-CB 3.33Å; E97-R100 PolarHBondContact O-N 3.49Å; Y98-R100 VanDerWaalsContact C-N 3.33Å; Y98-R100 PolarHBondContact O-N 3.08Å; R100-T103 VanDerWaalsContact CA-OG1 3.31Å; R100-T103 WeakPolarHBondContact CA-OG1 3.29Å; R100-T103 PolarHBondContact O-N 3.11Å; R100-T103 PolarHBondContact O-OG1 2.87Å; R100-F104 WeakPolarHBondContact O-CB 3.3Å; R100-F104 PolarHBondContact O-N 3.28Å
101	W	73.4	Confident	65.8	Low	98 Å²	98	99.5 Å²	99.5	37%	0.371	45%	0.447	S	S	.	.	H	α-helix	trans	-65.3	-45.4	177.4	-179.1	88.6	0	0	0	111.7	P90 L93 E97 Y98 T103 F104 Q105	P90-W101 HydrophobicContact CB-CD2 4.39Å; P90-W101 HydrophobicContact CB-CE3 4.39Å; P90-W101 HydrophobicContact CB-CH2 4.24Å; P90-W101 HydrophobicContact CB-CZ2 4.22Å; P90-W101 HydrophobicContact CB-CZ3 4.33Å; P90-W101 HydrophobicContact CG-CH2 4.25Å; P90-W101 HydrophobicContact CG-CZ2 4.03Å; L93-W101 HydrophobicContact CD1-CB 4.34Å; L93-W101 HydrophobicContact CD1-CG 4.43Å; E97-W101 WeakPolarHBondContact O-CB 3.44Å; E97-W101 PolarHBondContact O-N 3.47Å; Y98-W101 HydrophobicContact CD2-CE3 4.41Å; Y98-W101 HydrophobicContact CE2-CE3 4.2Å; Y98-W101 HydrophobicContact CE2-CZ3 4.31Å; Y98-W101 PolarHBondContact O-N 3.48Å; W101-T103 VanDerWaalsContact C-N 3.33Å; W101-T103 PolarHBondContact O-N 2.88Å; W101-F104 WeakPolarHBondContact O-CB 3.27Å; W101-F104 PolarHBondContact O-N 3.17Å; W101-Q105 HydrophobicContact CD2-CG 3.92Å; W101-Q105 HydrophobicContact CE3-CG 4.17Å; W101-Q105 HydrophobicContact CH2-CG 3.91Å; W101-Q105 HydrophobicContact CZ2-CG 3.65Å; W101-Q105 HydrophobicContact CZ3-CG 4.16Å; W101-Q105 WeakPolarHBondContact O-CG 3.17Å; W101-Q105 PolarHBondContact O-N 3.13Å
102	V	75.7	Confident	64.7	Low	51 Å²	51	103.7 Å²	103.7	31%	0.309	46%	0.461	S	S	.	.	H	α-helix	trans	-61.1	-40.9	175.8	171.9	0	0	0	0	111.6	Y98 Q105 R106	Y98-V102 HydrophobicContact CD1-CG2 4.14Å; Y98-V102 HydrophobicContact CE1-CG2 3.71Å; Y98-V102 HydrophobicContact CE2-CG2 4.16Å; Y98-V102 WeakPolarHBondContact O-CG2 3.47Å; Y98-V102 PolarHBondContact O-N 3.47Å; V102-Q105 PolarHBondContact O-N 3.04Å; V102-R106 PolarHBondContact O-N 2.84Å
103	T	74.1	Confident	63.4	Low	74 Å²	74	111.1 Å²	111.1	45%	0.454	49%	0.493	S	S	.	.	H	α-helix	trans	-68.3	-36.6	176.1	35.1	0	0	0	0	112.2	R99 R100 W101 K107	R99-T103 PolarHBondContact O-N 3.35Å; R99-T103 VanDerWaalsContact O-N 3.12Å; R99-T103 PolarHBondContact O-OG1 2.85Å; R100-T103 VanDerWaalsContact CA-OG1 3.31Å; R100-T103 WeakPolarHBondContact CA-OG1 3.29Å; R100-T103 PolarHBondContact O-N 3.11Å; R100-T103 PolarHBondContact O-OG1 2.87Å; W101-T103 VanDerWaalsContact C-N 3.33Å; W101-T103 PolarHBondContact O-N 2.88Å; T103-K107 WeakPolarHBondContact O-CG 3.21Å; T103-K107 PolarHBondContact O-N 3.49Å
104	F	73.7	Confident	62	Low	126 Å²	126	115.2 Å²	115.2	55%	0.553	52%	0.515	S	S	*	.	H	α-helix	trans	-63.8	-47	172.8	-178.7	-100.3	0	0	0	111.7	R100 W101 R106 K107 T108	R100-F104 WeakPolarHBondContact O-CB 3.3Å; R100-F104 PolarHBondContact O-N 3.28Å; W101-F104 WeakPolarHBondContact O-CB 3.27Å; W101-F104 PolarHBondContact O-N 3.17Å; F104-R106 PolarHBondContact O-N 3.38Å; F104-K107 WeakPolarHBondContact O-CB 3.32Å; F104-K107 PolarHBondContact O-N 3.34Å; F104-T108 HydrophobicContact CD1-CG2 4.05Å; F104-T108 HydrophobicContact CD2-CG2 4.49Å; F104-T108 HydrophobicContact CE1-CG2 3.61Å; F104-T108 HydrophobicContact CE2-CG2 4.1Å; F104-T108 HydrophobicContact CG-CG2 4.47Å; F104-T108 HydrophobicContact CZ-CG2 3.64Å; F104-T108 PolarHBondContact O-N 3.33Å; F104-T108 PolarHBondContact O-OG1 3.49Å
105	Q	64.5	Low	59.8	Low	82 Å²	82	117 Å²	117	38%	0.383	52%	0.522	S	S	.	.	H	α-helix	trans	-61	-39.3	177.2	-72.9	-66.4	-28.8	0	0	112.9	W101 V102 K107 T108 R109	W101-Q105 HydrophobicContact CD2-CG 3.92Å; W101-Q105 HydrophobicContact CE3-CG 4.17Å; W101-Q105 HydrophobicContact CH2-CG 3.91Å; W101-Q105 HydrophobicContact CZ2-CG 3.65Å; W101-Q105 HydrophobicContact CZ3-CG 4.16Å; W101-Q105 WeakPolarHBondContact O-CG 3.17Å; W101-Q105 PolarHBondContact O-N 3.13Å; V102-Q105 PolarHBondContact O-N 3.04Å; Q105-K107 VanDerWaalsContact C-N 3.33Å; Q105-K107 PolarHBondContact O-N 3.01Å; Q105-T108 WeakPolarHBondContact CA-OG1 3.28Å; Q105-T108 PolarHBondContact O-OG1 2.88Å; Q105-T108 VanDerWaalsContact O-OG1 3.04Å; Q105-R109 VanDerWaalsContact O-CB 3.29Å; Q105-R109 WeakPolarHBondContact O-CB 3.46Å; Q105-R109 PolarHBondContact O-N 3.01Å
106	R	68.4	Low	57.8	Low	189 Å²	189	121.3 Å²	121.3	71%	0.713	54%	0.535	S	S	*	.	H	α-helix	trans	-60.7	-42.1	172.3	-84.6	-179.8	134.2	-176.3	-4	111.8	V102 F104 T110	V102-R106 PolarHBondContact O-N 2.84Å; F104-R106 PolarHBondContact O-N 3.38Å; R106-T110 PolarHBondContact O-N 2.93Å; R106-T110 VanDerWaalsContact O-N 3.11Å; R106-T110 PolarHBondContact O-OG1 3.25Å
107	K	63.1	Low	56.2	Low	154 Å²	154	123.3 Å²	123.3	67%	0.67	54%	0.542	S	S	*	.	H	α-helix	trans	-68.3	-44.3	178.9	-72.1	177.5	179.4	-174.5	0	112.2	T103 F104 Q105 T110 R111	T103-K107 WeakPolarHBondContact O-CG 3.21Å; T103-K107 PolarHBondContact O-N 3.49Å; F104-K107 WeakPolarHBondContact O-CB 3.32Å; F104-K107 PolarHBondContact O-N 3.34Å; Q105-K107 VanDerWaalsContact C-N 3.33Å; Q105-K107 PolarHBondContact O-N 3.01Å; K107-T110 PolarHBondContact O-N 2.72Å; K107-R111 PolarHBondContact O-N 2.9Å
108	T	48.7	Very low	54.4	Low	34 Å²	34	127 Å²	127	21%	0.209	56%	0.559	C	S	.	*	H	α-helix	trans	-67.3	-38.8	178.7	54.8	0	0	0	0	112	F104 Q105 T110 R111 Q112	F104-T108 HydrophobicContact CD1-CG2 4.05Å; F104-T108 HydrophobicContact CD2-CG2 4.49Å; F104-T108 HydrophobicContact CE1-CG2 3.61Å; F104-T108 HydrophobicContact CE2-CG2 4.1Å; F104-T108 HydrophobicContact CG-CG2 4.47Å; F104-T108 HydrophobicContact CZ-CG2 3.64Å; F104-T108 PolarHBondContact O-N 3.33Å; F104-T108 PolarHBondContact O-OG1 3.49Å; Q105-T108 WeakPolarHBondContact CA-OG1 3.28Å; Q105-T108 PolarHBondContact O-OG1 2.88Å; Q105-T108 VanDerWaalsContact O-OG1 3.04Å; T108-T110 VanDerWaalsContact C-N 3.31Å; T108-T110 PolarHBondContact O-N 3.44Å; T108-R111 CarbonylContact O-C 3.35Å; T108-R111 PolarHBondContact O-N 3.3Å; T108-R111 VanDerWaalsContact O-N 3.15Å; T108-Q112 WeakPolarHBondContact O-CB 3.44Å; T108-Q112 PolarHBondContact O-N 2.92Å
109	R	40.5	Very low	52.3	Low	200 Å²	200	127.8 Å²	127.8	76%	0.755	57%	0.574	S	S	*	*	H	α-helix	trans	-65.6	-34.2	174.3	-167.7	174.1	129.5	172.7	-0.4	112.3	Q105 K113	Q105-R109 VanDerWaalsContact O-CB 3.29Å; Q105-R109 WeakPolarHBondContact O-CB 3.46Å; Q105-R109 PolarHBondContact O-N 3.01Å; R109-K113 WeakPolarHBondContact O-CB 3.28Å; R109-K113 PolarHBondContact O-N 3.33Å; R109-K113 VanDerWaalsContact O-N 3.13Å
110	T	42.6	Very low	50.1	Low	89 Å²	89	127.9 Å²	127.9	55%	0.546	58%	0.58	S	S	.	*	H	α-helix	trans	-68.7	-36.7	172.6	-47.1	0	0	0	0	111	R106 K107 T108 N114	R106-T110 PolarHBondContact O-N 2.93Å; R106-T110 VanDerWaalsContact O-N 3.11Å; R106-T110 PolarHBondContact O-OG1 3.25Å; K107-T110 PolarHBondContact O-N 2.72Å; T108-T110 VanDerWaalsContact C-N 3.31Å; T108-T110 PolarHBondContact O-N 3.44Å; T110-N114 PolarHBondContact O-N 3.19Å
111	R	44.7	Very low	48	Very low	159 Å²	159	126 Å²	126	60%	0.6	59%	0.587	S	S	*	*	H	α-helix	trans	-71.6	-44.3	177.2	-155.2	179.8	84.3	175.3	10.6	112.5	K107 T108 K113 N114 E115	K107-R111 PolarHBondContact O-N 2.9Å; T108-R111 CarbonylContact O-C 3.35Å; T108-R111 PolarHBondContact O-N 3.3Å; T108-R111 VanDerWaalsContact O-N 3.15Å; R111-K113 VanDerWaalsContact C-N 3.33Å; R111-K113 PolarHBondContact O-N 2.79Å; R111-N114 CarbonylContact O-C 3.49Å; R111-N114 WeakPolarHBondContact O-CA 3.33Å; R111-N114 WeakPolarHBondContact O-CB 3.27Å; R111-N114 PolarHBondContact O-N 2.9Å; R111-E115 HydrophobicContact CG-CG 4.33Å; R111-E115 WeakPolarHBondContact CG-OE2 3.42Å; R111-E115 IonicContact CZ-OE1 3.56Å; R111-E115 IonicContact CZ-OE2 3.39Å; R111-E115 IonicContact NE-OE1 3.43Å; R111-E115 PolarHBondContact NE-OE1 3.01Å; R111-E115 IonicContact NE-OE2 3.71Å; R111-E115 PolarHBondContact NE-OE2 2.79Å; R111-E115 IonicContact NH2-OE1 3.53Å; R111-E115 PolarHBondContact NH2-OE1 3.41Å; R111-E115 IonicContact NH2-OE2 2.65Å; R111-E115 WeakPolarHBondContact O-CB 3.43Å; R111-E115 WeakPolarHBondContact O-CG 3.37Å; R111-E115 PolarHBondContact O-N 3.09Å
112	Q	35.4	Very low	46	Very low	125 Å²	125	127.2 Å²	127.2	58%	0.584	61%	0.608	S	S	*	*	H	α-helix	trans	-62.6	-38.1	175.5	-79.5	-179.5	-27.1	0	0	112.1	T108 N114 E115 E116	T108-Q112 WeakPolarHBondContact O-CB 3.44Å; T108-Q112 PolarHBondContact O-N 2.92Å; Q112-N114 PolarHBondContact O-N 2.86Å; Q112-E115 PolarHBondContact O-N 3.39Å; Q112-E116 PolarHBondContact O-N 3.48Å
113	K	41.4	Very low	43.8	Very low	157 Å²	157	134.7 Å²	134.7	68%	0.683	64%	0.636	S	S	*	*	H	α-helix	trans	-65.7	-22.9	173.1	-155.9	179.3	-175	-174	0	113.1	R109 R111	R109-K113 WeakPolarHBondContact O-CB 3.28Å; R109-K113 PolarHBondContact O-N 3.33Å; R109-K113 VanDerWaalsContact O-N 3.13Å; R111-K113 VanDerWaalsContact C-N 3.33Å; R111-K113 PolarHBondContact O-N 2.79Å
114	N	40.8	Very low	41.5	Very low	108 Å²	108	138.7 Å²	138.7	58%	0.578	66%	0.655	S	S	*	*	H	α-helix	trans	-87.9	-33.8	171.5	-81.1	-4	0	0	0	112.4	T110 R111 Q112 K117	T110-N114 PolarHBondContact O-N 3.19Å; R111-N114 CarbonylContact O-C 3.49Å; R111-N114 WeakPolarHBondContact O-CA 3.33Å; R111-N114 WeakPolarHBondContact O-CB 3.27Å; R111-N114 PolarHBondContact O-N 2.9Å; Q112-N114 PolarHBondContact O-N 2.86Å; N114-K117 PolarHBondContact O-N 3.03Å
115	E	32.4	Very low	39.5	Very low	81 Å²	81	139.3 Å²	139.3	38%	0.379	67%	0.669	S	S	.	*	H	α-helix	trans	-74.9	-28.8	178.5	-71.9	170.8	129.1	0	0	111.6	R111 Q112 K117 E118	R111-E115 HydrophobicContact CG-CG 4.33Å; R111-E115 WeakPolarHBondContact CG-OE2 3.42Å; R111-E115 IonicContact CZ-OE1 3.56Å; R111-E115 IonicContact CZ-OE2 3.39Å; R111-E115 IonicContact NE-OE1 3.43Å; R111-E115 PolarHBondContact NE-OE1 3.01Å; R111-E115 IonicContact NE-OE2 3.71Å; R111-E115 PolarHBondContact NE-OE2 2.79Å; R111-E115 IonicContact NH2-OE1 3.53Å; R111-E115 PolarHBondContact NH2-OE1 3.41Å; R111-E115 IonicContact NH2-OE2 2.65Å; R111-E115 WeakPolarHBondContact O-CB 3.43Å; R111-E115 WeakPolarHBondContact O-CG 3.37Å; R111-E115 PolarHBondContact O-N 3.09Å; Q112-E115 PolarHBondContact O-N 3.39Å; E115-K117 PolarHBondContact O-N 3.32Å; E115-K117 VanDerWaalsContact O-N 3.13Å; E115-E118 CarbonylContact O-C 3.28Å; E115-E118 PolarHBondContact O-N 3.45Å
116	E	29.6	Very low	37.9	Very low	168 Å²	168	141.2 Å²	141.2	79%	0.785	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-17.9	171.2	-108.8	-179.7	128.6	0	0	113.4	Q112	Q112-E116 PolarHBondContact O-N 3.48Å
117	K	38.4	Very low	36	Very low	168 Å²	168	144.1 Å²	144.1	73%	0.73	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-13	173.5	-68.4	-173.5	174.9	-173.9	0	113.6	N114 E115	N114-K117 PolarHBondContact O-N 3.03Å; E115-K117 PolarHBondContact O-N 3.32Å; E115-K117 VanDerWaalsContact O-N 3.13Å
118	E	32.7	Very low	34.3	Very low	158 Å²	158	146.4 Å²	146.4	74%	0.738	71%	0.709	S	S	*	*			trans	-135.6	60.1	-165.6	-67.2	-71.5	143.5	0	0	110.6	E115	E115-E118 CarbonylContact O-C 3.28Å; E115-E118 PolarHBondContact O-N 3.45Å
119	V	30.2	Very low	33.2	Very low	120 Å²	120	148.4 Å²	148.4	73%	0.727	74%	0.736	S	S	*	*			trans	-131.4	92.4	168.9	-179.8	0	0	0	0	110
120	F	27.7	Very low	32.7	Very low	194 Å²	194	148.7 Å²	148.7	85%	0.851	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-88.7	142.2	157.9	-88.7	-88.2	0	0	0	109.9
121	P	30.7	Very low	32.2	Very low	110 Å²	110	156.4 Å²	156.4	71%	0.714	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-83.7	137.1	-164.5	31.7	-33.4	0	0	0	113.5
122	P	31.8	Very low	31.2	Very low	125 Å²	125	152.9 Å²	152.9	81%	0.812	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-87	143.7	174.4	-8.2	26.8	0	0	0	113.6
123	K	28.2	Very low	31	Very low	207 Å²	207	158.8 Å²	158.8	90%	0.9	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-85.4	135.9	-177	-66.3	177	176.7	177.6	0	113.2
124	D	25.6	Very low	30.5	Very low	159 Å²	159	160.8 Å²	160.8	85%	0.85	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.2	140.5	172.3	-73.6	-76.2	0	0	0	114.2
125	V	31.4	Very low	30.1	Very low	138 Å²	138	161.7 Å²	161.7	84%	0.836	81%	0.812	S	S	*	*			trans	-143.1	140.6	157.1	-177.6	0	0	0	0	111.1
126	P	31.3	Very low	30.1	Very low	122 Å²	122	163.6 Å²	163.6	79%	0.792	84%	0.835	S	S	*	*			trans	-98.2	162	-152.1	-5.2	27.1	0	0	0	117.6
127	R	28.4	Very low	30.2	Very low	250 Å²	250	165.1 Å²	165.1	94%	0.943	84%	0.839	S	S	*	*			trans	-78.9	122.5	-176.5	-157.7	176.1	-174.7	-178.5	1.9	112
128	K	28.5	Very low	29.9	Very low	203 Å²	203	163 Å²	163	88%	0.883	84%	0.843	S	S	*	*			trans	-108.3	117.3	167.6	-84.9	-177.2	177.5	174.2	0	111.1
129	G	26.3	Very low	29.9	Very low	75 Å²	75	167.3 Å²	167.3	77%	0.773	85%	0.852	S	S	*	*			trans	-80.3	146.3	168.9	0	0	0	0	0	112.2
130	K	29.8	Very low	30.1	Very low	207 Å²	207	169.9 Å²	169.9	90%	0.9	86%	0.861	S	S	*	*			trans	-132.5	134	164.6	-75.8	-169.5	177.6	-179.2	0	110.9
131	R	30.7	Very low	30.1	Very low	251 Å²	251	168.5 Å²	168.5	95%	0.947	86%	0.861	S	S	*	*			trans	-74.3	157.8	-171.4	-68.5	174.8	170.8	-148.4	-2.4	112.4
132	G	24.6	Very low	29.9	Very low	85 Å²	85	167.9 Å²	167.9	88%	0.876	87%	0.865	S	S	*	*			trans	-70	163.5	-172.3	0	0	0	0	0	116.6
133	R	30.8	Very low	29.9	Very low	249 Å²	249	173.1 Å²	173.1	94%	0.94	87%	0.868	S	S	*	*			trans	-117.2	124.4	176.3	-154.4	176.3	-171.4	-168.1	2.8	108.4
134	K	31.5	Very low	29.9	Very low	199 Å²	199	172.1 Å²	172.1	87%	0.865	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-77	148.4	175.3	-73.5	-179.7	178.9	176.2	0	110.7
135	P	32.4	Very low	30.4	Very low	126 Å²	126	170 Å²	170	82%	0.818	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-84.2	134.9	-170.6	-5.1	24.3	0	0	0	113.1
136	S	31.6	Very low	31.1	Very low	122 Å²	122	169 Å²	169	85%	0.853	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-69.4	137.1	176.2	-52	0	0	0	0	112.5
137	K	31.2	Very low	32.1	Very low	199 Å²	199	167.1 Å²	167.1	87%	0.865	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-73.3	148.9	173.4	-73.1	178.8	179.5	176	0	111.3
138	P	33	Very low	34.2	Very low	125 Å²	125	156.2 Å²	156.2	81%	0.812	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-77.5	135.1	-172.3	-9.1	26.8	0	0	0	112.6
139	R	31.9	Very low	36.4	Very low	247 Å²	247	148 Å²	148	93%	0.932	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71.9	119.6	169.5	-79.6	179.7	159.4	-161.9	-5.5	109.9
140	L	35	Very low	38.7	Very low	175 Å²	175	149.1 Å²	149.1	92%	0.916	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-83.7	131.2	166.8	-87.6	156.2	0	0	0	109.1
141	I	28.5	Very low	40.7	Very low	165 Å²	165	139.5 Å²	139.5	85%	0.846	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-78.8	134.3	-179.2	-63.5	167.1	0	0	0	109.2
142	A	25.5	Very low	42.4	Very low	97 Å²	97	133 Å²	133	80%	0.802	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-74.2	131.5	179.9	0	0	0	0	0	111.7
143	R	32.6	Very low	44.1	Very low	234 Å²	234	132.9 Å²	132.9	88%	0.883	71%	0.71	S	S	*	*			trans	-112.6	125.5	171.1	-161.5	177.9	-173.9	-152.3	0.8	108.4
144	Q	27.1	Very low	46.1	Very low	186 Å²	186	123.6 Å²	123.6	87%	0.869	68%	0.683	S	S	*	*			trans	-81.7	121	177.3	-61	176.6	5.1	0	0	109.6
145	T	37.1	Very low	48	Very low	114 Å²	114	116.3 Å²	116.3	70%	0.699	66%	0.664	S	S	*	*	S	Bend	trans	-165.5	114.3	158	25.3	0	0	0	0	107.2	G147	T145-G147 PolarHBondContact O-N 3.45Å
146	S	45.7	Very low	50.2	Low	117 Å²	117	113.1 Å²	113.1	82%	0.818	64%	0.644	S	S	*	*			trans	29	74.3	161.8	58.2	0	0	0	0	116.1	G148	S146-G148 PolarHBondContact O-N 3.34Å; S146-G148 VanDerWaalsContact O-N 3.16Å
147	G	53	Low	52.2	Low	84 Å²	84	111.3 Å²	111.3	87%	0.866	63%	0.628	S	S	*	*			trans	-87.7	61.2	-169.9	0	0	0	0	0	115.2	T145	T145-G147 PolarHBondContact O-N 3.45Å
148	G	71.1	Confident	54.3	Low	20 Å²	20	103.2 Å²	103.2	21%	0.206	59%	0.593	C	S	.	*	P	Polyproline II helix	trans	-71.2	151.6	163.3	0	0	0	0	0	111.5	S146 I150 F158	S146-G148 PolarHBondContact O-N 3.34Å; S146-G148 VanDerWaalsContact O-N 3.16Å; G148-I150 PolarHBondContact O-N 3.31Å; G148-F158 CarbonylContact C-O 3.36Å; G148-F158 WeakPolarHBondContact CA-O 3.28Å
149	P	75.6	Confident	56.6	Low	31 Å²	31	102.9 Å²	102.9	20%	0.201	59%	0.591	C	S	.	*	P	Polyproline II helix	trans	-61.5	134	177.6	23	-32.8	0	0	0	111.6	F158 D160 L161 L164	P149-F158 WeakPolarHBondContact CD-O 3.35Å; P149-F158 HydrophobicContact CG-CB 4.36Å; P149-F158 PolarHBondContact O-N 3.09Å; P149-D160 WeakPolarHBondContact CG-O 3.48Å; P149-L161 HydrophobicContact CB-CD2 3.82Å; P149-L161 HydrophobicContact CG-CD2 4.08Å; P149-L161 HydrophobicContact CG-CG 4.34Å; P149-L164 HydrophobicContact CB-CB 4.35Å; P149-L164 HydrophobicContact CB-CD2 3.75Å; P149-L164 HydrophobicContact CG-CB 4.27Å
150	I	73.6	Confident	58.7	Low	99 Å²	99	94.9 Å²	94.9	51%	0.508	57%	0.566	S	S	.	*	B	Isolated β-bridge	trans	-103.1	129.8	-176	-57.1	175.9	0	0	0	108.9	G148 P152 C156 T157	G148-I150 PolarHBondContact O-N 3.31Å; I150-P152 WeakPolarHBondContact O-CD 2.86Å; I150-C156 CarbonylContact C-O 3.57Å; I150-C156 VanDerWaalsContact CA-O 3.31Å; I150-C156 WeakPolarHBondContact CA-O 3.29Å; I150-T157 HydrophobicContact CG1-CG2 4.24Å
151	C	73.3	Confident	60.7	Low	4 Å²	4	92.2 Å²	92.2	3%	0.027	55%	0.553	C	S	.	*	P	Polyproline II helix	trans	-65.5	119.1	171.2	177.2	0	0	0	0	109.6	D153 C154 G155 C156 F158 L164	C151-D153 PolarHBondContact O-N 3.3Å; C151-C154 WeakPolarHBondContact CB-SG 3.41Å; C151-C154 PolarHBondContact SG-SG 3.46Å; C151-G155 VanDerWaalsContact O-CA 3.26Å; C151-G155 WeakPolarHBondContact O-CA 3.47Å; C151-G155 PolarHBondContact O-N 3.45Å; C151-C156 PolarHBondContact N-O 2.86Å; C151-F158 HydrophobicContact CB-CE2 3.74Å; C151-L164 HydrophobicContact CB-CD1 3.57Å
152	P	65.8	Low	63.1	Low	116 Å²	116	88.2 Å²	88.2	75%	0.753	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-19.2	-177.2	27	-34.5	0	0	0	113.1	I150	I150-P152 WeakPolarHBondContact O-CD 2.86Å
153	D	60.5	Low	65.5	Low	81 Å²	81	84.9 Å²	84.9	43%	0.433	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-31.8	-174.4	-63.5	-57.3	0	0	0	113.9	C151 N172	C151-D153 PolarHBondContact O-N 3.3Å; D153-N172 PolarHBondContact OD2-OD1 3.46Å
154	C	71.9	Confident	67.6	Low	54 Å²	54	75.6 Å²	75.6	37%	0.365	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-14.6	176.4	58.4	0	0	0	0	115	C151 C156 H167 C169	C151-C154 WeakPolarHBondContact CB-SG 3.41Å; C151-C154 PolarHBondContact SG-SG 3.46Å; C154-C156 VanDerWaalsContact C-N 3.31Å; C154-H167 PolarHBondContact SG-NE2 2.77Å; C154-C169 WeakPolarHBondContact CB-SG 3.19Å
155	G	71.8	Confident	69.6	Low	46 Å²	46	74.9 Å²	74.9	47%	0.474	47%	0.474	S	S	.	.			trans	79.2	5.5	-177.3	0	0	0	0	0	115.1	C151	C151-G155 VanDerWaalsContact O-CA 3.26Å; C151-G155 WeakPolarHBondContact O-CA 3.47Å; C151-G155 PolarHBondContact O-N 3.45Å
156	C	77.7	Confident	71.2	Confident	59 Å²	59	73.7 Å²	73.7	40%	0.399	47%	0.47	S	S	.	.			trans	-67	137.9	175.6	-64.8	0	0	0	0	110.9	I150 C151 C154 F158	I150-C156 CarbonylContact C-O 3.57Å; I150-C156 VanDerWaalsContact CA-O 3.31Å; I150-C156 WeakPolarHBondContact CA-O 3.29Å; C151-C156 PolarHBondContact N-O 2.86Å; C154-C156 VanDerWaalsContact C-N 3.31Å; C156-F158 HydrophobicContact CB-CE2 3.63Å; C156-F158 HydrophobicContact CB-CZ 3.64Å; C156-F158 WeakPolarHBondContact O-CD2 3.28Å; C156-F158 WeakPolarHBondContact O-CE2 3.4Å
157	T	74.4	Confident	72.4	Confident	84 Å²	84	70.6 Å²	70.6	52%	0.515	44%	0.443	S	S	.	.	B	Isolated β-bridge	trans	-97.6	132.1	176.7	-52.4	0	0	0	0	109.3	I150	I150-T157 HydrophobicContact CG1-CG2 4.24Å
158	F	75.5	Confident	72.9	Confident	30 Å²	30	74.8 Å²	74.8	13%	0.132	44%	0.437	C	S	.	.			trans	-112.1	153	-177.5	-64.3	-86.8	0	0	0	110.7	G148 P149 C151 C156 D160 A163 L164 H167	G148-F158 CarbonylContact C-O 3.36Å; G148-F158 WeakPolarHBondContact CA-O 3.28Å; P149-F158 WeakPolarHBondContact CD-O 3.35Å; P149-F158 HydrophobicContact CG-CB 4.36Å; P149-F158 PolarHBondContact O-N 3.09Å; C151-F158 HydrophobicContact CB-CE2 3.74Å; C156-F158 HydrophobicContact CB-CE2 3.63Å; C156-F158 HydrophobicContact CB-CZ 3.64Å; C156-F158 WeakPolarHBondContact O-CD2 3.28Å; C156-F158 WeakPolarHBondContact O-CE2 3.4Å; F158-D160 VanDerWaalsContact C-N 3.34Å; F158-A163 HydrophobicContact CB-CB 4.19Å; F158-A163 HydrophobicContact CD1-CB 4.23Å; F158-L164 HydrophobicContact CB-CB 4.1Å; F158-L164 HydrophobicContact CD2-CB 3.91Å; F158-L164 HydrophobicContact CD2-CD1 3.58Å; F158-L164 HydrophobicContact CD2-CG 4.32Å; F158-L164 HydrophobicContact CE2-CD1 3.71Å; F158-L164 HydrophobicContact CG-CB 4.01Å; F158-L164 HydrophobicContact CG-CD1 4.46Å; F158-H167 HydrophobicContact CD1-CB 4.35Å; F158-H167 HydrophobicContact CE1-CB 3.59Å; F158-H167 AromaticContact CE1-CG 3.6Å; F158-H167 AromaticContact CE1-ND1 3.63Å; F158-H167 HydrophobicContact CE2-CB 4.2Å; F158-H167 AromaticContact CE2-CD2 3.91Å; F158-H167 AromaticContact CE2-CG 3.93Å; F158-H167 HydrophobicContact CZ-CB 3.54Å; F158-H167 AromaticContact CZ-CD2 3.46Å; F158-H167 VanDerWaalsContact CZ-CD2 3.46Å; F158-H167 WeakPolarHBondContact CZ-CD2 3.46Å; F158-H167 AromaticContact CZ-CE1 3.69Å; F158-H167 AromaticContact CZ-CG 3.13Å; F158-H167 AromaticContact CZ-ND1 3.3Å; F158-H167 VanDerWaalsContact CZ-ND1 3.3Å; F158-H167 WeakPolarHBondContact CZ-ND1 3.29Å; F158-H167 AromaticContact CZ-NE2 3.82Å
159	P	80.2	Confident	72.6	Confident	118 Å²	118	74 Å²	74	77%	0.766	43%	0.429	S	S	*	.	S	Bend	trans	-66.2	-33.9	178.9	23.5	-31.3	0	0	0	113	A163	P159-A163 HydrophobicContact CG-CB 4.11Å
160	D	77.6	Confident	72	Confident	78 Å²	78	75.9 Å²	75.9	42%	0.417	45%	0.447	S	S	.	.	S	Bend	trans	-148.8	172.2	179.9	62.4	17	0	0	0	112.7	P149 F158 A163 L164	P149-D160 WeakPolarHBondContact CG-O 3.48Å; F158-D160 VanDerWaalsContact C-N 3.34Å; D160-A163 PolarHBondContact O-N 3.39Å; D160-A163 WeakPolarHBondContact OD1-CB 3.43Å; D160-A163 PolarHBondContact OD1-N 3.48Å; D160-L164 PolarHBondContact O-N 2.92Å
161	L	76.6	Confident	71.4	Confident	119 Å²	119	76 Å²	76	62%	0.623	45%	0.445	S	S	*	.	H	α-helix	trans	-64.1	-41.2	179.4	-73	169.5	0	0	0	112.8	P149 A163 L164 E165	P149-L161 HydrophobicContact CB-CD2 3.82Å; P149-L161 HydrophobicContact CG-CD2 4.08Å; P149-L161 HydrophobicContact CG-CG 4.34Å; L161-A163 VanDerWaalsContact C-N 3.35Å; L161-A163 PolarHBondContact O-N 2.97Å; L161-L164 CarbonylContact O-C 3.3Å; L161-L164 WeakPolarHBondContact O-CB 3.38Å; L161-L164 PolarHBondContact O-N 3.18Å; L161-L164 VanDerWaalsContact O-N 3.16Å; L161-E165 WeakPolarHBondContact O-CB 3.41Å; L161-E165 PolarHBondContact O-N 3.34Å
162	P	78.3	Confident	70.7	Confident	82 Å²	82	77 Å²	77	53%	0.532	45%	0.45	S	S	.	.	H	α-helix	trans	-60	-37.9	174.8	-26.6	35.6	0	0	0	114.2	E165 S166	P162-E165 PolarHBondContact O-N 3.33Å; P162-S166 WeakPolarHBondContact O-CB 3.45Å; P162-S166 PolarHBondContact O-N 2.95Å; P162-S166 PolarHBondContact O-OG 3.38Å
163	A	77.2	Confident	70.7	Confident	26 Å²	26	77.7 Å²	77.7	22%	0.215	45%	0.447	C	S	.	.	H	α-helix	trans	-67.7	-35.8	174.6	0	0	0	0	0	112	F158 P159 D160 L161 S166 H167	F158-A163 HydrophobicContact CB-CB 4.19Å; F158-A163 HydrophobicContact CD1-CB 4.23Å; P159-A163 HydrophobicContact CG-CB 4.11Å; D160-A163 PolarHBondContact O-N 3.39Å; D160-A163 WeakPolarHBondContact OD1-CB 3.43Å; D160-A163 PolarHBondContact OD1-N 3.48Å; L161-A163 VanDerWaalsContact C-N 3.35Å; L161-A163 PolarHBondContact O-N 2.97Å; A163-S166 WeakPolarHBondContact CA-OG 3.44Å; A163-S166 PolarHBondContact O-OG 3.23Å; A163-H167 WeakPolarHBondContact O-CB 3.33Å; A163-H167 PolarHBondContact O-N 3.11Å; A163-H167 VanDerWaalsContact O-N 3.16Å
164	L	75	Confident	71.4	Confident	39 Å²	39	81 Å²	81	20%	0.204	46%	0.458	C	S	.	.	H	α-helix	trans	-67.7	-38.7	170	173.1	62.5	0	0	0	111.7	P149 C151 F158 D160 L161 H167	P149-L164 HydrophobicContact CB-CB 4.35Å; P149-L164 HydrophobicContact CB-CD2 3.75Å; P149-L164 HydrophobicContact CG-CB 4.27Å; C151-L164 HydrophobicContact CB-CD1 3.57Å; F158-L164 HydrophobicContact CB-CB 4.1Å; F158-L164 HydrophobicContact CD2-CB 3.91Å; F158-L164 HydrophobicContact CD2-CD1 3.58Å; F158-L164 HydrophobicContact CD2-CG 4.32Å; F158-L164 HydrophobicContact CE2-CD1 3.71Å; F158-L164 HydrophobicContact CG-CB 4.01Å; F158-L164 HydrophobicContact CG-CD1 4.46Å; D160-L164 PolarHBondContact O-N 2.92Å; L161-L164 CarbonylContact O-C 3.3Å; L161-L164 WeakPolarHBondContact O-CB 3.38Å; L161-L164 PolarHBondContact O-N 3.18Å; L161-L164 VanDerWaalsContact O-N 3.16Å; L164-H167 VanDerWaalsContact O-CB 3.3Å; L164-H167 WeakPolarHBondContact O-CB 3.47Å; L164-H167 PolarHBondContact O-N 3.44Å
165	E	69.6	Low	71.7	Confident	171 Å²	171	82.9 Å²	82.9	80%	0.799	46%	0.46	S	S	*	.	H	α-helix	trans	-71.6	-35.3	-177.4	-166	161.1	-154.9	0	0	111.9	L161 P162 H167	L161-E165 WeakPolarHBondContact O-CB 3.41Å; L161-E165 PolarHBondContact O-N 3.34Å; P162-E165 PolarHBondContact O-N 3.33Å; E165-H167 VanDerWaalsContact C-N 3.3Å
166	S	70	Confident	72.1	Confident	89 Å²	89	83.5 Å²	83.5	62%	0.622	46%	0.455	S	S	*	.	H	α-helix	trans	-76.1	-13.7	170.6	55.4	0	0	0	0	113.6	P162 A163 K168	P162-S166 WeakPolarHBondContact O-CB 3.45Å; P162-S166 PolarHBondContact O-N 2.95Å; P162-S166 PolarHBondContact O-OG 3.38Å; A163-S166 WeakPolarHBondContact CA-OG 3.44Å; A163-S166 PolarHBondContact O-OG 3.23Å; S166-K168 PolarHBondContact O-N 3.39Å
