RANBM_ARATH Loading...

Isoform 2 of Ran-binding protein M homolog AlphaSync

Canonical isoform description:

AlphaFold DB , UniProt , Accession F4HYD7-2 (canonical: F4HYD7), Species ARATH (Arabidopsis thaliana, Mouse-ear cress), Gene RANBPM, Length 465 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.3	Very low	32.1	Very low	241 Å²	241	134.9 Å²	134.9	100%	1.187	85%	0.853	S	S	*	*				0	120.7	0	-84.9	177.7	174.9	0	0	108.2
2	N	37.8	Very low	31.6	Very low	160 Å²	160	138.2 Å²	138.2	86%	0.856	86%	0.86	S	S	*	*			trans	56.5	104.3	165.2	-63.8	1.1	0	0	0	119.9
3	S	37.1	Very low	31.2	Very low	125 Å²	125	133.2 Å²	133.2	87%	0.874	85%	0.851	S	S	*	*				-157.6	142.5	124.8	12.3	0	0	0	0	110.4
4	S	33.8	Very low	30.7	Very low	117 Å²	117	134.6 Å²	134.6	82%	0.818	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-67.4	170.2	-163.5	-52	0	0	0	0	115.3
5	P	32.9	Very low	30.5	Very low	121 Å²	121	135.2 Å²	135.2	79%	0.786	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-79.7	166.3	-158	15.4	-4.9	0	0	0	115.6
6	P	33.4	Very low	30.3	Very low	117 Å²	117	134.3 Å²	134.3	76%	0.76	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-77.8	152.6	-166.2	31.2	-34.5	0	0	0	113.1
7	P	31.2	Very low	29.8	Very low	132 Å²	132	135.4 Å²	135.4	86%	0.857	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-73.3	139.7	177.2	6.7	6.5	0	0	0	111.5
8	A	30.5	Very low	29.6	Very low	100 Å²	100	137.2 Å²	137.2	83%	0.826	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-73.4	149	178.1	0	0	0	0	0	112.7	S10	A8-S10 PolarHBondContact O-N 3.36Å
9	N	24.8	Very low	29.4	Very low	171 Å²	171	132.6 Å²	132.6	91%	0.914	83%	0.829	S	S	*	*			trans	-39.7	123.9	170.3	-75.2	-23.4	0	0	0	114
10	S	30.1	Very low	29.3	Very low	116 Å²	116	136.2 Å²	136.2	81%	0.811	84%	0.835	S	S	*	*			trans	-106.1	102.4	148.9	61.7	0	0	0	0	108.4	A8	A8-S10 PolarHBondContact O-N 3.36Å
11	A	25	Very low	29.4	Very low	84 Å²	84	136.9 Å²	136.9	69%	0.694	83%	0.834	S	S	*	*			trans	-66.4	127.9	155.9	0	0	0	0	0	108.6
12	N	26.1	Very low	29.5	Very low	174 Å²	174	129.1 Å²	129.1	93%	0.93	82%	0.815	S	S	*	*			trans	169.6	126.6	147	-88	-12.3	0	0	0	109.4
13	G	26.3	Very low	30.1	Very low	73 Å²	73	129.4 Å²	129.4	75%	0.753	81%	0.811	S	S	*	*			trans	157.5	84.8	169	0	0	0	0	0	112.5	T15	G13-T15 PolarHBondContact O-N 3.03Å
14	D	24.5	Very low	31.4	Very low	154 Å²	154	126 Å²	126	82%	0.824	78%	0.784	S	S	*	*			trans	-41.3	125.5	171.3	-73.6	-48.8	0	0	0	113.1
15	T	28.1	Very low	33	Very low	143 Å²	143	123.4 Å²	123.4	88%	0.877	76%	0.76	S	S	*	*			trans	-122.3	83.8	156.3	27.5	0	0	0	0	107.6	G13 N17	G13-T15 PolarHBondContact O-N 3.03Å; T15-N17 PolarHBondContact O-N 3.44Å
16	T	26.1	Very low	35.2	Very low	120 Å²	120	118.3 Å²	118.3	74%	0.736	73%	0.726	S	S	*	*			trans	-67.2	121.1	162.8	39.1	0	0	0	0	109.2	N18	T16-N18 PolarHBondContact O-N 3.42Å
17	N	22.9	Very low	37.6	Very low	154 Å²	154	116.2 Å²	116.2	82%	0.824	71%	0.708	S	S	*	*			trans	17.1	97.5	146.8	-70.7	-16.9	0	0	0	117.4	T15	T15-N17 PolarHBondContact O-N 3.44Å
18	N	26	Very low	40.2	Very low	167 Å²	167	113.6 Å²	113.6	89%	0.893	69%	0.687	S	S	*	*			trans	-100.2	88.4	137.4	-84.8	-17.7	0	0	0	106.6	T16 E20	T16-N18 PolarHBondContact O-N 3.42Å; N18-E20 PolarHBondContact O-N 2.92Å
19	G	25.7	Very low	43.2	Very low	51 Å²	51	109 Å²	109	53%	0.526	65%	0.648	S	S	.	*			trans	-55.6	136.4	162.8	0	0	0	0	0	108.6	N21	G19-N21 PolarHBondContact O-N 3.49Å
20	E	27.1	Very low	46.4	Very low	203 Å²	203	100.9 Å²	100.9	95%	0.949	61%	0.605	S	S	*	*			trans	-59.5	83.6	175.1	-64.3	174.2	152.7	0	0	109.2	N18 G22	N18-E20 PolarHBondContact O-N 2.92Å; E20-G22 PolarHBondContact O-N 3.38Å
21	N	31.2	Very low	49.3	Very low	152 Å²	152	99 Å²	99	81%	0.813	59%	0.585	S	S	*	*			trans	-64.7	128.3	177.5	-85.2	-17.9	0	0	0	109	G19 Q23	G19-N21 PolarHBondContact O-N 3.49Å; N21-Q23 PolarHBondContact O-N 3.48Å; N21-Q23 VanDerWaalsContact O-N 3.1Å
22	G	38.2	Very low	52.4	Low	77 Å²	77	97.7 Å²	97.7	79%	0.794	56%	0.564	S	S	*	*			trans	-48.6	115	-179.2	0	0	0	0	0	112	E20 D24	E20-G22 PolarHBondContact O-N 3.38Å; G22-D24 PolarHBondContact O-N 2.72Å
23	Q	50.1	Low	55.5	Low	167 Å²	167	89.5 Å²	89.5	78%	0.78	52%	0.52	S	S	*	.			trans	-56.1	128.9	165	-71.4	173.4	-22.4	0	0	108.2	N21 L25	N21-Q23 PolarHBondContact O-N 3.48Å; N21-Q23 VanDerWaalsContact O-N 3.1Å; Q23-L25 PolarHBondContact O-N 3.48Å
24	D	65.7	Low	58.5	Low	54 Å²	54	88.9 Å²	88.9	29%	0.289	50%	0.495	S	S	.	.			trans	-58.4	106	173.9	-172.9	-8.5	0	0	0	108.2	G22 N26 L27 V332	G22-D24 PolarHBondContact O-N 2.72Å; D24-N26 PolarHBondContact O-N 2.65Å; D24-N26 VanDerWaalsContact OD1-CB 3.25Å; D24-N26 WeakPolarHBondContact OD1-CB 3.18Å; D24-N26 PolarHBondContact OD1-N 3.49Å; D24-N26 VanDerWaalsContact OD1-N 3.11Å; D24-N26 PolarHBondContact OD1-ND2 3.02Å; D24-L27 WeakPolarHBondContact O-CB 3.47Å; D24-L27 WeakPolarHBondContact O-CG 3.38Å; D24-L27 PolarHBondContact O-N 2.68Å; D24-V332 HydrophobicContact CB-CG2 4.3Å; D24-V332 WeakPolarHBondContact OD2-CB 3.46Å; D24-V332 WeakPolarHBondContact OD2-CG2 2.95Å; D24-V332 PolarHBondContact OD2-N 3.05Å; D24-V332 VanDerWaalsContact OD2-N 3.17Å
25	L	67.2	Low	61.5	Low	62 Å²	62	87.1 Å²	87.1	33%	0.325	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-14.9	-176.6	-75.4	173.5	0	0	0	112.5	Q23 L27 N28 L426	Q23-L25 PolarHBondContact O-N 3.48Å; L25-L27 PolarHBondContact O-N 3.48Å; L25-N28 PolarHBondContact O-ND2 2.65Å; L25-N28 VanDerWaalsContact O-ND2 3.17Å; L25-L426 HydrophobicContact CB-CD1 4Å; L25-L426 HydrophobicContact CB-CD2 4.43Å
26	N	78.3	Confident	64.1	Low	14 Å²	14	81.1 Å²	81.1	8%	0.075	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-8.2	173.8	-61.8	-61.1	0	0	0	113.8	D24 N28 F29 V332	D24-N26 PolarHBondContact O-N 2.65Å; D24-N26 VanDerWaalsContact OD1-CB 3.25Å; D24-N26 WeakPolarHBondContact OD1-CB 3.18Å; D24-N26 PolarHBondContact OD1-N 3.49Å; D24-N26 VanDerWaalsContact OD1-N 3.11Å; D24-N26 PolarHBondContact OD1-ND2 3.02Å; N26-N28 PolarHBondContact O-N 2.8Å; N26-F29 HydrophobicContact CB-CD2 3.98Å; N26-F29 WeakPolarHBondContact O-CB 3.1Å; N26-F29 WeakPolarHBondContact O-CD2 3.42Å; N26-F29 PolarHBondContact O-N 3.4Å; N26-V332 HydrophobicContact CB-CB 3.79Å; N26-V332 HydrophobicContact CB-CG1 3.78Å; N26-V332 HydrophobicContact CB-CG2 4.42Å; N26-V332 WeakPolarHBondContact O-CG1 3.48Å
27	L	84.4	Confident	66.8	Low	73 Å²	73	77.5 Å²	77.5	38%	0.382	43%	0.431	S	S	.	.	H	α-helix	trans	-52.1	-29.2	172.8	-73.9	170.1	0	0	0	112.5	D24 L25 F29 L30 D31 V332	D24-L27 WeakPolarHBondContact O-CB 3.47Å; D24-L27 WeakPolarHBondContact O-CG 3.38Å; D24-L27 PolarHBondContact O-N 2.68Å; L25-L27 PolarHBondContact O-N 3.48Å; L27-F29 PolarHBondContact O-N 3.06Å; L27-F29 VanDerWaalsContact O-N 3.15Å; L27-L30 HydrophobicContact CD2-CD1 3.81Å; L27-L30 WeakPolarHBondContact O-CB 3.29Å; L27-L30 PolarHBondContact O-N 3.47Å; L27-D31 PolarHBondContact O-N 3.35Å; L27-V332 HydrophobicContact CD2-CG2 3.96Å; L27-V332 HydrophobicContact CG-CG2 4.35Å
28	N	86.8	Confident	69.4	Low	76 Å²	76	77 Å²	77	41%	0.406	42%	0.422	S	S	.	.	H	α-helix	trans	-56	-28	173.2	-72.8	-47.9	0	0	0	113.9	L25 N26 K32	L25-N28 PolarHBondContact O-ND2 2.65Å; L25-N28 VanDerWaalsContact O-ND2 3.17Å; N26-N28 PolarHBondContact O-N 2.8Å; N28-K32 WeakPolarHBondContact O-CG 3.4Å; N28-K32 PolarHBondContact O-N 3.48Å; N28-K32 VanDerWaalsContact O-N 3.15Å
29	F	91.9	Very high	71.4	Confident	4 Å²	4	74.5 Å²	74.5	2%	0.018	40%	0.4	C	S	.	.	H	α-helix	trans	-73.5	-33	176.9	-69.2	-74.1	0	0	0	112.2	N26 L27 D31 K32 I33 L336 L401 D404 A405 A408 L426	N26-F29 HydrophobicContact CB-CD2 3.98Å; N26-F29 WeakPolarHBondContact O-CB 3.1Å; N26-F29 WeakPolarHBondContact O-CD2 3.42Å; N26-F29 PolarHBondContact O-N 3.4Å; L27-F29 PolarHBondContact O-N 3.06Å; L27-F29 VanDerWaalsContact O-N 3.15Å; F29-D31 VanDerWaalsContact C-N 3.32Å; F29-K32 HydrophobicContact CD1-CD 4.1Å; F29-K32 WeakPolarHBondContact O-CB 3.45Å; F29-K32 PolarHBondContact O-N 3.02Å; F29-I33 PolarHBondContact O-N 3.07Å; F29-I33 VanDerWaalsContact O-N 3.14Å; F29-L336 HydrophobicContact CB-CD1 3.79Å; F29-L336 HydrophobicContact CG-CD1 4.45Å; F29-L401 HydrophobicContact CB-CD2 4.13Å; F29-L401 HydrophobicContact CD1-CD2 4.33Å; F29-L401 HydrophobicContact CD1-CG 4.29Å; F29-D404 HydrophobicContact CD1-CB 4.4Å; F29-D404 HydrophobicContact CE1-CB 3.5Å; F29-D404 VanDerWaalsContact CE1-CB 3.5Å; F29-D404 HydrophobicContact CZ-CB 4.09Å; F29-A405 HydrophobicContact CB-CB 4.4Å; F29-A405 HydrophobicContact CD1-CB 4.05Å; F29-A405 HydrophobicContact CD2-CB 3.71Å; F29-A405 HydrophobicContact CE1-CB 4.25Å; F29-A405 HydrophobicContact CE2-CB 3.93Å; F29-A405 HydrophobicContact CG-CB 3.79Å; F29-A405 HydrophobicContact CZ-CB 4.2Å; F29-A408 HydrophobicContact CE2-CB 4Å; F29-A408 HydrophobicContact CZ-CB 3.99Å; F29-L426 HydrophobicContact CE2-CD2 4.1Å
30	L	92.7	Very high	72.7	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-64.9	-40.5	173.1	-53.6	-179.6	0	0	0	110.7	L27 K32 I33 R34 V332 F335 L336 G368 F369 I372	L27-L30 HydrophobicContact CD2-CD1 3.81Å; L27-L30 WeakPolarHBondContact O-CB 3.29Å; L27-L30 PolarHBondContact O-N 3.47Å; L30-K32 VanDerWaalsContact C-N 3.3Å; L30-K32 PolarHBondContact O-N 3.29Å; L30-I33 WeakPolarHBondContact O-CB 3.46Å; L30-I33 PolarHBondContact O-N 3.22Å; L30-I33 VanDerWaalsContact O-N 3.16Å; L30-R34 WeakPolarHBondContact O-CG 3.29Å; L30-R34 PolarHBondContact O-N 3.02Å; L30-V332 HydrophobicContact CD1-CG1 4.44Å; L30-V332 HydrophobicContact CD1-CG2 4.29Å; L30-V332 HydrophobicContact CD2-CG1 3.97Å; L30-V332 HydrophobicContact CG-CG1 4.02Å; L30-F335 HydrophobicContact CD2-CD1 3.67Å; L30-F335 HydrophobicContact CD2-CE1 3.69Å; L30-L336 HydrophobicContact CD2-CD2 4.11Å; L30-L336 HydrophobicContact CD2-CG 4.47Å; L30-G368 WeakPolarHBondContact CD1-O 3.37Å; L30-F369 HydrophobicContact CD1-CD1 3.74Å; L30-F369 HydrophobicContact CD1-CE1 3.6Å; L30-F369 HydrophobicContact CD2-CD1 4.28Å; L30-F369 HydrophobicContact CD2-CE1 4.3Å; L30-I372 HydrophobicContact CB-CD1 3.94Å; L30-I372 HydrophobicContact CD2-CD1 3.83Å; L30-I372 HydrophobicContact CG-CD1 4.42Å
31	D	90.9	Very high	74.1	Confident	76 Å²	76	72.3 Å²	72.3	41%	0.406	39%	0.392	S	S	.	.	H	α-helix	trans	-65.6	-34.2	175.5	-67	-23	0	0	0	112.2	L27 F29 R34 L35	L27-D31 PolarHBondContact O-N 3.35Å; F29-D31 VanDerWaalsContact C-N 3.32Å; D31-R34 PolarHBondContact O-N 3.16Å; D31-R34 IonicContact OD1-NH1 3.6Å; D31-R34 PolarHBondContact OD1-NH1 2.85Å; D31-L35 WeakPolarHBondContact O-CB 3.24Å; D31-L35 VanDerWaalsContact O-CG 3.25Å; D31-L35 WeakPolarHBondContact O-CG 3.42Å; D31-L35 PolarHBondContact O-N 3.3Å
32	K	90	Very high	75.1	Confident	58 Å²	58	74.1 Å²	74.1	25%	0.252	39%	0.393	S	S	.	.	H	α-helix	trans	-62.5	-39.5	171.8	-74.3	178.5	178.5	-177.2	0	112	N28 F29 L30 L35 S36 L401	N28-K32 WeakPolarHBondContact O-CG 3.4Å; N28-K32 PolarHBondContact O-N 3.48Å; N28-K32 VanDerWaalsContact O-N 3.15Å; F29-K32 HydrophobicContact CD1-CD 4.1Å; F29-K32 WeakPolarHBondContact O-CB 3.45Å; F29-K32 PolarHBondContact O-N 3.02Å; L30-K32 VanDerWaalsContact C-N 3.3Å; L30-K32 PolarHBondContact O-N 3.29Å; K32-L35 PolarHBondContact O-N 3.21Å; K32-S36 PolarHBondContact O-N 2.75Å; K32-S36 VanDerWaalsContact O-N 3.08Å; K32-S36 PolarHBondContact O-OG 3.37Å; K32-L401 HydrophobicContact CB-CD1 3.55Å; K32-L401 HydrophobicContact CB-CG 4.47Å
33	I	90.7	Very high	76	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.005	39%	0.391	C	S	.	.	H	α-helix	trans	-61.8	-49.9	174	-65.2	175.5	0	0	0	110.1	F29 L30 L35 S36 A37 L336 I372 Y392 F393 L401	F29-I33 PolarHBondContact O-N 3.07Å; F29-I33 VanDerWaalsContact O-N 3.14Å; L30-I33 WeakPolarHBondContact O-CB 3.46Å; L30-I33 PolarHBondContact O-N 3.22Å; L30-I33 VanDerWaalsContact O-N 3.16Å; I33-L35 PolarHBondContact O-N 2.8Å; I33-S36 WeakPolarHBondContact O-CA 3.33Å; I33-S36 WeakPolarHBondContact O-CB 3.35Å; I33-S36 PolarHBondContact O-N 3.03Å; I33-A37 PolarHBondContact O-N 3.13Å; I33-A37 VanDerWaalsContact O-N 3.08Å; I33-L336 HydrophobicContact CD1-CD2 3.42Å; I33-L336 VanDerWaalsContact CD1-CD2 3.42Å; I33-I372 HydrophobicContact CB-CD1 4.32Å; I33-I372 HydrophobicContact CD1-CD1 4.32Å; I33-I372 HydrophobicContact CG2-CD1 4.28Å; I33-I372 HydrophobicContact CG2-CG1 4.25Å; I33-Y392 HydrophobicContact CG2-CE2 4.17Å; I33-F393 HydrophobicContact CD1-CE1 4.46Å; I33-F393 HydrophobicContact CG2-CE1 3.54Å; I33-F393 HydrophobicContact CG2-CZ 3.56Å; I33-L401 HydrophobicContact CD1-CD2 4.02Å; I33-L401 HydrophobicContact CG1-CD1 3.64Å; I33-L401 HydrophobicContact CG1-CD2 3.85Å; I33-L401 HydrophobicContact CG1-CG 4.43Å
34	R	91	Very high	76.5	Confident	60 Å²	60	74.1 Å²	74.1	23%	0.226	38%	0.375	C	S	.	.	H	α-helix	trans	-59.8	-33.5	178.3	-67	172.2	178.8	118.6	10.4	113.1	L30 D31 K38 G368 D371	L30-R34 WeakPolarHBondContact O-CG 3.29Å; L30-R34 PolarHBondContact O-N 3.02Å; D31-R34 PolarHBondContact O-N 3.16Å; D31-R34 IonicContact OD1-NH1 3.6Å; D31-R34 PolarHBondContact OD1-NH1 2.85Å; R34-K38 WeakPolarHBondContact O-CG 3.42Å; R34-K38 PolarHBondContact O-N 3.31Å; R34-G368 PolarHBondContact NH2-O 2.86Å; R34-D371 IonicContact CZ-OD1 2.73Å; R34-D371 IonicContact CZ-OD2 2.81Å; R34-D371 IonicContact NE-OD1 2.84Å; R34-D371 IonicContact NE-OD2 3.72Å; R34-D371 PolarHBondContact NE-OD2 3.45Å; R34-D371 IonicContact NH2-OD1 2.73Å; R34-D371 PolarHBondContact NH2-OD1 3.34Å; R34-D371 IonicContact NH2-OD2 2.62Å; R34-D371 PolarHBondContact NH2-OD2 3.12Å
35	L	86	Confident	76.5	Confident	117 Å²	117	79.4 Å²	79.4	61%	0.613	40%	0.398	S	S	*	.	H	α-helix	trans	-71.2	-33.8	174.5	-73.8	169.9	0	0	0	112.2	D31 K32 I33 A37 K38 R39	D31-L35 WeakPolarHBondContact O-CB 3.24Å; D31-L35 VanDerWaalsContact O-CG 3.25Å; D31-L35 WeakPolarHBondContact O-CG 3.42Å; D31-L35 PolarHBondContact O-N 3.3Å; K32-L35 PolarHBondContact O-N 3.21Å; I33-L35 PolarHBondContact O-N 2.8Å; L35-A37 VanDerWaalsContact C-N 3.35Å; L35-K38 PolarHBondContact O-N 3.4Å; L35-R39 PolarHBondContact O-N 3.26Å
36	S	83.6	Confident	77	Confident	17 Å²	17	79.7 Å²	79.7	12%	0.119	42%	0.416	C	S	.	.	H	α-helix	trans	-63.8	-40.6	172	-67	0	0	0	0	111.6	K32 I33 K38 R39	K32-S36 PolarHBondContact O-N 2.75Å; K32-S36 VanDerWaalsContact O-N 3.08Å; K32-S36 PolarHBondContact O-OG 3.37Å; I33-S36 WeakPolarHBondContact O-CA 3.33Å; I33-S36 WeakPolarHBondContact O-CB 3.35Å; I33-S36 PolarHBondContact O-N 3.03Å; S36-K38 PolarHBondContact O-N 3.16Å; S36-R39 WeakPolarHBondContact O-CG 3.36Å; S36-R39 PolarHBondContact O-N 2.87Å; S36-R39 PolarHBondContact OG-NH2 3.42Å; S36-R39 VanDerWaalsContact OG-NH2 3.16Å
37	A	82	Confident	77.6	Confident	44 Å²	44	81.8 Å²	81.8	36%	0.364	43%	0.425	S	S	.	.	H	α-helix	trans	-60.9	-25.5	174	0	0	0	0	0	113.6	I33 L35 Y392	I33-A37 PolarHBondContact O-N 3.13Å; I33-A37 VanDerWaalsContact O-N 3.08Å; L35-A37 VanDerWaalsContact C-N 3.35Å; A37-Y392 HydrophobicContact CB-CD1 4.24Å; A37-Y392 HydrophobicContact CB-CE1 3.59Å; A37-Y392 HydrophobicContact CB-CE2 4.08Å
38	K	78.5	Confident	78.1	Confident	143 Å²	143	84.5 Å²	84.5	62%	0.622	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	9	-178	-67.2	178.6	-176.2	179.2	0	114	R34 L35 S36 D40 A41	R34-K38 WeakPolarHBondContact O-CG 3.42Å; R34-K38 PolarHBondContact O-N 3.31Å; L35-K38 PolarHBondContact O-N 3.4Å; S36-K38 PolarHBondContact O-N 3.16Å; K38-D40 PolarHBondContact O-N 2.84Å; K38-D40 VanDerWaalsContact O-N 3.1Å; K38-A41 VanDerWaalsContact O-CB 3.25Å; K38-A41 WeakPolarHBondContact O-CB 3.36Å; K38-A41 PolarHBondContact O-N 2.83Å
39	R	66.9	Low	78.5	Confident	116 Å²	116	85.8 Å²	85.8	44%	0.438	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-29	-178	-77.5	179	-170.5	169.1	10.9	113	L35 S36 E395 S397	L35-R39 PolarHBondContact O-N 3.26Å; S36-R39 WeakPolarHBondContact O-CG 3.36Å; S36-R39 PolarHBondContact O-N 2.87Å; S36-R39 PolarHBondContact OG-NH2 3.42Å; S36-R39 VanDerWaalsContact OG-NH2 3.16Å; R39-E395 IonicContact CZ-OE2 2.85Å; R39-E395 IonicContact NH1-OE1 3.54Å; R39-E395 IonicContact NH1-OE2 2.75Å; R39-E395 PolarHBondContact NH1-OE2 3.15Å; R39-E395 IonicContact NH2-OE2 3.51Å; R39-S397 PolarHBondContact NH2-OG 3.17Å
40	D	54.9	Low	78.8	Confident	138 Å²	138	85.8 Å²	85.8	74%	0.738	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	4.5	178.1	-62.6	-30.3	0	0	0	114.5	K38 K42	K38-D40 PolarHBondContact O-N 2.84Å; K38-D40 VanDerWaalsContact O-N 3.1Å; D40-K42 PolarHBondContact O-N 3.12Å; D40-K42 VanDerWaalsContact O-N 3.14Å
41	A	54.6	Low	79.1	Confident	69 Å²	69	88.5 Å²	88.5	57%	0.57	46%	0.459	S	S	*	.	S	Bend	trans	-63.3	119.5	175.5	0	0	0	0	0	109.8	K38 E43	K38-A41 VanDerWaalsContact O-CB 3.25Å; K38-A41 WeakPolarHBondContact O-CB 3.36Å; K38-A41 PolarHBondContact O-N 2.83Å; A41-E43 PolarHBondContact O-N 3.4Å
42	K	52.3	Low	79.4	Confident	190 Å²	190	87.3 Å²	87.3	83%	0.826	45%	0.451	S	S	*	.			trans	-35.7	121.4	-176.8	-69.4	-177.5	177.4	-179.3	0	112	D40 D44	D40-K42 PolarHBondContact O-N 3.12Å; D40-K42 VanDerWaalsContact O-N 3.14Å; K42-D44 PolarHBondContact O-N 3.43Å
43	E	57.6	Low	79.7	Confident	162 Å²	162	84.6 Å²	84.6	76%	0.757	44%	0.439	S	S	*	.			trans	-53.8	134.2	171.7	-60.9	-172.2	147.5	0	0	109.7	A41 E45	A41-E43 PolarHBondContact O-N 3.4Å; E43-E45 PolarHBondContact O-N 3.27Å
44	D	61.7	Low	79.9	Confident	83 Å²	83	86.2 Å²	86.2	44%	0.444	45%	0.448	S	S	.	.			trans	-24.7	113.4	174.5	-171.4	20.1	0	0	0	112.3	K42 G46 K96 R456	K42-D44 PolarHBondContact O-N 3.43Å; D44-G46 PolarHBondContact O-N 3.45Å; D44-G46 VanDerWaalsContact O-N 3.1Å; D44-K96 IonicContact OD1-NZ 2.68Å; D44-K96 PolarHBondContact OD1-NZ 2.96Å; D44-K96 IonicContact OD2-NZ 3.67Å; D44-K96 PolarHBondContact OD2-NZ 3.49Å; D44-R456 IonicContact OD2-NH2 3.76Å
45	E	64.7	Low	79.8	Confident	164 Å²	164	86.4 Å²	86.4	77%	0.766	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-51.3	120.2	177.3	-68.1	-178.1	171.7	0	0	108.5	E43	E43-E45 PolarHBondContact O-N 3.27Å
46	G	78.7	Confident	79.6	Confident	68 Å²	68	88.6 Å²	88.6	70%	0.701	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-57.9	148.8	-178.5	0	0	0	0	0	111.4	D44 E48	D44-G46 PolarHBondContact O-N 3.45Å; D44-G46 VanDerWaalsContact O-N 3.1Å; G46-E48 PolarHBondContact O-N 2.89Å
47	E	90.6	Very high	79	Confident	59 Å²	59	90.6 Å²	90.6	28%	0.276	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-65.5	133.6	175.5	-67.2	179.6	106.3	0	0	110.8	L49 P94 I95 K96	E47-L49 PolarHBondContact O-N 3.38Å; E47-P94 HydrophobicContact CB-CB 4.22Å; E47-P94 WeakPolarHBondContact OE2-CB 3.47Å; E47-I95 WeakPolarHBondContact OE1-CG1 3.47Å; E47-I95 PolarHBondContact OE1-N 2.93Å; E47-I95 PolarHBondContact OE2-N 3.49Å; E47-K96 HydrophobicContact CG-CD 4.04Å; E47-K96 HydrophobicContact CG-CG 4.27Å; E47-K96 WeakPolarHBondContact OE2-CA 3.48Å; E47-K96 WeakPolarHBondContact OE2-CB 3.34Å; E47-K96 WeakPolarHBondContact OE2-CG 3.17Å; E47-K96 PolarHBondContact OE2-N 3.02Å
48	E	93.9	Very high	78.3	Confident	130 Å²	130	90.4 Å²	90.4	61%	0.607	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-68.6	123.1	171.8	-67.6	-175.9	-171.6	0	0	110.5	G46 K91	G46-E48 PolarHBondContact O-N 2.89Å; E48-K91 HydrophobicContact CB-CD 4.23Å; E48-K91 HydrophobicContact CB-CG 4.4Å; E48-K91 WeakPolarHBondContact OE2-CE 3.44Å; E48-K91 IonicContact OE2-NZ 2.65Å; E48-K91 PolarHBondContact OE2-NZ 3.03Å
49	L	96.5	Very high	78	Confident	103 Å²	103	83.9 Å²	83.9	54%	0.539	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-83.9	150.7	-176.6	-58.3	179.9	0	0	0	112.1	E47 T51 P94	E47-L49 PolarHBondContact O-N 3.38Å; L49-T51 PolarHBondContact O-N 2.92Å; L49-P94 HydrophobicContact CD2-CB 3.76Å; L49-P94 HydrophobicContact CD2-CG 3.55Å
50	P	97.8	Very high	78	Confident	4 Å²	4	80.8 Å²	80.8	3%	0.026	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-56.8	127.8	165.4	-25.3	36.5	0	0	0	110.6	A89 K91 P92 Y100 P199 F214	P50-A89 HydrophobicContact CB-CB 3.94Å; P50-K91 HydrophobicContact CG-CB 4.41Å; P50-K91 WeakPolarHBondContact CG-O 3.31Å; P50-P92 WeakPolarHBondContact CD-O 3.32Å; P50-P92 VanDerWaalsContact CG-O 3.23Å; P50-P92 WeakPolarHBondContact CG-O 3.5Å; P50-Y100 HydrophobicContact CG-CE2 4.14Å; P50-Y100 WeakPolarHBondContact CG-OH 3.34Å; P50-P199 HydrophobicContact CB-CG 4.28Å; P50-P199 HydrophobicContact CG-CG 4.06Å; P50-F214 HydrophobicContact CB-CB 4.47Å; P50-F214 HydrophobicContact CB-CD1 3.97Å; P50-F214 HydrophobicContact CB-CE1 4.46Å; P50-F214 HydrophobicContact CB-CG 4.22Å; P50-F214 VanDerWaalsContact O-CB 3.3Å; P50-F214 WeakPolarHBondContact O-CB 3.46Å
51	T	97.7	Very high	79	Confident	56 Å²	56	76.8 Å²	76.8	34%	0.344	44%	0.44	S	S	.	.			trans	-130.1	-20.8	-177.4	49.4	0	0	0	0	113.8	L49 N90 K216	L49-T51 PolarHBondContact O-N 2.92Å; T51-N90 PolarHBondContact N-OD1 2.97Å; T51-N90 PolarHBondContact OG1-ND2 3.4Å; T51-N90 VanDerWaalsContact OG1-ND2 3.15Å; T51-K216 VanDerWaalsContact O-CE 3.28Å; T51-K216 WeakPolarHBondContact O-CE 3.39Å; T51-K216 PolarHBondContact O-NZ 3.25Å
52	E	97.7	Very high	80.4	Confident	51 Å²	51	74.4 Å²	74.4	24%	0.238	42%	0.417	C	S	.	.	S	Bend	trans	-158.4	167.4	-177.3	58.8	-179.1	-141.1	0	0	111	K69 A89 N90	E52-K69 HydrophobicContact CB-CB 3.8Å; E52-K69 HydrophobicContact CB-CD 4.38Å; E52-K69 HydrophobicContact CG-CB 4.49Å; E52-K69 HydrophobicContact CG-CD 4.24Å; E52-K69 WeakPolarHBondContact OE1-CD 3.48Å; E52-K69 IonicContact OE1-NZ 3.88Å; E52-K69 PolarHBondContact OE1-NZ 2.89Å; E52-K69 WeakPolarHBondContact OE2-CD 3.37Å; E52-K69 IonicContact OE2-NZ 3.78Å; E52-A89 CarbonylContact O-C 3.46Å; E52-A89 WeakPolarHBondContact O-CA 3.45Å; E52-N90 HydrophobicContact CG-CB 4.07Å; E52-N90 WeakPolarHBondContact CG-ND2 3.27Å; E52-N90 PolarHBondContact N-OD1 3.02Å; E52-N90 PolarHBondContact O-N 3.41Å; E52-N90 PolarHBondContact O-OD1 3.39Å
53	L	97.3	Very high	82.2	Confident	2 Å²	2	66 Å²	66	1%	0.01	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	139.3	175	-64.1	165.5	0	0	0	110.6	T55 V65 K69 V72 V87 V212 F214	L53-T55 PolarHBondContact O-N 3.18Å; L53-V65 HydrophobicContact CB-CG1 4.19Å; L53-V65 HydrophobicContact CD1-CG1 4.07Å; L53-K69 WeakPolarHBondContact CB-O 3.36Å; L53-K69 WeakPolarHBondContact CG-O 3.33Å; L53-K69 PolarHBondContact N-O 3.44Å; L53-V72 HydrophobicContact CD1-CG2 3.4Å; L53-V87 HydrophobicContact CB-CG2 3.9Å; L53-V87 HydrophobicContact CD1-CG1 4.45Å; L53-V87 HydrophobicContact CD2-CG1 3.94Å; L53-V87 HydrophobicContact CD2-CG2 4.14Å; L53-V212 HydrophobicContact CD1-CG2 3.99Å; L53-V212 HydrophobicContact CD2-CB 4.48Å; L53-V212 HydrophobicContact CD2-CG2 4.05Å; L53-V212 HydrophobicContact CG-CG2 4.38Å; L53-F214 HydrophobicContact CD2-CE2 4.23Å; L53-F214 HydrophobicContact CD2-CZ 3.89Å; L53-F214 HydrophobicContact CG-CE2 4.29Å; L53-F214 HydrophobicContact CG-CZ 4.44Å
54	N	94.3	Very high	83.8	Confident	34 Å²	34	62 Å²	62	18%	0.182	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	104.2	177.8	-172.2	-13	0	0	0	110.4	I56 N57 Q88	N54-I56 VanDerWaalsContact C-N 3.34Å; N54-I56 WeakPolarHBondContact OD1-CB 3.13Å; N54-I56 PolarHBondContact OD1-N 3.01Å; N54-N57 PolarHBondContact OD1-N 3.48Å; N54-Q88 WeakPolarHBondContact CB-O 3.04Å; N54-Q88 PolarHBondContact N-O 3.46Å
55	T	88.2	Confident	85.4	Confident	64 Å²	64	59.4 Å²	59.4	39%	0.393	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-13.5	179.3	57.7	0	0	0	0	113.7	L53 V65 K69	L53-T55 PolarHBondContact O-N 3.18Å; T55-V65 HydrophobicContact CG2-CB 4.14Å; T55-V65 HydrophobicContact CG2-CG1 3.99Å; T55-K69 HydrophobicContact CG2-CD 4.43Å; T55-K69 HydrophobicContact CG2-CG 4.05Å
56	I	82.5	Confident	86.8	Confident	163 Å²	163	53 Å²	53	84%	0.836	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	-43.6	-179.9	-60	167.9	0	0	0	110.1	N54	N54-I56 VanDerWaalsContact C-N 3.34Å; N54-I56 WeakPolarHBondContact OD1-CB 3.13Å; N54-I56 PolarHBondContact OD1-N 3.01Å
57	N	69.8	Low	87.5	Confident	60 Å²	60	56.2 Å²	56.2	32%	0.321	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	57.8	-178.7	-165.3	20.2	0	0	0	111.6	N54 M126	N54-N57 PolarHBondContact OD1-N 3.48Å; N57-M126 WeakPolarHBondContact ND2-CE 3.46Å
58	S	69	Low	87.7	Confident	39 Å²	39	57.6 Å²	57.6	27%	0.273	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	158.3	178.3	70.9	0	0	0	0	111.7	G60	S58-G60 PolarHBondContact O-N 2.89Å
59	A	70.9	Confident	87.8	Confident	7 Å²	7	54.7 Å²	54.7	6%	0.058	33%	0.331	C	S	.	.			trans	-57.4	-4.3	-178.7	0	0	0	0	0	116.3	V86 M126	A59-V86 HydrophobicContact CB-CG1 4.17Å; A59-V86 PolarHBondContact N-O 3.22Å; A59-M126 WeakPolarHBondContact CA-O 3.44Å; A59-M126 WeakPolarHBondContact CB-O 3.46Å
60	G	66.7	Low	87.9	Confident	51 Å²	51	51.2 Å²	51.2	53%	0.526	31%	0.313	S	S	.	.	S	Bend	trans	51.1	85.3	170.3	0	0	0	0	0	113.7	S58	S58-G60 PolarHBondContact O-N 2.89Å
61	G	76.8	Confident	87.8	Confident	54 Å²	54	51.6 Å²	51.6	56%	0.557	32%	0.316	S	S	*	.	S	Bend	trans	113.7	-11	168.1	0	0	0	0	0	116.9
62	F	84.3	Confident	87.8	Confident	19 Å²	19	49 Å²	49	8%	0.083	30%	0.3	C	S	.	.	S	Bend	trans	-101	-23.2	175.1	-58.7	-65.4	0	0	0	113.6	Y74 T75 D83	F62-Y74 HydrophobicContact CB-CE2 3.88Å; F62-Y74 VanDerWaalsContact O-CD2 3.31Å; F62-Y74 WeakPolarHBondContact O-CD2 3.28Å; F62-T75 PolarHBondContact O-N 3.29Å; F62-D83 HydrophobicContact CD1-CB 3.61Å; F62-D83 HydrophobicContact CE1-CB 3.34Å; F62-D83 VanDerWaalsContact CE1-OD1 3.3Å; F62-D83 WeakPolarHBondContact CE1-OD1 3.41Å; F62-D83 HydrophobicContact CG-CB 4.35Å; F62-D83 HydrophobicContact CZ-CB 3.89Å; F62-D83 VanDerWaalsContact CZ-OD1 3.23Å; F62-D83 WeakPolarHBondContact CZ-OD1 3.24Å
63	L	89.3	Confident	87.7	Confident	13 Å²	13	50.1 Å²	50.1	7%	0.068	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	160.6	176.9	72.1	83.3	0	0	0	111.1	V65 V72 K73 V86 V87 V203	L63-V65 HydrophobicContact CD1-CG2 3.51Å; L63-V72 HydrophobicContact CB-CG1 4Å; L63-V72 HydrophobicContact CD1-CG1 4.18Å; L63-V72 HydrophobicContact CD2-CG1 3.95Å; L63-V72 HydrophobicContact CG-CG1 4.26Å; L63-K73 CarbonylContact C-O 3.54Å; L63-K73 WeakPolarHBondContact CA-O 3.5Å; L63-V86 WeakPolarHBondContact CD2-O 3.35Å; L63-V87 HydrophobicContact CD2-CB 4.24Å; L63-V87 HydrophobicContact CD2-CG1 4.33Å; L63-V203 HydrophobicContact CB-CG2 4.16Å
64	V	92	Very high	87.5	Confident	79 Å²	79	50 Å²	50	48%	0.479	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	132.2	164.3	174.5	0	0	0	0	108.5	K73 T75	V64-K73 PolarHBondContact N-O 3.27Å; V64-K73 PolarHBondContact O-N 3.08Å; V64-T75 HydrophobicContact CB-CG2 4.01Å; V64-T75 HydrophobicContact CG2-CG2 3.6Å
65	V	94	Very high	87.2	Confident	27 Å²	27	52 Å²	52	16%	0.164	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	130	166.9	-176.5	0	0	0	0	108	L53 T55 L63 S71 V87	L53-V65 HydrophobicContact CB-CG1 4.19Å; L53-V65 HydrophobicContact CD1-CG1 4.07Å; T55-V65 HydrophobicContact CG2-CB 4.14Å; T55-V65 HydrophobicContact CG2-CG1 3.99Å; L63-V65 HydrophobicContact CD1-CG2 3.51Å; V65-S71 VanDerWaalsContact CA-O 3.28Å; V65-S71 WeakPolarHBondContact CA-O 3.36Å; V65-V87 HydrophobicContact CG2-CG2 4.38Å
66	S	94.1	Very high	86.9	Confident	29 Å²	29	51.6 Å²	51.6	20%	0.203	31%	0.312	C	S	.	.			trans	-65.8	161.4	177.6	47.6	0	0	0	0	112.6	D68 K69 S71	S66-D68 WeakPolarHBondContact CB-OD1 3.34Å; S66-D68 PolarHBondContact O-N 3.31Å; S66-D68 VanDerWaalsContact O-N 3.16Å; S66-D68 PolarHBondContact OG-OD1 3.49Å; S66-K69 WeakPolarHBondContact O-CA 3.39Å; S66-K69 PolarHBondContact O-N 2.86Å; S66-S71 PolarHBondContact N-O 3.45Å; S66-S71 WeakPolarHBondContact OG-CA 3.3Å; S66-S71 WeakPolarHBondContact OG-CB 3.46Å; S66-S71 PolarHBondContact OG-N 2.89Å; S66-S71 VanDerWaalsContact OG-N 3.08Å; S66-S71 PolarHBondContact OG-O 3.06Å; S66-S71 PolarHBondContact OG-OG 3Å; S66-S71 VanDerWaalsContact OG-OG 3.1Å
67	P	94.1	Very high	86.6	Confident	136 Å²	136	47.2 Å²	47.2	88%	0.883	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-26.1	-179.4	-27	35.9	0	0	0	115.5	K69	P67-K69 PolarHBondContact O-N 3.48Å
68	D	95.1	Very high	86.4	Confident	89 Å²	89	46.6 Å²	46.6	48%	0.476	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-8.1	173.6	68.4	-1.1	0	0	0	113.5	S66 L70 S71	S66-D68 WeakPolarHBondContact CB-OD1 3.34Å; S66-D68 PolarHBondContact O-N 3.31Å; S66-D68 VanDerWaalsContact O-N 3.16Å; S66-D68 PolarHBondContact OG-OD1 3.49Å; D68-L70 PolarHBondContact O-N 3.03Å; D68-L70 PolarHBondContact OD1-N 3.34Å; D68-S71 PolarHBondContact OD1-N 3.35Å
69	K	96.7	Very high	86.1	Confident	68 Å²	68	50.5 Å²	50.5	30%	0.296	31%	0.307	S	S	.	.	S	Bend	trans	55.9	27.6	-176.4	-57.4	174	172.4	176.1	0	114.2	E52 L53 T55 S66 P67	E52-K69 HydrophobicContact CB-CB 3.8Å; E52-K69 HydrophobicContact CB-CD 4.38Å; E52-K69 HydrophobicContact CG-CB 4.49Å; E52-K69 HydrophobicContact CG-CD 4.24Å; E52-K69 WeakPolarHBondContact OE1-CD 3.48Å; E52-K69 IonicContact OE1-NZ 3.88Å; E52-K69 PolarHBondContact OE1-NZ 2.89Å; E52-K69 WeakPolarHBondContact OE2-CD 3.37Å; E52-K69 IonicContact OE2-NZ 3.78Å; L53-K69 WeakPolarHBondContact CB-O 3.36Å; L53-K69 WeakPolarHBondContact CG-O 3.33Å; L53-K69 PolarHBondContact N-O 3.44Å; T55-K69 HydrophobicContact CG2-CD 4.43Å; T55-K69 HydrophobicContact CG2-CG 4.05Å; S66-K69 WeakPolarHBondContact O-CA 3.39Å; S66-K69 PolarHBondContact O-N 2.86Å; P67-K69 PolarHBondContact O-N 3.48Å
70	L	97.6	Very high	86.3	Confident	30 Å²	30	55.3 Å²	55.3	16%	0.157	33%	0.328	C	S	.	.			trans	-128.3	-0.4	-179.4	-67.6	174.4	0	0	0	113	D68 L211 V212 F214 K216	D68-L70 PolarHBondContact O-N 3.03Å; D68-L70 PolarHBondContact OD1-N 3.34Å; L70-L211 CarbonylContact O-C 3.59Å; L70-L211 WeakPolarHBondContact O-CA 3.33Å; L70-V212 PolarHBondContact O-N 3.5Å; L70-F214 HydrophobicContact CD2-CD2 3.82Å; L70-F214 HydrophobicContact CD2-CE2 4.03Å; L70-K216 HydrophobicContact CD1-CD 4.34Å
71	S	96.8	Very high	86.7	Confident	12 Å²	12	55.3 Å²	55.3	8%	0.084	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	141.1	174.2	-34.9	0	0	0	0	111.2	V65 S66 D68 V210 L211	V65-S71 VanDerWaalsContact CA-O 3.28Å; V65-S71 WeakPolarHBondContact CA-O 3.36Å; S66-S71 PolarHBondContact N-O 3.45Å; S66-S71 WeakPolarHBondContact OG-CA 3.3Å; S66-S71 WeakPolarHBondContact OG-CB 3.46Å; S66-S71 PolarHBondContact OG-N 2.89Å; S66-S71 VanDerWaalsContact OG-N 3.08Å; S66-S71 PolarHBondContact OG-O 3.06Å; S66-S71 PolarHBondContact OG-OG 3Å; S66-S71 VanDerWaalsContact OG-OG 3.1Å; D68-S71 PolarHBondContact OD1-N 3.35Å; S71-V210 CarbonylContact C-O 3.54Å; S71-V210 VanDerWaalsContact CA-O 3.28Å; S71-V210 WeakPolarHBondContact CA-O 3.39Å; S71-L211 WeakPolarHBondContact OG-CD2 3.45Å
72	V	95.9	Very high	86.8	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.006	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	130.7	176.6	-176.1	0	0	0	0	107.9	L53 L63 V87 V203 E209 V210	L53-V72 HydrophobicContact CD1-CG2 3.4Å; L63-V72 HydrophobicContact CB-CG1 4Å; L63-V72 HydrophobicContact CD1-CG1 4.18Å; L63-V72 HydrophobicContact CD2-CG1 3.95Å; L63-V72 HydrophobicContact CG-CG1 4.26Å; V72-V87 HydrophobicContact CG1-CG1 4.28Å; V72-V87 HydrophobicContact CG2-CG1 3.48Å; V72-V87 VanDerWaalsContact CG2-CG1 3.48Å; V72-V203 HydrophobicContact CG1-CG1 4.4Å; V72-V203 HydrophobicContact CG1-CG2 3.7Å; V72-E209 CarbonylContact O-C 3.54Å; V72-E209 VanDerWaalsContact O-CA 3.3Å; V72-E209 WeakPolarHBondContact O-CA 3.45Å; V72-V210 HydrophobicContact CB-CG2 3.83Å; V72-V210 HydrophobicContact CG2-CG2 4.39Å; V72-V210 PolarHBondContact N-O 3.19Å; V72-V210 PolarHBondContact O-N 2.87Å
73	K	96	Very high	86.9	Confident	76 Å²	76	56.8 Å²	56.8	33%	0.33	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.1	173.6	-174.9	171.5	-170.2	147.5	0	111.1	L63 V64 T75 E208 E209	L63-K73 CarbonylContact C-O 3.54Å; L63-K73 WeakPolarHBondContact CA-O 3.5Å; V64-K73 PolarHBondContact N-O 3.27Å; V64-K73 PolarHBondContact O-N 3.08Å; K73-T75 HydrophobicContact CG-CG2 4.39Å; K73-E208 CarbonylContact C-O 3.6Å; K73-E208 VanDerWaalsContact CA-O 3.31Å; K73-E208 WeakPolarHBondContact CA-O 3.41Å; K73-E209 HydrophobicContact CB-CB 4.45Å; K73-E209 HydrophobicContact CB-CG 4.06Å; K73-E209 HydrophobicContact CD-CG 4.39Å; K73-E209 WeakPolarHBondContact CD-OE2 3.18Å; K73-E209 HydrophobicContact CG-CB 4.24Å; K73-E209 HydrophobicContact CG-CG 4.23Å; K73-E209 IonicContact NZ-OE2 2.85Å; K73-E209 PolarHBondContact NZ-OE2 3.25Å
74	Y	94.3	Very high	87	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	119.7	168.7	-162.2	-83.7	0	0	0	110	F62 N76 N78 D83 V203 S205 N207 E208	F62-Y74 HydrophobicContact CB-CE2 3.88Å; F62-Y74 VanDerWaalsContact O-CD2 3.31Å; F62-Y74 WeakPolarHBondContact O-CD2 3.28Å; Y74-N76 WeakPolarHBondContact CD1-O 3.49Å; Y74-N76 HydrophobicContact CE1-CB 3.88Å; Y74-N76 WeakPolarHBondContact CE1-O 3.17Å; Y74-N78 WeakPolarHBondContact CE1-OD1 3.41Å; Y74-N78 PolarHBondContact OH-OD1 2.94Å; Y74-D83 WeakPolarHBondContact CE2-O 3.39Å; Y74-D83 PolarHBondContact OH-O 2.86Å; Y74-V203 HydrophobicContact CD2-CB 4.27Å; Y74-V203 HydrophobicContact CD2-CG2 3.94Å; Y74-V203 WeakPolarHBondContact CD2-O 3.44Å; Y74-V203 HydrophobicContact CG-CG2 4.44Å; Y74-S205 WeakPolarHBondContact CB-O 3.42Å; Y74-S205 WeakPolarHBondContact CD1-O 3.24Å; Y74-N207 PolarHBondContact O-N 3.09Å; Y74-E208 PolarHBondContact N-O 3.45Å
75	T	87.4	Confident	87.1	Confident	76 Å²	76	52.4 Å²	52.4	47%	0.466	30%	0.295	S	S	.	.			trans	-108	-14.2	-172	52.8	0	0	0	0	114.2	F62 V64 K73	F62-T75 PolarHBondContact O-N 3.29Å; V64-T75 HydrophobicContact CB-CG2 4.01Å; V64-T75 HydrophobicContact CG2-CG2 3.6Å; K73-T75 HydrophobicContact CG-CG2 4.39Å
76	N	82.2	Confident	87.2	Confident	54 Å²	54	51.1 Å²	51.1	29%	0.289	29%	0.287	S	S	.	.	S	Bend	trans	-91.4	170.1	-175.7	-150	-17.9	0	0	0	111.9	Y74	Y74-N76 WeakPolarHBondContact CD1-O 3.49Å; Y74-N76 HydrophobicContact CE1-CB 3.88Å; Y74-N76 WeakPolarHBondContact CE1-O 3.17Å
77	T	75.7	Confident	87.3	Confident	72 Å²	72	49.8 Å²	49.8	44%	0.442	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-91	122.9	160.5	48.1	0	0	0	0	108	L79	T77-L79 PolarHBondContact O-N 3.44Å; T77-L79 VanDerWaalsContact O-N 3.11Å
78	N	64.8	Low	87.5	Confident	46 Å²	46	43.3 Å²	43.3	25%	0.246	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-55.8	117.2	179.1	-62	-9	0	0	0	110.8	Y74 H204 S205	Y74-N78 WeakPolarHBondContact CE1-OD1 3.41Å; Y74-N78 PolarHBondContact OH-OD1 2.94Å; N78-H204 PolarHBondContact ND2-O 2.65Å; N78-H204 PolarHBondContact OD1-O 3.22Å; N78-H204 VanDerWaalsContact OD1-O 3.13Å; N78-S205 WeakPolarHBondContact ND2-CA 3.33Å; N78-S205 WeakPolarHBondContact OD1-CA 3.46Å
79	L	63.7	Low	87.6	Confident	121 Å²	121	39.1 Å²	39.1	63%	0.634	21%	0.213	S	C	*	.			trans	-95.8	-37	173.6	-65	165	0	0	0	110.4	T77 D83	T77-L79 PolarHBondContact O-N 3.44Å; T77-L79 VanDerWaalsContact O-N 3.11Å; L79-D83 WeakPolarHBondContact CA-OD2 3.43Å; L79-D83 WeakPolarHBondContact CB-OD2 3.47Å; L79-D83 PolarHBondContact N-OD2 3.42Å; L79-D83 VanDerWaalsContact N-OD2 3.1Å
80	H	74.2	Confident	87.6	Confident	109 Å²	109	37.6 Å²	37.6	51%	0.505	21%	0.208	S	C	.	.	S	Bend	trans	-144.8	159.2	-175.1	-52.1	92.3	0	0	0	112.8	H82 D83	H80-H82 WeakPolarHBondContact CB-CE1 3.44Å; H80-H82 AromaticContact CG-CE1 3.7Å; H80-H82 PolarHBondContact O-N 3.26Å; H80-D83 PolarHBondContact N-OD2 2.87Å; H80-D83 IonicContact ND1-OD2 3.77Å; H80-D83 VanDerWaalsContact O-CB 3.31Å; H80-D83 WeakPolarHBondContact O-CB 3.42Å; H80-D83 PolarHBondContact O-N 3.29Å
81	G	74.9	Confident	87.6	Confident	51 Å²	51	39.6 Å²	39.6	53%	0.526	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	0.2	-179.5	0	0	0	0	0	116.2
82	H	78.9	Confident	87.7	Confident	94 Å²	94	40.5 Å²	40.5	44%	0.435	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	5	173.6	56.1	-95.7	0	0	0	112.8	H80 V84	H80-H82 WeakPolarHBondContact CB-CE1 3.44Å; H80-H82 AromaticContact CG-CE1 3.7Å; H80-H82 PolarHBondContact O-N 3.26Å; H82-V84 PolarHBondContact O-N 2.91Å
83	D	87.8	Confident	87.8	Confident	10 Å²	10	40.5 Å²	40.5	5%	0.053	22%	0.221	C	C	.	.			trans	-84.7	46.4	178	-64.3	-18.6	0	0	0	110.6	F62 Y74 L79 H80 H204	F62-D83 HydrophobicContact CD1-CB 3.61Å; F62-D83 HydrophobicContact CE1-CB 3.34Å; F62-D83 VanDerWaalsContact CE1-OD1 3.3Å; F62-D83 WeakPolarHBondContact CE1-OD1 3.41Å; F62-D83 HydrophobicContact CG-CB 4.35Å; F62-D83 HydrophobicContact CZ-CB 3.89Å; F62-D83 VanDerWaalsContact CZ-OD1 3.23Å; F62-D83 WeakPolarHBondContact CZ-OD1 3.24Å; Y74-D83 WeakPolarHBondContact CE2-O 3.39Å; Y74-D83 PolarHBondContact OH-O 2.86Å; L79-D83 WeakPolarHBondContact CA-OD2 3.43Å; L79-D83 WeakPolarHBondContact CB-OD2 3.47Å; L79-D83 PolarHBondContact N-OD2 3.42Å; L79-D83 VanDerWaalsContact N-OD2 3.1Å; H80-D83 PolarHBondContact N-OD2 2.87Å; H80-D83 IonicContact ND1-OD2 3.77Å; H80-D83 VanDerWaalsContact O-CB 3.31Å; H80-D83 WeakPolarHBondContact O-CB 3.42Å; H80-D83 PolarHBondContact O-N 3.29Å; D83-H204 PolarHBondContact O-CD2 2.96Å
84	V	91.9	Very high	87.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.209	C	C	.	.			trans	-83.6	126	-177.1	-178.5	0	0	0	0	109.6	H82 V86 Q129 W132 A202	H82-V84 PolarHBondContact O-N 2.91Å; V84-V86 HydrophobicContact CG1-CB 4.38Å; V84-V86 PolarHBondContact O-N 3.03Å; V84-Q129 HydrophobicContact CG1-CG 3.71Å; V84-Q129 HydrophobicContact CG2-CG 4.19Å; V84-W132 HydrophobicContact CG2-CZ3 4.05Å; V84-A202 HydrophobicContact CG1-CB 4.03Å
85	G	93.9	Very high	87.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	100	165.7	0	0	0	0	0	110.4	A202 V203	G85-A202 CarbonylContact O-C 3.53Å; G85-A202 VanDerWaalsContact O-CA 3.24Å; G85-A202 WeakPolarHBondContact O-CA 3.38Å; G85-V203 CarbonylContact C-O 3.59Å; G85-V203 WeakPolarHBondContact CA-O 3.41Å; G85-V203 PolarHBondContact N-O 3.22Å; G85-V203 WeakPolarHBondContact O-CG2 3.34Å; G85-V203 PolarHBondContact O-N 3.37Å; G85-V203 VanDerWaalsContact O-O 3.09Å
86	V	95.2	Very high	88.2	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	144.9	174.5	61.6	0	0	0	0	111.9	A59 L63 V84 F124 M126 T200 A202	A59-V86 HydrophobicContact CB-CG1 4.17Å; A59-V86 PolarHBondContact N-O 3.22Å; L63-V86 WeakPolarHBondContact CD2-O 3.35Å; V84-V86 HydrophobicContact CG1-CB 4.38Å; V84-V86 PolarHBondContact O-N 3.03Å; V86-F124 HydrophobicContact CG1-CE1 4.46Å; V86-F124 HydrophobicContact CG2-CE1 4.07Å; V86-M126 VanDerWaalsContact CG1-CA 3.49Å; V86-M126 HydrophobicContact CG1-CB 4.2Å; V86-M126 HydrophobicContact CG1-SD 4.03Å; V86-T200 HydrophobicContact CG2-CG2 3.49Å; V86-T200 VanDerWaalsContact CG2-CG2 3.49Å; V86-A202 HydrophobicContact CB-CB 4.13Å; V86-A202 HydrophobicContact CG2-CB 4.2Å
