A0A087YPP9_POEFO Loading...

Neuronal acetylcholine receptor subunit alpha-5

After binding acetylcholine, the AChR responds by an extensive change in conformation that affects all subunits and leads to opening of an ion-conducting channel across the plasma membrane. Component of neuronal acetylcholine receptors (nAChRs) that function as pentameric, ligand-gated cation channels with high calcium permeability among other activities. nAChRs are excitatory neurotrasnmitter receptors formed by a collection of nAChR subunits known to mediate synaptic transmission in the nervous system and the neuromuscular junction. Each nAchR subunit confers differential attributes to channel properties, including activation, deactivation and desensitization kinetics, pH sensitivity, cation permeability, and binding to allosteric modulators. Has an accessory rather than functional role and is only able to form functional nAChRs when co-assembled with another beta subunit. Participates in pentameric assemblies along with CHRNA3, CHRNA4, CHRNB2 and CHRNB4. Increases receptor sensitivity to acetylcholine and nicotine when associated with CHRNA4 and CHRNB2. Plays a role in nicotine addiction.

AlphaFold DB , UniProt , Accession A0A087YPP9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 464 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	L	37.7	Very low	30.7	Very low	237 Å²	237	154.8 Å²	154.8	100%	1.241	83%	0.832	S	S	*	*				0	100.3	0	-82	152.4	0	0	0	107
2	G	34.9	Very low	31.2	Very low	71 Å²	71	158.8 Å²	158.8	73%	0.732	84%	0.836	S	S	*	*			trans	-84.7	144.7	-168.6	0	0	0	0	0	113.3
3	Y	28.2	Very low	31.7	Very low	243 Å²	243	157.2 Å²	157.2	95%	0.953	83%	0.828	S	S	*	*			trans	-134.6	119.6	147	-88.8	-85.2	0	0	0	106.6
4	C	28	Very low	31.6	Very low	126 Å²	126	159.7 Å²	159.7	85%	0.851	82%	0.822	S	S	*	*			trans	-92.7	131.9	-178.4	-163.2	0	0	0	0	108.5
5	S	28.5	Very low	32.1	Very low	113 Å²	113	159.4 Å²	159.4	79%	0.79	82%	0.822	S	S	*	*			trans	-137.9	102.1	164.8	-77.8	0	0	0	0	108.7
6	I	30.8	Very low	32.4	Very low	157 Å²	157	155.2 Å²	155.2	81%	0.805	81%	0.81	S	S	*	*			trans	29.7	121.2	135.8	-52	165.3	0	0	0	116.7
7	S	27.8	Very low	32.7	Very low	97 Å²	97	154.8 Å²	154.8	68%	0.678	82%	0.816	S	S	*	*				-178.1	117	125.4	177.3	0	0	0	0	113.3
8	Y	28.3	Very low	33.1	Very low	216 Å²	216	155.4 Å²	155.4	85%	0.847	81%	0.811	S	S	*	*			trans	57	123.1	144.7	-71.1	-107.7	0	0	0	120.7
9	S	29	Very low	33.3	Very low	99 Å²	99	152.2 Å²	152.2	69%	0.692	80%	0.803	S	S	*	*				173.3	126	105.7	-168.8	0	0	0	0	113.8
10	T	32.6	Very low	33.5	Very low	112 Å²	112	153.1 Å²	153.1	69%	0.687	80%	0.802	S	S	*	*			trans	73.3	117.2	139.1	48.9	0	0	0	0	124.1
11	R	32.4	Very low	34	Very low	232 Å²	232	152.6 Å²	152.6	88%	0.875	80%	0.799	S	S	*	*			trans	74	107.5	130	-72.9	-177.5	177.2	-160.9	-0.5	120.4
12	K	36.2	Very low	34	Very low	202 Å²	202	146.5 Å²	146.5	88%	0.878	78%	0.776	S	S	*	*				175.6	97.6	118.4	-95.6	170.1	179.7	-177.1	0	108.8
13	L	37.3	Very low	34.3	Very low	139 Å²	139	151.7 Å²	151.7	73%	0.728	78%	0.781	S	S	*	*				42.2	104.4	108	-106	106.5	0	0	0	114.9
14	Y	31.1	Very low	35.4	Very low	192 Å²	192	146.2 Å²	146.2	75%	0.753	77%	0.772	S	S	*	*				167.3	131.4	102.7	-101.5	-75.6	0	0	0	112.5
15	L	38.4	Very low	36.3	Very low	155 Å²	155	145.6 Å²	145.6	81%	0.812	77%	0.767	S	S	*	*			trans	72	133.2	145.5	-77.4	147.8	0	0	0	121.8
16	S	37.4	Very low	37.6	Very low	92 Å²	92	147 Å²	147	64%	0.643	77%	0.766	S	S	*	*			trans	83.1	73.7	151.2	-179.4	0	0	0	0	117.7
17	V	37.5	Very low	38.6	Very low	149 Å²	149	144.6 Å²	144.6	90%	0.903	75%	0.754	S	S	*	*			trans	-113.7	98.4	141.7	-178.9	0	0	0	0	107.1	S19	V17-S19 PolarHBondContact O-N 3.2Å
18	F	39.8	Very low	40.6	Very low	166 Å²	166	143.3 Å²	143.3	73%	0.728	75%	0.745	S	S	*	*			trans	-48	117	170.7	-109.5	-102.3	0	0	0	110.1	H20	F18-H20 VanDerWaalsContact C-N 3.35Å; F18-H20 PolarHBondContact O-N 3.45Å
19	S	37.5	Very low	42.8	Very low	93 Å²	93	136.6 Å²	136.6	65%	0.65	73%	0.729	S	S	*	*			trans	-60.4	93.6	156.2	50.5	0	0	0	0	109.2	V17 I21	V17-S19 PolarHBondContact O-N 3.2Å; S19-I21 PolarHBondContact O-N 3.21Å; S19-I21 VanDerWaalsContact O-N 3.09Å
20	H	36	Very low	45.4	Very low	170 Å²	170	138.8 Å²	138.8	79%	0.787	72%	0.723	S	S	*	*			trans	-78.2	77.1	155.7	-96	5.9	0	0	0	107.8	F18 S22	F18-H20 VanDerWaalsContact C-N 3.35Å; F18-H20 PolarHBondContact O-N 3.45Å; H20-S22 PolarHBondContact O-N 3.43Å
21	I	44.1	Very low	47.9	Very low	144 Å²	144	135 Å²	135	74%	0.738	70%	0.703	S	S	*	*			trans	-73.2	108.2	152.5	-65.8	173	0	0	0	103.9	S19 E23	S19-I21 PolarHBondContact O-N 3.21Å; S19-I21 VanDerWaalsContact O-N 3.09Å; I21-E23 PolarHBondContact O-N 3.23Å
22	S	37.4	Very low	50.5	Low	109 Å²	109	128.6 Å²	128.6	76%	0.762	68%	0.682	S	S	*	*			trans	-57.2	102	169.1	-64.6	0	0	0	0	108.3	H20 V24	H20-S22 PolarHBondContact O-N 3.43Å; S22-V24 PolarHBondContact O-N 2.79Å
23	E	42.8	Very low	53.1	Low	179 Å²	179	119.6 Å²	119.6	84%	0.836	65%	0.645	S	S	*	*			trans	-56.8	109.4	162.9	-77.9	-177.4	151.5	0	0	107.2	I21 P25	I21-E23 PolarHBondContact O-N 3.23Å; E23-P25 WeakPolarHBondContact O-CD 3.45Å
24	V	50.8	Low	55.6	Low	128 Å²	128	117.1 Å²	117.1	78%	0.776	63%	0.63	S	S	*	*			trans	-55.7	120.5	160.8	-179.5	0	0	0	0	105.2	S22 N26	S22-V24 PolarHBondContact O-N 2.79Å; V24-N26 PolarHBondContact O-N 2.78Å; V24-N26 VanDerWaalsContact O-N 3.08Å
25	P	45.9	Very low	58.6	Low	114 Å²	114	111.7 Å²	111.7	74%	0.74	61%	0.614	S	S	*	*			trans	-56.7	124.5	-176.2	20.5	-30	0	0	0	108	E23 L27	E23-P25 WeakPolarHBondContact O-CD 3.45Å; P25-L27 VanDerWaalsContact C-N 3.32Å; P25-L27 PolarHBondContact O-N 3.17Å
26	N	55.5	Low	61.2	Low	143 Å²	143	110.9 Å²	110.9	77%	0.765	60%	0.604	S	S	*	*			trans	-58.8	97.4	178.5	-116.9	-30.9	0	0	0	107.7	V24 S28 K32	V24-N26 PolarHBondContact O-N 2.78Å; V24-N26 VanDerWaalsContact O-N 3.08Å; N26-S28 PolarHBondContact O-N 3.36Å; N26-S28 VanDerWaalsContact O-N 3.11Å; N26-K32 PolarHBondContact OD1-NZ 2.81Å; N26-K32 VanDerWaalsContact OD1-NZ 3.14Å
27	L	53.5	Low	63.9	Low	106 Å²	106	106.5 Å²	106.5	56%	0.555	57%	0.573	S	S	*	*			trans	-45.7	123.3	173	-170.5	77.7	0	0	0	107	P25 S29 A31 K32	P25-L27 VanDerWaalsContact C-N 3.32Å; P25-L27 PolarHBondContact O-N 3.17Å; L27-S29 PolarHBondContact O-N 3.14Å; L27-A31 HydrophobicContact CD1-CB 4.25Å; L27-A31 HydrophobicContact CD2-CB 4.09Å; L27-A31 HydrophobicContact CG-CB 3.82Å; L27-K32 HydrophobicContact CB-CG 4.24Å; L27-K32 HydrophobicContact CD2-CG 3.95Å; L27-K32 HydrophobicContact CG-CG 4.38Å; L27-K32 VanDerWaalsContact O-CE 3.25Å; L27-K32 WeakPolarHBondContact O-CE 3.34Å
28	S	68.4	Low	66.6	Low	69 Å²	69	101.9 Å²	101.9	48%	0.483	54%	0.541	S	S	.	.			trans	-48.1	140.1	-169.6	73.2	0	0	0	0	110.1	N26 Y30 A31 K32	N26-S28 PolarHBondContact O-N 3.36Å; N26-S28 VanDerWaalsContact O-N 3.11Å; S28-Y30 PolarHBondContact O-N 3.26Å; S28-A31 PolarHBondContact O-N 3.21Å; S28-A31 PolarHBondContact OG-N 3.18Å; S28-K32 PolarHBondContact O-N 3.15Å
29	S	75.7	Confident	69.1	Low	75 Å²	75	99.9 Å²	99.9	52%	0.524	53%	0.532	S	S	.	.	H	α-helix	trans	-48.3	-34.2	-178.9	52.6	0	0	0	0	112.4	L27 A33	L27-S29 PolarHBondContact O-N 3.14Å; S29-A33 WeakPolarHBondContact O-CB 3.17Å; S29-A33 PolarHBondContact O-N 3.21Å
30	Y	82.1	Confident	71.8	Confident	145 Å²	145	102.6 Å²	102.6	57%	0.569	53%	0.529	S	S	*	.	H	α-helix	trans	-63	-49.6	173.5	-74.6	-76.8	0	0	0	114	S28 K32 A33 E34 L103	S28-Y30 PolarHBondContact O-N 3.26Å; Y30-K32 VanDerWaalsContact C-N 3.28Å; Y30-K32 PolarHBondContact O-N 3.32Å; Y30-A33 PolarHBondContact O-N 3.23Å; Y30-A33 VanDerWaalsContact O-N 3.12Å; Y30-E34 WeakPolarHBondContact O-CB 3.26Å; Y30-E34 PolarHBondContact O-N 3.3Å; Y30-L103 HydrophobicContact CE1-CB 4.26Å
31	A	85.8	Confident	74.6	Confident	32 Å²	32	95 Å²	95	26%	0.264	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-34.4	179.1	0	0	0	0	0	112.1	L27 S28 D35	L27-A31 HydrophobicContact CD1-CB 4.25Å; L27-A31 HydrophobicContact CD2-CB 4.09Å; L27-A31 HydrophobicContact CG-CB 3.82Å; S28-A31 PolarHBondContact O-N 3.21Å; S28-A31 PolarHBondContact OG-N 3.18Å; A31-D35 WeakPolarHBondContact O-CB 3.46Å; A31-D35 PolarHBondContact O-N 2.82Å
32	K	88.3	Confident	77.1	Confident	99 Å²	99	90.1 Å²	90.1	43%	0.43	47%	0.468	S	S	.	.	H	α-helix	trans	-67.2	-39.4	172.4	-68.6	-180	-177.2	171.4	0	112.2	N26 L27 S28 Y30 K36	N26-K32 PolarHBondContact OD1-NZ 2.81Å; N26-K32 VanDerWaalsContact OD1-NZ 3.14Å; L27-K32 HydrophobicContact CB-CG 4.24Å; L27-K32 HydrophobicContact CD2-CG 3.95Å; L27-K32 HydrophobicContact CG-CG 4.38Å; L27-K32 VanDerWaalsContact O-CE 3.25Å; L27-K32 WeakPolarHBondContact O-CE 3.34Å; S28-K32 PolarHBondContact O-N 3.15Å; Y30-K32 VanDerWaalsContact C-N 3.28Å; Y30-K32 PolarHBondContact O-N 3.32Å; K32-K36 WeakPolarHBondContact O-CB 3.25Å; K32-K36 PolarHBondContact O-N 3.16Å
33	A	88.9	Confident	79.7	Confident	13 Å²	13	92 Å²	92	11%	0.107	47%	0.465	C	S	.	.	H	α-helix	trans	-69.6	-40.6	177.4	0	0	0	0	0	112.2	S29 Y30 K36 L37 L103 I105	S29-A33 WeakPolarHBondContact O-CB 3.17Å; S29-A33 PolarHBondContact O-N 3.21Å; Y30-A33 PolarHBondContact O-N 3.23Å; Y30-A33 VanDerWaalsContact O-N 3.12Å; A33-K36 PolarHBondContact O-N 3.06Å; A33-L37 WeakPolarHBondContact O-CB 3.46Å; A33-L37 PolarHBondContact O-N 3.32Å; A33-L103 HydrophobicContact CB-CB 4.42Å; A33-L103 HydrophobicContact CB-CD1 3.62Å; A33-L103 HydrophobicContact CB-CG 3.99Å; A33-I105 HydrophobicContact CB-CD1 4.24Å
34	E	91.4	Very high	81.9	Confident	87 Å²	87	91 Å²	91	41%	0.407	47%	0.465	S	S	.	.	H	α-helix	trans	-65	-42.4	175.6	-169.2	175.4	-170.1	0	0	111.4	Y30 K36 L37 F38 I105 I108	Y30-E34 WeakPolarHBondContact O-CB 3.26Å; Y30-E34 PolarHBondContact O-N 3.3Å; E34-K36 PolarHBondContact O-N 2.86Å; E34-L37 PolarHBondContact O-N 2.96Å; E34-F38 WeakPolarHBondContact O-CB 3.43Å; E34-F38 PolarHBondContact O-N 3.39Å; E34-I105 HydrophobicContact CB-CD1 4Å; E34-I108 HydrophobicContact CG-CG2 4.43Å
35	D	92.3	Very high	84	Confident	78 Å²	78	86.2 Å²	86.2	42%	0.417	43%	0.433	S	S	.	.	H	α-helix	trans	-62.3	-40.5	173.5	178	64	0	0	0	112.1	A31 F38 K39	A31-D35 WeakPolarHBondContact O-CB 3.46Å; A31-D35 PolarHBondContact O-N 2.82Å; D35-F38 PolarHBondContact O-N 2.93Å; D35-K39 WeakPolarHBondContact O-CG 3.07Å; D35-K39 PolarHBondContact O-N 2.95Å; D35-K39 IonicContact OD1-NZ 2.71Å; D35-K39 WeakPolarHBondContact OD2-CE 3.36Å; D35-K39 IonicContact OD2-NZ 2.64Å; D35-K39 PolarHBondContact OD2-NZ 2.8Å
36	K	93.1	Very high	86.3	Confident	138 Å²	138	85.4 Å²	85.4	60%	0.6	42%	0.42	S	S	*	.	H	α-helix	trans	-62.4	-44.4	174.3	-173.1	-172.2	176.5	-167.1	0	111.5	K32 A33 E34 K39 Y40 F102	K32-K36 WeakPolarHBondContact O-CB 3.25Å; K32-K36 PolarHBondContact O-N 3.16Å; A33-K36 PolarHBondContact O-N 3.06Å; E34-K36 PolarHBondContact O-N 2.86Å; K36-K39 PolarHBondContact O-N 2.91Å; K36-Y40 WeakPolarHBondContact O-CB 3.41Å; K36-Y40 PolarHBondContact O-N 2.9Å; K36-F102 HydrophobicContact CD-CE1 4.45Å; K36-F102 HydrophobicContact CG-CE1 4.36Å
37	L	94.4	Very high	88.1	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-61.5	-45.7	175.7	175.9	61.5	0	0	0	111	A33 E34 K39 Y40 L41 W97 F102 I105 I108	A33-L37 WeakPolarHBondContact O-CB 3.46Å; A33-L37 PolarHBondContact O-N 3.32Å; E34-L37 PolarHBondContact O-N 2.96Å; L37-K39 VanDerWaalsContact C-N 3.33Å; L37-K39 PolarHBondContact O-N 2.89Å; L37-Y40 WeakPolarHBondContact O-CB 3.33Å; L37-Y40 PolarHBondContact O-N 3.32Å; L37-Y40 VanDerWaalsContact O-N 3.15Å; L37-L41 HydrophobicContact CD1-CD1 3.88Å; L37-L41 HydrophobicContact CD1-CD2 4.44Å; L37-L41 HydrophobicContact CD1-CG 3.92Å; L37-L41 HydrophobicContact CG-CD1 3.98Å; L37-L41 HydrophobicContact CG-CG 4.38Å; L37-L41 WeakPolarHBondContact O-CG 3.5Å; L37-L41 PolarHBondContact O-N 3.01Å; L37-W97 HydrophobicContact CD1-CB 3.84Å; L37-W97 HydrophobicContact CD1-CD2 4.04Å; L37-W97 HydrophobicContact CD1-CG 3.66Å; L37-W97 HydrophobicContact CD2-CD2 4.09Å; L37-W97 HydrophobicContact CD2-CG 4.29Å; L37-W97 HydrophobicContact CD2-CZ2 4.22Å; L37-F102 HydrophobicContact CB-CD1 3.65Å; L37-F102 HydrophobicContact CB-CE1 3.87Å; L37-F102 HydrophobicContact CB-CG 4.12Å; L37-F102 HydrophobicContact CD1-CD1 4.11Å; L37-F102 HydrophobicContact CD1-CD2 3.77Å; L37-F102 HydrophobicContact CD1-CE1 4.01Å; L37-F102 HydrophobicContact CD1-CE2 3.67Å; L37-F102 HydrophobicContact CD1-CG 3.98Å; L37-F102 HydrophobicContact CD1-CZ 3.79Å; L37-F102 HydrophobicContact CG-CD1 4.41Å; L37-F102 HydrophobicContact CG-CG 4.45Å; L37-I105 HydrophobicContact CD2-CB 4.48Å; L37-I105 HydrophobicContact CD2-CG2 3.97Å; L37-I108 HydrophobicContact CD2-CG2 3.75Å
38	F	94.3	Very high	90	Very high	51 Å²	51	85.6 Å²	85.6	22%	0.224	40%	0.404	C	S	.	.	H	α-helix	trans	-60.3	-44.6	179.2	-159.3	-80.2	0	0	0	111.2	E34 D35 Y40 L41 F42 V110	E34-F38 WeakPolarHBondContact O-CB 3.43Å; E34-F38 PolarHBondContact O-N 3.39Å; D35-F38 PolarHBondContact O-N 2.93Å; F38-Y40 VanDerWaalsContact C-N 3.35Å; F38-Y40 PolarHBondContact O-N 3.12Å; F38-L41 PolarHBondContact O-N 3.36Å; F38-F42 AromaticContact CD1-CD2 3.71Å; F38-F42 HydrophobicContact CD1-CD2 3.71Å; F38-F42 HydrophobicContact CD1-CE2 4.39Å; F38-F42 HydrophobicContact CD1-CG 4.49Å; F38-F42 HydrophobicContact CD2-CD2 4.22Å; F38-F42 HydrophobicContact CD2-CE2 4.13Å; F38-F42 AromaticContact CE1-CD2 3.55Å; F38-F42 HydrophobicContact CE1-CD2 3.55Å; F38-F42 HydrophobicContact CE1-CE2 4.09Å; F38-F42 HydrophobicContact CE1-CG 4.14Å; F38-F42 HydrophobicContact CE2-CD2 4.1Å; F38-F42 AromaticContact CE2-CE2 3.83Å; F38-F42 HydrophobicContact CE2-CE2 3.83Å; F38-F42 HydrophobicContact CG-CD2 4.04Å; F38-F42 HydrophobicContact CG-CE2 4.4Å; F38-F42 AromaticContact CZ-CD2 3.76Å; F38-F42 HydrophobicContact CZ-CD2 3.76Å; F38-F42 AromaticContact CZ-CE2 3.8Å; F38-F42 HydrophobicContact CZ-CE2 3.8Å; F38-F42 VanDerWaalsContact O-CD2 3.3Å; F38-F42 WeakPolarHBondContact O-CD2 3.27Å; F38-F42 PolarHBondContact O-N 2.98Å; F38-F42 VanDerWaalsContact O-N 3.11Å; F38-V110 HydrophobicContact CE2-CG1 4.13Å; F38-V110 HydrophobicContact CE2-CG2 4.09Å; F38-V110 HydrophobicContact CZ-CG1 4.22Å
39	K	93.9	Very high	91.1	Very high	125 Å²	125	86 Å²	86	54%	0.543	40%	0.403	S	S	.	.	H	α-helix	trans	-62	-41.9	174.7	-74.3	168.4	-180	162.8	0	112.2	D35 K36 L37 Q43	D35-K39 WeakPolarHBondContact O-CG 3.07Å; D35-K39 PolarHBondContact O-N 2.95Å; D35-K39 IonicContact OD1-NZ 2.71Å; D35-K39 WeakPolarHBondContact OD2-CE 3.36Å; D35-K39 IonicContact OD2-NZ 2.64Å; D35-K39 PolarHBondContact OD2-NZ 2.8Å; K36-K39 PolarHBondContact O-N 2.91Å; L37-K39 VanDerWaalsContact C-N 3.33Å; L37-K39 PolarHBondContact O-N 2.89Å; K39-Q43 WeakPolarHBondContact O-CB 3.25Å; K39-Q43 PolarHBondContact O-N 3.44Å
40	Y	94.3	Very high	92	Very high	149 Å²	149	84 Å²	84	58%	0.584	38%	0.384	S	S	*	.	H	α-helix	trans	-61.5	-48.8	178.3	174.5	-102.6	0	0	0	112.3	K36 L37 F38 F102	K36-Y40 WeakPolarHBondContact O-CB 3.41Å; K36-Y40 PolarHBondContact O-N 2.9Å; L37-Y40 WeakPolarHBondContact O-CB 3.33Å; L37-Y40 PolarHBondContact O-N 3.32Å; L37-Y40 VanDerWaalsContact O-N 3.15Å; F38-Y40 VanDerWaalsContact C-N 3.35Å; F38-Y40 PolarHBondContact O-N 3.12Å; Y40-F102 HydrophobicContact CD1-CE2 4.48Å; Y40-F102 HydrophobicContact CD1-CZ 4Å; Y40-F102 HydrophobicContact CG-CZ 4.17Å
41	L	94.8	Very high	92.5	Very high	12 Å²	12	77.2 Å²	77.2	6%	0.063	36%	0.358	C	S	.	.	H	α-helix	trans	-67.4	-39.6	-178	-68.1	175.6	0	0	0	112.7	L37 F38 L95 W97 I108	L37-L41 HydrophobicContact CD1-CD1 3.88Å; L37-L41 HydrophobicContact CD1-CD2 4.44Å; L37-L41 HydrophobicContact CD1-CG 3.92Å; L37-L41 HydrophobicContact CG-CD1 3.98Å; L37-L41 HydrophobicContact CG-CG 4.38Å; L37-L41 WeakPolarHBondContact O-CG 3.5Å; L37-L41 PolarHBondContact O-N 3.01Å; F38-L41 PolarHBondContact O-N 3.36Å; L41-L95 HydrophobicContact CB-CD2 4.15Å; L41-W97 HydrophobicContact CD1-CE3 3.96Å; L41-W97 HydrophobicContact CD1-CZ3 4.27Å; L41-W97 HydrophobicContact CD2-CE3 4.42Å; L41-I108 HydrophobicContact CD1-CD1 3.55Å
42	F	95.4	Very high	92.8	Very high	40 Å²	40	77.1 Å²	77.1	18%	0.175	35%	0.354	C	S	.	.	H	α-helix	trans	-97.1	2	-171	-70	-77	0	0	0	115.2	F38 N44 Y45 L95 V110 R114 I115	F38-F42 AromaticContact CD1-CD2 3.71Å; F38-F42 HydrophobicContact CD1-CD2 3.71Å; F38-F42 HydrophobicContact CD1-CE2 4.39Å; F38-F42 HydrophobicContact CD1-CG 4.49Å; F38-F42 HydrophobicContact CD2-CD2 4.22Å; F38-F42 HydrophobicContact CD2-CE2 4.13Å; F38-F42 AromaticContact CE1-CD2 3.55Å; F38-F42 HydrophobicContact CE1-CD2 3.55Å; F38-F42 HydrophobicContact CE1-CE2 4.09Å; F38-F42 HydrophobicContact CE1-CG 4.14Å; F38-F42 HydrophobicContact CE2-CD2 4.1Å; F38-F42 AromaticContact CE2-CE2 3.83Å; F38-F42 HydrophobicContact CE2-CE2 3.83Å; F38-F42 HydrophobicContact CG-CD2 4.04Å; F38-F42 HydrophobicContact CG-CE2 4.4Å; F38-F42 AromaticContact CZ-CD2 3.76Å; F38-F42 HydrophobicContact CZ-CD2 3.76Å; F38-F42 AromaticContact CZ-CE2 3.8Å; F38-F42 HydrophobicContact CZ-CE2 3.8Å; F38-F42 VanDerWaalsContact O-CD2 3.3Å; F38-F42 WeakPolarHBondContact O-CD2 3.27Å; F38-F42 PolarHBondContact O-N 2.98Å; F38-F42 VanDerWaalsContact O-N 3.11Å; F42-N44 VanDerWaalsContact C-N 3.33Å; F42-N44 PolarHBondContact O-N 2.96Å; F42-Y45 HydrophobicContact CD1-CD1 4.21Å; F42-Y45 HydrophobicContact CD1-CG 4.24Å; F42-Y45 HydrophobicContact CE1-CD1 4.17Å; F42-Y45 HydrophobicContact CE1-CG 4.35Å; F42-L95 HydrophobicContact CE1-CD2 4.2Å; F42-L95 HydrophobicContact CZ-CD2 3.95Å; F42-V110 HydrophobicContact CE1-CG1 4.2Å; F42-V110 HydrophobicContact CE2-CG1 3.94Å; F42-V110 HydrophobicContact CE2-CG2 4.08Å; F42-V110 HydrophobicContact CZ-CB 4.38Å; F42-V110 HydrophobicContact CZ-CG1 3.45Å; F42-V110 VanDerWaalsContact CZ-CG1 3.45Å; F42-V110 HydrophobicContact CZ-CG2 4.07Å; F42-R114 HydrophobicContact CE1-CB 4.5Å; F42-I115 HydrophobicContact CE1-CG2 3.81Å; F42-I115 HydrophobicContact CZ-CG2 3.87Å
43	Q	91.8	Very high	92.8	Very high	150 Å²	150	78.6 Å²	78.6	70%	0.701	36%	0.362	S	S	*	.	S	Bend	trans	-61.5	-38.1	-177.6	-169	169.4	0.4	0	0	113.4	K39	K39-Q43 WeakPolarHBondContact O-CB 3.25Å; K39-Q43 PolarHBondContact O-N 3.44Å
44	N	90.1	Very high	92.9	Very high	156 Å²	156	85.3 Å²	85.3	83%	0.834	39%	0.386	S	S	*	.	S	Bend	trans	-129.2	21.2	-178.7	-68.3	-38.5	0	0	0	112.7	F42	F42-N44 VanDerWaalsContact C-N 3.33Å; F42-N44 PolarHBondContact O-N 2.96Å
45	Y	95.3	Very high	92.7	Very high	29 Å²	29	88.4 Å²	88.4	11%	0.114	40%	0.404	C	S	.	.			trans	-81	123	-177.6	-173.7	-88.4	0	0	0	110.8	F42 K47 D92 K94 L95 I115 W116	F42-Y45 HydrophobicContact CD1-CD1 4.21Å; F42-Y45 HydrophobicContact CD1-CG 4.24Å; F42-Y45 HydrophobicContact CE1-CD1 4.17Å; F42-Y45 HydrophobicContact CE1-CG 4.35Å; Y45-K47 HydrophobicContact CE1-CB 4.05Å; Y45-D92 WeakPolarHBondContact CE2-OD2 3.28Å; Y45-D92 PolarHBondContact OH-OD2 3.44Å; Y45-K94 HydrophobicContact CD2-CB 4.04Å; Y45-K94 HydrophobicContact CD2-CD 4.36Å; Y45-K94 HydrophobicContact CE2-CB 3.96Å; Y45-K94 HydrophobicContact CE2-CD 4.22Å; Y45-L95 HydrophobicContact CD2-CD2 3.78Å; Y45-L95 HydrophobicContact CD2-CG 4.12Å; Y45-L95 HydrophobicContact CE2-CD1 3.9Å; Y45-L95 HydrophobicContact CE2-CD2 3.82Å; Y45-L95 HydrophobicContact CE2-CG 3.65Å; Y45-L95 HydrophobicContact CG-CD2 4.5Å; Y45-I115 HydrophobicContact CE1-CB 4.45Å; Y45-W116 PolarHBondContact OH-N 3.21Å
46	Q	94.1	Very high	92.5	Very high	97 Å²	97	92.2 Å²	92.2	45%	0.453	43%	0.425	S	S	.	.			trans	-108.6	112	175	-178.3	57.4	-83.2	0	0	110.6	W48 V49	Q46-W48 VanDerWaalsContact C-N 3.32Å; Q46-W48 PolarHBondContact O-N 3.19Å; Q46-V49 HydrophobicContact CB-CG2 4.31Å; Q46-V49 HydrophobicContact CG-CB 4.49Å; Q46-V49 HydrophobicContact CG-CG2 3.77Å; Q46-V49 PolarHBondContact O-N 3.32Å
47	K	93.3	Very high	92.5	Very high	65 Å²	65	88.7 Å²	88.7	28%	0.283	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-20.7	-174.9	68.5	172.4	-178.2	171.2	0	115.1	Y45 V49 D113 W116	Y45-K47 HydrophobicContact CE1-CB 4.05Å; K47-V49 VanDerWaalsContact C-N 3.28Å; K47-V49 PolarHBondContact O-N 2.61Å; K47-D113 WeakPolarHBondContact CD-O 3.49Å; K47-D113 PolarHBondContact NZ-O 2.76Å; K47-W116 WeakPolarHBondContact O-CA 3.37Å; K47-W116 VanDerWaalsContact O-CB 3.32Å; K47-W116 WeakPolarHBondContact O-CB 3.44Å
48	W	92.6	Very high	92.5	Very high	188 Å²	188	91.3 Å²	91.3	71%	0.712	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-11.7	-179.9	-51.1	117.5	0	0	0	113.2	Q46	Q46-W48 VanDerWaalsContact C-N 3.32Å; Q46-W48 PolarHBondContact O-N 3.19Å
49	V	91.9	Very high	92.5	Very high	76 Å²	76	89.3 Å²	89.3	46%	0.461	42%	0.418	S	S	.	.	S	Bend	trans	-101.9	120.8	-175.7	179.7	0	0	0	0	109.3	Q46 K47 K94	Q46-V49 HydrophobicContact CB-CG2 4.31Å; Q46-V49 HydrophobicContact CG-CB 4.49Å; Q46-V49 HydrophobicContact CG-CG2 3.77Å; Q46-V49 PolarHBondContact O-N 3.32Å; K47-V49 VanDerWaalsContact C-N 3.28Å; K47-V49 PolarHBondContact O-N 2.61Å; V49-K94 PolarHBondContact O-NZ 3.23Å
50	R	93.1	Very high	92.6	Very high	34 Å²	34	86.5 Å²	86.5	13%	0.128	41%	0.414	C	S	.	.			trans	-46.7	132.5	175.6	-71.3	-163.3	-62.7	132.9	6.6	111.7	V52 L55 Q57 I59 W116 Y180 Q184	R50-V52 VanDerWaalsContact C-N 3.27Å; R50-V52 PolarHBondContact O-N 3.48Å; R50-L55 PolarHBondContact NH2-O 3.42Å; R50-Q57 PolarHBondContact NH1-O 3.05Å; R50-I59 HydrophobicContact CB-CD1 3.98Å; R50-I59 HydrophobicContact CG-CD1 4.31Å; R50-W116 HydrophobicContact CG-CZ2 4.02Å; R50-Y180 VanDerWaalsContact CD-CE1 3.46Å; R50-Y180 HydrophobicContact CG-CE1 3.81Å; R50-Q184 PolarHBondContact NH1-O 3.34Å
51	P	93.6	Very high	92.7	Very high	3 Å²	3	79.4 Å²	79.4	2%	0.019	39%	0.386	C	S	.	.			trans	-83.3	62.8	-175.4	34.2	-39.4	0	0	0	113.3	I59 D92 W116	P51-I59 HydrophobicContact CG-CD1 4.02Å; P51-D92 HydrophobicContact CB-CB 3.88Å; P51-D92 WeakPolarHBondContact CB-OD1 3.37Å; P51-D92 WeakPolarHBondContact CB-OD2 3.41Å; P51-D92 HydrophobicContact CG-CB 4.1Å; P51-W116 HydrophobicContact CG-CD2 4.08Å; P51-W116 HydrophobicContact CG-CE3 3.75Å; P51-W116 HydrophobicContact CG-CG 4.45Å; P51-W116 HydrophobicContact CG-CZ3 4.29Å
52	V	92.6	Very high	92.8	Very high	29 Å²	29	83.3 Å²	83.3	18%	0.176	40%	0.403	C	S	.	.			trans	-108.8	152.2	177.2	-66.6	0	0	0	0	111.6	R50 Y54 Q57 I59	R50-V52 VanDerWaalsContact C-N 3.27Å; R50-V52 PolarHBondContact O-N 3.48Å; V52-Y54 WeakPolarHBondContact CB-O 3.43Å; V52-Y54 WeakPolarHBondContact CG2-O 3.36Å; V52-Q57 HydrophobicContact CB-CB 4.19Å; V52-Q57 HydrophobicContact CG1-CB 4.21Å; V52-I59 HydrophobicContact CG1-CD1 3.92Å; V52-I59 HydrophobicContact CG1-CG1 3.51Å
53	E	88.8	Confident	92.9	Very high	130 Å²	130	81.4 Å²	81.4	61%	0.607	40%	0.395	S	S	*	.	S	Bend	trans	-79.2	-40.3	173.4	-171.9	170.5	-168.2	0	0	110.9
54	Y	91	Very high	93.1	Very high	155 Å²	155	74.4 Å²	74.4	61%	0.608	36%	0.363	S	S	*	.	S	Bend	trans	-121.5	146.7	177.9	-52	-75	0	0	0	111.2	V52 N56 Q57	V52-Y54 WeakPolarHBondContact CB-O 3.43Å; V52-Y54 WeakPolarHBondContact CG2-O 3.36Å; Y54-N56 PolarHBondContact O-N 2.96Å; Y54-Q57 VanDerWaalsContact O-CB 3.26Å; Y54-Q57 WeakPolarHBondContact O-CB 3.43Å; Y54-Q57 PolarHBondContact O-N 3.02Å
55	L	85.8	Confident	93.4	Very high	151 Å²	151	67.2 Å²	67.2	79%	0.791	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-33.4	-178.3	-70.6	172.3	0	0	0	113.7	R50 Q57	R50-L55 PolarHBondContact NH2-O 3.42Å; L55-Q57 PolarHBondContact O-N 2.69Å
56	N	89.3	Confident	93.5	Very high	158 Å²	158	66.3 Å²	66.3	85%	0.845	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	0.2	-179.4	-66	-6	0	0	0	113.2	Y54	Y54-N56 PolarHBondContact O-N 2.96Å
57	Q	92.4	Very high	93.6	Very high	65 Å²	65	61.8 Å²	61.8	30%	0.304	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-81.7	134.5	179.5	-168.6	176.2	7.3	0	0	110.4	R50 V52 Y54 L55	R50-Q57 PolarHBondContact NH1-O 3.05Å; V52-Q57 HydrophobicContact CB-CB 4.19Å; V52-Q57 HydrophobicContact CG1-CB 4.21Å; Y54-Q57 VanDerWaalsContact O-CB 3.26Å; Y54-Q57 WeakPolarHBondContact O-CB 3.43Å; Y54-Q57 PolarHBondContact O-N 3.02Å; L55-Q57 PolarHBondContact O-N 2.69Å
58	T	93.6	Very high	93.6	Very high	54 Å²	54	60.4 Å²	60.4	33%	0.331	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-89	136.2	174.3	-46.1	0	0	0	0	109.7	S183 D186	T58-S183 WeakPolarHBondContact CB-O 3.43Å; T58-S183 WeakPolarHBondContact CG2-O 3.28Å; T58-S183 PolarHBondContact OG1-O 3.1Å; T58-D186 HydrophobicContact CG2-CB 3.74Å
59	I	95.3	Very high	93.7	Very high	10 Å²	10	54.1 Å²	54.1	5%	0.051	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	118.7	171.6	-60.4	174.6	0	0	0	107.8	R50 P51 V52 V61 W90 W116 Q184 V185 D186	R50-I59 HydrophobicContact CB-CD1 3.98Å; R50-I59 HydrophobicContact CG-CD1 4.31Å; P51-I59 HydrophobicContact CG-CD1 4.02Å; V52-I59 HydrophobicContact CG1-CD1 3.92Å; V52-I59 HydrophobicContact CG1-CG1 3.51Å; I59-V61 HydrophobicContact CG2-CG2 4.07Å; I59-W90 HydrophobicContact CG2-CB 4.29Å; I59-W116 HydrophobicContact CD1-CH2 3.59Å; I59-W116 HydrophobicContact CD1-CZ2 3.92Å; I59-W116 HydrophobicContact CD1-CZ3 3.98Å; I59-W116 HydrophobicContact CG2-CH2 4.2Å; I59-W116 HydrophobicContact CG2-CZ3 4.26Å; I59-Q184 PolarHBondContact N-O 3.2Å; I59-V185 WeakPolarHBondContact O-CA 3.34Å; I59-D186 PolarHBondContact O-N 2.78Å
60	S	95.6	Very high	93.9	Very high	65 Å²	65	50.6 Å²	50.6	46%	0.455	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.6	171.3	-59.4	0	0	0	0	109.8	D186	S60-D186 WeakPolarHBondContact CA-O 3.25Å
61	V	96.9	Very high	93.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	112.1	175.2	-178.4	0	0	0	0	107.6	I59 W90 P118 V185 D186 V187 L188	I59-V61 HydrophobicContact CG2-CG2 4.07Å; V61-W90 HydrophobicContact CG2-CB 4.2Å; V61-P118 HydrophobicContact CG1-CG 4.12Å; V61-P118 HydrophobicContact CG2-CB 3.96Å; V61-P118 HydrophobicContact CG2-CG 4.19Å; V61-V185 HydrophobicContact CG2-CG1 3.92Å; V61-D186 PolarHBondContact N-O 3.5Å; V61-V187 WeakPolarHBondContact O-CA 3.4Å; V61-L188 PolarHBondContact O-N 3.42Å
62	K	97.3	Very high	93.8	Very high	95 Å²	95	54.4 Å²	54.4	41%	0.413	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	128	168.8	-61.9	179.9	-168.4	159.4	0	108.4	Q88 E89 L188	K62-Q88 WeakPolarHBondContact O-CA 3.41Å; K62-E89 HydrophobicContact CB-CB 4.26Å; K62-E89 PolarHBondContact N-O 2.68Å; K62-E89 IonicContact NZ-OE1 3.23Å; K62-E89 PolarHBondContact NZ-OE1 3.4Å; K62-E89 PolarHBondContact O-N 3.15Å; K62-L188 CarbonylContact C-O 3.56Å; K62-L188 WeakPolarHBondContact CA-O 3.46Å
63	F	97.1	Very high	93.8	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.8	-177.3	-176.2	-102.2	0	0	0	110	M86 K87 Q88 V120 F175 V187 L188 E190 I227 Y229	F63-M86 HydrophobicContact CE2-CB 4.14Å; F63-M86 HydrophobicContact CE2-CG 4.32Å; F63-M86 HydrophobicContact CE2-SD 4.45Å; F63-M86 HydrophobicContact CZ-CG 4.45Å; F63-K87 CarbonylContact C-O 3.49Å; F63-K87 WeakPolarHBondContact CA-O 3.34Å; F63-Q88 HydrophobicContact CD2-CG 4.07Å; F63-Q88 HydrophobicContact CE2-CG 4.38Å; F63-V120 HydrophobicContact CD2-CG1 4.1Å; F63-V120 HydrophobicContact CE2-CG1 3.85Å; F63-V120 HydrophobicContact CZ-CG1 4.32Å; F63-F175 HydrophobicContact CE1-CB 3.73Å; F63-F175 HydrophobicContact CE1-CD1 4.25Å; F63-F175 AromaticContact CE1-CD2 3.7Å; F63-F175 HydrophobicContact CE1-CD2 3.7Å; F63-F175 HydrophobicContact CE1-CE2 4.35Å; F63-F175 AromaticContact CE1-CG 3.63Å; F63-F175 HydrophobicContact CE1-CG 3.63Å; F63-F175 HydrophobicContact CZ-CB 3.89Å; F63-F175 AromaticContact CZ-CD1 3.67Å; F63-F175 HydrophobicContact CZ-CD1 3.67Å; F63-F175 AromaticContact CZ-CD2 3.89Å; F63-F175 HydrophobicContact CZ-CD2 3.89Å; F63-F175 HydrophobicContact CZ-CE1 4.11Å; F63-F175 HydrophobicContact CZ-CE2 4.31Å; F63-F175 AromaticContact CZ-CG 3.53Å; F63-F175 HydrophobicContact CZ-CG 3.53Å; F63-F175 HydrophobicContact CZ-CZ 4.41Å; F63-V187 HydrophobicContact CB-CG1 3.64Å; F63-V187 HydrophobicContact CG-CG1 4.31Å; F63-L188 PolarHBondContact N-O 2.91Å; F63-E190 PolarHBondContact O-N 2.85Å; F63-I227 HydrophobicContact CB-CD1 3.7Å; F63-I227 HydrophobicContact CD1-CB 4.29Å; F63-I227 HydrophobicContact CD1-CD1 3.8Å; F63-I227 HydrophobicContact CD1-CG2 4.17Å; F63-I227 HydrophobicContact CG-CD1 4.17Å; F63-Y229 HydrophobicContact CD1-CE2 4.05Å; F63-Y229 HydrophobicContact CE1-CD2 4.45Å; F63-Y229 AromaticContact CE1-CE2 3.73Å; F63-Y229 HydrophobicContact CE1-CE2 3.73Å
64	G	96.4	Very high	94	Very high	3 Å²	3	48.8 Å²	48.8	3%	0.031	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	160.4	172.5	0	0	0	0	0	110.4	K87	G64-K87 PolarHBondContact N-O 3.36Å; G64-K87 PolarHBondContact O-N 2.82Å
65	L	96.1	Very high	93.8	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128.1	176	-167.1	73	0	0	0	108.6	V84 M86 F175 V194 D195 Y229 F231	L65-V84 HydrophobicContact CD1-CB 3.84Å; L65-V84 HydrophobicContact CD1-CG1 4.29Å; L65-V84 HydrophobicContact CD1-CG2 3.85Å; L65-V84 HydrophobicContact CG-CB 4.37Å; L65-V84 HydrophobicContact CG-CG1 4.46Å; L65-M86 HydrophobicContact CD1-CG 4.5Å; L65-F175 HydrophobicContact CD1-CE2 4.22Å; L65-F175 HydrophobicContact CD1-CZ 4.1Å; L65-F175 HydrophobicContact CD2-CE2 4.25Å; L65-V194 WeakPolarHBondContact O-CG1 3.13Å; L65-D195 PolarHBondContact O-N 2.85Å; L65-Y229 HydrophobicContact CB-CD2 3.98Å; L65-Y229 HydrophobicContact CB-CE1 4.18Å; L65-Y229 HydrophobicContact CB-CE2 3.54Å; L65-Y229 HydrophobicContact CB-CG 4.45Å; L65-Y229 HydrophobicContact CD2-CD2 3.74Å; L65-Y229 HydrophobicContact CD2-CE2 4.21Å; L65-Y229 HydrophobicContact CD2-CG 3.91Å; L65-Y229 HydrophobicContact CG-CD2 4.46Å; L65-Y229 HydrophobicContact CG-CE2 4.46Å; L65-Y229 PolarHBondContact N-OH 3.09Å; L65-F231 HydrophobicContact CD2-CE2 4.23Å; L65-F231 HydrophobicContact CD2-CZ 3.79Å
66	A	96.1	Very high	93.7	Very high	10 Å²	10	40.6 Å²	40.6	8%	0.083	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	131	167.8	0	0	0	0	0	109.4	V84 W85 D195	A66-V84 CarbonylContact O-C 3.56Å; A66-V84 VanDerWaalsContact O-CA 3.24Å; A66-V84 WeakPolarHBondContact O-CA 3.33Å; A66-V84 WeakPolarHBondContact O-CB 3.48Å; A66-W85 HydrophobicContact CB-CB 4.25Å; A66-W85 PolarHBondContact N-O 2.92Å; A66-W85 PolarHBondContact O-N 2.87Å; A66-D195 CarbonylContact C-O 3.58Å; A66-D195 WeakPolarHBondContact CA-O 2.96Å; A66-D195 HydrophobicContact CB-CB 3.77Å
67	I	95.8	Very high	93.7	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127.4	178.2	-172.8	162.5	0	0	0	109.8	T82 V84 V194 D195 K196 Y199 I207 F231	I67-T82 HydrophobicContact CD1-CG2 4.22Å; I67-V84 HydrophobicContact CB-CG1 4.41Å; I67-V84 HydrophobicContact CG1-CG1 4.29Å; I67-V194 HydrophobicContact CB-CG1 4.18Å; I67-V194 HydrophobicContact CG2-CG1 3.93Å; I67-D195 PolarHBondContact N-O 2.93Å; I67-K196 HydrophobicContact CG2-CG 4Å; I67-Y199 HydrophobicContact CD1-CE2 4.44Å; I67-Y199 HydrophobicContact CG1-CD2 4.2Å; I67-Y199 HydrophobicContact CG1-CE2 4.42Å; I67-Y199 HydrophobicContact CG2-CD2 4Å; I67-I207 HydrophobicContact CD1-CD1 3.71Å; I67-I207 HydrophobicContact CG2-CD1 4.49Å; I67-F231 HydrophobicContact CD1-CE1 3.98Å