167	H	71.4	Confident	72.4	Confident	52 Å²	52	85.1 Å²	85.1	24%	0.241	45%	0.454	C	S	.	.			trans	-70.7	93.2	177.2	177.7	70.6	0	0	0	112.2	C154 F158 A163 L164 E165 C169	C154-H167 PolarHBondContact SG-NE2 2.77Å; F158-H167 HydrophobicContact CD1-CB 4.35Å; F158-H167 HydrophobicContact CE1-CB 3.59Å; F158-H167 AromaticContact CE1-CG 3.6Å; F158-H167 AromaticContact CE1-ND1 3.63Å; F158-H167 HydrophobicContact CE2-CB 4.2Å; F158-H167 AromaticContact CE2-CD2 3.91Å; F158-H167 AromaticContact CE2-CG 3.93Å; F158-H167 HydrophobicContact CZ-CB 3.54Å; F158-H167 AromaticContact CZ-CD2 3.46Å; F158-H167 VanDerWaalsContact CZ-CD2 3.46Å; F158-H167 WeakPolarHBondContact CZ-CD2 3.46Å; F158-H167 AromaticContact CZ-CE1 3.69Å; F158-H167 AromaticContact CZ-CG 3.13Å; F158-H167 AromaticContact CZ-ND1 3.3Å; F158-H167 VanDerWaalsContact CZ-ND1 3.3Å; F158-H167 WeakPolarHBondContact CZ-ND1 3.29Å; F158-H167 AromaticContact CZ-NE2 3.82Å; A163-H167 WeakPolarHBondContact O-CB 3.33Å; A163-H167 PolarHBondContact O-N 3.11Å; A163-H167 VanDerWaalsContact O-N 3.16Å; L164-H167 VanDerWaalsContact O-CB 3.3Å; L164-H167 WeakPolarHBondContact O-CB 3.47Å; L164-H167 PolarHBondContact O-N 3.44Å; E165-H167 VanDerWaalsContact C-N 3.3Å; H167-C169 VanDerWaalsContact C-N 3.31Å; H167-C169 WeakPolarHBondContact NE2-CA 3.31Å; H167-C169 WeakPolarHBondContact NE2-CB 3.45Å; H167-C169 PolarHBondContact O-N 3.26Å
168	K	64.3	Low	72.9	Confident	172 Å²	172	84.3 Å²	84.3	75%	0.748	45%	0.45	S	S	*	.			trans	-74.3	83.7	165.2	-67.3	179.7	-176.1	173.8	0	109.9	S166 A170	S166-K168 PolarHBondContact O-N 3.39Å; K168-A170 PolarHBondContact O-N 3.38Å
169	C	65.3	Low	73.3	Confident	4 Å²	4	83 Å²	83	3%	0.027	44%	0.444	C	S	.	.			trans	-50.8	131	173.5	-178.7	0	0	0	0	110.3	C154 H167 Q171 N172 L173	C154-C169 WeakPolarHBondContact CB-SG 3.19Å; H167-C169 VanDerWaalsContact C-N 3.31Å; H167-C169 WeakPolarHBondContact NE2-CA 3.31Å; H167-C169 WeakPolarHBondContact NE2-CB 3.45Å; H167-C169 PolarHBondContact O-N 3.26Å; C169-Q171 PolarHBondContact O-N 3.25Å; C169-Q171 VanDerWaalsContact SG-CB 3.6Å; C169-N172 HydrophobicContact CB-CB 4.31Å; C169-N172 VanDerWaalsContact CB-ND2 3.32Å; C169-N172 WeakPolarHBondContact CB-ND2 3.39Å; C169-N172 WeakPolarHBondContact O-CA 3.48Å; C169-N172 WeakPolarHBondContact O-CB 3.46Å; C169-N172 PolarHBondContact O-N 2.7Å; C169-L173 PolarHBondContact O-N 3.19Å
170	A	62.5	Low	73.4	Confident	71 Å²	71	82.4 Å²	82.4	59%	0.587	44%	0.441	S	S	*	.	H	α-helix	trans	-56.2	-23.5	177.8	0	0	0	0	0	112.7	K168	K168-A170 PolarHBondContact O-N 3.38Å
171	Q	59.9	Low	73.6	Confident	101 Å²	101	83.4 Å²	83.4	47%	0.472	45%	0.446	S	S	.	.	H	α-helix	trans	-70	-31.1	171.2	-60.4	-69.1	-20.3	0	0	112.9	C169 K174 K175	C169-Q171 PolarHBondContact O-N 3.25Å; C169-Q171 VanDerWaalsContact SG-CB 3.6Å; Q171-K174 PolarHBondContact O-N 3.13Å; Q171-K175 PolarHBondContact O-N 3.27Å
172	N	60	Low	73.9	Confident	25 Å²	25	80.9 Å²	80.9	13%	0.134	44%	0.437	C	S	.	.	H	α-helix	trans	-70.3	-37.3	177.7	-69.3	-29.8	0	0	0	112	D153 C169 K174 K175 R185	D153-N172 PolarHBondContact OD2-OD1 3.46Å; C169-N172 HydrophobicContact CB-CB 4.31Å; C169-N172 VanDerWaalsContact CB-ND2 3.32Å; C169-N172 WeakPolarHBondContact CB-ND2 3.39Å; C169-N172 WeakPolarHBondContact O-CA 3.48Å; C169-N172 WeakPolarHBondContact O-CB 3.46Å; C169-N172 PolarHBondContact O-N 2.7Å; N172-K174 PolarHBondContact O-N 3.02Å; N172-K175 CarbonylContact O-C 3.49Å; N172-K175 PolarHBondContact O-N 3.19Å; N172-K175 VanDerWaalsContact O-N 3.1Å; N172-R185 PolarHBondContact ND2-NH1 2.73Å; N172-R185 WeakPolarHBondContact OD1-CD 3.48Å; N172-R185 VanDerWaalsContact OD1-CZ 3.3Å; N172-R185 PolarHBondContact OD1-NE 3.3Å; N172-R185 PolarHBondContact OD1-NH1 3.34Å
173	L	66	Low	74	Confident	130 Å²	130	79.3 Å²	79.3	68%	0.681	44%	0.437	S	S	*	.	H	α-helix	trans	-62.7	-33.1	174.8	-67.7	174.3	0	0	0	112.1	C169	C169-L173 PolarHBondContact O-N 3.19Å
174	K	73.8	Confident	74.1	Confident	152 Å²	152	86 Å²	86	66%	0.661	46%	0.456	S	S	*	.	H	α-helix	trans	-80.7	-16	176	-65.1	-177	179.9	-179.4	0	113.5	Q171 N172 S187	Q171-K174 PolarHBondContact O-N 3.13Å; N172-K174 PolarHBondContact O-N 3.02Å; K174-S187 WeakPolarHBondContact O-CA 3.35Å; K174-S187 WeakPolarHBondContact O-CB 3.45Å
175	K	78.8	Confident	74.4	Confident	93 Å²	93	87.7 Å²	87.7	40%	0.404	46%	0.46	S	S	.	.			trans	-136.5	68.8	-175.2	-65.8	178.5	-174.7	163.2	0	111.6	Q171 N172 Y177 R185 F186	Q171-K175 PolarHBondContact O-N 3.27Å; N172-K175 CarbonylContact O-C 3.49Å; N172-K175 PolarHBondContact O-N 3.19Å; N172-K175 VanDerWaalsContact O-N 3.1Å; K175-Y177 VanDerWaalsContact C-N 3.27Å; K175-Y177 PolarHBondContact O-N 2.74Å; K175-R185 HydrophobicContact CB-CB 3.99Å; K175-R185 WeakPolarHBondContact O-CB 3.22Å; K175-R185 PolarHBondContact O-NE 3.07Å; K175-F186 CarbonylContact C-O 3.57Å; K175-F186 VanDerWaalsContact CA-O 3.23Å; K175-F186 WeakPolarHBondContact CA-O 3.48Å
176	P	79.6	Confident	75	Confident	59 Å²	59	80.8 Å²	80.8	38%	0.383	43%	0.427	S	S	.	.			trans	-73.2	-14.1	-171.3	27.5	-32.4	0	0	0	114	P178	P176-P178 WeakPolarHBondContact O-CD 3.5Å
177	Y	84.9	Confident	75.8	Confident	92 Å²	92	78.4 Å²	78.4	36%	0.361	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	93.4	-171.1	-53.2	-74.5	0	0	0	113.1	K175 R185 F186 S187 Y188 P189	K175-Y177 VanDerWaalsContact C-N 3.27Å; K175-Y177 PolarHBondContact O-N 2.74Å; Y177-R185 CarbonylContact O-C 3.18Å; Y177-R185 WeakPolarHBondContact O-CA 3.39Å; Y177-F186 WeakPolarHBondContact CD2-O 3.38Å; Y177-F186 PolarHBondContact N-O 2.88Å; Y177-F186 PolarHBondContact O-N 3.3Å; Y177-S187 WeakPolarHBondContact CE2-O 3.46Å; Y177-Y188 VanDerWaalsContact CD2-C 3.42Å; Y177-P189 HydrophobicContact CD1-CG 4.12Å; Y177-P189 HydrophobicContact CD2-CG 4.25Å; Y177-P189 HydrophobicContact CE1-CB 4.44Å; Y177-P189 HydrophobicContact CE1-CG 3.63Å; Y177-P189 HydrophobicContact CE2-CG 3.76Å; Y177-P189 HydrophobicContact CG-CG 4.41Å; Y177-P189 VanDerWaalsContact CZ-CG 3.43Å
178	P	84.2	Confident	76.4	Confident	68 Å²	68	83.2 Å²	83.2	44%	0.442	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	147.3	174.7	31.2	-36.4	0	0	0	112.8	P176 R184 R185 L192	P176-P178 WeakPolarHBondContact O-CD 3.5Å; P178-R184 CarbonylContact C-O 3.49Å; P178-R185 HydrophobicContact CB-CG 4.1Å; P178-L192 WeakPolarHBondContact O-CD2 3.33Å
179	C	83.7	Confident	77.5	Confident	2 Å²	2	78 Å²	78	1%	0.014	41%	0.411	C	S	.	.			trans	-84.7	126.2	168.8	178.2	0	0	0	0	110.5	D181 G183 R184 F186 L192	C179-D181 VanDerWaalsContact C-N 3.28Å; C179-D181 PolarHBondContact O-N 3.46Å; C179-G183 WeakPolarHBondContact O-CA 3.42Å; C179-G183 PolarHBondContact O-N 2.83Å; C179-R184 WeakPolarHBondContact CB-O 3.4Å; C179-R184 PolarHBondContact N-O 3.43Å; C179-F186 HydrophobicContact CB-CE2 4.23Å; C179-L192 VanDerWaalsContact CA-CD1 3.5Å; C179-L192 HydrophobicContact CB-CD1 3.57Å
180	P	83.3	Confident	78.5	Confident	106 Å²	106	81.8 Å²	81.8	69%	0.688	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-28.2	179.6	25.4	-33.1	0	0	0	113.1
181	D	81.1	Confident	79.5	Confident	98 Å²	98	81.3 Å²	81.3	52%	0.524	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-26.1	-173.9	-53	-62.9	0	0	0	113.8	C179 H199	C179-D181 VanDerWaalsContact C-N 3.28Å; C179-D181 PolarHBondContact O-N 3.46Å; D181-H199 IonicContact OD2-CD2 3.05Å
182	C	82.6	Confident	80.8	Confident	66 Å²	66	77.8 Å²	77.8	45%	0.446	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.8	1.6	-177.6	71.4	0	0	0	0	115.7	R184 H195 H199	C182-R184 PolarHBondContact O-N 3.27Å; C182-R184 VanDerWaalsContact O-N 3.14Å; C182-R184 VanDerWaalsContact SG-CB 3.59Å; C182-H195 PolarHBondContact SG-NE2 3.31Å; C182-H199 PolarHBondContact SG-NE2 3.36Å
183	G	80.5	Confident	82	Confident	50 Å²	50	80.2 Å²	80.2	52%	0.515	43%	0.425	S	S	.	.			trans	74.2	-7.5	-179.5	0	0	0	0	0	115.4	C179 R185	C179-G183 WeakPolarHBondContact O-CA 3.42Å; C179-G183 PolarHBondContact O-N 2.83Å; G183-R185 PolarHBondContact O-N 3.14Å
184	R	79.4	Confident	82.9	Confident	165 Å²	165	74.9 Å²	74.9	62%	0.623	40%	0.398	S	S	*	.			trans	-66.2	132.2	-176.5	-169.6	172.4	-176.9	165.8	3.7	111.8	P178 C179 C182 F186	P178-R184 CarbonylContact C-O 3.49Å; C179-R184 WeakPolarHBondContact CB-O 3.4Å; C179-R184 PolarHBondContact N-O 3.43Å; C182-R184 PolarHBondContact O-N 3.27Å; C182-R184 VanDerWaalsContact O-N 3.14Å; C182-R184 VanDerWaalsContact SG-CB 3.59Å; R184-F186 HydrophobicContact CB-CE2 4.17Å; R184-F186 HydrophobicContact CB-CZ 4.31Å; R184-F186 HydrophobicContact CG-CE2 4.13Å; R184-F186 HydrophobicContact CG-CZ 3.9Å; R184-F186 WeakPolarHBondContact O-CD2 3.44Å; R184-F186 WeakPolarHBondContact O-CE2 3.32Å
185	R	81.9	Confident	83.3	Confident	75 Å²	75	69.1 Å²	69.1	28%	0.283	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	146.8	-176.9	-50.5	-176.1	69.6	146.2	9.2	113.9	N172 K175 Y177 P178 G183	N172-R185 PolarHBondContact ND2-NH1 2.73Å; N172-R185 WeakPolarHBondContact OD1-CD 3.48Å; N172-R185 VanDerWaalsContact OD1-CZ 3.3Å; N172-R185 PolarHBondContact OD1-NE 3.3Å; N172-R185 PolarHBondContact OD1-NH1 3.34Å; K175-R185 HydrophobicContact CB-CB 3.99Å; K175-R185 WeakPolarHBondContact O-CB 3.22Å; K175-R185 PolarHBondContact O-NE 3.07Å; Y177-R185 CarbonylContact O-C 3.18Å; Y177-R185 WeakPolarHBondContact O-CA 3.39Å; P178-R185 HydrophobicContact CB-CG 4.1Å; G183-R185 PolarHBondContact O-N 3.14Å
186	F	81.8	Confident	83.6	Confident	27 Å²	27	70.8 Å²	70.8	12%	0.118	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	149.6	-177.2	-61.1	-86.4	0	0	0	111.5	K175 Y177 C179 R184 L191 L192 H195	K175-F186 CarbonylContact C-O 3.57Å; K175-F186 VanDerWaalsContact CA-O 3.23Å; K175-F186 WeakPolarHBondContact CA-O 3.48Å; Y177-F186 WeakPolarHBondContact CD2-O 3.38Å; Y177-F186 PolarHBondContact N-O 2.88Å; Y177-F186 PolarHBondContact O-N 3.3Å; C179-F186 HydrophobicContact CB-CE2 4.23Å; R184-F186 HydrophobicContact CB-CE2 4.17Å; R184-F186 HydrophobicContact CB-CZ 4.31Å; R184-F186 HydrophobicContact CG-CE2 4.13Å; R184-F186 HydrophobicContact CG-CZ 3.9Å; R184-F186 WeakPolarHBondContact O-CD2 3.44Å; R184-F186 WeakPolarHBondContact O-CE2 3.32Å; F186-L191 HydrophobicContact CB-CB 4.09Å; F186-L191 HydrophobicContact CD1-CB 3.82Å; F186-L191 HydrophobicContact CG-CB 4.24Å; F186-L192 HydrophobicContact CB-CB 4.16Å; F186-L192 HydrophobicContact CD2-CB 3.81Å; F186-L192 HydrophobicContact CD2-CD1 3.73Å; F186-L192 HydrophobicContact CD2-CG 4.36Å; F186-L192 HydrophobicContact CE2-CD1 3.94Å; F186-L192 HydrophobicContact CG-CB 4.13Å; F186-H195 HydrophobicContact CE1-CB 3.78Å; F186-H195 AromaticContact CE1-CG 3.99Å; F186-H195 HydrophobicContact CE2-CB 3.83Å; F186-H195 AromaticContact CE2-CD2 3.26Å; F186-H195 WeakPolarHBondContact CE2-CD2 3.39Å; F186-H195 AromaticContact CE2-CG 3.58Å; F186-H195 AromaticContact CE2-NE2 3.94Å; F186-H195 HydrophobicContact CZ-CB 3.34Å; F186-H195 AromaticContact CZ-CD2 3.28Å; F186-H195 WeakPolarHBondContact CZ-CD2 3.4Å; F186-H195 AromaticContact CZ-CG 3.11Å; F186-H195 AromaticContact CZ-ND1 3.65Å; F186-H195 AromaticContact CZ-NE2 3.84Å
187	S	86.7	Confident	83.8	Confident	39 Å²	39	70.6 Å²	70.6	27%	0.273	37%	0.369	S	S	.	.	S	Bend	trans	-75.5	-26.5	178.5	56.9	0	0	0	0	113.7	K174 Y177	K174-S187 WeakPolarHBondContact O-CA 3.35Å; K174-S187 WeakPolarHBondContact O-CB 3.45Å; Y177-S187 WeakPolarHBondContact CE2-O 3.46Å
188	Y	84.7	Confident	83.5	Confident	152 Å²	152	69.8 Å²	69.8	60%	0.596	38%	0.382	S	S	*	.	S	Bend	trans	-132.7	147.2	-178.9	-59.1	-74.8	0	0	0	110.7	Y177 S190 L191 L192	Y177-Y188 VanDerWaalsContact CD2-C 3.42Å; Y188-S190 PolarHBondContact O-N 3.19Å; Y188-L191 HydrophobicContact CD2-CD1 4.06Å; Y188-L191 PolarHBondContact O-N 3.48Å; Y188-L192 PolarHBondContact O-N 3.47Å
189	P	87.2	Confident	83.3	Confident	63 Å²	63	70.8 Å²	70.8	41%	0.409	38%	0.38	S	S	.	.	H	α-helix	trans	-59.7	-37.4	177.3	-18.8	29.6	0	0	0	112.1	Y177 L191 L192 V193	Y177-P189 HydrophobicContact CD1-CG 4.12Å; Y177-P189 HydrophobicContact CD2-CG 4.25Å; Y177-P189 HydrophobicContact CE1-CB 4.44Å; Y177-P189 HydrophobicContact CE1-CG 3.63Å; Y177-P189 HydrophobicContact CE2-CG 3.76Å; Y177-P189 HydrophobicContact CG-CG 4.41Å; Y177-P189 VanDerWaalsContact CZ-CG 3.43Å; P189-L191 VanDerWaalsContact C-N 3.26Å; P189-L191 PolarHBondContact O-N 2.77Å; P189-L192 WeakPolarHBondContact O-CB 3.27Å; P189-L192 PolarHBondContact O-N 2.85Å; P189-L192 VanDerWaalsContact O-N 3.09Å; P189-V193 WeakPolarHBondContact O-CG2 3.44Å; P189-V193 PolarHBondContact O-N 3.36Å
190	S	85.7	Confident	83.3	Confident	83 Å²	83	73.9 Å²	73.9	58%	0.58	40%	0.402	S	S	*	.	H	α-helix	trans	-59.2	-36.7	179.1	59.5	0	0	0	0	112.6	Y188 S194	Y188-S190 PolarHBondContact O-N 3.19Å; S190-S194 WeakPolarHBondContact O-CB 3.38Å; S190-S194 PolarHBondContact O-N 3.16Å
191	L	84.7	Confident	83	Confident	62 Å²	62	71.4 Å²	71.4	33%	0.325	40%	0.395	S	S	.	.	H	α-helix	trans	-70.3	-41	175.5	-67.5	178.9	0	0	0	111.4	F186 Y188 P189 S194 H195	F186-L191 HydrophobicContact CB-CB 4.09Å; F186-L191 HydrophobicContact CD1-CB 3.82Å; F186-L191 HydrophobicContact CG-CB 4.24Å; Y188-L191 HydrophobicContact CD2-CD1 4.06Å; Y188-L191 PolarHBondContact O-N 3.48Å; P189-L191 VanDerWaalsContact C-N 3.26Å; P189-L191 PolarHBondContact O-N 2.77Å; L191-S194 PolarHBondContact O-N 3.38Å; L191-S194 PolarHBondContact O-OG 3.44Å; L191-H195 VanDerWaalsContact O-CB 3.31Å; L191-H195 WeakPolarHBondContact O-CB 3.5Å; L191-H195 PolarHBondContact O-N 3.35Å
192	L	86.2	Confident	83	Confident	27 Å²	27	72.1 Å²	72.1	14%	0.141	40%	0.395	C	S	.	.	H	α-helix	trans	-61.1	-48.5	174	171.7	59.8	0	0	0	111.3	P178 C179 F186 Y188 P189 S194 H195 R196	P178-L192 WeakPolarHBondContact O-CD2 3.33Å; C179-L192 VanDerWaalsContact CA-CD1 3.5Å; C179-L192 HydrophobicContact CB-CD1 3.57Å; F186-L192 HydrophobicContact CB-CB 4.16Å; F186-L192 HydrophobicContact CD2-CB 3.81Å; F186-L192 HydrophobicContact CD2-CD1 3.73Å; F186-L192 HydrophobicContact CD2-CG 4.36Å; F186-L192 HydrophobicContact CE2-CD1 3.94Å; F186-L192 HydrophobicContact CG-CB 4.13Å; Y188-L192 PolarHBondContact O-N 3.47Å; P189-L192 WeakPolarHBondContact O-CB 3.27Å; P189-L192 PolarHBondContact O-N 2.85Å; P189-L192 VanDerWaalsContact O-N 3.09Å; L192-S194 VanDerWaalsContact C-N 3.31Å; L192-S194 PolarHBondContact O-N 2.86Å; L192-H195 CarbonylContact O-C 3.16Å; L192-H195 WeakPolarHBondContact O-CA 3.32Å; L192-H195 WeakPolarHBondContact O-CB 3.39Å; L192-H195 PolarHBondContact O-N 3.4Å; L192-R196 HydrophobicContact CD1-CG 4.09Å; L192-R196 WeakPolarHBondContact O-CG 3.34Å; L192-R196 PolarHBondContact O-N 3.25Å
193	V	86.3	Confident	83.1	Confident	75 Å²	75	70.7 Å²	70.7	46%	0.455	39%	0.386	S	S	.	.	H	α-helix	trans	-57.3	-46.2	176	173	0	0	0	0	110.6	P189 H195 R196 R197	P189-V193 WeakPolarHBondContact O-CG2 3.44Å; P189-V193 PolarHBondContact O-N 3.36Å; V193-H195 PolarHBondContact O-N 3.21Å; V193-R196 PolarHBondContact O-N 2.94Å; V193-R197 PolarHBondContact O-N 3.13Å
194	S	83.5	Confident	83.3	Confident	18 Å²	18	71.5 Å²	71.5	13%	0.126	38%	0.382	C	S	.	.	H	α-helix	trans	-64.4	-28.2	177.2	83.1	0	0	0	0	113.3	S190 L191 L192 Q216	S190-S194 WeakPolarHBondContact O-CB 3.38Å; S190-S194 PolarHBondContact O-N 3.16Å; L191-S194 PolarHBondContact O-N 3.38Å; L191-S194 PolarHBondContact O-OG 3.44Å; L192-S194 VanDerWaalsContact C-N 3.31Å; L192-S194 PolarHBondContact O-N 2.86Å; S194-Q216 PolarHBondContact OG-NE2 3.31Å
195	H	83.4	Confident	83.8	Confident	32 Å²	32	66.7 Å²	66.7	15%	0.148	36%	0.364	C	S	.	.	H	α-helix	trans	-78.9	-39	177.1	167.7	68.7	0	0	0	112	C182 F186 L191 L192 V193 R197 A198 H199	C182-H195 PolarHBondContact SG-NE2 3.31Å; F186-H195 HydrophobicContact CE1-CB 3.78Å; F186-H195 AromaticContact CE1-CG 3.99Å; F186-H195 HydrophobicContact CE2-CB 3.83Å; F186-H195 AromaticContact CE2-CD2 3.26Å; F186-H195 WeakPolarHBondContact CE2-CD2 3.39Å; F186-H195 AromaticContact CE2-CG 3.58Å; F186-H195 AromaticContact CE2-NE2 3.94Å; F186-H195 HydrophobicContact CZ-CB 3.34Å; F186-H195 AromaticContact CZ-CD2 3.28Å; F186-H195 WeakPolarHBondContact CZ-CD2 3.4Å; F186-H195 AromaticContact CZ-CG 3.11Å; F186-H195 AromaticContact CZ-ND1 3.65Å; F186-H195 AromaticContact CZ-NE2 3.84Å; L191-H195 VanDerWaalsContact O-CB 3.31Å; L191-H195 WeakPolarHBondContact O-CB 3.5Å; L191-H195 PolarHBondContact O-N 3.35Å; L192-H195 CarbonylContact O-C 3.16Å; L192-H195 WeakPolarHBondContact O-CA 3.32Å; L192-H195 WeakPolarHBondContact O-CB 3.39Å; L192-H195 PolarHBondContact O-N 3.4Å; V193-H195 PolarHBondContact O-N 3.21Å; H195-R197 PolarHBondContact O-N 3.03Å; H195-A198 WeakPolarHBondContact O-CA 3.43Å; H195-A198 WeakPolarHBondContact O-CB 3.47Å; H195-A198 PolarHBondContact O-N 2.77Å; H195-H199 AromaticContact CE1-NE2 3.75Å; H195-H199 AromaticContact NE2-CD2 3.94Å; H195-H199 AromaticContact NE2-NE2 3.42Å; H195-H199 PolarHBondContact NE2-NE2 3.05Å
196	R	84.6	Confident	84.1	Confident	127 Å²	127	65.5 Å²	65.5	48%	0.479	37%	0.365	S	S	.	.	H	α-helix	trans	-57.5	-31	175	-72.6	-176	69.4	-139.3	-2.2	112.4	L192 V193 A198 H199 S200	L192-R196 HydrophobicContact CD1-CG 4.09Å; L192-R196 WeakPolarHBondContact O-CG 3.34Å; L192-R196 PolarHBondContact O-N 3.25Å; V193-R196 PolarHBondContact O-N 2.94Å; R196-A198 PolarHBondContact O-N 2.99Å; R196-A198 VanDerWaalsContact O-N 3.17Å; R196-H199 WeakPolarHBondContact O-CA 3.34Å; R196-H199 WeakPolarHBondContact O-CB 3.21Å; R196-H199 PolarHBondContact O-N 2.73Å; R196-S200 PolarHBondContact O-N 2.82Å
197	R	84.4	Confident	84.5	Confident	56 Å²	56	64.3 Å²	64.3	21%	0.211	36%	0.36	C	S	.	.	H	α-helix	trans	-57.5	-26.2	170.2	-66.3	178.6	-171.8	173.7	-0.3	113.8	V193 H195 H199 G201 E202 S215	V193-R197 PolarHBondContact O-N 3.13Å; H195-R197 PolarHBondContact O-N 3.03Å; R197-H199 VanDerWaalsContact C-N 3.31Å; R197-G201 CarbonylContact O-C 3.47Å; R197-G201 WeakPolarHBondContact O-CA 3.42Å; R197-G201 PolarHBondContact O-N 3.04Å; R197-E202 HydrophobicContact CB-CB 4.49Å; R197-E202 WeakPolarHBondContact CB-O 3.47Å; R197-E202 HydrophobicContact CG-CB 4.37Å; R197-E202 PolarHBondContact O-N 3.47Å; R197-S215 WeakPolarHBondContact CD-O 3.45Å; R197-S215 PolarHBondContact NH1-O 3.04Å
198	A	77.7	Confident	84.6	Confident	75 Å²	75	69.6 Å²	69.6	62%	0.62	39%	0.385	S	S	*	.	H	α-helix	trans	-72.4	-25.4	173.7	0	0	0	0	0	112.7	H195 R196	H195-A198 WeakPolarHBondContact O-CA 3.43Å; H195-A198 WeakPolarHBondContact O-CB 3.47Å; H195-A198 PolarHBondContact O-N 2.77Å; R196-A198 PolarHBondContact O-N 2.99Å; R196-A198 VanDerWaalsContact O-N 3.17Å
199	H	80.5	Confident	84.7	Confident	89 Å²	89	69 Å²	69	41%	0.412	39%	0.388	S	S	.	.	H	α-helix	trans	-82.5	-45	173.3	-68.9	-66.1	0	0	0	111.8	D181 C182 H195 R196 R197 G201	D181-H199 IonicContact OD2-CD2 3.05Å; C182-H199 PolarHBondContact SG-NE2 3.36Å; H195-H199 AromaticContact CE1-NE2 3.75Å; H195-H199 AromaticContact NE2-CD2 3.94Å; H195-H199 AromaticContact NE2-NE2 3.42Å; H195-H199 PolarHBondContact NE2-NE2 3.05Å; R196-H199 WeakPolarHBondContact O-CA 3.34Å; R196-H199 WeakPolarHBondContact O-CB 3.21Å; R196-H199 PolarHBondContact O-N 2.73Å; R197-H199 VanDerWaalsContact C-N 3.31Å; H199-G201 VanDerWaalsContact C-N 3.27Å; H199-G201 PolarHBondContact O-N 3.46Å
200	S	82.9	Confident	84.7	Confident	67 Å²	67	68.6 Å²	68.6	47%	0.469	39%	0.386	S	S	.	.	H	α-helix	trans	-75.3	-15.1	178.7	65.2	0	0	0	0	113.8	R196 E202	R196-S200 PolarHBondContact O-N 2.82Å; S200-E202 VanDerWaalsContact CB-OE1 3.32Å; S200-E202 WeakPolarHBondContact CB-OE1 3.41Å; S200-E202 PolarHBondContact O-N 2.99Å; S200-E202 WeakPolarHBondContact OG-CB 3.33Å; S200-E202 VanDerWaalsContact OG-CD 3.26Å; S200-E202 WeakPolarHBondContact OG-CG 3.46Å; S200-E202 PolarHBondContact OG-N 3.38Å; S200-E202 PolarHBondContact OG-OE1 2.91Å
201	G	77.3	Confident	84.8	Confident	53 Å²	53	66.9 Å²	66.9	55%	0.546	38%	0.382	S	S	.	.			trans	75.1	2.1	-174.2	0	0	0	0	0	113.7	R197 H199 C203	R197-G201 CarbonylContact O-C 3.47Å; R197-G201 WeakPolarHBondContact O-CA 3.42Å; R197-G201 PolarHBondContact O-N 3.04Å; H199-G201 VanDerWaalsContact C-N 3.27Å; H199-G201 PolarHBondContact O-N 3.46Å; G201-C203 PolarHBondContact O-N 3.48Å
202	E	81.4	Confident	84.8	Confident	113 Å²	113	69.8 Å²	69.8	53%	0.528	39%	0.392	S	S	.	.			trans	-62.8	118.8	179.7	-76.4	167.7	-125.1	0	0	111.8	R197 S200 P204	R197-E202 HydrophobicContact CB-CB 4.49Å; R197-E202 WeakPolarHBondContact CB-O 3.47Å; R197-E202 HydrophobicContact CG-CB 4.37Å; R197-E202 PolarHBondContact O-N 3.47Å; S200-E202 VanDerWaalsContact CB-OE1 3.32Å; S200-E202 WeakPolarHBondContact CB-OE1 3.41Å; S200-E202 PolarHBondContact O-N 2.99Å; S200-E202 WeakPolarHBondContact OG-CB 3.33Å; S200-E202 VanDerWaalsContact OG-CD 3.26Å; S200-E202 WeakPolarHBondContact OG-CG 3.46Å; S200-E202 PolarHBondContact OG-N 3.38Å; S200-E202 PolarHBondContact OG-OE1 2.91Å; E202-P204 WeakPolarHBondContact O-CD 3.46Å
203	C	84.9	Confident	84.8	Confident	37 Å²	37	76.1 Å²	76.1	25%	0.25	41%	0.414	C	S	.	.			trans	-123.7	84.5	174.7	-66.3	0	0	0	0	109.7	G201 Y205 R213 F214	G201-C203 PolarHBondContact O-N 3.48Å; C203-Y205 VanDerWaalsContact C-N 3.29Å; C203-Y205 PolarHBondContact O-N 2.75Å; C203-R213 HydrophobicContact CB-CB 3.4Å; C203-R213 VanDerWaalsContact CB-CB 3.4Å; C203-R213 PolarHBondContact O-NE 3.03Å; C203-R213 PolarHBondContact O-NH2 3.36Å; C203-F214 CarbonylContact C-O 3.49Å; C203-F214 WeakPolarHBondContact CA-O 3.21Å
204	P	84.9	Confident	84.8	Confident	66 Å²	66	74.5 Å²	74.5	43%	0.429	40%	0.401	S	S	.	.			trans	-66.7	-28.1	-175.2	-22.4	34.2	0	0	0	113.7	E202 V206	E202-P204 WeakPolarHBondContact O-CD 3.46Å; P204-V206 PolarHBondContact O-N 2.76Å
205	Y	89.4	Confident	84.9	Confident	64 Å²	64	75 Å²	75	25%	0.251	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	108.4	-172.9	-54.1	-74.7	0	0	0	110.1	C203 R213 F214 R217	C203-Y205 VanDerWaalsContact C-N 3.29Å; C203-Y205 PolarHBondContact O-N 2.75Å; Y205-R213 CarbonylContact O-C 3.56Å; Y205-R213 WeakPolarHBondContact O-CA 3.34Å; Y205-F214 WeakPolarHBondContact CD2-O 3.14Å; Y205-F214 PolarHBondContact N-O 3.49Å; Y205-F214 VanDerWaalsContact N-O 3.16Å; Y205-F214 PolarHBondContact O-N 2.74Å; Y205-R217 HydrophobicContact CD1-CB 4.1Å; Y205-R217 VanDerWaalsContact CD2-N 3.34Å; Y205-R217 HydrophobicContact CE1-CB 3.86Å; Y205-R217 HydrophobicContact CE1-CG 4.5Å; Y205-R217 HydrophobicContact CE2-CB 4.3Å; Y205-R217 VanDerWaalsContact CE2-N 3.31Å; Y205-R217 HydrophobicContact CG-CB 4.43Å
206	V	88.3	Confident	84.9	Confident	51 Å²	51	75.4 Å²	75.4	31%	0.309	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	144.2	179.6	-169.7	0	0	0	0	109.6	P204 K212 R213 L220	P204-V206 PolarHBondContact O-N 2.76Å; V206-K212 CarbonylContact C-O 3.3Å; V206-R213 HydrophobicContact CG1-CG 4.31Å; V206-R213 HydrophobicContact CG2-CG 3.97Å; V206-L220 WeakPolarHBondContact O-CD2 3.38Å
207	C	90.6	Very high	85.1	Confident	2 Å²	2	77.4 Å²	77.4	1%	0.014	41%	0.414	C	S	.	.			trans	-87.9	116.4	168.4	179.7	0	0	0	0	109.6	Q209 C210 G211 K212 F214 L220	C207-Q209 PolarHBondContact O-N 3.39Å; C207-C210 PolarHBondContact O-N 3.06Å; C207-G211 VanDerWaalsContact O-CA 3.3Å; C207-G211 WeakPolarHBondContact O-CA 3.43Å; C207-G211 PolarHBondContact O-N 2.89Å; C207-K212 PolarHBondContact N-O 2.96Å; C207-F214 HydrophobicContact CB-CE2 4.35Å; C207-L220 HydrophobicContact CB-CD1 3.57Å
208	D	88.9	Confident	85.3	Confident	149 Å²	149	80.9 Å²	80.9	80%	0.797	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-29.2	-176.3	-52	-47.4	0	0	0	113
209	Q	85.3	Confident	85.8	Confident	141 Å²	141	80.1 Å²	80.1	66%	0.659	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-20.7	-177.5	-62.5	-167.2	12.1	0	0	115	C207 H227	C207-Q209 PolarHBondContact O-N 3.39Å; Q209-H227 PolarHBondContact OE1-ND1 2.77Å
210	C	88.9	Confident	86.3	Confident	54 Å²	54	76.7 Å²	76.7	37%	0.365	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.5	3.9	-179.9	70.4	0	0	0	0	115.5	C207 K212 H223 H227	C207-C210 PolarHBondContact O-N 3.06Å; C210-K212 PolarHBondContact O-N 3Å; C210-K212 VanDerWaalsContact O-N 3.12Å; C210-K212 VanDerWaalsContact SG-CG 3.58Å; C210-H223 PolarHBondContact SG-NE2 3.34Å; C210-H227 PolarHBondContact SG-NE2 3.44Å
211	G	85.9	Confident	86.7	Confident	47 Å²	47	76.2 Å²	76.2	49%	0.485	40%	0.397	S	S	.	.			trans	69.1	2.3	-179.9	0	0	0	0	0	115.3	C207 R213	C207-G211 VanDerWaalsContact O-CA 3.3Å; C207-G211 WeakPolarHBondContact O-CA 3.43Å; C207-G211 PolarHBondContact O-N 2.89Å; G211-R213 PolarHBondContact O-N 3.2Å
212	K	85.1	Confident	87.2	Confident	122 Å²	122	77.5 Å²	77.5	53%	0.53	39%	0.389	S	S	.	.			trans	-68.2	133	-179.6	-74.2	178.4	-175.9	168.3	0	111	V206 C207 C210 F214	V206-K212 CarbonylContact C-O 3.3Å; C207-K212 PolarHBondContact N-O 2.96Å; C210-K212 PolarHBondContact O-N 3Å; C210-K212 VanDerWaalsContact O-N 3.12Å; C210-K212 VanDerWaalsContact SG-CG 3.58Å; K212-F214 HydrophobicContact CB-CE2 3.88Å; K212-F214 HydrophobicContact CB-CZ 4.04Å; K212-F214 WeakPolarHBondContact O-CE2 3.48Å
213	R	86.6	Confident	87.5	Confident	160 Å²	160	72.9 Å²	72.9	60%	0.604	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	143.7	-177.7	-46	-174.7	67.9	142.8	-0.2	111.4	C203 Y205 V206 G211	C203-R213 HydrophobicContact CB-CB 3.4Å; C203-R213 VanDerWaalsContact CB-CB 3.4Å; C203-R213 PolarHBondContact O-NE 3.03Å; C203-R213 PolarHBondContact O-NH2 3.36Å; Y205-R213 CarbonylContact O-C 3.56Å; Y205-R213 WeakPolarHBondContact O-CA 3.34Å; V206-R213 HydrophobicContact CG1-CG 4.31Å; V206-R213 HydrophobicContact CG2-CG 3.97Å; G211-R213 PolarHBondContact O-N 3.2Å