87	V	96.6	Very high	88.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	137.5	175	57.9	0	0	0	0	110.8	L53 L63 V65 V72 V201	L53-V87 HydrophobicContact CB-CG2 3.9Å; L53-V87 HydrophobicContact CD1-CG1 4.45Å; L53-V87 HydrophobicContact CD2-CG1 3.94Å; L53-V87 HydrophobicContact CD2-CG2 4.14Å; L63-V87 HydrophobicContact CD2-CB 4.24Å; L63-V87 HydrophobicContact CD2-CG1 4.33Å; V65-V87 HydrophobicContact CG2-CG2 4.38Å; V72-V87 HydrophobicContact CG1-CG1 4.28Å; V72-V87 HydrophobicContact CG2-CG1 3.48Å; V72-V87 VanDerWaalsContact CG2-CG1 3.48Å; V87-V201 PolarHBondContact N-O 3.35Å; V87-V201 PolarHBondContact O-N 2.93Å
88	Q	97.7	Very high	89.7	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	161	173.1	-67.9	178.5	-44.2	0	0	111	N54 T120 K121 M126 F198 P199 T200	N54-Q88 WeakPolarHBondContact CB-O 3.04Å; N54-Q88 PolarHBondContact N-O 3.46Å; Q88-T120 PolarHBondContact NE2-OG1 3.21Å; Q88-K121 PolarHBondContact NE2-O 3.14Å; Q88-M126 HydrophobicContact CG-CE 3.76Å; Q88-F198 HydrophobicContact CB-CB 4.08Å; Q88-F198 HydrophobicContact CG-CB 4.13Å; Q88-P199 CarbonylContact C-O 3.47Å; Q88-P199 WeakPolarHBondContact CA-O 3.43Å; Q88-T200 HydrophobicContact CG-CG2 4.25Å
89	A	98	Very high	91.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	162	163.8	0	0	0	0	0	111.9	P50 E52 K91 F198 P199 F214	P50-A89 HydrophobicContact CB-CB 3.94Å; E52-A89 CarbonylContact O-C 3.46Å; E52-A89 WeakPolarHBondContact O-CA 3.45Å; A89-K91 VanDerWaalsContact C-N 3.27Å; A89-K91 PolarHBondContact O-N 2.86Å; A89-F198 WeakPolarHBondContact O-CD1 3.2Å; A89-P199 HydrophobicContact CB-CB 3.99Å; A89-P199 HydrophobicContact CB-CG 3.98Å; A89-P199 PolarHBondContact N-O 3.01Å; A89-F214 HydrophobicContact CB-CE1 3.73Å; A89-F214 HydrophobicContact CB-CE2 4.43Å; A89-F214 HydrophobicContact CB-CZ 3.64Å
90	N	97.1	Very high	92.9	Very high	36 Å²	36	26.9 Å²	26.9	19%	0.193	15%	0.145	C	C	.	.	S	Bend	trans	-69.7	-20	178.8	66.6	-32.1	0	0	0	114.6	T51 E52	T51-N90 PolarHBondContact N-OD1 2.97Å; T51-N90 PolarHBondContact OG1-ND2 3.4Å; T51-N90 VanDerWaalsContact OG1-ND2 3.15Å; E52-N90 HydrophobicContact CG-CB 4.07Å; E52-N90 WeakPolarHBondContact CG-ND2 3.27Å; E52-N90 PolarHBondContact N-OD1 3.02Å; E52-N90 PolarHBondContact O-N 3.41Å; E52-N90 PolarHBondContact O-OD1 3.39Å
91	K	97.4	Very high	94.1	Very high	73 Å²	73	22 Å²	22	32%	0.317	12%	0.123	S	C	.	.	S	Bend	trans	-137	156.8	-178.7	-60.9	-67.8	166.9	165.4	0	109.7	E48 P50 A89 F198	E48-K91 HydrophobicContact CB-CD 4.23Å; E48-K91 HydrophobicContact CB-CG 4.4Å; E48-K91 WeakPolarHBondContact OE2-CE 3.44Å; E48-K91 IonicContact OE2-NZ 2.65Å; E48-K91 PolarHBondContact OE2-NZ 3.03Å; P50-K91 HydrophobicContact CG-CB 4.41Å; P50-K91 WeakPolarHBondContact CG-O 3.31Å; A89-K91 VanDerWaalsContact C-N 3.27Å; A89-K91 PolarHBondContact O-N 2.86Å; K91-F198 VanDerWaalsContact C-CE1 3.42Å; K91-F198 WeakPolarHBondContact O-CD1 3.4Å
92	P	97.6	Very high	95.2	Very high	30 Å²	30	19.6 Å²	19.6	20%	0.195	10%	0.098	C	C	.	.	P	Polyproline II helix	trans	-69.9	160.9	172.9	31.2	-35.7	0	0	0	111.1	P50 H196 L197 F198	P50-P92 WeakPolarHBondContact CD-O 3.32Å; P50-P92 VanDerWaalsContact CG-O 3.23Å; P50-P92 WeakPolarHBondContact CG-O 3.5Å; P92-H196 HydrophobicContact CB-CB 3.82Å; P92-H196 HydrophobicContact CG-CB 4.31Å; P92-L197 CarbonylContact C-O 3.6Å; P92-L197 WeakPolarHBondContact CA-O 3.38Å; P92-F198 HydrophobicContact CB-CD2 4.3Å; P92-F198 HydrophobicContact CB-CE1 4.3Å; P92-F198 HydrophobicContact CB-CE2 3.97Å; P92-F198 HydrophobicContact CB-CZ 4Å; P92-F198 HydrophobicContact CG-CZ 4.29Å
93	A	98.1	Very high	96.2	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.008	8%	0.079	C	C	.	.	P	Polyproline II helix	trans	-58.2	129.1	165.6	0	0	0	0	0	109.6	Y100 F119 I170 L197	A93-Y100 HydrophobicContact CB-CD1 3.33Å; A93-Y100 HydrophobicContact CB-CD2 4.3Å; A93-Y100 HydrophobicContact CB-CE1 3.67Å; A93-Y100 HydrophobicContact CB-CG 3.67Å; A93-F119 HydrophobicContact CB-CE1 4.46Å; A93-I170 HydrophobicContact CB-CD1 4.17Å; A93-L197 WeakPolarHBondContact CB-O 3.23Å; A93-L197 PolarHBondContact N-O 3.31Å
94	P	96.9	Very high	96.7	Very high	12 Å²	12	15.2 Å²	15.2	8%	0.078	8%	0.077	C	C	.	.	P	Polyproline II helix	trans	-58	141	175.3	28.5	-39.6	0	0	0	110.6	E47 L49 C97 Y100 Y172	E47-P94 HydrophobicContact CB-CB 4.22Å; E47-P94 WeakPolarHBondContact OE2-CB 3.47Å; L49-P94 HydrophobicContact CD2-CB 3.76Å; L49-P94 HydrophobicContact CD2-CG 3.55Å; P94-C97 PolarHBondContact O-SG 3.16Å; P94-C97 VanDerWaalsContact O-SG 3.41Å; P94-Y100 HydrophobicContact CG-CD2 3.67Å; P94-Y100 HydrophobicContact CG-CE2 4.34Å; P94-Y100 HydrophobicContact CG-CG 4.32Å; P94-Y172 WeakPolarHBondContact O-CE2 3.07Å; P94-Y172 VanDerWaalsContact O-CZ 3.27Å; P94-Y172 PolarHBondContact O-OH 3.46Å
95	I	95.8	Very high	97	Very high	18 Å²	18	19 Å²	19	9%	0.092	9%	0.094	C	C	.	.	S	Bend	trans	-107.4	-10.7	-177.9	61.4	168.5	0	0	0	113.2	E47 C97 Y172 D450 Q451 G452	E47-I95 WeakPolarHBondContact OE1-CG1 3.47Å; E47-I95 PolarHBondContact OE1-N 2.93Å; E47-I95 PolarHBondContact OE2-N 3.49Å; I95-C97 VanDerWaalsContact C-N 3.27Å; I95-C97 PolarHBondContact O-N 2.82Å; I95-Y172 HydrophobicContact CB-CE1 4.46Å; I95-Y172 HydrophobicContact CG2-CE1 4.08Å; I95-D450 WeakPolarHBondContact CD1-O 3.32Å; I95-Q451 HydrophobicContact CB-CB 4.26Å; I95-Q451 HydrophobicContact CB-CG 4.09Å; I95-Q451 HydrophobicContact CD1-CG 4.39Å; I95-Q451 HydrophobicContact CG2-CG 4.1Å; I95-G452 CarbonylContact O-C 3.43Å; I95-G452 WeakPolarHBondContact O-CA 3.4Å; I95-G452 PolarHBondContact O-N 2.84Å
96	K	94.1	Very high	97.3	Very high	70 Å²	70	19 Å²	19	30%	0.304	9%	0.094	S	C	.	.	S	Bend	trans	-89.6	32.4	178.7	-58.1	178.4	-175.5	177.3	0	112.7	D44 E47	D44-K96 IonicContact OD1-NZ 2.68Å; D44-K96 PolarHBondContact OD1-NZ 2.96Å; D44-K96 IonicContact OD2-NZ 3.67Å; D44-K96 PolarHBondContact OD2-NZ 3.49Å; E47-K96 HydrophobicContact CG-CD 4.04Å; E47-K96 HydrophobicContact CG-CG 4.27Å; E47-K96 WeakPolarHBondContact OE2-CA 3.48Å; E47-K96 WeakPolarHBondContact OE2-CB 3.34Å; E47-K96 WeakPolarHBondContact OE2-CG 3.17Å; E47-K96 PolarHBondContact OE2-N 3.02Å
97	C	94.3	Very high	97.4	Very high	29 Å²	29	23.7 Å²	23.7	20%	0.196	11%	0.114	C	C	.	.	S	Bend	trans	-131.3	167.4	-179.5	61.4	0	0	0	0	112.5	P94 I95 T99 Y172 G452 E453	P94-C97 PolarHBondContact O-SG 3.16Å; P94-C97 VanDerWaalsContact O-SG 3.41Å; I95-C97 VanDerWaalsContact C-N 3.27Å; I95-C97 PolarHBondContact O-N 2.82Å; C97-T99 PolarHBondContact SG-O 2.78Å; C97-Y172 WeakPolarHBondContact O-CD2 3.42Å; C97-G452 CarbonylContact O-C 3.06Å; C97-G452 WeakPolarHBondContact O-CA 3.38Å; C97-E453 VanDerWaalsContact C-CG 3.49Å; C97-E453 PolarHBondContact O-N 3.17Å
98	L	95.3	Very high	97.5	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.021	13%	0.128	C	C	.	.	S	Bend	trans	-70.1	-48.6	175.8	-178.3	62.1	0	0	0	110.2	Y172 A173 E227 E230 R231 E453	L98-Y172 PolarHBondContact O-N 2.9Å; L98-A173 HydrophobicContact CD1-CB 3.45Å; L98-A173 VanDerWaalsContact CD1-CB 3.45Å; L98-E227 HydrophobicContact CD2-CB 4.19Å; L98-E227 HydrophobicContact CD2-CG 4.32Å; L98-E230 HydrophobicContact CD2-CB 4.37Å; L98-R231 HydrophobicContact CD2-CG 3.75Å; L98-E453 HydrophobicContact CB-CG 3.84Å
99	T	97.4	Very high	97.4	Very high	9 Å²	9	27.4 Å²	27.4	6%	0.055	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.2	177.8	70.1	0	0	0	0	111.5	C97 I170 N171 Y226 E227	C97-T99 PolarHBondContact SG-O 2.78Å; T99-I170 CarbonylContact C-O 3.38Å; T99-I170 WeakPolarHBondContact CA-O 3.38Å; T99-N171 HydrophobicContact CG2-CB 4.38Å; T99-Y226 HydrophobicContact CG2-CD1 4Å; T99-Y226 HydrophobicContact CG2-CE1 3.75Å; T99-E227 HydrophobicContact CG2-CG 4.01Å; T99-E227 WeakPolarHBondContact OG1-CG 3.32Å; T99-E227 PolarHBondContact OG1-OE1 3.14Å
100	Y	98.1	Very high	97.3	Very high	17 Å²	17	28.3 Å²	28.3	7%	0.067	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	145.1	162.6	172.9	-98.7	0	0	0	109.3	P50 A93 P94 F102 F119 G169 I170 P199	P50-Y100 HydrophobicContact CG-CE2 4.14Å; P50-Y100 WeakPolarHBondContact CG-OH 3.34Å; A93-Y100 HydrophobicContact CB-CD1 3.33Å; A93-Y100 HydrophobicContact CB-CD2 4.3Å; A93-Y100 HydrophobicContact CB-CE1 3.67Å; A93-Y100 HydrophobicContact CB-CG 3.67Å; P94-Y100 HydrophobicContact CG-CD2 3.67Å; P94-Y100 HydrophobicContact CG-CE2 4.34Å; P94-Y100 HydrophobicContact CG-CG 4.32Å; Y100-F102 HydrophobicContact CE1-CB 4.48Å; Y100-F102 HydrophobicContact CE1-CD1 4.05Å; Y100-F119 AromaticContact CD1-CE1 3.88Å; Y100-F119 HydrophobicContact CD1-CE1 3.88Å; Y100-F119 HydrophobicContact CD1-CZ 4.14Å; Y100-F119 AromaticContact CE1-CE1 3.83Å; Y100-F119 HydrophobicContact CE1-CE1 3.83Å; Y100-F119 HydrophobicContact CE1-CZ 4.27Å; Y100-G169 CarbonylContact O-C 3.6Å; Y100-G169 WeakPolarHBondContact O-CA 3.5Å; Y100-I170 PolarHBondContact N-O 3.16Å; Y100-I170 PolarHBondContact O-N 3.38Å; Y100-P199 HydrophobicContact CE1-CG 3.67Å; Y100-P199 WeakPolarHBondContact OH-CG 3.32Å
101	Y	98.8	Very high	97.1	Very high	8 Å²	8	32.1 Å²	32.1	3%	0.031	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	144.1	-176.9	-178.2	-103	0	0	0	112.1	E103 G167 G168 F178 T180 F219 F221 I223	Y101-E103 HydrophobicContact CD1-CG 4.4Å; Y101-E103 HydrophobicContact CE1-CG 3.37Å; Y101-E103 VanDerWaalsContact CE1-OE1 3.27Å; Y101-E103 WeakPolarHBondContact CE1-OE1 3.22Å; Y101-E103 WeakPolarHBondContact OH-CG 3.32Å; Y101-E103 PolarHBondContact OH-OE1 3.31Å; Y101-G167 WeakPolarHBondContact OH-CA 3.36Å; Y101-G168 WeakPolarHBondContact CA-O 3.38Å; Y101-G168 WeakPolarHBondContact CD2-O 3.43Å; Y101-F178 AromaticContact CD2-CE2 3.5Å; Y101-F178 HydrophobicContact CD2-CE2 3.5Å; Y101-F178 VanDerWaalsContact CD2-CE2 3.5Å; Y101-F178 AromaticContact CD2-CZ 3.75Å; Y101-F178 HydrophobicContact CD2-CZ 3.75Å; Y101-F178 AromaticContact CE2-CE2 3.84Å; Y101-F178 HydrophobicContact CE2-CE2 3.84Å; Y101-F178 HydrophobicContact CG-CE2 4.49Å; Y101-F178 HydrophobicContact CG-CZ 4.43Å; Y101-T180 HydrophobicContact CE2-CG2 3.81Å; Y101-T180 PolarHBondContact OH-OG1 3.31Å; Y101-F219 HydrophobicContact CD1-CD1 4.14Å; Y101-F219 AromaticContact CD1-CD2 3.88Å; Y101-F219 HydrophobicContact CD1-CD2 3.88Å; Y101-F219 HydrophobicContact CD1-CE1 4.2Å; Y101-F219 AromaticContact CD1-CE2 3.94Å; Y101-F219 HydrophobicContact CD1-CE2 3.94Å; Y101-F219 AromaticContact CD1-CG 3.97Å; Y101-F219 HydrophobicContact CD1-CG 3.97Å; Y101-F219 HydrophobicContact CD1-CZ 4.09Å; Y101-F219 HydrophobicContact CE1-CB 4.11Å; Y101-F219 AromaticContact CE1-CD1 3.96Å; Y101-F219 HydrophobicContact CE1-CD1 3.96Å; Y101-F219 HydrophobicContact CE1-CD2 4.2Å; Y101-F219 HydrophobicContact CE1-CE1 4.4Å; Y101-F219 AromaticContact CE1-CG 3.84Å; Y101-F219 HydrophobicContact CE1-CG 3.84Å; Y101-F221 HydrophobicContact CD1-CD1 4.39Å; Y101-F221 HydrophobicContact CD2-CD1 4.35Å; Y101-F221 HydrophobicContact CE1-CB 3.84Å; Y101-F221 AromaticContact CE1-CD1 3.98Å; Y101-F221 HydrophobicContact CE1-CD1 3.98Å; Y101-F221 HydrophobicContact CE1-CG 4.38Å; Y101-F221 AromaticContact CE2-CD1 3.95Å; Y101-F221 HydrophobicContact CE2-CD1 3.95Å; Y101-F221 HydrophobicContact CE2-CG 4.48Å; Y101-F221 AromaticContact CZ-CD1 3.75Å; Y101-F221 AromaticContact CZ-CG 4Å; Y101-F221 WeakPolarHBondContact OH-CB 3.43Å; Y101-I223 HydrophobicContact CD1-CB 4.39Å; Y101-I223 HydrophobicContact CG-CD1 4.06Å; Y101-I223 HydrophobicContact CG-CG1 4.45Å
102	F	98.9	Very high	96.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	160.8	171.5	79.2	-71	0	0	0	110.5	Y100 I117 F119 G167 G168 P199 V201 V212 F214	Y100-F102 HydrophobicContact CE1-CB 4.48Å; Y100-F102 HydrophobicContact CE1-CD1 4.05Å; F102-I117 HydrophobicContact CD2-CD1 4.24Å; F102-I117 HydrophobicContact CE1-CD1 4.21Å; F102-I117 HydrophobicContact CE1-CG1 4.14Å; F102-I117 HydrophobicContact CE2-CD1 3.65Å; F102-I117 HydrophobicContact CE2-CG1 3.68Å; F102-I117 HydrophobicContact CZ-CD1 3.64Å; F102-I117 HydrophobicContact CZ-CG1 3.34Å; F102-F119 HydrophobicContact CD1-CE1 4.21Å; F102-F119 HydrophobicContact CD1-CZ 4.01Å; F102-F119 AromaticContact CE1-CE1 3.87Å; F102-F119 HydrophobicContact CE1-CE1 3.87Å; F102-F119 HydrophobicContact CE1-CE2 4.3Å; F102-F119 AromaticContact CE1-CZ 3.72Å; F102-F119 HydrophobicContact CE1-CZ 3.72Å; F102-G167 CarbonylContact O-C 3.54Å; F102-G167 WeakPolarHBondContact O-CA 3.45Å; F102-G168 VanDerWaalsContact CD1-O 3.29Å; F102-G168 WeakPolarHBondContact CD1-O 3.44Å; F102-G168 PolarHBondContact N-O 2.84Å; F102-G168 PolarHBondContact O-N 2.96Å; F102-P199 HydrophobicContact CD1-CB 3.84Å; F102-P199 HydrophobicContact CD1-CG 4.37Å; F102-P199 HydrophobicContact CD2-CB 4.05Å; F102-P199 HydrophobicContact CE1-CB 3.68Å; F102-P199 HydrophobicContact CE2-CB 3.89Å; F102-P199 HydrophobicContact CG-CB 4.01Å; F102-P199 HydrophobicContact CZ-CB 3.7Å; F102-V201 HydrophobicContact CE2-CG2 3.97Å; F102-V212 HydrophobicContact CD2-CG1 4.04Å; F102-V212 HydrophobicContact CE2-CG1 4.43Å; F102-F214 HydrophobicContact CB-CD1 3.94Å; F102-F214 HydrophobicContact CB-CE1 4.46Å; F102-F214 HydrophobicContact CD2-CD1 4.22Å; F102-F214 AromaticContact CD2-CE1 3.92Å; F102-F214 HydrophobicContact CD2-CE1 3.92Å; F102-F214 HydrophobicContact CG-CD1 4.32Å; F102-F214 HydrophobicContact CG-CE1 4.37Å
103	E	98.8	Very high	96.8	Very high	10 Å²	10	33.4 Å²	33.4	5%	0.047	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	154.6	-179.3	-69.7	-179.7	166.2	0	0	112.2	Y101 V166 V212 N213 F219 A220 F221	Y101-E103 HydrophobicContact CD1-CG 4.4Å; Y101-E103 HydrophobicContact CE1-CG 3.37Å; Y101-E103 VanDerWaalsContact CE1-OE1 3.27Å; Y101-E103 WeakPolarHBondContact CE1-OE1 3.22Å; Y101-E103 WeakPolarHBondContact OH-CG 3.32Å; Y101-E103 PolarHBondContact OH-OE1 3.31Å; E103-V166 CarbonylContact C-O 3.49Å; E103-V166 WeakPolarHBondContact CA-O 3.45Å; E103-V212 CarbonylContact O-C 3.51Å; E103-V212 WeakPolarHBondContact O-CA 3.45Å; E103-N213 HydrophobicContact CB-CB 4.45Å; E103-N213 PolarHBondContact N-O 3.35Å; E103-N213 PolarHBondContact O-N 2.75Å; E103-F219 HydrophobicContact CB-CD1 4.2Å; E103-F219 HydrophobicContact CG-CD1 3.78Å; E103-F219 HydrophobicContact CG-CE1 4.38Å; E103-F219 VanDerWaalsContact OE2-CA 3.31Å; E103-F219 WeakPolarHBondContact OE2-CA 3.43Å; E103-A220 PolarHBondContact OE1-N 2.84Å; E103-A220 PolarHBondContact OE2-N 3.2Å; E103-F221 WeakPolarHBondContact OE1-CB 3.4Å; E103-F221 PolarHBondContact OE1-N 3.04Å
104	I	98.8	Very high	96.7	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	148.3	157.6	65.6	173.8	0	0	0	109.8	I115 I117 F160 A165 V166 V201 V210 L211 V212	I104-I115 HydrophobicContact CD1-CG2 3.81Å; I104-I117 HydrophobicContact CD1-CB 4.09Å; I104-I117 HydrophobicContact CG1-CD1 4.17Å; I104-I117 HydrophobicContact CG2-CD1 4.1Å; I104-F160 HydrophobicContact CD1-CE2 4.47Å; I104-A165 CarbonylContact O-C 3.6Å; I104-A165 WeakPolarHBondContact O-CA 3.42Å; I104-V166 HydrophobicContact CG1-CB 4Å; I104-V166 PolarHBondContact N-O 3.21Å; I104-V166 PolarHBondContact O-N 3.4Å; I104-V201 HydrophobicContact CG2-CB 4.47Å; I104-V201 HydrophobicContact CG2-CG1 4.05Å; I104-V201 HydrophobicContact CG2-CG2 3.52Å; I104-V210 HydrophobicContact CD1-CG1 4.35Å; I104-L211 CarbonylContact C-O 3.59Å; I104-L211 WeakPolarHBondContact CA-O 3.24Å; I104-V212 HydrophobicContact CG2-CG1 4.33Å; I104-V212 HydrophobicContact CG2-CG2 4.06Å
105	F	98.8	Very high	96.8	Very high	80 Å²	80	34.7 Å²	34.7	35%	0.351	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.9	165.4	175.8	-96.5	0	0	0	108.3	K107 D163 V210 L211	F105-K107 HydrophobicContact CE1-CB 4.49Å; F105-K107 PolarHBondContact O-N 3.24Å; F105-D163 WeakPolarHBondContact CE2-O 3.12Å; F105-D163 HydrophobicContact CZ-CB 4.42Å; F105-V210 CarbonylContact O-C 3.6Å; F105-V210 WeakPolarHBondContact O-CA 3.4Å; F105-L211 HydrophobicContact CB-CB 4.35Å; F105-L211 HydrophobicContact CD1-CD1 4.09Å; F105-L211 HydrophobicContact CD1-CG 4.45Å; F105-L211 PolarHBondContact N-O 3.49Å; F105-L211 PolarHBondContact O-N 2.84Å
106	V	98.8	Very high	96.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	103.4	-179.7	-175.3	0	0	0	0	109.4	I115 F160 T161 D163 D164 V210	V106-I115 HydrophobicContact CG1-CD1 3.53Å; V106-I115 HydrophobicContact CG2-CD1 4.29Å; V106-F160 HydrophobicContact CG2-CD2 4.1Å; V106-F160 HydrophobicContact CG2-CE2 4.49Å; V106-T161 VanDerWaalsContact CB-O 3.28Å; V106-T161 WeakPolarHBondContact CB-O 3.49Å; V106-D163 PolarHBondContact O-N 2.94Å; V106-D164 PolarHBondContact N-O 3.41Å; V106-V210 HydrophobicContact CG2-CG1 4.37Å
107	K	98.4	Very high	97.2	Very high	98 Å²	98	30.5 Å²	30.5	43%	0.426	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-36.9	179	-178.6	176	167	-165	0	111.8	F105 E209	F105-K107 HydrophobicContact CE1-CB 4.49Å; F105-K107 PolarHBondContact O-N 3.24Å; K107-E209 HydrophobicContact CB-CB 4.4Å; K107-E209 HydrophobicContact CB-CG 4.37Å; K107-E209 WeakPolarHBondContact CB-O 3.46Å; K107-E209 HydrophobicContact CD-CG 4.14Å; K107-E209 WeakPolarHBondContact CD-OE1 3.37Å; K107-E209 WeakPolarHBondContact CE-OE1 3.44Å; K107-E209 PolarHBondContact N-O 3.17Å; K107-E209 IonicContact NZ-OE1 3.8Å; K107-E209 PolarHBondContact NZ-OE1 3.27Å
108	D	98	Very high	97.4	Very high	56 Å²	56	29.1 Å²	29.1	30%	0.299	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	128.8	174.7	-164.9	-26.1	0	0	0	108.8	G110 N207 E208 E209	D108-G110 PolarHBondContact O-N 2.83Å; D108-G110 PolarHBondContact OD1-N 3.2Å; D108-N207 WeakPolarHBondContact CB-O 3.4Å; D108-E208 WeakPolarHBondContact O-CA 3.42Å; D108-E209 HydrophobicContact CB-CB 4.07Å; D108-E209 PolarHBondContact N-O 3.31Å; D108-E209 PolarHBondContact O-N 2.97Å
109	S	96.7	Very high	97.5	Very high	24 Å²	24	28.9 Å²	28.9	17%	0.168	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-6.9	176.3	56.9	0	0	0	0	112.9	G113 T161 E208	S109-G113 WeakPolarHBondContact O-CA 3.44Å; S109-G113 PolarHBondContact O-N 3.45Å; S109-T161 WeakPolarHBondContact CB-OG1 3.11Å; S109-T161 PolarHBondContact OG-OG1 3.48Å; S109-E208 WeakPolarHBondContact O-CG 3.37Å
110	G	94.6	Very high	97.5	Very high	18 Å²	18	28.5 Å²	28.5	19%	0.186	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	-154.6	-173.2	0	0	0	0	0	112.5	D108 Q206	D108-G110 PolarHBondContact O-N 2.83Å; D108-G110 PolarHBondContact OD1-N 3.2Å; G110-Q206 CarbonylContact C-O 3.5Å; G110-Q206 WeakPolarHBondContact CA-O 3.49Å
111	I	93.4	Very high	97.5	Very high	116 Å²	116	30.5 Å²	30.5	60%	0.595	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75	-38.7	-174.6	-62.6	-177.9	0	0	0	112.2	S205 Q206	I111-S205 PolarHBondContact N-OG 3.16Å; I111-Q206 HydrophobicContact CD1-CB 3.84Å; I111-Q206 HydrophobicContact CG1-CB 4.26Å; I111-Q206 PolarHBondContact N-O 3.16Å; I111-Q206 VanDerWaalsContact N-O 3.12Å
112	K	94.4	Very high	97.3	Very high	121 Å²	121	36.7 Å²	36.7	53%	0.526	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-14.3	-170.3	-58.4	-174.9	-179.2	-175	0	114.7	Q114 S205	K112-Q114 VanDerWaalsContact C-N 3.27Å; K112-Q114 HydrophobicContact CB-CG 3.66Å; K112-Q114 PolarHBondContact O-N 2.97Å; K112-S205 PolarHBondContact N-OG 3.08Å
113	G	95.4	Very high	97	Very high	9 Å²	9	41.8 Å²	41.8	9%	0.093	22%	0.216	C	C	.	.			trans	66.9	24	-179.6	0	0	0	0	0	114.7	S109 I115 D142 E208	S109-G113 WeakPolarHBondContact O-CA 3.44Å; S109-G113 PolarHBondContact O-N 3.45Å; G113-I115 PolarHBondContact O-N 2.87Å; G113-D142 PolarHBondContact O-N 2.58Å; G113-E208 PolarHBondContact N-OE1 3Å
114	Q	96	Very high	96.8	Very high	39 Å²	39	42 Å²	42	18%	0.182	22%	0.217	C	C	.	.			trans	-80.8	49.9	-177.6	-56.6	-161.7	-70.2	0	0	111.9	K112 Q129 D142 H204 E208	K112-Q114 VanDerWaalsContact C-N 3.27Å; K112-Q114 HydrophobicContact CB-CG 3.66Å; K112-Q114 PolarHBondContact O-N 2.97Å; Q114-Q129 PolarHBondContact O-NE2 2.96Å; Q114-D142 HydrophobicContact CG-CB 4.09Å; Q114-D142 WeakPolarHBondContact CG-OD2 3.06Å; Q114-D142 PolarHBondContact NE2-OD2 3.35Å; Q114-H204 HydrophobicContact CB-CB 3.93Å; Q114-E208 WeakPolarHBondContact CA-OE1 3.32Å; Q114-E208 PolarHBondContact N-OE1 3.24Å
115	I	98.2	Very high	96.5	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.242	C	C	.	.			trans	-90.7	136.8	178.2	-58.9	173.3	0	0	0	107.7	I104 V106 G113 G141 F160 A202 V203 E208 V210	I104-I115 HydrophobicContact CD1-CG2 3.81Å; V106-I115 HydrophobicContact CG1-CD1 3.53Å; V106-I115 HydrophobicContact CG2-CD1 4.29Å; G113-I115 PolarHBondContact O-N 2.87Å; I115-G141 PolarHBondContact O-N 3.18Å; I115-F160 HydrophobicContact CB-CE2 4.04Å; I115-F160 HydrophobicContact CG2-CE2 3.97Å; I115-F160 VanDerWaalsContact O-CZ 3.3Å; I115-F160 WeakPolarHBondContact O-CZ 3.5Å; I115-A202 CarbonylContact C-O 3.58Å; I115-A202 WeakPolarHBondContact CA-O 3.28Å; I115-V203 HydrophobicContact CG1-CG1 4.36Å; I115-E208 HydrophobicContact CD1-CB 4.24Å; I115-E208 HydrophobicContact CD1-CG 4.04Å; I115-E208 HydrophobicContact CG1-CB 4.09Å; I115-E208 HydrophobicContact CG1-CG 3.79Å; I115-V210 HydrophobicContact CD1-CG1 3.85Å; I115-V210 HydrophobicContact CG1-CG1 4.45Å; I115-V210 HydrophobicContact CG2-CG1 3.65Å
116	A	98.5	Very high	96.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	148.2	176.7	0	0	0	0	0	112.5	P130 Y139 H140 V201 A202	A116-P130 HydrophobicContact CB-CG 3.81Å; A116-Y139 WeakPolarHBondContact CA-O 3.31Å; A116-H140 VanDerWaalsContact CB-CD2 3.49Å; A116-H140 WeakPolarHBondContact CB-CD2 3.49Å; A116-V201 CarbonylContact O-C 3.53Å; A116-V201 WeakPolarHBondContact O-CA 3.43Å; A116-A202 HydrophobicContact CB-CB 4.45Å; A116-A202 PolarHBondContact N-O 2.88Å; A116-A202 PolarHBondContact O-N 2.92Å
117	I	98.8	Very high	95.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	142.9	175.3	-174.8	175.8	0	0	0	109.5	F102 I104 G138 Y139 V166 F179	F102-I117 HydrophobicContact CD2-CD1 4.24Å; F102-I117 HydrophobicContact CE1-CD1 4.21Å; F102-I117 HydrophobicContact CE1-CG1 4.14Å; F102-I117 HydrophobicContact CE2-CD1 3.65Å; F102-I117 HydrophobicContact CE2-CG1 3.68Å; F102-I117 HydrophobicContact CZ-CD1 3.64Å; F102-I117 HydrophobicContact CZ-CG1 3.34Å; I104-I117 HydrophobicContact CD1-CB 4.09Å; I104-I117 HydrophobicContact CG1-CD1 4.17Å; I104-I117 HydrophobicContact CG2-CD1 4.1Å; I117-G138 CarbonylContact O-C 3.57Å; I117-G138 VanDerWaalsContact O-CA 3.27Å; I117-G138 WeakPolarHBondContact O-CA 3.45Å; I117-Y139 HydrophobicContact CG2-CD1 4.34Å; I117-Y139 PolarHBondContact N-O 2.88Å; I117-Y139 PolarHBondContact O-N 2.98Å; I117-V166 WeakPolarHBondContact CD1-O 3.14Å; I117-V166 HydrophobicContact CG2-CG1 3.84Å; I117-F179 HydrophobicContact CG2-CD1 4.21Å; I117-F179 HydrophobicContact CG2-CE1 4.3Å; I117-F179 WeakPolarHBondContact O-CE1 3.2Å
118	G	98.6	Very high	95.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.8	-149	172.4	0	0	0	0	0	114.3	C137 T200	G118-C137 CarbonylContact C-O 3.57Å; G118-C137 VanDerWaalsContact CA-O 3.31Å; G118-C137 WeakPolarHBondContact CA-O 3.24Å; G118-T200 PolarHBondContact N-O 3.4Å; G118-T200 PolarHBondContact O-N 3.06Å
119	F	98.6	Very high	95.3	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	132.8	-172.6	-65.7	-79.3	0	0	0	110.8	A93 Y100 F102 S136 C137 I170 F177 L197 F198 P199	A93-F119 HydrophobicContact CB-CE1 4.46Å; Y100-F119 AromaticContact CD1-CE1 3.88Å; Y100-F119 HydrophobicContact CD1-CE1 3.88Å; Y100-F119 HydrophobicContact CD1-CZ 4.14Å; Y100-F119 AromaticContact CE1-CE1 3.83Å; Y100-F119 HydrophobicContact CE1-CE1 3.83Å; Y100-F119 HydrophobicContact CE1-CZ 4.27Å; F102-F119 HydrophobicContact CD1-CE1 4.21Å; F102-F119 HydrophobicContact CD1-CZ 4.01Å; F102-F119 AromaticContact CE1-CE1 3.87Å; F102-F119 HydrophobicContact CE1-CE1 3.87Å; F102-F119 HydrophobicContact CE1-CE2 4.3Å; F102-F119 AromaticContact CE1-CZ 3.72Å; F102-F119 HydrophobicContact CE1-CZ 3.72Å; F119-S136 WeakPolarHBondContact O-CA 3.24Å; F119-C137 PolarHBondContact N-O 3.12Å; F119-C137 PolarHBondContact O-N 2.91Å; F119-I170 HydrophobicContact CD1-CD1 3.89Å; F119-I170 HydrophobicContact CD1-CG1 4.42Å; F119-I170 HydrophobicContact CD2-CD1 4.5Å; F119-I170 HydrophobicContact CD2-CG1 4.25Å; F119-I170 HydrophobicContact CE1-CD1 3.77Å; F119-I170 HydrophobicContact CE1-CG1 4.07Å; F119-I170 HydrophobicContact CE2-CD1 4.4Å; F119-I170 HydrophobicContact CE2-CG1 3.89Å; F119-I170 HydrophobicContact CG-CD1 4.25Å; F119-I170 HydrophobicContact CG-CG1 4.5Å; F119-I170 HydrophobicContact CZ-CD1 4.05Å; F119-I170 HydrophobicContact CZ-CG1 3.8Å; F119-F177 HydrophobicContact CB-CE1 3.79Å; F119-F177 HydrophobicContact CB-CZ 4.2Å; F119-F177 AromaticContact CD2-CD1 3.51Å; F119-F177 HydrophobicContact CD2-CD1 3.51Å; F119-F177 AromaticContact CD2-CE1 3.48Å; F119-F177 HydrophobicContact CD2-CE1 3.48Å; F119-F177 VanDerWaalsContact CD2-CE1 3.48Å; F119-F177 AromaticContact CE2-CD1 3.96Å; F119-F177 HydrophobicContact CE2-CD1 3.96Å; F119-F177 HydrophobicContact CE2-CE1 4.26Å; F119-F177 HydrophobicContact CG-CD1 4.27Å; F119-F177 AromaticContact CG-CE1 3.77Å; F119-F177 HydrophobicContact CG-CE1 3.77Å; F119-L197 HydrophobicContact CB-CB 4.24Å; F119-L197 HydrophobicContact CB-CD1 4.3Å; F119-L197 HydrophobicContact CD1-CB 4.39Å; F119-F198 WeakPolarHBondContact CA-O 3.46Å; F119-P199 HydrophobicContact CE1-CG 4.46Å
120	T	97.6	Very high	95.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	162.3	-179.3	65.9	0	0	0	0	111	Q88 F124 P130 L197 F198 T200	Q88-T120 PolarHBondContact NE2-OG1 3.21Å; T120-F124 HydrophobicContact CG2-CB 4.4Å; T120-F124 HydrophobicContact CG2-CD1 3.99Å; T120-F124 HydrophobicContact CG2-CD2 3.67Å; T120-F124 HydrophobicContact CG2-CE1 4.15Å; T120-F124 HydrophobicContact CG2-CE2 3.83Å; T120-F124 HydrophobicContact CG2-CG 3.75Å; T120-F124 HydrophobicContact CG2-CZ 4.08Å; T120-P130 HydrophobicContact CG2-CB 3.91Å; T120-L197 CarbonylContact O-C 3.58Å; T120-L197 WeakPolarHBondContact O-CA 3.41Å; T120-F198 PolarHBondContact N-O 3.44Å; T120-F198 VanDerWaalsContact N-O 3.09Å; T120-F198 PolarHBondContact O-N 2.92Å; T120-T200 HydrophobicContact CG2-CG2 3.79Å; T120-T200 WeakPolarHBondContact CG2-OG1 3.49Å; T120-T200 PolarHBondContact OG1-OG1 3.28Å
121	K	96.6	Very high	95.4	Very high	59 Å²	59	45 Å²	45	26%	0.257	21%	0.214	S	C	.	.			trans	-78.9	159.2	169.7	-73	-169.1	170.5	-177.5	0	111.3	Q88 S123 F124 N135 R194 L197	Q88-K121 PolarHBondContact NE2-O 3.14Å; K121-S123 PolarHBondContact O-N 2.81Å; K121-F124 WeakPolarHBondContact O-CB 3.44Å; K121-F124 PolarHBondContact O-N 3.42Å; K121-N135 HydrophobicContact CD-CB 3.72Å; K121-N135 HydrophobicContact CG-CB 4.12Å; K121-R194 WeakPolarHBondContact CE-O 3.47Å; K121-R194 PolarHBondContact NZ-O 3.42Å; K121-L197 HydrophobicContact CG-CD2 4.18Å
122	E	95	Very high	95.5	Very high	138 Å²	138	41.3 Å²	41.3	65%	0.645	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-41.7	175.6	-173	172	-160.6	0	0	113.2	F124 F198	E122-F124 PolarHBondContact O-N 2.81Å; E122-F124 VanDerWaalsContact O-N 3.15Å; E122-F198 HydrophobicContact CB-CD2 4.29Å; E122-F198 HydrophobicContact CB-CE2 3.71Å; E122-F198 HydrophobicContact CB-CZ 4.3Å; E122-F198 HydrophobicContact CG-CE2 4.31Å; E122-F198 HydrophobicContact CG-CZ 4.41Å
123	S	93.8	Very high	95.5	Very high	107 Å²	107	37.3 Å²	37.3	75%	0.748	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	12.2	179.5	59.8	0	0	0	0	114.9	K121	K121-S123 PolarHBondContact O-N 2.81Å
124	F	94.3	Very high	95.4	Very high	16 Å²	16	41.9 Å²	41.9	7%	0.07	20%	0.202	C	C	.	.			trans	-60.5	141.7	-179.7	-178.7	-98.6	0	0	0	111.8	V86 T120 K121 E122 M126 R128 Q129 E133	V86-F124 HydrophobicContact CG1-CE1 4.46Å; V86-F124 HydrophobicContact CG2-CE1 4.07Å; T120-F124 HydrophobicContact CG2-CB 4.4Å; T120-F124 HydrophobicContact CG2-CD1 3.99Å; T120-F124 HydrophobicContact CG2-CD2 3.67Å; T120-F124 HydrophobicContact CG2-CE1 4.15Å; T120-F124 HydrophobicContact CG2-CE2 3.83Å; T120-F124 HydrophobicContact CG2-CG 3.75Å; T120-F124 HydrophobicContact CG2-CZ 4.08Å; K121-F124 WeakPolarHBondContact O-CB 3.44Å; K121-F124 PolarHBondContact O-N 3.42Å; E122-F124 PolarHBondContact O-N 2.81Å; E122-F124 VanDerWaalsContact O-N 3.15Å; F124-M126 HydrophobicContact CB-CE 4.42Å; F124-M126 HydrophobicContact CD1-CE 4.46Å; F124-M126 HydrophobicContact CD1-SD 4.35Å; F124-M126 WeakPolarHBondContact O-CE 3.26Å; F124-M126 PolarHBondContact O-N 2.73Å; F124-R128 HydrophobicContact CE1-CB 4.22Å; F124-R128 VanDerWaalsContact CE1-O 3.27Å; F124-R128 WeakPolarHBondContact CE1-O 3.41Å; F124-R128 HydrophobicContact CZ-CB 3.77Å; F124-R128 WeakPolarHBondContact CZ-O 3.42Å; F124-Q129 WeakPolarHBondContact CZ-O 3.47Å; F124-E133 HydrophobicContact CD2-CB 4.14Å; F124-E133 HydrophobicContact CE2-CB 3.74Å; F124-E133 HydrophobicContact CE2-CG 3.95Å; F124-E133 HydrophobicContact CZ-CG 4.46Å
125	K	91.5	Very high	95.4	Very high	124 Å²	124	43.3 Å²	43.3	54%	0.539	21%	0.211	S	C	.	.			trans	-73.1	114.6	-178.4	-64.5	179.6	-171.1	154.5	0	110.4	R127 R128 E133	K125-R127 PolarHBondContact O-N 3.02Å; K125-R128 HydrophobicContact CB-CG 4.04Å; K125-R128 PolarHBondContact O-N 2.93Å; K125-E133 HydrophobicContact CB-CG 4.48Å; K125-E133 HydrophobicContact CD-CG 4.34Å; K125-E133 WeakPolarHBondContact CE-OE2 3.42Å; K125-E133 IonicContact NZ-OE1 3.87Å; K125-E133 IonicContact NZ-OE2 2.76Å; K125-E133 PolarHBondContact NZ-OE2 3.34Å
126	M	90.2	Very high	95.3	Very high	24 Å²	24	43.3 Å²	43.3	12%	0.118	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	39.2	-175.2	-61.8	-55.7	162.2	0	0	115.9	N57 A59 V86 Q88 F124	N57-M126 WeakPolarHBondContact ND2-CE 3.46Å; A59-M126 WeakPolarHBondContact CA-O 3.44Å; A59-M126 WeakPolarHBondContact CB-O 3.46Å; V86-M126 VanDerWaalsContact CG1-CA 3.49Å; V86-M126 HydrophobicContact CG1-CB 4.2Å; V86-M126 HydrophobicContact CG1-SD 4.03Å; Q88-M126 HydrophobicContact CG-CE 3.76Å; F124-M126 HydrophobicContact CB-CE 4.42Å; F124-M126 HydrophobicContact CD1-CE 4.46Å; F124-M126 HydrophobicContact CD1-SD 4.35Å; F124-M126 WeakPolarHBondContact O-CE 3.26Å; F124-M126 PolarHBondContact O-N 2.73Å
127	R	89.8	Confident	95.3	Very high	125 Å²	125	43.3 Å²	43.3	47%	0.472	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-147.1	25.1	172.1	-69.2	-166.3	178.7	-165.7	-2.4	112	K125	K125-R127 PolarHBondContact O-N 3.02Å
128	R	93	Very high	95.3	Very high	64 Å²	64	43.3 Å²	43.3	24%	0.242	21%	0.211	C	C	.	.	S	Bend	trans	-134.7	149.6	-173.9	-57.3	-66.1	-73.8	147.2	2.9	108.7	F124 K125 E133	F124-R128 HydrophobicContact CE1-CB 4.22Å; F124-R128 VanDerWaalsContact CE1-O 3.27Å; F124-R128 WeakPolarHBondContact CE1-O 3.41Å; F124-R128 HydrophobicContact CZ-CB 3.77Å; F124-R128 WeakPolarHBondContact CZ-O 3.42Å; K125-R128 HydrophobicContact CB-CG 4.04Å; K125-R128 PolarHBondContact O-N 2.93Å; R128-E133 HydrophobicContact CB-CG 3.95Å; R128-E133 HydrophobicContact CG-CG 3.85Å; R128-E133 WeakPolarHBondContact CG-OE1 3.45Å; R128-E133 IonicContact CZ-OE1 3.82Å; R128-E133 IonicContact NE-OE1 3.28Å; R128-E133 PolarHBondContact NE-OE1 3.48Å; R128-E133 IonicContact NH2-OE1 2.97Å
129	Q	95.2	Very high	95.3	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	21%	0.211	C	C	.	.			trans	-75.8	149	172.9	-65.6	-155.7	24.1	0	0	110.8	V84 Q114 F124 G131 W132 H140 A202 H204	V84-Q129 HydrophobicContact CG1-CG 3.71Å; V84-Q129 HydrophobicContact CG2-CG 4.19Å; Q114-Q129 PolarHBondContact O-NE2 2.96Å; F124-Q129 WeakPolarHBondContact CZ-O 3.47Å; Q129-G131 PolarHBondContact O-N 2.7Å; Q129-W132 HydrophobicContact CB-CD2 3.8Å; Q129-W132 HydrophobicContact CB-CE3 4.01Å; Q129-W132 HydrophobicContact CB-CG 4.15Å; Q129-W132 HydrophobicContact CB-CZ2 4.36Å; Q129-W132 HydrophobicContact CB-CZ3 4.42Å; Q129-W132 HydrophobicContact CG-CD2 4.32Å; Q129-W132 HydrophobicContact CG-CE3 4.17Å; Q129-W132 HydrophobicContact CG-CH2 4.07Å; Q129-W132 HydrophobicContact CG-CZ2 4.18Å; Q129-W132 HydrophobicContact CG-CZ3 4.07Å; Q129-W132 WeakPolarHBondContact O-CB 3.44Å; Q129-W132 PolarHBondContact O-N 3.12Å; Q129-H140 PolarHBondContact OE1-CE1 2.92Å; Q129-H140 PolarHBondContact OE1-ND1 3.31Å; Q129-H140 VanDerWaalsContact OE1-ND1 3.07Å; Q129-H140 PolarHBondContact OE1-NE2 3.04Å; Q129-A202 HydrophobicContact CB-CB 4.46Å; Q129-A202 HydrophobicContact CG-CB 4.16Å; Q129-H204 PolarHBondContact NE2-ND1 3.31Å
130	P	96.8	Very high	95.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	134.2	172.4	25.2	-34.3	0	0	0	109.7	A116 T120 G138 H140 T200	A116-P130 HydrophobicContact CB-CG 3.81Å; T120-P130 HydrophobicContact CG2-CB 3.91Å; P130-G138 WeakPolarHBondContact O-CA 3.18Å; P130-H140 PolarHBondContact O-NE2 2.79Å; P130-T200 HydrophobicContact CB-CG2 4.37Å
131	G	97.1	Very high	95.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	-10.9	-174.7	0	0	0	0	0	115.2	Q129 S136 Y147 R148 G149 Q150	Q129-G131 PolarHBondContact O-N 2.7Å; G131-S136 VanDerWaalsContact CA-OG 3.25Å; G131-S136 WeakPolarHBondContact CA-OG 3.38Å; G131-S136 PolarHBondContact N-OG 3.32Å; G131-Y147 VanDerWaalsContact CA-O 3.24Å; G131-Y147 WeakPolarHBondContact CA-O 3.32Å; G131-Y147 CarbonylContact O-C 3.59Å; G131-Y147 WeakPolarHBondContact O-CB 3.34Å; G131-R148 PolarHBondContact O-N 3.29Å; G131-G149 CarbonylContact O-C 3.55Å; G131-G149 WeakPolarHBondContact O-CA 3.23Å; G131-G149 PolarHBondContact O-N 3.09Å; G131-Q150 PolarHBondContact O-N 2.81Å; G131-Q150 VanDerWaalsContact O-N 3.17Å
132	W	95.7	Very high	95.4	Very high	40 Å²	40	42.6 Å²	42.6	15%	0.152	21%	0.21	C	C	.	.	S	Bend	trans	-87.2	-12.3	178.7	-74.8	3.8	0	0	0	115	V84 Q129 H140 Y147	V84-W132 HydrophobicContact CG2-CZ3 4.05Å; Q129-W132 HydrophobicContact CB-CD2 3.8Å; Q129-W132 HydrophobicContact CB-CE3 4.01Å; Q129-W132 HydrophobicContact CB-CG 4.15Å; Q129-W132 HydrophobicContact CB-CZ2 4.36Å; Q129-W132 HydrophobicContact CB-CZ3 4.42Å; Q129-W132 HydrophobicContact CG-CD2 4.32Å; Q129-W132 HydrophobicContact CG-CE3 4.17Å; Q129-W132 HydrophobicContact CG-CH2 4.07Å; Q129-W132 HydrophobicContact CG-CZ2 4.18Å; Q129-W132 HydrophobicContact CG-CZ3 4.07Å; Q129-W132 WeakPolarHBondContact O-CB 3.44Å; Q129-W132 PolarHBondContact O-N 3.12Å; W132-H140 AromaticContact CD1-CE1 3.88Å; W132-H140 AromaticContact CE2-CE1 3.81Å; W132-H140 AromaticContact NE1-CE1 3.27Å; W132-H140 PolarHBondContact NE1-CE1 3.13Å; W132-H140 VanDerWaalsContact NE1-CE1 3.27Å; W132-Y147 AromaticContact CD1-CD1 3.37Å; W132-Y147 AromaticContact CD1-CE1 3.83Å; W132-Y147 AromaticContact CD1-CG 3.82Å; W132-Y147 AromaticContact NE1-CD1 3.39Å; W132-Y147 AromaticContact NE1-CE1 3.36Å; W132-Y147 AromaticContact NE1-CG 3.89Å; W132-Y147 AromaticContact NE1-CZ 3.88Å
133	E	94.5	Very high	95.5	Very high	36 Å²	36	37.9 Å²	37.9	17%	0.168	19%	0.189	C	C	.	.	S	Bend	trans	-121.8	148.2	177.6	-62.6	-69.8	144.8	0	0	110.6	F124 K125 R128 S136 G149	F124-E133 HydrophobicContact CD2-CB 4.14Å; F124-E133 HydrophobicContact CE2-CB 3.74Å; F124-E133 HydrophobicContact CE2-CG 3.95Å; F124-E133 HydrophobicContact CZ-CG 4.46Å; K125-E133 HydrophobicContact CB-CG 4.48Å; K125-E133 HydrophobicContact CD-CG 4.34Å; K125-E133 WeakPolarHBondContact CE-OE2 3.42Å; K125-E133 IonicContact NZ-OE1 3.87Å; K125-E133 IonicContact NZ-OE2 2.76Å; K125-E133 PolarHBondContact NZ-OE2 3.34Å; R128-E133 HydrophobicContact CB-CG 3.95Å; R128-E133 HydrophobicContact CG-CG 3.85Å; R128-E133 WeakPolarHBondContact CG-OE1 3.45Å; R128-E133 IonicContact CZ-OE1 3.82Å; R128-E133 IonicContact NE-OE1 3.28Å; R128-E133 PolarHBondContact NE-OE1 3.48Å; R128-E133 IonicContact NH2-OE1 2.97Å; E133-S136 WeakPolarHBondContact O-CB 3.32Å; E133-S136 PolarHBondContact O-N 3.24Å; E133-S136 PolarHBondContact O-OG 3.15Å; E133-G149 WeakPolarHBondContact O-CA 3.48Å
134	V	94.3	Very high	95.7	Very high	106 Å²	106	32.8 Å²	32.8	64%	0.642	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.1	146.1	177.9	69.2	0	0	0	0	111.9	S136 G149	V134-S136 VanDerWaalsContact C-N 3.27Å; V134-S136 PolarHBondContact O-N 2.76Å; V134-G149 PolarHBondContact N-O 3.14Å
135	N	95.1	Very high	95.9	Very high	68 Å²	68	36.3 Å²	36.3	36%	0.364	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	33.5	-176.1	-55.6	-62.3	0	0	0	113.8	K121 I193	K121-N135 HydrophobicContact CD-CB 3.72Å; K121-N135 HydrophobicContact CG-CB 4.12Å; N135-I193 HydrophobicContact CB-CG2 3.88Å
136	S	97.2	Very high	96.2	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.007	14%	0.142	C	C	.	.			trans	-136.1	156	167.5	68.7	0	0	0	0	111.8	F119 G131 E133 V134 R148 G149	F119-S136 WeakPolarHBondContact O-CA 3.24Å; G131-S136 VanDerWaalsContact CA-OG 3.25Å; G131-S136 WeakPolarHBondContact CA-OG 3.38Å; G131-S136 PolarHBondContact N-OG 3.32Å; E133-S136 WeakPolarHBondContact O-CB 3.32Å; E133-S136 PolarHBondContact O-N 3.24Å; E133-S136 PolarHBondContact O-OG 3.15Å; V134-S136 VanDerWaalsContact C-N 3.27Å; V134-S136 PolarHBondContact O-N 2.76Å; S136-R148 CarbonylContact O-C 3.5Å; S136-G149 PolarHBondContact O-N 3.23Å
137	C	98	Very high	96.6	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.007	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	137.8	174.2	-178.6	0	0	0	0	109.3	G118 F119 Y147 F177 I193	G118-C137 CarbonylContact C-O 3.57Å; G118-C137 VanDerWaalsContact CA-O 3.31Å; G118-C137 WeakPolarHBondContact CA-O 3.24Å; F119-C137 PolarHBondContact N-O 3.12Å; F119-C137 PolarHBondContact O-N 2.91Å; C137-Y147 CarbonylContact C-O 3.39Å; C137-Y147 VanDerWaalsContact CA-O 3.28Å; C137-Y147 WeakPolarHBondContact CA-O 3.46Å; C137-F177 HydrophobicContact CB-CD2 4.06Å; C137-F177 HydrophobicContact CB-CE2 3.79Å; C137-F177 HydrophobicContact CB-CZ 4.27Å; C137-I193 HydrophobicContact CB-CD1 4.15Å
