A0A096NNJ8_PAPAN Loading...

Glucosaminyl (N-acetyl) transferase family member 7

AlphaFold DB , UniProt , Accession A0A096NNJ8, Species PAPAN (Papio anubis, Olive baboon), Gene GCNT7, Length 409 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	40.8	Very low	251 Å²	251	145.7 Å²	145.7	100%	1.236	77%	0.774	S	S	*	*				0	105.9	0	-66.4	168.3	87.6	0	0	106.3
2	S	29.1	Very low	41.8	Very low	123 Å²	123	141.1 Å²	141.1	86%	0.86	76%	0.755	S	S	*	*				-156.5	131.8	84.5	179.7	0	0	0	0	110.8
3	Q	31.6	Very low	42.8	Very low	177 Å²	177	137 Å²	137	83%	0.827	74%	0.738	S	S	*	*			trans	-69.2	126.6	176.3	-74	-87.7	1.2	0	0	110.3	R5	Q3-R5 PolarHBondContact O-N 3Å; Q3-R5 VanDerWaalsContact O-N 3.07Å
4	L	38.9	Very low	43.6	Very low	167 Å²	167	132.3 Å²	132.3	87%	0.874	72%	0.72	S	S	*	*			trans	-68.6	102.6	167.1	-95.2	147.5	0	0	0	108.8	V6	L4-V6 PolarHBondContact O-N 2.92Å
5	R	37.5	Very low	44.4	Very low	230 Å²	230	126.7 Å²	126.7	87%	0.868	70%	0.699	S	S	*	*			trans	-63	103.1	167.7	-87.4	-178.4	-177.5	175.5	1.4	109.1	Q3 T7	Q3-R5 PolarHBondContact O-N 3Å; Q3-R5 VanDerWaalsContact O-N 3.07Å; R5-T7 PolarHBondContact O-N 3Å
6	V	41.3	Very low	45.6	Very low	110 Å²	110	122.9 Å²	122.9	67%	0.667	68%	0.68	S	S	*	*			trans	-69.6	108.7	157.4	179.7	0	0	0	0	106.7	L4 K8 L11	L4-V6 PolarHBondContact O-N 2.92Å; V6-K8 PolarHBondContact O-N 2.87Å; V6-L11 HydrophobicContact CG1-CD1 3.85Å
7	T	41.7	Very low	46.4	Very low	98 Å²	98	121.1 Å²	121.1	60%	0.601	67%	0.668	S	S	*	*			trans	-68	127	176	43.7	0	0	0	0	109.2	R5 S9 G10	R5-T7 PolarHBondContact O-N 3Å; T7-S9 PolarHBondContact O-N 3.26Å; T7-G10 PolarHBondContact O-N 3.06Å; T7-G10 VanDerWaalsContact O-N 3.08Å
8	K	47.3	Very low	46.9	Very low	187 Å²	187	118.6 Å²	118.6	81%	0.813	66%	0.659	S	S	*	*	H	α-helix	trans	-52.3	-19.4	-179.1	-79.3	-179.8	172.9	-179.8	0	114.2	V6 V12	V6-K8 PolarHBondContact O-N 2.87Å; K8-V12 WeakPolarHBondContact O-CG2 3.48Å
9	S	46.2	Very low	47.7	Very low	93 Å²	93	117.5 Å²	117.5	65%	0.65	65%	0.651	S	S	*	*	H	α-helix	trans	-75.2	-27	178.8	-52.4	0	0	0	0	114.3	T7 V13	T7-S9 PolarHBondContact O-N 3.26Å; S9-V13 WeakPolarHBondContact O-CG2 3.49Å; S9-V13 PolarHBondContact O-N 3.32Å
10	G	48.1	Very low	48	Very low	47 Å²	47	118.8 Å²	118.8	49%	0.485	65%	0.65	S	S	.	*	H	α-helix	trans	-76.3	-32.2	-178.9	0	0	0	0	0	114.3	T7 S14	T7-G10 PolarHBondContact O-N 3.06Å; T7-G10 VanDerWaalsContact O-N 3.08Å; G10-S14 PolarHBondContact O-N 3.46Å
11	L	49.2	Very low	48.3	Very low	120 Å²	120	117.6 Å²	117.6	63%	0.628	64%	0.642	S	S	*	*	H	α-helix	trans	-72.2	-33.2	176.4	-95.5	151.7	0	0	0	112.5	V6 A15	V6-L11 HydrophobicContact CG1-CD1 3.85Å; L11-A15 WeakPolarHBondContact O-CB 3.41Å; L11-A15 PolarHBondContact O-N 2.92Å; L11-A15 VanDerWaalsContact O-N 3.11Å
12	V	52.9	Low	49.1	Very low	90 Å²	90	111.8 Å²	111.8	55%	0.545	61%	0.61	S	S	.	*	H	α-helix	trans	-72.3	-39.9	178.9	178.2	0	0	0	0	111.1	K8 A15 V16	K8-V12 WeakPolarHBondContact O-CG2 3.48Å; V12-A15 PolarHBondContact O-N 2.8Å; V12-V16 HydrophobicContact CG1-CG2 4.39Å; V12-V16 WeakPolarHBondContact O-CB 3.24Å; V12-V16 VanDerWaalsContact O-CG2 3.22Å; V12-V16 WeakPolarHBondContact O-CG2 3.47Å; V12-V16 PolarHBondContact O-N 2.8Å
13	V	55.5	Low	50.2	Low	88 Å²	88	110.6 Å²	110.6	53%	0.533	59%	0.594	S	S	.	*	H	α-helix	trans	-66.5	-39.9	178.1	176.7	0	0	0	0	111.5	S9 V16 I17	S9-V13 WeakPolarHBondContact O-CG2 3.49Å; S9-V13 PolarHBondContact O-N 3.32Å; V13-V16 PolarHBondContact O-N 3.23Å; V13-I17 HydrophobicContact CG1-CD1 3.86Å; V13-I17 WeakPolarHBondContact O-CD1 3.48Å; V13-I17 VanDerWaalsContact O-CG1 3.27Å; V13-I17 WeakPolarHBondContact O-CG1 3.19Å; V13-I17 PolarHBondContact O-N 2.81Å; V13-I17 VanDerWaalsContact O-N 3.09Å
14	S	52.9	Low	51	Low	71 Å²	71	112 Å²	112	50%	0.497	59%	0.593	S	S	.	*	H	α-helix	trans	-66.4	-41.6	176.1	-177	0	0	0	0	112.6	G10 I17 C18	G10-S14 PolarHBondContact O-N 3.46Å; S14-I17 PolarHBondContact O-N 3.14Å; S14-C18 WeakPolarHBondContact O-CB 2.83Å; S14-C18 PolarHBondContact O-N 3.43Å; S14-C18 PolarHBondContact O-SG 3.26Å; S14-C18 VanDerWaalsContact O-SG 3.42Å
15	A	56.4	Low	51.5	Low	49 Å²	49	110.6 Å²	110.6	41%	0.405	59%	0.586	S	S	.	*	H	α-helix	trans	-65.2	-40.1	176.9	0	0	0	0	0	112.4	L11 V12 C18 I19	L11-A15 WeakPolarHBondContact O-CB 3.41Å; L11-A15 PolarHBondContact O-N 2.92Å; L11-A15 VanDerWaalsContact O-N 3.11Å; V12-A15 PolarHBondContact O-N 2.8Å; A15-C18 PolarHBondContact O-N 3.02Å; A15-I19 WeakPolarHBondContact O-CB 3.47Å; A15-I19 WeakPolarHBondContact O-CD1 3.23Å; A15-I19 WeakPolarHBondContact O-CG1 3.05Å; A15-I19 PolarHBondContact O-N 3.36Å
16	V	63.1	Low	51.9	Low	65 Å²	65	108.4 Å²	108.4	39%	0.394	58%	0.577	S	S	.	*	H	α-helix	trans	-67.1	-41.8	178.3	172.9	0	0	0	0	111.1	V12 V13 I19 F20	V12-V16 HydrophobicContact CG1-CG2 4.39Å; V12-V16 WeakPolarHBondContact O-CB 3.24Å; V12-V16 VanDerWaalsContact O-CG2 3.22Å; V12-V16 WeakPolarHBondContact O-CG2 3.47Å; V12-V16 PolarHBondContact O-N 2.8Å; V13-V16 PolarHBondContact O-N 3.23Å; V16-I19 PolarHBondContact O-N 3.29Å; V16-F20 HydrophobicContact CG1-CD2 3.65Å; V16-F20 HydrophobicContact CG1-CE2 3.66Å; V16-F20 VanDerWaalsContact O-CD2 3.27Å; V16-F20 WeakPolarHBondContact O-CD2 3.21Å; V16-F20 PolarHBondContact O-N 3.14Å
17	I	60.4	Low	51.5	Low	92 Å²	92	109.2 Å²	109.2	47%	0.472	58%	0.578	S	S	.	*	H	α-helix	trans	-64.3	-42.5	176.6	-67.3	166.8	0	0	0	111.1	V13 S14 I19 F20 I21	V13-I17 HydrophobicContact CG1-CD1 3.86Å; V13-I17 WeakPolarHBondContact O-CD1 3.48Å; V13-I17 VanDerWaalsContact O-CG1 3.27Å; V13-I17 WeakPolarHBondContact O-CG1 3.19Å; V13-I17 PolarHBondContact O-N 2.81Å; V13-I17 VanDerWaalsContact O-N 3.09Å; S14-I17 PolarHBondContact O-N 3.14Å; I17-I19 VanDerWaalsContact C-N 3.34Å; I17-I19 PolarHBondContact O-N 2.96Å; I17-F20 PolarHBondContact O-N 2.78Å; I17-I21 HydrophobicContact CG2-CD1 3.81Å; I17-I21 HydrophobicContact CG2-CG1 4.47Å; I17-I21 VanDerWaalsContact O-CG1 3.31Å; I17-I21 WeakPolarHBondContact O-CG1 3.47Å; I17-I21 PolarHBondContact O-N 2.64Å
18	C	54.9	Low	51.4	Low	76 Å²	76	109.8 Å²	109.8	51%	0.514	58%	0.583	S	S	.	*	H	α-helix	trans	-64.2	-37.6	175.7	-74.5	0	0	0	0	112.5	S14 A15 F22	S14-C18 WeakPolarHBondContact O-CB 2.83Å; S14-C18 PolarHBondContact O-N 3.43Å; S14-C18 PolarHBondContact O-SG 3.26Å; S14-C18 VanDerWaalsContact O-SG 3.42Å; A15-C18 PolarHBondContact O-N 3.02Å; C18-F22 VanDerWaalsContact O-CB 3.26Å; C18-F22 WeakPolarHBondContact O-CB 3.36Å; C18-F22 PolarHBondContact O-N 3.16Å
19	I	61	Low	51	Low	99 Å²	99	106.9 Å²	106.9	51%	0.508	58%	0.582	S	S	.	*	H	α-helix	trans	-68.3	-40.6	175.7	-69.8	165	0	0	0	110.8	A15 V16 I17 F22 L23	A15-I19 WeakPolarHBondContact O-CB 3.47Å; A15-I19 WeakPolarHBondContact O-CD1 3.23Å; A15-I19 WeakPolarHBondContact O-CG1 3.05Å; A15-I19 PolarHBondContact O-N 3.36Å; V16-I19 PolarHBondContact O-N 3.29Å; I17-I19 VanDerWaalsContact C-N 3.34Å; I17-I19 PolarHBondContact O-N 2.96Å; I19-F22 PolarHBondContact O-N 3.16Å; I19-L23 HydrophobicContact CG2-CD1 3.8Å; I19-L23 HydrophobicContact CG2-CG 4.31Å; I19-L23 WeakPolarHBondContact O-CB 2.84Å; I19-L23 VanDerWaalsContact O-CG 3.25Å; I19-L23 WeakPolarHBondContact O-CG 3.4Å; I19-L23 PolarHBondContact O-N 3.41Å
20	F	53.5	Low	50.4	Low	143 Å²	143	108.1 Å²	108.1	63%	0.627	59%	0.587	S	S	*	*	H	α-helix	trans	-65	-41.9	175	-88.9	-74.2	0	0	0	112.3	V16 I17 L23 Y24	V16-F20 HydrophobicContact CG1-CD2 3.65Å; V16-F20 HydrophobicContact CG1-CE2 3.66Å; V16-F20 VanDerWaalsContact O-CD2 3.27Å; V16-F20 WeakPolarHBondContact O-CD2 3.21Å; V16-F20 PolarHBondContact O-N 3.14Å; I17-F20 PolarHBondContact O-N 2.78Å; F20-L23 PolarHBondContact O-N 3.46Å; F20-Y24 VanDerWaalsContact O-CB 3.28Å; F20-Y24 WeakPolarHBondContact O-CB 3.48Å; F20-Y24 PolarHBondContact O-N 2.87Å
21	I	55.3	Low	49.8	Very low	94 Å²	94	110.3 Å²	110.3	48%	0.482	60%	0.601	S	S	.	*	H	α-helix	trans	-64.8	-41.1	175	-67.6	168.5	0	0	0	110.7	I17 Y24 L25	I17-I21 HydrophobicContact CG2-CD1 3.81Å; I17-I21 HydrophobicContact CG2-CG1 4.47Å; I17-I21 VanDerWaalsContact O-CG1 3.31Å; I17-I21 WeakPolarHBondContact O-CG1 3.47Å; I17-I21 PolarHBondContact O-N 2.64Å; I21-Y24 PolarHBondContact O-N 3Å; I21-L25 HydrophobicContact CG2-CD1 3.72Å; I21-L25 HydrophobicContact CG2-CG 4.34Å; I21-L25 WeakPolarHBondContact O-CB 3.46Å; I21-L25 VanDerWaalsContact O-CG 3.24Å; I21-L25 WeakPolarHBondContact O-CG 3.32Å; I21-L25 PolarHBondContact O-N 3.35Å
22	F	55.2	Low	48.9	Very low	128 Å²	128	113.1 Å²	113.1	56%	0.561	61%	0.611	S	S	*	*	H	α-helix	trans	-68.2	-36.2	178.5	-156.1	-91.4	0	0	0	112.3	C18 I19 R26	C18-F22 VanDerWaalsContact O-CB 3.26Å; C18-F22 WeakPolarHBondContact O-CB 3.36Å; C18-F22 PolarHBondContact O-N 3.16Å; I19-F22 PolarHBondContact O-N 3.16Å; F22-R26 WeakPolarHBondContact O-CB 3.36Å; F22-R26 PolarHBondContact O-N 3.33Å
23	L	50.9	Low	47.8	Very low	98 Å²	98	114.2 Å²	114.2	51%	0.513	62%	0.62	S	S	.	*	H	α-helix	trans	-72.6	-35.3	173.9	-70.6	172	0	0	0	112	I19 F20 R26 N27	I19-L23 HydrophobicContact CG2-CD1 3.8Å; I19-L23 HydrophobicContact CG2-CG 4.31Å; I19-L23 WeakPolarHBondContact O-CB 2.84Å; I19-L23 VanDerWaalsContact O-CG 3.25Å; I19-L23 WeakPolarHBondContact O-CG 3.4Å; I19-L23 PolarHBondContact O-N 3.41Å; F20-L23 PolarHBondContact O-N 3.46Å; L23-R26 PolarHBondContact O-N 3.48Å; L23-N27 PolarHBondContact O-N 3.03Å
24	Y	48.2	Very low	46.8	Very low	206 Å²	206	119.2 Å²	119.2	81%	0.808	64%	0.637	S	S	*	*	H	α-helix	trans	-68.3	-35.4	175	-149.5	-89.7	0	0	0	112.1	F20 I21	F20-Y24 VanDerWaalsContact O-CB 3.28Å; F20-Y24 WeakPolarHBondContact O-CB 3.48Å; F20-Y24 PolarHBondContact O-N 2.87Å; I21-Y24 PolarHBondContact O-N 3Å
25	L	50.6	Low	45.6	Very low	139 Å²	139	124.3 Å²	124.3	73%	0.728	65%	0.653	S	S	*	*	H	α-helix	trans	-79.8	-13.9	176.5	-70.3	170.6	0	0	0	114	I21	I21-L25 HydrophobicContact CG2-CD1 3.72Å; I21-L25 HydrophobicContact CG2-CG 4.34Å; I21-L25 WeakPolarHBondContact O-CB 3.46Å; I21-L25 VanDerWaalsContact O-CG 3.24Å; I21-L25 WeakPolarHBondContact O-CG 3.32Å; I21-L25 PolarHBondContact O-N 3.35Å
26	R	44.9	Very low	44.4	Very low	183 Å²	183	130 Å²	130	69%	0.691	67%	0.671	S	S	*	*	H	α-helix	trans	-105.2	-3.5	-176.1	-151.2	178.7	-168.4	-179.6	3.6	113.9	F22 L23 P28	F22-R26 WeakPolarHBondContact O-CB 3.36Å; F22-R26 PolarHBondContact O-N 3.33Å; L23-R26 PolarHBondContact O-N 3.48Å; R26-P28 WeakPolarHBondContact O-CD 3.17Å
27	N	34.6	Very low	42.9	Very low	128 Å²	128	132.5 Å²	132.5	68%	0.684	69%	0.689	S	S	*	*	S	Bend	trans	-90.3	104.2	166	-81.5	-14.9	0	0	0	108.6	L23 T29	L23-N27 PolarHBondContact O-N 3.03Å; N27-T29 PolarHBondContact O-N 2.96Å; N27-T29 VanDerWaalsContact O-N 3.14Å
28	P	39	Very low	41.4	Very low	109 Å²	109	132.5 Å²	132.5	71%	0.708	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-62.4	120.4	163.1	25.4	-24	0	0	0	105.8	R26 P30	R26-P28 WeakPolarHBondContact O-CD 3.17Å; P28-P30 WeakPolarHBondContact O-CD 3.34Å; P28-P30 VanDerWaalsContact O-N 3.14Å
29	T	38.7	Very low	40.6	Very low	127 Å²	127	137.1 Å²	137.1	78%	0.779	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-46.6	124.5	158.2	27.2	0	0	0	0	106.4	N27 A31	N27-T29 PolarHBondContact O-N 2.96Å; N27-T29 VanDerWaalsContact O-N 3.14Å; T29-A31 PolarHBondContact O-N 3.4Å; T29-A31 VanDerWaalsContact O-N 3.12Å
30	P	33.1	Very low	39.1	Very low	118 Å²	118	137.1 Å²	137.1	77%	0.766	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-50.8	128.3	172.9	-21.2	30.4	0	0	0	106.8	P28 E32	P28-P30 WeakPolarHBondContact O-CD 3.34Å; P28-P30 VanDerWaalsContact O-N 3.14Å; P30-E32 PolarHBondContact O-N 3.2Å
31	A	36.8	Very low	38.3	Very low	94 Å²	94	139.1 Å²	139.1	78%	0.777	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-51.4	117.7	168	0	0	0	0	0	106.1	T29 P33	T29-A31 PolarHBondContact O-N 3.4Å; T29-A31 VanDerWaalsContact O-N 3.12Å; A31-P33 VanDerWaalsContact O-N 3.16Å
32	E	30.1	Very low	37.4	Very low	178 Å²	178	139.1 Å²	139.1	83%	0.832	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-50.5	126.1	165.4	-75.9	-179.6	160.6	0	0	105.7	P30 E34	P30-E32 PolarHBondContact O-N 3.2Å; E32-E34 PolarHBondContact O-N 2.66Å; E32-E34 VanDerWaalsContact O-N 3.08Å
33	P	28.8	Very low	36.7	Very low	113 Å²	113	138.5 Å²	138.5	73%	0.734	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-55.3	124.4	168.5	23.2	-28.9	0	0	0	105.7	A31 E35	A31-P33 VanDerWaalsContact O-N 3.16Å; P33-E35 PolarHBondContact O-N 3.41Å
34	E	33.9	Very low	36.8	Very low	194 Å²	194	139.1 Å²	139.1	91%	0.907	75%	0.748	S	S	*	*			trans	-57.5	91.8	161.6	-79.7	-178.8	157.4	0	0	105.2	E32 E36	E32-E34 PolarHBondContact O-N 2.66Å; E32-E34 VanDerWaalsContact O-N 3.08Å; E34-E36 VanDerWaalsContact C-N 3.3Å; E34-E36 PolarHBondContact O-N 3.13Å
35	E	28.9	Very low	37.1	Very low	177 Å²	177	130.1 Å²	130.1	83%	0.827	72%	0.715	S	S	*	*			trans	-57.4	104.8	161.3	-92	-174.3	156.8	0	0	104.9	P33 P37	P33-E35 PolarHBondContact O-N 3.41Å; E35-P37 VanDerWaalsContact O-CD 3.23Å; E35-P37 WeakPolarHBondContact O-CD 3.41Å
36	E	30.9	Very low	37.2	Very low	168 Å²	168	125.7 Å²	125.7	79%	0.785	70%	0.703	S	S	*	*			trans	-50.1	114.4	160.6	-80.5	-173.5	153.8	0	0	106.1	E34 A38	E34-E36 VanDerWaalsContact C-N 3.3Å; E34-E36 PolarHBondContact O-N 3.13Å; E36-A38 PolarHBondContact O-N 3.01Å
37	P	30.6	Very low	37.5	Very low	118 Å²	118	122.9 Å²	122.9	77%	0.766	70%	0.696	S	S	*	*			trans	-60.9	124	175.7	22.3	-26.3	0	0	0	106	E35 H39	E35-P37 VanDerWaalsContact O-CD 3.23Å; E35-P37 WeakPolarHBondContact O-CD 3.41Å; P37-H39 PolarHBondContact O-N 3.32Å; P37-H39 VanDerWaalsContact O-N 3.15Å
38	A	29.1	Very low	38.6	Very low	93 Å²	93	120.7 Å²	120.7	77%	0.769	68%	0.679	S	S	*	*			trans	-35.5	123.1	176.4	0	0	0	0	0	109.5	E36 S40	E36-A38 PolarHBondContact O-N 3.01Å; A38-S40 PolarHBondContact O-N 3.04Å
39	H	38.2	Very low	40.1	Very low	172 Å²	172	116 Å²	116	80%	0.796	65%	0.648	S	S	*	*			trans	-53.6	88.1	178	-101.8	-73.8	0	0	0	109.5	P37 E41	P37-H39 PolarHBondContact O-N 3.32Å; P37-H39 VanDerWaalsContact O-N 3.15Å; H39-E41 PolarHBondContact O-N 3.4Å
40	S	30.7	Very low	42	Very low	99 Å²	99	111.6 Å²	111.6	69%	0.692	62%	0.62	S	S	*	*			trans	-63	122.8	159.7	170.3	0	0	0	0	105.3	A38 V42	A38-S40 PolarHBondContact O-N 3.04Å; S40-V42 PolarHBondContact O-N 3.46Å
41	E	36.1	Very low	44.5	Very low	185 Å²	185	109.7 Å²	109.7	86%	0.864	60%	0.601	S	S	*	*			trans	-43.1	108.9	177.9	-75.3	-175.6	151.7	0	0	109.6	H39 V43	H39-E41 PolarHBondContact O-N 3.4Å; E41-V43 PolarHBondContact O-N 3.11Å; E41-V43 VanDerWaalsContact O-N 3.12Å
42	V	36	Very low	46.9	Very low	94 Å²	94	106 Å²	106	57%	0.57	57%	0.568	S	S	*	*			trans	-71	110.6	-174.9	178.4	0	0	0	0	106	S40 E44	S40-V42 PolarHBondContact O-N 3.46Å; V42-E44 PolarHBondContact O-N 3.05Å
43	V	40.2	Very low	49.7	Very low	116 Å²	116	97.8 Å²	97.8	70%	0.703	53%	0.53	S	S	*	.			trans	-70.3	89.6	160.2	-174.4	0	0	0	0	105.6	E41	E41-V43 PolarHBondContact O-N 3.11Å; E41-V43 VanDerWaalsContact O-N 3.12Å
44	E	52.6	Low	52.7	Low	110 Å²	110	95 Å²	95	51%	0.514	51%	0.514	S	S	.	.	B	Isolated β-bridge	trans	-47.3	143.1	165	-149.7	168.8	-164	0	0	107	V42 G46 P73	V42-E44 PolarHBondContact O-N 3.05Å; E44-G46 WeakPolarHBondContact O-CA 3.31Å; E44-G46 PolarHBondContact O-N 3.39Å; E44-P73 HydrophobicContact CG-CG 4.31Å
45	C	55.1	Low	55.5	Low	17 Å²	17	87 Å²	87	12%	0.115	48%	0.48	C	S	.	.	S	Bend	trans	-53.9	95.4	169.7	-169.4	0	0	0	0	106.3	C70 K71	C45-C70 HydrophobicContact CB-CB 3.47Å; C45-C70 VanDerWaalsContact CB-CB 3.47Å; C45-C70 WeakPolarHBondContact CB-SG 3.31Å; C45-C70 WeakPolarHBondContact SG-CB 3.19Å; C45-C70 CovalentContact SG-SG 2.03Å; C45-C70 PolarHBondContact SG-SG 3.5Å; C45-K71 PolarHBondContact N-O 2.73Å
46	G	52.4	Low	58.6	Low	47 Å²	47	78.7 Å²	78.7	49%	0.485	44%	0.441	S	S	.	.			trans	-53.8	148.2	-159.9	0	0	0	0	0	110.3	E44 Y48	E44-G46 WeakPolarHBondContact O-CA 3.31Å; E44-G46 PolarHBondContact O-N 3.39Å; G46-Y48 PolarHBondContact O-N 3.37Å
47	F	51.8	Low	61.6	Low	123 Å²	123	72 Å²	72	54%	0.539	41%	0.41	S	S	.	.	S	Bend	trans	0.9	10.6	176.7	-71.7	-67	0	0	0	125	H402	F47-H402 AromaticContact CD1-CD2 3.23Å; F47-H402 WeakPolarHBondContact CD1-CD2 3.22Å; F47-H402 AromaticContact CD1-CE1 3.73Å; F47-H402 AromaticContact CD1-NE2 2.83Å; F47-H402 WeakPolarHBondContact CD1-NE2 3.38Å; F47-H402 AromaticContact CE1-CD2 3.94Å; F47-H402 AromaticContact CE1-CE1 3.65Å; F47-H402 AromaticContact CE1-NE2 3.05Å; F47-H402 WeakPolarHBondContact CE1-NE2 3.42Å; F47-H402 AromaticContact CG-CD2 3.47Å; F47-H402 VanDerWaalsContact CG-CD2 3.47Å; F47-H402 WeakPolarHBondContact CG-CD2 3.49Å; F47-H402 AromaticContact CG-NE2 3.47Å; F47-H402 WeakPolarHBondContact CG-NE2 3.5Å; F47-H402 AromaticContact CZ-NE2 3.86Å
48	Y	57.6	Low	64.6	Low	82 Å²	82	71.7 Å²	71.7	32%	0.322	40%	0.398	S	S	.	.			trans	-149.7	50.4	-164.2	-56.2	-70	0	0	0	114.1	G46 D50 E51 L52 H402 F403	G46-Y48 PolarHBondContact O-N 3.37Å; Y48-D50 PolarHBondContact O-N 2.87Å; Y48-E51 WeakPolarHBondContact CA-OE2 3.33Å; Y48-E51 WeakPolarHBondContact CB-OE2 3.39Å; Y48-E51 HydrophobicContact CD1-CG 4.43Å; Y48-E51 WeakPolarHBondContact CD1-OE1 3.49Å; Y48-E51 WeakPolarHBondContact CD1-OE2 3.4Å; Y48-L52 WeakPolarHBondContact O-CB 3.33Å; Y48-L52 PolarHBondContact O-N 3.47Å; Y48-L52 VanDerWaalsContact O-N 3.15Å; Y48-H402 HydrophobicContact CE1-CB 3.83Å; Y48-H402 WeakPolarHBondContact OH-CB 3.44Å; Y48-F403 AromaticContact CE1-CD2 3.92Å; Y48-F403 HydrophobicContact CE1-CD2 3.92Å; Y48-F403 AromaticContact CE1-CE2 3.85Å; Y48-F403 HydrophobicContact CE1-CE2 3.85Å
49	P	69.9	Low	67.6	Low	11 Å²	11	69.5 Å²	69.5	7%	0.071	39%	0.385	C	S	.	.	H	α-helix	trans	-59.5	-32.8	172.9	26.5	-34.1	0	0	0	111.4	C53 Q400	P49-C53 WeakPolarHBondContact O-CB 3.14Å; P49-C53 PolarHBondContact O-N 3.29Å; P49-C53 PolarHBondContact O-SG 3.31Å; P49-Q400 VanDerWaalsContact CD-OE1 3.24Å; P49-Q400 HydrophobicContact CG-CB 4.14Å; P49-Q400 VanDerWaalsContact CG-OE1 3.29Å
50	D	78.8	Confident	70.3	Confident	35 Å²	35	66.6 Å²	66.6	19%	0.187	37%	0.37	C	S	.	.	H	α-helix	trans	-71.5	-43.8	-176.4	-68	-38.6	0	0	0	112.3	Y48 C53 S54 R377 Q399	Y48-D50 PolarHBondContact O-N 2.87Å; D50-C53 PolarHBondContact O-N 2.92Å; D50-S54 WeakPolarHBondContact O-CB 3.44Å; D50-S54 PolarHBondContact O-N 3.31Å; D50-R377 WeakPolarHBondContact OD1-CD 3.33Å; D50-R377 IonicContact OD1-CZ 3.35Å; D50-R377 IonicContact OD1-NE 3.85Å; D50-R377 IonicContact OD1-NH1 2.8Å; D50-R377 PolarHBondContact OD1-NH1 2.98Å; D50-R377 IonicContact OD2-NH1 3.17Å; D50-R377 PolarHBondContact OD2-NH1 3.48Å; D50-Q399 WeakPolarHBondContact OD2-CG 3.42Å
51	E	85.2	Confident	73.1	Confident	77 Å²	77	65.1 Å²	65.1	36%	0.36	37%	0.371	S	S	.	.	H	α-helix	trans	-67.3	-42.9	176.9	-64.5	81.6	171.7	0	0	111.3	Y48 S54 A55	Y48-E51 WeakPolarHBondContact CA-OE2 3.33Å; Y48-E51 WeakPolarHBondContact CB-OE2 3.39Å; Y48-E51 HydrophobicContact CD1-CG 4.43Å; Y48-E51 WeakPolarHBondContact CD1-OE1 3.49Å; Y48-E51 WeakPolarHBondContact CD1-OE2 3.4Å; E51-S54 PolarHBondContact O-N 2.96Å; E51-A55 WeakPolarHBondContact O-CB 3.44Å; E51-A55 PolarHBondContact O-N 2.6Å
52	L	87.9	Confident	75.7	Confident	17 Å²	17	59.4 Å²	59.4	9%	0.089	36%	0.355	C	S	.	.	H	α-helix	trans	-64	-44.1	175.7	-179.9	58.4	0	0	0	111	Y48 S54 A55 L56 A63 I66 L370	Y48-L52 WeakPolarHBondContact O-CB 3.33Å; Y48-L52 PolarHBondContact O-N 3.47Å; Y48-L52 VanDerWaalsContact O-N 3.15Å; L52-S54 VanDerWaalsContact C-N 3.34Å; L52-S54 PolarHBondContact O-N 3.15Å; L52-A55 PolarHBondContact O-N 3.4Å; L52-L56 HydrophobicContact CD1-CD1 4.39Å; L52-L56 HydrophobicContact CD1-CG 4.34Å; L52-L56 HydrophobicContact CG-CD1 4.1Å; L52-L56 WeakPolarHBondContact O-CB 3.44Å; L52-L56 VanDerWaalsContact O-CG 3.26Å; L52-L56 WeakPolarHBondContact O-CG 2.97Å; L52-L56 PolarHBondContact O-N 3.23Å; L52-A63 HydrophobicContact CD1-CB 4.09Å; L52-I66 HydrophobicContact CD1-CB 4.17Å; L52-I66 HydrophobicContact CD1-CG2 3.99Å; L52-I66 HydrophobicContact CD2-CG2 4.33Å; L52-L370 HydrophobicContact CD2-CD2 3.68Å; L52-L370 HydrophobicContact CG-CD2 4.2Å
53	C	90.1	Very high	78.3	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.034	33%	0.329	C	S	.	.	H	α-helix	trans	-60.9	-42.6	174.7	-70.6	0	0	0	0	111.7	P49 D50 L56 F57 C374	P49-C53 WeakPolarHBondContact O-CB 3.14Å; P49-C53 PolarHBondContact O-N 3.29Å; P49-C53 PolarHBondContact O-SG 3.31Å; D50-C53 PolarHBondContact O-N 2.92Å; C53-L56 PolarHBondContact O-N 3.44Å; C53-F57 HydrophobicContact CB-CD2 4.46Å; C53-F57 HydrophobicContact CB-CE2 4.19Å; C53-F57 WeakPolarHBondContact O-CD2 3.46Å; C53-F57 WeakPolarHBondContact O-CG 3.26Å; C53-F57 PolarHBondContact O-N 2.87Å; C53-C374 WeakPolarHBondContact CA-SG 3.05Å; C53-C374 HydrophobicContact CB-CB 3.65Å; C53-C374 WeakPolarHBondContact CB-SG 3.42Å; C53-C374 WeakPolarHBondContact SG-CA 3.38Å; C53-C374 WeakPolarHBondContact SG-CB 3.46Å; C53-C374 CovalentContact SG-SG 2.03Å; C53-C374 PolarHBondContact SG-SG 3.29Å
54	S	91.1	Very high	80.6	Confident	56 Å²	56	51.4 Å²	51.4	39%	0.392	31%	0.308	S	S	.	.	H	α-helix	trans	-58.9	-48.9	174.9	-162.4	0	0	0	0	111.3	D50 E51 L52 L56 F57 E58	D50-S54 WeakPolarHBondContact O-CB 3.44Å; D50-S54 PolarHBondContact O-N 3.31Å; E51-S54 PolarHBondContact O-N 2.96Å; L52-S54 VanDerWaalsContact C-N 3.34Å; L52-S54 PolarHBondContact O-N 3.15Å; S54-L56 VanDerWaalsContact C-N 3.3Å; S54-L56 PolarHBondContact O-N 3.48Å; S54-F57 PolarHBondContact O-N 3.45Å; S54-E58 WeakPolarHBondContact O-CB 3.39Å; S54-E58 WeakPolarHBondContact O-CG 3.44Å; S54-E58 PolarHBondContact O-N 2.92Å; S54-E58 PolarHBondContact OG-OE1 2.89Å
55	A	92.5	Very high	82.2	Confident	25 Å²	25	51.2 Å²	51.2	21%	0.207	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-36.9	178.7	0	0	0	0	0	112.6	E51 L52 G59 K60 A63	E51-A55 WeakPolarHBondContact O-CB 3.44Å; E51-A55 PolarHBondContact O-N 2.6Å; L52-A55 PolarHBondContact O-N 3.4Å; A55-G59 PolarHBondContact O-N 2.96Å; A55-K60 HydrophobicContact CB-CB 4.22Å; A55-K60 HydrophobicContact CB-CG 3.97Å; A55-K60 WeakPolarHBondContact O-CB 3.3Å; A55-K60 WeakPolarHBondContact O-CG 3.39Å; A55-K60 PolarHBondContact O-N 3.09Å; A55-A63 HydrophobicContact CB-CB 3.78Å
56	L	93.3	Very high	83.7	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-66.6	-44.2	174.4	-73	167.7	0	0	0	112	L52 C53 S54 E58 G59 A63 P64 A67 P346 L349 P350 L370	L52-L56 HydrophobicContact CD1-CD1 4.39Å; L52-L56 HydrophobicContact CD1-CG 4.34Å; L52-L56 HydrophobicContact CG-CD1 4.1Å; L52-L56 WeakPolarHBondContact O-CB 3.44Å; L52-L56 VanDerWaalsContact O-CG 3.26Å; L52-L56 WeakPolarHBondContact O-CG 2.97Å; L52-L56 PolarHBondContact O-N 3.23Å; C53-L56 PolarHBondContact O-N 3.44Å; S54-L56 VanDerWaalsContact C-N 3.3Å; S54-L56 PolarHBondContact O-N 3.48Å; L56-E58 VanDerWaalsContact C-N 3.3Å; L56-E58 PolarHBondContact O-N 3.19Å; L56-G59 PolarHBondContact O-N 3.3Å; L56-G59 VanDerWaalsContact O-N 3.09Å; L56-A63 HydrophobicContact CD2-CB 3.76Å; L56-A63 HydrophobicContact CG-CB 3.96Å; L56-P64 HydrophobicContact CD2-CB 4.44Å; L56-P64 HydrophobicContact CD2-CG 3.98Å; L56-A67 HydrophobicContact CD1-CB 4.42Å; L56-A67 HydrophobicContact CD2-CB 4.47Å; L56-P346 HydrophobicContact CD1-CB 4.1Å; L56-P346 HydrophobicContact CD2-CB 3.67Å; L56-L349 HydrophobicContact CB-CD1 3.69Å; L56-L349 HydrophobicContact CD1-CD1 3.93Å; L56-L349 HydrophobicContact CG-CD1 4.35Å; L56-P350 WeakPolarHBondContact O-CD 3.46Å; L56-P350 VanDerWaalsContact O-CG 3.3Å; L56-P350 WeakPolarHBondContact O-CG 3.45Å; L56-L370 HydrophobicContact CD1-CD2 3.6Å; L56-L370 HydrophobicContact CD1-CG 4.21Å
57	F	94	Very high	85.2	Confident	27 Å²	27	53 Å²	53	12%	0.118	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-34.2	176.2	-73.1	-55.4	0	0	0	112.8	C53 S54 G59 L349 T353 C374 L375 R378	C53-F57 HydrophobicContact CB-CD2 4.46Å; C53-F57 HydrophobicContact CB-CE2 4.19Å; C53-F57 WeakPolarHBondContact O-CD2 3.46Å; C53-F57 WeakPolarHBondContact O-CG 3.26Å; C53-F57 PolarHBondContact O-N 2.87Å; S54-F57 PolarHBondContact O-N 3.45Å; F57-G59 PolarHBondContact O-N 2.92Å; F57-L349 HydrophobicContact CD1-CB 3.88Å; F57-L349 HydrophobicContact CE1-CB 3.98Å; F57-L349 HydrophobicContact CE1-CD1 4.48Å; F57-L349 HydrophobicContact CE1-CD2 3.76Å; F57-L349 HydrophobicContact CE1-CG 4.29Å; F57-L349 HydrophobicContact CZ-CD2 4.22Å; F57-T353 HydrophobicContact CD1-CG2 3.34Å; F57-T353 HydrophobicContact CE1-CG2 3.48Å; F57-T353 VanDerWaalsContact CE1-CG2 3.48Å; F57-T353 HydrophobicContact CG-CG2 4.38Å; F57-C374 HydrophobicContact CE2-CB 3.95Å; F57-C374 HydrophobicContact CZ-CB 3.87Å; F57-C374 WeakPolarHBondContact CZ-O 3.33Å; F57-L375 HydrophobicContact CE1-CD2 4.14Å; F57-L375 HydrophobicContact CZ-CD2 4.4Å; F57-R378 HydrophobicContact CE2-CB 3.69Å; F57-R378 HydrophobicContact CE2-CG 4.22Å; F57-R378 HydrophobicContact CZ-CB 3.72Å; F57-R378 VanDerWaalsContact CZ-CD 3.49Å; F57-R378 HydrophobicContact CZ-CG 4.23Å
58	E	94.1	Very high	86.6	Confident	113 Å²	113	54.3 Å²	54.3	53%	0.528	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-5.6	174.2	-72.2	175.2	-136.5	0	0	113.4	S54 L56 K60	S54-E58 WeakPolarHBondContact O-CB 3.39Å; S54-E58 WeakPolarHBondContact O-CG 3.44Å; S54-E58 PolarHBondContact O-N 2.92Å; S54-E58 PolarHBondContact OG-OE1 2.89Å; L56-E58 VanDerWaalsContact C-N 3.3Å; L56-E58 PolarHBondContact O-N 3.19Å; E58-K60 VanDerWaalsContact C-N 3.35Å; E58-K60 HydrophobicContact CB-CD 4.44Å; E58-K60 HydrophobicContact CB-CG 4.21Å; E58-K60 PolarHBondContact O-N 3.35Å; E58-K60 WeakPolarHBondContact OE2-CE 3.2Å; E58-K60 IonicContact OE2-NZ 2.92Å; E58-K60 PolarHBondContact OE2-NZ 3.03Å
59	G	92.7	Very high	87.5	Confident	47 Å²	47	58.2 Å²	58.2	49%	0.485	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	28.6	-179.8	0	0	0	0	0	113.9	A55 L56 F57 G61	A55-G59 PolarHBondContact O-N 2.96Å; L56-G59 PolarHBondContact O-N 3.3Å; L56-G59 VanDerWaalsContact O-N 3.09Å; F57-G59 PolarHBondContact O-N 2.92Å; G59-G61 PolarHBondContact O-N 3.16Å
60	K	93.5	Very high	87.6	Confident	110 Å²	110	58.6 Å²	58.6	48%	0.478	33%	0.331	S	S	.	.			trans	-63.8	126.1	177.3	-58.3	-62.3	-176.7	-165.2	0	110.1	A55 E58 A62 A63 P64	A55-K60 HydrophobicContact CB-CB 4.22Å; A55-K60 HydrophobicContact CB-CG 3.97Å; A55-K60 WeakPolarHBondContact O-CB 3.3Å; A55-K60 WeakPolarHBondContact O-CG 3.39Å; A55-K60 PolarHBondContact O-N 3.09Å; E58-K60 VanDerWaalsContact C-N 3.35Å; E58-K60 HydrophobicContact CB-CD 4.44Å; E58-K60 HydrophobicContact CB-CG 4.21Å; E58-K60 PolarHBondContact O-N 3.35Å; E58-K60 WeakPolarHBondContact OE2-CE 3.2Å; E58-K60 IonicContact OE2-NZ 2.92Å; E58-K60 PolarHBondContact OE2-NZ 3.03Å; K60-A62 VanDerWaalsContact C-N 3.28Å; K60-A62 PolarHBondContact O-N 3.32Å; K60-A62 VanDerWaalsContact O-N 3.14Å; K60-A63 HydrophobicContact CB-CB 4.26Å; K60-A63 WeakPolarHBondContact O-CB 3.45Å; K60-A63 PolarHBondContact O-N 3Å; K60-P64 WeakPolarHBondContact O-CD 3.44Å
61	G	90.2	Very high	87	Confident	69 Å²	69	64.7 Å²	64.7	71%	0.711	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.9	-172.5	0	0	0	0	0	115.8	G59	G59-G61 PolarHBondContact O-N 3.16Å
62	A	89.9	Confident	85.8	Confident	65 Å²	65	62.6 Å²	62.6	54%	0.537	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-24.8	178.1	0	0	0	0	0	113.5	K60 Q65 I66	K60-A62 VanDerWaalsContact C-N 3.28Å; K60-A62 PolarHBondContact O-N 3.32Å; K60-A62 VanDerWaalsContact O-N 3.14Å; A62-Q65 PolarHBondContact O-N 3.11Å; A62-Q65 VanDerWaalsContact O-N 3.16Å; A62-I66 HydrophobicContact CB-CD1 4.42Å; A62-I66 WeakPolarHBondContact O-CG1 3.49Å; A62-I66 PolarHBondContact O-N 3.14Å; A62-I66 VanDerWaalsContact O-N 3.11Å
63	A	90.7	Very high	84.3	Confident	4 Å²	4	64.4 Å²	64.4	3%	0.033	36%	0.361	C	S	.	.	H	α-helix	trans	-64.1	-42.7	-170.6	0	0	0	0	0	113.6	L52 A55 L56 K60 Q65 I66 A67	L52-A63 HydrophobicContact CD1-CB 4.09Å; A55-A63 HydrophobicContact CB-CB 3.78Å; L56-A63 HydrophobicContact CD2-CB 3.76Å; L56-A63 HydrophobicContact CG-CB 3.96Å; K60-A63 HydrophobicContact CB-CB 4.26Å; K60-A63 WeakPolarHBondContact O-CB 3.45Å; K60-A63 PolarHBondContact O-N 3Å; A63-Q65 VanDerWaalsContact C-N 3.25Å; A63-Q65 PolarHBondContact O-N 3.08Å; A63-I66 PolarHBondContact O-N 3.32Å; A63-A67 WeakPolarHBondContact O-CB 3.38Å; A63-A67 PolarHBondContact O-N 3.44Å
64	P	88.9	Confident	82.7	Confident	38 Å²	38	66.6 Å²	66.6	25%	0.247	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-29	175.1	-25.3	35.3	0	0	0	114.1	L56 K60	L56-P64 HydrophobicContact CD2-CB 4.44Å; L56-P64 HydrophobicContact CD2-CG 3.98Å; K60-P64 WeakPolarHBondContact O-CD 3.44Å
65	Q	87.3	Confident	81.2	Confident	106 Å²	106	68.5 Å²	68.5	50%	0.495	37%	0.372	S	S	.	.	H	α-helix	trans	-75	-41.5	176.2	-57.8	-58.8	-18.6	0	0	110.8	A62 A63 A67 K68 F69	A62-Q65 PolarHBondContact O-N 3.11Å; A62-Q65 VanDerWaalsContact O-N 3.16Å; A63-Q65 VanDerWaalsContact C-N 3.25Å; A63-Q65 PolarHBondContact O-N 3.08Å; Q65-A67 VanDerWaalsContact C-N 3.28Å; Q65-A67 PolarHBondContact O-N 3.41Å; Q65-K68 WeakPolarHBondContact O-CB 3.36Å; Q65-K68 PolarHBondContact O-N 3.03Å; Q65-F69 VanDerWaalsContact O-CD2 3.23Å; Q65-F69 WeakPolarHBondContact O-CD2 3.4Å; Q65-F69 VanDerWaalsContact O-CE2 3.3Å; Q65-F69 WeakPolarHBondContact O-CE2 3.32Å
66	I	85.6	Confident	79.9	Confident	93 Å²	93	71 Å²	71	48%	0.477	39%	0.388	S	S	.	.	H	α-helix	trans	-60.5	-41.9	174.2	-64	167.2	0	0	0	110.4	L52 A62 A63 K68 F69	L52-I66 HydrophobicContact CD1-CB 4.17Å; L52-I66 HydrophobicContact CD1-CG2 3.99Å; L52-I66 HydrophobicContact CD2-CG2 4.33Å; A62-I66 HydrophobicContact CB-CD1 4.42Å; A62-I66 WeakPolarHBondContact O-CG1 3.49Å; A62-I66 PolarHBondContact O-N 3.14Å; A62-I66 VanDerWaalsContact O-N 3.11Å; A63-I66 PolarHBondContact O-N 3.32Å; I66-K68 PolarHBondContact O-N 3.47Å; I66-K68 VanDerWaalsContact O-N 3.14Å; I66-F69 PolarHBondContact O-N 3.04Å
67	A	84.5	Confident	79.1	Confident	8 Å²	8	75.6 Å²	75.6	7%	0.066	41%	0.41	C	S	.	.	H	α-helix	trans	-56.3	-29	178.3	0	0	0	0	0	114.3	L56 A63 Q65 F69 C70 P346 L370	L56-A67 HydrophobicContact CD1-CB 4.42Å; L56-A67 HydrophobicContact CD2-CB 4.47Å; A63-A67 WeakPolarHBondContact O-CB 3.38Å; A63-A67 PolarHBondContact O-N 3.44Å; Q65-A67 VanDerWaalsContact C-N 3.28Å; Q65-A67 PolarHBondContact O-N 3.41Å; A67-F69 PolarHBondContact O-N 2.93Å; A67-C70 WeakPolarHBondContact O-CB 3.22Å; A67-C70 PolarHBondContact O-N 2.88Å; A67-C70 VanDerWaalsContact O-N 3.15Å; A67-P346 HydrophobicContact CB-CB 3.94Å; A67-P346 HydrophobicContact CB-CG 3.88Å; A67-L370 HydrophobicContact CB-CD2 3.41Å; A67-L370 VanDerWaalsContact CB-CD2 3.41Å
68	K	80.3	Confident	78.6	Confident	151 Å²	151	74.5 Å²	74.5	66%	0.657	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-25	178.1	-68.6	175.3	-179.8	172.3	0	113.2	Q65 I66 C70	Q65-K68 WeakPolarHBondContact O-CB 3.36Å; Q65-K68 PolarHBondContact O-N 3.03Å; I66-K68 PolarHBondContact O-N 3.47Å; I66-K68 VanDerWaalsContact O-N 3.14Å; K68-C70 VanDerWaalsContact C-N 3.29Å
69	F	77.1	Confident	78.1	Confident	164 Å²	164	72.2 Å²	72.2	72%	0.719	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-6.4	178.1	-57.5	-76.8	0	0	0	112.4	Q65 I66 A67 K71	Q65-F69 VanDerWaalsContact O-CD2 3.23Å; Q65-F69 WeakPolarHBondContact O-CD2 3.4Å; Q65-F69 VanDerWaalsContact O-CE2 3.3Å; Q65-F69 WeakPolarHBondContact O-CE2 3.32Å; I66-F69 PolarHBondContact O-N 3.04Å; A67-F69 PolarHBondContact O-N 2.93Å; F69-K71 PolarHBondContact O-N 3.4Å
70	C	72.4	Confident	77.7	Confident	19 Å²	19	73 Å²	73	13%	0.128	40%	0.395	C	S	.	.			trans	-85	114.2	-179.9	-81	0	0	0	0	112.2	C45 A67 K68	C45-C70 HydrophobicContact CB-CB 3.47Å; C45-C70 VanDerWaalsContact CB-CB 3.47Å; C45-C70 WeakPolarHBondContact CB-SG 3.31Å; C45-C70 WeakPolarHBondContact SG-CB 3.19Å; C45-C70 CovalentContact SG-SG 2.03Å; C45-C70 PolarHBondContact SG-SG 3.5Å; A67-C70 WeakPolarHBondContact O-CB 3.22Å; A67-C70 PolarHBondContact O-N 2.88Å; A67-C70 VanDerWaalsContact O-N 3.15Å; K68-C70 VanDerWaalsContact C-N 3.29Å
71	K	64.8	Low	77.2	Confident	163 Å²	163	70.9 Å²	70.9	71%	0.709	39%	0.387	S	S	*	.	B	Isolated β-bridge	trans	-100.6	123.7	161.1	-67.4	-176.3	-179.8	177.3	0	108.7	C45 F69	C45-K71 PolarHBondContact N-O 2.73Å; F69-K71 PolarHBondContact O-N 3.4Å
72	T	60.6	Low	77	Confident	32 Å²	32	67.8 Å²	67.8	20%	0.196	36%	0.355	C	S	.	.			trans	-88.5	131.9	-178	53.7	0	0	0	0	111.7	P369	T72-P369 HydrophobicContact CG2-CB 3.98Å; T72-P369 HydrophobicContact CG2-CG 3.98Å; T72-P369 WeakPolarHBondContact OG1-CB 3.31Å; T72-P369 WeakPolarHBondContact OG1-CG 3.32Å
73	P	55.8	Low	76.2	Confident	55 Å²	55	69 Å²	69	36%	0.357	35%	0.349	S	S	.	.			trans	-78.2	-16.3	178.1	30.1	-34.6	0	0	0	114.2	E44 K75 S76	E44-P73 HydrophobicContact CG-CG 4.31Å; P73-K75 PolarHBondContact O-N 3.23Å; P73-S76 PolarHBondContact O-N 3.33Å; P73-S76 PolarHBondContact O-OG 3.24Å
74	H	57.2	Low	75.1	Confident	51 Å²	51	73.2 Å²	73.2	24%	0.236	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-18.8	-168.6	-88.4	-46.5	0	0	0	117.5	S76 E77	H74-S76 VanDerWaalsContact C-N 3.26Å; H74-S76 PolarHBondContact O-N 3.43Å; H74-E77 IonicContact CE1-OE2 3.67Å; H74-E77 PolarHBondContact CE1-OE2 3.29Å; H74-E77 IonicContact CG-OE2 3.88Å; H74-E77 IonicContact ND1-OE2 2.99Å; H74-E77 PolarHBondContact ND1-OE2 2.68Å
75	K	60.8	Low	73.9	Confident	97 Å²	97	77.6 Å²	77.6	42%	0.422	40%	0.403	S	S	.	.	H	α-helix	trans	-60.3	-37.2	172.6	-78	-179.7	178.8	171.1	0	111.7	P73 H79 A122	P73-K75 PolarHBondContact O-N 3.23Å; K75-H79 WeakPolarHBondContact O-CB 3.4Å; K75-H79 PolarHBondContact O-CD2 2.82Å; K75-H79 PolarHBondContact O-N 2.9Å; K75-A122 HydrophobicContact CG-CB 4.28Å
76	S	63.5	Low	73	Confident	77 Å²	77	74.3 Å²	74.3	54%	0.538	40%	0.397	S	S	.	.	H	α-helix	trans	-68.7	-42.1	-176.2	61.5	0	0	0	0	112.4	P73 H74 H79 A80	P73-S76 PolarHBondContact O-N 3.33Å; P73-S76 PolarHBondContact O-OG 3.24Å; H74-S76 VanDerWaalsContact C-N 3.26Å; H74-S76 PolarHBondContact O-N 3.43Å; S76-H79 PolarHBondContact O-N 3.29Å; S76-A80 WeakPolarHBondContact O-CB 3.42Å; S76-A80 PolarHBondContact O-N 3.14Å
77	E	77.5	Confident	73.1	Confident	99 Å²	99	74.7 Å²	74.7	46%	0.463	40%	0.4	S	S	.	.	H	α-helix	trans	-65.5	-48.1	-177.5	-65.5	173.8	163.9	0	0	112.6	H74 H79 A80 H81	H74-E77 IonicContact CE1-OE2 3.67Å; H74-E77 PolarHBondContact CE1-OE2 3.29Å; H74-E77 IonicContact CG-OE2 3.88Å; H74-E77 IonicContact ND1-OE2 2.99Å; H74-E77 PolarHBondContact ND1-OE2 2.68Å; E77-H79 VanDerWaalsContact C-N 3.27Å; E77-H79 PolarHBondContact O-N 3.16Å; E77-A80 WeakPolarHBondContact O-CB 3.33Å; E77-A80 PolarHBondContact O-N 2.93Å; E77-A80 VanDerWaalsContact O-N 3.14Å; E77-H81 PolarHBondContact O-CD2 3.11Å; E77-H81 PolarHBondContact O-N 2.81Å; E77-H81 VanDerWaalsContact O-N 3.11Å