68	S	94.6	Very high	93.6	Very high	37 Å²	37	37.9 Å²	37.9	26%	0.259	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-42.8	173.1	-179.3	0	0	0	0	111	N83 Y199 F200	S68-N83 PolarHBondContact N-O 3.11Å; S68-Y199 WeakPolarHBondContact O-CA 3.48Å; S68-F200 PolarHBondContact O-N 2.86Å
69	Q	94.8	Very high	93.5	Very high	56 Å²	56	36.9 Å²	36.9	26%	0.262	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	138.6	179.8	-166.9	-178.3	2.8	0	0	110.7	N83	Q69-N83 HydrophobicContact CB-CB 4.26Å; Q69-N83 PolarHBondContact N-O 2.89Å; Q69-N83 PolarHBondContact O-N 2.94Å
70	L	95.1	Very high	93.5	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	107.1	158.9	176	62.5	0	0	0	105.9	V73 M80 T82 Y199 N202 W205 I207 I233	L70-V73 HydrophobicContact CD1-CG2 4.08Å; L70-V73 HydrophobicContact CD2-CG2 4.35Å; L70-V73 HydrophobicContact CG-CG2 4.47Å; L70-M80 HydrophobicContact CD1-CG 3.81Å; L70-M80 HydrophobicContact CD1-SD 4.14Å; L70-T82 HydrophobicContact CD1-CG2 3.72Å; L70-Y199 HydrophobicContact CB-CE2 4.37Å; L70-N202 VanDerWaalsContact O-CB 3.29Å; L70-N202 WeakPolarHBondContact O-CB 3.06Å; L70-N202 PolarHBondContact O-ND2 3.02Å; L70-N202 VanDerWaalsContact O-ND2 3.09Å; L70-W205 HydrophobicContact CD2-CB 3.62Å; L70-W205 HydrophobicContact CD2-CG 4.24Å; L70-I207 HydrophobicContact CB-CD1 4.44Å; L70-I207 HydrophobicContact CD2-CG1 4.42Å; L70-I233 HydrophobicContact CD2-CD1 4.45Å; L70-I233 HydrophobicContact CD2-CG2 4.18Å
71	V	93.7	Very high	93.4	Very high	49 Å²	49	34 Å²	34	30%	0.297	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-53.1	-171.3	178.3	0	0	0	0	109.8	T81 N83 N202	V71-T81 HydrophobicContact CB-CG2 3.9Å; V71-T81 HydrophobicContact CG1-CG2 4.25Å; V71-T81 HydrophobicContact CG2-CG2 4.29Å; V71-T81 PolarHBondContact N-O 3.36Å; V71-N83 HydrophobicContact CG2-CB 4.43Å; V71-N83 VanDerWaalsContact CG2-ND2 3.33Å; V71-N83 WeakPolarHBondContact CG2-ND2 3.4Å; V71-N202 PolarHBondContact O-ND2 3.03Å
72	D	92.4	Very high	93.3	Very high	67 Å²	67	34 Å²	34	36%	0.358	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	153.3	-174.2	-170.5	24.4	0	0	0	110.9	T81	D72-T81 PolarHBondContact N-O 3.49Å; D72-T81 PolarHBondContact O-N 3.2Å
73	V	92.7	Very high	93.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	96.6	171.9	-177.7	0	0	0	0	106.8	L70 E75 L79 M80 I159 W205 I233	L70-V73 HydrophobicContact CD1-CG2 4.08Å; L70-V73 HydrophobicContact CD2-CG2 4.35Å; L70-V73 HydrophobicContact CG-CG2 4.47Å; V73-E75 PolarHBondContact O-N 2.83Å; V73-E75 VanDerWaalsContact O-N 3.15Å; V73-L79 CarbonylContact C-O 3.6Å; V73-M80 HydrophobicContact CG2-CG 4.29Å; V73-I159 HydrophobicContact CG1-CD1 3.87Å; V73-W205 HydrophobicContact CB-CZ2 3.88Å; V73-W205 HydrophobicContact CG1-CZ2 4.05Å; V73-W205 HydrophobicContact CG2-CD2 4.3Å; V73-W205 HydrophobicContact CG2-CG 4.43Å; V73-W205 HydrophobicContact CG2-CZ2 4.35Å; V73-I233 HydrophobicContact CG2-CD1 3.71Å
74	D	91.3	Very high	93.1	Very high	42 Å²	42	31.9 Å²	31.9	23%	0.225	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	98.4	179.7	-174.5	-26.8	0	0	0	109.1	K76 N77 Q78 L79	D74-K76 VanDerWaalsContact C-N 3.28Å; D74-K76 PolarHBondContact O-N 2.75Å; D74-K76 WeakPolarHBondContact OD1-CB 3.43Å; D74-K76 PolarHBondContact OD1-N 3.41Å; D74-K76 VanDerWaalsContact OD1-N 3.16Å; D74-N77 HydrophobicContact CB-CB 4.49Å; D74-N77 PolarHBondContact OD1-N 2.9Å; D74-N77 PolarHBondContact OD1-ND2 2.97Å; D74-N77 PolarHBondContact OD2-ND2 2.78Å; D74-Q78 WeakPolarHBondContact O-CA 3.39Å; D74-Q78 PolarHBondContact O-N 2.83Å; D74-L79 HydrophobicContact CB-CB 4.36Å; D74-L79 PolarHBondContact N-O 2.58Å; D74-L79 PolarHBondContact O-N 2.81Å
75	E	87.4	Confident	93	Very high	22 Å²	22	36.7 Å²	36.7	10%	0.103	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-33.9	-177.3	-53.7	87.8	164.3	0	0	111.5	V73 Q78 I159 R235 P291	V73-E75 PolarHBondContact O-N 2.83Å; V73-E75 VanDerWaalsContact O-N 3.15Å; E75-Q78 PolarHBondContact O-N 2.83Å; E75-I159 HydrophobicContact CB-CG2 4.21Å; E75-I159 HydrophobicContact CG-CG2 4.02Å; E75-R235 IonicContact OE1-CZ 2.68Å; E75-R235 IonicContact OE1-NH1 3.91Å; E75-R235 PolarHBondContact OE1-NH1 2.85Å; E75-R235 IonicContact OE1-NH2 3.03Å; E75-R235 PolarHBondContact OE1-NH2 2.76Å; E75-P291 HydrophobicContact CB-CG 4.42Å; E75-P291 VanDerWaalsContact O-CB 3.25Å; E75-P291 WeakPolarHBondContact O-CB 3.47Å; E75-P291 WeakPolarHBondContact O-CG 3.26Å
76	K	84.6	Confident	92.9	Very high	112 Å²	112	36.6 Å²	36.6	49%	0.487	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-47.6	-178.1	-177.4	177	-177.2	166.2	0	111.6	D74	D74-K76 VanDerWaalsContact C-N 3.28Å; D74-K76 PolarHBondContact O-N 2.75Å; D74-K76 WeakPolarHBondContact OD1-CB 3.43Å; D74-K76 PolarHBondContact OD1-N 3.41Å; D74-K76 VanDerWaalsContact OD1-N 3.16Å
77	N	87.9	Confident	92.9	Very high	101 Å²	101	38.4 Å²	38.4	54%	0.54	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-3.8	179.1	-64.1	-48.6	0	0	0	113.1	D74 L79	D74-N77 HydrophobicContact CB-CB 4.49Å; D74-N77 PolarHBondContact OD1-N 2.9Å; D74-N77 PolarHBondContact OD1-ND2 2.97Å; D74-N77 PolarHBondContact OD2-ND2 2.78Å; N77-L79 HydrophobicContact CB-CD1 4.08Å; N77-L79 HydrophobicContact CB-CG 4.11Å
78	Q	90.2	Very high	92.9	Very high	64 Å²	64	38.4 Å²	38.4	30%	0.299	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	44.3	-179	-60.5	-175.5	-2.5	0	0	112.8	D74 E75 C157	D74-Q78 WeakPolarHBondContact O-CA 3.39Å; D74-Q78 PolarHBondContact O-N 2.83Å; E75-Q78 PolarHBondContact O-N 2.83Å; Q78-C157 CarbonylContact C-O 3.5Å; Q78-C157 WeakPolarHBondContact CB-O 3.3Å; Q78-C157 PolarHBondContact O-N 3.14Å; Q78-C157 VanDerWaalsContact O-O 3.1Å
79	L	92.6	Very high	93	Very high	34 Å²	34	38.9 Å²	38.9	18%	0.178	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	139	-176.2	-59.5	179.6	0	0	0	111.4	V73 D74 N77 S126 A156	V73-L79 CarbonylContact C-O 3.6Å; D74-L79 HydrophobicContact CB-CB 4.36Å; D74-L79 PolarHBondContact N-O 2.58Å; D74-L79 PolarHBondContact O-N 2.81Å; N77-L79 HydrophobicContact CB-CD1 4.08Å; N77-L79 HydrophobicContact CB-CG 4.11Å; L79-S126 VanDerWaalsContact CD2-CB 3.42Å; L79-S126 WeakPolarHBondContact CD2-OG 3.2Å; L79-A156 HydrophobicContact CD2-CB 4.44Å
80	M	94.8	Very high	93.1	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.5	169.6	179	-175	74.5	0	0	109	L70 V73 T82 K154 S155 C157 C171 M173 F231	L70-M80 HydrophobicContact CD1-CG 3.81Å; L70-M80 HydrophobicContact CD1-SD 4.14Å; V73-M80 HydrophobicContact CG2-CG 4.29Å; M80-T82 HydrophobicContact CE-CG2 3.84Å; M80-T82 HydrophobicContact CG-CG2 4.03Å; M80-T82 HydrophobicContact SD-CG2 4.13Å; M80-K154 WeakPolarHBondContact O-CA 3.32Å; M80-S155 VanDerWaalsContact CE-OG 3.31Å; M80-S155 WeakPolarHBondContact CE-OG 3.05Å; M80-S155 PolarHBondContact N-O 2.64Å; M80-S155 PolarHBondContact O-N 3.37Å; M80-S155 PolarHBondContact O-OG 3.5Å; M80-C157 HydrophobicContact CB-CB 4.47Å; M80-C171 HydrophobicContact CE-CB 4.09Å; M80-C171 HydrophobicContact SD-CB 3.65Å; M80-M173 HydrophobicContact CE-CG 3.78Å; M80-M173 HydrophobicContact CE-SD 3.79Å; M80-F231 HydrophobicContact CE-CD2 4.09Å
81	T	94.6	Very high	93.2	Very high	14 Å²	14	38.9 Å²	38.9	9%	0.086	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	121	179	-55	0	0	0	0	110.4	V71 D72 N152 Y153 K154	V71-T81 HydrophobicContact CB-CG2 3.9Å; V71-T81 HydrophobicContact CG1-CG2 4.25Å; V71-T81 HydrophobicContact CG2-CG2 4.29Å; V71-T81 PolarHBondContact N-O 3.36Å; D72-T81 PolarHBondContact N-O 3.49Å; D72-T81 PolarHBondContact O-N 3.2Å; T81-N152 VanDerWaalsContact CG2-OD1 3.29Å; T81-N152 WeakPolarHBondContact CG2-OD1 3.48Å; T81-Y153 CarbonylContact C-O 3.59Å; T81-Y153 WeakPolarHBondContact CA-O 3.48Å; T81-K154 HydrophobicContact CG2-CG 4.13Å
82	T	94.9	Very high	93.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	138.4	-177.2	53.2	0	0	0	0	111.8	I67 L70 M80 N152 Y153	I67-T82 HydrophobicContact CD1-CG2 4.22Å; L70-T82 HydrophobicContact CD1-CG2 3.72Å; M80-T82 HydrophobicContact CE-CG2 3.84Å; M80-T82 HydrophobicContact CG-CG2 4.03Å; M80-T82 HydrophobicContact SD-CG2 4.13Å; T82-N152 WeakPolarHBondContact O-CA 3.32Å; T82-Y153 PolarHBondContact N-O 3.16Å; T82-Y153 PolarHBondContact O-N 2.86Å
83	N	94.3	Very high	93.4	Very high	47 Å²	47	36 Å²	36	25%	0.251	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	114.2	167.3	-70.7	-25.2	0	0	0	108.3	S68 Q69 V71	S68-N83 PolarHBondContact N-O 3.11Å; Q69-N83 HydrophobicContact CB-CB 4.26Å; Q69-N83 PolarHBondContact N-O 2.89Å; Q69-N83 PolarHBondContact O-N 2.94Å; V71-N83 HydrophobicContact CG2-CB 4.43Å; V71-N83 VanDerWaalsContact CG2-ND2 3.33Å; V71-N83 WeakPolarHBondContact CG2-ND2 3.4Å
84	V	95	Very high	93.4	Very high	2 Å²	2	40 Å²	40	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	156.7	-174.8	-58.4	0	0	0	0	111.3	L65 A66 I67 P150 A151 Y153	L65-V84 HydrophobicContact CD1-CB 3.84Å; L65-V84 HydrophobicContact CD1-CG1 4.29Å; L65-V84 HydrophobicContact CD1-CG2 3.85Å; L65-V84 HydrophobicContact CG-CB 4.37Å; L65-V84 HydrophobicContact CG-CG1 4.46Å; A66-V84 CarbonylContact O-C 3.56Å; A66-V84 VanDerWaalsContact O-CA 3.24Å; A66-V84 WeakPolarHBondContact O-CA 3.33Å; A66-V84 WeakPolarHBondContact O-CB 3.48Å; I67-V84 HydrophobicContact CB-CG1 4.41Å; I67-V84 HydrophobicContact CG1-CG1 4.29Å; V84-P150 WeakPolarHBondContact O-CA 3.31Å; V84-A151 HydrophobicContact CG2-CB 4.42Å; V84-A151 PolarHBondContact N-O 2.79Å; V84-A151 PolarHBondContact O-N 3.5Å; V84-Y153 HydrophobicContact CG2-CD2 3.51Å; V84-Y153 HydrophobicContact CG2-CE2 3.83Å
85	W	95	Very high	93.6	Very high	104 Å²	104	38.1 Å²	38.1	39%	0.394	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.4	167	-54.3	82.3	0	0	0	107.9	A66 K87 P150	A66-W85 HydrophobicContact CB-CB 4.25Å; A66-W85 PolarHBondContact N-O 2.92Å; A66-W85 PolarHBondContact O-N 2.87Å; W85-K87 PolarHBondContact O-N 3.04Å; W85-P150 HydrophobicContact CD2-CB 4.3Å; W85-P150 HydrophobicContact CE3-CB 3.95Å; W85-P150 HydrophobicContact CE3-CG 4.48Å; W85-P150 HydrophobicContact CH2-CB 4.25Å; W85-P150 HydrophobicContact CZ3-CB 3.93Å; W85-P150 HydrophobicContact CZ3-CG 4.11Å
86	M	94.1	Very high	93.9	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.015	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	107.8	175.4	-66.9	-174.2	-70.3	0	0	108.8	F63 L65 Q88 N148 P149 A151 Y153 F175	F63-M86 HydrophobicContact CE2-CB 4.14Å; F63-M86 HydrophobicContact CE2-CG 4.32Å; F63-M86 HydrophobicContact CE2-SD 4.45Å; F63-M86 HydrophobicContact CZ-CG 4.45Å; L65-M86 HydrophobicContact CD1-CG 4.5Å; M86-Q88 HydrophobicContact CB-CG 4.48Å; M86-Q88 PolarHBondContact O-N 2.88Å; M86-N148 VanDerWaalsContact O-CA 3.28Å; M86-N148 WeakPolarHBondContact O-CA 3.33Å; M86-P149 HydrophobicContact CB-CG 4.33Å; M86-P149 HydrophobicContact CE-CG 3.73Å; M86-P149 PolarHBondContact N-O 2.87Å; M86-P149 VanDerWaalsContact N-O 3.16Å; M86-P149 WeakPolarHBondContact O-CD 3.41Å; M86-A151 HydrophobicContact CE-CB 4.19Å; M86-Y153 VanDerWaalsContact CE-OH 3.25Å; M86-Y153 WeakPolarHBondContact CE-OH 3.33Å; M86-Y153 HydrophobicContact CG-CE2 4.24Å; M86-Y153 HydrophobicContact SD-CE2 3.9Å; M86-Y153 PolarHBondContact SD-OH 3.39Å; M86-F175 HydrophobicContact SD-CE1 4.26Å
87	K	95.1	Very high	94.4	Very high	47 Å²	47	38.2 Å²	38.2	20%	0.204	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	116.8	176.5	-63.7	-179.4	-178.7	173.3	0	109.1	F63 G64 W85 N148 D195	F63-K87 CarbonylContact C-O 3.49Å; F63-K87 WeakPolarHBondContact CA-O 3.34Å; G64-K87 PolarHBondContact N-O 3.36Å; G64-K87 PolarHBondContact O-N 2.82Å; W85-K87 PolarHBondContact O-N 3.04Å; K87-N148 WeakPolarHBondContact CA-OD1 3.41Å; K87-D195 IonicContact NZ-OD2 2.69Å; K87-D195 PolarHBondContact NZ-OD2 2.65Å
88	Q	96	Very high	94.8	Very high	3 Å²	3	35.6 Å²	35.6	1%	0.014	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.3	180	-54.8	-175.1	39.7	0	0	109.5	K62 F63 M86 W90 S146 W147	K62-Q88 WeakPolarHBondContact O-CA 3.41Å; F63-Q88 HydrophobicContact CD2-CG 4.07Å; F63-Q88 HydrophobicContact CE2-CG 4.38Å; M86-Q88 HydrophobicContact CB-CG 4.48Å; M86-Q88 PolarHBondContact O-N 2.88Å; Q88-W90 HydrophobicContact CB-CE3 4.17Å; Q88-W90 HydrophobicContact CB-CZ3 3.81Å; Q88-S146 WeakPolarHBondContact O-CA 3.07Å; Q88-W147 WeakPolarHBondContact CB-O 3.38Å; Q88-W147 PolarHBondContact N-O 2.88Å; Q88-W147 PolarHBondContact O-N 2.9Å
89	E	97.4	Very high	95	Very high	47 Å²	47	33.9 Å²	33.9	22%	0.22	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.5	174.1	-175.8	-178.6	98.4	0	0	110.5	K62 T144 I145	K62-E89 HydrophobicContact CB-CB 4.26Å; K62-E89 PolarHBondContact N-O 2.68Å; K62-E89 IonicContact NZ-OE1 3.23Å; K62-E89 PolarHBondContact NZ-OE1 3.4Å; K62-E89 PolarHBondContact O-N 3.15Å; E89-T144 HydrophobicContact CG-CG2 3.74Å; E89-I145 VanDerWaalsContact CA-O 3.28Å; E89-I145 WeakPolarHBondContact CA-O 3.43Å
90	W	96.9	Very high	95	Very high	3 Å²	3	40.6 Å²	40.6	1%	0.011	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	171.2	174.2	69.1	96.7	0	0	0	110.3	I59 V61 Q88 I115 W116 L117 P118 I145 W147	I59-W90 HydrophobicContact CG2-CB 4.29Å; V61-W90 HydrophobicContact CG2-CB 4.2Å; Q88-W90 HydrophobicContact CB-CE3 4.17Å; Q88-W90 HydrophobicContact CB-CZ3 3.81Å; W90-I115 HydrophobicContact CZ2-CD1 4.31Å; W90-W116 AromaticContact CD1-CZ3 3.84Å; W90-W116 HydrophobicContact CG-CZ3 4.36Å; W90-W116 WeakPolarHBondContact CZ2-O 3.25Å; W90-W116 AromaticContact NE1-CE3 3.7Å; W90-W116 AromaticContact NE1-CZ3 3.85Å; W90-L117 HydrophobicContact CH2-CD2 3.73Å; W90-L117 HydrophobicContact CZ2-CD2 3.9Å; W90-P118 HydrophobicContact CD2-CG 4.47Å; W90-P118 HydrophobicContact CE3-CG 4.17Å; W90-P118 HydrophobicContact CZ3-CG 4.28Å; W90-I145 HydrophobicContact CD2-CB 4.23Å; W90-I145 HydrophobicContact CD2-CG2 4.45Å; W90-I145 HydrophobicContact CH2-CG2 3.71Å; W90-I145 HydrophobicContact CZ2-CB 4.05Å; W90-I145 HydrophobicContact CZ2-CD1 4.18Å; W90-I145 HydrophobicContact CZ2-CG2 3.52Å; W90-I145 HydrophobicContact CZ3-CG2 4.25Å; W90-I145 PolarHBondContact N-O 3.23Å; W90-I145 VanDerWaalsContact N-O 3.11Å; W90-I145 PolarHBondContact O-N 2.95Å; W90-W147 HydrophobicContact CH2-CB 3.72Å; W90-W147 HydrophobicContact CH2-CE3 4.19Å; W90-W147 HydrophobicContact CH2-CG 4.41Å; W90-W147 HydrophobicContact CZ3-CB 3.79Å; W90-W147 HydrophobicContact CZ3-CE3 4.41Å
91	V	96.8	Very high	94.8	Very high	54 Å²	54	46.1 Å²	46.1	33%	0.327	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.5	179.7	-178.8	0	0	0	0	109.5	M93 G143	V91-M93 HydrophobicContact CG1-CE 4.32Å; V91-M93 HydrophobicContact CG1-SD 4.3Å; V91-G143 WeakPolarHBondContact CA-O 3.32Å
92	D	96.3	Very high	94.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.22	C	C	.	.			trans	-108.8	112.1	171.6	-172.7	-30	0	0	0	110.1	Y45 P51 K94 L95 G143 I145	Y45-D92 WeakPolarHBondContact CE2-OD2 3.28Å; Y45-D92 PolarHBondContact OH-OD2 3.44Å; P51-D92 HydrophobicContact CB-CB 3.88Å; P51-D92 WeakPolarHBondContact CB-OD1 3.37Å; P51-D92 WeakPolarHBondContact CB-OD2 3.41Å; P51-D92 HydrophobicContact CG-CB 4.1Å; D92-K94 PolarHBondContact O-N 3.48Å; D92-K94 WeakPolarHBondContact OD1-CA 3.31Å; D92-K94 VanDerWaalsContact OD1-CB 3.32Å; D92-K94 WeakPolarHBondContact OD1-CB 3.41Å; D92-K94 PolarHBondContact OD1-N 2.98Å; D92-L95 HydrophobicContact CB-CB 4.32Å; D92-L95 HydrophobicContact CB-CD1 4.25Å; D92-L95 HydrophobicContact CB-CG 4.42Å; D92-L95 PolarHBondContact O-N 3.41Å; D92-G143 PolarHBondContact N-O 2.97Å; D92-G143 WeakPolarHBondContact O-CA 3.47Å; D92-I145 HydrophobicContact CB-CD1 3.51Å; D92-I145 HydrophobicContact CB-CG1 4.39Å
93	M	93	Very high	94.5	Very high	56 Å²	56	50.7 Å²	50.7	28%	0.276	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-65.1	-26.3	-178.5	-60.3	-61.1	-179.7	0	0	113.2	V91 L95 R96	V91-M93 HydrophobicContact CG1-CE 4.32Å; V91-M93 HydrophobicContact CG1-SD 4.3Å; M93-L95 VanDerWaalsContact C-N 3.34Å; M93-R96 PolarHBondContact SD-NH1 2.85Å; M93-R96 PolarHBondContact SD-NH2 2.94Å
94	K	92.9	Very high	94.3	Very high	85 Å²	85	50.6 Å²	50.6	37%	0.37	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-80.8	-16.2	-177.3	-58.8	173.2	-174.8	165.1	0	112.5	Y45 V49 D92	Y45-K94 HydrophobicContact CD2-CB 4.04Å; Y45-K94 HydrophobicContact CD2-CD 4.36Å; Y45-K94 HydrophobicContact CE2-CB 3.96Å; Y45-K94 HydrophobicContact CE2-CD 4.22Å; V49-K94 PolarHBondContact O-NZ 3.23Å; D92-K94 PolarHBondContact O-N 3.48Å; D92-K94 WeakPolarHBondContact OD1-CA 3.31Å; D92-K94 VanDerWaalsContact OD1-CB 3.32Å; D92-K94 WeakPolarHBondContact OD1-CB 3.41Å; D92-K94 PolarHBondContact OD1-N 2.98Å
95	L	95.1	Very high	94.2	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-103.7	30.9	-177.9	-65	176	0	0	0	112.8	L41 F42 Y45 D92 M93 W97 I115 V139 I145	L41-L95 HydrophobicContact CB-CD2 4.15Å; F42-L95 HydrophobicContact CE1-CD2 4.2Å; F42-L95 HydrophobicContact CZ-CD2 3.95Å; Y45-L95 HydrophobicContact CD2-CD2 3.78Å; Y45-L95 HydrophobicContact CD2-CG 4.12Å; Y45-L95 HydrophobicContact CE2-CD1 3.9Å; Y45-L95 HydrophobicContact CE2-CD2 3.82Å; Y45-L95 HydrophobicContact CE2-CG 3.65Å; Y45-L95 HydrophobicContact CG-CD2 4.5Å; D92-L95 HydrophobicContact CB-CB 4.32Å; D92-L95 HydrophobicContact CB-CD1 4.25Å; D92-L95 HydrophobicContact CB-CG 4.42Å; D92-L95 PolarHBondContact O-N 3.41Å; M93-L95 VanDerWaalsContact C-N 3.34Å; L95-W97 VanDerWaalsContact O-CE3 3.29Å; L95-W97 WeakPolarHBondContact O-CZ3 3.45Å; L95-I115 HydrophobicContact CD1-CB 4.42Å; L95-I115 HydrophobicContact CD1-CG2 3.74Å; L95-V139 HydrophobicContact CB-CG1 4.15Å; L95-I145 HydrophobicContact CD1-CD1 3.93Å
96	R	95.2	Very high	94.2	Very high	119 Å²	119	49.9 Å²	49.9	45%	0.449	26%	0.261	S	S	.	.			trans	-92.3	144	175.4	-70.9	179.3	168.4	179.4	-2.1	111.5	M93 Y141 D142	M93-R96 PolarHBondContact SD-NH1 2.85Å; M93-R96 PolarHBondContact SD-NH2 2.94Å; R96-Y141 WeakPolarHBondContact CA-O 3.36Å; R96-D142 WeakPolarHBondContact CG-O 3.42Å; R96-D142 PolarHBondContact NE-O 3.37Å; R96-D142 PolarHBondContact NH2-O 3.28Å
97	W	95.3	Very high	94.3	Very high	17 Å²	17	52.6 Å²	52.6	6%	0.064	28%	0.278	C	S	.	.			trans	-147.9	160.6	171.7	70.1	95	0	0	0	111.3	L37 L41 L95 F102 I105 I108 V139 K140 Y141	L37-W97 HydrophobicContact CD1-CB 3.84Å; L37-W97 HydrophobicContact CD1-CD2 4.04Å; L37-W97 HydrophobicContact CD1-CG 3.66Å; L37-W97 HydrophobicContact CD2-CD2 4.09Å; L37-W97 HydrophobicContact CD2-CG 4.29Å; L37-W97 HydrophobicContact CD2-CZ2 4.22Å; L41-W97 HydrophobicContact CD1-CE3 3.96Å; L41-W97 HydrophobicContact CD1-CZ3 4.27Å; L41-W97 HydrophobicContact CD2-CE3 4.42Å; L95-W97 VanDerWaalsContact O-CE3 3.29Å; L95-W97 WeakPolarHBondContact O-CZ3 3.45Å; W97-F102 HydrophobicContact CB-CD2 4.45Å; W97-F102 HydrophobicContact CB-CE2 4.3Å; W97-F102 AromaticContact CD1-CD2 3.97Å; W97-I105 HydrophobicContact CZ2-CG2 4.39Å; W97-I105 PolarHBondContact NE1-O 3.47Å; W97-I108 HydrophobicContact CH2-CD1 4.24Å; W97-I108 HydrophobicContact CH2-CG1 3.87Å; W97-I108 HydrophobicContact CH2-CG2 4.41Å; W97-I108 HydrophobicContact CZ2-CG2 4.33Å; W97-I108 HydrophobicContact CZ3-CD1 4.24Å; W97-I108 HydrophobicContact CZ3-CG1 4.29Å; W97-V139 HydrophobicContact CH2-CG1 4.43Å; W97-V139 HydrophobicContact CZ3-CG1 3.99Å; W97-K140 WeakPolarHBondContact CH2-O 3.41Å; W97-K140 WeakPolarHBondContact CZ3-O 3.32Å; W97-Y141 VanDerWaalsContact CH2-N 3.35Å; W97-Y141 PolarHBondContact N-O 2.82Å; W97-Y141 VanDerWaalsContact N-O 3.14Å
98	S	95.8	Very high	94.3	Very high	46 Å²	46	50.6 Å²	50.6	32%	0.322	27%	0.269	S	S	.	.			trans	-86.8	122.7	170.8	-175.4	0	0	0	0	109.8	E100 D101	S98-E100 PolarHBondContact O-N 2.84Å; S98-D101 PolarHBondContact O-N 3.05Å
99	P	94.3	Very high	94.3	Very high	28 Å²	28	58.7 Å²	58.7	18%	0.182	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-58	-28.8	175.8	-26.1	35.6	0	0	0	113.3	D101 F102 G104 T106 Y141	P99-D101 VanDerWaalsContact C-N 3.26Å; P99-D101 PolarHBondContact O-N 3.35Å; P99-F102 CarbonylContact O-C 3.57Å; P99-F102 PolarHBondContact O-N 3.01Å; P99-G104 VanDerWaalsContact O-CA 3.25Å; P99-G104 WeakPolarHBondContact O-CA 3.23Å; P99-G104 PolarHBondContact O-N 2.9Å; P99-T106 HydrophobicContact CG-CG2 4.49Å; P99-Y141 HydrophobicContact CG-CD1 4.33Å; P99-Y141 HydrophobicContact CG-CD2 3.74Å; P99-Y141 HydrophobicContact CG-CE2 4.39Å; P99-Y141 HydrophobicContact CG-CG 3.7Å
100	E	92.6	Very high	94.2	Very high	175 Å²	175	56.4 Å²	56.4	82%	0.818	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-61.2	-34.1	-178.9	-61.4	-180	-177.9	0	0	112.5	S98 F102	S98-E100 PolarHBondContact O-N 2.84Å; E100-F102 VanDerWaalsContact C-N 3.32Å; E100-F102 PolarHBondContact O-N 3.18Å
101	D	91.4	Very high	94.1	Very high	117 Å²	117	58 Å²	58	63%	0.626	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-78.5	-15.6	-178	-64.9	-33.4	0	0	0	113.4	S98 P99	S98-D101 PolarHBondContact O-N 3.05Å; P99-D101 VanDerWaalsContact C-N 3.26Å; P99-D101 PolarHBondContact O-N 3.35Å
102	F	91.5	Very high	94	Very high	15 Å²	15	55.4 Å²	55.4	7%	0.066	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-131.7	47.2	-170.1	-61.1	-82.4	0	0	0	112.5	K36 L37 Y40 W97 P99 E100 G104 I105	K36-F102 HydrophobicContact CD-CE1 4.45Å; K36-F102 HydrophobicContact CG-CE1 4.36Å; L37-F102 HydrophobicContact CB-CD1 3.65Å; L37-F102 HydrophobicContact CB-CE1 3.87Å; L37-F102 HydrophobicContact CB-CG 4.12Å; L37-F102 HydrophobicContact CD1-CD1 4.11Å; L37-F102 HydrophobicContact CD1-CD2 3.77Å; L37-F102 HydrophobicContact CD1-CE1 4.01Å; L37-F102 HydrophobicContact CD1-CE2 3.67Å; L37-F102 HydrophobicContact CD1-CG 3.98Å; L37-F102 HydrophobicContact CD1-CZ 3.79Å; L37-F102 HydrophobicContact CG-CD1 4.41Å; L37-F102 HydrophobicContact CG-CG 4.45Å; Y40-F102 HydrophobicContact CD1-CE2 4.48Å; Y40-F102 HydrophobicContact CD1-CZ 4Å; Y40-F102 HydrophobicContact CG-CZ 4.17Å; W97-F102 HydrophobicContact CB-CD2 4.45Å; W97-F102 HydrophobicContact CB-CE2 4.3Å; W97-F102 AromaticContact CD1-CD2 3.97Å; P99-F102 CarbonylContact O-C 3.57Å; P99-F102 PolarHBondContact O-N 3.01Å; E100-F102 VanDerWaalsContact C-N 3.32Å; E100-F102 PolarHBondContact O-N 3.18Å; F102-G104 PolarHBondContact O-N 3.11Å; F102-G104 VanDerWaalsContact O-N 3.15Å; F102-I105 HydrophobicContact CB-CD1 4.45Å; F102-I105 WeakPolarHBondContact O-CD1 3.41Å; F102-I105 WeakPolarHBondContact O-CG1 3.44Å; F102-I105 PolarHBondContact O-N 3.14Å
103	L	89.7	Confident	93.8	Very high	95 Å²	95	58.9 Å²	58.9	50%	0.497	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	31.3	175.4	-59.7	-178.9	0	0	0	114.3	Y30 A33	Y30-L103 HydrophobicContact CE1-CB 4.26Å; A33-L103 HydrophobicContact CB-CB 4.42Å; A33-L103 HydrophobicContact CB-CD1 3.62Å; A33-L103 HydrophobicContact CB-CG 3.99Å
104	G	91.3	Very high	93.8	Very high	46 Å²	46	62.6 Å²	62.6	47%	0.474	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	18	178.1	0	0	0	0	0	114.8	P99 F102 T106	P99-G104 VanDerWaalsContact O-CA 3.25Å; P99-G104 WeakPolarHBondContact O-CA 3.23Å; P99-G104 PolarHBondContact O-N 2.9Å; F102-G104 PolarHBondContact O-N 3.11Å; F102-G104 VanDerWaalsContact O-N 3.15Å; G104-T106 PolarHBondContact O-N 2.78Å
105	I	93.3	Very high	94	Very high	20 Å²	20	58.8 Å²	58.8	10%	0.103	30%	0.297	C	S	.	.			trans	-64.9	118	176.4	-66.1	166.7	0	0	0	109.5	A33 E34 L37 W97 F102 I108	A33-I105 HydrophobicContact CB-CD1 4.24Å; E34-I105 HydrophobicContact CB-CD1 4Å; L37-I105 HydrophobicContact CD2-CB 4.48Å; L37-I105 HydrophobicContact CD2-CG2 3.97Å; W97-I105 HydrophobicContact CZ2-CG2 4.39Å; W97-I105 PolarHBondContact NE1-O 3.47Å; F102-I105 HydrophobicContact CB-CD1 4.45Å; F102-I105 WeakPolarHBondContact O-CD1 3.41Å; F102-I105 WeakPolarHBondContact O-CG1 3.44Å; F102-I105 PolarHBondContact O-N 3.14Å; I105-I108 HydrophobicContact CG2-CG2 3.76Å
106	T	94.5	Very high	94	Very high	70 Å²	70	59 Å²	59	43%	0.429	30%	0.298	S	S	.	.			trans	-103.1	-21.7	179.8	54.1	0	0	0	0	113.7	P99 G104 K140 Y141	P99-T106 HydrophobicContact CG-CG2 4.49Å; G104-T106 PolarHBondContact O-N 2.78Å; T106-K140 CarbonylContact O-C 3.59Å; T106-K140 WeakPolarHBondContact O-CA 3.4Å; T106-Y141 HydrophobicContact CG2-CD1 4.37Å; T106-Y141 PolarHBondContact O-N 2.97Å
107	T	95.9	Very high	94	Very high	61 Å²	61	55.8 Å²	55.8	37%	0.374	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	140.7	-177.9	63.5	0	0	0	0	111.3	V139 K140	T107-V139 CarbonylContact C-O 3.58Å; T107-V139 VanDerWaalsContact CA-O 3.27Å; T107-V139 WeakPolarHBondContact CA-O 3.43Å; T107-K140 HydrophobicContact CG2-CG 4.09Å
108	I	95.4	Very high	93.9	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.026	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	156.3	172.8	61.2	174	0	0	0	110.6	E34 L37 L41 W97 I105 V110 V139	E34-I108 HydrophobicContact CG-CG2 4.43Å; L37-I108 HydrophobicContact CD2-CG2 3.75Å; L41-I108 HydrophobicContact CD1-CD1 3.55Å; W97-I108 HydrophobicContact CH2-CD1 4.24Å; W97-I108 HydrophobicContact CH2-CG1 3.87Å; W97-I108 HydrophobicContact CH2-CG2 4.41Å; W97-I108 HydrophobicContact CZ2-CG2 4.33Å; W97-I108 HydrophobicContact CZ3-CD1 4.24Å; W97-I108 HydrophobicContact CZ3-CG1 4.29Å; I105-I108 HydrophobicContact CG2-CG2 3.76Å; I108-V110 HydrophobicContact CD1-CG2 3.77Å; I108-V110 HydrophobicContact CG1-CG2 3.94Å; I108-V139 HydrophobicContact CG1-CB 3.91Å; I108-V139 PolarHBondContact N-O 2.79Å; I108-V139 PolarHBondContact O-N 3.27Å
109	R	95.6	Very high	93.8	Very high	172 Å²	172	55 Å²	55	65%	0.649	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	112.6	176.7	-70	176.7	175.6	88.2	-1.7	110	K136 A137 V138	R109-K136 HydrophobicContact CB-CD 4.36Å; R109-A137 WeakPolarHBondContact CA-O 3.49Å; R109-V138 HydrophobicContact CG-CG2 4.44Å
110	V	95.3	Very high	93.7	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137	-175.4	-173.3	0	0	0	0	109.7	F38 F42 I108 S112 R114 I115 K136 A137 V139	F38-V110 HydrophobicContact CE2-CG1 4.13Å; F38-V110 HydrophobicContact CE2-CG2 4.09Å; F38-V110 HydrophobicContact CZ-CG1 4.22Å; F42-V110 HydrophobicContact CE1-CG1 4.2Å; F42-V110 HydrophobicContact CE2-CG1 3.94Å; F42-V110 HydrophobicContact CE2-CG2 4.08Å; F42-V110 HydrophobicContact CZ-CB 4.38Å; F42-V110 HydrophobicContact CZ-CG1 3.45Å; F42-V110 VanDerWaalsContact CZ-CG1 3.45Å; F42-V110 HydrophobicContact CZ-CG2 4.07Å; I108-V110 HydrophobicContact CD1-CG2 3.77Å; I108-V110 HydrophobicContact CG1-CG2 3.94Å; V110-S112 PolarHBondContact O-N 3.08Å; V110-R114 HydrophobicContact CG1-CB 4.47Å; V110-I115 HydrophobicContact CG1-CG2 3.86Å; V110-K136 CarbonylContact O-C 3.33Å; V110-K136 VanDerWaalsContact O-CA 3.3Å; V110-K136 WeakPolarHBondContact O-CA 3.28Å; V110-A137 PolarHBondContact N-O 2.68Å; V110-A137 PolarHBondContact O-N 3.09Å; V110-V139 HydrophobicContact CB-CG2 4.26Å; V110-V139 HydrophobicContact CG2-CG2 3.84Å
111	P	95.3	Very high	93.8	Very high	35 Å²	35	46.5 Å²	46.5	23%	0.227	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	129.3	167.9	-24.8	35.7	0	0	0	111.9	D113 R114	P111-D113 WeakPolarHBondContact CB-OD1 3.38Å; P111-D113 PolarHBondContact O-N 2.91Å; P111-R114 HydrophobicContact CB-CG 4.41Å; P111-R114 PolarHBondContact O-N 3.01Å; P111-R114 VanDerWaalsContact O-N 3.16Å
112	S	93.8	Very high	93.9	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.007	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-61	-28.6	-176.7	51.6	0	0	0	0	113.2	V110 R114 I115 L117 T135	V110-S112 PolarHBondContact O-N 3.08Å; S112-R114 PolarHBondContact O-N 3.13Å; S112-I115 WeakPolarHBondContact O-CG1 3.46Å; S112-I115 PolarHBondContact O-N 2.76Å; S112-L117 WeakPolarHBondContact O-CD1 3.39Å; S112-T135 WeakPolarHBondContact CB-O 3.47Å; S112-T135 PolarHBondContact N-O 2.87Å; S112-T135 PolarHBondContact OG-N 2.94Å; S112-T135 PolarHBondContact OG-O 3.2Å
113	D	93.2	Very high	93.9	Very high	72 Å²	72	43 Å²	43	39%	0.385	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-68.9	-12	178.7	67.5	-51.3	0	0	0	114.6	K47 P111 I134	K47-D113 WeakPolarHBondContact CD-O 3.49Å; K47-D113 PolarHBondContact NZ-O 2.76Å; P111-D113 WeakPolarHBondContact CB-OD1 3.38Å; P111-D113 PolarHBondContact O-N 2.91Å; D113-I134 HydrophobicContact CB-CG2 4.16Å
114	R	93.3	Very high	93.9	Very high	135 Å²	135	41.4 Å²	41.4	51%	0.509	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-99.6	-10.4	179.4	-66.8	-169.3	174.5	-165.1	-2.4	114.3	F42 V110 P111 S112	F42-R114 HydrophobicContact CE1-CB 4.5Å; V110-R114 HydrophobicContact CG1-CB 4.47Å; P111-R114 HydrophobicContact CB-CG 4.41Å; P111-R114 PolarHBondContact O-N 3.01Å; P111-R114 VanDerWaalsContact O-N 3.16Å; S112-R114 PolarHBondContact O-N 3.13Å
115	I	95.7	Very high	93.9	Very high	5 Å²	5	40 Å²	40	3%	0.026	19%	0.194	C	C	.	.	S	Bend	trans	-111.6	162.4	-179.9	57.4	172.1	0	0	0	110.5	F42 Y45 W90 L95 V110 S112 L117 A137 I145	F42-I115 HydrophobicContact CE1-CG2 3.81Å; F42-I115 HydrophobicContact CZ-CG2 3.87Å; Y45-I115 HydrophobicContact CE1-CB 4.45Å; W90-I115 HydrophobicContact CZ2-CD1 4.31Å; L95-I115 HydrophobicContact CD1-CB 4.42Å; L95-I115 HydrophobicContact CD1-CG2 3.74Å; V110-I115 HydrophobicContact CG1-CG2 3.86Å; S112-I115 WeakPolarHBondContact O-CG1 3.46Å; S112-I115 PolarHBondContact O-N 2.76Å; I115-L117 HydrophobicContact CD1-CD2 4.08Å; I115-L117 HydrophobicContact CG1-CD2 3.93Å; I115-A137 HydrophobicContact CD1-CB 3.73Å; I115-I145 HydrophobicContact CD1-CD1 4.3Å; I115-I145 HydrophobicContact CD1-CG2 4.05Å
116	W	95.9	Very high	93.5	Very high	6 Å²	6	41.5 Å²	41.5	2%	0.023	21%	0.207	C	C	.	.			trans	-66.2	132.9	167.2	179.5	90.6	0	0	0	109	Y45 K47 R50 P51 I59 W90 P118 Y180 V185	Y45-W116 PolarHBondContact OH-N 3.21Å; K47-W116 WeakPolarHBondContact O-CA 3.37Å; K47-W116 VanDerWaalsContact O-CB 3.32Å; K47-W116 WeakPolarHBondContact O-CB 3.44Å; R50-W116 HydrophobicContact CG-CZ2 4.02Å; P51-W116 HydrophobicContact CG-CD2 4.08Å; P51-W116 HydrophobicContact CG-CE3 3.75Å; P51-W116 HydrophobicContact CG-CG 4.45Å; P51-W116 HydrophobicContact CG-CZ3 4.29Å; I59-W116 HydrophobicContact CD1-CH2 3.59Å; I59-W116 HydrophobicContact CD1-CZ2 3.92Å; I59-W116 HydrophobicContact CD1-CZ3 3.98Å; I59-W116 HydrophobicContact CG2-CH2 4.2Å; I59-W116 HydrophobicContact CG2-CZ3 4.26Å; W90-W116 AromaticContact CD1-CZ3 3.84Å; W90-W116 HydrophobicContact CG-CZ3 4.36Å; W90-W116 WeakPolarHBondContact CZ2-O 3.25Å; W90-W116 AromaticContact NE1-CE3 3.7Å; W90-W116 AromaticContact NE1-CZ3 3.85Å; W116-P118 HydrophobicContact CH2-CB 3.91Å; W116-P118 HydrophobicContact CZ3-CB 4.2Å; W116-Y180 HydrophobicContact CZ2-CE2 4.14Å; W116-Y180 PolarHBondContact NE1-OH 2.96Å; W116-V185 HydrophobicContact CH2-CG2 4.43Å; W116-V185 HydrophobicContact CZ2-CG2 4.46Å
117	L	94.9	Very high	92.8	Very high	51 Å²	51	41.2 Å²	41.2	27%	0.267	20%	0.202	S	C	.	.			trans	-121.7	140.6	176.6	-59.7	173.4	0	0	0	108.8	W90 S112 I115 W147	W90-L117 HydrophobicContact CH2-CD2 3.73Å; W90-L117 HydrophobicContact CZ2-CD2 3.9Å; S112-L117 WeakPolarHBondContact O-CD1 3.39Å; I115-L117 HydrophobicContact CD1-CD2 4.08Å; I115-L117 HydrophobicContact CG1-CD2 3.93Å; L117-W147 HydrophobicContact CD1-CH2 3.97Å; L117-W147 HydrophobicContact CD1-CZ2 4.33Å; L117-W147 HydrophobicContact CD1-CZ3 4.17Å; L117-W147 HydrophobicContact CD2-CD2 4.14Å; L117-W147 HydrophobicContact CD2-CE3 3.91Å; L117-W147 HydrophobicContact CD2-CZ3 4.15Å