138	G	98.3	Very high	96.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	143.1	176.3	0	0	0	0	0	113.6	I117 P130 L146 Y147	I117-G138 CarbonylContact O-C 3.57Å; I117-G138 VanDerWaalsContact O-CA 3.27Å; I117-G138 WeakPolarHBondContact O-CA 3.45Å; P130-G138 WeakPolarHBondContact O-CA 3.18Å; G138-L146 WeakPolarHBondContact O-CD1 3.49Å; G138-Y147 PolarHBondContact N-O 2.99Å; G138-Y147 PolarHBondContact O-N 2.93Å
139	Y	98.7	Very high	97	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125	174.6	173.1	-142.7	0	0	0	109.2	A116 I117 F156 P158 F160 V166 F179 V186	A116-Y139 WeakPolarHBondContact CA-O 3.31Å; I117-Y139 HydrophobicContact CG2-CD1 4.34Å; I117-Y139 PolarHBondContact N-O 2.88Å; I117-Y139 PolarHBondContact O-N 2.98Å; Y139-F156 AromaticContact CD2-CD1 3.93Å; Y139-F156 HydrophobicContact CD2-CD1 3.93Å; Y139-F156 HydrophobicContact CD2-CE1 4.46Å; Y139-F156 HydrophobicContact CE2-CD1 4.21Å; Y139-F156 HydrophobicContact CG-CD1 4.4Å; Y139-P158 WeakPolarHBondContact OH-CD 3.14Å; Y139-P158 PolarHBondContact OH-O 3.16Å; Y139-F160 HydrophobicContact CD1-CD1 4.25Å; Y139-F160 AromaticContact CD1-CE1 3.79Å; Y139-F160 HydrophobicContact CD1-CE1 3.79Å; Y139-F160 HydrophobicContact CD2-CE1 4.32Å; Y139-F160 AromaticContact CE1-CD1 3.7Å; Y139-F160 HydrophobicContact CE1-CD1 3.7Å; Y139-F160 AromaticContact CE1-CE1 3.73Å; Y139-F160 HydrophobicContact CE1-CE1 3.73Å; Y139-F160 HydrophobicContact CE2-CD1 4.33Å; Y139-F160 HydrophobicContact CE2-CE1 4.24Å; Y139-F160 HydrophobicContact CG-CE1 4.1Å; Y139-F160 AromaticContact CZ-CD1 3.74Å; Y139-F160 AromaticContact CZ-CE1 3.96Å; Y139-V166 HydrophobicContact CD1-CG1 3.86Å; Y139-V166 HydrophobicContact CE1-CG1 3.78Å; Y139-F179 HydrophobicContact CD1-CB 3.86Å; Y139-F179 AromaticContact CD1-CD1 3.96Å; Y139-F179 HydrophobicContact CD1-CD1 3.96Å; Y139-F179 HydrophobicContact CD1-CG 4.06Å; Y139-F179 HydrophobicContact CE1-CB 4.4Å; Y139-F179 HydrophobicContact CG-CB 4.43Å; Y139-F179 HydrophobicContact CG-CD1 4.2Å; Y139-F179 HydrophobicContact CG-CG 4.27Å; Y139-V186 HydrophobicContact CE1-CG2 3.94Å
140	H	98.6	Very high	96.6	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.009	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	140.4	-168	-71.6	-146.3	0	0	0	110.9	A116 Q129 P130 W132 D143 G144 Y145 Y147 F160	A116-H140 VanDerWaalsContact CB-CD2 3.49Å; A116-H140 WeakPolarHBondContact CB-CD2 3.49Å; Q129-H140 PolarHBondContact OE1-CE1 2.92Å; Q129-H140 PolarHBondContact OE1-ND1 3.31Å; Q129-H140 VanDerWaalsContact OE1-ND1 3.07Å; Q129-H140 PolarHBondContact OE1-NE2 3.04Å; P130-H140 PolarHBondContact O-NE2 2.79Å; W132-H140 AromaticContact CD1-CE1 3.88Å; W132-H140 AromaticContact CE2-CE1 3.81Å; W132-H140 AromaticContact NE1-CE1 3.27Å; W132-H140 PolarHBondContact NE1-CE1 3.13Å; W132-H140 VanDerWaalsContact NE1-CE1 3.27Å; H140-D143 WeakPolarHBondContact CB-OD1 3.37Å; H140-G144 VanDerWaalsContact O-CA 3.22Å; H140-G144 WeakPolarHBondContact O-CA 3.48Å; H140-G144 PolarHBondContact O-N 3.35Å; H140-G144 VanDerWaalsContact O-N 3.09Å; H140-Y145 PolarHBondContact N-O 2.96Å; H140-Y147 HydrophobicContact CB-CD2 4.29Å; H140-Y147 HydrophobicContact CB-CE2 4.03Å; H140-Y147 AromaticContact CD2-CD2 3.5Å; H140-Y147 VanDerWaalsContact CD2-CD2 3.5Å; H140-Y147 WeakPolarHBondContact CD2-CD2 3.4Å; H140-Y147 AromaticContact CE1-CD2 3.59Å; H140-Y147 AromaticContact CE1-CE2 3.77Å; H140-Y147 AromaticContact CG-CD2 3.55Å; H140-Y147 AromaticContact CG-CE2 3.55Å; H140-Y147 AromaticContact ND1-CD2 3.59Å; H140-Y147 AromaticContact ND1-CE2 3.37Å; H140-Y147 WeakPolarHBondContact ND1-CE2 3.43Å; H140-Y147 AromaticContact NE2-CD2 3.53Å; H140-Y147 AromaticContact NE2-CG 3.97Å; H140-F160 VanDerWaalsContact C-CE1 3.46Å
141	G	98.3	Very high	95.9	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.01	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-30.9	-170.6	0	0	0	0	0	115.1	I115 K159 F160	I115-G141 PolarHBondContact O-N 3.18Å; G141-K159 WeakPolarHBondContact O-CA 3.45Å; G141-K159 VanDerWaalsContact O-CB 3.26Å; G141-K159 WeakPolarHBondContact O-CB 3.49Å; G141-F160 VanDerWaalsContact CA-CD1 3.49Å; G141-F160 VanDerWaalsContact CA-CE2 3.47Å; G141-F160 PolarHBondContact O-N 2.65Å
142	D	97.6	Very high	95.6	Very high	41 Å²	41	44.9 Å²	44.9	22%	0.219	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-31.4	-174.6	56.3	-39.3	0	0	0	113	G113 Q114 K159	G113-D142 PolarHBondContact O-N 2.58Å; Q114-D142 HydrophobicContact CG-CB 4.09Å; Q114-D142 WeakPolarHBondContact CG-OD2 3.06Å; Q114-D142 PolarHBondContact NE2-OD2 3.35Å; D142-K159 WeakPolarHBondContact O-CD 3.49Å; D142-K159 WeakPolarHBondContact O-CE 3.35Å; D142-K159 PolarHBondContact O-NZ 3.22Å
143	D	97.7	Very high	95.6	Very high	38 Å²	38	43.5 Å²	43.5	20%	0.203	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-18.1	-179.9	61.4	10.4	0	0	0	114.3	H140 Y145 Y147	H140-D143 WeakPolarHBondContact CB-OD1 3.37Å; D143-Y145 VanDerWaalsContact C-N 3.27Å; D143-Y145 HydrophobicContact CB-CD1 4.25Å; D143-Y145 HydrophobicContact CB-CD2 4.44Å; D143-Y145 HydrophobicContact CB-CG 4.16Å; D143-Y145 WeakPolarHBondContact OD1-CB 3.49Å; D143-Y145 PolarHBondContact OD1-N 3.14Å; D143-Y145 WeakPolarHBondContact OD2-CD2 3.3Å; D143-Y147 PolarHBondContact OD2-OH 2.99Å; D143-Y147 VanDerWaalsContact OD2-OH 3.13Å
144	G	98.3	Very high	95.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.			trans	77.2	14.5	-174.8	0	0	0	0	0	113.1	H140 G157 P158	H140-G144 VanDerWaalsContact O-CA 3.22Å; H140-G144 WeakPolarHBondContact O-CA 3.48Å; H140-G144 PolarHBondContact O-N 3.35Å; H140-G144 VanDerWaalsContact O-N 3.09Å; G144-G157 WeakPolarHBondContact CA-O 3.44Å; G144-G157 PolarHBondContact O-N 3.25Å; G144-G157 VanDerWaalsContact O-O 3.06Å; G144-P158 WeakPolarHBondContact CA-O 3.46Å
145	Y	98.6	Very high	95.9	Very high	90 Å²	90	47.3 Å²	47.3	35%	0.353	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	157.8	-175.9	-72.6	5.9	0	0	0	112.2	H140 D143 E154 P155	H140-Y145 PolarHBondContact N-O 2.96Å; D143-Y145 VanDerWaalsContact C-N 3.27Å; D143-Y145 HydrophobicContact CB-CD1 4.25Å; D143-Y145 HydrophobicContact CB-CD2 4.44Å; D143-Y145 HydrophobicContact CB-CG 4.16Å; D143-Y145 WeakPolarHBondContact OD1-CB 3.49Å; D143-Y145 PolarHBondContact OD1-N 3.14Å; D143-Y145 WeakPolarHBondContact OD2-CD2 3.3Å; Y145-E154 CarbonylContact C-O 3.42Å; Y145-E154 VanDerWaalsContact CA-O 3.22Å; Y145-E154 WeakPolarHBondContact CA-O 3.44Å; Y145-E154 VanDerWaalsContact CB-O 3.31Å; Y145-E154 WeakPolarHBondContact CB-O 3.43Å; Y145-P155 HydrophobicContact CD1-CB 4.42Å; Y145-P155 HydrophobicContact CE1-CB 4.04Å; Y145-P155 HydrophobicContact CE1-CG 3.88Å
146	L	98.2	Very high	96.1	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.4	170.1	-167.1	75.8	0	0	0	110.1	G138 R148 G153 E154 F156 F179 I189	G138-L146 WeakPolarHBondContact O-CD1 3.49Å; L146-R148 HydrophobicContact CD2-CG 4.09Å; L146-R148 HydrophobicContact CG-CG 4.25Å; L146-G153 WeakPolarHBondContact O-CA 3.49Å; L146-E154 PolarHBondContact N-O 2.94Å; L146-E154 PolarHBondContact O-N 2.89Å; L146-F156 HydrophobicContact CB-CB 3.56Å; L146-F156 HydrophobicContact CB-CD1 3.97Å; L146-F156 HydrophobicContact CB-CD2 4.18Å; L146-F156 HydrophobicContact CB-CG 3.65Å; L146-F156 HydrophobicContact CD1-CD1 4.05Å; L146-F156 HydrophobicContact CD1-CE1 4.06Å; L146-F156 HydrophobicContact CD1-CG 4.44Å; L146-F156 HydrophobicContact CD1-CZ 4.49Å; L146-F156 HydrophobicContact CD2-CD2 4.01Å; L146-F156 HydrophobicContact CD2-CE2 4.13Å; L146-F156 HydrophobicContact CD2-CG 4.25Å; L146-F156 HydrophobicContact CD2-CZ 4.45Å; L146-F156 HydrophobicContact CG-CD1 4.44Å; L146-F156 HydrophobicContact CG-CG 4.35Å; L146-F179 HydrophobicContact CD1-CD2 4.01Å; L146-F179 HydrophobicContact CD1-CE2 3.47Å; L146-F179 VanDerWaalsContact CD1-CE2 3.47Å; L146-F179 HydrophobicContact CD1-CZ 4Å; L146-I189 HydrophobicContact CD2-CB 4.34Å; L146-I189 HydrophobicContact CD2-CD1 3.6Å; L146-I189 HydrophobicContact CD2-CG1 3.74Å; L146-I189 HydrophobicContact CD2-CG2 3.79Å
147	Y	98	Very high	96.1	Very high	26 Å²	26	47.2 Å²	47.2	10%	0.102	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.1	177.1	-69.7	-101.2	0	0	0	109.5	G131 W132 C137 G138 H140 D143 G153	G131-Y147 VanDerWaalsContact CA-O 3.24Å; G131-Y147 WeakPolarHBondContact CA-O 3.32Å; G131-Y147 CarbonylContact O-C 3.59Å; G131-Y147 WeakPolarHBondContact O-CB 3.34Å; W132-Y147 AromaticContact CD1-CD1 3.37Å; W132-Y147 AromaticContact CD1-CE1 3.83Å; W132-Y147 AromaticContact CD1-CG 3.82Å; W132-Y147 AromaticContact NE1-CD1 3.39Å; W132-Y147 AromaticContact NE1-CE1 3.36Å; W132-Y147 AromaticContact NE1-CG 3.89Å; W132-Y147 AromaticContact NE1-CZ 3.88Å; C137-Y147 CarbonylContact C-O 3.39Å; C137-Y147 VanDerWaalsContact CA-O 3.28Å; C137-Y147 WeakPolarHBondContact CA-O 3.46Å; G138-Y147 PolarHBondContact N-O 2.99Å; G138-Y147 PolarHBondContact O-N 2.93Å; H140-Y147 HydrophobicContact CB-CD2 4.29Å; H140-Y147 HydrophobicContact CB-CE2 4.03Å; H140-Y147 AromaticContact CD2-CD2 3.5Å; H140-Y147 VanDerWaalsContact CD2-CD2 3.5Å; H140-Y147 WeakPolarHBondContact CD2-CD2 3.4Å; H140-Y147 AromaticContact CE1-CD2 3.59Å; H140-Y147 AromaticContact CE1-CE2 3.77Å; H140-Y147 AromaticContact CG-CD2 3.55Å; H140-Y147 AromaticContact CG-CE2 3.55Å; H140-Y147 AromaticContact ND1-CD2 3.59Å; H140-Y147 AromaticContact ND1-CE2 3.37Å; H140-Y147 WeakPolarHBondContact ND1-CE2 3.43Å; H140-Y147 AromaticContact NE2-CD2 3.53Å; H140-Y147 AromaticContact NE2-CG 3.97Å; D143-Y147 PolarHBondContact OD2-OH 2.99Å; D143-Y147 VanDerWaalsContact OD2-OH 3.13Å; Y147-G153 VanDerWaalsContact CE1-CA 3.43Å
148	R	96.1	Very high	96.1	Very high	99 Å²	99	50.2 Å²	50.2	37%	0.374	27%	0.269	S	S	.	.	S	Bend	trans	-130.5	46.9	-170.4	-58	-178.8	74.5	-145.7	2	113.2	G131 S136 L146 I189 P190 D192	G131-R148 PolarHBondContact O-N 3.29Å; S136-R148 CarbonylContact O-C 3.5Å; L146-R148 HydrophobicContact CD2-CG 4.09Å; L146-R148 HydrophobicContact CG-CG 4.25Å; R148-I189 HydrophobicContact CG-CD1 4.47Å; R148-P190 PolarHBondContact NH2-O 3Å; R148-D192 IonicContact CZ-OD2 3.95Å; R148-D192 IonicContact NH1-OD2 3.5Å; R148-D192 IonicContact NH2-OD2 3.74Å; R148-D192 PolarHBondContact NH2-OD2 3.38Å
149	G	93.6	Very high	96.1	Very high	15 Å²	15	56.3 Å²	56.3	16%	0.155	30%	0.296	C	S	.	.	S	Bend	trans	87	21.8	177.7	0	0	0	0	0	115.7	G131 E133 V134 S136	G131-G149 CarbonylContact O-C 3.55Å; G131-G149 WeakPolarHBondContact O-CA 3.23Å; G131-G149 PolarHBondContact O-N 3.09Å; E133-G149 WeakPolarHBondContact O-CA 3.48Å; V134-G149 PolarHBondContact N-O 3.14Å; S136-G149 PolarHBondContact O-N 3.23Å
150	Q	87.1	Confident	96.1	Very high	140 Å²	140	56.6 Å²	56.6	65%	0.654	30%	0.297	S	S	*	.	S	Bend	trans	-137.1	156.1	174.8	-61.9	-176.2	-11.8	0	0	109.1	G131 K152	G131-Q150 PolarHBondContact O-N 2.81Å; G131-Q150 VanDerWaalsContact O-N 3.17Å; Q150-K152 PolarHBondContact O-N 3.21Å
151	G	82.3	Confident	96.1	Very high	60 Å²	60	59.8 Å²	59.8	62%	0.619	32%	0.317	S	S	*	.	S	Bend	trans	-72.1	-4.4	-179.9	0	0	0	0	0	115.1
152	K	92.3	Very high	96.1	Very high	175 Å²	175	64.9 Å²	64.9	76%	0.761	34%	0.339	S	S	*	.			trans	-105.1	121.2	177.9	-174.3	-177.2	177.8	-172.3	0	109.3	Q150	Q150-K152 PolarHBondContact O-N 3.21Å
153	G	95.2	Very high	96.2	Very high	10 Å²	10	67.8 Å²	67.8	10%	0.103	35%	0.354	C	S	.	.			trans	-85.3	162.1	175.4	0	0	0	0	0	112.2	L146 Y147	L146-G153 WeakPolarHBondContact O-CA 3.49Å; Y147-G153 VanDerWaalsContact CE1-CA 3.43Å
154	E	96.9	Very high	96.2	Very high	116 Å²	116	66.8 Å²	66.8	54%	0.542	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	142.5	176.2	-62.3	-179.8	152.3	0	0	110.1	Y145 L146 F156	Y145-E154 CarbonylContact C-O 3.42Å; Y145-E154 VanDerWaalsContact CA-O 3.22Å; Y145-E154 WeakPolarHBondContact CA-O 3.44Å; Y145-E154 VanDerWaalsContact CB-O 3.31Å; Y145-E154 WeakPolarHBondContact CB-O 3.43Å; L146-E154 PolarHBondContact N-O 2.94Å; L146-E154 PolarHBondContact O-N 2.89Å; E154-F156 PolarHBondContact O-N 2.87Å
155	P	98	Very high	96.3	Very high	107 Å²	107	67.4 Å²	67.4	70%	0.695	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54	128.9	172.6	-24.2	33.5	0	0	0	111.3	Y145	Y145-P155 HydrophobicContact CD1-CB 4.42Å; Y145-P155 HydrophobicContact CE1-CB 4.04Å; Y145-P155 HydrophobicContact CE1-CG 3.88Å
156	F	98.4	Very high	96.3	Very high	44 Å²	44	63.1 Å²	63.1	19%	0.193	34%	0.338	C	S	.	.			trans	-141.8	-56.3	-172.8	177.6	-111.8	0	0	0	113.4	Y139 L146 E154 F179 V186 G187 I189	Y139-F156 AromaticContact CD2-CD1 3.93Å; Y139-F156 HydrophobicContact CD2-CD1 3.93Å; Y139-F156 HydrophobicContact CD2-CE1 4.46Å; Y139-F156 HydrophobicContact CE2-CD1 4.21Å; Y139-F156 HydrophobicContact CG-CD1 4.4Å; L146-F156 HydrophobicContact CB-CB 3.56Å; L146-F156 HydrophobicContact CB-CD1 3.97Å; L146-F156 HydrophobicContact CB-CD2 4.18Å; L146-F156 HydrophobicContact CB-CG 3.65Å; L146-F156 HydrophobicContact CD1-CD1 4.05Å; L146-F156 HydrophobicContact CD1-CE1 4.06Å; L146-F156 HydrophobicContact CD1-CG 4.44Å; L146-F156 HydrophobicContact CD1-CZ 4.49Å; L146-F156 HydrophobicContact CD2-CD2 4.01Å; L146-F156 HydrophobicContact CD2-CE2 4.13Å; L146-F156 HydrophobicContact CD2-CG 4.25Å; L146-F156 HydrophobicContact CD2-CZ 4.45Å; L146-F156 HydrophobicContact CG-CD1 4.44Å; L146-F156 HydrophobicContact CG-CG 4.35Å; E154-F156 PolarHBondContact O-N 2.87Å; F156-F179 HydrophobicContact CE1-CB 3.94Å; F156-F179 AromaticContact CE1-CD2 3.61Å; F156-F179 HydrophobicContact CE1-CD2 3.61Å; F156-F179 HydrophobicContact CE1-CE2 4.5Å; F156-F179 HydrophobicContact CE1-CG 4.07Å; F156-F179 HydrophobicContact CZ-CB 4.44Å; F156-F179 AromaticContact CZ-CD2 3.79Å; F156-F179 HydrophobicContact CZ-CD2 3.79Å; F156-V186 HydrophobicContact CD1-CG2 4.34Å; F156-V186 HydrophobicContact CE1-CG2 3.77Å; F156-V186 HydrophobicContact CZ-CG2 4.42Å; F156-G187 VanDerWaalsContact CZ-C 3.49Å; F156-I189 HydrophobicContact CD2-CG2 4.35Å; F156-I189 HydrophobicContact CE2-CG2 3.85Å
157	G	97.8	Very high	96.3	Very high	23 Å²	23	63 Å²	63	24%	0.237	34%	0.337	C	S	.	.	S	Bend	trans	-136.9	-178.2	-176.6	0	0	0	0	0	112.4	G144	G144-G157 WeakPolarHBondContact CA-O 3.44Å; G144-G157 PolarHBondContact O-N 3.25Å; G144-G157 VanDerWaalsContact O-O 3.06Å
158	P	98.4	Very high	96.3	Very high	63 Å²	63	61.7 Å²	61.7	41%	0.409	33%	0.332	S	S	.	.			trans	-65.9	162.6	170.4	29.9	-35.1	0	0	0	110.9	Y139 G144 K181 V186	Y139-P158 WeakPolarHBondContact OH-CD 3.14Å; Y139-P158 PolarHBondContact OH-O 3.16Å; G144-P158 WeakPolarHBondContact CA-O 3.46Å; P158-K181 HydrophobicContact CB-CD 4.42Å; P158-K181 HydrophobicContact CG-CD 3.7Å; P158-V186 HydrophobicContact CG-CG1 4.11Å
159	K	98.6	Very high	96.5	Very high	129 Å²	129	57 Å²	57	56%	0.561	31%	0.314	S	S	*	.			trans	-64.4	157.6	163.1	-64.4	-178.4	-176.5	-143.8	0	110.4	G141 D142 K181	G141-K159 WeakPolarHBondContact O-CA 3.45Å; G141-K159 VanDerWaalsContact O-CB 3.26Å; G141-K159 WeakPolarHBondContact O-CB 3.49Å; D142-K159 WeakPolarHBondContact O-CD 3.49Å; D142-K159 WeakPolarHBondContact O-CE 3.35Å; D142-K159 PolarHBondContact O-NZ 3.22Å; K159-K181 PolarHBondContact O-NZ 3.09Å
160	F	98.7	Very high	96.7	Very high	5 Å²	5	56.3 Å²	56.3	2%	0.022	31%	0.307	C	S	.	.			trans	-135.1	148	171.4	60.7	-102.8	0	0	0	111.3	I104 V106 I115 Y139 H140 G141 D164 V166 K181	I104-F160 HydrophobicContact CD1-CE2 4.47Å; V106-F160 HydrophobicContact CG2-CD2 4.1Å; V106-F160 HydrophobicContact CG2-CE2 4.49Å; I115-F160 HydrophobicContact CB-CE2 4.04Å; I115-F160 HydrophobicContact CG2-CE2 3.97Å; I115-F160 VanDerWaalsContact O-CZ 3.3Å; I115-F160 WeakPolarHBondContact O-CZ 3.5Å; Y139-F160 HydrophobicContact CD1-CD1 4.25Å; Y139-F160 AromaticContact CD1-CE1 3.79Å; Y139-F160 HydrophobicContact CD1-CE1 3.79Å; Y139-F160 HydrophobicContact CD2-CE1 4.32Å; Y139-F160 AromaticContact CE1-CD1 3.7Å; Y139-F160 HydrophobicContact CE1-CD1 3.7Å; Y139-F160 AromaticContact CE1-CE1 3.73Å; Y139-F160 HydrophobicContact CE1-CE1 3.73Å; Y139-F160 HydrophobicContact CE2-CD1 4.33Å; Y139-F160 HydrophobicContact CE2-CE1 4.24Å; Y139-F160 HydrophobicContact CG-CE1 4.1Å; Y139-F160 AromaticContact CZ-CD1 3.74Å; Y139-F160 AromaticContact CZ-CE1 3.96Å; H140-F160 VanDerWaalsContact C-CE1 3.46Å; G141-F160 VanDerWaalsContact CA-CD1 3.49Å; G141-F160 VanDerWaalsContact CA-CE2 3.47Å; G141-F160 PolarHBondContact O-N 2.65Å; F160-D164 VanDerWaalsContact CA-OD2 3.28Å; F160-D164 WeakPolarHBondContact CA-OD2 3.37Å; F160-D164 HydrophobicContact CB-CB 4.18Å; F160-V166 HydrophobicContact CB-CG2 3.63Å; F160-V166 HydrophobicContact CD1-CG1 4.01Å; F160-V166 HydrophobicContact CD1-CG2 3.94Å; F160-V166 HydrophobicContact CD2-CG2 3.71Å; F160-V166 HydrophobicContact CE1-CG1 3.98Å; F160-V166 HydrophobicContact CE2-CG2 4.3Å; F160-V166 HydrophobicContact CG-CG1 4.4Å; F160-V166 HydrophobicContact CG-CG2 3.51Å; F160-V166 HydrophobicContact CZ-CG1 4.35Å; F160-K181 HydrophobicContact CB-CD 4.26Å
161	T	98.6	Very high	97.2	Very high	69 Å²	69	49.6 Å²	49.6	42%	0.423	28%	0.276	S	S	.	.			trans	-149.9	-168.4	-170	-168.6	0	0	0	0	110.3	V106 S109 D163 D164	V106-T161 VanDerWaalsContact CB-O 3.28Å; V106-T161 WeakPolarHBondContact CB-O 3.49Å; S109-T161 WeakPolarHBondContact CB-OG1 3.11Å; S109-T161 PolarHBondContact OG-OG1 3.48Å; T161-D163 PolarHBondContact O-N 3.44Å; T161-D164 PolarHBondContact N-OD2 3.44Å; T161-D164 VanDerWaalsContact O-CB 3.23Å; T161-D164 WeakPolarHBondContact O-CB 3.34Å; T161-D164 PolarHBondContact O-N 3.11Å; T161-D164 VanDerWaalsContact O-N 3.07Å
162	K	98.5	Very high	97.9	Very high	108 Å²	108	46.9 Å²	46.9	47%	0.47	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43.3	136.7	176.9	-177.1	176.4	176.6	179.4	0	112.4	D164	K162-D164 PolarHBondContact O-N 2.91Å
163	D	98.6	Very high	97.9	Very high	102 Å²	102	40.5 Å²	40.5	55%	0.545	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	2.4	-178.5	-54.5	-45.2	0	0	0	115.5	F105 V106 T161	F105-D163 WeakPolarHBondContact CE2-O 3.12Å; F105-D163 HydrophobicContact CZ-CB 4.42Å; V106-D163 PolarHBondContact O-N 2.94Å; T161-D163 PolarHBondContact O-N 3.44Å
164	D	98.9	Very high	97.8	Very high	17 Å²	17	42.3 Å²	42.3	9%	0.091	24%	0.237	C	C	.	.			trans	-80.3	139.4	170.2	-69.8	-46.5	0	0	0	111.7	V106 F160 T161 K162 V166 K181 N182	V106-D164 PolarHBondContact N-O 3.41Å; F160-D164 VanDerWaalsContact CA-OD2 3.28Å; F160-D164 WeakPolarHBondContact CA-OD2 3.37Å; F160-D164 HydrophobicContact CB-CB 4.18Å; T161-D164 PolarHBondContact N-OD2 3.44Å; T161-D164 VanDerWaalsContact O-CB 3.23Å; T161-D164 WeakPolarHBondContact O-CB 3.34Å; T161-D164 PolarHBondContact O-N 3.11Å; T161-D164 VanDerWaalsContact O-N 3.07Å; K162-D164 PolarHBondContact O-N 2.91Å; D164-V166 HydrophobicContact CB-CG2 4.21Å; D164-K181 WeakPolarHBondContact OD1-CE 3.4Å; D164-K181 IonicContact OD1-NZ 2.91Å; D164-K181 PolarHBondContact OD1-NZ 3.13Å; D164-K181 WeakPolarHBondContact OD2-CE 3.32Å; D164-K181 IonicContact OD2-NZ 3.58Å; D164-K181 PolarHBondContact OD2-NZ 3.16Å; D164-N182 WeakPolarHBondContact CA-OD1 3.32Å; D164-N182 PolarHBondContact OD1-ND2 2.62Å
165	A	98.8	Very high	97.7	Very high	14 Å²	14	38.3 Å²	38.3	12%	0.116	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	122.1	164.4	0	0	0	0	0	109.3	I104 K181 N182 A220	I104-A165 CarbonylContact O-C 3.6Å; I104-A165 WeakPolarHBondContact O-CA 3.42Å; A165-K181 CarbonylContact O-C 3.52Å; A165-K181 WeakPolarHBondContact O-CA 3.29Å; A165-N182 PolarHBondContact N-OD1 3.4Å; A165-N182 PolarHBondContact O-N 3.36Å; A165-N182 PolarHBondContact O-OD1 3.47Å; A165-A220 HydrophobicContact CB-CB 3.77Å
166	V	98.9	Very high	97.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	130.1	-174.6	-173.3	0	0	0	0	108.7	E103 I104 I117 Y139 F160 D164 T180	E103-V166 CarbonylContact C-O 3.49Å; E103-V166 WeakPolarHBondContact CA-O 3.45Å; I104-V166 HydrophobicContact CG1-CB 4Å; I104-V166 PolarHBondContact N-O 3.21Å; I104-V166 PolarHBondContact O-N 3.4Å; I117-V166 WeakPolarHBondContact CD1-O 3.14Å; I117-V166 HydrophobicContact CG2-CG1 3.84Å; Y139-V166 HydrophobicContact CD1-CG1 3.86Å; Y139-V166 HydrophobicContact CE1-CG1 3.78Å; F160-V166 HydrophobicContact CB-CG2 3.63Å; F160-V166 HydrophobicContact CD1-CG1 4.01Å; F160-V166 HydrophobicContact CD1-CG2 3.94Å; F160-V166 HydrophobicContact CD2-CG2 3.71Å; F160-V166 HydrophobicContact CE1-CG1 3.98Å; F160-V166 HydrophobicContact CE2-CG2 4.3Å; F160-V166 HydrophobicContact CG-CG1 4.4Å; F160-V166 HydrophobicContact CG-CG2 3.51Å; F160-V166 HydrophobicContact CZ-CG1 4.35Å; D164-V166 HydrophobicContact CB-CG2 4.21Å; V166-T180 WeakPolarHBondContact CA-O 3.34Å; V166-T180 VanDerWaalsContact CG1-O 3.3Å; V166-T180 WeakPolarHBondContact CG1-O 3.16Å
167	G	98.9	Very high	97.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	156.1	-177.5	0	0	0	0	0	113.7	Y101 F102 F179 T180	Y101-G167 WeakPolarHBondContact OH-CA 3.36Å; F102-G167 CarbonylContact O-C 3.54Å; F102-G167 WeakPolarHBondContact O-CA 3.45Å; G167-F179 CarbonylContact O-C 3.58Å; G167-F179 VanDerWaalsContact O-CA 3.22Å; G167-F179 WeakPolarHBondContact O-CA 3.41Å; G167-F179 WeakPolarHBondContact O-CD1 3.37Å; G167-T180 WeakPolarHBondContact CA-OG1 3.27Å; G167-T180 PolarHBondContact N-O 3.08Å; G167-T180 PolarHBondContact N-OG1 3.45Å; G167-T180 PolarHBondContact O-N 3.03Å
168	G	98.8	Very high	97.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.2	171.8	0	0	0	0	0	109.2	Y101 F102	Y101-G168 WeakPolarHBondContact CA-O 3.38Å; Y101-G168 WeakPolarHBondContact CD2-O 3.43Å; F102-G168 VanDerWaalsContact CD1-O 3.29Å; F102-G168 WeakPolarHBondContact CD1-O 3.44Å; F102-G168 PolarHBondContact N-O 2.84Å; F102-G168 PolarHBondContact O-N 2.96Å
169	G	98.7	Very high	97.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	163.8	177.9	0	0	0	0	0	113.7	Y100 F177 F178	Y100-G169 CarbonylContact O-C 3.6Å; Y100-G169 WeakPolarHBondContact O-CA 3.5Å; G169-F177 WeakPolarHBondContact O-CA 3.44Å; G169-F178 VanDerWaalsContact C-CE1 3.43Å; G169-F178 PolarHBondContact N-O 3.39Å; G169-F178 PolarHBondContact O-N 3.39Å
170	I	98.5	Very high	97.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.1	175	-59	166.9	0	0	0	106.8	A93 T99 Y100 F119 Y172 E176 F177 K191 L197	A93-I170 HydrophobicContact CB-CD1 4.17Å; T99-I170 CarbonylContact C-O 3.38Å; T99-I170 WeakPolarHBondContact CA-O 3.38Å; Y100-I170 PolarHBondContact N-O 3.16Å; Y100-I170 PolarHBondContact O-N 3.38Å; F119-I170 HydrophobicContact CD1-CD1 3.89Å; F119-I170 HydrophobicContact CD1-CG1 4.42Å; F119-I170 HydrophobicContact CD2-CD1 4.5Å; F119-I170 HydrophobicContact CD2-CG1 4.25Å; F119-I170 HydrophobicContact CE1-CD1 3.77Å; F119-I170 HydrophobicContact CE1-CG1 4.07Å; F119-I170 HydrophobicContact CE2-CD1 4.4Å; F119-I170 HydrophobicContact CE2-CG1 3.89Å; F119-I170 HydrophobicContact CG-CD1 4.25Å; F119-I170 HydrophobicContact CG-CG1 4.5Å; F119-I170 HydrophobicContact CZ-CD1 4.05Å; F119-I170 HydrophobicContact CZ-CG1 3.8Å; I170-Y172 HydrophobicContact CB-CE1 4.32Å; I170-Y172 HydrophobicContact CB-CE2 4.17Å; I170-Y172 HydrophobicContact CD1-CE1 4.47Å; I170-Y172 WeakPolarHBondContact CD1-OH 3.14Å; I170-Y172 HydrophobicContact CG2-CD1 3.61Å; I170-Y172 HydrophobicContact CG2-CD2 4.17Å; I170-Y172 HydrophobicContact CG2-CE1 3.45Å; I170-Y172 VanDerWaalsContact CG2-CE1 3.45Å; I170-Y172 HydrophobicContact CG2-CE2 3.98Å; I170-Y172 HydrophobicContact CG2-CG 3.99Å; I170-E176 CarbonylContact C-O 3.45Å; I170-E176 WeakPolarHBondContact CA-O 3.43Å; I170-F177 HydrophobicContact CD1-CE1 4.06Å; I170-F177 HydrophobicContact CG1-CD1 3.7Å; I170-F177 HydrophobicContact CG1-CE1 3.73Å; I170-K191 HydrophobicContact CG2-CD 3.55Å; I170-L197 HydrophobicContact CD1-CB 4.5Å; I170-L197 HydrophobicContact CD1-CD1 4.16Å
171	N	97.6	Very high	97.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	107.5	164.4	-177.3	-22.1	0	0	0	107.7	T99 A173 S174 Q175 E176 F178 Y226 E230	T99-N171 HydrophobicContact CG2-CB 4.38Å; N171-A173 VanDerWaalsContact C-N 3.33Å; N171-A173 WeakPolarHBondContact OD1-CB 3.32Å; N171-A173 PolarHBondContact OD1-N 3.13Å; N171-S174 WeakPolarHBondContact CB-OG 3.38Å; N171-S174 PolarHBondContact ND2-OG 3.03Å; N171-S174 PolarHBondContact OD1-N 3.39Å; N171-S174 PolarHBondContact OD1-OG 3.47Å; N171-Q175 VanDerWaalsContact O-CA 3.22Å; N171-Q175 WeakPolarHBondContact O-CA 3.45Å; N171-Q175 PolarHBondContact O-N 3.04Å; N171-E176 PolarHBondContact N-O 3Å; N171-E176 PolarHBondContact O-N 3.38Å; N171-F178 HydrophobicContact CB-CD1 4.43Å; N171-Y226 PolarHBondContact ND2-OH 3.24Å; N171-E230 PolarHBondContact ND2-OE2 2.82Å
172	Y	96.2	Very high	97.8	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.008	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-19.6	-177.5	-66.8	-72	0	0	0	112.9	P94 I95 C97 L98 I170 Q175 Q451 G452	P94-Y172 WeakPolarHBondContact O-CE2 3.07Å; P94-Y172 VanDerWaalsContact O-CZ 3.27Å; P94-Y172 PolarHBondContact O-OH 3.46Å; I95-Y172 HydrophobicContact CB-CE1 4.46Å; I95-Y172 HydrophobicContact CG2-CE1 4.08Å; C97-Y172 WeakPolarHBondContact O-CD2 3.42Å; L98-Y172 PolarHBondContact O-N 2.9Å; I170-Y172 HydrophobicContact CB-CE1 4.32Å; I170-Y172 HydrophobicContact CB-CE2 4.17Å; I170-Y172 HydrophobicContact CD1-CE1 4.47Å; I170-Y172 WeakPolarHBondContact CD1-OH 3.14Å; I170-Y172 HydrophobicContact CG2-CD1 3.61Å; I170-Y172 HydrophobicContact CG2-CD2 4.17Å; I170-Y172 HydrophobicContact CG2-CE1 3.45Å; I170-Y172 VanDerWaalsContact CG2-CE1 3.45Å; I170-Y172 HydrophobicContact CG2-CE2 3.98Å; I170-Y172 HydrophobicContact CG2-CG 3.99Å; Y172-Q175 PolarHBondContact O-NE2 2.86Å; Y172-Q451 HydrophobicContact CD1-CB 3.61Å; Y172-Q451 HydrophobicContact CD1-CG 4.45Å; Y172-Q451 HydrophobicContact CE1-CB 4.04Å; Y172-Q451 HydrophobicContact CE1-CG 4.45Å; Y172-Q451 HydrophobicContact CG-CB 4.45Å; Y172-G452 VanDerWaalsContact CB-CA 3.5Å
173	A	92	Very high	97.8	Very high	42 Å²	42	22 Å²	22	35%	0.347	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-43.7	174	0	0	0	0	0	112.2	L98 N171 Q234	L98-A173 HydrophobicContact CD1-CB 3.45Å; L98-A173 VanDerWaalsContact CD1-CB 3.45Å; N171-A173 VanDerWaalsContact C-N 3.33Å; N171-A173 WeakPolarHBondContact OD1-CB 3.32Å; N171-A173 PolarHBondContact OD1-N 3.13Å; A173-Q234 VanDerWaalsContact CB-NE2 3.29Å
174	S	93.8	Very high	97.8	Very high	47 Å²	47	21.8 Å²	21.8	33%	0.329	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-8.2	175.4	64	0	0	0	0	113.8	N171 E176	N171-S174 WeakPolarHBondContact CB-OG 3.38Å; N171-S174 PolarHBondContact ND2-OG 3.03Å; N171-S174 PolarHBondContact OD1-N 3.39Å; N171-S174 PolarHBondContact OD1-OG 3.47Å; S174-E176 VanDerWaalsContact CB-OE2 3.27Å; S174-E176 WeakPolarHBondContact CB-OE2 3.34Å; S174-E176 VanDerWaalsContact OG-CD 3.3Å; S174-E176 WeakPolarHBondContact OG-CG 3.19Å; S174-E176 PolarHBondContact OG-OE2 3.13Å
175	Q	95.5	Very high	97.8	Very high	33 Å²	33	23.6 Å²	23.6	15%	0.154	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	51.8	-172.8	-67.9	-67.5	-40.7	0	0	111.9	N171 Y172 K191 N448	N171-Q175 VanDerWaalsContact O-CA 3.22Å; N171-Q175 WeakPolarHBondContact O-CA 3.45Å; N171-Q175 PolarHBondContact O-N 3.04Å; Y172-Q175 PolarHBondContact O-NE2 2.86Å; Q175-K191 WeakPolarHBondContact O-CB 3.32Å; Q175-K191 PolarHBondContact O-N 2.92Å; Q175-N448 HydrophobicContact CG-CB 4.41Å
176	E	97.7	Very high	97.8	Very high	54 Å²	54	24.6 Å²	24.6	25%	0.252	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	142.6	-178.5	-66.8	171.3	139.4	0	0	111.5	I170 N171 S174 I189	I170-E176 CarbonylContact C-O 3.45Å; I170-E176 WeakPolarHBondContact CA-O 3.43Å; N171-E176 PolarHBondContact N-O 3Å; N171-E176 PolarHBondContact O-N 3.38Å; S174-E176 VanDerWaalsContact CB-OE2 3.27Å; S174-E176 WeakPolarHBondContact CB-OE2 3.34Å; S174-E176 VanDerWaalsContact OG-CD 3.3Å; S174-E176 WeakPolarHBondContact OG-CG 3.19Å; S174-E176 PolarHBondContact OG-OE2 3.13Å; E176-I189 CarbonylContact C-O 3.51Å; E176-I189 WeakPolarHBondContact CA-O 3.48Å; E176-I189 WeakPolarHBondContact CB-O 3.49Å
177	F	98.5	Very high	97.7	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.009	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	142.5	154.4	-63.5	-66.2	0	0	0	108.8	F119 C137 G169 I170 F179 K188 I189 K191 I193 L197	F119-F177 HydrophobicContact CB-CE1 3.79Å; F119-F177 HydrophobicContact CB-CZ 4.2Å; F119-F177 AromaticContact CD2-CD1 3.51Å; F119-F177 HydrophobicContact CD2-CD1 3.51Å; F119-F177 AromaticContact CD2-CE1 3.48Å; F119-F177 HydrophobicContact CD2-CE1 3.48Å; F119-F177 VanDerWaalsContact CD2-CE1 3.48Å; F119-F177 AromaticContact CE2-CD1 3.96Å; F119-F177 HydrophobicContact CE2-CD1 3.96Å; F119-F177 HydrophobicContact CE2-CE1 4.26Å; F119-F177 HydrophobicContact CG-CD1 4.27Å; F119-F177 AromaticContact CG-CE1 3.77Å; F119-F177 HydrophobicContact CG-CE1 3.77Å; C137-F177 HydrophobicContact CB-CD2 4.06Å; C137-F177 HydrophobicContact CB-CE2 3.79Å; C137-F177 HydrophobicContact CB-CZ 4.27Å; G169-F177 WeakPolarHBondContact O-CA 3.44Å; I170-F177 HydrophobicContact CD1-CE1 4.06Å; I170-F177 HydrophobicContact CG1-CD1 3.7Å; I170-F177 HydrophobicContact CG1-CE1 3.73Å; F177-F179 HydrophobicContact CB-CE2 4.21Å; F177-K188 CarbonylContact O-C 3.58Å; F177-K188 VanDerWaalsContact O-CA 3.28Å; F177-K188 WeakPolarHBondContact O-CA 3.34Å; F177-I189 HydrophobicContact CB-CD1 4.16Å; F177-I189 HydrophobicContact CB-CG1 3.99Å; F177-I189 HydrophobicContact CD2-CD1 3.84Å; F177-I189 HydrophobicContact CG-CD1 4.49Å; F177-I189 PolarHBondContact N-O 3.28Å; F177-I189 PolarHBondContact O-N 3.03Å; F177-K191 HydrophobicContact CD1-CG 4.27Å; F177-K191 HydrophobicContact CD2-CB 4.2Å; F177-K191 HydrophobicContact CD2-CG 4.02Å; F177-K191 HydrophobicContact CE1-CD 4.16Å; F177-K191 HydrophobicContact CE1-CG 3.85Å; F177-K191 HydrophobicContact CE2-CB 4.19Å; F177-K191 HydrophobicContact CE2-CG 3.59Å; F177-K191 HydrophobicContact CG-CG 4.35Å; F177-K191 HydrophobicContact CZ-CD 4.22Å; F177-K191 HydrophobicContact CZ-CG 3.51Å; F177-I193 HydrophobicContact CE2-CD1 3.88Å; F177-I193 HydrophobicContact CE2-CG1 4.31Å; F177-I193 HydrophobicContact CZ-CD1 3.99Å; F177-L197 HydrophobicContact CE1-CD1 3.77Å; F177-L197 HydrophobicContact CZ-CD1 3.61Å
178	F	98.7	Very high	97.7	Very high	1 Å²	1	29 Å²	29	0%	0.004	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.3	168.6	67.6	-86.5	0	0	0	109.8	Y101 G169 N171 T180 G187 K188 F221 I223 Y226	Y101-F178 AromaticContact CD2-CE2 3.5Å; Y101-F178 HydrophobicContact CD2-CE2 3.5Å; Y101-F178 VanDerWaalsContact CD2-CE2 3.5Å; Y101-F178 AromaticContact CD2-CZ 3.75Å; Y101-F178 HydrophobicContact CD2-CZ 3.75Å; Y101-F178 AromaticContact CE2-CE2 3.84Å; Y101-F178 HydrophobicContact CE2-CE2 3.84Å; Y101-F178 HydrophobicContact CG-CE2 4.49Å; Y101-F178 HydrophobicContact CG-CZ 4.43Å; G169-F178 VanDerWaalsContact C-CE1 3.43Å; G169-F178 PolarHBondContact N-O 3.39Å; G169-F178 PolarHBondContact O-N 3.39Å; N171-F178 HydrophobicContact CB-CD1 4.43Å; F178-T180 HydrophobicContact CD2-CG2 4.19Å; F178-T180 HydrophobicContact CE2-CG2 4.32Å; F178-G187 WeakPolarHBondContact CA-O 3.16Å; F178-K188 HydrophobicContact CB-CG 3.91Å; F178-F221 HydrophobicContact CE2-CD1 4.42Å; F178-F221 AromaticContact CE2-CE1 3.82Å; F178-F221 HydrophobicContact CE2-CE1 3.82Å; F178-F221 HydrophobicContact CE2-CZ 4.38Å; F178-F221 HydrophobicContact CZ-CE1 4.44Å; F178-I223 HydrophobicContact CZ-CD1 4.07Å; F178-Y226 HydrophobicContact CD1-CE1 4.38Å; F178-Y226 AromaticContact CE1-CE1 3.89Å; F178-Y226 HydrophobicContact CE1-CE1 3.89Å; F178-Y226 HydrophobicContact CZ-CD1 4.28Å; F178-Y226 AromaticContact CZ-CE1 3.96Å; F178-Y226 HydrophobicContact CZ-CE1 3.96Å
179	F	98.9	Very high	97.6	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	155.4	175.6	-65	-91.8	0	0	0	109.7	I117 Y139 L146 F156 G167 F177 I185 V186 G187	I117-F179 HydrophobicContact CG2-CD1 4.21Å; I117-F179 HydrophobicContact CG2-CE1 4.3Å; I117-F179 WeakPolarHBondContact O-CE1 3.2Å; Y139-F179 HydrophobicContact CD1-CB 3.86Å; Y139-F179 AromaticContact CD1-CD1 3.96Å; Y139-F179 HydrophobicContact CD1-CD1 3.96Å; Y139-F179 HydrophobicContact CD1-CG 4.06Å; Y139-F179 HydrophobicContact CE1-CB 4.4Å; Y139-F179 HydrophobicContact CG-CB 4.43Å; Y139-F179 HydrophobicContact CG-CD1 4.2Å; Y139-F179 HydrophobicContact CG-CG 4.27Å; L146-F179 HydrophobicContact CD1-CD2 4.01Å; L146-F179 HydrophobicContact CD1-CE2 3.47Å; L146-F179 VanDerWaalsContact CD1-CE2 3.47Å; L146-F179 HydrophobicContact CD1-CZ 4Å; F156-F179 HydrophobicContact CE1-CB 3.94Å; F156-F179 AromaticContact CE1-CD2 3.61Å; F156-F179 HydrophobicContact CE1-CD2 3.61Å; F156-F179 HydrophobicContact CE1-CE2 4.5Å; F156-F179 HydrophobicContact CE1-CG 4.07Å; F156-F179 HydrophobicContact CZ-CB 4.44Å; F156-F179 AromaticContact CZ-CD2 3.79Å; F156-F179 HydrophobicContact CZ-CD2 3.79Å; G167-F179 CarbonylContact O-C 3.58Å; G167-F179 VanDerWaalsContact O-CA 3.22Å; G167-F179 WeakPolarHBondContact O-CA 3.41Å; G167-F179 WeakPolarHBondContact O-CD1 3.37Å; F177-F179 HydrophobicContact CB-CE2 4.21Å; F179-I185 WeakPolarHBondContact O-CA 3.32Å; F179-V186 HydrophobicContact CB-CG2 3.71Å; F179-V186 WeakPolarHBondContact O-CG2 3.25Å; F179-V186 PolarHBondContact O-N 2.89Å; F179-G187 PolarHBondContact N-O 3.32Å; F179-G187 VanDerWaalsContact N-O 3.13Å
180	T	98.9	Very high	97.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	154.8	-178.2	64.5	0	0	0	0	110.5	Y101 V166 G167 F178 T184 I185 F221	Y101-T180 HydrophobicContact CE2-CG2 3.81Å; Y101-T180 PolarHBondContact OH-OG1 3.31Å; V166-T180 WeakPolarHBondContact CA-O 3.34Å; V166-T180 VanDerWaalsContact CG1-O 3.3Å; V166-T180 WeakPolarHBondContact CG1-O 3.16Å; G167-T180 WeakPolarHBondContact CA-OG1 3.27Å; G167-T180 PolarHBondContact N-O 3.08Å; G167-T180 PolarHBondContact N-OG1 3.45Å; G167-T180 PolarHBondContact O-N 3.03Å; F178-T180 HydrophobicContact CD2-CG2 4.19Å; F178-T180 HydrophobicContact CE2-CG2 4.32Å; T180-T184 CarbonylContact C-O 3.55Å; T180-T184 WeakPolarHBondContact CA-O 3.36Å; T180-T184 WeakPolarHBondContact CB-O 3.37Å; T180-I185 HydrophobicContact CG2-CG1 4.14Å; T180-F221 HydrophobicContact CG2-CB 4.29Å; T180-F221 HydrophobicContact CG2-CD1 4.1Å; T180-F221 HydrophobicContact CG2-CD2 3.76Å; T180-F221 HydrophobicContact CG2-CE1 4.36Å; T180-F221 HydrophobicContact CG2-CE2 4.06Å; T180-F221 HydrophobicContact CG2-CG 3.8Å; T180-F221 HydrophobicContact CG2-CZ 4.33Å
181	K	98.8	Very high	97.4	Very high	43 Å²	43	34.2 Å²	34.2	19%	0.187	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	127.9	167.9	-176.4	-179.3	-178.1	179.9	0	108.3	P158 K159 F160 D164 A165 G183 T184 V186	P158-K181 HydrophobicContact CB-CD 4.42Å; P158-K181 HydrophobicContact CG-CD 3.7Å; K159-K181 PolarHBondContact O-NZ 3.09Å; F160-K181 HydrophobicContact CB-CD 4.26Å; D164-K181 WeakPolarHBondContact OD1-CE 3.4Å; D164-K181 IonicContact OD1-NZ 2.91Å; D164-K181 PolarHBondContact OD1-NZ 3.13Å; D164-K181 WeakPolarHBondContact OD2-CE 3.32Å; D164-K181 IonicContact OD2-NZ 3.58Å; D164-K181 PolarHBondContact OD2-NZ 3.16Å; A165-K181 CarbonylContact O-C 3.52Å; A165-K181 WeakPolarHBondContact O-CA 3.29Å; K181-G183 PolarHBondContact O-N 3.04Å; K181-T184 PolarHBondContact N-O 2.93Å; K181-T184 PolarHBondContact O-N 3.46Å; K181-V186 HydrophobicContact CB-CG1 3.55Å
182	N	98.7	Very high	97	Very high	83 Å²	83	39.7 Å²	39.7	44%	0.444	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.9	47.1	178.2	-58.9	-25.5	0	0	0	112.6	D164 A165 T184	D164-N182 WeakPolarHBondContact CA-OD1 3.32Å; D164-N182 PolarHBondContact OD1-ND2 2.62Å; A165-N182 PolarHBondContact N-OD1 3.4Å; A165-N182 PolarHBondContact O-N 3.36Å; A165-N182 PolarHBondContact O-OD1 3.47Å; N182-T184 VanDerWaalsContact C-N 3.33Å; N182-T184 PolarHBondContact O-N 2.81Å
183	G	98.4	Very high	96.8	Very high	23 Å²	23	40.3 Å²	40.3	24%	0.237	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	8.7	177.8	0	0	0	0	0	116	K181 A220 F221	K181-G183 PolarHBondContact O-N 3.04Å; G183-A220 WeakPolarHBondContact CA-O 3.29Å; G183-F221 WeakPolarHBondContact O-CD2 3.4Å
184	T	98.6	Very high	96.7	Very high	97 Å²	97	47 Å²	47	60%	0.595	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.6	177.2	-56.2	0	0	0	0	110.8	T180 K181 N182 V186	T180-T184 CarbonylContact C-O 3.55Å; T180-T184 WeakPolarHBondContact CA-O 3.36Å; T180-T184 WeakPolarHBondContact CB-O 3.37Å; K181-T184 PolarHBondContact N-O 2.93Å; K181-T184 PolarHBondContact O-N 3.46Å; N182-T184 VanDerWaalsContact C-N 3.33Å; N182-T184 PolarHBondContact O-N 2.81Å; T184-V186 PolarHBondContact O-N 2.72Å
185	I	98.7	Very high	96.6	Very high	54 Å²	54	46.5 Å²	46.5	28%	0.277	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	126.7	173.9	-67.4	174.8	0	0	0	109.5	F179 T180 K188 F221 Y226	F179-I185 WeakPolarHBondContact O-CA 3.32Å; T180-I185 HydrophobicContact CG2-CG1 4.14Å; I185-K188 HydrophobicContact CG2-CG 4.21Å; I185-F221 HydrophobicContact CD1-CE2 4.27Å; I185-F221 HydrophobicContact CD1-CZ 4.01Å; I185-F221 HydrophobicContact CG1-CE2 3.77Å; I185-F221 HydrophobicContact CG1-CZ 3.89Å; I185-Y226 HydrophobicContact CD1-CD2 3.81Å; I185-Y226 HydrophobicContact CD1-CE2 3.52Å
186	V	98.3	Very high	96.6	Very high	35 Å²	35	50.2 Å²	50.2	21%	0.212	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-30.3	174.3	-57.1	0	0	0	0	112	Y139 F156 P158 F179 K181 T184	Y139-V186 HydrophobicContact CE1-CG2 3.94Å; F156-V186 HydrophobicContact CD1-CG2 4.34Å; F156-V186 HydrophobicContact CE1-CG2 3.77Å; F156-V186 HydrophobicContact CZ-CG2 4.42Å; P158-V186 HydrophobicContact CG-CG1 4.11Å; F179-V186 HydrophobicContact CB-CG2 3.71Å; F179-V186 WeakPolarHBondContact O-CG2 3.25Å; F179-V186 PolarHBondContact O-N 2.89Å; K181-V186 HydrophobicContact CB-CG1 3.55Å; T184-V186 PolarHBondContact O-N 2.72Å
187	G	98.2	Very high	96.6	Very high	16 Å²	16	47.8 Å²	47.8	17%	0.165	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	164.6	178.8	0	0	0	0	0	112.6	F156 F178 F179	F156-G187 VanDerWaalsContact CZ-C 3.49Å; F178-G187 WeakPolarHBondContact CA-O 3.16Å; F179-G187 PolarHBondContact N-O 3.32Å; F179-G187 VanDerWaalsContact N-O 3.13Å