78	I	83.3	Confident	73.5	Confident	4 Å²	4	76.5 Å²	76.5	2%	0.021	41%	0.412	C	S	.	.	H	α-helix	trans	-60.2	-42.5	178.2	-68.5	172.7	0	0	0	110.3	H81 L82 L95 A122 V125 Q126	I78-H81 PolarHBondContact O-N 2.97Å; I78-L82 HydrophobicContact CG2-CD1 4.03Å; I78-L82 WeakPolarHBondContact O-CG 3.3Å; I78-L82 PolarHBondContact O-N 2.74Å; I78-L95 HydrophobicContact CG1-CD2 4.16Å; I78-A122 HydrophobicContact CD1-CB 3.9Å; I78-V125 HydrophobicContact CD1-CB 4.27Å; I78-V125 HydrophobicContact CD1-CG1 4.13Å; I78-V125 HydrophobicContact CG1-CG1 4.29Å; I78-V125 HydrophobicContact CG2-CB 3.95Å; I78-V125 HydrophobicContact CG2-CG1 4.02Å; I78-V125 HydrophobicContact CG2-CG2 3.68Å; I78-Q126 HydrophobicContact CD1-CG 4.26Å
79	H	82.6	Confident	74.1	Confident	65 Å²	65	71.9 Å²	71.9	30%	0.301	40%	0.399	S	S	.	.	H	α-helix	trans	-64.7	-40.8	176.9	-82.4	-54.8	0	0	0	111.9	K75 S76 E77 H81 L82 H83	K75-H79 WeakPolarHBondContact O-CB 3.4Å; K75-H79 PolarHBondContact O-CD2 2.82Å; K75-H79 PolarHBondContact O-N 2.9Å; S76-H79 PolarHBondContact O-N 3.29Å; E77-H79 VanDerWaalsContact C-N 3.27Å; E77-H79 PolarHBondContact O-N 3.16Å; H79-H81 VanDerWaalsContact C-N 3.31Å; H79-H81 PolarHBondContact O-N 3.4Å; H79-L82 PolarHBondContact O-N 3.45Å; H79-L82 VanDerWaalsContact O-N 3.15Å; H79-H83 AromaticContact CG-NE2 3.65Å; H79-H83 AromaticContact ND1-CD2 3.97Å; H79-H83 AromaticContact ND1-CE1 3.91Å; H79-H83 AromaticContact ND1-NE2 3.13Å; H79-H83 PolarHBondContact ND1-NE2 3.43Å; H79-H83 VanDerWaalsContact ND1-NE2 3.13Å; H79-H83 PolarHBondContact O-CD2 2.88Å; H79-H83 PolarHBondContact O-N 2.89Å
80	A	84.5	Confident	74.8	Confident	62 Å²	62	73 Å²	73	51%	0.512	40%	0.398	S	S	.	.	H	α-helix	trans	-58.9	-41.3	177.4	0	0	0	0	0	112.3	S76 E77 L82	S76-A80 WeakPolarHBondContact O-CB 3.42Å; S76-A80 PolarHBondContact O-N 3.14Å; E77-A80 WeakPolarHBondContact O-CB 3.33Å; E77-A80 PolarHBondContact O-N 2.93Å; E77-A80 VanDerWaalsContact O-N 3.14Å; A80-L82 VanDerWaalsContact C-N 3.3Å; A80-L82 PolarHBondContact O-N 2.69Å
81	H	84.1	Confident	75.8	Confident	67 Å²	67	72.2 Å²	72.2	31%	0.31	39%	0.393	S	S	.	.	H	α-helix	trans	-68.8	-23	177.8	-74.6	-63.8	0	0	0	114.6	E77 I78 H79 L95	E77-H81 PolarHBondContact O-CD2 3.11Å; E77-H81 PolarHBondContact O-N 2.81Å; E77-H81 VanDerWaalsContact O-N 3.11Å; I78-H81 PolarHBondContact O-N 2.97Å; H79-H81 VanDerWaalsContact C-N 3.31Å; H79-H81 PolarHBondContact O-N 3.4Å; H81-L95 HydrophobicContact CB-CD1 4.45Å; H81-L95 HydrophobicContact CB-CD2 3.99Å; H81-L95 HydrophobicContact CB-CG 4.14Å
82	L	84.9	Confident	77.2	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-107.5	-17.6	-171.9	-63.5	178.6	0	0	0	114.6	I78 H79 A80 I91 L95 L121 V125 A153 T156 L157	I78-L82 HydrophobicContact CG2-CD1 4.03Å; I78-L82 WeakPolarHBondContact O-CG 3.3Å; I78-L82 PolarHBondContact O-N 2.74Å; H79-L82 PolarHBondContact O-N 3.45Å; H79-L82 VanDerWaalsContact O-N 3.15Å; A80-L82 VanDerWaalsContact C-N 3.3Å; A80-L82 PolarHBondContact O-N 2.69Å; L82-I91 HydrophobicContact CD2-CG2 4.25Å; L82-L95 HydrophobicContact CD2-CD1 4.32Å; L82-L121 HydrophobicContact CD1-CD1 4.38Å; L82-L121 HydrophobicContact CD1-CD2 3.8Å; L82-L121 HydrophobicContact CD1-CG 4.2Å; L82-V125 HydrophobicContact CD1-CG2 3.87Å; L82-A153 HydrophobicContact CB-CB 4.25Å; L82-T156 HydrophobicContact CD2-CG2 4.41Å; L82-L157 HydrophobicContact CD2-CB 3.85Å; L82-L157 HydrophobicContact CD2-CD1 4.17Å
83	H	74.6	Confident	78.8	Confident	89 Å²	89	67.9 Å²	67.9	41%	0.412	38%	0.375	S	S	.	.	H	α-helix	trans	-87.7	-21	178.8	-70.7	-51.7	0	0	0	113.8	H79 K149	H79-H83 AromaticContact CG-NE2 3.65Å; H79-H83 AromaticContact ND1-CD2 3.97Å; H79-H83 AromaticContact ND1-CE1 3.91Å; H79-H83 AromaticContact ND1-NE2 3.13Å; H79-H83 PolarHBondContact ND1-NE2 3.43Å; H79-H83 VanDerWaalsContact ND1-NE2 3.13Å; H79-H83 PolarHBondContact O-CD2 2.88Å; H79-H83 PolarHBondContact O-N 2.89Å; H83-K149 WeakPolarHBondContact CE1-CE 3.34Å
84	T	67.1	Low	80.5	Confident	93 Å²	93	66.5 Å²	66.5	57%	0.571	37%	0.37	S	S	*	.	S	Bend	trans	-98.3	131.8	174.9	-51	0	0	0	0	109.5	G86	T84-G86 PolarHBondContact O-N 2.79Å
85	P	63.3	Low	82.2	Confident	130 Å²	130	64.2 Å²	64.2	84%	0.844	36%	0.36	S	S	*	.			trans	-54.4	108.2	169.8	-22.9	32.8	0	0	0	109.5
86	G	68.9	Low	83.9	Confident	37 Å²	37	61.1 Å²	61.1	38%	0.381	35%	0.347	S	S	.	.			trans	-118.1	151.4	-172.7	0	0	0	0	0	111.4	T84 C88	T84-G86 PolarHBondContact O-N 2.79Å; G86-C88 PolarHBondContact O-N 3.48Å
87	N	87.6	Confident	85.5	Confident	101 Å²	101	57.5 Å²	57.5	54%	0.54	32%	0.321	S	S	.	.			trans	-63.2	130.6	166.9	179.1	-27.4	0	0	0	108.8	S89 R90 I91	N87-S89 PolarHBondContact O-N 3Å; N87-S89 VanDerWaalsContact O-N 3.16Å; N87-S89 WeakPolarHBondContact OD1-CB 3.34Å; N87-S89 PolarHBondContact OD1-N 3.43Å; N87-R90 HydrophobicContact CB-CG 4.23Å; N87-R90 WeakPolarHBondContact O-CA 3.1Å; N87-R90 WeakPolarHBondContact O-CB 3.32Å; N87-R90 PolarHBondContact O-N 2.98Å; N87-I91 PolarHBondContact O-N 3.49Å
88	C	93.5	Very high	86.4	Confident	46 Å²	46	53 Å²	53	31%	0.311	30%	0.301	S	S	.	.	H	α-helix	trans	-57.8	-28.7	-179.9	-76.3	0	0	0	0	114.4	G86 R90 I91 S92 C160	G86-C88 PolarHBondContact O-N 3.48Å; C88-R90 VanDerWaalsContact C-N 3.34Å; C88-I91 PolarHBondContact O-N 3.47Å; C88-S92 WeakPolarHBondContact O-CB 3.47Å; C88-S92 PolarHBondContact O-N 2.82Å; C88-S92 PolarHBondContact O-OG 3.04Å; C88-C160 WeakPolarHBondContact CA-SG 3.4Å; C88-C160 HydrophobicContact CB-CB 3.47Å; C88-C160 VanDerWaalsContact CB-CB 3.47Å; C88-C160 WeakPolarHBondContact CB-SG 3.41Å; C88-C160 WeakPolarHBondContact SG-CA 3.41Å; C88-C160 WeakPolarHBondContact SG-CB 3.28Å; C88-C160 CovalentContact SG-SG 2.06Å; C88-C160 PolarHBondContact SG-SG 2.76Å
89	S	92.5	Very high	86.9	Confident	55 Å²	55	55.2 Å²	55.2	39%	0.385	31%	0.314	S	S	.	.	H	α-helix	trans	-62.2	-41.3	170	178.3	0	0	0	0	111.7	N87 S92 Q93	N87-S89 PolarHBondContact O-N 3Å; N87-S89 VanDerWaalsContact O-N 3.16Å; N87-S89 WeakPolarHBondContact OD1-CB 3.34Å; N87-S89 PolarHBondContact OD1-N 3.43Å; S89-S92 PolarHBondContact O-OG 3.3Å; S89-S92 VanDerWaalsContact O-OG 3.08Å; S89-Q93 VanDerWaalsContact O-CB 3.24Å; S89-Q93 WeakPolarHBondContact O-CB 3.44Å; S89-Q93 WeakPolarHBondContact O-CG 3.46Å; S89-Q93 PolarHBondContact O-N 3.14Å
90	R	91.8	Very high	87.5	Confident	186 Å²	186	58.4 Å²	58.4	70%	0.702	32%	0.323	S	S	*	.	H	α-helix	trans	-71	-38.1	176.8	-65.7	-177.8	-179.4	174.2	-0.7	112.2	N87 C88 G94	N87-R90 HydrophobicContact CB-CG 4.23Å; N87-R90 WeakPolarHBondContact O-CA 3.1Å; N87-R90 WeakPolarHBondContact O-CB 3.32Å; N87-R90 PolarHBondContact O-N 2.98Å; C88-R90 VanDerWaalsContact C-N 3.34Å; R90-G94 WeakPolarHBondContact O-CA 3.35Å; R90-G94 PolarHBondContact O-N 3.31Å
91	I	93.3	Very high	88.1	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-50.8	177.9	-66.1	174.3	0	0	0	110	L82 N87 C88 Q93 L95 T156 L157	L82-I91 HydrophobicContact CD2-CG2 4.25Å; N87-I91 PolarHBondContact O-N 3.49Å; C88-I91 PolarHBondContact O-N 3.47Å; I91-Q93 PolarHBondContact O-N 3.42Å; I91-L95 HydrophobicContact CG2-CD1 3.77Å; I91-L95 HydrophobicContact CG2-CG 4.49Å; I91-L95 VanDerWaalsContact O-CB 3.23Å; I91-L95 WeakPolarHBondContact O-CB 3.35Å; I91-L95 WeakPolarHBondContact O-CG 3.38Å; I91-L95 PolarHBondContact O-N 3.02Å; I91-T156 HydrophobicContact CD1-CG2 4Å; I91-L157 HydrophobicContact CG2-CD1 4.14Å
92	S	94.3	Very high	88.7	Confident	15 Å²	15	54.7 Å²	54.7	11%	0.105	30%	0.3	C	S	.	.	H	α-helix	trans	-61.5	-44.1	179.2	53.9	0	0	0	0	112.3	C88 S89 H96 F97	C88-S92 WeakPolarHBondContact O-CB 3.47Å; C88-S92 PolarHBondContact O-N 2.82Å; C88-S92 PolarHBondContact O-OG 3.04Å; S89-S92 PolarHBondContact O-OG 3.3Å; S89-S92 VanDerWaalsContact O-OG 3.08Å; S92-H96 PolarHBondContact O-N 3.49Å; S92-H96 VanDerWaalsContact O-N 3.12Å; S92-F97 PolarHBondContact O-N 3.38Å
93	Q	93.6	Very high	89.3	Confident	89 Å²	89	54.8 Å²	54.8	42%	0.416	30%	0.301	S	S	.	.	H	α-helix	trans	-69.1	-47.8	177.7	-71.5	175.2	0.7	0	0	112.8	S89 I91 L95 H96 H394	S89-Q93 VanDerWaalsContact O-CB 3.24Å; S89-Q93 WeakPolarHBondContact O-CB 3.44Å; S89-Q93 WeakPolarHBondContact O-CG 3.46Å; S89-Q93 PolarHBondContact O-N 3.14Å; I91-Q93 PolarHBondContact O-N 3.42Å; Q93-L95 VanDerWaalsContact C-N 3.28Å; Q93-L95 PolarHBondContact O-N 3.2Å; Q93-H96 WeakPolarHBondContact O-CA 3.43Å; Q93-H96 PolarHBondContact O-N 3.42Å; Q93-H394 HydrophobicContact CB-CB 4.44Å
94	G	91.7	Very high	90.3	Very high	26 Å²	26	55.4 Å²	55.4	27%	0.268	31%	0.311	S	S	.	.	H	α-helix	trans	-66.5	-30.3	-179.1	0	0	0	0	0	113	R90 H96	R90-G94 WeakPolarHBondContact O-CA 3.35Å; R90-G94 PolarHBondContact O-N 3.31Å; G94-H96 VanDerWaalsContact C-N 3.32Å; G94-H96 PolarHBondContact O-CD2 3.47Å
95	L	93.2	Very high	91.6	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.016	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	0.8	171.1	-63.8	177.1	0	0	0	112.9	I78 H81 L82 I91 Q93 F97 V125 R129 L157	I78-L95 HydrophobicContact CG1-CD2 4.16Å; H81-L95 HydrophobicContact CB-CD1 4.45Å; H81-L95 HydrophobicContact CB-CD2 3.99Å; H81-L95 HydrophobicContact CB-CG 4.14Å; L82-L95 HydrophobicContact CD2-CD1 4.32Å; I91-L95 HydrophobicContact CG2-CD1 3.77Å; I91-L95 HydrophobicContact CG2-CG 4.49Å; I91-L95 VanDerWaalsContact O-CB 3.23Å; I91-L95 WeakPolarHBondContact O-CB 3.35Å; I91-L95 WeakPolarHBondContact O-CG 3.38Å; I91-L95 PolarHBondContact O-N 3.02Å; Q93-L95 VanDerWaalsContact C-N 3.28Å; Q93-L95 PolarHBondContact O-N 3.2Å; L95-F97 HydrophobicContact CB-CD2 3.71Å; L95-F97 HydrophobicContact CB-CE2 3.65Å; L95-F97 HydrophobicContact CD1-CE2 3.98Å; L95-F97 HydrophobicContact CG-CE2 4.49Å; L95-V125 HydrophobicContact CD1-CG1 4.2Å; L95-V125 HydrophobicContact CD2-CG1 4.35Å; L95-R129 WeakPolarHBondContact O-CD 3.21Å; L95-R129 PolarHBondContact O-NH1 2.81Å; L95-L157 HydrophobicContact CD1-CD1 3.78Å
96	H	95.3	Very high	93.2	Very high	32 Å²	32	47.7 Å²	47.7	15%	0.148	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	44.2	177.3	-49.2	-83.9	0	0	0	114.3	S92 Q93 G94 R380 H394 H396 F397	S92-H96 PolarHBondContact O-N 3.49Å; S92-H96 VanDerWaalsContact O-N 3.12Å; Q93-H96 WeakPolarHBondContact O-CA 3.43Å; Q93-H96 PolarHBondContact O-N 3.42Å; G94-H96 VanDerWaalsContact C-N 3.32Å; G94-H96 PolarHBondContact O-CD2 3.47Å; H96-R380 VanDerWaalsContact O-CZ 3.3Å; H96-R380 PolarHBondContact O-NH1 2.86Å; H96-R380 PolarHBondContact O-NH2 3.3Å; H96-H394 WeakPolarHBondContact CA-O 3.48Å; H96-H394 VanDerWaalsContact CB-O 3.3Å; H96-H394 WeakPolarHBondContact CB-O 3.27Å; H96-H394 PolarHBondContact ND1-O 3.45Å; H96-H396 PolarHBondContact CE1-O 3.42Å; H96-H396 PolarHBondContact ND1-O 3.11Å; H96-H396 VanDerWaalsContact ND1-O 3.11Å; H96-F397 HydrophobicContact CB-CD1 4.07Å; H96-F397 HydrophobicContact CB-CE1 3.85Å; H96-F397 AromaticContact CD2-CD1 3.89Å; H96-F397 AromaticContact CG-CD1 3.99Å
97	F	97.4	Very high	94.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.254	C	S	.	.			trans	-74.9	142.1	172.4	-82.5	-91.7	0	0	0	111.5	S92 L95 T99 L128 R129 Y132 L157 F161 W395	S92-F97 PolarHBondContact O-N 3.38Å; L95-F97 HydrophobicContact CB-CD2 3.71Å; L95-F97 HydrophobicContact CB-CE2 3.65Å; L95-F97 HydrophobicContact CD1-CE2 3.98Å; L95-F97 HydrophobicContact CG-CE2 4.49Å; F97-T99 HydrophobicContact CB-CG2 4.39Å; F97-L128 HydrophobicContact CE1-CD2 4.39Å; F97-L128 HydrophobicContact CE1-CG 4.07Å; F97-L128 HydrophobicContact CZ-CD2 4.42Å; F97-L128 HydrophobicContact CZ-CG 4.43Å; F97-R129 HydrophobicContact CD1-CB 4.38Å; F97-R129 VanDerWaalsContact CE1-CA 3.45Å; F97-R129 HydrophobicContact CE1-CB 3.91Å; F97-R129 HydrophobicContact CE2-CB 4.41Å; F97-R129 HydrophobicContact CZ-CB 3.93Å; F97-Y132 AromaticContact CD1-CD1 3.77Å; F97-Y132 HydrophobicContact CD1-CD1 3.77Å; F97-Y132 AromaticContact CD1-CG 3.81Å; F97-Y132 HydrophobicContact CD1-CG 3.81Å; F97-Y132 HydrophobicContact CE1-CG 4.19Å; F97-L157 HydrophobicContact CE2-CD1 3.93Å; F97-L157 HydrophobicContact CZ-CD1 4.09Å; F97-F161 HydrophobicContact CB-CE1 4.17Å; F97-F161 HydrophobicContact CB-CZ 4.15Å; F97-F161 HydrophobicContact CD1-CE1 4.06Å; F97-F161 HydrophobicContact CD1-CE2 4.41Å; F97-F161 AromaticContact CD1-CZ 3.64Å; F97-F161 HydrophobicContact CD1-CZ 3.64Å; F97-F161 AromaticContact CD2-CZ 3.72Å; F97-F161 HydrophobicContact CD2-CZ 3.72Å; F97-F161 HydrophobicContact CE1-CE2 4.23Å; F97-F161 AromaticContact CE1-CZ 3.89Å; F97-F161 HydrophobicContact CE1-CZ 3.89Å; F97-F161 HydrophobicContact CE2-CE2 4.36Å; F97-F161 AromaticContact CE2-CZ 3.96Å; F97-F161 HydrophobicContact CE2-CZ 3.96Å; F97-F161 HydrophobicContact CG-CE1 4.02Å; F97-F161 AromaticContact CG-CZ 3.55Å; F97-F161 HydrophobicContact CG-CZ 3.55Å; F97-F161 HydrophobicContact CZ-CE2 4.2Å; F97-F161 HydrophobicContact CZ-CZ 4.05Å; F97-W395 PolarHBondContact O-NE1 3.48Å
98	I	97.1	Very high	94.8	Very high	6 Å²	6	48.5 Å²	48.5	3%	0.031	26%	0.26	C	S	.	.			trans	-86.2	111.7	172.1	-60.1	178.4	0	0	0	107.8	R100 L102 Y132 V383 L384 W395	I98-R100 WeakPolarHBondContact CG2-O 3.46Å; I98-L102 HydrophobicContact CD1-CD1 4.13Å; I98-L102 HydrophobicContact CG2-CD1 4.22Å; I98-L102 HydrophobicContact CG2-CD2 3.77Å; I98-L102 HydrophobicContact CG2-CG 4.01Å; I98-Y132 WeakPolarHBondContact O-CD1 3.37Å; I98-Y132 VanDerWaalsContact O-CE1 3.31Å; I98-Y132 WeakPolarHBondContact O-CE1 3.4Å; I98-V383 HydrophobicContact CD1-CG1 3.62Å; I98-L384 HydrophobicContact CD1-CD2 4.2Å; I98-W395 HydrophobicContact CG1-CB 4.32Å; I98-W395 HydrophobicContact CG1-CD2 4.24Å; I98-W395 HydrophobicContact CG1-CG 4.06Å; I98-W395 HydrophobicContact CG2-CD2 4.24Å; I98-W395 HydrophobicContact CG2-CE3 4.35Å; I98-W395 HydrophobicContact CG2-CH2 4.44Å; I98-W395 HydrophobicContact CG2-CZ2 4.3Å; I98-W395 HydrophobicContact CG2-CZ3 4.46Å
99	T	94.5	Very high	95	Very high	49 Å²	49	46.9 Å²	46.9	30%	0.301	25%	0.248	S	C	.	.			trans	-103.1	9.6	-168.9	50.5	0	0	0	0	113.5	F97	F97-T99 HydrophobicContact CB-CG2 4.39Å
100	R	95.3	Very high	95.2	Very high	132 Å²	132	44.8 Å²	44.8	50%	0.498	23%	0.233	S	C	.	.	S	Bend	trans	-137.1	147.5	-179.9	-61.9	-177.2	67.9	178.2	-0.3	110.7	I98 E392 W395	I98-R100 WeakPolarHBondContact CG2-O 3.46Å; R100-E392 WeakPolarHBondContact CD-OE1 3.21Å; R100-W395 HydrophobicContact CB-CH2 3.98Å; R100-W395 HydrophobicContact CB-CZ2 4.06Å; R100-W395 HydrophobicContact CG-CH2 4.42Å; R100-W395 HydrophobicContact CG-CZ2 4.17Å
101	P	96.6	Very high	95.6	Very high	51 Å²	51	36 Å²	36	33%	0.331	20%	0.2	S	C	.	.			trans	-59.9	138.9	169.2	-18.3	31.8	0	0	0	109.8	P134	P101-P134 VanDerWaalsContact CD-CG 3.47Å; P101-P134 HydrophobicContact CG-CG 3.94Å
102	L	97.1	Very high	95.8	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.199	C	C	.	.	S	Bend	trans	-93.1	-12.2	-175.1	-64.8	-178.1	0	0	0	114	I98 V383 A387 E388 V389 W395	I98-L102 HydrophobicContact CD1-CD1 4.13Å; I98-L102 HydrophobicContact CG2-CD1 4.22Å; I98-L102 HydrophobicContact CG2-CD2 3.77Å; I98-L102 HydrophobicContact CG2-CG 4.01Å; L102-V383 HydrophobicContact CD1-CG1 3.25Å; L102-A387 HydrophobicContact CB-CB 4.23Å; L102-A387 HydrophobicContact CD1-CB 4.49Å; L102-A387 HydrophobicContact CD2-CB 4.12Å; L102-E388 PolarHBondContact O-N 3.24Å; L102-V389 HydrophobicContact CD2-CG2 3.91Å; L102-W395 HydrophobicContact CD2-CE3 4.2Å; L102-W395 HydrophobicContact CD2-CH2 4.12Å; L102-W395 HydrophobicContact CD2-CZ3 3.57Å
103	S	97.1	Very high	96.1	Very high	6 Å²	6	35.1 Å²	35.1	4%	0.042	19%	0.194	C	C	.	.	S	Bend	trans	-156.1	161.9	176.8	60.1	0	0	0	0	110.2	E105 E106 G107 E388	S103-E105 VanDerWaalsContact C-N 3.34Å; S103-E106 PolarHBondContact O-N 3.44Å; S103-E106 WeakPolarHBondContact OG-CB 3.42Å; S103-E106 WeakPolarHBondContact OG-CG 3Å; S103-E106 PolarHBondContact OG-N 3.05Å; S103-E106 PolarHBondContact OG-OE2 3.42Å; S103-G107 PolarHBondContact O-N 2.85Å; S103-E388 VanDerWaalsContact CB-OE2 3.32Å; S103-E388 WeakPolarHBondContact CB-OE2 3.25Å
104	T	95.8	Very high	96.3	Very high	101 Å²	101	30.9 Å²	30.9	62%	0.62	17%	0.174	S	C	*	.	H	α-helix	trans	-64.6	-41	173.4	-57.6	0	0	0	0	111.1	E106 G107 D108	T104-E106 VanDerWaalsContact C-N 3.29Å; T104-E106 PolarHBondContact O-N 3.28Å; T104-G107 PolarHBondContact O-N 3.14Å; T104-G107 VanDerWaalsContact O-N 3.08Å; T104-D108 WeakPolarHBondContact CG2-OD2 3.25Å; T104-D108 PolarHBondContact O-N 3.36Å
105	E	94.5	Very high	96.6	Very high	55 Å²	55	29.7 Å²	29.7	26%	0.257	16%	0.162	S	C	.	.	H	α-helix	trans	-53.8	-46.5	176.6	177.7	-179.8	-159.5	0	0	111.8	S103 R215	S103-E105 VanDerWaalsContact C-N 3.34Å; E105-R215 IonicContact OE2-CZ 2.73Å; E105-R215 IonicContact OE2-NE 3.85Å; E105-R215 PolarHBondContact OE2-NE 3.03Å; E105-R215 IonicContact OE2-NH2 3.54Å; E105-R215 PolarHBondContact OE2-NH2 3.3Å
106	E	96.3	Very high	96.8	Very high	6 Å²	6	29.7 Å²	29.7	3%	0.028	16%	0.162	C	C	.	.	H	α-helix	trans	-73.1	-33.5	178.2	-68.6	175.8	97.1	0	0	112.6	S103 T104 D108 Q135 N214 R215 I218	S103-E106 PolarHBondContact O-N 3.44Å; S103-E106 WeakPolarHBondContact OG-CB 3.42Å; S103-E106 WeakPolarHBondContact OG-CG 3Å; S103-E106 PolarHBondContact OG-N 3.05Å; S103-E106 PolarHBondContact OG-OE2 3.42Å; T104-E106 VanDerWaalsContact C-N 3.29Å; T104-E106 PolarHBondContact O-N 3.28Å; E106-D108 VanDerWaalsContact C-N 3.3Å; E106-Q135 VanDerWaalsContact C-NE2 3.3Å; E106-Q135 VanDerWaalsContact O-CG 3.26Å; E106-Q135 WeakPolarHBondContact O-CG 3.49Å; E106-Q135 PolarHBondContact O-NE2 2.03Å; E106-N214 WeakPolarHBondContact OE1-CB 3.09Å; E106-N214 PolarHBondContact OE1-ND2 3.44Å; E106-R215 HydrophobicContact CG-CB 4Å; E106-R215 HydrophobicContact CG-CG 4.37Å; E106-R215 PolarHBondContact OE1-N 3.37Å; E106-I218 HydrophobicContact CB-CD1 4.27Å; E106-I218 HydrophobicContact CG-CD1 4.09Å
107	G	95.5	Very high	96.8	Very high	30 Å²	30	28.1 Å²	28.1	31%	0.309	16%	0.155	S	C	.	.	H	α-helix	trans	-65.2	-33	177.5	0	0	0	0	0	113.3	S103 T104	S103-G107 PolarHBondContact O-N 2.85Å; T104-G107 PolarHBondContact O-N 3.14Å; T104-G107 VanDerWaalsContact O-N 3.08Å
108	D	95.5	Very high	96.5	Very high	125 Å²	125	31.7 Å²	31.7	67%	0.668	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	-3.2	-176.2	-67.4	-19.6	0	0	0	113.9	T104 E106	T104-D108 WeakPolarHBondContact CG2-OD2 3.25Å; T104-D108 PolarHBondContact O-N 3.36Å; E106-D108 VanDerWaalsContact C-N 3.3Å
109	F	96.7	Very high	96.2	Very high	13 Å²	13	35.3 Å²	35.3	6%	0.057	19%	0.187	C	C	.	.	S	Bend	trans	-133.5	106.7	-178.7	-165.2	-79	0	0	0	111.1	L111 N199 Y200 I218 I221 R222	F109-L111 HydrophobicContact CD1-CD2 4.2Å; F109-L111 HydrophobicContact CE1-CD2 3.71Å; F109-L111 HydrophobicContact CE1-CG 4.49Å; F109-N199 HydrophobicContact CE1-CB 4.22Å; F109-N199 HydrophobicContact CE2-CB 4.3Å; F109-N199 HydrophobicContact CZ-CB 4.04Å; F109-Y200 HydrophobicContact CE1-CD2 4.03Å; F109-Y200 HydrophobicContact CE2-CE2 4.43Å; F109-Y200 AromaticContact CZ-CD2 3.58Å; F109-Y200 HydrophobicContact CZ-CD2 3.58Å; F109-Y200 AromaticContact CZ-CE2 3.67Å; F109-Y200 HydrophobicContact CZ-CE2 3.67Å; F109-I218 HydrophobicContact CB-CD1 4.23Å; F109-I218 HydrophobicContact CB-CG2 3.9Å; F109-I218 HydrophobicContact CD1-CB 4.26Å; F109-I218 HydrophobicContact CD1-CD1 4.15Å; F109-I218 HydrophobicContact CD1-CG1 3.71Å; F109-I218 HydrophobicContact CD1-CG2 3.8Å; F109-I218 HydrophobicContact CD2-CG2 4.46Å; F109-I218 HydrophobicContact CE1-CG1 4.31Å; F109-I218 HydrophobicContact CE1-CG2 4.39Å; F109-I218 HydrophobicContact CG-CG1 4.43Å; F109-I218 HydrophobicContact CG-CG2 3.8Å; F109-I218 WeakPolarHBondContact O-CD1 2.92Å; F109-I221 HydrophobicContact CZ-CG2 4.08Å; F109-R222 HydrophobicContact CD2-CG 3.97Å; F109-R222 HydrophobicContact CE2-CG 3.59Å; F109-R222 HydrophobicContact CZ-CG 4.02Å
110	S	97.6	Very high	96	Very high	11 Å²	11	35 Å²	35	8%	0.077	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-98.5	130.9	-173.7	176	0	0	0	0	112.1	Q135 Q197 N199	S110-Q135 VanDerWaalsContact CB-O 3.27Å; S110-Q135 WeakPolarHBondContact CB-O 3.35Å; S110-Q135 PolarHBondContact OG-O 2.03Å; S110-Q197 VanDerWaalsContact CB-O 3.27Å; S110-Q197 WeakPolarHBondContact CB-O 3.45Å; S110-Q197 PolarHBondContact OG-O 3.45Å; S110-Q197 VanDerWaalsContact OG-O 3.05Å; S110-N199 PolarHBondContact N-OD1 3.31Å; S110-N199 VanDerWaalsContact N-OD1 3.14Å; S110-N199 PolarHBondContact O-N 2.03Å; S110-N199 PolarHBondContact O-OD1 3.48Å
111	L	98.8	Very high	95.8	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	140.9	173.2	-61	174.7	0	0	0	110.3	F109 Y113 N136 V137 I202 I217 I218 I221	F109-L111 HydrophobicContact CD1-CD2 4.2Å; F109-L111 HydrophobicContact CE1-CD2 3.71Å; F109-L111 HydrophobicContact CE1-CG 4.49Å; L111-Y113 HydrophobicContact CB-CD2 4.47Å; L111-Y113 HydrophobicContact CB-CE2 3.76Å; L111-Y113 HydrophobicContact CD1-CE2 4.37Å; L111-Y113 WeakPolarHBondContact CD1-OH 3.4Å; L111-N136 PolarHBondContact N-OD1 2.63Å; L111-N136 CarbonylContact O-C 3.56Å; L111-N136 WeakPolarHBondContact O-CA 3.07Å; L111-N136 WeakPolarHBondContact O-CB 3.01Å; L111-V137 PolarHBondContact O-N 3.22Å; L111-I202 HydrophobicContact CD1-CD1 4.43Å; L111-I217 HydrophobicContact CD1-CB 4.42Å; L111-I217 HydrophobicContact CD1-CG2 3.71Å; L111-I218 HydrophobicContact CD1-CG1 4.05Å; L111-I218 HydrophobicContact CG-CG1 4.36Å; L111-I221 HydrophobicContact CD2-CD1 3.89Å
112	A	98.9	Very high	95.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	147	164.9	0	0	0	0	0	110.7	V137 L191 W198 Y200 V201 I202	A112-V137 CarbonylContact C-O 3.02Å; A112-V137 WeakPolarHBondContact CA-O 3.48Å; A112-V137 HydrophobicContact CB-CB 4.43Å; A112-L191 HydrophobicContact CB-CD1 4.1Å; A112-L191 HydrophobicContact CB-CD2 3.92Å; A112-W198 HydrophobicContact CB-CB 4.07Å; A112-W198 HydrophobicContact CB-CD2 3.58Å; A112-W198 HydrophobicContact CB-CE3 3.75Å; A112-W198 HydrophobicContact CB-CG 3.72Å; A112-W198 HydrophobicContact CB-CZ3 4.42Å; A112-Y200 PolarHBondContact N-O 3.42Å; A112-V201 HydrophobicContact CB-CB 4Å; A112-V201 HydrophobicContact CB-CG2 3.98Å; A112-V201 CarbonylContact O-C 3.49Å; A112-V201 VanDerWaalsContact O-CA 3.27Å; A112-V201 WeakPolarHBondContact O-CA 3.25Å; A112-I202 PolarHBondContact O-N 2.86Å
113	Y	98.9	Very high	95.4	Very high	2 Å²	2	27 Å²	27	1%	0.008	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.4	175.4	-69.6	-85.2	0	0	0	110.7	L111 I131 V137 Y138 C139 I202 L204 F359	L111-Y113 HydrophobicContact CB-CD2 4.47Å; L111-Y113 HydrophobicContact CB-CE2 3.76Å; L111-Y113 HydrophobicContact CD1-CE2 4.37Å; L111-Y113 WeakPolarHBondContact CD1-OH 3.4Å; Y113-I131 HydrophobicContact CD1-CD1 4.07Å; Y113-I131 HydrophobicContact CD2-CD1 4.44Å; Y113-I131 HydrophobicContact CE1-CD1 4.41Å; Y113-I131 HydrophobicContact CG-CD1 4.07Å; Y113-V137 PolarHBondContact N-O 2.75Å; Y113-Y138 AromaticContact CD2-CD1 3.75Å; Y113-Y138 HydrophobicContact CD2-CD1 3.75Å; Y113-Y138 AromaticContact CD2-CE1 3.35Å; Y113-Y138 HydrophobicContact CD2-CE1 3.35Å; Y113-Y138 AromaticContact CE2-CE1 3.96Å; Y113-Y138 HydrophobicContact CE2-CE1 3.96Å; Y113-Y138 HydrophobicContact CG-CD1 4.05Å; Y113-Y138 HydrophobicContact CG-CE1 4.02Å; Y113-C139 PolarHBondContact O-N 3.28Å; Y113-I202 WeakPolarHBondContact CA-O 3.3Å; Y113-I202 HydrophobicContact CD1-CB 3.9Å; Y113-I202 HydrophobicContact CD1-CG2 4.5Å; Y113-I202 HydrophobicContact CE1-CB 3.85Å; Y113-I202 HydrophobicContact CE1-CD1 3.9Å; Y113-I202 HydrophobicContact CE1-CG1 4.26Å; Y113-I202 HydrophobicContact CE1-CG2 4.32Å; Y113-L204 HydrophobicContact CD1-CD1 3.65Å; Y113-L204 HydrophobicContact CD1-CG 4.21Å; Y113-L204 HydrophobicContact CE1-CD1 4.19Å; Y113-F359 HydrophobicContact CE1-CE2 4.34Å; Y113-F359 AromaticContact CE1-CZ 3.73Å; Y113-F359 HydrophobicContact CE1-CZ 3.73Å
114	I	98.8	Very high	95.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.8	167.7	-59.7	177.4	0	0	0	107	C139 D184 C187 M188 L191 V201 I202 N203 L204	I114-C139 CarbonylContact C-O 3.59Å; I114-C139 WeakPolarHBondContact CA-O 3.41Å; I114-D184 HydrophobicContact CD1-CB 4.32Å; I114-D184 WeakPolarHBondContact CG2-OD1 3.39Å; I114-C187 HydrophobicContact CB-CB 4.28Å; I114-C187 HydrophobicContact CD1-CB 3.8Å; I114-C187 HydrophobicContact CG1-CB 3.73Å; I114-C187 HydrophobicContact CG2-CB 3.7Å; I114-M188 HydrophobicContact CD1-CE 4.3Å; I114-M188 HydrophobicContact CD1-CG 3.84Å; I114-L191 HydrophobicContact CD1-CD1 4.12Å; I114-L191 HydrophobicContact CG1-CD1 3.7Å; I114-V201 HydrophobicContact CD1-CG2 3.81Å; I114-V201 HydrophobicContact CG1-CG2 3.7Å; I114-I202 PolarHBondContact N-O 3.15Å; I114-N203 HydrophobicContact CB-CB 4.31Å; I114-N203 CarbonylContact O-C 3.54Å; I114-L204 PolarHBondContact O-N 3.43Å
115	I	98.5	Very high	95.4	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	108	-178.5	-42.9	-178.3	0	0	0	109.5	I117 F124 L127 L128 I131 C139 I140 H141 L204	I115-I117 HydrophobicContact CG2-CG2 3.8Å; I115-F124 HydrophobicContact CD1-CE2 4.49Å; I115-F124 HydrophobicContact CG2-CD2 4.4Å; I115-F124 HydrophobicContact CG2-CE2 4.47Å; I115-L127 HydrophobicContact CG2-CD2 3.91Å; I115-L128 HydrophobicContact CD1-CD1 4.2Å; I115-I131 HydrophobicContact CD1-CD1 3.85Å; I115-C139 PolarHBondContact N-O 3.13Å; I115-I140 HydrophobicContact CB-CD1 3.94Å; I115-I140 HydrophobicContact CD1-CD1 3.72Å; I115-I140 HydrophobicContact CG1-CD1 3.96Å; I115-H141 PolarHBondContact O-N 2.89Å; I115-L204 WeakPolarHBondContact CA-O 3.23Å; I115-L204 HydrophobicContact CG1-CB 4.46Å; I115-L204 HydrophobicContact CG1-CD1 4.41Å; I115-L204 HydrophobicContact CG2-CB 4.46Å
116	T	96.8	Very high	95.4	Very high	3 Å²	3	19.8 Å²	19.8	2%	0.018	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	117.1	177	62.1	0	0	0	0	110.9	H141 A183 L204 C205 G206	T116-H141 WeakPolarHBondContact CA-O 3.41Å; T116-H141 HydrophobicContact CG2-CB 4.2Å; T116-A183 HydrophobicContact CG2-CB 4.18Å; T116-L204 PolarHBondContact N-O 3.46Å; T116-L204 PolarHBondContact OG1-O 3.48Å; T116-C205 CarbonylContact O-C 3.54Å; T116-C205 VanDerWaalsContact O-CA 3.27Å; T116-C205 WeakPolarHBondContact O-CA 3.43Å; T116-C205 WeakPolarHBondContact OG1-CB 3.46Å; T116-G206 PolarHBondContact O-N 3.4Å
117	I	95.9	Very high	95.5	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.7	-175.6	66.7	178.9	0	0	0	112.5	I115 F124 I140 H141 V142 D143 Y150 V154	I115-I117 HydrophobicContact CG2-CG2 3.8Å; I117-F124 HydrophobicContact CD1-CB 4.47Å; I117-F124 HydrophobicContact CD1-CD1 3.92Å; I117-F124 HydrophobicContact CD1-CD2 3.87Å; I117-F124 HydrophobicContact CD1-CE1 4.09Å; I117-F124 HydrophobicContact CD1-CE2 4.05Å; I117-F124 HydrophobicContact CD1-CG 3.8Å; I117-F124 HydrophobicContact CD1-CZ 4.15Å; I117-F124 HydrophobicContact CG2-CB 4.39Å; I117-F124 HydrophobicContact CG2-CD2 3.77Å; I117-F124 HydrophobicContact CG2-CE2 4.44Å; I117-F124 HydrophobicContact CG2-CG 4.25Å; I117-I140 HydrophobicContact CD1-CG2 3.62Å; I117-I140 HydrophobicContact CG1-CG2 4.08Å; I117-H141 PolarHBondContact N-O 2.93Å; I117-V142 HydrophobicContact CD1-CG2 4.1Å; I117-V142 HydrophobicContact CG1-CB 4.45Å; I117-V142 HydrophobicContact CG1-CG1 4.45Å; I117-V142 HydrophobicContact CG1-CG2 4.06Å; I117-D143 PolarHBondContact O-N 2.98Å; I117-Y150 HydrophobicContact CD1-CE1 4.02Å; I117-Y150 HydrophobicContact CG1-CE1 4.28Å; I117-V154 HydrophobicContact CD1-CG1 4.1Å; I117-V154 HydrophobicContact CD1-CG2 3.8Å
118	H	91.6	Very high	95.6	Very high	74 Å²	74	18.1 Å²	18.1	34%	0.343	9%	0.09	S	C	.	.	S	Bend	trans	-143.5	-17.5	178	65.3	-83	0	0	0	114.6	D143 T146 M173	H118-D143 HydrophobicContact CB-CB 3.75Å; H118-T146 WeakPolarHBondContact CA-OG1 3.48Å; H118-T146 WeakPolarHBondContact O-CG2 3.18Å; H118-T146 PolarHBondContact O-OG1 2.9Å; H118-M173 HydrophobicContact CB-CE 4Å
119	K	89.6	Confident	95.8	Very high	83 Å²	83	12.8 Å²	12.8	36%	0.361	6%	0.061	S	C	.	.	S	Bend	trans	-156.3	-177.8	-178.4	66.8	179	-179	166.5	0	111.6	Y150 E364	K119-Y150 VanDerWaalsContact C-CE2 3.43Å; K119-Y150 PolarHBondContact O-OH 3.41Å; K119-E364 IonicContact NZ-OE1 3.77Å
120	E	89.9	Confident	95.8	Very high	41 Å²	41	12.8 Å²	12.8	19%	0.192	6%	0.063	C	C	.	.			trans	52	74.7	173.7	-65	-167.3	-157.9	0	0	114.5	A122 M123 F124 P365 S366	E120-A122 VanDerWaalsContact C-N 3.3Å; E120-A122 PolarHBondContact O-N 3.03Å; E120-M123 HydrophobicContact CB-CB 4.07Å; E120-M123 WeakPolarHBondContact O-CB 3.26Å; E120-M123 PolarHBondContact O-N 3.14Å; E120-M123 VanDerWaalsContact O-N 3.14Å; E120-F124 PolarHBondContact O-N 3.05Å; E120-P365 VanDerWaalsContact OE2-CD 3.27Å; E120-P365 WeakPolarHBondContact OE2-CD 3.33Å; E120-S366 WeakPolarHBondContact OE1-CB 3.08Å; E120-S366 PolarHBondContact OE1-OG 3.4Å
121	L	92.2	Very high	95.9	Very high	7 Å²	7	12.6 Å²	12.6	4%	0.037	6%	0.061	C	C	.	.	H	α-helix	trans	-58.7	-40.7	-174.5	-177.5	67.8	0	0	0	112.6	L82 M123 F124 V125 Y150 A153 V154	L82-L121 HydrophobicContact CD1-CD1 4.38Å; L82-L121 HydrophobicContact CD1-CD2 3.8Å; L82-L121 HydrophobicContact CD1-CG 4.2Å; L121-M123 VanDerWaalsContact C-N 3.32Å; L121-M123 PolarHBondContact O-N 3.14Å; L121-F124 HydrophobicContact CD1-CD1 4.27Å; L121-F124 PolarHBondContact O-N 2.9Å; L121-V125 HydrophobicContact CD1-CG2 4.5Å; L121-V125 HydrophobicContact CG-CG2 4.39Å; L121-V125 WeakPolarHBondContact O-CG2 3.31Å; L121-V125 PolarHBondContact O-N 2.82Å; L121-Y150 HydrophobicContact CB-CD2 4.11Å; L121-Y150 HydrophobicContact CB-CE2 3.85Å; L121-Y150 HydrophobicContact CD1-CE2 4.29Å; L121-A153 HydrophobicContact CD1-CB 4.24Å; L121-A153 HydrophobicContact CD2-CB 3.58Å; L121-V154 HydrophobicContact CD1-CG2 3.86Å
122	A	90.9	Very high	95.9	Very high	10 Å²	10	13.3 Å²	13.3	8%	0.083	6%	0.064	C	C	.	.	H	α-helix	trans	-57.5	-45	177.8	0	0	0	0	0	111.8	K75 I78 E120 F124 V125 Q126	K75-A122 HydrophobicContact CG-CB 4.28Å; I78-A122 HydrophobicContact CD1-CB 3.9Å; E120-A122 VanDerWaalsContact C-N 3.3Å; E120-A122 PolarHBondContact O-N 3.03Å; A122-F124 VanDerWaalsContact C-N 3.35Å; A122-F124 PolarHBondContact O-N 3.23Å; A122-V125 PolarHBondContact O-N 3.24Å; A122-Q126 WeakPolarHBondContact O-CB 3.24Å; A122-Q126 VanDerWaalsContact O-CG 3.27Å; A122-Q126 WeakPolarHBondContact O-CG 3.42Å; A122-Q126 PolarHBondContact O-N 3.39Å
123	M	93	Very high	95.8	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-61.6	-43.3	177.7	-174.9	59.7	-166.1	0	0	111.7	E120 L121 V125 Q126 L127 G206 D208 F209 F363 P365 V372	E120-M123 HydrophobicContact CB-CB 4.07Å; E120-M123 WeakPolarHBondContact O-CB 3.26Å; E120-M123 PolarHBondContact O-N 3.14Å; E120-M123 VanDerWaalsContact O-N 3.14Å; L121-M123 VanDerWaalsContact C-N 3.32Å; L121-M123 PolarHBondContact O-N 3.14Å; M123-V125 PolarHBondContact O-N 2.86Å; M123-Q126 PolarHBondContact O-N 3.25Å; M123-L127 VanDerWaalsContact O-CB 3.31Å; M123-L127 WeakPolarHBondContact O-CB 3.32Å; M123-L127 PolarHBondContact O-N 3.29Å; M123-G206 WeakPolarHBondContact CG-O 3.05Å; M123-D208 WeakPolarHBondContact CE-O 3.5Å; M123-F209 HydrophobicContact CE-CB 4.14Å; M123-F209 HydrophobicContact CE-CD2 3.92Å; M123-F363 HydrophobicContact CE-CB 3.89Å; M123-F363 HydrophobicContact CE-CD2 4.16Å; M123-F363 HydrophobicContact CE-CG 4.32Å; M123-F363 HydrophobicContact SD-CB 4.42Å; M123-P365 HydrophobicContact CB-CG 4.05Å; M123-P365 HydrophobicContact CG-CG 4.12Å; M123-P365 HydrophobicContact SD-CG 3.48Å; M123-P365 WeakPolarHBondContact SD-CG 3.35Å; M123-V372 HydrophobicContact CE-CG2 4.17Å; M123-V372 HydrophobicContact SD-CB 4.4Å; M123-V372 HydrophobicContact SD-CG1 3.87Å; M123-V372 HydrophobicContact SD-CG2 3.8Å
124	F	96.4	Very high	95.7	Very high	1 Å²	1	15 Å²	15	0%	0.004	8%	0.075	C	C	.	.	H	α-helix	trans	-60.7	-45.2	175.3	167.5	-117.6	0	0	0	112	I115 I117 E120 L121 A122 L127 L128 I140 V154 L157	I115-F124 HydrophobicContact CD1-CE2 4.49Å; I115-F124 HydrophobicContact CG2-CD2 4.4Å; I115-F124 HydrophobicContact CG2-CE2 4.47Å; I117-F124 HydrophobicContact CD1-CB 4.47Å; I117-F124 HydrophobicContact CD1-CD1 3.92Å; I117-F124 HydrophobicContact CD1-CD2 3.87Å; I117-F124 HydrophobicContact CD1-CE1 4.09Å; I117-F124 HydrophobicContact CD1-CE2 4.05Å; I117-F124 HydrophobicContact CD1-CG 3.8Å; I117-F124 HydrophobicContact CD1-CZ 4.15Å; I117-F124 HydrophobicContact CG2-CB 4.39Å; I117-F124 HydrophobicContact CG2-CD2 3.77Å; I117-F124 HydrophobicContact CG2-CE2 4.44Å; I117-F124 HydrophobicContact CG2-CG 4.25Å; E120-F124 PolarHBondContact O-N 3.05Å; L121-F124 HydrophobicContact CD1-CD1 4.27Å; L121-F124 PolarHBondContact O-N 2.9Å; A122-F124 VanDerWaalsContact C-N 3.35Å; A122-F124 PolarHBondContact O-N 3.23Å; F124-L127 PolarHBondContact O-N 2.96Å; F124-L128 HydrophobicContact CE2-CB 4.26Å; F124-L128 HydrophobicContact CE2-CD2 4.38Å; F124-L128 HydrophobicContact CZ-CD2 3.94Å; F124-L128 WeakPolarHBondContact O-CB 3.12Å; F124-L128 PolarHBondContact O-N 2.94Å; F124-I140 HydrophobicContact CE2-CD1 3.86Å; F124-I140 HydrophobicContact CE2-CG1 4.38Å; F124-I140 HydrophobicContact CE2-CG2 4.05Å; F124-I140 HydrophobicContact CZ-CD1 4.06Å; F124-I140 HydrophobicContact CZ-CG1 4.14Å; F124-I140 HydrophobicContact CZ-CG2 3.96Å; F124-V154 HydrophobicContact CD1-CG2 4.15Å; F124-V154 HydrophobicContact CE1-CB 4.49Å; F124-V154 HydrophobicContact CE1-CG1 3.97Å; F124-V154 HydrophobicContact CE1-CG2 4.13Å; F124-V154 HydrophobicContact CZ-CG1 4.4Å; F124-L157 HydrophobicContact CD1-CD2 4.43Å; F124-L157 HydrophobicContact CE1-CD2 3.83Å; F124-L157 HydrophobicContact CZ-CD2 4.49Å
125	V	96.4	Very high	95.6	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.9	-45.5	178.7	172.1	0	0	0	0	110.9	I78 L82 L95 L121 A122 M123 L128 R129 L157	I78-V125 HydrophobicContact CD1-CB 4.27Å; I78-V125 HydrophobicContact CD1-CG1 4.13Å; I78-V125 HydrophobicContact CG1-CG1 4.29Å; I78-V125 HydrophobicContact CG2-CB 3.95Å; I78-V125 HydrophobicContact CG2-CG1 4.02Å; I78-V125 HydrophobicContact CG2-CG2 3.68Å; L82-V125 HydrophobicContact CD1-CG2 3.87Å; L95-V125 HydrophobicContact CD1-CG1 4.2Å; L95-V125 HydrophobicContact CD2-CG1 4.35Å; L121-V125 HydrophobicContact CD1-CG2 4.5Å; L121-V125 HydrophobicContact CG-CG2 4.39Å; L121-V125 WeakPolarHBondContact O-CG2 3.31Å; L121-V125 PolarHBondContact O-N 2.82Å; A122-V125 PolarHBondContact O-N 3.24Å; M123-V125 PolarHBondContact O-N 2.86Å; V125-L128 PolarHBondContact O-N 3.24Å; V125-R129 WeakPolarHBondContact O-CB 3.31Å; V125-R129 PolarHBondContact O-N 3.39Å; V125-L157 HydrophobicContact CG2-CD2 3.85Å
126	Q	95.6	Very high	95.6	Very high	9 Å²	9	16.3 Å²	16.3	4%	0.042	8%	0.081	C	C	.	.	H	α-helix	trans	-63.3	-44.8	177.8	-68.9	178	-73.6	0	0	111.6	I78 A122 M123 R129 A130 F209 V372 E376	I78-Q126 HydrophobicContact CD1-CG 4.26Å; A122-Q126 WeakPolarHBondContact O-CB 3.24Å; A122-Q126 VanDerWaalsContact O-CG 3.27Å; A122-Q126 WeakPolarHBondContact O-CG 3.42Å; A122-Q126 PolarHBondContact O-N 3.39Å; M123-Q126 PolarHBondContact O-N 3.25Å; Q126-R129 PolarHBondContact O-N 2.96Å; Q126-A130 VanDerWaalsContact O-CB 3.31Å; Q126-A130 WeakPolarHBondContact O-CB 3.41Å; Q126-A130 PolarHBondContact O-N 3.48Å; Q126-F209 HydrophobicContact CB-CE2 4.2Å; Q126-V372 HydrophobicContact CB-CG1 4.35Å; Q126-E376 WeakPolarHBondContact CA-OE1 3.36Å; Q126-E376 WeakPolarHBondContact CG-OE2 3.26Å; Q126-E376 PolarHBondContact NE2-OE2 3.32Å