118	P	94.2	Very high	91.9	Very high	7 Å²	7	40.8 Å²	40.8	5%	0.045	21%	0.21	C	C	.	.			trans	-68.9	143.2	167	32.2	-35.1	0	0	0	109.8	V61 W90 W116 V120	V61-P118 HydrophobicContact CG1-CG 4.12Å; V61-P118 HydrophobicContact CG2-CB 3.96Å; V61-P118 HydrophobicContact CG2-CG 4.19Å; W90-P118 HydrophobicContact CD2-CG 4.47Å; W90-P118 HydrophobicContact CE3-CG 4.17Å; W90-P118 HydrophobicContact CZ3-CG 4.28Å; W116-P118 HydrophobicContact CH2-CB 3.91Å; W116-P118 HydrophobicContact CZ3-CB 4.2Å; P118-V120 HydrophobicContact CB-CG2 4.18Å; P118-V120 HydrophobicContact CG-CG2 4.46Å; P118-V120 PolarHBondContact O-N 2.91Å; P118-V120 VanDerWaalsContact O-N 3.13Å
119	D	92.1	Very high	91.1	Very high	38 Å²	38	50.3 Å²	50.3	20%	0.203	25%	0.246	C	C	.	.			trans	-89.1	50.9	-178.1	64.1	-21.2	0	0	0	111.6	V121 S177 W178 T179 Y180	D119-V121 PolarHBondContact O-N 2.86Å; D119-S177 WeakPolarHBondContact O-CA 3.43Å; D119-S177 WeakPolarHBondContact OD1-CB 3.4Å; D119-S177 PolarHBondContact OD1-OG 3.38Å; D119-S177 PolarHBondContact OD2-OG 2.93Å; D119-W178 PolarHBondContact O-N 2.84Å; D119-W178 VanDerWaalsContact O-N 3.11Å; D119-W178 PolarHBondContact OD2-N 2.76Å; D119-T179 VanDerWaalsContact OD2-CB 3.3Å; D119-T179 WeakPolarHBondContact OD2-CB 3.27Å; D119-T179 WeakPolarHBondContact OD2-CG2 3.47Å; D119-T179 PolarHBondContact OD2-N 3.13Å; D119-T179 PolarHBondContact OD2-OG1 2.88Å; D119-Y180 VanDerWaalsContact OD1-CD2 3.27Å; D119-Y180 WeakPolarHBondContact OD1-CD2 3.33Å
120	V	93.1	Very high	90.2	Very high	10 Å²	10	45.8 Å²	45.8	6%	0.061	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	116.3	177.2	-174.3	0	0	0	0	109.2	F63 P118 F175 G176	F63-V120 HydrophobicContact CD2-CG1 4.1Å; F63-V120 HydrophobicContact CE2-CG1 3.85Å; F63-V120 HydrophobicContact CZ-CG1 4.32Å; P118-V120 HydrophobicContact CB-CG2 4.18Å; P118-V120 HydrophobicContact CG-CG2 4.46Å; P118-V120 PolarHBondContact O-N 2.91Å; P118-V120 VanDerWaalsContact O-N 3.13Å; V120-F175 HydrophobicContact CG1-CB 4.07Å; V120-F175 HydrophobicContact CG1-CD1 4.49Å; V120-G176 WeakPolarHBondContact CA-O 3.39Å
121	V	93.5	Very high	89.3	Confident	15 Å²	15	54.5 Å²	54.5	9%	0.091	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	157.4	-177.9	-60.5	0	0	0	0	111.1	D119 Y123 F130 F175 G176 W178	D119-V121 PolarHBondContact O-N 2.86Å; V121-Y123 HydrophobicContact CG2-CD1 3.94Å; V121-Y123 HydrophobicContact CG2-CE1 3.91Å; V121-F130 HydrophobicContact CB-CB 4.38Å; V121-F130 HydrophobicContact CG1-CB 4.19Å; V121-F175 WeakPolarHBondContact O-CA 3.41Å; V121-G176 PolarHBondContact N-O 3.39Å; V121-G176 PolarHBondContact O-N 3.5Å; V121-G176 VanDerWaalsContact O-N 3.16Å; V121-W178 HydrophobicContact CG2-CB 3.95Å; V121-W178 HydrophobicContact CG2-CD2 4.34Å; V121-W178 HydrophobicContact CG2-CE3 3.7Å; V121-W178 HydrophobicContact CG2-CG 4.49Å
122	L	94.1	Very high	88.3	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	117.4	168.4	177.2	67.2	0	0	0	109.2	N125 Y153 M173 K174 F175	L122-N125 HydrophobicContact CB-CB 4.23Å; L122-N125 HydrophobicContact CD2-CB 3.91Å; L122-N125 HydrophobicContact CG-CB 4.02Å; L122-N125 WeakPolarHBondContact O-CB 3.43Å; L122-Y153 HydrophobicContact CB-CD1 4.05Å; L122-Y153 HydrophobicContact CB-CE1 3.93Å; L122-Y153 HydrophobicContact CD2-CD1 3.59Å; L122-Y153 HydrophobicContact CD2-CE1 4.33Å; L122-Y153 HydrophobicContact CD2-CG 3.72Å; L122-Y153 HydrophobicContact CG-CD1 4.49Å; L122-M173 HydrophobicContact CD1-CB 3.85Å; L122-M173 HydrophobicContact CD1-CE 4.32Å; L122-M173 HydrophobicContact CD1-CG 4.46Å; L122-M173 HydrophobicContact CD2-CE 4.02Å; L122-K174 WeakPolarHBondContact CA-O 3.3Å; L122-F175 HydrophobicContact CB-CD1 4.24Å; L122-F175 HydrophobicContact CB-CE1 3.92Å; L122-F175 HydrophobicContact CD1-CE1 4.29Å; L122-F175 HydrophobicContact CD1-CE2 4.35Å; L122-F175 HydrophobicContact CD1-CZ 4.17Å
123	Y	91.8	Very high	87.8	Confident	58 Å²	58	57.8 Å²	57.8	23%	0.227	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-39.8	-179.7	-67.5	-22.5	0	0	0	112.9	V121 N125 K174 S177 W178 T226	V121-Y123 HydrophobicContact CG2-CD1 3.94Å; V121-Y123 HydrophobicContact CG2-CE1 3.91Å; Y123-N125 PolarHBondContact O-N 2.85Å; Y123-N125 VanDerWaalsContact O-N 3.12Å; Y123-K174 HydrophobicContact CD2-CD 4.04Å; Y123-K174 HydrophobicContact CD2-CG 4.03Å; Y123-K174 PolarHBondContact N-O 3.27Å; Y123-S177 PolarHBondContact OH-O 2.8Å; Y123-W178 HydrophobicContact CD1-CE3 4.01Å; Y123-W178 HydrophobicContact CD1-CZ3 4.06Å; Y123-W178 AromaticContact CE1-CE3 3.9Å; Y123-W178 HydrophobicContact CE1-CE3 3.9Å; Y123-W178 HydrophobicContact CE1-CZ3 4.33Å; Y123-T226 HydrophobicContact CE2-CG2 3.76Å
124	D	89.9	Confident	87.5	Confident	63 Å²	63	60.2 Å²	60.2	34%	0.337	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	31.1	-175.5	-54.4	-46.2	0	0	0	112.4	S155 A156 K174	D124-S155 CarbonylContact O-C 3.53Å; D124-S155 WeakPolarHBondContact O-CA 3.5Å; D124-A156 PolarHBondContact O-N 3.33Å; D124-K174 WeakPolarHBondContact OD2-CB 3.45Å
125	N	90.9	Very high	87.5	Confident	15 Å²	15	55.7 Å²	55.7	8%	0.08	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-84.1	126.5	-176.7	-174.2	34.1	0	0	0	111.6	L122 Y123 R129 F130 K154	L122-N125 HydrophobicContact CB-CB 4.23Å; L122-N125 HydrophobicContact CD2-CB 3.91Å; L122-N125 HydrophobicContact CG-CB 4.02Å; L122-N125 WeakPolarHBondContact O-CB 3.43Å; Y123-N125 PolarHBondContact O-N 2.85Å; Y123-N125 VanDerWaalsContact O-N 3.12Å; N125-R129 PolarHBondContact ND2-O 2.83Å; N125-F130 HydrophobicContact CB-CD1 4Å; N125-F130 HydrophobicContact CB-CE1 3.75Å; N125-K154 WeakPolarHBondContact CA-O 3.45Å; N125-K154 PolarHBondContact OD1-O 2.93Å; N125-K154 VanDerWaalsContact OD1-O 3.12Å
126	S	84.8	Confident	87.5	Confident	53 Å²	53	62.2 Å²	62.2	37%	0.371	32%	0.323	S	S	.	.	S	Bend	trans	-92.4	-14.8	-177.5	65.7	0	0	0	0	114.3	L79 G128 K154	L79-S126 VanDerWaalsContact CD2-CB 3.42Å; L79-S126 WeakPolarHBondContact CD2-OG 3.2Å; S126-G128 VanDerWaalsContact C-N 3.35Å; S126-G128 PolarHBondContact O-N 2.89Å; S126-K154 PolarHBondContact N-O 3.46Å; S126-K154 WeakPolarHBondContact OG-CB 3.39Å; S126-K154 PolarHBondContact OG-O 2.78Å
127	D	81.2	Confident	87.5	Confident	63 Å²	63	61.9 Å²	61.9	34%	0.337	32%	0.322	S	S	.	.	S	Bend	trans	-84.2	-5.9	-172.7	-97.1	8	0	0	0	114.3	R129 K154	D127-R129 PolarHBondContact O-N 2.79Å; D127-R129 VanDerWaalsContact O-N 3.07Å; D127-K154 HydrophobicContact CB-CB 4.39Å; D127-K154 WeakPolarHBondContact OD1-CD 3.24Å; D127-K154 WeakPolarHBondContact OD1-CE 3.37Å; D127-K154 IonicContact OD1-NZ 3.23Å; D127-K154 PolarHBondContact OD1-NZ 3.45Å; D127-K154 WeakPolarHBondContact OD2-CD 3.28Å; D127-K154 WeakPolarHBondContact OD2-CE 3.38Å; D127-K154 VanDerWaalsContact OD2-CG 3.31Å; D127-K154 WeakPolarHBondContact OD2-CG 3.45Å; D127-K154 IonicContact OD2-NZ 2.69Å; D127-K154 PolarHBondContact OD2-NZ 2.8Å
128	G	75.4	Confident	87.6	Confident	53 Å²	53	62 Å²	62	55%	0.546	33%	0.325	S	S	.	.	S	Bend	trans	68.6	0.1	-177.7	0	0	0	0	0	115	S126 F130	S126-G128 VanDerWaalsContact C-N 3.35Å; S126-G128 PolarHBondContact O-N 2.89Å; G128-F130 WeakPolarHBondContact O-CD2 3.49Å
129	R	79.5	Confident	87.8	Confident	204 Å²	204	61.7 Å²	61.7	77%	0.77	32%	0.323	S	S	*	.			trans	-103	98.2	175.2	-65	-177.4	-177.4	-172.2	1.3	110.1	N125 D127	N125-R129 PolarHBondContact ND2-O 2.83Å; D127-R129 PolarHBondContact O-N 2.79Å; D127-R129 VanDerWaalsContact O-N 3.07Å
130	F	76.9	Confident	88.1	Confident	77 Å²	77	64 Å²	64	34%	0.338	33%	0.331	S	S	.	.			trans	-92	-17.5	-174	-60.8	-84.9	0	0	0	113.7	V121 N125 G128	V121-F130 HydrophobicContact CB-CB 4.38Å; V121-F130 HydrophobicContact CG1-CB 4.19Å; N125-F130 HydrophobicContact CB-CD1 4Å; N125-F130 HydrophobicContact CB-CE1 3.75Å; G128-F130 WeakPolarHBondContact O-CD2 3.49Å
131	E	76.3	Confident	88.2	Confident	183 Å²	183	69 Å²	69	86%	0.855	35%	0.35	S	S	*	.	S	Bend	trans	-89.6	140	-179	-64	179.2	-178.3	0	0	112
132	G	73.9	Confident	88.3	Confident	25 Å²	25	71.1 Å²	71.1	26%	0.258	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-77.6	170.5	176.3	0	0	0	0	0	113.6
133	T	83.1	Confident	88.4	Confident	80 Å²	80	71.1 Å²	71.1	49%	0.491	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-65.8	134.6	177.6	-47.1	0	0	0	0	111.3	T135 P149 P150	T133-T135 HydrophobicContact CG2-CG2 4.47Å; T133-T135 PolarHBondContact O-N 3.35Å; T133-T135 VanDerWaalsContact O-N 3.15Å; T133-P149 WeakPolarHBondContact O-CB 3.41Å; T133-P150 WeakPolarHBondContact CB-O 3.31Å; T133-P150 PolarHBondContact OG1-O 2.77Å
134	I	86.8	Confident	88.7	Confident	123 Å²	123	69.1 Å²	69.1	63%	0.631	36%	0.355	S	S	*	.			trans	-70.2	110.8	174.8	-57.1	173.9	0	0	0	109.2	D113	D113-I134 HydrophobicContact CB-CG2 4.16Å
135	T	93.9	Very high	89	Confident	40 Å²	40	66.1 Å²	66.1	25%	0.245	34%	0.339	C	S	.	.			trans	-122.6	177.6	175	61.6	0	0	0	0	111	S112 T133 W147 P150	S112-T135 WeakPolarHBondContact CB-O 3.47Å; S112-T135 PolarHBondContact N-O 2.87Å; S112-T135 PolarHBondContact OG-N 2.94Å; S112-T135 PolarHBondContact OG-O 3.2Å; T133-T135 HydrophobicContact CG2-CG2 4.47Å; T133-T135 PolarHBondContact O-N 3.35Å; T133-T135 VanDerWaalsContact O-N 3.15Å; T135-W147 PolarHBondContact OG1-NE1 2.99Å; T135-P150 HydrophobicContact CG2-CG 4.46Å
136	K	95.3	Very high	89.3	Confident	142 Å²	142	67.1 Å²	67.1	62%	0.617	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	136.6	171.5	-65.7	-175.7	-179.5	-177.6	0	109.8	R109 V110	R109-K136 HydrophobicContact CB-CD 4.36Å; V110-K136 CarbonylContact O-C 3.33Å; V110-K136 VanDerWaalsContact O-CA 3.3Å; V110-K136 WeakPolarHBondContact O-CA 3.28Å
137	A	96.5	Very high	89.9	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	152.1	167.8	0	0	0	0	0	110.3	R109 V110 I115 I145 W147	R109-A137 WeakPolarHBondContact CA-O 3.49Å; V110-A137 PolarHBondContact N-O 2.68Å; V110-A137 PolarHBondContact O-N 3.09Å; I115-A137 HydrophobicContact CD1-CB 3.73Å; A137-I145 HydrophobicContact CB-CG2 3.95Å; A137-W147 HydrophobicContact CB-CB 3.99Å; A137-W147 HydrophobicContact CB-CG 4.17Å
138	V	97.4	Very high	90.5	Very high	52 Å²	52	65.5 Å²	65.5	32%	0.315	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	119.2	173.3	-178	0	0	0	0	107.8	R109 I145 S146	R109-V138 HydrophobicContact CG-CG2 4.44Å; V138-I145 WeakPolarHBondContact O-CA 3.29Å; V138-S146 PolarHBondContact N-O 2.94Å; V138-S146 PolarHBondContact O-N 2.88Å
139	V	97.4	Very high	91.4	Very high	1 Å²	1	63 Å²	63	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.8	178.3	-171.4	0	0	0	0	108.3	L95 W97 T107 I108 V110 I145	L95-V139 HydrophobicContact CB-CG1 4.15Å; W97-V139 HydrophobicContact CH2-CG1 4.43Å; W97-V139 HydrophobicContact CZ3-CG1 3.99Å; T107-V139 CarbonylContact C-O 3.58Å; T107-V139 VanDerWaalsContact CA-O 3.27Å; T107-V139 WeakPolarHBondContact CA-O 3.43Å; I108-V139 HydrophobicContact CG1-CB 3.91Å; I108-V139 PolarHBondContact N-O 2.79Å; I108-V139 PolarHBondContact O-N 3.27Å; V110-V139 HydrophobicContact CB-CG2 4.26Å; V110-V139 HydrophobicContact CG2-CG2 3.84Å; V139-I145 HydrophobicContact CB-CG1 4.47Å; V139-I145 HydrophobicContact CG1-CG1 4.04Å; V139-I145 HydrophobicContact CG2-CG1 4.12Å
140	K	97.6	Very high	92.2	Very high	88 Å²	88	55.4 Å²	55.4	38%	0.383	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	158.3	174.1	-67.7	177.6	-177.7	169.4	0	110.7	W97 T106 T107 D142 G143 T144	W97-K140 WeakPolarHBondContact CH2-O 3.41Å; W97-K140 WeakPolarHBondContact CZ3-O 3.32Å; T106-K140 CarbonylContact O-C 3.59Å; T106-K140 WeakPolarHBondContact O-CA 3.4Å; T107-K140 HydrophobicContact CG2-CG 4.09Å; K140-D142 WeakPolarHBondContact CB-OD1 3.42Å; K140-D142 PolarHBondContact O-N 3.07Å; K140-G143 PolarHBondContact O-N 3.18Å; K140-T144 PolarHBondContact N-O 3.27Å
141	Y	96.3	Very high	92.9	Very high	113 Å²	113	52.2 Å²	52.2	44%	0.443	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.3	-176.5	74.9	-83.7	0	0	0	114.7	R96 W97 P99 T106 G143	R96-Y141 WeakPolarHBondContact CA-O 3.36Å; W97-Y141 VanDerWaalsContact CH2-N 3.35Å; W97-Y141 PolarHBondContact N-O 2.82Å; W97-Y141 VanDerWaalsContact N-O 3.14Å; P99-Y141 HydrophobicContact CG-CD1 4.33Å; P99-Y141 HydrophobicContact CG-CD2 3.74Å; P99-Y141 HydrophobicContact CG-CE2 4.39Å; P99-Y141 HydrophobicContact CG-CG 3.7Å; T106-Y141 HydrophobicContact CG2-CD1 4.37Å; T106-Y141 PolarHBondContact O-N 2.97Å; Y141-G143 PolarHBondContact O-N 3.44Å
142	D	96.2	Very high	93.7	Very high	61 Å²	61	47.9 Å²	47.9	33%	0.326	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	0.1	175.5	66.9	-17.5	0	0	0	113.3	R96 K140 T144	R96-D142 WeakPolarHBondContact CG-O 3.42Å; R96-D142 PolarHBondContact NE-O 3.37Å; R96-D142 PolarHBondContact NH2-O 3.28Å; K140-D142 WeakPolarHBondContact CB-OD1 3.42Å; K140-D142 PolarHBondContact O-N 3.07Å; D142-T144 VanDerWaalsContact C-N 3.32Å; D142-T144 VanDerWaalsContact OD1-CB 3.25Å; D142-T144 WeakPolarHBondContact OD1-CB 3.35Å; D142-T144 PolarHBondContact OD1-N 3.03Å; D142-T144 PolarHBondContact OD1-OG1 3.16Å; D142-T144 PolarHBondContact OD2-OG1 3.47Å
143	G	95.3	Very high	94.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	84	3.3	-176.8	0	0	0	0	0	113.4	V91 D92 K140 Y141 I145	V91-G143 WeakPolarHBondContact CA-O 3.32Å; D92-G143 PolarHBondContact N-O 2.97Å; D92-G143 WeakPolarHBondContact O-CA 3.47Å; K140-G143 PolarHBondContact O-N 3.18Å; Y141-G143 PolarHBondContact O-N 3.44Å; G143-I145 PolarHBondContact O-N 3.11Å
144	T	97.4	Very high	95.1	Very high	16 Å²	16	46.2 Å²	46.2	10%	0.098	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	123.3	175.3	-58.2	0	0	0	0	109.7	E89 K140 D142	E89-T144 HydrophobicContact CG-CG2 3.74Å; K140-T144 PolarHBondContact N-O 3.27Å; D142-T144 VanDerWaalsContact C-N 3.32Å; D142-T144 VanDerWaalsContact OD1-CB 3.25Å; D142-T144 WeakPolarHBondContact OD1-CB 3.35Å; D142-T144 PolarHBondContact OD1-N 3.03Å; D142-T144 PolarHBondContact OD1-OG1 3.16Å; D142-T144 PolarHBondContact OD2-OG1 3.47Å
145	I	97.8	Very high	95.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.6	179.7	-59.6	173.2	0	0	0	108.2	E89 W90 D92 L95 I115 A137 V138 V139 G143	E89-I145 VanDerWaalsContact CA-O 3.28Å; E89-I145 WeakPolarHBondContact CA-O 3.43Å; W90-I145 HydrophobicContact CD2-CB 4.23Å; W90-I145 HydrophobicContact CD2-CG2 4.45Å; W90-I145 HydrophobicContact CH2-CG2 3.71Å; W90-I145 HydrophobicContact CZ2-CB 4.05Å; W90-I145 HydrophobicContact CZ2-CD1 4.18Å; W90-I145 HydrophobicContact CZ2-CG2 3.52Å; W90-I145 HydrophobicContact CZ3-CG2 4.25Å; W90-I145 PolarHBondContact N-O 3.23Å; W90-I145 VanDerWaalsContact N-O 3.11Å; W90-I145 PolarHBondContact O-N 2.95Å; D92-I145 HydrophobicContact CB-CD1 3.51Å; D92-I145 HydrophobicContact CB-CG1 4.39Å; L95-I145 HydrophobicContact CD1-CD1 3.93Å; I115-I145 HydrophobicContact CD1-CD1 4.3Å; I115-I145 HydrophobicContact CD1-CG2 4.05Å; A137-I145 HydrophobicContact CB-CG2 3.95Å; V138-I145 WeakPolarHBondContact O-CA 3.29Å; V139-I145 HydrophobicContact CB-CG1 4.47Å; V139-I145 HydrophobicContact CG1-CG1 4.04Å; V139-I145 HydrophobicContact CG2-CG1 4.12Å; G143-I145 PolarHBondContact O-N 3.11Å
146	S	97	Very high	95.4	Very high	35 Å²	35	40.7 Å²	40.7	25%	0.245	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.3	169.2	177.6	0	0	0	0	109.4	Q88 V138	Q88-S146 WeakPolarHBondContact O-CA 3.07Å; V138-S146 PolarHBondContact N-O 2.94Å; V138-S146 PolarHBondContact O-N 2.88Å
147	W	96.2	Very high	95.2	Very high	18 Å²	18	34.3 Å²	34.3	7%	0.068	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	115.7	179.8	-176.8	46.9	0	0	0	110.3	Q88 W90 L117 T135 A137 P149	Q88-W147 WeakPolarHBondContact CB-O 3.38Å; Q88-W147 PolarHBondContact N-O 2.88Å; Q88-W147 PolarHBondContact O-N 2.9Å; W90-W147 HydrophobicContact CH2-CB 3.72Å; W90-W147 HydrophobicContact CH2-CE3 4.19Å; W90-W147 HydrophobicContact CH2-CG 4.41Å; W90-W147 HydrophobicContact CZ3-CB 3.79Å; W90-W147 HydrophobicContact CZ3-CE3 4.41Å; L117-W147 HydrophobicContact CD1-CH2 3.97Å; L117-W147 HydrophobicContact CD1-CZ2 4.33Å; L117-W147 HydrophobicContact CD1-CZ3 4.17Å; L117-W147 HydrophobicContact CD2-CD2 4.14Å; L117-W147 HydrophobicContact CD2-CE3 3.91Å; L117-W147 HydrophobicContact CD2-CZ3 4.15Å; T135-W147 PolarHBondContact OG1-NE1 2.99Å; A137-W147 HydrophobicContact CB-CB 3.99Å; A137-W147 HydrophobicContact CB-CG 4.17Å; W147-P149 VanDerWaalsContact C-CD 3.42Å; W147-P149 HydrophobicContact CD2-CG 3.95Å; W147-P149 HydrophobicContact CE3-CG 4.15Å; W147-P149 HydrophobicContact CH2-CB 4.38Å; W147-P149 HydrophobicContact CH2-CG 3.87Å; W147-P149 HydrophobicContact CZ2-CB 3.72Å; W147-P149 HydrophobicContact CZ2-CG 3.62Å; W147-P149 HydrophobicContact CZ3-CG 4.12Å; W147-P149 VanDerWaalsContact O-CD 3.3Å; W147-P149 WeakPolarHBondContact O-CD 3.35Å
148	N	94.4	Very high	94.9	Very high	65 Å²	65	39.2 Å²	39.2	35%	0.348	21%	0.213	S	C	.	.			trans	-120	69.3	-175.4	-58.8	-13.6	0	0	0	111	M86 K87	M86-N148 VanDerWaalsContact O-CA 3.28Å; M86-N148 WeakPolarHBondContact O-CA 3.33Å; K87-N148 WeakPolarHBondContact CA-OD1 3.41Å
149	P	95	Very high	94.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.202	C	C	.	.			trans	-70.8	140.1	179.1	30.5	-37.2	0	0	0	111.4	M86 T133 W147	M86-P149 HydrophobicContact CB-CG 4.33Å; M86-P149 HydrophobicContact CE-CG 3.73Å; M86-P149 PolarHBondContact N-O 2.87Å; M86-P149 VanDerWaalsContact N-O 3.16Å; M86-P149 WeakPolarHBondContact O-CD 3.41Å; T133-P149 WeakPolarHBondContact O-CB 3.41Å; W147-P149 VanDerWaalsContact C-CD 3.42Å; W147-P149 HydrophobicContact CD2-CG 3.95Å; W147-P149 HydrophobicContact CE3-CG 4.15Å; W147-P149 HydrophobicContact CH2-CB 4.38Å; W147-P149 HydrophobicContact CH2-CG 3.87Å; W147-P149 HydrophobicContact CZ2-CB 3.72Å; W147-P149 HydrophobicContact CZ2-CG 3.62Å; W147-P149 HydrophobicContact CZ3-CG 4.12Å; W147-P149 VanDerWaalsContact O-CD 3.3Å; W147-P149 WeakPolarHBondContact O-CD 3.35Å
150	P	94.5	Very high	94	Very high	44 Å²	44	41 Å²	41	29%	0.286	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	139.4	167.1	31.9	-32.1	0	0	0	109.9	V84 W85 T133 T135	V84-P150 WeakPolarHBondContact O-CA 3.31Å; W85-P150 HydrophobicContact CD2-CB 4.3Å; W85-P150 HydrophobicContact CE3-CB 3.95Å; W85-P150 HydrophobicContact CE3-CG 4.48Å; W85-P150 HydrophobicContact CH2-CB 4.25Å; W85-P150 HydrophobicContact CZ3-CB 3.93Å; W85-P150 HydrophobicContact CZ3-CG 4.11Å; T133-P150 WeakPolarHBondContact CB-O 3.31Å; T133-P150 PolarHBondContact OG1-O 2.77Å; T135-P150 HydrophobicContact CG2-CG 4.46Å
151	A	92.4	Very high	93.5	Very high	10 Å²	10	37.1 Å²	37.1	8%	0.083	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	141.6	176.9	0	0	0	0	0	110.6	V84 M86 Y153	V84-A151 HydrophobicContact CG2-CB 4.42Å; V84-A151 PolarHBondContact N-O 2.79Å; V84-A151 PolarHBondContact O-N 3.5Å; M86-A151 HydrophobicContact CE-CB 4.19Å; A151-Y153 HydrophobicContact CB-CD2 3.94Å; A151-Y153 HydrophobicContact CB-CE1 4.4Å; A151-Y153 HydrophobicContact CB-CE2 3.44Å; A151-Y153 VanDerWaalsContact CB-CE2 3.44Å
152	N	92.6	Very high	93.1	Very high	92 Å²	92	33.1 Å²	33.1	49%	0.492	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	111.3	166.2	-179.6	-15.3	0	0	0	107.1	T81 T82	T81-N152 VanDerWaalsContact CG2-OD1 3.29Å; T81-N152 WeakPolarHBondContact CG2-OD1 3.48Å; T82-N152 WeakPolarHBondContact O-CA 3.32Å
153	Y	93.9	Very high	92.6	Very high	5 Å²	5	32.2 Å²	32.2	2%	0.02	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133.1	-179.2	-76.3	-57.2	0	0	0	111.3	T81 T82 V84 M86 L122 A151 M173 F175	T81-Y153 CarbonylContact C-O 3.59Å; T81-Y153 WeakPolarHBondContact CA-O 3.48Å; T82-Y153 PolarHBondContact N-O 3.16Å; T82-Y153 PolarHBondContact O-N 2.86Å; V84-Y153 HydrophobicContact CG2-CD2 3.51Å; V84-Y153 HydrophobicContact CG2-CE2 3.83Å; M86-Y153 VanDerWaalsContact CE-OH 3.25Å; M86-Y153 WeakPolarHBondContact CE-OH 3.33Å; M86-Y153 HydrophobicContact CG-CE2 4.24Å; M86-Y153 HydrophobicContact SD-CE2 3.9Å; M86-Y153 PolarHBondContact SD-OH 3.39Å; L122-Y153 HydrophobicContact CB-CD1 4.05Å; L122-Y153 HydrophobicContact CB-CE1 3.93Å; L122-Y153 HydrophobicContact CD2-CD1 3.59Å; L122-Y153 HydrophobicContact CD2-CE1 4.33Å; L122-Y153 HydrophobicContact CD2-CG 3.72Å; L122-Y153 HydrophobicContact CG-CD1 4.49Å; A151-Y153 HydrophobicContact CB-CD2 3.94Å; A151-Y153 HydrophobicContact CB-CE1 4.4Å; A151-Y153 HydrophobicContact CB-CE2 3.44Å; A151-Y153 VanDerWaalsContact CB-CE2 3.44Å; Y153-M173 HydrophobicContact CD2-CE 3.84Å; Y153-M173 HydrophobicContact CG-CE 4.01Å; Y153-F175 HydrophobicContact CD2-CE1 4.37Å; Y153-F175 HydrophobicContact CD2-CZ 4.24Å; Y153-F175 AromaticContact CE2-CE1 3.77Å; Y153-F175 HydrophobicContact CE2-CE1 3.77Å; Y153-F175 HydrophobicContact CE2-CZ 4.03Å
154	K	94	Very high	92.2	Very high	65 Å²	65	33 Å²	33	28%	0.283	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	96	164.5	-59.2	-155.2	-155	123.7	0	109.1	M80 T81 N125 S126 D127	M80-K154 WeakPolarHBondContact O-CA 3.32Å; T81-K154 HydrophobicContact CG2-CG 4.13Å; N125-K154 WeakPolarHBondContact CA-O 3.45Å; N125-K154 PolarHBondContact OD1-O 2.93Å; N125-K154 VanDerWaalsContact OD1-O 3.12Å; S126-K154 PolarHBondContact N-O 3.46Å; S126-K154 WeakPolarHBondContact OG-CB 3.39Å; S126-K154 PolarHBondContact OG-O 2.78Å; D127-K154 HydrophobicContact CB-CB 4.39Å; D127-K154 WeakPolarHBondContact OD1-CD 3.24Å; D127-K154 WeakPolarHBondContact OD1-CE 3.37Å; D127-K154 IonicContact OD1-NZ 3.23Å; D127-K154 PolarHBondContact OD1-NZ 3.45Å; D127-K154 WeakPolarHBondContact OD2-CD 3.28Å; D127-K154 WeakPolarHBondContact OD2-CE 3.38Å; D127-K154 VanDerWaalsContact OD2-CG 3.31Å; D127-K154 WeakPolarHBondContact OD2-CG 3.45Å; D127-K154 IonicContact OD2-NZ 2.69Å; D127-K154 PolarHBondContact OD2-NZ 2.8Å
155	S	94.4	Very high	91.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	134.1	178.3	54.4	0	0	0	0	110.6	M80 D124 C157	M80-S155 VanDerWaalsContact CE-OG 3.31Å; M80-S155 WeakPolarHBondContact CE-OG 3.05Å; M80-S155 PolarHBondContact N-O 2.64Å; M80-S155 PolarHBondContact O-N 3.37Å; M80-S155 PolarHBondContact O-OG 3.5Å; D124-S155 CarbonylContact O-C 3.53Å; D124-S155 WeakPolarHBondContact O-CA 3.5Å; S155-C157 PolarHBondContact O-N 2.68Å
156	A	92.5	Very high	91.3	Very high	48 Å²	48	33.8 Å²	33.8	40%	0.397	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	128.4	169.5	0	0	0	0	0	110.3	L79 D124	L79-A156 HydrophobicContact CD2-CB 4.44Å; D124-A156 PolarHBondContact O-N 3.33Å
157	C	91.4	Very high	90.9	Very high	8 Å²	8	32.4 Å²	32.4	5%	0.054	18%	0.18	C	C	.	.			trans	-141.9	128.8	179.6	174.9	0	0	0	0	110.4	Q78 M80 S155 I159 C171	Q78-C157 CarbonylContact C-O 3.5Å; Q78-C157 WeakPolarHBondContact CB-O 3.3Å; Q78-C157 PolarHBondContact O-N 3.14Å; Q78-C157 VanDerWaalsContact O-O 3.1Å; M80-C157 HydrophobicContact CB-CB 4.47Å; S155-C157 PolarHBondContact O-N 2.68Å; C157-I159 HydrophobicContact CB-CD1 4.35Å; C157-I159 PolarHBondContact O-N 2.91Å; C157-C171 HydrophobicContact CB-CB 3.73Å; C157-C171 WeakPolarHBondContact CB-SG 3.35Å; C157-C171 WeakPolarHBondContact SG-CA 3.47Å; C157-C171 WeakPolarHBondContact SG-CB 3.42Å; C157-C171 CovalentContact SG-SG 2.04Å; C157-C171 PolarHBondContact SG-SG 3.03Å
158	T	88.8	Confident	90.6	Very high	102 Å²	102	35.2 Å²	35.2	63%	0.626	20%	0.196	S	C	*	.			trans	-75.8	115.6	175.5	55.7	0	0	0	0	110.4
159	I	88.9	Confident	90.5	Very high	15 Å²	15	32.3 Å²	32.3	8%	0.077	18%	0.181	C	C	.	.			trans	-94.2	130.4	-179.7	-53.7	-56.4	0	0	0	110.3	V73 E75 C157 V161 Q169	V73-I159 HydrophobicContact CG1-CD1 3.87Å; E75-I159 HydrophobicContact CB-CG2 4.21Å; E75-I159 HydrophobicContact CG-CG2 4.02Å; C157-I159 HydrophobicContact CB-CD1 4.35Å; C157-I159 PolarHBondContact O-N 2.91Å; I159-V161 HydrophobicContact CG2-CG1 3.98Å; I159-Q169 HydrophobicContact CD1-CB 4.49Å; I159-Q169 HydrophobicContact CD1-CG 4.34Å; I159-Q169 HydrophobicContact CG2-CG 4.28Å
160	D	87.9	Confident	90.5	Very high	77 Å²	77	36.6 Å²	36.6	41%	0.412	20%	0.204	S	C	.	.			trans	-99.4	107.1	173	-180	6.9	0	0	0	110.5	T162 Q169	D160-T162 VanDerWaalsContact OD1-CB 3.29Å; D160-T162 WeakPolarHBondContact OD1-CB 3.42Å; D160-T162 PolarHBondContact OD1-N 3.36Å; D160-T162 PolarHBondContact OD1-OG1 3.03Å; D160-Q169 PolarHBondContact O-NE2 2.91Å
161	V	87.6	Confident	90.5	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.03	19%	0.19	C	C	.	.			trans	-92.9	8.4	-176.7	-64.4	0	0	0	0	113.9	I159 F163 F164 I290 P291 P298	I159-V161 HydrophobicContact CG2-CG1 3.98Å; V161-F163 VanDerWaalsContact C-N 3.26Å; V161-F163 PolarHBondContact O-N 3.21Å; V161-F164 WeakPolarHBondContact O-CB 3.3Å; V161-F164 PolarHBondContact O-N 3.21Å; V161-I290 HydrophobicContact CB-CG2 4.46Å; V161-I290 HydrophobicContact CG2-CG2 4.03Å; V161-P291 HydrophobicContact CG1-CG 3.89Å; V161-P291 HydrophobicContact CG2-CG 4.36Å; V161-P298 HydrophobicContact CB-CG 4.35Å; V161-P298 HydrophobicContact CG2-CG 3.88Å; V161-P298 WeakPolarHBondContact O-CB 3.3Å
162	T	86.2	Confident	90.6	Very high	30 Å²	30	35.9 Å²	35.9	18%	0.184	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-45.9	-176.2	-57.5	0	0	0	0	112	D160 A296 L299	D160-T162 VanDerWaalsContact OD1-CB 3.29Å; D160-T162 WeakPolarHBondContact OD1-CB 3.42Å; D160-T162 PolarHBondContact OD1-N 3.36Å; D160-T162 PolarHBondContact OD1-OG1 3.03Å; T162-A296 WeakPolarHBondContact OG1-CB 3.44Å; T162-L299 HydrophobicContact CG2-CD1 3.51Å; T162-L299 WeakPolarHBondContact O-CD1 3.3Å; T162-L299 PolarHBondContact O-N 3.09Å
163	F	86.6	Confident	90.7	Very high	41 Å²	41	31.5 Å²	31.5	18%	0.18	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	20.5	-174.5	-66.4	-87.3	0	0	0	114.2	V161 F166 L299 V451 K454	V161-F163 VanDerWaalsContact C-N 3.26Å; V161-F163 PolarHBondContact O-N 3.21Å; F163-F166 CarbonylContact O-C 3.57Å; F163-F166 WeakPolarHBondContact O-CA 3.41Å; F163-F166 PolarHBondContact O-N 2.66Å; F163-L299 HydrophobicContact CE1-CD2 4.47Å; F163-V451 HydrophobicContact CD1-CG2 4.25Å; F163-K454 HydrophobicContact CD1-CB 4.43Å; F163-K454 HydrophobicContact CD1-CD 3.6Å; F163-K454 HydrophobicContact CD2-CD 3.64Å; F163-K454 HydrophobicContact CE1-CB 4.3Å; F163-K454 HydrophobicContact CE1-CD 3.5Å; F163-K454 HydrophobicContact CE2-CD 3.56Å; F163-K454 HydrophobicContact CG-CD 3.65Å; F163-K454 HydrophobicContact CZ-CD 3.48Å; F163-K454 VanDerWaalsContact CZ-CD 3.48Å
164	F	86.3	Confident	90.7	Very high	16 Å²	16	33.9 Å²	33.9	7%	0.07	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	136.2	179	-178.9	-89.2	0	0	0	112.4	V161 Y240 L244 I289 I300	V161-F164 WeakPolarHBondContact O-CB 3.3Å; V161-F164 PolarHBondContact O-N 3.21Å; F164-Y240 HydrophobicContact CE1-CD1 4.07Å; F164-Y240 HydrophobicContact CE1-CG 4.32Å; F164-Y240 HydrophobicContact CE2-CE1 4.42Å; F164-Y240 AromaticContact CZ-CD1 3.55Å; F164-Y240 HydrophobicContact CZ-CD1 3.55Å; F164-Y240 HydrophobicContact CZ-CD2 4.33Å; F164-Y240 AromaticContact CZ-CE1 3.65Å; F164-Y240 HydrophobicContact CZ-CE1 3.65Å; F164-Y240 HydrophobicContact CZ-CE2 4.43Å; F164-Y240 AromaticContact CZ-CG 3.88Å; F164-Y240 HydrophobicContact CZ-CG 3.88Å; F164-L244 HydrophobicContact CE1-CD1 4.2Å; F164-I289 HydrophobicContact CZ-CG2 4.36Å; F164-I300 HydrophobicContact CD1-CG2 4.24Å
165	P	88.7	Confident	90.8	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.019	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	cis	-92.2	13.6	-1.3	38.8	-38.1	0	0	0	114	D167 P237 Y240 I245	P165-D167 VanDerWaalsContact C-N 3.28Å; P165-D167 PolarHBondContact O-N 3.01Å; P165-P237 HydrophobicContact CB-CB 4.22Å; P165-P237 HydrophobicContact CG-CB 3.97Å; P165-Y240 HydrophobicContact CB-CD2 3.99Å; P165-Y240 HydrophobicContact CB-CG 4.02Å; P165-I245 HydrophobicContact CG-CD1 4.18Å
166	F	88.6	Confident	90.8	Very high	31 Å²	31	30.8 Å²	30.8	14%	0.136	17%	0.173	C	C	.	.	S	Bend	trans	-96.8	51.7	-179.1	-50.9	-69.1	0	0	0	110.6	F163 P237 I245 V451 W455	F163-F166 CarbonylContact O-C 3.57Å; F163-F166 WeakPolarHBondContact O-CA 3.41Å; F163-F166 PolarHBondContact O-N 2.66Å; F166-P237 HydrophobicContact CD1-CB 3.54Å; F166-P237 HydrophobicContact CD1-CG 3.67Å; F166-P237 HydrophobicContact CE1-CB 3.32Å; F166-P237 HydrophobicContact CE1-CG 3.49Å; F166-P237 VanDerWaalsContact CE1-CG 3.49Å; F166-P237 HydrophobicContact CZ-CB 4.27Å; F166-I245 HydrophobicContact CE2-CD1 3.86Å; F166-I245 HydrophobicContact CZ-CD1 4.01Å; F166-V451 HydrophobicContact CB-CG1 4.32Å; F166-V451 HydrophobicContact CD2-CG1 3.36Å; F166-V451 HydrophobicContact CE2-CG1 4.01Å; F166-V451 HydrophobicContact CG-CG1 4.16Å; F166-W455 HydrophobicContact CB-CB 4.42Å; F166-W455 HydrophobicContact CB-CD2 4.35Å; F166-W455 HydrophobicContact CB-CE3 4.42Å; F166-W455 HydrophobicContact CB-CG 4.39Å; F166-W455 AromaticContact CD1-CD2 3.57Å; F166-W455 HydrophobicContact CD1-CD2 3.57Å; F166-W455 AromaticContact CD1-CE2 3.95Å; F166-W455 AromaticContact CD1-CE3 3.13Å; F166-W455 HydrophobicContact CD1-CE3 3.13Å; F166-W455 HydrophobicContact CD1-CG 4.43Å; F166-W455 AromaticContact CD1-CH2 3.6Å; F166-W455 HydrophobicContact CD1-CH2 3.6Å; F166-W455 AromaticContact CD1-CZ2 3.97Å; F166-W455 HydrophobicContact CD1-CZ2 3.97Å; F166-W455 AromaticContact CD1-CZ3 3.19Å; F166-W455 HydrophobicContact CD1-CZ3 3.19Å; F166-W455 HydrophobicContact CD2-CE3 4.47Å; F166-W455 HydrophobicContact CE1-CD2 4.19Å; F166-W455 AromaticContact CE1-CE3 3.36Å; F166-W455 HydrophobicContact CE1-CE3 3.36Å; F166-W455 AromaticContact CE1-CH2 3.34Å; F166-W455 HydrophobicContact CE1-CH2 3.34Å; F166-W455 HydrophobicContact CE1-CZ2 4.16Å; F166-W455 AromaticContact CE1-CZ3 2.89Å; F166-W455 HydrophobicContact CE1-CZ3 2.89Å; F166-W455 HydrophobicContact CG-CD2 4.14Å; F166-W455 AromaticContact CG-CE3 3.76Å; F166-W455 HydrophobicContact CG-CE3 3.76Å; F166-W455 HydrophobicContact CG-CZ3 4.19Å; F166-W455 HydrophobicContact CZ-CE3 4.1Å; F166-W455 HydrophobicContact CZ-CH2 4.42Å; F166-W455 AromaticContact CZ-CZ3 3.68Å; F166-W455 HydrophobicContact CZ-CZ3 3.68Å
167	D	88.1	Confident	90.9	Very high	5 Å²	5	28.7 Å²	28.7	3%	0.027	16%	0.155	C	C	.	.			trans	-106.9	153.5	-170.6	58.6	-53.3	0	0	0	113	P165 Q169 R235	P165-D167 VanDerWaalsContact C-N 3.28Å; P165-D167 PolarHBondContact O-N 3.01Å; D167-Q169 PolarHBondContact OD2-NE2 3.32Å; D167-R235 PolarHBondContact O-N 2.59Å; D167-R235 IonicContact OD1-NE 2.78Å; D167-R235 PolarHBondContact OD1-NE 2.76Å; D167-R235 IonicContact OD2-NE 2.77Å; D167-R235 IonicContact OD2-NH2 2.81Å; D167-R235 PolarHBondContact OD2-NH2 3.16Å
168	L	90.5	Very high	90.9	Very high	77 Å²	77	36 Å²	36	40%	0.403	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.2	174.3	-176.2	122.3	0	0	0	107	I232 I233 I458	L168-I232 HydrophobicContact CD1-CG2 3.81Å; L168-I232 HydrophobicContact CD2-CG2 3.65Å; L168-I232 HydrophobicContact CG-CG2 3.81Å; L168-I233 WeakPolarHBondContact CA-O 3.23Å; L168-I458 HydrophobicContact CD1-CG2 4.27Å