214	F	86.1	Confident	87.7	Confident	42 Å²	42	74.8 Å²	74.8	18%	0.184	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	145.2	-179.1	-58.4	-88.7	0	0	0	110.7	C203 Y205 C207 K212 Q216 N219 L220 H223	C203-F214 CarbonylContact C-O 3.49Å; C203-F214 WeakPolarHBondContact CA-O 3.21Å; Y205-F214 WeakPolarHBondContact CD2-O 3.14Å; Y205-F214 PolarHBondContact N-O 3.49Å; Y205-F214 VanDerWaalsContact N-O 3.16Å; Y205-F214 PolarHBondContact O-N 2.74Å; C207-F214 HydrophobicContact CB-CE2 4.35Å; K212-F214 HydrophobicContact CB-CE2 3.88Å; K212-F214 HydrophobicContact CB-CZ 4.04Å; K212-F214 WeakPolarHBondContact O-CE2 3.48Å; F214-Q216 VanDerWaalsContact C-N 3.34Å; F214-N219 HydrophobicContact CB-CB 4.3Å; F214-N219 HydrophobicContact CD1-CB 3.91Å; F214-N219 HydrophobicContact CG-CB 4.38Å; F214-L220 HydrophobicContact CB-CB 4.26Å; F214-L220 HydrophobicContact CD2-CB 3.83Å; F214-L220 HydrophobicContact CD2-CD1 3.7Å; F214-L220 HydrophobicContact CD2-CG 4.37Å; F214-L220 HydrophobicContact CE2-CD1 3.83Å; F214-L220 HydrophobicContact CG-CB 4.18Å; F214-H223 HydrophobicContact CE1-CB 3.89Å; F214-H223 HydrophobicContact CE2-CB 3.85Å; F214-H223 AromaticContact CE2-CD2 3.44Å; F214-H223 VanDerWaalsContact CE2-CD2 3.44Å; F214-H223 WeakPolarHBondContact CE2-CD2 3.38Å; F214-H223 AromaticContact CE2-CG 3.64Å; F214-H223 HydrophobicContact CZ-CB 3.37Å; F214-H223 AromaticContact CZ-CD2 3.48Å; F214-H223 VanDerWaalsContact CZ-CD2 3.48Å; F214-H223 WeakPolarHBondContact CZ-CD2 3.45Å; F214-H223 AromaticContact CZ-CG 3.19Å; F214-H223 AromaticContact CZ-ND1 3.72Å
215	S	85	Confident	87.9	Confident	29 Å²	29	73.1 Å²	73.1	20%	0.203	36%	0.361	C	S	.	.	S	Bend	trans	-77	-19.8	177	57	0	0	0	0	113.7	R197	R197-S215 WeakPolarHBondContact CD-O 3.45Å; R197-S215 PolarHBondContact NH1-O 3.04Å
216	Q	85.4	Confident	87.7	Confident	39 Å²	39	73.7 Å²	73.7	18%	0.182	37%	0.368	C	S	.	.	S	Bend	trans	-134.1	138.5	-177.6	-62.1	-175.4	1.9	0	0	111.5	S194 F214 K218 N219 L220	S194-Q216 PolarHBondContact OG-NE2 3.31Å; F214-Q216 VanDerWaalsContact C-N 3.34Å; Q216-K218 VanDerWaalsContact C-N 3.32Å; Q216-K218 HydrophobicContact CB-CG 4.29Å; Q216-K218 PolarHBondContact O-N 3.23Å; Q216-N219 WeakPolarHBondContact O-CB 3.32Å; Q216-N219 PolarHBondContact O-N 3.42Å; Q216-N219 VanDerWaalsContact O-N 3.09Å; Q216-L220 PolarHBondContact O-N 3.05Å
217	R	88.2	Confident	87.7	Confident	170 Å²	170	74.3 Å²	74.3	64%	0.642	37%	0.367	S	S	*	.	H	α-helix	trans	-56	-43.8	178.6	-176.7	176.3	-79.1	176.6	-5.3	112.4	Y205 N219 L220 S221	Y205-R217 HydrophobicContact CD1-CB 4.1Å; Y205-R217 VanDerWaalsContact CD2-N 3.34Å; Y205-R217 HydrophobicContact CE1-CB 3.86Å; Y205-R217 HydrophobicContact CE1-CG 4.5Å; Y205-R217 HydrophobicContact CE2-CB 4.3Å; Y205-R217 VanDerWaalsContact CE2-N 3.31Å; Y205-R217 HydrophobicContact CG-CB 4.43Å; R217-N219 PolarHBondContact O-N 3.1Å; R217-N219 VanDerWaalsContact O-N 3.15Å; R217-L220 WeakPolarHBondContact O-CA 3.39Å; R217-L220 WeakPolarHBondContact O-CB 3.31Å; R217-L220 PolarHBondContact O-N 3.21Å; R217-S221 PolarHBondContact O-N 3.18Å; R217-S221 PolarHBondContact O-OG 2.91Å
218	K	88.1	Confident	87.5	Confident	129 Å²	129	78 Å²	78	56%	0.561	39%	0.39	S	S	*	.	H	α-helix	trans	-57.1	-32.2	178.8	78.1	-168.8	-163.8	-153.8	0	113.7	Q216 Q222	Q216-K218 VanDerWaalsContact C-N 3.32Å; Q216-K218 HydrophobicContact CB-CG 4.29Å; Q216-K218 PolarHBondContact O-N 3.23Å; K218-Q222 WeakPolarHBondContact O-CB 3.44Å; K218-Q222 PolarHBondContact O-N 3.32Å
219	N	89	Confident	87.2	Confident	58 Å²	58	72.8 Å²	72.8	31%	0.31	37%	0.371	S	S	.	.	H	α-helix	trans	-77	-36.2	178.4	-67	-14.3	0	0	0	111.1	F214 Q216 R217 H223	F214-N219 HydrophobicContact CB-CB 4.3Å; F214-N219 HydrophobicContact CD1-CB 3.91Å; F214-N219 HydrophobicContact CG-CB 4.38Å; Q216-N219 WeakPolarHBondContact O-CB 3.32Å; Q216-N219 PolarHBondContact O-N 3.42Å; Q216-N219 VanDerWaalsContact O-N 3.09Å; R217-N219 PolarHBondContact O-N 3.1Å; R217-N219 VanDerWaalsContact O-N 3.15Å; N219-H223 VanDerWaalsContact O-CB 3.26Å; N219-H223 WeakPolarHBondContact O-CB 3.37Å; N219-H223 PolarHBondContact O-N 3.36Å
220	L	89.8	Confident	87.2	Confident	17 Å²	17	71.7 Å²	71.7	9%	0.089	37%	0.365	C	S	.	.	H	α-helix	trans	-63.5	-48.9	170.4	173	63.3	0	0	0	110.8	V206 C207 F214 Q216 R217 Q222 H223 Q224	V206-L220 WeakPolarHBondContact O-CD2 3.38Å; C207-L220 HydrophobicContact CB-CD1 3.57Å; F214-L220 HydrophobicContact CB-CB 4.26Å; F214-L220 HydrophobicContact CD2-CB 3.83Å; F214-L220 HydrophobicContact CD2-CD1 3.7Å; F214-L220 HydrophobicContact CD2-CG 4.37Å; F214-L220 HydrophobicContact CE2-CD1 3.83Å; F214-L220 HydrophobicContact CG-CB 4.18Å; Q216-L220 PolarHBondContact O-N 3.05Å; R217-L220 WeakPolarHBondContact O-CA 3.39Å; R217-L220 WeakPolarHBondContact O-CB 3.31Å; R217-L220 PolarHBondContact O-N 3.21Å; L220-Q222 VanDerWaalsContact C-N 3.32Å; L220-Q222 PolarHBondContact O-N 2.93Å; L220-H223 CarbonylContact O-C 3.42Å; L220-H223 WeakPolarHBondContact O-CA 3.37Å; L220-H223 VanDerWaalsContact O-CB 3.3Å; L220-H223 WeakPolarHBondContact O-CB 3.42Å; L220-H223 PolarHBondContact O-N 2.75Å; L220-Q224 HydrophobicContact CD1-CG 4.24Å; L220-Q224 HydrophobicContact CG-CG 4.47Å; L220-Q224 WeakPolarHBondContact O-CG 3.49Å; L220-Q224 PolarHBondContact O-N 3.46Å
221	S	90.7	Very high	87.1	Confident	57 Å²	57	74.4 Å²	74.4	40%	0.399	37%	0.371	S	S	.	.	H	α-helix	trans	-59	-44.3	177.5	-54.6	0	0	0	0	111.6	R217 H223 Q224	R217-S221 PolarHBondContact O-N 3.18Å; R217-S221 PolarHBondContact O-OG 2.91Å; S221-H223 PolarHBondContact O-N 3.42Å; S221-Q224 PolarHBondContact O-N 3.32Å
222	Q	88.3	Confident	87.1	Confident	81 Å²	81	76.3 Å²	76.3	38%	0.379	38%	0.375	S	S	.	.	H	α-helix	trans	-63.9	-28.9	172.6	-173.3	-173.5	79.2	0	0	112.6	K218 L220 V225 R244	K218-Q222 WeakPolarHBondContact O-CB 3.44Å; K218-Q222 PolarHBondContact O-N 3.32Å; L220-Q222 VanDerWaalsContact C-N 3.32Å; L220-Q222 PolarHBondContact O-N 2.93Å; Q222-V225 WeakPolarHBondContact O-CG2 3.5Å; Q222-R244 VanDerWaalsContact CD-NE 3.35Å; Q222-R244 VanDerWaalsContact OE1-CZ 3.3Å
223	H	88.2	Confident	87.4	Confident	15 Å²	15	75.2 Å²	75.2	7%	0.069	37%	0.368	C	S	.	.	H	α-helix	trans	-75.8	-35.8	176.1	169.5	69	0	0	0	112.2	C210 F214 N219 L220 S221 V225 I226 H227	C210-H223 PolarHBondContact SG-NE2 3.34Å; F214-H223 HydrophobicContact CE1-CB 3.89Å; F214-H223 HydrophobicContact CE2-CB 3.85Å; F214-H223 AromaticContact CE2-CD2 3.44Å; F214-H223 VanDerWaalsContact CE2-CD2 3.44Å; F214-H223 WeakPolarHBondContact CE2-CD2 3.38Å; F214-H223 AromaticContact CE2-CG 3.64Å; F214-H223 HydrophobicContact CZ-CB 3.37Å; F214-H223 AromaticContact CZ-CD2 3.48Å; F214-H223 VanDerWaalsContact CZ-CD2 3.48Å; F214-H223 WeakPolarHBondContact CZ-CD2 3.45Å; F214-H223 AromaticContact CZ-CG 3.19Å; F214-H223 AromaticContact CZ-ND1 3.72Å; N219-H223 VanDerWaalsContact O-CB 3.26Å; N219-H223 WeakPolarHBondContact O-CB 3.37Å; N219-H223 PolarHBondContact O-N 3.36Å; L220-H223 CarbonylContact O-C 3.42Å; L220-H223 WeakPolarHBondContact O-CA 3.37Å; L220-H223 VanDerWaalsContact O-CB 3.3Å; L220-H223 WeakPolarHBondContact O-CB 3.42Å; L220-H223 PolarHBondContact O-N 2.75Å; S221-H223 PolarHBondContact O-N 3.42Å; H223-V225 PolarHBondContact O-N 3.07Å; H223-I226 WeakPolarHBondContact O-CB 3.38Å; H223-I226 VanDerWaalsContact O-CG1 3.26Å; H223-I226 WeakPolarHBondContact O-CG1 3.4Å; H223-I226 PolarHBondContact O-N 3.17Å; H223-H227 AromaticContact CE1-NE2 3.96Å; H223-H227 AromaticContact NE2-CD2 3.9Å; H223-H227 AromaticContact NE2-NE2 3.48Å; H223-H227 PolarHBondContact NE2-NE2 3.07Å
224	Q	89.1	Confident	87.7	Confident	77 Å²	77	72.4 Å²	72.4	36%	0.36	36%	0.362	S	S	.	.	H	α-helix	trans	-59.8	-28.9	178.7	-74.7	170.2	-40.5	0	0	112.6	L220 S221 I226 H227 T228	L220-Q224 HydrophobicContact CD1-CG 4.24Å; L220-Q224 HydrophobicContact CG-CG 4.47Å; L220-Q224 WeakPolarHBondContact O-CG 3.49Å; L220-Q224 PolarHBondContact O-N 3.46Å; S221-Q224 PolarHBondContact O-N 3.32Å; Q224-I226 PolarHBondContact O-N 3.24Å; Q224-H227 WeakPolarHBondContact O-CB 3.31Å; Q224-H227 PolarHBondContact O-N 3.08Å; Q224-T228 PolarHBondContact O-N 3.34Å; Q224-T228 VanDerWaalsContact O-N 3.16Å
225	V	88.3	Confident	88	Confident	32 Å²	32	70.4 Å²	70.4	19%	0.194	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-14	173.1	-45.2	0	0	0	0	113.6	Q222 H223 H227 T228 G229 R243	Q222-V225 WeakPolarHBondContact O-CG2 3.5Å; H223-V225 PolarHBondContact O-N 3.07Å; V225-H227 VanDerWaalsContact C-N 3.33Å; V225-T228 WeakPolarHBondContact CA-OG1 3.41Å; V225-G229 PolarHBondContact O-N 2.98Å; V225-R243 HydrophobicContact CG2-CB 4.15Å; V225-R243 HydrophobicContact CG2-CG 4.35Å
226	I	86	Confident	88.2	Confident	76 Å²	76	73.3 Å²	73.3	39%	0.39	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-38.3	171.7	-61.6	-176.6	0	0	0	110.6	H223 Q224 R243	H223-I226 WeakPolarHBondContact O-CB 3.38Å; H223-I226 VanDerWaalsContact O-CG1 3.26Å; H223-I226 WeakPolarHBondContact O-CG1 3.4Å; H223-I226 PolarHBondContact O-N 3.17Å; Q224-I226 PolarHBondContact O-N 3.24Å; I226-R243 PolarHBondContact O-NH2 3.35Å; I226-R243 VanDerWaalsContact O-NH2 3.16Å
227	H	87.7	Confident	88.3	Confident	64 Å²	64	76.1 Å²	76.1	30%	0.296	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-42.3	-177.3	-74.3	-72	0	0	0	112.4	Q209 C210 H223 Q224 V225 G229	Q209-H227 PolarHBondContact OE1-ND1 2.77Å; C210-H227 PolarHBondContact SG-NE2 3.44Å; H223-H227 AromaticContact CE1-NE2 3.96Å; H223-H227 AromaticContact NE2-CD2 3.9Å; H223-H227 AromaticContact NE2-NE2 3.48Å; H223-H227 PolarHBondContact NE2-NE2 3.07Å; Q224-H227 WeakPolarHBondContact O-CB 3.31Å; Q224-H227 PolarHBondContact O-N 3.08Å; V225-H227 VanDerWaalsContact C-N 3.33Å; H227-G229 PolarHBondContact O-N 3.14Å
228	T	86.4	Confident	88.4	Confident	80 Å²	80	70.6 Å²	70.6	49%	0.491	37%	0.374	S	S	.	.	S	Bend	trans	-67.6	-17.5	175.4	64.9	0	0	0	0	112.3	Q224 V225 E230	Q224-T228 PolarHBondContact O-N 3.34Å; Q224-T228 VanDerWaalsContact O-N 3.16Å; V225-T228 WeakPolarHBondContact CA-OG1 3.41Å; T228-E230 PolarHBondContact O-N 2.89Å; T228-E230 VanDerWaalsContact O-N 3.1Å; T228-E230 WeakPolarHBondContact OG1-CB 3.48Å; T228-E230 WeakPolarHBondContact OG1-CG 3.07Å; T228-E230 PolarHBondContact OG1-N 3.21Å
229	G	82.8	Confident	88.4	Confident	38 Å²	38	66.4 Å²	66.4	39%	0.392	37%	0.368	S	S	.	.			trans	73.7	-7.1	-175.9	0	0	0	0	0	113.7	V225 H227	V225-G229 PolarHBondContact O-N 2.98Å; H227-G229 PolarHBondContact O-N 3.14Å
230	E	84.9	Confident	88.5	Confident	118 Å²	118	71.3 Å²	71.3	55%	0.551	38%	0.382	S	S	*	.			trans	-58.5	136.8	-177.4	-69.3	177.7	169.9	0	0	111.8	T228	T228-E230 PolarHBondContact O-N 2.89Å; T228-E230 VanDerWaalsContact O-N 3.1Å; T228-E230 WeakPolarHBondContact OG1-CB 3.48Å; T228-E230 WeakPolarHBondContact OG1-CG 3.07Å; T228-E230 PolarHBondContact OG1-N 3.21Å
231	K	88.2	Confident	88.5	Confident	111 Å²	111	72.9 Å²	72.9	48%	0.483	39%	0.394	S	S	.	.			trans	-131.9	80.1	179.5	-71.3	164.8	172.6	-171.6	0	108.6	Y233 C241 F242 R243	K231-Y233 PolarHBondContact O-N 3.35Å; K231-Y233 VanDerWaalsContact O-N 3.09Å; K231-C241 HydrophobicContact CB-CB 3.39Å; K231-C241 HydrophobicContact CD-CB 3.99Å; K231-C241 WeakPolarHBondContact CD-O 3.39Å; K231-C241 HydrophobicContact CG-CB 4.32Å; K231-C241 WeakPolarHBondContact O-CB 3.46Å; K231-F242 CarbonylContact C-O 3.59Å; K231-F242 VanDerWaalsContact C-O 3.28Å; K231-F242 WeakPolarHBondContact CA-O 3.47Å; K231-R243 HydrophobicContact CG-CG 3.85Å
232	P	86.1	Confident	88.4	Confident	88 Å²	88	72.2 Å²	72.2	57%	0.571	38%	0.384	S	S	*	.			trans	-63.8	-20.2	-170	-24.7	35.2	0	0	0	114.9
233	Y	91.4	Very high	88.5	Confident	98 Å²	98	72.8 Å²	72.8	38%	0.384	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	100.5	-171.7	-57.4	-79.2	0	0	0	111	K231 C241 F242 S245	K231-Y233 PolarHBondContact O-N 3.35Å; K231-Y233 VanDerWaalsContact O-N 3.09Å; Y233-C241 CarbonylContact O-C 3.57Å; Y233-C241 WeakPolarHBondContact O-CA 3.41Å; Y233-F242 WeakPolarHBondContact CB-O 3.31Å; Y233-F242 WeakPolarHBondContact CD2-O 3.34Å; Y233-F242 PolarHBondContact N-O 3.07Å; Y233-F242 PolarHBondContact O-N 3.28Å; Y233-S245 VanDerWaalsContact CD2-N 3.28Å
234	H	92.3	Very high	88.5	Confident	102 Å²	102	78 Å²	78	47%	0.472	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	139.2	-179.2	175.6	-91.9	0	0	0	112.6	G239 L248	H234-G239 VanDerWaalsContact NE2-CA 3.32Å; H234-G239 WeakPolarHBondContact NE2-CA 3.34Å; H234-L248 VanDerWaalsContact O-CD2 3.32Å; H234-L248 WeakPolarHBondContact O-CD2 3.41Å
235	C	92.4	Very high	88.6	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	41%	0.406	C	S	.	.			trans	-89.6	115.6	171.1	-168.5	0	0	0	0	110.6	D237 C238 G239 R240 F242 L248 H251	C235-D237 PolarHBondContact O-N 2.73Å; C235-C238 PolarHBondContact O-N 3.21Å; C235-G239 PolarHBondContact O-N 3Å; C235-R240 HydrophobicContact CB-CB 4.49Å; C235-R240 WeakPolarHBondContact CB-O 3.3Å; C235-R240 PolarHBondContact N-O 2.97Å; C235-F242 HydrophobicContact CB-CE2 4.28Å; C235-L248 HydrophobicContact CB-CD1 3.53Å; C235-H251 PolarHBondContact SG-CD2 3.47Å
236	P	88.4	Confident	88.6	Confident	89 Å²	89	85.4 Å²	85.4	58%	0.578	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-32	-177.4	26.1	-33.8	0	0	0	112.6
237	D	87.9	Confident	88.8	Confident	98 Å²	98	84.1 Å²	84.1	52%	0.524	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-22.1	-172.8	-49.3	-52.3	0	0	0	114.5	C235 H255	C235-D237 PolarHBondContact O-N 2.73Å; D237-H255 IonicContact OD2-CD2 3.78Å; D237-H255 IonicContact OD2-CG 2.74Å
238	C	91.4	Very high	88.9	Confident	54 Å²	54	82.2 Å²	82.2	37%	0.365	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.2	6.4	-175.6	70.7	0	0	0	0	115.9	C235 R240 H251 H255	C235-C238 PolarHBondContact O-N 3.21Å; C238-R240 PolarHBondContact O-N 3.23Å; C238-H251 PolarHBondContact SG-NE2 3.22Å; C238-H255 PolarHBondContact SG-NE2 3.33Å
239	G	88	Confident	88.9	Confident	41 Å²	41	81 Å²	81	42%	0.423	42%	0.42	S	S	.	.			trans	77.4	-4.1	178.3	0	0	0	0	0	115.2	H234 C235 C241	H234-G239 VanDerWaalsContact NE2-CA 3.32Å; H234-G239 WeakPolarHBondContact NE2-CA 3.34Å; C235-G239 PolarHBondContact O-N 3Å; G239-C241 PolarHBondContact O-N 2.93Å
240	R	89.5	Confident	89.1	Confident	161 Å²	161	81.9 Å²	81.9	61%	0.608	42%	0.416	S	S	*	.			trans	-74.7	127.5	-173.4	-73.9	-177.2	176.4	-175.3	2	111.8	C235 C238 F242	C235-R240 HydrophobicContact CB-CB 4.49Å; C235-R240 WeakPolarHBondContact CB-O 3.3Å; C235-R240 PolarHBondContact N-O 2.97Å; C238-R240 PolarHBondContact O-N 3.23Å; R240-F242 HydrophobicContact CB-CE2 3.86Å; R240-F242 HydrophobicContact CB-CZ 4.06Å; R240-F242 WeakPolarHBondContact O-CD2 3.33Å; R240-F242 VanDerWaalsContact O-CE2 3.29Å; R240-F242 WeakPolarHBondContact O-CE2 3.2Å
241	C	90.3	Very high	89.3	Confident	51 Å²	51	77 Å²	77	35%	0.345	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	142.5	177	-51.7	0	0	0	0	112.8	K231 Y233 G239	K231-C241 HydrophobicContact CB-CB 3.39Å; K231-C241 HydrophobicContact CD-CB 3.99Å; K231-C241 WeakPolarHBondContact CD-O 3.39Å; K231-C241 HydrophobicContact CG-CB 4.32Å; K231-C241 WeakPolarHBondContact O-CB 3.46Å; Y233-C241 CarbonylContact O-C 3.57Å; Y233-C241 WeakPolarHBondContact O-CA 3.41Å; G239-C241 PolarHBondContact O-N 2.93Å
242	F	89.7	Confident	89.3	Confident	42 Å²	42	78 Å²	78	18%	0.184	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.5	-179.3	-60.2	-90.9	0	0	0	111.2	K231 Y233 C235 R240 R244 L248 H251	K231-F242 CarbonylContact C-O 3.59Å; K231-F242 VanDerWaalsContact C-O 3.28Å; K231-F242 WeakPolarHBondContact CA-O 3.47Å; Y233-F242 WeakPolarHBondContact CB-O 3.31Å; Y233-F242 WeakPolarHBondContact CD2-O 3.34Å; Y233-F242 PolarHBondContact N-O 3.07Å; Y233-F242 PolarHBondContact O-N 3.28Å; C235-F242 HydrophobicContact CB-CE2 4.28Å; R240-F242 HydrophobicContact CB-CE2 3.86Å; R240-F242 HydrophobicContact CB-CZ 4.06Å; R240-F242 WeakPolarHBondContact O-CD2 3.33Å; R240-F242 VanDerWaalsContact O-CE2 3.29Å; R240-F242 WeakPolarHBondContact O-CE2 3.2Å; F242-R244 VanDerWaalsContact C-N 3.34Å; F242-L248 HydrophobicContact CB-CB 4.2Å; F242-L248 HydrophobicContact CD2-CB 3.82Å; F242-L248 HydrophobicContact CD2-CD1 3.73Å; F242-L248 HydrophobicContact CD2-CG 4.38Å; F242-L248 HydrophobicContact CE2-CD1 3.92Å; F242-L248 HydrophobicContact CG-CB 4.15Å; F242-H251 HydrophobicContact CE1-CB 3.77Å; F242-H251 HydrophobicContact CE2-CB 3.81Å; F242-H251 AromaticContact CE2-CD2 3.18Å; F242-H251 WeakPolarHBondContact CE2-CD2 3.46Å; F242-H251 AromaticContact CE2-CG 3.61Å; F242-H251 AromaticContact CE2-NE2 3.93Å; F242-H251 HydrophobicContact CZ-CB 3.31Å; F242-H251 AromaticContact CZ-CD2 3.21Å; F242-H251 WeakPolarHBondContact CZ-CD2 3.29Å; F242-H251 AromaticContact CZ-CG 3.15Å; F242-H251 AromaticContact CZ-ND1 3.85Å; F242-H251 AromaticContact CZ-NE2 3.85Å
243	R	89.7	Confident	89.3	Confident	94 Å²	94	75.1 Å²	75.1	36%	0.355	38%	0.375	S	S	.	.	S	Bend	trans	-78.8	-15.8	177	-64.6	-176.6	175.5	156.5	-4	114.1	V225 I226 K231	V225-R243 HydrophobicContact CG2-CB 4.15Å; V225-R243 HydrophobicContact CG2-CG 4.35Å; I226-R243 PolarHBondContact O-NH2 3.35Å; I226-R243 VanDerWaalsContact O-NH2 3.16Å; K231-R243 HydrophobicContact CG-CG 3.85Å
244	R	89	Confident	89	Confident	124 Å²	124	74.7 Å²	74.7	47%	0.468	38%	0.382	S	S	.	.	S	Bend	trans	-137.8	136.3	-175.5	-64.9	178.2	178.5	162.5	-4.1	109.7	Q222 F242 R246 S247 L248	Q222-R244 VanDerWaalsContact CD-NE 3.35Å; Q222-R244 VanDerWaalsContact OE1-CZ 3.3Å; F242-R244 VanDerWaalsContact C-N 3.34Å; R244-R246 VanDerWaalsContact C-N 3.29Å; R244-R246 PolarHBondContact O-N 3.34Å; R244-S247 WeakPolarHBondContact O-CA 3.5Å; R244-S247 WeakPolarHBondContact O-CB 3.21Å; R244-S247 PolarHBondContact O-N 3.35Å; R244-L248 PolarHBondContact O-N 3.39Å
245	S	90.3	Very high	88.8	Confident	64 Å²	64	73.6 Å²	73.6	45%	0.448	38%	0.377	S	S	.	.	H	α-helix	trans	-53.5	-45	175.6	172.4	0	0	0	0	112.1	Y233 S247 L248 A249	Y233-S245 VanDerWaalsContact CD2-N 3.28Å; S245-S247 PolarHBondContact O-N 3.24Å; S245-L248 WeakPolarHBondContact O-CB 3.42Å; S245-L248 PolarHBondContact O-N 3.11Å; S245-A249 PolarHBondContact O-N 3.27Å
246	R	88	Confident	88.5	Confident	201 Å²	201	77.5 Å²	77.5	76%	0.758	40%	0.401	S	S	*	.	H	α-helix	trans	-59.1	-32.2	177.1	-166.3	171.9	-156.4	152.6	8.1	113.3	R244 N250	R244-R246 VanDerWaalsContact C-N 3.29Å; R244-R246 PolarHBondContact O-N 3.34Å; R246-N250 VanDerWaalsContact O-CB 3.26Å; R246-N250 WeakPolarHBondContact O-CB 3.38Å; R246-N250 PolarHBondContact O-N 3.41Å; R246-N250 PolarHBondContact O-ND2 2.89Å; R246-N250 PolarHBondContact O-OD1 2.83Å
247	S	89.6	Confident	88.2	Confident	49 Å²	49	75.4 Å²	75.4	34%	0.343	40%	0.396	S	S	.	.	H	α-helix	trans	-71.9	-38.5	176.5	-60.3	0	0	0	0	111.7	R244 S245 H251	R244-S247 WeakPolarHBondContact O-CA 3.5Å; R244-S247 WeakPolarHBondContact O-CB 3.21Å; R244-S247 PolarHBondContact O-N 3.35Å; S245-S247 PolarHBondContact O-N 3.24Å; S247-H251 WeakPolarHBondContact O-CB 3.19Å; S247-H251 PolarHBondContact O-N 3.5Å
248	L	90	Very high	88.1	Confident	24 Å²	24	76.5 Å²	76.5	13%	0.126	40%	0.398	C	S	.	.	H	α-helix	trans	-65.2	-49.5	171.9	172	62.6	0	0	0	111	H234 C235 F242 R244 S245 N250 H251 R252	H234-L248 VanDerWaalsContact O-CD2 3.32Å; H234-L248 WeakPolarHBondContact O-CD2 3.41Å; C235-L248 HydrophobicContact CB-CD1 3.53Å; F242-L248 HydrophobicContact CB-CB 4.2Å; F242-L248 HydrophobicContact CD2-CB 3.82Å; F242-L248 HydrophobicContact CD2-CD1 3.73Å; F242-L248 HydrophobicContact CD2-CG 4.38Å; F242-L248 HydrophobicContact CE2-CD1 3.92Å; F242-L248 HydrophobicContact CG-CB 4.15Å; R244-L248 PolarHBondContact O-N 3.39Å; S245-L248 WeakPolarHBondContact O-CB 3.42Å; S245-L248 PolarHBondContact O-N 3.11Å; L248-N250 VanDerWaalsContact C-N 3.25Å; L248-N250 PolarHBondContact O-N 3.03Å; L248-H251 CarbonylContact O-C 3.58Å; L248-H251 WeakPolarHBondContact O-CA 3.41Å; L248-H251 WeakPolarHBondContact O-CB 3.35Å; L248-H251 PolarHBondContact O-N 3.3Å; L248-R252 HydrophobicContact CD1-CG 4.18Å; L248-R252 WeakPolarHBondContact O-CG 3.49Å; L248-R252 PolarHBondContact O-N 3.29Å
249	A	87.1	Confident	87.9	Confident	53 Å²	53	79.2 Å²	79.2	44%	0.438	40%	0.403	S	S	.	.	H	α-helix	trans	-55.5	-43.9	177.7	0	0	0	0	0	111.3	S245 R252	S245-A249 PolarHBondContact O-N 3.27Å; A249-R252 PolarHBondContact O-N 3.42Å
250	N	87.1	Confident	87.8	Confident	58 Å²	58	80.9 Å²	80.9	31%	0.31	41%	0.407	S	S	.	.	H	α-helix	trans	-60.7	-51	172.2	-75.8	-3.5	0	0	0	111.1	R246 L248 R252 T253 Y272	R246-N250 VanDerWaalsContact O-CB 3.26Å; R246-N250 WeakPolarHBondContact O-CB 3.38Å; R246-N250 PolarHBondContact O-N 3.41Å; R246-N250 PolarHBondContact O-ND2 2.89Å; R246-N250 PolarHBondContact O-OD1 2.83Å; L248-N250 VanDerWaalsContact C-N 3.25Å; L248-N250 PolarHBondContact O-N 3.03Å; N250-R252 VanDerWaalsContact C-N 3.28Å; N250-R252 PolarHBondContact O-N 2.88Å; N250-T253 WeakPolarHBondContact O-CB 3.39Å; N250-T253 WeakPolarHBondContact O-CG2 3.48Å; N250-T253 PolarHBondContact O-N 3.03Å; N250-T253 VanDerWaalsContact O-N 3.08Å; N250-T253 PolarHBondContact O-OG1 3.2Å; N250-Y272 HydrophobicContact CB-CD1 4.33Å; N250-Y272 HydrophobicContact CB-CE1 3.43Å; N250-Y272 VanDerWaalsContact CB-CE1 3.43Å; N250-Y272 WeakPolarHBondContact CB-OH 3.47Å; N250-Y272 VanDerWaalsContact CG-CE1 3.44Å; N250-Y272 PolarHBondContact O-OH 2.9Å
251	H	88.5	Confident	87.8	Confident	16 Å²	16	76.2 Å²	76.2	7%	0.074	39%	0.392	C	S	.	.	H	α-helix	trans	-57.5	-37	180	169.3	58.7	0	0	0	113.9	C235 C238 F242 S247 L248 T253 T254 H255	C235-H251 PolarHBondContact SG-CD2 3.47Å; C238-H251 PolarHBondContact SG-NE2 3.22Å; F242-H251 HydrophobicContact CE1-CB 3.77Å; F242-H251 HydrophobicContact CE2-CB 3.81Å; F242-H251 AromaticContact CE2-CD2 3.18Å; F242-H251 WeakPolarHBondContact CE2-CD2 3.46Å; F242-H251 AromaticContact CE2-CG 3.61Å; F242-H251 AromaticContact CE2-NE2 3.93Å; F242-H251 HydrophobicContact CZ-CB 3.31Å; F242-H251 AromaticContact CZ-CD2 3.21Å; F242-H251 WeakPolarHBondContact CZ-CD2 3.29Å; F242-H251 AromaticContact CZ-CG 3.15Å; F242-H251 AromaticContact CZ-ND1 3.85Å; F242-H251 AromaticContact CZ-NE2 3.85Å; S247-H251 WeakPolarHBondContact O-CB 3.19Å; S247-H251 PolarHBondContact O-N 3.5Å; L248-H251 CarbonylContact O-C 3.58Å; L248-H251 WeakPolarHBondContact O-CA 3.41Å; L248-H251 WeakPolarHBondContact O-CB 3.35Å; L248-H251 PolarHBondContact O-N 3.3Å; H251-T253 PolarHBondContact O-N 3.45Å; H251-T253 VanDerWaalsContact O-N 3.13Å; H251-T254 PolarHBondContact CE1-OG1 3.13Å; H251-T254 PolarHBondContact ND1-OG1 2.83Å; H251-T254 VanDerWaalsContact O-CB 3.29Å; H251-T254 WeakPolarHBondContact O-CB 3.41Å; H251-T254 WeakPolarHBondContact O-CG2 3.38Å; H251-T254 PolarHBondContact O-N 2.98Å; H251-T254 PolarHBondContact O-OG1 3.18Å; H251-H255 AromaticContact CE1-NE2 3.53Å; H251-H255 AromaticContact NE2-NE2 3.33Å; H251-H255 PolarHBondContact NE2-NE2 3.25Å
252	R	87.9	Confident	87.9	Confident	132 Å²	132	79.3 Å²	79.3	50%	0.498	40%	0.401	S	S	.	.	H	α-helix	trans	-57.4	-29.2	177.6	-70.8	179.5	73.3	-174.8	1.4	113.1	L248 A249 N250 T254 H255 T256	L248-R252 HydrophobicContact CD1-CG 4.18Å; L248-R252 WeakPolarHBondContact O-CG 3.49Å; L248-R252 PolarHBondContact O-N 3.29Å; A249-R252 PolarHBondContact O-N 3.42Å; N250-R252 VanDerWaalsContact C-N 3.28Å; N250-R252 PolarHBondContact O-N 2.88Å; R252-T254 PolarHBondContact O-N 3.08Å; R252-T254 VanDerWaalsContact O-N 3.08Å; R252-H255 PolarHBondContact O-N 2.62Å; R252-T256 PolarHBondContact O-N 3.48Å
253	T	87.2	Confident	88.1	Confident	27 Å²	27	77.3 Å²	77.3	17%	0.166	39%	0.392	C	S	.	.	H	α-helix	trans	-60.8	-19.2	172.9	70.4	0	0	0	0	113.4	N250 H251 G257 Y272	N250-T253 WeakPolarHBondContact O-CB 3.39Å; N250-T253 WeakPolarHBondContact O-CG2 3.48Å; N250-T253 PolarHBondContact O-N 3.03Å; N250-T253 VanDerWaalsContact O-N 3.08Å; N250-T253 PolarHBondContact O-OG1 3.2Å; H251-T253 PolarHBondContact O-N 3.45Å; H251-T253 VanDerWaalsContact O-N 3.13Å; T253-G257 WeakPolarHBondContact O-CA 3.49Å; T253-G257 PolarHBondContact O-N 3.2Å; T253-Y272 HydrophobicContact CG2-CE1 4.29Å; T253-Y272 PolarHBondContact OG1-OH 2.59Å
254	T	85.8	Confident	88.1	Confident	88 Å²	88	78 Å²	78	54%	0.54	41%	0.409	S	S	.	.	H	α-helix	trans	-77.4	-25.2	175.1	68.5	0	0	0	0	113	H251 R252	H251-T254 PolarHBondContact CE1-OG1 3.13Å; H251-T254 PolarHBondContact ND1-OG1 2.83Å; H251-T254 VanDerWaalsContact O-CB 3.29Å; H251-T254 WeakPolarHBondContact O-CB 3.41Å; H251-T254 WeakPolarHBondContact O-CG2 3.38Å; H251-T254 PolarHBondContact O-N 2.98Å; H251-T254 PolarHBondContact O-OG1 3.18Å; R252-T254 PolarHBondContact O-N 3.08Å; R252-T254 VanDerWaalsContact O-N 3.08Å
255	H	87.1	Confident	88.1	Confident	80 Å²	80	76.1 Å²	76.1	37%	0.37	42%	0.415	S	S	.	.	H	α-helix	trans	-82	-46.1	174	-68.6	-60.2	0	0	0	111.3	D237 C238 H251 R252 G257	D237-H255 IonicContact OD2-CD2 3.78Å; D237-H255 IonicContact OD2-CG 2.74Å; C238-H255 PolarHBondContact SG-NE2 3.33Å; H251-H255 AromaticContact CE1-NE2 3.53Å; H251-H255 AromaticContact NE2-NE2 3.33Å; H251-H255 PolarHBondContact NE2-NE2 3.25Å; R252-H255 PolarHBondContact O-N 2.62Å; H255-G257 PolarHBondContact O-N 3.2Å
256	T	85.7	Confident	88.2	Confident	81 Å²	81	76 Å²	76	50%	0.497	41%	0.414	S	S	.	.	H	α-helix	trans	-72.8	-19.5	179.5	64.8	0	0	0	0	112.6	R252 E258	R252-T256 PolarHBondContact O-N 3.48Å; T256-E258 PolarHBondContact O-N 2.76Å; T256-E258 VanDerWaalsContact O-N 3.1Å; T256-E258 WeakPolarHBondContact OG1-CB 3.49Å; T256-E258 WeakPolarHBondContact OG1-CG 3.39Å; T256-E258 PolarHBondContact OG1-N 2.99Å; T256-E258 PolarHBondContact OG1-OE2 3.31Å
257	G	83.3	Confident	88.3	Confident	46 Å²	46	68 Å²	68	47%	0.474	39%	0.394	S	S	.	.			trans	67.6	3.3	-172.7	0	0	0	0	0	113.3	T253 H255 K259	T253-G257 WeakPolarHBondContact O-CA 3.49Å; T253-G257 PolarHBondContact O-N 3.2Å; H255-G257 PolarHBondContact O-N 3.2Å; G257-K259 PolarHBondContact O-N 3.3Å