127	L	98.2	Very high	95.7	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-58.5	-55.5	174.8	172.1	57.6	0	0	0	110.7	I115 M123 F124 R129 A130 I131 L204 D208	I115-L127 HydrophobicContact CG2-CD2 3.91Å; M123-L127 VanDerWaalsContact O-CB 3.31Å; M123-L127 WeakPolarHBondContact O-CB 3.32Å; M123-L127 PolarHBondContact O-N 3.29Å; F124-L127 PolarHBondContact O-N 2.96Å; L127-R129 VanDerWaalsContact C-N 3.31Å; L127-R129 PolarHBondContact O-N 3.44Å; L127-A130 PolarHBondContact O-N 3.02Å; L127-A130 VanDerWaalsContact O-N 3.13Å; L127-I131 HydrophobicContact CD1-CD1 4.39Å; L127-I131 HydrophobicContact CD1-CG2 4.24Å; L127-I131 WeakPolarHBondContact O-CG1 3.23Å; L127-I131 PolarHBondContact O-N 3.12Å; L127-I131 VanDerWaalsContact O-N 3.14Å; L127-L204 HydrophobicContact CD1-CD1 4.26Å; L127-L204 HydrophobicContact CD2-CD1 4.48Å; L127-D208 WeakPolarHBondContact CD1-O 3.37Å
128	L	98.6	Very high	95.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-58.4	-46.2	-178.7	-176.1	62.6	0	0	0	110.3	F97 I115 F124 V125 A130 I131 Y132 Y138 L157 V164	F97-L128 HydrophobicContact CE1-CD2 4.39Å; F97-L128 HydrophobicContact CE1-CG 4.07Å; F97-L128 HydrophobicContact CZ-CD2 4.42Å; F97-L128 HydrophobicContact CZ-CG 4.43Å; I115-L128 HydrophobicContact CD1-CD1 4.2Å; F124-L128 HydrophobicContact CE2-CB 4.26Å; F124-L128 HydrophobicContact CE2-CD2 4.38Å; F124-L128 HydrophobicContact CZ-CD2 3.94Å; F124-L128 WeakPolarHBondContact O-CB 3.12Å; F124-L128 PolarHBondContact O-N 2.94Å; V125-L128 PolarHBondContact O-N 3.24Å; L128-A130 VanDerWaalsContact C-N 3.29Å; L128-A130 PolarHBondContact O-N 2.75Å; L128-I131 PolarHBondContact O-N 2.93Å; L128-Y132 WeakPolarHBondContact O-CA 3.24Å; L128-Y132 WeakPolarHBondContact O-CB 3.45Å; L128-Y132 PolarHBondContact O-N 2.83Å; L128-Y138 HydrophobicContact CD1-CD1 3.9Å; L128-Y138 HydrophobicContact CD1-CE1 4.43Å; L128-Y138 HydrophobicContact CD1-CG 4.12Å; L128-L157 HydrophobicContact CD2-CD2 3.88Å; L128-L157 HydrophobicContact CD2-CG 4.43Å; L128-V164 HydrophobicContact CD2-CG1 4.43Å
129	R	97.8	Very high	96.2	Very high	14 Å²	14	12.7 Å²	12.7	5%	0.053	6%	0.064	C	C	.	.	H	α-helix	trans	-59.6	-35.3	177	174.4	168.2	71.3	-177.8	1.8	114	L95 F97 V125 Q126 L127 E376	L95-R129 WeakPolarHBondContact O-CD 3.21Å; L95-R129 PolarHBondContact O-NH1 2.81Å; F97-R129 HydrophobicContact CD1-CB 4.38Å; F97-R129 VanDerWaalsContact CE1-CA 3.45Å; F97-R129 HydrophobicContact CE1-CB 3.91Å; F97-R129 HydrophobicContact CE2-CB 4.41Å; F97-R129 HydrophobicContact CZ-CB 3.93Å; V125-R129 WeakPolarHBondContact O-CB 3.31Å; V125-R129 PolarHBondContact O-N 3.39Å; Q126-R129 PolarHBondContact O-N 2.96Å; L127-R129 VanDerWaalsContact C-N 3.31Å; L127-R129 PolarHBondContact O-N 3.44Å; R129-E376 IonicContact CZ-OE1 3.41Å; R129-E376 IonicContact CZ-OE2 2.86Å; R129-E376 IonicContact NE-OE1 2.66Å; R129-E376 PolarHBondContact NE-OE1 3.22Å; R129-E376 IonicContact NH2-OE1 3.56Å; R129-E376 PolarHBondContact NH2-OE1 3.06Å; R129-E376 IonicContact NH2-OE2 3.11Å; R129-E376 PolarHBondContact NH2-OE2 3.27Å
130	A	98.3	Very high	96.6	Very high	13 Å²	13	8.7 Å²	8.7	11%	0.107	5%	0.047	C	C	.	.	H	α-helix	trans	-73.8	-32.2	178.9	0	0	0	0	0	112.3	Q126 L127 L128 F209 P210 H379	Q126-A130 VanDerWaalsContact O-CB 3.31Å; Q126-A130 WeakPolarHBondContact O-CB 3.41Å; Q126-A130 PolarHBondContact O-N 3.48Å; L127-A130 PolarHBondContact O-N 3.02Å; L127-A130 VanDerWaalsContact O-N 3.13Å; L128-A130 VanDerWaalsContact C-N 3.29Å; L128-A130 PolarHBondContact O-N 2.75Å; A130-F209 HydrophobicContact CB-CE1 4.38Å; A130-F209 HydrophobicContact CB-CE2 4.09Å; A130-F209 HydrophobicContact CB-CZ 3.71Å; A130-P210 HydrophobicContact CB-CG 3.6Å; A130-H379 PolarHBondContact O-CE1 3.08Å
131	I	98.6	Very high	97	Very high	7 Å²	7	6.8 Å²	6.8	4%	0.036	4%	0.038	C	C	.	.	H	α-helix	trans	-101.8	-10.6	-178.1	67.9	177.2	0	0	0	114.3	Y113 I115 L127 L128 V133 Y138 L204 P210 F359	Y113-I131 HydrophobicContact CD1-CD1 4.07Å; Y113-I131 HydrophobicContact CD2-CD1 4.44Å; Y113-I131 HydrophobicContact CE1-CD1 4.41Å; Y113-I131 HydrophobicContact CG-CD1 4.07Å; I115-I131 HydrophobicContact CD1-CD1 3.85Å; L127-I131 HydrophobicContact CD1-CD1 4.39Å; L127-I131 HydrophobicContact CD1-CG2 4.24Å; L127-I131 WeakPolarHBondContact O-CG1 3.23Å; L127-I131 PolarHBondContact O-N 3.12Å; L127-I131 VanDerWaalsContact O-N 3.14Å; L128-I131 PolarHBondContact O-N 2.93Å; I131-V133 PolarHBondContact O-N 2.84Å; I131-Y138 HydrophobicContact CD1-CD1 4.15Å; I131-Y138 HydrophobicContact CD1-CE1 3.91Å; I131-Y138 HydrophobicContact CG1-CD1 4.38Å; I131-Y138 HydrophobicContact CG1-CE1 3.77Å; I131-Y138 PolarHBondContact O-OH 3.06Å; I131-L204 HydrophobicContact CD1-CD1 3.61Å; I131-P210 HydrophobicContact CG2-CB 4.03Å; I131-P210 HydrophobicContact CG2-CG 3.75Å; I131-F359 HydrophobicContact CG2-CE1 3.9Å; I131-F359 HydrophobicContact CG2-CZ 4.37Å
132	Y	98.6	Very high	97.2	Very high	14 Å²	14	6.5 Å²	6.5	6%	0.055	4%	0.036	C	C	.	.			trans	-70.7	124.8	-174.3	-178.9	-92.8	0	0	0	111.8	F97 I98 L128 Y138 F161 N163 V164	F97-Y132 AromaticContact CD1-CD1 3.77Å; F97-Y132 HydrophobicContact CD1-CD1 3.77Å; F97-Y132 AromaticContact CD1-CG 3.81Å; F97-Y132 HydrophobicContact CD1-CG 3.81Å; F97-Y132 HydrophobicContact CE1-CG 4.19Å; I98-Y132 WeakPolarHBondContact O-CD1 3.37Å; I98-Y132 VanDerWaalsContact O-CE1 3.31Å; I98-Y132 WeakPolarHBondContact O-CE1 3.4Å; L128-Y132 WeakPolarHBondContact O-CA 3.24Å; L128-Y132 WeakPolarHBondContact O-CB 3.45Å; L128-Y132 PolarHBondContact O-N 2.83Å; Y132-Y138 VanDerWaalsContact CA-OH 3.23Å; Y132-Y138 WeakPolarHBondContact CA-OH 3.35Å; Y132-Y138 HydrophobicContact CD2-CD2 4.15Å; Y132-Y138 AromaticContact CD2-CE2 3.72Å; Y132-Y138 HydrophobicContact CD2-CE2 3.72Å; Y132-Y138 HydrophobicContact CE2-CD2 4.42Å; Y132-Y138 HydrophobicContact CE2-CE2 4.11Å; Y132-F161 HydrophobicContact CD1-CE1 4.41Å; Y132-F161 HydrophobicContact CD2-CD1 4.47Å; Y132-F161 AromaticContact CE1-CD1 3.83Å; Y132-F161 HydrophobicContact CE1-CD1 3.83Å; Y132-F161 AromaticContact CE1-CE1 3.9Å; Y132-F161 HydrophobicContact CE1-CE1 3.9Å; Y132-F161 HydrophobicContact CE2-CB 3.97Å; Y132-F161 AromaticContact CE2-CD1 3.68Å; Y132-F161 HydrophobicContact CE2-CD1 3.68Å; Y132-F161 HydrophobicContact CE2-CE1 4.32Å; Y132-F161 AromaticContact CE2-CG 3.86Å; Y132-F161 HydrophobicContact CE2-CG 3.86Å; Y132-F161 AromaticContact CZ-CD1 3.3Å; Y132-F161 AromaticContact CZ-CE1 3.87Å; Y132-F161 AromaticContact CZ-CG 3.96Å; Y132-F161 VanDerWaalsContact OH-CD1 3.29Å; Y132-F161 WeakPolarHBondContact OH-CD1 3.37Å; Y132-N163 VanDerWaalsContact CE2-OD1 3.24Å; Y132-N163 WeakPolarHBondContact CE2-OD1 3.2Å; Y132-N163 PolarHBondContact OH-OD1 2.82Å; Y132-V164 HydrophobicContact CD2-CG2 4.01Å; Y132-V164 HydrophobicContact CE2-CG2 3.76Å
133	V	97.4	Very high	97.3	Very high	7 Å²	7	6.6 Å²	6.6	4%	0.042	4%	0.036	C	C	.	.			trans	-141.9	149.6	164.4	-65.4	0	0	0	0	108	I131 Q135 N136 Y138 N163	I131-V133 PolarHBondContact O-N 2.84Å; V133-Q135 VanDerWaalsContact C-N 3.29Å; V133-Q135 HydrophobicContact CG2-CG 4.42Å; V133-Q135 PolarHBondContact O-N 3.08Å; V133-N136 HydrophobicContact CG2-CB 3.81Å; V133-N136 WeakPolarHBondContact CG2-ND2 2.8Å; V133-N136 PolarHBondContact O-N 3Å; V133-Y138 PolarHBondContact N-OH 3.12Å; V133-N163 PolarHBondContact O-ND2 3.05Å; V133-N163 VanDerWaalsContact O-ND2 3.09Å
134	P	96.9	Very high	97.3	Very high	31 Å²	31	10.7 Å²	10.7	20%	0.201	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-21.2	-168.4	27.3	-37.8	0	0	0	115	P101 N163	P101-P134 VanDerWaalsContact CD-CG 3.47Å; P101-P134 HydrophobicContact CG-CG 3.94Å; P134-N163 PolarHBondContact O-ND2 3.3Å
135	Q	97.1	Very high	97.1	Very high	28 Å²	28	17.3 Å²	17.3	13%	0.131	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-16.8	-179.7	71.9	-82.6	18	0	0	114.1	E106 S110 V133	E106-Q135 VanDerWaalsContact C-NE2 3.3Å; E106-Q135 VanDerWaalsContact O-CG 3.26Å; E106-Q135 WeakPolarHBondContact O-CG 3.49Å; E106-Q135 PolarHBondContact O-NE2 2.03Å; S110-Q135 VanDerWaalsContact CB-O 3.27Å; S110-Q135 WeakPolarHBondContact CB-O 3.35Å; S110-Q135 PolarHBondContact OG-O 2.03Å; V133-Q135 VanDerWaalsContact C-N 3.29Å; V133-Q135 HydrophobicContact CG2-CG 4.42Å; V133-Q135 PolarHBondContact O-N 3.08Å
136	N	98.5	Very high	96.9	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.086	C	C	.	.	S	Bend	trans	-82.8	172.5	176.6	-77.1	-4.4	0	0	0	111.3	L111 V133 Y138 N163 N214	L111-N136 PolarHBondContact N-OD1 2.63Å; L111-N136 CarbonylContact O-C 3.56Å; L111-N136 WeakPolarHBondContact O-CA 3.07Å; L111-N136 WeakPolarHBondContact O-CB 3.01Å; V133-N136 HydrophobicContact CG2-CB 3.81Å; V133-N136 WeakPolarHBondContact CG2-ND2 2.8Å; V133-N136 PolarHBondContact O-N 3Å; N136-Y138 HydrophobicContact CB-CE2 3.68Å; N136-Y138 WeakPolarHBondContact CB-OH 3.46Å; N136-Y138 PolarHBondContact ND2-OH 3.34Å; N136-N163 VanDerWaalsContact O-CB 3.3Å; N136-N163 WeakPolarHBondContact O-CB 3.5Å; N136-N163 PolarHBondContact O-ND2 2.77Å; N136-N214 PolarHBondContact ND2-OD1 2.86Å
137	V	98.7	Very high	96.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138.2	-179.1	-166.2	0	0	0	0	110.5	L111 A112 Y113 N163 F165 L191 F196 W198	L111-V137 PolarHBondContact O-N 3.22Å; A112-V137 CarbonylContact C-O 3.02Å; A112-V137 WeakPolarHBondContact CA-O 3.48Å; A112-V137 HydrophobicContact CB-CB 4.43Å; Y113-V137 PolarHBondContact N-O 2.75Å; V137-N163 WeakPolarHBondContact CA-O 3.21Å; V137-F165 HydrophobicContact CG1-CE1 3.8Å; V137-L191 HydrophobicContact CB-CD2 4.11Å; V137-L191 HydrophobicContact CG1-CD2 3.6Å; V137-F196 HydrophobicContact CG2-CB 3.37Å; V137-F196 HydrophobicContact CG2-CG 4.22Å; V137-W198 HydrophobicContact CG2-CB 4.27Å
138	Y	98.9	Very high	96.6	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	111.4	-172.8	-52.8	-94.3	0	0	0	111	Y113 L128 I131 Y132 V133 N136 N163 V164 F165	Y113-Y138 AromaticContact CD2-CD1 3.75Å; Y113-Y138 HydrophobicContact CD2-CD1 3.75Å; Y113-Y138 AromaticContact CD2-CE1 3.35Å; Y113-Y138 HydrophobicContact CD2-CE1 3.35Å; Y113-Y138 AromaticContact CE2-CE1 3.96Å; Y113-Y138 HydrophobicContact CE2-CE1 3.96Å; Y113-Y138 HydrophobicContact CG-CD1 4.05Å; Y113-Y138 HydrophobicContact CG-CE1 4.02Å; L128-Y138 HydrophobicContact CD1-CD1 3.9Å; L128-Y138 HydrophobicContact CD1-CE1 4.43Å; L128-Y138 HydrophobicContact CD1-CG 4.12Å; I131-Y138 HydrophobicContact CD1-CD1 4.15Å; I131-Y138 HydrophobicContact CD1-CE1 3.91Å; I131-Y138 HydrophobicContact CG1-CD1 4.38Å; I131-Y138 HydrophobicContact CG1-CE1 3.77Å; I131-Y138 PolarHBondContact O-OH 3.06Å; Y132-Y138 VanDerWaalsContact CA-OH 3.23Å; Y132-Y138 WeakPolarHBondContact CA-OH 3.35Å; Y132-Y138 HydrophobicContact CD2-CD2 4.15Å; Y132-Y138 AromaticContact CD2-CE2 3.72Å; Y132-Y138 HydrophobicContact CD2-CE2 3.72Å; Y132-Y138 HydrophobicContact CE2-CD2 4.42Å; Y132-Y138 HydrophobicContact CE2-CE2 4.11Å; V133-Y138 PolarHBondContact N-OH 3.12Å; N136-Y138 HydrophobicContact CB-CE2 3.68Å; N136-Y138 WeakPolarHBondContact CB-OH 3.46Å; N136-Y138 PolarHBondContact ND2-OH 3.34Å; Y138-N163 PolarHBondContact N-O 3.34Å; Y138-V164 HydrophobicContact CD2-CG2 3.78Å; Y138-V164 HydrophobicContact CG-CG2 4.17Å; Y138-V164 WeakPolarHBondContact O-CA 3.24Å; Y138-F165 PolarHBondContact O-N 3.14Å
139	C	98.8	Very high	96.4	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	121.2	169	-176.5	0	0	0	0	110.6	Y113 I114 I115 F165 C187 L191	Y113-C139 PolarHBondContact O-N 3.28Å; I114-C139 CarbonylContact C-O 3.59Å; I114-C139 WeakPolarHBondContact CA-O 3.41Å; I115-C139 PolarHBondContact N-O 3.13Å; C139-F165 HydrophobicContact CB-CD2 4.42Å; C139-F165 HydrophobicContact CB-CE2 3.64Å; C139-F165 HydrophobicContact CB-CZ 3.72Å; C139-F165 VanDerWaalsContact SG-CE2 3.5Å; C139-C187 HydrophobicContact CB-CB 3.61Å; C139-C187 WeakPolarHBondContact CB-SG 3.36Å; C139-C187 WeakPolarHBondContact SG-CA 3.31Å; C139-C187 WeakPolarHBondContact SG-CB 3.36Å; C139-C187 CovalentContact SG-SG 2.03Å; C139-C187 PolarHBondContact SG-SG 3.42Å; C139-L191 HydrophobicContact CB-CD1 4.23Å; C139-L191 HydrophobicContact CB-CD2 4.21Å; C139-L191 HydrophobicContact CB-CG 4.03Å
140	I	98.6	Very high	96.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	113.7	-179.9	-46.8	-52.8	0	0	0	109	I115 I117 F124 V142 V154 V158 V164 F165 I166 S167	I115-I140 HydrophobicContact CB-CD1 3.94Å; I115-I140 HydrophobicContact CD1-CD1 3.72Å; I115-I140 HydrophobicContact CG1-CD1 3.96Å; I117-I140 HydrophobicContact CD1-CG2 3.62Å; I117-I140 HydrophobicContact CG1-CG2 4.08Å; F124-I140 HydrophobicContact CE2-CD1 3.86Å; F124-I140 HydrophobicContact CE2-CG1 4.38Å; F124-I140 HydrophobicContact CE2-CG2 4.05Å; F124-I140 HydrophobicContact CZ-CD1 4.06Å; F124-I140 HydrophobicContact CZ-CG1 4.14Å; F124-I140 HydrophobicContact CZ-CG2 3.96Å; I140-V142 HydrophobicContact CG2-CG2 4.05Å; I140-V154 HydrophobicContact CG2-CG1 4.25Å; I140-V158 HydrophobicContact CG1-CG2 4.11Å; I140-V164 HydrophobicContact CD1-CG1 4.17Å; I140-V164 HydrophobicContact CG1-CG1 3.81Å; I140-F165 PolarHBondContact N-O 2.65Å; I140-I166 HydrophobicContact CB-CG1 4.49Å; I140-I166 CarbonylContact O-C 3.57Å; I140-I166 VanDerWaalsContact O-CA 3.29Å; I140-I166 WeakPolarHBondContact O-CA 3.01Å; I140-S167 PolarHBondContact O-N 2.85Å
141	H	98	Very high	96	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	109.4	171.7	-177.6	-73.9	0	0	0	109.9	I115 T116 I117 E171 A183	I115-H141 PolarHBondContact O-N 2.89Å; T116-H141 WeakPolarHBondContact CA-O 3.41Å; T116-H141 HydrophobicContact CG2-CB 4.2Å; I117-H141 PolarHBondContact N-O 2.93Å; H141-E171 PolarHBondContact CE1-N 2.95Å; H141-E171 PolarHBondContact NE2-N 2.85Å; H141-A183 HydrophobicContact CB-CB 4.46Å
142	V	96.7	Very high	95.8	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.2	176.7	-168.6	0	0	0	0	109.8	I117 I140 E144 T146 Y150 K151 V154 I166	I117-V142 HydrophobicContact CD1-CG2 4.1Å; I117-V142 HydrophobicContact CG1-CB 4.45Å; I117-V142 HydrophobicContact CG1-CG1 4.45Å; I117-V142 HydrophobicContact CG1-CG2 4.06Å; I140-V142 HydrophobicContact CG2-CG2 4.05Å; V142-E144 PolarHBondContact O-N 3.39Å; V142-T146 HydrophobicContact CG1-CG2 4.49Å; V142-Y150 HydrophobicContact CG1-CD1 4.43Å; V142-Y150 HydrophobicContact CG1-CE1 4.3Å; V142-K151 HydrophobicContact CG1-CG 3.93Å; V142-V154 HydrophobicContact CG2-CG1 3.92Å; V142-I166 HydrophobicContact CG2-CD1 4.29Å; V142-I166 HydrophobicContact CG2-CG2 4.24Å
143	D	93.2	Very high	95.6	Very high	13 Å²	13	41.8 Å²	41.8	7%	0.07	20%	0.204	C	C	.	.			trans	-53.6	132.5	176.4	-173.8	-12.4	0	0	0	111.2	I117 H118 K145 T146 K151 M173	I117-D143 PolarHBondContact O-N 2.98Å; H118-D143 HydrophobicContact CB-CB 3.75Å; D143-K145 PolarHBondContact O-N 3.34Å; D143-K145 PolarHBondContact OD1-N 3.01Å; D143-T146 WeakPolarHBondContact O-CB 3.35Å; D143-T146 PolarHBondContact O-N 3Å; D143-T146 VanDerWaalsContact O-N 3.13Å; D143-T146 PolarHBondContact O-OG1 2.81Å; D143-K151 WeakPolarHBondContact O-CE 3.44Å; D143-M173 HydrophobicContact CB-CB 4.24Å; D143-M173 HydrophobicContact CB-CE 3.95Å; D143-M173 HydrophobicContact CB-CG 3.97Å; D143-M173 PolarHBondContact OD1-N 3.16Å; D143-M173 WeakPolarHBondContact OD2-CB 3.2Å; D143-M173 PolarHBondContact OD2-N 3.45Å
144	E	91.7	Very high	95.5	Very high	87 Å²	87	41.5 Å²	41.5	41%	0.407	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-27.2	177.6	-163.6	-168.8	145.9	0	0	112.4	V142 T146 K151 R170 E171 K172	V142-E144 PolarHBondContact O-N 3.39Å; E144-T146 VanDerWaalsContact C-N 3.29Å; E144-T146 PolarHBondContact O-N 3.02Å; E144-K151 PolarHBondContact O-NZ 3.18Å; E144-R170 HydrophobicContact CB-CB 4.46Å; E144-E171 PolarHBondContact N-O 2.88Å; E144-K172 HydrophobicContact CB-CG 3.88Å; E144-K172 HydrophobicContact CG-CG 4.41Å; E144-K172 WeakPolarHBondContact OE1-CE 3.46Å; E144-K172 IonicContact OE1-NZ 3.73Å; E144-K172 WeakPolarHBondContact OE2-CE 3.25Å; E144-K172 WeakPolarHBondContact OE2-CG 3.25Å
145	K	92.3	Very high	95.4	Very high	140 Å²	140	43.2 Å²	43.2	61%	0.609	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-15	178.6	-65.6	173.5	-177	159.1	0	113.9	D143 K172 M173	D143-K145 PolarHBondContact O-N 3.34Å; D143-K145 PolarHBondContact OD1-N 3.01Å; K145-K172 HydrophobicContact CG-CG 4.43Å; K145-M173 PolarHBondContact NZ-O 2.93Å
146	T	92.3	Very high	95.3	Very high	8 Å²	8	43.6 Å²	43.6	5%	0.049	21%	0.212	C	C	.	.	S	Bend	trans	-66.4	142.2	-173.5	-63.3	0	0	0	0	112.1	H118 V142 D143 E144 Y150 K151	H118-T146 WeakPolarHBondContact CA-OG1 3.48Å; H118-T146 WeakPolarHBondContact O-CG2 3.18Å; H118-T146 PolarHBondContact O-OG1 2.9Å; V142-T146 HydrophobicContact CG1-CG2 4.49Å; D143-T146 WeakPolarHBondContact O-CB 3.35Å; D143-T146 PolarHBondContact O-N 3Å; D143-T146 VanDerWaalsContact O-N 3.13Å; D143-T146 PolarHBondContact O-OG1 2.81Å; E144-T146 VanDerWaalsContact C-N 3.29Å; E144-T146 PolarHBondContact O-N 3.02Å; T146-Y150 HydrophobicContact CG2-CD1 3.19Å; T146-Y150 HydrophobicContact CG2-CD2 4.42Å; T146-Y150 HydrophobicContact CG2-CE1 3.86Å; T146-Y150 HydrophobicContact CG2-CG 3.52Å; T146-K151 WeakPolarHBondContact O-CE 3.21Å; T146-K151 PolarHBondContact O-NZ 3.48Å
147	P	94.8	Very high	95.2	Very high	90 Å²	90	43.6 Å²	43.6	58%	0.584	21%	0.212	S	C	*	.			trans	-56.8	149.2	-178.4	-27.8	35.9	0	0	0	114	K149 Y150 K151	P147-K149 VanDerWaalsContact C-N 3.31Å; P147-K149 PolarHBondContact O-N 2.73Å; P147-Y150 PolarHBondContact O-N 2.89Å; P147-Y150 VanDerWaalsContact O-N 3.13Å; P147-K151 PolarHBondContact O-N 3.41Å; P147-K151 VanDerWaalsContact O-N 3.11Å
148	K	93.8	Very high	95.1	Very high	178 Å²	178	43.8 Å²	43.8	77%	0.774	21%	0.213	S	C	*	.	H	α-helix	trans	-56	-42.7	-179.7	-170.8	177.3	-179.4	-178.7	0	112.4	Y150 K151 T152	K148-Y150 VanDerWaalsContact C-N 3.31Å; K148-Y150 PolarHBondContact O-N 2.7Å; K148-K151 PolarHBondContact O-N 3.39Å; K148-T152 PolarHBondContact O-N 3.13Å; K148-T152 PolarHBondContact O-OG1 2.79Å; K148-T152 VanDerWaalsContact O-OG1 3.09Å
149	K	92.7	Very high	94.9	Very high	147 Å²	147	49 Å²	49	64%	0.639	24%	0.241	S	C	*	.	H	α-helix	trans	-55.9	-43.5	178.1	-174.7	175.4	-179	177.1	0	112.3	H83 P147 A153	H83-K149 WeakPolarHBondContact CE1-CE 3.34Å; P147-K149 VanDerWaalsContact C-N 3.31Å; P147-K149 PolarHBondContact O-N 2.73Å; K149-A153 PolarHBondContact O-N 3.31Å; K149-A153 VanDerWaalsContact O-N 3.09Å
150	Y	93.6	Very high	94.8	Very high	26 Å²	26	50.2 Å²	50.2	10%	0.102	25%	0.249	C	C	.	.	H	α-helix	trans	-67.6	-46.5	177.1	-179	-77.4	0	0	0	111.4	I117 K119 L121 V142 T146 P147 K148 T152 A153 V154	I117-Y150 HydrophobicContact CD1-CE1 4.02Å; I117-Y150 HydrophobicContact CG1-CE1 4.28Å; K119-Y150 VanDerWaalsContact C-CE2 3.43Å; K119-Y150 PolarHBondContact O-OH 3.41Å; L121-Y150 HydrophobicContact CB-CD2 4.11Å; L121-Y150 HydrophobicContact CB-CE2 3.85Å; L121-Y150 HydrophobicContact CD1-CE2 4.29Å; V142-Y150 HydrophobicContact CG1-CD1 4.43Å; V142-Y150 HydrophobicContact CG1-CE1 4.3Å; T146-Y150 HydrophobicContact CG2-CD1 3.19Å; T146-Y150 HydrophobicContact CG2-CD2 4.42Å; T146-Y150 HydrophobicContact CG2-CE1 3.86Å; T146-Y150 HydrophobicContact CG2-CG 3.52Å; P147-Y150 PolarHBondContact O-N 2.89Å; P147-Y150 VanDerWaalsContact O-N 3.13Å; K148-Y150 VanDerWaalsContact C-N 3.31Å; K148-Y150 PolarHBondContact O-N 2.7Å; Y150-T152 VanDerWaalsContact C-N 3.29Å; Y150-T152 PolarHBondContact O-N 3.49Å; Y150-A153 PolarHBondContact O-N 3.36Å; Y150-V154 HydrophobicContact CD1-CG2 3.8Å; Y150-V154 HydrophobicContact CE1-CG2 3.49Å; Y150-V154 VanDerWaalsContact CE1-CG2 3.49Å; Y150-V154 WeakPolarHBondContact O-CG2 3.07Å; Y150-V154 PolarHBondContact O-N 3.37Å
151	K	94.4	Very high	94.7	Very high	45 Å²	45	50.8 Å²	50.8	20%	0.196	25%	0.252	C	S	.	.	H	α-helix	trans	-57.9	-41.7	176.8	-72.6	171.3	176.3	155.2	0	112.1	V142 D143 E144 T146 P147 K148 V154 Q155	V142-K151 HydrophobicContact CG1-CG 3.93Å; D143-K151 WeakPolarHBondContact O-CE 3.44Å; E144-K151 PolarHBondContact O-NZ 3.18Å; T146-K151 WeakPolarHBondContact O-CE 3.21Å; T146-K151 PolarHBondContact O-NZ 3.48Å; P147-K151 PolarHBondContact O-N 3.41Å; P147-K151 VanDerWaalsContact O-N 3.11Å; K148-K151 PolarHBondContact O-N 3.39Å; K151-V154 PolarHBondContact O-N 2.76Å; K151-Q155 WeakPolarHBondContact O-CB 3.47Å; K151-Q155 PolarHBondContact O-N 2.73Å
152	T	94.1	Very high	94.6	Very high	76 Å²	76	57.9 Å²	57.9	47%	0.466	29%	0.285	S	S	.	.	H	α-helix	trans	-61.7	-47.8	175.5	-60	0	0	0	0	111.1	K148 Y150 V154 Q155 T156	K148-T152 PolarHBondContact O-N 3.13Å; K148-T152 PolarHBondContact O-OG1 2.79Å; K148-T152 VanDerWaalsContact O-OG1 3.09Å; Y150-T152 VanDerWaalsContact C-N 3.29Å; Y150-T152 PolarHBondContact O-N 3.49Å; T152-V154 VanDerWaalsContact C-N 3.34Å; T152-V154 PolarHBondContact O-N 3.22Å; T152-Q155 WeakPolarHBondContact O-CB 3.47Å; T152-Q155 PolarHBondContact O-N 3.05Å; T152-Q155 VanDerWaalsContact O-N 3.16Å; T152-T156 PolarHBondContact O-N 2.86Å; T152-T156 PolarHBondContact O-OG1 2.99Å; T152-T156 VanDerWaalsContact O-OG1 3.06Å
153	A	94.4	Very high	94.7	Very high	1 Å²	1	58 Å²	58	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-39.5	179.8	0	0	0	0	0	112.7	L82 L121 K149 Y150 T156 L157	L82-A153 HydrophobicContact CB-CB 4.25Å; L121-A153 HydrophobicContact CD1-CB 4.24Å; L121-A153 HydrophobicContact CD2-CB 3.58Å; K149-A153 PolarHBondContact O-N 3.31Å; K149-A153 VanDerWaalsContact O-N 3.09Å; Y150-A153 PolarHBondContact O-N 3.36Å; A153-T156 PolarHBondContact O-N 2.88Å; A153-L157 PolarHBondContact O-N 2.93Å; A153-L157 VanDerWaalsContact O-N 3.17Å
154	V	95.8	Very high	95	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-46.4	172.4	173.4	0	0	0	0	110.6	I117 L121 F124 I140 V142 Y150 K151 T152 T156 L157 V158 I166	I117-V154 HydrophobicContact CD1-CG1 4.1Å; I117-V154 HydrophobicContact CD1-CG2 3.8Å; L121-V154 HydrophobicContact CD1-CG2 3.86Å; F124-V154 HydrophobicContact CD1-CG2 4.15Å; F124-V154 HydrophobicContact CE1-CB 4.49Å; F124-V154 HydrophobicContact CE1-CG1 3.97Å; F124-V154 HydrophobicContact CE1-CG2 4.13Å; F124-V154 HydrophobicContact CZ-CG1 4.4Å; I140-V154 HydrophobicContact CG2-CG1 4.25Å; V142-V154 HydrophobicContact CG2-CG1 3.92Å; Y150-V154 HydrophobicContact CD1-CG2 3.8Å; Y150-V154 HydrophobicContact CE1-CG2 3.49Å; Y150-V154 VanDerWaalsContact CE1-CG2 3.49Å; Y150-V154 WeakPolarHBondContact O-CG2 3.07Å; Y150-V154 PolarHBondContact O-N 3.37Å; K151-V154 PolarHBondContact O-N 2.76Å; T152-V154 VanDerWaalsContact C-N 3.34Å; T152-V154 PolarHBondContact O-N 3.22Å; V154-T156 VanDerWaalsContact C-N 3.34Å; V154-T156 PolarHBondContact O-N 3.16Å; V154-L157 PolarHBondContact O-N 3.13Å; V154-V158 HydrophobicContact CG1-CG2 4.05Å; V154-V158 WeakPolarHBondContact O-CB 3.38Å; V154-V158 VanDerWaalsContact O-CG2 3.26Å; V154-V158 WeakPolarHBondContact O-CG2 3.41Å; V154-V158 PolarHBondContact O-N 2.87Å; V154-I166 HydrophobicContact CG1-CD1 4Å
155	Q	95.5	Very high	95.3	Very high	67 Å²	67	55.9 Å²	55.9	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-60.8	-42.9	178.3	-170.1	71.2	65.6	0	0	111.9	K151 T152 L157 V158 N159 I166	K151-Q155 WeakPolarHBondContact O-CB 3.47Å; K151-Q155 PolarHBondContact O-N 2.73Å; T152-Q155 WeakPolarHBondContact O-CB 3.47Å; T152-Q155 PolarHBondContact O-N 3.05Å; T152-Q155 VanDerWaalsContact O-N 3.16Å; Q155-L157 VanDerWaalsContact C-N 3.32Å; Q155-L157 PolarHBondContact O-N 3.49Å; Q155-V158 PolarHBondContact O-N 2.91Å; Q155-N159 PolarHBondContact NE2-OD1 2.89Å; Q155-N159 WeakPolarHBondContact O-CB 3.27Å; Q155-N159 PolarHBondContact O-N 3.47Å; Q155-N159 PolarHBondContact O-ND2 3.05Å; Q155-N159 PolarHBondContact O-OD1 3.21Å; Q155-I166 HydrophobicContact CB-CD1 4.41Å
156	T	94.9	Very high	95.6	Very high	37 Å²	37	50.5 Å²	50.5	23%	0.227	25%	0.252	C	S	.	.	H	α-helix	trans	-55.9	-46.5	176	-61.1	0	0	0	0	111.2	L82 I91 T152 A153 V154	L82-T156 HydrophobicContact CD2-CG2 4.41Å; I91-T156 HydrophobicContact CD1-CG2 4Å; T152-T156 PolarHBondContact O-N 2.86Å; T152-T156 PolarHBondContact O-OG1 2.99Å; T152-T156 VanDerWaalsContact O-OG1 3.06Å; A153-T156 PolarHBondContact O-N 2.88Å; V154-T156 VanDerWaalsContact C-N 3.34Å; V154-T156 PolarHBondContact O-N 3.16Å
157	L	95.9	Very high	95.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.5	-49.7	178.1	-178.6	67.2	0	0	0	112.1	L82 I91 L95 F97 F124 V125 L128 A153 V154 Q155 N159 C160 F161	L82-L157 HydrophobicContact CD2-CB 3.85Å; L82-L157 HydrophobicContact CD2-CD1 4.17Å; I91-L157 HydrophobicContact CG2-CD1 4.14Å; L95-L157 HydrophobicContact CD1-CD1 3.78Å; F97-L157 HydrophobicContact CE2-CD1 3.93Å; F97-L157 HydrophobicContact CZ-CD1 4.09Å; F124-L157 HydrophobicContact CD1-CD2 4.43Å; F124-L157 HydrophobicContact CE1-CD2 3.83Å; F124-L157 HydrophobicContact CZ-CD2 4.49Å; V125-L157 HydrophobicContact CG2-CD2 3.85Å; L128-L157 HydrophobicContact CD2-CD2 3.88Å; L128-L157 HydrophobicContact CD2-CG 4.43Å; A153-L157 PolarHBondContact O-N 2.93Å; A153-L157 VanDerWaalsContact O-N 3.17Å; V154-L157 PolarHBondContact O-N 3.13Å; Q155-L157 VanDerWaalsContact C-N 3.32Å; Q155-L157 PolarHBondContact O-N 3.49Å; L157-N159 VanDerWaalsContact C-N 3.28Å; L157-N159 PolarHBondContact O-N 3.09Å; L157-C160 WeakPolarHBondContact O-CB 3.27Å; L157-C160 PolarHBondContact O-N 2.75Å; L157-C160 VanDerWaalsContact O-N 3.1Å; L157-F161 HydrophobicContact CD1-CE2 3.88Å; L157-F161 HydrophobicContact CG-CE2 4.27Å; L157-F161 WeakPolarHBondContact O-CD2 3.3Å
158	V	96.3	Very high	95.8	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-60.9	-38.7	-175.6	168.9	0	0	0	0	111.3	I140 V154 Q155 C160 F161 V164 I166	I140-V158 HydrophobicContact CG1-CG2 4.11Å; V154-V158 HydrophobicContact CG1-CG2 4.05Å; V154-V158 WeakPolarHBondContact O-CB 3.38Å; V154-V158 VanDerWaalsContact O-CG2 3.26Å; V154-V158 WeakPolarHBondContact O-CG2 3.41Å; V154-V158 PolarHBondContact O-N 2.87Å; Q155-V158 PolarHBondContact O-N 2.91Å; V158-C160 PolarHBondContact O-N 3.15Å; V158-F161 PolarHBondContact O-N 3.33Å; V158-F161 VanDerWaalsContact O-N 3.14Å; V158-V164 HydrophobicContact CB-CG1 4.29Å; V158-V164 HydrophobicContact CG1-CB 4.31Å; V158-V164 HydrophobicContact CG1-CG1 3.96Å; V158-V164 WeakPolarHBondContact CG1-O 3.29Å; V158-V164 HydrophobicContact CG2-CG1 3.84Å; V158-I166 HydrophobicContact CB-CG1 4.45Å; V158-I166 HydrophobicContact CG1-CG1 4.2Å; V158-I166 HydrophobicContact CG2-CG1 4.19Å
159	N	95.6	Very high	95.8	Very high	111 Å²	111	47.2 Å²	47.2	59%	0.594	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-12.9	178.5	-74.7	-4.3	0	0	0	114.2	Q155 L157	Q155-N159 PolarHBondContact NE2-OD1 2.89Å; Q155-N159 WeakPolarHBondContact O-CB 3.27Å; Q155-N159 PolarHBondContact O-N 3.47Å; Q155-N159 PolarHBondContact O-ND2 3.05Å; Q155-N159 PolarHBondContact O-OD1 3.21Å; L157-N159 VanDerWaalsContact C-N 3.28Å; L157-N159 PolarHBondContact O-N 3.09Å
160	C	96.2	Very high	95.6	Very high	25 Å²	25	44.7 Å²	44.7	17%	0.169	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-4.9	178.7	-67	0	0	0	0	115	C88 L157 V158	C88-C160 WeakPolarHBondContact CA-SG 3.4Å; C88-C160 HydrophobicContact CB-CB 3.47Å; C88-C160 VanDerWaalsContact CB-CB 3.47Å; C88-C160 WeakPolarHBondContact CB-SG 3.41Å; C88-C160 WeakPolarHBondContact SG-CA 3.41Å; C88-C160 WeakPolarHBondContact SG-CB 3.28Å; C88-C160 CovalentContact SG-SG 2.06Å; C88-C160 PolarHBondContact SG-SG 2.76Å; L157-C160 WeakPolarHBondContact O-CB 3.27Å; L157-C160 PolarHBondContact O-N 2.75Å; L157-C160 VanDerWaalsContact O-N 3.1Å; V158-C160 PolarHBondContact O-N 3.15Å
161	F	97.1	Very high	95.3	Very high	12 Å²	12	44.9 Å²	44.9	5%	0.053	23%	0.229	C	C	.	.			trans	-131.8	126	-177.6	-53.4	-77.2	0	0	0	110	F97 Y132 L157 V158 N163 V164	F97-F161 HydrophobicContact CB-CE1 4.17Å; F97-F161 HydrophobicContact CB-CZ 4.15Å; F97-F161 HydrophobicContact CD1-CE1 4.06Å; F97-F161 HydrophobicContact CD1-CE2 4.41Å; F97-F161 AromaticContact CD1-CZ 3.64Å; F97-F161 HydrophobicContact CD1-CZ 3.64Å; F97-F161 AromaticContact CD2-CZ 3.72Å; F97-F161 HydrophobicContact CD2-CZ 3.72Å; F97-F161 HydrophobicContact CE1-CE2 4.23Å; F97-F161 AromaticContact CE1-CZ 3.89Å; F97-F161 HydrophobicContact CE1-CZ 3.89Å; F97-F161 HydrophobicContact CE2-CE2 4.36Å; F97-F161 AromaticContact CE2-CZ 3.96Å; F97-F161 HydrophobicContact CE2-CZ 3.96Å; F97-F161 HydrophobicContact CG-CE1 4.02Å; F97-F161 AromaticContact CG-CZ 3.55Å; F97-F161 HydrophobicContact CG-CZ 3.55Å; F97-F161 HydrophobicContact CZ-CE2 4.2Å; F97-F161 HydrophobicContact CZ-CZ 4.05Å; Y132-F161 HydrophobicContact CD1-CE1 4.41Å; Y132-F161 HydrophobicContact CD2-CD1 4.47Å; Y132-F161 AromaticContact CE1-CD1 3.83Å; Y132-F161 HydrophobicContact CE1-CD1 3.83Å; Y132-F161 AromaticContact CE1-CE1 3.9Å; Y132-F161 HydrophobicContact CE1-CE1 3.9Å; Y132-F161 HydrophobicContact CE2-CB 3.97Å; Y132-F161 AromaticContact CE2-CD1 3.68Å; Y132-F161 HydrophobicContact CE2-CD1 3.68Å; Y132-F161 HydrophobicContact CE2-CE1 4.32Å; Y132-F161 AromaticContact CE2-CG 3.86Å; Y132-F161 HydrophobicContact CE2-CG 3.86Å; Y132-F161 AromaticContact CZ-CD1 3.3Å; Y132-F161 AromaticContact CZ-CE1 3.87Å; Y132-F161 AromaticContact CZ-CG 3.96Å; Y132-F161 VanDerWaalsContact OH-CD1 3.29Å; Y132-F161 WeakPolarHBondContact OH-CD1 3.37Å; L157-F161 HydrophobicContact CD1-CE2 3.88Å; L157-F161 HydrophobicContact CG-CE2 4.27Å; L157-F161 WeakPolarHBondContact O-CD2 3.3Å; V158-F161 PolarHBondContact O-N 3.33Å; V158-F161 VanDerWaalsContact O-N 3.14Å; F161-N163 PolarHBondContact O-N 3.12Å; F161-V164 HydrophobicContact CB-CB 3.96Å; F161-V164 HydrophobicContact CB-CG2 3.52Å; F161-V164 HydrophobicContact CD2-CG2 4.22Å; F161-V164 HydrophobicContact CG-CG2 4.08Å; F161-V164 PolarHBondContact O-N 2.85Å
162	E	96.6	Very high	94.8	Very high	149 Å²	149	48.1 Å²	48.1	70%	0.696	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-27.4	-178.5	-63.6	-166	-174.7	0	0	113.5	K195 F196	E162-K195 IonicContact OE2-NZ 3.05Å; E162-K195 PolarHBondContact OE2-NZ 3.04Å; E162-F196 HydrophobicContact CB-CE2 4.37Å; E162-F196 HydrophobicContact CB-CZ 3.94Å; E162-F196 VanDerWaalsContact O-CE2 3.3Å; E162-F196 WeakPolarHBondContact O-CE2 3.45Å
163	N	98.1	Very high	93.8	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	7.7	-175.8	64.1	-39	0	0	0	113.4	Y132 V133 P134 N136 V137 Y138 F161 F196	Y132-N163 VanDerWaalsContact CE2-OD1 3.24Å; Y132-N163 WeakPolarHBondContact CE2-OD1 3.2Å; Y132-N163 PolarHBondContact OH-OD1 2.82Å; V133-N163 PolarHBondContact O-ND2 3.05Å; V133-N163 VanDerWaalsContact O-ND2 3.09Å; P134-N163 PolarHBondContact O-ND2 3.3Å; N136-N163 VanDerWaalsContact O-CB 3.3Å; N136-N163 WeakPolarHBondContact O-CB 3.5Å; N136-N163 PolarHBondContact O-ND2 2.77Å; V137-N163 WeakPolarHBondContact CA-O 3.21Å; Y138-N163 PolarHBondContact N-O 3.34Å; F161-N163 PolarHBondContact O-N 3.12Å; N163-F196 HydrophobicContact CB-CD1 4.42Å; N163-F196 HydrophobicContact CB-CD2 4.11Å; N163-F196 HydrophobicContact CB-CE1 4.11Å; N163-F196 HydrophobicContact CB-CE2 3.78Å; N163-F196 HydrophobicContact CB-CG 4.42Å; N163-F196 HydrophobicContact CB-CZ 3.78Å
164	V	98.5	Very high	92.3	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.042	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	132.8	173.8	-171.5	0	0	0	0	108	L128 Y132 Y138 I140 V158 F161	L128-V164 HydrophobicContact CD2-CG1 4.43Å; Y132-V164 HydrophobicContact CD2-CG2 4.01Å; Y132-V164 HydrophobicContact CE2-CG2 3.76Å; Y138-V164 HydrophobicContact CD2-CG2 3.78Å; Y138-V164 HydrophobicContact CG-CG2 4.17Å; Y138-V164 WeakPolarHBondContact O-CA 3.24Å; I140-V164 HydrophobicContact CD1-CG1 4.17Å; I140-V164 HydrophobicContact CG1-CG1 3.81Å; V158-V164 HydrophobicContact CB-CG1 4.29Å; V158-V164 HydrophobicContact CG1-CB 4.31Å; V158-V164 HydrophobicContact CG1-CG1 3.96Å; V158-V164 WeakPolarHBondContact CG1-O 3.29Å; V158-V164 HydrophobicContact CG2-CG1 3.84Å; F161-V164 HydrophobicContact CB-CB 3.96Å; F161-V164 HydrophobicContact CB-CG2 3.52Å; F161-V164 HydrophobicContact CD2-CG2 4.22Å; F161-V164 HydrophobicContact CG-CG2 4.08Å; F161-V164 PolarHBondContact O-N 2.85Å
165	F	98.3	Very high	90.4	Very high	48 Å²	48	54.3 Å²	54.3	21%	0.211	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	156	177.3	61.3	-92.6	0	0	0	111.7	V137 Y138 C139 I140 D190 L191	V137-F165 HydrophobicContact CG1-CE1 3.8Å; Y138-F165 PolarHBondContact O-N 3.14Å; C139-F165 HydrophobicContact CB-CD2 4.42Å; C139-F165 HydrophobicContact CB-CE2 3.64Å; C139-F165 HydrophobicContact CB-CZ 3.72Å; C139-F165 VanDerWaalsContact SG-CE2 3.5Å; I140-F165 PolarHBondContact N-O 2.65Å; F165-D190 HydrophobicContact CD2-CB 4.4Å; F165-D190 HydrophobicContact CE2-CB 3.42Å; F165-D190 VanDerWaalsContact CE2-CB 3.42Å; F165-D190 HydrophobicContact CZ-CB 3.9Å; F165-L191 HydrophobicContact CE1-CD2 4.11Å; F165-L191 HydrophobicContact CZ-CD2 3.84Å; F165-L191 HydrophobicContact CZ-CG 4.11Å
166	I	98.3	Very high	88.7	Confident	26 Å²	26	53 Å²	53	13%	0.133	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	135.2	172.5	-60.3	-176	0	0	0	108.7	I140 V142 V154 Q155 V158 S168	I140-I166 HydrophobicContact CB-CG1 4.49Å; I140-I166 CarbonylContact O-C 3.57Å; I140-I166 VanDerWaalsContact O-CA 3.29Å; I140-I166 WeakPolarHBondContact O-CA 3.01Å; V142-I166 HydrophobicContact CG2-CD1 4.29Å; V142-I166 HydrophobicContact CG2-CG2 4.24Å; V154-I166 HydrophobicContact CG1-CD1 4Å; Q155-I166 HydrophobicContact CB-CD1 4.41Å; V158-I166 HydrophobicContact CB-CG1 4.45Å; V158-I166 HydrophobicContact CG1-CG1 4.2Å; V158-I166 HydrophobicContact CG2-CG1 4.19Å; I166-S168 PolarHBondContact O-N 2.85Å
167	S	97.6	Very high	87.9	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.021	27%	0.267	C	S	.	.			trans	-46.9	131.7	175.6	178.9	0	0	0	0	111.6	I140 K169 D190	I140-S167 PolarHBondContact O-N 2.85Å; S167-K169 PolarHBondContact O-N 2.76Å; S167-K169 PolarHBondContact OG-O 3.34Å; S167-D190 WeakPolarHBondContact CA-OD2 3.48Å
168	S	95.4	Very high	87.6	Confident	98 Å²	98	53.5 Å²	53.5	69%	0.685	27%	0.274	S	S	*	.	S	Bend	trans	-61.1	-32.1	-179.6	64.3	0	0	0	0	112	I166 D190	I166-S168 PolarHBondContact O-N 2.85Å; S168-D190 WeakPolarHBondContact CB-OD1 3.01Å; S168-D190 PolarHBondContact N-OD2 2.75Å; S168-D190 VanDerWaalsContact OG-CG 3.29Å; S168-D190 PolarHBondContact OG-OD1 3.38Å; S168-D190 PolarHBondContact OG-OD2 3.2Å
169	K	93.4	Very high	87.3	Confident	107 Å²	107	55 Å²	55	47%	0.465	28%	0.283	S	S	.	.	S	Bend	trans	-115.4	131.4	174.4	-170.2	179.6	177.3	-151.3	0	111	S167 E171 N186	S167-K169 PolarHBondContact O-N 2.76Å; S167-K169 PolarHBondContact OG-O 3.34Å; K169-E171 WeakPolarHBondContact CE-OE1 3.36Å; K169-E171 IonicContact NZ-OE1 2.7Å; K169-E171 PolarHBondContact NZ-OE1 3.09Å; K169-N186 HydrophobicContact CB-CB 4.29Å