169	Q	92.4	Very high	91	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.019	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	146.8	-177.8	-52.9	-59.3	-23.7	0	0	110	I159 D160 D167 W205 I232 I233	I159-Q169 HydrophobicContact CD1-CB 4.49Å; I159-Q169 HydrophobicContact CD1-CG 4.34Å; I159-Q169 HydrophobicContact CG2-CG 4.28Å; D160-Q169 PolarHBondContact O-NE2 2.91Å; D167-Q169 PolarHBondContact OD2-NE2 3.32Å; Q169-W205 HydrophobicContact CG-CH2 3.87Å; Q169-W205 HydrophobicContact CG-CZ3 3.94Å; Q169-I232 WeakPolarHBondContact O-CA 3.44Å; Q169-I233 HydrophobicContact CB-CD1 4.16Å; Q169-I233 HydrophobicContact CB-CG1 3.72Å; Q169-I233 HydrophobicContact CG-CG1 4.5Å; Q169-I233 PolarHBondContact N-O 3.11Å; Q169-I233 PolarHBondContact O-N 3.3Å
170	N	93.6	Very high	91.2	Very high	90 Å²	90	36.8 Å²	36.8	48%	0.481	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	94.2	176	-178.4	15.1	0	0	0	108.7	F231	N170-F231 WeakPolarHBondContact CA-O 3.34Å
171	C	94.9	Very high	91.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	144.4	178.5	-66.8	0	0	0	0	110.9	M80 C157 F230 F231	M80-C171 HydrophobicContact CE-CB 4.09Å; M80-C171 HydrophobicContact SD-CB 3.65Å; C157-C171 HydrophobicContact CB-CB 3.73Å; C157-C171 WeakPolarHBondContact CB-SG 3.35Å; C157-C171 WeakPolarHBondContact SG-CA 3.47Å; C157-C171 WeakPolarHBondContact SG-CB 3.42Å; C157-C171 CovalentContact SG-SG 2.04Å; C157-C171 PolarHBondContact SG-SG 3.03Å; C171-F230 CarbonylContact O-C 3.53Å; C171-F230 WeakPolarHBondContact O-CA 3.42Å; C171-F231 PolarHBondContact N-O 3.45Å; C171-F231 PolarHBondContact O-N 2.54Å
172	S	94.9	Very high	91.7	Very high	40 Å²	40	35.4 Å²	35.4	28%	0.28	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141.9	178.6	58.4	0	0	0	0	111.5	Y229	S172-Y229 CarbonylContact C-O 3.58Å; S172-Y229 VanDerWaalsContact CA-O 3.27Å; S172-Y229 WeakPolarHBondContact CA-O 3.44Å
173	M	94.9	Very high	91.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.5	169.7	-63.7	179.7	76.3	0	0	108.9	M80 L122 Y153 F175 T228 Y229 F231	M80-M173 HydrophobicContact CE-CG 3.78Å; M80-M173 HydrophobicContact CE-SD 3.79Å; L122-M173 HydrophobicContact CD1-CB 3.85Å; L122-M173 HydrophobicContact CD1-CE 4.32Å; L122-M173 HydrophobicContact CD1-CG 4.46Å; L122-M173 HydrophobicContact CD2-CE 4.02Å; Y153-M173 HydrophobicContact CD2-CE 3.84Å; Y153-M173 HydrophobicContact CG-CE 4.01Å; M173-F175 HydrophobicContact CB-CD2 4.49Å; M173-F175 HydrophobicContact CB-CE2 3.79Å; M173-F175 HydrophobicContact CB-CZ 4.44Å; M173-F175 HydrophobicContact CE-CE2 4.28Å; M173-F175 HydrophobicContact CE-CZ 3.86Å; M173-T228 WeakPolarHBondContact O-CA 3.35Å; M173-Y229 PolarHBondContact N-O 2.78Å; M173-Y229 PolarHBondContact O-N 3.3Å; M173-F231 HydrophobicContact CB-CE2 4.4Å; M173-F231 HydrophobicContact CG-CD2 4.32Å; M173-F231 HydrophobicContact CG-CE2 3.99Å; M173-F231 HydrophobicContact SD-CD2 4.28Å; M173-F231 HydrophobicContact SD-CE2 3.56Å; M173-F231 VanDerWaalsContact SD-CE2 3.56Å; M173-F231 HydrophobicContact SD-CZ 4.19Å
174	K	94.4	Very high	92.2	Very high	54 Å²	54	38.4 Å²	38.4	24%	0.235	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	115.4	-176.8	-173.1	173.7	178.8	179.6	0	112	L122 Y123 D124	L122-K174 WeakPolarHBondContact CA-O 3.3Å; Y123-K174 HydrophobicContact CD2-CD 4.04Å; Y123-K174 HydrophobicContact CD2-CG 4.03Å; Y123-K174 PolarHBondContact N-O 3.27Å; D124-K174 WeakPolarHBondContact OD2-CB 3.45Å
175	F	95.4	Very high	92.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	146	178.3	-64.6	-86	0	0	0	111.6	F63 L65 M86 V120 V121 L122 Y153 M173 T226 I227 Y229	F63-F175 HydrophobicContact CE1-CB 3.73Å; F63-F175 HydrophobicContact CE1-CD1 4.25Å; F63-F175 AromaticContact CE1-CD2 3.7Å; F63-F175 HydrophobicContact CE1-CD2 3.7Å; F63-F175 HydrophobicContact CE1-CE2 4.35Å; F63-F175 AromaticContact CE1-CG 3.63Å; F63-F175 HydrophobicContact CE1-CG 3.63Å; F63-F175 HydrophobicContact CZ-CB 3.89Å; F63-F175 AromaticContact CZ-CD1 3.67Å; F63-F175 HydrophobicContact CZ-CD1 3.67Å; F63-F175 AromaticContact CZ-CD2 3.89Å; F63-F175 HydrophobicContact CZ-CD2 3.89Å; F63-F175 HydrophobicContact CZ-CE1 4.11Å; F63-F175 HydrophobicContact CZ-CE2 4.31Å; F63-F175 AromaticContact CZ-CG 3.53Å; F63-F175 HydrophobicContact CZ-CG 3.53Å; F63-F175 HydrophobicContact CZ-CZ 4.41Å; L65-F175 HydrophobicContact CD1-CE2 4.22Å; L65-F175 HydrophobicContact CD1-CZ 4.1Å; L65-F175 HydrophobicContact CD2-CE2 4.25Å; M86-F175 HydrophobicContact SD-CE1 4.26Å; V120-F175 HydrophobicContact CG1-CB 4.07Å; V120-F175 HydrophobicContact CG1-CD1 4.49Å; V121-F175 WeakPolarHBondContact O-CA 3.41Å; L122-F175 HydrophobicContact CB-CD1 4.24Å; L122-F175 HydrophobicContact CB-CE1 3.92Å; L122-F175 HydrophobicContact CD1-CE1 4.29Å; L122-F175 HydrophobicContact CD1-CE2 4.35Å; L122-F175 HydrophobicContact CD1-CZ 4.17Å; Y153-F175 HydrophobicContact CD2-CE1 4.37Å; Y153-F175 HydrophobicContact CD2-CZ 4.24Å; Y153-F175 AromaticContact CE2-CE1 3.77Å; Y153-F175 HydrophobicContact CE2-CE1 3.77Å; Y153-F175 HydrophobicContact CE2-CZ 4.03Å; M173-F175 HydrophobicContact CB-CD2 4.49Å; M173-F175 HydrophobicContact CB-CE2 3.79Å; M173-F175 HydrophobicContact CB-CZ 4.44Å; M173-F175 HydrophobicContact CE-CE2 4.28Å; M173-F175 HydrophobicContact CE-CZ 3.86Å; F175-T226 CarbonylContact O-C 3.53Å; F175-T226 VanDerWaalsContact O-CA 3.28Å; F175-T226 WeakPolarHBondContact O-CA 3.33Å; F175-T226 WeakPolarHBondContact O-CB 3.35Å; F175-I227 PolarHBondContact N-O 2.92Å; F175-I227 PolarHBondContact O-N 3.4Å; F175-Y229 HydrophobicContact CD2-CD2 4.11Å; F175-Y229 HydrophobicContact CE2-CD2 4.22Å
176	G	94.2	Very high	92.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	166.9	174.5	0	0	0	0	0	111.3	V120 V121	V120-G176 WeakPolarHBondContact CA-O 3.39Å; V121-G176 PolarHBondContact N-O 3.39Å; V121-G176 PolarHBondContact O-N 3.5Å; V121-G176 VanDerWaalsContact O-N 3.16Å
177	S	93.9	Very high	93.3	Very high	4 Å²	4	37.7 Å²	37.7	3%	0.028	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	140.3	169.7	174.2	0	0	0	0	110	D119 Y123 Y180	D119-S177 WeakPolarHBondContact O-CA 3.43Å; D119-S177 WeakPolarHBondContact OD1-CB 3.4Å; D119-S177 PolarHBondContact OD1-OG 3.38Å; D119-S177 PolarHBondContact OD2-OG 2.93Å; Y123-S177 PolarHBondContact OH-O 2.8Å; S177-Y180 WeakPolarHBondContact OG-CB 3.27Å; S177-Y180 PolarHBondContact OG-N 3.33Å
178	W	91.3	Very high	93.6	Very high	163 Å²	163	40.2 Å²	40.2	62%	0.617	21%	0.211	S	C	*	.	S	Bend	trans	-80	-41.4	176.5	-171.1	-105.2	0	0	0	112.4	D119 V121 Y123	D119-W178 PolarHBondContact O-N 2.84Å; D119-W178 VanDerWaalsContact O-N 3.11Å; D119-W178 PolarHBondContact OD2-N 2.76Å; V121-W178 HydrophobicContact CG2-CB 3.95Å; V121-W178 HydrophobicContact CG2-CD2 4.34Å; V121-W178 HydrophobicContact CG2-CE3 3.7Å; V121-W178 HydrophobicContact CG2-CG 4.49Å; Y123-W178 HydrophobicContact CD1-CE3 4.01Å; Y123-W178 HydrophobicContact CD1-CZ3 4.06Å; Y123-W178 AromaticContact CE1-CE3 3.9Å; Y123-W178 HydrophobicContact CE1-CE3 3.9Å; Y123-W178 HydrophobicContact CE1-CZ3 4.33Å
179	T	92.2	Very high	93.8	Very high	89 Å²	89	38.9 Å²	38.9	55%	0.546	20%	0.204	S	C	.	.	S	Bend	trans	-110.2	-31.1	-169.6	62.7	0	0	0	0	114.4	D119	D119-T179 VanDerWaalsContact OD2-CB 3.3Å; D119-T179 WeakPolarHBondContact OD2-CB 3.27Å; D119-T179 WeakPolarHBondContact OD2-CG2 3.47Å; D119-T179 PolarHBondContact OD2-N 3.13Å; D119-T179 PolarHBondContact OD2-OG1 2.88Å
180	Y	93.2	Very high	93.9	Very high	44 Å²	44	42.4 Å²	42.4	17%	0.173	22%	0.221	C	C	.	.			trans	-89	144.9	-175.7	-59.5	-72.6	0	0	0	111.8	R50 W116 D119 S177 Q184 V185 Y224	R50-Y180 VanDerWaalsContact CD-CE1 3.46Å; R50-Y180 HydrophobicContact CG-CE1 3.81Å; W116-Y180 HydrophobicContact CZ2-CE2 4.14Å; W116-Y180 PolarHBondContact NE1-OH 2.96Å; D119-Y180 VanDerWaalsContact OD1-CD2 3.27Å; D119-Y180 WeakPolarHBondContact OD1-CD2 3.33Å; S177-Y180 WeakPolarHBondContact OG-CB 3.27Å; S177-Y180 PolarHBondContact OG-N 3.33Å; Y180-Q184 HydrophobicContact CD1-CB 4.06Å; Y180-Q184 HydrophobicContact CG-CB 4.48Å; Y180-V185 HydrophobicContact CD1-CG2 4.23Å; Y180-V185 HydrophobicContact CD2-CB 4.48Å; Y180-V185 HydrophobicContact CD2-CG2 3.63Å; Y180-V185 HydrophobicContact CE2-CG2 4.37Å; Y180-V185 HydrophobicContact CG-CB 4.31Å; Y180-V185 HydrophobicContact CG-CG2 3.55Å; Y180-Y224 WeakPolarHBondContact O-CD1 3.31Å
181	D	92.8	Very high	93.8	Very high	34 Å²	34	42.6 Å²	42.6	18%	0.182	22%	0.221	C	C	.	.			trans	-85.6	171.9	167.9	71.8	16.6	0	0	0	111.6	S183 Q184 V185 Y224	D181-S183 VanDerWaalsContact CG-OG 3.32Å; D181-S183 PolarHBondContact O-N 2.95Å; D181-S183 WeakPolarHBondContact OD1-CA 3.21Å; D181-S183 WeakPolarHBondContact OD1-CB 3.4Å; D181-S183 PolarHBondContact OD1-N 3.47Å; D181-S183 PolarHBondContact OD1-OG 2.94Å; D181-S183 PolarHBondContact OD2-OG 3.01Å; D181-Q184 PolarHBondContact O-N 3.24Å; D181-Q184 WeakPolarHBondContact OD1-CG 3.48Å; D181-Q184 PolarHBondContact OD1-N 3.4Å; D181-V185 PolarHBondContact O-N 3.16Å; D181-Y224 HydrophobicContact CB-CE1 4.13Å
182	G	91.6	Very high	93.7	Very high	18 Å²	18	47.7 Å²	47.7	19%	0.186	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.8	179	0	0	0	0	0	115	V185 S223 P225	G182-V185 WeakPolarHBondContact CA-O 3.43Å; G182-S223 WeakPolarHBondContact CA-O 3.18Å; G182-S223 PolarHBondContact N-O 3.36Å; G182-P225 VanDerWaalsContact CA-CD 3.42Å
183	S	91.8	Very high	93.7	Very high	71 Å²	71	51.3 Å²	51.3	50%	0.497	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-27.6	172.3	81.2	0	0	0	0	111.4	T58 D181	T58-S183 WeakPolarHBondContact CB-O 3.43Å; T58-S183 WeakPolarHBondContact CG2-O 3.28Å; T58-S183 PolarHBondContact OG1-O 3.1Å; D181-S183 VanDerWaalsContact CG-OG 3.32Å; D181-S183 PolarHBondContact O-N 2.95Å; D181-S183 WeakPolarHBondContact OD1-CA 3.21Å; D181-S183 WeakPolarHBondContact OD1-CB 3.4Å; D181-S183 PolarHBondContact OD1-N 3.47Å; D181-S183 PolarHBondContact OD1-OG 2.94Å; D181-S183 PolarHBondContact OD2-OG 3.01Å
184	Q	93.2	Very high	93.7	Very high	64 Å²	64	51.7 Å²	51.7	30%	0.299	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-45.1	-178.5	-67.5	177.4	-37.4	0	0	112.7	R50 I59 Y180 D181	R50-Q184 PolarHBondContact NH1-O 3.34Å; I59-Q184 PolarHBondContact N-O 3.2Å; Y180-Q184 HydrophobicContact CD1-CB 4.06Å; Y180-Q184 HydrophobicContact CG-CB 4.48Å; D181-Q184 PolarHBondContact O-N 3.24Å; D181-Q184 WeakPolarHBondContact OD1-CG 3.48Å; D181-Q184 PolarHBondContact OD1-N 3.4Å
185	V	94.9	Very high	93.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	115.8	-179.8	177.1	0	0	0	0	108.9	I59 V61 W116 Y180 D181 G182 V187	I59-V185 WeakPolarHBondContact O-CA 3.34Å; V61-V185 HydrophobicContact CG2-CG1 3.92Å; W116-V185 HydrophobicContact CH2-CG2 4.43Å; W116-V185 HydrophobicContact CZ2-CG2 4.46Å; Y180-V185 HydrophobicContact CD1-CG2 4.23Å; Y180-V185 HydrophobicContact CD2-CB 4.48Å; Y180-V185 HydrophobicContact CD2-CG2 3.63Å; Y180-V185 HydrophobicContact CE2-CG2 4.37Å; Y180-V185 HydrophobicContact CG-CB 4.31Å; Y180-V185 HydrophobicContact CG-CG2 3.55Å; D181-V185 PolarHBondContact O-N 3.16Å; G182-V185 WeakPolarHBondContact CA-O 3.43Å; V185-V187 HydrophobicContact CG1-CG2 4.37Å
186	D	95.1	Very high	93.5	Very high	34 Å²	34	54.3 Å²	54.3	18%	0.182	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.9	174	-169.6	15.6	0	0	0	110.1	T58 I59 S60 V61 R214	T58-D186 HydrophobicContact CG2-CB 3.74Å; I59-D186 PolarHBondContact O-N 2.78Å; S60-D186 WeakPolarHBondContact CA-O 3.25Å; V61-D186 PolarHBondContact N-O 3.5Å; D186-R214 VanDerWaalsContact CG-NH2 3.35Å; D186-R214 IonicContact OD1-CZ 2.82Å; D186-R214 IonicContact OD1-NE 2.67Å; D186-R214 IonicContact OD1-NH2 3.69Å; D186-R214 PolarHBondContact OD1-NH2 2.88Å; D186-R214 IonicContact OD2-NH2 3.14Å; D186-R214 PolarHBondContact OD2-NH2 2.91Å
187	V	95.4	Very high	93.3	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	118.4	178.7	-162.6	0	0	0	0	108.8	V61 F63 V185 R214 I227	V61-V187 WeakPolarHBondContact O-CA 3.4Å; F63-V187 HydrophobicContact CB-CG1 3.64Å; F63-V187 HydrophobicContact CG-CG1 4.31Å; V185-V187 HydrophobicContact CG1-CG2 4.37Å; V187-R214 PolarHBondContact O-NE 2.82Å; V187-I227 HydrophobicContact CB-CD1 4.3Å; V187-I227 HydrophobicContact CG1-CD1 3.51Å; V187-I227 HydrophobicContact CG1-CG1 4.3Å
188	L	95.4	Very high	93.2	Very high	57 Å²	57	68.2 Å²	68.2	30%	0.298	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	138.1	-177.7	-59.9	178.8	0	0	0	109.7	V61 K62 F63 E190	V61-L188 PolarHBondContact O-N 3.42Å; K62-L188 CarbonylContact C-O 3.56Å; K62-L188 WeakPolarHBondContact CA-O 3.46Å; F63-L188 PolarHBondContact N-O 2.91Å; L188-E190 PolarHBondContact O-N 2.84Å
189	L	95.3	Very high	93.3	Very high	49 Å²	49	62.4 Å²	62.4	26%	0.257	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	123.1	176.3	-171.6	69.5	0	0	0	109.3	D191 I227 Y229	L189-D191 WeakPolarHBondContact CD1-O 3.48Å; L189-D191 VanDerWaalsContact CG-O 3.31Å; L189-D191 WeakPolarHBondContact CG-O 3.32Å; L189-I227 HydrophobicContact CB-CD1 4.38Å; L189-I227 HydrophobicContact CD1-CD1 4.32Å; L189-I227 HydrophobicContact CD1-CG2 3.64Å; L189-Y229 HydrophobicContact CD1-CE1 4.19Å; L189-Y229 VanDerWaalsContact CD1-OH 3.32Å; L189-Y229 WeakPolarHBondContact CD1-OH 3.45Å
190	E	92.7	Very high	93.2	Very high	79 Å²	79	64.9 Å²	64.9	37%	0.369	32%	0.322	S	S	.	.	S	Bend	trans	-68.8	-55.5	174.1	-176.9	178.6	-154.5	0	0	110.3	F63 L188	F63-E190 PolarHBondContact O-N 2.85Å; L188-E190 PolarHBondContact O-N 2.84Å
191	D	92.4	Very high	92.9	Very high	93 Å²	93	68.2 Å²	68.2	50%	0.497	34%	0.342	S	S	.	.			trans	-134.4	143.9	-179	-77.2	-50.7	0	0	0	112.1	L189	L189-D191 WeakPolarHBondContact CD1-O 3.48Å; L189-D191 VanDerWaalsContact CG-O 3.31Å; L189-D191 WeakPolarHBondContact CG-O 3.32Å
192	F	93	Very high	92.3	Very high	107 Å²	107	68.4 Å²	68.4	47%	0.469	34%	0.344	S	S	.	.	S	Bend	trans	-69.5	-32.1	175.8	179.1	-98.4	0	0	0	112.8	T211 G212	F192-T211 HydrophobicContact CD1-CG2 4.01Å; F192-T211 HydrophobicContact CE1-CG2 3.33Å; F192-T211 HydrophobicContact CZ-CG2 3.76Å; F192-T211 CarbonylContact O-C 3.56Å; F192-T211 VanDerWaalsContact O-CA 3.31Å; F192-T211 WeakPolarHBondContact O-CA 3.46Å; F192-G212 WeakPolarHBondContact CD2-O 3.11Å; F192-G212 WeakPolarHBondContact CE2-O 3.3Å; F192-G212 PolarHBondContact O-N 3.34Å
193	H	94.9	Very high	92.1	Very high	117 Å²	117	70.6 Å²	70.6	54%	0.542	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-96.8	140.1	177.9	-65.4	99.2	0	0	0	109.9	D195	H193-D195 PolarHBondContact O-N 3.22Å
194	V	94.5	Very high	92	Very high	8 Å²	8	69.9 Å²	69.9	5%	0.048	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-66.9	133	169.5	178.5	0	0	0	0	108.1	L65 I67 K196 A210 Y229 F231	L65-V194 WeakPolarHBondContact O-CG1 3.13Å; I67-V194 HydrophobicContact CB-CG1 4.18Å; I67-V194 HydrophobicContact CG2-CG1 3.93Å; V194-K196 PolarHBondContact O-N 2.86Å; V194-A210 HydrophobicContact CB-CB 3.73Å; V194-A210 HydrophobicContact CG2-CB 3.77Å; V194-A210 PolarHBondContact N-O 2.92Å; V194-Y229 HydrophobicContact CG2-CD1 3.3Å; V194-Y229 HydrophobicContact CG2-CE1 3.72Å; V194-Y229 HydrophobicContact CG2-CG 4.1Å; V194-F231 HydrophobicContact CG1-CE1 4.28Å; V194-F231 HydrophobicContact CG1-CZ 4.4Å; V194-F231 HydrophobicContact CG2-CE1 4.26Å; V194-F231 HydrophobicContact CG2-CZ 4.13Å
195	D	93.1	Very high	92	Very high	33 Å²	33	67 Å²	67	18%	0.176	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-70	124.7	177	-178.2	5.4	0	0	0	110	L65 A66 I67 K87 H193 Q197	L65-D195 PolarHBondContact O-N 2.85Å; A66-D195 CarbonylContact C-O 3.58Å; A66-D195 WeakPolarHBondContact CA-O 2.96Å; A66-D195 HydrophobicContact CB-CB 3.77Å; I67-D195 PolarHBondContact N-O 2.93Å; K87-D195 IonicContact NZ-OD2 2.69Å; K87-D195 PolarHBondContact NZ-OD2 2.65Å; H193-D195 PolarHBondContact O-N 3.22Å; D195-Q197 WeakPolarHBondContact OD1-CB 3.14Å; D195-Q197 VanDerWaalsContact OD1-CG 3.23Å; D195-Q197 WeakPolarHBondContact OD1-CG 3.36Å; D195-Q197 PolarHBondContact OD1-N 3.15Å
196	K	92.4	Very high	91.8	Very high	76 Å²	76	70.1 Å²	70.1	33%	0.33	36%	0.356	S	S	.	.			trans	-117	13.6	-179.1	-60.6	-177.2	-176.5	179.9	0	112.5	I67 V194 D198 Y199 I207	I67-K196 HydrophobicContact CG2-CG 4Å; V194-K196 PolarHBondContact O-N 2.86Å; K196-D198 VanDerWaalsContact C-N 3.3Å; K196-D198 PolarHBondContact O-N 3.39Å; K196-Y199 VanDerWaalsContact O-CB 3.23Å; K196-Y199 WeakPolarHBondContact O-CB 3.27Å; K196-Y199 PolarHBondContact O-N 2.92Å; K196-Y199 VanDerWaalsContact O-N 3.14Å; K196-I207 PolarHBondContact NZ-O 2.96Å
197	Q	91.1	Very high	91.7	Very high	168 Å²	168	69.1 Å²	69.1	79%	0.785	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-41.7	-175.8	-75.3	176.1	34.6	0	0	112.9	D195	D195-Q197 WeakPolarHBondContact OD1-CB 3.14Å; D195-Q197 VanDerWaalsContact OD1-CG 3.23Å; D195-Q197 WeakPolarHBondContact OD1-CG 3.36Å; D195-Q197 PolarHBondContact OD1-N 3.15Å
198	D	90.8	Very high	91.5	Very high	128 Å²	128	70.7 Å²	70.7	68%	0.684	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	25.6	179.2	-62.5	-40.2	0	0	0	112.5	K196	K196-D198 VanDerWaalsContact C-N 3.3Å; K196-D198 PolarHBondContact O-N 3.39Å
199	Y	93.3	Very high	91.3	Very high	40 Å²	40	71.9 Å²	71.9	16%	0.157	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-76.3	129.3	-178.3	179.2	-113.7	0	0	0	111.8	I67 S68 L70 K196 D201 I207	I67-Y199 HydrophobicContact CD1-CE2 4.44Å; I67-Y199 HydrophobicContact CG1-CD2 4.2Å; I67-Y199 HydrophobicContact CG1-CE2 4.42Å; I67-Y199 HydrophobicContact CG2-CD2 4Å; S68-Y199 WeakPolarHBondContact O-CA 3.48Å; L70-Y199 HydrophobicContact CB-CE2 4.37Å; K196-Y199 VanDerWaalsContact O-CB 3.23Å; K196-Y199 WeakPolarHBondContact O-CB 3.27Å; K196-Y199 PolarHBondContact O-N 2.92Å; K196-Y199 VanDerWaalsContact O-N 3.14Å; Y199-D201 WeakPolarHBondContact CE1-OD1 3Å; Y199-I207 HydrophobicContact CD2-CD1 4.22Å; Y199-I207 HydrophobicContact CE1-CD1 4.29Å; Y199-I207 HydrophobicContact CE2-CD1 3.5Å; Y199-I207 VanDerWaalsContact CE2-CD1 3.5Å; Y199-I207 HydrophobicContact CE2-CG1 4.4Å
200	F	91.3	Very high	91.3	Very high	142 Å²	142	69.8 Å²	69.8	62%	0.623	35%	0.352	S	S	*	.	B	Isolated β-bridge	trans	-103.3	122.4	170.9	-173.2	-95.1	0	0	0	110.6	S68	S68-F200 PolarHBondContact O-N 2.86Å
201	D	86.9	Confident	91.5	Very high	113 Å²	113	66.7 Å²	66.7	60%	0.604	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-64.9	134.2	-177.9	-67.8	-51.5	0	0	0	112.3	Y199 G203	Y199-D201 WeakPolarHBondContact CE1-OD1 3Å; D201-G203 VanDerWaalsContact C-N 3.33Å; D201-G203 PolarHBondContact O-N 2.62Å
202	N	80.3	Confident	91.6	Very high	38 Å²	38	62.2 Å²	62.2	20%	0.203	32%	0.315	C	S	.	.			trans	-82.7	-3.2	-177.2	-163.8	21.5	0	0	0	114	L70 V71 E204	L70-N202 VanDerWaalsContact O-CB 3.29Å; L70-N202 WeakPolarHBondContact O-CB 3.06Å; L70-N202 PolarHBondContact O-ND2 3.02Å; L70-N202 VanDerWaalsContact O-ND2 3.09Å; V71-N202 PolarHBondContact O-ND2 3.03Å; N202-E204 PolarHBondContact O-N 2.86Å
203	G	86.7	Confident	91.7	Very high	64 Å²	64	59.2 Å²	59.2	66%	0.66	31%	0.307	S	S	*	.	S	Bend	trans	65.4	-17.5	179.1	0	0	0	0	0	116.5	D201 L236	D201-G203 VanDerWaalsContact C-N 3.33Å; D201-G203 PolarHBondContact O-N 2.62Å; G203-L236 WeakPolarHBondContact O-CD1 3.29Å
204	E	90	Very high	91.7	Very high	57 Å²	57	59.9 Å²	59.9	27%	0.266	31%	0.305	S	S	.	.	S	Bend	trans	-106.9	-37.8	174.3	-172.9	-175.1	161	0	0	112.1	N202 R235 L236 Y240	N202-E204 PolarHBondContact O-N 2.86Å; E204-R235 IonicContact OE1-NH1 2.96Å; E204-R235 PolarHBondContact OE1-NH1 2.89Å; E204-L236 WeakPolarHBondContact O-CB 3.34Å; E204-L236 PolarHBondContact O-N 3.07Å; E204-Y240 PolarHBondContact OE1-OH 3.45Å
205	W	92.7	Very high	91.6	Very high	3 Å²	3	60.8 Å²	60.8	1%	0.011	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.5	-176.2	-68	94.4	0	0	0	111.1	L70 V73 Q169 I233 R235	L70-W205 HydrophobicContact CD2-CB 3.62Å; L70-W205 HydrophobicContact CD2-CG 4.24Å; V73-W205 HydrophobicContact CB-CZ2 3.88Å; V73-W205 HydrophobicContact CG1-CZ2 4.05Å; V73-W205 HydrophobicContact CG2-CD2 4.3Å; V73-W205 HydrophobicContact CG2-CG 4.43Å; V73-W205 HydrophobicContact CG2-CZ2 4.35Å; Q169-W205 HydrophobicContact CG-CH2 3.87Å; Q169-W205 HydrophobicContact CG-CZ3 3.94Å; W205-I233 HydrophobicContact CD2-CD1 4.36Å; W205-I233 HydrophobicContact CE3-CB 4.17Å; W205-I233 HydrophobicContact CE3-CD1 3.88Å; W205-I233 HydrophobicContact CE3-CG1 3.92Å; W205-I233 HydrophobicContact CZ3-CD1 4.06Å; W205-I233 HydrophobicContact CZ3-CG1 4.01Å; W205-R235 HydrophobicContact CD2-CB 4.49Å; W205-R235 HydrophobicContact CE3-CB 4Å; W205-R235 HydrophobicContact CH2-CB 4.12Å; W205-R235 VanDerWaalsContact CH2-CZ 3.45Å; W205-R235 VanDerWaalsContact CZ2-NH1 3.27Å; W205-R235 HydrophobicContact CZ3-CB 3.78Å
206	E	91.6	Very high	91.6	Very high	65 Å²	65	64.3 Å²	64.3	30%	0.304	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	130.6	176	-177.9	-170	-176.9	0	0	109.9	V208 I233 R234	E206-V208 PolarHBondContact O-N 3.12Å; E206-I233 CarbonylContact O-C 3.46Å; E206-I233 VanDerWaalsContact O-CA 3.32Å; E206-I233 WeakPolarHBondContact O-CA 3.33Å; E206-R234 PolarHBondContact N-O 3.02Å; E206-R234 PolarHBondContact O-N 2.6Å; E206-R234 IonicContact OE1-NH2 3.23Å; E206-R234 PolarHBondContact OE1-NH2 2.92Å; E206-R234 IonicContact OE2-CZ 3.91Å; E206-R234 VanDerWaalsContact OE2-CZ 3.23Å; E206-R234 IonicContact OE2-NE 3.5Å; E206-R234 PolarHBondContact OE2-NE 3.31Å; E206-R234 IonicContact OE2-NH2 2.65Å; E206-R234 PolarHBondContact OE2-NH2 3.46Å
207	I	92.5	Very high	91.4	Very high	13 Å²	13	66.8 Å²	66.8	7%	0.067	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	94	177	-51.6	177.3	0	0	0	109.8	I67 L70 K196 Y199 A210 F231 I233	I67-I207 HydrophobicContact CD1-CD1 3.71Å; I67-I207 HydrophobicContact CG2-CD1 4.49Å; L70-I207 HydrophobicContact CB-CD1 4.44Å; L70-I207 HydrophobicContact CD2-CG1 4.42Å; K196-I207 PolarHBondContact NZ-O 2.96Å; Y199-I207 HydrophobicContact CD2-CD1 4.22Å; Y199-I207 HydrophobicContact CE1-CD1 4.29Å; Y199-I207 HydrophobicContact CE2-CD1 3.5Å; Y199-I207 VanDerWaalsContact CE2-CD1 3.5Å; Y199-I207 HydrophobicContact CE2-CG1 4.4Å; I207-A210 HydrophobicContact CG2-CB 3.94Å; I207-F231 HydrophobicContact CG2-CD1 4.39Å; I207-I233 HydrophobicContact CG1-CG2 4.11Å; I207-I233 HydrophobicContact CG2-CG2 4.47Å
208	V	91	Very high	91.3	Very high	34 Å²	34	63.4 Å²	63.4	21%	0.206	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	-48.6	178.4	179.6	0	0	0	0	111.4	E206 I232 R234 V460	E206-V208 PolarHBondContact O-N 3.12Å; V208-I232 HydrophobicContact CB-CG2 4.33Å; V208-I232 PolarHBondContact N-O 2.92Å; V208-R234 HydrophobicContact CG2-CB 3.66Å; V208-V460 HydrophobicContact CG1-CG1 4.23Å
209	K	92.1	Very high	91.1	Very high	82 Å²	82	61.6 Å²	61.6	36%	0.357	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	135.6	-178.9	-177	172.6	178.6	176.6	0	110.5	T211 I232	K209-T211 HydrophobicContact CD-CG2 4.25Å; K209-T211 HydrophobicContact CG-CG2 3.84Å; K209-I232 HydrophobicContact CB-CB 4.14Å; K209-I232 HydrophobicContact CB-CD1 4.23Å; K209-I232 HydrophobicContact CB-CG1 4.47Å; K209-I232 HydrophobicContact CD-CD1 4.31Å; K209-I232 PolarHBondContact N-O 2.04Å; K209-I232 VanDerWaalsContact N-O 3.16Å; K209-I232 PolarHBondContact O-N 3.33Å
210	A	94.5	Very high	90.8	Very high	5 Å²	5	63.4 Å²	63.4	4%	0.041	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	110.1	176.4	0	0	0	0	0	109.1	V194 I207 F230 F231	V194-A210 HydrophobicContact CB-CB 3.73Å; V194-A210 HydrophobicContact CG2-CB 3.77Å; V194-A210 PolarHBondContact N-O 2.92Å; I207-A210 HydrophobicContact CG2-CB 3.94Å; A210-F230 VanDerWaalsContact CA-O 3.29Å; A210-F230 WeakPolarHBondContact CA-O 3.4Å; A210-F231 HydrophobicContact CB-CD1 3.86Å; A210-F231 HydrophobicContact CB-CE1 3.97Å
211	T	95.8	Very high	90.6	Very high	14 Å²	14	62.8 Å²	62.8	9%	0.086	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	137.5	-171.1	50.2	0	0	0	0	112.6	F192 K209 Y229 F230	F192-T211 HydrophobicContact CD1-CG2 4.01Å; F192-T211 HydrophobicContact CE1-CG2 3.33Å; F192-T211 HydrophobicContact CZ-CG2 3.76Å; F192-T211 CarbonylContact O-C 3.56Å; F192-T211 VanDerWaalsContact O-CA 3.31Å; F192-T211 WeakPolarHBondContact O-CA 3.46Å; K209-T211 HydrophobicContact CD-CG2 4.25Å; K209-T211 HydrophobicContact CG-CG2 3.84Å; T211-Y229 CarbonylContact O-C 3.59Å; T211-Y229 WeakPolarHBondContact O-CA 3.42Å; T211-F230 PolarHBondContact N-O 2.76Å; T211-F230 PolarHBondContact O-N 3.18Å
212	G	95.5	Very high	90.7	Very high	0 Å²	0	59 Å²	59	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	144.4	176.4	0	0	0	0	0	112.7	F192 T228 Y229	F192-G212 WeakPolarHBondContact CD2-O 3.11Å; F192-G212 WeakPolarHBondContact CE2-O 3.3Å; F192-G212 PolarHBondContact O-N 3.34Å; G212-T228 CarbonylContact C-O 3.49Å; G212-T228 WeakPolarHBondContact CA-O 3.29Å; G212-Y229 VanDerWaalsContact CA-CE1 3.49Å
213	S	95.2	Very high	91.2	Very high	43 Å²	43	59.4 Å²	59.4	30%	0.301	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	139.7	171.9	63.8	0	0	0	0	109.8	I227 T228 F230	S213-I227 WeakPolarHBondContact O-CA 3.48Å; S213-T228 PolarHBondContact N-O 3.24Å; S213-T228 PolarHBondContact O-N 2.86Å; S213-T228 PolarHBondContact OG-O 2.77Å; S213-F230 WeakPolarHBondContact OG-CE2 3.29Å
214	R	94.8	Very high	91.6	Very high	132 Å²	132	59.4 Å²	59.4	50%	0.498	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	127.1	172.3	-174.2	173.7	179.1	-113	6.7	108.8	D186 V187	D186-R214 VanDerWaalsContact CG-NH2 3.35Å; D186-R214 IonicContact OD1-CZ 2.82Å; D186-R214 IonicContact OD1-NE 2.67Å; D186-R214 IonicContact OD1-NH2 3.69Å; D186-R214 PolarHBondContact OD1-NH2 2.88Å; D186-R214 IonicContact OD2-NH2 3.14Å; D186-R214 PolarHBondContact OD2-NH2 2.91Å; V187-R214 PolarHBondContact O-NE 2.82Å
215	G	92.8	Very high	91.8	Very high	27 Å²	27	57 Å²	57	28%	0.278	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	160	174.2	0	0	0	0	0	111.1	T226	G215-T226 PolarHBondContact N-O 2.87Å; G215-T226 PolarHBondContact O-N 3.41Å; G215-T226 PolarHBondContact O-OG1 2.91Å
216	L	92.6	Very high	91.9	Very high	106 Å²	106	57 Å²	57	56%	0.555	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125	122.3	174.3	-169.3	68.1	0	0	0	108.5	T218 P225	L216-T218 HydrophobicContact CD2-CG2 4.47Å; L216-P225 HydrophobicContact CD1-CB 4.36Å
217	R	88.6	Confident	92.2	Very high	128 Å²	128	53.9 Å²	53.9	48%	0.483	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	123.2	169.9	177	-177.9	162.2	88.3	6.1	108.2	D219 Y224	R217-D219 IonicContact CZ-OD2 3.62Å; R217-D219 IonicContact NH2-OD2 3.02Å; R217-D219 PolarHBondContact NH2-OD2 3.01Å; R217-Y224 PolarHBondContact N-O 3.24Å; R217-Y224 PolarHBondContact O-N 2.8Å
218	T	88.6	Confident	92.3	Very high	98 Å²	98	54.1 Å²	54.1	60%	0.601	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	129	172.4	51.6	0	0	0	0	109.7	L216	L216-T218 HydrophobicContact CD2-CG2 4.47Å
219	D	86	Confident	92.6	Very high	90 Å²	90	52.6 Å²	52.6	48%	0.481	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	105.1	173.3	-150.6	-25.2	0	0	0	108.6	R217 S221 S222 Y224	R217-D219 IonicContact CZ-OD2 3.62Å; R217-D219 IonicContact NH2-OD2 3.02Å; R217-D219 PolarHBondContact NH2-OD2 3.01Å; D219-S221 PolarHBondContact O-N 2.89Å; D219-S222 PolarHBondContact N-O 3.42Å; D219-S222 PolarHBondContact O-N 3.02Å; D219-S222 VanDerWaalsContact O-N 3.13Å; D219-Y224 HydrophobicContact CB-CD2 4.36Å; D219-Y224 HydrophobicContact CB-CE2 4.04Å
220	G	86.9	Confident	92.8	Very high	78 Å²	78	52.2 Å²	52.2	80%	0.804	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	-118.8	-169.5	0	0	0	0	0	112.4
221	S	87	Confident	92.8	Very high	129 Å²	129	52.1 Å²	52.1	90%	0.902	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-9.6	179.1	55.6	0	0	0	0	114.3	D219	D219-S221 PolarHBondContact O-N 2.89Å
222	S	89.1	Confident	92.8	Very high	34 Å²	34	53.5 Å²	53.5	24%	0.238	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	136.4	-175.2	-63.6	0	0	0	0	110.9	D219	D219-S222 PolarHBondContact N-O 3.42Å; D219-S222 PolarHBondContact O-N 3.02Å; D219-S222 VanDerWaalsContact O-N 3.13Å
223	S	92.1	Very high	92.7	Very high	46 Å²	46	53.6 Å²	53.6	32%	0.322	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.7	178.4	66.4	0	0	0	0	110.4	G182	G182-S223 WeakPolarHBondContact CA-O 3.18Å; G182-S223 PolarHBondContact N-O 3.36Å
224	Y	93.6	Very high	92.5	Very high	64 Å²	64	54.1 Å²	54.1	25%	0.251	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	107.2	-179.8	-63.2	-86.8	0	0	0	109.5	Y180 D181 R217 D219	Y180-Y224 WeakPolarHBondContact O-CD1 3.31Å; D181-Y224 HydrophobicContact CB-CE1 4.13Å; R217-Y224 PolarHBondContact N-O 3.24Å; R217-Y224 PolarHBondContact O-N 2.8Å; D219-Y224 HydrophobicContact CB-CD2 4.36Å; D219-Y224 HydrophobicContact CB-CE2 4.04Å
225	P	94.9	Very high	92.4	Very high	5 Å²	5	48 Å²	48	3%	0.032	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	136.5	176	27.6	-31.3	0	0	0	109.6	G182 L216	G182-P225 VanDerWaalsContact CA-CD 3.42Å; L216-P225 HydrophobicContact CD1-CB 4.36Å
226	T	95.6	Very high	92.3	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	152.1	-178.3	58.7	0	0	0	0	110.2	Y123 F175 G215	Y123-T226 HydrophobicContact CE2-CG2 3.76Å; F175-T226 CarbonylContact O-C 3.53Å; F175-T226 VanDerWaalsContact O-CA 3.28Å; F175-T226 WeakPolarHBondContact O-CA 3.33Å; F175-T226 WeakPolarHBondContact O-CB 3.35Å; G215-T226 PolarHBondContact N-O 2.87Å; G215-T226 PolarHBondContact O-N 3.41Å; G215-T226 PolarHBondContact O-OG1 2.91Å
227	I	96.3	Very high	92.2	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124.2	173.6	-67.8	172.4	0	0	0	107.8	F63 F175 V187 L189 S213 Y229	F63-I227 HydrophobicContact CB-CD1 3.7Å; F63-I227 HydrophobicContact CD1-CB 4.29Å; F63-I227 HydrophobicContact CD1-CD1 3.8Å; F63-I227 HydrophobicContact CD1-CG2 4.17Å; F63-I227 HydrophobicContact CG-CD1 4.17Å; F175-I227 PolarHBondContact N-O 2.92Å; F175-I227 PolarHBondContact O-N 3.4Å; V187-I227 HydrophobicContact CB-CD1 4.3Å; V187-I227 HydrophobicContact CG1-CD1 3.51Å; V187-I227 HydrophobicContact CG1-CG1 4.3Å; L189-I227 HydrophobicContact CB-CD1 4.38Å; L189-I227 HydrophobicContact CD1-CD1 4.32Å; L189-I227 HydrophobicContact CD1-CG2 3.64Å; S213-I227 WeakPolarHBondContact O-CA 3.48Å; I227-Y229 HydrophobicContact CG2-CD2 3.98Å; I227-Y229 HydrophobicContact CG2-CE2 3.56Å
228	T	96.3	Very high	92.2	Very high	19 Å²	19	45.9 Å²	45.9	12%	0.117	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.4	178.4	-51.5	0	0	0	0	109.4	M173 G212 S213 F230	M173-T228 WeakPolarHBondContact O-CA 3.35Å; G212-T228 CarbonylContact C-O 3.49Å; G212-T228 WeakPolarHBondContact CA-O 3.29Å; S213-T228 PolarHBondContact N-O 3.24Å; S213-T228 PolarHBondContact O-N 2.86Å; S213-T228 PolarHBondContact OG-O 2.77Å; T228-F230 HydrophobicContact CG2-CE1 4.02Å; T228-F230 HydrophobicContact CG2-CE2 3.99Å; T228-F230 HydrophobicContact CG2-CZ 3.72Å