188	K	98.2	Very high	96.6	Very high	76 Å²	76	48.4 Å²	48.4	33%	0.33	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	143.7	174.1	-53.8	-171.3	-176.4	-171.6	0	108.9	F177 F178 I185 Y226 E230	F177-K188 CarbonylContact O-C 3.58Å; F177-K188 VanDerWaalsContact O-CA 3.28Å; F177-K188 WeakPolarHBondContact O-CA 3.34Å; F178-K188 HydrophobicContact CB-CG 3.91Å; I185-K188 HydrophobicContact CG2-CG 4.21Å; K188-Y226 PolarHBondContact NZ-OH 3.33Å; K188-E230 IonicContact NZ-OE1 3.88Å
189	I	97.5	Very high	96.6	Very high	23 Å²	23	48.4 Å²	48.4	12%	0.118	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	153.2	176.5	53.3	129.7	0	0	0	111.1	L146 R148 F156 E176 F177 K191	L146-I189 HydrophobicContact CD2-CB 4.34Å; L146-I189 HydrophobicContact CD2-CD1 3.6Å; L146-I189 HydrophobicContact CD2-CG1 3.74Å; L146-I189 HydrophobicContact CD2-CG2 3.79Å; R148-I189 HydrophobicContact CG-CD1 4.47Å; F156-I189 HydrophobicContact CD2-CG2 4.35Å; F156-I189 HydrophobicContact CE2-CG2 3.85Å; E176-I189 CarbonylContact C-O 3.51Å; E176-I189 WeakPolarHBondContact CA-O 3.48Å; E176-I189 WeakPolarHBondContact CB-O 3.49Å; F177-I189 HydrophobicContact CB-CD1 4.16Å; F177-I189 HydrophobicContact CB-CG1 3.99Å; F177-I189 HydrophobicContact CD2-CD1 3.84Å; F177-I189 HydrophobicContact CG-CD1 4.49Å; F177-I189 PolarHBondContact N-O 3.28Å; F177-I189 PolarHBondContact O-N 3.03Å; I189-K191 PolarHBondContact O-N 3.28Å
190	P	97	Very high	96.6	Very high	74 Å²	74	48.4 Å²	48.4	48%	0.481	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	135.1	174.5	-26.1	35.5	0	0	0	113.5	R148 D192	R148-P190 PolarHBondContact NH2-O 3Å; P190-D192 PolarHBondContact O-N 3.12Å; P190-D192 VanDerWaalsContact O-N 3.17Å
191	K	95.2	Very high	96.6	Very high	13 Å²	13	48.5 Å²	48.5	6%	0.057	26%	0.26	C	S	.	.			trans	-85.4	75.5	177	-167	-170.3	120.6	-64.5	0	110.6	I170 Q175 F177 I189 I193 L197	I170-K191 HydrophobicContact CG2-CD 3.55Å; Q175-K191 WeakPolarHBondContact O-CB 3.32Å; Q175-K191 PolarHBondContact O-N 2.92Å; F177-K191 HydrophobicContact CD1-CG 4.27Å; F177-K191 HydrophobicContact CD2-CB 4.2Å; F177-K191 HydrophobicContact CD2-CG 4.02Å; F177-K191 HydrophobicContact CE1-CD 4.16Å; F177-K191 HydrophobicContact CE1-CG 3.85Å; F177-K191 HydrophobicContact CE2-CB 4.19Å; F177-K191 HydrophobicContact CE2-CG 3.59Å; F177-K191 HydrophobicContact CG-CG 4.35Å; F177-K191 HydrophobicContact CZ-CD 4.22Å; F177-K191 HydrophobicContact CZ-CG 3.51Å; I189-K191 PolarHBondContact O-N 3.28Å; K191-I193 VanDerWaalsContact CE-O 3.23Å; K191-I193 WeakPolarHBondContact CE-O 3.32Å; K191-I193 PolarHBondContact NZ-O 3.09Å; K191-I193 PolarHBondContact O-N 3.29Å; K191-L197 HydrophobicContact CD-CD1 4.41Å
192	D	89	Confident	96.5	Very high	116 Å²	116	46.4 Å²	46.4	62%	0.62	25%	0.252	S	S	*	.			trans	-74.1	7	-179.6	-58.6	-30.5	0	0	0	113.9	R148 P190	R148-D192 IonicContact CZ-OD2 3.95Å; R148-D192 IonicContact NH1-OD2 3.5Å; R148-D192 IonicContact NH2-OD2 3.74Å; R148-D192 PolarHBondContact NH2-OD2 3.38Å; P190-D192 PolarHBondContact O-N 3.12Å; P190-D192 VanDerWaalsContact O-N 3.17Å
193	I	92.8	Very high	96.4	Very high	15 Å²	15	42.5 Å²	42.5	8%	0.077	23%	0.23	C	C	.	.			trans	-107.1	121.8	-177.6	-46.2	169.6	0	0	0	109.4	N135 C137 F177 K191 L197	N135-I193 HydrophobicContact CB-CG2 3.88Å; C137-I193 HydrophobicContact CB-CD1 4.15Å; F177-I193 HydrophobicContact CE2-CD1 3.88Å; F177-I193 HydrophobicContact CE2-CG1 4.31Å; F177-I193 HydrophobicContact CZ-CD1 3.99Å; K191-I193 VanDerWaalsContact CE-O 3.23Å; K191-I193 WeakPolarHBondContact CE-O 3.32Å; K191-I193 PolarHBondContact NZ-O 3.09Å; K191-I193 PolarHBondContact O-N 3.29Å; I193-L197 HydrophobicContact CB-CD1 4.48Å; I193-L197 HydrophobicContact CB-CD2 4.41Å; I193-L197 HydrophobicContact CG2-CD2 3.75Å
194	R	90	Very high	96.2	Very high	183 Å²	183	41.9 Å²	41.9	69%	0.691	22%	0.221	S	C	*	.			trans	-95.8	156.6	177.1	-60.7	-171.5	-175.1	-165	0	112.6	K121	K121-R194 WeakPolarHBondContact CE-O 3.47Å; K121-R194 PolarHBondContact NZ-O 3.42Å
195	G	91.9	Very high	95.9	Very high	36 Å²	36	37.2 Å²	37.2	37%	0.371	19%	0.193	S	C	.	.	S	Bend	trans	93.2	-172.1	177	0	0	0	0	0	113.3	Q451	G195-Q451 PolarHBondContact O-NE2 2.85Å; G195-Q451 VanDerWaalsContact O-NE2 3.1Å
196	H	95.6	Very high	95.6	Very high	111 Å²	111	37.8 Å²	37.8	51%	0.514	19%	0.194	S	C	.	.			trans	-69.7	129.1	178.7	-66.5	177.2	0	0	0	110.8	P92	P92-H196 HydrophobicContact CB-CB 3.82Å; P92-H196 HydrophobicContact CG-CB 4.31Å
197	L	97.8	Very high	95.4	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.01	20%	0.202	C	C	.	.			trans	-118.3	134	-178.8	-67	178	0	0	0	109.8	P92 A93 F119 T120 K121 I170 F177 K191 I193	P92-L197 CarbonylContact C-O 3.6Å; P92-L197 WeakPolarHBondContact CA-O 3.38Å; A93-L197 WeakPolarHBondContact CB-O 3.23Å; A93-L197 PolarHBondContact N-O 3.31Å; F119-L197 HydrophobicContact CB-CB 4.24Å; F119-L197 HydrophobicContact CB-CD1 4.3Å; F119-L197 HydrophobicContact CD1-CB 4.39Å; T120-L197 CarbonylContact O-C 3.58Å; T120-L197 WeakPolarHBondContact O-CA 3.41Å; K121-L197 HydrophobicContact CG-CD2 4.18Å; I170-L197 HydrophobicContact CD1-CB 4.5Å; I170-L197 HydrophobicContact CD1-CD1 4.16Å; F177-L197 HydrophobicContact CE1-CD1 3.77Å; F177-L197 HydrophobicContact CZ-CD1 3.61Å; K191-L197 HydrophobicContact CD-CD1 4.41Å; I193-L197 HydrophobicContact CB-CD1 4.48Å; I193-L197 HydrophobicContact CB-CD2 4.41Å; I193-L197 HydrophobicContact CG2-CD2 3.75Å
198	F	98.2	Very high	95.4	Very high	16 Å²	16	38.8 Å²	38.8	7%	0.07	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127.4	-179.8	-71.7	-102.7	0	0	0	109.4	Q88 A89 K91 P92 F119 T120 E122 T200	Q88-F198 HydrophobicContact CB-CB 4.08Å; Q88-F198 HydrophobicContact CG-CB 4.13Å; A89-F198 WeakPolarHBondContact O-CD1 3.2Å; K91-F198 VanDerWaalsContact C-CE1 3.42Å; K91-F198 WeakPolarHBondContact O-CD1 3.4Å; P92-F198 HydrophobicContact CB-CD2 4.3Å; P92-F198 HydrophobicContact CB-CE1 4.3Å; P92-F198 HydrophobicContact CB-CE2 3.97Å; P92-F198 HydrophobicContact CB-CZ 4Å; P92-F198 HydrophobicContact CG-CZ 4.29Å; F119-F198 WeakPolarHBondContact CA-O 3.46Å; T120-F198 PolarHBondContact N-O 3.44Å; T120-F198 VanDerWaalsContact N-O 3.09Å; T120-F198 PolarHBondContact O-N 2.92Å; E122-F198 HydrophobicContact CB-CD2 4.29Å; E122-F198 HydrophobicContact CB-CE2 3.71Å; E122-F198 HydrophobicContact CB-CZ 4.3Å; E122-F198 HydrophobicContact CG-CE2 4.31Å; E122-F198 HydrophobicContact CG-CZ 4.41Å; F198-T200 PolarHBondContact O-N 2.86Å; F198-T200 PolarHBondContact O-OG1 3.45Å
199	P	98.7	Very high	95.4	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.5	128.4	162.7	-22.4	30.9	0	0	0	109.2	P50 Q88 A89 Y100 F102 F119 F214	P50-P199 HydrophobicContact CB-CG 4.28Å; P50-P199 HydrophobicContact CG-CG 4.06Å; Q88-P199 CarbonylContact C-O 3.47Å; Q88-P199 WeakPolarHBondContact CA-O 3.43Å; A89-P199 HydrophobicContact CB-CB 3.99Å; A89-P199 HydrophobicContact CB-CG 3.98Å; A89-P199 PolarHBondContact N-O 3.01Å; Y100-P199 HydrophobicContact CE1-CG 3.67Å; Y100-P199 WeakPolarHBondContact OH-CG 3.32Å; F102-P199 HydrophobicContact CD1-CB 3.84Å; F102-P199 HydrophobicContact CD1-CG 4.37Å; F102-P199 HydrophobicContact CD2-CB 4.05Å; F102-P199 HydrophobicContact CE1-CB 3.68Å; F102-P199 HydrophobicContact CE2-CB 3.89Å; F102-P199 HydrophobicContact CG-CB 4.01Å; F102-P199 HydrophobicContact CZ-CB 3.7Å; F119-P199 HydrophobicContact CE1-CG 4.46Å; P199-F214 HydrophobicContact CB-CD1 4.42Å; P199-F214 HydrophobicContact CB-CE1 3.73Å; P199-F214 HydrophobicContact CG-CE1 4.23Å
200	T	98.3	Very high	95.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	137.6	-172.6	-53.2	0	0	0	0	110	V86 Q88 G118 T120 P130 F198	V86-T200 HydrophobicContact CG2-CG2 3.49Å; V86-T200 VanDerWaalsContact CG2-CG2 3.49Å; Q88-T200 HydrophobicContact CG-CG2 4.25Å; G118-T200 PolarHBondContact N-O 3.4Å; G118-T200 PolarHBondContact O-N 3.06Å; T120-T200 HydrophobicContact CG2-CG2 3.79Å; T120-T200 WeakPolarHBondContact CG2-OG1 3.49Å; T120-T200 PolarHBondContact OG1-OG1 3.28Å; P130-T200 HydrophobicContact CB-CG2 4.37Å; F198-T200 PolarHBondContact O-N 2.86Å; F198-T200 PolarHBondContact O-OG1 3.45Å
201	V	98.2	Very high	95.5	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	139.4	177.2	-176.1	0	0	0	0	108.5	V87 F102 I104 A116 V210 V212	V87-V201 PolarHBondContact N-O 3.35Å; V87-V201 PolarHBondContact O-N 2.93Å; F102-V201 HydrophobicContact CE2-CG2 3.97Å; I104-V201 HydrophobicContact CG2-CB 4.47Å; I104-V201 HydrophobicContact CG2-CG1 4.05Å; I104-V201 HydrophobicContact CG2-CG2 3.52Å; A116-V201 CarbonylContact O-C 3.53Å; A116-V201 WeakPolarHBondContact O-CA 3.43Å; V201-V210 HydrophobicContact CG1-CG2 3.71Å; V201-V212 HydrophobicContact CG2-CG1 4.42Å; V201-V212 HydrophobicContact CG2-CG2 4.01Å
202	A	96.8	Very high	95.6	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	146.8	174.8	0	0	0	0	0	111.6	V84 G85 V86 I115 A116 Q129	V84-A202 HydrophobicContact CG1-CB 4.03Å; G85-A202 CarbonylContact O-C 3.53Å; G85-A202 VanDerWaalsContact O-CA 3.24Å; G85-A202 WeakPolarHBondContact O-CA 3.38Å; V86-A202 HydrophobicContact CB-CB 4.13Å; V86-A202 HydrophobicContact CG2-CB 4.2Å; I115-A202 CarbonylContact C-O 3.58Å; I115-A202 WeakPolarHBondContact CA-O 3.28Å; A116-A202 HydrophobicContact CB-CB 4.45Å; A116-A202 PolarHBondContact N-O 2.88Å; A116-A202 PolarHBondContact O-N 2.92Å; Q129-A202 HydrophobicContact CB-CB 4.46Å; Q129-A202 HydrophobicContact CG-CB 4.16Å
203	V	96.2	Very high	96.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142.7	171.3	-70.8	0	0	0	0	107.7	L63 V72 Y74 G85 I115 E208 V210	L63-V203 HydrophobicContact CB-CG2 4.16Å; V72-V203 HydrophobicContact CG1-CG1 4.4Å; V72-V203 HydrophobicContact CG1-CG2 3.7Å; Y74-V203 HydrophobicContact CD2-CB 4.27Å; Y74-V203 HydrophobicContact CD2-CG2 3.94Å; Y74-V203 WeakPolarHBondContact CD2-O 3.44Å; Y74-V203 HydrophobicContact CG-CG2 4.44Å; G85-V203 CarbonylContact C-O 3.59Å; G85-V203 WeakPolarHBondContact CA-O 3.41Å; G85-V203 PolarHBondContact N-O 3.22Å; G85-V203 WeakPolarHBondContact O-CG2 3.34Å; G85-V203 PolarHBondContact O-N 3.37Å; G85-V203 VanDerWaalsContact O-O 3.09Å; I115-V203 HydrophobicContact CG1-CG1 4.36Å; V203-E208 VanDerWaalsContact CA-OE2 3.28Å; V203-E208 WeakPolarHBondContact CA-OE2 3.49Å; V203-E208 HydrophobicContact CB-CB 3.97Å; V203-E208 WeakPolarHBondContact CB-OE2 3.33Å; V203-E208 HydrophobicContact CG1-CB 3.88Å; V203-V210 HydrophobicContact CG1-CG2 4.26Å
204	H	94.4	Very high	96.4	Very high	10 Å²	10	29.9 Å²	29.9	5%	0.046	15%	0.146	C	C	.	.			trans	-147.1	15.1	-171.8	-168.9	-159	0	0	0	112.9	N78 D83 Q114 Q129 E208	N78-H204 PolarHBondContact ND2-O 2.65Å; N78-H204 PolarHBondContact OD1-O 3.22Å; N78-H204 VanDerWaalsContact OD1-O 3.13Å; D83-H204 PolarHBondContact O-CD2 2.96Å; Q114-H204 HydrophobicContact CB-CB 3.93Å; Q129-H204 PolarHBondContact NE2-ND1 3.31Å; H204-E208 PolarHBondContact N-OE2 2.99Å
205	S	93.1	Very high	96.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-144.9	155	167	87.6	0	0	0	0	114.5	Y74 N78 I111 K112 N207 E208	Y74-S205 WeakPolarHBondContact CB-O 3.42Å; Y74-S205 WeakPolarHBondContact CD1-O 3.24Å; N78-S205 WeakPolarHBondContact ND2-CA 3.33Å; N78-S205 WeakPolarHBondContact OD1-CA 3.46Å; I111-S205 PolarHBondContact N-OG 3.16Å; K112-S205 PolarHBondContact N-OG 3.08Å; S205-N207 PolarHBondContact O-N 3.32Å; S205-E208 WeakPolarHBondContact CB-OE1 3.4Å; S205-E208 PolarHBondContact N-OE1 3.23Å; S205-E208 PolarHBondContact N-OE2 3.36Å; S205-E208 VanDerWaalsContact O-CB 3.29Å; S205-E208 WeakPolarHBondContact O-CB 3.39Å; S205-E208 WeakPolarHBondContact O-CG 3.38Å; S205-E208 PolarHBondContact O-N 2.88Å; S205-E208 VanDerWaalsContact O-N 3.08Å; S205-E208 PolarHBondContact OG-OE1 3.35Å
206	Q	93	Very high	96.8	Very high	66 Å²	66	27.5 Å²	27.5	31%	0.308	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	133.7	-175.2	-167.6	179.4	28.7	0	0	111.8	G110 I111 E208	G110-Q206 CarbonylContact C-O 3.5Å; G110-Q206 WeakPolarHBondContact CA-O 3.49Å; I111-Q206 HydrophobicContact CD1-CB 3.84Å; I111-Q206 HydrophobicContact CG1-CB 4.26Å; I111-Q206 PolarHBondContact N-O 3.16Å; I111-Q206 VanDerWaalsContact N-O 3.12Å; Q206-E208 PolarHBondContact O-N 2.81Å
207	N	93.9	Very high	96.8	Very high	71 Å²	71	29.4 Å²	29.4	38%	0.38	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	1.8	-180	-54.7	-42.4	0	0	0	116.1	Y74 D108 S205 E209	Y74-N207 PolarHBondContact O-N 3.09Å; D108-N207 WeakPolarHBondContact CB-O 3.4Å; S205-N207 PolarHBondContact O-N 3.32Å; N207-E209 PolarHBondContact O-N 2.81Å
208	E	97.1	Very high	96.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	127.8	169.5	-77.7	170.4	-167.7	0	0	110.3	K73 Y74 D108 S109 G113 Q114 I115 V203 H204 S205 Q206	K73-E208 CarbonylContact C-O 3.6Å; K73-E208 VanDerWaalsContact CA-O 3.31Å; K73-E208 WeakPolarHBondContact CA-O 3.41Å; Y74-E208 PolarHBondContact N-O 3.45Å; D108-E208 WeakPolarHBondContact O-CA 3.42Å; S109-E208 WeakPolarHBondContact O-CG 3.37Å; G113-E208 PolarHBondContact N-OE1 3Å; Q114-E208 WeakPolarHBondContact CA-OE1 3.32Å; Q114-E208 PolarHBondContact N-OE1 3.24Å; I115-E208 HydrophobicContact CD1-CB 4.24Å; I115-E208 HydrophobicContact CD1-CG 4.04Å; I115-E208 HydrophobicContact CG1-CB 4.09Å; I115-E208 HydrophobicContact CG1-CG 3.79Å; V203-E208 VanDerWaalsContact CA-OE2 3.28Å; V203-E208 WeakPolarHBondContact CA-OE2 3.49Å; V203-E208 HydrophobicContact CB-CB 3.97Å; V203-E208 WeakPolarHBondContact CB-OE2 3.33Å; V203-E208 HydrophobicContact CG1-CB 3.88Å; H204-E208 PolarHBondContact N-OE2 2.99Å; S205-E208 WeakPolarHBondContact CB-OE1 3.4Å; S205-E208 PolarHBondContact N-OE1 3.23Å; S205-E208 PolarHBondContact N-OE2 3.36Å; S205-E208 VanDerWaalsContact O-CB 3.29Å; S205-E208 WeakPolarHBondContact O-CB 3.39Å; S205-E208 WeakPolarHBondContact O-CG 3.38Å; S205-E208 PolarHBondContact O-N 2.88Å; S205-E208 VanDerWaalsContact O-N 3.08Å; S205-E208 PolarHBondContact OG-OE1 3.35Å; Q206-E208 PolarHBondContact O-N 2.81Å
209	E	97.9	Very high	96.8	Very high	26 Å²	26	40.1 Å²	40.1	12%	0.121	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	126.9	-176.5	-168	172.8	159.4	0	0	110	V72 K73 K107 D108 N207	V72-E209 CarbonylContact O-C 3.54Å; V72-E209 VanDerWaalsContact O-CA 3.3Å; V72-E209 WeakPolarHBondContact O-CA 3.45Å; K73-E209 HydrophobicContact CB-CB 4.45Å; K73-E209 HydrophobicContact CB-CG 4.06Å; K73-E209 HydrophobicContact CD-CG 4.39Å; K73-E209 WeakPolarHBondContact CD-OE2 3.18Å; K73-E209 HydrophobicContact CG-CB 4.24Å; K73-E209 HydrophobicContact CG-CG 4.23Å; K73-E209 IonicContact NZ-OE2 2.85Å; K73-E209 PolarHBondContact NZ-OE2 3.25Å; K107-E209 HydrophobicContact CB-CB 4.4Å; K107-E209 HydrophobicContact CB-CG 4.37Å; K107-E209 WeakPolarHBondContact CB-O 3.46Å; K107-E209 HydrophobicContact CD-CG 4.14Å; K107-E209 WeakPolarHBondContact CD-OE1 3.37Å; K107-E209 WeakPolarHBondContact CE-OE1 3.44Å; K107-E209 PolarHBondContact N-O 3.17Å; K107-E209 IonicContact NZ-OE1 3.8Å; K107-E209 PolarHBondContact NZ-OE1 3.27Å; D108-E209 HydrophobicContact CB-CB 4.07Å; D108-E209 PolarHBondContact N-O 3.31Å; D108-E209 PolarHBondContact O-N 2.97Å; N207-E209 PolarHBondContact O-N 2.81Å
210	V	98.5	Very high	96.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.3	-177.7	-63.2	0	0	0	0	111	S71 V72 I104 F105 V106 I115 V201 V203	S71-V210 CarbonylContact C-O 3.54Å; S71-V210 VanDerWaalsContact CA-O 3.28Å; S71-V210 WeakPolarHBondContact CA-O 3.39Å; V72-V210 HydrophobicContact CB-CG2 3.83Å; V72-V210 HydrophobicContact CG2-CG2 4.39Å; V72-V210 PolarHBondContact N-O 3.19Å; V72-V210 PolarHBondContact O-N 2.87Å; I104-V210 HydrophobicContact CD1-CG1 4.35Å; F105-V210 CarbonylContact O-C 3.6Å; F105-V210 WeakPolarHBondContact O-CA 3.4Å; V106-V210 HydrophobicContact CG2-CG1 4.37Å; I115-V210 HydrophobicContact CD1-CG1 3.85Å; I115-V210 HydrophobicContact CG1-CG1 4.45Å; I115-V210 HydrophobicContact CG2-CG1 3.65Å; V201-V210 HydrophobicContact CG1-CG2 3.71Å; V203-V210 HydrophobicContact CG1-CG2 4.26Å
211	L	98.4	Very high	96.8	Very high	54 Å²	54	43.6 Å²	43.6	28%	0.283	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.1	169.8	-51	178.9	0	0	0	108.3	L70 S71 I104 F105	L70-L211 CarbonylContact O-C 3.59Å; L70-L211 WeakPolarHBondContact O-CA 3.33Å; S71-L211 WeakPolarHBondContact OG-CD2 3.45Å; I104-L211 CarbonylContact C-O 3.59Å; I104-L211 WeakPolarHBondContact CA-O 3.24Å; F105-L211 HydrophobicContact CB-CB 4.35Å; F105-L211 HydrophobicContact CD1-CD1 4.09Å; F105-L211 HydrophobicContact CD1-CG 4.45Å; F105-L211 PolarHBondContact N-O 3.49Å; F105-L211 PolarHBondContact O-N 2.84Å
212	V	98.7	Very high	96.9	Very high	7 Å²	7	48.5 Å²	48.5	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134.3	-179.8	-167.4	0	0	0	0	109.3	L53 L70 F102 E103 I104 V201 F214	L53-V212 HydrophobicContact CD1-CG2 3.99Å; L53-V212 HydrophobicContact CD2-CB 4.48Å; L53-V212 HydrophobicContact CD2-CG2 4.05Å; L53-V212 HydrophobicContact CG-CG2 4.38Å; L70-V212 PolarHBondContact O-N 3.5Å; F102-V212 HydrophobicContact CD2-CG1 4.04Å; F102-V212 HydrophobicContact CE2-CG1 4.43Å; E103-V212 CarbonylContact O-C 3.51Å; E103-V212 WeakPolarHBondContact O-CA 3.45Å; I104-V212 HydrophobicContact CG2-CG1 4.33Å; I104-V212 HydrophobicContact CG2-CG2 4.06Å; V201-V212 HydrophobicContact CG2-CG1 4.42Å; V201-V212 HydrophobicContact CG2-CG2 4.01Å; V212-F214 HydrophobicContact CB-CE2 4.33Å; V212-F214 HydrophobicContact CB-CZ 4.35Å; V212-F214 HydrophobicContact CG1-CD1 4.25Å; V212-F214 HydrophobicContact CG1-CD2 4.3Å; V212-F214 HydrophobicContact CG1-CE1 3.66Å; V212-F214 HydrophobicContact CG1-CE2 3.74Å; V212-F214 HydrophobicContact CG1-CZ 3.4Å; V212-F214 VanDerWaalsContact CG1-CZ 3.4Å
213	N	98.6	Very high	96.9	Very high	23 Å²	23	49.8 Å²	49.8	12%	0.123	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	110.4	175.6	-178.2	17.4	0	0	0	109.3	E103 G215 K216 K217 F219	E103-N213 HydrophobicContact CB-CB 4.45Å; E103-N213 PolarHBondContact N-O 3.35Å; E103-N213 PolarHBondContact O-N 2.75Å; N213-G215 VanDerWaalsContact C-N 3.31Å; N213-G215 PolarHBondContact OD1-N 3.48Å; N213-K216 PolarHBondContact OD1-N 2.92Å; N213-K217 PolarHBondContact ND2-O 3.31Å; N213-K217 PolarHBondContact OD1-N 2.99Å; N213-K217 VanDerWaalsContact OD1-N 3.12Å; N213-K217 PolarHBondContact OD1-O 3.45Å; N213-F219 HydrophobicContact CB-CE1 4.39Å; N213-F219 VanDerWaalsContact ND2-CD1 3.33Å; N213-F219 WeakPolarHBondContact ND2-CD1 3.25Å; N213-F219 WeakPolarHBondContact O-CE1 3.44Å
214	F	98.5	Very high	97	Very high	20 Å²	20	57.2 Å²	57.2	9%	0.088	29%	0.286	C	S	.	.	S	Bend	trans	-91.3	15	173.6	-60.4	-65.1	0	0	0	113.4	P50 L53 L70 A89 F102 P199 V212	P50-F214 HydrophobicContact CB-CB 4.47Å; P50-F214 HydrophobicContact CB-CD1 3.97Å; P50-F214 HydrophobicContact CB-CE1 4.46Å; P50-F214 HydrophobicContact CB-CG 4.22Å; P50-F214 VanDerWaalsContact O-CB 3.3Å; P50-F214 WeakPolarHBondContact O-CB 3.46Å; L53-F214 HydrophobicContact CD2-CE2 4.23Å; L53-F214 HydrophobicContact CD2-CZ 3.89Å; L53-F214 HydrophobicContact CG-CE2 4.29Å; L53-F214 HydrophobicContact CG-CZ 4.44Å; L70-F214 HydrophobicContact CD2-CD2 3.82Å; L70-F214 HydrophobicContact CD2-CE2 4.03Å; A89-F214 HydrophobicContact CB-CE1 3.73Å; A89-F214 HydrophobicContact CB-CE2 4.43Å; A89-F214 HydrophobicContact CB-CZ 3.64Å; F102-F214 HydrophobicContact CB-CD1 3.94Å; F102-F214 HydrophobicContact CB-CE1 4.46Å; F102-F214 HydrophobicContact CD2-CD1 4.22Å; F102-F214 AromaticContact CD2-CE1 3.92Å; F102-F214 HydrophobicContact CD2-CE1 3.92Å; F102-F214 HydrophobicContact CG-CD1 4.32Å; F102-F214 HydrophobicContact CG-CE1 4.37Å; P199-F214 HydrophobicContact CB-CD1 4.42Å; P199-F214 HydrophobicContact CB-CE1 3.73Å; P199-F214 HydrophobicContact CG-CE1 4.23Å; V212-F214 HydrophobicContact CB-CE2 4.33Å; V212-F214 HydrophobicContact CB-CZ 4.35Å; V212-F214 HydrophobicContact CG1-CD1 4.25Å; V212-F214 HydrophobicContact CG1-CD2 4.3Å; V212-F214 HydrophobicContact CG1-CE1 3.66Å; V212-F214 HydrophobicContact CG1-CE2 3.74Å; V212-F214 HydrophobicContact CG1-CZ 3.4Å; V212-F214 VanDerWaalsContact CG1-CZ 3.4Å
215	G	97	Very high	97.1	Very high	43 Å²	43	58.1 Å²	58.1	44%	0.443	30%	0.299	S	S	.	.	S	Bend	trans	106.6	4.5	-178.8	0	0	0	0	0	114.8	N213 K217	N213-G215 VanDerWaalsContact C-N 3.31Å; N213-G215 PolarHBondContact OD1-N 3.48Å; G215-K217 PolarHBondContact O-N 3.31Å
216	K	94.2	Very high	97.4	Very high	126 Å²	126	59 Å²	59	55%	0.548	30%	0.302	S	S	.	.	S	Bend	trans	-70.4	-22.8	171.7	-72.6	179.1	175.1	167.8	0	112.5	T51 L70 N213	T51-K216 VanDerWaalsContact O-CE 3.28Å; T51-K216 WeakPolarHBondContact O-CE 3.39Å; T51-K216 PolarHBondContact O-NZ 3.25Å; L70-K216 HydrophobicContact CD1-CD 4.34Å; N213-K216 PolarHBondContact OD1-N 2.92Å
217	K	95.5	Very high	97.6	Very high	152 Å²	152	57.5 Å²	57.5	66%	0.661	30%	0.295	S	S	*	.	S	Bend	trans	-119.7	155.3	172.5	-62.4	179.3	-176.6	174.8	0	109	N213 G215 F219	N213-K217 PolarHBondContact ND2-O 3.31Å; N213-K217 PolarHBondContact OD1-N 2.99Å; N213-K217 VanDerWaalsContact OD1-N 3.12Å; N213-K217 PolarHBondContact OD1-O 3.45Å; G215-K217 PolarHBondContact O-N 3.31Å; K217-F219 PolarHBondContact O-N 3.33Å
218	K	97.7	Very high	97.8	Very high	206 Å²	206	56.9 Å²	56.9	90%	0.896	30%	0.3	S	S	*	.			trans	-55.6	132	172.1	-173.7	-178.8	176.6	-178	0	109.6
219	F	98.7	Very high	97.8	Very high	37 Å²	37	60.2 Å²	60.2	16%	0.162	32%	0.323	C	S	.	.			trans	-71.9	151.8	175.1	-65.9	-53.9	0	0	0	111.8	Y101 E103 N213 K217 F221 I223	Y101-F219 HydrophobicContact CD1-CD1 4.14Å; Y101-F219 AromaticContact CD1-CD2 3.88Å; Y101-F219 HydrophobicContact CD1-CD2 3.88Å; Y101-F219 HydrophobicContact CD1-CE1 4.2Å; Y101-F219 AromaticContact CD1-CE2 3.94Å; Y101-F219 HydrophobicContact CD1-CE2 3.94Å; Y101-F219 AromaticContact CD1-CG 3.97Å; Y101-F219 HydrophobicContact CD1-CG 3.97Å; Y101-F219 HydrophobicContact CD1-CZ 4.09Å; Y101-F219 HydrophobicContact CE1-CB 4.11Å; Y101-F219 AromaticContact CE1-CD1 3.96Å; Y101-F219 HydrophobicContact CE1-CD1 3.96Å; Y101-F219 HydrophobicContact CE1-CD2 4.2Å; Y101-F219 HydrophobicContact CE1-CE1 4.4Å; Y101-F219 AromaticContact CE1-CG 3.84Å; Y101-F219 HydrophobicContact CE1-CG 3.84Å; E103-F219 HydrophobicContact CB-CD1 4.2Å; E103-F219 HydrophobicContact CG-CD1 3.78Å; E103-F219 HydrophobicContact CG-CE1 4.38Å; E103-F219 VanDerWaalsContact OE2-CA 3.31Å; E103-F219 WeakPolarHBondContact OE2-CA 3.43Å; N213-F219 HydrophobicContact CB-CE1 4.39Å; N213-F219 VanDerWaalsContact ND2-CD1 3.33Å; N213-F219 WeakPolarHBondContact ND2-CD1 3.25Å; N213-F219 WeakPolarHBondContact O-CE1 3.44Å; K217-F219 PolarHBondContact O-N 3.33Å; F219-F221 VanDerWaalsContact C-N 3.31Å; F219-F221 VanDerWaalsContact CB-O 3.27Å; F219-F221 WeakPolarHBondContact CB-O 3.43Å; F219-I223 HydrophobicContact CD2-CB 4.44Å; F219-I223 HydrophobicContact CD2-CG2 3.74Å; F219-I223 HydrophobicContact CE2-CG2 4.19Å
220	A	98.5	Very high	97.7	Very high	55 Å²	55	59.8 Å²	59.8	46%	0.455	32%	0.321	S	S	.	.	S	Bend	trans	-67.5	-36.2	167.2	0	0	0	0	0	110.8	E103 A165 G183	E103-A220 PolarHBondContact OE1-N 2.84Å; E103-A220 PolarHBondContact OE2-N 3.2Å; A165-A220 HydrophobicContact CB-CB 3.77Å; G183-A220 WeakPolarHBondContact CA-O 3.29Å
221	F	98.7	Very high	97.5	Very high	18 Å²	18	64.8 Å²	64.8	8%	0.079	34%	0.34	C	S	.	.	S	Bend	trans	-81.4	135.3	172.3	-178.3	-117	0	0	0	112.3	Y101 E103 F178 T180 G183 I185 F219 I223 Y226	Y101-F221 HydrophobicContact CD1-CD1 4.39Å; Y101-F221 HydrophobicContact CD2-CD1 4.35Å; Y101-F221 HydrophobicContact CE1-CB 3.84Å; Y101-F221 AromaticContact CE1-CD1 3.98Å; Y101-F221 HydrophobicContact CE1-CD1 3.98Å; Y101-F221 HydrophobicContact CE1-CG 4.38Å; Y101-F221 AromaticContact CE2-CD1 3.95Å; Y101-F221 HydrophobicContact CE2-CD1 3.95Å; Y101-F221 HydrophobicContact CE2-CG 4.48Å; Y101-F221 AromaticContact CZ-CD1 3.75Å; Y101-F221 AromaticContact CZ-CG 4Å; Y101-F221 WeakPolarHBondContact OH-CB 3.43Å; E103-F221 WeakPolarHBondContact OE1-CB 3.4Å; E103-F221 PolarHBondContact OE1-N 3.04Å; F178-F221 HydrophobicContact CE2-CD1 4.42Å; F178-F221 AromaticContact CE2-CE1 3.82Å; F178-F221 HydrophobicContact CE2-CE1 3.82Å; F178-F221 HydrophobicContact CE2-CZ 4.38Å; F178-F221 HydrophobicContact CZ-CE1 4.44Å; T180-F221 HydrophobicContact CG2-CB 4.29Å; T180-F221 HydrophobicContact CG2-CD1 4.1Å; T180-F221 HydrophobicContact CG2-CD2 3.76Å; T180-F221 HydrophobicContact CG2-CE1 4.36Å; T180-F221 HydrophobicContact CG2-CE2 4.06Å; T180-F221 HydrophobicContact CG2-CG 3.8Å; T180-F221 HydrophobicContact CG2-CZ 4.33Å; G183-F221 WeakPolarHBondContact O-CD2 3.4Å; I185-F221 HydrophobicContact CD1-CE2 4.27Å; I185-F221 HydrophobicContact CD1-CZ 4.01Å; I185-F221 HydrophobicContact CG1-CE2 3.77Å; I185-F221 HydrophobicContact CG1-CZ 3.89Å; F219-F221 VanDerWaalsContact C-N 3.31Å; F219-F221 VanDerWaalsContact CB-O 3.27Å; F219-F221 WeakPolarHBondContact CB-O 3.43Å; F221-I223 VanDerWaalsContact C-N 3.28Å; F221-I223 HydrophobicContact CD1-CB 4.21Å; F221-I223 HydrophobicContact CD1-CD1 4.29Å; F221-I223 HydrophobicContact CE1-CB 4.49Å; F221-I223 HydrophobicContact CE1-CD1 3.97Å; F221-I223 PolarHBondContact O-N 3.49Å; F221-Y226 HydrophobicContact CE1-CD1 4.36Å; F221-Y226 HydrophobicContact CE1-CD2 4.48Å; F221-Y226 AromaticContact CE1-CG 3.95Å; F221-Y226 HydrophobicContact CE1-CG 3.95Å; F221-Y226 AromaticContact CZ-CD2 3.84Å; F221-Y226 HydrophobicContact CZ-CD2 3.84Å; F221-Y226 AromaticContact CZ-CG 3.73Å; F221-Y226 HydrophobicContact CZ-CG 3.73Å
222	D	98.5	Very high	97.4	Very high	105 Å²	105	66.5 Å²	66.5	56%	0.561	35%	0.349	S	S	*	.			trans	-77.7	78	173.6	-176.2	14	0	0	0	111.4	K224 G225 Y226	D222-K224 VanDerWaalsContact C-N 3.25Å; D222-K224 PolarHBondContact O-N 3.46Å; D222-K224 PolarHBondContact OD1-N 3.4Å; D222-G225 PolarHBondContact O-N 3.32Å; D222-G225 PolarHBondContact OD1-N 3.29Å; D222-G225 WeakPolarHBondContact OD2-CA 3.37Å; D222-G225 PolarHBondContact OD2-N 3.32Å; D222-Y226 PolarHBondContact O-N 3.02Å
223	I	98.1	Very high	97.2	Very high	26 Å²	26	72.7 Å²	72.7	13%	0.133	38%	0.376	C	S	.	.	H	α-helix	trans	-61.2	-34.3	178.7	-171.4	58.9	0	0	0	112.4	Y101 F178 F219 F221 Y226 E227	Y101-I223 HydrophobicContact CD1-CB 4.39Å; Y101-I223 HydrophobicContact CG-CD1 4.06Å; Y101-I223 HydrophobicContact CG-CG1 4.45Å; F178-I223 HydrophobicContact CZ-CD1 4.07Å; F219-I223 HydrophobicContact CD2-CB 4.44Å; F219-I223 HydrophobicContact CD2-CG2 3.74Å; F219-I223 HydrophobicContact CE2-CG2 4.19Å; F221-I223 VanDerWaalsContact C-N 3.28Å; F221-I223 HydrophobicContact CD1-CB 4.21Å; F221-I223 HydrophobicContact CD1-CD1 4.29Å; F221-I223 HydrophobicContact CE1-CB 4.49Å; F221-I223 HydrophobicContact CE1-CD1 3.97Å; F221-I223 PolarHBondContact O-N 3.49Å; I223-Y226 HydrophobicContact CD1-CD1 4.11Å; I223-Y226 WeakPolarHBondContact O-CB 3.28Å; I223-Y226 PolarHBondContact O-N 3.35Å; I223-E227 WeakPolarHBondContact O-CG 3.25Å; I223-E227 PolarHBondContact O-N 3.31Å
224	K	97.3	Very high	96.9	Very high	156 Å²	156	74.7 Å²	74.7	68%	0.678	38%	0.384	S	S	*	.	H	α-helix	trans	-68.7	-44.6	179.1	-73.1	-75.1	-176.3	-176.5	0	110.8	D222 Y226 E227 A228	D222-K224 VanDerWaalsContact C-N 3.25Å; D222-K224 PolarHBondContact O-N 3.46Å; D222-K224 PolarHBondContact OD1-N 3.4Å; K224-Y226 VanDerWaalsContact C-N 3.32Å; K224-E227 PolarHBondContact O-N 3.01Å; K224-A228 WeakPolarHBondContact O-CB 3.45Å; K224-A228 PolarHBondContact O-N 3.15Å
225	G	98.2	Very high	96.7	Very high	30 Å²	30	78 Å²	78	31%	0.309	40%	0.4	S	S	.	.	H	α-helix	trans	-62.2	-39	172.6	0	0	0	0	0	112.5	D222 A228 S229	D222-G225 PolarHBondContact O-N 3.32Å; D222-G225 PolarHBondContact OD1-N 3.29Å; D222-G225 WeakPolarHBondContact OD2-CA 3.37Å; D222-G225 PolarHBondContact OD2-N 3.32Å; G225-A228 PolarHBondContact O-N 2.99Å; G225-S229 WeakPolarHBondContact O-CB 3.42Å; G225-S229 PolarHBondContact O-N 3.03Å
226	Y	98.2	Very high	96.6	Very high	17 Å²	17	79.7 Å²	79.7	7%	0.067	40%	0.398	C	S	.	.	H	α-helix	trans	-61	-49.6	173.9	180	-105.3	0	0	0	112.3	T99 N171 F178 I185 K188 F221 D222 I223 K224 A228 S229 E230	T99-Y226 HydrophobicContact CG2-CD1 4Å; T99-Y226 HydrophobicContact CG2-CE1 3.75Å; N171-Y226 PolarHBondContact ND2-OH 3.24Å; F178-Y226 HydrophobicContact CD1-CE1 4.38Å; F178-Y226 AromaticContact CE1-CE1 3.89Å; F178-Y226 HydrophobicContact CE1-CE1 3.89Å; F178-Y226 HydrophobicContact CZ-CD1 4.28Å; F178-Y226 AromaticContact CZ-CE1 3.96Å; F178-Y226 HydrophobicContact CZ-CE1 3.96Å; I185-Y226 HydrophobicContact CD1-CD2 3.81Å; I185-Y226 HydrophobicContact CD1-CE2 3.52Å; K188-Y226 PolarHBondContact NZ-OH 3.33Å; F221-Y226 HydrophobicContact CE1-CD1 4.36Å; F221-Y226 HydrophobicContact CE1-CD2 4.48Å; F221-Y226 AromaticContact CE1-CG 3.95Å; F221-Y226 HydrophobicContact CE1-CG 3.95Å; F221-Y226 AromaticContact CZ-CD2 3.84Å; F221-Y226 HydrophobicContact CZ-CD2 3.84Å; F221-Y226 AromaticContact CZ-CG 3.73Å; F221-Y226 HydrophobicContact CZ-CG 3.73Å; D222-Y226 PolarHBondContact O-N 3.02Å; I223-Y226 HydrophobicContact CD1-CD1 4.11Å; I223-Y226 WeakPolarHBondContact O-CB 3.28Å; I223-Y226 PolarHBondContact O-N 3.35Å; K224-Y226 VanDerWaalsContact C-N 3.32Å; Y226-A228 VanDerWaalsContact C-N 3.33Å; Y226-A228 PolarHBondContact O-N 3.04Å; Y226-S229 WeakPolarHBondContact O-CB 3.49Å; Y226-S229 PolarHBondContact O-N 3.39Å; Y226-E230 HydrophobicContact CD1-CG 4.34Å; Y226-E230 HydrophobicContact CE1-CG 3.96Å; Y226-E230 HydrophobicContact CE2-CG 4.13Å; Y226-E230 WeakPolarHBondContact O-CG 3.24Å; Y226-E230 PolarHBondContact O-N 2.89Å
227	E	97.2	Very high	96.7	Very high	36 Å²	36	76.2 Å²	76.2	17%	0.168	39%	0.394	C	S	.	.	H	α-helix	trans	-58.7	-43.5	175.6	-73.6	-174.3	144.3	0	0	112.1	L98 T99 I223 K224 S229 E230 R231	L98-E227 HydrophobicContact CD2-CB 4.19Å; L98-E227 HydrophobicContact CD2-CG 4.32Å; T99-E227 HydrophobicContact CG2-CG 4.01Å; T99-E227 WeakPolarHBondContact OG1-CG 3.32Å; T99-E227 PolarHBondContact OG1-OE1 3.14Å; I223-E227 WeakPolarHBondContact O-CG 3.25Å; I223-E227 PolarHBondContact O-N 3.31Å; K224-E227 PolarHBondContact O-N 3.01Å; E227-S229 VanDerWaalsContact C-N 3.34Å; E227-S229 PolarHBondContact O-N 3.3Å; E227-E230 PolarHBondContact O-N 3.44Å; E227-R231 WeakPolarHBondContact O-CG 3.36Å; E227-R231 PolarHBondContact O-N 3.02Å
228	A	97.5	Very high	96.5	Very high	58 Å²	58	73.8 Å²	73.8	48%	0.479	39%	0.387	S	S	.	.	H	α-helix	trans	-61.4	-41.8	176.7	0	0	0	0	0	112	K224 G225 Y226 R231 N232	K224-A228 WeakPolarHBondContact O-CB 3.45Å; K224-A228 PolarHBondContact O-N 3.15Å; G225-A228 PolarHBondContact O-N 2.99Å; Y226-A228 VanDerWaalsContact C-N 3.33Å; Y226-A228 PolarHBondContact O-N 3.04Å; A228-R231 PolarHBondContact O-N 3.16Å; A228-N232 WeakPolarHBondContact O-CB 3.49Å; A228-N232 PolarHBondContact O-N 3.17Å
229	S	97.3	Very high	96.2	Very high	70 Å²	70	69.8 Å²	69.8	49%	0.49	37%	0.371	S	S	.	.	H	α-helix	trans	-63.6	-43	175.1	-178.5	0	0	0	0	112.1	G225 Y226 E227 N232 K233	G225-S229 WeakPolarHBondContact O-CB 3.42Å; G225-S229 PolarHBondContact O-N 3.03Å; Y226-S229 WeakPolarHBondContact O-CB 3.49Å; Y226-S229 PolarHBondContact O-N 3.39Å; E227-S229 VanDerWaalsContact C-N 3.34Å; E227-S229 PolarHBondContact O-N 3.3Å; S229-N232 PolarHBondContact O-N 3.47Å; S229-K233 PolarHBondContact O-N 3.27Å
230	E	96	Very high	96.1	Very high	17 Å²	17	76.5 Å²	76.5	8%	0.079	40%	0.4	C	S	.	.	H	α-helix	trans	-65.7	-40.9	177.8	-69.3	-66.1	124.9	0	0	111.6	L98 N171 K188 Y226 E227 K233 Q234	L98-E230 HydrophobicContact CD2-CB 4.37Å; N171-E230 PolarHBondContact ND2-OE2 2.82Å; K188-E230 IonicContact NZ-OE1 3.88Å; Y226-E230 HydrophobicContact CD1-CG 4.34Å; Y226-E230 HydrophobicContact CE1-CG 3.96Å; Y226-E230 HydrophobicContact CE2-CG 4.13Å; Y226-E230 WeakPolarHBondContact O-CG 3.24Å; Y226-E230 PolarHBondContact O-N 2.89Å; E227-E230 PolarHBondContact O-N 3.44Å; E230-K233 PolarHBondContact O-N 3.38Å; E230-Q234 WeakPolarHBondContact O-CG 3.39Å; E230-Q234 PolarHBondContact O-N 3.1Å; E230-Q234 VanDerWaalsContact O-N 3.13Å
231	R	94.6	Very high	95.9	Very high	104 Å²	104	79.4 Å²	79.4	39%	0.392	41%	0.407	S	S	.	.	H	α-helix	trans	-62.2	-43.9	172.2	-71.2	-175.6	-165.8	-70.3	-0.9	112.1	L98 E227 A228 K233 Q234 Q235 E453	L98-R231 HydrophobicContact CD2-CG 3.75Å; E227-R231 WeakPolarHBondContact O-CG 3.36Å; E227-R231 PolarHBondContact O-N 3.02Å; A228-R231 PolarHBondContact O-N 3.16Å; R231-K233 VanDerWaalsContact C-N 3.32Å; R231-K233 PolarHBondContact O-N 3.04Å; R231-Q234 WeakPolarHBondContact O-CB 3.41Å; R231-Q234 PolarHBondContact O-N 2.91Å; R231-Q234 VanDerWaalsContact O-N 3.15Å; R231-Q235 WeakPolarHBondContact O-CB 3.45Å; R231-Q235 PolarHBondContact O-N 3.21Å; R231-E453 IonicContact CZ-OE1 3.66Å; R231-E453 IonicContact CZ-OE2 3.44Å; R231-E453 VanDerWaalsContact NH1-CD 3.3Å; R231-E453 IonicContact NH1-OE1 3.84Å; R231-E453 PolarHBondContact NH1-OE1 2.8Å; R231-E453 VanDerWaalsContact NH1-OE1 3.1Å; R231-E453 IonicContact NH1-OE2 2.58Å; R231-E453 PolarHBondContact NH1-OE2 3.47Å; R231-E453 IonicContact NH2-OE1 3.22Å; R231-E453 PolarHBondContact NH2-OE1 3.43Å; R231-E453 IonicContact NH2-OE2 2.7Å
232	N	96.3	Very high	95.5	Very high	90 Å²	90	84.1 Å²	84.1	48%	0.481	44%	0.442	S	S	.	.	H	α-helix	trans	-61.5	-41.5	177.4	-173.7	22.6	0	0	0	111.5	A228 S229 Q234 Q235 L236	A228-N232 WeakPolarHBondContact O-CB 3.49Å; A228-N232 PolarHBondContact O-N 3.17Å; S229-N232 PolarHBondContact O-N 3.47Å; N232-Q234 VanDerWaalsContact C-N 3.3Å; N232-Q234 PolarHBondContact O-N 2.94Å; N232-Q235 PolarHBondContact O-N 3.1Å; N232-L236 WeakPolarHBondContact O-CB 3.48Å; N232-L236 VanDerWaalsContact O-CG 3.32Å; N232-L236 WeakPolarHBondContact O-CG 3.37Å; N232-L236 PolarHBondContact O-N 3.47Å
233	K	95.5	Very high	95	Very high	138 Å²	138	84.8 Å²	84.8	60%	0.6	44%	0.444	S	S	*	.	H	α-helix	trans	-58.8	-41.5	174.4	-177.5	-178.2	174.8	-173.7	0	112	S229 E230 R231 A237	S229-K233 PolarHBondContact O-N 3.27Å; E230-K233 PolarHBondContact O-N 3.38Å; R231-K233 VanDerWaalsContact C-N 3.32Å; R231-K233 PolarHBondContact O-N 3.04Å; K233-A237 PolarHBondContact O-N 3.3Å; K233-A237 VanDerWaalsContact O-N 3.13Å
234	Q	92.3	Very high	94.4	Very high	65 Å²	65	86.9 Å²	86.9	30%	0.304	46%	0.46	S	S	.	.	H	α-helix	trans	-65.5	-44.6	175	-67.1	174.2	4.8	0	0	111.5	A173 E230 R231 N232 A237 I238	A173-Q234 VanDerWaalsContact CB-NE2 3.29Å; E230-Q234 WeakPolarHBondContact O-CG 3.39Å; E230-Q234 PolarHBondContact O-N 3.1Å; E230-Q234 VanDerWaalsContact O-N 3.13Å; R231-Q234 WeakPolarHBondContact O-CB 3.41Å; R231-Q234 PolarHBondContact O-N 2.91Å; R231-Q234 VanDerWaalsContact O-N 3.15Å; N232-Q234 VanDerWaalsContact C-N 3.3Å; N232-Q234 PolarHBondContact O-N 2.94Å; Q234-A237 WeakPolarHBondContact O-CB 3.44Å; Q234-A237 PolarHBondContact O-N 2.99Å; Q234-A237 VanDerWaalsContact O-N 3.14Å; Q234-I238 WeakPolarHBondContact O-CG1 3.4Å; Q234-I238 PolarHBondContact O-N 3.43Å
235	Q	93.3	Very high	93.5	Very high	88 Å²	88	84.7 Å²	84.7	41%	0.411	46%	0.461	S	S	.	.	H	α-helix	trans	-60.7	-47.1	178.3	-177.7	58.1	32.9	0	0	111.8	R231 N232 A237 I238 E239	R231-Q235 WeakPolarHBondContact O-CB 3.45Å; R231-Q235 PolarHBondContact O-N 3.21Å; N232-Q235 PolarHBondContact O-N 3.1Å; Q235-A237 PolarHBondContact O-N 3.27Å; Q235-I238 WeakPolarHBondContact O-CA 3.43Å; Q235-I238 WeakPolarHBondContact O-CB 3.37Å; Q235-I238 PolarHBondContact O-N 3.27Å; Q235-E239 WeakPolarHBondContact CG-OE1 3.44Å; Q235-E239 PolarHBondContact NE2-OE1 3.18Å; Q235-E239 WeakPolarHBondContact O-CG 3.36Å; Q235-E239 PolarHBondContact O-N 3.05Å
236	L	95.9	Very high	92.8	Very high	79 Å²	79	84 Å²	84	41%	0.414	45%	0.451	S	S	.	.	H	α-helix	trans	-61.8	-32	175.1	-70.4	170.9	0	0	0	112.7	N232 K240	N232-L236 WeakPolarHBondContact O-CB 3.48Å; N232-L236 VanDerWaalsContact O-CG 3.32Å; N232-L236 WeakPolarHBondContact O-CG 3.37Å; N232-L236 PolarHBondContact O-N 3.47Å; L236-K240 VanDerWaalsContact O-CG 3.28Å; L236-K240 WeakPolarHBondContact O-CG 3.25Å; L236-K240 PolarHBondContact O-N 2.65Å
237	A	94.6	Very high	92.2	Very high	54 Å²	54	86.1 Å²	86.1	45%	0.446	46%	0.463	S	S	.	.	H	α-helix	trans	-70	-38.3	174.2	0	0	0	0	0	111.5	K233 Q234 Q235	K233-A237 PolarHBondContact O-N 3.3Å; K233-A237 VanDerWaalsContact O-N 3.13Å; Q234-A237 WeakPolarHBondContact O-CB 3.44Å; Q234-A237 PolarHBondContact O-N 2.99Å; Q234-A237 VanDerWaalsContact O-N 3.14Å; Q235-A237 PolarHBondContact O-N 3.27Å
238	I	92.1	Very high	91.8	Very high	100 Å²	100	86.5 Å²	86.5	51%	0.513	48%	0.476	S	S	.	.	H	α-helix	trans	-65.9	-44.3	174.1	-66.8	164.7	0	0	0	110.5	Q234 Q235 K240 I241	Q234-I238 WeakPolarHBondContact O-CG1 3.4Å; Q234-I238 PolarHBondContact O-N 3.43Å; Q235-I238 WeakPolarHBondContact O-CA 3.43Å; Q235-I238 WeakPolarHBondContact O-CB 3.37Å; Q235-I238 PolarHBondContact O-N 3.27Å; I238-K240 PolarHBondContact O-N 3.22Å; I238-I241 VanDerWaalsContact O-CB 3.24Å; I238-I241 WeakPolarHBondContact O-CB 3.33Å; I238-I241 PolarHBondContact O-N 3.2Å
239	E	92.2	Very high	91.3	Very high	123 Å²	123	88 Å²	88	58%	0.575	47%	0.47	S	S	*	.	H	α-helix	trans	-65.6	-23.9	-179.6	-73.8	170.9	-173.8	0	0	113.8	Q235 I241	Q235-E239 WeakPolarHBondContact CG-OE1 3.44Å; Q235-E239 PolarHBondContact NE2-OE1 3.18Å; Q235-E239 WeakPolarHBondContact O-CG 3.36Å; Q235-E239 PolarHBondContact O-N 3.05Å; E239-I241 PolarHBondContact O-N 3.22Å
240	K	95.5	Very high	90.9	Very high	177 Å²	177	84.8 Å²	84.8	77%	0.77	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-17.3	171.5	-75	170.7	-174.4	-177.8	0	112.9	L236 I238 S242	L236-K240 VanDerWaalsContact O-CG 3.28Å; L236-K240 WeakPolarHBondContact O-CG 3.25Å; L236-K240 PolarHBondContact O-N 2.65Å; I238-K240 PolarHBondContact O-N 3.22Å; K240-S242 PolarHBondContact O-N 3.18Å; K240-S242 VanDerWaalsContact O-N 3.14Å
241	I	93.7	Very high	90.6	Very high	117 Å²	117	85.8 Å²	85.8	60%	0.6	45%	0.454	S	S	*	.	S	Bend	trans	-77.2	100.8	175.5	-55.6	174.7	0	0	0	107.5	I238 E239 I243	I238-I241 VanDerWaalsContact O-CB 3.24Å; I238-I241 WeakPolarHBondContact O-CB 3.33Å; I238-I241 PolarHBondContact O-N 3.2Å; E239-I241 PolarHBondContact O-N 3.22Å; I241-I243 HydrophobicContact CG2-CG2 4.47Å; I241-I243 PolarHBondContact O-N 3.25Å