170	R	87.3	Confident	87	Confident	94 Å²	94	51 Å²	51	36%	0.355	26%	0.26	S	S	.	.			trans	-107.2	138.6	177.7	-59.9	179.2	-172.8	172.6	-1.2	110.1	E144	E144-R170 HydrophobicContact CB-CB 4.46Å
171	E	88.4	Confident	87	Confident	29 Å²	29	49.8 Å²	49.8	14%	0.136	25%	0.252	C	S	.	.			trans	-108.7	148.8	174.2	-57.8	-63.6	156.1	0	0	110.2	H141 E144 K169 M173 Q182 N186	H141-E171 PolarHBondContact CE1-N 2.95Å; H141-E171 PolarHBondContact NE2-N 2.85Å; E144-E171 PolarHBondContact N-O 2.88Å; K169-E171 WeakPolarHBondContact CE-OE1 3.36Å; K169-E171 IonicContact NZ-OE1 2.7Å; K169-E171 PolarHBondContact NZ-OE1 3.09Å; E171-M173 PolarHBondContact O-N 3.17Å; E171-Q182 HydrophobicContact CG-CB 4.22Å; E171-Q182 HydrophobicContact CG-CG 3.96Å; E171-Q182 VanDerWaalsContact OE1-CG 3.3Å; E171-Q182 WeakPolarHBondContact OE1-CG 3.07Å; E171-N186 WeakPolarHBondContact CG-ND2 3.39Å; E171-N186 PolarHBondContact OE1-ND2 3.45Å
172	K	82.9	Confident	86.9	Confident	114 Å²	114	50.1 Å²	50.1	50%	0.496	25%	0.253	S	S	.	.			trans	-76.7	101.3	169.2	-73.7	176.2	-171.9	176.7	0	108.5	E144 K145 T179	E144-K172 HydrophobicContact CB-CG 3.88Å; E144-K172 HydrophobicContact CG-CG 4.41Å; E144-K172 WeakPolarHBondContact OE1-CE 3.46Å; E144-K172 IonicContact OE1-NZ 3.73Å; E144-K172 WeakPolarHBondContact OE2-CE 3.25Å; E144-K172 WeakPolarHBondContact OE2-CG 3.25Å; K145-K172 HydrophobicContact CG-CG 4.43Å; K172-T179 PolarHBondContact O-OG1 2.74Å
173	M	72.6	Confident	86.9	Confident	18 Å²	18	43 Å²	43	9%	0.089	22%	0.22	C	C	.	.			trans	-70.1	144.7	-172.3	-59.1	-151.1	-72.2	0	0	111.6	H118 D143 K145 E171	H118-M173 HydrophobicContact CB-CE 4Å; D143-M173 HydrophobicContact CB-CB 4.24Å; D143-M173 HydrophobicContact CB-CE 3.95Å; D143-M173 HydrophobicContact CB-CG 3.97Å; D143-M173 PolarHBondContact OD1-N 3.16Å; D143-M173 WeakPolarHBondContact OD2-CB 3.2Å; D143-M173 PolarHBondContact OD2-N 3.45Å; K145-M173 PolarHBondContact NZ-O 2.93Å; E171-M173 PolarHBondContact O-N 3.17Å
174	A	63.3	Low	86.9	Confident	52 Å²	52	42.9 Å²	42.9	43%	0.43	22%	0.219	S	C	.	.			trans	-112.3	159.6	161.5	0	0	0	0	0	107.7	A176 T179	A174-A176 PolarHBondContact O-N 2.83Å; A174-T179 PolarHBondContact N-OG1 3.4Å
175	Y	56.2	Low	86.9	Confident	137 Å²	137	42.7 Å²	42.7	54%	0.537	22%	0.218	S	C	.	.	S	Bend	trans	-57.1	-35.8	-178.3	176	-93.3	0	0	0	112.9	Q339	Y175-Q339 PolarHBondContact OH-OE1 3.18Å
176	A	60	Low	86.9	Confident	38 Å²	38	40.5 Å²	40.5	31%	0.314	21%	0.209	S	C	.	.	S	Bend	trans	-145.6	163.5	170.7	0	0	0	0	0	108.4	A174	A174-A176 PolarHBondContact O-N 2.83Å
177	G	78.9	Confident	86.9	Confident	13 Å²	13	39.3 Å²	39.3	13%	0.134	20%	0.203	C	C	.	.	S	Bend	trans	119.1	-177.7	175.6	0	0	0	0	0	114.3	T179 R180 E291	G177-T179 PolarHBondContact O-N 2.77Å; G177-R180 WeakPolarHBondContact O-CB 3.38Å; G177-R180 PolarHBondContact O-N 2.62Å; G177-E291 PolarHBondContact N-OE2 3.41Å
178	F	88.1	Confident	87	Confident	35 Å²	35	39.1 Å²	39.1	15%	0.154	20%	0.202	C	C	.	.	H	α-helix	trans	-51.3	-35.6	-171.4	-178.4	-99.6	0	0	0	114.8	R180 L181 Q182 L281 K285 P290	F178-R180 VanDerWaalsContact C-N 3.27Å; F178-R180 PolarHBondContact O-N 2.88Å; F178-L181 WeakPolarHBondContact O-CB 3.15Å; F178-L181 PolarHBondContact O-N 2.91Å; F178-Q182 HydrophobicContact CD1-CB 4.38Å; F178-Q182 HydrophobicContact CE1-CB 3.99Å; F178-Q182 HydrophobicContact CE1-CG 4.24Å; F178-Q182 HydrophobicContact CZ-CB 4.33Å; F178-Q182 WeakPolarHBondContact O-CB 3.14Å; F178-Q182 PolarHBondContact O-N 3.02Å; F178-L281 HydrophobicContact CE2-CD1 3.71Å; F178-L281 HydrophobicContact CE2-CG 4.13Å; F178-L281 VanDerWaalsContact CE2-O 3.26Å; F178-L281 WeakPolarHBondContact CE2-O 3.48Å; F178-L281 HydrophobicContact CZ-CD1 4.22Å; F178-L281 HydrophobicContact CZ-CG 4.37Å; F178-K285 HydrophobicContact CD1-CG 4.02Å; F178-K285 HydrophobicContact CD2-CB 4.32Å; F178-K285 HydrophobicContact CD2-CG 3.76Å; F178-K285 HydrophobicContact CE1-CD 4.41Å; F178-K285 HydrophobicContact CE1-CG 3.78Å; F178-K285 HydrophobicContact CE2-CB 4.48Å; F178-K285 HydrophobicContact CE2-CG 3.5Å; F178-K285 HydrophobicContact CG-CB 4.47Å; F178-K285 HydrophobicContact CG-CG 4.01Å; F178-K285 HydrophobicContact CZ-CD 4.24Å; F178-K285 HydrophobicContact CZ-CG 3.52Å; F178-P290 HydrophobicContact CB-CG 4.17Å; F178-P290 HydrophobicContact CD2-CG 4.46Å
179	T	89.9	Confident	87.1	Confident	35 Å²	35	39.1 Å²	39.1	22%	0.215	19%	0.189	C	C	.	.	H	α-helix	trans	-66.6	-28.1	-179.7	56.4	0	0	0	0	113.1	K172 A174 G177 A183	K172-T179 PolarHBondContact O-OG1 2.74Å; A174-T179 PolarHBondContact N-OG1 3.4Å; G177-T179 PolarHBondContact O-N 2.77Å; T179-A183 WeakPolarHBondContact O-CB 3.37Å; T179-A183 PolarHBondContact O-N 3.46Å
180	R	90.6	Very high	87.3	Confident	26 Å²	26	35.5 Å²	35.5	10%	0.098	18%	0.175	C	C	.	.	H	α-helix	trans	-69.4	-42.5	173.7	177.2	61.9	-173.3	81.4	-3.3	111.6	G177 F178 D184 N203 E291	G177-R180 WeakPolarHBondContact O-CB 3.38Å; G177-R180 PolarHBondContact O-N 2.62Å; F178-R180 VanDerWaalsContact C-N 3.27Å; F178-R180 PolarHBondContact O-N 2.88Å; R180-D184 IonicContact CZ-OD1 2.87Å; R180-D184 IonicContact CZ-OD2 3.89Å; R180-D184 IonicContact NH1-OD1 2.73Å; R180-D184 PolarHBondContact NH1-OD1 3.21Å; R180-D184 IonicContact NH1-OD2 2.76Å; R180-D184 PolarHBondContact NH1-OD2 3.38Å; R180-D184 IonicContact NH2-OD1 3.78Å; R180-D184 IonicContact NH2-OD2 3.22Å; R180-N203 PolarHBondContact NH2-ND2 3.15Å; R180-E291 HydrophobicContact CG-CG 4.43Å
181	L	95	Very high	87.9	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-46.7	172.6	170.4	56.8	0	0	0	110.6	F178 A183 D184 I185 L281 P290 E291 Y294 W295	F178-L181 WeakPolarHBondContact O-CB 3.15Å; F178-L181 PolarHBondContact O-N 2.91Å; L181-A183 VanDerWaalsContact C-N 3.31Å; L181-A183 PolarHBondContact O-N 3.41Å; L181-D184 PolarHBondContact O-N 2.83Å; L181-I185 HydrophobicContact CD1-CG1 4.28Å; L181-I185 WeakPolarHBondContact O-CG1 3.33Å; L181-I185 PolarHBondContact O-N 3.11Å; L181-I185 VanDerWaalsContact O-N 3.09Å; L181-L281 HydrophobicContact CD1-CD1 4.43Å; L181-L281 HydrophobicContact CD2-CD1 3.64Å; L181-L281 HydrophobicContact CG-CD1 3.78Å; L181-P290 HydrophobicContact CB-CG 4.47Å; L181-P290 HydrophobicContact CD2-CB 3.92Å; L181-P290 HydrophobicContact CD2-CG 4.11Å; L181-E291 HydrophobicContact CB-CB 4.28Å; L181-Y294 HydrophobicContact CD1-CD1 3.58Å; L181-Y294 HydrophobicContact CD1-CE1 4.17Å; L181-Y294 HydrophobicContact CD1-CG 3.88Å; L181-Y294 HydrophobicContact CD2-CD1 4.34Å; L181-Y294 HydrophobicContact CD2-CD2 4.05Å; L181-Y294 HydrophobicContact CD2-CG 3.8Å; L181-Y294 HydrophobicContact CG-CG 4.49Å; L181-W295 HydrophobicContact CD1-CD2 4.46Å; L181-W295 HydrophobicContact CD1-CH2 3.49Å; L181-W295 VanDerWaalsContact CD1-CH2 3.49Å; L181-W295 HydrophobicContact CD1-CZ2 3.12Å; L181-W295 HydrophobicContact CD1-CZ3 4.28Å
182	Q	96.3	Very high	88.3	Confident	19 Å²	19	30.9 Å²	30.9	9%	0.089	16%	0.159	C	C	.	.	H	α-helix	trans	-64	-34.6	-179.3	-172.3	59.9	71.7	0	0	112.8	E171 F178 D184 I185 N186	E171-Q182 HydrophobicContact CG-CB 4.22Å; E171-Q182 HydrophobicContact CG-CG 3.96Å; E171-Q182 VanDerWaalsContact OE1-CG 3.3Å; E171-Q182 WeakPolarHBondContact OE1-CG 3.07Å; F178-Q182 HydrophobicContact CD1-CB 4.38Å; F178-Q182 HydrophobicContact CE1-CB 3.99Å; F178-Q182 HydrophobicContact CE1-CG 4.24Å; F178-Q182 HydrophobicContact CZ-CB 4.33Å; F178-Q182 WeakPolarHBondContact O-CB 3.14Å; F178-Q182 PolarHBondContact O-N 3.02Å; Q182-D184 VanDerWaalsContact C-N 3.34Å; Q182-D184 PolarHBondContact O-N 2.87Å; Q182-I185 PolarHBondContact O-N 3.37Å; Q182-N186 PolarHBondContact NE2-OD1 2.87Å; Q182-N186 WeakPolarHBondContact O-CB 3.23Å; Q182-N186 PolarHBondContact O-N 2.69Å; Q182-N186 PolarHBondContact O-ND2 3.38Å; Q182-N186 PolarHBondContact O-OD1 3.49Å
183	A	96	Very high	89	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.2	-43.6	173.9	0	0	0	0	0	112	T116 H141 T179 L181 N186 C187	T116-A183 HydrophobicContact CG2-CB 4.18Å; H141-A183 HydrophobicContact CB-CB 4.46Å; T179-A183 WeakPolarHBondContact O-CB 3.37Å; T179-A183 PolarHBondContact O-N 3.46Å; L181-A183 VanDerWaalsContact C-N 3.31Å; L181-A183 PolarHBondContact O-N 3.41Å; A183-N186 PolarHBondContact O-N 3.06Å; A183-C187 PolarHBondContact O-N 3.43Å; A183-C187 VanDerWaalsContact O-N 3.13Å
184	D	97.9	Very high	90.1	Very high	1 Å²	1	33 Å²	33	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-65	-45.4	175.1	-78.9	5	0	0	0	111.3	I114 R180 L181 Q182 N186 C187 M188 N203 Y261 W295	I114-D184 HydrophobicContact CD1-CB 4.32Å; I114-D184 WeakPolarHBondContact CG2-OD1 3.39Å; R180-D184 IonicContact CZ-OD1 2.87Å; R180-D184 IonicContact CZ-OD2 3.89Å; R180-D184 IonicContact NH1-OD1 2.73Å; R180-D184 PolarHBondContact NH1-OD1 3.21Å; R180-D184 IonicContact NH1-OD2 2.76Å; R180-D184 PolarHBondContact NH1-OD2 3.38Å; R180-D184 IonicContact NH2-OD1 3.78Å; R180-D184 IonicContact NH2-OD2 3.22Å; L181-D184 PolarHBondContact O-N 2.83Å; Q182-D184 VanDerWaalsContact C-N 3.34Å; Q182-D184 PolarHBondContact O-N 2.87Å; D184-N186 VanDerWaalsContact C-N 3.28Å; D184-N186 PolarHBondContact O-N 3.27Å; D184-C187 PolarHBondContact O-N 3.46Å; D184-M188 WeakPolarHBondContact O-CG 3.41Å; D184-M188 PolarHBondContact O-N 2.89Å; D184-N203 PolarHBondContact OD2-ND2 3.43Å; D184-Y261 WeakPolarHBondContact CB-OH 3.37Å; D184-Y261 WeakPolarHBondContact OD2-CE1 3.09Å; D184-Y261 PolarHBondContact OD2-OH 3.13Å; D184-W295 HydrophobicContact CB-CH2 4.06Å; D184-W295 HydrophobicContact CB-CZ2 3.85Å
185	I	98.3	Very high	91.6	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.015	18%	0.182	C	C	.	.	H	α-helix	trans	-60	-37.9	177.4	-63.8	-67.3	0	0	0	111.8	L181 Q182 M188 K189 I271 L272 L281 Y294 W295	L181-I185 HydrophobicContact CD1-CG1 4.28Å; L181-I185 WeakPolarHBondContact O-CG1 3.33Å; L181-I185 PolarHBondContact O-N 3.11Å; L181-I185 VanDerWaalsContact O-N 3.09Å; Q182-I185 PolarHBondContact O-N 3.37Å; I185-M188 HydrophobicContact CD1-SD 4.17Å; I185-M188 PolarHBondContact O-N 3.21Å; I185-K189 WeakPolarHBondContact O-CG 3.13Å; I185-K189 PolarHBondContact O-N 3.14Å; I185-I271 HydrophobicContact CD1-CG2 3.44Å; I185-I271 VanDerWaalsContact CD1-CG2 3.44Å; I185-L272 HydrophobicContact CG2-CD2 4.17Å; I185-L281 HydrophobicContact CG1-CD1 4.21Å; I185-L281 HydrophobicContact CG1-CD2 4.19Å; I185-L281 HydrophobicContact CG2-CD2 4.12Å; I185-Y294 HydrophobicContact CD1-CE1 4.07Å; I185-W295 HydrophobicContact CD1-CH2 3.67Å; I185-W295 HydrophobicContact CD1-CZ3 3.92Å; I185-W295 HydrophobicContact CG1-CH2 4.14Å
186	N	98.3	Very high	93.4	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-64.5	-46.7	176.2	-67.8	-17.1	0	0	0	110.8	K169 E171 Q182 A183 D184 M188 K189 D190	K169-N186 HydrophobicContact CB-CB 4.29Å; E171-N186 WeakPolarHBondContact CG-ND2 3.39Å; E171-N186 PolarHBondContact OE1-ND2 3.45Å; Q182-N186 PolarHBondContact NE2-OD1 2.87Å; Q182-N186 WeakPolarHBondContact O-CB 3.23Å; Q182-N186 PolarHBondContact O-N 2.69Å; Q182-N186 PolarHBondContact O-ND2 3.38Å; Q182-N186 PolarHBondContact O-OD1 3.49Å; A183-N186 PolarHBondContact O-N 3.06Å; D184-N186 VanDerWaalsContact C-N 3.28Å; D184-N186 PolarHBondContact O-N 3.27Å; N186-M188 VanDerWaalsContact C-N 3.34Å; N186-M188 PolarHBondContact O-N 3.43Å; N186-K189 WeakPolarHBondContact O-CB 3.5Å; N186-K189 PolarHBondContact O-N 2.91Å; N186-D190 PolarHBondContact O-N 3.35Å
187	C	98.6	Very high	95.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-38.8	174.6	-91.2	0	0	0	0	113	I114 C139 A183 D184 K189 D190 L191	I114-C187 HydrophobicContact CB-CB 4.28Å; I114-C187 HydrophobicContact CD1-CB 3.8Å; I114-C187 HydrophobicContact CG1-CB 3.73Å; I114-C187 HydrophobicContact CG2-CB 3.7Å; C139-C187 HydrophobicContact CB-CB 3.61Å; C139-C187 WeakPolarHBondContact CB-SG 3.36Å; C139-C187 WeakPolarHBondContact SG-CA 3.31Å; C139-C187 WeakPolarHBondContact SG-CB 3.36Å; C139-C187 CovalentContact SG-SG 2.03Å; C139-C187 PolarHBondContact SG-SG 3.42Å; A183-C187 PolarHBondContact O-N 3.43Å; A183-C187 VanDerWaalsContact O-N 3.13Å; D184-C187 PolarHBondContact O-N 3.46Å; C187-K189 VanDerWaalsContact C-N 3.3Å; C187-K189 PolarHBondContact O-N 3.5Å; C187-D190 PolarHBondContact O-N 3.39Å; C187-L191 WeakPolarHBondContact O-CB 3.31Å; C187-L191 VanDerWaalsContact O-CG 3.23Å; C187-L191 WeakPolarHBondContact O-CG 3.27Å; C187-L191 PolarHBondContact O-N 2.87Å
188	M	98.7	Very high	96	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.6	-42	174.9	-77.7	178.9	-178.1	0	0	111.9	I114 D184 I185 N186 D190 L191 V192 V201 Y261 L263 V268 I271 L272 W295	I114-M188 HydrophobicContact CD1-CE 4.3Å; I114-M188 HydrophobicContact CD1-CG 3.84Å; D184-M188 WeakPolarHBondContact O-CG 3.41Å; D184-M188 PolarHBondContact O-N 2.89Å; I185-M188 HydrophobicContact CD1-SD 4.17Å; I185-M188 PolarHBondContact O-N 3.21Å; N186-M188 VanDerWaalsContact C-N 3.34Å; N186-M188 PolarHBondContact O-N 3.43Å; M188-D190 VanDerWaalsContact C-N 3.32Å; M188-D190 PolarHBondContact O-N 3.36Å; M188-L191 PolarHBondContact O-N 2.9Å; M188-V192 WeakPolarHBondContact O-CG1 3.49Å; M188-V192 WeakPolarHBondContact O-CG2 3.44Å; M188-V192 PolarHBondContact O-N 3.14Å; M188-V201 HydrophobicContact CE-CG1 4.32Å; M188-Y261 HydrophobicContact CE-CE2 3.78Å; M188-Y261 WeakPolarHBondContact CE-OH 3.41Å; M188-L263 HydrophobicContact CE-CD1 3.76Å; M188-V268 HydrophobicContact CB-CG1 3.61Å; M188-V268 HydrophobicContact CE-CG2 4.24Å; M188-V268 HydrophobicContact CG-CG1 3.67Å; M188-V268 HydrophobicContact CG-CG2 4.39Å; M188-V268 HydrophobicContact SD-CG1 3.95Å; M188-V268 HydrophobicContact SD-CG2 4.23Å; M188-I271 HydrophobicContact SD-CD1 4.33Å; M188-I271 HydrophobicContact SD-CG2 4.39Å; M188-L272 HydrophobicContact CB-CD1 4.42Å; M188-L272 HydrophobicContact CB-CD2 4.4Å; M188-W295 HydrophobicContact CE-CH2 3.77Å; M188-W295 HydrophobicContact CE-CZ3 3.73Å; M188-W295 HydrophobicContact SD-CH2 4.11Å; M188-W295 HydrophobicContact SD-CZ3 4.05Å
189	K	98.5	Very high	96.5	Very high	97 Å²	97	38.7 Å²	38.7	42%	0.422	18%	0.184	S	C	.	.	H	α-helix	trans	-59.8	-42.8	175.3	-72.2	172.6	-178.1	177.1	0	111.8	I185 N186 C187 V192 H193 L272	I185-K189 WeakPolarHBondContact O-CG 3.13Å; I185-K189 PolarHBondContact O-N 3.14Å; N186-K189 WeakPolarHBondContact O-CB 3.5Å; N186-K189 PolarHBondContact O-N 2.91Å; C187-K189 VanDerWaalsContact C-N 3.3Å; C187-K189 PolarHBondContact O-N 3.5Å; K189-V192 VanDerWaalsContact O-CG2 3.27Å; K189-V192 WeakPolarHBondContact O-CG2 3.47Å; K189-H193 PolarHBondContact O-ND1 2.95Å; K189-L272 HydrophobicContact CG-CD1 4.18Å; K189-L272 HydrophobicContact CG-CD2 3.56Å; K189-L272 HydrophobicContact CG-CG 4.49Å
190	D	98.6	Very high	96.9	Very high	32 Å²	32	37.3 Å²	37.3	17%	0.171	18%	0.175	C	C	.	.	H	α-helix	trans	-71.9	-40	178.8	-62.7	-24.9	0	0	0	111.4	F165 S167 S168 N186 C187 M188 V192 H193 S194	F165-D190 HydrophobicContact CD2-CB 4.4Å; F165-D190 HydrophobicContact CE2-CB 3.42Å; F165-D190 VanDerWaalsContact CE2-CB 3.42Å; F165-D190 HydrophobicContact CZ-CB 3.9Å; S167-D190 WeakPolarHBondContact CA-OD2 3.48Å; S168-D190 WeakPolarHBondContact CB-OD1 3.01Å; S168-D190 PolarHBondContact N-OD2 2.75Å; S168-D190 VanDerWaalsContact OG-CG 3.29Å; S168-D190 PolarHBondContact OG-OD1 3.38Å; S168-D190 PolarHBondContact OG-OD2 3.2Å; N186-D190 PolarHBondContact O-N 3.35Å; C187-D190 PolarHBondContact O-N 3.39Å; M188-D190 VanDerWaalsContact C-N 3.32Å; M188-D190 PolarHBondContact O-N 3.36Å; D190-V192 PolarHBondContact O-N 2.82Å; D190-H193 CarbonylContact O-C 3.4Å; D190-H193 PolarHBondContact O-N 3.4Å; D190-S194 PolarHBondContact O-N 3.03Å; D190-S194 VanDerWaalsContact O-N 3.14Å
191	L	98.7	Very high	97.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-62.4	-40.8	-179.4	-77.2	169	0	0	0	113	A112 I114 V137 C139 F165 C187 M188 H193 S194 W198 V201	A112-L191 HydrophobicContact CB-CD1 4.1Å; A112-L191 HydrophobicContact CB-CD2 3.92Å; I114-L191 HydrophobicContact CD1-CD1 4.12Å; I114-L191 HydrophobicContact CG1-CD1 3.7Å; V137-L191 HydrophobicContact CB-CD2 4.11Å; V137-L191 HydrophobicContact CG1-CD2 3.6Å; C139-L191 HydrophobicContact CB-CD1 4.23Å; C139-L191 HydrophobicContact CB-CD2 4.21Å; C139-L191 HydrophobicContact CB-CG 4.03Å; F165-L191 HydrophobicContact CE1-CD2 4.11Å; F165-L191 HydrophobicContact CZ-CD2 3.84Å; F165-L191 HydrophobicContact CZ-CG 4.11Å; C187-L191 WeakPolarHBondContact O-CB 3.31Å; C187-L191 VanDerWaalsContact O-CG 3.23Å; C187-L191 WeakPolarHBondContact O-CG 3.27Å; C187-L191 PolarHBondContact O-N 2.87Å; M188-L191 PolarHBondContact O-N 2.9Å; L191-H193 PolarHBondContact O-N 2.94Å; L191-S194 WeakPolarHBondContact O-CB 3.37Å; L191-S194 PolarHBondContact O-N 3.19Å; L191-S194 VanDerWaalsContact O-N 3.11Å; L191-W198 HydrophobicContact CB-CZ2 3.84Å; L191-W198 PolarHBondContact O-NE1 2.95Å; L191-V201 HydrophobicContact CD1-CG2 3.81Å
192	V	98	Very high	97.5	Very high	24 Å²	24	36.1 Å²	36.1	15%	0.145	17%	0.171	C	C	.	.	H	α-helix	trans	-66.7	-22.7	178.5	-64.3	0	0	0	0	113.1	M188 K189 D190 W198 V268 E269 L272	M188-V192 WeakPolarHBondContact O-CG1 3.49Å; M188-V192 WeakPolarHBondContact O-CG2 3.44Å; M188-V192 PolarHBondContact O-N 3.14Å; K189-V192 VanDerWaalsContact O-CG2 3.27Å; K189-V192 WeakPolarHBondContact O-CG2 3.47Å; D190-V192 PolarHBondContact O-N 2.82Å; V192-W198 HydrophobicContact CG1-CZ2 4.1Å; V192-V268 HydrophobicContact CG1-CG1 3.74Å; V192-E269 HydrophobicContact CG1-CG 4.13Å; V192-L272 HydrophobicContact CB-CD1 4.45Å; V192-L272 HydrophobicContact CG1-CD1 3.92Å; V192-L272 HydrophobicContact CG2-CD1 3.67Å
193	H	96.9	Very high	97.6	Very high	159 Å²	159	35.2 Å²	35.2	74%	0.736	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	3.6	175.1	-59.6	102.4	0	0	0	113.2	K189 D190 L191	K189-H193 PolarHBondContact O-ND1 2.95Å; D190-H193 CarbonylContact O-C 3.4Å; D190-H193 PolarHBondContact O-N 3.4Å; L191-H193 PolarHBondContact O-N 2.94Å
194	S	95.8	Very high	97.7	Very high	19 Å²	19	35.2 Å²	35.2	13%	0.133	17%	0.166	C	C	.	.			trans	-60.1	143	177.4	-178.3	0	0	0	0	111	D190 L191 F196	D190-S194 PolarHBondContact O-N 3.03Å; D190-S194 VanDerWaalsContact O-N 3.14Å; L191-S194 WeakPolarHBondContact O-CB 3.37Å; L191-S194 PolarHBondContact O-N 3.19Å; L191-S194 VanDerWaalsContact O-N 3.11Å; S194-F196 PolarHBondContact O-N 3.5Å; S194-F196 PolarHBondContact OG-N 3.05Å; S194-F196 VanDerWaalsContact OG-N 3.16Å
195	K	94.4	Very high	97.6	Very high	146 Å²	146	36 Å²	36	64%	0.635	17%	0.172	S	C	*	.	S	Bend	trans	-64	-21.9	170.5	68.3	178.9	-172.4	170.6	0	112.4	E162	E162-K195 IonicContact OE2-NZ 3.05Å; E162-K195 PolarHBondContact OE2-NZ 3.04Å
196	F	94	Very high	97.4	Very high	51 Å²	51	36.3 Å²	36.3	22%	0.224	18%	0.176	C	C	.	.	S	Bend	trans	-90.6	127.7	177.5	-61	-86.9	0	0	0	110.2	V137 E162 N163 S194	V137-F196 HydrophobicContact CG2-CB 3.37Å; V137-F196 HydrophobicContact CG2-CG 4.22Å; E162-F196 HydrophobicContact CB-CE2 4.37Å; E162-F196 HydrophobicContact CB-CZ 3.94Å; E162-F196 VanDerWaalsContact O-CE2 3.3Å; E162-F196 WeakPolarHBondContact O-CE2 3.45Å; N163-F196 HydrophobicContact CB-CD1 4.42Å; N163-F196 HydrophobicContact CB-CD2 4.11Å; N163-F196 HydrophobicContact CB-CE1 4.11Å; N163-F196 HydrophobicContact CB-CE2 3.78Å; N163-F196 HydrophobicContact CB-CG 4.42Å; N163-F196 HydrophobicContact CB-CZ 3.78Å; S194-F196 PolarHBondContact O-N 3.5Å; S194-F196 PolarHBondContact OG-N 3.05Å; S194-F196 VanDerWaalsContact OG-N 3.16Å
197	Q	95.3	Very high	97.3	Very high	121 Å²	121	37 Å²	37	57%	0.565	18%	0.179	S	C	*	.			trans	-75.4	143.9	172.1	-56.3	-59.1	-55.3	0	0	109.6	S110	S110-Q197 VanDerWaalsContact CB-O 3.27Å; S110-Q197 WeakPolarHBondContact CB-O 3.45Å; S110-Q197 PolarHBondContact OG-O 3.45Å; S110-Q197 VanDerWaalsContact OG-O 3.05Å
198	W	98.3	Very high	97.3	Very high	5 Å²	5	37 Å²	37	2%	0.019	18%	0.179	C	C	.	.			trans	-145.9	153.5	177.7	54.3	-90.1	0	0	0	110.5	A112 V137 L191 V192 V201 R265 V268	A112-W198 HydrophobicContact CB-CB 4.07Å; A112-W198 HydrophobicContact CB-CD2 3.58Å; A112-W198 HydrophobicContact CB-CE3 3.75Å; A112-W198 HydrophobicContact CB-CG 3.72Å; A112-W198 HydrophobicContact CB-CZ3 4.42Å; V137-W198 HydrophobicContact CG2-CB 4.27Å; L191-W198 HydrophobicContact CB-CZ2 3.84Å; L191-W198 PolarHBondContact O-NE1 2.95Å; V192-W198 HydrophobicContact CG1-CZ2 4.1Å; W198-V201 HydrophobicContact CE3-CB 4.4Å; W198-V201 HydrophobicContact CH2-CB 4.28Å; W198-V201 HydrophobicContact CH2-CG1 4.46Å; W198-V201 HydrophobicContact CZ3-CB 3.84Å; W198-V201 HydrophobicContact CZ3-CG1 4.21Å; W198-R265 HydrophobicContact CD2-CB 4.44Å; W198-R265 HydrophobicContact CD2-CG 4.42Å; W198-R265 HydrophobicContact CE3-CB 3.84Å; W198-R265 HydrophobicContact CE3-CG 4.25Å; W198-R265 HydrophobicContact CH2-CB 3.77Å; W198-R265 HydrophobicContact CH2-CG 3.67Å; W198-R265 HydrophobicContact CZ2-CB 4.37Å; W198-R265 HydrophobicContact CZ2-CG 3.85Å; W198-R265 VanDerWaalsContact CZ3-CA 3.43Å; W198-R265 HydrophobicContact CZ3-CB 3.47Å; W198-R265 VanDerWaalsContact CZ3-CB 3.47Å; W198-R265 HydrophobicContact CZ3-CG 3.89Å; W198-R265 VanDerWaalsContact O-CD 3.25Å; W198-R265 WeakPolarHBondContact O-CD 3.38Å; W198-V268 HydrophobicContact CH2-CB 3.96Å; W198-V268 HydrophobicContact CH2-CG1 4.17Å; W198-V268 HydrophobicContact CH2-CG2 3.87Å; W198-V268 HydrophobicContact CZ3-CG2 4.38Å
199	N	98.1	Very high	97.2	Very high	71 Å²	71	37 Å²	37	38%	0.38	18%	0.179	S	C	.	.	S	Bend	trans	-97.3	-45.9	-173.7	-60.9	90.5	0	0	0	112	F109 S110 R265	F109-N199 HydrophobicContact CE1-CB 4.22Å; F109-N199 HydrophobicContact CE2-CB 4.3Å; F109-N199 HydrophobicContact CZ-CB 4.04Å; S110-N199 PolarHBondContact N-OD1 3.31Å; S110-N199 VanDerWaalsContact N-OD1 3.14Å; S110-N199 PolarHBondContact O-N 2.03Å; S110-N199 PolarHBondContact O-OD1 3.48Å; N199-R265 PolarHBondContact O-N 3.14Å
200	Y	98.8	Very high	97.2	Very high	6 Å²	6	32.4 Å²	32.4	2%	0.024	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	147.7	-176.6	-72.4	-97.4	0	0	0	111.4	F109 A112 I221 W225 D227 K228 V262 L263 T264	F109-Y200 HydrophobicContact CE1-CD2 4.03Å; F109-Y200 HydrophobicContact CE2-CE2 4.43Å; F109-Y200 AromaticContact CZ-CD2 3.58Å; F109-Y200 HydrophobicContact CZ-CD2 3.58Å; F109-Y200 AromaticContact CZ-CE2 3.67Å; F109-Y200 HydrophobicContact CZ-CE2 3.67Å; A112-Y200 PolarHBondContact N-O 3.42Å; Y200-I221 HydrophobicContact CD1-CG2 4.17Å; Y200-I221 HydrophobicContact CD2-CG2 3.79Å; Y200-I221 HydrophobicContact CE1-CG2 3.82Å; Y200-I221 HydrophobicContact CE2-CG2 3.5Å; Y200-I221 VanDerWaalsContact CE2-CG2 3.5Å; Y200-I221 HydrophobicContact CG-CG2 4.11Å; Y200-I221 VanDerWaalsContact CZ-CG2 3.47Å; Y200-W225 PolarHBondContact OH-O 2.97Å; Y200-D227 WeakPolarHBondContact OH-CA 3.35Å; Y200-D227 PolarHBondContact OH-N 3.42Å; Y200-K228 WeakPolarHBondContact CE1-O 3.03Å; Y200-V262 HydrophobicContact CD1-CG1 3.78Å; Y200-V262 HydrophobicContact CG-CG1 4.28Å; Y200-L263 CarbonylContact C-O 3.5Å; Y200-L263 WeakPolarHBondContact CA-O 3.47Å; Y200-T264 HydrophobicContact CD1-CG2 4.09Å; Y200-T264 HydrophobicContact CE1-CG2 3.46Å; Y200-T264 VanDerWaalsContact CE1-CG2 3.46Å
201	V	98.9	Very high	97.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	136.4	170.4	66.3	0	0	0	0	111.2	A112 I114 M188 L191 W198 Y261 V262 L263 V268	A112-V201 HydrophobicContact CB-CB 4Å; A112-V201 HydrophobicContact CB-CG2 3.98Å; A112-V201 CarbonylContact O-C 3.49Å; A112-V201 VanDerWaalsContact O-CA 3.27Å; A112-V201 WeakPolarHBondContact O-CA 3.25Å; I114-V201 HydrophobicContact CD1-CG2 3.81Å; I114-V201 HydrophobicContact CG1-CG2 3.7Å; M188-V201 HydrophobicContact CE-CG1 4.32Å; L191-V201 HydrophobicContact CD1-CG2 3.81Å; W198-V201 HydrophobicContact CE3-CB 4.4Å; W198-V201 HydrophobicContact CH2-CB 4.28Å; W198-V201 HydrophobicContact CH2-CG1 4.46Å; W198-V201 HydrophobicContact CZ3-CB 3.84Å; W198-V201 HydrophobicContact CZ3-CG1 4.21Å; V201-Y261 HydrophobicContact CG1-CE2 4.3Å; V201-V262 CarbonylContact O-C 3.49Å; V201-V262 WeakPolarHBondContact O-CA 3.03Å; V201-L263 HydrophobicContact CG1-CB 3.91Å; V201-L263 PolarHBondContact N-O 2.83Å; V201-L263 PolarHBondContact O-N 2.93Å; V201-V268 HydrophobicContact CG1-CG2 3.54Å
202	I	98.9	Very high	97.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.4	176.3	-50.4	-179.4	0	0	0	108.3	L111 A112 Y113 I114 L204 I217 V262 F359	L111-I202 HydrophobicContact CD1-CD1 4.43Å; A112-I202 PolarHBondContact O-N 2.86Å; Y113-I202 WeakPolarHBondContact CA-O 3.3Å; Y113-I202 HydrophobicContact CD1-CB 3.9Å; Y113-I202 HydrophobicContact CD1-CG2 4.5Å; Y113-I202 HydrophobicContact CE1-CB 3.85Å; Y113-I202 HydrophobicContact CE1-CD1 3.9Å; Y113-I202 HydrophobicContact CE1-CG1 4.26Å; Y113-I202 HydrophobicContact CE1-CG2 4.32Å; I114-I202 PolarHBondContact N-O 3.15Å; I202-L204 HydrophobicContact CG2-CD2 4.33Å; I202-I217 HydrophobicContact CD1-CG2 3.86Å; I202-V262 HydrophobicContact CD1-CG2 4.35Å; I202-V262 HydrophobicContact CG1-CB 4.45Å; I202-V262 HydrophobicContact CG1-CG1 4Å; I202-V262 HydrophobicContact CG1-CG2 4.02Å; I202-V262 HydrophobicContact CG2-CG2 4.37Å; I202-F359 HydrophobicContact CD1-CE2 4.34Å; I202-F359 HydrophobicContact CG2-CD2 4.4Å; I202-F359 HydrophobicContact CG2-CE2 3.96Å
203	N	98.6	Very high	97.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	143.4	176.1	75.2	-27.9	0	0	0	112.2	I114 R180 D184 A259 Y260 Y261 R318	I114-N203 HydrophobicContact CB-CB 4.31Å; I114-N203 CarbonylContact O-C 3.54Å; R180-N203 PolarHBondContact NH2-ND2 3.15Å; D184-N203 PolarHBondContact OD2-ND2 3.43Å; N203-A259 PolarHBondContact ND2-O 2.96Å; N203-Y260 VanDerWaalsContact OD1-CA 3.29Å; N203-Y260 WeakPolarHBondContact OD1-CA 3.33Å; N203-Y261 HydrophobicContact CB-CD2 4.47Å; N203-Y261 HydrophobicContact CB-CE1 3.97Å; N203-Y261 HydrophobicContact CB-CE2 3.81Å; N203-Y261 WeakPolarHBondContact CB-OH 3.45Å; N203-Y261 VanDerWaalsContact CG-CE1 3.4Å; N203-Y261 VanDerWaalsContact CG-CZ 3.5Å; N203-Y261 WeakPolarHBondContact ND2-CE1 3.14Å; N203-Y261 PolarHBondContact OD1-N 3.41Å; N203-R318 PolarHBondContact O-NH2 3.06Å
204	L	98.4	Very high	97.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	159.6	-177.6	-55.4	176.2	0	0	0	108.9	Y113 I114 I115 T116 L127 I131 I202 D208 F359	Y113-L204 HydrophobicContact CD1-CD1 3.65Å; Y113-L204 HydrophobicContact CD1-CG 4.21Å; Y113-L204 HydrophobicContact CE1-CD1 4.19Å; I114-L204 PolarHBondContact O-N 3.43Å; I115-L204 WeakPolarHBondContact CA-O 3.23Å; I115-L204 HydrophobicContact CG1-CB 4.46Å; I115-L204 HydrophobicContact CG1-CD1 4.41Å; I115-L204 HydrophobicContact CG2-CB 4.46Å; T116-L204 PolarHBondContact N-O 3.46Å; T116-L204 PolarHBondContact OG1-O 3.48Å; L127-L204 HydrophobicContact CD1-CD1 4.26Å; L127-L204 HydrophobicContact CD2-CD1 4.48Å; I131-L204 HydrophobicContact CD1-CD1 3.61Å; I202-L204 HydrophobicContact CG2-CD2 4.33Å; L204-D208 WeakPolarHBondContact CA-OD2 3.31Å; L204-D208 HydrophobicContact CB-CB 4.45Å; L204-D208 HydrophobicContact CD2-CB 4.33Å; L204-F359 HydrophobicContact CD1-CD1 4.5Å; L204-F359 HydrophobicContact CD1-CE1 3.95Å; L204-F359 HydrophobicContact CD1-CZ 4.33Å; L204-F359 HydrophobicContact CD2-CD1 3.55Å; L204-F359 HydrophobicContact CD2-CD2 4.01Å; L204-F359 HydrophobicContact CD2-CE1 3.67Å; L204-F359 HydrophobicContact CD2-CE2 4.14Å; L204-F359 HydrophobicContact CD2-CG 3.76Å; L204-F359 HydrophobicContact CD2-CZ 3.99Å; L204-F359 HydrophobicContact CG-CE1 4.5Å
205	C	95.5	Very high	97.4	Very high	19 Å²	19	28 Å²	28	13%	0.128	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	166.6	165.3	77.9	0	0	0	0	110.7	T116 Q207 D208	T116-C205 CarbonylContact O-C 3.54Å; T116-C205 VanDerWaalsContact O-CA 3.27Å; T116-C205 WeakPolarHBondContact O-CA 3.43Å; T116-C205 WeakPolarHBondContact OG1-CB 3.46Å; C205-Q207 PolarHBondContact O-N 3.27Å; C205-D208 PolarHBondContact N-OD2 3.47Å; C205-D208 WeakPolarHBondContact O-CB 3.41Å; C205-D208 PolarHBondContact O-N 2.59Å; C205-D208 PolarHBondContact SG-OD2 3.35Å
206	G	94.4	Very high	97.6	Very high	9 Å²	9	23.2 Å²	23.2	9%	0.093	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	10.5	-179.9	0	0	0	0	0	116	T116 M123	T116-G206 PolarHBondContact O-N 3.4Å; M123-G206 WeakPolarHBondContact CG-O 3.05Å
207	Q	95.8	Very high	97.8	Very high	16 Å²	16	20.9 Å²	20.9	8%	0.075	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.3	9.4	176.1	-50.7	-165.5	-84.1	0	0	112.2	C205 Y361 K362 F363 E364	C205-Q207 PolarHBondContact O-N 3.27Å; Q207-Y361 HydrophobicContact CB-CD2 4.35Å; Q207-Y361 HydrophobicContact CB-CE2 4.09Å; Q207-K362 HydrophobicContact CB-CG 3.93Å; Q207-K362 VanDerWaalsContact CD-CE 3.42Å; Q207-F363 WeakPolarHBondContact CB-O 3.48Å; Q207-F363 PolarHBondContact NE2-O 2.9Å; Q207-F363 WeakPolarHBondContact O-CD2 3.42Å; Q207-F363 PolarHBondContact O-N 2.67Å; Q207-E364 VanDerWaalsContact NE2-CG 3.34Å; Q207-E364 PolarHBondContact NE2-OE1 2.7Å
208	D	97.9	Very high	97.9	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.075	C	C	.	.			trans	-89.6	153	172.3	-74.5	-54.9	0	0	0	111.1	M123 L127 L204 C205 R318 A360 Y361	M123-D208 WeakPolarHBondContact CE-O 3.5Å; L127-D208 WeakPolarHBondContact CD1-O 3.37Å; L204-D208 WeakPolarHBondContact CA-OD2 3.31Å; L204-D208 HydrophobicContact CB-CB 4.45Å; L204-D208 HydrophobicContact CD2-CB 4.33Å; C205-D208 PolarHBondContact N-OD2 3.47Å; C205-D208 WeakPolarHBondContact O-CB 3.41Å; C205-D208 PolarHBondContact O-N 2.59Å; C205-D208 PolarHBondContact SG-OD2 3.35Å; D208-R318 VanDerWaalsContact OD1-CD 3.25Å; D208-R318 WeakPolarHBondContact OD1-CD 3.33Å; D208-R318 IonicContact OD1-CZ 2.73Å; D208-R318 IonicContact OD1-NE 3.44Å; D208-R318 PolarHBondContact OD1-NE 3.23Å; D208-R318 IonicContact OD1-NH1 3.63Å; D208-R318 PolarHBondContact OD1-NH1 2.66Å; D208-R318 IonicContact OD2-CZ 3.85Å; D208-R318 IonicContact OD2-NH1 3.04Å; D208-R318 PolarHBondContact OD2-NH1 2.9Å; D208-R318 VanDerWaalsContact OD2-NH1 3.11Å; D208-A360 WeakPolarHBondContact CA-O 3.18Å; D208-Y361 WeakPolarHBondContact OD1-CB 3.41Å
209	F	98.3	Very high	97.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	141.9	169.2	-155.7	-97.7	0	0	0	111.1	M123 Q126 A130 F359 A360 F363 V372 L375 E376	M123-F209 HydrophobicContact CE-CB 4.14Å; M123-F209 HydrophobicContact CE-CD2 3.92Å; Q126-F209 HydrophobicContact CB-CE2 4.2Å; A130-F209 HydrophobicContact CB-CE1 4.38Å; A130-F209 HydrophobicContact CB-CE2 4.09Å; A130-F209 HydrophobicContact CB-CZ 3.71Å; F209-F359 WeakPolarHBondContact O-CA 3.48Å; F209-A360 PolarHBondContact N-O 2.93Å; F209-A360 VanDerWaalsContact N-O 3.14Å; F209-A360 PolarHBondContact O-N 3.39Å; F209-F363 HydrophobicContact CB-CD2 3.59Å; F209-F363 HydrophobicContact CB-CE2 3.32Å; F209-F363 HydrophobicContact CB-CZ 4.06Å; F209-V372 HydrophobicContact CD2-CG1 3.88Å; F209-V372 HydrophobicContact CE2-CG1 3.82Å; F209-V372 HydrophobicContact CZ-CG1 4.45Å; F209-L375 HydrophobicContact CD1-CB 3.79Å; F209-L375 HydrophobicContact CD1-CD1 4.25Å; F209-L375 HydrophobicContact CE1-CB 3.77Å; F209-E376 HydrophobicContact CE1-CB 4.24Å; F209-E376 HydrophobicContact CE2-CB 4.42Å; F209-E376 HydrophobicContact CZ-CB 3.59Å; F209-E376 HydrophobicContact CZ-CG 4.02Å
210	P	98.4	Very high	97.9	Very high	2 Å²	2	18.5 Å²	18.5	1%	0.013	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	139.2	176.4	28.2	-36.2	0	0	0	111.7	A130 I131 F359	A130-P210 HydrophobicContact CB-CG 3.6Å; I131-P210 HydrophobicContact CG2-CB 4.03Å; I131-P210 HydrophobicContact CG2-CG 3.75Å; P210-F359 HydrophobicContact CB-CD1 3.98Å; P210-F359 HydrophobicContact CB-CE1 3.72Å
211	I	97.8	Very high	97.8	Very high	22 Å²	22	18.2 Å²	18.2	11%	0.113	9%	0.086	C	C	.	.	S	Bend	trans	-119.7	13.2	170	57.9	162.6	0	0	0	111.8	A319 S357 L358 A360 L375	I211-A319 HydrophobicContact CD1-CB 4.23Å; I211-S357 VanDerWaalsContact CD1-O 3.25Å; I211-S357 WeakPolarHBondContact CD1-O 3.49Å; I211-S357 VanDerWaalsContact CG1-O 3.25Å; I211-S357 WeakPolarHBondContact CG1-O 3.22Å; I211-L358 WeakPolarHBondContact CG1-O 3.43Å; I211-L358 PolarHBondContact N-O 3.42Å; I211-A360 HydrophobicContact CG2-CB 3.87Å; I211-L375 HydrophobicContact CG2-CD2 4.49Å
212	K	98.4	Very high	97.7	Very high	40 Å²	40	23.8 Å²	23.8	17%	0.174	11%	0.107	C	C	.	.	S	Bend	trans	-135.8	149.8	170.4	-64.4	-64.1	170.3	-62.9	0	109.2	E216 I217 S355 S357 L358 H379	K212-E216 VanDerWaalsContact CA-OE2 3.28Å; K212-E216 WeakPolarHBondContact CA-OE2 3.42Å; K212-E216 HydrophobicContact CB-CB 3.96Å; K212-E216 HydrophobicContact CD-CB 4.29Å; K212-E216 WeakPolarHBondContact CD-OE2 3.03Å; K212-I217 HydrophobicContact CB-CG1 3.95Å; K212-S355 PolarHBondContact NZ-O 2.85Å; K212-S357 WeakPolarHBondContact CG-O 3.24Å; K212-S357 PolarHBondContact NZ-O 3.27Å; K212-L358 HydrophobicContact CG-CD2 4.4Å; K212-L358 PolarHBondContact N-O 3.1Å; K212-H379 PolarHBondContact O-NE2 3.16Å
213	T	98.4	Very high	97.6	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.006	13%	0.13	C	C	.	.			trans	-74.2	164.8	173.7	69.7	0	0	0	0	111.2	R215 E216 I217 Q382 V383 Q386	T213-R215 VanDerWaalsContact C-N 3.31Å; T213-R215 PolarHBondContact O-N 2.87Å; T213-E216 PolarHBondContact N-OE2 2.06Å; T213-E216 PolarHBondContact O-N 3.01Å; T213-E216 VanDerWaalsContact O-N 3.14Å; T213-E216 VanDerWaalsContact OG1-CG 3.31Å; T213-E216 WeakPolarHBondContact OG1-CG 3.38Å; T213-E216 PolarHBondContact OG1-N 3.1Å; T213-E216 VanDerWaalsContact OG1-N 3.16Å; T213-I217 VanDerWaalsContact O-CG1 3.32Å; T213-I217 WeakPolarHBondContact O-CG1 3.42Å; T213-I217 PolarHBondContact O-N 2.74Å; T213-Q382 HydrophobicContact CG2-CB 4.11Å; T213-Q382 HydrophobicContact CG2-CG 3.72Å; T213-V383 HydrophobicContact CG2-CG2 3.65Å; T213-Q386 VanDerWaalsContact CB-OE1 3.28Å; T213-Q386 PolarHBondContact OG1-OE1 3.36Å
214	N	98.5	Very high	97.5	Very high	12 Å²	12	33.8 Å²	33.8	6%	0.064	16%	0.159	C	C	.	.	H	α-helix	trans	-57.5	-45.6	175.6	179.9	75.5	0	0	0	111.3	E106 N136 E216 I217 I218	E106-N214 WeakPolarHBondContact OE1-CB 3.09Å; E106-N214 PolarHBondContact OE1-ND2 3.44Å; N136-N214 PolarHBondContact ND2-OD1 2.86Å; N214-E216 VanDerWaalsContact C-N 3.35Å; N214-E216 PolarHBondContact O-N 3.32Å; N214-I217 PolarHBondContact O-N 2.92Å; N214-I218 WeakPolarHBondContact ND2-CD1 3.06Å; N214-I218 WeakPolarHBondContact O-CG1 3.43Å; N214-I218 PolarHBondContact O-N 3.33Å
215	R	98.2	Very high	97.4	Very high	66 Å²	66	35 Å²	35	25%	0.249	16%	0.164	C	C	.	.	H	α-helix	trans	-54.1	-45.9	171.5	-168.4	176.6	-173.8	163.8	6.4	113.2	E105 E106 T213 I218 H219 Q386 E388	E105-R215 IonicContact OE2-CZ 2.73Å; E105-R215 IonicContact OE2-NE 3.85Å; E105-R215 PolarHBondContact OE2-NE 3.03Å; E105-R215 IonicContact OE2-NH2 3.54Å; E105-R215 PolarHBondContact OE2-NH2 3.3Å; E106-R215 HydrophobicContact CG-CB 4Å; E106-R215 HydrophobicContact CG-CG 4.37Å; E106-R215 PolarHBondContact OE1-N 3.37Å; T213-R215 VanDerWaalsContact C-N 3.31Å; T213-R215 PolarHBondContact O-N 2.87Å; R215-I218 PolarHBondContact O-N 3.3Å; R215-H219 WeakPolarHBondContact O-CB 3.38Å; R215-H219 PolarHBondContact O-N 2.86Å; R215-Q386 PolarHBondContact NH1-O 3.14Å; R215-E388 IonicContact CZ-OE1 3.39Å; R215-E388 IonicContact NH1-OE1 3.99Å; R215-E388 PolarHBondContact NH1-OE1 3.41Å; R215-E388 IonicContact NH2-OE1 2.79Å; R215-E388 PolarHBondContact NH2-OE1 2.86Å