229	Y	96.8	Very high	92.3	Very high	1 Å²	1	47.3 Å²	47.3	0%	0.004	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.9	171.2	-74.4	-77.2	0	0	0	109.9	F63 L65 S172 M173 F175 L189 V194 T211 G212 I227	F63-Y229 HydrophobicContact CD1-CE2 4.05Å; F63-Y229 HydrophobicContact CE1-CD2 4.45Å; F63-Y229 AromaticContact CE1-CE2 3.73Å; F63-Y229 HydrophobicContact CE1-CE2 3.73Å; L65-Y229 HydrophobicContact CB-CD2 3.98Å; L65-Y229 HydrophobicContact CB-CE1 4.18Å; L65-Y229 HydrophobicContact CB-CE2 3.54Å; L65-Y229 HydrophobicContact CB-CG 4.45Å; L65-Y229 HydrophobicContact CD2-CD2 3.74Å; L65-Y229 HydrophobicContact CD2-CE2 4.21Å; L65-Y229 HydrophobicContact CD2-CG 3.91Å; L65-Y229 HydrophobicContact CG-CD2 4.46Å; L65-Y229 HydrophobicContact CG-CE2 4.46Å; L65-Y229 PolarHBondContact N-OH 3.09Å; S172-Y229 CarbonylContact C-O 3.58Å; S172-Y229 VanDerWaalsContact CA-O 3.27Å; S172-Y229 WeakPolarHBondContact CA-O 3.44Å; M173-Y229 PolarHBondContact N-O 2.78Å; M173-Y229 PolarHBondContact O-N 3.3Å; F175-Y229 HydrophobicContact CD2-CD2 4.11Å; F175-Y229 HydrophobicContact CE2-CD2 4.22Å; L189-Y229 HydrophobicContact CD1-CE1 4.19Å; L189-Y229 VanDerWaalsContact CD1-OH 3.32Å; L189-Y229 WeakPolarHBondContact CD1-OH 3.45Å; V194-Y229 HydrophobicContact CG2-CD1 3.3Å; V194-Y229 HydrophobicContact CG2-CE1 3.72Å; V194-Y229 HydrophobicContact CG2-CG 4.1Å; T211-Y229 CarbonylContact O-C 3.59Å; T211-Y229 WeakPolarHBondContact O-CA 3.42Å; G212-Y229 VanDerWaalsContact CA-CE1 3.49Å; I227-Y229 HydrophobicContact CG2-CD2 3.98Å; I227-Y229 HydrophobicContact CG2-CE2 3.56Å
230	F	95.9	Very high	92.4	Very high	75 Å²	75	44.2 Å²	44.2	33%	0.329	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125.2	175.2	-63.9	-78.3	0	0	0	109.8	C171 A210 T211 S213 T228	C171-F230 CarbonylContact O-C 3.53Å; C171-F230 WeakPolarHBondContact O-CA 3.42Å; A210-F230 VanDerWaalsContact CA-O 3.29Å; A210-F230 WeakPolarHBondContact CA-O 3.4Å; T211-F230 PolarHBondContact N-O 2.76Å; T211-F230 PolarHBondContact O-N 3.18Å; S213-F230 WeakPolarHBondContact OG-CE2 3.29Å; T228-F230 HydrophobicContact CG2-CE1 4.02Å; T228-F230 HydrophobicContact CG2-CE2 3.99Å; T228-F230 HydrophobicContact CG2-CZ 3.72Å
231	F	95.3	Very high	92.4	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.009	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	106.7	176.1	-67.3	-89.8	0	0	0	108.8	L65 I67 M80 N170 C171 M173 V194 I207 A210 I233	L65-F231 HydrophobicContact CD2-CE2 4.23Å; L65-F231 HydrophobicContact CD2-CZ 3.79Å; I67-F231 HydrophobicContact CD1-CE1 3.98Å; M80-F231 HydrophobicContact CE-CD2 4.09Å; N170-F231 WeakPolarHBondContact CA-O 3.34Å; C171-F231 PolarHBondContact N-O 3.45Å; C171-F231 PolarHBondContact O-N 2.54Å; M173-F231 HydrophobicContact CB-CE2 4.4Å; M173-F231 HydrophobicContact CG-CD2 4.32Å; M173-F231 HydrophobicContact CG-CE2 3.99Å; M173-F231 HydrophobicContact SD-CD2 4.28Å; M173-F231 HydrophobicContact SD-CE2 3.56Å; M173-F231 VanDerWaalsContact SD-CE2 3.56Å; M173-F231 HydrophobicContact SD-CZ 4.19Å; V194-F231 HydrophobicContact CG1-CE1 4.28Å; V194-F231 HydrophobicContact CG1-CZ 4.4Å; V194-F231 HydrophobicContact CG2-CE1 4.26Å; V194-F231 HydrophobicContact CG2-CZ 4.13Å; I207-F231 HydrophobicContact CG2-CD1 4.39Å; A210-F231 HydrophobicContact CB-CD1 3.86Å; A210-F231 HydrophobicContact CB-CE1 3.97Å; F231-I233 HydrophobicContact CB-CG2 4.33Å
232	I	94.1	Very high	92.5	Very high	44 Å²	44	40.1 Å²	40.1	23%	0.226	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	109.2	169.4	-57.6	178.9	0	0	0	107.2	L168 Q169 V208 K209	L168-I232 HydrophobicContact CD1-CG2 3.81Å; L168-I232 HydrophobicContact CD2-CG2 3.65Å; L168-I232 HydrophobicContact CG-CG2 3.81Å; Q169-I232 WeakPolarHBondContact O-CA 3.44Å; V208-I232 HydrophobicContact CB-CG2 4.33Å; V208-I232 PolarHBondContact N-O 2.92Å; K209-I232 HydrophobicContact CB-CB 4.14Å; K209-I232 HydrophobicContact CB-CD1 4.23Å; K209-I232 HydrophobicContact CB-CG1 4.47Å; K209-I232 HydrophobicContact CD-CD1 4.31Å; K209-I232 PolarHBondContact N-O 2.04Å; K209-I232 VanDerWaalsContact N-O 3.16Å; K209-I232 PolarHBondContact O-N 3.33Å
233	I	93.5	Very high	92.4	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	145.5	-176.5	61.8	179.1	0	0	0	110.7	L70 V73 L168 Q169 W205 E206 I207 F231	L70-I233 HydrophobicContact CD2-CD1 4.45Å; L70-I233 HydrophobicContact CD2-CG2 4.18Å; V73-I233 HydrophobicContact CG2-CD1 3.71Å; L168-I233 WeakPolarHBondContact CA-O 3.23Å; Q169-I233 HydrophobicContact CB-CD1 4.16Å; Q169-I233 HydrophobicContact CB-CG1 3.72Å; Q169-I233 HydrophobicContact CG-CG1 4.5Å; Q169-I233 PolarHBondContact N-O 3.11Å; Q169-I233 PolarHBondContact O-N 3.3Å; W205-I233 HydrophobicContact CD2-CD1 4.36Å; W205-I233 HydrophobicContact CE3-CB 4.17Å; W205-I233 HydrophobicContact CE3-CD1 3.88Å; W205-I233 HydrophobicContact CE3-CG1 3.92Å; W205-I233 HydrophobicContact CZ3-CD1 4.06Å; W205-I233 HydrophobicContact CZ3-CG1 4.01Å; E206-I233 CarbonylContact O-C 3.46Å; E206-I233 VanDerWaalsContact O-CA 3.32Å; E206-I233 WeakPolarHBondContact O-CA 3.33Å; I207-I233 HydrophobicContact CG1-CG2 4.11Å; I207-I233 HydrophobicContact CG2-CG2 4.47Å; F231-I233 HydrophobicContact CB-CG2 4.33Å
234	R	91.6	Very high	92.1	Very high	55 Å²	55	43 Å²	43	21%	0.208	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	134.1	-180	175.5	172.2	69.5	168.4	-0.7	109.6	E206 V208	E206-R234 PolarHBondContact N-O 3.02Å; E206-R234 PolarHBondContact O-N 2.6Å; E206-R234 IonicContact OE1-NH2 3.23Å; E206-R234 PolarHBondContact OE1-NH2 2.92Å; E206-R234 IonicContact OE2-CZ 3.91Å; E206-R234 VanDerWaalsContact OE2-CZ 3.23Å; E206-R234 IonicContact OE2-NE 3.5Å; E206-R234 PolarHBondContact OE2-NE 3.31Å; E206-R234 IonicContact OE2-NH2 2.65Å; E206-R234 PolarHBondContact OE2-NH2 3.46Å; V208-R234 HydrophobicContact CG2-CB 3.66Å
235	R	91.8	Very high	91.6	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.015	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	141.8	174.5	-167.2	-174.5	-57	-91.2	3.7	111.3	E75 D167 E204 W205 P237	E75-R235 IonicContact OE1-CZ 2.68Å; E75-R235 IonicContact OE1-NH1 3.91Å; E75-R235 PolarHBondContact OE1-NH1 2.85Å; E75-R235 IonicContact OE1-NH2 3.03Å; E75-R235 PolarHBondContact OE1-NH2 2.76Å; D167-R235 PolarHBondContact O-N 2.59Å; D167-R235 IonicContact OD1-NE 2.78Å; D167-R235 PolarHBondContact OD1-NE 2.76Å; D167-R235 IonicContact OD2-NE 2.77Å; D167-R235 IonicContact OD2-NH2 2.81Å; D167-R235 PolarHBondContact OD2-NH2 3.16Å; E204-R235 IonicContact OE1-NH1 2.96Å; E204-R235 PolarHBondContact OE1-NH1 2.89Å; W205-R235 HydrophobicContact CD2-CB 4.49Å; W205-R235 HydrophobicContact CE3-CB 4Å; W205-R235 HydrophobicContact CH2-CB 4.12Å; W205-R235 VanDerWaalsContact CH2-CZ 3.45Å; W205-R235 VanDerWaalsContact CZ2-NH1 3.27Å; W205-R235 HydrophobicContact CZ3-CB 3.78Å; R235-P237 WeakPolarHBondContact O-CD 3.36Å
236	L	91.1	Very high	91.1	Very high	73 Å²	73	45 Å²	45	38%	0.382	22%	0.219	S	C	.	.			trans	-87.9	109	168.5	-65.8	173.6	0	0	0	109.1	G203 E204 L238	G203-L236 WeakPolarHBondContact O-CD1 3.29Å; E204-L236 WeakPolarHBondContact O-CB 3.34Å; E204-L236 PolarHBondContact O-N 3.07Å; L236-L238 VanDerWaalsContact C-N 3.35Å; L236-L238 PolarHBondContact O-N 3.35Å
237	P	90.4	Very high	90.8	Very high	17 Å²	17	46.7 Å²	46.7	11%	0.11	23%	0.23	C	C	.	.			trans	-85.5	-0.8	-161.6	33.6	-38.3	0	0	0	114.8	P165 F166 R235 F239 Y240 T241 W455	P165-P237 HydrophobicContact CB-CB 4.22Å; P165-P237 HydrophobicContact CG-CB 3.97Å; F166-P237 HydrophobicContact CD1-CB 3.54Å; F166-P237 HydrophobicContact CD1-CG 3.67Å; F166-P237 HydrophobicContact CE1-CB 3.32Å; F166-P237 HydrophobicContact CE1-CG 3.49Å; F166-P237 VanDerWaalsContact CE1-CG 3.49Å; F166-P237 HydrophobicContact CZ-CB 4.27Å; R235-P237 WeakPolarHBondContact O-CD 3.36Å; P237-F239 PolarHBondContact O-N 2.89Å; P237-Y240 PolarHBondContact O-N 2.93Å; P237-T241 WeakPolarHBondContact O-CB 3.39Å; P237-T241 PolarHBondContact O-N 3.35Å; P237-T241 PolarHBondContact O-OG1 3.07Å; P237-W455 HydrophobicContact CG-CH2 3.57Å; P237-W455 HydrophobicContact CG-CZ2 3.69Å; P237-W455 HydrophobicContact CG-CZ3 4.44Å
238	L	89.3	Confident	90.1	Very high	125 Å²	125	46.8 Å²	46.8	65%	0.654	23%	0.231	S	C	*	.	H	α-helix	trans	-58.5	-46.3	-167.5	-177.4	66.3	0	0	0	112.4	L236 T241 L242	L236-L238 VanDerWaalsContact C-N 3.35Å; L236-L238 PolarHBondContact O-N 3.35Å; L238-T241 PolarHBondContact O-N 3.08Å; L238-L242 HydrophobicContact CD1-CD1 4.09Å; L238-L242 HydrophobicContact CD1-CG 4.29Å; L238-L242 HydrophobicContact CG-CD1 4.18Å; L238-L242 WeakPolarHBondContact O-CG 3.43Å; L238-L242 PolarHBondContact O-N 3.02Å
239	F	90.3	Very high	89.5	Confident	128 Å²	128	49.8 Å²	49.8	56%	0.561	25%	0.246	S	C	*	.	H	α-helix	trans	-57.9	-54.5	179.6	176.6	-97.7	0	0	0	111.5	P237 T241 L242 F243	P237-F239 PolarHBondContact O-N 2.89Å; F239-T241 VanDerWaalsContact C-N 3.32Å; F239-T241 PolarHBondContact O-N 3.46Å; F239-L242 PolarHBondContact O-N 3.2Å; F239-F243 AromaticContact CD2-CD2 3.6Å; F239-F243 HydrophobicContact CD2-CD2 3.6Å; F239-F243 AromaticContact CD2-CE2 3.76Å; F239-F243 HydrophobicContact CD2-CE2 3.76Å; F239-F243 AromaticContact CE2-CD2 3.61Å; F239-F243 HydrophobicContact CE2-CD2 3.61Å; F239-F243 AromaticContact CE2-CE2 3.85Å; F239-F243 HydrophobicContact CE2-CE2 3.85Å; F239-F243 HydrophobicContact CG-CD2 4.19Å; F239-F243 HydrophobicContact CZ-CD2 4.22Å; F239-F243 VanDerWaalsContact O-CD2 3.26Å; F239-F243 WeakPolarHBondContact O-CD2 3.27Å; F239-F243 PolarHBondContact O-N 3.18Å
240	Y	88.4	Confident	89	Confident	26 Å²	26	51.4 Å²	51.4	10%	0.102	26%	0.263	C	S	.	.	H	α-helix	trans	-66.7	-32.8	-179.8	-61.3	-74.5	0	0	0	112.7	F164 P165 E204 P237 L244 I245 I289	F164-Y240 HydrophobicContact CE1-CD1 4.07Å; F164-Y240 HydrophobicContact CE1-CG 4.32Å; F164-Y240 HydrophobicContact CE2-CE1 4.42Å; F164-Y240 AromaticContact CZ-CD1 3.55Å; F164-Y240 HydrophobicContact CZ-CD1 3.55Å; F164-Y240 HydrophobicContact CZ-CD2 4.33Å; F164-Y240 AromaticContact CZ-CE1 3.65Å; F164-Y240 HydrophobicContact CZ-CE1 3.65Å; F164-Y240 HydrophobicContact CZ-CE2 4.43Å; F164-Y240 AromaticContact CZ-CG 3.88Å; F164-Y240 HydrophobicContact CZ-CG 3.88Å; P165-Y240 HydrophobicContact CB-CD2 3.99Å; P165-Y240 HydrophobicContact CB-CG 4.02Å; E204-Y240 PolarHBondContact OE1-OH 3.45Å; P237-Y240 PolarHBondContact O-N 2.93Å; Y240-L244 HydrophobicContact CD1-CD1 3.72Å; Y240-L244 HydrophobicContact CD1-CG 4.48Å; Y240-L244 WeakPolarHBondContact O-CA 3.39Å; Y240-L244 VanDerWaalsContact O-CB 3.27Å; Y240-L244 WeakPolarHBondContact O-CB 3.45Å; Y240-L244 PolarHBondContact O-N 2.85Å; Y240-I245 PolarHBondContact O-N 2.89Å; Y240-I245 VanDerWaalsContact O-N 3.13Å; Y240-I289 HydrophobicContact CE1-CG2 4.49Å
241	T	87	Confident	88.4	Confident	38 Å²	38	48.5 Å²	48.5	23%	0.233	25%	0.25	C	S	.	.	I	π-helix	trans	-64	-46.3	176	-57.7	0	0	0	0	111.2	P237 L238 F239 I245 I246	P237-T241 WeakPolarHBondContact O-CB 3.39Å; P237-T241 PolarHBondContact O-N 3.35Å; P237-T241 PolarHBondContact O-OG1 3.07Å; L238-T241 PolarHBondContact O-N 3.08Å; F239-T241 VanDerWaalsContact C-N 3.32Å; F239-T241 PolarHBondContact O-N 3.46Å; T241-I245 HydrophobicContact CG2-CD1 4.46Å; T241-I245 WeakPolarHBondContact O-CB 3.47Å; T241-I245 PolarHBondContact O-N 3.16Å; T241-I246 WeakPolarHBondContact O-CG1 3.46Å; T241-I246 PolarHBondContact O-N 3.41Å
242	L	88.9	Confident	87.8	Confident	82 Å²	82	48.9 Å²	48.9	43%	0.429	25%	0.253	S	S	.	.	I	π-helix	trans	-72.5	-40.6	-178	-67.8	178.1	0	0	0	113.1	L238 F239 I246 P247	L238-L242 HydrophobicContact CD1-CD1 4.09Å; L238-L242 HydrophobicContact CD1-CG 4.29Å; L238-L242 HydrophobicContact CG-CD1 4.18Å; L238-L242 WeakPolarHBondContact O-CG 3.43Å; L238-L242 PolarHBondContact O-N 3.02Å; F239-L242 PolarHBondContact O-N 3.2Å; L242-I246 HydrophobicContact CD2-CD1 3.63Å; L242-P247 WeakPolarHBondContact O-CD 3.5Å
243	F	87.2	Confident	87.4	Confident	124 Å²	124	52.8 Å²	52.8	54%	0.544	27%	0.268	S	S	.	.	I	π-helix	trans	-99.9	-19.9	-170.9	-63.7	-64.8	0	0	0	114.9	F239 P247	F239-F243 AromaticContact CD2-CD2 3.6Å; F239-F243 HydrophobicContact CD2-CD2 3.6Å; F239-F243 AromaticContact CD2-CE2 3.76Å; F239-F243 HydrophobicContact CD2-CE2 3.76Å; F239-F243 AromaticContact CE2-CD2 3.61Å; F239-F243 HydrophobicContact CE2-CD2 3.61Å; F239-F243 AromaticContact CE2-CE2 3.85Å; F239-F243 HydrophobicContact CE2-CE2 3.85Å; F239-F243 HydrophobicContact CG-CD2 4.19Å; F239-F243 HydrophobicContact CZ-CD2 4.22Å; F239-F243 VanDerWaalsContact O-CD2 3.26Å; F239-F243 WeakPolarHBondContact O-CD2 3.27Å; F239-F243 PolarHBondContact O-N 3.18Å; F243-P247 WeakPolarHBondContact O-CG 3.05Å
244	L	84.8	Confident	87.1	Confident	17 Å²	17	55.6 Å²	55.6	9%	0.089	28%	0.283	C	S	.	.	I	π-helix	trans	-108.4	-55.5	174.1	-58.9	-179.1	0	0	0	111.6	F164 Y240 P247 C248 V285 I286 I289	F164-L244 HydrophobicContact CE1-CD1 4.2Å; Y240-L244 HydrophobicContact CD1-CD1 3.72Å; Y240-L244 HydrophobicContact CD1-CG 4.48Å; Y240-L244 WeakPolarHBondContact O-CA 3.39Å; Y240-L244 VanDerWaalsContact O-CB 3.27Å; Y240-L244 WeakPolarHBondContact O-CB 3.45Å; Y240-L244 PolarHBondContact O-N 2.85Å; L244-P247 WeakPolarHBondContact O-CD 3.08Å; L244-C248 PolarHBondContact O-N 2.79Å; L244-C248 PolarHBondContact O-SG 2.99Å; L244-V285 HydrophobicContact CD2-CG1 4.43Å; L244-I286 HydrophobicContact CD1-CG1 4.47Å; L244-I286 HydrophobicContact CD2-CG1 4.43Å; L244-I289 HydrophobicContact CD1-CD1 4.22Å
245	I	83.6	Confident	86.7	Confident	19 Å²	19	53.5 Å²	53.5	10%	0.097	28%	0.277	C	S	.	.	I	π-helix	trans	-68.6	-49.1	-170.7	-57.7	-180	0	0	0	111.8	P165 F166 Y240 T241 C248 I249 F448	P165-I245 HydrophobicContact CG-CD1 4.18Å; F166-I245 HydrophobicContact CE2-CD1 3.86Å; F166-I245 HydrophobicContact CZ-CD1 4.01Å; Y240-I245 PolarHBondContact O-N 2.89Å; Y240-I245 VanDerWaalsContact O-N 3.13Å; T241-I245 HydrophobicContact CG2-CD1 4.46Å; T241-I245 WeakPolarHBondContact O-CB 3.47Å; T241-I245 PolarHBondContact O-N 3.16Å; I245-C248 PolarHBondContact O-N 3.12Å; I245-I249 HydrophobicContact CG2-CD1 3.81Å; I245-I249 HydrophobicContact CG2-CG1 4.37Å; I245-I249 WeakPolarHBondContact O-CG1 3.4Å; I245-I249 PolarHBondContact O-N 3.02Å; I245-F448 HydrophobicContact CG2-CE1 4.38Å
246	I	85.9	Confident	86.5	Confident	92 Å²	92	54.1 Å²	54.1	47%	0.472	28%	0.28	S	S	.	.	H	α-helix	trans	-59.4	-48.2	-178.3	-70.5	178.9	0	0	0	112.3	T241 L242 C248 I249 G250	T241-I246 WeakPolarHBondContact O-CG1 3.46Å; T241-I246 PolarHBondContact O-N 3.41Å; L242-I246 HydrophobicContact CD2-CD1 3.63Å; I246-C248 VanDerWaalsContact C-N 3.32Å; I246-C248 PolarHBondContact O-N 2.67Å; I246-I249 PolarHBondContact O-N 2.81Å; I246-G250 PolarHBondContact O-N 2.91Å
247	P	87.4	Confident	86.4	Confident	38 Å²	38	54 Å²	54	25%	0.247	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-39	175.1	-29.1	38.1	0	0	0	113.5	L242 F243 L244 G250 L251 F282	L242-P247 WeakPolarHBondContact O-CD 3.5Å; F243-P247 WeakPolarHBondContact O-CG 3.05Å; L244-P247 WeakPolarHBondContact O-CD 3.08Å; P247-G250 PolarHBondContact O-N 3.39Å; P247-L251 WeakPolarHBondContact O-CG 3.37Å; P247-L251 PolarHBondContact O-N 3.35Å; P247-F282 HydrophobicContact CB-CE1 3.88Å; P247-F282 HydrophobicContact CB-CE2 4.31Å; P247-F282 HydrophobicContact CB-CZ 3.61Å; P247-F282 HydrophobicContact CG-CE1 4.46Å; P247-F282 HydrophobicContact CG-CZ 4.39Å
248	C	82.2	Confident	86.2	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.014	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-40.7	177.8	-65.9	0	0	0	0	112.2	L244 I245 I246 L251 S252 Y303 L304	L244-C248 PolarHBondContact O-N 2.79Å; L244-C248 PolarHBondContact O-SG 2.99Å; I245-C248 PolarHBondContact O-N 3.12Å; I246-C248 VanDerWaalsContact C-N 3.32Å; I246-C248 PolarHBondContact O-N 2.67Å; C248-L251 PolarHBondContact O-N 2.71Å; C248-S252 PolarHBondContact O-N 3.34Å; C248-Y303 HydrophobicContact CB-CE1 4.34Å; C248-L304 HydrophobicContact CB-CD2 4.2Å
249	I	83.6	Confident	86.2	Confident	83 Å²	83	47.6 Å²	47.6	43%	0.426	25%	0.245	S	C	.	.	H	α-helix	trans	-63.8	-44.4	172.7	-65.4	171.5	0	0	0	110	I245 I246 L251 S252 F253	I245-I249 HydrophobicContact CG2-CD1 3.81Å; I245-I249 HydrophobicContact CG2-CG1 4.37Å; I245-I249 WeakPolarHBondContact O-CG1 3.4Å; I245-I249 PolarHBondContact O-N 3.02Å; I246-I249 PolarHBondContact O-N 2.81Å; I249-L251 PolarHBondContact O-N 2.75Å; I249-S252 PolarHBondContact O-N 3.34Å; I249-S252 PolarHBondContact O-OG 3.04Å; I249-F253 PolarHBondContact O-N 3.05Å
250	G	86.3	Confident	86	Confident	35 Å²	35	48.1 Å²	48.1	36%	0.361	24%	0.244	S	C	.	.	H	α-helix	trans	-58.2	-45.3	176.2	0	0	0	0	0	113	I246 P247 F253 L254	I246-G250 PolarHBondContact O-N 2.91Å; P247-G250 PolarHBondContact O-N 3.39Å; G250-F253 WeakPolarHBondContact O-CB 3.2Å; G250-F253 PolarHBondContact O-N 3.48Å; G250-L254 WeakPolarHBondContact O-CG 3.18Å; G250-L254 PolarHBondContact O-N 2.81Å
251	L	83.9	Confident	86	Confident	14 Å²	14	49.8 Å²	49.8	7%	0.073	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-43.2	175.9	-72.5	176.2	0	0	0	111.8	P247 C248 I249 F253 L254 T255 L279 F282	P247-L251 WeakPolarHBondContact O-CG 3.37Å; P247-L251 PolarHBondContact O-N 3.35Å; C248-L251 PolarHBondContact O-N 2.71Å; I249-L251 PolarHBondContact O-N 2.75Å; L251-F253 VanDerWaalsContact C-N 3.27Å; L251-F253 PolarHBondContact O-N 3.4Å; L251-L254 HydrophobicContact CD2-CD1 4.35Å; L251-L254 PolarHBondContact O-N 2.86Å; L251-T255 WeakPolarHBondContact O-CG2 3.31Å; L251-T255 PolarHBondContact O-N 3.49Å; L251-L279 HydrophobicContact CD1-CD1 4.48Å; L251-F282 HydrophobicContact CD1-CD2 3.43Å; L251-F282 VanDerWaalsContact CD1-CD2 3.43Å; L251-F282 HydrophobicContact CD1-CE2 3.76Å; L251-F282 HydrophobicContact CD1-CG 4.33Å
252	S	82.8	Confident	85.9	Confident	9 Å²	9	51.7 Å²	51.7	6%	0.063	27%	0.267	C	S	.	.	H	α-helix	trans	-59.2	-39.3	175.7	75.8	0	0	0	0	111.9	C248 I249 T255 Y303	C248-S252 PolarHBondContact O-N 3.34Å; I249-S252 PolarHBondContact O-N 3.34Å; I249-S252 PolarHBondContact O-OG 3.04Å; S252-T255 PolarHBondContact O-N 3.35Å; S252-T255 PolarHBondContact O-OG1 3.32Å; S252-Y303 VanDerWaalsContact CB-OH 3.29Å; S252-Y303 WeakPolarHBondContact CB-OH 3.44Å; S252-Y303 PolarHBondContact OG-OH 2.65Å
253	F	85.3	Confident	85.5	Confident	126 Å²	126	48.3 Å²	48.3	55%	0.553	25%	0.251	S	S	*	.	H	α-helix	trans	-66.5	-40.4	176	179.5	-101.7	0	0	0	112.7	I249 G250 L251 T255 I256 L257	I249-F253 PolarHBondContact O-N 3.05Å; G250-F253 WeakPolarHBondContact O-CB 3.2Å; G250-F253 PolarHBondContact O-N 3.48Å; L251-F253 VanDerWaalsContact C-N 3.27Å; L251-F253 PolarHBondContact O-N 3.4Å; F253-T255 PolarHBondContact O-N 3.49Å; F253-I256 PolarHBondContact O-N 2.95Å; F253-I256 VanDerWaalsContact O-N 3.11Å; F253-L257 PolarHBondContact O-N 3.5Å; F253-L257 VanDerWaalsContact O-N 3.12Å
254	L	87.1	Confident	85	Confident	61 Å²	61	47.5 Å²	47.5	32%	0.319	25%	0.252	S	S	.	.	H	α-helix	trans	-60.2	-31.3	176.8	-70.8	176.4	0	0	0	112.4	G250 L251 I256 L257 V258 V275	G250-L254 WeakPolarHBondContact O-CG 3.18Å; G250-L254 PolarHBondContact O-N 2.81Å; L251-L254 HydrophobicContact CD2-CD1 4.35Å; L251-L254 PolarHBondContact O-N 2.86Å; L254-I256 VanDerWaalsContact C-N 3.31Å; L254-I256 PolarHBondContact O-N 3.45Å; L254-L257 HydrophobicContact CD2-CD2 4.04Å; L254-L257 WeakPolarHBondContact O-CB 3.43Å; L254-L257 PolarHBondContact O-N 3.39Å; L254-V258 PolarHBondContact O-N 3.09Å; L254-V275 HydrophobicContact CB-CG2 3.97Å; L254-V275 HydrophobicContact CD1-CG2 4.43Å
255	T	83.3	Confident	84.4	Confident	11 Å²	11	49.2 Å²	49.2	7%	0.067	27%	0.274	C	S	.	.	H	α-helix	trans	-65.7	-33.5	177.1	71.5	0	0	0	0	112.8	L251 S252 F253 V275 V311	L251-T255 WeakPolarHBondContact O-CG2 3.31Å; L251-T255 PolarHBondContact O-N 3.49Å; S252-T255 PolarHBondContact O-N 3.35Å; S252-T255 PolarHBondContact O-OG1 3.32Å; F253-T255 PolarHBondContact O-N 3.49Å; T255-V275 HydrophobicContact CG2-CG1 3.7Å; T255-V311 HydrophobicContact CG2-CB 4.42Å; T255-V311 HydrophobicContact CG2-CG2 3.3Å
256	I	87.6	Confident	84.1	Confident	17 Å²	17	51 Å²	51	9%	0.087	30%	0.297	C	S	.	.	H	α-helix	trans	-75.2	-38.6	176	-59.5	166.8	0	0	0	109.5	F253 L254 V258 F259 L433 L437	F253-I256 PolarHBondContact O-N 2.95Å; F253-I256 VanDerWaalsContact O-N 3.11Å; L254-I256 VanDerWaalsContact C-N 3.31Å; L254-I256 PolarHBondContact O-N 3.45Å; I256-V258 PolarHBondContact O-N 3.41Å; I256-F259 PolarHBondContact O-N 2.92Å; I256-F259 VanDerWaalsContact O-N 3.15Å; I256-L433 HydrophobicContact CG2-CG 4.37Å; I256-L437 HydrophobicContact CD1-CD1 3.99Å; I256-L437 HydrophobicContact CG2-CB 4.45Å
257	L	88.1	Confident	84.1	Confident	71 Å²	71	52.5 Å²	52.5	37%	0.372	30%	0.302	S	S	.	.	H	α-helix	trans	-60.3	-30.6	179.4	-171.5	65.1	0	0	0	112.8	F253 L254 F259 Y260 L261	F253-L257 PolarHBondContact O-N 3.5Å; F253-L257 VanDerWaalsContact O-N 3.12Å; L254-L257 HydrophobicContact CD2-CD2 4.04Å; L254-L257 WeakPolarHBondContact O-CB 3.43Å; L254-L257 PolarHBondContact O-N 3.39Å; L257-F259 VanDerWaalsContact C-N 3.26Å; L257-F259 PolarHBondContact O-N 3.19Å; L257-Y260 WeakPolarHBondContact O-CB 3.3Å; L257-Y260 PolarHBondContact O-N 3.46Å; L257-L261 PolarHBondContact O-N 3.5Å
258	V	87.9	Confident	84	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-52.6	-42.2	174.2	166.7	0	0	0	0	112.2	L254 I256 Y260 L261 K268 L271 C272 T318	L254-V258 PolarHBondContact O-N 3.09Å; I256-V258 PolarHBondContact O-N 3.41Å; V258-Y260 VanDerWaalsContact C-N 3.26Å; V258-Y260 PolarHBondContact O-N 2.91Å; V258-L261 PolarHBondContact O-N 2.84Å; V258-K268 HydrophobicContact CG1-CG 4.32Å; V258-K268 WeakPolarHBondContact O-CE 3.29Å; V258-L271 HydrophobicContact CG2-CD2 3.76Å; V258-L271 HydrophobicContact CG2-CG 3.95Å; V258-C272 WeakPolarHBondContact CG1-SG 3.4Å; V258-T318 HydrophobicContact CG1-CG2 4.07Å
259	F	87.9	Confident	84.1	Confident	3 Å²	3	54.9 Å²	54.9	1%	0.013	31%	0.311	C	S	.	.	H	α-helix	trans	-76	-15.4	-179.3	-64.5	-66.4	0	0	0	113.4	I256 L257 S314 I317 F432 L433 F436	I256-F259 PolarHBondContact O-N 2.92Å; I256-F259 VanDerWaalsContact O-N 3.15Å; L257-F259 VanDerWaalsContact C-N 3.26Å; L257-F259 PolarHBondContact O-N 3.19Å; F259-S314 VanDerWaalsContact CE2-OG 3.28Å; F259-S314 WeakPolarHBondContact CE2-OG 3.41Å; F259-S314 WeakPolarHBondContact CZ-OG 3.26Å; F259-I317 HydrophobicContact CE1-CB 4.48Å; F259-I317 HydrophobicContact CE1-CG2 3.95Å; F259-I317 HydrophobicContact CZ-CG2 4.47Å; F259-F432 HydrophobicContact CD1-CB 4.2Å; F259-F432 HydrophobicContact CE1-CB 4.06Å; F259-F432 HydrophobicContact CZ-CB 4.34Å; F259-L433 HydrophobicContact CB-CB 3.79Å; F259-L433 HydrophobicContact CB-CD1 4.36Å; F259-L433 HydrophobicContact CB-CG 4.31Å; F259-F436 HydrophobicContact CD2-CG 4.43Å; F259-F436 HydrophobicContact CE2-CB 4.23Å; F259-F436 AromaticContact CE2-CD1 3.95Å; F259-F436 HydrophobicContact CE2-CD1 3.95Å; F259-F436 AromaticContact CE2-CD2 3.74Å; F259-F436 HydrophobicContact CE2-CD2 3.74Å; F259-F436 HydrophobicContact CE2-CE1 4.18Å; F259-F436 AromaticContact CE2-CE2 3.96Å; F259-F436 HydrophobicContact CE2-CE2 3.96Å; F259-F436 AromaticContact CE2-CG 3.7Å; F259-F436 HydrophobicContact CE2-CG 3.7Å; F259-F436 HydrophobicContact CE2-CZ 4.16Å; F259-F436 HydrophobicContact CZ-CD2 4.05Å; F259-F436 HydrophobicContact CZ-CE1 4.47Å; F259-F436 AromaticContact CZ-CE2 3.84Å; F259-F436 HydrophobicContact CZ-CE2 3.84Å; F259-F436 HydrophobicContact CZ-CG 4.42Å; F259-F436 HydrophobicContact CZ-CZ 4.04Å
260	Y	87.6	Confident	84.3	Confident	139 Å²	139	53.7 Å²	53.7	55%	0.545	31%	0.31	S	S	.	.	H	α-helix	trans	-81.9	-27.5	173.3	-169.4	-95.3	0	0	0	111.9	L257 V258 L433	L257-Y260 WeakPolarHBondContact O-CB 3.3Å; L257-Y260 PolarHBondContact O-N 3.46Å; V258-Y260 VanDerWaalsContact C-N 3.26Å; V258-Y260 PolarHBondContact O-N 2.91Å; Y260-L433 HydrophobicContact CD2-CD1 4.05Å
261	L	87.2	Confident	84.3	Confident	62 Å²	62	54.3 Å²	54.3	33%	0.325	31%	0.305	S	S	.	.	S	Bend	trans	-72.2	127.7	-176.4	-166.7	74	0	0	0	111.5	L257 V258 E267 K268	L257-L261 PolarHBondContact O-N 3.5Å; V258-L261 PolarHBondContact O-N 2.84Å; L261-E267 HydrophobicContact CD2-CB 4.5Å; L261-K268 HydrophobicContact CD2-CB 4.21Å
262	P	85.3	Confident	84.3	Confident	77 Å²	77	54 Å²	54	50%	0.5	30%	0.304	S	S	.	.			trans	-67.9	139.6	179.1	28	-34.3	0	0	0	111.6	N264	P262-N264 PolarHBondContact O-N 3.5Å; P262-N264 VanDerWaalsContact O-N 3.08Å
263	S	79.6	Confident	84.4	Confident	12 Å²	12	56.9 Å²	56.9	8%	0.084	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-68.6	-2.4	179.4	51.4	0	0	0	0	115.3	G265 H325	S263-G265 VanDerWaalsContact C-N 3.34Å; S263-H325 PolarHBondContact OG-CD2 3.23Å; S263-H325 PolarHBondContact OG-CE1 3.45Å; S263-H325 PolarHBondContact OG-ND1 3.16Å; S263-H325 PolarHBondContact OG-NE2 3.15Å
264	N	77.6	Confident	84.7	Confident	107 Å²	107	54.2 Å²	54.2	57%	0.572	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-73.2	-24.8	-179.5	-71.1	-31.6	0	0	0	113.4	P262 H325	P262-N264 PolarHBondContact O-N 3.5Å; P262-N264 VanDerWaalsContact O-N 3.08Å; N264-H325 PolarHBondContact OD1-CE1 3.26Å; N264-H325 VanDerWaalsContact OD1-CE1 3.24Å; N264-H325 PolarHBondContact OD1-NE2 3.02Å; N264-H325 VanDerWaalsContact OD1-NE2 3.1Å
265	G	72.3	Confident	84.6	Confident	52 Å²	52	51.7 Å²	51.7	54%	0.536	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-88.5	-4.6	-169	0	0	0	0	0	116.1	S263 E267	S263-G265 VanDerWaalsContact C-N 3.34Å; G265-E267 PolarHBondContact O-N 2.81Å
266	G	78	Confident	84.7	Confident	57 Å²	57	53.7 Å²	53.7	59%	0.588	32%	0.315	S	S	*	.	S	Bend	trans	69.1	-28.1	-175.4	0	0	0	0	0	115.3	K268	G266-K268 PolarHBondContact O-N 3.49Å; G266-K268 VanDerWaalsContact O-N 3.11Å
267	E	85	Confident	84.8	Confident	123 Å²	123	57.3 Å²	57.3	58%	0.575	34%	0.338	S	S	*	.	H	α-helix	trans	-65.6	-13.5	-177.8	-63.1	-53.3	145.5	0	0	115	L261 G265 I269 S270 L271	L261-E267 HydrophobicContact CD2-CB 4.5Å; G265-E267 PolarHBondContact O-N 2.81Å; E267-I269 VanDerWaalsContact C-N 3.3Å; E267-I269 PolarHBondContact O-N 3.45Å; E267-S270 WeakPolarHBondContact O-CB 3.39Å; E267-S270 PolarHBondContact O-N 3.4Å; E267-L271 PolarHBondContact O-N 2.77Å
268	K	86.1	Confident	84.9	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.009	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-39.9	-178.9	-163.3	-179.3	-168.8	-167.4	0	112.3	V258 L261 G266 C272 T318 I322 D429	V258-K268 HydrophobicContact CG1-CG 4.32Å; V258-K268 WeakPolarHBondContact O-CE 3.29Å; L261-K268 HydrophobicContact CD2-CB 4.21Å; G266-K268 PolarHBondContact O-N 3.49Å; G266-K268 VanDerWaalsContact O-N 3.11Å; K268-C272 PolarHBondContact O-N 2.93Å; K268-C272 PolarHBondContact O-SG 3.22Å; K268-T318 HydrophobicContact CD-CG2 3.63Å; K268-T318 VanDerWaalsContact CE-CG2 3.42Å; K268-T318 HydrophobicContact CG-CG2 3.83Å; K268-I322 HydrophobicContact CD-CD1 4.36Å; K268-I322 HydrophobicContact CD-CG1 4.45Å; K268-D429 IonicContact NZ-OD1 2.72Å; K268-D429 PolarHBondContact NZ-OD1 2.98Å; K268-D429 IonicContact NZ-OD2 3.19Å; K268-D429 PolarHBondContact NZ-OD2 2.96Å
269	I	83.9	Confident	84.7	Confident	88 Å²	88	55.8 Å²	55.8	45%	0.451	33%	0.333	S	S	.	.	H	α-helix	trans	-71.7	-42.6	178.7	-60.5	179.2	0	0	0	110.4	E267 L271 C272 T273 I322	E267-I269 VanDerWaalsContact C-N 3.3Å; E267-I269 PolarHBondContact O-N 3.45Å; I269-L271 PolarHBondContact O-N 3.01Å; I269-C272 WeakPolarHBondContact O-CB 3.33Å; I269-C272 PolarHBondContact O-N 2.91Å; I269-T273 HydrophobicContact CG2-CG2 4.36Å; I269-T273 WeakPolarHBondContact O-CG2 3.48Å; I269-T273 PolarHBondContact O-N 3.01Å; I269-T273 PolarHBondContact O-OG1 3.39Å; I269-I322 HydrophobicContact CD1-CD1 3.86Å; I269-I322 HydrophobicContact CG1-CD1 3.47Å; I269-I322 VanDerWaalsContact CG1-CD1 3.47Å
270	S	87.2	Confident	84.5	Confident	58 Å²	58	58.6 Å²	58.6	41%	0.406	35%	0.351	S	S	.	.	H	α-helix	trans	-55.2	-52.9	177.2	-174.2	0	0	0	0	110.8	E267 C272 T273 S274	E267-S270 WeakPolarHBondContact O-CB 3.39Å; E267-S270 PolarHBondContact O-N 3.4Å; S270-C272 VanDerWaalsContact C-N 3.35Å; S270-C272 PolarHBondContact O-N 3.01Å; S270-T273 PolarHBondContact O-N 3.29Å; S270-T273 VanDerWaalsContact O-N 3.16Å; S270-T273 PolarHBondContact O-OG1 3.13Å; S270-S274 PolarHBondContact O-N 3.38Å; S270-S274 PolarHBondContact O-OG 2.97Å
271	L	87.4	Confident	84.6	Confident	49 Å²	49	55.8 Å²	55.8	26%	0.257	35%	0.348	S	S	.	.	H	α-helix	trans	-56.5	-45.5	176.9	-178.3	64.6	0	0	0	112.5	V258 E267 I269 T273 S274 V275	V258-L271 HydrophobicContact CG2-CD2 3.76Å; V258-L271 HydrophobicContact CG2-CG 3.95Å; E267-L271 PolarHBondContact O-N 2.77Å; I269-L271 PolarHBondContact O-N 3.01Å; L271-T273 PolarHBondContact O-N 3.2Å; L271-S274 PolarHBondContact O-N 3.43Å; L271-V275 HydrophobicContact CD1-CG2 4.34Å; L271-V275 VanDerWaalsContact O-CG2 3.28Å; L271-V275 WeakPolarHBondContact O-CG2 3.36Å; L271-V275 PolarHBondContact O-N 3.04Å
272	C	84.1	Confident	84.4	Confident	7 Å²	7	55.3 Å²	55.3	5%	0.047	34%	0.343	C	S	.	.	H	α-helix	trans	-57.7	-47.2	177	-73.1	0	0	0	0	112.5	V258 K268 I269 S270 V275 L276 I315	V258-C272 WeakPolarHBondContact CG1-SG 3.4Å; K268-C272 PolarHBondContact O-N 2.93Å; K268-C272 PolarHBondContact O-SG 3.22Å; I269-C272 WeakPolarHBondContact O-CB 3.33Å; I269-C272 PolarHBondContact O-N 2.91Å; S270-C272 VanDerWaalsContact C-N 3.35Å; S270-C272 PolarHBondContact O-N 3.01Å; C272-V275 PolarHBondContact O-N 3.25Å; C272-L276 PolarHBondContact O-N 2.92Å; C272-L276 VanDerWaalsContact O-N 3.15Å; C272-I315 HydrophobicContact CB-CG1 4.12Å
273	T	85	Confident	84.3	Confident	70 Å²	70	53.8 Å²	53.8	43%	0.429	33%	0.331	S	S	.	.	H	α-helix	trans	-67.5	-41.2	-178.9	53.7	0	0	0	0	112.1	I269 S270 L271 V275 L276 V277	I269-T273 HydrophobicContact CG2-CG2 4.36Å; I269-T273 WeakPolarHBondContact O-CG2 3.48Å; I269-T273 PolarHBondContact O-N 3.01Å; I269-T273 PolarHBondContact O-OG1 3.39Å; S270-T273 PolarHBondContact O-N 3.29Å; S270-T273 VanDerWaalsContact O-N 3.16Å; S270-T273 PolarHBondContact O-OG1 3.13Å; L271-T273 PolarHBondContact O-N 3.2Å; T273-V275 PolarHBondContact O-N 2.91Å; T273-L276 PolarHBondContact O-N 2.92Å; T273-V277 WeakPolarHBondContact O-CG2 3.29Å; T273-V277 PolarHBondContact O-N 3.04Å
274	S	89.6	Confident	84.6	Confident	69 Å²	69	57.9 Å²	57.9	48%	0.483	35%	0.351	S	S	.	.	H	α-helix	trans	-63.2	-40.2	176.9	-58.5	0	0	0	0	112.2	S270 L271 S278	S270-S274 PolarHBondContact O-N 3.38Å; S270-S274 PolarHBondContact O-OG 2.97Å; L271-S274 PolarHBondContact O-N 3.43Å; S274-S278 WeakPolarHBondContact O-CB 3.37Å; S274-S278 PolarHBondContact O-N 2.83Å
275	V	86.9	Confident	85	Confident	8 Å²	8	55.4 Å²	55.4	5%	0.048	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-41.8	177.1	171.2	0	0	0	0	111.4	L254 T255 L271 C272 T273 S278 L279 V311	L254-V275 HydrophobicContact CB-CG2 3.97Å; L254-V275 HydrophobicContact CD1-CG2 4.43Å; T255-V275 HydrophobicContact CG2-CG1 3.7Å; L271-V275 HydrophobicContact CD1-CG2 4.34Å; L271-V275 VanDerWaalsContact O-CG2 3.28Å; L271-V275 WeakPolarHBondContact O-CG2 3.36Å; L271-V275 PolarHBondContact O-N 3.04Å; C272-V275 PolarHBondContact O-N 3.25Å; T273-V275 PolarHBondContact O-N 2.91Å; V275-S278 PolarHBondContact O-N 3.5Å; V275-L279 WeakPolarHBondContact O-CB 3.41Å; V275-L279 PolarHBondContact O-N 2.84Å; V275-V311 HydrophobicContact CG1-CG1 4.31Å