242	S	91	Very high	90.5	Very high	116 Å²	116	83.6 Å²	83.6	81%	0.811	45%	0.452	S	S	*	.			trans	-68.6	119.6	174.3	-178.3	0	0	0	0	110	K240	K240-S242 PolarHBondContact O-N 3.18Å; K240-S242 VanDerWaalsContact O-N 3.14Å
243	I	87.5	Confident	90.3	Very high	119 Å²	119	81.6 Å²	81.6	61%	0.61	44%	0.439	S	S	*	.			trans	-109.7	145.3	168.5	59.9	175	0	0	0	109.2	I241	I241-I243 HydrophobicContact CG2-CG2 4.47Å; I241-I243 PolarHBondContact O-N 3.25Å
244	P	86.4	Confident	90.1	Very high	70 Å²	70	75.1 Å²	75.1	46%	0.455	41%	0.411	S	S	.	.			trans	-58.7	133.7	175.1	-17	24.9	0	0	0	110.5	N246 I247	P244-N246 PolarHBondContact O-N 2.97Å; P244-I247 HydrophobicContact CB-CD1 4.37Å; P244-I247 HydrophobicContact CB-CG1 3.83Å; P244-I247 HydrophobicContact CG-CD1 4.19Å; P244-I247 HydrophobicContact CG-CG1 3.84Å; P244-I247 WeakPolarHBondContact O-CG1 3.3Å; P244-I247 PolarHBondContact O-N 3.46Å; P244-I247 VanDerWaalsContact O-N 3.09Å
245	P	79.1	Confident	90.1	Very high	110 Å²	110	75.5 Å²	75.5	71%	0.714	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.9	-170.3	24.8	-35	0	0	0	113.5
246	N	81.8	Confident	90.3	Very high	17 Å²	17	72 Å²	72	9%	0.091	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-4.2	-178.7	59.2	0.4	0	0	0	114.2	P244 G248 Y249 G250 V276 P278 I279	P244-N246 PolarHBondContact O-N 2.97Å; N246-G248 VanDerWaalsContact C-N 3.31Å; N246-G248 PolarHBondContact O-N 2.9Å; N246-Y249 WeakPolarHBondContact O-CB 3.48Å; N246-Y249 PolarHBondContact O-N 3.24Å; N246-Y249 VanDerWaalsContact O-N 3.16Å; N246-G250 PolarHBondContact O-N 2.83Å; N246-G250 VanDerWaalsContact O-N 3.13Å; N246-V276 HydrophobicContact CB-CG1 4Å; N246-P278 PolarHBondContact ND2-O 3.25Å; N246-P278 VanDerWaalsContact ND2-O 3.08Å; N246-I279 HydrophobicContact CB-CG1 4.06Å; N246-I279 WeakPolarHBondContact ND2-CA 3.19Å
247	I	87.3	Confident	90.2	Very high	61 Å²	61	68.7 Å²	68.7	31%	0.313	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-42.6	179.6	-69.3	-61	0	0	0	111.5	P244 Y249 G250 L251	P244-I247 HydrophobicContact CB-CD1 4.37Å; P244-I247 HydrophobicContact CB-CG1 3.83Å; P244-I247 HydrophobicContact CG-CD1 4.19Å; P244-I247 HydrophobicContact CG-CG1 3.84Å; P244-I247 WeakPolarHBondContact O-CG1 3.3Å; P244-I247 PolarHBondContact O-N 3.46Å; P244-I247 VanDerWaalsContact O-N 3.09Å; I247-Y249 VanDerWaalsContact C-N 3.25Å; I247-Y249 PolarHBondContact O-N 3.12Å; I247-G250 PolarHBondContact O-N 3.3Å; I247-G250 VanDerWaalsContact O-N 3.12Å; I247-L251 HydrophobicContact CG2-CD1 3.95Å; I247-L251 HydrophobicContact CG2-CG 4.18Å; I247-L251 WeakPolarHBondContact O-CG 3.47Å; I247-L251 PolarHBondContact O-N 3.26Å
248	G	87.5	Confident	90.1	Very high	44 Å²	44	66.5 Å²	66.5	45%	0.454	36%	0.357	S	S	.	.	H	α-helix	trans	-56.6	-40.9	178.4	0	0	0	0	0	112.3	N246 L251 V252	N246-G248 VanDerWaalsContact C-N 3.31Å; N246-G248 PolarHBondContact O-N 2.9Å; G248-L251 PolarHBondContact O-N 3.44Å; G248-V252 WeakPolarHBondContact O-CG2 3.42Å; G248-V252 PolarHBondContact O-N 2.68Å; G248-V252 VanDerWaalsContact O-N 3.09Å
249	Y	88.1	Confident	90.2	Very high	89 Å²	89	61.9 Å²	61.9	35%	0.349	33%	0.333	S	S	.	.	H	α-helix	trans	-66.8	-43.2	176.2	-63.7	-85.6	0	0	0	112.2	N246 I247 L251 V252 K253 F268 T272 V276	N246-Y249 WeakPolarHBondContact O-CB 3.48Å; N246-Y249 PolarHBondContact O-N 3.24Å; N246-Y249 VanDerWaalsContact O-N 3.16Å; I247-Y249 VanDerWaalsContact C-N 3.25Å; I247-Y249 PolarHBondContact O-N 3.12Å; Y249-L251 VanDerWaalsContact C-N 3.33Å; Y249-L251 PolarHBondContact O-N 3.27Å; Y249-V252 PolarHBondContact O-N 3.21Å; Y249-K253 VanDerWaalsContact O-CB 3.27Å; Y249-K253 WeakPolarHBondContact O-CB 3.27Å; Y249-K253 PolarHBondContact O-N 3.25Å; Y249-F268 HydrophobicContact CD1-CE1 4.46Å; Y249-F268 HydrophobicContact CD1-CE2 4.46Å; Y249-F268 AromaticContact CD1-CZ 3.77Å; Y249-F268 HydrophobicContact CD1-CZ 3.77Å; Y249-T272 HydrophobicContact CD1-CG2 3.58Å; Y249-T272 HydrophobicContact CE1-CG2 3.6Å; Y249-V276 HydrophobicContact CD1-CG1 4.38Å; Y249-V276 HydrophobicContact CD1-CG2 3.55Å; Y249-V276 HydrophobicContact CD2-CB 4.46Å; Y249-V276 HydrophobicContact CD2-CG1 3.58Å; Y249-V276 HydrophobicContact CD2-CG2 3.94Å; Y249-V276 HydrophobicContact CE1-CG2 3.29Å; Y249-V276 HydrophobicContact CE2-CB 4.44Å; Y249-V276 HydrophobicContact CE2-CG1 3.88Å; Y249-V276 HydrophobicContact CE2-CG2 3.69Å; Y249-V276 HydrophobicContact CG-CG1 3.82Å; Y249-V276 HydrophobicContact CG-CG2 3.84Å
250	G	87.5	Confident	90.4	Very high	2 Å²	2	56.1 Å²	56.1	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-59.1	-42.8	174.9	0	0	0	0	0	112.4	N246 I247 K253 T254	N246-G250 PolarHBondContact O-N 2.83Å; N246-G250 VanDerWaalsContact O-N 3.13Å; I247-G250 PolarHBondContact O-N 3.3Å; I247-G250 VanDerWaalsContact O-N 3.12Å; G250-K253 PolarHBondContact O-N 2.92Å; G250-T254 WeakPolarHBondContact O-CB 3.49Å; G250-T254 VanDerWaalsContact O-CG2 3.23Å; G250-T254 WeakPolarHBondContact O-CG2 3.48Å; G250-T254 PolarHBondContact O-N 3.45Å; G250-T254 PolarHBondContact O-OG1 3.18Å
251	L	90.8	Very high	90.5	Very high	39 Å²	39	49.9 Å²	49.9	20%	0.204	28%	0.278	C	S	.	.	H	α-helix	trans	-64.3	-43.2	177.6	-69	176.6	0	0	0	112.6	I247 G248 Y249 T254 Y255 H429 L433	I247-L251 HydrophobicContact CG2-CD1 3.95Å; I247-L251 HydrophobicContact CG2-CG 4.18Å; I247-L251 WeakPolarHBondContact O-CG 3.47Å; I247-L251 PolarHBondContact O-N 3.26Å; G248-L251 PolarHBondContact O-N 3.44Å; Y249-L251 VanDerWaalsContact C-N 3.33Å; Y249-L251 PolarHBondContact O-N 3.27Å; L251-T254 PolarHBondContact O-OG1 3.03Å; L251-Y255 WeakPolarHBondContact O-CB 3.41Å; L251-Y255 PolarHBondContact O-N 3.27Å; L251-Y255 VanDerWaalsContact O-N 3.08Å; L251-H429 HydrophobicContact CD2-CB 4.12Å; L251-L433 HydrophobicContact CD1-CD1 3.8Å; L251-L433 HydrophobicContact CD2-CD1 3.51Å; L251-L433 HydrophobicContact CG-CD1 4.31Å
252	V	92.5	Very high	90.6	Very high	58 Å²	58	45.3 Å²	45.3	35%	0.352	26%	0.255	S	S	.	.	H	α-helix	trans	-66.5	-46.8	176.2	175	0	0	0	0	110.8	G248 Y249 T254 Y255 L256 F268	G248-V252 WeakPolarHBondContact O-CG2 3.42Å; G248-V252 PolarHBondContact O-N 2.68Å; G248-V252 VanDerWaalsContact O-N 3.09Å; Y249-V252 PolarHBondContact O-N 3.21Å; V252-T254 VanDerWaalsContact C-N 3.33Å; V252-T254 PolarHBondContact O-N 3.47Å; V252-Y255 WeakPolarHBondContact O-CB 3.19Å; V252-Y255 PolarHBondContact O-N 3.26Å; V252-Y255 VanDerWaalsContact O-N 3.16Å; V252-L256 HydrophobicContact CG1-CD1 4.04Å; V252-L256 HydrophobicContact CG1-CG 4.36Å; V252-L256 WeakPolarHBondContact O-CG 3.47Å; V252-L256 PolarHBondContact O-N 3.24Å; V252-F268 HydrophobicContact CB-CE1 4.33Å; V252-F268 HydrophobicContact CB-CE2 4.2Å; V252-F268 HydrophobicContact CB-CZ 3.78Å; V252-F268 HydrophobicContact CG1-CD2 4.09Å; V252-F268 HydrophobicContact CG1-CE1 4.12Å; V252-F268 HydrophobicContact CG1-CE2 3.62Å; V252-F268 HydrophobicContact CG1-CZ 3.63Å
253	K	91.7	Very high	90.9	Very high	48 Å²	48	45.8 Å²	45.8	21%	0.209	24%	0.244	C	C	.	.	H	α-helix	trans	-55.6	-47.7	178.2	-172.7	-170.8	173.5	-161.9	0	111.4	Y249 G250 Y255 L256 L257 L265 F268 E289	Y249-K253 VanDerWaalsContact O-CB 3.27Å; Y249-K253 WeakPolarHBondContact O-CB 3.27Å; Y249-K253 PolarHBondContact O-N 3.25Å; G250-K253 PolarHBondContact O-N 2.92Å; K253-Y255 PolarHBondContact O-N 3.47Å; K253-L256 PolarHBondContact O-N 3.37Å; K253-L257 HydrophobicContact CG-CD1 4.2Å; K253-L257 WeakPolarHBondContact O-CB 3.34Å; K253-L257 WeakPolarHBondContact O-CG 3.47Å; K253-L257 PolarHBondContact O-N 3.24Å; K253-L265 HydrophobicContact CG-CD1 3.77Å; K253-F268 HydrophobicContact CB-CE1 4.33Å; K253-E289 WeakPolarHBondContact CE-OE1 3.39Å; K253-E289 IonicContact NZ-OE1 3.16Å; K253-E289 PolarHBondContact NZ-OE1 3.25Å; K253-E289 IonicContact NZ-OE2 3.1Å; K253-E289 PolarHBondContact NZ-OE2 3.22Å
254	T	90.6	Very high	91.3	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-65.8	-36.2	178.8	54.1	0	0	0	0	113.2	G250 L251 V252 H258 I287	G250-T254 WeakPolarHBondContact O-CB 3.49Å; G250-T254 VanDerWaalsContact O-CG2 3.23Å; G250-T254 WeakPolarHBondContact O-CG2 3.48Å; G250-T254 PolarHBondContact O-N 3.45Å; G250-T254 PolarHBondContact O-OG1 3.18Å; L251-T254 PolarHBondContact O-OG1 3.03Å; V252-T254 VanDerWaalsContact C-N 3.33Å; V252-T254 PolarHBondContact O-N 3.47Å; T254-H258 WeakPolarHBondContact O-CB 3.44Å; T254-H258 PolarHBondContact O-N 2.67Å; T254-I287 HydrophobicContact CG2-CB 4.46Å; T254-I287 HydrophobicContact CG2-CD1 4.12Å; T254-I287 HydrophobicContact CG2-CG2 3.15Å
255	Y	94	Very high	91.7	Very high	72 Å²	72	40.9 Å²	40.9	28%	0.282	22%	0.218	S	C	.	.	H	α-helix	trans	-61.7	-47.3	173.6	-177.3	-85.4	0	0	0	111.5	L251 V252 K253 H258 Y259 Y261 S428 L430	L251-Y255 WeakPolarHBondContact O-CB 3.41Å; L251-Y255 PolarHBondContact O-N 3.27Å; L251-Y255 VanDerWaalsContact O-N 3.08Å; V252-Y255 WeakPolarHBondContact O-CB 3.19Å; V252-Y255 PolarHBondContact O-N 3.26Å; V252-Y255 VanDerWaalsContact O-N 3.16Å; K253-Y255 PolarHBondContact O-N 3.47Å; Y255-H258 PolarHBondContact O-N 2.8Å; Y255-Y259 HydrophobicContact CD1-CD2 4.27Å; Y255-Y259 HydrophobicContact CD2-CD2 4.04Å; Y255-Y259 HydrophobicContact CD2-CE2 4.02Å; Y255-Y259 AromaticContact CE1-CD2 3.92Å; Y255-Y259 HydrophobicContact CE1-CD2 3.92Å; Y255-Y259 AromaticContact CE2-CD2 3.64Å; Y255-Y259 HydrophobicContact CE2-CD2 3.64Å; Y255-Y259 AromaticContact CE2-CE2 3.44Å; Y255-Y259 HydrophobicContact CE2-CE2 3.44Å; Y255-Y259 VanDerWaalsContact CE2-CE2 3.44Å; Y255-Y259 HydrophobicContact CG-CD2 4.31Å; Y255-Y259 AromaticContact CZ-CD2 3.56Å; Y255-Y259 AromaticContact CZ-CE2 3.72Å; Y255-Y259 PolarHBondContact O-N 3.46Å; Y255-Y259 VanDerWaalsContact O-N 3.09Å; Y255-Y261 HydrophobicContact CE1-CD2 4.22Å; Y255-Y261 AromaticContact CE1-CE2 3.81Å; Y255-Y261 HydrophobicContact CE1-CE2 3.81Å; Y255-S428 VanDerWaalsContact CD2-OG 3.29Å; Y255-S428 WeakPolarHBondContact CD2-OG 3.33Å; Y255-L430 HydrophobicContact CD2-CB 4.4Å; Y255-L430 HydrophobicContact CD2-CD2 4.26Å
256	L	95.6	Very high	92.4	Very high	15 Å²	15	39.9 Å²	39.9	8%	0.079	21%	0.207	C	C	.	.	H	α-helix	trans	-64.6	-42	179.8	-63.6	175	0	0	0	112.2	V252 K253 G260 Y261 T264 L265 F268	V252-L256 HydrophobicContact CG1-CD1 4.04Å; V252-L256 HydrophobicContact CG1-CG 4.36Å; V252-L256 WeakPolarHBondContact O-CG 3.47Å; V252-L256 PolarHBondContact O-N 3.24Å; K253-L256 PolarHBondContact O-N 3.37Å; L256-G260 PolarHBondContact O-N 3.37Å; L256-G260 VanDerWaalsContact O-N 3.12Å; L256-Y261 HydrophobicContact CD2-CD2 3.96Å; L256-Y261 HydrophobicContact CD2-CG 4.22Å; L256-Y261 PolarHBondContact O-N 3.4Å; L256-T264 HydrophobicContact CD1-CG2 4.15Å; L256-T264 HydrophobicContact CD2-CG2 3.8Å; L256-L265 HydrophobicContact CB-CB 4.05Å; L256-L265 HydrophobicContact CB-CD1 4.17Å; L256-L265 HydrophobicContact CD1-CB 4.35Å; L256-L265 HydrophobicContact CD1-CD1 4.37Å; L256-F268 HydrophobicContact CD1-CB 4.01Å; L256-F268 HydrophobicContact CD1-CD1 4.38Å; L256-F268 HydrophobicContact CD1-CG 4.13Å
257	L	93.8	Very high	93.1	Very high	10 Å²	10	42 Å²	42	5%	0.052	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-51.2	172.4	-79	167.7	0	0	0	111.4	K253 Y259 G260 L265 E289 S292 L296 R299	K253-L257 HydrophobicContact CG-CD1 4.2Å; K253-L257 WeakPolarHBondContact O-CB 3.34Å; K253-L257 WeakPolarHBondContact O-CG 3.47Å; K253-L257 PolarHBondContact O-N 3.24Å; L257-Y259 PolarHBondContact O-N 3.35Å; L257-G260 PolarHBondContact O-N 3.26Å; L257-G260 VanDerWaalsContact O-N 3.16Å; L257-L265 HydrophobicContact CD2-CD2 3.39Å; L257-L265 HydrophobicContact CG-CD2 3.69Å; L257-E289 HydrophobicContact CD1-CG 4.3Å; L257-S292 CarbonylContact C-O 3.37Å; L257-L296 HydrophobicContact CD2-CD2 4.01Å; L257-R299 PolarHBondContact O-NH1 3.34Å; L257-R299 PolarHBondContact O-NH2 3.33Å; L257-R299 VanDerWaalsContact O-NH2 3.12Å
258	H	93.4	Very high	93.3	Very high	7 Å²	7	41.3 Å²	41.3	3%	0.032	22%	0.221	C	C	.	.	H	α-helix	trans	-57.1	-46.1	-175.8	-177.5	84	0	0	0	112.2	T254 Y255 R299 N407 C424 H425 Q427	T254-H258 WeakPolarHBondContact O-CB 3.44Å; T254-H258 PolarHBondContact O-N 2.67Å; Y255-H258 PolarHBondContact O-N 2.8Å; H258-R299 PolarHBondContact O-NH1 3.14Å; H258-N407 PolarHBondContact O-ND2 2.99Å; H258-N407 PolarHBondContact O-OD1 2.9Å; H258-C424 PolarHBondContact CE1-O 2.83Å; H258-C424 VanDerWaalsContact CE1-O 3.24Å; H258-H425 PolarHBondContact CE1-O 3.01Å; H258-Q427 PolarHBondContact NE2-N 2.66Å
259	Y	95.3	Very high	93.5	Very high	4 Å²	4	42 Å²	42	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-89.1	-0.9	-178.7	-76.9	-70.4	0	0	0	114.9	Y255 L257 Y261 R303 D404 E431	Y255-Y259 HydrophobicContact CD1-CD2 4.27Å; Y255-Y259 HydrophobicContact CD2-CD2 4.04Å; Y255-Y259 HydrophobicContact CD2-CE2 4.02Å; Y255-Y259 AromaticContact CE1-CD2 3.92Å; Y255-Y259 HydrophobicContact CE1-CD2 3.92Å; Y255-Y259 AromaticContact CE2-CD2 3.64Å; Y255-Y259 HydrophobicContact CE2-CD2 3.64Å; Y255-Y259 AromaticContact CE2-CE2 3.44Å; Y255-Y259 HydrophobicContact CE2-CE2 3.44Å; Y255-Y259 VanDerWaalsContact CE2-CE2 3.44Å; Y255-Y259 HydrophobicContact CG-CD2 4.31Å; Y255-Y259 AromaticContact CZ-CD2 3.56Å; Y255-Y259 AromaticContact CZ-CE2 3.72Å; Y255-Y259 PolarHBondContact O-N 3.46Å; Y255-Y259 VanDerWaalsContact O-N 3.09Å; L257-Y259 PolarHBondContact O-N 3.35Å; Y259-Y261 HydrophobicContact CD2-CE2 4.44Å; Y259-Y261 HydrophobicContact CG-CE2 4.01Å; Y259-R303 WeakPolarHBondContact O-CD 3.11Å; Y259-R303 VanDerWaalsContact O-CZ 3.28Å; Y259-R303 PolarHBondContact O-NE 3.04Å; Y259-R303 VanDerWaalsContact O-NE 3.14Å; Y259-R303 PolarHBondContact O-NH1 2.7Å; Y259-D404 WeakPolarHBondContact CD1-OD1 3.5Å; Y259-D404 HydrophobicContact CE1-CB 4.14Å; Y259-D404 VanDerWaalsContact CE1-CG 3.46Å; Y259-D404 WeakPolarHBondContact CE1-OD1 3.46Å; Y259-E431 WeakPolarHBondContact CE2-OE2 3.47Å; Y259-E431 PolarHBondContact OH-OE1 2.91Å; Y259-E431 PolarHBondContact OH-OE2 2.98Å
260	G	95.7	Very high	93.7	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.01	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	27.1	175.9	0	0	0	0	0	114.1	L256 L257 E262 K300	L256-G260 PolarHBondContact O-N 3.37Å; L256-G260 VanDerWaalsContact O-N 3.12Å; L257-G260 PolarHBondContact O-N 3.26Å; L257-G260 VanDerWaalsContact O-N 3.16Å; G260-E262 PolarHBondContact O-N 3.04Å; G260-K300 WeakPolarHBondContact O-CA 3.45Å; G260-K300 VanDerWaalsContact O-CB 3.31Å; G260-K300 WeakPolarHBondContact O-CB 3.21Å
261	Y	96.8	Very high	93.8	Very high	46 Å²	46	47.4 Å²	47.4	18%	0.18	26%	0.258	C	S	.	.			trans	-80.4	58	177	-63.1	-57	0	0	0	111.4	Y255 L256 Y259 E263 T264 L265 R303	Y255-Y261 HydrophobicContact CE1-CD2 4.22Å; Y255-Y261 AromaticContact CE1-CE2 3.81Å; Y255-Y261 HydrophobicContact CE1-CE2 3.81Å; L256-Y261 HydrophobicContact CD2-CD2 3.96Å; L256-Y261 HydrophobicContact CD2-CG 4.22Å; L256-Y261 PolarHBondContact O-N 3.4Å; Y259-Y261 HydrophobicContact CD2-CE2 4.44Å; Y259-Y261 HydrophobicContact CG-CE2 4.01Å; Y261-E263 PolarHBondContact O-N 2.86Å; Y261-T264 PolarHBondContact O-N 3.11Å; Y261-L265 WeakPolarHBondContact O-CB 3.19Å; Y261-L265 PolarHBondContact O-N 3.2Å; Y261-R303 PolarHBondContact OH-NH2 3Å
262	E	96.8	Very high	93.5	Very high	22 Å²	22	46.7 Å²	46.7	10%	0.103	26%	0.255	C	S	.	.	H	α-helix	trans	-57	-48.7	-171.1	-172.3	-170.6	-161	0	0	113.7	G260 T264 L265 D266 L296 K297 K300	G260-E262 PolarHBondContact O-N 3.04Å; E262-T264 VanDerWaalsContact C-N 3.33Å; E262-T264 PolarHBondContact O-N 3.17Å; E262-L265 CarbonylContact O-C 3.53Å; E262-L265 WeakPolarHBondContact O-CB 3.42Å; E262-L265 PolarHBondContact O-N 2.96Å; E262-L265 VanDerWaalsContact O-N 3.12Å; E262-D266 PolarHBondContact O-N 3.46Å; E262-L296 HydrophobicContact CB-CD1 4.33Å; E262-L296 HydrophobicContact CB-CD2 4.32Å; E262-L296 HydrophobicContact CB-CG 4.06Å; E262-L296 HydrophobicContact CG-CD2 3.97Å; E262-L296 HydrophobicContact CG-CG 4.04Å; E262-K297 VanDerWaalsContact CD-CE 3.48Å; E262-K297 WeakPolarHBondContact OE1-CE 3.39Å; E262-K297 IonicContact OE1-NZ 2.72Å; E262-K297 PolarHBondContact OE1-NZ 3.17Å; E262-K297 VanDerWaalsContact OE2-CD 3.29Å; E262-K297 WeakPolarHBondContact OE2-CD 3.44Å; E262-K297 WeakPolarHBondContact OE2-CE 3.44Å; E262-K297 IonicContact OE2-NZ 2.68Å; E262-K297 PolarHBondContact OE2-NZ 3.01Å; E262-K300 HydrophobicContact CB-CB 4.03Å; E262-K300 HydrophobicContact CB-CG 3.98Å
263	E	95.9	Very high	93	Very high	125 Å²	125	51.7 Å²	51.7	58%	0.584	27%	0.272	S	S	*	.	H	α-helix	trans	-63.6	-40.4	-179.2	-68.2	176	-174.7	0	0	111.7	Y261 L265 D266 A267 K300	Y261-E263 PolarHBondContact O-N 2.86Å; E263-L265 VanDerWaalsContact C-N 3.33Å; E263-D266 PolarHBondContact O-N 2.92Å; E263-A267 PolarHBondContact O-N 3.02Å; E263-K300 WeakPolarHBondContact OE1-CE 3.44Å; E263-K300 IonicContact OE1-NZ 2.65Å; E263-K300 PolarHBondContact OE1-NZ 2.96Å
264	T	96.4	Very high	92.5	Very high	80 Å²	80	56.8 Å²	56.8	49%	0.491	30%	0.302	S	S	.	.	H	α-helix	trans	-65.5	-38.8	174.3	-51.5	0	0	0	0	111.1	L256 Y261 E262 A267 F268	L256-T264 HydrophobicContact CD1-CG2 4.15Å; L256-T264 HydrophobicContact CD2-CG2 3.8Å; Y261-T264 PolarHBondContact O-N 3.11Å; E262-T264 VanDerWaalsContact C-N 3.33Å; E262-T264 PolarHBondContact O-N 3.17Å; T264-A267 PolarHBondContact O-N 3.29Å; T264-F268 WeakPolarHBondContact O-CB 3.48Å; T264-F268 PolarHBondContact O-N 2.9Å
265	L	94.9	Very high	91.9	Very high	7 Å²	7	61.4 Å²	61.4	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-63.8	-43.1	175.9	176.2	64.7	0	0	0	111.5	K253 L256 L257 Y261 E262 E263 F268 N269 L296	K253-L265 HydrophobicContact CG-CD1 3.77Å; L256-L265 HydrophobicContact CB-CB 4.05Å; L256-L265 HydrophobicContact CB-CD1 4.17Å; L256-L265 HydrophobicContact CD1-CB 4.35Å; L256-L265 HydrophobicContact CD1-CD1 4.37Å; L257-L265 HydrophobicContact CD2-CD2 3.39Å; L257-L265 HydrophobicContact CG-CD2 3.69Å; Y261-L265 WeakPolarHBondContact O-CB 3.19Å; Y261-L265 PolarHBondContact O-N 3.2Å; E262-L265 CarbonylContact O-C 3.53Å; E262-L265 WeakPolarHBondContact O-CB 3.42Å; E262-L265 PolarHBondContact O-N 2.96Å; E262-L265 VanDerWaalsContact O-N 3.12Å; E263-L265 VanDerWaalsContact C-N 3.33Å; L265-F268 PolarHBondContact O-N 3.42Å; L265-N269 WeakPolarHBondContact O-CB 3.47Å; L265-N269 PolarHBondContact O-N 3Å; L265-N269 PolarHBondContact O-ND2 2.96Å; L265-L296 HydrophobicContact CD2-CD2 4.08Å
266	D	94.6	Very high	90.8	Very high	89 Å²	89	59.3 Å²	59.3	48%	0.476	33%	0.325	S	S	.	.	H	α-helix	trans	-62.9	-46.3	177	-73	-22.2	0	0	0	111.3	E262 E263 F268 N269 L270	E262-D266 PolarHBondContact O-N 3.46Å; E263-D266 PolarHBondContact O-N 2.92Å; D266-F268 VanDerWaalsContact C-N 3.34Å; D266-F268 PolarHBondContact O-N 3.46Å; D266-N269 PolarHBondContact O-N 2.85Å; D266-L270 WeakPolarHBondContact O-CB 3.47Å; D266-L270 PolarHBondContact O-N 3.32Å
267	A	95.8	Very high	89.6	Confident	60 Å²	60	62.3 Å²	62.3	50%	0.496	35%	0.345	S	S	.	.	H	α-helix	trans	-61.5	-42.3	174.7	0	0	0	0	0	111.9	E263 T264 L270 A271	E263-A267 PolarHBondContact O-N 3.02Å; T264-A267 PolarHBondContact O-N 3.29Å; A267-L270 PolarHBondContact O-N 3.02Å; A267-A271 WeakPolarHBondContact O-CB 3.43Å; A267-A271 PolarHBondContact O-N 3.35Å
268	F	92.6	Very high	88.1	Confident	47 Å²	47	66.4 Å²	66.4	21%	0.206	37%	0.373	C	S	.	.	H	α-helix	trans	-63.2	-45.9	176.8	-177.9	-100.3	0	0	0	111.8	Y249 V252 K253 L256 T264 L265 D266 L270 A271 T272	Y249-F268 HydrophobicContact CD1-CE1 4.46Å; Y249-F268 HydrophobicContact CD1-CE2 4.46Å; Y249-F268 AromaticContact CD1-CZ 3.77Å; Y249-F268 HydrophobicContact CD1-CZ 3.77Å; V252-F268 HydrophobicContact CB-CE1 4.33Å; V252-F268 HydrophobicContact CB-CE2 4.2Å; V252-F268 HydrophobicContact CB-CZ 3.78Å; V252-F268 HydrophobicContact CG1-CD2 4.09Å; V252-F268 HydrophobicContact CG1-CE1 4.12Å; V252-F268 HydrophobicContact CG1-CE2 3.62Å; V252-F268 HydrophobicContact CG1-CZ 3.63Å; K253-F268 HydrophobicContact CB-CE1 4.33Å; L256-F268 HydrophobicContact CD1-CB 4.01Å; L256-F268 HydrophobicContact CD1-CD1 4.38Å; L256-F268 HydrophobicContact CD1-CG 4.13Å; T264-F268 WeakPolarHBondContact O-CB 3.48Å; T264-F268 PolarHBondContact O-N 2.9Å; L265-F268 PolarHBondContact O-N 3.42Å; D266-F268 VanDerWaalsContact C-N 3.34Å; D266-F268 PolarHBondContact O-N 3.46Å; F268-L270 PolarHBondContact O-N 3.44Å; F268-A271 PolarHBondContact O-N 3.08Å; F268-T272 HydrophobicContact CD1-CG2 4.49Å; F268-T272 HydrophobicContact CD2-CG2 4.47Å; F268-T272 HydrophobicContact CE1-CG2 4.23Å; F268-T272 HydrophobicContact CE2-CG2 4.21Å; F268-T272 HydrophobicContact CZ-CG2 4.09Å; F268-T272 WeakPolarHBondContact O-CB 3.27Å; F268-T272 VanDerWaalsContact O-CG2 3.24Å; F268-T272 WeakPolarHBondContact O-CG2 3.4Å; F268-T272 PolarHBondContact O-N 3.14Å; F268-T272 PolarHBondContact O-OG1 3.08Å
269	N	91	Very high	86.3	Confident	58 Å²	58	69 Å²	69	31%	0.31	39%	0.386	S	S	.	.	H	α-helix	trans	-63.2	-41.4	177	-72.6	-26.6	0	0	0	111.5	L265 D266 T272 K273	L265-N269 WeakPolarHBondContact O-CB 3.47Å; L265-N269 PolarHBondContact O-N 3Å; L265-N269 PolarHBondContact O-ND2 2.96Å; D266-N269 PolarHBondContact O-N 2.85Å; N269-T272 WeakPolarHBondContact CA-OG1 3.08Å; N269-T272 PolarHBondContact O-N 3.16Å; N269-T272 PolarHBondContact O-OG1 3.2Å; N269-K273 WeakPolarHBondContact O-CB 3.27Å; N269-K273 PolarHBondContact O-N 3.25Å
270	L	91.6	Very high	84.1	Confident	134 Å²	134	76.8 Å²	76.8	70%	0.702	42%	0.422	S	S	*	.	H	α-helix	trans	-61.8	-44.9	176.6	-179.5	62.5	0	0	0	111.9	D266 A267 F268 T272	D266-L270 WeakPolarHBondContact O-CB 3.47Å; D266-L270 PolarHBondContact O-N 3.32Å; A267-L270 PolarHBondContact O-N 3.02Å; F268-L270 PolarHBondContact O-N 3.44Å; L270-T272 VanDerWaalsContact C-N 3.3Å; L270-T272 PolarHBondContact O-N 3.37Å
271	A	89.1	Confident	81.9	Confident	72 Å²	72	79 Å²	79	60%	0.595	43%	0.433	S	S	*	.	H	α-helix	trans	-68	-28.6	179.8	0	0	0	0	0	113.3	A267 F268 T275	A267-A271 WeakPolarHBondContact O-CB 3.43Å; A267-A271 PolarHBondContact O-N 3.35Å; F268-A271 PolarHBondContact O-N 3.08Å; A271-T275 PolarHBondContact O-OG1 2.99Å
272	T	86.1	Confident	79.4	Confident	23 Å²	23	83 Å²	83	14%	0.141	46%	0.458	C	S	.	.	H	α-helix	trans	-94.2	-17.5	-175.3	53.1	0	0	0	0	114.1	Y249 F268 N269 L270 N274 T275 V276	Y249-T272 HydrophobicContact CD1-CG2 3.58Å; Y249-T272 HydrophobicContact CE1-CG2 3.6Å; F268-T272 HydrophobicContact CD1-CG2 4.49Å; F268-T272 HydrophobicContact CD2-CG2 4.47Å; F268-T272 HydrophobicContact CE1-CG2 4.23Å; F268-T272 HydrophobicContact CE2-CG2 4.21Å; F268-T272 HydrophobicContact CZ-CG2 4.09Å; F268-T272 WeakPolarHBondContact O-CB 3.27Å; F268-T272 VanDerWaalsContact O-CG2 3.24Å; F268-T272 WeakPolarHBondContact O-CG2 3.4Å; F268-T272 PolarHBondContact O-N 3.14Å; F268-T272 PolarHBondContact O-OG1 3.08Å; N269-T272 WeakPolarHBondContact CA-OG1 3.08Å; N269-T272 PolarHBondContact O-N 3.16Å; N269-T272 PolarHBondContact O-OG1 3.2Å; L270-T272 VanDerWaalsContact C-N 3.3Å; L270-T272 PolarHBondContact O-N 3.37Å; T272-N274 PolarHBondContact O-N 2.98Å; T272-T275 WeakPolarHBondContact CA-OG1 3.39Å; T272-T275 PolarHBondContact O-N 3.24Å; T272-T275 PolarHBondContact O-OG1 3.24Å; T272-V276 HydrophobicContact CG2-CG2 3.97Å; T272-V276 PolarHBondContact O-N 3.16Å; T272-V276 VanDerWaalsContact O-N 3.16Å
273	K	82.2	Confident	76.8	Confident	163 Å²	163	90.8 Å²	90.8	71%	0.709	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-37.2	-173.2	-167	174.8	-177.7	176.7	0	115.3	N269	N269-K273 WeakPolarHBondContact O-CB 3.27Å; N269-K273 PolarHBondContact O-N 3.25Å
274	N	80.7	Confident	74.3	Confident	156 Å²	156	93.9 Å²	93.9	83%	0.834	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-3	-176.4	-63.4	-22.5	0	0	0	113.7	T272	T272-N274 PolarHBondContact O-N 2.98Å
275	T	78.1	Confident	71.9	Confident	98 Å²	98	95.8 Å²	95.8	60%	0.601	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	-20.8	-172.4	52.3	0	0	0	0	112.9	A271 T272	A271-T275 PolarHBondContact O-OG1 2.99Å; T272-T275 WeakPolarHBondContact CA-OG1 3.39Å; T272-T275 PolarHBondContact O-N 3.24Å; T272-T275 PolarHBondContact O-OG1 3.24Å
276	V	71.6	Confident	69.7	Low	28 Å²	28	98.6 Å²	98.6	17%	0.17	54%	0.54	C	S	.	.	S	Bend	trans	-110	126.3	-173.8	-169.5	0	0	0	0	110.5	N246 Y249 T272	N246-V276 HydrophobicContact CB-CG1 4Å; Y249-V276 HydrophobicContact CD1-CG1 4.38Å; Y249-V276 HydrophobicContact CD1-CG2 3.55Å; Y249-V276 HydrophobicContact CD2-CB 4.46Å; Y249-V276 HydrophobicContact CD2-CG1 3.58Å; Y249-V276 HydrophobicContact CD2-CG2 3.94Å; Y249-V276 HydrophobicContact CE1-CG2 3.29Å; Y249-V276 HydrophobicContact CE2-CB 4.44Å; Y249-V276 HydrophobicContact CE2-CG1 3.88Å; Y249-V276 HydrophobicContact CE2-CG2 3.69Å; Y249-V276 HydrophobicContact CG-CG1 3.82Å; Y249-V276 HydrophobicContact CG-CG2 3.84Å; T272-V276 HydrophobicContact CG2-CG2 3.97Å; T272-V276 PolarHBondContact O-N 3.16Å; T272-V276 VanDerWaalsContact O-N 3.16Å
277	P	68.8	Low	67.6	Low	78 Å²	78	96.5 Å²	96.5	51%	0.506	53%	0.529	S	S	.	.			trans	-57.4	143.7	169.4	-22.3	32.6	0	0	0	111.2	I279	P277-I279 PolarHBondContact O-N 3.3Å
278	P	62.8	Low	65.8	Low	96 Å²	96	95.5 Å²	95.5	62%	0.623	52%	0.515	S	S	*	.			trans	-49.2	138.1	179.9	-26.4	32.9	0	0	0	112.8	N246 H280	N246-P278 PolarHBondContact ND2-O 3.25Å; N246-P278 VanDerWaalsContact ND2-O 3.08Å; P278-H280 PolarHBondContact O-N 3.03Å
279	I	56.1	Low	64.3	Low	63 Å²	63	96.3 Å²	96.3	32%	0.323	52%	0.519	S	S	.	.			trans	-74.5	91	173.2	-60.3	176.6	0	0	0	108.4	N246 P277 I281	N246-I279 HydrophobicContact CB-CG1 4.06Å; N246-I279 WeakPolarHBondContact ND2-CA 3.19Å; P277-I279 PolarHBondContact O-N 3.3Å; I279-I281 VanDerWaalsContact C-N 3.32Å; I279-I281 HydrophobicContact CG2-CB 4.25Å; I279-I281 HydrophobicContact CG2-CD1 3.28Å; I279-I281 HydrophobicContact CG2-CG1 3.38Å; I279-I281 PolarHBondContact O-N 3.23Å
280	H	48.5	Very low	63.2	Low	167 Å²	167	98.5 Å²	98.5	77%	0.773	53%	0.531	S	S	*	.			trans	-86.1	78.6	161.6	-65.3	-68.2	0	0	0	108	P278	P278-H280 PolarHBondContact O-N 3.03Å
281	I	50.4	Low	62.5	Low	46 Å²	46	92.9 Å²	92.9	24%	0.236	50%	0.502	C	S	.	.			trans	-79.1	123.3	162.7	-70	162.8	0	0	0	105.6	I279 Q283 N285 I287	I279-I281 VanDerWaalsContact C-N 3.32Å; I279-I281 HydrophobicContact CG2-CB 4.25Å; I279-I281 HydrophobicContact CG2-CD1 3.28Å; I279-I281 HydrophobicContact CG2-CG1 3.38Å; I279-I281 PolarHBondContact O-N 3.23Å; I281-Q283 PolarHBondContact O-N 2.67Å; I281-N285 HydrophobicContact CG2-CB 3.59Å; I281-N285 VanDerWaalsContact CG2-O 3.27Å; I281-N285 WeakPolarHBondContact CG2-O 3.38Å; I281-I287 HydrophobicContact CD1-CD1 3.18Å; I281-I287 HydrophobicContact CD1-CG1 3.68Å
282	D	42.8	Very low	62.1	Low	132 Å²	132	89.8 Å²	89.8	71%	0.706	48%	0.476	S	S	*	.			trans	-46.4	129	172.7	-67.1	-45.5	0	0	0	108.9	E284 N285	D282-E284 PolarHBondContact O-N 3.48Å; D282-N285 PolarHBondContact O-N 3.09Å
283	Q	42.1	Very low	62.1	Low	184 Å²	184	91.1 Å²	91.1	86%	0.86	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-53.8	-18.7	-169.5	-76.2	173.9	-26.6	0	0	114.5	I281 N285 A286	I281-Q283 PolarHBondContact O-N 2.67Å; Q283-N285 VanDerWaalsContact C-N 3.26Å; Q283-N285 PolarHBondContact O-N 2.92Å; Q283-A286 VanDerWaalsContact O-CB 3.29Å; Q283-A286 WeakPolarHBondContact O-CB 3.19Å; Q283-A286 PolarHBondContact O-N 3.31Å
284	E	44.9	Very low	62.5	Low	191 Å²	191	86 Å²	86	89%	0.893	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-66.7	-26.1	172.8	-74.3	-171.9	156.1	0	0	113.6	D282	D282-E284 PolarHBondContact O-N 3.48Å
285	N	45.5	Very low	63.1	Low	120 Å²	120	79.5 Å²	79.5	64%	0.642	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-109.5	18.3	174.1	-69.7	-45.5	0	0	0	111.8	I281 D282 Q283 I287	I281-N285 HydrophobicContact CG2-CB 3.59Å; I281-N285 VanDerWaalsContact CG2-O 3.27Å; I281-N285 WeakPolarHBondContact CG2-O 3.38Å; D282-N285 PolarHBondContact O-N 3.09Å; Q283-N285 VanDerWaalsContact C-N 3.26Å; Q283-N285 PolarHBondContact O-N 2.92Å; N285-I287 VanDerWaalsContact C-N 3.27Å; N285-I287 PolarHBondContact O-N 3.06Å
286	A	48.7	Very low	63.9	Low	66 Å²	66	76.1 Å²	76.1	55%	0.545	41%	0.408	S	S	.	.			trans	-49	100.2	175.2	0	0	0	0	0	107.9	Q283 D288	Q283-A286 VanDerWaalsContact O-CB 3.29Å; Q283-A286 WeakPolarHBondContact O-CB 3.19Å; Q283-A286 PolarHBondContact O-N 3.31Å; A286-D288 PolarHBondContact O-N 3.48Å
287	I	51.1	Low	65.1	Low	45 Å²	45	79.5 Å²	79.5	23%	0.231	42%	0.421	C	S	.	.			trans	-46.8	139.9	-175.4	-71.9	179.7	0	0	0	106.9	T254 I281 N285 E289	T254-I287 HydrophobicContact CG2-CB 4.46Å; T254-I287 HydrophobicContact CG2-CD1 4.12Å; T254-I287 HydrophobicContact CG2-CG2 3.15Å; I281-I287 HydrophobicContact CD1-CD1 3.18Å; I281-I287 HydrophobicContact CD1-CG1 3.68Å; N285-I287 VanDerWaalsContact C-N 3.27Å; N285-I287 PolarHBondContact O-N 3.06Å; I287-E289 HydrophobicContact CB-CG 4.22Å; I287-E289 HydrophobicContact CG2-CG 3.78Å; I287-E289 PolarHBondContact O-N 2.97Å
288	D	57	Low	66.4	Low	38 Å²	38	79.5 Å²	79.5	20%	0.203	41%	0.414	C	S	.	.	S	Bend	trans	-59.9	47	173	-70.3	-47.2	0	0	0	112.4	A286 D290 D291 S292 Q421	A286-D288 PolarHBondContact O-N 3.48Å; D288-D290 PolarHBondContact O-N 2.94Å; D288-D291 HydrophobicContact CB-CB 4.13Å; D288-D291 PolarHBondContact O-N 2.92Å; D288-S292 VanDerWaalsContact O-CB 3.3Å; D288-S292 WeakPolarHBondContact O-CB 3.31Å; D288-S292 PolarHBondContact O-N 3.49Å; D288-S292 PolarHBondContact O-OG 3.33Å; D288-Q421 PolarHBondContact OD2-NE2 2.87Å; D288-Q421 PolarHBondContact OD2-OE1 3.14Å; D288-Q421 VanDerWaalsContact OD2-OE1 3.12Å
289	E	61.6	Low	68.1	Low	65 Å²	65	75 Å²	75	30%	0.304	39%	0.385	S	S	.	.	H	α-helix	trans	-60.8	-37.1	172	-69.8	-162.3	175.6	0	0	109	K253 L257 I287 S292 S293	K253-E289 WeakPolarHBondContact CE-OE1 3.39Å; K253-E289 IonicContact NZ-OE1 3.16Å; K253-E289 PolarHBondContact NZ-OE1 3.25Å; K253-E289 IonicContact NZ-OE2 3.1Å; K253-E289 PolarHBondContact NZ-OE2 3.22Å; L257-E289 HydrophobicContact CD1-CG 4.3Å; I287-E289 HydrophobicContact CB-CG 4.22Å; I287-E289 HydrophobicContact CG2-CG 3.78Å; I287-E289 PolarHBondContact O-N 2.97Å; E289-S292 PolarHBondContact O-N 3.3Å; E289-S293 WeakPolarHBondContact O-CA 3.33Å; E289-S293 WeakPolarHBondContact O-CB 3.43Å; E289-S293 PolarHBondContact O-N 3.3Å; E289-S293 PolarHBondContact O-OG 2.85Å
290	D	68	Low	70.1	Confident	104 Å²	104	73.9 Å²	73.9	56%	0.556	38%	0.377	S	S	*	.	H	α-helix	trans	-61.1	-50.3	176.7	-165.5	45.5	0	0	0	110.8	D288 S293 Y294 N416	D288-D290 PolarHBondContact O-N 2.94Å; D290-S293 PolarHBondContact O-N 3.42Å; D290-S293 PolarHBondContact O-OG 2.81Å; D290-Y294 PolarHBondContact O-N 3.09Å; D290-N416 PolarHBondContact OD2-ND2 2.9Å
291	D	76.3	Confident	72.4	Confident	16 Å²	16	69.5 Å²	69.5	9%	0.086	36%	0.36	C	S	.	.	H	α-helix	trans	-65.2	-44.3	178.2	-165.3	32.7	0	0	0	112.1	D288 S293 Y294 L411 N414 C424	D288-D291 HydrophobicContact CB-CB 4.13Å; D288-D291 PolarHBondContact O-N 2.92Å; D291-S293 VanDerWaalsContact C-N 3.27Å; D291-S293 PolarHBondContact O-N 2.89Å; D291-Y294 VanDerWaalsContact O-CB 3.32Å; D291-Y294 WeakPolarHBondContact O-CB 3.43Å; D291-Y294 PolarHBondContact O-N 3.31Å; D291-L411 WeakPolarHBondContact O-CD2 3.41Å; D291-N414 WeakPolarHBondContact CA-ND2 3.18Å; D291-N414 PolarHBondContact OD1-ND2 2.68Å; D291-C424 PolarHBondContact OD2-SG 2.91Å
292	S	81.9	Confident	74.7	Confident	7 Å²	7	67.5 Å²	67.5	5%	0.049	35%	0.349	C	S	.	.	H	α-helix	trans	-73.4	-16.2	-179.5	-54.8	0	0	0	0	113.5	L257 D288 E289 R299	L257-S292 CarbonylContact C-O 3.37Å; D288-S292 VanDerWaalsContact O-CB 3.3Å; D288-S292 WeakPolarHBondContact O-CB 3.31Å; D288-S292 PolarHBondContact O-N 3.49Å; D288-S292 PolarHBondContact O-OG 3.33Å; E289-S292 PolarHBondContact O-N 3.3Å; S292-R299 PolarHBondContact O-NH2 3.15Å
293	S	84.6	Confident	77.3	Confident	50 Å²	50	61.5 Å²	61.5	35%	0.35	32%	0.317	S	S	.	.	H	α-helix	trans	-89.9	-14.4	176.2	73.5	0	0	0	0	113.1	E289 D290 D291 A295 L296	E289-S293 WeakPolarHBondContact O-CA 3.33Å; E289-S293 WeakPolarHBondContact O-CB 3.43Å; E289-S293 PolarHBondContact O-N 3.3Å; E289-S293 PolarHBondContact O-OG 2.85Å; D290-S293 PolarHBondContact O-N 3.42Å; D290-S293 PolarHBondContact O-OG 2.81Å; D291-S293 VanDerWaalsContact C-N 3.27Å; D291-S293 PolarHBondContact O-N 2.89Å; S293-A295 PolarHBondContact O-N 2.93Å; S293-L296 WeakPolarHBondContact O-CB 3.43Å; S293-L296 PolarHBondContact O-N 2.89Å; S293-L296 VanDerWaalsContact O-N 3.16Å
294	Y	90.3	Very high	80	Confident	56 Å²	56	56.3 Å²	56.3	22%	0.22	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	128	179.9	173.7	-108.4	0	0	0	111.2	D290 D291 L296 R299 I410 T413 N414	D290-Y294 PolarHBondContact O-N 3.09Å; D291-Y294 VanDerWaalsContact O-CB 3.32Å; D291-Y294 WeakPolarHBondContact O-CB 3.43Å; D291-Y294 PolarHBondContact O-N 3.31Å; Y294-L296 PolarHBondContact O-N 3Å; Y294-R299 PolarHBondContact O-NE 3.48Å; Y294-R299 PolarHBondContact O-NH2 3.15Å; Y294-R299 VanDerWaalsContact O-NH2 3.13Å; Y294-I410 HydrophobicContact CE1-CG2 4.09Å; Y294-I410 WeakPolarHBondContact CE1-O 3.36Å; Y294-T413 WeakPolarHBondContact CE1-OG1 3.42Å; Y294-T413 PolarHBondContact OH-OG1 3.49Å; Y294-N414 HydrophobicContact CD1-CB 3.76Å; Y294-N414 HydrophobicContact CD2-CB 4.1Å; Y294-N414 HydrophobicContact CE1-CB 4.09Å; Y294-N414 HydrophobicContact CE2-CB 4.42Å; Y294-N414 HydrophobicContact CG-CB 3.75Å
295	A	93.6	Very high	82.5	Confident	19 Å²	19	48.6 Å²	48.6	16%	0.157	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	33.6	176.8	0	0	0	0	0	115.2	S293 K297 Q298 R299 Y322 I410	S293-A295 PolarHBondContact O-N 2.93Å; A295-K297 PolarHBondContact O-N 2.79Å; A295-Q298 HydrophobicContact CB-CB 4.4Å; A295-Q298 PolarHBondContact O-N 2.85Å; A295-Q298 VanDerWaalsContact O-N 3.13Å; A295-Q298 PolarHBondContact O-OE1 3.35Å; A295-R299 WeakPolarHBondContact O-CG 3.37Å; A295-R299 PolarHBondContact O-N 3.31Å; A295-Y322 VanDerWaalsContact CB-OH 3.23Å; A295-Y322 WeakPolarHBondContact CB-OH 3.44Å; A295-I410 HydrophobicContact CB-CG2 4.23Å
296	L	95.1	Very high	85	Confident	28 Å²	28	42.9 Å²	42.9	15%	0.147	23%	0.227	C	C	.	.	H	α-helix	trans	-52.8	-47.4	-171.8	-179.4	61.4	0	0	0	113.6	L257 E262 L265 S293 Y294 R299 K300	L257-L296 HydrophobicContact CD2-CD2 4.01Å; E262-L296 HydrophobicContact CB-CD1 4.33Å; E262-L296 HydrophobicContact CB-CD2 4.32Å; E262-L296 HydrophobicContact CB-CG 4.06Å; E262-L296 HydrophobicContact CG-CD2 3.97Å; E262-L296 HydrophobicContact CG-CG 4.04Å; L265-L296 HydrophobicContact CD2-CD2 4.08Å; S293-L296 WeakPolarHBondContact O-CB 3.43Å; S293-L296 PolarHBondContact O-N 2.89Å; S293-L296 VanDerWaalsContact O-N 3.16Å; Y294-L296 PolarHBondContact O-N 3Å; L296-R299 PolarHBondContact O-N 2.97Å; L296-K300 WeakPolarHBondContact O-CB 3.22Å; L296-K300 PolarHBondContact O-N 3.34Å
297	K	96.6	Very high	87.3	Confident	98 Å²	98	44.1 Å²	44.1	43%	0.426	22%	0.217	S	C	.	.	H	α-helix	trans	-62.2	-44.8	179.2	-177.5	66.5	67.5	-166.9	0	111.9	E262 A295 K300 N301	E262-K297 VanDerWaalsContact CD-CE 3.48Å; E262-K297 WeakPolarHBondContact OE1-CE 3.39Å; E262-K297 IonicContact OE1-NZ 2.72Å; E262-K297 PolarHBondContact OE1-NZ 3.17Å; E262-K297 VanDerWaalsContact OE2-CD 3.29Å; E262-K297 WeakPolarHBondContact OE2-CD 3.44Å; E262-K297 WeakPolarHBondContact OE2-CE 3.44Å; E262-K297 IonicContact OE2-NZ 2.68Å; E262-K297 PolarHBondContact OE2-NZ 3.01Å; A295-K297 PolarHBondContact O-N 2.79Å; K297-K300 PolarHBondContact O-N 3.03Å; K297-N301 VanDerWaalsContact O-CG 3.27Å; K297-N301 PolarHBondContact O-N 3.31Å; K297-N301 PolarHBondContact O-ND2 3.03Å
298	Q	97.3	Very high	89.5	Confident	79 Å²	79	46.1 Å²	46.1	37%	0.369	23%	0.228	S	C	.	.	H	α-helix	trans	-65.5	-44.4	178.3	-67.5	80.2	-0.9	0	0	111	A295 K300 N301 L302 L321 Y322	A295-Q298 HydrophobicContact CB-CB 4.4Å; A295-Q298 PolarHBondContact O-N 2.85Å; A295-Q298 VanDerWaalsContact O-N 3.13Å; A295-Q298 PolarHBondContact O-OE1 3.35Å; Q298-K300 PolarHBondContact O-N 2.86Å; Q298-N301 PolarHBondContact O-N 3.4Å; Q298-L302 WeakPolarHBondContact O-CB 3.18Å; Q298-L302 PolarHBondContact O-N 2.92Å; Q298-L321 HydrophobicContact CG-CD1 4.17Å; Q298-Y322 HydrophobicContact CB-CE2 4.48Å; Q298-Y322 WeakPolarHBondContact CB-OH 3.33Å
299	R	97.2	Very high	91.4	Very high	2 Å²	2	45 Å²	45	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-43.2	176	-72	-172.6	-60.6	112.4	-3.3	111.8	L257 H258 S292 Y294 A295 L296 N301 R303 N407 I410	L257-R299 PolarHBondContact O-NH1 3.34Å; L257-R299 PolarHBondContact O-NH2 3.33Å; L257-R299 VanDerWaalsContact O-NH2 3.12Å; H258-R299 PolarHBondContact O-NH1 3.14Å; S292-R299 PolarHBondContact O-NH2 3.15Å; Y294-R299 PolarHBondContact O-NE 3.48Å; Y294-R299 PolarHBondContact O-NH2 3.15Å; Y294-R299 VanDerWaalsContact O-NH2 3.13Å; A295-R299 WeakPolarHBondContact O-CG 3.37Å; A295-R299 PolarHBondContact O-N 3.31Å; L296-R299 PolarHBondContact O-N 2.97Å; R299-N301 PolarHBondContact O-N 3.5Å; R299-R303 WeakPolarHBondContact O-CB 3.36Å; R299-R303 PolarHBondContact O-N 3.35Å; R299-N407 WeakPolarHBondContact CD-OD1 3.14Å; R299-N407 PolarHBondContact NH1-OD1 3.23Å; R299-I410 HydrophobicContact CG-CB 3.97Å; R299-I410 HydrophobicContact CG-CD1 3.93Å; R299-I410 HydrophobicContact CG-CG2 3.6Å
300	K	97.7	Very high	93.2	Very high	38 Å²	38	45.8 Å²	45.8	17%	0.165	23%	0.23	C	C	.	.	H	α-helix	trans	-57.1	-48.4	173.5	178.5	-99.2	-179.2	176.3	0	111.8	G260 E262 E263 L296 K297 Q298 Q304	G260-K300 WeakPolarHBondContact O-CA 3.45Å; G260-K300 VanDerWaalsContact O-CB 3.31Å; G260-K300 WeakPolarHBondContact O-CB 3.21Å; E262-K300 HydrophobicContact CB-CB 4.03Å; E262-K300 HydrophobicContact CB-CG 3.98Å; E263-K300 WeakPolarHBondContact OE1-CE 3.44Å; E263-K300 IonicContact OE1-NZ 2.65Å; E263-K300 PolarHBondContact OE1-NZ 2.96Å; L296-K300 WeakPolarHBondContact O-CB 3.22Å; L296-K300 PolarHBondContact O-N 3.34Å; K297-K300 PolarHBondContact O-N 3.03Å; Q298-K300 PolarHBondContact O-N 2.86Å; K300-Q304 PolarHBondContact O-N 3.4Å
301	N	98.1	Very high	94.6	Very high	75 Å²	75	40.9 Å²	40.9	40%	0.401	20%	0.203	S	C	.	.	H	α-helix	trans	-64.9	-47.8	-178.9	-70.3	-14.9	0	0	0	111.8	K297 Q298 R299 R303 Q304 L305	K297-N301 VanDerWaalsContact O-CG 3.27Å; K297-N301 PolarHBondContact O-N 3.31Å; K297-N301 PolarHBondContact O-ND2 3.03Å; Q298-N301 PolarHBondContact O-N 3.4Å; R299-N301 PolarHBondContact O-N 3.5Å; N301-R303 PolarHBondContact O-N 3.43Å; N301-Q304 PolarHBondContact O-N 3.38Å; N301-L305 WeakPolarHBondContact O-CG 3.45Å; N301-L305 PolarHBondContact O-N 3.4Å