216	E	98.3	Very high	97.4	Very high	47 Å²	47	38.4 Å²	38.4	22%	0.22	18%	0.181	C	C	.	.	H	α-helix	trans	-66.6	-38.2	179	-74.4	165.1	178.3	0	0	113	K212 T213 N214 H219 Y220 Q382 Q386	K212-E216 VanDerWaalsContact CA-OE2 3.28Å; K212-E216 WeakPolarHBondContact CA-OE2 3.42Å; K212-E216 HydrophobicContact CB-CB 3.96Å; K212-E216 HydrophobicContact CD-CB 4.29Å; K212-E216 WeakPolarHBondContact CD-OE2 3.03Å; T213-E216 PolarHBondContact N-OE2 2.06Å; T213-E216 PolarHBondContact O-N 3.01Å; T213-E216 VanDerWaalsContact O-N 3.14Å; T213-E216 VanDerWaalsContact OG1-CG 3.31Å; T213-E216 WeakPolarHBondContact OG1-CG 3.38Å; T213-E216 PolarHBondContact OG1-N 3.1Å; T213-E216 VanDerWaalsContact OG1-N 3.16Å; N214-E216 VanDerWaalsContact C-N 3.35Å; N214-E216 PolarHBondContact O-N 3.32Å; E216-H219 PolarHBondContact O-N 3.3Å; E216-Y220 VanDerWaalsContact O-CB 3.31Å; E216-Y220 WeakPolarHBondContact O-CB 3.27Å; E216-Y220 PolarHBondContact O-N 2.83Å; E216-Q382 PolarHBondContact OE1-NE2 3.29Å; E216-Q382 PolarHBondContact OE2-NE2 3.36Å; E216-Q386 PolarHBondContact OE1-NE2 3.35Å
217	I	98.6	Very high	97.5	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-63.3	-47.7	175	-66.7	165.2	0	0	0	110	L111 I202 K212 T213 N214 Y220 I221 L358 F359	L111-I217 HydrophobicContact CD1-CB 4.42Å; L111-I217 HydrophobicContact CD1-CG2 3.71Å; I202-I217 HydrophobicContact CD1-CG2 3.86Å; K212-I217 HydrophobicContact CB-CG1 3.95Å; T213-I217 VanDerWaalsContact O-CG1 3.32Å; T213-I217 WeakPolarHBondContact O-CG1 3.42Å; T213-I217 PolarHBondContact O-N 2.74Å; N214-I217 PolarHBondContact O-N 2.92Å; I217-Y220 PolarHBondContact O-N 2.81Å; I217-I221 HydrophobicContact CG2-CD1 3.86Å; I217-I221 WeakPolarHBondContact O-CG1 3.4Å; I217-I221 PolarHBondContact O-N 3.11Å; I217-L358 HydrophobicContact CG1-CD2 4.22Å; I217-L358 HydrophobicContact CG2-CD1 4.47Å; I217-F359 HydrophobicContact CD1-CE2 3.97Å; I217-F359 HydrophobicContact CD1-CZ 3.85Å
218	I	98.1	Very high	97.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.8	-48.8	177.5	-69.5	172	0	0	0	110.3	E106 F109 L111 N214 R215 Y220 I221 R222	E106-I218 HydrophobicContact CB-CD1 4.27Å; E106-I218 HydrophobicContact CG-CD1 4.09Å; F109-I218 HydrophobicContact CB-CD1 4.23Å; F109-I218 HydrophobicContact CB-CG2 3.9Å; F109-I218 HydrophobicContact CD1-CB 4.26Å; F109-I218 HydrophobicContact CD1-CD1 4.15Å; F109-I218 HydrophobicContact CD1-CG1 3.71Å; F109-I218 HydrophobicContact CD1-CG2 3.8Å; F109-I218 HydrophobicContact CD2-CG2 4.46Å; F109-I218 HydrophobicContact CE1-CG1 4.31Å; F109-I218 HydrophobicContact CE1-CG2 4.39Å; F109-I218 HydrophobicContact CG-CG1 4.43Å; F109-I218 HydrophobicContact CG-CG2 3.8Å; F109-I218 WeakPolarHBondContact O-CD1 2.92Å; L111-I218 HydrophobicContact CD1-CG1 4.05Å; L111-I218 HydrophobicContact CG-CG1 4.36Å; N214-I218 WeakPolarHBondContact ND2-CD1 3.06Å; N214-I218 WeakPolarHBondContact O-CG1 3.43Å; N214-I218 PolarHBondContact O-N 3.33Å; R215-I218 PolarHBondContact O-N 3.3Å; I218-Y220 VanDerWaalsContact C-N 3.33Å; I218-Y220 PolarHBondContact O-N 3.15Å; I218-I221 PolarHBondContact O-N 3.16Å; I218-R222 HydrophobicContact CG2-CG 4.25Å; I218-R222 WeakPolarHBondContact O-CB 3.3Å; I218-R222 VanDerWaalsContact O-CG 3.31Å; I218-R222 WeakPolarHBondContact O-CG 3.25Å; I218-R222 PolarHBondContact O-N 2.81Å
219	H	97.8	Very high	97.6	Very high	114 Å²	114	47.2 Å²	47.2	53%	0.528	22%	0.221	S	C	.	.	H	α-helix	trans	-58.8	-43.7	177.9	-176.7	80.6	0	0	0	112	R215 E216 S223	R215-H219 WeakPolarHBondContact O-CB 3.38Å; R215-H219 PolarHBondContact O-N 2.86Å; E216-H219 PolarHBondContact O-N 3.3Å; H219-S223 VanDerWaalsContact O-CB 3.22Å; H219-S223 WeakPolarHBondContact O-CB 3.49Å; H219-S223 PolarHBondContact O-N 2.77Å; H219-S223 PolarHBondContact O-OG 2.81Å
220	Y	97.8	Very high	97.6	Very high	32 Å²	32	47.3 Å²	47.3	13%	0.125	22%	0.221	C	C	.	.	H	α-helix	trans	-60.8	-47.6	177.4	178.4	-97.6	0	0	0	112.2	E216 I217 I218 S223 K224 W225 I230 G315 L358	E216-Y220 VanDerWaalsContact O-CB 3.31Å; E216-Y220 WeakPolarHBondContact O-CB 3.27Å; E216-Y220 PolarHBondContact O-N 2.83Å; I217-Y220 PolarHBondContact O-N 2.81Å; I218-Y220 VanDerWaalsContact C-N 3.33Å; I218-Y220 PolarHBondContact O-N 3.15Å; Y220-S223 PolarHBondContact O-OG 2.92Å; Y220-K224 HydrophobicContact CD2-CD 4.18Å; Y220-K224 HydrophobicContact CE2-CD 3.76Å; Y220-K224 PolarHBondContact O-N 3.35Å; Y220-K224 VanDerWaalsContact O-N 3.12Å; Y220-W225 AromaticContact CE1-CD1 3.46Å; Y220-W225 VanDerWaalsContact CE1-CD1 3.46Å; Y220-W225 AromaticContact CE1-NE1 3.47Å; Y220-W225 AromaticContact CZ-CD1 3.84Å; Y220-W225 AromaticContact CZ-NE1 3.45Å; Y220-W225 PolarHBondContact OH-NE1 2.92Å; Y220-W225 VanDerWaalsContact OH-NE1 3.08Å; Y220-I230 HydrophobicContact CE1-CD1 4.03Å; Y220-G315 WeakPolarHBondContact CE1-O 3.39Å; Y220-G315 WeakPolarHBondContact OH-CA 3.44Å; Y220-G315 PolarHBondContact OH-O 2.95Å; Y220-L358 HydrophobicContact CD1-CD1 4.25Å; Y220-L358 HydrophobicContact CD1-CD2 3.78Å; Y220-L358 HydrophobicContact CD1-CG 4.42Å; Y220-L358 HydrophobicContact CE1-CD2 4.38Å; Y220-L358 HydrophobicContact CG-CD2 3.97Å
221	I	97.8	Very high	97.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.7	-49.6	179.4	-67.4	167	0	0	0	110.1	F109 L111 Y200 I217 I218 S223 W225 N226 V262	F109-I221 HydrophobicContact CZ-CG2 4.08Å; L111-I221 HydrophobicContact CD2-CD1 3.89Å; Y200-I221 HydrophobicContact CD1-CG2 4.17Å; Y200-I221 HydrophobicContact CD2-CG2 3.79Å; Y200-I221 HydrophobicContact CE1-CG2 3.82Å; Y200-I221 HydrophobicContact CE2-CG2 3.5Å; Y200-I221 VanDerWaalsContact CE2-CG2 3.5Å; Y200-I221 HydrophobicContact CG-CG2 4.11Å; Y200-I221 VanDerWaalsContact CZ-CG2 3.47Å; I217-I221 HydrophobicContact CG2-CD1 3.86Å; I217-I221 WeakPolarHBondContact O-CG1 3.4Å; I217-I221 PolarHBondContact O-N 3.11Å; I218-I221 PolarHBondContact O-N 3.16Å; I221-S223 PolarHBondContact O-N 2.89Å; I221-W225 CarbonylContact O-C 3.08Å; I221-W225 VanDerWaalsContact O-CA 3.24Å; I221-W225 WeakPolarHBondContact O-CA 3.46Å; I221-W225 PolarHBondContact O-N 2.84Å; I221-N226 PolarHBondContact O-N 3.36Å; I221-V262 HydrophobicContact CD1-CG1 3.92Å; I221-V262 HydrophobicContact CG1-CG1 4.37Å
222	R	96.4	Very high	97.3	Very high	117 Å²	117	47 Å²	47	44%	0.442	22%	0.22	S	C	.	.	H	α-helix	trans	-65.6	-36.1	-177.4	-69.6	179	68.1	140.2	2.3	113.2	F109 I218	F109-R222 HydrophobicContact CD2-CG 3.97Å; F109-R222 HydrophobicContact CE2-CG 3.59Å; F109-R222 HydrophobicContact CZ-CG 4.02Å; I218-R222 HydrophobicContact CG2-CG 4.25Å; I218-R222 WeakPolarHBondContact O-CB 3.3Å; I218-R222 VanDerWaalsContact O-CG 3.31Å; I218-R222 WeakPolarHBondContact O-CG 3.25Å; I218-R222 PolarHBondContact O-N 2.81Å
223	S	96.4	Very high	97	Very high	70 Å²	70	45 Å²	45	49%	0.49	21%	0.212	S	C	.	.	H	α-helix	trans	-80	-34.3	-177.2	59	0	0	0	0	113.6	H219 Y220 I221	H219-S223 VanDerWaalsContact O-CB 3.22Å; H219-S223 WeakPolarHBondContact O-CB 3.49Å; H219-S223 PolarHBondContact O-N 2.77Å; H219-S223 PolarHBondContact O-OG 2.81Å; Y220-S223 PolarHBondContact O-OG 2.92Å; I221-S223 PolarHBondContact O-N 2.89Å
224	K	95.8	Very high	96.3	Very high	140 Å²	140	46.7 Å²	46.7	61%	0.609	23%	0.226	S	C	*	.	H	α-helix	trans	-114.9	-26.3	-172.3	-65.8	-171.3	177.7	-173.3	0	114.6	Y220	Y220-K224 HydrophobicContact CD2-CD 4.18Å; Y220-K224 HydrophobicContact CE2-CD 3.76Å; Y220-K224 PolarHBondContact O-N 3.35Å; Y220-K224 VanDerWaalsContact O-N 3.12Å
225	W	96.4	Very high	95.3	Very high	26 Å²	26	51.3 Å²	51.3	10%	0.098	25%	0.249	C	C	.	.			trans	-131.2	26.1	-167.7	-60.9	100.7	0	0	0	112.7	Y200 Y220 I221 D227 K228 I230 T308 E314	Y200-W225 PolarHBondContact OH-O 2.97Å; Y220-W225 AromaticContact CE1-CD1 3.46Å; Y220-W225 VanDerWaalsContact CE1-CD1 3.46Å; Y220-W225 AromaticContact CE1-NE1 3.47Å; Y220-W225 AromaticContact CZ-CD1 3.84Å; Y220-W225 AromaticContact CZ-NE1 3.45Å; Y220-W225 PolarHBondContact OH-NE1 2.92Å; Y220-W225 VanDerWaalsContact OH-NE1 3.08Å; I221-W225 CarbonylContact O-C 3.08Å; I221-W225 VanDerWaalsContact O-CA 3.24Å; I221-W225 WeakPolarHBondContact O-CA 3.46Å; I221-W225 PolarHBondContact O-N 2.84Å; W225-D227 PolarHBondContact O-N 3.17Å; W225-K228 HydrophobicContact CE3-CB 4.06Å; W225-K228 PolarHBondContact O-N 3.26Å; W225-I230 HydrophobicContact CB-CD1 3.97Å; W225-I230 HydrophobicContact CB-CG1 4.11Å; W225-I230 VanDerWaalsContact CD1-CD1 3.45Å; W225-I230 HydrophobicContact CD2-CD1 3.79Å; W225-I230 HydrophobicContact CD2-CG1 3.61Å; W225-I230 HydrophobicContact CE3-CG1 3.85Å; W225-I230 HydrophobicContact CG-CD1 3.47Å; W225-I230 VanDerWaalsContact CG-CD1 3.47Å; W225-I230 HydrophobicContact CG-CG1 3.72Å; W225-I230 HydrophobicContact CZ2-CG2 4.4Å; W225-I230 HydrophobicContact CZ3-CG1 4.46Å; W225-T308 HydrophobicContact CZ3-CG2 4.16Å; W225-E314 HydrophobicContact CH2-CB 3.99Å; W225-E314 HydrophobicContact CZ2-CB 3.88Å
226	N	95.9	Very high	94.1	Very high	91 Å²	91	51 Å²	51	49%	0.487	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	123.9	178.8	-170.8	66.4	0	0	0	110.7	I221 K228	I221-N226 PolarHBondContact O-N 3.36Å; N226-K228 PolarHBondContact O-N 2.9Å
227	D	96.1	Very high	92.8	Very high	103 Å²	103	51.6 Å²	51.6	55%	0.551	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	19.9	-173.5	-61.9	-56.3	0	0	0	115.7	Y200 W225 G306	Y200-D227 WeakPolarHBondContact OH-CA 3.35Å; Y200-D227 PolarHBondContact OH-N 3.42Å; W225-D227 PolarHBondContact O-N 3.17Å; D227-G306 WeakPolarHBondContact O-CA 3.21Å
228	K	97.9	Very high	91.2	Very high	107 Å²	107	56.9 Å²	56.9	47%	0.465	29%	0.293	S	S	.	.			trans	-120.1	142.9	179.5	-66.3	176.9	-176.2	179.5	0	112.1	Y200 W225 N226 T308	Y200-K228 WeakPolarHBondContact CE1-O 3.03Å; W225-K228 HydrophobicContact CE3-CB 4.06Å; W225-K228 PolarHBondContact O-N 3.26Å; N226-K228 PolarHBondContact O-N 2.9Å; K228-T308 HydrophobicContact CB-CG2 3.93Å; K228-T308 HydrophobicContact CD-CG2 4.3Å; K228-T308 HydrophobicContact CG-CG2 4.26Å
229	N	98.3	Very high	89.9	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.316	C	S	.	.			trans	-78.3	158.6	172.5	-55.4	-43.4	0	0	0	110.8	V262 L263 T264 F267 N299 P305 G306	N229-V262 CarbonylContact C-O 3.46Å; N229-L263 HydrophobicContact CB-CD2 3.88Å; N229-T264 WeakPolarHBondContact OD1-CB 2.88Å; N229-T264 WeakPolarHBondContact OD1-CG2 3.43Å; N229-T264 PolarHBondContact OD1-N 3.41Å; N229-T264 PolarHBondContact OD1-OG1 3.01Å; N229-F267 WeakPolarHBondContact ND2-CD2 3.21Å; N229-F267 WeakPolarHBondContact ND2-CG 3.5Å; N229-F267 WeakPolarHBondContact OD1-CB 3.2Å; N229-N299 VanDerWaalsContact CB-OD1 3.3Å; N229-N299 WeakPolarHBondContact CB-OD1 3.33Å; N229-N299 PolarHBondContact ND2-OD1 3.13Å; N229-P305 PolarHBondContact ND2-O 3.22Å; N229-G306 PolarHBondContact N-O 3.31Å; N229-G306 VanDerWaalsContact ND2-C 3.31Å; N229-G306 PolarHBondContact ND2-O 2.94Å; N229-G306 VanDerWaalsContact ND2-O 3.16Å
230	I	97.9	Very high	88.6	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-123.1	103.8	175.1	-44.9	-175.4	0	0	0	108	Y220 W225 P232 Y261 V262 G315 V317	Y220-I230 HydrophobicContact CE1-CD1 4.03Å; W225-I230 HydrophobicContact CB-CD1 3.97Å; W225-I230 HydrophobicContact CB-CG1 4.11Å; W225-I230 VanDerWaalsContact CD1-CD1 3.45Å; W225-I230 HydrophobicContact CD2-CD1 3.79Å; W225-I230 HydrophobicContact CD2-CG1 3.61Å; W225-I230 HydrophobicContact CE3-CG1 3.85Å; W225-I230 HydrophobicContact CG-CD1 3.47Å; W225-I230 VanDerWaalsContact CG-CD1 3.47Å; W225-I230 HydrophobicContact CG-CG1 3.72Å; W225-I230 HydrophobicContact CZ2-CG2 4.4Å; W225-I230 HydrophobicContact CZ3-CG1 4.46Å; I230-P232 HydrophobicContact CG2-CG 4.44Å; I230-Y261 VanDerWaalsContact O-CA 3.29Å; I230-Y261 WeakPolarHBondContact O-CA 3.3Å; I230-Y261 WeakPolarHBondContact O-CB 3.4Å; I230-V262 HydrophobicContact CB-CB 3.92Å; I230-V262 HydrophobicContact CB-CG2 4.4Å; I230-V262 HydrophobicContact CD1-CB 3.9Å; I230-V262 HydrophobicContact CD1-CG1 4.39Å; I230-V262 HydrophobicContact CD1-CG2 4.1Å; I230-V262 HydrophobicContact CG1-CB 3.94Å; I230-V262 PolarHBondContact N-O 3Å; I230-V262 PolarHBondContact O-N 3.14Å; I230-G315 VanDerWaalsContact CG2-CA 3.49Å; I230-V317 HydrophobicContact CB-CG2 4.25Å; I230-V317 HydrophobicContact CG2-CG2 3.53Å
231	T	96.7	Very high	87.2	Confident	8 Å²	8	57.6 Å²	57.6	5%	0.049	30%	0.299	C	S	.	.			trans	-132.1	81.6	177.3	60.6	0	0	0	0	109.5	G233 L263 W295 N299	T231-G233 PolarHBondContact O-N 2.88Å; T231-L263 HydrophobicContact CG2-CD2 3.59Å; T231-W295 HydrophobicContact CG2-CB 4.06Å; T231-N299 HydrophobicContact CG2-CB 3.94Å; T231-N299 WeakPolarHBondContact OG1-CB 3.4Å; T231-N299 PolarHBondContact OG1-ND2 3.04Å
232	P	94.5	Very high	85.9	Confident	9 Å²	9	64.2 Å²	64.2	6%	0.058	34%	0.335	C	S	.	.			trans	-58.7	128.4	-175.4	-20.7	31.2	0	0	0	110.9	I230 G257 S258 G312 W313 E314 V317	I230-P232 HydrophobicContact CG2-CG 4.44Å; P232-G257 CarbonylContact O-C 3.41Å; P232-G257 WeakPolarHBondContact O-CA 3.48Å; P232-S258 PolarHBondContact O-N 2.82Å; P232-G312 WeakPolarHBondContact CA-O 3.49Å; P232-W313 HydrophobicContact CB-CE3 3.87Å; P232-W313 HydrophobicContact CB-CZ3 4.44Å; P232-E314 WeakPolarHBondContact CG-O 3.36Å; P232-V317 HydrophobicContact CG-CG2 4.02Å
233	G	90.3	Very high	84.9	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.3	175.4	178.4	0	0	0	0	0	112.4	T231 F256 G257 G312	T231-G233 PolarHBondContact O-N 2.88Å; G233-F256 CarbonylContact C-O 3.59Å; G233-F256 WeakPolarHBondContact CA-O 3.48Å; G233-G257 VanDerWaalsContact CA-CA 3.5Å; G233-G312 PolarHBondContact N-O 3.11Å; G233-G312 CarbonylContact O-C 3.6Å; G233-G312 WeakPolarHBondContact O-CA 3.44Å
234	A	84.1	Confident	84.2	Confident	35 Å²	35	65.5 Å²	65.5	29%	0.289	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	160.2	-177.5	0	0	0	0	0	112.3	Q236 F256	A234-Q236 PolarHBondContact O-N 2.75Å; A234-F256 PolarHBondContact N-O 3.05Å; A234-F256 PolarHBondContact O-N 2.98Å; A234-F256 VanDerWaalsContact O-N 3.15Å
235	I	77.4	Confident	83.6	Confident	109 Å²	109	68.3 Å²	68.3	56%	0.559	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.8	127.9	168	-63.7	171.3	0	0	0	108.1	Y255	I235-Y255 HydrophobicContact CB-CD1 4.43Å; I235-Y255 HydrophobicContact CB-CE1 4.18Å; I235-Y255 HydrophobicContact CD1-CE1 3.83Å; I235-Y255 HydrophobicContact CG1-CD1 3.66Å; I235-Y255 HydrophobicContact CG1-CE1 3.01Å
236	Q	73.8	Confident	83.2	Confident	61 Å²	61	71.3 Å²	71.3	29%	0.285	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-83.3	153.5	166.9	-74.7	-62	-16	0	0	111.1	A234 I240 F256	A234-Q236 PolarHBondContact O-N 2.75Å; Q236-I240 HydrophobicContact CB-CB 4.04Å; Q236-I240 HydrophobicContact CB-CD1 3.89Å; Q236-I240 HydrophobicContact CB-CG1 4.22Å; Q236-I240 HydrophobicContact CB-CG2 4.34Å; Q236-I240 HydrophobicContact CG-CD1 3.98Å; Q236-F256 HydrophobicContact CB-CD2 4.1Å; Q236-F256 HydrophobicContact CB-CE2 4.45Å; Q236-F256 HydrophobicContact CG-CB 3.77Å; Q236-F256 HydrophobicContact CG-CD1 4.37Å; Q236-F256 HydrophobicContact CG-CD2 3.17Å; Q236-F256 HydrophobicContact CG-CE2 3.78Å; Q236-F256 HydrophobicContact CG-CG 3.52Å
237	P	71.4	Confident	82.9	Confident	59 Å²	59	76 Å²	76	38%	0.383	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-50.6	142.6	171.3	-28.2	36.5	0	0	0	111.8	H239 I240	P237-H239 WeakPolarHBondContact CB-CE1 3.2Å; P237-H239 WeakPolarHBondContact CB-ND1 3.4Å; P237-H239 PolarHBondContact O-N 2.93Å; P237-I240 PolarHBondContact O-N 3.01Å
238	P	65.6	Low	82.6	Confident	112 Å²	112	72 Å²	72	73%	0.727	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-53	-30.2	-170.8	-29.4	34.1	0	0	0	115.3	I240 N241	P238-I240 PolarHBondContact O-N 2.73Å; P238-N241 PolarHBondContact O-N 3Å
239	H	69.3	Low	82.4	Confident	103 Å²	103	68.2 Å²	68.2	48%	0.477	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-68.8	-16.3	-178.7	68.9	-95.8	0	0	0	114.1	P237 N242	P237-H239 WeakPolarHBondContact CB-CE1 3.2Å; P237-H239 WeakPolarHBondContact CB-ND1 3.4Å; P237-H239 PolarHBondContact O-N 2.93Å; H239-N242 PolarHBondContact O-N 3.15Å
240	I	70	Confident	82.3	Confident	23 Å²	23	72.6 Å²	72.6	12%	0.118	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-70.9	-34.5	176.4	-60.7	-159.4	0	0	0	110.9	Q236 P237 P238 N242 R243 F256	Q236-I240 HydrophobicContact CB-CB 4.04Å; Q236-I240 HydrophobicContact CB-CD1 3.89Å; Q236-I240 HydrophobicContact CB-CG1 4.22Å; Q236-I240 HydrophobicContact CB-CG2 4.34Å; Q236-I240 HydrophobicContact CG-CD1 3.98Å; P237-I240 PolarHBondContact O-N 3.01Å; P238-I240 PolarHBondContact O-N 2.73Å; I240-N242 PolarHBondContact O-N 3.38Å; I240-R243 VanDerWaalsContact O-CB 3.3Å; I240-R243 WeakPolarHBondContact O-CB 3.27Å; I240-R243 WeakPolarHBondContact O-CG 3.21Å; I240-R243 PolarHBondContact O-N 2.72Å; I240-F256 HydrophobicContact CG2-CE2 3.69Å; I240-F256 HydrophobicContact CG2-CZ 3.73Å
241	N	68.9	Low	81.9	Confident	36 Å²	36	79.9 Å²	79.9	19%	0.193	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-65.5	-22	176	-71.7	-22.1	0	0	0	113	P238 R243 F244 I254	P238-N241 PolarHBondContact O-N 3Å; N241-R243 PolarHBondContact O-N 3.26Å; N241-F244 WeakPolarHBondContact O-CD2 3.33Å; N241-I254 WeakPolarHBondContact OD1-CB 3.41Å
242	N	70.8	Confident	81.7	Confident	139 Å²	139	80.3 Å²	80.3	74%	0.743	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-76.1	-7	175	-62.3	-18.3	0	0	0	113.1	H239 I240	H239-N242 PolarHBondContact O-N 3.15Å; I240-N242 PolarHBondContact O-N 3.38Å
243	R	75.8	Confident	81.5	Confident	176 Å²	176	83.4 Å²	83.4	66%	0.664	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-85.1	-14.1	179.4	-58.1	-177.5	-173.4	-173.4	4	113	I240 N241	I240-R243 VanDerWaalsContact O-CB 3.3Å; I240-R243 WeakPolarHBondContact O-CB 3.27Å; I240-R243 WeakPolarHBondContact O-CG 3.21Å; I240-R243 PolarHBondContact O-N 2.72Å; N241-R243 PolarHBondContact O-N 3.26Å
244	F	82.6	Confident	81.5	Confident	38 Å²	38	83.4 Å²	83.4	17%	0.167	42%	0.422	C	S	.	.	S	Bend	trans	-76.1	135.7	177.1	-59.2	-60.6	0	0	0	110.3	N241 D246 I254 F256 W283 I287	N241-F244 WeakPolarHBondContact O-CD2 3.33Å; F244-D246 VanDerWaalsContact C-N 3.34Å; F244-D246 PolarHBondContact O-N 3.27Å; F244-I254 HydrophobicContact CD2-CG1 4.36Å; F244-I254 HydrophobicContact CE2-CB 3.94Å; F244-I254 HydrophobicContact CE2-CG1 3.74Å; F244-I254 HydrophobicContact CE2-CG2 4.13Å; F244-I254 HydrophobicContact CZ-CB 4.35Å; F244-I254 HydrophobicContact CZ-CG1 4.35Å; F244-I254 HydrophobicContact CZ-CG2 4.02Å; F244-F256 HydrophobicContact CZ-CE2 4.38Å; F244-F256 HydrophobicContact CZ-CZ 4.37Å; F244-W283 HydrophobicContact CB-CZ2 3.91Å; F244-W283 AromaticContact CD1-CH2 3.93Å; F244-W283 HydrophobicContact CD1-CH2 3.93Å; F244-W283 HydrophobicContact CD1-CZ2 4.05Å; F244-W283 HydrophobicContact CD2-CH2 4.03Å; F244-W283 HydrophobicContact CD2-CZ2 4.06Å; F244-W283 HydrophobicContact CE1-CH2 4.05Å; F244-W283 HydrophobicContact CE2-CH2 4.16Å; F244-W283 AromaticContact CG-CH2 3.92Å; F244-W283 HydrophobicContact CG-CH2 3.92Å; F244-W283 AromaticContact CG-CZ2 3.74Å; F244-W283 HydrophobicContact CG-CZ2 3.74Å; F244-W283 HydrophobicContact CZ-CH2 4.16Å; F244-I287 HydrophobicContact CD1-CD1 3.7Å; F244-I287 HydrophobicContact CE1-CD1 4.21Å; F244-I287 HydrophobicContact CE1-CG2 4.07Å; F244-I287 HydrophobicContact CG-CD1 4.49Å
245	K	82.8	Confident	81.8	Confident	199 Å²	199	83.3 Å²	83.3	87%	0.865	41%	0.414	S	S	*	.	S	Bend	trans	-60	-45.8	179.8	-177.5	-173.4	173.3	-166.2	0	111.5
246	D	87.1	Confident	82.4	Confident	88 Å²	88	80.5 Å²	80.5	47%	0.471	40%	0.398	S	S	.	.	S	Bend	trans	-112.8	141.7	178	-60.4	-52	0	0	0	109.8	F244 W283	F244-D246 VanDerWaalsContact C-N 3.34Å; F244-D246 PolarHBondContact O-N 3.27Å; D246-W283 PolarHBondContact O-NE1 2.86Å
247	K	89.2	Confident	83.2	Confident	189 Å²	189	78 Å²	78	82%	0.822	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-62.3	141.9	179.3	-68.2	-175.6	179.5	-179.2	0	110.6	W283	K247-W283 PolarHBondContact O-NE1 3.44Å
248	P	90.8	Very high	84.2	Confident	20 Å²	20	76.3 Å²	76.3	13%	0.13	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-53.9	140.4	171	-26.9	35.3	0	0	0	111.7	L252 I254 W283	P248-L252 HydrophobicContact CB-CB 4.2Å; P248-L252 VanDerWaalsContact CB-O 3.29Å; P248-L252 WeakPolarHBondContact CB-O 3.29Å; P248-I254 HydrophobicContact CB-CD1 3.87Å; P248-I254 HydrophobicContact CB-CG1 4.22Å; P248-I254 HydrophobicContact CG-CD1 3.84Å; P248-I254 HydrophobicContact CG-CG1 3.62Å; P248-W283 HydrophobicContact CB-CZ2 4.5Å; P248-W283 HydrophobicContact CG-CH2 4.37Å; P248-W283 HydrophobicContact CG-CZ2 4.03Å
249	P	94.3	Very high	85.6	Confident	27 Å²	27	71.8 Å²	71.8	18%	0.175	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-65.6	157.4	177.7	29.4	-34.6	0	0	0	110.4	N251 L252 D279 M280 W283	P249-N251 PolarHBondContact O-N 3.48Å; P249-L252 HydrophobicContact CG-CD1 4.41Å; P249-L252 WeakPolarHBondContact O-CB 3.43Å; P249-L252 WeakPolarHBondContact O-CG 3.43Å; P249-L252 PolarHBondContact O-N 2.86Å; P249-D279 HydrophobicContact CB-CB 4.01Å; P249-D279 HydrophobicContact CG-CB 4.19Å; P249-M280 HydrophobicContact CG-CB 4.34Å; P249-W283 HydrophobicContact CG-CB 4.13Å; P249-W283 HydrophobicContact CG-CG 4.47Å
250	H	94.9	Very high	86.9	Confident	93 Å²	93	68.2 Å²	68.2	43%	0.431	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	54.8	24.9	176	-54.8	-72.8	0	0	0	115.1	L252 R276 D279	H250-L252 HydrophobicContact CB-CG 4.31Å; H250-L252 PolarHBondContact O-N 3.11Å; H250-R276 HydrophobicContact CB-CG 4.13Å; H250-D279 IonicContact CD2-OD2 2.98Å; H250-D279 IonicContact CE1-OD2 2.73Å; H250-D279 PolarHBondContact CE1-OD2 3Å; H250-D279 IonicContact NE2-OD2 3.83Å; H250-D279 PolarHBondContact NE2-OD2 3.39Å
251	N	89.9	Confident	88.2	Confident	153 Å²	153	67.1 Å²	67.1	82%	0.818	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	53.7	31.5	-174	-60.5	-33.8	0	0	0	113.3	P249 T253	P249-N251 PolarHBondContact O-N 3.48Å; N251-T253 PolarHBondContact O-N 2.69Å
252	L	91.3	Very high	89.6	Confident	18 Å²	18	65.4 Å²	65.4	9%	0.094	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-61.5	134.4	177	-69.4	171.3	0	0	0	110.7	P248 P249 H250 M280 T297 L301	P248-L252 HydrophobicContact CB-CB 4.2Å; P248-L252 VanDerWaalsContact CB-O 3.29Å; P248-L252 WeakPolarHBondContact CB-O 3.29Å; P249-L252 HydrophobicContact CG-CD1 4.41Å; P249-L252 WeakPolarHBondContact O-CB 3.43Å; P249-L252 WeakPolarHBondContact O-CG 3.43Å; P249-L252 PolarHBondContact O-N 2.86Å; H250-L252 HydrophobicContact CB-CG 4.31Å; H250-L252 PolarHBondContact O-N 3.11Å; L252-M280 HydrophobicContact CD1-CB 4.05Å; L252-M280 HydrophobicContact CD1-CG 4.24Å; L252-M280 HydrophobicContact CD1-SD 4.1Å; L252-T297 HydrophobicContact CB-CG2 4.49Å; L252-L301 HydrophobicContact CD2-CD1 4.31Å; L252-L301 HydrophobicContact CD2-CD2 3.68Å; L252-L301 HydrophobicContact CD2-CG 4.34Å
253	T	90.4	Very high	90.9	Very high	73 Å²	73	58.8 Å²	58.8	45%	0.448	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-84.3	124.4	167.6	-62	0	0	0	0	108.1	N251 Y255 T297	N251-T253 PolarHBondContact O-N 2.69Å; T253-Y255 HydrophobicContact CG2-CE2 3.99Å; T253-Y255 WeakPolarHBondContact O-CD2 3.41Å; T253-Y255 WeakPolarHBondContact O-CE2 3.44Å; T253-T297 VanDerWaalsContact O-CG2 3.32Å; T253-T297 WeakPolarHBondContact O-CG2 3.3Å
254	I	90.6	Very high	92	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-82.2	132	-178.9	-52.6	-56.8	0	0	0	110.6	N241 F244 P248 F256 M280 W283 H293 T297	N241-I254 WeakPolarHBondContact OD1-CB 3.41Å; F244-I254 HydrophobicContact CD2-CG1 4.36Å; F244-I254 HydrophobicContact CE2-CB 3.94Å; F244-I254 HydrophobicContact CE2-CG1 3.74Å; F244-I254 HydrophobicContact CE2-CG2 4.13Å; F244-I254 HydrophobicContact CZ-CB 4.35Å; F244-I254 HydrophobicContact CZ-CG1 4.35Å; F244-I254 HydrophobicContact CZ-CG2 4.02Å; P248-I254 HydrophobicContact CB-CD1 3.87Å; P248-I254 HydrophobicContact CB-CG1 4.22Å; P248-I254 HydrophobicContact CG-CD1 3.84Å; P248-I254 HydrophobicContact CG-CG1 3.62Å; I254-F256 HydrophobicContact CG2-CE2 4.31Å; I254-M280 HydrophobicContact CD1-CE 4.01Å; I254-W283 HydrophobicContact CD1-CH2 3.97Å; I254-W283 HydrophobicContact CD1-CZ3 3.92Å; I254-W283 HydrophobicContact CG1-CH2 4.02Å; I254-W283 HydrophobicContact CG1-CZ3 4.43Å; I254-H293 HydrophobicContact CG2-CB 3.86Å; I254-T297 HydrophobicContact CD1-CG2 4.16Å
255	Y	91.2	Very high	92.8	Very high	33 Å²	33	51.7 Å²	51.7	13%	0.129	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	153.2	174.7	-71.5	-115.2	0	0	0	109.6	I235 T253 H293 V296 T297 Q300	I235-Y255 HydrophobicContact CB-CD1 4.43Å; I235-Y255 HydrophobicContact CB-CE1 4.18Å; I235-Y255 HydrophobicContact CD1-CE1 3.83Å; I235-Y255 HydrophobicContact CG1-CD1 3.66Å; I235-Y255 HydrophobicContact CG1-CE1 3.01Å; T253-Y255 HydrophobicContact CG2-CE2 3.99Å; T253-Y255 WeakPolarHBondContact O-CD2 3.41Å; T253-Y255 WeakPolarHBondContact O-CE2 3.44Å; Y255-H293 VanDerWaalsContact O-CA 3.3Å; Y255-H293 WeakPolarHBondContact O-CA 3.43Å; Y255-H293 WeakPolarHBondContact O-CB 3.36Å; Y255-H293 PolarHBondContact O-CD2 2.93Å; Y255-V296 HydrophobicContact CD1-CG2 4.49Å; Y255-V296 HydrophobicContact CG-CG2 4.44Å; Y255-T297 PolarHBondContact N-OG1 3.42Å; Y255-Q300 HydrophobicContact CD1-CG 3.63Å; Y255-Q300 HydrophobicContact CD2-CB 4.12Å; Y255-Q300 HydrophobicContact CD2-CG 3.85Å; Y255-Q300 HydrophobicContact CE1-CB 4.23Å; Y255-Q300 HydrophobicContact CE1-CG 3.47Å; Y255-Q300 VanDerWaalsContact CE1-CG 3.47Å; Y255-Q300 VanDerWaalsContact CE1-OE1 3.27Å; Y255-Q300 HydrophobicContact CE2-CB 3.77Å; Y255-Q300 HydrophobicContact CE2-CG 3.8Å; Y255-Q300 HydrophobicContact CG-CG 3.82Å; Y255-Q300 PolarHBondContact OH-OE1 2.97Å
256	F	89.8	Confident	93.6	Very high	49 Å²	49	48.8 Å²	48.8	22%	0.215	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	135.2	177.2	-79.8	-118	0	0	0	109.7	G233 A234 Q236 I240 F244 I254 H293	G233-F256 CarbonylContact C-O 3.59Å; G233-F256 WeakPolarHBondContact CA-O 3.48Å; A234-F256 PolarHBondContact N-O 3.05Å; A234-F256 PolarHBondContact O-N 2.98Å; A234-F256 VanDerWaalsContact O-N 3.15Å; Q236-F256 HydrophobicContact CB-CD2 4.1Å; Q236-F256 HydrophobicContact CB-CE2 4.45Å; Q236-F256 HydrophobicContact CG-CB 3.77Å; Q236-F256 HydrophobicContact CG-CD1 4.37Å; Q236-F256 HydrophobicContact CG-CD2 3.17Å; Q236-F256 HydrophobicContact CG-CE2 3.78Å; Q236-F256 HydrophobicContact CG-CG 3.52Å; I240-F256 HydrophobicContact CG2-CE2 3.69Å; I240-F256 HydrophobicContact CG2-CZ 3.73Å; F244-F256 HydrophobicContact CZ-CE2 4.38Å; F244-F256 HydrophobicContact CZ-CZ 4.37Å; I254-F256 HydrophobicContact CG2-CE2 4.31Å; F256-H293 AromaticContact CD1-CD2 3.44Å; F256-H293 VanDerWaalsContact CD1-CD2 3.44Å; F256-H293 WeakPolarHBondContact CD1-CD2 3.44Å; F256-H293 AromaticContact CD1-NE2 2.99Å; F256-H293 WeakPolarHBondContact CD1-NE2 3.42Å; F256-H293 AromaticContact CD2-CD2 3.52Å; F256-H293 AromaticContact CD2-NE2 3.88Å; F256-H293 AromaticContact CE1-CD2 3.59Å; F256-H293 AromaticContact CE1-CE1 3.89Å; F256-H293 AromaticContact CE1-NE2 2.85Å; F256-H293 WeakPolarHBondContact CE1-NE2 3.07Å; F256-H293 AromaticContact CE2-CD2 3.67Å; F256-H293 AromaticContact CE2-NE2 3.77Å; F256-H293 AromaticContact CG-CD2 3.42Å; F256-H293 VanDerWaalsContact CG-CD2 3.42Å; F256-H293 WeakPolarHBondContact CG-CD2 3.29Å; F256-H293 AromaticContact CG-NE2 3.54Å; F256-H293 AromaticContact CZ-CD2 3.69Å; F256-H293 AromaticContact CZ-NE2 3.27Å; F256-H293 VanDerWaalsContact CZ-NE2 3.27Å; F256-H293 WeakPolarHBondContact CZ-NE2 3.35Å
257	G	91	Very high	94.1	Very high	9 Å²	9	44.6 Å²	44.6	9%	0.093	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	-156.4	-175	0	0	0	0	0	112.9	P232 G233 Q292	P232-G257 CarbonylContact O-C 3.41Å; P232-G257 WeakPolarHBondContact O-CA 3.48Å; G233-G257 VanDerWaalsContact CA-CA 3.5Å; G257-Q292 CarbonylContact C-O 3.5Å; G257-Q292 PolarHBondContact N-O 2.84Å; G257-Q292 WeakPolarHBondContact O-CB 3.41Å
258	S	91.8	Very high	94.6	Very high	24 Å²	24	35.6 Å²	35.6	17%	0.168	18%	0.182	C	C	.	.			trans	-83.6	146.3	-177.6	-170.6	0	0	0	0	111.8	P232 Y260	P232-S258 PolarHBondContact O-N 2.82Å; S258-Y260 PolarHBondContact O-N 2.7Å; S258-Y260 WeakPolarHBondContact OG-CB 3.37Å; S258-Y260 WeakPolarHBondContact OG-CD2 3.48Å; S258-Y260 PolarHBondContact OG-N 3.21Å; S258-Y260 PolarHBondContact OG-O 3.25Å
259	A	94.2	Very high	94.9	Very high	17 Å²	17	38.3 Å²	38.3	14%	0.14	19%	0.193	C	C	.	.	S	Bend	trans	-70.3	-12.9	164	0	0	0	0	0	112.4	N203 E291	N203-A259 PolarHBondContact ND2-O 2.96Å; A259-E291 WeakPolarHBondContact CA-O 3.34Å; A259-E291 HydrophobicContact CB-CB 4.12Å; A259-E291 HydrophobicContact CB-CG 3.57Å
260	Y	96.8	Very high	95.1	Very high	27 Å²	27	37.9 Å²	37.9	11%	0.106	19%	0.188	C	C	.	.			trans	-101.3	132.9	-176.5	-52.4	-71.7	0	0	0	111.5	N203 S258 R318 I320	N203-Y260 VanDerWaalsContact OD1-CA 3.29Å; N203-Y260 WeakPolarHBondContact OD1-CA 3.33Å; S258-Y260 PolarHBondContact O-N 2.7Å; S258-Y260 WeakPolarHBondContact OG-CB 3.37Å; S258-Y260 WeakPolarHBondContact OG-CD2 3.48Å; S258-Y260 PolarHBondContact OG-N 3.21Å; S258-Y260 PolarHBondContact OG-O 3.25Å; Y260-R318 HydrophobicContact CD2-CB 3.96Å; Y260-R318 HydrophobicContact CD2-CG 4.06Å; Y260-R318 HydrophobicContact CE2-CG 4.14Å; Y260-R318 HydrophobicContact CG-CB 4.27Å; Y260-R318 HydrophobicContact CG-CG 4.42Å; Y260-I320 HydrophobicContact CD2-CD1 4.23Å; Y260-I320 HydrophobicContact CE2-CD1 3.76Å
261	Y	98	Very high	95.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.			trans	-144.4	167.5	-173.8	54.5	-105.5	0	0	0	112.9	D184 M188 V201 N203 I230 L263 W295	D184-Y261 WeakPolarHBondContact CB-OH 3.37Å; D184-Y261 WeakPolarHBondContact OD2-CE1 3.09Å; D184-Y261 PolarHBondContact OD2-OH 3.13Å; M188-Y261 HydrophobicContact CE-CE2 3.78Å; M188-Y261 WeakPolarHBondContact CE-OH 3.41Å; V201-Y261 HydrophobicContact CG1-CE2 4.3Å; N203-Y261 HydrophobicContact CB-CD2 4.47Å; N203-Y261 HydrophobicContact CB-CE1 3.97Å; N203-Y261 HydrophobicContact CB-CE2 3.81Å; N203-Y261 WeakPolarHBondContact CB-OH 3.45Å; N203-Y261 VanDerWaalsContact CG-CE1 3.4Å; N203-Y261 VanDerWaalsContact CG-CZ 3.5Å; N203-Y261 WeakPolarHBondContact ND2-CE1 3.14Å; N203-Y261 PolarHBondContact OD1-N 3.41Å; I230-Y261 VanDerWaalsContact O-CA 3.29Å; I230-Y261 WeakPolarHBondContact O-CA 3.3Å; I230-Y261 WeakPolarHBondContact O-CB 3.4Å; Y261-L263 HydrophobicContact CD1-CD1 4.44Å; Y261-L263 HydrophobicContact CD2-CB 4.34Å; Y261-L263 HydrophobicContact CD2-CD1 3.52Å; Y261-L263 HydrophobicContact CD2-CD2 4.4Å; Y261-L263 HydrophobicContact CD2-CG 3.43Å; Y261-L263 VanDerWaalsContact CD2-CG 3.43Å; Y261-L263 HydrophobicContact CE2-CD1 3.65Å; Y261-L263 HydrophobicContact CE2-CG 4.01Å; Y261-L263 HydrophobicContact CG-CD1 3.92Å; Y261-L263 HydrophobicContact CG-CD2 4.43Å; Y261-L263 HydrophobicContact CG-CG 3.89Å; Y261-W295 HydrophobicContact CD1-CB 4.32Å; Y261-W295 AromaticContact CD1-CD1 3.52Å; Y261-W295 AromaticContact CD1-CD2 3.78Å; Y261-W295 HydrophobicContact CD1-CD2 3.78Å; Y261-W295 AromaticContact CD1-CE2 3.77Å; Y261-W295 AromaticContact CD1-CG 3.62Å; Y261-W295 HydrophobicContact CD1-CG 3.62Å; Y261-W295 HydrophobicContact CD1-CZ2 4.48Å; Y261-W295 AromaticContact CD1-NE1 3.6Å; Y261-W295 AromaticContact CE1-CD1 3.81Å; Y261-W295 AromaticContact CE1-CD2 3.65Å; Y261-W295 HydrophobicContact CE1-CD2 3.65Å; Y261-W295 AromaticContact CE1-CE2 3.25Å; Y261-W295 HydrophobicContact CE1-CE3 4.3Å; Y261-W295 AromaticContact CE1-CG 3.98Å; Y261-W295 HydrophobicContact CE1-CG 3.98Å; Y261-W295 HydrophobicContact CE1-CH2 4.24Å; Y261-W295 AromaticContact CE1-CZ2 3.55Å; Y261-W295 HydrophobicContact CE1-CZ2 3.55Å; Y261-W295 AromaticContact CE1-NE1 3.37Å
262	V	98.6	Very high	95.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	116.5	161.1	-176.7	0	0	0	0	107.4	Y200 V201 I202 I221 N229 I230 V317 L358	Y200-V262 HydrophobicContact CD1-CG1 3.78Å; Y200-V262 HydrophobicContact CG-CG1 4.28Å; V201-V262 CarbonylContact O-C 3.49Å; V201-V262 WeakPolarHBondContact O-CA 3.03Å; I202-V262 HydrophobicContact CD1-CG2 4.35Å; I202-V262 HydrophobicContact CG1-CB 4.45Å; I202-V262 HydrophobicContact CG1-CG1 4Å; I202-V262 HydrophobicContact CG1-CG2 4.02Å; I202-V262 HydrophobicContact CG2-CG2 4.37Å; I221-V262 HydrophobicContact CD1-CG1 3.92Å; I221-V262 HydrophobicContact CG1-CG1 4.37Å; N229-V262 CarbonylContact C-O 3.46Å; I230-V262 HydrophobicContact CB-CB 3.92Å; I230-V262 HydrophobicContact CB-CG2 4.4Å; I230-V262 HydrophobicContact CD1-CB 3.9Å; I230-V262 HydrophobicContact CD1-CG1 4.39Å; I230-V262 HydrophobicContact CD1-CG2 4.1Å; I230-V262 HydrophobicContact CG1-CB 3.94Å; I230-V262 PolarHBondContact N-O 3Å; I230-V262 PolarHBondContact O-N 3.14Å; V262-V317 HydrophobicContact CG2-CG1 4.2Å; V262-V317 HydrophobicContact CG2-CG2 4.17Å; V262-L358 HydrophobicContact CG2-CD1 4.21Å
263	L	98.8	Very high	96.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140	-173	-59.3	174.2	0	0	0	111	M188 Y200 V201 N229 T231 Y261 F267 V268 I271 W295	M188-L263 HydrophobicContact CE-CD1 3.76Å; Y200-L263 CarbonylContact C-O 3.5Å; Y200-L263 WeakPolarHBondContact CA-O 3.47Å; V201-L263 HydrophobicContact CG1-CB 3.91Å; V201-L263 PolarHBondContact N-O 2.83Å; V201-L263 PolarHBondContact O-N 2.93Å; N229-L263 HydrophobicContact CB-CD2 3.88Å; T231-L263 HydrophobicContact CG2-CD2 3.59Å; Y261-L263 HydrophobicContact CD1-CD1 4.44Å; Y261-L263 HydrophobicContact CD2-CB 4.34Å; Y261-L263 HydrophobicContact CD2-CD1 3.52Å; Y261-L263 HydrophobicContact CD2-CD2 4.4Å; Y261-L263 HydrophobicContact CD2-CG 3.43Å; Y261-L263 VanDerWaalsContact CD2-CG 3.43Å; Y261-L263 HydrophobicContact CE2-CD1 3.65Å; Y261-L263 HydrophobicContact CE2-CG 4.01Å; Y261-L263 HydrophobicContact CG-CD1 3.92Å; Y261-L263 HydrophobicContact CG-CD2 4.43Å; Y261-L263 HydrophobicContact CG-CG 3.89Å; L263-F267 HydrophobicContact CB-CD1 4.13Å; L263-F267 HydrophobicContact CD1-CD1 3.94Å; L263-F267 HydrophobicContact CD1-CE1 4.08Å; L263-F267 HydrophobicContact CD2-CD1 3.64Å; L263-F267 HydrophobicContact CD2-CE1 3.71Å; L263-F267 HydrophobicContact CG-CD1 4.08Å; L263-F267 HydrophobicContact CG-CE1 4.41Å; L263-V268 HydrophobicContact CB-CG2 4.24Å; L263-I271 HydrophobicContact CD1-CD1 3.96Å; L263-W295 HydrophobicContact CD1-CE3 4.08Å; L263-W295 HydrophobicContact CD1-CZ3 4.46Å