258	E	84.1	Confident	88.4	Confident	121 Å²	121	73.6 Å²	73.6	57%	0.565	41%	0.407	S	S	*	.			trans	-64.1	130.2	-176.7	-72.7	176.9	151.1	0	0	110.9	T256	T256-E258 PolarHBondContact O-N 2.76Å; T256-E258 VanDerWaalsContact O-N 3.1Å; T256-E258 WeakPolarHBondContact OG1-CB 3.49Å; T256-E258 WeakPolarHBondContact OG1-CG 3.39Å; T256-E258 PolarHBondContact OG1-N 2.99Å; T256-E258 PolarHBondContact OG1-OE2 3.31Å
259	K	88.3	Confident	88.4	Confident	110 Å²	110	79.1 Å²	79.1	48%	0.478	43%	0.426	S	S	.	.			trans	-128.4	81.2	177.9	-69.3	169.4	-170.8	167.7	0	108.2	G257 H261 R269 F270	G257-K259 PolarHBondContact O-N 3.3Å; K259-H261 PolarHBondContact O-N 3.42Å; K259-R269 HydrophobicContact CB-CB 3.51Å; K259-R269 HydrophobicContact CD-CB 4.44Å; K259-R269 WeakPolarHBondContact CD-O 3.24Å; K259-R269 WeakPolarHBondContact O-CB 3.28Å; K259-R269 PolarHBondContact O-NE 3.47Å; K259-R269 PolarHBondContact O-NH2 3.06Å; K259-F270 CarbonylContact C-O 3.44Å; K259-F270 VanDerWaalsContact C-O 3.3Å; K259-F270 WeakPolarHBondContact CA-O 3.38Å
260	P	85.2	Confident	88.6	Confident	76 Å²	76	77.8 Å²	77.8	49%	0.494	41%	0.411	S	S	.	.			trans	-63.6	-28.4	-172.9	-24.1	35.3	0	0	0	113.1	Q262	P260-Q262 PolarHBondContact O-N 3.39Å
261	H	90.5	Very high	88.6	Confident	64 Å²	64	76 Å²	76	30%	0.296	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	98.5	-169.4	-56.3	-69.3	0	0	0	111.7	K259 R269 F270 A271 Y272 P273 L276	K259-H261 PolarHBondContact O-N 3.42Å; H261-R269 CarbonylContact O-C 3.5Å; H261-R269 WeakPolarHBondContact O-CA 3.43Å; H261-F270 HydrophobicContact CB-CB 4.39Å; H261-F270 WeakPolarHBondContact CB-O 3.22Å; H261-F270 PolarHBondContact N-O 3.19Å; H261-F270 PolarHBondContact O-N 3.05Å; H261-A271 PolarHBondContact CD2-O 3.34Å; H261-Y272 VanDerWaalsContact CD2-C 3.46Å; H261-P273 VanDerWaalsContact NE2-CD 3.35Å; H261-P273 WeakPolarHBondContact NE2-CD 2.97Å; H261-L276 HydrophobicContact CB-CB 4.25Å; H261-L276 HydrophobicContact CB-CD2 3.91Å
262	Q	92.7	Very high	88.4	Confident	115 Å²	115	77.6 Å²	77.6	54%	0.537	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	137.9	177	-168.3	171.6	7.7	0	0	111.8	P260 G267 R269	P260-Q262 PolarHBondContact O-N 3.39Å; Q262-G267 WeakPolarHBondContact CG-O 3.35Å; Q262-G267 PolarHBondContact NE2-O 3.29Å; Q262-R269 HydrophobicContact CB-CG 4.11Å; Q262-R269 HydrophobicContact CG-CG 4.04Å
263	C	93	Very high	88.5	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	41%	0.411	C	S	.	.			trans	-76.6	123.5	168.7	-177.4	0	0	0	0	109.8	S265 G267 R268 F270 L276 H279	C263-S265 PolarHBondContact O-N 2.94Å; C263-G267 VanDerWaalsContact O-CA 3.27Å; C263-G267 WeakPolarHBondContact O-CA 3.46Å; C263-G267 PolarHBondContact O-N 2.78Å; C263-R268 WeakPolarHBondContact CB-O 3.46Å; C263-R268 PolarHBondContact N-O 2.97Å; C263-F270 HydrophobicContact CB-CE2 4.22Å; C263-L276 HydrophobicContact CB-CD1 3.69Å; C263-H279 PolarHBondContact SG-NE2 3.15Å
264	P	90.7	Very high	88.5	Confident	109 Å²	109	77.4 Å²	77.4	71%	0.708	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.5	-179.6	26.1	-34.2	0	0	0	112.8
265	S	88.9	Confident	88.6	Confident	84 Å²	84	77 Å²	77	59%	0.587	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-24.2	-174.7	-49.7	0	0	0	0	114.7	C263	C263-S265 PolarHBondContact O-N 2.94Å
266	C	92	Very high	88.9	Confident	63 Å²	63	74.2 Å²	74.2	43%	0.426	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.9	3.7	-178.3	67	0	0	0	0	114.5	R268 H279 H283	C266-R268 PolarHBondContact O-N 3.45Å; C266-R268 VanDerWaalsContact SG-CB 3.51Å; C266-H279 PolarHBondContact SG-NE2 2.67Å; C266-H283 PolarHBondContact SG-NE2 2.68Å; C266-H283 VanDerWaalsContact SG-NE2 3.36Å
267	G	89.8	Confident	89.1	Confident	33 Å²	33	72.5 Å²	72.5	34%	0.34	40%	0.403	S	S	.	.			trans	68.5	-1.9	-178	0	0	0	0	0	115	Q262 C263 R269	Q262-G267 WeakPolarHBondContact CG-O 3.35Å; Q262-G267 PolarHBondContact NE2-O 3.29Å; C263-G267 VanDerWaalsContact O-CA 3.27Å; C263-G267 WeakPolarHBondContact O-CA 3.46Å; C263-G267 PolarHBondContact O-N 2.78Å; G267-R269 PolarHBondContact O-N 3.11Å
268	R	91.3	Very high	89.4	Confident	165 Å²	165	72.9 Å²	72.9	62%	0.623	39%	0.394	S	S	*	.			trans	-68.1	131.6	-178.6	-171.6	170.6	-179.9	157.4	3.3	111.1	C263 C266 F270	C263-R268 WeakPolarHBondContact CB-O 3.46Å; C263-R268 PolarHBondContact N-O 2.97Å; C266-R268 PolarHBondContact O-N 3.45Å; C266-R268 VanDerWaalsContact SG-CB 3.51Å; R268-F270 HydrophobicContact CB-CE2 4.09Å; R268-F270 HydrophobicContact CB-CZ 4.33Å; R268-F270 HydrophobicContact CG-CE2 3.96Å; R268-F270 HydrophobicContact CG-CZ 3.84Å; R268-F270 WeakPolarHBondContact O-CD2 3.49Å; R268-F270 VanDerWaalsContact O-CE2 3.31Å; R268-F270 WeakPolarHBondContact O-CE2 3.39Å
269	R	91.5	Very high	89.7	Confident	140 Å²	140	68.3 Å²	68.3	53%	0.528	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	144.8	-177.4	-59	-178.5	75.2	162.8	7.2	112.4	K259 H261 Q262 G267	K259-R269 HydrophobicContact CB-CB 3.51Å; K259-R269 HydrophobicContact CD-CB 4.44Å; K259-R269 WeakPolarHBondContact CD-O 3.24Å; K259-R269 WeakPolarHBondContact O-CB 3.28Å; K259-R269 PolarHBondContact O-NE 3.47Å; K259-R269 PolarHBondContact O-NH2 3.06Å; H261-R269 CarbonylContact O-C 3.5Å; H261-R269 WeakPolarHBondContact O-CA 3.43Å; Q262-R269 HydrophobicContact CB-CG 4.11Å; Q262-R269 HydrophobicContact CG-CG 4.04Å; G267-R269 PolarHBondContact O-N 3.11Å
270	F	89.4	Confident	89.9	Confident	26 Å²	26	66.5 Å²	66.5	11%	0.114	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	147.3	179.9	-61.6	-89.1	0	0	0	111.5	K259 H261 C263 R268 Y272 L275 L276 H279	K259-F270 CarbonylContact C-O 3.44Å; K259-F270 VanDerWaalsContact C-O 3.3Å; K259-F270 WeakPolarHBondContact CA-O 3.38Å; H261-F270 HydrophobicContact CB-CB 4.39Å; H261-F270 WeakPolarHBondContact CB-O 3.22Å; H261-F270 PolarHBondContact N-O 3.19Å; H261-F270 PolarHBondContact O-N 3.05Å; C263-F270 HydrophobicContact CB-CE2 4.22Å; R268-F270 HydrophobicContact CB-CE2 4.09Å; R268-F270 HydrophobicContact CB-CZ 4.33Å; R268-F270 HydrophobicContact CG-CE2 3.96Å; R268-F270 HydrophobicContact CG-CZ 3.84Å; R268-F270 WeakPolarHBondContact O-CD2 3.49Å; R268-F270 VanDerWaalsContact O-CE2 3.31Å; R268-F270 WeakPolarHBondContact O-CE2 3.39Å; F270-Y272 VanDerWaalsContact C-N 3.32Å; F270-Y272 PolarHBondContact O-N 3.04Å; F270-L275 HydrophobicContact CB-CB 4.29Å; F270-L275 HydrophobicContact CD1-CB 3.96Å; F270-L275 HydrophobicContact CG-CB 4.44Å; F270-L276 HydrophobicContact CB-CB 4.19Å; F270-L276 HydrophobicContact CD2-CB 3.99Å; F270-L276 HydrophobicContact CD2-CD1 3.75Å; F270-L276 HydrophobicContact CD2-CG 4.46Å; F270-L276 HydrophobicContact CE2-CD1 4.01Å; F270-L276 HydrophobicContact CG-CB 4.19Å; F270-H279 HydrophobicContact CE1-CB 3.72Å; F270-H279 AromaticContact CE1-CG 3.94Å; F270-H279 HydrophobicContact CE2-CB 3.88Å; F270-H279 AromaticContact CE2-CD2 3.14Å; F270-H279 WeakPolarHBondContact CE2-CD2 3.05Å; F270-H279 AromaticContact CE2-CG 3.54Å; F270-H279 AromaticContact CE2-NE2 3.75Å; F270-H279 HydrophobicContact CZ-CB 3.35Å; F270-H279 AromaticContact CZ-CD2 3.21Å; F270-H279 WeakPolarHBondContact CZ-CD2 3.4Å; F270-H279 AromaticContact CZ-CE1 4Å; F270-H279 AromaticContact CZ-CG 3.09Å; F270-H279 AromaticContact CZ-ND1 3.64Å; F270-H279 AromaticContact CZ-NE2 3.75Å
271	A	87.9	Confident	90.2	Very high	20 Å²	20	65.6 Å²	65.6	17%	0.165	35%	0.353	C	S	.	.	S	Bend	trans	-68.4	-30.6	177.9	0	0	0	0	0	112.7	H261	H261-A271 PolarHBondContact CD2-O 3.34Å
272	Y	85.3	Confident	90.2	Very high	49 Å²	49	65.8 Å²	65.8	19%	0.192	36%	0.359	C	S	.	.	S	Bend	trans	-135.4	151.7	-174.8	-40.6	-59.2	0	0	0	112.7	N250 T253 H261 F270 S274 L275 L276	N250-Y272 HydrophobicContact CB-CD1 4.33Å; N250-Y272 HydrophobicContact CB-CE1 3.43Å; N250-Y272 VanDerWaalsContact CB-CE1 3.43Å; N250-Y272 WeakPolarHBondContact CB-OH 3.47Å; N250-Y272 VanDerWaalsContact CG-CE1 3.44Å; N250-Y272 PolarHBondContact O-OH 2.9Å; T253-Y272 HydrophobicContact CG2-CE1 4.29Å; T253-Y272 PolarHBondContact OG1-OH 2.59Å; H261-Y272 VanDerWaalsContact CD2-C 3.46Å; F270-Y272 VanDerWaalsContact C-N 3.32Å; F270-Y272 PolarHBondContact O-N 3.04Å; Y272-S274 VanDerWaalsContact C-N 3.27Å; Y272-S274 PolarHBondContact O-N 3.32Å; Y272-L275 HydrophobicContact CD2-CD1 3.63Å; Y272-L275 HydrophobicContact CD2-CG 4.05Å; Y272-L275 HydrophobicContact CE2-CD1 4.16Å; Y272-L275 PolarHBondContact O-N 3.47Å; Y272-L276 PolarHBondContact O-N 3.41Å
273	P	88.1	Confident	90.1	Very high	81 Å²	81	64.3 Å²	64.3	53%	0.526	35%	0.351	S	S	.	.	H	α-helix	trans	-61.1	-34.8	177.5	-21.2	31.7	0	0	0	113	H261 L275 L276 A277	H261-P273 VanDerWaalsContact NE2-CD 3.35Å; H261-P273 WeakPolarHBondContact NE2-CD 2.97Å; P273-L275 PolarHBondContact O-N 2.85Å; P273-L276 PolarHBondContact O-N 3.02Å; P273-A277 WeakPolarHBondContact O-CB 2.91Å; P273-A277 PolarHBondContact O-N 3.4Å
274	S	87.6	Confident	90	Very high	75 Å²	75	68.4 Å²	68.4	52%	0.524	38%	0.377	S	S	.	.	H	α-helix	trans	-65.4	-37.4	179.6	55.5	0	0	0	0	112.6	Y272 A277 I278	Y272-S274 VanDerWaalsContact C-N 3.27Å; Y272-S274 PolarHBondContact O-N 3.32Å; S274-A277 PolarHBondContact O-N 3.41Å; S274-I278 WeakPolarHBondContact O-CD1 3.17Å; S274-I278 WeakPolarHBondContact O-CG1 3.29Å; S274-I278 PolarHBondContact O-N 3.12Å
275	L	89.3	Confident	89.9	Confident	79 Å²	79	64.9 Å²	64.9	41%	0.414	36%	0.36	S	S	.	.	H	α-helix	trans	-70.4	-39.7	175.1	-67.3	-178.2	0	0	0	111.3	F270 Y272 P273 I278 H279	F270-L275 HydrophobicContact CB-CB 4.29Å; F270-L275 HydrophobicContact CD1-CB 3.96Å; F270-L275 HydrophobicContact CG-CB 4.44Å; Y272-L275 HydrophobicContact CD2-CD1 3.63Å; Y272-L275 HydrophobicContact CD2-CG 4.05Å; Y272-L275 HydrophobicContact CE2-CD1 4.16Å; Y272-L275 PolarHBondContact O-N 3.47Å; P273-L275 PolarHBondContact O-N 2.85Å; L275-I278 PolarHBondContact O-N 2.86Å; L275-H279 WeakPolarHBondContact O-CB 3.37Å; L275-H279 PolarHBondContact O-N 2.79Å
276	L	92.2	Very high	90	Very high	22 Å²	22	66.2 Å²	66.2	12%	0.115	36%	0.357	C	S	.	.	H	α-helix	trans	-60.2	-47.8	172.1	172.7	60.3	0	0	0	111	H261 C263 F270 Y272 P273 I278 H279 Q280	H261-L276 HydrophobicContact CB-CB 4.25Å; H261-L276 HydrophobicContact CB-CD2 3.91Å; C263-L276 HydrophobicContact CB-CD1 3.69Å; F270-L276 HydrophobicContact CB-CB 4.19Å; F270-L276 HydrophobicContact CD2-CB 3.99Å; F270-L276 HydrophobicContact CD2-CD1 3.75Å; F270-L276 HydrophobicContact CD2-CG 4.46Å; F270-L276 HydrophobicContact CE2-CD1 4.01Å; F270-L276 HydrophobicContact CG-CB 4.19Å; Y272-L276 PolarHBondContact O-N 3.41Å; P273-L276 PolarHBondContact O-N 3.02Å; L276-I278 VanDerWaalsContact C-N 3.33Å; L276-I278 PolarHBondContact O-N 3.2Å; L276-H279 CarbonylContact O-C 3.47Å; L276-H279 WeakPolarHBondContact O-CA 3.22Å; L276-H279 WeakPolarHBondContact O-CB 3.43Å; L276-H279 PolarHBondContact O-N 2.79Å; L276-Q280 HydrophobicContact CD1-CG 4Å; L276-Q280 HydrophobicContact CG-CG 4.35Å; L276-Q280 WeakPolarHBondContact O-CG 3.4Å; L276-Q280 PolarHBondContact O-N 2.85Å
277	A	90.4	Very high	89.9	Confident	44 Å²	44	67.1 Å²	67.1	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-61	-40.6	179.1	0	0	0	0	0	112.2	P273 S274 H279 Q280	P273-A277 WeakPolarHBondContact O-CB 2.91Å; P273-A277 PolarHBondContact O-N 3.4Å; S274-A277 PolarHBondContact O-N 3.41Å; A277-H279 VanDerWaalsContact C-N 3.32Å; A277-Q280 PolarHBondContact O-N 3.37Å
278	I	89.6	Confident	89.9	Confident	54 Å²	54	68.6 Å²	68.6	28%	0.277	36%	0.357	S	S	.	.	H	α-helix	trans	-65	-39	173.6	-68.6	164	0	0	0	110.8	S274 L275 L276 R281 Q300	S274-I278 WeakPolarHBondContact O-CD1 3.17Å; S274-I278 WeakPolarHBondContact O-CG1 3.29Å; S274-I278 PolarHBondContact O-N 3.12Å; L275-I278 PolarHBondContact O-N 2.86Å; L276-I278 VanDerWaalsContact C-N 3.33Å; L276-I278 PolarHBondContact O-N 3.2Å; I278-R281 WeakPolarHBondContact O-CB 3.37Å; I278-R281 PolarHBondContact O-N 2.73Å; I278-Q300 HydrophobicContact CG2-CG 3.75Å
279	H	91.1	Very high	90	Very high	25 Å²	25	64.3 Å²	64.3	12%	0.116	34%	0.342	C	S	.	.	H	α-helix	trans	-68.5	-39.6	176.9	167.3	66.7	0	0	0	112.6	C263 C266 F270 L275 L276 A277 R281 T282 H283	C263-H279 PolarHBondContact SG-NE2 3.15Å; C266-H279 PolarHBondContact SG-NE2 2.67Å; F270-H279 HydrophobicContact CE1-CB 3.72Å; F270-H279 AromaticContact CE1-CG 3.94Å; F270-H279 HydrophobicContact CE2-CB 3.88Å; F270-H279 AromaticContact CE2-CD2 3.14Å; F270-H279 WeakPolarHBondContact CE2-CD2 3.05Å; F270-H279 AromaticContact CE2-CG 3.54Å; F270-H279 AromaticContact CE2-NE2 3.75Å; F270-H279 HydrophobicContact CZ-CB 3.35Å; F270-H279 AromaticContact CZ-CD2 3.21Å; F270-H279 WeakPolarHBondContact CZ-CD2 3.4Å; F270-H279 AromaticContact CZ-CE1 4Å; F270-H279 AromaticContact CZ-CG 3.09Å; F270-H279 AromaticContact CZ-ND1 3.64Å; F270-H279 AromaticContact CZ-NE2 3.75Å; L275-H279 WeakPolarHBondContact O-CB 3.37Å; L275-H279 PolarHBondContact O-N 2.79Å; L276-H279 CarbonylContact O-C 3.47Å; L276-H279 WeakPolarHBondContact O-CA 3.22Å; L276-H279 WeakPolarHBondContact O-CB 3.43Å; L276-H279 PolarHBondContact O-N 2.79Å; A277-H279 VanDerWaalsContact C-N 3.32Å; H279-R281 PolarHBondContact O-N 3.28Å; H279-T282 PolarHBondContact ND1-OG1 2.82Å; H279-T282 WeakPolarHBondContact O-CB 3.33Å; H279-T282 WeakPolarHBondContact O-CG2 3.32Å; H279-T282 PolarHBondContact O-N 3.16Å; H279-T282 PolarHBondContact O-OG1 2.65Å; H279-H283 AromaticContact CE1-NE2 3.53Å; H279-H283 AromaticContact NE2-CD2 3.92Å; H279-H283 AromaticContact NE2-NE2 3.31Å; H279-H283 PolarHBondContact NE2-NE2 3.22Å
280	Q	91.4	Very high	90.1	Very high	73 Å²	73	60.3 Å²	60.3	34%	0.341	33%	0.333	S	S	.	.	H	α-helix	trans	-56.3	-28.3	177.6	-76.8	171.1	-34.2	0	0	112.3	L276 A277 T282 H283 T284	L276-Q280 HydrophobicContact CD1-CG 4Å; L276-Q280 HydrophobicContact CG-CG 4.35Å; L276-Q280 WeakPolarHBondContact O-CG 3.4Å; L276-Q280 PolarHBondContact O-N 2.85Å; A277-Q280 PolarHBondContact O-N 3.37Å; Q280-T282 PolarHBondContact O-N 2.6Å; Q280-T282 VanDerWaalsContact O-N 3.13Å; Q280-H283 WeakPolarHBondContact O-CB 3.33Å; Q280-H283 PolarHBondContact O-N 3.06Å; Q280-T284 PolarHBondContact O-N 3.3Å
281	R	92.1	Very high	90.2	Very high	56 Å²	56	59 Å²	59	21%	0.211	33%	0.327	C	S	.	.	H	α-helix	trans	-62	-16	171.3	-58.2	177.9	-173.4	174.9	0.6	114.4	I278 H279 T284 G285 E286 R299	I278-R281 WeakPolarHBondContact O-CB 3.37Å; I278-R281 PolarHBondContact O-N 2.73Å; H279-R281 PolarHBondContact O-N 3.28Å; R281-T284 WeakPolarHBondContact CA-OG1 3.22Å; R281-G285 PolarHBondContact O-N 2.85Å; R281-E286 HydrophobicContact CB-CB 4.42Å; R281-E286 HydrophobicContact CG-CB 4.32Å; R281-R299 PolarHBondContact NH1-O 2.81Å; R281-R299 WeakPolarHBondContact O-CD 3.35Å; R281-R299 PolarHBondContact O-NE 2.85Å
282	T	90.8	Very high	90.4	Very high	69 Å²	69	65.7 Å²	65.7	42%	0.423	36%	0.359	S	S	.	.	H	α-helix	trans	-74.2	-31.9	171.1	66.3	0	0	0	0	111.7	H279 Q280	H279-T282 PolarHBondContact ND1-OG1 2.82Å; H279-T282 WeakPolarHBondContact O-CB 3.33Å; H279-T282 WeakPolarHBondContact O-CG2 3.32Å; H279-T282 PolarHBondContact O-N 3.16Å; H279-T282 PolarHBondContact O-OG1 2.65Å; Q280-T282 PolarHBondContact O-N 2.6Å; Q280-T282 VanDerWaalsContact O-N 3.13Å
283	H	90.5	Very high	90.5	Very high	83 Å²	83	69.3 Å²	69.3	38%	0.384	38%	0.378	S	S	.	.	H	α-helix	trans	-82.1	-47.4	176.5	-62.7	-63.5	0	0	0	111.8	C266 H279 Q280 G285	C266-H283 PolarHBondContact SG-NE2 2.68Å; C266-H283 VanDerWaalsContact SG-NE2 3.36Å; H279-H283 AromaticContact CE1-NE2 3.53Å; H279-H283 AromaticContact NE2-CD2 3.92Å; H279-H283 AromaticContact NE2-NE2 3.31Å; H279-H283 PolarHBondContact NE2-NE2 3.22Å; Q280-H283 WeakPolarHBondContact O-CB 3.33Å; Q280-H283 PolarHBondContact O-N 3.06Å; H283-G285 PolarHBondContact O-N 3.12Å
284	T	90.2	Very high	90.7	Very high	86 Å²	86	67.8 Å²	67.8	53%	0.528	37%	0.368	S	S	.	.	S	Bend	trans	-73.2	-14	-179.9	64	0	0	0	0	113.2	Q280 R281 E286	Q280-T284 PolarHBondContact O-N 3.3Å; R281-T284 WeakPolarHBondContact CA-OG1 3.22Å; T284-E286 PolarHBondContact O-N 3.44Å; T284-E286 VanDerWaalsContact O-N 3.16Å; T284-E286 WeakPolarHBondContact OG1-CB 3.38Å; T284-E286 WeakPolarHBondContact OG1-CG 3.44Å; T284-E286 PolarHBondContact OG1-N 3.47Å
285	G	88.8	Confident	90.9	Very high	35 Å²	35	68.5 Å²	68.5	36%	0.361	37%	0.374	S	S	.	.			trans	71.4	0.6	-174.8	0	0	0	0	0	114.3	R281 H283 K287	R281-G285 PolarHBondContact O-N 2.85Å; H283-G285 PolarHBondContact O-N 3.12Å; G285-K287 PolarHBondContact O-N 3.36Å
286	E	90.6	Very high	91	Very high	112 Å²	112	72.6 Å²	72.6	52%	0.523	38%	0.384	S	S	.	.			trans	-57.5	128	-177.3	-77.6	-178.5	179.8	0	0	112.6	R281 T284 R299	R281-E286 HydrophobicContact CB-CB 4.42Å; R281-E286 HydrophobicContact CG-CB 4.32Å; T284-E286 PolarHBondContact O-N 3.44Å; T284-E286 VanDerWaalsContact O-N 3.16Å; T284-E286 WeakPolarHBondContact OG1-CB 3.38Å; T284-E286 WeakPolarHBondContact OG1-CG 3.44Å; T284-E286 PolarHBondContact OG1-N 3.47Å; E286-R299 WeakPolarHBondContact O-CG 3.36Å
287	K	90.3	Very high	91.1	Very high	82 Å²	82	78.4 Å²	78.4	36%	0.357	40%	0.404	S	S	.	.			trans	-127.6	83.2	177.1	-70.2	164.5	171.6	-169.2	0	109.6	G285 Y289 R297 F298 R299	G285-K287 PolarHBondContact O-N 3.36Å; K287-Y289 VanDerWaalsContact C-N 3.26Å; K287-Y289 PolarHBondContact O-N 3.05Å; K287-R297 HydrophobicContact CB-CB 3.48Å; K287-R297 VanDerWaalsContact CB-CB 3.48Å; K287-R297 HydrophobicContact CD-CB 4.06Å; K287-R297 WeakPolarHBondContact CD-O 3.36Å; K287-R297 HydrophobicContact CG-CB 4.36Å; K287-R297 PolarHBondContact O-NE 3.43Å; K287-R297 PolarHBondContact O-NH2 2.89Å; K287-F298 CarbonylContact C-O 3.59Å; K287-F298 VanDerWaalsContact C-O 3.31Å; K287-F298 VanDerWaalsContact CA-O 3.3Å; K287-F298 WeakPolarHBondContact CA-O 3.29Å; K287-R299 HydrophobicContact CG-CG 3.77Å
288	P	89.9	Confident	91.1	Very high	64 Å²	64	78.2 Å²	78.2	42%	0.416	40%	0.395	S	S	.	.			trans	-67.9	-24.1	-173.9	-22.4	34.8	0	0	0	114
289	Y	92.4	Very high	91.1	Very high	76 Å²	76	80 Å²	80	30%	0.298	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	112.4	-172.1	-55.1	-76	0	0	0	110.3	K287 R297 F298 R299 R301	K287-Y289 VanDerWaalsContact C-N 3.26Å; K287-Y289 PolarHBondContact O-N 3.05Å; Y289-R297 CarbonylContact O-C 3.57Å; Y289-R297 WeakPolarHBondContact O-CA 3.48Å; Y289-F298 PolarHBondContact N-O 2.9Å; Y289-F298 VanDerWaalsContact N-O 3.15Å; Y289-F298 PolarHBondContact O-N 3.08Å; Y289-R299 WeakPolarHBondContact CE2-O 3.39Å; Y289-R301 HydrophobicContact CD1-CB 4.03Å; Y289-R301 HydrophobicContact CD1-CG 4.42Å; Y289-R301 VanDerWaalsContact CD2-N 3.35Å; Y289-R301 HydrophobicContact CE1-CB 3.77Å; Y289-R301 HydrophobicContact CE1-CG 4.33Å; Y289-R301 HydrophobicContact CE2-CB 4.27Å; Y289-R301 VanDerWaalsContact CE2-N 3.3Å; Y289-R301 HydrophobicContact CG-CB 4.4Å
290	T	93.7	Very high	91.1	Very high	55 Å²	55	83 Å²	83	34%	0.337	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	133.9	-178.1	-54	0	0	0	0	110.3	R297	T290-R297 HydrophobicContact CG2-CG 4.06Å
291	C	92.1	Very high	91.1	Very high	0 Å²	0	88 Å²	88	0%	0	43%	0.428	C	S	.	.			trans	-76	124.7	167.7	179.6	0	0	0	0	109.1	E293 C294 S295 R296 F298 L304 H311	C291-E293 VanDerWaalsContact C-N 3.31Å; C291-E293 PolarHBondContact O-N 3.44Å; C291-C294 VanDerWaalsContact SG-SG 3.67Å; C291-S295 WeakPolarHBondContact O-CA 3.45Å; C291-S295 PolarHBondContact O-N 3.27Å; C291-R296 PolarHBondContact N-O 3Å; C291-F298 HydrophobicContact CB-CE2 4.28Å; C291-L304 HydrophobicContact CB-CD1 3.63Å; C291-H311 PolarHBondContact SG-NE2 3.27Å
292	L	91.3	Very high	91	Very high	159 Å²	159	89.6 Å²	89.6	83%	0.832	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-24.8	-176.9	-60.6	179.1	0	0	0	113
293	E	89.1	Confident	91.1	Very high	126 Å²	126	88.1 Å²	88.1	59%	0.589	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-35.7	-175.8	-66.6	169.7	-133.6	0	0	113.5	C291 H311	C291-E293 VanDerWaalsContact C-N 3.31Å; C291-E293 PolarHBondContact O-N 3.44Å; E293-H311 WeakPolarHBondContact OE2-CB 3.18Å; E293-H311 IonicContact OE2-CD2 3.62Å; E293-H311 PolarHBondContact OE2-CD2 3.07Å; E293-H311 IonicContact OE2-CG 3.71Å; E293-H311 IonicContact OE2-ND1 3.92Å
294	C	92.1	Very high	91.2	Very high	48 Å²	48	85 Å²	85	32%	0.324	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	6.7	-179.8	73	0	0	0	0	114	C291 R296 H307	C291-C294 VanDerWaalsContact SG-SG 3.67Å; C294-R296 PolarHBondContact O-N 3.12Å; C294-R296 VanDerWaalsContact SG-CB 3.57Å; C294-H307 PolarHBondContact SG-NE2 3.38Å
295	S	90.6	Very high	91.3	Very high	91 Å²	91	83.8 Å²	83.8	64%	0.636	42%	0.417	S	S	*	.			trans	57.4	8.6	-178.4	-48.7	0	0	0	0	115.6	C291	C291-S295 WeakPolarHBondContact O-CA 3.45Å; C291-S295 PolarHBondContact O-N 3.27Å
296	R	91.5	Very high	91.4	Very high	165 Å²	165	84.8 Å²	84.8	62%	0.623	41%	0.414	S	S	*	.			trans	-66.6	135.6	176.7	-77.3	-176.3	161	-171.1	-2.9	111	C291 C294 F298	C291-R296 PolarHBondContact N-O 3Å; C294-R296 PolarHBondContact O-N 3.12Å; C294-R296 VanDerWaalsContact SG-CB 3.57Å; R296-F298 HydrophobicContact CB-CE2 3.93Å; R296-F298 HydrophobicContact CB-CZ 4.08Å; R296-F298 WeakPolarHBondContact O-CE2 3.43Å
297	R	93.6	Very high	91.5	Very high	144 Å²	144	80.1 Å²	80.1	54%	0.543	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	141.3	-177.6	-52.2	-179.5	63.1	175.7	1.8	112	K287 Y289 T290	K287-R297 HydrophobicContact CB-CB 3.48Å; K287-R297 VanDerWaalsContact CB-CB 3.48Å; K287-R297 HydrophobicContact CD-CB 4.06Å; K287-R297 WeakPolarHBondContact CD-O 3.36Å; K287-R297 HydrophobicContact CG-CB 4.36Å; K287-R297 PolarHBondContact O-NE 3.43Å; K287-R297 PolarHBondContact O-NH2 2.89Å; Y289-R297 CarbonylContact O-C 3.57Å; Y289-R297 WeakPolarHBondContact O-CA 3.48Å; T290-R297 HydrophobicContact CG2-CG 4.06Å
298	F	90.9	Very high	91.6	Very high	40 Å²	40	79.5 Å²	79.5	18%	0.175	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.7	-176.7	-59.5	-88.8	0	0	0	111.4	K287 Y289 C291 R296 A303 L304 H307	K287-F298 CarbonylContact C-O 3.59Å; K287-F298 VanDerWaalsContact C-O 3.31Å; K287-F298 VanDerWaalsContact CA-O 3.3Å; K287-F298 WeakPolarHBondContact CA-O 3.29Å; Y289-F298 PolarHBondContact N-O 2.9Å; Y289-F298 VanDerWaalsContact N-O 3.15Å; Y289-F298 PolarHBondContact O-N 3.08Å; C291-F298 HydrophobicContact CB-CE2 4.28Å; R296-F298 HydrophobicContact CB-CE2 3.93Å; R296-F298 HydrophobicContact CB-CZ 4.08Å; R296-F298 WeakPolarHBondContact O-CE2 3.43Å; F298-A303 HydrophobicContact CB-CB 4.28Å; F298-A303 HydrophobicContact CD1-CB 3.92Å; F298-A303 HydrophobicContact CG-CB 4.4Å; F298-L304 HydrophobicContact CB-CB 4.27Å; F298-L304 HydrophobicContact CD2-CB 3.89Å; F298-L304 HydrophobicContact CD2-CD1 3.74Å; F298-L304 HydrophobicContact CD2-CG 4.42Å; F298-L304 HydrophobicContact CE2-CD1 3.9Å; F298-L304 HydrophobicContact CG-CB 4.19Å; F298-H307 HydrophobicContact CE1-CB 3.78Å; F298-H307 AromaticContact CE1-CG 4Å; F298-H307 HydrophobicContact CE2-CB 3.91Å; F298-H307 AromaticContact CE2-CD2 3.37Å; F298-H307 WeakPolarHBondContact CE2-CD2 3.26Å; F298-H307 AromaticContact CE2-CG 3.64Å; F298-H307 HydrophobicContact CZ-CB 3.36Å; F298-H307 AromaticContact CZ-CD2 3.35Å; F298-H307 WeakPolarHBondContact CZ-CD2 3.46Å; F298-H307 AromaticContact CZ-CG 3.13Å; F298-H307 AromaticContact CZ-ND1 3.68Å; F298-H307 AromaticContact CZ-NE2 3.95Å
299	R	90.6	Very high	91.7	Very high	91 Å²	91	78.8 Å²	78.8	34%	0.343	38%	0.379	S	S	.	.	S	Bend	trans	-76.7	-25.9	178.3	-59.9	-170	171.8	87.8	-3.6	113.1	R281 E286 K287 Y289	R281-R299 PolarHBondContact NH1-O 2.81Å; R281-R299 WeakPolarHBondContact O-CD 3.35Å; R281-R299 PolarHBondContact O-NE 2.85Å; E286-R299 WeakPolarHBondContact O-CG 3.36Å; K287-R299 HydrophobicContact CG-CG 3.77Å; Y289-R299 WeakPolarHBondContact CE2-O 3.39Å
300	Q	89.8	Confident	91.7	Very high	89 Å²	89	80.6 Å²	80.6	42%	0.416	39%	0.393	S	S	.	.	S	Bend	trans	-130.4	145.6	-176.4	-63	-177.1	16.5	0	0	111	I278 T302 A303 L304	I278-Q300 HydrophobicContact CG2-CG 3.75Å; Q300-T302 PolarHBondContact O-N 3.25Å; Q300-A303 HydrophobicContact CB-CB 4.49Å; Q300-A303 PolarHBondContact O-N 3.45Å; Q300-L304 PolarHBondContact O-N 2.89Å
301	R	92.1	Very high	91.5	Very high	178 Å²	178	81.3 Å²	81.3	67%	0.672	39%	0.392	S	S	*	.	H	α-helix	trans	-62.9	-40.4	178.9	-175	177.1	178.7	171.6	0.7	112.3	Y289 A303 L304 V305	Y289-R301 HydrophobicContact CD1-CB 4.03Å; Y289-R301 HydrophobicContact CD1-CG 4.42Å; Y289-R301 VanDerWaalsContact CD2-N 3.35Å; Y289-R301 HydrophobicContact CE1-CB 3.77Å; Y289-R301 HydrophobicContact CE1-CG 4.33Å; Y289-R301 HydrophobicContact CE2-CB 4.27Å; Y289-R301 VanDerWaalsContact CE2-N 3.3Å; Y289-R301 HydrophobicContact CG-CB 4.4Å; R301-A303 VanDerWaalsContact C-N 3.27Å; R301-A303 PolarHBondContact O-N 3.13Å; R301-L304 WeakPolarHBondContact O-CB 3.44Å; R301-L304 PolarHBondContact O-N 2.95Å; R301-L304 VanDerWaalsContact O-N 3.13Å; R301-V305 HydrophobicContact CG-CG2 4.47Å; R301-V305 WeakPolarHBondContact O-CG2 3.47Å; R301-V305 PolarHBondContact O-N 3.11Å
302	T	90.6	Very high	91.4	Very high	88 Å²	88	85.1 Å²	85.1	54%	0.54	42%	0.416	S	S	.	.	H	α-helix	trans	-58.7	-39.9	178	48.4	0	0	0	0	111.9	Q300 V305 I306	Q300-T302 PolarHBondContact O-N 3.25Å; T302-V305 PolarHBondContact O-N 3.05Å; T302-I306 VanDerWaalsContact O-CG1 3.3Å; T302-I306 WeakPolarHBondContact O-CG1 3.3Å; T302-I306 PolarHBondContact O-N 3.31Å
303	A	92.5	Very high	91.4	Very high	39 Å²	39	79.9 Å²	79.9	32%	0.322	40%	0.401	S	S	.	.	H	α-helix	trans	-66.3	-39	176	0	0	0	0	0	112.3	F298 Q300 R301 H307	F298-A303 HydrophobicContact CB-CB 4.28Å; F298-A303 HydrophobicContact CD1-CB 3.92Å; F298-A303 HydrophobicContact CG-CB 4.4Å; Q300-A303 HydrophobicContact CB-CB 4.49Å; Q300-A303 PolarHBondContact O-N 3.45Å; R301-A303 VanDerWaalsContact C-N 3.27Å; R301-A303 PolarHBondContact O-N 3.13Å; A303-H307 VanDerWaalsContact O-CB 3.29Å; A303-H307 WeakPolarHBondContact O-CB 3.35Å; A303-H307 PolarHBondContact O-N 3.34Å