302	L	98.2	Very high	95.6	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-63	-41.6	178.3	-78.7	166.1	0	0	0	112.2	Q298 Q304 L305 V306 A314 E317 L318 Y322 V406 I410	Q298-L302 WeakPolarHBondContact O-CB 3.18Å; Q298-L302 PolarHBondContact O-N 2.92Å; L302-Q304 VanDerWaalsContact C-N 3.32Å; L302-Q304 PolarHBondContact O-N 3.45Å; L302-L305 HydrophobicContact CD2-CD1 4.41Å; L302-L305 PolarHBondContact O-N 3.25Å; L302-V306 WeakPolarHBondContact O-CG2 3.45Å; L302-V306 PolarHBondContact O-N 2.92Å; L302-A314 HydrophobicContact CD2-CB 4.44Å; L302-E317 HydrophobicContact CD2-CB 3.82Å; L302-L318 HydrophobicContact CD1-CD2 3.86Å; L302-L318 HydrophobicContact CD1-CG 4.32Å; L302-L318 HydrophobicContact CD2-CD2 4.44Å; L302-L318 HydrophobicContact CD2-CG 4Å; L302-Y322 HydrophobicContact CD1-CD2 4.32Å; L302-Y322 HydrophobicContact CD1-CE2 4.05Å; L302-V406 HydrophobicContact CB-CG1 4.42Å; L302-I410 HydrophobicContact CB-CD1 4.45Å; L302-I410 HydrophobicContact CD1-CD1 3.48Å; L302-I410 VanDerWaalsContact CD1-CD1 3.48Å
303	R	97.4	Very high	96.4	Very high	6 Å²	6	47 Å²	47	2%	0.023	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-44.6	172.5	172	173.4	-132.9	71.6	6.4	111.8	Y259 Y261 R299 N301 V306 R307 A403 D404	Y259-R303 WeakPolarHBondContact O-CD 3.11Å; Y259-R303 VanDerWaalsContact O-CZ 3.28Å; Y259-R303 PolarHBondContact O-NE 3.04Å; Y259-R303 VanDerWaalsContact O-NE 3.14Å; Y259-R303 PolarHBondContact O-NH1 2.7Å; Y261-R303 PolarHBondContact OH-NH2 3Å; R299-R303 WeakPolarHBondContact O-CB 3.36Å; R299-R303 PolarHBondContact O-N 3.35Å; N301-R303 PolarHBondContact O-N 3.43Å; R303-V306 PolarHBondContact O-N 3.22Å; R303-R307 HydrophobicContact CG-CG 4.48Å; R303-R307 WeakPolarHBondContact O-CB 3.3Å; R303-R307 VanDerWaalsContact O-CG 3.3Å; R303-R307 WeakPolarHBondContact O-CG 3.02Å; R303-R307 PolarHBondContact O-N 3.37Å; R303-A403 HydrophobicContact CB-CB 4.5Å; R303-A403 HydrophobicContact CG-CB 4.07Å; R303-A403 VanDerWaalsContact NH1-C 3.32Å; R303-A403 PolarHBondContact NH1-O 2.97Å; R303-D404 IonicContact CZ-OD1 3.72Å; R303-D404 IonicContact NH1-OD1 2.81Å; R303-D404 IonicContact NH2-OD1 2.78Å; R303-D404 PolarHBondContact NH2-OD1 3.23Å
304	Q	97.9	Very high	97.1	Very high	75 Å²	75	44.7 Å²	44.7	35%	0.35	22%	0.222	S	C	.	.	H	α-helix	trans	-64.2	-43.3	178.8	-169.8	64	40.6	0	0	111.8	K300 N301 L302 V306 R307 N308	K300-Q304 PolarHBondContact O-N 3.4Å; N301-Q304 PolarHBondContact O-N 3.38Å; L302-Q304 VanDerWaalsContact C-N 3.32Å; L302-Q304 PolarHBondContact O-N 3.45Å; Q304-V306 VanDerWaalsContact C-N 3.34Å; Q304-V306 PolarHBondContact O-N 3.32Å; Q304-R307 PolarHBondContact O-N 3.18Å; Q304-N308 PolarHBondContact NE2-OD1 2.74Å; Q304-N308 WeakPolarHBondContact O-CB 3.21Å; Q304-N308 PolarHBondContact O-N 3.07Å; Q304-N308 PolarHBondContact O-OD1 3.1Å
305	L	98.6	Very high	97.5	Very high	29 Å²	29	43.6 Å²	43.6	15%	0.152	22%	0.219	C	C	.	.	H	α-helix	trans	-57.6	-47.2	176.3	-69.2	170.8	0	0	0	111.3	N301 L302 N308 G309 E310 T313 A314	N301-L305 WeakPolarHBondContact O-CG 3.45Å; N301-L305 PolarHBondContact O-N 3.4Å; L302-L305 HydrophobicContact CD2-CD1 4.41Å; L302-L305 PolarHBondContact O-N 3.25Å; L305-N308 PolarHBondContact O-N 3.28Å; L305-G309 PolarHBondContact O-N 2.78Å; L305-E310 HydrophobicContact CB-CB 4.32Å; L305-E310 HydrophobicContact CD2-CB 3.96Å; L305-E310 PolarHBondContact O-N 2.86Å; L305-T313 HydrophobicContact CD1-CG2 3.95Å; L305-T313 HydrophobicContact CD2-CG2 3.86Å; L305-A314 HydrophobicContact CB-CB 4.02Å; L305-A314 HydrophobicContact CD1-CB 4.49Å
306	V	98.3	Very high	97.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.2	-44.5	177.8	176.4	0	0	0	0	111.8	L302 R303 Q304 N308 G309 I311 A314 L337 V402 A403 V406	L302-V306 WeakPolarHBondContact O-CG2 3.45Å; L302-V306 PolarHBondContact O-N 2.92Å; R303-V306 PolarHBondContact O-N 3.22Å; Q304-V306 VanDerWaalsContact C-N 3.34Å; Q304-V306 PolarHBondContact O-N 3.32Å; V306-N308 PolarHBondContact O-N 2.94Å; V306-G309 PolarHBondContact O-N 2.94Å; V306-I311 HydrophobicContact CB-CD1 4.44Å; V306-I311 HydrophobicContact CG1-CD1 4.19Å; V306-I311 HydrophobicContact CG2-CD1 4.45Å; V306-A314 HydrophobicContact CG2-CB 4.01Å; V306-L337 HydrophobicContact CG2-CD2 4.09Å; V306-V402 HydrophobicContact CG1-CB 3.87Å; V306-V402 HydrophobicContact CG1-CG1 3.72Å; V306-A403 HydrophobicContact CB-CB 4.06Å; V306-A403 HydrophobicContact CG1-CB 3.9Å; V306-V406 HydrophobicContact CG2-CG2 4.41Å
307	R	97.1	Very high	97.8	Very high	93 Å²	93	47.3 Å²	47.3	35%	0.351	24%	0.243	S	C	.	.	H	α-helix	trans	-63.6	-28.4	177.4	-71.4	-179.2	81.8	-155.4	9.6	113.2	R303 Q304 G309 R399 E400 A403	R303-R307 HydrophobicContact CG-CG 4.48Å; R303-R307 WeakPolarHBondContact O-CB 3.3Å; R303-R307 VanDerWaalsContact O-CG 3.3Å; R303-R307 WeakPolarHBondContact O-CG 3.02Å; R303-R307 PolarHBondContact O-N 3.37Å; Q304-R307 PolarHBondContact O-N 3.18Å; R307-G309 VanDerWaalsContact C-N 3.32Å; R307-R399 VanDerWaalsContact O-CD 3.28Å; R307-R399 WeakPolarHBondContact O-CD 3.33Å; R307-E400 IonicContact CZ-OE1 3.6Å; R307-E400 IonicContact NE-OE1 3.88Å; R307-E400 IonicContact NH2-OE1 2.65Å; R307-E400 PolarHBondContact NH2-OE1 3.42Å; R307-A403 HydrophobicContact CG-CB 4.23Å
308	N	97.2	Very high	97.9	Very high	86 Å²	86	42.7 Å²	42.7	46%	0.46	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-4.5	174.9	-69.8	-3.3	0	0	0	113.6	Q304 L305 V306 E310	Q304-N308 PolarHBondContact NE2-OD1 2.74Å; Q304-N308 WeakPolarHBondContact O-CB 3.21Å; Q304-N308 PolarHBondContact O-N 3.07Å; Q304-N308 PolarHBondContact O-OD1 3.1Å; L305-N308 PolarHBondContact O-N 3.28Å; V306-N308 PolarHBondContact O-N 2.94Å; N308-E310 VanDerWaalsContact C-N 3.28Å; N308-E310 HydrophobicContact CB-CG 3.98Å; N308-E310 WeakPolarHBondContact CB-OE1 3.5Å; N308-E310 PolarHBondContact ND2-OE1 3.25Å; N308-E310 PolarHBondContact O-N 3.14Å
309	G	97.1	Very high	97.9	Very high	14 Å²	14	44 Å²	44	14%	0.144	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	11	-173.2	0	0	0	0	0	114.4	L305 V306 R307 I311	L305-G309 PolarHBondContact O-N 2.78Å; V306-G309 PolarHBondContact O-N 2.94Å; R307-G309 VanDerWaalsContact C-N 3.32Å; G309-I311 PolarHBondContact O-N 3.29Å
310	E	98.2	Very high	97.9	Very high	83 Å²	83	50.8 Å²	50.8	39%	0.388	26%	0.259	S	S	.	.			trans	-81.5	57	179.9	-62.5	179	-117.3	0	0	111.6	L305 N308 D312 T313 A314	L305-E310 HydrophobicContact CB-CB 4.32Å; L305-E310 HydrophobicContact CD2-CB 3.96Å; L305-E310 PolarHBondContact O-N 2.86Å; N308-E310 VanDerWaalsContact C-N 3.28Å; N308-E310 HydrophobicContact CB-CG 3.98Å; N308-E310 WeakPolarHBondContact CB-OE1 3.5Å; N308-E310 PolarHBondContact ND2-OE1 3.25Å; N308-E310 PolarHBondContact O-N 3.14Å; E310-D312 PolarHBondContact O-N 3.26Å; E310-T313 PolarHBondContact O-N 2.84Å; E310-A314 PolarHBondContact O-N 2.99Å
311	I	98.1	Very high	97.9	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-68.8	-36	-167.9	-51.9	-55.3	0	0	0	113.2	V306 G309 T313 A314 L315 L337 Q340 K341 E344	V306-I311 HydrophobicContact CB-CD1 4.44Å; V306-I311 HydrophobicContact CG1-CD1 4.19Å; V306-I311 HydrophobicContact CG2-CD1 4.45Å; G309-I311 PolarHBondContact O-N 3.29Å; I311-T313 VanDerWaalsContact C-N 3.34Å; I311-T313 PolarHBondContact O-N 3.06Å; I311-A314 WeakPolarHBondContact O-CB 3.49Å; I311-A314 PolarHBondContact O-N 3.43Å; I311-L315 HydrophobicContact CG2-CD1 4.11Å; I311-L315 HydrophobicContact CG2-CG 4.38Å; I311-L315 WeakPolarHBondContact O-CG 3.11Å; I311-L315 PolarHBondContact O-N 2.73Å; I311-L337 HydrophobicContact CG2-CB 4.23Å; I311-L337 HydrophobicContact CG2-CD2 4.05Å; I311-L337 WeakPolarHBondContact CG2-O 3.42Å; I311-Q340 HydrophobicContact CD1-CB 4.05Å; I311-Q340 HydrophobicContact CD1-CG 3.62Å; I311-Q340 HydrophobicContact CG1-CB 4.21Å; I311-Q340 HydrophobicContact CG1-CG 3.99Å; I311-K341 HydrophobicContact CB-CB 3.96Å; I311-K341 HydrophobicContact CB-CD 4.24Å; I311-K341 HydrophobicContact CG1-CB 4.28Å; I311-K341 HydrophobicContact CG2-CB 3.83Å; I311-E344 HydrophobicContact CG1-CG 4.46Å
312	D	98	Very high	97.8	Very high	85 Å²	85	49.5 Å²	49.5	46%	0.455	25%	0.252	S	S	.	.	H	α-helix	trans	-63.5	-42.9	177.7	-59.4	-34.1	0	0	0	111	E310 A314 L315 A316 K341	E310-D312 PolarHBondContact O-N 3.26Å; D312-A314 VanDerWaalsContact C-N 3.34Å; D312-L315 PolarHBondContact O-N 3.18Å; D312-A316 WeakPolarHBondContact O-CB 3.29Å; D312-A316 PolarHBondContact O-N 2.87Å; D312-K341 WeakPolarHBondContact OD1-CE 3.37Å; D312-K341 IonicContact OD1-NZ 2.73Å; D312-K341 PolarHBondContact OD1-NZ 3.13Å; D312-K341 VanDerWaalsContact OD2-CE 3.29Å; D312-K341 WeakPolarHBondContact OD2-CE 3.37Å; D312-K341 IonicContact OD2-NZ 2.78Å; D312-K341 PolarHBondContact OD2-NZ 3.14Å
313	T	98.5	Very high	97.7	Very high	67 Å²	67	52 Å²	52	41%	0.411	27%	0.269	S	S	.	.	H	α-helix	trans	-63.4	-42	175	-48.7	0	0	0	0	110.7	L305 E310 I311 A316 E317	L305-T313 HydrophobicContact CD1-CG2 3.95Å; L305-T313 HydrophobicContact CD2-CG2 3.86Å; E310-T313 PolarHBondContact O-N 2.84Å; I311-T313 VanDerWaalsContact C-N 3.34Å; I311-T313 PolarHBondContact O-N 3.06Å; T313-A316 PolarHBondContact O-N 3.43Å; T313-E317 PolarHBondContact O-N 3.36Å
314	A	98.4	Very high	97.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.4	-44.3	177	0	0	0	0	0	112.2	L302 L305 V306 E310 I311 D312 E317 L318	L302-A314 HydrophobicContact CD2-CB 4.44Å; L305-A314 HydrophobicContact CB-CB 4.02Å; L305-A314 HydrophobicContact CD1-CB 4.49Å; V306-A314 HydrophobicContact CG2-CB 4.01Å; E310-A314 PolarHBondContact O-N 2.99Å; I311-A314 WeakPolarHBondContact O-CB 3.49Å; I311-A314 PolarHBondContact O-N 3.43Å; D312-A314 VanDerWaalsContact C-N 3.34Å; A314-E317 PolarHBondContact O-N 2.94Å; A314-L318 WeakPolarHBondContact O-CB 3.19Å; A314-L318 WeakPolarHBondContact O-CG 3.21Å; A314-L318 PolarHBondContact O-N 3.34Å
315	L	97.9	Very high	97.3	Very high	33 Å²	33	53.5 Å²	53.5	17%	0.173	28%	0.277	C	S	.	.	H	α-helix	trans	-62.4	-44.1	175.9	-79.3	166.4	0	0	0	111.9	I311 D312 L318 Q319 L337	I311-L315 HydrophobicContact CG2-CD1 4.11Å; I311-L315 HydrophobicContact CG2-CG 4.38Å; I311-L315 WeakPolarHBondContact O-CG 3.11Å; I311-L315 PolarHBondContact O-N 2.73Å; D312-L315 PolarHBondContact O-N 3.18Å; L315-L318 PolarHBondContact O-N 2.9Å; L315-Q319 WeakPolarHBondContact O-CB 3.44Å; L315-Q319 PolarHBondContact O-N 3.15Å; L315-L337 HydrophobicContact CD2-CB 4.17Å; L315-L337 HydrophobicContact CD2-CD1 3.71Å; L315-L337 HydrophobicContact CG-CD1 4.39Å
316	A	98.1	Very high	97.1	Very high	62 Å²	62	53 Å²	53	51%	0.512	27%	0.274	S	S	.	.	H	α-helix	trans	-62.6	-43.9	177.8	0	0	0	0	0	112.2	D312 T313 Q319 K320	D312-A316 WeakPolarHBondContact O-CB 3.29Å; D312-A316 PolarHBondContact O-N 2.87Å; T313-A316 PolarHBondContact O-N 3.43Å; A316-Q319 PolarHBondContact O-N 3.31Å; A316-K320 WeakPolarHBondContact O-CB 3.47Å; A316-K320 PolarHBondContact O-N 2.92Å; A316-K320 VanDerWaalsContact O-N 3.08Å
317	E	98.2	Very high	96.9	Very high	64 Å²	64	60.6 Å²	60.6	30%	0.299	31%	0.31	S	S	.	.	H	α-helix	trans	-67.8	-37.9	176	-77.5	-66.5	138.3	0	0	112.1	L302 T313 A314 K320 L321	L302-E317 HydrophobicContact CD2-CB 3.82Å; T313-E317 PolarHBondContact O-N 3.36Å; A314-E317 PolarHBondContact O-N 2.94Å; E317-K320 PolarHBondContact O-N 3.36Å; E317-K320 IonicContact OE1-NZ 3.48Å; E317-K320 PolarHBondContact OE1-NZ 3.47Å; E317-L321 WeakPolarHBondContact O-CB 3.5Å; E317-L321 WeakPolarHBondContact O-CG 3.5Å; E317-L321 PolarHBondContact O-N 3.26Å
318	L	97.9	Very high	96.6	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-46.9	172.7	-79.7	169.9	0	0	0	112	L302 A314 L315 K320 L321 Y322 I325 V326 L337 V406 I410	L302-L318 HydrophobicContact CD1-CD2 3.86Å; L302-L318 HydrophobicContact CD1-CG 4.32Å; L302-L318 HydrophobicContact CD2-CD2 4.44Å; L302-L318 HydrophobicContact CD2-CG 4Å; A314-L318 WeakPolarHBondContact O-CB 3.19Å; A314-L318 WeakPolarHBondContact O-CG 3.21Å; A314-L318 PolarHBondContact O-N 3.34Å; L315-L318 PolarHBondContact O-N 2.9Å; L318-K320 PolarHBondContact O-N 3.37Å; L318-L321 PolarHBondContact O-N 2.87Å; L318-Y322 HydrophobicContact CD2-CD2 4.17Å; L318-Y322 CarbonylContact O-C 3.56Å; L318-Y322 VanDerWaalsContact O-CA 3.32Å; L318-Y322 WeakPolarHBondContact O-CA 3.49Å; L318-Y322 PolarHBondContact O-N 3.4Å; L318-I325 HydrophobicContact CD2-CD1 4.37Å; L318-V326 HydrophobicContact CB-CG1 3.89Å; L318-V326 HydrophobicContact CD1-CG1 4.4Å; L318-L337 HydrophobicContact CD1-CD1 3.6Å; L318-V406 HydrophobicContact CD1-CG1 4.07Å; L318-V406 HydrophobicContact CD1-CG2 4.38Å; L318-V406 HydrophobicContact CD2-CG1 4.06Å; L318-I410 HydrophobicContact CD2-CD1 4.31Å; L318-I410 HydrophobicContact CD2-CG1 4.31Å
319	Q	97.4	Very high	96.3	Very high	107 Å²	107	59.6 Å²	59.6	50%	0.5	31%	0.312	S	S	.	.	H	α-helix	trans	-59.9	-34.7	177.7	-177.9	59.5	76.8	0	0	112.4	L315 A316 V326	L315-Q319 WeakPolarHBondContact O-CB 3.44Å; L315-Q319 PolarHBondContact O-N 3.15Å; A316-Q319 PolarHBondContact O-N 3.31Å; Q319-V326 HydrophobicContact CB-CG2 4.01Å; Q319-V326 HydrophobicContact CG-CG2 4.45Å; Q319-V326 VanDerWaalsContact OE1-CG2 3.26Å
320	K	97.8	Very high	96.1	Very high	145 Å²	145	63.5 Å²	63.5	63%	0.63	33%	0.325	S	S	*	.	H	α-helix	trans	-77	-45.6	179.4	177.8	-175.1	170.8	-167.5	0	113	A316 E317 L318	A316-K320 WeakPolarHBondContact O-CB 3.47Å; A316-K320 PolarHBondContact O-N 2.92Å; A316-K320 VanDerWaalsContact O-N 3.08Å; E317-K320 PolarHBondContact O-N 3.36Å; E317-K320 IonicContact OE1-NZ 3.48Å; E317-K320 PolarHBondContact OE1-NZ 3.47Å; L318-K320 PolarHBondContact O-N 3.37Å
321	L	97	Very high	95.8	Very high	70 Å²	70	60.2 Å²	60.2	37%	0.366	31%	0.311	S	S	.	.	H	α-helix	trans	-94.8	-32.8	-171	-61	178.4	0	0	0	113.3	Q298 E317 L318	Q298-L321 HydrophobicContact CG-CD1 4.17Å; E317-L321 WeakPolarHBondContact O-CB 3.5Å; E317-L321 WeakPolarHBondContact O-CG 3.5Å; E317-L321 PolarHBondContact O-N 3.26Å; L318-L321 PolarHBondContact O-N 2.87Å
322	Y	96.1	Very high	95.6	Very high	15 Å²	15	60.3 Å²	60.3	6%	0.059	31%	0.311	C	S	.	.			trans	-138.1	59.5	-175	-51.3	-77.6	0	0	0	110.9	A295 Q298 L302 L318 Q324 I325 I410	A295-Y322 VanDerWaalsContact CB-OH 3.23Å; A295-Y322 WeakPolarHBondContact CB-OH 3.44Å; Q298-Y322 HydrophobicContact CB-CE2 4.48Å; Q298-Y322 WeakPolarHBondContact CB-OH 3.33Å; L302-Y322 HydrophobicContact CD1-CD2 4.32Å; L302-Y322 HydrophobicContact CD1-CE2 4.05Å; L318-Y322 HydrophobicContact CD2-CD2 4.17Å; L318-Y322 CarbonylContact O-C 3.56Å; L318-Y322 VanDerWaalsContact O-CA 3.32Å; L318-Y322 WeakPolarHBondContact O-CA 3.49Å; L318-Y322 PolarHBondContact O-N 3.4Å; Y322-Q324 VanDerWaalsContact C-OE1 3.23Å; Y322-Q324 PolarHBondContact O-N 3.16Å; Y322-I325 HydrophobicContact CG-CD1 4.01Å; Y322-I325 WeakPolarHBondContact O-CB 3.14Å; Y322-I325 PolarHBondContact O-N 3.46Å; Y322-I410 HydrophobicContact CD1-CG2 4.41Å; Y322-I410 HydrophobicContact CD2-CD1 4.49Å; Y322-I410 HydrophobicContact CD2-CG1 4.07Å; Y322-I410 HydrophobicContact CE1-CG2 3.86Å; Y322-I410 HydrophobicContact CE2-CD1 4.26Å; Y322-I410 HydrophobicContact CE2-CG1 4.11Å; Y322-I410 HydrophobicContact CE2-CG2 4.07Å; Y322-I410 HydrophobicContact CG-CG1 4.45Å
323	P	96.3	Very high	95.5	Very high	57 Å²	57	56.4 Å²	56.4	37%	0.37	29%	0.291	S	S	.	.	H	α-helix	trans	-54.1	-31.5	-175.6	21.9	-34.2	0	0	0	113.3	I325 V326 Q327	P323-I325 PolarHBondContact O-N 3.2Å; P323-V326 WeakPolarHBondContact O-CG2 3.23Å; P323-V326 PolarHBondContact O-N 2.8Å; P323-Q327 WeakPolarHBondContact O-CB 3.47Å; P323-Q327 PolarHBondContact O-N 3.1Å
324	Q	94.1	Very high	95.4	Very high	96 Å²	96	53.4 Å²	53.4	45%	0.449	27%	0.272	S	S	.	.	H	α-helix	trans	-61.6	-24.3	176.8	68.1	-81.9	15.3	0	0	114.3	Y322 T413	Y322-Q324 VanDerWaalsContact C-OE1 3.23Å; Y322-Q324 PolarHBondContact O-N 3.16Å; Q324-T413 HydrophobicContact CG-CG2 3.91Å; Q324-T413 VanDerWaalsContact NE2-CG2 3.26Å
325	I	93.3	Very high	95.3	Very high	17 Å²	17	53.4 Å²	53.4	9%	0.087	27%	0.272	C	S	.	.	H	α-helix	trans	-76.3	-33.6	178.1	-63.8	177.2	0	0	0	110.8	L318 Y322 P323 V333 A409 I410 T413	L318-I325 HydrophobicContact CD2-CD1 4.37Å; Y322-I325 HydrophobicContact CG-CD1 4.01Å; Y322-I325 WeakPolarHBondContact O-CB 3.14Å; Y322-I325 PolarHBondContact O-N 3.46Å; P323-I325 PolarHBondContact O-N 3.2Å; I325-V333 HydrophobicContact CG2-CB 4.37Å; I325-V333 HydrophobicContact CG2-CG1 3.86Å; I325-A409 HydrophobicContact CD1-CB 4.07Å; I325-A409 WeakPolarHBondContact CD1-O 3.24Å; I325-A409 HydrophobicContact CG1-CB 4.39Å; I325-A409 HydrophobicContact CG2-CB 3.86Å; I325-I410 HydrophobicContact CD1-CB 4.35Å; I325-I410 HydrophobicContact CD1-CG1 3.74Å; I325-T413 HydrophobicContact CD1-CG2 3.94Å; I325-T413 HydrophobicContact CG1-CG2 3.87Å
326	V	93.9	Very high	95.2	Very high	17 Å²	17	51.8 Å²	51.8	10%	0.103	26%	0.264	C	S	.	.	H	α-helix	trans	-106.1	-0.5	-176	-62.9	0	0	0	0	113.4	L318 Q319 P323 D328	L318-V326 HydrophobicContact CB-CG1 3.89Å; L318-V326 HydrophobicContact CD1-CG1 4.4Å; Q319-V326 HydrophobicContact CB-CG2 4.01Å; Q319-V326 HydrophobicContact CG-CG2 4.45Å; Q319-V326 VanDerWaalsContact OE1-CG2 3.26Å; P323-V326 WeakPolarHBondContact O-CG2 3.23Å; P323-V326 PolarHBondContact O-N 2.8Å; V326-D328 VanDerWaalsContact C-N 3.31Å; V326-D328 PolarHBondContact O-N 2.93Å
327	Q	93.6	Very high	95.2	Very high	160 Å²	160	48.9 Å²	48.9	75%	0.748	24%	0.24	S	C	*	.	S	Bend	trans	-62.8	-38.9	-179.9	-179.6	178.3	9.3	0	0	112.1	P323	P323-Q327 WeakPolarHBondContact O-CB 3.47Å; P323-Q327 PolarHBondContact O-N 3.1Å
328	D	91.9	Very high	95.2	Very high	89 Å²	89	46.7 Å²	46.7	48%	0.476	23%	0.23	S	C	.	.	S	Bend	trans	-88.4	102.3	169.5	179.8	13.4	0	0	0	109	V326 K330 S331 C334	V326-D328 VanDerWaalsContact C-N 3.31Å; V326-D328 PolarHBondContact O-N 2.93Å; D328-K330 PolarHBondContact O-N 3.46Å; D328-K330 VanDerWaalsContact O-N 3.15Å; D328-K330 PolarHBondContact OD1-N 3.38Å; D328-S331 WeakPolarHBondContact O-CB 3.3Å; D328-S331 PolarHBondContact O-N 3.45Å; D328-S331 VanDerWaalsContact O-N 3.14Å; D328-S331 PolarHBondContact O-OG 3.41Å; D328-C334 PolarHBondContact O-SG 3.48Å
329	D	90.8	Very high	95.1	Very high	69 Å²	69	46.8 Å²	46.8	37%	0.369	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-9.5	179	73.6	-29.6	0	0	0	112.8	F363	D329-F363 WeakPolarHBondContact O-CZ 3.28Å
330	K	91.7	Very high	95.2	Very high	97 Å²	97	41.7 Å²	41.7	42%	0.422	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	6.7	176.4	-66.8	175.1	-178.9	-178.8	0	113.8	D328 L366	D328-K330 PolarHBondContact O-N 3.46Å; D328-K330 VanDerWaalsContact O-N 3.15Å; D328-K330 PolarHBondContact OD1-N 3.38Å; K330-L366 HydrophobicContact CB-CD1 4.15Å; K330-L366 HydrophobicContact CD-CD1 3.93Å; K330-L366 HydrophobicContact CG-CD1 4.03Å
331	S	93.3	Very high	95.1	Very high	14 Å²	14	36.3 Å²	36.3	10%	0.098	18%	0.183	C	C	.	.	S	Bend	trans	-64.7	158.6	175.4	68.8	0	0	0	0	112.2	D328 V333 C334 F335	D328-S331 WeakPolarHBondContact O-CB 3.3Å; D328-S331 PolarHBondContact O-N 3.45Å; D328-S331 VanDerWaalsContact O-N 3.14Å; D328-S331 PolarHBondContact O-OG 3.41Å; S331-V333 PolarHBondContact O-N 3.41Å; S331-C334 PolarHBondContact O-N 3.18Å; S331-C334 WeakPolarHBondContact OG-CB 3.48Å; S331-C334 PolarHBondContact OG-N 3.26Å; S331-C334 PolarHBondContact OG-SG 3.13Å; S331-F335 WeakPolarHBondContact O-CB 3.49Å; S331-F335 PolarHBondContact O-N 3Å
332	V	94	Very high	95.1	Very high	2 Å²	2	33 Å²	33	1%	0.012	17%	0.165	C	C	.	.	H	α-helix	trans	-61.8	-33.9	178.1	174.8	0	0	0	0	111.8	D24 N26 L27 L30 F335 L336 F369	D24-V332 HydrophobicContact CB-CG2 4.3Å; D24-V332 WeakPolarHBondContact OD2-CB 3.46Å; D24-V332 WeakPolarHBondContact OD2-CG2 2.95Å; D24-V332 PolarHBondContact OD2-N 3.05Å; D24-V332 VanDerWaalsContact OD2-N 3.17Å; N26-V332 HydrophobicContact CB-CB 3.79Å; N26-V332 HydrophobicContact CB-CG1 3.78Å; N26-V332 HydrophobicContact CB-CG2 4.42Å; N26-V332 WeakPolarHBondContact O-CG1 3.48Å; L27-V332 HydrophobicContact CD2-CG2 3.96Å; L27-V332 HydrophobicContact CG-CG2 4.35Å; L30-V332 HydrophobicContact CD1-CG1 4.44Å; L30-V332 HydrophobicContact CD1-CG2 4.29Å; L30-V332 HydrophobicContact CD2-CG1 3.97Å; L30-V332 HydrophobicContact CG-CG1 4.02Å; V332-F335 WeakPolarHBondContact O-CB 3.02Å; V332-F335 PolarHBondContact O-N 2.73Å; V332-L336 HydrophobicContact CG1-CD1 3.87Å; V332-L336 HydrophobicContact CG1-CG 4.21Å; V332-L336 WeakPolarHBondContact O-CB 3.33Å; V332-L336 WeakPolarHBondContact O-CG 3.2Å; V332-L336 PolarHBondContact O-N 3.1Å; V332-F369 HydrophobicContact CB-CE1 4.43Å; V332-F369 HydrophobicContact CG2-CE1 3.86Å; V332-F369 HydrophobicContact CG2-CZ 3.9Å
333	V	95.3	Very high	95.1	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.018	16%	0.164	C	C	.	.	H	α-helix	trans	-69.3	-46.1	179.6	176.9	0	0	0	0	110.8	I325 S331 F335 L336 L337 V406 A409	I325-V333 HydrophobicContact CG2-CB 4.37Å; I325-V333 HydrophobicContact CG2-CG1 3.86Å; S331-V333 PolarHBondContact O-N 3.41Å; V333-F335 VanDerWaalsContact C-N 3.33Å; V333-F335 PolarHBondContact O-N 2.66Å; V333-L336 PolarHBondContact O-N 3.32Å; V333-L337 HydrophobicContact CG1-CD1 4.05Å; V333-L337 WeakPolarHBondContact O-CG 2.98Å; V333-L337 PolarHBondContact O-N 3.4Å; V333-V406 HydrophobicContact CG1-CG2 4.14Å; V333-A409 HydrophobicContact CG1-CB 4.4Å; V333-A409 HydrophobicContact CG2-CB 3.63Å
334	C	95.8	Very high	95.1	Very high	4 Å²	4	32.3 Å²	32.3	3%	0.027	16%	0.158	C	C	.	.	H	α-helix	trans	-59.1	-46.3	173.2	-71.6	0	0	0	0	110.7	D328 S331 L336 L337 H338	D328-C334 PolarHBondContact O-SG 3.48Å; S331-C334 PolarHBondContact O-N 3.18Å; S331-C334 WeakPolarHBondContact OG-CB 3.48Å; S331-C334 PolarHBondContact OG-N 3.26Å; S331-C334 PolarHBondContact OG-SG 3.13Å; C334-L336 PolarHBondContact O-N 2.97Å; C334-L337 PolarHBondContact O-N 3.33Å; C334-H338 PolarHBondContact O-CD2 3.24Å; C334-H338 PolarHBondContact O-N 3.28Å
335	F	96.6	Very high	95.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-53.1	-53.6	175	176.2	-112.3	0	0	0	112.4	L30 S331 V332 V333 L337 H338 C339 F363 F369 I372 V373	L30-F335 HydrophobicContact CD2-CD1 3.67Å; L30-F335 HydrophobicContact CD2-CE1 3.69Å; S331-F335 WeakPolarHBondContact O-CB 3.49Å; S331-F335 PolarHBondContact O-N 3Å; V332-F335 WeakPolarHBondContact O-CB 3.02Å; V332-F335 PolarHBondContact O-N 2.73Å; V333-F335 VanDerWaalsContact C-N 3.33Å; V333-F335 PolarHBondContact O-N 2.66Å; F335-L337 VanDerWaalsContact C-N 3.33Å; F335-L337 PolarHBondContact O-N 2.95Å; F335-H338 PolarHBondContact O-N 2.9Å; F335-C339 WeakPolarHBondContact CE2-SG 3.46Å; F335-C339 WeakPolarHBondContact CZ-SG 3.22Å; F335-C339 WeakPolarHBondContact O-CB 3.28Å; F335-C339 PolarHBondContact O-N 3.21Å; F335-F363 VanDerWaalsContact CA-CZ 3.47Å; F335-F363 HydrophobicContact CB-CD1 3.84Å; F335-F363 HydrophobicContact CB-CE1 3.44Å; F335-F363 VanDerWaalsContact CB-CE1 3.44Å; F335-F363 HydrophobicContact CB-CZ 3.89Å; F335-F363 HydrophobicContact CD2-CB 3.88Å; F335-F363 AromaticContact CD2-CD1 3.47Å; F335-F363 HydrophobicContact CD2-CD1 3.47Å; F335-F363 VanDerWaalsContact CD2-CD1 3.47Å; F335-F363 AromaticContact CD2-CD2 3.82Å; F335-F363 HydrophobicContact CD2-CD2 3.82Å; F335-F363 AromaticContact CD2-CE1 3.88Å; F335-F363 HydrophobicContact CD2-CE1 3.88Å; F335-F363 HydrophobicContact CD2-CE2 4.2Å; F335-F363 AromaticContact CD2-CG 3.43Å; F335-F363 HydrophobicContact CD2-CG 3.43Å; F335-F363 VanDerWaalsContact CD2-CG 3.43Å; F335-F363 HydrophobicContact CD2-CZ 4.23Å; F335-F363 HydrophobicContact CE2-CB 4Å; F335-F363 HydrophobicContact CE2-CD1 4.4Å; F335-F363 HydrophobicContact CE2-CD2 4.47Å; F335-F363 HydrophobicContact CE2-CG 4.06Å; F335-F363 HydrophobicContact CG-CD1 4.02Å; F335-F363 HydrophobicContact CG-CE1 4.12Å; F335-F363 HydrophobicContact CG-CG 4.41Å; F335-F369 HydrophobicContact CB-CD1 4.17Å; F335-F369 HydrophobicContact CB-CE1 3.91Å; F335-F369 HydrophobicContact CB-CZ 4.47Å; F335-F369 AromaticContact CD1-CD1 3.37Å; F335-F369 HydrophobicContact CD1-CD1 3.37Å; F335-F369 AromaticContact CD1-CE1 3.71Å; F335-F369 HydrophobicContact CD1-CE1 3.71Å; F335-F369 HydrophobicContact CD1-CG 4.36Å; F335-F369 HydrophobicContact CD2-CB 4.32Å; F335-F369 AromaticContact CD2-CD1 3.97Å; F335-F369 HydrophobicContact CD2-CD1 3.97Å; F335-F369 HydrophobicContact CD2-CG 4.23Å; F335-F369 HydrophobicContact CE1-CB 4.41Å; F335-F369 AromaticContact CE1-CD1 3.61Å; F335-F369 HydrophobicContact CE1-CD1 3.61Å; F335-F369 HydrophobicContact CE1-CE1 4.37Å; F335-F369 HydrophobicContact CE1-CG 4.42Å; F335-F369 HydrophobicContact CE2-CB 3.93Å; F335-F369 HydrophobicContact CE2-CD1 4.18Å; F335-F369 HydrophobicContact CE2-CG 4.3Å; F335-F369 AromaticContact CG-CD1 3.54Å; F335-F369 HydrophobicContact CG-CD1 3.54Å; F335-F369 AromaticContact CG-CE1 3.77Å; F335-F369 HydrophobicContact CG-CE1 3.77Å; F335-F369 HydrophobicContact CG-CG 4.23Å; F335-F369 HydrophobicContact CZ-CB 3.95Å; F335-F369 AromaticContact CZ-CD1 3.99Å; F335-F369 HydrophobicContact CZ-CD1 3.99Å; F335-F369 HydrophobicContact CZ-CG 4.37Å; F335-I372 HydrophobicContact CE1-CB 4.1Å; F335-I372 HydrophobicContact CE1-CD1 4.27Å; F335-I372 HydrophobicContact CE1-CG2 3.74Å; F335-I372 HydrophobicContact CZ-CB 3.84Å; F335-I372 HydrophobicContact CZ-CG2 3.6Å; F335-V373 HydrophobicContact CE2-CG2 3.47Å; F335-V373 VanDerWaalsContact CE2-CG2 3.47Å; F335-V373 HydrophobicContact CZ-CG2 3.92Å
336	L	97	Very high	95.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.8	-39.1	-178.5	-73.4	173.1	0	0	0	112.5	F29 L30 I33 V332 V333 C334 Q340 L401 V402 A405	F29-L336 HydrophobicContact CB-CD1 3.79Å; F29-L336 HydrophobicContact CG-CD1 4.45Å; L30-L336 HydrophobicContact CD2-CD2 4.11Å; L30-L336 HydrophobicContact CD2-CG 4.47Å; I33-L336 HydrophobicContact CD1-CD2 3.42Å; I33-L336 VanDerWaalsContact CD1-CD2 3.42Å; V332-L336 HydrophobicContact CG1-CD1 3.87Å; V332-L336 HydrophobicContact CG1-CG 4.21Å; V332-L336 WeakPolarHBondContact O-CB 3.33Å; V332-L336 WeakPolarHBondContact O-CG 3.2Å; V332-L336 PolarHBondContact O-N 3.1Å; V333-L336 PolarHBondContact O-N 3.32Å; C334-L336 PolarHBondContact O-N 2.97Å; L336-Q340 WeakPolarHBondContact O-CB 3.23Å; L336-Q340 PolarHBondContact O-N 3.36Å; L336-L401 HydrophobicContact CD1-CD2 4.39Å; L336-L401 HydrophobicContact CD2-CD2 4.11Å; L336-V402 HydrophobicContact CB-CG1 4.27Å; L336-V402 HydrophobicContact CB-CG2 4.28Å; L336-A405 HydrophobicContact CD1-CB 3.46Å; L336-A405 VanDerWaalsContact CD1-CB 3.46Å
337	L	98	Very high	94.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.3	-45	174.9	-73.4	166	0	0	0	111.5	V306 I311 L315 L318 V333 C334 F335 Q340 K341 V402 V406	V306-L337 HydrophobicContact CG2-CD2 4.09Å; I311-L337 HydrophobicContact CG2-CB 4.23Å; I311-L337 HydrophobicContact CG2-CD2 4.05Å; I311-L337 WeakPolarHBondContact CG2-O 3.42Å; L315-L337 HydrophobicContact CD2-CB 4.17Å; L315-L337 HydrophobicContact CD2-CD1 3.71Å; L315-L337 HydrophobicContact CG-CD1 4.39Å; L318-L337 HydrophobicContact CD1-CD1 3.6Å; V333-L337 HydrophobicContact CG1-CD1 4.05Å; V333-L337 WeakPolarHBondContact O-CG 2.98Å; V333-L337 PolarHBondContact O-N 3.4Å; C334-L337 PolarHBondContact O-N 3.33Å; F335-L337 VanDerWaalsContact C-N 3.33Å; F335-L337 PolarHBondContact O-N 2.95Å; L337-Q340 PolarHBondContact O-N 2.81Å; L337-K341 WeakPolarHBondContact O-CB 3.36Å; L337-K341 PolarHBondContact O-N 2.93Å; L337-V402 HydrophobicContact CD2-CG1 3.97Å; L337-V402 HydrophobicContact CG-CG1 4.38Å; L337-V406 HydrophobicContact CD1-CG2 4.1Å; L337-V406 HydrophobicContact CD2-CG2 3.91Å; L337-V406 HydrophobicContact CG-CG2 4.14Å
338	H	97.4	Very high	94.7	Very high	19 Å²	19	28.9 Å²	28.9	9%	0.088	16%	0.162	C	C	.	.	H	α-helix	trans	-65.8	-39.2	177.1	-70.2	-63	0	0	0	112.1	C334 F335 K341 F342 Y355 E359 L360 F363	C334-H338 PolarHBondContact O-CD2 3.24Å; C334-H338 PolarHBondContact O-N 3.28Å; F335-H338 PolarHBondContact O-N 2.9Å; H338-K341 PolarHBondContact O-N 3.5Å; H338-F342 WeakPolarHBondContact O-CB 3.23Å; H338-F342 PolarHBondContact O-N 3.35Å; H338-Y355 HydrophobicContact CB-CE1 4.47Å; H338-Y355 AromaticContact ND1-CZ 3.72Å; H338-Y355 PolarHBondContact ND1-OH 3.45Å; H338-Y355 WeakPolarHBondContact O-CE1 3.4Å; H338-E359 HydrophobicContact CB-CB 4.45Å; H338-E359 IonicContact CE1-OE2 2.66Å; H338-E359 PolarHBondContact CE1-OE2 2.76Å; H338-E359 VanDerWaalsContact CE1-OE2 3.22Å; H338-E359 IonicContact ND1-OE2 3.8Å; H338-E359 IonicContact NE2-OE2 3.33Å; H338-L360 HydrophobicContact CB-CD2 4.16Å; H338-F363 HydrophobicContact CB-CE2 4.37Å; H338-F363 AromaticContact CD2-CE2 3.99Å
339	C	96.8	Very high	94.6	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.007	17%	0.166	C	C	.	.	H	α-helix	trans	-58	-50.1	169.8	-79.3	0	0	0	0	111.2	F335 K341 F342 I343 L360	F335-C339 WeakPolarHBondContact CE2-SG 3.46Å; F335-C339 WeakPolarHBondContact CZ-SG 3.22Å; F335-C339 WeakPolarHBondContact O-CB 3.28Å; F335-C339 PolarHBondContact O-N 3.21Å; C339-K341 VanDerWaalsContact C-N 3.35Å; C339-K341 PolarHBondContact O-N 2.92Å; C339-F342 WeakPolarHBondContact O-CB 3.05Å; C339-F342 PolarHBondContact O-N 3.37Å; C339-I343 WeakPolarHBondContact O-CD1 3.49Å; C339-I343 VanDerWaalsContact O-CG1 3.26Å; C339-I343 WeakPolarHBondContact O-CG1 3.41Å; C339-I343 PolarHBondContact O-N 2.93Å; C339-L360 HydrophobicContact CB-CD2 4.46Å
340	Q	97.7	Very high	94.7	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-60.5	-45.4	179.9	-167.2	58.3	49	0	0	111.6	I311 L336 L337 F342 I343 E344 V402	I311-Q340 HydrophobicContact CD1-CB 4.05Å; I311-Q340 HydrophobicContact CD1-CG 3.62Å; I311-Q340 HydrophobicContact CG1-CB 4.21Å; I311-Q340 HydrophobicContact CG1-CG 3.99Å; L336-Q340 WeakPolarHBondContact O-CB 3.23Å; L336-Q340 PolarHBondContact O-N 3.36Å; L337-Q340 PolarHBondContact O-N 2.81Å; Q340-F342 VanDerWaalsContact C-N 3.31Å; Q340-F342 PolarHBondContact O-N 3.11Å; Q340-I343 WeakPolarHBondContact O-CB 3.48Å; Q340-I343 PolarHBondContact O-N 3.36Å; Q340-I343 VanDerWaalsContact O-N 3.11Å; Q340-E344 PolarHBondContact NE2-OE1 3.39Å; Q340-E344 WeakPolarHBondContact O-CG 3.41Å; Q340-E344 PolarHBondContact O-N 2.93Å; Q340-V402 HydrophobicContact CB-CG1 4.26Å; Q340-V402 HydrophobicContact CB-CG2 4.12Å; Q340-V402 HydrophobicContact CG-CG2 4.45Å
341	K	97.5	Very high	94.8	Very high	31 Å²	31	34 Å²	34	14%	0.135	19%	0.185	C	C	.	.	H	α-helix	trans	-60.1	-42.8	177.4	177.7	54.4	171.6	-173.9	0	111.7	I311 D312 L337 H338 C339 I343 E344 L345 Y355	I311-K341 HydrophobicContact CB-CB 3.96Å; I311-K341 HydrophobicContact CB-CD 4.24Å; I311-K341 HydrophobicContact CG1-CB 4.28Å; I311-K341 HydrophobicContact CG2-CB 3.83Å; D312-K341 WeakPolarHBondContact OD1-CE 3.37Å; D312-K341 IonicContact OD1-NZ 2.73Å; D312-K341 PolarHBondContact OD1-NZ 3.13Å; D312-K341 VanDerWaalsContact OD2-CE 3.29Å; D312-K341 WeakPolarHBondContact OD2-CE 3.37Å; D312-K341 IonicContact OD2-NZ 2.78Å; D312-K341 PolarHBondContact OD2-NZ 3.14Å; L337-K341 WeakPolarHBondContact O-CB 3.36Å; L337-K341 PolarHBondContact O-N 2.93Å; H338-K341 PolarHBondContact O-N 3.5Å; C339-K341 VanDerWaalsContact C-N 3.35Å; C339-K341 PolarHBondContact O-N 2.92Å; K341-I343 VanDerWaalsContact C-N 3.32Å; K341-I343 PolarHBondContact O-N 3.42Å; K341-E344 PolarHBondContact O-N 2.93Å; K341-L345 HydrophobicContact CD-CD1 4.38Å; K341-L345 HydrophobicContact CD-CG 4.43Å; K341-L345 HydrophobicContact CG-CD1 4.4Å; K341-L345 WeakPolarHBondContact O-CG 3.28Å; K341-L345 PolarHBondContact O-N 3.34Å; K341-Y355 HydrophobicContact CB-CE1 3.81Å; K341-Y355 HydrophobicContact CB-CE2 4.47Å; K341-Y355 WeakPolarHBondContact CB-OH 3.39Å; K341-Y355 HydrophobicContact CG-CD1 4.27Å; K341-Y355 HydrophobicContact CG-CD2 4.22Å; K341-Y355 HydrophobicContact CG-CE1 3.64Å; K341-Y355 HydrophobicContact CG-CE2 3.58Å; K341-Y355 VanDerWaalsContact CG-OH 3.28Å; K341-Y355 WeakPolarHBondContact CG-OH 3.06Å
342	F	97	Very high	94.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-42.8	175	177.8	-86.2	0	0	0	111.6	H338 C339 Q340 E344 L345 V346 G352 Y355 L360 C376 F377 L380	H338-F342 WeakPolarHBondContact O-CB 3.23Å; H338-F342 PolarHBondContact O-N 3.35Å; C339-F342 WeakPolarHBondContact O-CB 3.05Å; C339-F342 PolarHBondContact O-N 3.37Å; Q340-F342 VanDerWaalsContact C-N 3.31Å; Q340-F342 PolarHBondContact O-N 3.11Å; F342-E344 VanDerWaalsContact C-N 3.34Å; F342-E344 PolarHBondContact O-N 2.78Å; F342-L345 CarbonylContact O-C 3.57Å; F342-L345 WeakPolarHBondContact O-CA 3.41Å; F342-L345 WeakPolarHBondContact O-CB 3.28Å; F342-L345 PolarHBondContact O-N 3.31Å; F342-V346 HydrophobicContact CE1-CG2 4.29Å; F342-V346 PolarHBondContact O-N 3.48Å; F342-G352 WeakPolarHBondContact CD2-O 3.28Å; F342-G352 VanDerWaalsContact CE2-O 3.24Å; F342-G352 WeakPolarHBondContact CE2-O 3.33Å; F342-Y355 HydrophobicContact CB-CD1 4.09Å; F342-Y355 HydrophobicContact CB-CE1 4.32Å; F342-Y355 HydrophobicContact CD2-CD1 4.48Å; F342-L360 HydrophobicContact CB-CD1 3.47Å; F342-L360 VanDerWaalsContact CB-CD1 3.47Å; F342-L360 HydrophobicContact CB-CG 4.26Å; F342-L360 HydrophobicContact CD1-CD1 3.91Å; F342-L360 HydrophobicContact CD2-CD1 3.53Å; F342-L360 HydrophobicContact CE2-CD1 4.19Å; F342-L360 HydrophobicContact CG-CD1 3.34Å; F342-L360 HydrophobicContact CG-CG 4.5Å; F342-C376 HydrophobicContact CD1-CB 4.07Å; F342-C376 HydrophobicContact CE1-CB 4.17Å; F342-C376 WeakPolarHBondContact CE1-O 3.37Å; F342-F377 AromaticContact CE2-CD1 3.96Å; F342-F377 HydrophobicContact CE2-CD1 3.96Å; F342-F377 AromaticContact CE2-CE1 3.92Å; F342-F377 HydrophobicContact CE2-CE1 3.92Å; F342-F377 AromaticContact CZ-CD1 3.74Å; F342-F377 HydrophobicContact CZ-CD1 3.74Å; F342-F377 HydrophobicContact CZ-CE1 4.19Å; F342-L380 HydrophobicContact CE1-CD1 4.47Å; F342-L380 HydrophobicContact CE1-CG 4.27Å; F342-L380 HydrophobicContact CE2-CD1 3.86Å; F342-L380 HydrophobicContact CE2-CG 4.5Å; F342-L380 HydrophobicContact CZ-CD1 3.43Å; F342-L380 VanDerWaalsContact CZ-CD1 3.43Å; F342-L380 HydrophobicContact CZ-CD2 4.39Å; F342-L380 HydrophobicContact CZ-CG 3.66Å
343	I	96	Very high	94.9	Very high	6 Å²	6	35.2 Å²	35.2	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-43.6	176.4	-68.2	159.9	0	0	0	111	C339 Q340 K341 L345 V346 L379 F393 L394 Q398	C339-I343 WeakPolarHBondContact O-CD1 3.49Å; C339-I343 VanDerWaalsContact O-CG1 3.26Å; C339-I343 WeakPolarHBondContact O-CG1 3.41Å; C339-I343 PolarHBondContact O-N 2.93Å; Q340-I343 WeakPolarHBondContact O-CB 3.48Å; Q340-I343 PolarHBondContact O-N 3.36Å; Q340-I343 VanDerWaalsContact O-N 3.11Å; K341-I343 VanDerWaalsContact C-N 3.32Å; K341-I343 PolarHBondContact O-N 3.42Å; I343-L345 PolarHBondContact O-N 2.75Å; I343-L345 VanDerWaalsContact O-N 3.16Å; I343-V346 WeakPolarHBondContact O-CB 3.39Å; I343-V346 WeakPolarHBondContact O-CG2 3.4Å; I343-V346 PolarHBondContact O-N 3.41Å; I343-V346 VanDerWaalsContact O-N 3.17Å; I343-L379 HydrophobicContact CG1-CD1 4.07Å; I343-F393 HydrophobicContact CD1-CB 3.85Å; I343-F393 HydrophobicContact CD1-CD1 3.58Å; I343-F393 HydrophobicContact CD1-CE1 4.46Å; I343-F393 HydrophobicContact CD1-CG 3.96Å; I343-F393 HydrophobicContact CG1-CB 4.29Å; I343-L394 HydrophobicContact CG2-CD2 3.99Å; I343-Q398 HydrophobicContact CD1-CG 4.29Å
344	E	95.7	Very high	94.9	Very high	53 Å²	53	39.1 Å²	39.1	25%	0.248	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-19.7	174.9	-57.3	-48.8	155.5	0	0	113.3	I311 Q340 K341 F342 R399	I311-E344 HydrophobicContact CG1-CG 4.46Å; Q340-E344 PolarHBondContact NE2-OE1 3.39Å; Q340-E344 WeakPolarHBondContact O-CG 3.41Å; Q340-E344 PolarHBondContact O-N 2.93Å; K341-E344 PolarHBondContact O-N 2.93Å; F342-E344 VanDerWaalsContact C-N 3.34Å; F342-E344 PolarHBondContact O-N 2.78Å; E344-R399 IonicContact OE1-CZ 3.68Å; E344-R399 IonicContact OE1-NE 3.39Å; E344-R399 PolarHBondContact OE1-NE 3.46Å; E344-R399 IonicContact OE1-NH2 3.02Å; E344-R399 PolarHBondContact OE1-NH2 3.02Å; E344-R399 VanDerWaalsContact OE1-NH2 3.16Å; E344-R399 IonicContact OE2-CZ 3.66Å; E344-R399 IonicContact OE2-NE 3.72Å; E344-R399 IonicContact OE2-NH2 3.49Å; E344-R399 PolarHBondContact OE2-NH2 2.84Å
345	L	95.7	Very high	95	Very high	8 Å²	8	40.6 Å²	40.6	4%	0.042	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-0.2	179.2	-66.5	175.9	0	0	0	113.8	K341 F342 I343 G347 K348 E351 Y355	K341-L345 HydrophobicContact CD-CD1 4.38Å; K341-L345 HydrophobicContact CD-CG 4.43Å; K341-L345 HydrophobicContact CG-CD1 4.4Å; K341-L345 WeakPolarHBondContact O-CG 3.28Å; K341-L345 PolarHBondContact O-N 3.34Å; F342-L345 CarbonylContact O-C 3.57Å; F342-L345 WeakPolarHBondContact O-CA 3.41Å; F342-L345 WeakPolarHBondContact O-CB 3.28Å; F342-L345 PolarHBondContact O-N 3.31Å; I343-L345 PolarHBondContact O-N 2.75Å; I343-L345 VanDerWaalsContact O-N 3.16Å; L345-G347 PolarHBondContact O-N 2.85Å; L345-K348 HydrophobicContact CD2-CD 4.15Å; L345-K348 CarbonylContact O-C 3.6Å; L345-K348 WeakPolarHBondContact O-CA 3.17Å; L345-K348 PolarHBondContact O-N 3.1Å; L345-E351 HydrophobicContact CD2-CB 4.13Å; L345-Y355 HydrophobicContact CD1-CD1 4.28Å; L345-Y355 HydrophobicContact CD1-CD2 4.21Å; L345-Y355 HydrophobicContact CD1-CG 3.79Å
346	V	90.7	Very high	94.9	Very high	18 Å²	18	40.6 Å²	40.6	11%	0.109	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.8	-178.5	170.6	0	0	0	0	112	F342 I343 K348 L379 L380 P385	F342-V346 HydrophobicContact CE1-CG2 4.29Å; F342-V346 PolarHBondContact O-N 3.48Å; I343-V346 WeakPolarHBondContact O-CB 3.39Å; I343-V346 WeakPolarHBondContact O-CG2 3.4Å; I343-V346 PolarHBondContact O-N 3.41Å; I343-V346 VanDerWaalsContact O-N 3.17Å; V346-K348 PolarHBondContact O-N 3.45Å; V346-L379 HydrophobicContact CG1-CB 4.14Å; V346-L379 HydrophobicContact CG2-CB 3.86Å; V346-L379 HydrophobicContact CG2-CD1 4.1Å; V346-L380 HydrophobicContact CB-CD2 4.43Å; V346-L380 HydrophobicContact CG1-CD2 4.35Å; V346-L380 HydrophobicContact CG2-CD2 4.37Å; V346-P385 HydrophobicContact CG1-CB 3.89Å; V346-P385 HydrophobicContact CG1-CG 3.39Å