264	T	98.8	Very high	96.4	Very high	10 Å²	10	29.4 Å²	29.4	6%	0.061	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	150.4	171.2	63.4	0	0	0	0	110.2	Y200 N229 K266 F267 V268	Y200-T264 HydrophobicContact CD1-CG2 4.09Å; Y200-T264 HydrophobicContact CE1-CG2 3.46Å; Y200-T264 VanDerWaalsContact CE1-CG2 3.46Å; N229-T264 WeakPolarHBondContact OD1-CB 2.88Å; N229-T264 WeakPolarHBondContact OD1-CG2 3.43Å; N229-T264 PolarHBondContact OD1-N 3.41Å; N229-T264 PolarHBondContact OD1-OG1 3.01Å; T264-K266 VanDerWaalsContact C-N 3.28Å; T264-K266 PolarHBondContact O-N 2.82Å; T264-F267 WeakPolarHBondContact O-CB 3.41Å; T264-F267 PolarHBondContact O-N 3.41Å; T264-F267 VanDerWaalsContact O-N 3.1Å; T264-F267 VanDerWaalsContact OG1-CB 3.3Å; T264-F267 WeakPolarHBondContact OG1-CB 3.23Å; T264-F267 PolarHBondContact OG1-N 2.71Å; T264-V268 PolarHBondContact O-N 3.46Å; T264-V268 VanDerWaalsContact O-N 3.11Å
265	R	98.6	Very high	96.8	Very high	56 Å²	56	34 Å²	34	21%	0.211	17%	0.17	C	C	.	.	H	α-helix	trans	-56.7	-41	174.9	-179.2	170.3	171.7	-156	10.5	113.2	W198 N199 F267 V268 E269	W198-R265 HydrophobicContact CD2-CB 4.44Å; W198-R265 HydrophobicContact CD2-CG 4.42Å; W198-R265 HydrophobicContact CE3-CB 3.84Å; W198-R265 HydrophobicContact CE3-CG 4.25Å; W198-R265 HydrophobicContact CH2-CB 3.77Å; W198-R265 HydrophobicContact CH2-CG 3.67Å; W198-R265 HydrophobicContact CZ2-CB 4.37Å; W198-R265 HydrophobicContact CZ2-CG 3.85Å; W198-R265 VanDerWaalsContact CZ3-CA 3.43Å; W198-R265 HydrophobicContact CZ3-CB 3.47Å; W198-R265 VanDerWaalsContact CZ3-CB 3.47Å; W198-R265 HydrophobicContact CZ3-CG 3.89Å; W198-R265 VanDerWaalsContact O-CD 3.25Å; W198-R265 WeakPolarHBondContact O-CD 3.38Å; N199-R265 PolarHBondContact O-N 3.14Å; R265-F267 VanDerWaalsContact C-N 3.27Å; R265-F267 PolarHBondContact O-N 2.89Å; R265-V268 WeakPolarHBondContact O-CB 3.33Å; R265-V268 PolarHBondContact O-N 3.29Å; R265-V268 VanDerWaalsContact O-N 3.08Å; R265-E269 IonicContact CZ-OE1 3.43Å; R265-E269 IonicContact NE-OE1 3.02Å; R265-E269 PolarHBondContact NE-OE1 3.43Å; R265-E269 PolarHBondContact O-N 3.09Å
266	K	98.6	Very high	97.1	Very high	138 Å²	138	34.7 Å²	34.7	60%	0.6	17%	0.173	S	C	*	.	H	α-helix	trans	-60.3	-37.7	177.1	-66.5	179.1	-180	171.2	0	111.9	T264 E269 F270 P305	T264-K266 VanDerWaalsContact C-N 3.28Å; T264-K266 PolarHBondContact O-N 2.82Å; K266-E269 PolarHBondContact O-N 3.08Å; K266-F270 PolarHBondContact O-N 3.02Å; K266-P305 HydrophobicContact CB-CB 3.61Å; K266-P305 HydrophobicContact CB-CG 4.22Å
267	F	98.8	Very high	97.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.3	-35	175.6	-171	-105.9	0	0	0	112.2	N229 L263 T264 R265 F270 I271 L298 N299 A304 P305	N229-F267 WeakPolarHBondContact ND2-CD2 3.21Å; N229-F267 WeakPolarHBondContact ND2-CG 3.5Å; N229-F267 WeakPolarHBondContact OD1-CB 3.2Å; L263-F267 HydrophobicContact CB-CD1 4.13Å; L263-F267 HydrophobicContact CD1-CD1 3.94Å; L263-F267 HydrophobicContact CD1-CE1 4.08Å; L263-F267 HydrophobicContact CD2-CD1 3.64Å; L263-F267 HydrophobicContact CD2-CE1 3.71Å; L263-F267 HydrophobicContact CG-CD1 4.08Å; L263-F267 HydrophobicContact CG-CE1 4.41Å; T264-F267 WeakPolarHBondContact O-CB 3.41Å; T264-F267 PolarHBondContact O-N 3.41Å; T264-F267 VanDerWaalsContact O-N 3.1Å; T264-F267 VanDerWaalsContact OG1-CB 3.3Å; T264-F267 WeakPolarHBondContact OG1-CB 3.23Å; T264-F267 PolarHBondContact OG1-N 2.71Å; R265-F267 VanDerWaalsContact C-N 3.27Å; R265-F267 PolarHBondContact O-N 2.89Å; F267-F270 HydrophobicContact CD2-CD1 4.12Å; F267-F270 HydrophobicContact CE2-CD1 4.05Å; F267-F270 HydrophobicContact CE2-CE1 4.29Å; F267-F270 WeakPolarHBondContact O-CB 3.34Å; F267-F270 PolarHBondContact O-N 2.83Å; F267-I271 HydrophobicContact CD1-CD1 3.45Å; F267-I271 VanDerWaalsContact CD1-CD1 3.45Å; F267-I271 HydrophobicContact CD1-CG1 4.13Å; F267-I271 HydrophobicContact CE1-CD1 3.39Å; F267-I271 HydrophobicContact CE1-CG1 3.95Å; F267-I271 HydrophobicContact CG-CD1 4.42Å; F267-I271 HydrophobicContact CZ-CD1 4.32Å; F267-I271 HydrophobicContact CZ-CG1 4.43Å; F267-I271 WeakPolarHBondContact O-CG1 3.19Å; F267-I271 PolarHBondContact O-N 2.86Å; F267-L298 HydrophobicContact CE2-CB 4.47Å; F267-L298 HydrophobicContact CZ-CB 3.84Å; F267-N299 HydrophobicContact CE2-CB 4.35Å; F267-N299 HydrophobicContact CZ-CB 3.93Å; F267-A304 HydrophobicContact CD2-CB 4.07Å; F267-A304 HydrophobicContact CE2-CB 3.75Å; F267-P305 WeakPolarHBondContact CB-O 3.44Å; F267-P305 WeakPolarHBondContact CD2-O 3.27Å
268	V	98.8	Very high	97.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.5	-44	172.2	176.1	0	0	0	0	111.2	M188 V192 W198 V201 L263 T264 R265 F270 I271 L272	M188-V268 HydrophobicContact CB-CG1 3.61Å; M188-V268 HydrophobicContact CE-CG2 4.24Å; M188-V268 HydrophobicContact CG-CG1 3.67Å; M188-V268 HydrophobicContact CG-CG2 4.39Å; M188-V268 HydrophobicContact SD-CG1 3.95Å; M188-V268 HydrophobicContact SD-CG2 4.23Å; V192-V268 HydrophobicContact CG1-CG1 3.74Å; W198-V268 HydrophobicContact CH2-CB 3.96Å; W198-V268 HydrophobicContact CH2-CG1 4.17Å; W198-V268 HydrophobicContact CH2-CG2 3.87Å; W198-V268 HydrophobicContact CZ3-CG2 4.38Å; V201-V268 HydrophobicContact CG1-CG2 3.54Å; L263-V268 HydrophobicContact CB-CG2 4.24Å; T264-V268 PolarHBondContact O-N 3.46Å; T264-V268 VanDerWaalsContact O-N 3.11Å; R265-V268 WeakPolarHBondContact O-CB 3.33Å; R265-V268 PolarHBondContact O-N 3.29Å; R265-V268 VanDerWaalsContact O-N 3.08Å; V268-F270 VanDerWaalsContact C-N 3.31Å; V268-F270 PolarHBondContact O-N 2.79Å; V268-I271 WeakPolarHBondContact O-CB 3.39Å; V268-I271 PolarHBondContact O-N 3.36Å; V268-L272 HydrophobicContact CG1-CD1 4.2Å; V268-L272 VanDerWaalsContact O-CG 3.3Å; V268-L272 WeakPolarHBondContact O-CG 3.12Å; V268-L272 PolarHBondContact O-N 3.04Å
269	E	98.6	Very high	98.2	Very high	76 Å²	76	38.4 Å²	38.4	36%	0.355	19%	0.186	S	C	.	.	H	α-helix	trans	-59.9	-42.5	174.3	-70.7	167.2	180	0	0	111.5	V192 R265 K266 L272 T273	V192-E269 HydrophobicContact CG1-CG 4.13Å; R265-E269 IonicContact CZ-OE1 3.43Å; R265-E269 IonicContact NE-OE1 3.02Å; R265-E269 PolarHBondContact NE-OE1 3.43Å; R265-E269 PolarHBondContact O-N 3.09Å; K266-E269 PolarHBondContact O-N 3.08Å; E269-L272 PolarHBondContact O-N 3.31Å; E269-T273 WeakPolarHBondContact O-CB 3.5Å; E269-T273 WeakPolarHBondContact O-CG2 3.44Å; E269-T273 PolarHBondContact O-N 3.07Å; E269-T273 PolarHBondContact O-OG1 3.17Å
270	F	98.7	Very high	98.3	Very high	18 Å²	18	37.6 Å²	37.6	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-57.1	-50.1	171.9	168.2	-92.4	0	0	0	112.1	K266 F267 V268 L272 T273 D274 A277 L301 A304 P305	K266-F270 PolarHBondContact O-N 3.02Å; F267-F270 HydrophobicContact CD2-CD1 4.12Å; F267-F270 HydrophobicContact CE2-CD1 4.05Å; F267-F270 HydrophobicContact CE2-CE1 4.29Å; F267-F270 WeakPolarHBondContact O-CB 3.34Å; F267-F270 PolarHBondContact O-N 2.83Å; V268-F270 VanDerWaalsContact C-N 3.31Å; V268-F270 PolarHBondContact O-N 2.79Å; F270-L272 PolarHBondContact O-N 2.96Å; F270-T273 PolarHBondContact O-N 2.66Å; F270-T273 VanDerWaalsContact O-N 3.11Å; F270-D274 HydrophobicContact CD2-CB 3.64Å; F270-D274 HydrophobicContact CE1-CB 4.48Å; F270-D274 HydrophobicContact CE2-CB 3.5Å; F270-D274 WeakPolarHBondContact CE2-OD2 3.21Å; F270-D274 HydrophobicContact CG-CB 4.22Å; F270-D274 HydrophobicContact CZ-CB 3.94Å; F270-D274 VanDerWaalsContact O-CB 3.31Å; F270-D274 WeakPolarHBondContact O-CB 3.36Å; F270-D274 PolarHBondContact O-N 2.85Å; F270-A277 HydrophobicContact CE1-CB 4.4Å; F270-L301 HydrophobicContact CE1-CD1 4.41Å; F270-L301 HydrophobicContact CZ-CD1 3.9Å; F270-A304 HydrophobicContact CD1-CB 4.23Å; F270-A304 HydrophobicContact CE1-CB 3.89Å; F270-A304 HydrophobicContact CE2-CB 4.23Å; F270-A304 HydrophobicContact CZ-CB 3.89Å; F270-P305 HydrophobicContact CB-CG 4.01Å
271	I	98.4	Very high	98.3	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-53.9	-38.6	177.1	-76.3	159.3	0	0	0	111.6	I185 M188 L263 F267 V268 A277 Y294 W295 L298	I185-I271 HydrophobicContact CD1-CG2 3.44Å; I185-I271 VanDerWaalsContact CD1-CG2 3.44Å; M188-I271 HydrophobicContact SD-CD1 4.33Å; M188-I271 HydrophobicContact SD-CG2 4.39Å; L263-I271 HydrophobicContact CD1-CD1 3.96Å; F267-I271 HydrophobicContact CD1-CD1 3.45Å; F267-I271 VanDerWaalsContact CD1-CD1 3.45Å; F267-I271 HydrophobicContact CD1-CG1 4.13Å; F267-I271 HydrophobicContact CE1-CD1 3.39Å; F267-I271 HydrophobicContact CE1-CG1 3.95Å; F267-I271 HydrophobicContact CG-CD1 4.42Å; F267-I271 HydrophobicContact CZ-CD1 4.32Å; F267-I271 HydrophobicContact CZ-CG1 4.43Å; F267-I271 WeakPolarHBondContact O-CG1 3.19Å; F267-I271 PolarHBondContact O-N 2.86Å; V268-I271 WeakPolarHBondContact O-CB 3.39Å; V268-I271 PolarHBondContact O-N 3.36Å; I271-A277 WeakPolarHBondContact O-CB 3.23Å; I271-Y294 HydrophobicContact CG2-CE1 4.2Å; I271-W295 HydrophobicContact CD1-CE3 4.05Å; I271-W295 HydrophobicContact CD1-CZ3 3.84Å; I271-L298 HydrophobicContact CG1-CD1 4.24Å
272	L	98.5	Very high	98.2	Very high	30 Å²	30	42.6 Å²	42.6	16%	0.157	21%	0.205	C	C	.	.	H	α-helix	trans	-83.2	-17.9	-176	-64.9	178.6	0	0	0	113.8	I185 M188 K189 V192 V268 E269 F270 K278	I185-L272 HydrophobicContact CG2-CD2 4.17Å; M188-L272 HydrophobicContact CB-CD1 4.42Å; M188-L272 HydrophobicContact CB-CD2 4.4Å; K189-L272 HydrophobicContact CG-CD1 4.18Å; K189-L272 HydrophobicContact CG-CD2 3.56Å; K189-L272 HydrophobicContact CG-CG 4.49Å; V192-L272 HydrophobicContact CB-CD1 4.45Å; V192-L272 HydrophobicContact CG1-CD1 3.92Å; V192-L272 HydrophobicContact CG2-CD1 3.67Å; V268-L272 HydrophobicContact CG1-CD1 4.2Å; V268-L272 VanDerWaalsContact O-CG 3.3Å; V268-L272 WeakPolarHBondContact O-CG 3.12Å; V268-L272 PolarHBondContact O-N 3.04Å; E269-L272 PolarHBondContact O-N 3.31Å; F270-L272 PolarHBondContact O-N 2.96Å; L272-K278 WeakPolarHBondContact O-CE 3.32Å; L272-K278 PolarHBondContact O-NZ 3.34Å
273	T	98.4	Very high	98	Very high	93 Å²	93	44.2 Å²	44.2	57%	0.571	21%	0.211	S	C	*	.	H	α-helix	trans	-118.2	-40.8	-169.2	57	0	0	0	0	113.7	E269 F270 K278	E269-T273 WeakPolarHBondContact O-CB 3.5Å; E269-T273 WeakPolarHBondContact O-CG2 3.44Å; E269-T273 PolarHBondContact O-N 3.07Å; E269-T273 PolarHBondContact O-OG1 3.17Å; F270-T273 PolarHBondContact O-N 2.66Å; F270-T273 VanDerWaalsContact O-N 3.11Å; T273-K278 WeakPolarHBondContact O-CE 3.29Å; T273-K278 PolarHBondContact O-NZ 2.83Å
274	D	98.6	Very high	97.7	Very high	33 Å²	33	44.2 Å²	44.2	18%	0.176	21%	0.211	C	C	.	.			trans	-66.6	137.4	-175.6	-168.9	-71.5	0	0	0	111.7	F270 R276 A277 K278	F270-D274 HydrophobicContact CD2-CB 3.64Å; F270-D274 HydrophobicContact CE1-CB 4.48Å; F270-D274 HydrophobicContact CE2-CB 3.5Å; F270-D274 WeakPolarHBondContact CE2-OD2 3.21Å; F270-D274 HydrophobicContact CG-CB 4.22Å; F270-D274 HydrophobicContact CZ-CB 3.94Å; F270-D274 VanDerWaalsContact O-CB 3.31Å; F270-D274 WeakPolarHBondContact O-CB 3.36Å; F270-D274 PolarHBondContact O-N 2.85Å; D274-R276 VanDerWaalsContact C-N 3.31Å; D274-R276 PolarHBondContact O-N 3.11Å; D274-R276 WeakPolarHBondContact OD1-CA 3.38Å; D274-R276 VanDerWaalsContact OD1-CB 3.22Å; D274-R276 WeakPolarHBondContact OD1-CB 3.2Å; D274-R276 WeakPolarHBondContact OD1-CG 3.34Å; D274-R276 IonicContact OD1-CZ 3.95Å; D274-R276 PolarHBondContact OD1-N 3.22Å; D274-R276 IonicContact OD1-NE 3.11Å; D274-R276 PolarHBondContact OD1-NE 3.35Å; D274-R276 IonicContact OD1-NH2 2.9Å; D274-R276 IonicContact OD2-CZ 3.48Å; D274-R276 IonicContact OD2-NE 3.01Å; D274-R276 PolarHBondContact OD2-NE 3.3Å; D274-R276 IonicContact OD2-NH2 2.73Å; D274-R276 PolarHBondContact OD2-NH2 3.19Å; D274-A277 HydrophobicContact CB-CB 4.39Å; D274-A277 PolarHBondContact O-N 2.97Å; D274-K278 WeakPolarHBondContact O-CG 2.97Å; D274-K278 PolarHBondContact O-N 2.96Å; D274-K278 VanDerWaalsContact O-N 3.1Å
275	I	98.3	Very high	97.4	Very high	97 Å²	97	48.2 Å²	48.2	50%	0.497	23%	0.227	S	C	.	.	H	α-helix	trans	-65	-34.8	-177.3	-170.8	58.1	0	0	0	112.1	K278 D279	I275-K278 PolarHBondContact O-N 3.08Å; I275-D279 WeakPolarHBondContact O-CB 3.26Å; I275-D279 VanDerWaalsContact O-CG 3.23Å; I275-D279 PolarHBondContact O-N 3.14Å
276	R	98.1	Very high	96.8	Very high	47 Å²	47	52.4 Å²	52.4	18%	0.177	25%	0.254	C	S	.	.	H	α-helix	trans	-66.6	-41.9	179.1	-59.2	168.2	-70.9	-178.3	-9.4	111	H250 D274 M280 D303	H250-R276 HydrophobicContact CB-CG 4.13Å; D274-R276 VanDerWaalsContact C-N 3.31Å; D274-R276 PolarHBondContact O-N 3.11Å; D274-R276 WeakPolarHBondContact OD1-CA 3.38Å; D274-R276 VanDerWaalsContact OD1-CB 3.22Å; D274-R276 WeakPolarHBondContact OD1-CB 3.2Å; D274-R276 WeakPolarHBondContact OD1-CG 3.34Å; D274-R276 IonicContact OD1-CZ 3.95Å; D274-R276 PolarHBondContact OD1-N 3.22Å; D274-R276 IonicContact OD1-NE 3.11Å; D274-R276 PolarHBondContact OD1-NE 3.35Å; D274-R276 IonicContact OD1-NH2 2.9Å; D274-R276 IonicContact OD2-CZ 3.48Å; D274-R276 IonicContact OD2-NE 3.01Å; D274-R276 PolarHBondContact OD2-NE 3.3Å; D274-R276 IonicContact OD2-NH2 2.73Å; D274-R276 PolarHBondContact OD2-NH2 3.19Å; R276-M280 WeakPolarHBondContact O-CB 3.39Å; R276-M280 PolarHBondContact O-N 3.1Å; R276-D303 IonicContact CZ-OD1 3.49Å; R276-D303 IonicContact CZ-OD2 2.9Å; R276-D303 VanDerWaalsContact CZ-OD2 3.22Å; R276-D303 VanDerWaalsContact NH1-CG 3.29Å; R276-D303 IonicContact NH1-OD1 2.85Å; R276-D303 PolarHBondContact NH1-OD1 3.39Å; R276-D303 IonicContact NH1-OD2 3.8Å; R276-D303 PolarHBondContact NH1-OD2 2.77Å; R276-D303 IonicContact NH2-OD1 3.61Å; R276-D303 IonicContact NH2-OD2 3.85Å; R276-D303 PolarHBondContact NH2-OD2 2.77Å
277	A	98.3	Very high	96.3	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.2	-46.4	176.2	0	0	0	0	0	111.4	F270 I271 D274 M280 L281 Y294 L298	F270-A277 HydrophobicContact CE1-CB 4.4Å; I271-A277 WeakPolarHBondContact O-CB 3.23Å; D274-A277 HydrophobicContact CB-CB 4.39Å; D274-A277 PolarHBondContact O-N 2.97Å; A277-M280 PolarHBondContact O-N 3.4Å; A277-L281 WeakPolarHBondContact O-CB 3.36Å; A277-L281 PolarHBondContact O-N 3.09Å; A277-Y294 PolarHBondContact O-OH 2.94Å; A277-L298 HydrophobicContact CB-CD1 3.74Å; A277-L298 HydrophobicContact CB-CD2 4.2Å
278	K	98.2	Very high	95.7	Very high	100 Å²	100	57.6 Å²	57.6	44%	0.435	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-46.5	177.7	-72.6	170.9	177.8	164.9	0	112.8	L272 T273 D274 I275 L281 Q282	L272-K278 WeakPolarHBondContact O-CE 3.32Å; L272-K278 PolarHBondContact O-NZ 3.34Å; T273-K278 WeakPolarHBondContact O-CE 3.29Å; T273-K278 PolarHBondContact O-NZ 2.83Å; D274-K278 WeakPolarHBondContact O-CG 2.97Å; D274-K278 PolarHBondContact O-N 2.96Å; D274-K278 VanDerWaalsContact O-N 3.1Å; I275-K278 PolarHBondContact O-N 3.08Å; K278-L281 WeakPolarHBondContact O-CB 3.06Å; K278-L281 PolarHBondContact O-N 3.05Å; K278-Q282 PolarHBondContact O-N 3.46Å
279	D	97.8	Very high	95.2	Very high	60 Å²	60	58.5 Å²	58.5	32%	0.321	28%	0.277	S	S	.	.	H	α-helix	trans	-68.1	-38.1	179.4	-69.8	-13.9	0	0	0	111.1	P249 H250 I275 L281 Q282 W283	P249-D279 HydrophobicContact CB-CB 4.01Å; P249-D279 HydrophobicContact CG-CB 4.19Å; H250-D279 IonicContact CD2-OD2 2.98Å; H250-D279 IonicContact CE1-OD2 2.73Å; H250-D279 PolarHBondContact CE1-OD2 3Å; H250-D279 IonicContact NE2-OD2 3.83Å; H250-D279 PolarHBondContact NE2-OD2 3.39Å; I275-D279 WeakPolarHBondContact O-CB 3.26Å; I275-D279 VanDerWaalsContact O-CG 3.23Å; I275-D279 PolarHBondContact O-N 3.14Å; D279-L281 VanDerWaalsContact C-N 3.32Å; D279-L281 PolarHBondContact O-N 3.26Å; D279-Q282 PolarHBondContact O-N 3.41Å; D279-W283 WeakPolarHBondContact O-CB 3.45Å; D279-W283 PolarHBondContact O-N 2.8Å
280	M	96.4	Very high	94.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-39.4	173.1	-172.6	-177.8	179.1	0	0	111.5	P249 L252 I254 R276 A277 Q282 W283 S284 Y294 T297 L298	P249-M280 HydrophobicContact CG-CB 4.34Å; L252-M280 HydrophobicContact CD1-CB 4.05Å; L252-M280 HydrophobicContact CD1-CG 4.24Å; L252-M280 HydrophobicContact CD1-SD 4.1Å; I254-M280 HydrophobicContact CD1-CE 4.01Å; R276-M280 WeakPolarHBondContact O-CB 3.39Å; R276-M280 PolarHBondContact O-N 3.1Å; A277-M280 PolarHBondContact O-N 3.4Å; M280-Q282 VanDerWaalsContact C-N 3.34Å; M280-W283 PolarHBondContact O-N 2.77Å; M280-S284 VanDerWaalsContact O-CB 3.26Å; M280-S284 WeakPolarHBondContact O-CB 3.4Å; M280-S284 PolarHBondContact O-N 3.49Å; M280-S284 PolarHBondContact O-OG 2.94Å; M280-Y294 HydrophobicContact CB-CD2 4.47Å; M280-Y294 HydrophobicContact CB-CE2 4.16Å; M280-Y294 HydrophobicContact CE-CD2 4.27Å; M280-Y294 HydrophobicContact CG-CD2 3.96Å; M280-Y294 HydrophobicContact CG-CE2 4.14Å; M280-Y294 HydrophobicContact SD-CD2 4.01Å; M280-Y294 HydrophobicContact SD-CE2 4.4Å; M280-T297 HydrophobicContact CE-CG2 3.63Å; M280-T297 HydrophobicContact SD-CG2 3.77Å; M280-L298 HydrophobicContact SD-CD2 3.79Å; M280-L298 HydrophobicContact SD-CG 3.81Å
281	L	96.9	Very high	94.6	Very high	24 Å²	24	54.4 Å²	54.4	13%	0.126	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-43.3	177.2	-178.3	64.8	0	0	0	110.1	F178 L181 I185 A277 K278 D279 S284 Y294	F178-L281 HydrophobicContact CE2-CD1 3.71Å; F178-L281 HydrophobicContact CE2-CG 4.13Å; F178-L281 VanDerWaalsContact CE2-O 3.26Å; F178-L281 WeakPolarHBondContact CE2-O 3.48Å; F178-L281 HydrophobicContact CZ-CD1 4.22Å; F178-L281 HydrophobicContact CZ-CG 4.37Å; L181-L281 HydrophobicContact CD1-CD1 4.43Å; L181-L281 HydrophobicContact CD2-CD1 3.64Å; L181-L281 HydrophobicContact CG-CD1 3.78Å; I185-L281 HydrophobicContact CG1-CD1 4.21Å; I185-L281 HydrophobicContact CG1-CD2 4.19Å; I185-L281 HydrophobicContact CG2-CD2 4.12Å; A277-L281 WeakPolarHBondContact O-CB 3.36Å; A277-L281 PolarHBondContact O-N 3.09Å; K278-L281 WeakPolarHBondContact O-CB 3.06Å; K278-L281 PolarHBondContact O-N 3.05Å; D279-L281 VanDerWaalsContact C-N 3.32Å; D279-L281 PolarHBondContact O-N 3.26Å; L281-S284 WeakPolarHBondContact O-CB 3.43Å; L281-S284 PolarHBondContact O-N 2.86Å; L281-Y294 HydrophobicContact CB-CE2 3.67Å; L281-Y294 HydrophobicContact CD1-CE2 4.12Å; L281-Y294 HydrophobicContact CG-CE2 4.5Å
282	Q	95.9	Very high	94.3	Very high	109 Å²	109	58 Å²	58	51%	0.509	28%	0.275	S	S	.	.	H	α-helix	trans	-62.9	-45.2	176.4	-179.7	61.1	27.7	0	0	112	K278 D279 M280 S284 K285	K278-Q282 PolarHBondContact O-N 3.46Å; D279-Q282 PolarHBondContact O-N 3.41Å; M280-Q282 VanDerWaalsContact C-N 3.34Å; Q282-S284 VanDerWaalsContact C-N 3.25Å; Q282-S284 PolarHBondContact O-N 3.06Å; Q282-K285 WeakPolarHBondContact O-CB 3.37Å; Q282-K285 WeakPolarHBondContact O-CG 3.33Å; Q282-K285 PolarHBondContact O-N 2.03Å
283	W	94.6	Very high	93.9	Very high	33 Å²	33	57 Å²	57	13%	0.125	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-35	175.4	174.7	86.6	0	0	0	112.1	F244 D246 K247 P248 P249 I254 D279 M280 K285 I287	F244-W283 HydrophobicContact CB-CZ2 3.91Å; F244-W283 AromaticContact CD1-CH2 3.93Å; F244-W283 HydrophobicContact CD1-CH2 3.93Å; F244-W283 HydrophobicContact CD1-CZ2 4.05Å; F244-W283 HydrophobicContact CD2-CH2 4.03Å; F244-W283 HydrophobicContact CD2-CZ2 4.06Å; F244-W283 HydrophobicContact CE1-CH2 4.05Å; F244-W283 HydrophobicContact CE2-CH2 4.16Å; F244-W283 AromaticContact CG-CH2 3.92Å; F244-W283 HydrophobicContact CG-CH2 3.92Å; F244-W283 AromaticContact CG-CZ2 3.74Å; F244-W283 HydrophobicContact CG-CZ2 3.74Å; F244-W283 HydrophobicContact CZ-CH2 4.16Å; D246-W283 PolarHBondContact O-NE1 2.86Å; K247-W283 PolarHBondContact O-NE1 3.44Å; P248-W283 HydrophobicContact CB-CZ2 4.5Å; P248-W283 HydrophobicContact CG-CH2 4.37Å; P248-W283 HydrophobicContact CG-CZ2 4.03Å; P249-W283 HydrophobicContact CG-CB 4.13Å; P249-W283 HydrophobicContact CG-CG 4.47Å; I254-W283 HydrophobicContact CD1-CH2 3.97Å; I254-W283 HydrophobicContact CD1-CZ3 3.92Å; I254-W283 HydrophobicContact CG1-CH2 4.02Å; I254-W283 HydrophobicContact CG1-CZ3 4.43Å; D279-W283 WeakPolarHBondContact O-CB 3.45Å; D279-W283 PolarHBondContact O-N 2.8Å; M280-W283 PolarHBondContact O-N 2.77Å; W283-K285 PolarHBondContact O-N 3.44Å; W283-K285 VanDerWaalsContact O-N 3.11Å; W283-I287 HydrophobicContact CD2-CD1 4.42Å; W283-I287 HydrophobicContact CD2-CG1 4.25Å; W283-I287 HydrophobicContact CE3-CD1 4.43Å; W283-I287 HydrophobicContact CE3-CG1 3.92Å; W283-I287 HydrophobicContact CH2-CD1 3.65Å; W283-I287 HydrophobicContact CH2-CG1 3.82Å; W283-I287 HydrophobicContact CZ2-CD1 3.62Å; W283-I287 HydrophobicContact CZ2-CG1 4.16Å; W283-I287 HydrophobicContact CZ3-CD1 4.08Å; W283-I287 HydrophobicContact CZ3-CG1 3.7Å
284	S	93.6	Very high	93.8	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.007	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-67.8	-8.8	-178.4	-67.6	0	0	0	0	114.8	M280 L281 Q282 D286 I287	M280-S284 VanDerWaalsContact O-CB 3.26Å; M280-S284 WeakPolarHBondContact O-CB 3.4Å; M280-S284 PolarHBondContact O-N 3.49Å; M280-S284 PolarHBondContact O-OG 2.94Å; L281-S284 WeakPolarHBondContact O-CB 3.43Å; L281-S284 PolarHBondContact O-N 2.86Å; Q282-S284 VanDerWaalsContact C-N 3.25Å; Q282-S284 PolarHBondContact O-N 3.06Å; S284-D286 VanDerWaalsContact C-N 3.29Å; S284-D286 PolarHBondContact O-N 3.25Å; S284-I287 PolarHBondContact O-N 3.26Å
285	K	92.1	Very high	93.7	Very high	93 Å²	93	51 Å²	51	40%	0.404	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-60.4	-36.8	-179.8	-76.4	178.7	174	176.6	0	113.6	F178 Q282 W283	F178-K285 HydrophobicContact CD1-CG 4.02Å; F178-K285 HydrophobicContact CD2-CB 4.32Å; F178-K285 HydrophobicContact CD2-CG 3.76Å; F178-K285 HydrophobicContact CE1-CD 4.41Å; F178-K285 HydrophobicContact CE1-CG 3.78Å; F178-K285 HydrophobicContact CE2-CB 4.48Å; F178-K285 HydrophobicContact CE2-CG 3.5Å; F178-K285 HydrophobicContact CG-CB 4.47Å; F178-K285 HydrophobicContact CG-CG 4.01Å; F178-K285 HydrophobicContact CZ-CD 4.24Å; F178-K285 HydrophobicContact CZ-CG 3.52Å; Q282-K285 WeakPolarHBondContact O-CB 3.37Å; Q282-K285 WeakPolarHBondContact O-CG 3.33Å; Q282-K285 PolarHBondContact O-N 2.03Å; W283-K285 PolarHBondContact O-N 3.44Å; W283-K285 VanDerWaalsContact O-N 3.11Å
286	D	86	Confident	93.6	Very high	144 Å²	144	46.5 Å²	46.5	77%	0.77	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-98.9	8.2	-176.8	-61.5	-43.9	0	0	0	112.6	S284	S284-D286 VanDerWaalsContact C-N 3.29Å; S284-D286 PolarHBondContact O-N 3.25Å
287	I	87.6	Confident	93.4	Very high	25 Å²	25	44.4 Å²	44.4	13%	0.128	20%	0.204	C	C	.	.	S	Bend	trans	-96.6	141	-178.4	-54.1	-60.8	0	0	0	109.7	F244 W283 S284 P290	F244-I287 HydrophobicContact CD1-CD1 3.7Å; F244-I287 HydrophobicContact CE1-CD1 4.21Å; F244-I287 HydrophobicContact CE1-CG2 4.07Å; F244-I287 HydrophobicContact CG-CD1 4.49Å; W283-I287 HydrophobicContact CD2-CD1 4.42Å; W283-I287 HydrophobicContact CD2-CG1 4.25Å; W283-I287 HydrophobicContact CE3-CD1 4.43Å; W283-I287 HydrophobicContact CE3-CG1 3.92Å; W283-I287 HydrophobicContact CH2-CD1 3.65Å; W283-I287 HydrophobicContact CH2-CG1 3.82Å; W283-I287 HydrophobicContact CZ2-CD1 3.62Å; W283-I287 HydrophobicContact CZ2-CG1 4.16Å; W283-I287 HydrophobicContact CZ3-CD1 4.08Å; W283-I287 HydrophobicContact CZ3-CG1 3.7Å; S284-I287 PolarHBondContact O-N 3.26Å; I287-P290 HydrophobicContact CB-CB 4.42Å; I287-P290 WeakPolarHBondContact O-CD 3.21Å
288	R	85.9	Confident	93.4	Very high	223 Å²	223	44.4 Å²	44.4	84%	0.842	20%	0.204	S	C	*	.	S	Bend	trans	-73.4	130.4	172.8	-176.8	176.7	175.5	169.5	-1.9	109.9
289	S	88	Confident	93.3	Very high	18 Å²	18	39.7 Å²	39.7	13%	0.126	18%	0.183	C	C	.	.	S	Bend	trans	49.6	53.1	177.9	-66.3	0	0	0	0	113.8	E291 Q292 H293	S289-E291 WeakPolarHBondContact CA-OE1 3.45Å; S289-E291 VanDerWaalsContact CA-OE2 3.29Å; S289-E291 WeakPolarHBondContact CA-OE2 3.44Å; S289-E291 WeakPolarHBondContact CB-OE1 3.19Å; S289-E291 PolarHBondContact O-N 3.28Å; S289-E291 VanDerWaalsContact O-N 3.14Å; S289-E291 PolarHBondContact OG-OE1 3.02Å; S289-Q292 WeakPolarHBondContact O-CB 3.33Å; S289-Q292 PolarHBondContact O-N 3.46Å; S289-H293 PolarHBondContact O-CE1 2.73Å; S289-H293 PolarHBondContact O-ND1 3.32Å
290	P	92.4	Very high	93.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-62.4	-23.4	-175.6	28.5	-34.1	0	0	0	113	F178 L181 I287 Q292 H293 Y294	F178-P290 HydrophobicContact CB-CG 4.17Å; F178-P290 HydrophobicContact CD2-CG 4.46Å; L181-P290 HydrophobicContact CB-CG 4.47Å; L181-P290 HydrophobicContact CD2-CB 3.92Å; L181-P290 HydrophobicContact CD2-CG 4.11Å; I287-P290 HydrophobicContact CB-CB 4.42Å; I287-P290 WeakPolarHBondContact O-CD 3.21Å; P290-Q292 PolarHBondContact O-N 3.3Å; P290-Q292 VanDerWaalsContact O-N 3.16Å; P290-H293 PolarHBondContact O-N 3.49Å; P290-Y294 WeakPolarHBondContact O-CB 3.27Å; P290-Y294 PolarHBondContact O-N 2.99Å
291	E	91.9	Very high	93.1	Very high	9 Å²	9	39 Å²	39	4%	0.042	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-58.1	-23.4	173.2	69.5	-75.6	175.8	0	0	113.5	G177 R180 L181 A259 S289 H293 W295	G177-E291 PolarHBondContact N-OE2 3.41Å; R180-E291 HydrophobicContact CG-CG 4.43Å; L181-E291 HydrophobicContact CB-CB 4.28Å; A259-E291 WeakPolarHBondContact CA-O 3.34Å; A259-E291 HydrophobicContact CB-CB 4.12Å; A259-E291 HydrophobicContact CB-CG 3.57Å; S289-E291 WeakPolarHBondContact CA-OE1 3.45Å; S289-E291 VanDerWaalsContact CA-OE2 3.29Å; S289-E291 WeakPolarHBondContact CA-OE2 3.44Å; S289-E291 WeakPolarHBondContact CB-OE1 3.19Å; S289-E291 PolarHBondContact O-N 3.28Å; S289-E291 VanDerWaalsContact O-N 3.14Å; S289-E291 PolarHBondContact OG-OE1 3.02Å; E291-H293 VanDerWaalsContact C-N 3.33Å; E291-W295 PolarHBondContact O-NE1 3.16Å
292	Q	92.1	Very high	93	Very high	79 Å²	79	46.8 Å²	46.8	37%	0.369	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-85.1	-5.3	177.2	-64	-176.9	-2.5	0	0	113.3	G257 S289 P290	G257-Q292 CarbonylContact C-O 3.5Å; G257-Q292 PolarHBondContact N-O 2.84Å; G257-Q292 WeakPolarHBondContact O-CB 3.41Å; S289-Q292 WeakPolarHBondContact O-CB 3.33Å; S289-Q292 PolarHBondContact O-N 3.46Å; P290-Q292 PolarHBondContact O-N 3.3Å; P290-Q292 VanDerWaalsContact O-N 3.16Å
293	H	91.8	Very high	93	Very high	9 Å²	9	46.5 Å²	46.5	4%	0.042	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-38.5	-177.4	-46.4	105.7	0	0	0	112.5	I254 Y255 F256 S289 P290 E291 W295 V296 T297	I254-H293 HydrophobicContact CG2-CB 3.86Å; Y255-H293 VanDerWaalsContact O-CA 3.3Å; Y255-H293 WeakPolarHBondContact O-CA 3.43Å; Y255-H293 WeakPolarHBondContact O-CB 3.36Å; Y255-H293 PolarHBondContact O-CD2 2.93Å; F256-H293 AromaticContact CD1-CD2 3.44Å; F256-H293 VanDerWaalsContact CD1-CD2 3.44Å; F256-H293 WeakPolarHBondContact CD1-CD2 3.44Å; F256-H293 AromaticContact CD1-NE2 2.99Å; F256-H293 WeakPolarHBondContact CD1-NE2 3.42Å; F256-H293 AromaticContact CD2-CD2 3.52Å; F256-H293 AromaticContact CD2-NE2 3.88Å; F256-H293 AromaticContact CE1-CD2 3.59Å; F256-H293 AromaticContact CE1-CE1 3.89Å; F256-H293 AromaticContact CE1-NE2 2.85Å; F256-H293 WeakPolarHBondContact CE1-NE2 3.07Å; F256-H293 AromaticContact CE2-CD2 3.67Å; F256-H293 AromaticContact CE2-NE2 3.77Å; F256-H293 AromaticContact CG-CD2 3.42Å; F256-H293 VanDerWaalsContact CG-CD2 3.42Å; F256-H293 WeakPolarHBondContact CG-CD2 3.29Å; F256-H293 AromaticContact CG-NE2 3.54Å; F256-H293 AromaticContact CZ-CD2 3.69Å; F256-H293 AromaticContact CZ-NE2 3.27Å; F256-H293 VanDerWaalsContact CZ-NE2 3.27Å; F256-H293 WeakPolarHBondContact CZ-NE2 3.35Å; S289-H293 PolarHBondContact O-CE1 2.73Å; S289-H293 PolarHBondContact O-ND1 3.32Å; P290-H293 PolarHBondContact O-N 3.49Å; E291-H293 VanDerWaalsContact C-N 3.33Å; H293-W295 PolarHBondContact O-N 2.68Å; H293-V296 WeakPolarHBondContact O-CG1 3.44Å; H293-T297 WeakPolarHBondContact O-CB 3.28Å; H293-T297 PolarHBondContact O-N 2.92Å; H293-T297 PolarHBondContact O-OG1 3.47Å
294	Y	95.9	Very high	93.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.9	-53	-169.2	-176.8	-95.2	0	0	0	112.7	L181 I185 I271 A277 M280 L281 P290 L298	L181-Y294 HydrophobicContact CD1-CD1 3.58Å; L181-Y294 HydrophobicContact CD1-CE1 4.17Å; L181-Y294 HydrophobicContact CD1-CG 3.88Å; L181-Y294 HydrophobicContact CD2-CD1 4.34Å; L181-Y294 HydrophobicContact CD2-CD2 4.05Å; L181-Y294 HydrophobicContact CD2-CG 3.8Å; L181-Y294 HydrophobicContact CG-CG 4.49Å; I185-Y294 HydrophobicContact CD1-CE1 4.07Å; I271-Y294 HydrophobicContact CG2-CE1 4.2Å; A277-Y294 PolarHBondContact O-OH 2.94Å; M280-Y294 HydrophobicContact CB-CD2 4.47Å; M280-Y294 HydrophobicContact CB-CE2 4.16Å; M280-Y294 HydrophobicContact CE-CD2 4.27Å; M280-Y294 HydrophobicContact CG-CD2 3.96Å; M280-Y294 HydrophobicContact CG-CE2 4.14Å; M280-Y294 HydrophobicContact SD-CD2 4.01Å; M280-Y294 HydrophobicContact SD-CE2 4.4Å; L281-Y294 HydrophobicContact CB-CE2 3.67Å; L281-Y294 HydrophobicContact CD1-CE2 4.12Å; L281-Y294 HydrophobicContact CG-CE2 4.5Å; P290-Y294 WeakPolarHBondContact O-CB 3.27Å; P290-Y294 PolarHBondContact O-N 2.99Å; Y294-L298 HydrophobicContact CD1-CD1 4.14Å; Y294-L298 HydrophobicContact CD2-CD1 4.34Å; Y294-L298 HydrophobicContact CE1-CD1 3.57Å; Y294-L298 HydrophobicContact CE2-CD1 3.78Å; Y294-L298 HydrophobicContact CG-CD1 4.5Å; Y294-L298 WeakPolarHBondContact O-CG 3.12Å; Y294-L298 PolarHBondContact O-N 2.95Å; Y294-L298 VanDerWaalsContact O-N 3.13Å
295	W	96.5	Very high	93.4	Very high	1 Å²	1	47.1 Å²	47.1	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-65.8	-51.4	-175.6	-46	117.3	0	0	0	112.2	L181 D184 I185 M188 T231 Y261 L263 I271 E291 H293 T297 L298 N299	L181-W295 HydrophobicContact CD1-CD2 4.46Å; L181-W295 HydrophobicContact CD1-CH2 3.49Å; L181-W295 VanDerWaalsContact CD1-CH2 3.49Å; L181-W295 HydrophobicContact CD1-CZ2 3.12Å; L181-W295 HydrophobicContact CD1-CZ3 4.28Å; D184-W295 HydrophobicContact CB-CH2 4.06Å; D184-W295 HydrophobicContact CB-CZ2 3.85Å; I185-W295 HydrophobicContact CD1-CH2 3.67Å; I185-W295 HydrophobicContact CD1-CZ3 3.92Å; I185-W295 HydrophobicContact CG1-CH2 4.14Å; M188-W295 HydrophobicContact CE-CH2 3.77Å; M188-W295 HydrophobicContact CE-CZ3 3.73Å; M188-W295 HydrophobicContact SD-CH2 4.11Å; M188-W295 HydrophobicContact SD-CZ3 4.05Å; T231-W295 HydrophobicContact CG2-CB 4.06Å; Y261-W295 HydrophobicContact CD1-CB 4.32Å; Y261-W295 AromaticContact CD1-CD1 3.52Å; Y261-W295 AromaticContact CD1-CD2 3.78Å; Y261-W295 HydrophobicContact CD1-CD2 3.78Å; Y261-W295 AromaticContact CD1-CE2 3.77Å; Y261-W295 AromaticContact CD1-CG 3.62Å; Y261-W295 HydrophobicContact CD1-CG 3.62Å; Y261-W295 HydrophobicContact CD1-CZ2 4.48Å; Y261-W295 AromaticContact CD1-NE1 3.6Å; Y261-W295 AromaticContact CE1-CD1 3.81Å; Y261-W295 AromaticContact CE1-CD2 3.65Å; Y261-W295 HydrophobicContact CE1-CD2 3.65Å; Y261-W295 AromaticContact CE1-CE2 3.25Å; Y261-W295 HydrophobicContact CE1-CE3 4.3Å; Y261-W295 AromaticContact CE1-CG 3.98Å; Y261-W295 HydrophobicContact CE1-CG 3.98Å; Y261-W295 HydrophobicContact CE1-CH2 4.24Å; Y261-W295 AromaticContact CE1-CZ2 3.55Å; Y261-W295 HydrophobicContact CE1-CZ2 3.55Å; Y261-W295 AromaticContact CE1-NE1 3.37Å; L263-W295 HydrophobicContact CD1-CE3 4.08Å; L263-W295 HydrophobicContact CD1-CZ3 4.46Å; I271-W295 HydrophobicContact CD1-CE3 4.05Å; I271-W295 HydrophobicContact CD1-CZ3 3.84Å; E291-W295 PolarHBondContact O-NE1 3.16Å; H293-W295 PolarHBondContact O-N 2.68Å; W295-T297 VanDerWaalsContact C-N 3.35Å; W295-T297 PolarHBondContact O-N 2.87Å; W295-L298 PolarHBondContact O-N 2.89Å; W295-N299 WeakPolarHBondContact O-CB 3.35Å; W295-N299 PolarHBondContact O-N 3.09Å
296	V	95.6	Very high	93.6	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-63.8	-41.3	-178.4	59.4	0	0	0	0	111	Y255 H293 L298 N299 Q300	Y255-V296 HydrophobicContact CD1-CG2 4.49Å; Y255-V296 HydrophobicContact CG-CG2 4.44Å; H293-V296 WeakPolarHBondContact O-CG1 3.44Å; V296-L298 PolarHBondContact O-N 3.17Å; V296-N299 PolarHBondContact O-N 3.38Å; V296-Q300 WeakPolarHBondContact O-CG 3.37Å; V296-Q300 PolarHBondContact O-N 2.82Å
297	T	95.1	Very high	94.2	Very high	3 Å²	3	38 Å²	38	2%	0.018	19%	0.187	C	C	.	.	H	α-helix	trans	-64.1	-43.9	179.3	-60.5	0	0	0	0	112.1	L252 T253 I254 Y255 M280 H293 W295 N299 Q300	L252-T297 HydrophobicContact CB-CG2 4.49Å; T253-T297 VanDerWaalsContact O-CG2 3.32Å; T253-T297 WeakPolarHBondContact O-CG2 3.3Å; I254-T297 HydrophobicContact CD1-CG2 4.16Å; Y255-T297 PolarHBondContact N-OG1 3.42Å; M280-T297 HydrophobicContact CE-CG2 3.63Å; M280-T297 HydrophobicContact SD-CG2 3.77Å; H293-T297 WeakPolarHBondContact O-CB 3.28Å; H293-T297 PolarHBondContact O-N 2.92Å; H293-T297 PolarHBondContact O-OG1 3.47Å; W295-T297 VanDerWaalsContact C-N 3.35Å; W295-T297 PolarHBondContact O-N 2.87Å; T297-N299 VanDerWaalsContact C-N 3.31Å; T297-N299 PolarHBondContact O-N 3.38Å; T297-Q300 WeakPolarHBondContact O-CB 3.31Å; T297-Q300 PolarHBondContact O-N 3.38Å
298	L	97.1	Very high	94.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-69.4	-32.1	178.2	-69.1	178.7	0	0	0	112.2	F267 I271 A277 M280 Y294 W295 V296 Q300 L301	F267-L298 HydrophobicContact CE2-CB 4.47Å; F267-L298 HydrophobicContact CZ-CB 3.84Å; I271-L298 HydrophobicContact CG1-CD1 4.24Å; A277-L298 HydrophobicContact CB-CD1 3.74Å; A277-L298 HydrophobicContact CB-CD2 4.2Å; M280-L298 HydrophobicContact SD-CD2 3.79Å; M280-L298 HydrophobicContact SD-CG 3.81Å; Y294-L298 HydrophobicContact CD1-CD1 4.14Å; Y294-L298 HydrophobicContact CD2-CD1 4.34Å; Y294-L298 HydrophobicContact CE1-CD1 3.57Å; Y294-L298 HydrophobicContact CE2-CD1 3.78Å; Y294-L298 HydrophobicContact CG-CD1 4.5Å; Y294-L298 WeakPolarHBondContact O-CG 3.12Å; Y294-L298 PolarHBondContact O-N 2.95Å; Y294-L298 VanDerWaalsContact O-N 3.13Å; W295-L298 PolarHBondContact O-N 2.89Å; V296-L298 PolarHBondContact O-N 3.17Å; L298-Q300 PolarHBondContact O-N 3.37Å; L298-L301 HydrophobicContact CD2-CD1 4Å; L298-L301 WeakPolarHBondContact O-CB 3.39Å; L298-L301 PolarHBondContact O-N 2.84Å
299	N	96.7	Very high	94.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-73.5	-7.4	178.7	-164.8	40.5	0	0	0	113.7	N229 T231 F267 W295 V296 T297 A307 T308	N229-N299 VanDerWaalsContact CB-OD1 3.3Å; N229-N299 WeakPolarHBondContact CB-OD1 3.33Å; N229-N299 PolarHBondContact ND2-OD1 3.13Å; T231-N299 HydrophobicContact CG2-CB 3.94Å; T231-N299 WeakPolarHBondContact OG1-CB 3.4Å; T231-N299 PolarHBondContact OG1-ND2 3.04Å; F267-N299 HydrophobicContact CE2-CB 4.35Å; F267-N299 HydrophobicContact CZ-CB 3.93Å; W295-N299 WeakPolarHBondContact O-CB 3.35Å; W295-N299 PolarHBondContact O-N 3.09Å; V296-N299 PolarHBondContact O-N 3.38Å; T297-N299 VanDerWaalsContact C-N 3.31Å; T297-N299 PolarHBondContact O-N 3.38Å; N299-A307 WeakPolarHBondContact O-CA 3.5Å; N299-A307 WeakPolarHBondContact O-CB 3.36Å; N299-A307 WeakPolarHBondContact OD1-CA 3.43Å; N299-T308 PolarHBondContact ND2-OG1 3.22Å; N299-T308 PolarHBondContact O-N 2.87Å; N299-T308 VanDerWaalsContact O-N 3.14Å