276	L	84.8	Confident	85.5	Confident	53 Å²	53	53.4 Å²	53.4	28%	0.277	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-46.8	177.2	-177.6	66.5	0	0	0	112.4	C272 T273 L279 T280 V311 T312 I315	C272-L276 PolarHBondContact O-N 2.92Å; C272-L276 VanDerWaalsContact O-N 3.15Å; T273-L276 PolarHBondContact O-N 2.92Å; L276-L279 PolarHBondContact O-N 2.88Å; L276-T280 PolarHBondContact O-N 3.42Å; L276-T280 PolarHBondContact O-OG1 2.77Å; L276-V311 HydrophobicContact CB-CG1 4.34Å; L276-V311 HydrophobicContact CD1-CG1 4.05Å; L276-T312 HydrophobicContact CD1-CG2 4.1Å; L276-I315 HydrophobicContact CB-CD1 3.84Å; L276-I315 HydrophobicContact CD1-CD1 4.21Å; L276-I315 HydrophobicContact CD2-CD1 3.79Å; L276-I315 HydrophobicContact CG-CD1 4.16Å
277	V	89.9	Confident	85.5	Confident	93 Å²	93	57.3 Å²	57.3	56%	0.564	32%	0.32	S	S	*	.	H	α-helix	trans	-62.8	-46.3	179.1	172.8	0	0	0	0	110.2	T273 L279 T280 V281	T273-V277 WeakPolarHBondContact O-CG2 3.29Å; T273-V277 PolarHBondContact O-N 3.04Å; V277-L279 PolarHBondContact O-N 3.42Å; V277-T280 PolarHBondContact O-N 3.02Å; V277-V281 WeakPolarHBondContact O-CG2 3.39Å; V277-V281 PolarHBondContact O-N 2.7Å
278	S	88.9	Confident	85.4	Confident	39 Å²	39	58.3 Å²	58.3	27%	0.273	32%	0.324	S	S	.	.	H	α-helix	trans	-59.1	-45.7	177.8	-176.9	0	0	0	0	111.8	S274 V275 T280 V281 F282	S274-S278 WeakPolarHBondContact O-CB 3.37Å; S274-S278 PolarHBondContact O-N 2.83Å; V275-S278 PolarHBondContact O-N 3.5Å; S278-T280 VanDerWaalsContact C-N 3.31Å; S278-T280 PolarHBondContact O-N 3.24Å; S278-V281 PolarHBondContact O-N 3.3Å; S278-F282 VanDerWaalsContact O-CD2 3.25Å; S278-F282 WeakPolarHBondContact O-CD2 3.32Å; S278-F282 PolarHBondContact O-N 2.92Å
279	L	84.3	Confident	85.2	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-40.1	177.4	-174.1	70.3	0	0	0	112.5	L251 V275 L276 V277 F282 L283 L304 T307 M308 V311	L251-L279 HydrophobicContact CD1-CD1 4.48Å; V275-L279 WeakPolarHBondContact O-CB 3.41Å; V275-L279 PolarHBondContact O-N 2.84Å; L276-L279 PolarHBondContact O-N 2.88Å; V277-L279 PolarHBondContact O-N 3.42Å; L279-F282 PolarHBondContact O-N 2.97Å; L279-L283 PolarHBondContact O-N 3.49Å; L279-L304 HydrophobicContact CD1-CD2 3.86Å; L279-T307 HydrophobicContact CD1-CG2 4.08Å; L279-T307 HydrophobicContact CD2-CG2 4.21Å; L279-M308 VanDerWaalsContact CD2-CA 3.45Å; L279-M308 HydrophobicContact CD2-CB 3.79Å; L279-M308 HydrophobicContact CD2-CG 4.22Å; L279-V311 HydrophobicContact CD2-CB 4.16Å; L279-V311 HydrophobicContact CD2-CG2 3.72Å
280	T	84.9	Confident	85	Confident	62 Å²	62	57.5 Å²	57.5	38%	0.38	32%	0.32	S	S	.	.	H	α-helix	trans	-64.2	-42.5	177.8	-52.6	0	0	0	0	111.1	L276 V277 S278 L283 L284	L276-T280 PolarHBondContact O-N 3.42Å; L276-T280 PolarHBondContact O-OG1 2.77Å; V277-T280 PolarHBondContact O-N 3.02Å; S278-T280 VanDerWaalsContact C-N 3.31Å; S278-T280 PolarHBondContact O-N 3.24Å; T280-L283 PolarHBondContact O-N 3.19Å; T280-L284 WeakPolarHBondContact O-CG 3.44Å; T280-L284 PolarHBondContact O-N 3.06Å; T280-L284 VanDerWaalsContact O-N 3.12Å
281	V	89.3	Confident	84.5	Confident	80 Å²	80	55.3 Å²	55.3	49%	0.485	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-44.4	175.8	173.1	0	0	0	0	111.4	V277 S278 L283 L284 V285	V277-V281 WeakPolarHBondContact O-CG2 3.39Å; V277-V281 PolarHBondContact O-N 2.7Å; S278-V281 PolarHBondContact O-N 3.3Å; V281-L283 VanDerWaalsContact C-N 3.3Å; V281-L283 PolarHBondContact O-N 3.19Å; V281-L284 PolarHBondContact O-N 3.27Å; V281-V285 WeakPolarHBondContact O-CG2 3.48Å; V281-V285 PolarHBondContact O-N 3.22Å; V281-V285 VanDerWaalsContact O-N 3.07Å
282	F	83.4	Confident	83.7	Confident	51 Å²	51	59 Å²	59	22%	0.224	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-35.2	176.9	-85.6	-72.8	0	0	0	112.9	P247 L251 S278 L279 V285 I286	P247-F282 HydrophobicContact CB-CE1 3.88Å; P247-F282 HydrophobicContact CB-CE2 4.31Å; P247-F282 HydrophobicContact CB-CZ 3.61Å; P247-F282 HydrophobicContact CG-CE1 4.46Å; P247-F282 HydrophobicContact CG-CZ 4.39Å; L251-F282 HydrophobicContact CD1-CD2 3.43Å; L251-F282 VanDerWaalsContact CD1-CD2 3.43Å; L251-F282 HydrophobicContact CD1-CE2 3.76Å; L251-F282 HydrophobicContact CD1-CG 4.33Å; S278-F282 VanDerWaalsContact O-CD2 3.25Å; S278-F282 WeakPolarHBondContact O-CD2 3.32Å; S278-F282 PolarHBondContact O-N 2.92Å; L279-F282 PolarHBondContact O-N 2.97Å; F282-V285 PolarHBondContact O-N 3.45Å; F282-I286 PolarHBondContact O-N 2.82Å; F282-I286 VanDerWaalsContact O-N 3.14Å
283	L	81.9	Confident	83	Confident	45 Å²	45	60.3 Å²	60.3	24%	0.236	34%	0.344	C	S	.	.	H	α-helix	trans	-63.7	-43.7	174.6	-176	66.1	0	0	0	111.6	L279 T280 V281 V285 I286 E287 L304 M308	L279-L283 PolarHBondContact O-N 3.49Å; T280-L283 PolarHBondContact O-N 3.19Å; V281-L283 VanDerWaalsContact C-N 3.3Å; V281-L283 PolarHBondContact O-N 3.19Å; L283-V285 PolarHBondContact O-N 3.4Å; L283-I286 PolarHBondContact O-N 3.5Å; L283-E287 PolarHBondContact O-N 3.38Å; L283-L304 HydrophobicContact CD1-CB 4.25Å; L283-M308 HydrophobicContact CD2-SD 4Å
284	L	85.4	Confident	82.1	Confident	98 Å²	98	62.7 Å²	62.7	51%	0.513	36%	0.364	S	S	.	.	H	α-helix	trans	-61.5	-42.6	176.4	-68.4	173.8	0	0	0	111.9	T280 V281 I286 E287 E288	T280-L284 WeakPolarHBondContact O-CG 3.44Å; T280-L284 PolarHBondContact O-N 3.06Å; T280-L284 VanDerWaalsContact O-N 3.12Å; V281-L284 PolarHBondContact O-N 3.27Å; L284-I286 VanDerWaalsContact C-N 3.27Å; L284-I286 PolarHBondContact O-N 3.27Å; L284-E287 PolarHBondContact O-N 3.35Å; L284-E288 PolarHBondContact O-N 3.34Å; L284-E288 VanDerWaalsContact O-N 3.07Å
285	V	86.6	Confident	81.2	Confident	55 Å²	55	68 Å²	68	33%	0.333	38%	0.378	S	S	.	.	H	α-helix	trans	-59.7	-39.7	176	171.3	0	0	0	0	111.4	L244 V281 F282 L283 E288 I289	L244-V285 HydrophobicContact CD2-CG1 4.43Å; V281-V285 WeakPolarHBondContact O-CG2 3.48Å; V281-V285 PolarHBondContact O-N 3.22Å; V281-V285 VanDerWaalsContact O-N 3.07Å; F282-V285 PolarHBondContact O-N 3.45Å; L283-V285 PolarHBondContact O-N 3.4Å; V285-E288 PolarHBondContact O-N 2.86Å; V285-I289 HydrophobicContact CG1-CD1 3.95Å; V285-I289 WeakPolarHBondContact O-CG1 3.25Å; V285-I289 PolarHBondContact O-N 2.82Å
286	I	81.9	Confident	80.3	Confident	10 Å²	10	69 Å²	69	5%	0.051	39%	0.386	C	S	.	.	H	α-helix	trans	-72.5	-35.4	180	-79.1	166.8	0	0	0	112.1	L244 F282 L283 L284 E288 I289 I290 I300 L304	L244-I286 HydrophobicContact CD1-CG1 4.47Å; L244-I286 HydrophobicContact CD2-CG1 4.43Å; F282-I286 PolarHBondContact O-N 2.82Å; F282-I286 VanDerWaalsContact O-N 3.14Å; L283-I286 PolarHBondContact O-N 3.5Å; L284-I286 VanDerWaalsContact C-N 3.27Å; L284-I286 PolarHBondContact O-N 3.27Å; I286-E288 VanDerWaalsContact C-N 3.26Å; I286-E288 PolarHBondContact O-N 3Å; I286-I289 PolarHBondContact O-N 3.44Å; I286-I290 HydrophobicContact CG2-CD1 3.68Å; I286-I290 HydrophobicContact CG2-CG1 4.4Å; I286-I290 WeakPolarHBondContact O-CG1 3.09Å; I286-I290 PolarHBondContact O-N 3.15Å; I286-I290 VanDerWaalsContact O-N 3.15Å; I286-I300 HydrophobicContact CD1-CG1 4.42Å; I286-L304 HydrophobicContact CD1-CD1 3.08Å; I286-L304 HydrophobicContact CG1-CD1 4.35Å
287	E	79.1	Confident	79.8	Confident	140 Å²	140	72.2 Å²	72.2	65%	0.654	40%	0.403	S	S	*	.	H	α-helix	trans	-62.7	-33.4	171.5	-173.8	-179.5	173.4	0	0	112.1	L283 L284	L283-E287 PolarHBondContact O-N 3.38Å; L284-E287 PolarHBondContact O-N 3.35Å
288	E	83.4	Confident	79.6	Confident	143 Å²	143	68.3 Å²	68.3	67%	0.668	38%	0.38	S	S	*	.	H	α-helix	trans	-70.1	-35	177.6	-74.7	-173.7	166.3	0	0	113.5	L284 V285 I286	L284-E288 PolarHBondContact O-N 3.34Å; L284-E288 VanDerWaalsContact O-N 3.07Å; V285-E288 PolarHBondContact O-N 2.86Å; I286-E288 VanDerWaalsContact C-N 3.26Å; I286-E288 PolarHBondContact O-N 3Å
289	I	81.3	Confident	79.3	Confident	54 Å²	54	68 Å²	68	28%	0.277	37%	0.374	S	S	.	.	H	α-helix	trans	-81.1	-37.3	-176	-63.6	164.7	0	0	0	111.7	F164 Y240 L244 V285 I286	F164-I289 HydrophobicContact CZ-CG2 4.36Å; Y240-I289 HydrophobicContact CE1-CG2 4.49Å; L244-I289 HydrophobicContact CD1-CD1 4.22Å; V285-I289 HydrophobicContact CG1-CD1 3.95Å; V285-I289 WeakPolarHBondContact O-CG1 3.25Å; V285-I289 PolarHBondContact O-N 2.82Å; I286-I289 PolarHBondContact O-N 3.44Å
290	I	80.1	Confident	79.1	Confident	19 Å²	19	68.4 Å²	68.4	10%	0.097	38%	0.377	C	S	.	.	S	Bend	trans	-92.2	141.9	-170.9	-59.8	-177.2	0	0	0	110.5	V161 I286 P298 I300	V161-I290 HydrophobicContact CB-CG2 4.46Å; V161-I290 HydrophobicContact CG2-CG2 4.03Å; I286-I290 HydrophobicContact CG2-CD1 3.68Å; I286-I290 HydrophobicContact CG2-CG1 4.4Å; I286-I290 WeakPolarHBondContact O-CG1 3.09Å; I286-I290 PolarHBondContact O-N 3.15Å; I286-I290 VanDerWaalsContact O-N 3.15Å; I290-P298 HydrophobicContact CD1-CB 4Å; I290-P298 HydrophobicContact CD1-CG 3.49Å; I290-P298 VanDerWaalsContact CD1-CG 3.49Å; I290-P298 HydrophobicContact CG1-CG 4.46Å; I290-P298 HydrophobicContact CG2-CG 3.57Å; I290-I300 HydrophobicContact CD1-CG2 4.32Å
291	P	76.8	Confident	78.9	Confident	12 Å²	12	66 Å²	66	8%	0.078	37%	0.365	C	S	.	.			trans	-56.5	144.3	173.1	18.2	-30.3	0	0	0	113.1	E75 V161 S293	E75-P291 HydrophobicContact CB-CG 4.42Å; E75-P291 VanDerWaalsContact O-CB 3.25Å; E75-P291 WeakPolarHBondContact O-CB 3.47Å; E75-P291 WeakPolarHBondContact O-CG 3.26Å; V161-P291 HydrophobicContact CG1-CG 3.89Å; V161-P291 HydrophobicContact CG2-CG 4.36Å; P291-S293 PolarHBondContact O-N 3.2Å
292	S	69.1	Low	78.6	Confident	126 Å²	126	67.5 Å²	67.5	88%	0.881	37%	0.366	S	S	*	.			trans	-74.6	52.3	169.4	52.5	0	0	0	0	112
293	S	70.6	Confident	78.6	Confident	35 Å²	35	65.2 Å²	65.2	25%	0.245	36%	0.356	C	S	.	.			trans	-98.6	129.2	177.4	-177.3	0	0	0	0	110.7	P291 K295	P291-S293 PolarHBondContact O-N 3.2Å; S293-K295 VanDerWaalsContact C-N 3.33Å; S293-K295 PolarHBondContact OG-N 3.14Å
294	S	66.6	Low	78.6	Confident	121 Å²	121	63.2 Å²	63.2	85%	0.846	35%	0.345	S	S	*	.	S	Bend	trans	-84.4	-5.6	174	58	0	0	0	0	113.8	A296	S294-A296 VanDerWaalsContact C-N 3.35Å; S294-A296 PolarHBondContact O-N 3.32Å
295	K	69.2	Low	78.5	Confident	181 Å²	181	61.6 Å²	61.6	79%	0.787	34%	0.34	S	S	*	.	S	Bend	trans	-68.1	-34.7	-175.4	-70.2	-175.7	179.2	174.9	0	112.7	S293	S293-K295 VanDerWaalsContact C-N 3.33Å; S293-K295 PolarHBondContact OG-N 3.14Å
296	A	67.8	Low	78.4	Confident	27 Å²	27	61.9 Å²	61.9	22%	0.223	34%	0.336	C	S	.	.			trans	-152.9	128.1	177.2	0	0	0	0	0	109.7	T162 S294	T162-A296 WeakPolarHBondContact OG1-CB 3.44Å; S294-A296 VanDerWaalsContact C-N 3.35Å; S294-A296 PolarHBondContact O-N 3.32Å
297	I	76.2	Confident	78.4	Confident	121 Å²	121	61.8 Å²	61.8	62%	0.621	34%	0.336	S	S	*	.			trans	-88.1	130.5	173.8	-59.5	170.9	0	0	0	107.4
298	P	83.9	Confident	78.6	Confident	12 Å²	12	58 Å²	58	8%	0.078	32%	0.319	C	S	.	.			trans	-59.3	139.8	175.1	-14.8	21.4	0	0	0	111.8	V161 I290 I300 G301 E302	V161-P298 HydrophobicContact CB-CG 4.35Å; V161-P298 HydrophobicContact CG2-CG 3.88Å; V161-P298 WeakPolarHBondContact O-CB 3.3Å; I290-P298 HydrophobicContact CD1-CB 4Å; I290-P298 HydrophobicContact CD1-CG 3.49Å; I290-P298 VanDerWaalsContact CD1-CG 3.49Å; I290-P298 HydrophobicContact CG1-CG 4.46Å; I290-P298 HydrophobicContact CG2-CG 3.57Å; P298-I300 HydrophobicContact CB-CG2 3.89Å; P298-I300 PolarHBondContact O-N 2.82Å; P298-G301 WeakPolarHBondContact O-CA 3.35Å; P298-G301 PolarHBondContact O-N 3.09Å; P298-E302 PolarHBondContact O-N 2.62Å; P298-E302 VanDerWaalsContact O-N 3.09Å
299	L	82.9	Confident	78.7	Confident	31 Å²	31	55.7 Å²	55.7	16%	0.162	31%	0.311	C	S	.	.	H	α-helix	trans	-57.9	-33.5	176.4	-90.7	77.7	0	0	0	112.5	T162 F163 G301 E302 Y303 V451	T162-L299 HydrophobicContact CG2-CD1 3.51Å; T162-L299 WeakPolarHBondContact O-CD1 3.3Å; T162-L299 PolarHBondContact O-N 3.09Å; F163-L299 HydrophobicContact CE1-CD2 4.47Å; L299-G301 VanDerWaalsContact C-N 3.32Å; L299-G301 PolarHBondContact O-N 3.33Å; L299-E302 PolarHBondContact O-N 3.13Å; L299-Y303 PolarHBondContact O-N 3.31Å; L299-V451 HydrophobicContact CD2-CG2 3.55Å
300	I	81.3	Confident	78.8	Confident	14 Å²	14	55.5 Å²	55.5	7%	0.072	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-35.7	174.8	-172.4	61.6	0	0	0	112.2	F164 I286 I290 P298 Y303 L304	F164-I300 HydrophobicContact CD1-CG2 4.24Å; I286-I300 HydrophobicContact CD1-CG1 4.42Å; I290-I300 HydrophobicContact CD1-CG2 4.32Å; P298-I300 HydrophobicContact CB-CG2 3.89Å; P298-I300 PolarHBondContact O-N 2.82Å; I300-Y303 HydrophobicContact CD1-CD1 4.31Å; I300-Y303 PolarHBondContact O-N 3.02Å; I300-L304 HydrophobicContact CG1-CD1 4.46Å; I300-L304 WeakPolarHBondContact O-CG 3.29Å; I300-L304 PolarHBondContact O-N 3.24Å
301	G	80.6	Confident	78.9	Confident	12 Å²	12	54.8 Å²	54.8	12%	0.124	30%	0.304	C	S	.	.	H	α-helix	trans	-67.1	-44	175.4	0	0	0	0	0	111.2	P298 L299 Y303 L304 V305	P298-G301 WeakPolarHBondContact O-CA 3.35Å; P298-G301 PolarHBondContact O-N 3.09Å; L299-G301 VanDerWaalsContact C-N 3.32Å; L299-G301 PolarHBondContact O-N 3.33Å; G301-Y303 VanDerWaalsContact C-N 3.33Å; G301-Y303 PolarHBondContact O-N 3.34Å; G301-L304 PolarHBondContact O-N 3.01Å; G301-V305 WeakPolarHBondContact O-CG2 3.44Å; G301-V305 PolarHBondContact O-N 3.47Å
302	E	83.1	Confident	79.4	Confident	110 Å²	110	57.2 Å²	57.2	51%	0.514	32%	0.319	S	S	.	.	H	α-helix	trans	-59.3	-44	173.5	-171.4	178.9	174.9	0	0	111.6	P298 L299 L304 V305 F306 L447	P298-E302 PolarHBondContact O-N 2.62Å; P298-E302 VanDerWaalsContact O-N 3.09Å; L299-E302 PolarHBondContact O-N 3.13Å; E302-L304 VanDerWaalsContact C-N 3.34Å; E302-L304 PolarHBondContact O-N 3.44Å; E302-V305 PolarHBondContact O-N 3.4Å; E302-F306 VanDerWaalsContact O-CB 3.28Å; E302-F306 WeakPolarHBondContact O-CB 3.47Å; E302-F306 PolarHBondContact O-N 3.12Å; E302-L447 HydrophobicContact CG-CD2 4.48Å
303	Y	83.3	Confident	80.3	Confident	4 Å²	4	55.3 Å²	55.3	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-41.3	176	177.7	-104.2	0	0	0	112.9	C248 S252 L299 I300 G301 T307 L447 F448	C248-Y303 HydrophobicContact CB-CE1 4.34Å; S252-Y303 VanDerWaalsContact CB-OH 3.29Å; S252-Y303 WeakPolarHBondContact CB-OH 3.44Å; S252-Y303 PolarHBondContact OG-OH 2.65Å; L299-Y303 PolarHBondContact O-N 3.31Å; I300-Y303 HydrophobicContact CD1-CD1 4.31Å; I300-Y303 PolarHBondContact O-N 3.02Å; G301-Y303 VanDerWaalsContact C-N 3.33Å; G301-Y303 PolarHBondContact O-N 3.34Å; Y303-T307 WeakPolarHBondContact O-CB 3.42Å; Y303-T307 PolarHBondContact O-N 2.83Å; Y303-T307 PolarHBondContact O-OG1 3.23Å; Y303-L447 HydrophobicContact CD2-CD1 3.75Å; Y303-L447 HydrophobicContact CG-CD1 4.38Å; Y303-F448 HydrophobicContact CD1-CZ 4.41Å; Y303-F448 AromaticContact CD2-CE2 3.99Å; Y303-F448 HydrophobicContact CD2-CE2 3.99Å; Y303-F448 HydrophobicContact CE1-CE2 4.47Å; Y303-F448 AromaticContact CE2-CE2 3.94Å; Y303-F448 HydrophobicContact CE2-CE2 3.94Å; Y303-F448 HydrophobicContact CG-CE2 4.28Å; Y303-F448 HydrophobicContact CG-CZ 4.41Å
304	L	80.8	Confident	81	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-72.4	-39.7	179.8	-76.4	172.4	0	0	0	113	C248 L279 L283 I286 I300 G301 E302 F306 T307 M308	C248-L304 HydrophobicContact CB-CD2 4.2Å; L279-L304 HydrophobicContact CD1-CD2 3.86Å; L283-L304 HydrophobicContact CD1-CB 4.25Å; I286-L304 HydrophobicContact CD1-CD1 3.08Å; I286-L304 HydrophobicContact CG1-CD1 4.35Å; I300-L304 HydrophobicContact CG1-CD1 4.46Å; I300-L304 WeakPolarHBondContact O-CG 3.29Å; I300-L304 PolarHBondContact O-N 3.24Å; G301-L304 PolarHBondContact O-N 3.01Å; E302-L304 VanDerWaalsContact C-N 3.34Å; E302-L304 PolarHBondContact O-N 3.44Å; L304-F306 VanDerWaalsContact C-N 3.35Å; L304-T307 PolarHBondContact O-N 3.21Å; L304-M308 WeakPolarHBondContact O-CB 3.27Å; L304-M308 PolarHBondContact O-N 3.01Å
305	V	83.3	Confident	82	Confident	65 Å²	65	49.8 Å²	49.8	39%	0.394	26%	0.257	S	S	.	.	H	α-helix	trans	-63.4	-44.1	173.2	172.8	0	0	0	0	110.3	G301 E302 T307 M308 I309	G301-V305 WeakPolarHBondContact O-CG2 3.44Å; G301-V305 PolarHBondContact O-N 3.47Å; E302-V305 PolarHBondContact O-N 3.4Å; V305-T307 PolarHBondContact O-N 3.41Å; V305-M308 WeakPolarHBondContact O-CB 3.41Å; V305-M308 PolarHBondContact O-N 3.16Å; V305-I309 HydrophobicContact CG1-CD1 4.17Å; V305-I309 WeakPolarHBondContact O-CG1 3.32Å; V305-I309 PolarHBondContact O-N 2.99Å
306	F	84.5	Confident	82.9	Confident	61 Å²	61	46.1 Å²	46.1	27%	0.268	25%	0.249	S	C	.	.	H	α-helix	trans	-56.2	-52	172.2	175.4	-95.7	0	0	0	110.8	E302 L304 M308 I309 F310 V439	E302-F306 VanDerWaalsContact O-CB 3.28Å; E302-F306 WeakPolarHBondContact O-CB 3.47Å; E302-F306 PolarHBondContact O-N 3.12Å; L304-F306 VanDerWaalsContact C-N 3.35Å; F306-M308 VanDerWaalsContact C-N 3.27Å; F306-M308 PolarHBondContact O-N 3.03Å; F306-I309 PolarHBondContact O-N 2.98Å; F306-F310 HydrophobicContact CD1-CD2 4.05Å; F306-F310 HydrophobicContact CD1-CE2 4.44Å; F306-F310 HydrophobicContact CD2-CD2 4.03Å; F306-F310 AromaticContact CD2-CE2 3.81Å; F306-F310 HydrophobicContact CD2-CE2 3.81Å; F306-F310 AromaticContact CE1-CD2 3.75Å; F306-F310 HydrophobicContact CE1-CD2 3.75Å; F306-F310 AromaticContact CE1-CE2 3.89Å; F306-F310 HydrophobicContact CE1-CE2 3.89Å; F306-F310 HydrophobicContact CE1-CG 4.48Å; F306-F310 AromaticContact CE2-CD2 3.75Å; F306-F310 HydrophobicContact CE2-CD2 3.75Å; F306-F310 AromaticContact CE2-CE2 3.18Å; F306-F310 HydrophobicContact CE2-CE2 3.18Å; F306-F310 HydrophobicContact CE2-CZ 4.08Å; F306-F310 HydrophobicContact CG-CD2 4.18Å; F306-F310 HydrophobicContact CG-CE2 4.41Å; F306-F310 AromaticContact CZ-CD2 3.6Å; F306-F310 HydrophobicContact CZ-CD2 3.6Å; F306-F310 AromaticContact CZ-CE2 3.23Å; F306-F310 HydrophobicContact CZ-CE2 3.23Å; F306-F310 AromaticContact CZ-CZ 3.9Å; F306-F310 HydrophobicContact CZ-CZ 3.9Å; F306-F310 WeakPolarHBondContact O-CD2 3.37Å; F306-F310 PolarHBondContact O-N 3.28Å; F306-V439 HydrophobicContact CZ-CG1 3.86Å
307	T	82.3	Confident	83.9	Confident	8 Å²	8	45.8 Å²	45.8	5%	0.049	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-40.8	178.1	-58.8	0	0	0	0	111.3	L279 Y303 L304 V305 F310 V311	L279-T307 HydrophobicContact CD1-CG2 4.08Å; L279-T307 HydrophobicContact CD2-CG2 4.21Å; Y303-T307 WeakPolarHBondContact O-CB 3.42Å; Y303-T307 PolarHBondContact O-N 2.83Å; Y303-T307 PolarHBondContact O-OG1 3.23Å; L304-T307 PolarHBondContact O-N 3.21Å; V305-T307 PolarHBondContact O-N 3.41Å; T307-F310 CarbonylContact O-C 3.56Å; T307-F310 WeakPolarHBondContact O-CB 3.28Å; T307-F310 PolarHBondContact O-N 3.23Å; T307-F310 VanDerWaalsContact O-N 3.16Å; T307-V311 HydrophobicContact CG2-CG2 4.1Å; T307-V311 WeakPolarHBondContact O-CG2 3.13Å; T307-V311 PolarHBondContact O-N 3.27Å
308	M	83.4	Confident	84.4	Confident	60 Å²	60	40.2 Å²	40.2	30%	0.296	22%	0.215	S	C	.	.	H	α-helix	trans	-64	-43.4	178.3	-173.5	-178.8	71.1	0	0	112.7	L279 L283 L304 V305 F306 F310 V311 T312	L279-M308 VanDerWaalsContact CD2-CA 3.45Å; L279-M308 HydrophobicContact CD2-CB 3.79Å; L279-M308 HydrophobicContact CD2-CG 4.22Å; L283-M308 HydrophobicContact CD2-SD 4Å; L304-M308 WeakPolarHBondContact O-CB 3.27Å; L304-M308 PolarHBondContact O-N 3.01Å; V305-M308 WeakPolarHBondContact O-CB 3.41Å; V305-M308 PolarHBondContact O-N 3.16Å; F306-M308 VanDerWaalsContact C-N 3.27Å; F306-M308 PolarHBondContact O-N 3.03Å; M308-F310 VanDerWaalsContact C-N 3.26Å; M308-F310 PolarHBondContact O-N 2.81Å; M308-V311 PolarHBondContact O-N 2.86Å; M308-T312 WeakPolarHBondContact O-CG2 3.42Å; M308-T312 PolarHBondContact O-N 3.08Å; M308-T312 PolarHBondContact O-OG1 3.19Å
309	I	85.9	Confident	84.6	Confident	95 Å²	95	43.7 Å²	43.7	49%	0.487	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-40.7	173.6	-65.9	166.8	0	0	0	110	V305 F306 T312 L313	V305-I309 HydrophobicContact CG1-CD1 4.17Å; V305-I309 WeakPolarHBondContact O-CG1 3.32Å; V305-I309 PolarHBondContact O-N 2.99Å; F306-I309 PolarHBondContact O-N 2.98Å; I309-T312 WeakPolarHBondContact CA-OG1 3.26Å; I309-T312 PolarHBondContact O-OG1 2.94Å; I309-L313 WeakPolarHBondContact O-CB 3.29Å; I309-L313 PolarHBondContact O-N 3.33Å; I309-L313 VanDerWaalsContact O-N 3.08Å
310	F	83.4	Confident	84.9	Confident	50 Å²	50	47.7 Å²	47.7	22%	0.219	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-43.4	176.4	-89.5	-89.7	0	0	0	113	F306 T307 M308 T312 L313 S314 F436 V439	F306-F310 HydrophobicContact CD1-CD2 4.05Å; F306-F310 HydrophobicContact CD1-CE2 4.44Å; F306-F310 HydrophobicContact CD2-CD2 4.03Å; F306-F310 AromaticContact CD2-CE2 3.81Å; F306-F310 HydrophobicContact CD2-CE2 3.81Å; F306-F310 AromaticContact CE1-CD2 3.75Å; F306-F310 HydrophobicContact CE1-CD2 3.75Å; F306-F310 AromaticContact CE1-CE2 3.89Å; F306-F310 HydrophobicContact CE1-CE2 3.89Å; F306-F310 HydrophobicContact CE1-CG 4.48Å; F306-F310 AromaticContact CE2-CD2 3.75Å; F306-F310 HydrophobicContact CE2-CD2 3.75Å; F306-F310 AromaticContact CE2-CE2 3.18Å; F306-F310 HydrophobicContact CE2-CE2 3.18Å; F306-F310 HydrophobicContact CE2-CZ 4.08Å; F306-F310 HydrophobicContact CG-CD2 4.18Å; F306-F310 HydrophobicContact CG-CE2 4.41Å; F306-F310 AromaticContact CZ-CD2 3.6Å; F306-F310 HydrophobicContact CZ-CD2 3.6Å; F306-F310 AromaticContact CZ-CE2 3.23Å; F306-F310 HydrophobicContact CZ-CE2 3.23Å; F306-F310 AromaticContact CZ-CZ 3.9Å; F306-F310 HydrophobicContact CZ-CZ 3.9Å; F306-F310 WeakPolarHBondContact O-CD2 3.37Å; F306-F310 PolarHBondContact O-N 3.28Å; T307-F310 CarbonylContact O-C 3.56Å; T307-F310 WeakPolarHBondContact O-CB 3.28Å; T307-F310 PolarHBondContact O-N 3.23Å; T307-F310 VanDerWaalsContact O-N 3.16Å; M308-F310 VanDerWaalsContact C-N 3.26Å; M308-F310 PolarHBondContact O-N 2.81Å; F310-T312 PolarHBondContact O-N 3.36Å; F310-L313 PolarHBondContact O-N 3.01Å; F310-S314 WeakPolarHBondContact O-CB 3.34Å; F310-S314 PolarHBondContact O-N 3.38Å; F310-F436 HydrophobicContact CB-CE1 4.45Å; F310-F436 AromaticContact CD1-CD1 3.9Å; F310-F436 HydrophobicContact CD1-CD1 3.9Å; F310-F436 AromaticContact CD1-CE1 3.76Å; F310-F436 HydrophobicContact CD1-CE1 3.76Å; F310-F436 WeakPolarHBondContact O-CE1 3.38Å; F310-V439 HydrophobicContact CD1-CG1 4.33Å; F310-V439 HydrophobicContact CE1-CB 3.89Å; F310-V439 HydrophobicContact CE1-CG1 3.34Å; F310-V439 HydrophobicContact CE1-CG2 4.47Å; F310-V439 HydrophobicContact CE2-CG1 3.99Å; F310-V439 HydrophobicContact CZ-CB 4.19Å; F310-V439 HydrophobicContact CZ-CG1 3.16Å
311	V	83.1	Confident	85.1	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.024	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-44.3	177.7	177.4	0	0	0	0	110.8	T255 V275 L276 L279 T307 M308 L313 S314 I315	T255-V311 HydrophobicContact CG2-CB 4.42Å; T255-V311 HydrophobicContact CG2-CG2 3.3Å; V275-V311 HydrophobicContact CG1-CG1 4.31Å; L276-V311 HydrophobicContact CB-CG1 4.34Å; L276-V311 HydrophobicContact CD1-CG1 4.05Å; L279-V311 HydrophobicContact CD2-CB 4.16Å; L279-V311 HydrophobicContact CD2-CG2 3.72Å; T307-V311 HydrophobicContact CG2-CG2 4.1Å; T307-V311 WeakPolarHBondContact O-CG2 3.13Å; T307-V311 PolarHBondContact O-N 3.27Å; M308-V311 PolarHBondContact O-N 2.86Å; V311-L313 PolarHBondContact O-N 3.44Å; V311-S314 WeakPolarHBondContact O-CB 3.19Å; V311-S314 PolarHBondContact O-N 3.49Å; V311-I315 HydrophobicContact CG1-CD1 4.03Å; V311-I315 VanDerWaalsContact O-CG1 3.29Å; V311-I315 WeakPolarHBondContact O-CG1 3.44Å; V311-I315 PolarHBondContact O-N 3.44Å
312	T	85.4	Confident	85.4	Confident	63 Å²	63	47.9 Å²	47.9	39%	0.387	25%	0.25	S	S	.	.	H	α-helix	trans	-63.2	-44	178.9	52.2	0	0	0	0	111.6	L276 M308 I309 F310 S314 I315 V316	L276-T312 HydrophobicContact CD1-CG2 4.1Å; M308-T312 WeakPolarHBondContact O-CG2 3.42Å; M308-T312 PolarHBondContact O-N 3.08Å; M308-T312 PolarHBondContact O-OG1 3.19Å; I309-T312 WeakPolarHBondContact CA-OG1 3.26Å; I309-T312 PolarHBondContact O-OG1 2.94Å; F310-T312 PolarHBondContact O-N 3.36Å; T312-S314 VanDerWaalsContact C-N 3.34Å; T312-S314 PolarHBondContact O-N 2.9Å; T312-I315 PolarHBondContact O-N 3.48Å; T312-V316 WeakPolarHBondContact O-CG2 3.37Å; T312-V316 PolarHBondContact O-N 2.84Å
313	L	88.3	Confident	85.6	Confident	85 Å²	85	47.9 Å²	47.9	45%	0.445	25%	0.254	S	S	.	.	H	α-helix	trans	-64	-38.7	174.7	-168.2	148.7	0	0	0	111.8	I309 F310 V311 I315 V316 I317 F436	I309-L313 WeakPolarHBondContact O-CB 3.29Å; I309-L313 PolarHBondContact O-N 3.33Å; I309-L313 VanDerWaalsContact O-N 3.08Å; F310-L313 PolarHBondContact O-N 3.01Å; V311-L313 PolarHBondContact O-N 3.44Å; L313-I315 PolarHBondContact O-N 3.27Å; L313-V316 PolarHBondContact O-N 2.96Å; L313-I317 HydrophobicContact CD2-CD1 3.37Å; L313-I317 HydrophobicContact CD2-CG1 4.25Å; L313-I317 HydrophobicContact CG-CD1 4.45Å; L313-I317 WeakPolarHBondContact O-CG1 3.39Å; L313-I317 PolarHBondContact O-N 2.83Å; L313-I317 VanDerWaalsContact O-N 3.08Å; L313-F436 HydrophobicContact CD2-CE1 4.46Å; L313-F436 HydrophobicContact CD2-CE2 4Å; L313-F436 HydrophobicContact CD2-CZ 3.46Å; L313-F436 VanDerWaalsContact CD2-CZ 3.46Å
314	S	86.5	Confident	85.7	Confident	4 Å²	4	48.5 Å²	48.5	3%	0.028	26%	0.257	C	S	.	.	H	α-helix	trans	-59.6	-44.7	174.4	174	0	0	0	0	112	F259 F310 V311 T312 V316 I317 T318	F259-S314 VanDerWaalsContact CE2-OG 3.28Å; F259-S314 WeakPolarHBondContact CE2-OG 3.41Å; F259-S314 WeakPolarHBondContact CZ-OG 3.26Å; F310-S314 WeakPolarHBondContact O-CB 3.34Å; F310-S314 PolarHBondContact O-N 3.38Å; V311-S314 WeakPolarHBondContact O-CB 3.19Å; V311-S314 PolarHBondContact O-N 3.49Å; T312-S314 VanDerWaalsContact C-N 3.34Å; T312-S314 PolarHBondContact O-N 2.9Å; S314-V316 PolarHBondContact O-N 2.79Å; S314-I317 PolarHBondContact O-N 2.99Å; S314-T318 WeakPolarHBondContact O-CB 3.5Å; S314-T318 PolarHBondContact O-N 3.32Å; S314-T318 PolarHBondContact O-OG1 3.4Å
315	I	86.1	Confident	85.9	Confident	37 Å²	37	49 Å²	49	19%	0.19	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-46	178.8	-67	167.8	0	0	0	111	C272 L276 V311 T312 L313 I317 T318 V319	C272-I315 HydrophobicContact CB-CG1 4.12Å; L276-I315 HydrophobicContact CB-CD1 3.84Å; L276-I315 HydrophobicContact CD1-CD1 4.21Å; L276-I315 HydrophobicContact CD2-CD1 3.79Å; L276-I315 HydrophobicContact CG-CD1 4.16Å; V311-I315 HydrophobicContact CG1-CD1 4.03Å; V311-I315 VanDerWaalsContact O-CG1 3.29Å; V311-I315 WeakPolarHBondContact O-CG1 3.44Å; V311-I315 PolarHBondContact O-N 3.44Å; T312-I315 PolarHBondContact O-N 3.48Å; L313-I315 PolarHBondContact O-N 3.27Å; I315-I317 VanDerWaalsContact C-N 3.33Å; I315-I317 PolarHBondContact O-N 3.38Å; I315-T318 PolarHBondContact O-N 3.49Å; I315-T318 VanDerWaalsContact O-N 3.14Å; I315-V319 WeakPolarHBondContact O-CG2 3.45Å; I315-V319 PolarHBondContact O-N 3.07Å
316	V	89.4	Confident	85.8	Confident	103 Å²	103	52 Å²	52	62%	0.624	27%	0.269	S	S	*	.	H	α-helix	trans	-58.9	-45.6	178.3	174.1	0	0	0	0	111	T312 L313 S314 T318 V319 F320	T312-V316 WeakPolarHBondContact O-CG2 3.37Å; T312-V316 PolarHBondContact O-N 2.84Å; L313-V316 PolarHBondContact O-N 2.96Å; S314-V316 PolarHBondContact O-N 2.79Å; V316-T318 VanDerWaalsContact C-N 3.34Å; V316-T318 PolarHBondContact O-N 3.07Å; V316-V319 PolarHBondContact O-N 3.24Å; V316-F320 PolarHBondContact O-N 3.26Å
317	I	88.8	Confident	85.6	Confident	21 Å²	21	52.9 Å²	52.9	11%	0.108	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-39.8	176.6	-68.5	173.8	0	0	0	111.2	F259 L313 S314 I315 F320 A321 L428 F432 F436	F259-I317 HydrophobicContact CE1-CB 4.48Å; F259-I317 HydrophobicContact CE1-CG2 3.95Å; F259-I317 HydrophobicContact CZ-CG2 4.47Å; L313-I317 HydrophobicContact CD2-CD1 3.37Å; L313-I317 HydrophobicContact CD2-CG1 4.25Å; L313-I317 HydrophobicContact CG-CD1 4.45Å; L313-I317 WeakPolarHBondContact O-CG1 3.39Å; L313-I317 PolarHBondContact O-N 2.83Å; L313-I317 VanDerWaalsContact O-N 3.08Å; S314-I317 PolarHBondContact O-N 2.99Å; I315-I317 VanDerWaalsContact C-N 3.33Å; I315-I317 PolarHBondContact O-N 3.38Å; I317-F320 CarbonylContact O-C 3.58Å; I317-F320 WeakPolarHBondContact O-CB 3.48Å; I317-F320 PolarHBondContact O-N 3.02Å; I317-A321 WeakPolarHBondContact O-CB 3.32Å; I317-A321 PolarHBondContact O-N 3.11Å; I317-L428 HydrophobicContact CG2-CD2 4.32Å; I317-F432 HydrophobicContact CD1-CD1 3.67Å; I317-F432 HydrophobicContact CD1-CE1 3.53Å; I317-F432 HydrophobicContact CD1-CE2 4.4Å; I317-F432 HydrophobicContact CD1-CG 4.19Å; I317-F432 HydrophobicContact CD1-CZ 3.92Å; I317-F432 HydrophobicContact CG1-CE1 4.45Å; I317-F432 HydrophobicContact CG1-CZ 4.37Å; I317-F432 HydrophobicContact CG2-CB 4.33Å; I317-F432 HydrophobicContact CG2-CD1 4.27Å; I317-F432 HydrophobicContact CG2-CD2 3.34Å; I317-F432 HydrophobicContact CG2-CE1 4.44Å; I317-F432 HydrophobicContact CG2-CE2 3.53Å; I317-F432 HydrophobicContact CG2-CG 3.73Å; I317-F432 HydrophobicContact CG2-CZ 4.1Å; I317-F436 HydrophobicContact CD1-CE2 3.83Å; I317-F436 HydrophobicContact CD1-CZ 4.15Å
318	T	86.9	Confident	84.7	Confident	3 Å²	3	55 Å²	55	2%	0.018	29%	0.285	C	S	.	.	H	α-helix	trans	-63.9	-43.2	179.8	-49.3	0	0	0	0	111.4	V258 K268 S314 I315 V316 F320 A321 I322	V258-T318 HydrophobicContact CG1-CG2 4.07Å; K268-T318 HydrophobicContact CD-CG2 3.63Å; K268-T318 VanDerWaalsContact CE-CG2 3.42Å; K268-T318 HydrophobicContact CG-CG2 3.83Å; S314-T318 WeakPolarHBondContact O-CB 3.5Å; S314-T318 PolarHBondContact O-N 3.32Å; S314-T318 PolarHBondContact O-OG1 3.4Å; I315-T318 PolarHBondContact O-N 3.49Å; I315-T318 VanDerWaalsContact O-N 3.14Å; V316-T318 VanDerWaalsContact C-N 3.34Å; V316-T318 PolarHBondContact O-N 3.07Å; T318-F320 VanDerWaalsContact C-N 3.31Å; T318-F320 PolarHBondContact O-N 3.15Å; T318-A321 PolarHBondContact O-N 3.25Å; T318-I322 HydrophobicContact CG2-CD1 4.19Å; T318-I322 VanDerWaalsContact O-CG1 3.25Å; T318-I322 WeakPolarHBondContact O-CG1 3.33Å; T318-I322 PolarHBondContact O-N 3.18Å
319	V	87.6	Confident	83.3	Confident	86 Å²	86	53.3 Å²	53.3	52%	0.521	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-42.3	173.6	172.8	0	0	0	0	110.7	I315 V316 I322 N323	I315-V319 WeakPolarHBondContact O-CG2 3.45Å; I315-V319 PolarHBondContact O-N 3.07Å; V316-V319 PolarHBondContact O-N 3.24Å; V319-I322 PolarHBondContact O-N 3.12Å; V319-N323 WeakPolarHBondContact O-CB 3.3Å; V319-N323 PolarHBondContact O-N 3.39Å
320	F	88.6	Confident	82	Confident	115 Å²	115	53.4 Å²	53.4	50%	0.504	29%	0.289	S	S	.	.	H	α-helix	trans	-63.1	-42.8	175.1	-179.1	-105.3	0	0	0	112.7	V316 I317 T318 I322 N323 I324 L428	V316-F320 PolarHBondContact O-N 3.26Å; I317-F320 CarbonylContact O-C 3.58Å; I317-F320 WeakPolarHBondContact O-CB 3.48Å; I317-F320 PolarHBondContact O-N 3.02Å; T318-F320 VanDerWaalsContact C-N 3.31Å; T318-F320 PolarHBondContact O-N 3.15Å; F320-I322 PolarHBondContact O-N 3.27Å; F320-N323 WeakPolarHBondContact O-CB 3.38Å; F320-N323 PolarHBondContact O-N 3.25Å; F320-I324 HydrophobicContact CD1-CD1 3.86Å; F320-I324 HydrophobicContact CE1-CD1 3.35Å; F320-I324 HydrophobicContact CE1-CG1 4.42Å; F320-I324 HydrophobicContact CE2-CD1 4.35Å; F320-I324 HydrophobicContact CZ-CD1 3.64Å; F320-I324 HydrophobicContact CZ-CG1 4.43Å; F320-I324 WeakPolarHBondContact O-CG1 3.46Å; F320-I324 PolarHBondContact O-N 3.43Å; F320-L428 HydrophobicContact CD1-CD1 4.14Å; F320-L428 HydrophobicContact CE1-CD1 3.84Å