347	G	87.8	Confident	94.8	Very high	81 Å²	81	49.4 Å²	49.4	84%	0.835	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-4.9	173.8	0	0	0	0	0	115.1	L345	L345-G347 PolarHBondContact O-N 2.85Å
348	K	92.3	Very high	94.7	Very high	110 Å²	110	54.8 Å²	54.8	48%	0.478	28%	0.279	S	S	.	.	S	Bend	trans	-126.6	74	-176.7	-60.1	-176.3	179.8	-174.4	0	110	L345 V346 E350 E351 G352	L345-K348 HydrophobicContact CD2-CD 4.15Å; L345-K348 CarbonylContact O-C 3.6Å; L345-K348 WeakPolarHBondContact O-CA 3.17Å; L345-K348 PolarHBondContact O-N 3.1Å; V346-K348 PolarHBondContact O-N 3.45Å; K348-E350 PolarHBondContact O-N 3.01Å; K348-E350 VanDerWaalsContact O-N 3.14Å; K348-E351 HydrophobicContact CB-CB 4.12Å; K348-E351 WeakPolarHBondContact CD-OE1 3.46Å; K348-E351 IonicContact NZ-OE1 3.84Å; K348-E351 IonicContact NZ-OE2 2.86Å; K348-E351 PolarHBondContact O-N 2.87Å; K348-G352 PolarHBondContact O-N 2.86Å
349	L	88.6	Confident	94.6	Very high	109 Å²	109	55.5 Å²	55.5	57%	0.571	28%	0.283	S	S	*	.	H	α-helix	trans	-46.3	-50.1	-166.9	-176.1	62.6	0	0	0	114.8	G352 V353 L380	L349-G352 PolarHBondContact O-N 3.08Å; L349-V353 HydrophobicContact CD1-CG2 4.1Å; L349-V353 WeakPolarHBondContact O-CB 3.45Å; L349-V353 VanDerWaalsContact O-CG2 3.24Å; L349-V353 WeakPolarHBondContact O-CG2 3.46Å; L349-V353 PolarHBondContact O-N 3Å; L349-L380 HydrophobicContact CD1-CB 4.42Å; L349-L380 HydrophobicContact CD1-CD2 4.1Å
350	E	93.6	Very high	94.4	Very high	154 Å²	154	55.5 Å²	55.5	72%	0.72	28%	0.283	S	S	*	.	H	α-helix	trans	-64.5	-46.2	-178.6	-175.1	176.7	-177.8	0	0	112.4	K348 N354	K348-E350 PolarHBondContact O-N 3.01Å; K348-E350 VanDerWaalsContact O-N 3.14Å; E350-N354 WeakPolarHBondContact O-CB 3.33Å; E350-N354 VanDerWaalsContact O-CG 3.29Å; E350-N354 PolarHBondContact O-N 2.82Å; E350-N354 PolarHBondContact O-ND2 2.93Å
351	E	94.7	Very high	94.2	Very high	101 Å²	101	57.5 Å²	57.5	47%	0.472	30%	0.3	S	S	.	.	H	α-helix	trans	-62.8	-45.2	176.6	-68.2	177.7	-130.2	0	0	110.9	L345 K348 N354 Y355	L345-E351 HydrophobicContact CD2-CB 4.13Å; K348-E351 HydrophobicContact CB-CB 4.12Å; K348-E351 WeakPolarHBondContact CD-OE1 3.46Å; K348-E351 IonicContact NZ-OE1 3.84Å; K348-E351 IonicContact NZ-OE2 2.86Å; K348-E351 PolarHBondContact O-N 2.87Å; E351-N354 PolarHBondContact O-N 3.06Å; E351-Y355 VanDerWaalsContact O-CB 3.24Å; E351-Y355 WeakPolarHBondContact O-CB 3.45Å; E351-Y355 PolarHBondContact O-N 3.28Å
352	G	93.9	Very high	94	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-45.7	178.5	0	0	0	0	0	112.8	F342 K348 L349 Y355 G356	F342-G352 WeakPolarHBondContact CD2-O 3.28Å; F342-G352 VanDerWaalsContact CE2-O 3.24Å; F342-G352 WeakPolarHBondContact CE2-O 3.33Å; K348-G352 PolarHBondContact O-N 2.86Å; L349-G352 PolarHBondContact O-N 3.08Å; G352-Y355 PolarHBondContact O-N 3.27Å; G352-G356 PolarHBondContact O-N 3.35Å
353	V	94.5	Very high	93.9	Very high	41 Å²	41	59.4 Å²	59.4	25%	0.248	31%	0.308	C	S	.	.	H	α-helix	trans	-62.9	-46.1	176.9	169.7	0	0	0	0	111.3	L349 G356 R357 L380	L349-V353 HydrophobicContact CD1-CG2 4.1Å; L349-V353 WeakPolarHBondContact O-CB 3.45Å; L349-V353 VanDerWaalsContact O-CG2 3.24Å; L349-V353 WeakPolarHBondContact O-CG2 3.46Å; L349-V353 PolarHBondContact O-N 3Å; V353-G356 PolarHBondContact O-N 3.16Å; V353-R357 WeakPolarHBondContact O-CB 3.37Å; V353-R357 VanDerWaalsContact O-CG 3.31Å; V353-R357 WeakPolarHBondContact O-CG 3.37Å; V353-R357 PolarHBondContact O-N 3.43Å; V353-L380 HydrophobicContact CG2-CD1 3.81Å
354	N	96.3	Very high	93.7	Very high	84 Å²	84	62.6 Å²	62.6	45%	0.449	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-44.7	179.6	-73.9	-26.8	0	0	0	111.4	E350 E351 R357 L358	E350-N354 WeakPolarHBondContact O-CB 3.33Å; E350-N354 VanDerWaalsContact O-CG 3.29Å; E350-N354 PolarHBondContact O-N 2.82Å; E350-N354 PolarHBondContact O-ND2 2.93Å; E351-N354 PolarHBondContact O-N 3.06Å; N354-R357 PolarHBondContact O-N 2.98Å; N354-L358 PolarHBondContact O-N 2.93Å; N354-L358 VanDerWaalsContact O-N 3.13Å
355	Y	96.4	Very high	93.3	Very high	36 Å²	36	63.1 Å²	63.1	14%	0.141	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-46	177.6	-171.9	-90.9	0	0	0	111.8	H338 K341 F342 L345 E351 G352 R357 L358 E359	H338-Y355 HydrophobicContact CB-CE1 4.47Å; H338-Y355 AromaticContact ND1-CZ 3.72Å; H338-Y355 PolarHBondContact ND1-OH 3.45Å; H338-Y355 WeakPolarHBondContact O-CE1 3.4Å; K341-Y355 HydrophobicContact CB-CE1 3.81Å; K341-Y355 HydrophobicContact CB-CE2 4.47Å; K341-Y355 WeakPolarHBondContact CB-OH 3.39Å; K341-Y355 HydrophobicContact CG-CD1 4.27Å; K341-Y355 HydrophobicContact CG-CD2 4.22Å; K341-Y355 HydrophobicContact CG-CE1 3.64Å; K341-Y355 HydrophobicContact CG-CE2 3.58Å; K341-Y355 VanDerWaalsContact CG-OH 3.28Å; K341-Y355 WeakPolarHBondContact CG-OH 3.06Å; F342-Y355 HydrophobicContact CB-CD1 4.09Å; F342-Y355 HydrophobicContact CB-CE1 4.32Å; F342-Y355 HydrophobicContact CD2-CD1 4.48Å; L345-Y355 HydrophobicContact CD1-CD1 4.28Å; L345-Y355 HydrophobicContact CD1-CD2 4.21Å; L345-Y355 HydrophobicContact CD1-CG 3.79Å; E351-Y355 VanDerWaalsContact O-CB 3.24Å; E351-Y355 WeakPolarHBondContact O-CB 3.45Å; E351-Y355 PolarHBondContact O-N 3.28Å; G352-Y355 PolarHBondContact O-N 3.27Å; Y355-R357 VanDerWaalsContact C-N 3.32Å; Y355-R357 PolarHBondContact O-N 2.84Å; Y355-L358 PolarHBondContact O-N 2.95Å; Y355-L358 VanDerWaalsContact O-N 3.16Å; Y355-E359 HydrophobicContact CD1-CB 4.34Å; Y355-E359 HydrophobicContact CD2-CG 4.17Å; Y355-E359 HydrophobicContact CE1-CB 3.91Å; Y355-E359 HydrophobicContact CE1-CG 4.25Å; Y355-E359 HydrophobicContact CE2-CB 4.31Å; Y355-E359 HydrophobicContact CE2-CG 3.73Å; Y355-E359 PolarHBondContact O-N 3.14Å
356	G	94.8	Very high	93.1	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.6	-39	177.9	0	0	0	0	0	113.1	G352 V353 L358 L360 A361	G352-G356 PolarHBondContact O-N 3.35Å; V353-G356 PolarHBondContact O-N 3.16Å; G356-L358 VanDerWaalsContact C-N 3.34Å; G356-L360 WeakPolarHBondContact O-CB 3.34Å; G356-L360 PolarHBondContact O-N 2.76Å; G356-A361 PolarHBondContact O-N 3.32Å
357	R	95.3	Very high	92.9	Very high	184 Å²	184	71.2 Å²	71.2	69%	0.694	40%	0.395	S	S	*	.	H	α-helix	trans	-68.1	-30.6	175.6	-74.8	174.3	178.6	174.5	1.4	113.7	V353 N354 Y355 A361	V353-R357 WeakPolarHBondContact O-CB 3.37Å; V353-R357 VanDerWaalsContact O-CG 3.31Å; V353-R357 WeakPolarHBondContact O-CG 3.37Å; V353-R357 PolarHBondContact O-N 3.43Å; N354-R357 PolarHBondContact O-N 2.98Å; Y355-R357 VanDerWaalsContact C-N 3.32Å; Y355-R357 PolarHBondContact O-N 2.84Å; R357-A361 WeakPolarHBondContact O-CB 3.43Å
358	L	95.5	Very high	92.9	Very high	114 Å²	114	68.6 Å²	68.6	60%	0.597	37%	0.368	S	S	*	.	H	α-helix	trans	-88	-49.9	-177.2	-177.7	63.4	0	0	0	112	N354 Y355 G356 K362	N354-L358 PolarHBondContact O-N 2.93Å; N354-L358 VanDerWaalsContact O-N 3.13Å; Y355-L358 PolarHBondContact O-N 2.95Å; Y355-L358 VanDerWaalsContact O-N 3.16Å; G356-L358 VanDerWaalsContact C-N 3.34Å; L358-K362 WeakPolarHBondContact O-CE 3.5Å
359	E	95.3	Very high	92.9	Very high	34 Å²	34	64.2 Å²	64.2	16%	0.159	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-50.9	-169.2	-62.8	-57	150.1	0	0	112.5	H338 Y355 A361 K362 F363	H338-E359 HydrophobicContact CB-CB 4.45Å; H338-E359 IonicContact CE1-OE2 2.66Å; H338-E359 PolarHBondContact CE1-OE2 2.76Å; H338-E359 VanDerWaalsContact CE1-OE2 3.22Å; H338-E359 IonicContact ND1-OE2 3.8Å; H338-E359 IonicContact NE2-OE2 3.33Å; Y355-E359 HydrophobicContact CD1-CB 4.34Å; Y355-E359 HydrophobicContact CD2-CG 4.17Å; Y355-E359 HydrophobicContact CE1-CB 3.91Å; Y355-E359 HydrophobicContact CE1-CG 4.25Å; Y355-E359 HydrophobicContact CE2-CB 4.31Å; Y355-E359 HydrophobicContact CE2-CG 3.73Å; Y355-E359 PolarHBondContact O-N 3.14Å; E359-A361 PolarHBondContact O-N 2.92Å; E359-K362 WeakPolarHBondContact O-CB 3.41Å; E359-K362 WeakPolarHBondContact O-CG 3.5Å; E359-K362 PolarHBondContact O-N 3.2Å; E359-K362 IonicContact OE1-NZ 3.59Å; E359-K362 WeakPolarHBondContact OE2-CE 2.98Å; E359-K362 IonicContact OE2-NZ 3.56Å; E359-K362 PolarHBondContact OE2-NZ 3.33Å; E359-F363 WeakPolarHBondContact O-CE2 3.26Å
360	L	93.6	Very high	93.1	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-70.9	-31.1	-179.1	-76.2	179.3	0	0	0	113.3	H338 C339 F342 G356 K362 F363 C376 F377	H338-L360 HydrophobicContact CB-CD2 4.16Å; C339-L360 HydrophobicContact CB-CD2 4.46Å; F342-L360 HydrophobicContact CB-CD1 3.47Å; F342-L360 VanDerWaalsContact CB-CD1 3.47Å; F342-L360 HydrophobicContact CB-CG 4.26Å; F342-L360 HydrophobicContact CD1-CD1 3.91Å; F342-L360 HydrophobicContact CD2-CD1 3.53Å; F342-L360 HydrophobicContact CE2-CD1 4.19Å; F342-L360 HydrophobicContact CG-CD1 3.34Å; F342-L360 HydrophobicContact CG-CG 4.5Å; G356-L360 WeakPolarHBondContact O-CB 3.34Å; G356-L360 PolarHBondContact O-N 2.76Å; L360-K362 PolarHBondContact O-N 3.2Å; L360-K362 VanDerWaalsContact O-N 3.09Å; L360-F363 PolarHBondContact O-N 2.84Å; L360-C376 HydrophobicContact CD1-CB 4.34Å; L360-F377 HydrophobicContact CB-CZ 4.01Å
361	A	92.5	Very high	93	Very high	44 Å²	44	57.3 Å²	57.3	36%	0.364	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-58.3	-24.1	177.8	0	0	0	0	0	113.2	G356 R357 E359 F363 V364	G356-A361 PolarHBondContact O-N 3.32Å; R357-A361 WeakPolarHBondContact O-CB 3.43Å; E359-A361 PolarHBondContact O-N 2.92Å; A361-F363 PolarHBondContact O-N 2.63Å; A361-V364 PolarHBondContact O-N 3.41Å
362	K	94.3	Very high	92.9	Very high	70 Å²	70	52.6 Å²	52.6	30%	0.304	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-61.9	-24.2	176.2	-60.9	175	-178.3	172	0	113.2	L358 E359 L360	L358-K362 WeakPolarHBondContact O-CE 3.5Å; E359-K362 WeakPolarHBondContact O-CB 3.41Å; E359-K362 WeakPolarHBondContact O-CG 3.5Å; E359-K362 PolarHBondContact O-N 3.2Å; E359-K362 IonicContact OE1-NZ 3.59Å; E359-K362 WeakPolarHBondContact OE2-CE 2.98Å; E359-K362 IonicContact OE2-NZ 3.56Å; E359-K362 PolarHBondContact OE2-NZ 3.33Å; L360-K362 PolarHBondContact O-N 3.2Å; L360-K362 VanDerWaalsContact O-N 3.09Å
363	F	94.5	Very high	93	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-96.9	-8.5	-177.2	-57.8	-88.1	0	0	0	113.3	D329 F335 H338 E359 L360 A361 G365 L366 F369 V373	D329-F363 WeakPolarHBondContact O-CZ 3.28Å; F335-F363 VanDerWaalsContact CA-CZ 3.47Å; F335-F363 HydrophobicContact CB-CD1 3.84Å; F335-F363 HydrophobicContact CB-CE1 3.44Å; F335-F363 VanDerWaalsContact CB-CE1 3.44Å; F335-F363 HydrophobicContact CB-CZ 3.89Å; F335-F363 HydrophobicContact CD2-CB 3.88Å; F335-F363 AromaticContact CD2-CD1 3.47Å; F335-F363 HydrophobicContact CD2-CD1 3.47Å; F335-F363 VanDerWaalsContact CD2-CD1 3.47Å; F335-F363 AromaticContact CD2-CD2 3.82Å; F335-F363 HydrophobicContact CD2-CD2 3.82Å; F335-F363 AromaticContact CD2-CE1 3.88Å; F335-F363 HydrophobicContact CD2-CE1 3.88Å; F335-F363 HydrophobicContact CD2-CE2 4.2Å; F335-F363 AromaticContact CD2-CG 3.43Å; F335-F363 HydrophobicContact CD2-CG 3.43Å; F335-F363 VanDerWaalsContact CD2-CG 3.43Å; F335-F363 HydrophobicContact CD2-CZ 4.23Å; F335-F363 HydrophobicContact CE2-CB 4Å; F335-F363 HydrophobicContact CE2-CD1 4.4Å; F335-F363 HydrophobicContact CE2-CD2 4.47Å; F335-F363 HydrophobicContact CE2-CG 4.06Å; F335-F363 HydrophobicContact CG-CD1 4.02Å; F335-F363 HydrophobicContact CG-CE1 4.12Å; F335-F363 HydrophobicContact CG-CG 4.41Å; H338-F363 HydrophobicContact CB-CE2 4.37Å; H338-F363 AromaticContact CD2-CE2 3.99Å; E359-F363 WeakPolarHBondContact O-CE2 3.26Å; L360-F363 PolarHBondContact O-N 2.84Å; A361-F363 PolarHBondContact O-N 2.63Å; F363-G365 PolarHBondContact O-N 2.76Å; F363-L366 HydrophobicContact CD1-CD1 4.31Å; F363-L366 WeakPolarHBondContact O-CB 3.34Å; F363-L366 PolarHBondContact O-N 3.04Å; F363-F369 HydrophobicContact CB-CB 4.22Å; F363-F369 HydrophobicContact CD1-CD2 4.14Å; F363-F369 HydrophobicContact CD1-CE2 4.32Å; F363-F369 HydrophobicContact CD1-CG 4.41Å; F363-V373 HydrophobicContact CB-CG2 4.02Å
364	V	91.5	Very high	92.9	Very high	73 Å²	73	55.8 Å²	55.8	44%	0.442	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	132	177.3	176.4	0	0	0	0	109.6	A361 L366 V373	A361-V364 PolarHBondContact O-N 3.41Å; V364-L366 PolarHBondContact O-N 2.93Å; V364-V373 HydrophobicContact CG2-CG1 3.87Å
365	G	88	Confident	92.8	Very high	64 Å²	64	54.4 Å²	54.4	66%	0.66	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	-6.3	-178	0	0	0	0	0	114.7	F363	F363-G365 PolarHBondContact O-N 2.76Å
366	L	90.7	Very high	92.7	Very high	52 Å²	52	52.7 Å²	52.7	27%	0.272	29%	0.292	S	S	.	.			trans	-78.7	131.1	172.1	-62.7	-175.1	0	0	0	110.2	K330 F363 V364 G368 F369	K330-L366 HydrophobicContact CB-CD1 4.15Å; K330-L366 HydrophobicContact CD-CD1 3.93Å; K330-L366 HydrophobicContact CG-CD1 4.03Å; F363-L366 HydrophobicContact CD1-CD1 4.31Å; F363-L366 WeakPolarHBondContact O-CB 3.34Å; F363-L366 PolarHBondContact O-N 3.04Å; V364-L366 PolarHBondContact O-N 2.93Å; L366-G368 PolarHBondContact O-N 3.34Å; L366-F369 HydrophobicContact CB-CD2 3.67Å; L366-F369 HydrophobicContact CB-CE2 4.33Å; L366-F369 HydrophobicContact CD1-CD2 4.18Å; L366-F369 HydrophobicContact CD1-CE2 4.32Å; L366-F369 PolarHBondContact O-N 3.4Å
367	T	87	Confident	92.6	Very high	145 Å²	145	56.1 Å²	56.1	89%	0.89	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	127.7	-178.2	-51.3	0	0	0	0	110.8
368	G	87.1	Confident	92.5	Very high	26 Å²	26	48.7 Å²	48.7	27%	0.268	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.6	-6.6	176.9	0	0	0	0	0	115.5	L30 R34 L366	L30-G368 WeakPolarHBondContact CD1-O 3.37Å; R34-G368 PolarHBondContact NH2-O 2.86Å; L366-G368 PolarHBondContact O-N 3.34Å
369	F	93.2	Very high	92.5	Very high	17 Å²	17	43.3 Å²	43.3	8%	0.075	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-27.3	175.6	-58.2	-59.3	0	0	0	113.6	L30 V332 F335 F363 L366 D371 I372 V373	L30-F369 HydrophobicContact CD1-CD1 3.74Å; L30-F369 HydrophobicContact CD1-CE1 3.6Å; L30-F369 HydrophobicContact CD2-CD1 4.28Å; L30-F369 HydrophobicContact CD2-CE1 4.3Å; V332-F369 HydrophobicContact CB-CE1 4.43Å; V332-F369 HydrophobicContact CG2-CE1 3.86Å; V332-F369 HydrophobicContact CG2-CZ 3.9Å; F335-F369 HydrophobicContact CB-CD1 4.17Å; F335-F369 HydrophobicContact CB-CE1 3.91Å; F335-F369 HydrophobicContact CB-CZ 4.47Å; F335-F369 AromaticContact CD1-CD1 3.37Å; F335-F369 HydrophobicContact CD1-CD1 3.37Å; F335-F369 AromaticContact CD1-CE1 3.71Å; F335-F369 HydrophobicContact CD1-CE1 3.71Å; F335-F369 HydrophobicContact CD1-CG 4.36Å; F335-F369 HydrophobicContact CD2-CB 4.32Å; F335-F369 AromaticContact CD2-CD1 3.97Å; F335-F369 HydrophobicContact CD2-CD1 3.97Å; F335-F369 HydrophobicContact CD2-CG 4.23Å; F335-F369 HydrophobicContact CE1-CB 4.41Å; F335-F369 AromaticContact CE1-CD1 3.61Å; F335-F369 HydrophobicContact CE1-CD1 3.61Å; F335-F369 HydrophobicContact CE1-CE1 4.37Å; F335-F369 HydrophobicContact CE1-CG 4.42Å; F335-F369 HydrophobicContact CE2-CB 3.93Å; F335-F369 HydrophobicContact CE2-CD1 4.18Å; F335-F369 HydrophobicContact CE2-CG 4.3Å; F335-F369 AromaticContact CG-CD1 3.54Å; F335-F369 HydrophobicContact CG-CD1 3.54Å; F335-F369 AromaticContact CG-CE1 3.77Å; F335-F369 HydrophobicContact CG-CE1 3.77Å; F335-F369 HydrophobicContact CG-CG 4.23Å; F335-F369 HydrophobicContact CZ-CB 3.95Å; F335-F369 AromaticContact CZ-CD1 3.99Å; F335-F369 HydrophobicContact CZ-CD1 3.99Å; F335-F369 HydrophobicContact CZ-CG 4.37Å; F363-F369 HydrophobicContact CB-CB 4.22Å; F363-F369 HydrophobicContact CD1-CD2 4.14Å; F363-F369 HydrophobicContact CD1-CE2 4.32Å; F363-F369 HydrophobicContact CD1-CG 4.41Å; L366-F369 HydrophobicContact CB-CD2 3.67Å; L366-F369 HydrophobicContact CB-CE2 4.33Å; L366-F369 HydrophobicContact CD1-CD2 4.18Å; L366-F369 HydrophobicContact CD1-CE2 4.32Å; L366-F369 PolarHBondContact O-N 3.4Å; F369-D371 VanDerWaalsContact C-N 3.34Å; F369-D371 PolarHBondContact O-N 2.96Å; F369-I372 PolarHBondContact O-N 3.26Å; F369-I372 VanDerWaalsContact O-N 3.07Å; F369-V373 HydrophobicContact CB-CG2 4.46Å; F369-V373 WeakPolarHBondContact O-CG2 3.22Å; F369-V373 PolarHBondContact O-N 3.39Å
370	Q	91.7	Very high	92.3	Very high	58 Å²	58	43.5 Å²	43.5	27%	0.271	26%	0.259	S	S	.	.	H	α-helix	trans	-50.9	-47.2	-169.3	-175.5	64.4	25.8	0	0	114.1	I372 V373 E374	Q370-I372 VanDerWaalsContact C-N 3.34Å; Q370-I372 PolarHBondContact O-N 3.33Å; Q370-V373 PolarHBondContact O-N 2.63Å; Q370-E374 PolarHBondContact NE2-OE1 3.2Å; Q370-E374 WeakPolarHBondContact O-CG 3.41Å; Q370-E374 PolarHBondContact O-N 3.47Å
371	D	91.8	Very high	92.1	Very high	61 Å²	61	47.6 Å²	47.6	33%	0.326	29%	0.293	S	S	.	.	H	α-helix	trans	-62	-41.9	-178.6	56.8	-44.4	0	0	0	112.1	R34 F369 E374 D375	R34-D371 IonicContact CZ-OD1 2.73Å; R34-D371 IonicContact CZ-OD2 2.81Å; R34-D371 IonicContact NE-OD1 2.84Å; R34-D371 IonicContact NE-OD2 3.72Å; R34-D371 PolarHBondContact NE-OD2 3.45Å; R34-D371 IonicContact NH2-OD1 2.73Å; R34-D371 PolarHBondContact NH2-OD1 3.34Å; R34-D371 IonicContact NH2-OD2 2.62Å; R34-D371 PolarHBondContact NH2-OD2 3.12Å; F369-D371 VanDerWaalsContact C-N 3.34Å; F369-D371 PolarHBondContact O-N 2.96Å; D371-E374 PolarHBondContact O-N 3.19Å; D371-D375 PolarHBondContact O-N 3.15Å
372	I	94	Very high	92	Very high	2 Å²	2	50 Å²	50	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-72.2	-35.9	179.3	-64.2	167.5	0	0	0	111	L30 I33 F335 F369 Q370 D375 C376 F393	L30-I372 HydrophobicContact CB-CD1 3.94Å; L30-I372 HydrophobicContact CD2-CD1 3.83Å; L30-I372 HydrophobicContact CG-CD1 4.42Å; I33-I372 HydrophobicContact CB-CD1 4.32Å; I33-I372 HydrophobicContact CD1-CD1 4.32Å; I33-I372 HydrophobicContact CG2-CD1 4.28Å; I33-I372 HydrophobicContact CG2-CG1 4.25Å; F335-I372 HydrophobicContact CE1-CB 4.1Å; F335-I372 HydrophobicContact CE1-CD1 4.27Å; F335-I372 HydrophobicContact CE1-CG2 3.74Å; F335-I372 HydrophobicContact CZ-CB 3.84Å; F335-I372 HydrophobicContact CZ-CG2 3.6Å; F369-I372 PolarHBondContact O-N 3.26Å; F369-I372 VanDerWaalsContact O-N 3.07Å; Q370-I372 VanDerWaalsContact C-N 3.34Å; Q370-I372 PolarHBondContact O-N 3.33Å; I372-D375 PolarHBondContact O-N 3.39Å; I372-C376 WeakPolarHBondContact O-CB 3.31Å; I372-C376 PolarHBondContact O-N 3.13Å; I372-C376 PolarHBondContact O-SG 2.87Å; I372-F393 HydrophobicContact CG2-CE1 4.21Å; I372-F393 HydrophobicContact CG2-CZ 3.89Å
373	V	94.6	Very high	91.7	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	32%	0.323	C	S	.	.	H	α-helix	trans	-62.9	-46.2	174.8	173.4	0	0	0	0	110.9	F335 F363 V364 F369 Q370 C376 F377	F335-V373 HydrophobicContact CE2-CG2 3.47Å; F335-V373 VanDerWaalsContact CE2-CG2 3.47Å; F335-V373 HydrophobicContact CZ-CG2 3.92Å; F363-V373 HydrophobicContact CB-CG2 4.02Å; V364-V373 HydrophobicContact CG2-CG1 3.87Å; F369-V373 HydrophobicContact CB-CG2 4.46Å; F369-V373 WeakPolarHBondContact O-CG2 3.22Å; F369-V373 PolarHBondContact O-N 3.39Å; Q370-V373 PolarHBondContact O-N 2.63Å; V373-C376 WeakPolarHBondContact O-CB 3.28Å; V373-C376 PolarHBondContact O-N 2.92Å; V373-F377 HydrophobicContact CG1-CD2 3.64Å; V373-F377 HydrophobicContact CG1-CE2 3.35Å; V373-F377 HydrophobicContact CG1-CZ 4.41Å; V373-F377 VanDerWaalsContact O-CD2 3.24Å; V373-F377 WeakPolarHBondContact O-CD2 3.03Å; V373-F377 PolarHBondContact O-N 3.45Å
374	E	93.3	Very high	91.5	Very high	107 Å²	107	60.9 Å²	60.9	50%	0.5	34%	0.343	S	S	.	.	H	α-helix	trans	-60.6	-45.5	177.3	-74.3	173.5	-177	0	0	111.3	Q370 D371 C376 F377 A378	Q370-E374 PolarHBondContact NE2-OE1 3.2Å; Q370-E374 WeakPolarHBondContact O-CG 3.41Å; Q370-E374 PolarHBondContact O-N 3.47Å; D371-E374 PolarHBondContact O-N 3.19Å; E374-C376 PolarHBondContact O-N 2.84Å; E374-F377 PolarHBondContact O-N 2.85Å; E374-A378 WeakPolarHBondContact O-CB 3.3Å; E374-A378 PolarHBondContact O-N 3.19Å
375	D	93.5	Very high	91.5	Very high	54 Å²	54	58.5 Å²	58.5	29%	0.289	33%	0.329	S	S	.	.	H	α-helix	trans	-65.2	-37.6	177	-77.2	-4.4	0	0	0	112.5	D371 I372 A378 L379 V390 Y392 F393	D371-D375 PolarHBondContact O-N 3.15Å; I372-D375 PolarHBondContact O-N 3.39Å; D375-A378 WeakPolarHBondContact O-CB 3.27Å; D375-A378 PolarHBondContact O-N 3.39Å; D375-L379 PolarHBondContact O-N 2.87Å; D375-V390 HydrophobicContact CB-CB 4.37Å; D375-V390 HydrophobicContact CB-CG1 3.65Å; D375-Y392 PolarHBondContact OD2-OH 3.34Å; D375-F393 HydrophobicContact CB-CD2 4.49Å; D375-F393 HydrophobicContact CB-CE2 3.62Å; D375-F393 HydrophobicContact CB-CZ 4.39Å
376	C	94	Very high	91.7	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-58.9	-52.3	172.2	-72.2	0	0	0	0	110.2	F342 L360 I372 V373 E374 A378 L379	F342-C376 HydrophobicContact CD1-CB 4.07Å; F342-C376 HydrophobicContact CE1-CB 4.17Å; F342-C376 WeakPolarHBondContact CE1-O 3.37Å; L360-C376 HydrophobicContact CD1-CB 4.34Å; I372-C376 WeakPolarHBondContact O-CB 3.31Å; I372-C376 PolarHBondContact O-N 3.13Å; I372-C376 PolarHBondContact O-SG 2.87Å; V373-C376 WeakPolarHBondContact O-CB 3.28Å; V373-C376 PolarHBondContact O-N 2.92Å; E374-C376 PolarHBondContact O-N 2.84Å; C376-A378 PolarHBondContact O-N 3.02Å; C376-L379 VanDerWaalsContact O-CB 3.32Å; C376-L379 WeakPolarHBondContact O-CB 3.4Å; C376-L379 PolarHBondContact O-N 2.78Å; C376-L379 VanDerWaalsContact O-N 3.1Å
377	F	93.7	Very high	91.7	Very high	72 Å²	72	64.7 Å²	64.7	32%	0.316	34%	0.34	S	S	.	.	H	α-helix	trans	-61.1	-32.9	179	-75.3	-53.3	0	0	0	113.1	F342 L360 V373 E374 L379 L380	F342-F377 AromaticContact CE2-CD1 3.96Å; F342-F377 HydrophobicContact CE2-CD1 3.96Å; F342-F377 AromaticContact CE2-CE1 3.92Å; F342-F377 HydrophobicContact CE2-CE1 3.92Å; F342-F377 AromaticContact CZ-CD1 3.74Å; F342-F377 HydrophobicContact CZ-CD1 3.74Å; F342-F377 HydrophobicContact CZ-CE1 4.19Å; L360-F377 HydrophobicContact CB-CZ 4.01Å; V373-F377 HydrophobicContact CG1-CD2 3.64Å; V373-F377 HydrophobicContact CG1-CE2 3.35Å; V373-F377 HydrophobicContact CG1-CZ 4.41Å; V373-F377 VanDerWaalsContact O-CD2 3.24Å; V373-F377 WeakPolarHBondContact O-CD2 3.03Å; V373-F377 PolarHBondContact O-N 3.45Å; E374-F377 PolarHBondContact O-N 2.85Å; F377-L379 PolarHBondContact O-N 3.04Å; F377-L380 PolarHBondContact O-N 3.03Å
378	A	93.5	Very high	91.9	Very high	29 Å²	29	58 Å²	58	24%	0.24	30%	0.299	C	S	.	.	H	α-helix	trans	-58.8	-31	176.8	0	0	0	0	0	112.4	E374 D375 C376 L380 A381 Y382 V390	E374-A378 WeakPolarHBondContact O-CB 3.3Å; E374-A378 PolarHBondContact O-N 3.19Å; D375-A378 WeakPolarHBondContact O-CB 3.27Å; D375-A378 PolarHBondContact O-N 3.39Å; C376-A378 PolarHBondContact O-N 3.02Å; A378-L380 PolarHBondContact O-N 2.94Å; A378-A381 WeakPolarHBondContact O-CB 3.34Å; A378-A381 PolarHBondContact O-N 2.83Å; A378-Y382 WeakPolarHBondContact O-CD2 3.41Å; A378-V390 HydrophobicContact CB-CG2 4.13Å
379	L	94	Very high	92.1	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-56	-34.7	177.1	-71.3	164.4	0	0	0	113.1	I343 V346 D375 C376 F377 A381 P385 V390 F393 L394	I343-L379 HydrophobicContact CG1-CD1 4.07Å; V346-L379 HydrophobicContact CG1-CB 4.14Å; V346-L379 HydrophobicContact CG2-CB 3.86Å; V346-L379 HydrophobicContact CG2-CD1 4.1Å; D375-L379 PolarHBondContact O-N 2.87Å; C376-L379 VanDerWaalsContact O-CB 3.32Å; C376-L379 WeakPolarHBondContact O-CB 3.4Å; C376-L379 PolarHBondContact O-N 2.78Å; C376-L379 VanDerWaalsContact O-N 3.1Å; F377-L379 PolarHBondContact O-N 3.04Å; L379-A381 VanDerWaalsContact C-N 3.25Å; L379-A381 PolarHBondContact O-N 2.62Å; L379-P385 HydrophobicContact CD2-CB 4.1Å; L379-V390 HydrophobicContact CD2-CG2 3.69Å; L379-V390 HydrophobicContact CG-CG2 3.82Å; L379-F393 HydrophobicContact CD1-CB 3.98Å; L379-F393 HydrophobicContact CD1-CD2 4.49Å; L379-F393 HydrophobicContact CD1-CG 4.5Å; L379-L394 HydrophobicContact CD2-CD1 4.31Å; L379-L394 HydrophobicContact CD2-CD2 4.24Å; L379-L394 HydrophobicContact CD2-CG 4.22Å
380	L	90.9	Very high	92	Very high	39 Å²	39	60.3 Å²	60.3	20%	0.204	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-73.3	-16.4	178.9	-66	-178.5	0	0	0	113.5	F342 V346 L349 V353 F377 A378 Y382	F342-L380 HydrophobicContact CE1-CD1 4.47Å; F342-L380 HydrophobicContact CE1-CG 4.27Å; F342-L380 HydrophobicContact CE2-CD1 3.86Å; F342-L380 HydrophobicContact CE2-CG 4.5Å; F342-L380 HydrophobicContact CZ-CD1 3.43Å; F342-L380 VanDerWaalsContact CZ-CD1 3.43Å; F342-L380 HydrophobicContact CZ-CD2 4.39Å; F342-L380 HydrophobicContact CZ-CG 3.66Å; V346-L380 HydrophobicContact CB-CD2 4.43Å; V346-L380 HydrophobicContact CG1-CD2 4.35Å; V346-L380 HydrophobicContact CG2-CD2 4.37Å; L349-L380 HydrophobicContact CD1-CB 4.42Å; L349-L380 HydrophobicContact CD1-CD2 4.1Å; V353-L380 HydrophobicContact CG2-CD1 3.81Å; F377-L380 PolarHBondContact O-N 3.03Å; A378-L380 PolarHBondContact O-N 2.94Å; L380-Y382 VanDerWaalsContact C-N 3.33Å
381	A	89.7	Confident	92	Very high	86 Å²	86	62.4 Å²	62.4	71%	0.711	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-81.5	-15	-179.5	0	0	0	0	0	112.9	A378 L379	A378-A381 WeakPolarHBondContact O-CB 3.34Å; A378-A381 PolarHBondContact O-N 2.83Å; L379-A381 VanDerWaalsContact C-N 3.25Å; L379-A381 PolarHBondContact O-N 2.62Å
382	Y	90.2	Very high	92	Very high	93 Å²	93	60.2 Å²	60.2	37%	0.365	31%	0.305	S	S	.	.			trans	-96.7	132.9	179.5	-66.7	-93.9	0	0	0	110.6	A378 L380 K384 S388 S389	A378-Y382 WeakPolarHBondContact O-CD2 3.41Å; L380-Y382 VanDerWaalsContact C-N 3.33Å; Y382-K384 PolarHBondContact O-N 2.81Å; Y382-S388 VanDerWaalsContact CE2-CB 3.44Å; Y382-S388 VanDerWaalsContact CG-CB 3.45Å; Y382-S389 PolarHBondContact OH-OG 2.83Å
383	E	88.4	Confident	92	Very high	199 Å²	199	60.1 Å²	60.1	93%	0.93	31%	0.305	S	S	*	.	S	Bend	trans	-61.3	-35.6	171.9	-174.9	177.4	-178.2	0	0	111.4
384	K	91.1	Very high	92	Very high	101 Å²	101	62.7 Å²	62.7	44%	0.439	32%	0.318	S	S	.	.	S	Bend	trans	-121.7	95.4	172	-70.4	-177.5	-174.9	-178.7	0	110	Y382 E386 E387	Y382-K384 PolarHBondContact O-N 2.81Å; K384-E386 PolarHBondContact O-N 2.98Å; K384-E386 VanDerWaalsContact O-N 3.13Å; K384-E387 HydrophobicContact CB-CB 4.31Å; K384-E387 HydrophobicContact CB-CG 4.09Å; K384-E387 VanDerWaalsContact CD-CD 3.45Å; K384-E387 HydrophobicContact CD-CG 4.2Å; K384-E387 WeakPolarHBondContact CD-OE1 3.08Å; K384-E387 IonicContact NZ-OE1 2.82Å; K384-E387 PolarHBondContact NZ-OE1 2.82Å; K384-E387 PolarHBondContact O-N 3.1Å
385	P	91.9	Very high	91.9	Very high	22 Å²	22	60 Å²	60	14%	0.143	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-55.5	-28.5	-178.9	-27.2	35.6	0	0	0	114.1	V346 L379 E387 S388 L394	V346-P385 HydrophobicContact CG1-CB 3.89Å; V346-P385 HydrophobicContact CG1-CG 3.39Å; L379-P385 HydrophobicContact CD2-CB 4.1Å; P385-E387 VanDerWaalsContact C-N 3.26Å; P385-E387 PolarHBondContact O-N 3.39Å; P385-S388 WeakPolarHBondContact O-CB 3.18Å; P385-S388 PolarHBondContact O-N 2.75Å; P385-S388 PolarHBondContact O-OG 2.86Å; P385-L394 VanDerWaalsContact C-CD1 3.46Å; P385-L394 HydrophobicContact CB-CD1 3.64Å
386	E	90.6	Very high	91.9	Very high	114 Å²	114	62.7 Å²	62.7	53%	0.533	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-68.4	-20.5	176.9	68.4	-83.4	-164.2	0	0	114.2	K384 W391 L394	K384-E386 PolarHBondContact O-N 2.98Å; K384-E386 VanDerWaalsContact O-N 3.13Å; E386-W391 WeakPolarHBondContact O-CB 3.3Å; E386-L394 HydrophobicContact CB-CD1 4.34Å
387	E	91.6	Very high	91.9	Very high	133 Å²	133	64.4 Å²	64.4	62%	0.621	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-94.2	2	175.5	-61.6	-179	-171.4	0	0	111.9	K384 P385	K384-E387 HydrophobicContact CB-CB 4.31Å; K384-E387 HydrophobicContact CB-CG 4.09Å; K384-E387 VanDerWaalsContact CD-CD 3.45Å; K384-E387 HydrophobicContact CD-CG 4.2Å; K384-E387 WeakPolarHBondContact CD-OE1 3.08Å; K384-E387 IonicContact NZ-OE1 2.82Å; K384-E387 PolarHBondContact NZ-OE1 2.82Å; K384-E387 PolarHBondContact O-N 3.1Å; P385-E387 VanDerWaalsContact C-N 3.26Å; P385-E387 PolarHBondContact O-N 3.39Å
388	S	91.7	Very high	91.9	Very high	5 Å²	5	61 Å²	61	4%	0.035	32%	0.317	C	S	.	.	S	Bend	trans	-76.3	164.2	-177.1	73.7	0	0	0	0	113.3	Y382 P385 V390 W391	Y382-S388 VanDerWaalsContact CE2-CB 3.44Å; Y382-S388 VanDerWaalsContact CG-CB 3.45Å; P385-S388 WeakPolarHBondContact O-CB 3.18Å; P385-S388 PolarHBondContact O-N 2.75Å; P385-S388 PolarHBondContact O-OG 2.86Å; S388-V390 PolarHBondContact O-N 3.42Å; S388-V390 WeakPolarHBondContact OG-CG2 3.36Å; S388-V390 PolarHBondContact OG-N 2.74Å; S388-W391 WeakPolarHBondContact O-CB 3.42Å; S388-W391 PolarHBondContact O-N 3.03Å; S388-W391 PolarHBondContact OG-N 2.96Å
389	S	90.5	Very high	92.1	Very high	87 Å²	87	61.9 Å²	61.9	61%	0.608	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-12.1	169.3	58.1	0	0	0	0	113.9	Y382	Y382-S389 PolarHBondContact OH-OG 2.83Å
390	V	92	Very high	92.2	Very high	3 Å²	3	65.2 Å²	65.2	2%	0.018	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	18.2	-176.3	-66.2	0	0	0	0	112	D375 A378 L379 S388 Y392 F393	D375-V390 HydrophobicContact CB-CB 4.37Å; D375-V390 HydrophobicContact CB-CG1 3.65Å; A378-V390 HydrophobicContact CB-CG2 4.13Å; L379-V390 HydrophobicContact CD2-CG2 3.69Å; L379-V390 HydrophobicContact CG-CG2 3.82Å; S388-V390 PolarHBondContact O-N 3.42Å; S388-V390 WeakPolarHBondContact OG-CG2 3.36Å; S388-V390 PolarHBondContact OG-N 2.74Å; V390-Y392 HydrophobicContact CB-CE1 4.19Å; V390-Y392 HydrophobicContact CG1-CE1 4.26Å; V390-Y392 PolarHBondContact O-N 2.99Å; V390-F393 HydrophobicContact CB-CD2 4.28Å; V390-F393 PolarHBondContact O-N 2.81Å
391	W	91.7	Very high	92.4	Very high	103 Å²	103	64 Å²	64	39%	0.39	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-55.7	-25.6	-177.4	71.1	-92	0	0	0	113.5	E386 S388 F393 L394 E395	E386-W391 WeakPolarHBondContact O-CB 3.3Å; S388-W391 WeakPolarHBondContact O-CB 3.42Å; S388-W391 PolarHBondContact O-N 3.03Å; S388-W391 PolarHBondContact OG-N 2.96Å; W391-F393 PolarHBondContact O-N 2.78Å; W391-F393 VanDerWaalsContact O-N 3.1Å; W391-L394 VanDerWaalsContact O-CB 3.32Å; W391-L394 WeakPolarHBondContact O-CB 3.4Å; W391-L394 PolarHBondContact O-N 3.04Å; W391-E395 HydrophobicContact CE3-CG 4.19Å; W391-E395 HydrophobicContact CH2-CG 4.45Å; W391-E395 WeakPolarHBondContact CH2-OE1 3.47Å; W391-E395 HydrophobicContact CZ3-CG 3.6Å; W391-E395 WeakPolarHBondContact CZ3-OE1 3.31Å
392	Y	91.2	Very high	92.8	Very high	14 Å²	14	60 Å²	60	6%	0.055	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-59.2	-22	-179.3	62.9	-97.8	0	0	0	113.5	I33 A37 D375 V390 L394 E395	I33-Y392 HydrophobicContact CG2-CE2 4.17Å; A37-Y392 HydrophobicContact CB-CD1 4.24Å; A37-Y392 HydrophobicContact CB-CE1 3.59Å; A37-Y392 HydrophobicContact CB-CE2 4.08Å; D375-Y392 PolarHBondContact OD2-OH 3.34Å; V390-Y392 HydrophobicContact CB-CE1 4.19Å; V390-Y392 HydrophobicContact CG1-CE1 4.26Å; V390-Y392 PolarHBondContact O-N 2.99Å; Y392-L394 PolarHBondContact O-N 2.77Å; Y392-E395 PolarHBondContact O-N 3.04Å
393	F	94.4	Very high	93.2	Very high	1 Å²	1	55.5 Å²	55.5	0%	0.004	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-67.9	-22.6	172.4	-81.6	-64	0	0	0	113.7	I33 I343 I372 D375 L379 V390 W391 E395 Q398	I33-F393 HydrophobicContact CD1-CE1 4.46Å; I33-F393 HydrophobicContact CG2-CE1 3.54Å; I33-F393 HydrophobicContact CG2-CZ 3.56Å; I343-F393 HydrophobicContact CD1-CB 3.85Å; I343-F393 HydrophobicContact CD1-CD1 3.58Å; I343-F393 HydrophobicContact CD1-CE1 4.46Å; I343-F393 HydrophobicContact CD1-CG 3.96Å; I343-F393 HydrophobicContact CG1-CB 4.29Å; I372-F393 HydrophobicContact CG2-CE1 4.21Å; I372-F393 HydrophobicContact CG2-CZ 3.89Å; D375-F393 HydrophobicContact CB-CD2 4.49Å; D375-F393 HydrophobicContact CB-CE2 3.62Å; D375-F393 HydrophobicContact CB-CZ 4.39Å; L379-F393 HydrophobicContact CD1-CB 3.98Å; L379-F393 HydrophobicContact CD1-CD2 4.49Å; L379-F393 HydrophobicContact CD1-CG 4.5Å; V390-F393 HydrophobicContact CB-CD2 4.28Å; V390-F393 PolarHBondContact O-N 2.81Å; W391-F393 PolarHBondContact O-N 2.78Å; W391-F393 VanDerWaalsContact O-N 3.1Å; F393-E395 VanDerWaalsContact C-N 3.34Å; F393-Q398 HydrophobicContact CD1-CG 4.02Å; F393-Q398 WeakPolarHBondContact O-CB 3.39Å
394	L	93.2	Very high	93.5	Very high	54 Å²	54	47.1 Å²	47.1	28%	0.283	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-85.4	-9.9	-177.9	-53.1	173.7	0	0	0	112.5	I343 L379 P385 E386 W391 Y392	I343-L394 HydrophobicContact CG2-CD2 3.99Å; L379-L394 HydrophobicContact CD2-CD1 4.31Å; L379-L394 HydrophobicContact CD2-CD2 4.24Å; L379-L394 HydrophobicContact CD2-CG 4.22Å; P385-L394 VanDerWaalsContact C-CD1 3.46Å; P385-L394 HydrophobicContact CB-CD1 3.64Å; E386-L394 HydrophobicContact CB-CD1 4.34Å; W391-L394 VanDerWaalsContact O-CB 3.32Å; W391-L394 WeakPolarHBondContact O-CB 3.4Å; W391-L394 PolarHBondContact O-N 3.04Å; Y392-L394 PolarHBondContact O-N 2.77Å
395	E	92.7	Very high	93.8	Very high	51 Å²	51	42.3 Å²	42.3	24%	0.238	21%	0.213	C	C	.	.	S	Bend	trans	-68.6	149.6	176.2	-66.7	-169	153.4	0	0	112	R39 W391 Y392 F393 S397 Q398	R39-E395 IonicContact CZ-OE2 2.85Å; R39-E395 IonicContact NH1-OE1 3.54Å; R39-E395 IonicContact NH1-OE2 2.75Å; R39-E395 PolarHBondContact NH1-OE2 3.15Å; R39-E395 IonicContact NH2-OE2 3.51Å; W391-E395 HydrophobicContact CE3-CG 4.19Å; W391-E395 HydrophobicContact CH2-CG 4.45Å; W391-E395 WeakPolarHBondContact CH2-OE1 3.47Å; W391-E395 HydrophobicContact CZ3-CG 3.6Å; W391-E395 WeakPolarHBondContact CZ3-OE1 3.31Å; Y392-E395 PolarHBondContact O-N 3.04Å; F393-E395 VanDerWaalsContact C-N 3.34Å; E395-S397 PolarHBondContact O-N 2.88Å; E395-S397 VanDerWaalsContact O-N 3.09Å; E395-S397 PolarHBondContact OE2-OG 2.62Å; E395-Q398 WeakPolarHBondContact O-CB 3.28Å; E395-Q398 PolarHBondContact O-N 2.83Å
396	D	93.6	Very high	94	Very high	110 Å²	110	41.4 Å²	41.4	59%	0.588	21%	0.207	S	C	*	.	H	α-helix	trans	-57.9	-25.5	170.2	-68.7	-27.3	0	0	0	112.8	Q398 R399 E400	D396-Q398 PolarHBondContact O-N 3.22Å; D396-R399 PolarHBondContact O-N 2.73Å; D396-R399 VanDerWaalsContact O-N 3.14Å; D396-R399 IonicContact OD1-NH1 2.86Å; D396-R399 PolarHBondContact OD1-NH1 3.04Å; D396-E400 WeakPolarHBondContact O-CG 3.46Å; D396-E400 PolarHBondContact O-N 3.44Å
397	S	92.6	Very high	94.3	Very high	36 Å²	36	36.1 Å²	36.1	25%	0.252	18%	0.182	S	C	.	.	H	α-helix	trans	-61.1	-28	177.1	81.1	0	0	0	0	112.9	R39 E395 L401	R39-S397 PolarHBondContact NH2-OG 3.17Å; E395-S397 PolarHBondContact O-N 2.88Å; E395-S397 VanDerWaalsContact O-N 3.09Å; E395-S397 PolarHBondContact OE2-OG 2.62Å; S397-L401 WeakPolarHBondContact O-CB 3.22Å; S397-L401 PolarHBondContact O-N 2.85Å
398	Q	95.5	Very high	94.3	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.009	15%	0.154	C	C	.	.	H	α-helix	trans	-71.6	-45.2	174.5	179.9	60.7	18.8	0	0	111.4	I343 F393 E395 D396 E400 L401 V402	I343-Q398 HydrophobicContact CD1-CG 4.29Å; F393-Q398 HydrophobicContact CD1-CG 4.02Å; F393-Q398 WeakPolarHBondContact O-CB 3.39Å; E395-Q398 WeakPolarHBondContact O-CB 3.28Å; E395-Q398 PolarHBondContact O-N 2.83Å; D396-Q398 PolarHBondContact O-N 3.22Å; Q398-E400 VanDerWaalsContact C-N 3.28Å; Q398-E400 PolarHBondContact O-N 2.75Å; Q398-L401 WeakPolarHBondContact O-CB 3.33Å; Q398-L401 PolarHBondContact O-N 2.76Å; Q398-L401 VanDerWaalsContact O-N 3.16Å; Q398-V402 WeakPolarHBondContact O-CG2 3.39Å; Q398-V402 PolarHBondContact O-N 2.84Å
399	R	97	Very high	94.4	Very high	47 Å²	47	29.8 Å²	29.8	18%	0.177	15%	0.153	C	C	.	.	H	α-helix	trans	-60.5	-39.9	174.7	-65.6	-177.4	-175.9	95.4	6.2	111.4	R307 E344 D396 V402 A403	R307-R399 VanDerWaalsContact O-CD 3.28Å; R307-R399 WeakPolarHBondContact O-CD 3.33Å; E344-R399 IonicContact OE1-CZ 3.68Å; E344-R399 IonicContact OE1-NE 3.39Å; E344-R399 PolarHBondContact OE1-NE 3.46Å; E344-R399 IonicContact OE1-NH2 3.02Å; E344-R399 PolarHBondContact OE1-NH2 3.02Å; E344-R399 VanDerWaalsContact OE1-NH2 3.16Å; E344-R399 IonicContact OE2-CZ 3.66Å; E344-R399 IonicContact OE2-NE 3.72Å; E344-R399 IonicContact OE2-NH2 3.49Å; E344-R399 PolarHBondContact OE2-NH2 2.84Å; D396-R399 PolarHBondContact O-N 2.73Å; D396-R399 VanDerWaalsContact O-N 3.14Å; D396-R399 IonicContact OD1-NH1 2.86Å; D396-R399 PolarHBondContact OD1-NH1 3.04Å; R399-V402 PolarHBondContact O-N 3.09Å; R399-A403 WeakPolarHBondContact O-CB 3.11Å; R399-A403 PolarHBondContact O-N 2.82Å
400	E	96.1	Very high	94.6	Very high	70 Å²	70	25.6 Å²	25.6	33%	0.327	12%	0.124	S	C	.	.	H	α-helix	trans	-62.9	-41.6	175.2	-70.3	-174.9	165.2	0	0	112.2	R307 D396 Q398 A403 D404	R307-E400 IonicContact CZ-OE1 3.6Å; R307-E400 IonicContact NE-OE1 3.88Å; R307-E400 IonicContact NH2-OE1 2.65Å; R307-E400 PolarHBondContact NH2-OE1 3.42Å; D396-E400 WeakPolarHBondContact O-CG 3.46Å; D396-E400 PolarHBondContact O-N 3.44Å; Q398-E400 VanDerWaalsContact C-N 3.28Å; Q398-E400 PolarHBondContact O-N 2.75Å; E400-A403 PolarHBondContact O-N 3.26Å; E400-D404 PolarHBondContact O-N 2.53Å
401	L	95.7	Very high	94.6	Very high	14 Å²	14	25.6 Å²	25.6	7%	0.073	12%	0.124	C	C	.	.	H	α-helix	trans	-62	-43.9	175.6	-177.7	157.5	0	0	0	112.2	F29 K32 I33 L336 S397 Q398 A403 D404 A405	F29-L401 HydrophobicContact CB-CD2 4.13Å; F29-L401 HydrophobicContact CD1-CD2 4.33Å; F29-L401 HydrophobicContact CD1-CG 4.29Å; K32-L401 HydrophobicContact CB-CD1 3.55Å; K32-L401 HydrophobicContact CB-CG 4.47Å; I33-L401 HydrophobicContact CD1-CD2 4.02Å; I33-L401 HydrophobicContact CG1-CD1 3.64Å; I33-L401 HydrophobicContact CG1-CD2 3.85Å; I33-L401 HydrophobicContact CG1-CG 4.43Å; L336-L401 HydrophobicContact CD1-CD2 4.39Å; L336-L401 HydrophobicContact CD2-CD2 4.11Å; S397-L401 WeakPolarHBondContact O-CB 3.22Å; S397-L401 PolarHBondContact O-N 2.85Å; Q398-L401 WeakPolarHBondContact O-CB 3.33Å; Q398-L401 PolarHBondContact O-N 2.76Å; Q398-L401 VanDerWaalsContact O-N 3.16Å; L401-A403 VanDerWaalsContact C-N 3.34Å; L401-D404 WeakPolarHBondContact O-CB 3.49Å; L401-D404 PolarHBondContact O-N 3.32Å; L401-A405 PolarHBondContact O-N 3.46Å