304	L	92.5	Very high	91.4	Very high	18 Å²	18	79.3 Å²	79.3	9%	0.094	40%	0.398	C	S	.	.	H	α-helix	trans	-62.2	-47.8	172.9	171.6	62.7	0	0	0	111.4	C291 F298 Q300 R301 I306 H307 Q308	C291-L304 HydrophobicContact CB-CD1 3.63Å; F298-L304 HydrophobicContact CB-CB 4.27Å; F298-L304 HydrophobicContact CD2-CB 3.89Å; F298-L304 HydrophobicContact CD2-CD1 3.74Å; F298-L304 HydrophobicContact CD2-CG 4.42Å; F298-L304 HydrophobicContact CE2-CD1 3.9Å; F298-L304 HydrophobicContact CG-CB 4.19Å; Q300-L304 PolarHBondContact O-N 2.89Å; R301-L304 WeakPolarHBondContact O-CB 3.44Å; R301-L304 PolarHBondContact O-N 2.95Å; R301-L304 VanDerWaalsContact O-N 3.13Å; L304-I306 VanDerWaalsContact C-N 3.35Å; L304-I306 PolarHBondContact O-N 3.06Å; L304-H307 CarbonylContact O-C 3.51Å; L304-H307 WeakPolarHBondContact O-CA 3.43Å; L304-H307 WeakPolarHBondContact O-CB 3.41Å; L304-H307 PolarHBondContact O-N 3.15Å; L304-Q308 HydrophobicContact CD1-CG 4.01Å; L304-Q308 HydrophobicContact CG-CG 4.39Å; L304-Q308 WeakPolarHBondContact O-CG 3.45Å; L304-Q308 PolarHBondContact O-N 3.36Å
305	V	92.2	Very high	91.5	Very high	59 Å²	59	82.4 Å²	82.4	36%	0.358	41%	0.406	S	S	.	.	H	α-helix	trans	-60.8	-44.5	-179.7	172.6	0	0	0	0	111.1	R301 T302 H307 Q308 R309	R301-V305 HydrophobicContact CG-CG2 4.47Å; R301-V305 WeakPolarHBondContact O-CG2 3.47Å; R301-V305 PolarHBondContact O-N 3.11Å; T302-V305 PolarHBondContact O-N 3.05Å; V305-H307 PolarHBondContact O-N 3.13Å; V305-Q308 PolarHBondContact O-N 3.04Å; V305-R309 PolarHBondContact O-N 3.39Å
306	I	91.5	Very high	91.5	Very high	57 Å²	57	80.6 Å²	80.6	29%	0.292	39%	0.392	S	S	.	.	H	α-helix	trans	-64.1	-34.3	175.6	-66.1	165.5	0	0	0	111	T302 L304 R309	T302-I306 VanDerWaalsContact O-CG1 3.3Å; T302-I306 WeakPolarHBondContact O-CG1 3.3Å; T302-I306 PolarHBondContact O-N 3.31Å; L304-I306 VanDerWaalsContact C-N 3.35Å; L304-I306 PolarHBondContact O-N 3.06Å; I306-R309 WeakPolarHBondContact O-CB 3.43Å
307	H	92.2	Very high	91.6	Very high	14 Å²	14	76.5 Å²	76.5	7%	0.065	38%	0.377	C	S	.	.	H	α-helix	trans	-69.9	-41.6	176.8	168.6	68.8	0	0	0	112.8	C294 F298 A303 L304 V305 R309 I310 H311	C294-H307 PolarHBondContact SG-NE2 3.38Å; F298-H307 HydrophobicContact CE1-CB 3.78Å; F298-H307 AromaticContact CE1-CG 4Å; F298-H307 HydrophobicContact CE2-CB 3.91Å; F298-H307 AromaticContact CE2-CD2 3.37Å; F298-H307 WeakPolarHBondContact CE2-CD2 3.26Å; F298-H307 AromaticContact CE2-CG 3.64Å; F298-H307 HydrophobicContact CZ-CB 3.36Å; F298-H307 AromaticContact CZ-CD2 3.35Å; F298-H307 WeakPolarHBondContact CZ-CD2 3.46Å; F298-H307 AromaticContact CZ-CG 3.13Å; F298-H307 AromaticContact CZ-ND1 3.68Å; F298-H307 AromaticContact CZ-NE2 3.95Å; A303-H307 VanDerWaalsContact O-CB 3.29Å; A303-H307 WeakPolarHBondContact O-CB 3.35Å; A303-H307 PolarHBondContact O-N 3.34Å; L304-H307 CarbonylContact O-C 3.51Å; L304-H307 WeakPolarHBondContact O-CA 3.43Å; L304-H307 WeakPolarHBondContact O-CB 3.41Å; L304-H307 PolarHBondContact O-N 3.15Å; V305-H307 PolarHBondContact O-N 3.13Å; H307-R309 PolarHBondContact O-N 3.32Å; H307-R309 VanDerWaalsContact O-N 3.13Å; H307-I310 VanDerWaalsContact O-CB 3.22Å; H307-I310 WeakPolarHBondContact O-CB 3.22Å; H307-I310 WeakPolarHBondContact O-CG1 3.35Å; H307-I310 PolarHBondContact O-N 2.84Å; H307-H311 AromaticContact NE2-NE2 3.45Å; H307-H311 PolarHBondContact NE2-NE2 2.81Å
308	Q	92.3	Very high	91.7	Very high	69 Å²	69	73 Å²	73	32%	0.322	37%	0.373	S	S	.	.	H	α-helix	trans	-57.8	-28.2	178.4	-75	173.2	-52.7	0	0	112.4	L304 V305 I310 H311 T312	L304-Q308 HydrophobicContact CD1-CG 4.01Å; L304-Q308 HydrophobicContact CG-CG 4.39Å; L304-Q308 WeakPolarHBondContact O-CG 3.45Å; L304-Q308 PolarHBondContact O-N 3.36Å; V305-Q308 PolarHBondContact O-N 3.04Å; Q308-I310 PolarHBondContact O-N 3.39Å; Q308-I310 VanDerWaalsContact O-N 3.11Å; Q308-H311 PolarHBondContact O-N 2.96Å; Q308-T312 PolarHBondContact O-N 2.97Å; Q308-T312 VanDerWaalsContact O-N 3.16Å
309	R	92.6	Very high	91.8	Very high	48 Å²	48	71.6 Å²	71.6	18%	0.181	37%	0.368	C	S	.	.	H	α-helix	trans	-60.8	-17.9	172.8	-65	176.3	-178	-176.7	-5.5	114.6	V305 I306 H307 H311 T312 G313 E314 Y317 S327	V305-R309 PolarHBondContact O-N 3.39Å; I306-R309 WeakPolarHBondContact O-CB 3.43Å; H307-R309 PolarHBondContact O-N 3.32Å; H307-R309 VanDerWaalsContact O-N 3.13Å; R309-H311 VanDerWaalsContact C-N 3.32Å; R309-T312 WeakPolarHBondContact CA-OG1 3.32Å; R309-G313 CarbonylContact O-C 3.54Å; R309-G313 WeakPolarHBondContact O-CA 3.42Å; R309-G313 PolarHBondContact O-N 3.42Å; R309-E314 HydrophobicContact CB-CB 4.45Å; R309-E314 WeakPolarHBondContact CB-O 3.45Å; R309-E314 HydrophobicContact CG-CB 4.28Å; R309-E314 PolarHBondContact O-N 3.01Å; R309-Y317 VanDerWaalsContact NH1-CE2 3.33Å; R309-S327 WeakPolarHBondContact CD-O 3.21Å; R309-S327 PolarHBondContact NH1-O 2.76Å
310	I	91.5	Very high	91.9	Very high	114 Å²	114	72 Å²	72	59%	0.585	38%	0.383	S	S	*	.	H	α-helix	trans	-70.1	-35.9	173.4	-61.2	175.6	0	0	0	110.1	H307 Q308	H307-I310 VanDerWaalsContact O-CB 3.22Å; H307-I310 WeakPolarHBondContact O-CB 3.22Å; H307-I310 WeakPolarHBondContact O-CG1 3.35Å; H307-I310 PolarHBondContact O-N 2.84Å; Q308-I310 PolarHBondContact O-N 3.39Å; Q308-I310 VanDerWaalsContact O-N 3.11Å
311	H	90.6	Very high	91.9	Very high	70 Å²	70	72 Å²	72	32%	0.324	39%	0.385	S	S	.	.	H	α-helix	trans	-82.6	-40.1	-179.4	-52.4	-51.2	0	0	0	112.3	C291 E293 H307 Q308 R309 G313	C291-H311 PolarHBondContact SG-NE2 3.27Å; E293-H311 WeakPolarHBondContact OE2-CB 3.18Å; E293-H311 IonicContact OE2-CD2 3.62Å; E293-H311 PolarHBondContact OE2-CD2 3.07Å; E293-H311 IonicContact OE2-CG 3.71Å; E293-H311 IonicContact OE2-ND1 3.92Å; H307-H311 AromaticContact NE2-NE2 3.45Å; H307-H311 PolarHBondContact NE2-NE2 2.81Å; Q308-H311 PolarHBondContact O-N 2.96Å; R309-H311 VanDerWaalsContact C-N 3.32Å; H311-G313 PolarHBondContact O-N 3.49Å
312	T	90.4	Very high	92	Very high	80 Å²	80	65.4 Å²	65.4	49%	0.491	37%	0.366	S	S	.	.	H	α-helix	trans	-75.2	-14.9	175.9	65.5	0	0	0	0	112.9	Q308 R309 E314	Q308-T312 PolarHBondContact O-N 2.97Å; Q308-T312 VanDerWaalsContact O-N 3.16Å; R309-T312 WeakPolarHBondContact CA-OG1 3.32Å; T312-E314 PolarHBondContact O-N 3.36Å; T312-E314 WeakPolarHBondContact OG1-CB 3.4Å; T312-E314 WeakPolarHBondContact OG1-CG 3.29Å; T312-E314 PolarHBondContact OG1-N 3.5Å
313	G	89.5	Confident	92	Very high	50 Å²	50	70.6 Å²	70.6	52%	0.515	38%	0.384	S	S	.	.			trans	71.3	2.1	-173.4	0	0	0	0	0	114.3	R309 H311 K315	R309-G313 CarbonylContact O-C 3.54Å; R309-G313 WeakPolarHBondContact O-CA 3.42Å; R309-G313 PolarHBondContact O-N 3.42Å; H311-G313 PolarHBondContact O-N 3.49Å; G313-K315 PolarHBondContact O-N 2.97Å
314	E	90.8	Very high	92	Very high	114 Å²	114	76.2 Å²	76.2	53%	0.533	40%	0.397	S	S	.	.			trans	-63.1	127.5	-176.5	-75.5	-177.5	173.3	0	0	112.4	R309 T312	R309-E314 HydrophobicContact CB-CB 4.45Å; R309-E314 WeakPolarHBondContact CB-O 3.45Å; R309-E314 HydrophobicContact CG-CB 4.28Å; R309-E314 PolarHBondContact O-N 3.01Å; T312-E314 PolarHBondContact O-N 3.36Å; T312-E314 WeakPolarHBondContact OG1-CB 3.4Å; T312-E314 WeakPolarHBondContact OG1-CG 3.29Å; T312-E314 PolarHBondContact OG1-N 3.5Å
315	K	92.3	Very high	92	Very high	112 Å²	112	82.1 Å²	82.1	49%	0.487	42%	0.418	S	S	.	.			trans	-128.1	80.4	176	-69.9	165.2	171.6	-174.5	0	110	G313 Y317 R325 F326	G313-K315 PolarHBondContact O-N 2.97Å; K315-Y317 PolarHBondContact O-N 3.31Å; K315-Y317 VanDerWaalsContact O-N 3.16Å; K315-R325 HydrophobicContact CB-CB 3.43Å; K315-R325 VanDerWaalsContact CB-CB 3.43Å; K315-R325 HydrophobicContact CD-CB 4.19Å; K315-R325 WeakPolarHBondContact CD-O 3.44Å; K315-R325 HydrophobicContact CG-CB 4.39Å; K315-R325 PolarHBondContact O-NE 3.48Å; K315-R325 PolarHBondContact O-NH2 2.77Å; K315-F326 CarbonylContact C-O 3.53Å; K315-F326 WeakPolarHBondContact CA-O 3.38Å
316	P	91.5	Very high	92	Very high	53 Å²	53	80.6 Å²	80.6	34%	0.344	41%	0.406	S	S	.	.			trans	-67.7	-15.2	-172.2	-23.6	36.3	0	0	0	114.6	P318	P316-P318 WeakPolarHBondContact O-CD 3.24Å
317	Y	94.4	Very high	92.1	Very high	79 Å²	79	79 Å²	79	31%	0.31	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	89.3	-173.5	-55.3	-75.5	0	0	0	110.6	R309 K315 R325 F326 S328 S329	R309-Y317 VanDerWaalsContact NH1-CE2 3.33Å; K315-Y317 PolarHBondContact O-N 3.31Å; K315-Y317 VanDerWaalsContact O-N 3.16Å; Y317-R325 CarbonylContact O-C 3.51Å; Y317-R325 WeakPolarHBondContact O-CA 3.4Å; Y317-F326 WeakPolarHBondContact CD2-O 3.46Å; Y317-F326 PolarHBondContact N-O 3.43Å; Y317-F326 PolarHBondContact O-N 3.39Å; Y317-S328 VanDerWaalsContact CE2-CA 3.5Å; Y317-S329 VanDerWaalsContact CD2-N 3.34Å; Y317-S329 VanDerWaalsContact CE2-N 3.28Å
318	P	94.3	Very high	92.1	Very high	72 Å²	72	78.7 Å²	78.7	47%	0.468	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	147	172.6	30.8	-34.9	0	0	0	111.3	P316 R325 L332	P316-P318 WeakPolarHBondContact O-CD 3.24Å; P318-R325 HydrophobicContact CB-CG 4.16Å; P318-L332 WeakPolarHBondContact O-CD2 3.29Å
319	C	94.2	Very high	92.1	Very high	9 Å²	9	78.1 Å²	78.1	6%	0.061	40%	0.403	C	S	.	.			trans	-78.2	134.4	163.3	-163.3	0	0	0	0	108.9	D321 R324 F326 L332	C319-D321 VanDerWaalsContact C-N 3.29Å; C319-R324 WeakPolarHBondContact CB-O 3.41Å; C319-R324 PolarHBondContact N-O 2.88Å; C319-F326 HydrophobicContact CB-CE2 4.41Å; C319-L332 HydrophobicContact CB-CD1 3.91Å
320	P	91.6	Very high	92.1	Very high	101 Å²	101	80.1 Å²	80.1	66%	0.656	43%	0.425	S	S	*	.	S	Bend	trans	-71.4	-27.8	173.5	28	-32.8	0	0	0	112.1
321	D	91	Very high	92.1	Very high	89 Å²	89	81 Å²	81	48%	0.476	42%	0.421	S	S	.	.	S	Bend	trans	-92.9	-6.4	-172.7	-47.4	-63.5	0	0	0	113.3	C319 H339	C319-D321 VanDerWaalsContact C-N 3.29Å; D321-H339 HydrophobicContact CB-CB 4.14Å; D321-H339 IonicContact OD2-CD2 3.56Å
322	C	92.6	Very high	92.2	Very high	39 Å²	39	79 Å²	79	26%	0.264	41%	0.412	S	S	.	.	S	Bend	trans	-159.6	166.7	173.6	69.6	0	0	0	0	112.5	R324 H335 H339	C322-R324 PolarHBondContact O-N 3.17Å; C322-H335 PolarHBondContact SG-NE2 3.13Å; C322-H339 PolarHBondContact SG-NE2 3.02Å; C322-H339 VanDerWaalsContact SG-NE2 3.35Å
323	E	90.8	Very high	92.3	Very high	197 Å²	197	79.3 Å²	79.3	92%	0.921	41%	0.414	S	S	*	.	S	Bend	trans	-69.1	-0.1	-178.8	-60.2	178.3	-169.2	0	0	114.7	R325	E323-R325 PolarHBondContact O-N 3.16Å
324	R	92.5	Very high	92.4	Very high	157 Å²	157	78.5 Å²	78.5	59%	0.592	40%	0.401	S	S	*	.			trans	-74.8	131.9	-177.8	-62.6	-173.1	72.2	162.7	4.6	111.1	C319 C322 F326	C319-R324 WeakPolarHBondContact CB-O 3.41Å; C319-R324 PolarHBondContact N-O 2.88Å; C322-R324 PolarHBondContact O-N 3.17Å; R324-F326 HydrophobicContact CB-CE2 3.98Å; R324-F326 HydrophobicContact CB-CZ 4.02Å
325	R	93.8	Very high	92.5	Very high	141 Å²	141	74 Å²	74	53%	0.532	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	147.4	174.2	-52	179.2	66.9	159.5	5.6	111.2	K315 Y317 P318 E323	K315-R325 HydrophobicContact CB-CB 3.43Å; K315-R325 VanDerWaalsContact CB-CB 3.43Å; K315-R325 HydrophobicContact CD-CB 4.19Å; K315-R325 WeakPolarHBondContact CD-O 3.44Å; K315-R325 HydrophobicContact CG-CB 4.39Å; K315-R325 PolarHBondContact O-NE 3.48Å; K315-R325 PolarHBondContact O-NH2 2.77Å; Y317-R325 CarbonylContact O-C 3.51Å; Y317-R325 WeakPolarHBondContact O-CA 3.4Å; P318-R325 HydrophobicContact CB-CG 4.16Å; E323-R325 PolarHBondContact O-N 3.16Å
326	F	92.4	Very high	92.5	Very high	27 Å²	27	74.7 Å²	74.7	12%	0.118	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	149.6	-176.3	-60	-88.7	0	0	0	112.3	K315 Y317 C319 R324 S328 R331 L332 H335	K315-F326 CarbonylContact C-O 3.53Å; K315-F326 WeakPolarHBondContact CA-O 3.38Å; Y317-F326 WeakPolarHBondContact CD2-O 3.46Å; Y317-F326 PolarHBondContact N-O 3.43Å; Y317-F326 PolarHBondContact O-N 3.39Å; C319-F326 HydrophobicContact CB-CE2 4.41Å; R324-F326 HydrophobicContact CB-CE2 3.98Å; R324-F326 HydrophobicContact CB-CZ 4.02Å; F326-S328 VanDerWaalsContact C-N 3.33Å; F326-R331 HydrophobicContact CB-CB 4.28Å; F326-R331 HydrophobicContact CD1-CB 3.94Å; F326-R331 HydrophobicContact CG-CB 4.37Å; F326-L332 HydrophobicContact CB-CB 4.28Å; F326-L332 HydrophobicContact CD2-CB 3.96Å; F326-L332 HydrophobicContact CD2-CD1 3.79Å; F326-L332 HydrophobicContact CD2-CG 4.48Å; F326-L332 HydrophobicContact CE2-CD1 4.03Å; F326-L332 HydrophobicContact CG-CB 4.26Å; F326-H335 HydrophobicContact CE1-CB 3.87Å; F326-H335 AromaticContact CE1-CG 4Å; F326-H335 HydrophobicContact CE2-CB 3.89Å; F326-H335 AromaticContact CE2-CD2 3.19Å; F326-H335 WeakPolarHBondContact CE2-CD2 3.44Å; F326-H335 AromaticContact CE2-CG 3.59Å; F326-H335 AromaticContact CE2-NE2 3.86Å; F326-H335 HydrophobicContact CZ-CB 3.43Å; F326-H335 VanDerWaalsContact CZ-CB 3.43Å; F326-H335 AromaticContact CZ-CD2 3.21Å; F326-H335 WeakPolarHBondContact CZ-CD2 3.43Å; F326-H335 AromaticContact CZ-CG 3.13Å; F326-H335 AromaticContact CZ-ND1 3.69Å; F326-H335 AromaticContact CZ-NE2 3.73Å
327	S	92	Very high	92.5	Very high	24 Å²	24	74.8 Å²	74.8	17%	0.168	37%	0.373	C	S	.	.	S	Bend	trans	-80.8	-10.4	178	57.9	0	0	0	0	113.8	R309	R309-S327 WeakPolarHBondContact CD-O 3.21Å; R309-S327 PolarHBondContact NH1-O 2.76Å
328	S	92.5	Very high	92.3	Very high	7 Å²	7	75.8 Å²	75.8	5%	0.049	39%	0.387	C	S	.	.	S	Bend	trans	-147.1	140.7	-179.6	59.2	0	0	0	0	111.1	Y317 F326 S330 R331 L332	Y317-S328 VanDerWaalsContact CE2-CA 3.5Å; F326-S328 VanDerWaalsContact C-N 3.33Å; S328-S330 VanDerWaalsContact C-N 3.32Å; S328-S330 PolarHBondContact O-N 2.9Å; S328-R331 WeakPolarHBondContact O-CB 3.45Å; S328-R331 PolarHBondContact O-N 2.99Å; S328-R331 VanDerWaalsContact O-N 3.11Å; S328-R331 WeakPolarHBondContact OG-CB 3.5Å; S328-R331 WeakPolarHBondContact OG-CD 3.35Å; S328-R331 WeakPolarHBondContact OG-CG 3.36Å; S328-R331 PolarHBondContact OG-NH1 3.3Å; S328-L332 PolarHBondContact O-N 3.46Å
329	S	93.4	Very high	92.1	Very high	57 Å²	57	76.1 Å²	76.1	40%	0.399	38%	0.382	S	S	.	.	H	α-helix	trans	-58.2	-40	179.4	55.6	0	0	0	0	113	Y317 R331 L332 V333	Y317-S329 VanDerWaalsContact CD2-N 3.34Å; Y317-S329 VanDerWaalsContact CE2-N 3.28Å; S329-R331 VanDerWaalsContact C-N 3.26Å; S329-R331 PolarHBondContact O-N 3.25Å; S329-L332 WeakPolarHBondContact O-CB 3.36Å; S329-L332 PolarHBondContact O-N 2.87Å; S329-V333 WeakPolarHBondContact O-CG2 3.44Å; S329-V333 PolarHBondContact O-N 3.1Å
330	S	91.5	Very high	92	Very high	91 Å²	91	78.8 Å²	78.8	64%	0.636	40%	0.401	S	S	*	.	H	α-helix	trans	-59.9	-35.7	178	-47.3	0	0	0	0	112.8	S328 S334	S328-S330 VanDerWaalsContact C-N 3.32Å; S328-S330 PolarHBondContact O-N 2.9Å; S330-S334 PolarHBondContact O-N 3.49Å; S330-S334 PolarHBondContact O-OG 3.26Å
331	R	92	Very high	91.8	Very high	133 Å²	133	76.4 Å²	76.4	50%	0.502	40%	0.395	S	S	.	.	H	α-helix	trans	-69.2	-40.8	174.7	-74.4	179	179.6	95.3	-4.5	111.4	F326 S328 S329 S334 H335	F326-R331 HydrophobicContact CB-CB 4.28Å; F326-R331 HydrophobicContact CD1-CB 3.94Å; F326-R331 HydrophobicContact CG-CB 4.37Å; S328-R331 WeakPolarHBondContact O-CB 3.45Å; S328-R331 PolarHBondContact O-N 2.99Å; S328-R331 VanDerWaalsContact O-N 3.11Å; S328-R331 WeakPolarHBondContact OG-CB 3.5Å; S328-R331 WeakPolarHBondContact OG-CD 3.35Å; S328-R331 WeakPolarHBondContact OG-CG 3.36Å; S328-R331 PolarHBondContact OG-NH1 3.3Å; S329-R331 VanDerWaalsContact C-N 3.26Å; S329-R331 PolarHBondContact O-N 3.25Å; R331-S334 WeakPolarHBondContact CA-OG 3.49Å; R331-S334 PolarHBondContact O-N 3.08Å; R331-S334 PolarHBondContact O-OG 2.97Å; R331-H335 WeakPolarHBondContact O-CB 2.83Å; R331-H335 PolarHBondContact O-N 3.47Å
332	L	93.3	Very high	91.8	Very high	27 Å²	27	77.4 Å²	77.4	14%	0.141	40%	0.396	C	S	.	.	H	α-helix	trans	-59.9	-48.7	173.7	171.9	62.1	0	0	0	111	P318 C319 F326 S328 S329 S334 H335 R336	P318-L332 WeakPolarHBondContact O-CD2 3.29Å; C319-L332 HydrophobicContact CB-CD1 3.91Å; F326-L332 HydrophobicContact CB-CB 4.28Å; F326-L332 HydrophobicContact CD2-CB 3.96Å; F326-L332 HydrophobicContact CD2-CD1 3.79Å; F326-L332 HydrophobicContact CD2-CG 4.48Å; F326-L332 HydrophobicContact CE2-CD1 4.03Å; F326-L332 HydrophobicContact CG-CB 4.26Å; S328-L332 PolarHBondContact O-N 3.46Å; S329-L332 WeakPolarHBondContact O-CB 3.36Å; S329-L332 PolarHBondContact O-N 2.87Å; L332-S334 VanDerWaalsContact C-N 3.31Å; L332-S334 PolarHBondContact O-N 3.17Å; L332-H335 CarbonylContact O-C 3.58Å; L332-H335 WeakPolarHBondContact O-CA 3.4Å; L332-H335 WeakPolarHBondContact O-CB 3.27Å; L332-H335 PolarHBondContact O-N 2.95Å; L332-R336 HydrophobicContact CD1-CG 4.1Å; L332-R336 HydrophobicContact CG-CG 4.48Å; L332-R336 WeakPolarHBondContact O-CG 3.36Å; L332-R336 PolarHBondContact O-N 3.09Å
333	V	92.8	Very high	91.7	Very high	87 Å²	87	82 Å²	82	53%	0.527	41%	0.408	S	S	.	.	H	α-helix	trans	-57.5	-44.7	177.7	173.6	0	0	0	0	111.2	S329 H335 R336	S329-V333 WeakPolarHBondContact O-CG2 3.44Å; S329-V333 PolarHBondContact O-N 3.1Å; V333-H335 VanDerWaalsContact C-N 3.26Å; V333-H335 PolarHBondContact O-N 3.13Å; V333-R336 PolarHBondContact O-N 3.27Å
334	S	91.1	Very high	91.7	Very high	33 Å²	33	75.7 Å²	75.7	23%	0.231	38%	0.384	C	S	.	.	H	α-helix	trans	-65.3	-30.9	176.1	70.2	0	0	0	0	113.2	S330 R331 L332	S330-S334 PolarHBondContact O-N 3.49Å; S330-S334 PolarHBondContact O-OG 3.26Å; R331-S334 WeakPolarHBondContact CA-OG 3.49Å; R331-S334 PolarHBondContact O-N 3.08Å; R331-S334 PolarHBondContact O-OG 2.97Å; L332-S334 VanDerWaalsContact C-N 3.31Å; L332-S334 PolarHBondContact O-N 3.17Å
335	H	92.7	Very high	91.8	Very high	19 Å²	19	71.6 Å²	71.6	9%	0.088	37%	0.369	C	S	.	.	H	α-helix	trans	-75.6	-37.4	179	170	63.9	0	0	0	112.3	C322 F326 R331 L332 V333 R337 V338 H339	C322-H335 PolarHBondContact SG-NE2 3.13Å; F326-H335 HydrophobicContact CE1-CB 3.87Å; F326-H335 AromaticContact CE1-CG 4Å; F326-H335 HydrophobicContact CE2-CB 3.89Å; F326-H335 AromaticContact CE2-CD2 3.19Å; F326-H335 WeakPolarHBondContact CE2-CD2 3.44Å; F326-H335 AromaticContact CE2-CG 3.59Å; F326-H335 AromaticContact CE2-NE2 3.86Å; F326-H335 HydrophobicContact CZ-CB 3.43Å; F326-H335 VanDerWaalsContact CZ-CB 3.43Å; F326-H335 AromaticContact CZ-CD2 3.21Å; F326-H335 WeakPolarHBondContact CZ-CD2 3.43Å; F326-H335 AromaticContact CZ-CG 3.13Å; F326-H335 AromaticContact CZ-ND1 3.69Å; F326-H335 AromaticContact CZ-NE2 3.73Å; R331-H335 WeakPolarHBondContact O-CB 2.83Å; R331-H335 PolarHBondContact O-N 3.47Å; L332-H335 CarbonylContact O-C 3.58Å; L332-H335 WeakPolarHBondContact O-CA 3.4Å; L332-H335 WeakPolarHBondContact O-CB 3.27Å; L332-H335 PolarHBondContact O-N 2.95Å; V333-H335 VanDerWaalsContact C-N 3.26Å; V333-H335 PolarHBondContact O-N 3.13Å; H335-R337 PolarHBondContact O-N 3.41Å; H335-V338 WeakPolarHBondContact O-CB 3.42Å; H335-V338 WeakPolarHBondContact O-CG2 3.45Å; H335-V338 PolarHBondContact O-N 2.85Å; H335-H339 AromaticContact CE1-NE2 3.84Å; H335-H339 AromaticContact NE2-NE2 3.41Å; H335-H339 PolarHBondContact NE2-NE2 2.91Å
336	R	92.4	Very high	91.7	Very high	126 Å²	126	66.8 Å²	66.8	48%	0.475	36%	0.359	S	S	.	.	H	α-helix	trans	-56.2	-25.6	177.6	-73.1	-172.9	68.7	-128.5	-2.3	113.3	L332 V333 V338 H339 S340	L332-R336 HydrophobicContact CD1-CG 4.1Å; L332-R336 HydrophobicContact CG-CG 4.48Å; L332-R336 WeakPolarHBondContact O-CG 3.36Å; L332-R336 PolarHBondContact O-N 3.09Å; V333-R336 PolarHBondContact O-N 3.27Å; R336-V338 PolarHBondContact O-N 3.04Å; R336-H339 WeakPolarHBondContact O-CB 3.36Å; R336-H339 PolarHBondContact O-N 3.21Å; R336-S340 PolarHBondContact O-N 3.16Å
337	R	92.2	Very high	91.7	Very high	56 Å²	56	65.9 Å²	65.9	21%	0.211	36%	0.356	C	S	.	.	H	α-helix	trans	-62.1	-20.5	172.2	-60.7	180	-177.5	179.6	-3.4	114.1	H335 H339 G341 E342 Y345 S355	H335-R337 PolarHBondContact O-N 3.41Å; R337-H339 VanDerWaalsContact C-N 3.32Å; R337-G341 WeakPolarHBondContact O-CA 3.07Å; R337-G341 PolarHBondContact O-N 3.49Å; R337-E342 HydrophobicContact CB-CB 4.48Å; R337-E342 HydrophobicContact CG-CB 4.38Å; R337-E342 PolarHBondContact O-N 3.5Å; R337-Y345 VanDerWaalsContact NH1-CE2 3.27Å; R337-S355 WeakPolarHBondContact CD-O 3.43Å; R337-S355 PolarHBondContact NH1-O 3.01Å
338	V	89.8	Confident	91.6	Very high	100 Å²	100	72.7 Å²	72.7	61%	0.606	39%	0.385	S	S	*	.	H	α-helix	trans	-69.3	-35.4	172.1	179.4	0	0	0	0	110.4	H335 R336	H335-V338 WeakPolarHBondContact O-CB 3.42Å; H335-V338 WeakPolarHBondContact O-CG2 3.45Å; H335-V338 PolarHBondContact O-N 2.85Å; R336-V338 PolarHBondContact O-N 3.04Å
339	H	90.4	Very high	91.3	Very high	78 Å²	78	78.9 Å²	78.9	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-81.5	-44.5	177.9	-62.7	-69.2	0	0	0	111.9	D321 C322 H335 R336 R337 G341	D321-H339 HydrophobicContact CB-CB 4.14Å; D321-H339 IonicContact OD2-CD2 3.56Å; C322-H339 PolarHBondContact SG-NE2 3.02Å; C322-H339 VanDerWaalsContact SG-NE2 3.35Å; H335-H339 AromaticContact CE1-NE2 3.84Å; H335-H339 AromaticContact NE2-NE2 3.41Å; H335-H339 PolarHBondContact NE2-NE2 2.91Å; R336-H339 WeakPolarHBondContact O-CB 3.36Å; R336-H339 PolarHBondContact O-N 3.21Å; R337-H339 VanDerWaalsContact C-N 3.32Å; H339-G341 PolarHBondContact O-N 3.18Å
340	S	90.5	Very high	91.1	Very high	66 Å²	66	78.4 Å²	78.4	46%	0.462	41%	0.409	S	S	.	.	H	α-helix	trans	-75.1	-11.5	178.8	67.2	0	0	0	0	113.9	R336 E342	R336-S340 PolarHBondContact O-N 3.16Å; S340-E342 PolarHBondContact O-N 3.29Å; S340-E342 VanDerWaalsContact O-N 3.14Å; S340-E342 WeakPolarHBondContact OG-CB 3.22Å; S340-E342 VanDerWaalsContact OG-CD 3.31Å; S340-E342 WeakPolarHBondContact OG-CG 3.21Å; S340-E342 PolarHBondContact OG-OE1 3.31Å
341	G	87.9	Confident	91	Very high	51 Å²	51	83.3 Å²	83.3	53%	0.526	42%	0.422	S	S	.	.			trans	68.6	4.3	-174.8	0	0	0	0	0	114.1	R337 H339 R343	R337-G341 WeakPolarHBondContact O-CA 3.07Å; R337-G341 PolarHBondContact O-N 3.49Å; H339-G341 PolarHBondContact O-N 3.18Å; G341-R343 PolarHBondContact O-N 2.93Å
342	E	90.5	Very high	90.9	Very high	109 Å²	109	78.4 Å²	78.4	51%	0.509	41%	0.41	S	S	.	.			trans	-61.5	125.5	-177.8	-78.8	169.9	-132.6	0	0	112.1	R337 S340 P344	R337-E342 HydrophobicContact CB-CB 4.48Å; R337-E342 HydrophobicContact CG-CB 4.38Å; R337-E342 PolarHBondContact O-N 3.5Å; S340-E342 PolarHBondContact O-N 3.29Å; S340-E342 VanDerWaalsContact O-N 3.14Å; S340-E342 WeakPolarHBondContact OG-CB 3.22Å; S340-E342 VanDerWaalsContact OG-CD 3.31Å; S340-E342 WeakPolarHBondContact OG-CG 3.21Å; S340-E342 PolarHBondContact OG-OE1 3.31Å; E342-P344 WeakPolarHBondContact O-CD 3.1Å
343	R	91.8	Very high	90.8	Very high	136 Å²	136	83.8 Å²	83.8	51%	0.513	43%	0.429	S	S	.	.			trans	-124.5	75.9	175.7	-64	170	84.8	135.6	-1.5	109.9	G341 Y345 R353 F354	G341-R343 PolarHBondContact O-N 2.93Å; R343-Y345 PolarHBondContact O-N 3.45Å; R343-R353 HydrophobicContact CB-CB 3.63Å; R343-R353 PolarHBondContact NE-O 3.28Å; R343-R353 PolarHBondContact NH2-O 3.04Å; R343-R353 PolarHBondContact O-NE 3.44Å; R343-F354 CarbonylContact C-O 3.47Å; R343-F354 VanDerWaalsContact C-O 3.3Å; R343-F354 WeakPolarHBondContact CA-O 3.22Å
344	P	90.5	Very high	90.7	Very high	64 Å²	64	80.8 Å²	80.8	42%	0.416	41%	0.409	S	S	.	.			trans	-68.4	-21.2	-172.7	-20.4	33.9	0	0	0	113.9	E342	E342-P344 WeakPolarHBondContact O-CD 3.1Å
345	Y	93.5	Very high	90.7	Very high	72 Å²	72	80.9 Å²	80.9	28%	0.282	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	98.3	-174.4	-54	-71.4	0	0	0	109.9	R337 R343 R353 F354 S355 R357	R337-Y345 VanDerWaalsContact NH1-CE2 3.27Å; R343-Y345 PolarHBondContact O-N 3.45Å; Y345-R353 CarbonylContact O-C 3.47Å; Y345-R353 WeakPolarHBondContact O-CA 3.46Å; Y345-F354 WeakPolarHBondContact CD2-O 3.35Å; Y345-F354 PolarHBondContact N-O 3.48Å; Y345-F354 VanDerWaalsContact N-O 3.13Å; Y345-F354 PolarHBondContact O-N 3.37Å; Y345-S355 WeakPolarHBondContact CE2-O 3.26Å; Y345-R357 HydrophobicContact CD1-CB 4.09Å; Y345-R357 HydrophobicContact CD1-CG 4.48Å; Y345-R357 HydrophobicContact CD2-CB 4.41Å; Y345-R357 VanDerWaalsContact CD2-N 3.3Å; Y345-R357 HydrophobicContact CE1-CB 3.89Å; Y345-R357 HydrophobicContact CE1-CG 4.46Å; Y345-R357 HydrophobicContact CE2-CB 4.18Å; Y345-R357 VanDerWaalsContact CE2-N 3.27Å; Y345-R357 HydrophobicContact CG-CB 4.35Å
346	A	92.8	Very high	90.6	Very high	39 Å²	39	83.8 Å²	83.8	32%	0.322	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	150.5	173.5	0	0	0	0	0	111.2	R353 L360	A346-R353 HydrophobicContact CB-CG 4.13Å; A346-L360 WeakPolarHBondContact O-CD1 3.49Å; A346-L360 VanDerWaalsContact O-CD2 3.29Å; A346-L360 WeakPolarHBondContact O-CD2 3.34Å
347	C	91.7	Very high	90.7	Very high	8 Å²	8	85.6 Å²	85.6	5%	0.054	43%	0.43	C	S	.	.			trans	-85.7	135.1	165.3	-169.2	0	0	0	0	109	H349 A352 L360 H363 H367	C347-H349 VanDerWaalsContact C-N 3.26Å; C347-H349 PolarHBondContact O-N 2.87Å; C347-A352 WeakPolarHBondContact CB-O 3.31Å; C347-A352 PolarHBondContact N-O 3.22Å; C347-L360 HydrophobicContact CB-CD1 3.81Å; C347-H363 VanDerWaalsContact SG-CD2 3.55Å; C347-H363 PolarHBondContact SG-NE2 3Å; C347-H363 VanDerWaalsContact SG-NE2 3.39Å; C347-H367 PolarHBondContact SG-NE2 3.37Å
348	E	90.6	Very high	90.6	Very high	167 Å²	167	86.4 Å²	86.4	78%	0.78	44%	0.444	S	S	*	.	S	Bend	trans	-75.4	-18.6	178.3	-57.2	-60.2	127.4	0	0	112.6
349	H	86.7	Confident	90.7	Very high	137 Å²	137	84 Å²	84	63%	0.634	43%	0.43	S	S	*	.	S	Bend	trans	-102.4	-6.5	-173.8	-59.9	74.7	0	0	0	113.1	C347 H367	C347-H349 VanDerWaalsContact C-N 3.26Å; C347-H349 PolarHBondContact O-N 2.87Å; H349-H367 HydrophobicContact CB-CB 4.5Å