300	Q	94.4	Very high	94.3	Very high	20 Å²	20	35.4 Å²	35.4	9%	0.093	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-10.1	176.2	-69.3	-78.7	-19.7	0	0	112.6	Y255 V296 T297 L298 K302 P309	Y255-Q300 HydrophobicContact CD1-CG 3.63Å; Y255-Q300 HydrophobicContact CD2-CB 4.12Å; Y255-Q300 HydrophobicContact CD2-CG 3.85Å; Y255-Q300 HydrophobicContact CE1-CB 4.23Å; Y255-Q300 HydrophobicContact CE1-CG 3.47Å; Y255-Q300 VanDerWaalsContact CE1-CG 3.47Å; Y255-Q300 VanDerWaalsContact CE1-OE1 3.27Å; Y255-Q300 HydrophobicContact CE2-CB 3.77Å; Y255-Q300 HydrophobicContact CE2-CG 3.8Å; Y255-Q300 HydrophobicContact CG-CG 3.82Å; Y255-Q300 PolarHBondContact OH-OE1 2.97Å; V296-Q300 WeakPolarHBondContact O-CG 3.37Å; V296-Q300 PolarHBondContact O-N 2.82Å; T297-Q300 WeakPolarHBondContact O-CB 3.31Å; T297-Q300 PolarHBondContact O-N 3.38Å; L298-Q300 PolarHBondContact O-N 3.37Å; Q300-K302 PolarHBondContact O-N 2.8Å; Q300-P309 PolarHBondContact NE2-O 3.07Å; Q300-P309 VanDerWaalsContact OE1-C 3.31Å; Q300-P309 PolarHBondContact OE1-O 2.87Å
301	L	95.2	Very high	93.9	Very high	27 Å²	27	36.3 Å²	36.3	14%	0.141	20%	0.199	C	C	.	.			trans	-69.4	115.5	171.4	-66.9	174.6	0	0	0	109.2	L252 F270 L298 D303 A304 A307	L252-L301 HydrophobicContact CD2-CD1 4.31Å; L252-L301 HydrophobicContact CD2-CD2 3.68Å; L252-L301 HydrophobicContact CD2-CG 4.34Å; F270-L301 HydrophobicContact CE1-CD1 4.41Å; F270-L301 HydrophobicContact CZ-CD1 3.9Å; L298-L301 HydrophobicContact CD2-CD1 4Å; L298-L301 WeakPolarHBondContact O-CB 3.39Å; L298-L301 PolarHBondContact O-N 2.84Å; L301-D303 PolarHBondContact O-N 3.15Å; L301-D303 VanDerWaalsContact O-N 3.09Å; L301-A304 HydrophobicContact CB-CB 3.93Å; L301-A304 WeakPolarHBondContact O-CB 3.3Å; L301-A304 PolarHBondContact O-N 2.76Å; L301-A307 WeakPolarHBondContact O-CB 3.39Å
302	K	94.4	Very high	93.8	Very high	186 Å²	186	36.9 Å²	36.9	81%	0.809	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.1	-176	-65.9	-174.6	176.9	-176.3	0	113.8	Q300 P309	Q300-K302 PolarHBondContact O-N 2.8Å; K302-P309 HydrophobicContact CG-CG 4.4Å
303	D	96.4	Very high	93.8	Very high	103 Å²	103	40.8 Å²	40.8	55%	0.551	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-2.7	179.2	65.7	-44.8	0	0	0	113.5	R276 L301	R276-D303 IonicContact CZ-OD1 3.49Å; R276-D303 IonicContact CZ-OD2 2.9Å; R276-D303 VanDerWaalsContact CZ-OD2 3.22Å; R276-D303 VanDerWaalsContact NH1-CG 3.29Å; R276-D303 IonicContact NH1-OD1 2.85Å; R276-D303 PolarHBondContact NH1-OD1 3.39Å; R276-D303 IonicContact NH1-OD2 3.8Å; R276-D303 PolarHBondContact NH1-OD2 2.77Å; R276-D303 IonicContact NH2-OD1 3.61Å; R276-D303 IonicContact NH2-OD2 3.85Å; R276-D303 PolarHBondContact NH2-OD2 2.77Å; L301-D303 PolarHBondContact O-N 3.15Å; L301-D303 VanDerWaalsContact O-N 3.09Å
304	A	97.8	Very high	93.7	Very high	6 Å²	6	45.1 Å²	45.1	5%	0.05	24%	0.238	C	C	.	.	S	Bend	trans	-75.3	142.9	175.6	0	0	0	0	0	111.4	F267 F270 L301 G306 A307	F267-A304 HydrophobicContact CD2-CB 4.07Å; F267-A304 HydrophobicContact CE2-CB 3.75Å; F270-A304 HydrophobicContact CD1-CB 4.23Å; F270-A304 HydrophobicContact CE1-CB 3.89Å; F270-A304 HydrophobicContact CE2-CB 4.23Å; F270-A304 HydrophobicContact CZ-CB 3.89Å; L301-A304 HydrophobicContact CB-CB 3.93Å; L301-A304 WeakPolarHBondContact O-CB 3.3Å; L301-A304 PolarHBondContact O-N 2.76Å; A304-G306 PolarHBondContact O-N 2.93Å; A304-A307 HydrophobicContact CB-CB 4.34Å; A304-A307 WeakPolarHBondContact O-CB 3.33Å; A304-A307 PolarHBondContact O-N 2.72Å; A304-A307 VanDerWaalsContact O-N 3.15Å
305	P	98.4	Very high	93.5	Very high	41 Å²	41	45.2 Å²	45.2	27%	0.266	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	128.5	-179.1	-24.6	34.6	0	0	0	112.5	N229 K266 F267 F270 A307	N229-P305 PolarHBondContact ND2-O 3.22Å; K266-P305 HydrophobicContact CB-CB 3.61Å; K266-P305 HydrophobicContact CB-CG 4.22Å; F267-P305 WeakPolarHBondContact CB-O 3.44Å; F267-P305 WeakPolarHBondContact CD2-O 3.27Å; F270-P305 HydrophobicContact CB-CG 4.01Å; P305-A307 PolarHBondContact O-N 2.73Å
306	G	97.5	Very high	93.3	Very high	22 Å²	22	48.4 Å²	48.4	23%	0.227	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	17.7	-179.7	0	0	0	0	0	114.7	D227 N229 A304	D227-G306 WeakPolarHBondContact O-CA 3.21Å; N229-G306 PolarHBondContact N-O 3.31Å; N229-G306 VanDerWaalsContact ND2-C 3.31Å; N229-G306 PolarHBondContact ND2-O 2.94Å; N229-G306 VanDerWaalsContact ND2-O 3.16Å; A304-G306 PolarHBondContact O-N 2.93Å
307	A	97	Very high	93.3	Very high	24 Å²	24	48.4 Å²	48.4	20%	0.198	26%	0.256	C	S	.	.			trans	-54	145.6	178.7	0	0	0	0	0	113.5	N299 L301 A304 P305	N299-A307 WeakPolarHBondContact O-CA 3.5Å; N299-A307 WeakPolarHBondContact O-CB 3.36Å; N299-A307 WeakPolarHBondContact OD1-CA 3.43Å; L301-A307 WeakPolarHBondContact O-CB 3.39Å; A304-A307 HydrophobicContact CB-CB 4.34Å; A304-A307 WeakPolarHBondContact O-CB 3.33Å; A304-A307 PolarHBondContact O-N 2.72Å; A304-A307 VanDerWaalsContact O-N 3.15Å; P305-A307 PolarHBondContact O-N 2.73Å
308	T	93.9	Very high	93.4	Very high	15 Å²	15	49.3 Å²	49.3	9%	0.092	26%	0.259	C	S	.	.			trans	-134.3	70.8	177.9	59	0	0	0	0	110	W225 K228 N299 D310 A311	W225-T308 HydrophobicContact CZ3-CG2 4.16Å; K228-T308 HydrophobicContact CB-CG2 3.93Å; K228-T308 HydrophobicContact CD-CG2 4.3Å; K228-T308 HydrophobicContact CG-CG2 4.26Å; N299-T308 PolarHBondContact ND2-OG1 3.22Å; N299-T308 PolarHBondContact O-N 2.87Å; N299-T308 VanDerWaalsContact O-N 3.14Å; T308-D310 PolarHBondContact O-N 2.67Å; T308-A311 WeakPolarHBondContact O-CB 3.43Å; T308-A311 PolarHBondContact O-N 3.18Å; T308-A311 VanDerWaalsContact O-N 3.13Å
309	P	87.9	Confident	93.4	Very high	38 Å²	38	49.4 Å²	49.4	25%	0.247	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-22.4	-171.1	26.7	-35.4	0	0	0	113.9	Q300 K302	Q300-P309 PolarHBondContact NE2-O 3.07Å; Q300-P309 VanDerWaalsContact OE1-C 3.31Å; Q300-P309 PolarHBondContact OE1-O 2.87Å; K302-P309 HydrophobicContact CG-CG 4.4Å
310	D	82.3	Confident	93.4	Very high	159 Å²	159	50.7 Å²	50.7	85%	0.85	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	2.1	179.3	-52.3	-55.6	0	0	0	112.8	T308	T308-D310 PolarHBondContact O-N 2.67Å
311	A	84.7	Confident	93.5	Very high	19 Å²	19	49.7 Å²	49.7	16%	0.157	26%	0.262	C	S	.	.			trans	-79.1	129.9	177.8	0	0	0	0	0	110.7	T308 E314	T308-A311 WeakPolarHBondContact O-CB 3.43Å; T308-A311 PolarHBondContact O-N 3.18Å; T308-A311 VanDerWaalsContact O-N 3.13Å; A311-E314 WeakPolarHBondContact CA-OE2 3.46Å
312	G	89.2	Confident	93.6	Very high	20 Å²	20	53.2 Å²	53.2	21%	0.206	27%	0.274	C	S	.	.			trans	-91.6	-123	169.7	0	0	0	0	0	111.7	P232 G233 E314	P232-G312 WeakPolarHBondContact CA-O 3.49Å; G233-G312 PolarHBondContact N-O 3.11Å; G233-G312 CarbonylContact O-C 3.6Å; G233-G312 WeakPolarHBondContact O-CA 3.44Å; G312-E314 VanDerWaalsContact C-N 3.27Å; G312-E314 VanDerWaalsContact C-OE2 3.31Å; G312-E314 WeakPolarHBondContact CA-OE2 3.45Å; G312-E314 PolarHBondContact N-OE2 3.43Å; G312-E314 PolarHBondContact O-N 3.32Å
313	W	91.1	Very high	93.6	Very high	162 Å²	162	49.5 Å²	49.5	61%	0.614	26%	0.258	S	S	*	.	S	Bend	trans	-86.5	15.4	-178.5	-71.6	96	0	0	0	114	P232	P232-W313 HydrophobicContact CB-CE3 3.87Å; P232-W313 HydrophobicContact CB-CZ3 4.44Å
314	E	90.9	Very high	93.5	Very high	100 Å²	100	49 Å²	49	47%	0.467	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	160.6	179.5	-50.6	86.2	179.9	0	0	112.2	W225 P232 A311 G312	W225-E314 HydrophobicContact CH2-CB 3.99Å; W225-E314 HydrophobicContact CZ2-CB 3.88Å; P232-E314 WeakPolarHBondContact CG-O 3.36Å; A311-E314 WeakPolarHBondContact CA-OE2 3.46Å; G312-E314 VanDerWaalsContact C-N 3.27Å; G312-E314 VanDerWaalsContact C-OE2 3.31Å; G312-E314 WeakPolarHBondContact CA-OE2 3.45Å; G312-E314 PolarHBondContact N-OE2 3.43Å; G312-E314 PolarHBondContact O-N 3.32Å
315	G	90.6	Very high	93.3	Very high	2 Å²	2	51.1 Å²	51.1	2%	0.021	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	117.1	-18.8	170.7	0	0	0	0	0	115.5	Y220 I230 V317	Y220-G315 WeakPolarHBondContact CE1-O 3.39Å; Y220-G315 WeakPolarHBondContact OH-CA 3.44Å; Y220-G315 PolarHBondContact OH-O 2.95Å; I230-G315 VanDerWaalsContact CG2-CA 3.49Å; G315-V317 PolarHBondContact O-N 3.06Å
316	N	92.6	Very high	93.2	Very high	67 Å²	67	53.7 Å²	53.7	36%	0.358	28%	0.281	S	S	.	.			trans	43.3	45.8	175.4	-57.8	-23.6	0	0	0	113.1	R318 S356 S357 L358	N316-R318 VanDerWaalsContact C-N 3.34Å; N316-R318 PolarHBondContact O-N 3.21Å; N316-S356 PolarHBondContact ND2-OG 3.14Å; N316-S357 CarbonylContact O-C 3.48Å; N316-S357 WeakPolarHBondContact O-CA 3.21Å; N316-S357 WeakPolarHBondContact O-CB 3.32Å; N316-S357 PolarHBondContact O-OG 3.45Å; N316-L358 PolarHBondContact O-N 2.78Å
317	V	96.7	Very high	92.9	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.012	30%	0.303	C	S	.	.			trans	-65.4	-41.7	-175.8	-176.8	0	0	0	0	110.7	I230 P232 V262 G315 F359	I230-V317 HydrophobicContact CB-CG2 4.25Å; I230-V317 HydrophobicContact CG2-CG2 3.53Å; P232-V317 HydrophobicContact CG-CG2 4.02Å; V262-V317 HydrophobicContact CG2-CG1 4.2Å; V262-V317 HydrophobicContact CG2-CG2 4.17Å; G315-V317 PolarHBondContact O-N 3.06Å; V317-F359 PolarHBondContact O-N 3.18Å
318	R	97.1	Very high	92.7	Very high	22 Å²	22	61.5 Å²	61.5	8%	0.083	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	130.1	-176.9	-154	71	58.7	-176.6	-15	111.3	N203 D208 Y260 N316 I320 F359	N203-R318 PolarHBondContact O-NH2 3.06Å; D208-R318 VanDerWaalsContact OD1-CD 3.25Å; D208-R318 WeakPolarHBondContact OD1-CD 3.33Å; D208-R318 IonicContact OD1-CZ 2.73Å; D208-R318 IonicContact OD1-NE 3.44Å; D208-R318 PolarHBondContact OD1-NE 3.23Å; D208-R318 IonicContact OD1-NH1 3.63Å; D208-R318 PolarHBondContact OD1-NH1 2.66Å; D208-R318 IonicContact OD2-CZ 3.85Å; D208-R318 IonicContact OD2-NH1 3.04Å; D208-R318 PolarHBondContact OD2-NH1 2.9Å; D208-R318 VanDerWaalsContact OD2-NH1 3.11Å; Y260-R318 HydrophobicContact CD2-CB 3.96Å; Y260-R318 HydrophobicContact CD2-CG 4.06Å; Y260-R318 HydrophobicContact CE2-CG 4.14Å; Y260-R318 HydrophobicContact CG-CB 4.27Å; Y260-R318 HydrophobicContact CG-CG 4.42Å; N316-R318 VanDerWaalsContact C-N 3.34Å; N316-R318 PolarHBondContact O-N 3.21Å; R318-I320 HydrophobicContact CB-CD1 4.19Å; R318-I320 HydrophobicContact CB-CG1 4.06Å; R318-I320 HydrophobicContact CG-CD1 3.93Å; R318-I320 HydrophobicContact CG-CG1 3.65Å; R318-F359 CarbonylContact C-O 3.53Å; R318-F359 WeakPolarHBondContact CA-O 3.14Å
319	A	97.3	Very high	92.5	Very high	3 Å²	3	65.5 Å²	65.5	3%	0.025	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	120.3	161.9	0	0	0	0	0	108.2	I211 Y344 W351 S357 F359 A360 Y361	I211-A319 HydrophobicContact CD1-CB 4.23Å; A319-Y344 PolarHBondContact O-OH 2.69Å; A319-W351 HydrophobicContact CB-CH2 3.92Å; A319-W351 HydrophobicContact CB-CZ3 3.86Å; A319-S357 PolarHBondContact N-OG 3.37Å; A319-F359 PolarHBondContact N-O 3.23Å; A319-A360 HydrophobicContact CB-CB 4.12Å; A319-A360 WeakPolarHBondContact O-CA 3.5Å; A319-Y361 PolarHBondContact O-N 3.38Å
320	I	96.3	Very high	92.8	Very high	26 Å²	26	64.2 Å²	64.2	13%	0.133	35%	0.345	C	S	.	.			trans	-135	131.2	176.9	-53.1	179.7	0	0	0	106.9	Y260 R318 W322 I341 Y344 Y361	Y260-I320 HydrophobicContact CD2-CD1 4.23Å; Y260-I320 HydrophobicContact CE2-CD1 3.76Å; R318-I320 HydrophobicContact CB-CD1 4.19Å; R318-I320 HydrophobicContact CB-CG1 4.06Å; R318-I320 HydrophobicContact CG-CD1 3.93Å; R318-I320 HydrophobicContact CG-CG1 3.65Å; I320-W322 HydrophobicContact CD1-CZ2 4.05Å; I320-W322 HydrophobicContact CG2-CD2 4.06Å; I320-W322 HydrophobicContact CG2-CG 4.31Å; I320-W322 HydrophobicContact CG2-CZ2 4.04Å; I320-I341 HydrophobicContact CG2-CG1 4.48Å; I320-I341 HydrophobicContact CG2-CG2 3.75Å; I320-Y344 WeakPolarHBondContact CA-OH 3.3Å; I320-Y361 HydrophobicContact CD1-CD1 4.2Å; I320-Y361 HydrophobicContact CG1-CD1 4.26Å; I320-Y361 HydrophobicContact CG2-CD1 4.43Å
321	K	96.9	Very high	93.4	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.33	C	S	.	.			trans	-95	107	168.9	-79.9	-171.2	175.8	-168.8	0	108.7	H330 D331 G332 C342 Y344 D348 W351	K321-H330 HydrophobicContact CD-CB 4.17Å; K321-H330 HydrophobicContact CG-CB 4.23Å; K321-D331 IonicContact NZ-OD1 2.8Å; K321-G332 PolarHBondContact NZ-O 3.4Å; K321-C342 HydrophobicContact CB-CB 3.53Å; K321-C342 WeakPolarHBondContact O-CB 3.27Å; K321-C342 PolarHBondContact O-N 3.17Å; K321-Y344 HydrophobicContact CB-CE1 4.22Å; K321-Y344 HydrophobicContact CD-CE1 4.02Å; K321-Y344 HydrophobicContact CG-CE1 3.93Å; K321-Y344 PolarHBondContact N-OH 2.93Å; K321-D348 IonicContact NZ-OD1 3.87Å; K321-D348 PolarHBondContact NZ-OD1 3.43Å; K321-W351 HydrophobicContact CD-CD2 4.37Å; K321-W351 HydrophobicContact CD-CE3 4.41Å; K321-W351 VanDerWaalsContact CE-CG 3.46Å; K321-W351 HydrophobicContact CG-CD2 4.32Å; K321-W351 HydrophobicContact CG-CE3 4.22Å; K321-W351 HydrophobicContact CG-CH2 3.8Å; K321-W351 HydrophobicContact CG-CZ2 3.89Å; K321-W351 HydrophobicContact CG-CZ3 3.98Å
322	W	95.6	Very high	93.9	Very high	101 Å²	101	60.6 Å²	60.6	38%	0.383	32%	0.323	S	S	.	.	B	Isolated β-bridge	trans	-87.8	138.6	175.5	-61.9	98.7	0	0	0	110.2	I320 S324 D325 H330 I341	I320-W322 HydrophobicContact CD1-CZ2 4.05Å; I320-W322 HydrophobicContact CG2-CD2 4.06Å; I320-W322 HydrophobicContact CG2-CG 4.31Å; I320-W322 HydrophobicContact CG2-CZ2 4.04Å; W322-S324 PolarHBondContact O-N 2.82Å; W322-S324 VanDerWaalsContact O-N 3.17Å; W322-D325 HydrophobicContact CB-CB 4.4Å; W322-D325 PolarHBondContact O-N 3.44Å; W322-H330 PolarHBondContact O-CE1 3.39Å; W322-H330 PolarHBondContact O-NE2 3.3Å; W322-I341 HydrophobicContact CD2-CG1 4.42Å; W322-I341 HydrophobicContact CE3-CD1 4.25Å; W322-I341 HydrophobicContact CE3-CG1 3.62Å; W322-I341 HydrophobicContact CH2-CD1 3.7Å; W322-I341 HydrophobicContact CH2-CG1 4.01Å; W322-I341 HydrophobicContact CZ3-CD1 3.53Å; W322-I341 HydrophobicContact CZ3-CG1 3.38Å
323	K	96.1	Very high	94.2	Very high	108 Å²	108	60.7 Å²	60.7	47%	0.47	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-58.1	-31.9	177.2	-168.8	-180	179.7	-174.6	0	112.6	D325 E326 Y337 D340	K323-D325 PolarHBondContact O-N 3.33Å; K323-E326 WeakPolarHBondContact O-CB 3.38Å; K323-E326 PolarHBondContact O-N 3.4Å; K323-Y337 HydrophobicContact CB-CD1 3.76Å; K323-Y337 HydrophobicContact CB-CE1 3.65Å; K323-Y337 HydrophobicContact CB-CG 4.28Å; K323-Y337 HydrophobicContact CD-CD2 4.3Å; K323-Y337 HydrophobicContact CD-CG 4.25Å; K323-Y337 HydrophobicContact CG-CD1 4.19Å; K323-Y337 HydrophobicContact CG-CD2 4.21Å; K323-Y337 HydrophobicContact CG-CE1 4.07Å; K323-Y337 HydrophobicContact CG-CE2 4.06Å; K323-Y337 HydrophobicContact CG-CG 4.25Å; K323-D340 HydrophobicContact CB-CB 4.02Å; K323-D340 WeakPolarHBondContact CD-OD1 3.48Å; K323-D340 PolarHBondContact N-O 3.41Å
324	S	94.5	Very high	94.4	Very high	91 Å²	91	57.5 Å²	57.5	64%	0.636	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-64.4	-22.5	176.1	54.8	0	0	0	0	114.1	W322	W322-S324 PolarHBondContact O-N 2.82Å; W322-S324 VanDerWaalsContact O-N 3.17Å
325	D	93.8	Very high	94.6	Very high	51 Å²	51	54.3 Å²	54.3	27%	0.273	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-99.9	0.8	-172.3	-57.9	-10.5	0	0	0	112.1	W322 K323 G327 N328 V329	W322-D325 HydrophobicContact CB-CB 4.4Å; W322-D325 PolarHBondContact O-N 3.44Å; K323-D325 PolarHBondContact O-N 3.33Å; D325-G327 PolarHBondContact O-N 2.88Å; D325-N328 PolarHBondContact O-N 3.18Å; D325-N328 VanDerWaalsContact O-N 3.09Å; D325-V329 HydrophobicContact CB-CB 3.97Å; D325-V329 HydrophobicContact CB-CG2 3.91Å; D325-V329 PolarHBondContact O-N 3.13Å
326	E	94.3	Very high	94.8	Very high	95 Å²	95	58.5 Å²	58.5	44%	0.444	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-61.7	130	176.5	179.1	162	-177.2	0	0	111.3	K323 N328 G332 Y337	K323-E326 WeakPolarHBondContact O-CB 3.38Å; K323-E326 PolarHBondContact O-N 3.4Å; E326-N328 VanDerWaalsContact C-N 3.26Å; E326-N328 PolarHBondContact O-N 2.76Å; E326-G332 WeakPolarHBondContact OE1-CA 3.33Å; E326-Y337 WeakPolarHBondContact OE2-CE2 3.42Å; E326-Y337 PolarHBondContact OE2-OH 3.49Å
327	G	93.1	Very high	95	Very high	67 Å²	67	58.3 Å²	58.3	69%	0.691	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-12.3	-175.2	0	0	0	0	0	114.3	D325 H330	D325-G327 PolarHBondContact O-N 2.88Å; G327-H330 PolarHBondContact N-O 2.71Å
328	N	91.4	Very high	94.8	Very high	144 Å²	144	60 Å²	60	77%	0.77	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-58.2	-179.9	-64.4	-40.1	0	0	0	112.1	D325 E326	D325-N328 PolarHBondContact O-N 3.18Å; D325-N328 VanDerWaalsContact O-N 3.09Å; E326-N328 VanDerWaalsContact C-N 3.26Å; E326-N328 PolarHBondContact O-N 2.76Å
329	V	90.4	Very high	94.5	Very high	98 Å²	98	64.4 Å²	64.4	59%	0.594	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-28.2	-176	-176.2	0	0	0	0	111.4	D325	D325-V329 HydrophobicContact CB-CB 3.97Å; D325-V329 HydrophobicContact CB-CG2 3.91Å; D325-V329 PolarHBondContact O-N 3.13Å
330	H	93.8	Very high	94.4	Very high	11 Å²	11	68.7 Å²	68.7	5%	0.051	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-147.8	162	177	61.5	80.8	0	0	0	112.2	K321 W322 G327 G332	K321-H330 HydrophobicContact CD-CB 4.17Å; K321-H330 HydrophobicContact CG-CB 4.23Å; W322-H330 PolarHBondContact O-CE1 3.39Å; W322-H330 PolarHBondContact O-NE2 3.3Å; G327-H330 PolarHBondContact N-O 2.71Å; H330-G332 WeakPolarHBondContact ND1-CA 3.42Å; H330-G332 PolarHBondContact ND1-N 3.13Å; H330-G332 PolarHBondContact O-N 3.49Å
331	D	94.4	Very high	94.4	Very high	100 Å²	100	68 Å²	68	54%	0.535	37%	0.366	S	S	.	.	S	Bend	trans	-84.4	37.4	-176.9	72.1	-34	0	0	0	113.3	K321 K334	K321-D331 IonicContact NZ-OD1 2.8Å; D331-K334 VanDerWaalsContact CG-NZ 3.32Å; D331-K334 PolarHBondContact O-NZ 3.09Å; D331-K334 IonicContact OD1-NZ 3.64Å; D331-K334 WeakPolarHBondContact OD2-CE 3.44Å; D331-K334 IonicContact OD2-NZ 3.58Å; D331-K334 PolarHBondContact OD2-NZ 2.9Å
332	G	95.7	Very high	94.4	Very high	2 Å²	2	68 Å²	68	2%	0.021	37%	0.366	C	S	.	.			trans	78.4	175.4	-174	0	0	0	0	0	114.7	K321 E326 H330	K321-G332 PolarHBondContact NZ-O 3.4Å; E326-G332 WeakPolarHBondContact OE1-CA 3.33Å; H330-G332 WeakPolarHBondContact ND1-CA 3.42Å; H330-G332 PolarHBondContact ND1-N 3.13Å; H330-G332 PolarHBondContact O-N 3.49Å
333	C	96.4	Very high	94.4	Very high	23 Å²	23	63.3 Å²	63.3	16%	0.155	35%	0.348	C	S	.	.			trans	-86.9	129.3	176.9	-175.2	0	0	0	0	109.9	R336 Y337 C342	C333-R336 PolarHBondContact SG-N 3.3Å; C333-R336 VanDerWaalsContact SG-N 3.4Å; C333-Y337 HydrophobicContact CB-CD1 4.25Å; C333-Y337 HydrophobicContact CB-CD2 4.13Å; C333-Y337 HydrophobicContact CB-CE1 3.72Å; C333-Y337 HydrophobicContact CB-CE2 3.62Å; C333-Y337 HydrophobicContact CB-CG 4.44Å; C333-Y337 PolarHBondContact N-OH 3.37Å; C333-C342 VanDerWaalsContact CA-SG 3.57Å; C333-C342 HydrophobicContact CB-CB 3.67Å; C333-C342 WeakPolarHBondContact CB-SG 2.99Å; C333-C342 VanDerWaalsContact SG-CA 3.5Å; C333-C342 WeakPolarHBondContact SG-CB 2.85Å; C333-C342 CovalentContact SG-SG 2.03Å; C333-C342 PolarHBondContact SG-SG 3.34Å
334	K	95.1	Very high	94.5	Very high	94 Å²	94	58.2 Å²	58.2	41%	0.409	33%	0.326	S	S	.	.	S	Bend	trans	-94.1	3.2	175.5	-48.1	-52.3	-174.2	-170.3	0	113.2	D331 D348	D331-K334 VanDerWaalsContact CG-NZ 3.32Å; D331-K334 PolarHBondContact O-NZ 3.09Å; D331-K334 IonicContact OD1-NZ 3.64Å; D331-K334 WeakPolarHBondContact OD2-CE 3.44Å; D331-K334 IonicContact OD2-NZ 3.58Å; D331-K334 PolarHBondContact OD2-NZ 2.9Å; K334-D348 WeakPolarHBondContact CA-OD2 3.37Å; K334-D348 WeakPolarHBondContact CB-OD2 3.39Å; K334-D348 WeakPolarHBondContact CG-OD1 3.29Å; K334-D348 PolarHBondContact N-OD1 3.14Å; K334-D348 PolarHBondContact N-OD2 3.23Å
335	G	94.3	Very high	94.5	Very high	33 Å²	33	53.9 Å²	53.9	34%	0.34	30%	0.296	S	S	.	.	S	Bend	trans	-106.5	-112.1	163.5	0	0	0	0	0	110.8	V343 D348	G335-V343 WeakPolarHBondContact CA-O 3.44Å; G335-D348 PolarHBondContact N-OD2 2.99Å; G335-D348 VanDerWaalsContact N-OD2 3.16Å
336	R	95.2	Very high	94.4	Very high	91 Å²	91	52.2 Å²	52.2	34%	0.343	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	151.3	178.7	61.7	-178.1	172.3	83.3	3.7	112.5	C333 V343 E364 T367	C333-R336 PolarHBondContact SG-N 3.3Å; C333-R336 VanDerWaalsContact SG-N 3.4Å; R336-V343 HydrophobicContact CG-CB 4.2Å; R336-V343 PolarHBondContact N-O 2.99Å; R336-V343 VanDerWaalsContact N-O 3.15Å; R336-V343 PolarHBondContact O-N 3.09Å; R336-E364 IonicContact CZ-OE2 2.68Å; R336-E364 IonicContact NH1-OE2 3.8Å; R336-E364 IonicContact NH2-OE2 3.63Å; R336-E364 PolarHBondContact NH2-OE2 3.37Å; R336-T367 PolarHBondContact NH2-OG1 3.18Å
337	Y	96.1	Very high	94.4	Very high	63 Å²	63	48.9 Å²	48.9	25%	0.247	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	135.4	172.8	-68.9	-73	0	0	0	111.8	K323 E326 C333 I341 C342	K323-Y337 HydrophobicContact CB-CD1 3.76Å; K323-Y337 HydrophobicContact CB-CE1 3.65Å; K323-Y337 HydrophobicContact CB-CG 4.28Å; K323-Y337 HydrophobicContact CD-CD2 4.3Å; K323-Y337 HydrophobicContact CD-CG 4.25Å; K323-Y337 HydrophobicContact CG-CD1 4.19Å; K323-Y337 HydrophobicContact CG-CD2 4.21Å; K323-Y337 HydrophobicContact CG-CE1 4.07Å; K323-Y337 HydrophobicContact CG-CE2 4.06Å; K323-Y337 HydrophobicContact CG-CG 4.25Å; E326-Y337 WeakPolarHBondContact OE2-CE2 3.42Å; E326-Y337 PolarHBondContact OE2-OH 3.49Å; C333-Y337 HydrophobicContact CB-CD1 4.25Å; C333-Y337 HydrophobicContact CB-CD2 4.13Å; C333-Y337 HydrophobicContact CB-CE1 3.72Å; C333-Y337 HydrophobicContact CB-CE2 3.62Å; C333-Y337 HydrophobicContact CB-CG 4.44Å; C333-Y337 PolarHBondContact N-OH 3.37Å; Y337-I341 WeakPolarHBondContact CA-O 3.44Å; Y337-C342 HydrophobicContact CD1-CB 4.29Å; Y337-C342 HydrophobicContact CE1-CB 4.08Å
338	V	94.1	Very high	94.6	Very high	38 Å²	38	45.7 Å²	45.7	23%	0.23	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	119.1	168.6	-179.5	0	0	0	0	107.5	D340 I341 V343	V338-D340 PolarHBondContact O-N 2.98Å; V338-I341 PolarHBondContact N-O 2.86Å; V338-I341 PolarHBondContact O-N 3.37Å; V338-I341 VanDerWaalsContact O-N 3.07Å; V338-V343 HydrophobicContact CB-CG2 4.21Å; V338-V343 HydrophobicContact CG2-CG2 3.71Å
339	Q	90.7	Very high	94.8	Very high	113 Å²	113	38.9 Å²	38.9	53%	0.528	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	47.4	-177.7	-61.2	163	-57.5	0	0	111.4	Y175 I341	Y175-Q339 PolarHBondContact OH-OE1 3.18Å; Q339-I341 PolarHBondContact O-N 2.88Å; Q339-I341 VanDerWaalsContact O-N 3.09Å
340	D	94.3	Very high	95.1	Very high	93 Å²	93	35.5 Å²	35.5	50%	0.497	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	13.1	-179.6	-56.5	-43.1	0	0	0	116.2	K323 V338	K323-D340 HydrophobicContact CB-CB 4.02Å; K323-D340 WeakPolarHBondContact CD-OD1 3.48Å; K323-D340 PolarHBondContact N-O 3.41Å; V338-D340 PolarHBondContact O-N 2.98Å
341	I	95.6	Very high	95.2	Very high	13 Å²	13	37.6 Å²	37.6	7%	0.067	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.9	173.5	-60.4	174.7	0	0	0	109.4	I320 W322 Y337 V338 Q339 V343 Y361 K362	I320-I341 HydrophobicContact CG2-CG1 4.48Å; I320-I341 HydrophobicContact CG2-CG2 3.75Å; W322-I341 HydrophobicContact CD2-CG1 4.42Å; W322-I341 HydrophobicContact CE3-CD1 4.25Å; W322-I341 HydrophobicContact CE3-CG1 3.62Å; W322-I341 HydrophobicContact CH2-CD1 3.7Å; W322-I341 HydrophobicContact CH2-CG1 4.01Å; W322-I341 HydrophobicContact CZ3-CD1 3.53Å; W322-I341 HydrophobicContact CZ3-CG1 3.38Å; Y337-I341 WeakPolarHBondContact CA-O 3.44Å; V338-I341 PolarHBondContact N-O 2.86Å; V338-I341 PolarHBondContact O-N 3.37Å; V338-I341 VanDerWaalsContact O-N 3.07Å; Q339-I341 PolarHBondContact O-N 2.88Å; Q339-I341 VanDerWaalsContact O-N 3.09Å; I341-V343 PolarHBondContact O-N 3.36Å; I341-Y361 HydrophobicContact CD1-CE1 3.83Å; I341-Y361 HydrophobicContact CG2-CD1 4.03Å; I341-Y361 HydrophobicContact CG2-CE1 3.86Å; I341-K362 HydrophobicContact CG2-CB 4.4Å
342	C	97.4	Very high	95.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	123.4	174.6	-176.6	0	0	0	0	110.8	K321 C333 Y337 K362	K321-C342 HydrophobicContact CB-CB 3.53Å; K321-C342 WeakPolarHBondContact O-CB 3.27Å; K321-C342 PolarHBondContact O-N 3.17Å; C333-C342 VanDerWaalsContact CA-SG 3.57Å; C333-C342 HydrophobicContact CB-CB 3.67Å; C333-C342 WeakPolarHBondContact CB-SG 2.99Å; C333-C342 VanDerWaalsContact SG-CA 3.5Å; C333-C342 WeakPolarHBondContact SG-CB 2.85Å; C333-C342 CovalentContact SG-SG 2.03Å; C333-C342 PolarHBondContact SG-SG 3.34Å; Y337-C342 HydrophobicContact CD1-CB 4.29Å; Y337-C342 HydrophobicContact CE1-CB 4.08Å; C342-K362 PolarHBondContact O-N 3.03Å
343	V	97.1	Very high	95.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	112.5	155.4	179.8	0	0	0	0	106.4	G335 R336 V338 I341 G345 K362 E364	G335-V343 WeakPolarHBondContact CA-O 3.44Å; R336-V343 HydrophobicContact CG-CB 4.2Å; R336-V343 PolarHBondContact N-O 2.99Å; R336-V343 VanDerWaalsContact N-O 3.15Å; R336-V343 PolarHBondContact O-N 3.09Å; V338-V343 HydrophobicContact CB-CG2 4.21Å; V338-V343 HydrophobicContact CG2-CG2 3.71Å; I341-V343 PolarHBondContact O-N 3.36Å; V343-G345 PolarHBondContact O-N 3.45Å; V343-K362 WeakPolarHBondContact CA-O 3.46Å; V343-K362 HydrophobicContact CG2-CD 4.31Å; V343-K362 HydrophobicContact CG2-CG 4.41Å; V343-E364 HydrophobicContact CG1-CB 3.85Å; V343-E364 HydrophobicContact CG1-CG 3.86Å; V343-E364 HydrophobicContact CG2-CG 4.25Å
344	Y	96.8	Very high	95	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.008	21%	0.211	C	C	.	.			trans	-62.1	133.9	-171.9	-64.5	-61.6	0	0	0	112.1	A319 I320 K321 D348 W351 L352 A360 Y361 K362 F363	A319-Y344 PolarHBondContact O-OH 2.69Å; I320-Y344 WeakPolarHBondContact CA-OH 3.3Å; K321-Y344 HydrophobicContact CB-CE1 4.22Å; K321-Y344 HydrophobicContact CD-CE1 4.02Å; K321-Y344 HydrophobicContact CG-CE1 3.93Å; K321-Y344 PolarHBondContact N-OH 2.93Å; Y344-D348 HydrophobicContact CD1-CB 3.7Å; Y344-D348 HydrophobicContact CG-CB 4.35Å; Y344-W351 HydrophobicContact CE1-CE3 4.19Å; Y344-W351 AromaticContact CE1-CZ3 3.93Å; Y344-W351 HydrophobicContact CE1-CZ3 3.93Å; Y344-W351 AromaticContact CZ-CZ3 3.96Å; Y344-W351 WeakPolarHBondContact OH-CZ3 3.39Å; Y344-L352 HydrophobicContact CD1-CD1 4.33Å; Y344-L352 HydrophobicContact CD1-CD2 4.35Å; Y344-L352 HydrophobicContact CD1-CG 4.47Å; Y344-L352 HydrophobicContact CD2-CD1 4.21Å; Y344-L352 HydrophobicContact CD2-CD2 4.15Å; Y344-L352 HydrophobicContact CE1-CD2 4.01Å; Y344-L352 HydrophobicContact CE1-CG 4.49Å; Y344-L352 HydrophobicContact CE2-CD2 3.77Å; Y344-L352 HydrophobicContact CG-CD1 4.03Å; Y344-L352 HydrophobicContact CG-CD2 4.42Å; Y344-A360 HydrophobicContact CE2-CB 4.04Å; Y344-Y361 VanDerWaalsContact CE2-O 3.24Å; Y344-Y361 WeakPolarHBondContact CE2-O 3.26Å; Y344-Y361 PolarHBondContact OH-O 3.2Å; Y344-K362 WeakPolarHBondContact CD2-O 3.3Å; Y344-K362 PolarHBondContact N-O 3.45Å; Y344-F363 HydrophobicContact CD2-CD1 4.07Å; Y344-F363 AromaticContact CD2-CE1 3.59Å; Y344-F363 HydrophobicContact CD2-CE1 3.59Å; Y344-F363 HydrophobicContact CD2-CE2 4.31Å; Y344-F363 AromaticContact CD2-CZ 3.73Å; Y344-F363 HydrophobicContact CD2-CZ 3.73Å; Y344-F363 HydrophobicContact CE2-CE1 4.49Å; Y344-F363 HydrophobicContact CE2-CZ 4.2Å; Y344-F363 HydrophobicContact CG-CE1 4.2Å
345	G	94.7	Very high	95	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.198	C	C	.	.			trans	-102.5	174.6	169.8	0	0	0	0	0	112.2	V343 G347 D348	V343-G345 PolarHBondContact O-N 3.45Å; G345-G347 PolarHBondContact O-N 3Å; G345-G347 VanDerWaalsContact O-N 3.13Å; G345-D348 PolarHBondContact N-OD2 3.35Å; G345-D348 WeakPolarHBondContact O-CB 3.48Å; G345-D348 PolarHBondContact O-N 3.16Å
346	P	92.6	Very high	95.1	Very high	15 Å²	15	39.6 Å²	39.6	10%	0.097	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-55.2	-32.7	179.8	-28.2	35.7	0	0	0	114.1	L56 A67 D348 L349 V371	L56-P346 HydrophobicContact CD1-CB 4.1Å; L56-P346 HydrophobicContact CD2-CB 3.67Å; A67-P346 HydrophobicContact CB-CB 3.94Å; A67-P346 HydrophobicContact CB-CG 3.88Å; P346-D348 PolarHBondContact O-N 2.88Å; P346-L349 WeakPolarHBondContact O-CB 3.43Å; P346-L349 WeakPolarHBondContact O-CG 3.34Å; P346-L349 PolarHBondContact O-N 2.95Å; P346-V371 HydrophobicContact CG-CG2 4.08Å
347	G	94.2	Very high	95.2	Very high	26 Å²	26	35.8 Å²	35.8	27%	0.268	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-70.5	-12.5	176.9	0	0	0	0	0	114.9	G345	G345-G347 PolarHBondContact O-N 3Å; G345-G347 VanDerWaalsContact O-N 3.13Å
348	D	96.3	Very high	95.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-86.3	-9.5	177.5	-66.4	-64.8	0	0	0	112.7	K321 K334 G335 Y344 G345 P346 W351 L352	K321-D348 IonicContact NZ-OD1 3.87Å; K321-D348 PolarHBondContact NZ-OD1 3.43Å; K334-D348 WeakPolarHBondContact CA-OD2 3.37Å; K334-D348 WeakPolarHBondContact CB-OD2 3.39Å; K334-D348 WeakPolarHBondContact CG-OD1 3.29Å; K334-D348 PolarHBondContact N-OD1 3.14Å; K334-D348 PolarHBondContact N-OD2 3.23Å; G335-D348 PolarHBondContact N-OD2 2.99Å; G335-D348 VanDerWaalsContact N-OD2 3.16Å; Y344-D348 HydrophobicContact CD1-CB 3.7Å; Y344-D348 HydrophobicContact CG-CB 4.35Å; G345-D348 PolarHBondContact N-OD2 3.35Å; G345-D348 WeakPolarHBondContact O-CB 3.48Å; G345-D348 PolarHBondContact O-N 3.16Å; P346-D348 PolarHBondContact O-N 2.88Å; D348-W351 WeakPolarHBondContact O-CB 3.11Å; D348-W351 PolarHBondContact O-N 3.13Å; D348-W351 VanDerWaalsContact O-N 3.14Å; D348-L352 WeakPolarHBondContact O-CG 3.4Å; D348-L352 PolarHBondContact O-N 3.29Å
349	L	95.7	Very high	95.5	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56.2	-42.4	-177.8	-73.6	170.9	0	0	0	113.9	L56 F57 P346 W351 L352 T353 V371 C374 L375	L56-L349 HydrophobicContact CB-CD1 3.69Å; L56-L349 HydrophobicContact CD1-CD1 3.93Å; L56-L349 HydrophobicContact CG-CD1 4.35Å; F57-L349 HydrophobicContact CD1-CB 3.88Å; F57-L349 HydrophobicContact CE1-CB 3.98Å; F57-L349 HydrophobicContact CE1-CD1 4.48Å; F57-L349 HydrophobicContact CE1-CD2 3.76Å; F57-L349 HydrophobicContact CE1-CG 4.29Å; F57-L349 HydrophobicContact CZ-CD2 4.22Å; P346-L349 WeakPolarHBondContact O-CB 3.43Å; P346-L349 WeakPolarHBondContact O-CG 3.34Å; P346-L349 PolarHBondContact O-N 2.95Å; L349-W351 PolarHBondContact O-N 3.11Å; L349-L352 HydrophobicContact CD2-CD1 4.42Å; L349-L352 PolarHBondContact O-N 3.4Å; L349-T353 WeakPolarHBondContact O-CG2 3.46Å; L349-T353 PolarHBondContact O-N 3.02Å; L349-T353 PolarHBondContact O-OG1 3.23Å; L349-V371 HydrophobicContact CD2-CG1 3.93Å; L349-V371 HydrophobicContact CG-CG1 4.44Å; L349-C374 HydrophobicContact CD1-CB 3.87Å; L349-C374 HydrophobicContact CD2-CB 4.43Å; L349-L375 HydrophobicContact CD2-CD1 4.26Å; L349-L375 HydrophobicContact CD2-CD2 3.84Å; L349-L375 HydrophobicContact CD2-CG 3.66Å
350	P	96.1	Very high	95.9	Very high	27 Å²	27	25.7 Å²	25.7	18%	0.175	15%	0.146	C	C	.	.	H	α-helix	trans	-57.5	-46.6	174.4	-26.4	35.8	0	0	0	112.7	L56 L352 T353 Q354	L56-P350 WeakPolarHBondContact O-CD 3.46Å; L56-P350 VanDerWaalsContact O-CG 3.3Å; L56-P350 WeakPolarHBondContact O-CG 3.45Å; P350-L352 VanDerWaalsContact C-N 3.34Å; P350-L352 PolarHBondContact O-N 3.35Å; P350-T353 PolarHBondContact O-N 3.36Å; P350-T353 PolarHBondContact O-OG1 3.24Å; P350-Q354 WeakPolarHBondContact O-CG 3.18Å; P350-Q354 PolarHBondContact O-N 2.97Å
351	W	96.5	Very high	96.1	Very high	55 Å²	55	22 Å²	22	21%	0.208	13%	0.125	C	C	.	.	H	α-helix	trans	-62.1	-41.6	179.2	-176.8	91.1	0	0	0	111.7	A319 K321 Y344 D348 L349 T353 Q354 S355	A319-W351 HydrophobicContact CB-CH2 3.92Å; A319-W351 HydrophobicContact CB-CZ3 3.86Å; K321-W351 HydrophobicContact CD-CD2 4.37Å; K321-W351 HydrophobicContact CD-CE3 4.41Å; K321-W351 VanDerWaalsContact CE-CG 3.46Å; K321-W351 HydrophobicContact CG-CD2 4.32Å; K321-W351 HydrophobicContact CG-CE3 4.22Å; K321-W351 HydrophobicContact CG-CH2 3.8Å; K321-W351 HydrophobicContact CG-CZ2 3.89Å; K321-W351 HydrophobicContact CG-CZ3 3.98Å; Y344-W351 HydrophobicContact CE1-CE3 4.19Å; Y344-W351 AromaticContact CE1-CZ3 3.93Å; Y344-W351 HydrophobicContact CE1-CZ3 3.93Å; Y344-W351 AromaticContact CZ-CZ3 3.96Å; Y344-W351 WeakPolarHBondContact OH-CZ3 3.39Å; D348-W351 WeakPolarHBondContact O-CB 3.11Å; D348-W351 PolarHBondContact O-N 3.13Å; D348-W351 VanDerWaalsContact O-N 3.14Å; L349-W351 PolarHBondContact O-N 3.11Å; W351-T353 PolarHBondContact O-N 3.47Å; W351-Q354 PolarHBondContact O-N 2.93Å; W351-S355 PolarHBondContact O-N 3.08Å; W351-S355 VanDerWaalsContact O-N 3.14Å
352	L	96.6	Very high	96.1	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62	-41.7	176.9	-71.9	170.3	0	0	0	112.3	Y344 D348 L349 P350 Q354 S355 A360 F363 L375	Y344-L352 HydrophobicContact CD1-CD1 4.33Å; Y344-L352 HydrophobicContact CD1-CD2 4.35Å; Y344-L352 HydrophobicContact CD1-CG 4.47Å; Y344-L352 HydrophobicContact CD2-CD1 4.21Å; Y344-L352 HydrophobicContact CD2-CD2 4.15Å; Y344-L352 HydrophobicContact CE1-CD2 4.01Å; Y344-L352 HydrophobicContact CE1-CG 4.49Å; Y344-L352 HydrophobicContact CE2-CD2 3.77Å; Y344-L352 HydrophobicContact CG-CD1 4.03Å; Y344-L352 HydrophobicContact CG-CD2 4.42Å; D348-L352 WeakPolarHBondContact O-CG 3.4Å; D348-L352 PolarHBondContact O-N 3.29Å; L349-L352 HydrophobicContact CD2-CD1 4.42Å; L349-L352 PolarHBondContact O-N 3.4Å; P350-L352 VanDerWaalsContact C-N 3.34Å; P350-L352 PolarHBondContact O-N 3.35Å; L352-Q354 VanDerWaalsContact C-N 3.3Å; L352-Q354 PolarHBondContact O-N 2.72Å; L352-S355 WeakPolarHBondContact O-CB 2.9Å; L352-S355 PolarHBondContact O-N 3.49Å; L352-A360 HydrophobicContact CD2-CB 3.5Å; L352-F363 HydrophobicContact CD1-CE1 3.99Å; L352-F363 HydrophobicContact CD1-CZ 4.11Å; L352-L375 HydrophobicContact CD1-CD1 4.07Å
353	T	91.8	Very high	96	Very high	44 Å²	44	22 Å²	22	27%	0.27	13%	0.125	S	C	.	.	H	α-helix	trans	-70.6	-24.5	179.7	57.4	0	0	0	0	114.3	F57 L349 P350 W351	F57-T353 HydrophobicContact CD1-CG2 3.34Å; F57-T353 HydrophobicContact CE1-CG2 3.48Å; F57-T353 VanDerWaalsContact CE1-CG2 3.48Å; F57-T353 HydrophobicContact CG-CG2 4.38Å; L349-T353 WeakPolarHBondContact O-CG2 3.46Å; L349-T353 PolarHBondContact O-N 3.02Å; L349-T353 PolarHBondContact O-OG1 3.23Å; P350-T353 PolarHBondContact O-N 3.36Å; P350-T353 PolarHBondContact O-OG1 3.24Å; W351-T353 PolarHBondContact O-N 3.47Å
354	Q	94.2	Very high	95.7	Very high	157 Å²	157	22.9 Å²	22.9	73%	0.734	13%	0.129	S	C	*	.	H	α-helix	trans	-87.6	-14.5	177.1	-66.3	172.6	18.2	0	0	112.4	P350 W351 L352 S356	P350-Q354 WeakPolarHBondContact O-CG 3.18Å; P350-Q354 PolarHBondContact O-N 2.97Å; W351-Q354 PolarHBondContact O-N 2.93Å; L352-Q354 VanDerWaalsContact C-N 3.3Å; L352-Q354 PolarHBondContact O-N 2.72Å; Q354-S356 PolarHBondContact O-N 3.44Å
355	S	95.6	Very high	95	Very high	20 Å²	20	23.1 Å²	23.1	14%	0.14	13%	0.131	C	C	.	.			trans	-64.4	135.9	-179.4	-179	0	0	0	0	111.6	K212 W351 L352 S357	K212-S355 PolarHBondContact NZ-O 2.85Å; W351-S355 PolarHBondContact O-N 3.08Å; W351-S355 VanDerWaalsContact O-N 3.14Å; L352-S355 WeakPolarHBondContact O-CB 2.9Å; L352-S355 PolarHBondContact O-N 3.49Å; S355-S357 PolarHBondContact O-N 2.88Å; S355-S357 PolarHBondContact OG-N 3.01Å; S355-S357 PolarHBondContact OG-OG 2.91Å