402	V	97.4	Very high	94.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.7	-40.8	177.1	179.8	0	0	0	0	110.2	V306 L336 L337 Q340 Q398 R399 D404 A405 V406	V306-V402 HydrophobicContact CG1-CB 3.87Å; V306-V402 HydrophobicContact CG1-CG1 3.72Å; L336-V402 HydrophobicContact CB-CG1 4.27Å; L336-V402 HydrophobicContact CB-CG2 4.28Å; L337-V402 HydrophobicContact CD2-CG1 3.97Å; L337-V402 HydrophobicContact CG-CG1 4.38Å; Q340-V402 HydrophobicContact CB-CG1 4.26Å; Q340-V402 HydrophobicContact CB-CG2 4.12Å; Q340-V402 HydrophobicContact CG-CG2 4.45Å; Q398-V402 WeakPolarHBondContact O-CG2 3.39Å; Q398-V402 PolarHBondContact O-N 2.84Å; R399-V402 PolarHBondContact O-N 3.09Å; V402-D404 VanDerWaalsContact C-N 3.34Å; V402-D404 PolarHBondContact O-N 3.07Å; V402-A405 PolarHBondContact O-N 2.82Å; V402-V406 WeakPolarHBondContact O-CG2 3.49Å; V402-V406 PolarHBondContact O-N 2.97Å
403	A	97.8	Very high	94.4	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.3	-35.7	175.9	0	0	0	0	0	112.5	R303 V306 R307 R399 E400 L401 N407	R303-A403 HydrophobicContact CB-CB 4.5Å; R303-A403 HydrophobicContact CG-CB 4.07Å; R303-A403 VanDerWaalsContact NH1-C 3.32Å; R303-A403 PolarHBondContact NH1-O 2.97Å; V306-A403 HydrophobicContact CB-CB 4.06Å; V306-A403 HydrophobicContact CG1-CB 3.9Å; R307-A403 HydrophobicContact CG-CB 4.23Å; R399-A403 WeakPolarHBondContact O-CB 3.11Å; R399-A403 PolarHBondContact O-N 2.82Å; E400-A403 PolarHBondContact O-N 3.26Å; L401-A403 VanDerWaalsContact C-N 3.34Å; A403-N407 VanDerWaalsContact O-CB 3.24Å; A403-N407 WeakPolarHBondContact O-CB 3.18Å; A403-N407 PolarHBondContact O-N 2.77Å
404	D	96	Very high	94.2	Very high	23 Å²	23	24.5 Å²	24.5	12%	0.123	13%	0.132	C	C	.	.	H	α-helix	trans	-61.4	-44.1	170.9	-74.6	-13.6	0	0	0	111.7	F29 Y259 R303 E400 L401 V402 N407 A408	F29-D404 HydrophobicContact CD1-CB 4.4Å; F29-D404 HydrophobicContact CE1-CB 3.5Å; F29-D404 VanDerWaalsContact CE1-CB 3.5Å; F29-D404 HydrophobicContact CZ-CB 4.09Å; Y259-D404 WeakPolarHBondContact CD1-OD1 3.5Å; Y259-D404 HydrophobicContact CE1-CB 4.14Å; Y259-D404 VanDerWaalsContact CE1-CG 3.46Å; Y259-D404 WeakPolarHBondContact CE1-OD1 3.46Å; R303-D404 IonicContact CZ-OD1 3.72Å; R303-D404 IonicContact NH1-OD1 2.81Å; R303-D404 IonicContact NH2-OD1 2.78Å; R303-D404 PolarHBondContact NH2-OD1 3.23Å; E400-D404 PolarHBondContact O-N 2.53Å; L401-D404 WeakPolarHBondContact O-CB 3.49Å; L401-D404 PolarHBondContact O-N 3.32Å; V402-D404 VanDerWaalsContact C-N 3.34Å; V402-D404 PolarHBondContact O-N 3.07Å; D404-N407 PolarHBondContact O-N 2.77Å; D404-A408 WeakPolarHBondContact O-CB 3.37Å; D404-A408 PolarHBondContact O-N 2.72Å
405	A	95.8	Very high	93.8	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-45.3	179.8	0	0	0	0	0	111.7	F29 L336 L401 V402 N407 A408 A409	F29-A405 HydrophobicContact CB-CB 4.4Å; F29-A405 HydrophobicContact CD1-CB 4.05Å; F29-A405 HydrophobicContact CD2-CB 3.71Å; F29-A405 HydrophobicContact CE1-CB 4.25Å; F29-A405 HydrophobicContact CE2-CB 3.93Å; F29-A405 HydrophobicContact CG-CB 3.79Å; F29-A405 HydrophobicContact CZ-CB 4.2Å; L336-A405 HydrophobicContact CD1-CB 3.46Å; L336-A405 VanDerWaalsContact CD1-CB 3.46Å; L401-A405 PolarHBondContact O-N 3.46Å; V402-A405 PolarHBondContact O-N 2.82Å; A405-N407 VanDerWaalsContact C-N 3.34Å; A405-N407 PolarHBondContact O-N 2.83Å; A405-A408 PolarHBondContact O-N 2.8Å; A405-A409 WeakPolarHBondContact O-CB 3.04Å; A405-A409 PolarHBondContact O-N 3.39Å
406	V	96.6	Very high	93.3	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.018	17%	0.167	C	C	.	.	H	α-helix	trans	-60.5	-44.7	173.7	173	0	0	0	0	111.1	L302 V306 L318 V333 L337 V402 A408 A409 I410	L302-V406 HydrophobicContact CB-CG1 4.42Å; V306-V406 HydrophobicContact CG2-CG2 4.41Å; L318-V406 HydrophobicContact CD1-CG1 4.07Å; L318-V406 HydrophobicContact CD1-CG2 4.38Å; L318-V406 HydrophobicContact CD2-CG1 4.06Å; V333-V406 HydrophobicContact CG1-CG2 4.14Å; L337-V406 HydrophobicContact CD1-CG2 4.1Å; L337-V406 HydrophobicContact CD2-CG2 3.91Å; L337-V406 HydrophobicContact CG-CG2 4.14Å; V402-V406 WeakPolarHBondContact O-CG2 3.49Å; V402-V406 PolarHBondContact O-N 2.97Å; V406-A408 PolarHBondContact O-N 2.85Å; V406-A409 PolarHBondContact O-N 2.7Å; V406-I410 HydrophobicContact CG1-CD1 3.9Å; V406-I410 VanDerWaalsContact O-CG1 3.32Å; V406-I410 WeakPolarHBondContact O-CG1 3.44Å; V406-I410 PolarHBondContact O-N 3.4Å
407	N	96.2	Very high	92.3	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.011	15%	0.151	C	C	.	.	H	α-helix	trans	-59.8	-47.4	177.1	174.1	84.3	0	0	0	111.9	H258 R299 A403 D404 A405 A409 I410 L411	H258-N407 PolarHBondContact O-ND2 2.99Å; H258-N407 PolarHBondContact O-OD1 2.9Å; R299-N407 WeakPolarHBondContact CD-OD1 3.14Å; R299-N407 PolarHBondContact NH1-OD1 3.23Å; A403-N407 VanDerWaalsContact O-CB 3.24Å; A403-N407 WeakPolarHBondContact O-CB 3.18Å; A403-N407 PolarHBondContact O-N 2.77Å; D404-N407 PolarHBondContact O-N 2.77Å; A405-N407 VanDerWaalsContact C-N 3.34Å; A405-N407 PolarHBondContact O-N 2.83Å; N407-A409 VanDerWaalsContact C-N 3.32Å; N407-A409 PolarHBondContact O-N 2.85Å; N407-I410 PolarHBondContact O-N 3.25Å; N407-L411 WeakPolarHBondContact O-CG 3.49Å; N407-L411 PolarHBondContact O-N 2.88Å
408	A	93.6	Very high	91	Very high	2 Å²	2	32.9 Å²	32.9	2%	0.017	17%	0.172	C	C	.	.	H	α-helix	trans	-61.6	-40.5	177.9	0	0	0	0	0	111.7	F29 D404 A405 V406 L411 S412 H425 L426	F29-A408 HydrophobicContact CE2-CB 4Å; F29-A408 HydrophobicContact CZ-CB 3.99Å; D404-A408 WeakPolarHBondContact O-CB 3.37Å; D404-A408 PolarHBondContact O-N 2.72Å; A405-A408 PolarHBondContact O-N 2.8Å; V406-A408 PolarHBondContact O-N 2.85Å; A408-L411 PolarHBondContact O-N 3.08Å; A408-S412 PolarHBondContact O-N 2.91Å; A408-H425 VanDerWaalsContact CB-O 3.32Å; A408-H425 WeakPolarHBondContact CB-O 3.13Å; A408-H425 PolarHBondContact O-CD2 2.86Å; A408-H425 VanDerWaalsContact O-CD2 3.31Å; A408-L426 HydrophobicContact CB-CD2 4.28Å
409	A	93.3	Very high	89.2	Confident	3 Å²	3	39.1 Å²	39.1	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-64.3	-39.1	175.9	0	0	0	0	0	112.4	I325 V333 A405 V406 N407 S412 T413	I325-A409 HydrophobicContact CD1-CB 4.07Å; I325-A409 WeakPolarHBondContact CD1-O 3.24Å; I325-A409 HydrophobicContact CG1-CB 4.39Å; I325-A409 HydrophobicContact CG2-CB 3.86Å; V333-A409 HydrophobicContact CG1-CB 4.4Å; V333-A409 HydrophobicContact CG2-CB 3.63Å; A405-A409 WeakPolarHBondContact O-CB 3.04Å; A405-A409 PolarHBondContact O-N 3.39Å; V406-A409 PolarHBondContact O-N 2.7Å; N407-A409 VanDerWaalsContact C-N 3.32Å; N407-A409 PolarHBondContact O-N 2.85Å; A409-S412 PolarHBondContact O-N 3.3Å; A409-S412 PolarHBondContact O-OG 3.1Å; A409-T413 WeakPolarHBondContact O-CG2 3.25Å
410	I	94.3	Very high	87	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.9	-46.7	174.8	-64.4	159.7	0	0	0	110.3	Y294 A295 R299 L302 L318 Y322 I325 V406 N407 S412 T413	Y294-I410 HydrophobicContact CE1-CG2 4.09Å; Y294-I410 WeakPolarHBondContact CE1-O 3.36Å; A295-I410 HydrophobicContact CB-CG2 4.23Å; R299-I410 HydrophobicContact CG-CB 3.97Å; R299-I410 HydrophobicContact CG-CD1 3.93Å; R299-I410 HydrophobicContact CG-CG2 3.6Å; L302-I410 HydrophobicContact CB-CD1 4.45Å; L302-I410 HydrophobicContact CD1-CD1 3.48Å; L302-I410 VanDerWaalsContact CD1-CD1 3.48Å; L318-I410 HydrophobicContact CD2-CD1 4.31Å; L318-I410 HydrophobicContact CD2-CG1 4.31Å; Y322-I410 HydrophobicContact CD1-CG2 4.41Å; Y322-I410 HydrophobicContact CD2-CD1 4.49Å; Y322-I410 HydrophobicContact CD2-CG1 4.07Å; Y322-I410 HydrophobicContact CE1-CG2 3.86Å; Y322-I410 HydrophobicContact CE2-CD1 4.26Å; Y322-I410 HydrophobicContact CE2-CG1 4.11Å; Y322-I410 HydrophobicContact CE2-CG2 4.07Å; Y322-I410 HydrophobicContact CG-CG1 4.45Å; I325-I410 HydrophobicContact CD1-CB 4.35Å; I325-I410 HydrophobicContact CD1-CG1 3.74Å; V406-I410 HydrophobicContact CG1-CD1 3.9Å; V406-I410 VanDerWaalsContact O-CG1 3.32Å; V406-I410 WeakPolarHBondContact O-CG1 3.44Å; V406-I410 PolarHBondContact O-N 3.4Å; N407-I410 PolarHBondContact O-N 3.25Å; I410-S412 PolarHBondContact O-N 2.87Å; I410-T413 WeakPolarHBondContact O-CB 3.35Å; I410-T413 PolarHBondContact O-N 2.49Å; I410-T413 PolarHBondContact O-OG1 3.18Å
411	L	92.3	Very high	85.1	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-58.5	-32	176.8	-71.6	176.7	0	0	0	112.6	D291 N407 A408 T413 N414 H425	D291-L411 WeakPolarHBondContact O-CD2 3.41Å; N407-L411 WeakPolarHBondContact O-CG 3.49Å; N407-L411 PolarHBondContact O-N 2.88Å; A408-L411 PolarHBondContact O-N 3.08Å; L411-T413 PolarHBondContact O-N 3.26Å; L411-N414 WeakPolarHBondContact O-CB 3.44Å; L411-N414 PolarHBondContact O-N 3.16Å; L411-H425 HydrophobicContact CB-CB 3.72Å; L411-H425 HydrophobicContact CD1-CB 4.43Å
412	S	88.7	Confident	83.1	Confident	57 Å²	57	52.3 Å²	52.3	40%	0.399	27%	0.27	S	S	.	.	H	α-helix	trans	-66.8	-16.9	176.4	84.5	0	0	0	0	113.6	A408 A409 I410	A408-S412 PolarHBondContact O-N 2.91Å; A409-S412 PolarHBondContact O-N 3.3Å; A409-S412 PolarHBondContact O-OG 3.1Å; I410-S412 PolarHBondContact O-N 2.87Å
413	T	90.5	Very high	81.7	Confident	28 Å²	28	55.5 Å²	55.5	17%	0.172	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-0.2	177.1	73.1	0	0	0	0	114.1	Y294 Q324 I325 A409 I410 L411 P415	Y294-T413 WeakPolarHBondContact CE1-OG1 3.42Å; Y294-T413 PolarHBondContact OH-OG1 3.49Å; Q324-T413 HydrophobicContact CG-CG2 3.91Å; Q324-T413 VanDerWaalsContact NE2-CG2 3.26Å; I325-T413 HydrophobicContact CD1-CG2 3.94Å; I325-T413 HydrophobicContact CG1-CG2 3.87Å; A409-T413 WeakPolarHBondContact O-CG2 3.25Å; I410-T413 WeakPolarHBondContact O-CB 3.35Å; I410-T413 PolarHBondContact O-N 2.49Å; I410-T413 PolarHBondContact O-OG1 3.18Å; L411-T413 PolarHBondContact O-N 3.26Å; T413-P415 WeakPolarHBondContact O-CD 3.33Å
414	N	89	Confident	80.2	Confident	10 Å²	10	55.9 Å²	55.9	5%	0.053	30%	0.295	C	S	.	.			trans	-62.9	118.9	-178.9	-176.1	1.3	0	0	0	111.2	D291 Y294 L411 N416 K417	D291-N414 WeakPolarHBondContact CA-ND2 3.18Å; D291-N414 PolarHBondContact OD1-ND2 2.68Å; Y294-N414 HydrophobicContact CD1-CB 3.76Å; Y294-N414 HydrophobicContact CD2-CB 4.1Å; Y294-N414 HydrophobicContact CE1-CB 4.09Å; Y294-N414 HydrophobicContact CE2-CB 4.42Å; Y294-N414 HydrophobicContact CG-CB 3.75Å; L411-N414 WeakPolarHBondContact O-CB 3.44Å; L411-N414 PolarHBondContact O-N 3.16Å; N414-N416 PolarHBondContact O-N 2.92Å; N414-N416 PolarHBondContact OD1-N 3.29Å; N414-K417 WeakPolarHBondContact O-CB 3.17Å; N414-K417 PolarHBondContact O-N 2.98Å
415	P	85.6	Confident	79.2	Confident	107 Å²	107	55.2 Å²	55.2	70%	0.695	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-21.5	179.9	27.3	-35.8	0	0	0	113.8	T413 K417	T413-P415 WeakPolarHBondContact O-CD 3.33Å; P415-K417 VanDerWaalsContact C-N 3.27Å; P415-K417 PolarHBondContact O-N 2.98Å
416	N	82.3	Confident	78.6	Confident	106 Å²	106	55.7 Å²	55.7	57%	0.567	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	2	-180	-68.2	-11.8	0	0	0	113.3	D290 N414 K418	D290-N416 PolarHBondContact OD2-ND2 2.9Å; N414-N416 PolarHBondContact O-N 2.92Å; N414-N416 PolarHBondContact OD1-N 3.29Å; N416-K418 PolarHBondContact O-N 2.85Å
417	K	71.1	Confident	78.2	Confident	58 Å²	58	57.4 Å²	57.4	25%	0.252	30%	0.301	S	S	.	.			trans	-65.7	124	-173.7	-169.2	174.4	177.9	-177.1	0	111.2	N414 P415 R422 C424 H425	N414-K417 WeakPolarHBondContact O-CB 3.17Å; N414-K417 PolarHBondContact O-N 2.98Å; P415-K417 VanDerWaalsContact C-N 3.27Å; P415-K417 PolarHBondContact O-N 2.98Å; K417-R422 PolarHBondContact NZ-O 3.09Å; K417-C424 VanDerWaalsContact CE-SG 3.59Å; K417-H425 PolarHBondContact NZ-ND1 2.83Å
418	K	66.5	Low	77.9	Confident	156 Å²	156	57.3 Å²	57.3	68%	0.678	30%	0.301	S	S	*	.			trans	-76.3	126.4	173.7	-64.9	177.5	-176.9	170.1	0	109.3	N416 V420 Q421	N416-K418 PolarHBondContact O-N 2.85Å; K418-V420 PolarHBondContact O-N 2.96Å; K418-Q421 PolarHBondContact O-N 2.89Å
419	D	56.6	Low	77.6	Confident	134 Å²	134	59.6 Å²	59.6	72%	0.717	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-52.8	-23.8	-175.6	-108.6	-32.7	0	0	0	114.8	Q421	D419-Q421 PolarHBondContact O-N 2.96Å
420	V	52.6	Low	77.6	Confident	143 Å²	143	62.2 Å²	62.2	87%	0.867	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-71.4	-12.5	-173	-173.3	0	0	0	0	113.2	K418	K418-V420 PolarHBondContact O-N 2.96Å
421	Q	54.3	Low	77.4	Confident	80 Å²	80	64.3 Å²	64.3	37%	0.374	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-123.8	55.6	-176.8	-68.3	171.4	-25	0	0	112.8	D288 K418 D419 S423 C424	D288-Q421 PolarHBondContact OD2-NE2 2.87Å; D288-Q421 PolarHBondContact OD2-OE1 3.14Å; D288-Q421 VanDerWaalsContact OD2-OE1 3.12Å; K418-Q421 PolarHBondContact O-N 2.89Å; D419-Q421 PolarHBondContact O-N 2.96Å; Q421-S423 PolarHBondContact O-N 3.25Å; Q421-C424 HydrophobicContact CB-CB 4.16Å; Q421-C424 PolarHBondContact O-N 3.04Å; Q421-C424 VanDerWaalsContact O-N 3.09Å; Q421-C424 PolarHBondContact O-SG 2.92Å
422	R	55.4	Low	77.4	Confident	184 Å²	184	67.5 Å²	67.5	69%	0.694	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-35.9	-176.6	-79.8	-176.4	177.6	179.9	-1.1	114.6	K417 H425	K417-R422 PolarHBondContact NZ-O 3.09Å; R422-H425 PolarHBondContact O-CE1 3.2Å; R422-H425 PolarHBondContact O-ND1 2.98Å
423	S	66.2	Low	77.6	Confident	67 Å²	67	68.5 Å²	68.5	47%	0.469	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	9.3	-175.1	-48.8	0	0	0	0	116.4	Q421 H425 L426	Q421-S423 PolarHBondContact O-N 3.25Å; S423-H425 VanDerWaalsContact C-N 3.27Å; S423-H425 PolarHBondContact O-N 2.8Å; S423-L426 PolarHBondContact O-N 2.77Å
424	C	68.4	Low	77.7	Confident	9 Å²	9	69.4 Å²	69.4	6%	0.061	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-59.6	-33.4	-177.4	59.4	0	0	0	0	114.1	H258 D291 K417 Q421 L426 Q427	H258-C424 PolarHBondContact CE1-O 2.83Å; H258-C424 VanDerWaalsContact CE1-O 3.24Å; D291-C424 PolarHBondContact OD2-SG 2.91Å; K417-C424 VanDerWaalsContact CE-SG 3.59Å; Q421-C424 HydrophobicContact CB-CB 4.16Å; Q421-C424 PolarHBondContact O-N 3.04Å; Q421-C424 VanDerWaalsContact O-N 3.09Å; Q421-C424 PolarHBondContact O-SG 2.92Å; C424-L426 VanDerWaalsContact C-N 3.31Å; C424-L426 PolarHBondContact O-N 3.06Å; C424-Q427 VanDerWaalsContact O-O 3.06Å
425	H	74.3	Confident	77.8	Confident	8 Å²	8	75.3 Å²	75.3	4%	0.037	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-72.9	-12.5	-176.7	64.1	-72.8	0	0	0	115.6	H258 A408 L411 K417 R422 S423	H258-H425 PolarHBondContact CE1-O 3.01Å; A408-H425 VanDerWaalsContact CB-O 3.32Å; A408-H425 WeakPolarHBondContact CB-O 3.13Å; A408-H425 PolarHBondContact O-CD2 2.86Å; A408-H425 VanDerWaalsContact O-CD2 3.31Å; L411-H425 HydrophobicContact CB-CB 3.72Å; L411-H425 HydrophobicContact CD1-CB 4.43Å; K417-H425 PolarHBondContact NZ-ND1 2.83Å; R422-H425 PolarHBondContact O-CE1 3.2Å; R422-H425 PolarHBondContact O-ND1 2.98Å; S423-H425 VanDerWaalsContact C-N 3.27Å; S423-H425 PolarHBondContact O-N 2.8Å
426	L	83.4	Confident	78.2	Confident	10 Å²	10	75.9 Å²	75.9	5%	0.052	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-90.4	-21.7	-176.9	-59.9	172.9	0	0	0	113.2	L25 F29 A408 S423 C424	L25-L426 HydrophobicContact CB-CD1 4Å; L25-L426 HydrophobicContact CB-CD2 4.43Å; F29-L426 HydrophobicContact CE2-CD2 4.1Å; A408-L426 HydrophobicContact CB-CD2 4.28Å; S423-L426 PolarHBondContact O-N 2.77Å; C424-L426 VanDerWaalsContact C-N 3.31Å; C424-L426 PolarHBondContact O-N 3.06Å
427	Q	87.3	Confident	78.8	Confident	39 Å²	39	74.5 Å²	74.5	18%	0.182	36%	0.359	C	S	.	.	S	Bend	trans	-150.3	134.6	-168.6	-63.2	176.1	7.2	0	0	111	H258 C424 E431 K432	H258-Q427 PolarHBondContact NE2-N 2.66Å; C424-Q427 VanDerWaalsContact O-O 3.06Å; Q427-E431 HydrophobicContact CB-CB 4.41Å; Q427-K432 HydrophobicContact CB-CG 4.29Å; Q427-K432 WeakPolarHBondContact O-CE 3.28Å
428	S	90.2	Very high	79.9	Confident	1 Å²	1	73.5 Å²	73.5	1%	0.007	36%	0.358	C	S	.	.			trans	-67.6	163.2	170.8	66.7	0	0	0	0	112.5	Y255 L430 E431 K432	Y255-S428 VanDerWaalsContact CD2-OG 3.29Å; Y255-S428 WeakPolarHBondContact CD2-OG 3.33Å; S428-L430 VanDerWaalsContact C-N 3.27Å; S428-L430 PolarHBondContact O-N 3Å; S428-E431 WeakPolarHBondContact CB-OE2 3.46Å; S428-E431 PolarHBondContact N-OE2 3.4Å; S428-E431 PolarHBondContact O-N 2.91Å; S428-E431 VanDerWaalsContact OG-CG 3.32Å; S428-E431 WeakPolarHBondContact OG-CG 3.44Å; S428-E431 PolarHBondContact OG-N 3.24Å; S428-E431 PolarHBondContact OG-OE2 2.97Å; S428-K432 WeakPolarHBondContact O-CG 3.34Å; S428-K432 PolarHBondContact O-N 2.88Å
429	H	88.2	Confident	81.3	Confident	50 Å²	50	70.3 Å²	70.3	23%	0.231	35%	0.352	C	S	.	.	H	α-helix	trans	-58.3	-39.9	173.3	-68.1	97.5	0	0	0	112.6	L251 E431 K432 L433	L251-H429 HydrophobicContact CD2-CB 4.12Å; H429-E431 PolarHBondContact O-N 3.42Å; H429-K432 PolarHBondContact O-N 2.94Å; H429-L433 WeakPolarHBondContact O-CG 3.29Å; H429-L433 PolarHBondContact O-N 2.99Å
430	L	91.6	Very high	83.1	Confident	58 Å²	58	67.2 Å²	67.2	30%	0.304	34%	0.34	S	S	.	.	H	α-helix	trans	-59	-47.8	176.9	179.5	58.9	0	0	0	111	Y255 S428 K432 L433 L434	Y255-L430 HydrophobicContact CD2-CB 4.4Å; Y255-L430 HydrophobicContact CD2-CD2 4.26Å; S428-L430 VanDerWaalsContact C-N 3.27Å; S428-L430 PolarHBondContact O-N 3Å; L430-K432 PolarHBondContact O-N 3.15Å; L430-L433 PolarHBondContact O-N 2.84Å; L430-L434 HydrophobicContact CD1-CD1 4.45Å; L430-L434 HydrophobicContact CD1-CG 4.37Å; L430-L434 HydrophobicContact CG-CD1 4.31Å; L430-L434 VanDerWaalsContact O-CG 3.32Å; L430-L434 WeakPolarHBondContact O-CG 3.24Å; L430-L434 PolarHBondContact O-N 3.06Å
431	E	92	Very high	85.1	Confident	43 Å²	43	61.2 Å²	61.2	20%	0.201	30%	0.304	C	S	.	.	H	α-helix	trans	-65.8	-38.5	178.9	-69	165	113.3	0	0	112.5	Y259 Q427 S428 H429 L433 L434 R435	Y259-E431 WeakPolarHBondContact CE2-OE2 3.47Å; Y259-E431 PolarHBondContact OH-OE1 2.91Å; Y259-E431 PolarHBondContact OH-OE2 2.98Å; Q427-E431 HydrophobicContact CB-CB 4.41Å; S428-E431 WeakPolarHBondContact CB-OE2 3.46Å; S428-E431 PolarHBondContact N-OE2 3.4Å; S428-E431 PolarHBondContact O-N 2.91Å; S428-E431 VanDerWaalsContact OG-CG 3.32Å; S428-E431 WeakPolarHBondContact OG-CG 3.44Å; S428-E431 PolarHBondContact OG-N 3.24Å; S428-E431 PolarHBondContact OG-OE2 2.97Å; H429-E431 PolarHBondContact O-N 3.42Å; E431-L433 VanDerWaalsContact C-N 3.33Å; E431-L433 PolarHBondContact O-N 3.45Å; E431-L434 PolarHBondContact O-N 2.84Å; E431-R435 WeakPolarHBondContact O-CB 3.27Å; E431-R435 WeakPolarHBondContact O-CG 3.31Å; E431-R435 PolarHBondContact O-N 2.7Å
432	K	90.9	Very high	86.9	Confident	69 Å²	69	61.8 Å²	61.8	30%	0.3	31%	0.309	S	S	.	.	H	α-helix	trans	-59.4	-44.8	173.5	-69.8	173.3	-172	169	0	111.1	Q427 S428 H429 L430 R435 Q436	Q427-K432 HydrophobicContact CB-CG 4.29Å; Q427-K432 WeakPolarHBondContact O-CE 3.28Å; S428-K432 WeakPolarHBondContact O-CG 3.34Å; S428-K432 PolarHBondContact O-N 2.88Å; H429-K432 PolarHBondContact O-N 2.94Å; L430-K432 PolarHBondContact O-N 3.15Å; K432-R435 PolarHBondContact O-N 2.99Å; K432-Q436 WeakPolarHBondContact O-CB 3.42Å; K432-Q436 PolarHBondContact O-N 3.2Å
433	L	92.3	Very high	88.9	Confident	78 Å²	78	57.9 Å²	57.9	41%	0.408	30%	0.299	S	S	.	.	H	α-helix	trans	-64.9	-41.2	176.5	-72.1	174.2	0	0	0	112.2	L251 H429 L430 E431 R435 Q436 L437	L251-L433 HydrophobicContact CD1-CD1 3.8Å; L251-L433 HydrophobicContact CD2-CD1 3.51Å; L251-L433 HydrophobicContact CG-CD1 4.31Å; H429-L433 WeakPolarHBondContact O-CG 3.29Å; H429-L433 PolarHBondContact O-N 2.99Å; L430-L433 PolarHBondContact O-N 2.84Å; E431-L433 VanDerWaalsContact C-N 3.33Å; E431-L433 PolarHBondContact O-N 3.45Å; L433-R435 VanDerWaalsContact C-N 3.33Å; L433-R435 PolarHBondContact O-N 2.95Å; L433-Q436 PolarHBondContact O-N 3.46Å; L433-L437 WeakPolarHBondContact O-CB 3.42Å; L433-L437 PolarHBondContact O-N 2.74Å
434	L	93.1	Very high	90.1	Very high	48 Å²	48	62 Å²	62	25%	0.251	30%	0.304	S	S	.	.	H	α-helix	trans	-66	-36.2	176.6	-68.2	178.7	0	0	0	112.2	L430 E431 T438 L457	L430-L434 HydrophobicContact CD1-CD1 4.45Å; L430-L434 HydrophobicContact CD1-CG 4.37Å; L430-L434 HydrophobicContact CG-CD1 4.31Å; L430-L434 VanDerWaalsContact O-CG 3.32Å; L430-L434 WeakPolarHBondContact O-CG 3.24Å; L430-L434 PolarHBondContact O-N 3.06Å; E431-L434 PolarHBondContact O-N 2.84Å; L434-T438 WeakPolarHBondContact O-CB 3.1Å; L434-T438 PolarHBondContact O-N 3.13Å; L434-T438 PolarHBondContact O-OG1 3.19Å; L434-L457 HydrophobicContact CB-CD2 3.98Å; L434-L457 HydrophobicContact CD1-CD2 4.37Å; L434-L457 HydrophobicContact CD2-CD1 3.95Å
435	R	91.9	Very high	91.3	Very high	134 Å²	134	63.6 Å²	63.6	51%	0.506	31%	0.309	S	S	.	.	H	α-helix	trans	-66.4	-46.1	171.8	-75.3	174.8	178.7	-102.1	0.9	111.2	E431 K432 L433 L437 T438 V439	E431-R435 WeakPolarHBondContact O-CB 3.27Å; E431-R435 WeakPolarHBondContact O-CG 3.31Å; E431-R435 PolarHBondContact O-N 2.7Å; K432-R435 PolarHBondContact O-N 2.99Å; L433-R435 VanDerWaalsContact C-N 3.33Å; L433-R435 PolarHBondContact O-N 2.95Å; R435-L437 VanDerWaalsContact C-N 3.34Å; R435-L437 PolarHBondContact O-N 2.57Å; R435-T438 WeakPolarHBondContact O-CB 3.49Å; R435-T438 PolarHBondContact O-N 3.2Å; R435-T438 VanDerWaalsContact O-N 3.16Å; R435-V439 WeakPolarHBondContact O-CG2 3.21Å; R435-V439 PolarHBondContact O-N 2.89Å
436	Q	93.9	Very high	92.2	Very high	118 Å²	118	66 Å²	66	55%	0.551	33%	0.327	S	S	*	.	H	α-helix	trans	-58.5	-46.3	175.7	-175.9	179.4	-2.1	0	0	111	K432 L433 T438 V439 C440	K432-Q436 WeakPolarHBondContact O-CB 3.42Å; K432-Q436 PolarHBondContact O-N 3.2Å; L433-Q436 PolarHBondContact O-N 3.46Å; Q436-T438 VanDerWaalsContact C-N 3.32Å; Q436-T438 PolarHBondContact O-N 3.18Å; Q436-V439 PolarHBondContact O-N 3.38Å; Q436-C440 WeakPolarHBondContact O-CB 3.21Å; Q436-C440 PolarHBondContact O-N 2.91Å; Q436-C440 PolarHBondContact O-SG 3.3Å
437	L	94.5	Very high	92.6	Very high	77 Å²	77	71.2 Å²	71.2	40%	0.403	35%	0.354	S	S	.	.	H	α-helix	trans	-55.1	-48.9	173.9	174	62.3	0	0	0	111.1	L433 R435 V439 C440 C441 F455	L433-L437 WeakPolarHBondContact O-CB 3.42Å; L433-L437 PolarHBondContact O-N 2.74Å; R435-L437 VanDerWaalsContact C-N 3.34Å; R435-L437 PolarHBondContact O-N 2.57Å; L437-V439 PolarHBondContact O-N 3.03Å; L437-C440 PolarHBondContact O-N 3.33Å; L437-C441 WeakPolarHBondContact O-CB 3.46Å; L437-C441 PolarHBondContact O-N 3.41Å; L437-C441 PolarHBondContact O-SG 2.7Å; L437-F455 HydrophobicContact CD2-CE2 4.33Å; L437-F455 HydrophobicContact CD2-CZ 3.78Å; L437-F455 HydrophobicContact CG-CE1 4.39Å; L437-F455 HydrophobicContact CG-CE2 4.28Å; L437-F455 HydrophobicContact CG-CZ 3.73Å
438	T	94.4	Very high	92.8	Very high	37 Å²	37	71.7 Å²	71.7	23%	0.227	36%	0.358	C	S	.	.	H	α-helix	trans	-58.4	-48.9	178.6	-56.2	0	0	0	0	111.3	L434 R435 Q436 C441 L442 F455	L434-T438 WeakPolarHBondContact O-CB 3.1Å; L434-T438 PolarHBondContact O-N 3.13Å; L434-T438 PolarHBondContact O-OG1 3.19Å; R435-T438 WeakPolarHBondContact O-CB 3.49Å; R435-T438 PolarHBondContact O-N 3.2Å; R435-T438 VanDerWaalsContact O-N 3.16Å; Q436-T438 VanDerWaalsContact C-N 3.32Å; Q436-T438 PolarHBondContact O-N 3.18Å; T438-C441 PolarHBondContact O-N 2.98Å; T438-L442 HydrophobicContact CG2-CD1 4.1Å; T438-L442 VanDerWaalsContact O-CG 3.3Å; T438-L442 WeakPolarHBondContact O-CG 3.5Å; T438-L442 PolarHBondContact O-N 3.26Å; T438-F455 HydrophobicContact CG2-CD1 4.26Å; T438-F455 HydrophobicContact CG2-CE1 4.29Å
439	V	95.1	Very high	92.9	Very high	90 Å²	90	73.3 Å²	73.3	55%	0.545	37%	0.374	S	S	.	.	H	α-helix	trans	-63.4	-45.8	178.8	172.9	0	0	0	0	111.3	R435 Q436 L437 C441 L442 E443	R435-V439 WeakPolarHBondContact O-CG2 3.21Å; R435-V439 PolarHBondContact O-N 2.89Å; Q436-V439 PolarHBondContact O-N 3.38Å; L437-V439 PolarHBondContact O-N 3.03Å; V439-C441 VanDerWaalsContact C-N 3.3Å; V439-C441 PolarHBondContact O-N 3.49Å; V439-L442 PolarHBondContact O-N 2.51Å; V439-E443 WeakPolarHBondContact O-CB 2.99Å; V439-E443 PolarHBondContact O-N 3.07Å
440	C	95.9	Very high	93.1	Very high	68 Å²	68	75 Å²	75	46%	0.459	39%	0.385	S	S	.	.	H	α-helix	trans	-59.9	-40.2	177	-71.2	0	0	0	0	111.9	Q436 L437 R444	Q436-C440 WeakPolarHBondContact O-CB 3.21Å; Q436-C440 PolarHBondContact O-N 2.91Å; Q436-C440 PolarHBondContact O-SG 3.3Å; L437-C440 PolarHBondContact O-N 3.33Å; C440-R444 VanDerWaalsContact O-CB 3.25Å; C440-R444 WeakPolarHBondContact O-CB 3.2Å; C440-R444 PolarHBondContact O-N 3.4Å
441	C	93.8	Very high	93.2	Very high	18 Å²	18	72.5 Å²	72.5	12%	0.122	37%	0.372	C	S	.	.	H	α-helix	trans	-67.5	-41.4	176.2	-71.2	0	0	0	0	112.5	L437 T438 V439 R445 F455	L437-C441 WeakPolarHBondContact O-CB 3.46Å; L437-C441 PolarHBondContact O-N 3.41Å; L437-C441 PolarHBondContact O-SG 2.7Å; T438-C441 PolarHBondContact O-N 2.98Å; V439-C441 VanDerWaalsContact C-N 3.3Å; V439-C441 PolarHBondContact O-N 3.49Å; C441-R445 WeakPolarHBondContact O-CB 3.48Å; C441-R445 PolarHBondContact O-N 2.88Å; C441-R445 VanDerWaalsContact O-N 3.11Å; C441-F455 HydrophobicContact CB-CB 3.52Å; C441-F455 HydrophobicContact CB-CD1 3.85Å; C441-F455 HydrophobicContact CB-CD2 3.92Å; C441-F455 HydrophobicContact CB-CG 3.48Å; C441-F455 VanDerWaalsContact CB-CG 3.48Å; C441-F455 VanDerWaalsContact SG-CD2 3.54Å
442	L	93.2	Very high	93.2	Very high	91 Å²	91	70.8 Å²	70.8	48%	0.476	37%	0.366	S	S	.	.	H	α-helix	trans	-64.9	-45.3	175.7	-70.5	172.6	0	0	0	111.5	T438 V439 R445 S446	T438-L442 HydrophobicContact CG2-CD1 4.1Å; T438-L442 VanDerWaalsContact O-CG 3.3Å; T438-L442 WeakPolarHBondContact O-CG 3.5Å; T438-L442 PolarHBondContact O-N 3.26Å; V439-L442 PolarHBondContact O-N 2.51Å; L442-R445 WeakPolarHBondContact O-CB 3.39Å; L442-R445 PolarHBondContact O-N 2.8Å; L442-R445 VanDerWaalsContact O-N 3.16Å; L442-S446 PolarHBondContact O-N 3.12Å
443	E	95.6	Very high	93.2	Very high	103 Å²	103	71.1 Å²	71.1	48%	0.481	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-45.6	178.3	-174.9	59.2	-154.6	0	0	111.2	V439 R445 S446 L447	V439-E443 WeakPolarHBondContact O-CB 2.99Å; V439-E443 PolarHBondContact O-N 3.07Å; E443-R445 PolarHBondContact O-N 3.24Å; E443-S446 WeakPolarHBondContact O-CB 3.45Å; E443-S446 PolarHBondContact O-N 2.93Å; E443-S446 VanDerWaalsContact O-N 3.08Å; E443-L447 HydrophobicContact CG-CD1 4.42Å; E443-L447 WeakPolarHBondContact O-CG 3.42Å; E443-L447 PolarHBondContact O-N 2.67Å
444	R	92.6	Very high	93.1	Very high	154 Å²	154	70 Å²	70	58%	0.581	37%	0.365	S	S	*	.	H	α-helix	trans	-55.8	-41.3	173.9	-177.1	-178.3	67.4	166.6	1.6	111.6	C440 N448	C440-R444 VanDerWaalsContact O-CB 3.25Å; C440-R444 WeakPolarHBondContact O-CB 3.2Å; C440-R444 PolarHBondContact O-N 3.4Å; R444-N448 PolarHBondContact O-N 2.97Å
445	R	92.3	Very high	93	Very high	41 Å²	41	69.7 Å²	69.7	16%	0.155	36%	0.361	C	S	.	.	H	α-helix	trans	-68.7	-39.8	176.9	-172.1	177.5	175.3	-78.9	-1.1	111.5	C441 L442 E443 N448 G449 D450 G452	C441-R445 WeakPolarHBondContact O-CB 3.48Å; C441-R445 PolarHBondContact O-N 2.88Å; C441-R445 VanDerWaalsContact O-N 3.11Å; L442-R445 WeakPolarHBondContact O-CB 3.39Å; L442-R445 PolarHBondContact O-N 2.8Å; L442-R445 VanDerWaalsContact O-N 3.16Å; E443-R445 PolarHBondContact O-N 3.24Å; R445-N448 CarbonylContact O-C 3.53Å; R445-N448 WeakPolarHBondContact O-CA 3.48Å; R445-N448 WeakPolarHBondContact O-CB 3.03Å; R445-N448 PolarHBondContact O-N 3.08Å; R445-N448 VanDerWaalsContact O-N 3.15Å; R445-G449 PolarHBondContact O-N 2.79Å; R445-D450 PolarHBondContact NH1-O 3.36Å; R445-D450 IonicContact NH1-OD1 2.98Å; R445-D450 PolarHBondContact NH2-O 3.31Å; R445-D450 WeakPolarHBondContact O-CA 3.19Å; R445-D450 PolarHBondContact O-N 3.26Å; R445-G452 PolarHBondContact NE-O 3.21Å
446	S	93.3	Very high	92.7	Very high	59 Å²	59	68.3 Å²	68.3	41%	0.413	36%	0.356	S	S	.	.	H	α-helix	trans	-62.5	-44.3	176	-170.9	0	0	0	0	112	L442 E443 N448 G449	L442-S446 PolarHBondContact O-N 3.12Å; E443-S446 WeakPolarHBondContact O-CB 3.45Å; E443-S446 PolarHBondContact O-N 2.93Å; E443-S446 VanDerWaalsContact O-N 3.08Å; S446-N448 PolarHBondContact O-N 3.37Å; S446-G449 WeakPolarHBondContact O-CA 3.31Å; S446-G449 PolarHBondContact O-N 2.83Å
447	L	92.4	Very high	92.4	Very high	120 Å²	120	65 Å²	65	63%	0.628	34%	0.342	S	S	*	.	H	α-helix	trans	-59.3	-29.8	174	-70.1	172.9	0	0	0	112.6	E443 G449	E443-L447 HydrophobicContact CG-CD1 4.42Å; E443-L447 WeakPolarHBondContact O-CG 3.42Å; E443-L447 PolarHBondContact O-N 2.67Å; L447-G449 PolarHBondContact O-N 3.3Å
448	N	92.1	Very high	92	Very high	49 Å²	49	70 Å²	70	26%	0.262	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	15.2	173.2	-75.7	-14.2	0	0	0	113.8	Q175 R444 R445 S446 Q451	Q175-N448 HydrophobicContact CG-CB 4.41Å; R444-N448 PolarHBondContact O-N 2.97Å; R445-N448 CarbonylContact O-C 3.53Å; R445-N448 WeakPolarHBondContact O-CA 3.48Å; R445-N448 WeakPolarHBondContact O-CB 3.03Å; R445-N448 PolarHBondContact O-N 3.08Å; R445-N448 VanDerWaalsContact O-N 3.15Å; S446-N448 PolarHBondContact O-N 3.37Å; N448-Q451 WeakPolarHBondContact O-CB 3.12Å; N448-Q451 PolarHBondContact O-N 3.36Å
449	G	91.3	Very high	91.4	Very high	34 Å²	34	73.6 Å²	73.6	35%	0.351	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	35.7	178.6	0	0	0	0	0	113.5	R445 S446 L447 Q451	R445-G449 PolarHBondContact O-N 2.79Å; S446-G449 WeakPolarHBondContact O-CA 3.31Å; S446-G449 PolarHBondContact O-N 2.83Å; L447-G449 PolarHBondContact O-N 3.3Å; G449-Q451 VanDerWaalsContact C-N 3.25Å; G449-Q451 WeakPolarHBondContact O-CG 3.31Å; G449-Q451 PolarHBondContact O-N 3.29Å
450	D	92.4	Very high	90.9	Very high	86 Å²	86	71.8 Å²	71.8	46%	0.46	36%	0.359	S	S	.	.	S	Bend	trans	61.7	29.5	-174	-64.4	-52.5	0	0	0	113.8	I95 R445	I95-D450 WeakPolarHBondContact CD1-O 3.32Å; R445-D450 PolarHBondContact NH1-O 3.36Å; R445-D450 IonicContact NH1-OD1 2.98Å; R445-D450 PolarHBondContact NH2-O 3.31Å; R445-D450 WeakPolarHBondContact O-CA 3.19Å; R445-D450 PolarHBondContact O-N 3.26Å
451	Q	93.8	Very high	90.3	Very high	5 Å²	5	73.1 Å²	73.1	2%	0.023	36%	0.36	C	S	.	.			trans	-113.2	145.7	179.9	-49.9	-174.8	-46.3	0	0	111.7	I95 Y172 G195 N448 G449	I95-Q451 HydrophobicContact CB-CB 4.26Å; I95-Q451 HydrophobicContact CB-CG 4.09Å; I95-Q451 HydrophobicContact CD1-CG 4.39Å; I95-Q451 HydrophobicContact CG2-CG 4.1Å; Y172-Q451 HydrophobicContact CD1-CB 3.61Å; Y172-Q451 HydrophobicContact CD1-CG 4.45Å; Y172-Q451 HydrophobicContact CE1-CB 4.04Å; Y172-Q451 HydrophobicContact CE1-CG 4.45Å; Y172-Q451 HydrophobicContact CG-CB 4.45Å; G195-Q451 PolarHBondContact O-NE2 2.85Å; G195-Q451 VanDerWaalsContact O-NE2 3.1Å; N448-Q451 WeakPolarHBondContact O-CB 3.12Å; N448-Q451 PolarHBondContact O-N 3.36Å; G449-Q451 VanDerWaalsContact C-N 3.25Å; G449-Q451 WeakPolarHBondContact O-CG 3.31Å; G449-Q451 PolarHBondContact O-N 3.29Å
452	G	93.2	Very high	89.5	Confident	7 Å²	7	77.4 Å²	77.4	7%	0.072	38%	0.382	C	S	.	.	S	Bend	trans	110.4	169.6	-173.4	0	0	0	0	0	112.6	I95 C97 Y172 R445 T454	I95-G452 CarbonylContact O-C 3.43Å; I95-G452 WeakPolarHBondContact O-CA 3.4Å; I95-G452 PolarHBondContact O-N 2.84Å; C97-G452 CarbonylContact O-C 3.06Å; C97-G452 WeakPolarHBondContact O-CA 3.38Å; Y172-G452 VanDerWaalsContact CB-CA 3.5Å; R445-G452 PolarHBondContact NE-O 3.21Å; G452-T454 PolarHBondContact O-N 3.46Å
453	E	90.9	Very high	88.4	Confident	77 Å²	77	77.4 Å²	77.4	36%	0.36	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-51.3	134.1	179.7	-64.8	-169.7	107.2	0	0	112.2	C97 L98 R231 F455	C97-E453 VanDerWaalsContact C-CG 3.49Å; C97-E453 PolarHBondContact O-N 3.17Å; L98-E453 HydrophobicContact CB-CG 3.84Å; R231-E453 IonicContact CZ-OE1 3.66Å; R231-E453 IonicContact CZ-OE2 3.44Å; R231-E453 VanDerWaalsContact NH1-CD 3.3Å; R231-E453 IonicContact NH1-OE1 3.84Å; R231-E453 PolarHBondContact NH1-OE1 2.8Å; R231-E453 VanDerWaalsContact NH1-OE1 3.1Å; R231-E453 IonicContact NH1-OE2 2.58Å; R231-E453 PolarHBondContact NH1-OE2 3.47Å; R231-E453 IonicContact NH2-OE1 3.22Å; R231-E453 PolarHBondContact NH2-OE1 3.43Å; R231-E453 IonicContact NH2-OE2 2.7Å; E453-F455 PolarHBondContact O-N 3.27Å
454	T	90	Very high	86.4	Confident	55 Å²	55	79 Å²	79	34%	0.337	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-71.1	123.2	172.2	-55.3	0	0	0	0	109.3	G452 R456	G452-T454 PolarHBondContact O-N 3.46Å; T454-R456 HydrophobicContact CG2-CG 4.28Å
455	F	90.1	Very high	83.8	Confident	40 Å²	40	85 Å²	85	18%	0.175	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-78.5	123.2	171.8	-179.6	-94.8	0	0	0	110.3	L437 T438 C441 E453 L457 V460	L437-F455 HydrophobicContact CD2-CE2 4.33Å; L437-F455 HydrophobicContact CD2-CZ 3.78Å; L437-F455 HydrophobicContact CG-CE1 4.39Å; L437-F455 HydrophobicContact CG-CE2 4.28Å; L437-F455 HydrophobicContact CG-CZ 3.73Å; T438-F455 HydrophobicContact CG2-CD1 4.26Å; T438-F455 HydrophobicContact CG2-CE1 4.29Å; C441-F455 HydrophobicContact CB-CB 3.52Å; C441-F455 HydrophobicContact CB-CD1 3.85Å; C441-F455 HydrophobicContact CB-CD2 3.92Å; C441-F455 HydrophobicContact CB-CG 3.48Å; C441-F455 VanDerWaalsContact CB-CG 3.48Å; C441-F455 VanDerWaalsContact SG-CD2 3.54Å; E453-F455 PolarHBondContact O-N 3.27Å; F455-L457 HydrophobicContact CE1-CB 4.13Å; F455-L457 HydrophobicContact CZ-CD1 4.43Å; F455-V460 HydrophobicContact CD2-CG2 4.28Å; F455-V460 HydrophobicContact CE2-CG2 3.78Å; F455-V460 HydrophobicContact CZ-CG2 4.35Å
456	R	86.7	Confident	83.4	Confident	106 Å²	106	87.2 Å²	87.2	40%	0.4	43%	0.43	S	S	.	.			trans	-127.1	113.3	171	-67.6	-171.3	179.2	-174.7	3.9	109.6	D44 T454 R458 H459 V460	D44-R456 IonicContact OD2-NH2 3.76Å; T454-R456 HydrophobicContact CG2-CG 4.28Å; R456-R458 VanDerWaalsContact C-N 3.29Å; R456-R458 PolarHBondContact O-N 2.85Å; R456-H459 HydrophobicContact CB-CB 3.99Å; R456-H459 WeakPolarHBondContact O-CB 3.49Å; R456-H459 PolarHBondContact O-N 2.76Å; R456-V460 PolarHBondContact O-N 2.96Å; R456-V460 VanDerWaalsContact O-N 3.14Å
457	L	87.8	Confident	82.9	Confident	47 Å²	47	88.6 Å²	88.6	25%	0.246	43%	0.431	C	S	.	.	H	α-helix	trans	-54.5	-43.9	-179.1	179	60.3	0	0	0	112.4	L434 F455 H459 V460 L461	L434-L457 HydrophobicContact CB-CD2 3.98Å; L434-L457 HydrophobicContact CD1-CD2 4.37Å; L434-L457 HydrophobicContact CD2-CD1 3.95Å; F455-L457 HydrophobicContact CE1-CB 4.13Å; F455-L457 HydrophobicContact CZ-CD1 4.43Å; L457-H459 VanDerWaalsContact C-N 3.31Å; L457-H459 PolarHBondContact O-N 3.06Å; L457-V460 PolarHBondContact O-N 3.46Å; L457-L461 HydrophobicContact CD1-CD1 4.06Å; L457-L461 HydrophobicContact CD1-CD2 4.44Å; L457-L461 HydrophobicContact CD1-CG 4.03Å; L457-L461 HydrophobicContact CG-CD1 3.93Å; L457-L461 HydrophobicContact CG-CG 4.33Å; L457-L461 VanDerWaalsContact O-CG 3.32Å; L457-L461 WeakPolarHBondContact O-CG 3.23Å; L457-L461 PolarHBondContact O-N 3.49Å
458	R	84.6	Confident	82.4	Confident	183 Å²	183	86.9 Å²	86.9	69%	0.691	42%	0.42	S	S	*	.	H	α-helix	trans	-58.1	-40.5	177.4	-69.6	-174.8	-174.1	161.6	2	113	R456 L461 N462	R456-R458 VanDerWaalsContact C-N 3.29Å; R456-R458 PolarHBondContact O-N 2.85Å; R458-L461 PolarHBondContact O-N 2.68Å; R458-N462 WeakPolarHBondContact O-CB 3.3Å; R458-N462 VanDerWaalsContact O-CG 3.24Å; R458-N462 PolarHBondContact O-N 3.03Å; R458-N462 PolarHBondContact O-ND2 2.8Å
459	H	82.8	Confident	81.8	Confident	113 Å²	113	89.1 Å²	89.1	52%	0.523	43%	0.43	S	S	.	.	H	α-helix	trans	-67.1	-42.8	179.3	-172.2	66.8	0	0	0	111.2	R456 L457 L461 N462 N463	R456-H459 HydrophobicContact CB-CB 3.99Å; R456-H459 WeakPolarHBondContact O-CB 3.49Å; R456-H459 PolarHBondContact O-N 2.76Å; L457-H459 VanDerWaalsContact C-N 3.31Å; L457-H459 PolarHBondContact O-N 3.06Å; H459-L461 VanDerWaalsContact C-N 3.33Å; H459-L461 PolarHBondContact O-N 3.13Å; H459-N462 PolarHBondContact O-N 3.35Å; H459-N463 PolarHBondContact CD2-ND2 2.7Å; H459-N463 PolarHBondContact CE1-ND2 3.01Å; H459-N463 PolarHBondContact ND1-ND2 3.05Å; H459-N463 PolarHBondContact NE2-ND2 3.11Å; H459-N463 WeakPolarHBondContact O-CB 3.28Å; H459-N463 PolarHBondContact O-N 3.02Å
460	V	83.7	Confident	81.2	Confident	52 Å²	52	92.6 Å²	92.6	32%	0.315	43%	0.434	S	S	.	.	H	α-helix	trans	-61.7	-42	176.1	177.2	0	0	0	0	111.3	F455 R456 L457 N464	F455-V460 HydrophobicContact CD2-CG2 4.28Å; F455-V460 HydrophobicContact CE2-CG2 3.78Å; F455-V460 HydrophobicContact CZ-CG2 4.35Å; R456-V460 PolarHBondContact O-N 2.96Å; R456-V460 VanDerWaalsContact O-N 3.14Å; L457-V460 PolarHBondContact O-N 3.46Å; V460-N464 PolarHBondContact O-ND2 3.1Å
461	L	82.9	Confident	80.5	Confident	95 Å²	95	93 Å²	93	50%	0.497	43%	0.433	S	S	.	.	H	α-helix	trans	-70	-32.4	179	-66	175.6	0	0	0	113.1	L457 R458 H459	L457-L461 HydrophobicContact CD1-CD1 4.06Å; L457-L461 HydrophobicContact CD1-CD2 4.44Å; L457-L461 HydrophobicContact CD1-CG 4.03Å; L457-L461 HydrophobicContact CG-CD1 3.93Å; L457-L461 HydrophobicContact CG-CG 4.33Å; L457-L461 VanDerWaalsContact O-CG 3.32Å; L457-L461 WeakPolarHBondContact O-CG 3.23Å; L457-L461 PolarHBondContact O-N 3.49Å; R458-L461 PolarHBondContact O-N 2.68Å; H459-L461 VanDerWaalsContact C-N 3.33Å; H459-L461 PolarHBondContact O-N 3.13Å
462	N	77.9	Confident	79.5	Confident	108 Å²	108	99.3 Å²	99.3	58%	0.578	46%	0.462	S	S	*	.	H	α-helix	trans	-85.2	-33.2	-177.8	-71.3	-12.8	0	0	0	113.7	R458 H459	R458-N462 WeakPolarHBondContact O-CB 3.3Å; R458-N462 VanDerWaalsContact O-CG 3.24Å; R458-N462 PolarHBondContact O-N 3.03Å; R458-N462 PolarHBondContact O-ND2 2.8Å; H459-N462 PolarHBondContact O-N 3.35Å
463	N	69.7	Low	78.5	Confident	92 Å²	92	106.4 Å²	106.4	49%	0.492	49%	0.492	S	S	.	.	H	α-helix	trans	-81.8	-9.9	-177.7	-74.4	6	0	0	0	114.6	H459 R465	H459-N463 PolarHBondContact CD2-ND2 2.7Å; H459-N463 PolarHBondContact CE1-ND2 3.01Å; H459-N463 PolarHBondContact ND1-ND2 3.05Å; H459-N463 PolarHBondContact NE2-ND2 3.11Å; H459-N463 WeakPolarHBondContact O-CB 3.28Å; H459-N463 PolarHBondContact O-N 3.02Å; N463-R465 PolarHBondContact O-N 2.8Å
464	N	53.4	Low	77.4	Confident	137 Å²	137	108.8 Å²	108.8	73%	0.733	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	15.8	175.4	-75	-19.6	0	0	0	112.7	V460	V460-N464 PolarHBondContact O-ND2 3.1Å
465	R	39.5	Very low	76.3	Confident	278 Å²	278	113.7 Å²	113.7	100%	1.049	52%	0.518	S	S	*	.			trans	-101.8	0	166.7	-65.8	-175.6	-178.3	-170.2	1.2	108.8	N463	N463-R465 PolarHBondContact O-N 2.8Å

Retrieved 465 of 465 residues in 258.9 ms (Link to these results)

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