350	C	89.6	Confident	90.8	Very high	47 Å²	47	81.1 Å²	81.1	32%	0.318	42%	0.417	S	S	.	.	S	Bend	trans	-160.5	166.9	173.4	69	0	0	0	0	111.1	A352 H363 H367	C350-A352 PolarHBondContact O-N 3.07Å; C350-A352 WeakPolarHBondContact SG-CB 3.3Å; C350-H363 VanDerWaalsContact SG-CE1 3.52Å; C350-H363 PolarHBondContact SG-NE2 3.47Å; C350-H367 PolarHBondContact SG-NE2 3.22Å; C350-H367 VanDerWaalsContact SG-NE2 3.39Å
351	E	88.4	Confident	91	Very high	194 Å²	194	82.1 Å²	82.1	91%	0.907	42%	0.417	S	S	*	.	S	Bend	trans	-69	1.8	-178.5	-60.1	177.1	-172.9	0	0	114.5	R353	E351-R353 PolarHBondContact O-N 2.89Å
352	A	89.5	Confident	91.1	Very high	31 Å²	31	83.7 Å²	83.7	26%	0.256	41%	0.41	S	S	.	.			trans	-69	121	-178.9	0	0	0	0	0	111.3	C347 C350 F354	C347-A352 WeakPolarHBondContact CB-O 3.31Å; C347-A352 PolarHBondContact N-O 3.22Å; C350-A352 PolarHBondContact O-N 3.07Å; C350-A352 WeakPolarHBondContact SG-CB 3.3Å; A352-F354 HydrophobicContact CB-CE2 3.81Å; A352-F354 HydrophobicContact CB-CZ 3.72Å
353	R	92	Very high	91	Very high	139 Å²	139	80 Å²	80	53%	0.525	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	155	172.7	-54.7	-179.7	72.5	145.2	5.2	110.6	R343 Y345 A346 E351	R343-R353 HydrophobicContact CB-CB 3.63Å; R343-R353 PolarHBondContact NE-O 3.28Å; R343-R353 PolarHBondContact NH2-O 3.04Å; R343-R353 PolarHBondContact O-NE 3.44Å; Y345-R353 CarbonylContact O-C 3.47Å; Y345-R353 WeakPolarHBondContact O-CA 3.46Å; A346-R353 HydrophobicContact CB-CG 4.13Å; E351-R353 PolarHBondContact O-N 2.89Å
354	F	91	Very high	91	Very high	25 Å²	25	76.1 Å²	76.1	11%	0.11	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	148.2	-177.8	-56.7	-84.7	0	0	0	111.8	R343 Y345 A352 Q356 T359 L360 H363	R343-F354 CarbonylContact C-O 3.47Å; R343-F354 VanDerWaalsContact C-O 3.3Å; R343-F354 WeakPolarHBondContact CA-O 3.22Å; Y345-F354 WeakPolarHBondContact CD2-O 3.35Å; Y345-F354 PolarHBondContact N-O 3.48Å; Y345-F354 VanDerWaalsContact N-O 3.13Å; Y345-F354 PolarHBondContact O-N 3.37Å; A352-F354 HydrophobicContact CB-CE2 3.81Å; A352-F354 HydrophobicContact CB-CZ 3.72Å; F354-Q356 VanDerWaalsContact C-N 3.33Å; F354-T359 HydrophobicContact CD1-CG2 3.49Å; F354-T359 VanDerWaalsContact CD1-CG2 3.49Å; F354-T359 HydrophobicContact CE1-CG2 4.02Å; F354-T359 HydrophobicContact CG-CG2 4.28Å; F354-L360 HydrophobicContact CB-CB 4.35Å; F354-L360 HydrophobicContact CD2-CB 3.8Å; F354-L360 HydrophobicContact CD2-CD1 3.75Å; F354-L360 HydrophobicContact CD2-CG 4.39Å; F354-L360 HydrophobicContact CE2-CD1 3.91Å; F354-L360 HydrophobicContact CG-CB 4.29Å; F354-H363 HydrophobicContact CE1-CB 4.03Å; F354-H363 HydrophobicContact CE2-CB 3.8Å; F354-H363 AromaticContact CE2-CD2 3.47Å; F354-H363 VanDerWaalsContact CE2-CD2 3.47Å; F354-H363 WeakPolarHBondContact CE2-CD2 3.44Å; F354-H363 AromaticContact CE2-CG 3.56Å; F354-H363 HydrophobicContact CZ-CB 3.41Å; F354-H363 VanDerWaalsContact CZ-CB 3.41Å; F354-H363 AromaticContact CZ-CD2 3.6Å; F354-H363 AromaticContact CZ-CG 3.21Å; F354-H363 AromaticContact CZ-ND1 3.53Å
355	S	91	Very high	91	Very high	35 Å²	35	74.5 Å²	74.5	25%	0.245	37%	0.368	C	S	.	.	S	Bend	trans	-77.7	-19.2	176.2	58	0	0	0	0	113.1	R337 Y345	R337-S355 WeakPolarHBondContact CD-O 3.43Å; R337-S355 PolarHBondContact NH1-O 3.01Å; Y345-S355 WeakPolarHBondContact CE2-O 3.26Å
356	Q	90.9	Very high	90.7	Very high	79 Å²	79	75.6 Å²	75.6	37%	0.369	38%	0.378	S	S	.	.	S	Bend	trans	-132.5	139.9	-178.5	-61.2	-175.7	3.1	0	0	111.9	F354 S358 T359 L360	F354-Q356 VanDerWaalsContact C-N 3.33Å; Q356-S358 VanDerWaalsContact C-N 3.32Å; Q356-S358 PolarHBondContact O-N 2.9Å; Q356-T359 PolarHBondContact O-N 3.5Å; Q356-L360 PolarHBondContact O-N 3.28Å
357	R	92.7	Very high	90.4	Very high	164 Å²	164	77.5 Å²	77.5	62%	0.619	38%	0.381	S	S	*	.	H	α-helix	trans	-62.6	-36.5	179.9	-174.4	174.9	-178.5	139.4	1.9	112.8	Y345 T359 L360 L361	Y345-R357 HydrophobicContact CD1-CB 4.09Å; Y345-R357 HydrophobicContact CD1-CG 4.48Å; Y345-R357 HydrophobicContact CD2-CB 4.41Å; Y345-R357 VanDerWaalsContact CD2-N 3.3Å; Y345-R357 HydrophobicContact CE1-CB 3.89Å; Y345-R357 HydrophobicContact CE1-CG 4.46Å; Y345-R357 HydrophobicContact CE2-CB 4.18Å; Y345-R357 VanDerWaalsContact CE2-N 3.27Å; Y345-R357 HydrophobicContact CG-CB 4.35Å; R357-T359 VanDerWaalsContact C-N 3.26Å; R357-T359 PolarHBondContact O-N 2.91Å; R357-L360 PolarHBondContact O-N 3.07Å; R357-L361 HydrophobicContact CG-CD1 4.3Å; R357-L361 HydrophobicContact CG-CG 4.4Å; R357-L361 WeakPolarHBondContact O-CG 3.34Å; R357-L361 PolarHBondContact O-N 3.08Å
358	S	91.3	Very high	90.3	Very high	74 Å²	74	81 Å²	81	52%	0.517	40%	0.402	S	S	.	.	H	α-helix	trans	-61	-36.5	176.9	46.1	0	0	0	0	112.5	Q356 Q362	Q356-S358 VanDerWaalsContact C-N 3.32Å; Q356-S358 PolarHBondContact O-N 2.9Å; S358-Q362 WeakPolarHBondContact O-CB 3.5Å; S358-Q362 PolarHBondContact O-N 2.98Å
359	T	92.2	Very high	90.1	Very high	49 Å²	49	74.9 Å²	74.9	30%	0.301	38%	0.383	S	S	.	.	H	α-helix	trans	-71.9	-38.8	177.6	-45.1	0	0	0	0	111.1	F354 Q356 R357 Q362 H363	F354-T359 HydrophobicContact CD1-CG2 3.49Å; F354-T359 VanDerWaalsContact CD1-CG2 3.49Å; F354-T359 HydrophobicContact CE1-CG2 4.02Å; F354-T359 HydrophobicContact CG-CG2 4.28Å; Q356-T359 PolarHBondContact O-N 3.5Å; R357-T359 VanDerWaalsContact C-N 3.26Å; R357-T359 PolarHBondContact O-N 2.91Å; T359-Q362 PolarHBondContact O-N 3.08Å; T359-H363 VanDerWaalsContact O-CB 3.28Å; T359-H363 WeakPolarHBondContact O-CB 3.29Å; T359-H363 PolarHBondContact O-N 3.27Å
360	L	93	Very high	90.2	Very high	17 Å²	17	73.9 Å²	73.9	9%	0.089	38%	0.379	C	S	.	.	H	α-helix	trans	-60	-51.4	171.5	171.9	63.9	0	0	0	111.3	A346 C347 F354 Q356 R357 Q362 H363 Q364	A346-L360 WeakPolarHBondContact O-CD1 3.49Å; A346-L360 VanDerWaalsContact O-CD2 3.29Å; A346-L360 WeakPolarHBondContact O-CD2 3.34Å; C347-L360 HydrophobicContact CB-CD1 3.81Å; F354-L360 HydrophobicContact CB-CB 4.35Å; F354-L360 HydrophobicContact CD2-CB 3.8Å; F354-L360 HydrophobicContact CD2-CD1 3.75Å; F354-L360 HydrophobicContact CD2-CG 4.39Å; F354-L360 HydrophobicContact CE2-CD1 3.91Å; F354-L360 HydrophobicContact CG-CB 4.29Å; Q356-L360 PolarHBondContact O-N 3.28Å; R357-L360 PolarHBondContact O-N 3.07Å; L360-Q362 VanDerWaalsContact C-N 3.28Å; L360-Q362 PolarHBondContact O-N 3.49Å; L360-H363 CarbonylContact O-C 3.58Å; L360-H363 WeakPolarHBondContact O-CA 3.46Å; L360-H363 WeakPolarHBondContact O-CB 3.48Å; L360-H363 PolarHBondContact O-N 3.32Å; L360-Q364 HydrophobicContact CD1-CG 4.17Å; L360-Q364 HydrophobicContact CG-CG 4.49Å; L360-Q364 WeakPolarHBondContact O-CG 3.38Å; L360-Q364 PolarHBondContact O-N 3.17Å
361	L	93	Very high	90.2	Very high	88 Å²	88	76.6 Å²	76.6	46%	0.461	39%	0.386	S	S	.	.	H	α-helix	trans	-58.9	-41.2	179.4	-69.8	173	0	0	0	111.6	R357 H363 Q364	R357-L361 HydrophobicContact CG-CD1 4.3Å; R357-L361 HydrophobicContact CG-CG 4.4Å; R357-L361 WeakPolarHBondContact O-CG 3.34Å; R357-L361 PolarHBondContact O-N 3.08Å; L361-H363 VanDerWaalsContact C-N 3.32Å; L361-H363 PolarHBondContact O-N 3.4Å; L361-Q364 PolarHBondContact O-N 3.39Å
362	Q	90.4	Very high	90.3	Very high	84 Å²	84	70.7 Å²	70.7	39%	0.393	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-37.2	174.4	174.3	175.3	77.8	0	0	112.5	S358 T359 L360 L365 R384	S358-Q362 WeakPolarHBondContact O-CB 3.5Å; S358-Q362 PolarHBondContact O-N 2.98Å; T359-Q362 PolarHBondContact O-N 3.08Å; L360-Q362 VanDerWaalsContact C-N 3.28Å; L360-Q362 PolarHBondContact O-N 3.49Å; Q362-L365 WeakPolarHBondContact O-CB 3.32Å; Q362-L365 PolarHBondContact O-N 2.92Å; Q362-R384 HydrophobicContact CG-CG 4.48Å; Q362-R384 VanDerWaalsContact NE2-CG 3.31Å
363	H	88.8	Confident	90.5	Very high	30 Å²	30	73.8 Å²	73.8	14%	0.139	37%	0.37	C	S	.	.	H	α-helix	trans	-69.1	-36.9	177	163.7	82.6	0	0	0	111.8	C347 C350 F354 T359 L360 L361 L365 L366 H367	C347-H363 VanDerWaalsContact SG-CD2 3.55Å; C347-H363 PolarHBondContact SG-NE2 3Å; C347-H363 VanDerWaalsContact SG-NE2 3.39Å; C350-H363 VanDerWaalsContact SG-CE1 3.52Å; C350-H363 PolarHBondContact SG-NE2 3.47Å; F354-H363 HydrophobicContact CE1-CB 4.03Å; F354-H363 HydrophobicContact CE2-CB 3.8Å; F354-H363 AromaticContact CE2-CD2 3.47Å; F354-H363 VanDerWaalsContact CE2-CD2 3.47Å; F354-H363 WeakPolarHBondContact CE2-CD2 3.44Å; F354-H363 AromaticContact CE2-CG 3.56Å; F354-H363 HydrophobicContact CZ-CB 3.41Å; F354-H363 VanDerWaalsContact CZ-CB 3.41Å; F354-H363 AromaticContact CZ-CD2 3.6Å; F354-H363 AromaticContact CZ-CG 3.21Å; F354-H363 AromaticContact CZ-ND1 3.53Å; T359-H363 VanDerWaalsContact O-CB 3.28Å; T359-H363 WeakPolarHBondContact O-CB 3.29Å; T359-H363 PolarHBondContact O-N 3.27Å; L360-H363 CarbonylContact O-C 3.58Å; L360-H363 WeakPolarHBondContact O-CA 3.46Å; L360-H363 WeakPolarHBondContact O-CB 3.48Å; L360-H363 PolarHBondContact O-N 3.32Å; L361-H363 VanDerWaalsContact C-N 3.32Å; L361-H363 PolarHBondContact O-N 3.4Å; H363-L365 PolarHBondContact O-N 3.28Å; H363-L365 VanDerWaalsContact O-N 3.15Å; H363-L366 WeakPolarHBondContact O-CB 3.47Å; H363-L366 WeakPolarHBondContact O-CG 3.32Å; H363-L366 PolarHBondContact O-N 2.94Å; H363-H367 AromaticContact CE1-NE2 3.78Å; H363-H367 AromaticContact NE2-CD2 3.81Å; H363-H367 AromaticContact NE2-NE2 3.26Å; H363-H367 PolarHBondContact NE2-NE2 3.36Å
364	Q	90.5	Very high	90.5	Very high	56 Å²	56	70.7 Å²	70.7	26%	0.262	37%	0.368	S	S	.	.	H	α-helix	trans	-59.3	-26.6	176.5	-74.2	174.2	-32.5	0	0	112.9	L360 L361 L366 H367 T368	L360-Q364 HydrophobicContact CD1-CG 4.17Å; L360-Q364 HydrophobicContact CG-CG 4.49Å; L360-Q364 WeakPolarHBondContact O-CG 3.38Å; L360-Q364 PolarHBondContact O-N 3.17Å; L361-Q364 PolarHBondContact O-N 3.39Å; Q364-L366 PolarHBondContact O-N 2.88Å; Q364-L366 VanDerWaalsContact O-N 3.14Å; Q364-H367 PolarHBondContact O-N 3.16Å; Q364-T368 PolarHBondContact O-N 3.16Å
365	L	90.9	Very high	90.4	Very high	29 Å²	29	69.7 Å²	69.7	15%	0.152	36%	0.364	C	S	.	.	H	α-helix	trans	-63.3	-14.6	171.3	-58	175.2	0	0	0	113.9	Q362 H363 G369 E370 P372 R383	Q362-L365 WeakPolarHBondContact O-CB 3.32Å; Q362-L365 PolarHBondContact O-N 2.92Å; H363-L365 PolarHBondContact O-N 3.28Å; H363-L365 VanDerWaalsContact O-N 3.15Å; L365-G369 PolarHBondContact O-N 3.41Å; L365-E370 HydrophobicContact CD2-CB 4Å; L365-P372 HydrophobicContact CD1-CG 4.3Å; L365-P372 HydrophobicContact CD2-CG 4.34Å; L365-R383 HydrophobicContact CB-CG 4.48Å; L365-R383 HydrophobicContact CD1-CB 4.45Å; L365-R383 WeakPolarHBondContact O-CD 3.37Å; L365-R383 PolarHBondContact O-NE 2.75Å; L365-R383 VanDerWaalsContact O-NE 3.09Å
366	L	87.9	Confident	90.2	Very high	95 Å²	95	72.2 Å²	72.2	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-73.6	-38.1	170.5	-60.5	176.5	0	0	0	111.1	H363 Q364	H363-L366 WeakPolarHBondContact O-CB 3.47Å; H363-L366 WeakPolarHBondContact O-CG 3.32Å; H363-L366 PolarHBondContact O-N 2.94Å; Q364-L366 PolarHBondContact O-N 2.88Å; Q364-L366 VanDerWaalsContact O-N 3.14Å
367	H	87.5	Confident	89.9	Confident	79 Å²	79	73.3 Å²	73.3	37%	0.366	39%	0.388	S	S	.	.	H	α-helix	trans	-77	-45.1	179.6	-65.2	-68.6	0	0	0	111.8	C347 H349 C350 H363 Q364 G369	C347-H367 PolarHBondContact SG-NE2 3.37Å; H349-H367 HydrophobicContact CB-CB 4.5Å; C350-H367 PolarHBondContact SG-NE2 3.22Å; C350-H367 VanDerWaalsContact SG-NE2 3.39Å; H363-H367 AromaticContact CE1-NE2 3.78Å; H363-H367 AromaticContact NE2-CD2 3.81Å; H363-H367 AromaticContact NE2-NE2 3.26Å; H363-H367 PolarHBondContact NE2-NE2 3.36Å; Q364-H367 PolarHBondContact O-N 3.16Å; H367-G369 PolarHBondContact O-N 2.99Å
368	T	88.6	Confident	89.6	Confident	82 Å²	82	68.3 Å²	68.3	50%	0.503	38%	0.377	S	S	.	.	S	Bend	trans	-73.3	-16.7	179.3	64.6	0	0	0	0	112.8	Q364 E370	Q364-T368 PolarHBondContact O-N 3.16Å; T368-E370 PolarHBondContact O-N 2.84Å; T368-E370 VanDerWaalsContact O-N 3.08Å; T368-E370 WeakPolarHBondContact OG1-CB 3.47Å; T368-E370 WeakPolarHBondContact OG1-CG 3.47Å; T368-E370 PolarHBondContact OG1-N 3.43Å
369	G	85.8	Confident	89.4	Confident	38 Å²	38	67.5 Å²	67.5	39%	0.392	38%	0.381	S	S	.	.			trans	70.3	-3.9	-173.8	0	0	0	0	0	114.1	L365 H367	L365-G369 PolarHBondContact O-N 3.41Å; H367-G369 PolarHBondContact O-N 2.99Å
370	E	88.9	Confident	89.2	Confident	116 Å²	116	73.3 Å²	73.3	54%	0.542	40%	0.397	S	S	.	.			trans	-60.6	137.3	-177.1	-72.1	-179.4	-173.2	0	0	111.9	L365 T368	L365-E370 HydrophobicContact CD2-CB 4Å; T368-E370 PolarHBondContact O-N 2.84Å; T368-E370 VanDerWaalsContact O-N 3.08Å; T368-E370 WeakPolarHBondContact OG1-CB 3.47Å; T368-E370 WeakPolarHBondContact OG1-CG 3.47Å; T368-E370 PolarHBondContact OG1-N 3.43Å
371	K	90.7	Very high	89	Confident	105 Å²	105	73.8 Å²	73.8	46%	0.457	40%	0.404	S	S	.	.			trans	-127.8	83.8	-179.6	-73.5	162.1	166.1	-161.3	0	109	Y373 A381 F382 R383	K371-Y373 PolarHBondContact O-N 2.81Å; K371-A381 HydrophobicContact CB-CB 3.45Å; K371-A381 VanDerWaalsContact CB-CB 3.45Å; K371-A381 HydrophobicContact CD-CB 4.22Å; K371-A381 VanDerWaalsContact CD-O 3.28Å; K371-A381 WeakPolarHBondContact CD-O 3.42Å; K371-A381 HydrophobicContact CG-CB 4.42Å; K371-A381 WeakPolarHBondContact O-CB 3.47Å; K371-F382 CarbonylContact C-O 3.53Å; K371-F382 WeakPolarHBondContact CA-O 3.14Å; K371-R383 HydrophobicContact CG-CG 3.94Å
372	P	90.1	Very high	88.8	Confident	69 Å²	69	71.8 Å²	71.8	45%	0.448	39%	0.391	S	S	.	.			trans	-66.5	-9.8	-170.9	-23.7	35.1	0	0	0	115.3	L365 P374	L365-P372 HydrophobicContact CD1-CG 4.3Å; L365-P372 HydrophobicContact CD2-CG 4.34Å; P372-P374 VanDerWaalsContact C-CD 3.42Å; P372-P374 WeakPolarHBondContact O-CD 3.4Å
373	Y	92.5	Very high	88.7	Confident	96 Å²	96	72.2 Å²	72.2	38%	0.376	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	79.3	-173.3	-56.3	-81.5	0	0	0	111	K371 A381 F382	K371-Y373 PolarHBondContact O-N 2.81Å; Y373-A381 WeakPolarHBondContact O-CA 3.35Å; Y373-F382 WeakPolarHBondContact CB-O 3.44Å; Y373-F382 WeakPolarHBondContact CD2-O 3.23Å; Y373-F382 PolarHBondContact N-O 3.22Å; Y373-F382 PolarHBondContact O-N 3.04Å
374	P	92.1	Very high	88.7	Confident	75 Å²	75	77.3 Å²	77.3	49%	0.487	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	142.6	173.1	29.5	-34	0	0	0	112	P372 A381 L388	P372-P374 VanDerWaalsContact C-CD 3.42Å; P372-P374 WeakPolarHBondContact O-CD 3.4Å; P374-A381 HydrophobicContact CB-CB 4.27Å; P374-L388 WeakPolarHBondContact O-CD2 3.22Å
375	C	88.8	Confident	88.7	Confident	3 Å²	3	78 Å²	78	2%	0.02	42%	0.418	C	S	.	.			trans	-80.4	126	168.7	179.5	0	0	0	0	110	D377 G379 R380 F382 L388 H391 H395	C375-D377 VanDerWaalsContact C-N 3.26Å; C375-D377 PolarHBondContact O-N 3.18Å; C375-G379 VanDerWaalsContact O-CA 3.24Å; C375-G379 WeakPolarHBondContact O-CA 3.4Å; C375-G379 PolarHBondContact O-N 3.3Å; C375-R380 WeakPolarHBondContact CB-O 3.12Å; C375-R380 PolarHBondContact N-O 2.81Å; C375-F382 HydrophobicContact CB-CE2 4.45Å; C375-L388 HydrophobicContact CB-CD1 3.67Å; C375-H391 VanDerWaalsContact SG-CD2 3.54Å; C375-H391 PolarHBondContact SG-NE2 3.01Å; C375-H395 PolarHBondContact SG-CD2 3.16Å; C375-H395 PolarHBondContact SG-NE2 3.05Å
376	P	88.2	Confident	88.4	Confident	88 Å²	88	78.3 Å²	78.3	57%	0.571	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-28.9	179.5	28.1	-34	0	0	0	112
377	D	83.5	Confident	88.2	Confident	103 Å²	103	75.2 Å²	75.2	55%	0.551	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-27.2	-171.3	-41.9	-63.2	0	0	0	113.3	C375 H395	C375-D377 VanDerWaalsContact C-N 3.26Å; C375-D377 PolarHBondContact O-N 3.18Å; D377-H395 HydrophobicContact CB-CB 4.26Å; D377-H395 IonicContact OD2-CD2 3.89Å; D377-H395 PolarHBondContact OD2-CD2 3.27Å; D377-H395 IonicContact OD2-CG 3.92Å
378	C	87.1	Confident	88.1	Confident	59 Å²	59	72.3 Å²	72.3	40%	0.399	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	5.3	-178.4	76	0	0	0	0	115.2	R380 H391 H395	C378-R380 PolarHBondContact O-N 2.97Å; C378-H391 PolarHBondContact SG-NE2 2.95Å; C378-H395 VanDerWaalsContact SG-CE1 3.59Å; C378-H395 PolarHBondContact SG-NE2 3.18Å
379	G	87	Confident	87.8	Confident	57 Å²	57	71.1 Å²	71.1	59%	0.588	40%	0.4	S	S	*	.			trans	71.5	-9.3	179.8	0	0	0	0	0	115.6	C375 A381	C375-G379 VanDerWaalsContact O-CA 3.24Å; C375-G379 WeakPolarHBondContact O-CA 3.4Å; C375-G379 PolarHBondContact O-N 3.3Å; G379-A381 PolarHBondContact O-N 2.83Å
380	R	87.8	Confident	87.2	Confident	170 Å²	170	72.3 Å²	72.3	64%	0.642	40%	0.397	S	S	*	.			trans	-61.4	125.2	177.9	-76.1	-176.8	175.3	171.4	1.5	110.7	C375 C378 F382	C375-R380 WeakPolarHBondContact CB-O 3.12Å; C375-R380 PolarHBondContact N-O 2.81Å; C378-R380 PolarHBondContact O-N 2.97Å; R380-F382 HydrophobicContact CB-CE2 4Å; R380-F382 HydrophobicContact CB-CZ 4.14Å; R380-F382 VanDerWaalsContact O-CE2 3.25Å; R380-F382 WeakPolarHBondContact O-CE2 3.43Å
381	A	89.4	Confident	86.8	Confident	28 Å²	28	67.5 Å²	67.5	23%	0.231	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	144.8	-179.6	0	0	0	0	0	113	K371 Y373 P374 G379	K371-A381 HydrophobicContact CB-CB 3.45Å; K371-A381 VanDerWaalsContact CB-CB 3.45Å; K371-A381 HydrophobicContact CD-CB 4.22Å; K371-A381 VanDerWaalsContact CD-O 3.28Å; K371-A381 WeakPolarHBondContact CD-O 3.42Å; K371-A381 HydrophobicContact CG-CB 4.42Å; K371-A381 WeakPolarHBondContact O-CB 3.47Å; Y373-A381 WeakPolarHBondContact O-CA 3.35Å; P374-A381 HydrophobicContact CB-CB 4.27Å; G379-A381 PolarHBondContact O-N 2.83Å
382	F	87.8	Confident	86.3	Confident	46 Å²	46	67.8 Å²	67.8	20%	0.202	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	151.5	-177.2	-59.3	-90.4	0	0	0	110.9	K371 Y373 C375 R380 R384 L388 H391	K371-F382 CarbonylContact C-O 3.53Å; K371-F382 WeakPolarHBondContact CA-O 3.14Å; Y373-F382 WeakPolarHBondContact CB-O 3.44Å; Y373-F382 WeakPolarHBondContact CD2-O 3.23Å; Y373-F382 PolarHBondContact N-O 3.22Å; Y373-F382 PolarHBondContact O-N 3.04Å; C375-F382 HydrophobicContact CB-CE2 4.45Å; R380-F382 HydrophobicContact CB-CE2 4Å; R380-F382 HydrophobicContact CB-CZ 4.14Å; R380-F382 VanDerWaalsContact O-CE2 3.25Å; R380-F382 WeakPolarHBondContact O-CE2 3.43Å; F382-R384 VanDerWaalsContact C-N 3.33Å; F382-L388 HydrophobicContact CB-CB 4.29Å; F382-L388 HydrophobicContact CD2-CB 3.94Å; F382-L388 HydrophobicContact CD2-CD1 3.86Å; F382-L388 HydrophobicContact CE2-CD1 4.13Å; F382-L388 HydrophobicContact CG-CB 4.32Å; F382-H391 HydrophobicContact CD2-CB 4.43Å; F382-H391 HydrophobicContact CE1-CB 3.91Å; F382-H391 HydrophobicContact CE2-CB 3.58Å; F382-H391 AromaticContact CE2-CD2 3.22Å; F382-H391 WeakPolarHBondContact CE2-CD2 3.3Å; F382-H391 AromaticContact CE2-CG 3.42Å; F382-H391 VanDerWaalsContact CE2-CG 3.42Å; F382-H391 HydrophobicContact CZ-CB 3.28Å; F382-H391 AromaticContact CZ-CD2 3.44Å; F382-H391 VanDerWaalsContact CZ-CD2 3.44Å; F382-H391 WeakPolarHBondContact CZ-CD2 3.43Å; F382-H391 AromaticContact CZ-CG 3.15Å; F382-H391 AromaticContact CZ-ND1 3.78Å
383	R	89.2	Confident	85.5	Confident	92 Å²	92	65.4 Å²	65.4	35%	0.347	36%	0.357	S	S	.	.	S	Bend	trans	-78.9	-17.7	176.1	-58.1	-172.1	-178	102.4	-2.2	113.3	L365 K371	L365-R383 HydrophobicContact CB-CG 4.48Å; L365-R383 HydrophobicContact CD1-CB 4.45Å; L365-R383 WeakPolarHBondContact O-CD 3.37Å; L365-R383 PolarHBondContact O-NE 2.75Å; L365-R383 VanDerWaalsContact O-NE 3.09Å; K371-R383 HydrophobicContact CG-CG 3.94Å
384	R	88.5	Confident	84.6	Confident	138 Å²	138	64.8 Å²	64.8	52%	0.521	36%	0.364	S	S	.	.	S	Bend	trans	-131.1	136.3	-176.6	-59.3	-170.2	-75.6	-179.1	-7.9	110	Q362 F382 G386 S387 L388	Q362-R384 HydrophobicContact CG-CG 4.48Å; Q362-R384 VanDerWaalsContact NE2-CG 3.31Å; F382-R384 VanDerWaalsContact C-N 3.33Å; R384-G386 VanDerWaalsContact C-N 3.27Å; R384-G386 PolarHBondContact O-N 2.85Å; R384-S387 WeakPolarHBondContact O-CB 3.49Å; R384-S387 PolarHBondContact O-N 3.4Å; R384-L388 PolarHBondContact O-N 3.39Å; R384-L388 VanDerWaalsContact O-N 3.13Å
385	S	89.8	Confident	83.8	Confident	70 Å²	70	64.5 Å²	64.5	49%	0.49	36%	0.356	S	S	.	.	H	α-helix	trans	-58.4	-38.6	175.4	56.5	0	0	0	0	112.5	S387 L388 A389	S385-S387 VanDerWaalsContact C-N 3.29Å; S385-S387 PolarHBondContact O-N 3.43Å; S385-L388 WeakPolarHBondContact O-CB 3.47Å; S385-L388 PolarHBondContact O-N 2.94Å; S385-A389 PolarHBondContact O-N 2.9Å
386	G	84.6	Confident	82.9	Confident	35 Å²	35	67.4 Å²	67.4	36%	0.361	37%	0.374	S	S	.	.	H	α-helix	trans	-59.9	-38.5	174.5	0	0	0	0	0	112.6	R384 A389 I390	R384-G386 VanDerWaalsContact C-N 3.27Å; R384-G386 PolarHBondContact O-N 2.85Å; G386-A389 PolarHBondContact O-N 2.89Å; G386-I390 VanDerWaalsContact O-CG1 3.29Å; G386-I390 WeakPolarHBondContact O-CG1 3.03Å; G386-I390 PolarHBondContact O-N 3.41Å; G386-I390 VanDerWaalsContact O-N 3.08Å
387	S	85.2	Confident	81.5	Confident	30 Å²	30	71.5 Å²	71.5	21%	0.21	39%	0.385	C	S	.	.	H	α-helix	trans	-68.2	-37.6	175.4	-59.4	0	0	0	0	112.4	R384 S385 I390 H391	R384-S387 WeakPolarHBondContact O-CB 3.49Å; R384-S387 PolarHBondContact O-N 3.4Å; S385-S387 VanDerWaalsContact C-N 3.29Å; S385-S387 PolarHBondContact O-N 3.43Å; S387-I390 PolarHBondContact O-N 3.39Å; S387-H391 WeakPolarHBondContact O-CB 3.41Å; S387-H391 PolarHBondContact O-N 3.34Å
388	L	85	Confident	80.2	Confident	18 Å²	18	72.8 Å²	72.8	9%	0.094	39%	0.388	C	S	.	.	H	α-helix	trans	-63.6	-41.3	171.1	173	62.7	0	0	0	111.4	P374 C375 F382 R384 S385 I390 H391 R392	P374-L388 WeakPolarHBondContact O-CD2 3.22Å; C375-L388 HydrophobicContact CB-CD1 3.67Å; F382-L388 HydrophobicContact CB-CB 4.29Å; F382-L388 HydrophobicContact CD2-CB 3.94Å; F382-L388 HydrophobicContact CD2-CD1 3.86Å; F382-L388 HydrophobicContact CE2-CD1 4.13Å; F382-L388 HydrophobicContact CG-CB 4.32Å; R384-L388 PolarHBondContact O-N 3.39Å; R384-L388 VanDerWaalsContact O-N 3.13Å; S385-L388 WeakPolarHBondContact O-CB 3.47Å; S385-L388 PolarHBondContact O-N 2.94Å; L388-I390 PolarHBondContact O-N 3.46Å; L388-H391 CarbonylContact O-C 3.56Å; L388-H391 PolarHBondContact O-N 3.46Å; L388-H391 VanDerWaalsContact O-N 3.15Å; L388-R392 HydrophobicContact CD1-CG 3.95Å; L388-R392 HydrophobicContact CG-CG 4.31Å; L388-R392 WeakPolarHBondContact O-CG 3.46Å; L388-R392 PolarHBondContact O-N 2.88Å
389	A	81.9	Confident	78.7	Confident	58 Å²	58	74.2 Å²	74.2	48%	0.479	39%	0.387	S	S	.	.	H	α-helix	trans	-61.4	-43.1	178.3	0	0	0	0	0	112.1	S385 G386 H391 R392 S393	S385-A389 PolarHBondContact O-N 2.9Å; G386-A389 PolarHBondContact O-N 2.89Å; A389-H391 VanDerWaalsContact C-N 3.29Å; A389-H391 PolarHBondContact O-N 3.14Å; A389-R392 PolarHBondContact O-N 3.24Å; A389-S393 PolarHBondContact O-N 3.12Å
390	I	74	Confident	77.7	Confident	62 Å²	62	77.3 Å²	77.3	32%	0.318	39%	0.39	S	S	.	.	H	α-helix	trans	-59.1	-45	172.3	-61.2	165.4	0	0	0	110.8	G386 S387 L388 S393 A411 Y412	G386-I390 VanDerWaalsContact O-CG1 3.29Å; G386-I390 WeakPolarHBondContact O-CG1 3.03Å; G386-I390 PolarHBondContact O-N 3.41Å; G386-I390 VanDerWaalsContact O-N 3.08Å; S387-I390 PolarHBondContact O-N 3.39Å; L388-I390 PolarHBondContact O-N 3.46Å; I390-S393 PolarHBondContact O-N 3.27Å; I390-S393 PolarHBondContact O-OG 2.97Å; I390-A411 HydrophobicContact CG2-CB 4.1Å; I390-Y412 HydrophobicContact CD1-CE2 3.41Å; I390-Y412 VanDerWaalsContact CD1-CE2 3.41Å; I390-Y412 WeakPolarHBondContact CD1-OH 3.49Å; I390-Y412 HydrophobicContact CG1-CD2 4.46Å; I390-Y412 HydrophobicContact CG1-CE1 4.42Å; I390-Y412 HydrophobicContact CG1-CE2 3.3Å; I390-Y412 WeakPolarHBondContact CG1-OH 3.4Å
391	H	78.9	Confident	77.1	Confident	16 Å²	16	72 Å²	72	7%	0.074	37%	0.372	C	S	.	.	H	α-helix	trans	-69.1	-39	-177.1	173.3	59.7	0	0	0	111.9	C375 C378 F382 S387 L388 A389 S393 T394 H395	C375-H391 VanDerWaalsContact SG-CD2 3.54Å; C375-H391 PolarHBondContact SG-NE2 3.01Å; C378-H391 PolarHBondContact SG-NE2 2.95Å; F382-H391 HydrophobicContact CD2-CB 4.43Å; F382-H391 HydrophobicContact CE1-CB 3.91Å; F382-H391 HydrophobicContact CE2-CB 3.58Å; F382-H391 AromaticContact CE2-CD2 3.22Å; F382-H391 WeakPolarHBondContact CE2-CD2 3.3Å; F382-H391 AromaticContact CE2-CG 3.42Å; F382-H391 VanDerWaalsContact CE2-CG 3.42Å; F382-H391 HydrophobicContact CZ-CB 3.28Å; F382-H391 AromaticContact CZ-CD2 3.44Å; F382-H391 VanDerWaalsContact CZ-CD2 3.44Å; F382-H391 WeakPolarHBondContact CZ-CD2 3.43Å; F382-H391 AromaticContact CZ-CG 3.15Å; F382-H391 AromaticContact CZ-ND1 3.78Å; S387-H391 WeakPolarHBondContact O-CB 3.41Å; S387-H391 PolarHBondContact O-N 3.34Å; L388-H391 CarbonylContact O-C 3.56Å; L388-H391 PolarHBondContact O-N 3.46Å; L388-H391 VanDerWaalsContact O-N 3.15Å; A389-H391 VanDerWaalsContact C-N 3.29Å; A389-H391 PolarHBondContact O-N 3.14Å; H391-S393 PolarHBondContact O-N 3.47Å; H391-T394 WeakPolarHBondContact O-CB 3.32Å; H391-T394 PolarHBondContact O-N 2.72Å; H391-T394 PolarHBondContact O-OG1 3.39Å; H391-H395 AromaticContact CD2-NE2 3.83Å; H391-H395 AromaticContact CE1-CE1 3.87Å; H391-H395 AromaticContact CE1-NE2 3.42Å; H391-H395 PolarHBondContact CE1-NE2 2.95Å; H391-H395 AromaticContact NE2-CD2 3.88Å; H391-H395 AromaticContact NE2-CE1 3.84Å; H391-H395 AromaticContact NE2-NE2 3.01Å; H391-H395 PolarHBondContact NE2-NE2 3.26Å
392	R	80.1	Confident	76.4	Confident	111 Å²	111	72.7 Å²	72.7	42%	0.419	38%	0.378	S	S	.	.	H	α-helix	trans	-60.3	-33.2	174.4	-75.6	-176	178.3	-159.4	1.3	112	L388 A389 T394 H395 T396	L388-R392 HydrophobicContact CD1-CG 3.95Å; L388-R392 HydrophobicContact CG-CG 4.31Å; L388-R392 WeakPolarHBondContact O-CG 3.46Å; L388-R392 PolarHBondContact O-N 2.88Å; A389-R392 PolarHBondContact O-N 3.24Å; R392-T394 PolarHBondContact O-N 2.56Å; R392-H395 PolarHBondContact O-N 2.88Å; R392-T396 PolarHBondContact O-N 2.98Å; R392-T396 PolarHBondContact O-OG1 3.13Å