321	A	86.7	Confident	80.9	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-63	-41.3	176.6	0	0	0	0	0	111.9	I317 T318 I324 H325 L428	I317-A321 WeakPolarHBondContact O-CB 3.32Å; I317-A321 PolarHBondContact O-N 3.11Å; T318-A321 PolarHBondContact O-N 3.25Å; A321-I324 PolarHBondContact O-N 3.43Å; A321-H325 WeakPolarHBondContact O-CB 3.49Å; A321-H325 PolarHBondContact O-N 3.23Å; A321-L428 HydrophobicContact CB-CD2 3.6Å
322	I	86.1	Confident	79.7	Confident	29 Å²	29	60 Å²	60	15%	0.149	33%	0.327	C	S	.	.	H	α-helix	trans	-65.5	-40.9	175.5	-68.4	168.5	0	0	0	110.7	K268 I269 T318 V319 F320 I324 H325 H326	K268-I322 HydrophobicContact CD-CD1 4.36Å; K268-I322 HydrophobicContact CD-CG1 4.45Å; I269-I322 HydrophobicContact CD1-CD1 3.86Å; I269-I322 HydrophobicContact CG1-CD1 3.47Å; I269-I322 VanDerWaalsContact CG1-CD1 3.47Å; T318-I322 HydrophobicContact CG2-CD1 4.19Å; T318-I322 VanDerWaalsContact O-CG1 3.25Å; T318-I322 WeakPolarHBondContact O-CG1 3.33Å; T318-I322 PolarHBondContact O-N 3.18Å; V319-I322 PolarHBondContact O-N 3.12Å; F320-I322 PolarHBondContact O-N 3.27Å; I322-I324 VanDerWaalsContact C-N 3.3Å; I322-I324 PolarHBondContact O-N 3Å; I322-H325 WeakPolarHBondContact O-CB 3.28Å; I322-H325 PolarHBondContact O-N 3.42Å; I322-H325 VanDerWaalsContact O-N 3.14Å; I322-H326 PolarHBondContact O-CD2 3.33Å; I322-H326 PolarHBondContact O-N 3.48Å
323	N	87.4	Confident	78.1	Confident	110 Å²	110	66.3 Å²	66.3	59%	0.588	35%	0.352	S	S	*	.	H	α-helix	trans	-59	-42.4	175.2	-176.7	-94.4	0	0	0	111.7	V319 F320 R327	V319-N323 WeakPolarHBondContact O-CB 3.3Å; V319-N323 PolarHBondContact O-N 3.39Å; F320-N323 WeakPolarHBondContact O-CB 3.38Å; F320-N323 PolarHBondContact O-N 3.25Å; N323-R327 PolarHBondContact O-N 2.97Å
324	I	84.5	Confident	77	Confident	17 Å²	17	64.8 Å²	64.8	9%	0.087	36%	0.357	C	S	.	.	H	α-helix	trans	-65.5	-41.6	174.2	-67.8	173.3	0	0	0	111.1	F320 A321 I322 H326 R327 W421 A425 L428	F320-I324 HydrophobicContact CD1-CD1 3.86Å; F320-I324 HydrophobicContact CE1-CD1 3.35Å; F320-I324 HydrophobicContact CE1-CG1 4.42Å; F320-I324 HydrophobicContact CE2-CD1 4.35Å; F320-I324 HydrophobicContact CZ-CD1 3.64Å; F320-I324 HydrophobicContact CZ-CG1 4.43Å; F320-I324 WeakPolarHBondContact O-CG1 3.46Å; F320-I324 PolarHBondContact O-N 3.43Å; A321-I324 PolarHBondContact O-N 3.43Å; I322-I324 VanDerWaalsContact C-N 3.3Å; I322-I324 PolarHBondContact O-N 3Å; I324-H326 PolarHBondContact O-N 3.25Å; I324-R327 VanDerWaalsContact O-CB 3.27Å; I324-R327 WeakPolarHBondContact O-CB 3.22Å; I324-R327 PolarHBondContact O-N 3Å; I324-W421 HydrophobicContact CG2-CE3 3.8Å; I324-W421 HydrophobicContact CG2-CZ3 4.16Å; I324-A425 HydrophobicContact CB-CB 4.44Å; I324-A425 HydrophobicContact CG2-CB 4Å; I324-L428 HydrophobicContact CD1-CD1 3.92Å
325	H	85.1	Confident	76.4	Confident	11 Å²	11	65.8 Å²	65.8	5%	0.051	36%	0.362	C	S	.	.	H	α-helix	trans	-62.4	-41.4	-179.4	178.2	-103.5	0	0	0	113.3	S263 N264 A321 I322 R327 A425	S263-H325 PolarHBondContact OG-CD2 3.23Å; S263-H325 PolarHBondContact OG-CE1 3.45Å; S263-H325 PolarHBondContact OG-ND1 3.16Å; S263-H325 PolarHBondContact OG-NE2 3.15Å; N264-H325 PolarHBondContact OD1-CE1 3.26Å; N264-H325 VanDerWaalsContact OD1-CE1 3.24Å; N264-H325 PolarHBondContact OD1-NE2 3.02Å; N264-H325 VanDerWaalsContact OD1-NE2 3.1Å; A321-H325 WeakPolarHBondContact O-CB 3.49Å; A321-H325 PolarHBondContact O-N 3.23Å; I322-H325 WeakPolarHBondContact O-CB 3.28Å; I322-H325 PolarHBondContact O-N 3.42Å; I322-H325 VanDerWaalsContact O-N 3.14Å; H325-R327 VanDerWaalsContact C-N 3.29Å; H325-R327 PolarHBondContact O-N 3.24Å; H325-A425 HydrophobicContact CB-CB 3.87Å
326	H	82.5	Confident	76.2	Confident	128 Å²	128	65.8 Å²	65.8	59%	0.593	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	7.8	179.8	-75.1	-83.6	0	0	0	113.8	I322 I324 S328	I322-H326 PolarHBondContact O-CD2 3.33Å; I322-H326 PolarHBondContact O-N 3.48Å; I324-H326 PolarHBondContact O-N 3.25Å; H326-S328 PolarHBondContact O-N 3.38Å
327	R	80.1	Confident	75.9	Confident	80 Å²	80	65.8 Å²	65.8	30%	0.302	37%	0.369	S	S	.	.			trans	-67	103.2	176.9	-162.4	170	-172.5	168.6	5.7	110.3	N323 I324 H325 H332 W421	N323-R327 PolarHBondContact O-N 2.97Å; I324-R327 VanDerWaalsContact O-CB 3.27Å; I324-R327 WeakPolarHBondContact O-CB 3.22Å; I324-R327 PolarHBondContact O-N 3Å; H325-R327 VanDerWaalsContact C-N 3.29Å; H325-R327 PolarHBondContact O-N 3.24Å; R327-H332 PolarHBondContact NE-CD2 3.4Å; R327-H332 PolarHBondContact NH2-CD2 3.13Å; R327-H332 PolarHBondContact NH2-CE1 3.21Å; R327-H332 PolarHBondContact NH2-ND1 3.49Å; R327-H332 PolarHBondContact NH2-NE2 3.31Å; R327-H332 VanDerWaalsContact NH2-NE2 3.19Å; R327-W421 HydrophobicContact CB-CD2 4.3Å; R327-W421 HydrophobicContact CB-CG 4.4Å; R327-W421 HydrophobicContact CG-CD2 4.44Å
328	S	63	Low	75.7	Confident	52 Å²	52	72.7 Å²	72.7	36%	0.364	39%	0.394	S	S	.	.			trans	-80.7	151.7	-177.9	-172.9	0	0	0	0	112.7	H326 S330	H326-S328 PolarHBondContact O-N 3.38Å; S328-S330 PolarHBondContact O-N 3.49Å; S328-S330 PolarHBondContact OG-OG 3.08Å
329	S	54.6	Low	75.5	Confident	25 Å²	25	73.3 Å²	73.3	18%	0.175	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-15.9	177.4	65.1	0	0	0	0	114.9	V414	S329-V414 WeakPolarHBondContact OG-CG1 3.42Å
330	S	58.2	Low	75.3	Confident	98 Å²	98	75.1 Å²	75.1	69%	0.685	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-27.2	-174.8	52.8	0	0	0	0	114.2	S328	S328-S330 PolarHBondContact O-N 3.49Å; S328-S330 PolarHBondContact OG-OG 3.08Å
331	T	60.8	Low	75.1	Confident	107 Å²	107	77.7 Å²	77.7	66%	0.656	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-15.6	-176.6	44.3	0	0	0	0	114.3
332	H	56.7	Low	75.1	Confident	84 Å²	84	81.1 Å²	81.1	39%	0.389	42%	0.419	S	S	.	.			trans	-133	108.3	179.2	-72.4	-71.2	0	0	0	111.9	R327 G334	R327-H332 PolarHBondContact NE-CD2 3.4Å; R327-H332 PolarHBondContact NH2-CD2 3.13Å; R327-H332 PolarHBondContact NH2-CE1 3.21Å; R327-H332 PolarHBondContact NH2-ND1 3.49Å; R327-H332 PolarHBondContact NH2-NE2 3.31Å; R327-H332 VanDerWaalsContact NH2-NE2 3.19Å; H332-G334 PolarHBondContact O-N 3.48Å
333	H	52.8	Low	75	Confident	196 Å²	196	81.3 Å²	81.3	91%	0.907	42%	0.419	S	S	*	.			trans	-68.6	111.7	168.1	-97.2	71.8	0	0	0	109.9
334	G	64.7	Low	74.7	Confident	53 Å²	53	76.1 Å²	76.1	55%	0.546	39%	0.391	S	S	.	.	S	Bend	trans	72.6	129.2	167.9	0	0	0	0	0	115.8	H332 A336	H332-G334 PolarHBondContact O-N 3.48Å; G334-A336 PolarHBondContact O-N 3.49Å
335	M	74.3	Confident	74.5	Confident	26 Å²	26	79.1 Å²	79.1	13%	0.128	40%	0.404	C	S	.	.			trans	-64.8	129.4	167.2	-168.2	172.5	-177.9	0	0	109.1	V339 R340 F343 L344 W421 A424	M335-V339 HydrophobicContact CE-CB 3.91Å; M335-V339 HydrophobicContact CE-CG1 3.29Å; M335-V339 HydrophobicContact CG-CB 4.06Å; M335-V339 HydrophobicContact CG-CG1 4.25Å; M335-R340 HydrophobicContact SD-CB 4.46Å; M335-F343 HydrophobicContact CE-CB 4.23Å; M335-L344 HydrophobicContact CE-CD1 3.53Å; M335-L344 HydrophobicContact SD-CD1 3.57Å; M335-L344 VanDerWaalsContact SD-CD1 3.57Å; M335-W421 HydrophobicContact CB-CZ2 4.02Å; M335-W421 HydrophobicContact CE-CZ3 4.45Å; M335-W421 HydrophobicContact CG-CH2 4.01Å; M335-W421 HydrophobicContact CG-CZ2 3.82Å; M335-A424 HydrophobicContact CE-CB 3.76Å
336	A	82.2	Confident	74.4	Confident	37 Å²	37	87.7 Å²	87.7	31%	0.306	44%	0.436	S	S	.	.			trans	-56.6	140	-177.7	0	0	0	0	0	110.7	G334 W338 V339 R340	G334-A336 PolarHBondContact O-N 3.49Å; A336-W338 PolarHBondContact O-N 3.02Å; A336-V339 HydrophobicContact CB-CG2 3.94Å; A336-V339 PolarHBondContact O-N 2.97Å; A336-R340 PolarHBondContact O-N 3.42Å; A336-R340 VanDerWaalsContact O-N 3.11Å
337	P	81.6	Confident	74.5	Confident	102 Å²	102	83 Å²	83	66%	0.662	42%	0.415	S	S	*	.	H	α-helix	trans	-57.4	-31.9	-169.5	-27.7	34.5	0	0	0	114.2	R341	P337-R341 PolarHBondContact O-N 3.41Å; P337-R341 VanDerWaalsContact O-N 3.14Å
338	W	85.1	Confident	74.7	Confident	166 Å²	166	79.3 Å²	79.3	63%	0.629	40%	0.402	S	S	*	.	H	α-helix	trans	-70.2	-42	176.8	69.4	-96.5	0	0	0	112.2	A336 R340 R341 I342	A336-W338 PolarHBondContact O-N 3.02Å; W338-R340 VanDerWaalsContact C-N 3.32Å; W338-R340 PolarHBondContact O-N 3.33Å; W338-R341 PolarHBondContact O-N 2.96Å; W338-I342 HydrophobicContact CE3-CD1 3.91Å; W338-I342 HydrophobicContact CZ3-CD1 4.31Å; W338-I342 WeakPolarHBondContact O-CG1 3.49Å; W338-I342 PolarHBondContact O-N 3.29Å
339	V	83.6	Confident	75.6	Confident	17 Å²	17	84.6 Å²	84.6	10%	0.103	42%	0.418	C	S	.	.	H	α-helix	trans	-63.7	-43.1	178.6	-166.3	0	0	0	0	109.3	M335 A336 R341 I342 F343	M335-V339 HydrophobicContact CE-CB 3.91Å; M335-V339 HydrophobicContact CE-CG1 3.29Å; M335-V339 HydrophobicContact CG-CB 4.06Å; M335-V339 HydrophobicContact CG-CG1 4.25Å; A336-V339 HydrophobicContact CB-CG2 3.94Å; A336-V339 PolarHBondContact O-N 2.97Å; V339-R341 PolarHBondContact O-N 3.46Å; V339-I342 PolarHBondContact O-N 2.63Å; V339-F343 HydrophobicContact CG1-CD2 3.54Å; V339-F343 HydrophobicContact CG1-CE2 4.01Å; V339-F343 HydrophobicContact CG1-CG 4.47Å; V339-F343 WeakPolarHBondContact O-CB 3.38Å; V339-F343 PolarHBondContact O-N 3.27Å
340	R	82.9	Confident	77.1	Confident	124 Å²	124	89.7 Å²	89.7	47%	0.468	44%	0.443	S	S	.	.	H	α-helix	trans	-59.4	-45.1	175.9	-172.8	177.9	-171.9	178.7	5.8	111.7	M335 A336 W338 I342 L344	M335-R340 HydrophobicContact SD-CB 4.46Å; A336-R340 PolarHBondContact O-N 3.42Å; A336-R340 VanDerWaalsContact O-N 3.11Å; W338-R340 VanDerWaalsContact C-N 3.32Å; W338-R340 PolarHBondContact O-N 3.33Å; R340-I342 PolarHBondContact O-N 3.22Å; R340-L344 HydrophobicContact CB-CD1 4.44Å; R340-L344 HydrophobicContact CG-CD1 4.12Å; R340-L344 VanDerWaalsContact O-CB 3.31Å; R340-L344 WeakPolarHBondContact O-CB 3.33Å; R340-L344 PolarHBondContact O-N 2.83Å
341	R	83.6	Confident	78.3	Confident	169 Å²	169	86.7 Å²	86.7	64%	0.638	42%	0.419	S	S	*	.	I	π-helix	trans	-64.8	-39.3	179.7	-166.3	179.2	-66.3	161.3	-0.6	112.4	P337 W338 V339 H345 R346	P337-R341 PolarHBondContact O-N 3.41Å; P337-R341 VanDerWaalsContact O-N 3.14Å; W338-R341 PolarHBondContact O-N 2.96Å; V339-R341 PolarHBondContact O-N 3.46Å; R341-H345 WeakPolarHBondContact O-CB 3.43Å; R341-R346 PolarHBondContact O-N 2.83Å; R341-R346 VanDerWaalsContact O-N 3.13Å
342	I	86.4	Confident	79.2	Confident	72 Å²	72	93.1 Å²	93.1	37%	0.369	43%	0.431	S	S	.	.	I	π-helix	trans	-74.4	-58.7	-179.7	-66.1	177.7	0	0	0	110.8	W338 V339 R340 R346 L347	W338-I342 HydrophobicContact CE3-CD1 3.91Å; W338-I342 HydrophobicContact CZ3-CD1 4.31Å; W338-I342 WeakPolarHBondContact O-CG1 3.49Å; W338-I342 PolarHBondContact O-N 3.29Å; V339-I342 PolarHBondContact O-N 2.63Å; R340-I342 PolarHBondContact O-N 3.22Å; I342-R346 PolarHBondContact O-N 3.39Å; I342-L347 HydrophobicContact CG2-CD1 3.66Å; I342-L347 HydrophobicContact CG2-CG 3.96Å; I342-L347 PolarHBondContact O-N 3.01Å
343	F	84.3	Confident	80.3	Confident	33 Å²	33	91.2 Å²	91.2	15%	0.145	42%	0.423	C	S	.	.	I	π-helix	trans	-80	-28.3	-170.2	-75	-86.4	0	0	0	114.6	M335 V339 L347 P348 A424 V427 L428	M335-F343 HydrophobicContact CE-CB 4.23Å; V339-F343 HydrophobicContact CG1-CD2 3.54Å; V339-F343 HydrophobicContact CG1-CE2 4.01Å; V339-F343 HydrophobicContact CG1-CG 4.47Å; V339-F343 WeakPolarHBondContact O-CB 3.38Å; V339-F343 PolarHBondContact O-N 3.27Å; F343-L347 HydrophobicContact CD1-CD1 3.85Å; F343-L347 HydrophobicContact CE1-CD1 3.9Å; F343-L347 HydrophobicContact CG-CD1 4.3Å; F343-L347 HydrophobicContact CZ-CD1 4.42Å; F343-P348 VanDerWaalsContact O-CD 3.22Å; F343-P348 WeakPolarHBondContact O-CD 3.32Å; F343-P348 WeakPolarHBondContact O-CG 3.22Å; F343-A424 HydrophobicContact CB-CB 3.98Å; F343-A424 HydrophobicContact CD1-CB 4.46Å; F343-A424 HydrophobicContact CG-CB 4.33Å; F343-V427 HydrophobicContact CD1-CG1 4.24Å; F343-L428 HydrophobicContact CE1-CB 3.96Å; F343-L428 HydrophobicContact CE1-CD1 3.91Å; F343-L428 HydrophobicContact CE1-CG 4.38Å; F343-L428 HydrophobicContact CZ-CD1 4.07Å
344	L	81.9	Confident	81	Confident	1 Å²	1	92.9 Å²	92.9	1%	0.005	42%	0.422	C	S	.	.	I	π-helix	trans	-98.2	-20.1	180	-72.7	92.7	0	0	0	114.3	M335 R340 S355 V357 D420 F423	M335-L344 HydrophobicContact CE-CD1 3.53Å; M335-L344 HydrophobicContact SD-CD1 3.57Å; M335-L344 VanDerWaalsContact SD-CD1 3.57Å; R340-L344 HydrophobicContact CB-CD1 4.44Å; R340-L344 HydrophobicContact CG-CD1 4.12Å; R340-L344 VanDerWaalsContact O-CB 3.31Å; R340-L344 WeakPolarHBondContact O-CB 3.33Å; R340-L344 PolarHBondContact O-N 2.83Å; L344-S355 PolarHBondContact O-OG 3.2Å; L344-V357 HydrophobicContact CD2-CG2 3.9Å; L344-D420 HydrophobicContact CD2-CB 4.11Å; L344-F423 HydrophobicContact CG-CD1 4.22Å
345	H	80.4	Confident	80.8	Confident	80 Å²	80	91 Å²	91	37%	0.37	40%	0.4	S	S	.	.	I	π-helix	trans	-122.1	-43.6	-174.6	-64.6	-75.5	0	0	0	115.1	R341 K349	R341-H345 WeakPolarHBondContact O-CB 3.43Å; H345-K349 VanDerWaalsContact O-CD 3.3Å; H345-K349 WeakPolarHBondContact O-CD 3.38Å; H345-K349 VanDerWaalsContact O-CG 3.28Å; H345-K349 WeakPolarHBondContact O-CG 3.13Å
346	R	83.3	Confident	80.1	Confident	192 Å²	192	93.6 Å²	93.6	73%	0.725	41%	0.412	S	S	*	.	I	π-helix	trans	-85.7	-55.5	-175.9	-72.7	-77.2	-172	165.9	1.2	112.6	R341 I342 K349 L350	R341-R346 PolarHBondContact O-N 2.83Å; R341-R346 VanDerWaalsContact O-N 3.13Å; I342-R346 PolarHBondContact O-N 3.39Å; R346-K349 PolarHBondContact O-N 3.43Å; R346-L350 PolarHBondContact O-N 3.44Å
347	L	84.7	Confident	78.8	Confident	29 Å²	29	93.7 Å²	93.7	15%	0.152	41%	0.408	C	S	.	.	H	α-helix	trans	-64.5	-41.3	-176.6	-72.5	174.2	0	0	0	114	I342 F343 K349 L350 L351 V427 M431	I342-L347 HydrophobicContact CG2-CD1 3.66Å; I342-L347 HydrophobicContact CG2-CG 3.96Å; I342-L347 PolarHBondContact O-N 3.01Å; F343-L347 HydrophobicContact CD1-CD1 3.85Å; F343-L347 HydrophobicContact CE1-CD1 3.9Å; F343-L347 HydrophobicContact CG-CD1 4.3Å; F343-L347 HydrophobicContact CZ-CD1 4.42Å; L347-K349 VanDerWaalsContact C-N 3.29Å; L347-K349 PolarHBondContact O-N 2.88Å; L347-L350 PolarHBondContact O-N 3.44Å; L347-L351 WeakPolarHBondContact O-CB 3.28Å; L347-L351 WeakPolarHBondContact O-CG 3.42Å; L347-L351 PolarHBondContact O-N 3Å; L347-V427 HydrophobicContact CB-CG1 3.63Å; L347-V427 HydrophobicContact CD1-CG1 4.24Å; L347-M431 HydrophobicContact CD1-SD 4.37Å; L347-M431 HydrophobicContact CD2-SD 4.35Å
348	P	84.3	Confident	77.4	Confident	2 Å²	2	93.6 Å²	93.6	1%	0.013	40%	0.402	C	S	.	.	H	α-helix	trans	-62.9	-35.9	177.5	-24.1	35.1	0	0	0	112.8	F343 L351 W352 M353 F423 V427	F343-P348 VanDerWaalsContact O-CD 3.22Å; F343-P348 WeakPolarHBondContact O-CD 3.32Å; F343-P348 WeakPolarHBondContact O-CG 3.22Å; P348-L351 CarbonylContact O-C 3.6Å; P348-L351 PolarHBondContact O-N 3.42Å; P348-W352 PolarHBondContact O-N 2.78Å; P348-W352 VanDerWaalsContact O-N 3.09Å; P348-M353 HydrophobicContact CB-CB 4.13Å; P348-M353 PolarHBondContact O-N 2.69Å; P348-F423 HydrophobicContact CB-CE1 4.42Å; P348-F423 HydrophobicContact CB-CZ 4.22Å; P348-F423 HydrophobicContact CG-CE1 3.78Å; P348-F423 HydrophobicContact CG-CZ 4.06Å; P348-V427 HydrophobicContact CG-CG1 4.34Å; P348-V427 HydrophobicContact CG-CG2 3.91Å
349	K	82.4	Confident	75.7	Confident	163 Å²	163	94.1 Å²	94.1	71%	0.709	40%	0.404	S	S	*	.	H	α-helix	trans	-67.3	-38.5	175.6	-69.7	-176.4	-176.9	-171.5	0	112	H345 R346 L347	H345-K349 VanDerWaalsContact O-CD 3.3Å; H345-K349 WeakPolarHBondContact O-CD 3.38Å; H345-K349 VanDerWaalsContact O-CG 3.28Å; H345-K349 WeakPolarHBondContact O-CG 3.13Å; R346-K349 PolarHBondContact O-N 3.43Å; L347-K349 VanDerWaalsContact C-N 3.29Å; L347-K349 PolarHBondContact O-N 2.88Å
350	L	85.6	Confident	74	Confident	133 Å²	133	98.2 Å²	98.2	70%	0.696	42%	0.418	S	S	*	.	H	α-helix	trans	-67.4	-39.9	175.7	-176.6	66.8	0	0	0	112	R346 L347 W352	R346-L350 PolarHBondContact O-N 3.44Å; L347-L350 PolarHBondContact O-N 3.44Å; L350-W352 VanDerWaalsContact C-N 3.31Å; L350-W352 PolarHBondContact O-N 3.2Å
351	L	82.4	Confident	72.2	Confident	35 Å²	35	95.7 Å²	95.7	18%	0.183	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	10.9	-177.7	-63.8	166.1	0	0	0	113.4	L347 P348 M353 V427 M431	L347-L351 WeakPolarHBondContact O-CB 3.28Å; L347-L351 WeakPolarHBondContact O-CG 3.42Å; L347-L351 PolarHBondContact O-N 3Å; P348-L351 CarbonylContact O-C 3.6Å; P348-L351 PolarHBondContact O-N 3.42Å; L351-M353 HydrophobicContact CB-CE 3.53Å; L351-M353 HydrophobicContact CD1-CE 3.45Å; L351-M353 VanDerWaalsContact CD1-CE 3.45Å; L351-M353 HydrophobicContact CG-CE 4.13Å; L351-M353 PolarHBondContact O-N 2.92Å; L351-M353 VanDerWaalsContact O-N 3.13Å; L351-V427 HydrophobicContact CD1-CG1 4.22Å; L351-M431 HydrophobicContact CD1-CB 3.95Å
352	W	81.3	Confident	70.3	Confident	241 Å²	241	91.2 Å²	91.2	91%	0.913	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	35	-174.8	-65.8	-35.5	0	0	0	115.3	P348 L350	P348-W352 PolarHBondContact O-N 2.78Å; P348-W352 VanDerWaalsContact O-N 3.09Å; L350-W352 VanDerWaalsContact C-N 3.31Å; L350-W352 PolarHBondContact O-N 3.2Å
353	M	78.6	Confident	68.3	Low	45 Å²	45	91.4 Å²	91.4	22%	0.222	44%	0.436	C	S	.	.			trans	-87	131.5	170.8	-79.5	-178.7	-81.1	0	0	111	P348 L351 S355 V427 R430	P348-M353 HydrophobicContact CB-CB 4.13Å; P348-M353 PolarHBondContact O-N 2.69Å; L351-M353 HydrophobicContact CB-CE 3.53Å; L351-M353 HydrophobicContact CD1-CE 3.45Å; L351-M353 VanDerWaalsContact CD1-CE 3.45Å; L351-M353 HydrophobicContact CG-CE 4.13Å; L351-M353 PolarHBondContact O-N 2.92Å; L351-M353 VanDerWaalsContact O-N 3.13Å; M353-S355 PolarHBondContact O-N 3.11Å; M353-V427 HydrophobicContact CE-CB 4.12Å; M353-V427 HydrophobicContact CE-CG1 4.04Å; M353-V427 HydrophobicContact CE-CG2 3.86Å; M353-V427 HydrophobicContact SD-CG2 4.16Å; M353-R430 HydrophobicContact CE-CB 3.75Å; M353-R430 HydrophobicContact CE-CG 4.15Å; M353-R430 HydrophobicContact SD-CB 4.11Å; M353-R430 HydrophobicContact SD-CG 3.81Å
354	R	68	Low	66.2	Low	231 Å²	231	100.1 Å²	100.1	87%	0.872	47%	0.468	S	S	*	.			trans	-74.9	111.2	174	-158.1	170.6	-174.7	175	1.6	109.2
355	S	59.9	Low	63.9	Low	14 Å²	14	105.7 Å²	105.7	10%	0.098	50%	0.501	C	S	.	.			trans	-70.7	133.6	-178.5	-171.9	0	0	0	0	110.8	L344 M353 V357 D358	L344-S355 PolarHBondContact O-OG 3.2Å; M353-S355 PolarHBondContact O-N 3.11Å; S355-V357 PolarHBondContact O-N 3.05Å; S355-V357 WeakPolarHBondContact OG-CG2 3.22Å; S355-V357 PolarHBondContact OG-N 3.48Å; S355-D358 PolarHBondContact O-N 3.15Å
356	H	59.6	Low	62	Low	80 Å²	80	106.9 Å²	106.9	37%	0.37	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.4	172.6	-97.7	-83.4	0	0	0	113	D358 R359	H356-D358 PolarHBondContact O-N 3.49Å; H356-R359 PolarHBondContact CE1-NH2 3.33Å; H356-R359 PolarHBondContact NE2-NH2 3.02Å; H356-R359 PolarHBondContact O-N 2.97Å
357	V	55.6	Low	59.6	Low	38 Å²	38	105.6 Å²	105.6	23%	0.23	52%	0.519	C	S	.	.	H	α-helix	trans	-63.6	-30.3	176.9	-179.1	0	0	0	0	111.5	L344 S355 R359 Y360 A361	L344-V357 HydrophobicContact CD2-CG2 3.9Å; S355-V357 PolarHBondContact O-N 3.05Å; S355-V357 WeakPolarHBondContact OG-CG2 3.22Å; S355-V357 PolarHBondContact OG-N 3.48Å; V357-R359 VanDerWaalsContact C-N 3.26Å; V357-R359 PolarHBondContact O-N 3.06Å; V357-Y360 PolarHBondContact O-N 3.47Å; V357-A361 PolarHBondContact O-N 3.39Å
358	D	52.5	Low	57.3	Low	101 Å²	101	108.8 Å²	108.8	54%	0.54	54%	0.543	S	S	.	.	H	α-helix	trans	-69.5	-25.2	179.4	-61	-29.3	0	0	0	112.2	S355 H356 A362	S355-D358 PolarHBondContact O-N 3.15Å; H356-D358 PolarHBondContact O-N 3.49Å; D358-A362 PolarHBondContact O-N 3.34Å
359	R	49	Very low	55	Low	177 Å²	177	116.8 Å²	116.8	67%	0.668	58%	0.581	S	S	*	*	H	α-helix	trans	-72.7	-28.8	177.5	-106.7	-175.2	-87.3	-173.5	-7	113.1	H356 V357	H356-R359 PolarHBondContact CE1-NH2 3.33Å; H356-R359 PolarHBondContact NE2-NH2 3.02Å; H356-R359 PolarHBondContact O-N 2.97Å; V357-R359 VanDerWaalsContact C-N 3.26Å; V357-R359 PolarHBondContact O-N 3.06Å
360	Y	47.3	Very low	52.5	Low	102 Å²	102	119.1 Å²	119.1	40%	0.4	59%	0.585	S	S	.	*	H	α-helix	trans	-86.8	-31	177.4	-81.1	-85.1	0	0	0	112.9	V357 A362 A363 R364 R419	V357-Y360 PolarHBondContact O-N 3.47Å; Y360-A362 VanDerWaalsContact C-N 3.31Å; Y360-A363 PolarHBondContact O-N 3.32Å; Y360-R364 PolarHBondContact O-N 3.23Å; Y360-R419 PolarHBondContact OH-NH1 3.05Å; Y360-R419 PolarHBondContact OH-NH2 3.42Å
361	A	45.6	Very low	49.9	Very low	71 Å²	71	119.9 Å²	119.9	59%	0.587	59%	0.59	S	S	*	*	H	α-helix	trans	-64	-38.1	172.8	0	0	0	0	0	111.6	V357 A363 R364	V357-A361 PolarHBondContact O-N 3.39Å; A361-A363 VanDerWaalsContact C-N 3.28Å; A361-A363 PolarHBondContact O-N 3.41Å; A361-R364 PolarHBondContact O-N 3.27Å
362	A	44.1	Very low	47.7	Very low	75 Å²	75	124.9 Å²	124.9	62%	0.62	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-23.2	174.3	0	0	0	0	0	113.8	D358 Y360	D358-A362 PolarHBondContact O-N 3.34Å; Y360-A362 VanDerWaalsContact C-N 3.31Å
363	A	44.4	Very low	45.4	Very low	77 Å²	77	116.9 Å²	116.9	64%	0.636	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-10.7	178.2	0	0	0	0	0	113.8	Y360 A361	Y360-A363 PolarHBondContact O-N 3.32Å; A361-A363 VanDerWaalsContact C-N 3.28Å; A361-A363 PolarHBondContact O-N 3.41Å
364	R	39.3	Very low	43.3	Very low	215 Å²	215	122.4 Å²	122.4	81%	0.811	64%	0.644	S	S	*	*			trans	-96.6	42.1	175.3	-70.4	-167.7	-161.2	167.9	4.3	112.9	Y360 A361	Y360-R364 PolarHBondContact O-N 3.23Å; A361-R364 PolarHBondContact O-N 3.27Å
365	V	34.1	Very low	41.6	Very low	118 Å²	118	115.1 Å²	115.1	72%	0.715	64%	0.64	S	S	*	*			trans	-67.7	128	160	-179.5	0	0	0	0	106.8	E367	V365-E367 PolarHBondContact O-N 3.37Å
366	P	39.5	Very low	40.3	Very low	106 Å²	106	123.5 Å²	123.5	69%	0.688	68%	0.675	S	S	*	*			trans	-67.1	122.3	177.1	3.7	7.9	0	0	0	108.5	S368	P366-S368 PolarHBondContact O-N 3.28Å
367	E	34.5	Very low	38.9	Very low	165 Å²	165	127.8 Å²	127.8	77%	0.771	70%	0.697	S	S	*	*			trans	-73.2	73.5	165.4	-150.8	176.1	-166.8	0	0	107.5	V365	V365-E367 PolarHBondContact O-N 3.37Å
368	S	35.5	Very low	37.7	Very low	95 Å²	95	131.5 Å²	131.5	66%	0.664	72%	0.72	S	S	*	*			trans	-85.7	126.2	162.4	72.1	0	0	0	0	108.4	P366	P366-S368 PolarHBondContact O-N 3.28Å
369	E	36.1	Very low	36.8	Very low	171 Å²	171	134.2 Å²	134.2	80%	0.799	74%	0.735	S	S	*	*			trans	76.2	75.4	169.5	-56	-173.9	162.6	0	0	116.9
370	R	30	Very low	36.4	Very low	211 Å²	211	131.9 Å²	131.9	80%	0.796	74%	0.743	S	S	*	*			trans	-103.9	100.6	140.9	-105.9	179.2	-175.4	169.3	1.3	109	V372	R370-V372 PolarHBondContact O-N 3.17Å
371	N	30.8	Very low	35.7	Very low	149 Å²	149	132.2 Å²	132.2	80%	0.797	76%	0.76	S	S	*	*			trans	-52.2	117.1	171.4	-75.5	-33.6	0	0	0	110.6	G373	N371-G373 PolarHBondContact O-N 3.31Å
372	V	35.8	Very low	36.4	Very low	140 Å²	140	134.2 Å²	134.2	85%	0.848	77%	0.767	S	S	*	*			trans	-73.2	102.8	167.1	175.6	0	0	0	0	107.4	R370 L374	R370-V372 PolarHBondContact O-N 3.17Å; V372-L374 PolarHBondContact O-N 3.32Å
373	G	33.9	Very low	35.9	Very low	74 Å²	74	140.3 Å²	140.3	76%	0.763	78%	0.782	S	S	*	*			trans	-70.6	108.6	167.8	0	0	0	0	0	110.3	N371 G375	N371-G373 PolarHBondContact O-N 3.31Å; G373-G375 PolarHBondContact O-N 3.34Å
374	L	34.1	Very low	35.9	Very low	161 Å²	161	144.1 Å²	144.1	84%	0.843	79%	0.791	S	S	*	*			trans	-63.4	107.2	173.7	-176.8	72.4	0	0	0	111.1	V372	V372-L374 PolarHBondContact O-N 3.32Å
375	G	32.5	Very low	36.3	Very low	78 Å²	78	138.6 Å²	138.6	80%	0.804	78%	0.782	S	S	*	*			trans	-94.5	112.5	165.5	0	0	0	0	0	110.6	G373	G373-G375 PolarHBondContact O-N 3.34Å
376	K	32.9	Very low	37	Very low	189 Å²	189	138 Å²	138	82%	0.822	78%	0.78	S	S	*	*			trans	-91.8	129	179.6	-138	-176.8	-171.1	179.8	0	109.6
377	M	29.6	Very low	37.7	Very low	170 Å²	170	138.5 Å²	138.5	84%	0.837	78%	0.776	S	S	*	*			trans	-173.3	102.5	142.5	-132.5	100.8	179	0	0	108.9
378	T	30.6	Very low	38.6	Very low	117 Å²	117	137.9 Å²	137.9	72%	0.718	78%	0.778	S	S	*	*				80.9	113.6	105.7	51.2	0	0	0	0	116.1
379	N	32.8	Very low	39.4	Very low	158 Å²	158	141.7 Å²	141.7	85%	0.845	78%	0.779	S	S	*	*			trans	-71.8	160.8	158.7	-69.9	-17.5	0	0	0	110.7
380	P	41.3	Very low	40.4	Very low	128 Å²	128	137.8 Å²	137.8	83%	0.831	77%	0.766	S	S	*	*				-132.6	158.8	97.5	30.3	-14.7	0	0	0	115.1
381	S	33.2	Very low	42	Very low	108 Å²	108	133.3 Å²	133.3	76%	0.755	76%	0.755	S	S	*	*			trans	-73.7	-171	-178.1	53.1	0	0	0	0	115.2
382	P	59.3	Low	43.7	Very low	113 Å²	113	132.6 Å²	132.6	73%	0.734	75%	0.746	S	S	*	*				-131	150.2	-52.6	34.2	-18.2	0	0	0	111.9
383	E	33.1	Very low	45.3	Very low	204 Å²	204	129.4 Å²	129.4	95%	0.953	72%	0.724	S	S	*	*			trans	-142.6	147.2	158.8	-98	-176.3	179.8	0	0	112.3
384	L	45.4	Very low	47.4	Very low	157 Å²	157	131.2 Å²	131.2	82%	0.822	72%	0.716	S	S	*	*			trans	-97.2	115.6	-148.9	-173.2	77.4	0	0	0	112.2
385	T	48	Very low	49.6	Very low	99 Å²	99	128.8 Å²	128.8	61%	0.607	70%	0.701	S	S	*	*			trans	63.2	139.4	160	44.6	0	0	0	0	119.2
386	P	48.4	Very low	51.8	Low	106 Å²	106	127 Å²	127	69%	0.688	68%	0.678	S	S	*	*			cis	-118.1	91.8	49.3	35.3	-22.1	0	0	0	112.8	L388 T390	P386-L388 VanDerWaalsContact C-N 3.33Å; P386-L388 PolarHBondContact O-N 3.42Å; P386-T390 PolarHBondContact O-OG1 3.23Å
387	L	53.4	Low	54.2	Low	115 Å²	115	120.2 Å²	120.2	60%	0.602	66%	0.657	S	S	*	*	H	α-helix	trans	-81.1	1.1	-173.2	-80	167.9	0	0	0	115.5	Q391	L387-Q391 VanDerWaalsContact O-CB 3.31Å; L387-Q391 WeakPolarHBondContact O-CB 3.32Å
388	L	53.1	Low	56.9	Low	153 Å²	153	117.1 Å²	117.1	80%	0.801	64%	0.643	S	S	*	*	H	α-helix	trans	-93.7	-29.3	178.7	-88	160.1	0	0	0	113.6	P386 H392	P386-L388 VanDerWaalsContact C-N 3.33Å; P386-L388 PolarHBondContact O-N 3.42Å; L388-H392 WeakPolarHBondContact O-CB 3.38Å; L388-H392 PolarHBondContact O-N 3.45Å
389	Y	53	Low	59.6	Low	174 Å²	174	117.6 Å²	117.6	68%	0.682	64%	0.638	S	S	*	*	H	α-helix	trans	-78.9	-40.7	-178.8	-172.5	-104.6	0	0	0	112.3	N393	Y389-N393 WeakPolarHBondContact CE1-ND2 3.25Å; Y389-N393 WeakPolarHBondContact O-CB 3.37Å; Y389-N393 VanDerWaalsContact O-CG 3.28Å; Y389-N393 PolarHBondContact O-N 3.09Å; Y389-N393 VanDerWaalsContact O-N 3.14Å; Y389-N393 PolarHBondContact O-ND2 3.49Å
390	T	57.1	Low	62.1	Low	89 Å²	89	113.2 Å²	113.2	55%	0.546	62%	0.619	S	S	.	*	H	α-helix	trans	-70.5	-34.2	175.5	20.8	0	0	0	0	112.8	P386 L394	P386-T390 PolarHBondContact O-OG1 3.23Å; T390-L394 WeakPolarHBondContact O-CB 3.45Å; T390-L394 PolarHBondContact O-N 3.23Å
391	Q	63.3	Low	64.4	Low	117 Å²	117	111.8 Å²	111.8	55%	0.547	60%	0.604	S	S	.	*	H	α-helix	trans	-69.6	-41	176.5	-171.5	168.5	-29	0	0	111.8	L387 L394 Q395	L387-Q391 VanDerWaalsContact O-CB 3.31Å; L387-Q391 WeakPolarHBondContact O-CB 3.32Å; Q391-L394 PolarHBondContact O-N 3.14Å; Q391-Q395 VanDerWaalsContact O-CB 3.25Å; Q391-Q395 WeakPolarHBondContact O-CB 3.38Å; Q391-Q395 PolarHBondContact O-N 3.46Å
392	H	66.1	Low	67	Low	134 Å²	134	115.1 Å²	115.1	62%	0.62	60%	0.599	S	S	*	*	H	α-helix	trans	-65.4	-42.9	175.6	-172.7	-86.5	0	0	0	112.3	L388 Q395 A396	L388-H392 WeakPolarHBondContact O-CB 3.38Å; L388-H392 PolarHBondContact O-N 3.45Å; H392-Q395 PolarHBondContact O-N 3.11Å; H392-A396 WeakPolarHBondContact O-CB 3.47Å; H392-A396 PolarHBondContact O-N 3.06Å
393	N	69.5	Low	68.5	Low	73 Å²	73	117.3 Å²	117.3	39%	0.39	59%	0.594	S	S	.	*	H	α-helix	trans	-68.4	-36.8	177.4	-69.6	-16.7	0	0	0	112.7	Y389 A397	Y389-N393 WeakPolarHBondContact CE1-ND2 3.25Å; Y389-N393 WeakPolarHBondContact O-CB 3.37Å; Y389-N393 VanDerWaalsContact O-CG 3.28Å; Y389-N393 PolarHBondContact O-N 3.09Å; Y389-N393 VanDerWaalsContact O-N 3.14Å; Y389-N393 PolarHBondContact O-ND2 3.49Å; N393-A397 WeakPolarHBondContact O-CB 3.46Å; N393-A397 PolarHBondContact O-N 2.87Å
394	L	78.4	Confident	71.2	Confident	112 Å²	112	112.4 Å²	112.4	59%	0.586	57%	0.574	S	S	*	*	H	α-helix	trans	-66.4	-40.2	174.2	-177.1	66	0	0	0	111.5	T390 Q391 A397 L398	T390-L394 WeakPolarHBondContact O-CB 3.45Å; T390-L394 PolarHBondContact O-N 3.23Å; Q391-L394 PolarHBondContact O-N 3.14Å; L394-A397 PolarHBondContact O-N 2.96Å; L394-L398 HydrophobicContact CG-CD1 4.38Å; L394-L398 WeakPolarHBondContact O-CB 3.4Å; L394-L398 WeakPolarHBondContact O-CG 3.38Å; L394-L398 PolarHBondContact O-N 2.79Å
395	Q	79.8	Confident	73.3	Confident	111 Å²	111	108.7 Å²	108.7	52%	0.519	56%	0.557	S	S	.	*	H	α-helix	trans	-69.1	-41.3	178.8	-165.3	157.5	-16.4	0	0	111.7	Q391 H392 A397 L398 E399	Q391-Q395 VanDerWaalsContact O-CB 3.25Å; Q391-Q395 WeakPolarHBondContact O-CB 3.38Å; Q391-Q395 PolarHBondContact O-N 3.46Å; H392-Q395 PolarHBondContact O-N 3.11Å; Q395-A397 PolarHBondContact O-N 3.27Å; Q395-L398 PolarHBondContact O-N 3.05Å; Q395-E399 WeakPolarHBondContact O-CG 3.46Å; Q395-E399 PolarHBondContact O-N 3.48Å
396	A	79.2	Confident	75	Confident	40 Å²	40	109.7 Å²	109.7	33%	0.331	56%	0.556	S	S	.	*	H	α-helix	trans	-63.5	-38	172	0	0	0	0	0	112.9	H392 E399 S400	H392-A396 WeakPolarHBondContact O-CB 3.47Å; H392-A396 PolarHBondContact O-N 3.06Å; A396-E399 PolarHBondContact O-N 3.2Å; A396-S400 WeakPolarHBondContact O-CB 3.31Å; A396-S400 PolarHBondContact O-N 3.47Å; A396-S400 PolarHBondContact O-OG 2.92Å
397	A	83.8	Confident	76.9	Confident	46 Å²	46	109 Å²	109	38%	0.38	54%	0.544	S	S	.	.	H	α-helix	trans	-67	-41.1	174.9	0	0	0	0	0	112.1	N393 L394 Q395 S400 I401	N393-A397 WeakPolarHBondContact O-CB 3.46Å; N393-A397 PolarHBondContact O-N 2.87Å; L394-A397 PolarHBondContact O-N 2.96Å; Q395-A397 PolarHBondContact O-N 3.27Å; A397-S400 WeakPolarHBondContact O-CB 3.08Å; A397-S400 PolarHBondContact O-N 3.45Å; A397-I401 VanDerWaalsContact O-CG1 3.31Å; A397-I401 WeakPolarHBondContact O-CG1 3.41Å; A397-I401 PolarHBondContact O-N 3.49Å
398	L	86.8	Confident	78.6	Confident	105 Å²	105	106.6 Å²	106.6	55%	0.55	53%	0.534	S	S	.	.	H	α-helix	trans	-64.5	-40.5	174.8	-78.2	169.3	0	0	0	112.2	L394 Q395 S400 I401 R402	L394-L398 HydrophobicContact CG-CD1 4.38Å; L394-L398 WeakPolarHBondContact O-CB 3.4Å; L394-L398 WeakPolarHBondContact O-CG 3.38Å; L394-L398 PolarHBondContact O-N 2.79Å; Q395-L398 PolarHBondContact O-N 3.05Å; L398-S400 VanDerWaalsContact C-N 3.34Å; L398-I401 PolarHBondContact O-N 3.26Å; L398-R402 VanDerWaalsContact O-CB 3.3Å; L398-R402 WeakPolarHBondContact O-CB 3.23Å; L398-R402 PolarHBondContact O-N 3.14Å
399	E	86	Confident	80.2	Confident	128 Å²	128	102.9 Å²	102.9	60%	0.598	52%	0.518	S	S	*	.	H	α-helix	trans	-63.7	-40.1	173.6	-76.3	-177.1	177.2	0	0	112	Q395 A396 R402 Y403	Q395-E399 WeakPolarHBondContact O-CG 3.46Å; Q395-E399 PolarHBondContact O-N 3.48Å; A396-E399 PolarHBondContact O-N 3.2Å; E399-R402 PolarHBondContact O-N 3.06Å; E399-Y403 WeakPolarHBondContact O-CB 3.47Å; E399-Y403 PolarHBondContact O-N 3.41Å
400	S	85.6	Confident	81.6	Confident	65 Å²	65	101.5 Å²	101.5	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-64	-44.8	175.2	-59.1	0	0	0	0	111.8	A396 A397 L398 Y403 I404	A396-S400 WeakPolarHBondContact O-CB 3.31Å; A396-S400 PolarHBondContact O-N 3.47Å; A396-S400 PolarHBondContact O-OG 2.92Å; A397-S400 WeakPolarHBondContact O-CB 3.08Å; A397-S400 PolarHBondContact O-N 3.45Å; L398-S400 VanDerWaalsContact C-N 3.34Å; S400-Y403 PolarHBondContact O-N 2.88Å; S400-I404 WeakPolarHBondContact O-CB 3.11Å; S400-I404 WeakPolarHBondContact O-CD1 3.29Å; S400-I404 WeakPolarHBondContact O-CG1 3.39Å; S400-I404 PolarHBondContact O-N 3.26Å