356	S	95.6	Very high	94.3	Very high	74 Å²	74	26.1 Å²	26.1	52%	0.517	15%	0.152	S	C	.	.			trans	-81.8	-1.2	173.2	61.9	0	0	0	0	113.2	N316 Q354	N316-S356 PolarHBondContact ND2-OG 3.14Å; Q354-S356 PolarHBondContact O-N 3.44Å
357	S	97.7	Very high	93.6	Very high	10 Å²	10	28.4 Å²	28.4	7%	0.07	17%	0.165	C	C	.	.			trans	-71.2	159.9	179.1	-55	0	0	0	0	113	I211 K212 N316 A319 S355	I211-S357 VanDerWaalsContact CD1-O 3.25Å; I211-S357 WeakPolarHBondContact CD1-O 3.49Å; I211-S357 VanDerWaalsContact CG1-O 3.25Å; I211-S357 WeakPolarHBondContact CG1-O 3.22Å; K212-S357 WeakPolarHBondContact CG-O 3.24Å; K212-S357 PolarHBondContact NZ-O 3.27Å; N316-S357 CarbonylContact O-C 3.48Å; N316-S357 WeakPolarHBondContact O-CA 3.21Å; N316-S357 WeakPolarHBondContact O-CB 3.32Å; N316-S357 PolarHBondContact O-OG 3.45Å; A319-S357 PolarHBondContact N-OG 3.37Å; S355-S357 PolarHBondContact O-N 2.88Å; S355-S357 PolarHBondContact OG-N 3.01Å; S355-S357 PolarHBondContact OG-OG 2.91Å
358	L	98.4	Very high	92.9	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	16%	0.163	C	C	.	.	S	Bend	trans	-76.8	-45.7	178.8	-55.4	-178.3	0	0	0	111.6	I211 K212 I217 Y220 V262 N316	I211-L358 WeakPolarHBondContact CG1-O 3.43Å; I211-L358 PolarHBondContact N-O 3.42Å; K212-L358 HydrophobicContact CG-CD2 4.4Å; K212-L358 PolarHBondContact N-O 3.1Å; I217-L358 HydrophobicContact CG1-CD2 4.22Å; I217-L358 HydrophobicContact CG2-CD1 4.47Å; Y220-L358 HydrophobicContact CD1-CD1 4.25Å; Y220-L358 HydrophobicContact CD1-CD2 3.78Å; Y220-L358 HydrophobicContact CD1-CG 4.42Å; Y220-L358 HydrophobicContact CE1-CD2 4.38Å; Y220-L358 HydrophobicContact CG-CD2 3.97Å; V262-L358 HydrophobicContact CG2-CD1 4.21Å; N316-L358 PolarHBondContact O-N 2.78Å
359	F	98.7	Very high	92.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	164.1	-179	-66.6	-91.8	0	0	0	110.8	Y113 I131 I202 L204 F209 P210 I217 V317 R318 A319	Y113-F359 HydrophobicContact CE1-CE2 4.34Å; Y113-F359 AromaticContact CE1-CZ 3.73Å; Y113-F359 HydrophobicContact CE1-CZ 3.73Å; I131-F359 HydrophobicContact CG2-CE1 3.9Å; I131-F359 HydrophobicContact CG2-CZ 4.37Å; I202-F359 HydrophobicContact CD1-CE2 4.34Å; I202-F359 HydrophobicContact CG2-CD2 4.4Å; I202-F359 HydrophobicContact CG2-CE2 3.96Å; L204-F359 HydrophobicContact CD1-CD1 4.5Å; L204-F359 HydrophobicContact CD1-CE1 3.95Å; L204-F359 HydrophobicContact CD1-CZ 4.33Å; L204-F359 HydrophobicContact CD2-CD1 3.55Å; L204-F359 HydrophobicContact CD2-CD2 4.01Å; L204-F359 HydrophobicContact CD2-CE1 3.67Å; L204-F359 HydrophobicContact CD2-CE2 4.14Å; L204-F359 HydrophobicContact CD2-CG 3.76Å; L204-F359 HydrophobicContact CD2-CZ 3.99Å; L204-F359 HydrophobicContact CG-CE1 4.5Å; F209-F359 WeakPolarHBondContact O-CA 3.48Å; P210-F359 HydrophobicContact CB-CD1 3.98Å; P210-F359 HydrophobicContact CB-CE1 3.72Å; I217-F359 HydrophobicContact CD1-CE2 3.97Å; I217-F359 HydrophobicContact CD1-CZ 3.85Å; V317-F359 PolarHBondContact O-N 3.18Å; R318-F359 CarbonylContact C-O 3.53Å; R318-F359 WeakPolarHBondContact CA-O 3.14Å; A319-F359 PolarHBondContact N-O 3.23Å
360	A	98.3	Very high	91.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	148	174.3	0	0	0	0	0	111.9	D208 F209 I211 A319 Y344 L352 F363	D208-A360 WeakPolarHBondContact CA-O 3.18Å; F209-A360 PolarHBondContact N-O 2.93Å; F209-A360 VanDerWaalsContact N-O 3.14Å; F209-A360 PolarHBondContact O-N 3.39Å; I211-A360 HydrophobicContact CG2-CB 3.87Å; A319-A360 HydrophobicContact CB-CB 4.12Å; A319-A360 WeakPolarHBondContact O-CA 3.5Å; Y344-A360 HydrophobicContact CE2-CB 4.04Å; L352-A360 HydrophobicContact CD2-CB 3.5Å; A360-F363 HydrophobicContact CB-CE2 3.78Å; A360-F363 HydrophobicContact CB-CZ 3.76Å; A360-F363 VanDerWaalsContact O-CE2 3.31Å; A360-F363 WeakPolarHBondContact O-CE2 3.29Å
361	Y	97.3	Very high	91.5	Very high	16 Å²	16	29.4 Å²	29.4	6%	0.063	17%	0.165	C	C	.	.			trans	-142.5	129.7	176	176.3	-98.9	0	0	0	109.6	Q207 D208 A319 I320 I341 Y344	Q207-Y361 HydrophobicContact CB-CD2 4.35Å; Q207-Y361 HydrophobicContact CB-CE2 4.09Å; D208-Y361 WeakPolarHBondContact OD1-CB 3.41Å; A319-Y361 PolarHBondContact O-N 3.38Å; I320-Y361 HydrophobicContact CD1-CD1 4.2Å; I320-Y361 HydrophobicContact CG1-CD1 4.26Å; I320-Y361 HydrophobicContact CG2-CD1 4.43Å; I341-Y361 HydrophobicContact CD1-CE1 3.83Å; I341-Y361 HydrophobicContact CG2-CD1 4.03Å; I341-Y361 HydrophobicContact CG2-CE1 3.86Å; Y344-Y361 VanDerWaalsContact CE2-O 3.24Å; Y344-Y361 WeakPolarHBondContact CE2-O 3.26Å; Y344-Y361 PolarHBondContact OH-O 3.2Å
362	K	95.6	Very high	91.3	Very high	12 Å²	12	26.9 Å²	26.9	5%	0.052	16%	0.155	C	C	.	.			cis	-128	143.2	20.8	179.1	170.5	146.9	153.5	0	113.2	Q207 I341 C342 V343 Y344 E364	Q207-K362 HydrophobicContact CB-CG 3.93Å; Q207-K362 VanDerWaalsContact CD-CE 3.42Å; I341-K362 HydrophobicContact CG2-CB 4.4Å; C342-K362 PolarHBondContact O-N 3.03Å; V343-K362 WeakPolarHBondContact CA-O 3.46Å; V343-K362 HydrophobicContact CG2-CD 4.31Å; V343-K362 HydrophobicContact CG2-CG 4.41Å; Y344-K362 WeakPolarHBondContact CD2-O 3.3Å; Y344-K362 PolarHBondContact N-O 3.45Å; K362-E364 WeakPolarHBondContact CE-OE1 3.37Å; K362-E364 IonicContact NZ-OE1 2.75Å; K362-E364 PolarHBondContact NZ-OE1 3.18Å
363	F	95.3	Very high	91	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.009	16%	0.157	C	C	.	.			trans	-110.1	139.2	172.1	-57.3	-77.9	0	0	0	112.2	M123 Q207 F209 Y344 L352 A360 V371 V372 L375	M123-F363 HydrophobicContact CE-CB 3.89Å; M123-F363 HydrophobicContact CE-CD2 4.16Å; M123-F363 HydrophobicContact CE-CG 4.32Å; M123-F363 HydrophobicContact SD-CB 4.42Å; Q207-F363 WeakPolarHBondContact CB-O 3.48Å; Q207-F363 PolarHBondContact NE2-O 2.9Å; Q207-F363 WeakPolarHBondContact O-CD2 3.42Å; Q207-F363 PolarHBondContact O-N 2.67Å; F209-F363 HydrophobicContact CB-CD2 3.59Å; F209-F363 HydrophobicContact CB-CE2 3.32Å; F209-F363 HydrophobicContact CB-CZ 4.06Å; Y344-F363 HydrophobicContact CD2-CD1 4.07Å; Y344-F363 AromaticContact CD2-CE1 3.59Å; Y344-F363 HydrophobicContact CD2-CE1 3.59Å; Y344-F363 HydrophobicContact CD2-CE2 4.31Å; Y344-F363 AromaticContact CD2-CZ 3.73Å; Y344-F363 HydrophobicContact CD2-CZ 3.73Å; Y344-F363 HydrophobicContact CE2-CE1 4.49Å; Y344-F363 HydrophobicContact CE2-CZ 4.2Å; Y344-F363 HydrophobicContact CG-CE1 4.2Å; L352-F363 HydrophobicContact CD1-CE1 3.99Å; L352-F363 HydrophobicContact CD1-CZ 4.11Å; A360-F363 HydrophobicContact CB-CE2 3.78Å; A360-F363 HydrophobicContact CB-CZ 3.76Å; A360-F363 VanDerWaalsContact O-CE2 3.31Å; A360-F363 WeakPolarHBondContact O-CE2 3.29Å; F363-V371 HydrophobicContact CD1-CG1 3.83Å; F363-V371 HydrophobicContact CE1-CG1 3.63Å; F363-V372 HydrophobicContact CB-CG2 3.66Å; F363-V372 HydrophobicContact CD1-CG2 3.74Å; F363-V372 HydrophobicContact CG-CG2 3.74Å; F363-L375 HydrophobicContact CD1-CD1 4.41Å; F363-L375 HydrophobicContact CE1-CD1 3.41Å; F363-L375 VanDerWaalsContact CE1-CD1 3.41Å; F363-L375 HydrophobicContact CE2-CD1 4.44Å; F363-L375 HydrophobicContact CZ-CD1 3.43Å; F363-L375 VanDerWaalsContact CZ-CD1 3.43Å
364	E	91.7	Very high	91	Very high	19 Å²	19	25.1 Å²	25.1	9%	0.089	14%	0.144	C	C	.	.			trans	-132.4	83.7	168.7	-61	-158.9	143.7	0	0	109.5	K119 Q207 R336 V343 K362 S366 T367 D368	K119-E364 IonicContact NZ-OE1 3.77Å; Q207-E364 VanDerWaalsContact NE2-CG 3.34Å; Q207-E364 PolarHBondContact NE2-OE1 2.7Å; R336-E364 IonicContact CZ-OE2 2.68Å; R336-E364 IonicContact NH1-OE2 3.8Å; R336-E364 IonicContact NH2-OE2 3.63Å; R336-E364 PolarHBondContact NH2-OE2 3.37Å; V343-E364 HydrophobicContact CG1-CB 3.85Å; V343-E364 HydrophobicContact CG1-CG 3.86Å; V343-E364 HydrophobicContact CG2-CG 4.25Å; K362-E364 WeakPolarHBondContact CE-OE1 3.37Å; K362-E364 IonicContact NZ-OE1 2.75Å; K362-E364 PolarHBondContact NZ-OE1 3.18Å; E364-S366 PolarHBondContact O-N 3.47Å; E364-T367 PolarHBondContact O-N 3.41Å; E364-D368 PolarHBondContact O-N 2.9Å; E364-D368 VanDerWaalsContact O-N 3.08Å
365	P	82.6	Confident	91	Very high	7 Å²	7	18 Å²	18	5%	0.045	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-18.2	177.5	-29.6	35.1	0	0	0	115.2	E120 M123 T367 P369 V372	E120-P365 VanDerWaalsContact OE2-CD 3.27Å; E120-P365 WeakPolarHBondContact OE2-CD 3.33Å; M123-P365 HydrophobicContact CB-CG 4.05Å; M123-P365 HydrophobicContact CG-CG 4.12Å; M123-P365 HydrophobicContact SD-CG 3.48Å; M123-P365 WeakPolarHBondContact SD-CG 3.35Å; P365-T367 PolarHBondContact O-N 2.94Å; P365-P369 WeakPolarHBondContact O-CB 3.32Å; P365-P369 WeakPolarHBondContact O-CD 3.49Å; P365-V372 HydrophobicContact CG-CB 4.25Å; P365-V372 HydrophobicContact CG-CG2 3.82Å
366	S	80.1	Confident	90.9	Very high	62 Å²	62	17.4 Å²	17.4	43%	0.434	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.7	168.6	52.7	0	0	0	0	113.7	E120 E364	E120-S366 WeakPolarHBondContact OE1-CB 3.08Å; E120-S366 PolarHBondContact OE1-OG 3.4Å; E364-S366 PolarHBondContact O-N 3.47Å
367	T	77.9	Confident	90.7	Very high	63 Å²	63	14.9 Å²	14.9	39%	0.387	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-51.7	176.3	-47.9	0	0	0	0	111.3	R336 E364 P365	R336-T367 PolarHBondContact NH2-OG1 3.18Å; E364-T367 PolarHBondContact O-N 3.41Å; P365-T367 PolarHBondContact O-N 2.94Å
368	D	78.2	Confident	90.5	Very high	43 Å²	43	19.2 Å²	19.2	23%	0.23	10%	0.1	C	C	.	.			trans	-131.6	72	-170.4	-66.8	-70.6	0	0	0	111	E364 L370 V371	E364-D368 PolarHBondContact O-N 2.9Å; E364-D368 VanDerWaalsContact O-N 3.08Å; D368-L370 PolarHBondContact O-N 2.82Å; D368-V371 HydrophobicContact CB-CG2 4.03Å; D368-V371 PolarHBondContact O-N 2.87Å
369	P	80.9	Confident	90.4	Very high	26 Å²	26	19.8 Å²	19.8	17%	0.169	10%	0.103	C	C	.	.	H	α-helix	trans	-66	-24.9	-172.9	25.9	-34.2	0	0	0	113.7	T72 P365 V371 T373	T72-P369 HydrophobicContact CG2-CB 3.98Å; T72-P369 HydrophobicContact CG2-CG 3.98Å; T72-P369 WeakPolarHBondContact OG1-CB 3.31Å; T72-P369 WeakPolarHBondContact OG1-CG 3.32Å; P365-P369 WeakPolarHBondContact O-CB 3.32Å; P365-P369 WeakPolarHBondContact O-CD 3.49Å; P369-V371 VanDerWaalsContact C-N 3.28Å; P369-V371 PolarHBondContact O-N 3.33Å; P369-T373 WeakPolarHBondContact O-CB 3.37Å; P369-T373 PolarHBondContact O-N 3.04Å; P369-T373 VanDerWaalsContact O-N 3.13Å; P369-T373 PolarHBondContact O-OG1 3.45Å
370	L	87	Confident	90.3	Very high	5 Å²	5	20.2 Å²	20.2	3%	0.026	10%	0.104	C	C	.	.	H	α-helix	trans	-65.3	-31.2	-178	-170	65.6	0	0	0	112.5	L52 L56 A67 D368 T373 C374	L52-L370 HydrophobicContact CD2-CD2 3.68Å; L52-L370 HydrophobicContact CG-CD2 4.2Å; L56-L370 HydrophobicContact CD1-CD2 3.6Å; L56-L370 HydrophobicContact CD1-CG 4.21Å; A67-L370 HydrophobicContact CB-CD2 3.41Å; A67-L370 VanDerWaalsContact CB-CD2 3.41Å; D368-L370 PolarHBondContact O-N 2.82Å; L370-T373 PolarHBondContact O-N 3.42Å; L370-C374 WeakPolarHBondContact O-CB 3.3Å; L370-C374 PolarHBondContact O-N 3.25Å; L370-C374 PolarHBondContact O-SG 2.9Å
371	V	91.6	Very high	90.1	Very high	1 Å²	1	24 Å²	24	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-61.3	-53.5	-178.5	-177.1	0	0	0	0	110.7	P346 L349 F363 D368 P369 T373 C374 L375	P346-V371 HydrophobicContact CG-CG2 4.08Å; L349-V371 HydrophobicContact CD2-CG1 3.93Å; L349-V371 HydrophobicContact CG-CG1 4.44Å; F363-V371 HydrophobicContact CD1-CG1 3.83Å; F363-V371 HydrophobicContact CE1-CG1 3.63Å; D368-V371 HydrophobicContact CB-CG2 4.03Å; D368-V371 PolarHBondContact O-N 2.87Å; P369-V371 VanDerWaalsContact C-N 3.28Å; P369-V371 PolarHBondContact O-N 3.33Å; V371-T373 VanDerWaalsContact C-N 3.33Å; V371-T373 PolarHBondContact O-N 3.33Å; V371-C374 PolarHBondContact O-N 3.03Å; V371-L375 HydrophobicContact CG1-CD1 4.23Å; V371-L375 WeakPolarHBondContact O-CG 3.48Å; V371-L375 PolarHBondContact O-N 2.89Å
372	V	91.9	Very high	90	Very high	1 Å²	1	26 Å²	26	1%	0.006	13%	0.134	C	C	.	.	H	α-helix	trans	-66.9	-37.1	178.1	176.3	0	0	0	0	110.8	M123 Q126 F209 F363 P365 C374 L375 E376	M123-V372 HydrophobicContact CE-CG2 4.17Å; M123-V372 HydrophobicContact SD-CB 4.4Å; M123-V372 HydrophobicContact SD-CG1 3.87Å; M123-V372 HydrophobicContact SD-CG2 3.8Å; Q126-V372 HydrophobicContact CB-CG1 4.35Å; F209-V372 HydrophobicContact CD2-CG1 3.88Å; F209-V372 HydrophobicContact CE2-CG1 3.82Å; F209-V372 HydrophobicContact CZ-CG1 4.45Å; F363-V372 HydrophobicContact CB-CG2 3.66Å; F363-V372 HydrophobicContact CD1-CG2 3.74Å; F363-V372 HydrophobicContact CG-CG2 3.74Å; P365-V372 HydrophobicContact CG-CB 4.25Å; P365-V372 HydrophobicContact CG-CG2 3.82Å; V372-C374 PolarHBondContact O-N 2.94Å; V372-L375 PolarHBondContact O-N 2.66Å; V372-E376 WeakPolarHBondContact O-CB 3.13Å; V372-E376 PolarHBondContact O-N 3.42Å
373	T	89.8	Confident	90.1	Very high	7 Å²	7	26.1 Å²	26.1	4%	0.043	14%	0.136	C	C	.	.	H	α-helix	trans	-60.4	-46.6	177.1	-57.6	0	0	0	0	111.8	P369 L370 V371 E376 R377	P369-T373 WeakPolarHBondContact O-CB 3.37Å; P369-T373 PolarHBondContact O-N 3.04Å; P369-T373 VanDerWaalsContact O-N 3.13Å; P369-T373 PolarHBondContact O-OG1 3.45Å; L370-T373 PolarHBondContact O-N 3.42Å; V371-T373 VanDerWaalsContact C-N 3.33Å; V371-T373 PolarHBondContact O-N 3.33Å; T373-E376 PolarHBondContact O-N 3.13Å; T373-R377 WeakPolarHBondContact O-CB 3.43Å; T373-R377 WeakPolarHBondContact O-CG 3.2Å; T373-R377 PolarHBondContact O-N 3.02Å
374	C	91.9	Very high	90.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66.4	-43.8	177.4	-68	0	0	0	0	112.5	C53 F57 L349 L370 V371 V372 E376 R377 R378	C53-C374 WeakPolarHBondContact CA-SG 3.05Å; C53-C374 HydrophobicContact CB-CB 3.65Å; C53-C374 WeakPolarHBondContact CB-SG 3.42Å; C53-C374 WeakPolarHBondContact SG-CA 3.38Å; C53-C374 WeakPolarHBondContact SG-CB 3.46Å; C53-C374 CovalentContact SG-SG 2.03Å; C53-C374 PolarHBondContact SG-SG 3.29Å; F57-C374 HydrophobicContact CE2-CB 3.95Å; F57-C374 HydrophobicContact CZ-CB 3.87Å; F57-C374 WeakPolarHBondContact CZ-O 3.33Å; L349-C374 HydrophobicContact CD1-CB 3.87Å; L349-C374 HydrophobicContact CD2-CB 4.43Å; L370-C374 WeakPolarHBondContact O-CB 3.3Å; L370-C374 PolarHBondContact O-N 3.25Å; L370-C374 PolarHBondContact O-SG 2.9Å; V371-C374 PolarHBondContact O-N 3.03Å; V372-C374 PolarHBondContact O-N 2.94Å; C374-E376 VanDerWaalsContact C-N 3.35Å; C374-R377 PolarHBondContact O-N 3.22Å; C374-R378 WeakPolarHBondContact O-CB 3.33Å; C374-R378 PolarHBondContact O-N 2.73Å
375	L	94.3	Very high	90.4	Very high	9 Å²	9	35.2 Å²	35.2	5%	0.047	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-44.9	176.3	-73.3	171.2	0	0	0	111.4	F57 F209 I211 L349 L352 F363 V371 V372 R378 H379	F57-L375 HydrophobicContact CE1-CD2 4.14Å; F57-L375 HydrophobicContact CZ-CD2 4.4Å; F209-L375 HydrophobicContact CD1-CB 3.79Å; F209-L375 HydrophobicContact CD1-CD1 4.25Å; F209-L375 HydrophobicContact CE1-CB 3.77Å; I211-L375 HydrophobicContact CG2-CD2 4.49Å; L349-L375 HydrophobicContact CD2-CD1 4.26Å; L349-L375 HydrophobicContact CD2-CD2 3.84Å; L349-L375 HydrophobicContact CD2-CG 3.66Å; L352-L375 HydrophobicContact CD1-CD1 4.07Å; F363-L375 HydrophobicContact CD1-CD1 4.41Å; F363-L375 HydrophobicContact CE1-CD1 3.41Å; F363-L375 VanDerWaalsContact CE1-CD1 3.41Å; F363-L375 HydrophobicContact CE2-CD1 4.44Å; F363-L375 HydrophobicContact CZ-CD1 3.43Å; F363-L375 VanDerWaalsContact CZ-CD1 3.43Å; V371-L375 HydrophobicContact CG1-CD1 4.23Å; V371-L375 WeakPolarHBondContact O-CG 3.48Å; V371-L375 PolarHBondContact O-N 2.89Å; V372-L375 PolarHBondContact O-N 2.66Å; L375-R378 PolarHBondContact O-N 2.88Å; L375-H379 WeakPolarHBondContact O-CB 3.08Å; L375-H379 PolarHBondContact O-N 2.99Å
376	E	93.7	Very high	91.1	Very high	7 Å²	7	37 Å²	37	3%	0.033	18%	0.178	C	C	.	.	H	α-helix	trans	-63	-46	179.9	-174.4	174.2	-145.1	0	0	111.8	Q126 R129 F209 V372 T373 C374 H379 R380 F397	Q126-E376 WeakPolarHBondContact CA-OE1 3.36Å; Q126-E376 WeakPolarHBondContact CG-OE2 3.26Å; Q126-E376 PolarHBondContact NE2-OE2 3.32Å; R129-E376 IonicContact CZ-OE1 3.41Å; R129-E376 IonicContact CZ-OE2 2.86Å; R129-E376 IonicContact NE-OE1 2.66Å; R129-E376 PolarHBondContact NE-OE1 3.22Å; R129-E376 IonicContact NH2-OE1 3.56Å; R129-E376 PolarHBondContact NH2-OE1 3.06Å; R129-E376 IonicContact NH2-OE2 3.11Å; R129-E376 PolarHBondContact NH2-OE2 3.27Å; F209-E376 HydrophobicContact CE1-CB 4.24Å; F209-E376 HydrophobicContact CE2-CB 4.42Å; F209-E376 HydrophobicContact CZ-CB 3.59Å; F209-E376 HydrophobicContact CZ-CG 4.02Å; V372-E376 WeakPolarHBondContact O-CB 3.13Å; V372-E376 PolarHBondContact O-N 3.42Å; T373-E376 PolarHBondContact O-N 3.13Å; C374-E376 VanDerWaalsContact C-N 3.35Å; E376-H379 PolarHBondContact O-N 3.25Å; E376-R380 VanDerWaalsContact O-CB 3.32Å; E376-R380 WeakPolarHBondContact O-CB 3.42Å; E376-R380 PolarHBondContact O-N 2.98Å; E376-F397 HydrophobicContact CG-CE2 3.71Å; E376-F397 HydrophobicContact CG-CZ 3.78Å
377	R	92.2	Very high	91.9	Very high	21 Å²	21	35.2 Å²	35.2	8%	0.079	17%	0.167	C	C	.	.	H	α-helix	trans	-61.3	-48	176.2	-76.2	176.3	167.4	-93.3	-5.4	111.7	D50 T373 C374 R380 L381 F397 H398	D50-R377 WeakPolarHBondContact OD1-CD 3.33Å; D50-R377 IonicContact OD1-CZ 3.35Å; D50-R377 IonicContact OD1-NE 3.85Å; D50-R377 IonicContact OD1-NH1 2.8Å; D50-R377 PolarHBondContact OD1-NH1 2.98Å; D50-R377 IonicContact OD2-NH1 3.17Å; D50-R377 PolarHBondContact OD2-NH1 3.48Å; T373-R377 WeakPolarHBondContact O-CB 3.43Å; T373-R377 WeakPolarHBondContact O-CG 3.2Å; T373-R377 PolarHBondContact O-N 3.02Å; C374-R377 PolarHBondContact O-N 3.22Å; R377-R380 PolarHBondContact O-N 3.39Å; R377-L381 WeakPolarHBondContact O-CG 3.41Å; R377-L381 PolarHBondContact O-N 3.27Å; R377-F397 HydrophobicContact CG-CD2 4.15Å; R377-H398 PolarHBondContact NH2-O 3.45Å
378	R	93.4	Very high	92.9	Very high	101 Å²	101	37.5 Å²	37.5	38%	0.381	17%	0.173	S	C	.	.	H	α-helix	trans	-61.3	-47.2	176.9	-179.2	-179.1	178.6	116.2	-0.6	111.8	F57 C374 L375 L381 Q382	F57-R378 HydrophobicContact CE2-CB 3.69Å; F57-R378 HydrophobicContact CE2-CG 4.22Å; F57-R378 HydrophobicContact CZ-CB 3.72Å; F57-R378 VanDerWaalsContact CZ-CD 3.49Å; F57-R378 HydrophobicContact CZ-CG 4.23Å; C374-R378 WeakPolarHBondContact O-CB 3.33Å; C374-R378 PolarHBondContact O-N 2.73Å; L375-R378 PolarHBondContact O-N 2.88Å; R378-L381 PolarHBondContact O-N 3.29Å; R378-Q382 PolarHBondContact O-N 3.39Å
379	H	96.2	Very high	93.7	Very high	13 Å²	13	37.6 Å²	37.6	6%	0.06	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-48.7	179.3	-178.5	-80.6	0	0	0	110.7	A130 K212 L375 E376 L381 Q382 V383	A130-H379 PolarHBondContact O-CE1 3.08Å; K212-H379 PolarHBondContact O-NE2 3.16Å; L375-H379 WeakPolarHBondContact O-CB 3.08Å; L375-H379 PolarHBondContact O-N 2.99Å; E376-H379 PolarHBondContact O-N 3.25Å; H379-L381 PolarHBondContact O-N 3.02Å; H379-Q382 WeakPolarHBondContact O-CB 3.49Å; H379-Q382 PolarHBondContact O-N 3.11Å; H379-Q382 VanDerWaalsContact O-N 3.13Å; H379-V383 VanDerWaalsContact CE1-CG2 3.42Å; H379-V383 WeakPolarHBondContact CE1-CG2 3.24Å; H379-V383 WeakPolarHBondContact O-CG2 3.2Å; H379-V383 PolarHBondContact O-N 3.12Å
380	R	96	Very high	94.5	Very high	9 Å²	9	41.6 Å²	41.6	3%	0.034	20%	0.201	C	C	.	.	H	α-helix	trans	-57.8	-46.6	176.5	178.9	57.8	61.2	84.1	-6	112.3	H96 E376 R377 Q382 V383 L384 W395 F397	H96-R380 VanDerWaalsContact O-CZ 3.3Å; H96-R380 PolarHBondContact O-NH1 2.86Å; H96-R380 PolarHBondContact O-NH2 3.3Å; E376-R380 VanDerWaalsContact O-CB 3.32Å; E376-R380 WeakPolarHBondContact O-CB 3.42Å; E376-R380 PolarHBondContact O-N 2.98Å; R377-R380 PolarHBondContact O-N 3.39Å; R380-Q382 VanDerWaalsContact C-N 3.29Å; R380-Q382 PolarHBondContact O-N 3.03Å; R380-V383 PolarHBondContact O-N 3.48Å; R380-L384 HydrophobicContact CG-CD1 4.11Å; R380-L384 HydrophobicContact CG-CG 4.45Å; R380-L384 WeakPolarHBondContact O-CG 3.36Å; R380-L384 PolarHBondContact O-N 3.35Å; R380-W395 WeakPolarHBondContact CD-O 3.44Å; R380-W395 PolarHBondContact NH1-O 2.91Å; R380-F397 HydrophobicContact CB-CD2 3.91Å; R380-F397 HydrophobicContact CB-CE2 3.47Å; R380-F397 VanDerWaalsContact CB-CE2 3.47Å; R380-F397 HydrophobicContact CB-CZ 4.32Å; R380-F397 HydrophobicContact CG-CD2 3.9Å; R380-F397 HydrophobicContact CG-CE2 3.73Å; R380-F397 HydrophobicContact CG-CZ 4.34Å
381	L	94.6	Very high	94.9	Very high	81 Å²	81	44.7 Å²	44.7	42%	0.424	22%	0.217	S	C	.	.	H	α-helix	trans	-60	-40.8	177.3	-72.5	170.7	0	0	0	111.8	R377 R378 H379 R385	R377-L381 WeakPolarHBondContact O-CG 3.41Å; R377-L381 PolarHBondContact O-N 3.27Å; R378-L381 PolarHBondContact O-N 3.29Å; H379-L381 PolarHBondContact O-N 3.02Å; L381-R385 WeakPolarHBondContact O-CB 3.2Å; L381-R385 VanDerWaalsContact O-CG 3.24Å; L381-R385 WeakPolarHBondContact O-CG 3.28Å; L381-R385 PolarHBondContact O-N 3.18Å
382	Q	95.8	Very high	95.1	Very high	57 Å²	57	47.2 Å²	47.2	27%	0.266	23%	0.229	S	C	.	.	H	α-helix	trans	-67.6	-44.3	178.2	-170.8	170.6	-12.9	0	0	112	T213 E216 R378 H379 R380 L384 R385 Q386	T213-Q382 HydrophobicContact CG2-CB 4.11Å; T213-Q382 HydrophobicContact CG2-CG 3.72Å; E216-Q382 PolarHBondContact OE1-NE2 3.29Å; E216-Q382 PolarHBondContact OE2-NE2 3.36Å; R378-Q382 PolarHBondContact O-N 3.39Å; H379-Q382 WeakPolarHBondContact O-CB 3.49Å; H379-Q382 PolarHBondContact O-N 3.11Å; H379-Q382 VanDerWaalsContact O-N 3.13Å; R380-Q382 VanDerWaalsContact C-N 3.29Å; R380-Q382 PolarHBondContact O-N 3.03Å; Q382-L384 PolarHBondContact O-N 3.35Å; Q382-R385 PolarHBondContact O-N 3.38Å; Q382-Q386 WeakPolarHBondContact O-CG 3.26Å; Q382-Q386 PolarHBondContact O-N 3.38Å; Q382-Q386 VanDerWaalsContact O-N 3.16Å
383	V	97.7	Very high	95.1	Very high	14 Å²	14	52.6 Å²	52.6	9%	0.085	26%	0.264	C	S	.	.	H	α-helix	trans	-57.2	-48.8	174.7	169.1	0	0	0	0	111	I98 L102 T213 H379 R380 R385 Q386 A387	I98-V383 HydrophobicContact CD1-CG1 3.62Å; L102-V383 HydrophobicContact CD1-CG1 3.25Å; T213-V383 HydrophobicContact CG2-CG2 3.65Å; H379-V383 VanDerWaalsContact CE1-CG2 3.42Å; H379-V383 WeakPolarHBondContact CE1-CG2 3.24Å; H379-V383 WeakPolarHBondContact O-CG2 3.2Å; H379-V383 PolarHBondContact O-N 3.12Å; R380-V383 PolarHBondContact O-N 3.48Å; V383-R385 PolarHBondContact O-N 3.14Å; V383-Q386 PolarHBondContact O-N 2.91Å; V383-Q386 VanDerWaalsContact O-N 3.16Å; V383-A387 PolarHBondContact O-N 2.93Å
384	L	96.8	Very high	95.3	Very high	10 Å²	10	54 Å²	54	5%	0.052	27%	0.27	C	S	.	.	H	α-helix	trans	-68.9	-32.7	-178.7	-66.1	-178.8	0	0	0	112.9	I98 R380 Q382 Q386 A387 I391 W395	I98-L384 HydrophobicContact CD1-CD2 4.2Å; R380-L384 HydrophobicContact CG-CD1 4.11Å; R380-L384 HydrophobicContact CG-CG 4.45Å; R380-L384 WeakPolarHBondContact O-CG 3.36Å; R380-L384 PolarHBondContact O-N 3.35Å; Q382-L384 PolarHBondContact O-N 3.35Å; L384-Q386 PolarHBondContact O-N 2.9Å; L384-A387 WeakPolarHBondContact O-CB 3.31Å; L384-A387 PolarHBondContact O-N 2.86Å; L384-I391 HydrophobicContact CB-CD1 4.17Å; L384-I391 HydrophobicContact CD1-CG2 4.38Å; L384-I391 HydrophobicContact CD2-CG1 4.45Å; L384-I391 HydrophobicContact CD2-CG2 3.98Å; L384-W395 HydrophobicContact CD2-CB 4.12Å; L384-W395 HydrophobicContact CD2-CE3 4.06Å
385	R	96.9	Very high	95.4	Very high	203 Å²	203	54 Å²	54	77%	0.766	27%	0.27	S	S	*	.	H	α-helix	trans	-66.8	-26	172.8	-75.7	174	-168.6	171	4	113.2	L381 Q382 V383 A387	L381-R385 WeakPolarHBondContact O-CB 3.2Å; L381-R385 VanDerWaalsContact O-CG 3.24Å; L381-R385 WeakPolarHBondContact O-CG 3.28Å; L381-R385 PolarHBondContact O-N 3.18Å; Q382-R385 PolarHBondContact O-N 3.38Å; V383-R385 PolarHBondContact O-N 3.14Å; R385-A387 VanDerWaalsContact C-N 3.34Å
386	Q	96.9	Very high	95.3	Very high	44 Å²	44	57.6 Å²	57.6	21%	0.206	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-3.9	178.5	-70.4	172.2	-6.2	0	0	112.8	T213 R215 E216 Q382 V383 L384	T213-Q386 VanDerWaalsContact CB-OE1 3.28Å; T213-Q386 PolarHBondContact OG1-OE1 3.36Å; R215-Q386 PolarHBondContact NH1-O 3.14Å; E216-Q386 PolarHBondContact OE1-NE2 3.35Å; Q382-Q386 WeakPolarHBondContact O-CG 3.26Å; Q382-Q386 PolarHBondContact O-N 3.38Å; Q382-Q386 VanDerWaalsContact O-N 3.16Å; V383-Q386 PolarHBondContact O-N 2.91Å; V383-Q386 VanDerWaalsContact O-N 3.16Å; L384-Q386 PolarHBondContact O-N 2.9Å
387	A	97.4	Very high	95	Very high	25 Å²	25	58.9 Å²	58.9	21%	0.207	29%	0.292	C	S	.	.			trans	-70.5	132.7	-177.9	0	0	0	0	0	111.8	L102 V383 L384 R385 I391	L102-A387 HydrophobicContact CB-CB 4.23Å; L102-A387 HydrophobicContact CD1-CB 4.49Å; L102-A387 HydrophobicContact CD2-CB 4.12Å; V383-A387 PolarHBondContact O-N 2.93Å; L384-A387 WeakPolarHBondContact O-CB 3.31Å; L384-A387 PolarHBondContact O-N 2.86Å; R385-A387 VanDerWaalsContact C-N 3.34Å; A387-I391 HydrophobicContact CB-CG1 4.27Å
388	E	97.7	Very high	94.1	Very high	111 Å²	111	65 Å²	65	52%	0.519	32%	0.321	S	S	.	.	S	Bend	trans	-102.5	7.4	176.1	-63.1	172.1	-175.7	0	0	111.3	L102 S103 R215	L102-E388 PolarHBondContact O-N 3.24Å; S103-E388 VanDerWaalsContact CB-OE2 3.32Å; S103-E388 WeakPolarHBondContact CB-OE2 3.25Å; R215-E388 IonicContact CZ-OE1 3.39Å; R215-E388 IonicContact NH1-OE1 3.99Å; R215-E388 PolarHBondContact NH1-OE1 3.41Å; R215-E388 IonicContact NH2-OE1 2.79Å; R215-E388 PolarHBondContact NH2-OE1 2.86Å
389	V	95.8	Very high	92.7	Very high	45 Å²	45	67.4 Å²	67.4	27%	0.273	34%	0.337	S	S	.	.	S	Bend	trans	-121.9	158.2	179.3	-58.4	0	0	0	0	110.6	L102 I391	L102-V389 HydrophobicContact CD2-CG2 3.91Å; V389-I391 PolarHBondContact O-N 3.47Å
390	P	96.5	Very high	90.7	Very high	110 Å²	110	70.7 Å²	70.7	71%	0.714	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-56.3	130.4	173.1	-25.2	35	0	0	0	111.8
391	I	96.1	Very high	88.4	Confident	69 Å²	69	72.4 Å²	72.4	35%	0.354	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-81.9	130.6	-179.4	-62.1	165.2	0	0	0	109.5	L384 A387 V389 W395 H396	L384-I391 HydrophobicContact CB-CD1 4.17Å; L384-I391 HydrophobicContact CD1-CG2 4.38Å; L384-I391 HydrophobicContact CD2-CG1 4.45Å; L384-I391 HydrophobicContact CD2-CG2 3.98Å; A387-I391 HydrophobicContact CB-CG1 4.27Å; V389-I391 PolarHBondContact O-N 3.47Å; I391-W395 HydrophobicContact CB-CE3 4.48Å; I391-W395 HydrophobicContact CG2-CE3 4.02Å; I391-H396 VanDerWaalsContact CG2-NE2 3.31Å; I391-H396 WeakPolarHBondContact CG2-NE2 3.37Å
392	E	95.1	Very high	86.1	Confident	54 Å²	54	73.8 Å²	73.8	25%	0.252	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-80.9	139.6	174.5	-61.7	-170.5	-147	0	0	111.3	R100 H394 W395	R100-E392 WeakPolarHBondContact CD-OE1 3.21Å; E392-H394 PolarHBondContact O-N 2.97Å; E392-H394 VanDerWaalsContact O-N 3.14Å; E392-H394 IonicContact OE2-CE1 2.74Å; E392-H394 PolarHBondContact OE2-CE1 3.04Å; E392-H394 IonicContact OE2-ND1 3.38Å; E392-H394 PolarHBondContact OE2-ND1 3.42Å; E392-W395 HydrophobicContact CB-CD2 3.85Å; E392-W395 HydrophobicContact CB-CE3 4.36Å; E392-W395 HydrophobicContact CB-CG 4.15Å; E392-W395 HydrophobicContact CB-CZ2 4.05Å; E392-W395 HydrophobicContact CG-CD2 4.37Å; E392-W395 HydrophobicContact CG-CH2 4Å; E392-W395 HydrophobicContact CG-CZ2 3.66Å; E392-W395 WeakPolarHBondContact O-CB 3.49Å; E392-W395 PolarHBondContact O-N 3.28Å; E392-W395 WeakPolarHBondContact OE1-CZ2 3.27Å
393	P	93.3	Very high	83.5	Confident	115 Å²	115	78 Å²	78	75%	0.747	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-55.3	-38	-176.1	-28.4	34.9	0	0	0	113.8	W395 H396	P393-W395 PolarHBondContact O-N 3.32Å; P393-H396 PolarHBondContact O-N 3.02Å
394	H	92.8	Very high	80.6	Confident	35 Å²	35	84.2 Å²	84.2	16%	0.162	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-72.2	-8.9	-178.7	78.9	-91.6	0	0	0	113.5	Q93 H96 E392 H396	Q93-H394 HydrophobicContact CB-CB 4.44Å; H96-H394 WeakPolarHBondContact CA-O 3.48Å; H96-H394 VanDerWaalsContact CB-O 3.3Å; H96-H394 WeakPolarHBondContact CB-O 3.27Å; H96-H394 PolarHBondContact ND1-O 3.45Å; E392-H394 PolarHBondContact O-N 2.97Å; E392-H394 VanDerWaalsContact O-N 3.14Å; E392-H394 IonicContact OE2-CE1 2.74Å; E392-H394 PolarHBondContact OE2-CE1 3.04Å; E392-H394 IonicContact OE2-ND1 3.38Å; E392-H394 PolarHBondContact OE2-ND1 3.42Å; H394-H396 VanDerWaalsContact C-N 3.3Å
395	W	94.8	Very high	77.5	Confident	0 Å²	0	90.6 Å²	90.6	0%	0	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-78.4	-16.7	172.4	-60.5	-13.3	0	0	0	112.5	F97 I98 R100 L102 R380 L384 I391 E392 P393	F97-W395 PolarHBondContact O-NE1 3.48Å; I98-W395 HydrophobicContact CG1-CB 4.32Å; I98-W395 HydrophobicContact CG1-CD2 4.24Å; I98-W395 HydrophobicContact CG1-CG 4.06Å; I98-W395 HydrophobicContact CG2-CD2 4.24Å; I98-W395 HydrophobicContact CG2-CE3 4.35Å; I98-W395 HydrophobicContact CG2-CH2 4.44Å; I98-W395 HydrophobicContact CG2-CZ2 4.3Å; I98-W395 HydrophobicContact CG2-CZ3 4.46Å; R100-W395 HydrophobicContact CB-CH2 3.98Å; R100-W395 HydrophobicContact CB-CZ2 4.06Å; R100-W395 HydrophobicContact CG-CH2 4.42Å; R100-W395 HydrophobicContact CG-CZ2 4.17Å; L102-W395 HydrophobicContact CD2-CE3 4.2Å; L102-W395 HydrophobicContact CD2-CH2 4.12Å; L102-W395 HydrophobicContact CD2-CZ3 3.57Å; R380-W395 WeakPolarHBondContact CD-O 3.44Å; R380-W395 PolarHBondContact NH1-O 2.91Å; L384-W395 HydrophobicContact CD2-CB 4.12Å; L384-W395 HydrophobicContact CD2-CE3 4.06Å; I391-W395 HydrophobicContact CB-CE3 4.48Å; I391-W395 HydrophobicContact CG2-CE3 4.02Å; E392-W395 HydrophobicContact CB-CD2 3.85Å; E392-W395 HydrophobicContact CB-CE3 4.36Å; E392-W395 HydrophobicContact CB-CG 4.15Å; E392-W395 HydrophobicContact CB-CZ2 4.05Å; E392-W395 HydrophobicContact CG-CD2 4.37Å; E392-W395 HydrophobicContact CG-CH2 4Å; E392-W395 HydrophobicContact CG-CZ2 3.66Å; E392-W395 WeakPolarHBondContact O-CB 3.49Å; E392-W395 PolarHBondContact O-N 3.28Å; E392-W395 WeakPolarHBondContact OE1-CZ2 3.27Å; P393-W395 PolarHBondContact O-N 3.32Å
396	H	91.3	Very high	74.4	Confident	86 Å²	86	91.4 Å²	91.4	40%	0.398	45%	0.454	S	S	.	.	S	Bend	trans	-77.1	138	172.7	-69.8	-87.8	0	0	0	110.4	H96 I391 P393 H394	H96-H396 PolarHBondContact CE1-O 3.42Å; H96-H396 PolarHBondContact ND1-O 3.11Å; H96-H396 VanDerWaalsContact ND1-O 3.11Å; I391-H396 VanDerWaalsContact CG2-NE2 3.31Å; I391-H396 WeakPolarHBondContact CG2-NE2 3.37Å; P393-H396 PolarHBondContact O-N 3.02Å; H394-H396 VanDerWaalsContact C-N 3.3Å
397	F	87.8	Confident	71.3	Confident	33 Å²	33	96.5 Å²	96.5	15%	0.145	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-73.1	140.6	158.6	-59.8	-45.9	0	0	0	108.5	H96 E376 R377 R380 Q399	H96-F397 HydrophobicContact CB-CD1 4.07Å; H96-F397 HydrophobicContact CB-CE1 3.85Å; H96-F397 AromaticContact CD2-CD1 3.89Å; H96-F397 AromaticContact CG-CD1 3.99Å; E376-F397 HydrophobicContact CG-CE2 3.71Å; E376-F397 HydrophobicContact CG-CZ 3.78Å; R377-F397 HydrophobicContact CG-CD2 4.15Å; R380-F397 HydrophobicContact CB-CD2 3.91Å; R380-F397 HydrophobicContact CB-CE2 3.47Å; R380-F397 VanDerWaalsContact CB-CE2 3.47Å; R380-F397 HydrophobicContact CB-CZ 4.32Å; R380-F397 HydrophobicContact CG-CD2 3.9Å; R380-F397 HydrophobicContact CG-CE2 3.73Å; R380-F397 HydrophobicContact CG-CZ 4.34Å; F397-Q399 PolarHBondContact O-N 3.09Å; F397-Q399 VanDerWaalsContact O-N 3.11Å
398	H	73.8	Confident	68.1	Low	149 Å²	149	102.5 Å²	102.5	69%	0.69	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-57.8	121.3	176.5	-71.9	-71.6	0	0	0	110.1	R377 Q400	R377-H398 PolarHBondContact NH2-O 3.45Å; H398-Q400 PolarHBondContact O-N 3.34Å
399	Q	63.8	Low	65.1	Low	153 Å²	153	112.2 Å²	112.2	72%	0.715	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-72.9	119.7	175	-144.4	174.5	3.6	0	0	107.3	D50 F397 S401	D50-Q399 WeakPolarHBondContact OD2-CG 3.42Å; F397-Q399 PolarHBondContact O-N 3.09Å; F397-Q399 VanDerWaalsContact O-N 3.11Å; Q399-S401 PolarHBondContact O-N 3.44Å
400	Q	55	Low	63.5	Low	82 Å²	82	115.6 Å²	115.6	38%	0.383	56%	0.556	S	S	.	*			trans	-97.5	84.2	173.6	-71.3	179.8	-11.7	0	0	105.7	P49 H398	P49-Q400 VanDerWaalsContact CD-OE1 3.24Å; P49-Q400 HydrophobicContact CG-CB 4.14Å; P49-Q400 VanDerWaalsContact CG-OE1 3.29Å; H398-Q400 PolarHBondContact O-N 3.34Å
401	S	46.8	Very low	61.8	Low	45 Å²	45	115.8 Å²	115.8	32%	0.315	55%	0.547	S	S	.	.			trans	-123.8	115.3	174.8	70.1	0	0	0	0	109.6	Q399	Q399-S401 PolarHBondContact O-N 3.44Å
402	H	45.3	Very low	59.9	Low	109 Å²	109	118.4 Å²	118.4	51%	0.505	56%	0.558	S	S	.	*			trans	-83.6	-10.8	176.8	-90.2	-99.2	0	0	0	114	F47 Y48 N404	F47-H402 AromaticContact CD1-CD2 3.23Å; F47-H402 WeakPolarHBondContact CD1-CD2 3.22Å; F47-H402 AromaticContact CD1-CE1 3.73Å; F47-H402 AromaticContact CD1-NE2 2.83Å; F47-H402 WeakPolarHBondContact CD1-NE2 3.38Å; F47-H402 AromaticContact CE1-CD2 3.94Å; F47-H402 AromaticContact CE1-CE1 3.65Å; F47-H402 AromaticContact CE1-NE2 3.05Å; F47-H402 WeakPolarHBondContact CE1-NE2 3.42Å; F47-H402 AromaticContact CG-CD2 3.47Å; F47-H402 VanDerWaalsContact CG-CD2 3.47Å; F47-H402 WeakPolarHBondContact CG-CD2 3.49Å; F47-H402 AromaticContact CG-NE2 3.47Å; F47-H402 WeakPolarHBondContact CG-NE2 3.5Å; F47-H402 AromaticContact CZ-NE2 3.86Å; Y48-H402 HydrophobicContact CE1-CB 3.83Å; Y48-H402 WeakPolarHBondContact OH-CB 3.44Å; H402-N404 PolarHBondContact O-N 3.08Å
403	F	42.4	Very low	57.8	Low	147 Å²	147	122.2 Å²	122.2	65%	0.645	58%	0.576	S	S	*	*			trans	-86.5	53.2	175.9	-68.2	-75.5	0	0	0	112.6	Y48 M405	Y48-F403 AromaticContact CE1-CD2 3.92Å; Y48-F403 HydrophobicContact CE1-CD2 3.92Å; Y48-F403 AromaticContact CE1-CE2 3.85Å; Y48-F403 HydrophobicContact CE1-CE2 3.85Å; F403-M405 PolarHBondContact O-N 2.93Å
404	N	36.4	Very low	55.6	Low	143 Å²	143	122.7 Å²	122.7	77%	0.765	57%	0.565	S	S	*	*			trans	-87.5	61.8	158.9	-116.4	-14.3	0	0	0	108.8	H402 R406	H402-N404 PolarHBondContact O-N 3.08Å; N404-R406 PolarHBondContact O-N 3.43Å
405	M	31.4	Very low	53.1	Low	145 Å²	145	128.5 Å²	128.5	71%	0.714	59%	0.592	S	S	*	*			trans	-72.9	91.1	159	-82.6	-165.3	-68.6	0	0	106.9	F403 L407	F403-M405 PolarHBondContact O-N 2.93Å; M405-L407 PolarHBondContact O-N 3.07Å
406	R	31.4	Very low	50.1	Low	220 Å²	220	137.7 Å²	137.7	83%	0.83	64%	0.635	S	S	*	*			trans	-56.1	96.1	145.2	-82.2	-176.3	178	178	-0.7	105.7	N404 N408	N404-R406 PolarHBondContact O-N 3.43Å; R406-N408 PolarHBondContact O-N 3.22Å
407	L	32.2	Very low	47	Very low	150 Å²	150	141.7 Å²	141.7	79%	0.785	65%	0.653	S	S	*	*			trans	-62.6	96.6	156.9	-83.2	158.7	0	0	0	105	M405 R409	M405-L407 PolarHBondContact O-N 3.07Å; L407-R409 PolarHBondContact O-N 3.07Å
408	N	30.7	Very low	43.6	Very low	151 Å²	151	150.8 Å²	150.8	81%	0.807	70%	0.695	S	S	*	*			trans	-52.6	110.7	159.1	-76.1	-15.3	0	0	0	106.1	R406	R406-N408 PolarHBondContact O-N 3.22Å
409	R	33.5	Very low	40.8	Very low	315 Å²	315	150.9 Å²	150.9	100%	1.189	70%	0.696	S	S	*	*			trans	-96.6	0	157.2	-91.7	-170.5	178.5	-176.6	0.5	108.2	L407	L407-R409 PolarHBondContact O-N 3.07Å

Retrieved 409 of 409 residues in 569.3 ms (Link to these results)

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