393	S	75	Confident	76.1	Confident	18 Å²	18	70.5 Å²	70.5	13%	0.126	37%	0.368	C	S	.	.	H	α-helix	trans	-66.8	-5.6	173.9	84.3	0	0	0	0	114	A389 I390 H391 T396 A411	A389-S393 PolarHBondContact O-N 3.12Å; I390-S393 PolarHBondContact O-N 3.27Å; I390-S393 PolarHBondContact O-OG 2.97Å; H391-S393 PolarHBondContact O-N 3.47Å; S393-T396 WeakPolarHBondContact CA-OG1 3.41Å; S393-A411 VanDerWaalsContact OG-CB 3.28Å; S393-A411 WeakPolarHBondContact OG-CB 3.37Å
394	T	72.3	Confident	75.9	Confident	83 Å²	83	72.2 Å²	72.2	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-89.4	-21	169.9	70.8	0	0	0	0	113.1	H391 R392	H391-T394 WeakPolarHBondContact O-CB 3.32Å; H391-T394 PolarHBondContact O-N 2.72Å; H391-T394 PolarHBondContact O-OG1 3.39Å; R392-T394 PolarHBondContact O-N 2.56Å
395	H	75.9	Confident	75.6	Confident	69 Å²	69	70.9 Å²	70.9	32%	0.319	39%	0.387	S	S	.	.	H	α-helix	trans	-85.7	-41.8	175.8	-64.2	-51.3	0	0	0	111.6	C375 D377 C378 H391 R392 E397	C375-H395 PolarHBondContact SG-CD2 3.16Å; C375-H395 PolarHBondContact SG-NE2 3.05Å; D377-H395 HydrophobicContact CB-CB 4.26Å; D377-H395 IonicContact OD2-CD2 3.89Å; D377-H395 PolarHBondContact OD2-CD2 3.27Å; D377-H395 IonicContact OD2-CG 3.92Å; C378-H395 VanDerWaalsContact SG-CE1 3.59Å; C378-H395 PolarHBondContact SG-NE2 3.18Å; H391-H395 AromaticContact CD2-NE2 3.83Å; H391-H395 AromaticContact CE1-CE1 3.87Å; H391-H395 AromaticContact CE1-NE2 3.42Å; H391-H395 PolarHBondContact CE1-NE2 2.95Å; H391-H395 AromaticContact NE2-CD2 3.88Å; H391-H395 AromaticContact NE2-CE1 3.84Å; H391-H395 AromaticContact NE2-NE2 3.01Å; H391-H395 PolarHBondContact NE2-NE2 3.26Å; R392-H395 PolarHBondContact O-N 2.88Å; H395-E397 PolarHBondContact O-N 3.07Å
396	T	69.8	Low	75.3	Confident	65 Å²	65	70.1 Å²	70.1	40%	0.399	38%	0.381	S	S	.	.	S	Bend	trans	-70.1	115	169.7	59.8	0	0	0	0	107.2	R392 S393 E398	R392-T396 PolarHBondContact O-N 2.98Å; R392-T396 PolarHBondContact O-OG1 3.13Å; S393-T396 WeakPolarHBondContact CA-OG1 3.41Å; T396-E398 PolarHBondContact O-N 2.99Å
397	E	58.3	Low	75	Confident	174 Å²	174	70.9 Å²	70.9	81%	0.813	39%	0.389	S	S	*	.	S	Bend	trans	-55.8	-12.7	168.4	-67.3	-161.7	162	0	0	111.7	H395 K399 R409	H395-E397 PolarHBondContact O-N 3.07Å; E397-K399 PolarHBondContact O-N 3.48Å; E397-R409 PolarHBondContact O-NH1 3.36Å; E397-R409 PolarHBondContact O-NH2 3.28Å
398	E	56.4	Low	74.6	Confident	130 Å²	130	77.2 Å²	77.2	61%	0.607	41%	0.409	S	S	*	.			trans	-64.5	54.3	164.1	-57.3	-171.9	160.1	0	0	114.7	T396 L400	T396-E398 PolarHBondContact O-N 2.99Å; E398-L400 VanDerWaalsContact C-N 3.34Å; E398-L400 HydrophobicContact CB-CD2 4.47Å; E398-L400 PolarHBondContact O-N 3.15Å
399	K	56.2	Low	74	Confident	88 Å²	88	81.4 Å²	81.4	38%	0.383	42%	0.423	S	S	.	.			trans	-60.3	101.3	159	-73.8	172.7	169.8	-176.7	0	107.9	E397 H401 R409	E397-K399 PolarHBondContact O-N 3.48Å; K399-H401 PolarHBondContact O-N 3.32Å; K399-H401 VanDerWaalsContact O-N 3.09Å; K399-R409 HydrophobicContact CB-CB 3.18Å; K399-R409 HydrophobicContact CB-CG 4.23Å; K399-R409 HydrophobicContact CD-CB 3.57Å; K399-R409 WeakPolarHBondContact CD-O 3.44Å; K399-R409 HydrophobicContact CG-CB 4.04Å; K399-R409 VanDerWaalsContact O-CZ 3.23Å; K399-R409 PolarHBondContact O-NE 3.42Å; K399-R409 PolarHBondContact O-NH2 2.96Å
400	L	65.9	Low	73.7	Confident	123 Å²	123	80.5 Å²	80.5	64%	0.644	41%	0.408	S	S	*	.	S	Bend	trans	-62	-21.8	-165.2	-62.5	172.5	0	0	0	114.4	E398	E398-L400 VanDerWaalsContact C-N 3.34Å; E398-L400 HydrophobicContact CB-CD2 4.47Å; E398-L400 PolarHBondContact O-N 3.15Å
401	H	74.6	Confident	73.6	Confident	58 Å²	58	78.7 Å²	78.7	27%	0.269	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	90	-171.9	-56.3	-62.4	0	0	0	111.1	K399 R409 F410 P413 L416	K399-H401 PolarHBondContact O-N 3.32Å; K399-H401 VanDerWaalsContact O-N 3.09Å; H401-R409 CarbonylContact O-C 3.31Å; H401-R409 WeakPolarHBondContact O-CA 3.34Å; H401-F410 PolarHBondContact N-O 3.01Å; H401-F410 PolarHBondContact O-N 3.26Å; H401-P413 WeakPolarHBondContact NE2-CD 3.37Å; H401-L416 HydrophobicContact CB-CB 4.21Å; H401-L416 HydrophobicContact CB-CD2 3.85Å
402	A	75.4	Confident	73.3	Confident	42 Å²	42	82.2 Å²	82.2	35%	0.347	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	145.9	174.1	0	0	0	0	0	111.5	R408 R409 L416	A402-R408 CarbonylContact C-O 3.34Å; A402-R409 HydrophobicContact CB-CG 4.01Å; A402-L416 WeakPolarHBondContact O-CD2 3.45Å
403	C	81.5	Confident	73.3	Confident	1 Å²	1	80.6 Å²	80.6	1%	0.007	42%	0.42	C	S	.	.			trans	-84.8	120.8	165.4	-172.6	0	0	0	0	109.2	D405 C406 G407 R408 F410 L416 H419 H423	C403-D405 PolarHBondContact O-N 3.21Å; C403-C406 PolarHBondContact O-N 2.81Å; C403-G407 VanDerWaalsContact O-CA 3.3Å; C403-G407 WeakPolarHBondContact O-CA 3.47Å; C403-G407 PolarHBondContact O-N 3.18Å; C403-R408 WeakPolarHBondContact CB-O 3.43Å; C403-R408 PolarHBondContact N-O 2.81Å; C403-F410 HydrophobicContact CB-CE2 4.27Å; C403-L416 HydrophobicContact CB-CD1 3.65Å; C403-H419 VanDerWaalsContact SG-CD2 3.55Å; C403-H423 PolarHBondContact SG-CD2 2.81Å
404	D	84.8	Confident	73.6	Confident	127 Å²	127	83.5 Å²	83.5	68%	0.679	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-31.7	-177.8	-50	-60.9	0	0	0	111.8	R420	D404-R420 IonicContact OD2-CZ 3.79Å; D404-R420 IonicContact OD2-NH2 3.34Å; D404-R420 PolarHBondContact OD2-NH2 3.48Å
405	D	81.7	Confident	74	Confident	110 Å²	110	83.8 Å²	83.8	59%	0.588	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-22.6	-176.6	-57.6	-44.4	0	0	0	114.9	C403 H423	C403-D405 PolarHBondContact O-N 3.21Å; D405-H423 HydrophobicContact CB-CB 4.26Å; D405-H423 WeakPolarHBondContact OD2-CB 3.41Å; D405-H423 IonicContact OD2-CD2 3.36Å; D405-H423 IonicContact OD2-CG 3.7Å
406	C	83.6	Confident	74.4	Confident	54 Å²	54	81.1 Å²	81.1	37%	0.365	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.3	2	-175.6	70.9	0	0	0	0	115.6	C403 R408 H419 H423	C403-C406 PolarHBondContact O-N 2.81Å; C406-R408 PolarHBondContact O-N 3.19Å; C406-H419 PolarHBondContact SG-NE2 3.16Å; C406-H423 PolarHBondContact SG-NE2 3.42Å
407	G	78.4	Confident	75.1	Confident	51 Å²	51	80.4 Å²	80.4	53%	0.526	43%	0.428	S	S	.	.			trans	68.3	-2.5	-178.9	0	0	0	0	0	115.1	C403 R409	C403-G407 VanDerWaalsContact O-CA 3.3Å; C403-G407 WeakPolarHBondContact O-CA 3.47Å; C403-G407 PolarHBondContact O-N 3.18Å; G407-R409 WeakPolarHBondContact O-CG 3.21Å; G407-R409 PolarHBondContact O-N 3.16Å
408	R	76.7	Confident	76.4	Confident	164 Å²	164	73.4 Å²	73.4	62%	0.619	40%	0.398	S	S	*	.			trans	-64.6	131.2	176.5	-74.7	-175.6	178.9	163.8	3	110	A402 C403 C406 F410	A402-R408 CarbonylContact C-O 3.34Å; C403-R408 WeakPolarHBondContact CB-O 3.43Å; C403-R408 PolarHBondContact N-O 2.81Å; C406-R408 PolarHBondContact O-N 3.19Å; R408-F410 HydrophobicContact CB-CE2 3.85Å; R408-F410 HydrophobicContact CB-CZ 4.02Å; R408-F410 VanDerWaalsContact O-CE2 3.29Å; R408-F410 WeakPolarHBondContact O-CE2 3.44Å
409	R	72.2	Confident	77.7	Confident	105 Å²	105	68 Å²	68	40%	0.396	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	142.8	-176.7	-46.1	173.2	65.7	175.4	1.7	110.9	E397 K399 H401 A402 G407	E397-R409 PolarHBondContact O-NH1 3.36Å; E397-R409 PolarHBondContact O-NH2 3.28Å; K399-R409 HydrophobicContact CB-CB 3.18Å; K399-R409 HydrophobicContact CB-CG 4.23Å; K399-R409 HydrophobicContact CD-CB 3.57Å; K399-R409 WeakPolarHBondContact CD-O 3.44Å; K399-R409 HydrophobicContact CG-CB 4.04Å; K399-R409 VanDerWaalsContact O-CZ 3.23Å; K399-R409 PolarHBondContact O-NE 3.42Å; K399-R409 PolarHBondContact O-NH2 2.96Å; H401-R409 CarbonylContact O-C 3.31Å; H401-R409 WeakPolarHBondContact O-CA 3.34Å; A402-R409 HydrophobicContact CB-CG 4.01Å; G407-R409 WeakPolarHBondContact O-CG 3.21Å; G407-R409 PolarHBondContact O-N 3.16Å
410	F	75	Confident	79.1	Confident	39 Å²	39	69 Å²	69	17%	0.171	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	151.3	-174.5	-62.1	-89.6	0	0	0	111.1	H401 C403 R408 Y412 L415 L416 H419	H401-F410 PolarHBondContact N-O 3.01Å; H401-F410 PolarHBondContact O-N 3.26Å; C403-F410 HydrophobicContact CB-CE2 4.27Å; R408-F410 HydrophobicContact CB-CE2 3.85Å; R408-F410 HydrophobicContact CB-CZ 4.02Å; R408-F410 VanDerWaalsContact O-CE2 3.29Å; R408-F410 WeakPolarHBondContact O-CE2 3.44Å; F410-Y412 VanDerWaalsContact C-N 3.3Å; F410-Y412 PolarHBondContact O-N 3.42Å; F410-L415 HydrophobicContact CB-CB 4.16Å; F410-L415 HydrophobicContact CD1-CB 3.97Å; F410-L415 HydrophobicContact CG-CB 4.37Å; F410-L416 HydrophobicContact CB-CB 4.19Å; F410-L416 HydrophobicContact CD2-CB 4.02Å; F410-L416 HydrophobicContact CD2-CD1 3.74Å; F410-L416 HydrophobicContact CD2-CG 4.49Å; F410-L416 HydrophobicContact CE2-CD1 4.05Å; F410-L416 HydrophobicContact CG-CB 4.24Å; F410-H419 HydrophobicContact CD1-CB 4.48Å; F410-H419 HydrophobicContact CE1-CB 3.73Å; F410-H419 AromaticContact CE1-CG 3.89Å; F410-H419 HydrophobicContact CE2-CB 3.78Å; F410-H419 AromaticContact CE2-CD2 3.17Å; F410-H419 WeakPolarHBondContact CE2-CD2 3.32Å; F410-H419 AromaticContact CE2-CG 3.45Å; F410-H419 VanDerWaalsContact CE2-CG 3.45Å; F410-H419 AromaticContact CE2-NE2 3.79Å; F410-H419 HydrophobicContact CZ-CB 3.35Å; F410-H419 AromaticContact CZ-CD2 3.27Å; F410-H419 WeakPolarHBondContact CZ-CD2 3.4Å; F410-H419 AromaticContact CZ-CE1 3.93Å; F410-H419 AromaticContact CZ-CG 3.04Å; F410-H419 AromaticContact CZ-ND1 3.51Å; F410-H419 AromaticContact CZ-NE2 3.77Å
411	A	73.2	Confident	80.2	Confident	25 Å²	25	65.9 Å²	65.9	21%	0.207	35%	0.354	C	S	.	.	S	Bend	trans	-70.6	-23.6	178.3	0	0	0	0	0	113.5	I390 S393	I390-A411 HydrophobicContact CG2-CB 4.1Å; S393-A411 VanDerWaalsContact OG-CB 3.28Å; S393-A411 WeakPolarHBondContact OG-CB 3.37Å
412	Y	72.7	Confident	80.7	Confident	89 Å²	89	67.7 Å²	67.7	35%	0.349	37%	0.368	S	S	.	.	S	Bend	trans	-139.4	153.6	-177	-67.5	-59.6	0	0	0	113.1	I390 F410 S414 L415 L416	I390-Y412 HydrophobicContact CD1-CE2 3.41Å; I390-Y412 VanDerWaalsContact CD1-CE2 3.41Å; I390-Y412 WeakPolarHBondContact CD1-OH 3.49Å; I390-Y412 HydrophobicContact CG1-CD2 4.46Å; I390-Y412 HydrophobicContact CG1-CE1 4.42Å; I390-Y412 HydrophobicContact CG1-CE2 3.3Å; I390-Y412 WeakPolarHBondContact CG1-OH 3.4Å; F410-Y412 VanDerWaalsContact C-N 3.3Å; F410-Y412 PolarHBondContact O-N 3.42Å; Y412-S414 PolarHBondContact O-N 3Å; Y412-L415 HydrophobicContact CD2-CD1 4.24Å; Y412-L415 PolarHBondContact O-N 3.06Å; Y412-L416 PolarHBondContact O-N 3.09Å; Y412-L416 VanDerWaalsContact O-N 3.09Å
413	P	79.5	Confident	81.2	Confident	77 Å²	77	69.5 Å²	69.5	50%	0.5	37%	0.369	S	S	.	.	H	α-helix	trans	-60.2	-32.3	171.2	-21.7	33	0	0	0	113.1	H401 L416 A417	H401-P413 WeakPolarHBondContact NE2-CD 3.37Å; P413-L416 PolarHBondContact O-N 3.33Å; P413-A417 VanDerWaalsContact O-CB 3.22Å; P413-A417 WeakPolarHBondContact O-CB 3.21Å; P413-A417 PolarHBondContact O-N 2.73Å
414	S	82.1	Confident	81.4	Confident	80 Å²	80	72.5 Å²	72.5	56%	0.559	39%	0.39	S	S	*	.	H	α-helix	trans	-69.3	-38.2	179.6	55.3	0	0	0	0	112.8	Y412 A417 S418	Y412-S414 PolarHBondContact O-N 3Å; S414-A417 PolarHBondContact O-N 3.14Å; S414-S418 WeakPolarHBondContact O-CB 3.46Å; S414-S418 PolarHBondContact O-N 2.74Å
415	L	79.7	Confident	81.3	Confident	88 Å²	88	68.9 Å²	68.9	46%	0.461	38%	0.383	S	S	.	.	H	α-helix	trans	-69.8	-41	174.3	-69	178.9	0	0	0	110.8	F410 Y412 S418 H419	F410-L415 HydrophobicContact CB-CB 4.16Å; F410-L415 HydrophobicContact CD1-CB 3.97Å; F410-L415 HydrophobicContact CG-CB 4.37Å; Y412-L415 HydrophobicContact CD2-CD1 4.24Å; Y412-L415 PolarHBondContact O-N 3.06Å; L415-S418 PolarHBondContact O-N 2.81Å; L415-H419 VanDerWaalsContact O-CB 3.28Å; L415-H419 WeakPolarHBondContact O-CB 3.17Å; L415-H419 PolarHBondContact O-N 3.14Å
416	L	83.8	Confident	81.5	Confident	13 Å²	13	69 Å²	69	7%	0.068	38%	0.38	C	S	.	.	H	α-helix	trans	-60.5	-46.4	171.4	174.3	60.8	0	0	0	111.3	H401 A402 C403 F410 Y412 P413 S418 H419 R420	H401-L416 HydrophobicContact CB-CB 4.21Å; H401-L416 HydrophobicContact CB-CD2 3.85Å; A402-L416 WeakPolarHBondContact O-CD2 3.45Å; C403-L416 HydrophobicContact CB-CD1 3.65Å; F410-L416 HydrophobicContact CB-CB 4.19Å; F410-L416 HydrophobicContact CD2-CB 4.02Å; F410-L416 HydrophobicContact CD2-CD1 3.74Å; F410-L416 HydrophobicContact CD2-CG 4.49Å; F410-L416 HydrophobicContact CE2-CD1 4.05Å; F410-L416 HydrophobicContact CG-CB 4.24Å; Y412-L416 PolarHBondContact O-N 3.09Å; Y412-L416 VanDerWaalsContact O-N 3.09Å; P413-L416 PolarHBondContact O-N 3.33Å; L416-S418 VanDerWaalsContact C-N 3.33Å; L416-S418 PolarHBondContact O-N 3.12Å; L416-H419 CarbonylContact O-C 3.58Å; L416-H419 WeakPolarHBondContact O-CA 3.14Å; L416-H419 WeakPolarHBondContact O-CB 3.33Å; L416-H419 PolarHBondContact O-N 3.5Å; L416-R420 HydrophobicContact CD1-CG 4.09Å; L416-R420 HydrophobicContact CG-CG 4.4Å; L416-R420 WeakPolarHBondContact O-CG 3.39Å; L416-R420 PolarHBondContact O-N 2.72Å
417	A	85.8	Confident	81.7	Confident	51 Å²	51	73.6 Å²	73.6	42%	0.421	39%	0.39	S	S	.	.	H	α-helix	trans	-61.2	-41.1	178.1	0	0	0	0	0	111.8	P413 S414 H419	P413-A417 VanDerWaalsContact O-CB 3.22Å; P413-A417 WeakPolarHBondContact O-CB 3.21Å; P413-A417 PolarHBondContact O-N 2.73Å; S414-A417 PolarHBondContact O-N 3.14Å; A417-H419 VanDerWaalsContact C-N 3.29Å; A417-H419 PolarHBondContact O-N 3.35Å
418	S	84.6	Confident	82	Confident	27 Å²	27	74 Å²	74	19%	0.189	38%	0.383	C	S	.	.	H	α-helix	trans	-67	-31.4	172.6	-176.2	0	0	0	0	112.6	S414 L415 L416 R421	S414-S418 WeakPolarHBondContact O-CB 3.46Å; S414-S418 PolarHBondContact O-N 2.74Å; L415-S418 PolarHBondContact O-N 2.81Å; L416-S418 VanDerWaalsContact C-N 3.33Å; L416-S418 PolarHBondContact O-N 3.12Å; S418-R421 WeakPolarHBondContact O-CB 3.26Å
419	H	84.5	Confident	82.6	Confident	15 Å²	15	69.9 Å²	69.9	7%	0.069	37%	0.368	C	S	.	.	H	α-helix	trans	-76.7	-38.3	178.7	168.7	68.6	0	0	0	112.6	C403 C406 F410 L415 L416 A417 R421 V422 H423	C403-H419 VanDerWaalsContact SG-CD2 3.55Å; C406-H419 PolarHBondContact SG-NE2 3.16Å; F410-H419 HydrophobicContact CD1-CB 4.48Å; F410-H419 HydrophobicContact CE1-CB 3.73Å; F410-H419 AromaticContact CE1-CG 3.89Å; F410-H419 HydrophobicContact CE2-CB 3.78Å; F410-H419 AromaticContact CE2-CD2 3.17Å; F410-H419 WeakPolarHBondContact CE2-CD2 3.32Å; F410-H419 AromaticContact CE2-CG 3.45Å; F410-H419 VanDerWaalsContact CE2-CG 3.45Å; F410-H419 AromaticContact CE2-NE2 3.79Å; F410-H419 HydrophobicContact CZ-CB 3.35Å; F410-H419 AromaticContact CZ-CD2 3.27Å; F410-H419 WeakPolarHBondContact CZ-CD2 3.4Å; F410-H419 AromaticContact CZ-CE1 3.93Å; F410-H419 AromaticContact CZ-CG 3.04Å; F410-H419 AromaticContact CZ-ND1 3.51Å; F410-H419 AromaticContact CZ-NE2 3.77Å; L415-H419 VanDerWaalsContact O-CB 3.28Å; L415-H419 WeakPolarHBondContact O-CB 3.17Å; L415-H419 PolarHBondContact O-N 3.14Å; L416-H419 CarbonylContact O-C 3.58Å; L416-H419 WeakPolarHBondContact O-CA 3.14Å; L416-H419 WeakPolarHBondContact O-CB 3.33Å; L416-H419 PolarHBondContact O-N 3.5Å; A417-H419 VanDerWaalsContact C-N 3.29Å; A417-H419 PolarHBondContact O-N 3.35Å; H419-R421 PolarHBondContact O-N 3.14Å; H419-V422 WeakPolarHBondContact O-CB 3.07Å; H419-V422 WeakPolarHBondContact O-CG2 3.42Å; H419-V422 PolarHBondContact O-N 2.82Å; H419-H423 AromaticContact CE1-NE2 3.87Å; H419-H423 AromaticContact NE2-CD2 3.96Å; H419-H423 AromaticContact NE2-NE2 3.49Å; H419-H423 PolarHBondContact NE2-NE2 3.44Å
420	R	86.3	Confident	83.3	Confident	110 Å²	110	66.8 Å²	66.8	42%	0.415	37%	0.365	S	S	.	.	H	α-helix	trans	-54.6	-25.7	175.2	-78.1	-179.8	170.2	177.9	-3.9	112.4	D404 L416 V422 H423 S424	D404-R420 IonicContact OD2-CZ 3.79Å; D404-R420 IonicContact OD2-NH2 3.34Å; D404-R420 PolarHBondContact OD2-NH2 3.48Å; L416-R420 HydrophobicContact CD1-CG 4.09Å; L416-R420 HydrophobicContact CG-CG 4.4Å; L416-R420 WeakPolarHBondContact O-CG 3.39Å; L416-R420 PolarHBondContact O-N 2.72Å; R420-V422 PolarHBondContact O-N 3.43Å; R420-H423 PolarHBondContact O-N 2.93Å; R420-S424 PolarHBondContact O-N 3.01Å; R420-S424 PolarHBondContact O-OG 2.89Å
421	R	87.9	Confident	84	Confident	58 Å²	58	65.3 Å²	65.3	22%	0.219	36%	0.36	C	S	.	.	H	α-helix	trans	-62	-21.3	171.7	-60.1	178.6	-172.7	178.7	-0.8	114.5	S418 H419 H423 S424 G425 E426 Y429 A439	S418-R421 WeakPolarHBondContact O-CB 3.26Å; H419-R421 PolarHBondContact O-N 3.14Å; R421-H423 VanDerWaalsContact C-N 3.33Å; R421-S424 WeakPolarHBondContact CA-OG 3.46Å; R421-G425 WeakPolarHBondContact O-CA 3.45Å; R421-G425 PolarHBondContact O-N 3.35Å; R421-E426 HydrophobicContact CG-CB 4.36Å; R421-E426 PolarHBondContact O-N 3.26Å; R421-Y429 PolarHBondContact NH1-OH 3.1Å; R421-A439 HydrophobicContact CB-CB 4.22Å; R421-A439 WeakPolarHBondContact CD-O 3.26Å; R421-A439 PolarHBondContact NH1-O 3.17Å
422	V	84.3	Confident	84.6	Confident	96 Å²	96	71.1 Å²	71.1	58%	0.582	39%	0.387	S	S	*	.	H	α-helix	trans	-69.4	-35.5	172.4	-178.9	0	0	0	0	110.5	H419 R420	H419-V422 WeakPolarHBondContact O-CB 3.07Å; H419-V422 WeakPolarHBondContact O-CG2 3.42Å; H419-V422 PolarHBondContact O-N 2.82Å; R420-V422 PolarHBondContact O-N 3.43Å
423	H	85.9	Confident	85	Confident	79 Å²	79	72.6 Å²	72.6	37%	0.366	40%	0.4	S	S	.	.	H	α-helix	trans	-83.1	-44.5	177	-63.6	-65.4	0	0	0	112.2	C403 D405 C406 H419 R420 R421 G425	C403-H423 PolarHBondContact SG-CD2 2.81Å; D405-H423 HydrophobicContact CB-CB 4.26Å; D405-H423 WeakPolarHBondContact OD2-CB 3.41Å; D405-H423 IonicContact OD2-CD2 3.36Å; D405-H423 IonicContact OD2-CG 3.7Å; C406-H423 PolarHBondContact SG-NE2 3.42Å; H419-H423 AromaticContact CE1-NE2 3.87Å; H419-H423 AromaticContact NE2-CD2 3.96Å; H419-H423 AromaticContact NE2-NE2 3.49Å; H419-H423 PolarHBondContact NE2-NE2 3.44Å; R420-H423 PolarHBondContact O-N 2.93Å; R421-H423 VanDerWaalsContact C-N 3.33Å; H423-G425 PolarHBondContact O-N 3.34Å
424	S	86.2	Confident	85.4	Confident	64 Å²	64	70.5 Å²	70.5	45%	0.448	39%	0.387	S	S	.	.	H	α-helix	trans	-73.1	-15	178.6	69.6	0	0	0	0	113.6	R420 R421 E426	R420-S424 PolarHBondContact O-N 3.01Å; R420-S424 PolarHBondContact O-OG 2.89Å; R421-S424 WeakPolarHBondContact CA-OG 3.46Å; S424-E426 PolarHBondContact O-N 2.73Å; S424-E426 WeakPolarHBondContact OG-CB 3.14Å; S424-E426 VanDerWaalsContact OG-CG 3.31Å; S424-E426 WeakPolarHBondContact OG-CG 3.45Å; S424-E426 PolarHBondContact OG-N 3.1Å; S424-E426 PolarHBondContact OG-OE1 3.24Å
425	G	82.5	Confident	85.6	Confident	51 Å²	51	72.9 Å²	72.9	53%	0.526	40%	0.404	S	S	.	.			trans	68.9	6.5	-175	0	0	0	0	0	113.8	R421 H423 R427	R421-G425 WeakPolarHBondContact O-CA 3.45Å; R421-G425 PolarHBondContact O-N 3.35Å; H423-G425 PolarHBondContact O-N 3.34Å; G425-R427 PolarHBondContact O-N 3.41Å
426	E	85.7	Confident	86	Confident	113 Å²	113	74.3 Å²	74.3	53%	0.528	41%	0.406	S	S	.	.			trans	-63.2	126.8	-178.6	-76.9	171.6	-143.1	0	0	111.5	R421 S424 P428	R421-E426 HydrophobicContact CG-CB 4.36Å; R421-E426 PolarHBondContact O-N 3.26Å; S424-E426 PolarHBondContact O-N 2.73Å; S424-E426 WeakPolarHBondContact OG-CB 3.14Å; S424-E426 VanDerWaalsContact OG-CG 3.31Å; S424-E426 WeakPolarHBondContact OG-CG 3.45Å; S424-E426 PolarHBondContact OG-N 3.1Å; S424-E426 PolarHBondContact OG-OE1 3.24Å; E426-P428 WeakPolarHBondContact O-CD 3.33Å
427	R	89	Confident	86.2	Confident	151 Å²	151	80.1 Å²	80.1	57%	0.57	43%	0.427	S	S	*	.			trans	-123	77.4	176.7	-69.8	173.1	159.3	-166.6	-0.2	110.2	G425 Y429 R437 F438 A439	G425-R427 PolarHBondContact O-N 3.41Å; R427-Y429 VanDerWaalsContact C-N 3.27Å; R427-Y429 PolarHBondContact O-N 3.04Å; R427-R437 HydrophobicContact CB-CB 3.64Å; R427-R437 WeakPolarHBondContact CD-O 2.99Å; R427-R437 PolarHBondContact O-NE 3.4Å; R427-R437 PolarHBondContact O-NH2 3.16Å; R427-F438 CarbonylContact C-O 3.59Å; R427-F438 WeakPolarHBondContact CA-O 3.37Å; R427-A439 HydrophobicContact CG-CB 4.48Å
428	P	84.9	Confident	86.4	Confident	58 Å²	58	79.7 Å²	79.7	38%	0.377	42%	0.416	S	S	.	.			trans	-64.6	-31.3	-175.1	-22.5	34.9	0	0	0	112.9	E426 A430	E426-P428 WeakPolarHBondContact O-CD 3.33Å; P428-A430 PolarHBondContact O-N 3.22Å
429	Y	88.7	Confident	86.5	Confident	78 Å²	78	79.4 Å²	79.4	31%	0.306	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	102.6	-172	-54.1	-73.2	0	0	0	110.7	R421 R427 R437 F438 A439 W441	R421-Y429 PolarHBondContact NH1-OH 3.1Å; R427-Y429 VanDerWaalsContact C-N 3.27Å; R427-Y429 PolarHBondContact O-N 3.04Å; Y429-R437 CarbonylContact O-C 3.48Å; Y429-R437 VanDerWaalsContact O-CA 3.27Å; Y429-R437 WeakPolarHBondContact O-CA 3.21Å; Y429-F438 WeakPolarHBondContact CD2-O 3.28Å; Y429-F438 PolarHBondContact N-O 2.9Å; Y429-F438 PolarHBondContact O-N 3.42Å; Y429-A439 WeakPolarHBondContact CE2-O 3.4Å; Y429-W441 HydrophobicContact CD1-CB 4.11Å; Y429-W441 HydrophobicContact CD2-CB 4.39Å; Y429-W441 VanDerWaalsContact CD2-N 3.32Å; Y429-W441 HydrophobicContact CE1-CB 3.89Å; Y429-W441 HydrophobicContact CE2-CB 4.14Å; Y429-W441 VanDerWaalsContact CE2-N 3.28Å; Y429-W441 HydrophobicContact CG-CB 4.36Å
430	A	87.8	Confident	86.5	Confident	40 Å²	40	81.7 Å²	81.7	33%	0.331	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	147	173.7	0	0	0	0	0	110.9	P428 R437 L444	P428-A430 PolarHBondContact O-N 3.22Å; A430-R437 HydrophobicContact CB-CG 3.98Å; A430-L444 VanDerWaalsContact O-CD2 3.28Å; A430-L444 WeakPolarHBondContact O-CD2 3.48Å
431	C	88	Confident	86.5	Confident	9 Å²	9	84.3 Å²	84.3	6%	0.061	44%	0.436	C	S	.	.			trans	-81.1	135.7	163.2	-176	0	0	0	0	109	L433 C434 K436 L444	C431-L433 VanDerWaalsContact C-N 3.34Å; C431-L433 PolarHBondContact SG-N 3.4Å; C431-C434 CarbonylContact C-O 3.57Å; C431-C434 WeakPolarHBondContact CB-O 3.47Å; C431-K436 PolarHBondContact N-O 3.37Å; C431-L444 HydrophobicContact CB-CD1 3.68Å
432	D	85.7	Confident	86.3	Confident	146 Å²	146	84.4 Å²	84.4	78%	0.781	45%	0.446	S	S	*	.	S	Bend	trans	-80.7	-21.4	178.2	-53.1	-48.6	0	0	0	112
433	L	82.5	Confident	86.5	Confident	120 Å²	120	83.8 Å²	83.8	63%	0.628	44%	0.436	S	S	*	.	S	Bend	trans	-92.4	-14.6	-178.9	-59.5	177.1	0	0	0	113.2	C431 H451	C431-L433 VanDerWaalsContact C-N 3.34Å; C431-L433 PolarHBondContact SG-N 3.4Å; L433-H451 HydrophobicContact CD1-CB 3.46Å; L433-H451 VanDerWaalsContact CD1-CB 3.46Å
434	C	88.3	Confident	86.6	Confident	34 Å²	34	80.6 Å²	80.6	23%	0.23	42%	0.422	C	S	.	.	S	Bend	trans	-152.7	160.8	172.7	78	0	0	0	0	111.6	C431 K436 H447	C431-C434 CarbonylContact C-O 3.57Å; C431-C434 WeakPolarHBondContact CB-O 3.47Å; C434-K436 PolarHBondContact O-N 2.83Å; C434-K436 VanDerWaalsContact SG-CB 3.59Å; C434-H447 PolarHBondContact SG-NE2 3.33Å
435	S	84.9	Confident	86.6	Confident	130 Å²	130	78.8 Å²	78.8	91%	0.909	41%	0.411	S	S	*	.	S	Bend	trans	-71.7	14.4	-177	-45.2	0	0	0	0	115.3
436	K	87.7	Confident	86.7	Confident	118 Å²	118	80.1 Å²	80.1	51%	0.513	40%	0.403	S	S	.	.			trans	-79.5	134.4	178.9	-67.1	-178.7	-179.1	178.8	0	110.4	C431 C434 F438	C431-K436 PolarHBondContact N-O 3.37Å; C434-K436 PolarHBondContact O-N 2.83Å; C434-K436 VanDerWaalsContact SG-CB 3.59Å; K436-F438 HydrophobicContact CB-CE2 3.85Å; K436-F438 HydrophobicContact CB-CZ 3.95Å
437	R	89.7	Confident	86.7	Confident	135 Å²	135	75.4 Å²	75.4	51%	0.509	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	147.2	175.6	-54.9	-180	68.7	146	5.2	110.2	R427 Y429 A430	R427-R437 HydrophobicContact CB-CB 3.64Å; R427-R437 WeakPolarHBondContact CD-O 2.99Å; R427-R437 PolarHBondContact O-NE 3.4Å; R427-R437 PolarHBondContact O-NH2 3.16Å; Y429-R437 CarbonylContact O-C 3.48Å; Y429-R437 VanDerWaalsContact O-CA 3.27Å; Y429-R437 WeakPolarHBondContact O-CA 3.21Å; A430-R437 HydrophobicContact CB-CG 3.98Å
438	F	88.5	Confident	86.5	Confident	41 Å²	41	71.3 Å²	71.3	18%	0.18	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	147.1	-175	-58.8	-89	0	0	0	111	R427 Y429 K436 Q440 H443 L444 H447	R427-F438 CarbonylContact C-O 3.59Å; R427-F438 WeakPolarHBondContact CA-O 3.37Å; Y429-F438 WeakPolarHBondContact CD2-O 3.28Å; Y429-F438 PolarHBondContact N-O 2.9Å; Y429-F438 PolarHBondContact O-N 3.42Å; K436-F438 HydrophobicContact CB-CE2 3.85Å; K436-F438 HydrophobicContact CB-CZ 3.95Å; F438-Q440 VanDerWaalsContact C-N 3.31Å; F438-H443 HydrophobicContact CB-CB 4.09Å; F438-H443 HydrophobicContact CD1-CB 3.66Å; F438-H443 HydrophobicContact CE1-CB 4.48Å; F438-H443 HydrophobicContact CG-CB 4.11Å; F438-L444 HydrophobicContact CB-CB 4.32Å; F438-L444 HydrophobicContact CD2-CB 3.84Å; F438-L444 HydrophobicContact CD2-CD1 3.83Å; F438-L444 HydrophobicContact CD2-CG 4.45Å; F438-L444 HydrophobicContact CE2-CD1 3.99Å; F438-L444 HydrophobicContact CG-CB 4.27Å; F438-H447 HydrophobicContact CE1-CB 3.99Å; F438-H447 HydrophobicContact CE2-CB 3.74Å; F438-H447 AromaticContact CE2-CD2 3.41Å; F438-H447 VanDerWaalsContact CE2-CD2 3.41Å; F438-H447 WeakPolarHBondContact CE2-CD2 3.3Å; F438-H447 AromaticContact CE2-CG 3.56Å; F438-H447 HydrophobicContact CZ-CB 3.34Å; F438-H447 AromaticContact CZ-CD2 3.58Å; F438-H447 AromaticContact CZ-CG 3.24Å; F438-H447 AromaticContact CZ-ND1 3.83Å
439	A	86.9	Confident	86.5	Confident	21 Å²	21	70.1 Å²	70.1	17%	0.174	36%	0.359	C	S	.	.	S	Bend	trans	-74.1	-25.1	176.6	0	0	0	0	0	112.6	R421 R427 Y429	R421-A439 HydrophobicContact CB-CB 4.22Å; R421-A439 WeakPolarHBondContact CD-O 3.26Å; R421-A439 PolarHBondContact NH1-O 3.17Å; R427-A439 HydrophobicContact CG-CB 4.48Å; Y429-A439 WeakPolarHBondContact CE2-O 3.4Å
440	Q	84.8	Confident	86.1	Confident	64 Å²	64	70.7 Å²	70.7	30%	0.299	37%	0.367	S	S	.	.	S	Bend	trans	-127.5	143.9	-177.2	-61.4	-177.3	6.8	0	0	110.9	F438 S442 H443 L444	F438-Q440 VanDerWaalsContact C-N 3.31Å; Q440-S442 VanDerWaalsContact C-N 3.33Å; Q440-S442 PolarHBondContact O-N 2.82Å; Q440-S442 PolarHBondContact OE1-OG 3.2Å; Q440-H443 PolarHBondContact O-N 3.45Å; Q440-L444 PolarHBondContact O-N 2.78Å
441	W	86.7	Confident	85.8	Confident	164 Å²	164	72.5 Å²	72.5	62%	0.621	37%	0.368	S	S	*	.	H	α-helix	trans	-64.6	-36.9	179	177.8	84.4	0	0	0	112.3	Y429 H443 L444 A445	Y429-W441 HydrophobicContact CD1-CB 4.11Å; Y429-W441 HydrophobicContact CD2-CB 4.39Å; Y429-W441 VanDerWaalsContact CD2-N 3.32Å; Y429-W441 HydrophobicContact CE1-CB 3.89Å; Y429-W441 HydrophobicContact CE2-CB 4.14Å; Y429-W441 VanDerWaalsContact CE2-N 3.28Å; Y429-W441 HydrophobicContact CG-CB 4.36Å; W441-H443 VanDerWaalsContact C-N 3.27Å; W441-H443 PolarHBondContact O-N 3.14Å; W441-L444 WeakPolarHBondContact O-CB 3.31Å; W441-L444 PolarHBondContact O-N 3.03Å; W441-L444 VanDerWaalsContact O-N 3.11Å; W441-A445 HydrophobicContact CE3-CB 4.47Å; W441-A445 HydrophobicContact CH2-CB 4.16Å; W441-A445 HydrophobicContact CZ2-CB 4.22Å; W441-A445 HydrophobicContact CZ3-CB 4.28Å; W441-A445 PolarHBondContact O-N 3.3Å
442	S	83.8	Confident	85.5	Confident	60 Å²	60	75.8 Å²	75.8	42%	0.42	39%	0.388	S	S	.	.	H	α-helix	trans	-56.9	-39.3	176.1	47.1	0	0	0	0	112.7	Q440 A445 Q446	Q440-S442 VanDerWaalsContact C-N 3.33Å; Q440-S442 PolarHBondContact O-N 2.82Å; Q440-S442 PolarHBondContact OE1-OG 3.2Å; S442-A445 PolarHBondContact O-N 3.02Å; S442-Q446 WeakPolarHBondContact O-CB 3.47Å; S442-Q446 PolarHBondContact O-N 2.88Å
443	H	88.9	Confident	85.1	Confident	83 Å²	83	70.7 Å²	70.7	38%	0.384	37%	0.37	S	S	.	.	H	α-helix	trans	-71.2	-36.8	177.1	-60	158	0	0	0	112	F438 Q440 W441 H447	F438-H443 HydrophobicContact CB-CB 4.09Å; F438-H443 HydrophobicContact CD1-CB 3.66Å; F438-H443 HydrophobicContact CE1-CB 4.48Å; F438-H443 HydrophobicContact CG-CB 4.11Å; Q440-H443 PolarHBondContact O-N 3.45Å; W441-H443 VanDerWaalsContact C-N 3.27Å; W441-H443 PolarHBondContact O-N 3.14Å; H443-H447 WeakPolarHBondContact O-CB 3.39Å; H443-H447 PolarHBondContact O-N 3.27Å
444	L	87.9	Confident	84.7	Confident	13 Å²	13	70.4 Å²	70.4	7%	0.068	37%	0.365	C	S	.	.	H	α-helix	trans	-63.5	-48.5	171.7	172.9	62.8	0	0	0	110.8	A430 C431 F438 Q440 W441 Q446 H447 Q448	A430-L444 VanDerWaalsContact O-CD2 3.28Å; A430-L444 WeakPolarHBondContact O-CD2 3.48Å; C431-L444 HydrophobicContact CB-CD1 3.68Å; F438-L444 HydrophobicContact CB-CB 4.32Å; F438-L444 HydrophobicContact CD2-CB 3.84Å; F438-L444 HydrophobicContact CD2-CD1 3.83Å; F438-L444 HydrophobicContact CD2-CG 4.45Å; F438-L444 HydrophobicContact CE2-CD1 3.99Å; F438-L444 HydrophobicContact CG-CB 4.27Å; Q440-L444 PolarHBondContact O-N 2.78Å; W441-L444 WeakPolarHBondContact O-CB 3.31Å; W441-L444 PolarHBondContact O-N 3.03Å; W441-L444 VanDerWaalsContact O-N 3.11Å; L444-Q446 VanDerWaalsContact C-N 3.33Å; L444-Q446 PolarHBondContact O-N 3.35Å; L444-H447 CarbonylContact O-C 3.59Å; L444-H447 WeakPolarHBondContact O-CA 3.23Å; L444-H447 WeakPolarHBondContact O-CB 3.26Å; L444-H447 PolarHBondContact O-N 3.17Å; L444-Q448 HydrophobicContact CD1-CG 4.06Å; L444-Q448 HydrophobicContact CG-CG 4.38Å; L444-Q448 WeakPolarHBondContact O-CG 3.49Å; L444-Q448 PolarHBondContact O-N 2.8Å
445	A	85.7	Confident	84.3	Confident	26 Å²	26	74.1 Å²	74.1	22%	0.215	38%	0.377	C	S	.	.	H	α-helix	trans	-59.2	-45.2	179.1	0	0	0	0	0	111.4	W441 S442 H447 Q448 L449	W441-A445 HydrophobicContact CE3-CB 4.47Å; W441-A445 HydrophobicContact CH2-CB 4.16Å; W441-A445 HydrophobicContact CZ2-CB 4.22Å; W441-A445 HydrophobicContact CZ3-CB 4.28Å; W441-A445 PolarHBondContact O-N 3.3Å; S442-A445 PolarHBondContact O-N 3.02Å; A445-H447 VanDerWaalsContact C-N 3.29Å; A445-H447 PolarHBondContact O-N 3.31Å; A445-Q448 PolarHBondContact O-N 3.33Å; A445-L449 PolarHBondContact O-N 3.09Å
446	Q	84.6	Confident	84	Confident	78 Å²	78	71.3 Å²	71.3	36%	0.364	36%	0.356	S	S	.	.	H	α-helix	trans	-62.5	-37.2	174.1	-174.5	-178.9	35.8	0	0	112.4	S442 L444 L449	S442-Q446 WeakPolarHBondContact O-CB 3.47Å; S442-Q446 PolarHBondContact O-N 2.88Å; L444-Q446 VanDerWaalsContact C-N 3.33Å; L444-Q446 PolarHBondContact O-N 3.35Å; Q446-L449 WeakPolarHBondContact O-CB 3.44Å; Q446-L449 PolarHBondContact O-N 2.75Å
447	H	84.9	Confident	83.7	Confident	15 Å²	15	68.9 Å²	68.9	7%	0.069	35%	0.346	C	S	.	.	H	α-helix	trans	-69	-37.4	176.5	167.8	64.7	0	0	0	112.5	C434 F438 H443 L444 A445 L449 L450 H451	C434-H447 PolarHBondContact SG-NE2 3.33Å; F438-H447 HydrophobicContact CE1-CB 3.99Å; F438-H447 HydrophobicContact CE2-CB 3.74Å; F438-H447 AromaticContact CE2-CD2 3.41Å; F438-H447 VanDerWaalsContact CE2-CD2 3.41Å; F438-H447 WeakPolarHBondContact CE2-CD2 3.3Å; F438-H447 AromaticContact CE2-CG 3.56Å; F438-H447 HydrophobicContact CZ-CB 3.34Å; F438-H447 AromaticContact CZ-CD2 3.58Å; F438-H447 AromaticContact CZ-CG 3.24Å; F438-H447 AromaticContact CZ-ND1 3.83Å; H443-H447 WeakPolarHBondContact O-CB 3.39Å; H443-H447 PolarHBondContact O-N 3.27Å; L444-H447 CarbonylContact O-C 3.59Å; L444-H447 WeakPolarHBondContact O-CA 3.23Å; L444-H447 WeakPolarHBondContact O-CB 3.26Å; L444-H447 PolarHBondContact O-N 3.17Å; A445-H447 VanDerWaalsContact C-N 3.29Å; A445-H447 PolarHBondContact O-N 3.31Å; H447-L449 PolarHBondContact O-N 2.97Å; H447-L450 WeakPolarHBondContact ND1-CD1 3.45Å; H447-L450 WeakPolarHBondContact O-CB 3.48Å; H447-L450 VanDerWaalsContact O-CG 3.26Å; H447-L450 WeakPolarHBondContact O-CG 3.36Å; H447-L450 PolarHBondContact O-N 3.09Å; H447-H451 AromaticContact CE1-NE2 3.78Å; H447-H451 AromaticContact NE2-CD2 3.81Å; H447-H451 AromaticContact NE2-NE2 3.45Å; H447-H451 PolarHBondContact NE2-NE2 3.02Å
448	Q	85.7	Confident	83.3	Confident	64 Å²	64	65.6 Å²	65.6	30%	0.299	34%	0.342	S	S	.	.	H	α-helix	trans	-62	-27.8	177.1	-75.5	172	-38.4	0	0	112.2	L444 A445 L450 H451 T452	L444-Q448 HydrophobicContact CD1-CG 4.06Å; L444-Q448 HydrophobicContact CG-CG 4.38Å; L444-Q448 WeakPolarHBondContact O-CG 3.49Å; L444-Q448 PolarHBondContact O-N 2.8Å; A445-Q448 PolarHBondContact O-N 3.33Å; Q448-L450 PolarHBondContact O-N 3.34Å; Q448-L450 VanDerWaalsContact O-N 3.12Å; Q448-H451 PolarHBondContact O-N 2.9Å; Q448-T452 PolarHBondContact O-N 3.48Å
449	L	84.4	Confident	82.9	Confident	34 Å²	34	63.7 Å²	63.7	18%	0.178	33%	0.334	C	S	.	.	H	α-helix	trans	-59.7	-20.9	170.1	-58.1	175.4	0	0	0	113.3	A445 Q446 H447 T452 G453 E454 P456 R467	A445-L449 PolarHBondContact O-N 3.09Å; Q446-L449 WeakPolarHBondContact O-CB 3.44Å; Q446-L449 PolarHBondContact O-N 2.75Å; H447-L449 PolarHBondContact O-N 2.97Å; L449-T452 WeakPolarHBondContact CA-OG1 3.35Å; L449-G453 PolarHBondContact O-N 3.2Å; L449-E454 HydrophobicContact CD2-CB 4.05Å; L449-P456 HydrophobicContact CD1-CG 4.27Å; L449-P456 HydrophobicContact CD2-CG 4.33Å; L449-R467 HydrophobicContact CB-CG 3.77Å; L449-R467 HydrophobicContact CD1-CG 4.18Å; L449-R467 VanDerWaalsContact O-CZ 3.27Å; L449-R467 PolarHBondContact O-NE 3.41Å; L449-R467 PolarHBondContact O-NH2 3.32Å
450	L	80.3	Confident	82.5	Confident	89 Å²	89	70.4 Å²	70.4	47%	0.466	37%	0.366	S	S	.	.	H	α-helix	trans	-68.2	-38	172.1	-57.2	-177.4	0	0	0	111.6	H447 Q448	H447-L450 WeakPolarHBondContact ND1-CD1 3.45Å; H447-L450 WeakPolarHBondContact O-CB 3.48Å; H447-L450 VanDerWaalsContact O-CG 3.26Å; H447-L450 WeakPolarHBondContact O-CG 3.36Å; H447-L450 PolarHBondContact O-N 3.09Å; Q448-L450 PolarHBondContact O-N 3.34Å; Q448-L450 VanDerWaalsContact O-N 3.12Å
451	H	82.2	Confident	82	Confident	79 Å²	79	74.3 Å²	74.3	37%	0.366	38%	0.384	S	S	.	.	H	α-helix	trans	-79.8	-41.6	-178.9	-71.2	-72	0	0	0	112.2	L433 H447 Q448 G453	L433-H451 HydrophobicContact CD1-CB 3.46Å; L433-H451 VanDerWaalsContact CD1-CB 3.46Å; H447-H451 AromaticContact CE1-NE2 3.78Å; H447-H451 AromaticContact NE2-CD2 3.81Å; H447-H451 AromaticContact NE2-NE2 3.45Å; H447-H451 PolarHBondContact NE2-NE2 3.02Å; Q448-H451 PolarHBondContact O-N 2.9Å; H451-G453 PolarHBondContact O-N 2.89Å
452	T	81.5	Confident	81.8	Confident	78 Å²	78	69.5 Å²	69.5	48%	0.479	38%	0.375	S	S	.	.	H	α-helix	trans	-75.4	-15.8	179.8	62.5	0	0	0	0	112.8	Q448 L449 E454	Q448-T452 PolarHBondContact O-N 3.48Å; L449-T452 WeakPolarHBondContact CA-OG1 3.35Å; T452-E454 PolarHBondContact O-N 2.94Å; T452-E454 VanDerWaalsContact O-N 3.15Å; T452-E454 PolarHBondContact OG1-N 3.15Å
453	G	76.3	Confident	81.6	Confident	38 Å²	38	69.2 Å²	69.2	39%	0.392	38%	0.381	S	S	.	.			trans	76.7	-10.1	-175.8	0	0	0	0	0	113.8	L449 H451	L449-G453 PolarHBondContact O-N 3.2Å; H451-G453 PolarHBondContact O-N 2.89Å
454	E	75.7	Confident	81.1	Confident	115 Å²	115	73 Å²	73	54%	0.537	39%	0.392	S	S	.	.			trans	-59.2	136.2	-174.4	-69.6	178.2	-167.7	0	0	112.2	L449 T452	L449-E454 HydrophobicContact CD2-CB 4.05Å; T452-E454 PolarHBondContact O-N 2.94Å; T452-E454 VanDerWaalsContact O-N 3.15Å; T452-E454 PolarHBondContact OG1-N 3.15Å
455	K	80	Confident	80.6	Confident	111 Å²	111	75 Å²	75	48%	0.483	41%	0.407	S	S	.	.			trans	-126.6	83.8	178.5	-63.2	-168.9	-164.4	172.1	0	109.1	F457 C465 F466 R467	K455-F457 PolarHBondContact O-N 2.99Å; K455-C465 HydrophobicContact CB-CB 3.53Å; K455-C465 HydrophobicContact CD-CB 4.27Å; K455-C465 WeakPolarHBondContact CD-O 3.48Å; K455-C465 WeakPolarHBondContact O-CB 3.45Å; K455-F466 CarbonylContact C-O 3.25Å; K455-F466 VanDerWaalsContact C-O 3.25Å; K455-F466 WeakPolarHBondContact CA-O 3.49Å; K455-R467 HydrophobicContact CG-CB 4.39Å
456	P	78.6	Confident	80.3	Confident	71 Å²	71	75.7 Å²	75.7	46%	0.461	41%	0.405	S	S	.	.			trans	-67.9	-9.1	-168.5	-21.8	33.7	0	0	0	115.6	L449 P458	L449-P456 HydrophobicContact CD1-CG 4.27Å; L449-P456 HydrophobicContact CD2-CG 4.33Å; P456-P458 WeakPolarHBondContact O-CD 3.46Å
457	F	81.4	Confident	80	Confident	67 Å²	67	75.4 Å²	75.4	29%	0.294	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	85.4	-172.3	-55.1	-77.4	0	0	0	111.2	K455 F466 R469 L472	K455-F457 PolarHBondContact O-N 2.99Å; F457-F466 HydrophobicContact CB-CB 4.34Å; F457-F466 WeakPolarHBondContact CB-O 3.33Å; F457-F466 WeakPolarHBondContact CD2-O 3.34Å; F457-F466 PolarHBondContact N-O 3.16Å; F457-F466 PolarHBondContact O-N 3.26Å; F457-R469 HydrophobicContact CD1-CB 4.21Å; F457-R469 HydrophobicContact CE1-CB 4Å; F457-R469 HydrophobicContact CZ-CB 4.18Å; F457-L472 HydrophobicContact CB-CB 4.43Å; F457-L472 HydrophobicContact CB-CD2 4.08Å
458	P	81.1	Confident	79.7	Confident	66 Å²	66	78.8 Å²	78.8	43%	0.429	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	138.3	173.7	29.2	-33.8	0	0	0	111.6	P456	P456-P458 WeakPolarHBondContact O-CD 3.46Å
459	C	79.4	Confident	79.3	Confident	2 Å²	2	84.9 Å²	84.9	1%	0.014	44%	0.436	C	S	.	.			trans	-78.3	116.6	163.5	-173.3	0	0	0	0	109	E461 C462 G463 R464 F466 L472	C459-E461 PolarHBondContact O-N 2.9Å; C459-C462 VanDerWaalsContact CB-SG 3.56Å; C459-C462 VanDerWaalsContact SG-SG 3.62Å; C459-G463 VanDerWaalsContact O-CA 3.23Å; C459-G463 WeakPolarHBondContact O-CA 3.42Å; C459-G463 PolarHBondContact O-N 3.32Å; C459-R464 WeakPolarHBondContact CB-O 3.32Å; C459-R464 PolarHBondContact N-O 2.83Å; C459-F466 HydrophobicContact CB-CE2 4.15Å; C459-L472 HydrophobicContact CB-CD1 3.46Å; C459-L472 VanDerWaalsContact CB-CD1 3.46Å
460	L	78.6	Confident	79	Confident	161 Å²	161	92.3 Å²	92.3	84%	0.843	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-20	178.9	-61.7	175.5	0	0	0	113.3
461	E	74.8	Confident	79	Confident	147 Å²	147	90.3 Å²	90.3	69%	0.687	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-30.5	-177	-70.5	152.1	-133.1	0	0	113.1	C459 K476	C459-E461 PolarHBondContact O-N 2.9Å; E461-K476 IonicContact OE1-NZ 2.71Å; E461-K476 PolarHBondContact OE1-NZ 3.12Å
462	C	82.9	Confident	78.9	Confident	63 Å²	63	87.6 Å²	87.6	43%	0.426	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	2.1	-176.3	75	0	0	0	0	114.6	C459 R464 H475	C459-C462 VanDerWaalsContact CB-SG 3.56Å; C459-C462 VanDerWaalsContact SG-SG 3.62Å; C462-R464 PolarHBondContact O-N 3.39Å; C462-R464 VanDerWaalsContact O-N 3.07Å; C462-R464 VanDerWaalsContact SG-CB 3.58Å; C462-R464 VanDerWaalsContact SG-CG 3.55Å; C462-R464 PolarHBondContact SG-N 2.87Å; C462-H475 PolarHBondContact SG-NE2 3.38Å
463	G	78.4	Confident	78.7	Confident	53 Å²	53	85.8 Å²	85.8	55%	0.546	44%	0.436	S	S	.	.			trans	71.6	-5.9	-179	0	0	0	0	0	115.6	C459 C465	C459-G463 VanDerWaalsContact O-CA 3.23Å; C459-G463 WeakPolarHBondContact O-CA 3.42Å; C459-G463 PolarHBondContact O-N 3.32Å; G463-C465 PolarHBondContact O-N 2.91Å
464	R	78.3	Confident	78.7	Confident	162 Å²	162	87 Å²	87	61%	0.611	44%	0.436	S	S	*	.			trans	-65.4	123.3	-179.2	-68.6	-179.9	-177.2	-144.5	0.7	110.8	C459 C462 F466	C459-R464 WeakPolarHBondContact CB-O 3.32Å; C459-R464 PolarHBondContact N-O 2.83Å; C462-R464 PolarHBondContact O-N 3.39Å; C462-R464 VanDerWaalsContact O-N 3.07Å; C462-R464 VanDerWaalsContact SG-CB 3.58Å; C462-R464 VanDerWaalsContact SG-CG 3.55Å; C462-R464 PolarHBondContact SG-N 2.87Å; R464-F466 HydrophobicContact CB-CE2 3.69Å; R464-F466 HydrophobicContact CB-CZ 3.91Å; R464-F466 VanDerWaalsContact O-CD2 3.27Å; R464-F466 WeakPolarHBondContact O-CD2 3.48Å; R464-F466 VanDerWaalsContact O-CE2 3.23Å; R464-F466 WeakPolarHBondContact O-CE2 3.41Å
465	C	77.3	Confident	78.9	Confident	57 Å²	57	83.9 Å²	83.9	39%	0.385	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	135	175.5	-59.4	0	0	0	0	110.9	K455 G463	K455-C465 HydrophobicContact CB-CB 3.53Å; K455-C465 HydrophobicContact CD-CB 4.27Å; K455-C465 WeakPolarHBondContact CD-O 3.48Å; K455-C465 WeakPolarHBondContact O-CB 3.45Å; G463-C465 PolarHBondContact O-N 2.91Å
466	F	79.4	Confident	78.6	Confident	39 Å²	39	82.6 Å²	82.6	17%	0.171	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	148.8	178.7	-62.5	-90.2	0	0	0	110.6	K455 F457 C459 R464 L472 H475	K455-F466 CarbonylContact C-O 3.25Å; K455-F466 VanDerWaalsContact C-O 3.25Å; K455-F466 WeakPolarHBondContact CA-O 3.49Å; F457-F466 HydrophobicContact CB-CB 4.34Å; F457-F466 WeakPolarHBondContact CB-O 3.33Å; F457-F466 WeakPolarHBondContact CD2-O 3.34Å; F457-F466 PolarHBondContact N-O 3.16Å; F457-F466 PolarHBondContact O-N 3.26Å; C459-F466 HydrophobicContact CB-CE2 4.15Å; R464-F466 HydrophobicContact CB-CE2 3.69Å; R464-F466 HydrophobicContact CB-CZ 3.91Å; R464-F466 VanDerWaalsContact O-CD2 3.27Å; R464-F466 WeakPolarHBondContact O-CD2 3.48Å; R464-F466 VanDerWaalsContact O-CE2 3.23Å; R464-F466 WeakPolarHBondContact O-CE2 3.41Å; F466-L472 HydrophobicContact CB-CB 4.16Å; F466-L472 HydrophobicContact CD2-CB 3.83Å; F466-L472 HydrophobicContact CD2-CD1 3.71Å; F466-L472 HydrophobicContact CD2-CG 4.36Å; F466-L472 HydrophobicContact CE2-CD1 3.86Å; F466-L472 HydrophobicContact CG-CB 4.1Å; F466-H475 HydrophobicContact CE1-CB 3.93Å; F466-H475 HydrophobicContact CE2-CB 4.01Å; F466-H475 AromaticContact CE2-CD2 3.45Å; F466-H475 VanDerWaalsContact CE2-CD2 3.45Å; F466-H475 WeakPolarHBondContact CE2-CD2 3.44Å; F466-H475 AromaticContact CE2-CG 3.76Å; F466-H475 HydrophobicContact CZ-CB 3.45Å; F466-H475 VanDerWaalsContact CZ-CB 3.45Å; F466-H475 AromaticContact CZ-CD2 3.46Å; F466-H475 VanDerWaalsContact CZ-CD2 3.46Å; F466-H475 WeakPolarHBondContact CZ-CD2 3.42Å; F466-H475 AromaticContact CZ-CG 3.28Å; F466-H475 AromaticContact CZ-ND1 3.91Å
467	R	78.7	Confident	77.9	Confident	73 Å²	73	84.2 Å²	84.2	28%	0.275	43%	0.428	S	S	.	.	S	Bend	trans	-83.3	-19.4	179.5	-161.4	174.3	-80.1	157.9	-12.4	112.5	L449 K455	L449-R467 HydrophobicContact CB-CG 3.77Å; L449-R467 HydrophobicContact CD1-CG 4.18Å; L449-R467 VanDerWaalsContact O-CZ 3.27Å; L449-R467 PolarHBondContact O-NE 3.41Å; L449-R467 PolarHBondContact O-NH2 3.32Å; K455-R467 HydrophobicContact CG-CB 4.39Å
468	Q	78	Confident	76.8	Confident	85 Å²	85	84.8 Å²	84.8	40%	0.397	44%	0.439	S	S	.	.	S	Bend	trans	-130.9	144.6	177.7	-53.7	-170.4	8.7	0	0	110.8	W470 S471 L472	Q468-W470 VanDerWaalsContact C-N 3.28Å; Q468-W470 PolarHBondContact O-N 2.88Å; Q468-S471 PolarHBondContact O-N 3.49Å; Q468-L472 PolarHBondContact O-N 3.05Å
469	R	78	Confident	75.5	Confident	192 Å²	192	86.5 Å²	86.5	73%	0.725	45%	0.45	S	S	*	.	H	α-helix	trans	-60	-36.5	176.4	-171	-179.6	178.7	104.2	1	112.6	F457 L472 A473	F457-R469 HydrophobicContact CD1-CB 4.21Å; F457-R469 HydrophobicContact CE1-CB 4Å; F457-R469 HydrophobicContact CZ-CB 4.18Å; R469-L472 PolarHBondContact O-N 3.3Å; R469-A473 PolarHBondContact O-N 2.98Å
470	W	77.5	Confident	73.9	Confident	191 Å²	191	93.1 Å²	93.1	72%	0.723	49%	0.486	S	S	*	.	H	α-helix	trans	-63.7	-41	176.8	176.8	-95.1	0	0	0	112.3	Q468 L472 A473 V474	Q468-W470 VanDerWaalsContact C-N 3.28Å; Q468-W470 PolarHBondContact O-N 2.88Å; W470-L472 VanDerWaalsContact C-N 3.3Å; W470-L472 PolarHBondContact O-N 3.21Å; W470-A473 WeakPolarHBondContact O-CB 3.44Å; W470-A473 PolarHBondContact O-N 3.38Å; W470-V474 HydrophobicContact CD2-CG2 4.24Å; W470-V474 HydrophobicContact CG-CG2 4.41Å; W470-V474 HydrophobicContact CZ2-CG2 3.97Å; W470-V474 WeakPolarHBondContact O-CG2 3.35Å; W470-V474 PolarHBondContact O-N 3.32Å
471	S	81.2	Confident	72.1	Confident	46 Å²	46	92 Å²	92	32%	0.322	49%	0.485	S	S	.	.	H	α-helix	trans	-63.1	-37.2	177.3	-51.8	0	0	0	0	112.3	Q468 H475	Q468-S471 PolarHBondContact O-N 3.49Å; S471-H475 VanDerWaalsContact O-CB 3.24Å; S471-H475 WeakPolarHBondContact O-CB 3.41Å; S471-H475 PolarHBondContact O-N 3.16Å
472	L	78.7	Confident	70.4	Confident	22 Å²	22	92.9 Å²	92.9	12%	0.115	49%	0.489	C	S	.	.	H	α-helix	trans	-65.9	-41.1	170.8	174.8	62.5	0	0	0	111.6	F457 C459 F466 Q468 R469 W470 H475 K476	F457-L472 HydrophobicContact CB-CB 4.43Å; F457-L472 HydrophobicContact CB-CD2 4.08Å; C459-L472 HydrophobicContact CB-CD1 3.46Å; C459-L472 VanDerWaalsContact CB-CD1 3.46Å; F466-L472 HydrophobicContact CB-CB 4.16Å; F466-L472 HydrophobicContact CD2-CB 3.83Å; F466-L472 HydrophobicContact CD2-CD1 3.71Å; F466-L472 HydrophobicContact CD2-CG 4.36Å; F466-L472 HydrophobicContact CE2-CD1 3.86Å; F466-L472 HydrophobicContact CG-CB 4.1Å; Q468-L472 PolarHBondContact O-N 3.05Å; R469-L472 PolarHBondContact O-N 3.3Å; W470-L472 VanDerWaalsContact C-N 3.3Å; W470-L472 PolarHBondContact O-N 3.21Å; L472-H475 WeakPolarHBondContact O-CB 3.3Å; L472-H475 PolarHBondContact O-N 2.73Å; L472-K476 HydrophobicContact CD1-CD 4.41Å; L472-K476 HydrophobicContact CD1-CG 4.33Å; L472-K476 HydrophobicContact CG-CD 4.41Å; L472-K476 WeakPolarHBondContact O-CG 3.34Å; L472-K476 PolarHBondContact O-N 3.47Å
473	A	77.5	Confident	68.1	Low	40 Å²	40	97.3 Å²	97.3	33%	0.331	51%	0.509	S	S	.	.	H	α-helix	trans	-63.3	-46.7	178.5	0	0	0	0	0	112.1	R469 W470 H475 K476 C477	R469-A473 PolarHBondContact O-N 2.98Å; W470-A473 WeakPolarHBondContact O-CB 3.44Å; W470-A473 PolarHBondContact O-N 3.38Å; A473-H475 VanDerWaalsContact C-N 3.3Å; A473-H475 PolarHBondContact O-N 2.84Å; A473-K476 PolarHBondContact O-N 3.41Å; A473-C477 PolarHBondContact O-N 2.77Å; A473-C477 PolarHBondContact O-SG 3.21Å
474	V	77.2	Confident	65.9	Low	63 Å²	63	98.3 Å²	98.3	38%	0.382	52%	0.519	S	S	.	.	H	α-helix	trans	-61.1	-41.2	174.4	174.6	0	0	0	0	110.9	W470 K476 C477 C478	W470-V474 HydrophobicContact CD2-CG2 4.24Å; W470-V474 HydrophobicContact CG-CG2 4.41Å; W470-V474 HydrophobicContact CZ2-CG2 3.97Å; W470-V474 WeakPolarHBondContact O-CG2 3.35Å; W470-V474 PolarHBondContact O-N 3.32Å; V474-K476 VanDerWaalsContact C-N 3.33Å; V474-K476 PolarHBondContact O-N 2.8Å; V474-C477 PolarHBondContact O-N 3.3Å; V474-C478 PolarHBondContact O-N 2.86Å
475	H	78.9	Confident	63.7	Low	51 Å²	51	96 Å²	96	24%	0.236	53%	0.528	C	S	.	.	H	α-helix	trans	-61.9	-38.4	175.8	172	60.5	0	0	0	113	C462 F466 S471 L472 A473	C462-H475 PolarHBondContact SG-NE2 3.38Å; F466-H475 HydrophobicContact CE1-CB 3.93Å; F466-H475 HydrophobicContact CE2-CB 4.01Å; F466-H475 AromaticContact CE2-CD2 3.45Å; F466-H475 VanDerWaalsContact CE2-CD2 3.45Å; F466-H475 WeakPolarHBondContact CE2-CD2 3.44Å; F466-H475 AromaticContact CE2-CG 3.76Å; F466-H475 HydrophobicContact CZ-CB 3.45Å; F466-H475 VanDerWaalsContact CZ-CB 3.45Å; F466-H475 AromaticContact CZ-CD2 3.46Å; F466-H475 VanDerWaalsContact CZ-CD2 3.46Å; F466-H475 WeakPolarHBondContact CZ-CD2 3.42Å; F466-H475 AromaticContact CZ-CG 3.28Å; F466-H475 AromaticContact CZ-ND1 3.91Å; S471-H475 VanDerWaalsContact O-CB 3.24Å; S471-H475 WeakPolarHBondContact O-CB 3.41Å; S471-H475 PolarHBondContact O-N 3.16Å; L472-H475 WeakPolarHBondContact O-CB 3.3Å; L472-H475 PolarHBondContact O-N 2.73Å; A473-H475 VanDerWaalsContact C-N 3.3Å; A473-H475 PolarHBondContact O-N 2.84Å
476	K	75.5	Confident	61.7	Low	83 Å²	83	99.2 Å²	99.2	36%	0.361	55%	0.548	S	S	.	.	H	α-helix	trans	-71.7	-33.3	173.9	-75	177.8	167.8	-90.4	0	113.1	E461 L472 A473 V474 C478	E461-K476 IonicContact OE1-NZ 2.71Å; E461-K476 PolarHBondContact OE1-NZ 3.12Å; L472-K476 HydrophobicContact CD1-CD 4.41Å; L472-K476 HydrophobicContact CD1-CG 4.33Å; L472-K476 HydrophobicContact CG-CD 4.41Å; L472-K476 WeakPolarHBondContact O-CG 3.34Å; L472-K476 PolarHBondContact O-N 3.47Å; A473-K476 PolarHBondContact O-N 3.41Å; V474-K476 VanDerWaalsContact C-N 3.33Å; V474-K476 PolarHBondContact O-N 2.8Å; K476-C478 VanDerWaalsContact C-N 3.34Å
477	C	63.7	Low	59.6	Low	105 Å²	105	108.5 Å²	108.5	71%	0.709	58%	0.582	S	S	*	*	H	α-helix	trans	-75.6	-20.6	178.8	-70.7	0	0	0	0	113.5	A473 V474 P479	A473-C477 PolarHBondContact O-N 2.77Å; A473-C477 PolarHBondContact O-SG 3.21Å; V474-C477 PolarHBondContact O-N 3.3Å; C477-P479 WeakPolarHBondContact O-CD 3.37Å
478	C	57.7	Low	57.4	Low	80 Å²	80	110.6 Å²	110.6	54%	0.541	61%	0.605	S	S	.	*			trans	-120.7	83.8	177.1	-63	0	0	0	0	110.9	V474 K476 N480	V474-C478 PolarHBondContact O-N 2.86Å; K476-C478 VanDerWaalsContact C-N 3.34Å; C478-N480 PolarHBondContact O-N 3.29Å
479	P	54.7	Low	55.4	Low	101 Å²	101	114.9 Å²	114.9	66%	0.656	63%	0.629	S	S	*	*			trans	-70.4	-12.7	-179.6	-17.3	31.1	0	0	0	114.9	C477	C477-P479 WeakPolarHBondContact O-CD 3.37Å
480	N	44	Very low	53.4	Low	141 Å²	141	113.7 Å²	113.7	75%	0.754	64%	0.636	S	S	*	*			trans	-120.8	83.4	-170.8	-81.9	-12.4	0	0	0	113.4	C478	C478-N480 PolarHBondContact O-N 3.29Å
481	T	41.6	Very low	51.2	Low	137 Å²	137	107.8 Å²	107.8	84%	0.84	64%	0.635	S	S	*	*			trans	-139.6	77.6	144.4	58.7	0	0	0	0	107.5
482	H	39	Very low	48.9	Very low	166 Å²	166	108.8 Å²	108.8	77%	0.769	65%	0.652	S	S	*	*			trans	-76.7	142.2	163.8	-95.4	-84.6	0	0	0	109.7
483	N	35.5	Very low	46.9	Very low	157 Å²	157	113.2 Å²	113.2	84%	0.84	68%	0.682	S	S	*	*	S	Bend	trans	76.6	122	170.6	-81.4	-3	0	0	0	119.6
484	G	31.2	Very low	44.7	Very low	74 Å²	74	118.6 Å²	118.6	76%	0.763	71%	0.705	S	S	*	*			trans	-63.9	144.6	176.8	0	0	0	0	0	112.2
485	S	32.3	Very low	42.8	Very low	112 Å²	112	123.5 Å²	123.5	78%	0.783	72%	0.724	S	S	*	*			trans	-133.4	123.4	144.4	-75	0	0	0	0	105.9	R487	S485-R487 PolarHBondContact O-N 2.97Å
486	P	36.1	Very low	40.6	Very low	126 Å²	126	132.4 Å²	132.4	82%	0.818	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-58.8	125.6	172.3	-16	28.5	0	0	0	108.3
487	R	34.8	Very low	38.7	Very low	234 Å²	234	133.3 Å²	133.3	88%	0.883	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-53.4	127.7	173.6	-104.9	177.1	168.6	-123.9	-0.9	109.3	S485 L489	S485-R487 PolarHBondContact O-N 2.97Å; R487-L489 PolarHBondContact O-N 2.91Å
488	P	32.5	Very low	37.1	Very low	116 Å²	116	134.2 Å²	134.2	75%	0.753	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-64.4	136	176.1	-16.2	29	0	0	0	110.3	I490	P488-I490 PolarHBondContact O-N 3.22Å; P488-I490 VanDerWaalsContact O-N 3.14Å
489	L	35.5	Very low	35.9	Very low	175 Å²	175	134.9 Å²	134.9	92%	0.916	79%	0.791	S	S	*	*			trans	-60.1	112.1	168.4	-73	163.9	0	0	0	108.3	R487 G491	R487-L489 PolarHBondContact O-N 2.91Å; L489-G491 PolarHBondContact O-N 3.33Å
490	I	37.3	Very low	35.2	Very low	167 Å²	167	142.2 Å²	142.2	86%	0.856	82%	0.824	S	S	*	*			trans	-70.1	85.9	167.9	-60	175.4	0	0	0	106.6	P488	P488-I490 PolarHBondContact O-N 3.22Å; P488-I490 VanDerWaalsContact O-N 3.14Å
491	G	31	Very low	34.7	Very low	68 Å²	68	142.3 Å²	142.3	70%	0.701	83%	0.827	S	S	*	*			trans	-85	100.1	158.5	0	0	0	0	0	107.9	L489 P493	L489-G491 PolarHBondContact O-N 3.33Å; G491-P493 WeakPolarHBondContact O-CD 3.41Å
492	G	32.4	Very low	34.4	Very low	66 Å²	66	142.6 Å²	142.6	68%	0.68	83%	0.826	S	S	*	*			trans	-74.4	121.8	170.8	0	0	0	0	0	110
493	P	37.2	Very low	34.1	Very low	116 Å²	116	141.3 Å²	141.3	75%	0.753	83%	0.83	S	S	*	*			trans	-78.5	124.1	-179.2	29.8	-30.2	0	0	0	110.5	G491 Q495	G491-P493 WeakPolarHBondContact O-CD 3.41Å; P493-Q495 PolarHBondContact O-N 3Å
494	N	30.6	Very low	34	Very low	153 Å²	153	140.4 Å²	140.4	82%	0.818	83%	0.829	S	S	*	*			trans	-87.2	85.4	169.1	-160.5	7.1	0	0	0	107.3
495	Q	38.2	Very low	34.2	Very low	165 Å²	165	144.5 Å²	144.5	77%	0.771	83%	0.833	S	S	*	*			trans	-112.7	99.7	166.3	-72.7	-165.3	30.7	0	0	108.7	P493 S497	P493-Q495 PolarHBondContact O-N 3Å; Q495-S497 PolarHBondContact O-N 3.49Å
496	R	32.4	Very low	34.3	Very low	238 Å²	238	146.7 Å²	146.7	90%	0.898	84%	0.837	S	S	*	*			trans	-64.8	118.3	155	-79.8	174.4	170.1	175.6	-5.1	107.3
497	S	35.2	Very low	34.2	Very low	102 Å²	102	148.1 Å²	148.1	71%	0.713	84%	0.838	S	S	*	*			trans	-128.5	106.3	161	-56	0	0	0	0	107.4	Q495	Q495-S497 PolarHBondContact O-N 3.49Å
498	S	29.7	Very low	34.2	Very low	125 Å²	125	141.5 Å²	141.5	87%	0.874	83%	0.834	S	S	*	*			trans	-55.8	135.8	160.3	-46	0	0	0	0	109.7
499	A	33.2	Very low	34.3	Very low	94 Å²	94	143.7 Å²	143.7	78%	0.777	84%	0.841	S	S	*	*			trans	-156.6	122	154.4	0	0	0	0	0	109.4
500	L	38.8	Very low	34.2	Very low	255 Å²	255	140.8 Å²	140.8	100%	1.335	83%	0.834	S	S	*	*			trans	74.7	0	167.6	-58.9	169.8	0	0	0	117

Retrieved 500 of 500 residues in 398.5 ms (Link to these results)

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