401	I	90	Very high	82.9	Confident	99 Å²	99	100.8 Å²	100.8	51%	0.508	51%	0.505	S	S	.	.	H	α-helix	trans	-63.9	-41.4	175.5	-69.5	166.5	0	0	0	110.9	A397 L398 I404 T405	A397-I401 VanDerWaalsContact O-CG1 3.31Å; A397-I401 WeakPolarHBondContact O-CG1 3.41Å; A397-I401 PolarHBondContact O-N 3.49Å; L398-I401 PolarHBondContact O-N 3.26Å; I401-I404 PolarHBondContact O-N 3.39Å; I401-T405 VanDerWaalsContact O-CB 3.31Å; I401-T405 WeakPolarHBondContact O-CB 3.45Å; I401-T405 PolarHBondContact O-N 2.87Å; I401-T405 PolarHBondContact O-OG1 2.97Å
402	R	87.8	Confident	83.9	Confident	177 Å²	177	98.3 Å²	98.3	67%	0.668	50%	0.496	S	S	*	.	H	α-helix	trans	-63	-43.4	175.9	-177.6	177.5	173.8	156.2	-1	111.1	L398 E399 T405 M406	L398-R402 VanDerWaalsContact O-CB 3.3Å; L398-R402 WeakPolarHBondContact O-CB 3.23Å; L398-R402 PolarHBondContact O-N 3.14Å; E399-R402 PolarHBondContact O-N 3.06Å; R402-T405 PolarHBondContact O-N 3.46Å; R402-M406 HydrophobicContact CG-SD 4.33Å; R402-M406 WeakPolarHBondContact O-CB 3.43Å; R402-M406 WeakPolarHBondContact O-CG 3.26Å; R402-M406 PolarHBondContact O-N 3.16Å
403	Y	91.3	Very high	84.5	Confident	160 Å²	160	97.7 Å²	97.7	63%	0.627	49%	0.493	S	S	*	.	H	α-helix	trans	-61.8	-48.6	175.5	177.7	-96.2	0	0	0	111.5	E399 S400 T405 M406 H407	E399-Y403 WeakPolarHBondContact O-CB 3.47Å; E399-Y403 PolarHBondContact O-N 3.41Å; S400-Y403 PolarHBondContact O-N 2.88Å; Y403-T405 VanDerWaalsContact C-N 3.33Å; Y403-T405 PolarHBondContact O-N 3.39Å; Y403-M406 PolarHBondContact O-N 3.46Å; Y403-H407 VanDerWaalsContact O-CB 3.27Å; Y403-H407 WeakPolarHBondContact O-CB 3.48Å; Y403-H407 PolarHBondContact O-N 3.47Å
404	I	89.1	Confident	85.1	Confident	101 Å²	101	97 Å²	97	52%	0.518	49%	0.492	S	S	.	.	H	α-helix	trans	-59.3	-45.9	176.7	-67.7	162.7	0	0	0	110.3	S400 I401 H407 V408	S400-I404 WeakPolarHBondContact O-CB 3.11Å; S400-I404 WeakPolarHBondContact O-CD1 3.29Å; S400-I404 WeakPolarHBondContact O-CG1 3.39Å; S400-I404 PolarHBondContact O-N 3.26Å; I401-I404 PolarHBondContact O-N 3.39Å; I404-H407 PolarHBondContact O-N 3.22Å; I404-V408 HydrophobicContact CG2-CG2 4.26Å; I404-V408 WeakPolarHBondContact O-CB 3.31Å; I404-V408 VanDerWaalsContact O-CG2 3.23Å; I404-V408 WeakPolarHBondContact O-CG2 3.41Å; I404-V408 PolarHBondContact O-N 3.34Å
405	T	88.8	Confident	85.1	Confident	78 Å²	78	97.4 Å²	97.4	48%	0.479	49%	0.485	S	S	.	.	H	α-helix	trans	-62.9	-46.2	179.7	-56.3	0	0	0	0	111.1	I401 R402 Y403 H407 V408 V409	I401-T405 VanDerWaalsContact O-CB 3.31Å; I401-T405 WeakPolarHBondContact O-CB 3.45Å; I401-T405 PolarHBondContact O-N 2.87Å; I401-T405 PolarHBondContact O-OG1 2.97Å; R402-T405 PolarHBondContact O-N 3.46Å; Y403-T405 VanDerWaalsContact C-N 3.33Å; Y403-T405 PolarHBondContact O-N 3.39Å; T405-H407 VanDerWaalsContact C-N 3.35Å; T405-H407 PolarHBondContact O-N 2.95Å; T405-V408 PolarHBondContact O-N 2.93Å; T405-V409 WeakPolarHBondContact O-CB 3.35Å; T405-V409 VanDerWaalsContact O-CG2 3.26Å; T405-V409 WeakPolarHBondContact O-CG2 3.44Å; T405-V409 PolarHBondContact O-N 2.9Å
406	M	85.4	Confident	85.2	Confident	120 Å²	120	95.7 Å²	95.7	59%	0.591	48%	0.477	S	S	*	.	H	α-helix	trans	-63.9	-39.6	176.1	-75.8	-174.3	70.2	0	0	112.1	R402 Y403 V409 K410	R402-M406 HydrophobicContact CG-SD 4.33Å; R402-M406 WeakPolarHBondContact O-CB 3.43Å; R402-M406 WeakPolarHBondContact O-CG 3.26Å; R402-M406 PolarHBondContact O-N 3.16Å; Y403-M406 PolarHBondContact O-N 3.46Å; M406-V409 PolarHBondContact O-N 3.21Å; M406-K410 WeakPolarHBondContact O-CB 3.28Å; M406-K410 PolarHBondContact O-N 3.08Å
407	H	88.3	Confident	85.3	Confident	93 Å²	93	96 Å²	96	43%	0.431	48%	0.475	S	S	.	.	H	α-helix	trans	-64.1	-47.5	176.5	-172.6	-80.4	0	0	0	111.1	Y403 I404 T405 V409 K410 E411	Y403-H407 VanDerWaalsContact O-CB 3.27Å; Y403-H407 WeakPolarHBondContact O-CB 3.48Å; Y403-H407 PolarHBondContact O-N 3.47Å; I404-H407 PolarHBondContact O-N 3.22Å; T405-H407 VanDerWaalsContact C-N 3.35Å; T405-H407 PolarHBondContact O-N 2.95Å; H407-V409 VanDerWaalsContact C-N 3.35Å; H407-V409 PolarHBondContact O-N 3.21Å; H407-K410 PolarHBondContact O-N 3.19Å; H407-E411 IonicContact CE1-OE2 3.59Å; H407-E411 IonicContact ND1-OE2 3.61Å; H407-E411 VanDerWaalsContact O-CB 3.29Å; H407-E411 WeakPolarHBondContact O-CB 3.16Å; H407-E411 PolarHBondContact O-N 3.41Å
408	V	87.8	Confident	85.3	Confident	64 Å²	64	95.5 Å²	95.5	39%	0.388	47%	0.467	S	S	.	.	H	α-helix	trans	-61.1	-42.1	177.1	169.6	0	0	0	0	111.3	I404 T405 E411 N412	I404-V408 HydrophobicContact CG2-CG2 4.26Å; I404-V408 WeakPolarHBondContact O-CB 3.31Å; I404-V408 VanDerWaalsContact O-CG2 3.23Å; I404-V408 WeakPolarHBondContact O-CG2 3.41Å; I404-V408 PolarHBondContact O-N 3.34Å; T405-V408 PolarHBondContact O-N 2.93Å; V408-E411 PolarHBondContact O-N 3.24Å; V408-N412 VanDerWaalsContact O-CB 3.3Å; V408-N412 WeakPolarHBondContact O-CB 3.43Å; V408-N412 PolarHBondContact O-N 3.33Å; V408-N412 PolarHBondContact O-ND2 3.11Å
409	V	87.2	Confident	85.1	Confident	75 Å²	75	94.8 Å²	94.8	46%	0.455	46%	0.457	S	S	.	.	H	α-helix	trans	-63.4	-46	176	169.7	0	0	0	0	111.2	T405 M406 H407 N412 Q413	T405-V409 WeakPolarHBondContact O-CB 3.35Å; T405-V409 VanDerWaalsContact O-CG2 3.26Å; T405-V409 WeakPolarHBondContact O-CG2 3.44Å; T405-V409 PolarHBondContact O-N 2.9Å; M406-V409 PolarHBondContact O-N 3.21Å; H407-V409 VanDerWaalsContact C-N 3.35Å; H407-V409 PolarHBondContact O-N 3.21Å; V409-N412 PolarHBondContact O-N 2.95Å; V409-Q413 WeakPolarHBondContact O-CG 3.43Å; V409-Q413 PolarHBondContact O-N 3Å
410	K	83.4	Confident	85	Confident	145 Å²	145	90.8 Å²	90.8	63%	0.63	44%	0.44	S	S	*	.	H	α-helix	trans	-63.7	-42.4	178.3	-172.9	177.8	-179	-179.1	0	111.8	M406 H407 N412 Q413 V414	M406-K410 WeakPolarHBondContact O-CB 3.28Å; M406-K410 PolarHBondContact O-N 3.08Å; H407-K410 PolarHBondContact O-N 3.19Å; K410-N412 VanDerWaalsContact C-N 3.33Å; K410-N412 PolarHBondContact O-N 3.44Å; K410-Q413 PolarHBondContact O-N 2.96Å; K410-V414 WeakPolarHBondContact O-CG2 3.44Å; K410-V414 PolarHBondContact O-N 2.76Å
411	E	83.3	Confident	85	Confident	73 Å²	73	88.2 Å²	88.2	34%	0.341	42%	0.42	S	S	.	.	H	α-helix	trans	-64.9	-37.6	176.3	-164.2	-171.4	145.1	0	0	111.5	H407 V408 V414 R415	H407-E411 IonicContact CE1-OE2 3.59Å; H407-E411 IonicContact ND1-OE2 3.61Å; H407-E411 VanDerWaalsContact O-CB 3.29Å; H407-E411 WeakPolarHBondContact O-CB 3.16Å; H407-E411 PolarHBondContact O-N 3.41Å; V408-E411 PolarHBondContact O-N 3.24Å; E411-V414 PolarHBondContact O-N 3.16Å; E411-R415 WeakPolarHBondContact O-CB 3.46Å; E411-R415 PolarHBondContact O-N 3.27Å; E411-R415 IonicContact OE1-CZ 3.41Å; E411-R415 VanDerWaalsContact OE1-CZ 3.23Å; E411-R415 IonicContact OE1-NH1 3.02Å; E411-R415 PolarHBondContact OE1-NH1 3.42Å; E411-R415 IonicContact OE1-NH2 3.68Å; E411-R415 PolarHBondContact OE1-NH2 3.41Å
412	N	83.7	Confident	84.8	Confident	66 Å²	66	87.2 Å²	87.2	35%	0.353	41%	0.412	S	S	.	.	H	α-helix	trans	-65.9	-42	174	-76.3	-16	0	0	0	112.5	V408 V409 K410 V414 R415 E416	V408-N412 VanDerWaalsContact O-CB 3.3Å; V408-N412 WeakPolarHBondContact O-CB 3.43Å; V408-N412 PolarHBondContact O-N 3.33Å; V408-N412 PolarHBondContact O-ND2 3.11Å; V409-N412 PolarHBondContact O-N 2.95Å; K410-N412 VanDerWaalsContact C-N 3.33Å; K410-N412 PolarHBondContact O-N 3.44Å; N412-V414 VanDerWaalsContact C-N 3.34Å; N412-V414 PolarHBondContact O-N 2.88Å; N412-R415 PolarHBondContact O-N 2.85Å; N412-R415 PolarHBondContact OD1-NE 2.82Å; N412-R415 PolarHBondContact OD1-NH2 3.33Å; N412-E416 WeakPolarHBondContact O-CG 3.41Å; N412-E416 PolarHBondContact O-N 3.36Å
413	Q	80.5	Confident	84.7	Confident	120 Å²	120	79.7 Å²	79.7	56%	0.561	39%	0.385	S	S	*	.	H	α-helix	trans	-61.6	-42.7	174.2	-73.5	179.4	-12.8	0	0	111.8	V409 K410 E416 V417	V409-Q413 WeakPolarHBondContact O-CG 3.43Å; V409-Q413 PolarHBondContact O-N 3Å; K410-Q413 PolarHBondContact O-N 2.96Å; Q413-E416 PolarHBondContact O-N 2.93Å; Q413-V417 WeakPolarHBondContact O-CG2 3.4Å; Q413-V417 PolarHBondContact O-N 2.95Å
414	V	80.6	Confident	84.5	Confident	59 Å²	59	72.2 Å²	72.2	36%	0.358	36%	0.356	S	S	.	.	H	α-helix	trans	-60.3	-46.6	174.1	158.6	0	0	0	0	111.1	S329 K410 E411 N412 E416 V417 V418	S329-V414 WeakPolarHBondContact OG-CG1 3.42Å; K410-V414 WeakPolarHBondContact O-CG2 3.44Å; K410-V414 PolarHBondContact O-N 2.76Å; E411-V414 PolarHBondContact O-N 3.16Å; N412-V414 VanDerWaalsContact C-N 3.34Å; N412-V414 PolarHBondContact O-N 2.88Å; V414-E416 VanDerWaalsContact C-N 3.31Å; V414-E416 PolarHBondContact O-N 3.39Å; V414-V417 PolarHBondContact O-N 3.39Å; V414-V418 WeakPolarHBondContact O-CG2 3.37Å; V414-V418 PolarHBondContact O-N 3.4Å
415	R	79.8	Confident	84.4	Confident	120 Å²	120	67.4 Å²	67.4	45%	0.453	33%	0.331	S	S	.	.	H	α-helix	trans	-60.8	-37.5	175.7	-83.4	-167	-81.9	-111.8	-4.7	112.7	E411 N412 R419	E411-R415 WeakPolarHBondContact O-CB 3.46Å; E411-R415 PolarHBondContact O-N 3.27Å; E411-R415 IonicContact OE1-CZ 3.41Å; E411-R415 VanDerWaalsContact OE1-CZ 3.23Å; E411-R415 IonicContact OE1-NH1 3.02Å; E411-R415 PolarHBondContact OE1-NH1 3.42Å; E411-R415 IonicContact OE1-NH2 3.68Å; E411-R415 PolarHBondContact OE1-NH2 3.41Å; N412-R415 PolarHBondContact O-N 2.85Å; N412-R415 PolarHBondContact OD1-NE 2.82Å; N412-R415 PolarHBondContact OD1-NH2 3.33Å; R415-R419 VanDerWaalsContact O-CB 3.3Å; R415-R419 WeakPolarHBondContact O-CB 3.45Å; R415-R419 PolarHBondContact O-N 3.3Å
416	E	81.1	Confident	84.3	Confident	75 Å²	75	68.1 Å²	68.1	35%	0.35	33%	0.329	S	S	.	.	H	α-helix	trans	-63.4	-49.6	175.2	-78.6	179.1	-179.6	0	0	112	N412 Q413 V414 V418 R419 D420	N412-E416 WeakPolarHBondContact O-CG 3.41Å; N412-E416 PolarHBondContact O-N 3.36Å; Q413-E416 PolarHBondContact O-N 2.93Å; V414-E416 VanDerWaalsContact C-N 3.31Å; V414-E416 PolarHBondContact O-N 3.39Å; E416-V418 VanDerWaalsContact C-N 3.34Å; E416-V418 PolarHBondContact O-N 3.05Å; E416-R419 VanDerWaalsContact CG-NH2 3.32Å; E416-R419 WeakPolarHBondContact O-CB 3.44Å; E416-R419 PolarHBondContact O-N 3.33Å; E416-R419 VanDerWaalsContact O-N 3.1Å; E416-D420 PolarHBondContact O-N 3.1Å
417	V	81.6	Confident	84.5	Confident	46 Å²	46	62.4 Å²	62.4	28%	0.279	30%	0.301	S	S	.	.	H	α-helix	trans	-60.5	-43.8	178.8	173.4	0	0	0	0	111.6	Q413 V414 R419 D420 W421	Q413-V417 WeakPolarHBondContact O-CG2 3.4Å; Q413-V417 PolarHBondContact O-N 2.95Å; V414-V417 PolarHBondContact O-N 3.39Å; V417-R419 VanDerWaalsContact C-N 3.29Å; V417-R419 PolarHBondContact O-N 3.14Å; V417-D420 PolarHBondContact O-N 2.98Å; V417-W421 VanDerWaalsContact O-CD1 3.23Å; V417-W421 PolarHBondContact O-N 3.38Å; V417-W421 VanDerWaalsContact O-N 3.14Å
418	V	82.8	Confident	84.5	Confident	37 Å²	37	58.2 Å²	58.2	22%	0.224	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-39.7	176.8	171.7	0	0	0	0	111	V414 E416 W421 K422	V414-V418 WeakPolarHBondContact O-CG2 3.37Å; V414-V418 PolarHBondContact O-N 3.4Å; E416-V418 VanDerWaalsContact C-N 3.34Å; E416-V418 PolarHBondContact O-N 3.05Å; V418-W421 PolarHBondContact O-N 3.49Å; V418-K422 HydrophobicContact CG1-CD 4.28Å; V418-K422 HydrophobicContact CG1-CG 4.48Å; V418-K422 WeakPolarHBondContact O-CG 3.38Å; V418-K422 PolarHBondContact O-N 3.27Å
419	R	82.6	Confident	84.6	Confident	89 Å²	89	55.6 Å²	55.6	34%	0.336	27%	0.265	S	S	.	.	H	α-helix	trans	-66.2	-38.6	178.4	-165.1	-173.3	-21	174.9	15.1	112.3	Y360 R415 E416 V417 K422 F423	Y360-R419 PolarHBondContact OH-NH1 3.05Å; Y360-R419 PolarHBondContact OH-NH2 3.42Å; R415-R419 VanDerWaalsContact O-CB 3.3Å; R415-R419 WeakPolarHBondContact O-CB 3.45Å; R415-R419 PolarHBondContact O-N 3.3Å; E416-R419 VanDerWaalsContact CG-NH2 3.32Å; E416-R419 WeakPolarHBondContact O-CB 3.44Å; E416-R419 PolarHBondContact O-N 3.33Å; E416-R419 VanDerWaalsContact O-N 3.1Å; V417-R419 VanDerWaalsContact C-N 3.29Å; V417-R419 PolarHBondContact O-N 3.14Å; R419-K422 PolarHBondContact O-N 3.48Å; R419-F423 WeakPolarHBondContact O-CB 3.38Å; R419-F423 PolarHBondContact O-N 3.48Å
420	D	84.8	Confident	84.7	Confident	44 Å²	44	56.1 Å²	56.1	24%	0.235	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-41.8	176	-77.1	-3.5	0	0	0	111.5	L344 E416 V417 F423 A424	L344-D420 HydrophobicContact CD2-CB 4.11Å; E416-D420 PolarHBondContact O-N 3.1Å; V417-D420 PolarHBondContact O-N 2.98Å; D420-F423 PolarHBondContact O-N 2.98Å; D420-A424 WeakPolarHBondContact O-CB 3.46Å; D420-A424 PolarHBondContact O-N 3.27Å
421	W	85.2	Confident	85	Confident	11 Å²	11	51.8 Å²	51.8	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-66.1	-42.2	174.5	-79	112.1	0	0	0	112.9	I324 R327 M335 V417 V418 F423 A424 A425	I324-W421 HydrophobicContact CG2-CE3 3.8Å; I324-W421 HydrophobicContact CG2-CZ3 4.16Å; R327-W421 HydrophobicContact CB-CD2 4.3Å; R327-W421 HydrophobicContact CB-CG 4.4Å; R327-W421 HydrophobicContact CG-CD2 4.44Å; M335-W421 HydrophobicContact CB-CZ2 4.02Å; M335-W421 HydrophobicContact CE-CZ3 4.45Å; M335-W421 HydrophobicContact CG-CH2 4.01Å; M335-W421 HydrophobicContact CG-CZ2 3.82Å; V417-W421 VanDerWaalsContact O-CD1 3.23Å; V417-W421 PolarHBondContact O-N 3.38Å; V417-W421 VanDerWaalsContact O-N 3.14Å; V418-W421 PolarHBondContact O-N 3.49Å; W421-F423 VanDerWaalsContact C-N 3.32Å; W421-F423 PolarHBondContact O-N 3.14Å; W421-A424 PolarHBondContact O-N 2.89Å; W421-A425 PolarHBondContact O-N 3.05Å
422	K	86.3	Confident	85.4	Confident	79 Å²	79	50.6 Å²	50.6	34%	0.343	24%	0.236	S	C	.	.	H	α-helix	trans	-61.1	-41.8	173.8	-71.8	-175.1	176.3	-169	0	111.8	V418 R419 A425 Q426	V418-K422 HydrophobicContact CG1-CD 4.28Å; V418-K422 HydrophobicContact CG1-CG 4.48Å; V418-K422 WeakPolarHBondContact O-CG 3.38Å; V418-K422 PolarHBondContact O-N 3.27Å; R419-K422 PolarHBondContact O-N 3.48Å; K422-A425 PolarHBondContact O-N 3.1Å; K422-Q426 WeakPolarHBondContact O-CG 3.25Å; K422-Q426 PolarHBondContact O-N 3.24Å
423	F	86.1	Confident	85.8	Confident	19 Å²	19	48.4 Å²	48.4	8%	0.083	22%	0.224	C	C	.	.	H	α-helix	trans	-65.7	-41.5	175.9	-176.1	-103.5	0	0	0	111.5	L344 P348 R419 D420 W421 A425 Q426 V427	L344-F423 HydrophobicContact CG-CD1 4.22Å; P348-F423 HydrophobicContact CB-CE1 4.42Å; P348-F423 HydrophobicContact CB-CZ 4.22Å; P348-F423 HydrophobicContact CG-CE1 3.78Å; P348-F423 HydrophobicContact CG-CZ 4.06Å; R419-F423 WeakPolarHBondContact O-CB 3.38Å; R419-F423 PolarHBondContact O-N 3.48Å; D420-F423 PolarHBondContact O-N 2.98Å; W421-F423 VanDerWaalsContact C-N 3.32Å; W421-F423 PolarHBondContact O-N 3.14Å; F423-A425 VanDerWaalsContact C-N 3.33Å; F423-A425 PolarHBondContact O-N 3.01Å; F423-Q426 WeakPolarHBondContact O-CB 3.46Å; F423-Q426 PolarHBondContact O-N 3.19Å; F423-V427 HydrophobicContact CD1-CG2 4Å; F423-V427 HydrophobicContact CE1-CG2 3.63Å; F423-V427 HydrophobicContact CE2-CG2 4.31Å; F423-V427 HydrophobicContact CG-CG2 4.49Å; F423-V427 HydrophobicContact CZ-CG2 3.81Å; F423-V427 VanDerWaalsContact O-CG2 3.26Å; F423-V427 WeakPolarHBondContact O-CG2 3.48Å; F423-V427 PolarHBondContact O-N 3.19Å
424	A	86.8	Confident	86.2	Confident	3 Å²	3	49.9 Å²	49.9	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-60.7	-41.1	175.2	0	0	0	0	0	112.4	M335 F343 D420 W421 V427 L428	M335-A424 HydrophobicContact CE-CB 3.76Å; F343-A424 HydrophobicContact CB-CB 3.98Å; F343-A424 HydrophobicContact CD1-CB 4.46Å; F343-A424 HydrophobicContact CG-CB 4.33Å; D420-A424 WeakPolarHBondContact O-CB 3.46Å; D420-A424 PolarHBondContact O-N 3.27Å; W421-A424 PolarHBondContact O-N 2.89Å; A424-V427 PolarHBondContact O-N 3.4Å; A424-L428 WeakPolarHBondContact O-CB 3.39Å; A424-L428 PolarHBondContact O-N 3.45Å
425	A	86.8	Confident	86.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-43.4	173.5	0	0	0	0	0	112.2	I324 H325 W421 K422 F423 V427 L428 D429	I324-A425 HydrophobicContact CB-CB 4.44Å; I324-A425 HydrophobicContact CG2-CB 4Å; H325-A425 HydrophobicContact CB-CB 3.87Å; W421-A425 PolarHBondContact O-N 3.05Å; K422-A425 PolarHBondContact O-N 3.1Å; F423-A425 VanDerWaalsContact C-N 3.33Å; F423-A425 PolarHBondContact O-N 3.01Å; A425-V427 VanDerWaalsContact C-N 3.33Å; A425-V427 PolarHBondContact O-N 3.13Å; A425-L428 WeakPolarHBondContact O-CB 3.39Å; A425-L428 PolarHBondContact O-N 3.24Å; A425-D429 PolarHBondContact O-N 3.27Å
426	Q	86.5	Confident	87.2	Confident	93 Å²	93	44.1 Å²	44.1	44%	0.435	21%	0.206	S	C	.	.	H	α-helix	trans	-61.6	-40.2	174.6	-72.8	175.7	-19.1	0	0	112.3	K422 F423 L428 D429 R430	K422-Q426 WeakPolarHBondContact O-CG 3.25Å; K422-Q426 PolarHBondContact O-N 3.24Å; F423-Q426 WeakPolarHBondContact O-CB 3.46Å; F423-Q426 PolarHBondContact O-N 3.19Å; Q426-L428 VanDerWaalsContact C-N 3.33Å; Q426-D429 PolarHBondContact O-N 3.21Å; Q426-R430 VanDerWaalsContact O-CG 3.22Å; Q426-R430 WeakPolarHBondContact O-CG 3.44Å; Q426-R430 PolarHBondContact O-N 3.34Å
427	V	88.9	Confident	87.7	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.5	-40.4	177.7	171.6	0	0	0	0	110.9	F343 L347 P348 L351 M353 F423 A424 A425 R430 M431	F343-V427 HydrophobicContact CD1-CG1 4.24Å; L347-V427 HydrophobicContact CB-CG1 3.63Å; L347-V427 HydrophobicContact CD1-CG1 4.24Å; P348-V427 HydrophobicContact CG-CG1 4.34Å; P348-V427 HydrophobicContact CG-CG2 3.91Å; L351-V427 HydrophobicContact CD1-CG1 4.22Å; M353-V427 HydrophobicContact CE-CB 4.12Å; M353-V427 HydrophobicContact CE-CG1 4.04Å; M353-V427 HydrophobicContact CE-CG2 3.86Å; M353-V427 HydrophobicContact SD-CG2 4.16Å; F423-V427 HydrophobicContact CD1-CG2 4Å; F423-V427 HydrophobicContact CE1-CG2 3.63Å; F423-V427 HydrophobicContact CE2-CG2 4.31Å; F423-V427 HydrophobicContact CG-CG2 4.49Å; F423-V427 HydrophobicContact CZ-CG2 3.81Å; F423-V427 VanDerWaalsContact O-CG2 3.26Å; F423-V427 WeakPolarHBondContact O-CG2 3.48Å; F423-V427 PolarHBondContact O-N 3.19Å; A424-V427 PolarHBondContact O-N 3.4Å; A425-V427 VanDerWaalsContact C-N 3.33Å; A425-V427 PolarHBondContact O-N 3.13Å; V427-R430 PolarHBondContact O-N 3.21Å; V427-M431 WeakPolarHBondContact O-CB 3.45Å; V427-M431 PolarHBondContact O-N 3.26Å
428	L	88.6	Confident	88.1	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-46.8	175.6	-173.3	140.9	0	0	0	111.7	I317 F320 A321 I324 F343 A424 A425 Q426 R430 M431 F432	I317-L428 HydrophobicContact CG2-CD2 4.32Å; F320-L428 HydrophobicContact CD1-CD1 4.14Å; F320-L428 HydrophobicContact CE1-CD1 3.84Å; A321-L428 HydrophobicContact CB-CD2 3.6Å; I324-L428 HydrophobicContact CD1-CD1 3.92Å; F343-L428 HydrophobicContact CE1-CB 3.96Å; F343-L428 HydrophobicContact CE1-CD1 3.91Å; F343-L428 HydrophobicContact CE1-CG 4.38Å; F343-L428 HydrophobicContact CZ-CD1 4.07Å; A424-L428 WeakPolarHBondContact O-CB 3.39Å; A424-L428 PolarHBondContact O-N 3.45Å; A425-L428 WeakPolarHBondContact O-CB 3.39Å; A425-L428 PolarHBondContact O-N 3.24Å; Q426-L428 VanDerWaalsContact C-N 3.33Å; L428-R430 VanDerWaalsContact C-N 3.33Å; L428-R430 PolarHBondContact O-N 3.16Å; L428-M431 WeakPolarHBondContact O-CB 3.3Å; L428-M431 PolarHBondContact O-N 2.9Å; L428-F432 HydrophobicContact CD1-CE2 4.13Å; L428-F432 HydrophobicContact CD2-CD2 3.57Å; L428-F432 HydrophobicContact CD2-CE2 3.63Å; L428-F432 HydrophobicContact CG-CD2 3.77Å; L428-F432 HydrophobicContact CG-CE2 3.61Å; L428-F432 VanDerWaalsContact O-CD2 3.23Å; L428-F432 WeakPolarHBondContact O-CD2 3.32Å; L428-F432 PolarHBondContact O-N 3.49Å
429	D	89.4	Confident	88.4	Confident	9 Å²	9	46.8 Å²	46.8	5%	0.048	22%	0.221	C	C	.	.	H	α-helix	trans	-57.6	-44.2	175.2	-85.9	-26.3	0	0	0	111.7	K268 A425 Q426 F432 L433	K268-D429 IonicContact NZ-OD1 2.72Å; K268-D429 PolarHBondContact NZ-OD1 2.98Å; K268-D429 IonicContact NZ-OD2 3.19Å; K268-D429 PolarHBondContact NZ-OD2 2.96Å; A425-D429 PolarHBondContact O-N 3.27Å; Q426-D429 PolarHBondContact O-N 3.21Å; D429-F432 PolarHBondContact O-N 3.41Å; D429-L433 VanDerWaalsContact O-CB 3.32Å; D429-L433 WeakPolarHBondContact O-CB 3.27Å; D429-L433 PolarHBondContact O-N 3.02Å
430	R	89.7	Confident	88.6	Confident	87 Å²	87	43.6 Å²	43.6	33%	0.328	21%	0.212	S	C	.	.	H	α-helix	trans	-67.9	-37.8	178.6	-68.1	-71.5	-179.1	-173.4	-5.3	113.1	M353 Q426 V427 L428 L433 W434	M353-R430 HydrophobicContact CE-CB 3.75Å; M353-R430 HydrophobicContact CE-CG 4.15Å; M353-R430 HydrophobicContact SD-CB 4.11Å; M353-R430 HydrophobicContact SD-CG 3.81Å; Q426-R430 VanDerWaalsContact O-CG 3.22Å; Q426-R430 WeakPolarHBondContact O-CG 3.44Å; Q426-R430 PolarHBondContact O-N 3.34Å; V427-R430 PolarHBondContact O-N 3.21Å; L428-R430 VanDerWaalsContact C-N 3.33Å; L428-R430 PolarHBondContact O-N 3.16Å; R430-L433 PolarHBondContact O-N 3.37Å; R430-W434 PolarHBondContact O-N 2.92Å
431	M	91	Very high	88.8	Confident	53 Å²	53	45.8 Å²	45.8	26%	0.261	23%	0.227	S	C	.	.	H	α-helix	trans	-61.7	-50	174.9	-179.1	-166.1	68.8	0	0	110.6	L347 L351 V427 L428 L433 W434 A435	L347-M431 HydrophobicContact CD1-SD 4.37Å; L347-M431 HydrophobicContact CD2-SD 4.35Å; L351-M431 HydrophobicContact CD1-CB 3.95Å; V427-M431 WeakPolarHBondContact O-CB 3.45Å; V427-M431 PolarHBondContact O-N 3.26Å; L428-M431 WeakPolarHBondContact O-CB 3.3Å; L428-M431 PolarHBondContact O-N 2.9Å; M431-L433 VanDerWaalsContact C-N 3.34Å; M431-W434 PolarHBondContact O-N 3.19Å; M431-A435 PolarHBondContact O-N 3.45Å
432	F	90.8	Very high	89	Confident	49 Å²	49	49.7 Å²	49.7	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-68.6	-33.3	179.2	-74.8	-63	0	0	0	112.1	F259 I317 L428 D429 W434 A435 F436	F259-F432 HydrophobicContact CD1-CB 4.2Å; F259-F432 HydrophobicContact CE1-CB 4.06Å; F259-F432 HydrophobicContact CZ-CB 4.34Å; I317-F432 HydrophobicContact CD1-CD1 3.67Å; I317-F432 HydrophobicContact CD1-CE1 3.53Å; I317-F432 HydrophobicContact CD1-CE2 4.4Å; I317-F432 HydrophobicContact CD1-CG 4.19Å; I317-F432 HydrophobicContact CD1-CZ 3.92Å; I317-F432 HydrophobicContact CG1-CE1 4.45Å; I317-F432 HydrophobicContact CG1-CZ 4.37Å; I317-F432 HydrophobicContact CG2-CB 4.33Å; I317-F432 HydrophobicContact CG2-CD1 4.27Å; I317-F432 HydrophobicContact CG2-CD2 3.34Å; I317-F432 HydrophobicContact CG2-CE1 4.44Å; I317-F432 HydrophobicContact CG2-CE2 3.53Å; I317-F432 HydrophobicContact CG2-CG 3.73Å; I317-F432 HydrophobicContact CG2-CZ 4.1Å; L428-F432 HydrophobicContact CD1-CE2 4.13Å; L428-F432 HydrophobicContact CD2-CD2 3.57Å; L428-F432 HydrophobicContact CD2-CE2 3.63Å; L428-F432 HydrophobicContact CG-CD2 3.77Å; L428-F432 HydrophobicContact CG-CE2 3.61Å; L428-F432 VanDerWaalsContact O-CD2 3.23Å; L428-F432 WeakPolarHBondContact O-CD2 3.32Å; L428-F432 PolarHBondContact O-N 3.49Å; D429-F432 PolarHBondContact O-N 3.41Å; F432-W434 PolarHBondContact O-N 2.72Å; F432-A435 PolarHBondContact O-N 2.88Å; F432-F436 HydrophobicContact CB-CD2 4.28Å; F432-F436 HydrophobicContact CB-CE2 4.46Å; F432-F436 HydrophobicContact CD1-CE2 4.22Å; F432-F436 WeakPolarHBondContact O-CB 3.47Å; F432-F436 WeakPolarHBondContact O-CD2 3.48Å; F432-F436 PolarHBondContact O-N 3.28Å
433	L	91.3	Very high	89	Confident	20 Å²	20	46.3 Å²	46.3	11%	0.105	24%	0.236	C	C	.	.	H	α-helix	trans	-53.8	-51.5	171.1	-173.8	158.4	0	0	0	111.5	I256 F259 Y260 D429 R430 M431 F436 L437	I256-L433 HydrophobicContact CG2-CG 4.37Å; F259-L433 HydrophobicContact CB-CB 3.79Å; F259-L433 HydrophobicContact CB-CD1 4.36Å; F259-L433 HydrophobicContact CB-CG 4.31Å; Y260-L433 HydrophobicContact CD2-CD1 4.05Å; D429-L433 VanDerWaalsContact O-CB 3.32Å; D429-L433 WeakPolarHBondContact O-CB 3.27Å; D429-L433 PolarHBondContact O-N 3.02Å; R430-L433 PolarHBondContact O-N 3.37Å; M431-L433 VanDerWaalsContact C-N 3.34Å; L433-F436 PolarHBondContact O-N 3.27Å; L433-L437 WeakPolarHBondContact O-CB 3.3Å; L433-L437 PolarHBondContact O-N 2.95Å
434	W	90.7	Very high	88.9	Confident	151 Å²	151	46.9 Å²	46.9	57%	0.572	24%	0.242	S	C	*	.	H	α-helix	trans	-66.8	-38.8	179.6	-76.9	110.4	0	0	0	112.7	R430 M431 F432 L437 L438	R430-W434 PolarHBondContact O-N 2.92Å; M431-W434 PolarHBondContact O-N 3.19Å; F432-W434 PolarHBondContact O-N 2.72Å; W434-L437 HydrophobicContact CE3-CD2 3.91Å; W434-L437 HydrophobicContact CZ3-CD2 3.86Å; W434-L438 WeakPolarHBondContact O-CB 3.11Å; W434-L438 PolarHBondContact O-N 3.48Å
435	A	90.5	Very high	88.8	Confident	45 Å²	45	48.5 Å²	48.5	37%	0.372	26%	0.255	S	S	.	.	H	α-helix	trans	-62.9	-48.4	176.5	0	0	0	0	0	111.6	M431 F432 L438 V439	M431-A435 PolarHBondContact O-N 3.45Å; F432-A435 PolarHBondContact O-N 2.88Å; A435-L438 PolarHBondContact O-N 2.83Å; A435-V439 VanDerWaalsContact O-CG2 3.29Å; A435-V439 WeakPolarHBondContact O-CG2 3.36Å; A435-V439 PolarHBondContact O-N 2.94Å
436	F	90.2	Very high	88.8	Confident	13 Å²	13	54.7 Å²	54.7	6%	0.057	29%	0.288	C	S	.	.	H	α-helix	trans	-67.6	-38.4	178.5	-86.8	-102.9	0	0	0	112.4	F259 F310 L313 I317 F432 L433 V439 S440	F259-F436 HydrophobicContact CD2-CG 4.43Å; F259-F436 HydrophobicContact CE2-CB 4.23Å; F259-F436 AromaticContact CE2-CD1 3.95Å; F259-F436 HydrophobicContact CE2-CD1 3.95Å; F259-F436 AromaticContact CE2-CD2 3.74Å; F259-F436 HydrophobicContact CE2-CD2 3.74Å; F259-F436 HydrophobicContact CE2-CE1 4.18Å; F259-F436 AromaticContact CE2-CE2 3.96Å; F259-F436 HydrophobicContact CE2-CE2 3.96Å; F259-F436 AromaticContact CE2-CG 3.7Å; F259-F436 HydrophobicContact CE2-CG 3.7Å; F259-F436 HydrophobicContact CE2-CZ 4.16Å; F259-F436 HydrophobicContact CZ-CD2 4.05Å; F259-F436 HydrophobicContact CZ-CE1 4.47Å; F259-F436 AromaticContact CZ-CE2 3.84Å; F259-F436 HydrophobicContact CZ-CE2 3.84Å; F259-F436 HydrophobicContact CZ-CG 4.42Å; F259-F436 HydrophobicContact CZ-CZ 4.04Å; F310-F436 HydrophobicContact CB-CE1 4.45Å; F310-F436 AromaticContact CD1-CD1 3.9Å; F310-F436 HydrophobicContact CD1-CD1 3.9Å; F310-F436 AromaticContact CD1-CE1 3.76Å; F310-F436 HydrophobicContact CD1-CE1 3.76Å; F310-F436 WeakPolarHBondContact O-CE1 3.38Å; L313-F436 HydrophobicContact CD2-CE1 4.46Å; L313-F436 HydrophobicContact CD2-CE2 4Å; L313-F436 HydrophobicContact CD2-CZ 3.46Å; L313-F436 VanDerWaalsContact CD2-CZ 3.46Å; I317-F436 HydrophobicContact CD1-CE2 3.83Å; I317-F436 HydrophobicContact CD1-CZ 4.15Å; F432-F436 HydrophobicContact CB-CD2 4.28Å; F432-F436 HydrophobicContact CB-CE2 4.46Å; F432-F436 HydrophobicContact CD1-CE2 4.22Å; F432-F436 WeakPolarHBondContact O-CB 3.47Å; F432-F436 WeakPolarHBondContact O-CD2 3.48Å; F432-F436 PolarHBondContact O-N 3.28Å; L433-F436 PolarHBondContact O-N 3.27Å; F436-V439 PolarHBondContact O-N 3.41Å; F436-S440 WeakPolarHBondContact O-CB 3.45Å; F436-S440 PolarHBondContact O-N 3.46Å
437	L	90.7	Very high	88.4	Confident	56 Å²	56	51.5 Å²	51.5	29%	0.293	27%	0.273	S	S	.	.	H	α-helix	trans	-60.6	-48.1	174.2	179.1	65.7	0	0	0	111	I256 L433 W434 V439 S440 V441	I256-L437 HydrophobicContact CD1-CD1 3.99Å; I256-L437 HydrophobicContact CG2-CB 4.45Å; L433-L437 WeakPolarHBondContact O-CB 3.3Å; L433-L437 PolarHBondContact O-N 2.95Å; W434-L437 HydrophobicContact CE3-CD2 3.91Å; W434-L437 HydrophobicContact CZ3-CD2 3.86Å; L437-V439 PolarHBondContact O-N 3.44Å; L437-S440 PolarHBondContact O-N 3.26Å; L437-V441 HydrophobicContact CD1-CG2 4.19Å; L437-V441 WeakPolarHBondContact O-CB 3.45Å; L437-V441 VanDerWaalsContact O-CG2 3.26Å; L437-V441 WeakPolarHBondContact O-CG2 3.26Å; L437-V441 PolarHBondContact O-N 3.28Å
438	L	90.5	Very high	88.1	Confident	109 Å²	109	53.8 Å²	53.8	57%	0.571	28%	0.283	S	S	*	.	H	α-helix	trans	-59.1	-49.9	178.1	-175.5	99.4	0	0	0	110.9	W434 A435 V441 L442	W434-L438 WeakPolarHBondContact O-CB 3.11Å; W434-L438 PolarHBondContact O-N 3.48Å; A435-L438 PolarHBondContact O-N 2.83Å; L438-V441 PolarHBondContact O-N 3.5Å; L438-L442 HydrophobicContact CD2-CD1 3.95Å; L438-L442 HydrophobicContact CG-CD1 3.82Å; L438-L442 WeakPolarHBondContact O-CB 3.31Å; L438-L442 VanDerWaalsContact O-CG 3.29Å; L438-L442 WeakPolarHBondContact O-CG 3.29Å; L438-L442 PolarHBondContact O-N 3.48Å
439	V	89.6	Confident	87.8	Confident	48 Å²	48	58.7 Å²	58.7	29%	0.291	31%	0.309	S	S	.	.	H	α-helix	trans	-68.7	-36.7	-177.1	179.9	0	0	0	0	111.8	F306 F310 A435 F436 L437 G443	F306-V439 HydrophobicContact CZ-CG1 3.86Å; F310-V439 HydrophobicContact CD1-CG1 4.33Å; F310-V439 HydrophobicContact CE1-CB 3.89Å; F310-V439 HydrophobicContact CE1-CG1 3.34Å; F310-V439 HydrophobicContact CE1-CG2 4.47Å; F310-V439 HydrophobicContact CE2-CG1 3.99Å; F310-V439 HydrophobicContact CZ-CB 4.19Å; F310-V439 HydrophobicContact CZ-CG1 3.16Å; A435-V439 VanDerWaalsContact O-CG2 3.29Å; A435-V439 WeakPolarHBondContact O-CG2 3.36Å; A435-V439 PolarHBondContact O-N 2.94Å; F436-V439 PolarHBondContact O-N 3.41Å; L437-V439 PolarHBondContact O-N 3.44Å; V439-G443 PolarHBondContact O-N 3.41Å
440	S	87.1	Confident	87.4	Confident	23 Å²	23	61.2 Å²	61.2	16%	0.161	33%	0.326	C	S	.	.	H	α-helix	trans	-64.4	-45.3	174.4	177.2	0	0	0	0	111.6	F436 L437 G443 S444	F436-S440 WeakPolarHBondContact O-CB 3.45Å; F436-S440 PolarHBondContact O-N 3.46Å; L437-S440 PolarHBondContact O-N 3.26Å; S440-G443 PolarHBondContact O-N 2.83Å; S440-S444 VanDerWaalsContact O-CB 3.3Å; S440-S444 WeakPolarHBondContact O-CB 3.48Å; S440-S444 PolarHBondContact O-N 2.83Å; S440-S444 PolarHBondContact O-OG 3.47Å
441	V	88.6	Confident	86.9	Confident	89 Å²	89	57.7 Å²	57.7	54%	0.539	31%	0.314	S	S	.	.	H	α-helix	trans	-64.6	-44.9	177.5	171.5	0	0	0	0	111.2	L437 L438 A445	L437-V441 HydrophobicContact CD1-CG2 4.19Å; L437-V441 WeakPolarHBondContact O-CB 3.45Å; L437-V441 VanDerWaalsContact O-CG2 3.26Å; L437-V441 WeakPolarHBondContact O-CG2 3.26Å; L437-V441 PolarHBondContact O-N 3.28Å; L438-V441 PolarHBondContact O-N 3.5Å; V441-A445 VanDerWaalsContact O-CB 3.26Å; V441-A445 WeakPolarHBondContact O-CB 3.35Å; V441-A445 PolarHBondContact O-N 3.28Å
442	L	88.8	Confident	86.3	Confident	93 Å²	93	60.3 Å²	60.3	49%	0.487	33%	0.328	S	S	.	.	H	α-helix	trans	-65.1	-44.5	177.7	-72.9	170.7	0	0	0	112	L438 A445 L446	L438-L442 HydrophobicContact CD2-CD1 3.95Å; L438-L442 HydrophobicContact CG-CD1 3.82Å; L438-L442 WeakPolarHBondContact O-CB 3.31Å; L438-L442 VanDerWaalsContact O-CG 3.29Å; L438-L442 WeakPolarHBondContact O-CG 3.29Å; L438-L442 PolarHBondContact O-N 3.48Å; L442-A445 PolarHBondContact O-N 2.88Å; L442-L446 WeakPolarHBondContact O-CB 3.4Å; L442-L446 VanDerWaalsContact O-CG 3.27Å; L442-L446 WeakPolarHBondContact O-CG 3.27Å; L442-L446 PolarHBondContact O-N 3.33Å
443	G	85.6	Confident	85.9	Confident	8 Å²	8	64.5 Å²	64.5	8%	0.082	35%	0.348	C	S	.	.	H	α-helix	trans	-61.8	-47.3	177.7	0	0	0	0	0	111.9	V439 S440 A445 L446 L447	V439-G443 PolarHBondContact O-N 3.41Å; S440-G443 PolarHBondContact O-N 2.83Å; G443-A445 PolarHBondContact O-N 3.43Å; G443-L446 PolarHBondContact O-N 2.87Å; G443-L447 WeakPolarHBondContact O-CB 3.23Å; G443-L447 WeakPolarHBondContact O-CG 3.31Å; G443-L447 PolarHBondContact O-N 3.42Å; G443-L447 VanDerWaalsContact O-N 3.08Å
444	S	84.8	Confident	85.2	Confident	31 Å²	31	67.5 Å²	67.5	22%	0.217	36%	0.36	C	S	.	.	H	α-helix	trans	-61.9	-43.1	175	-64.9	0	0	0	0	112	S440 L447 F448	S440-S444 VanDerWaalsContact O-CB 3.3Å; S440-S444 WeakPolarHBondContact O-CB 3.48Å; S440-S444 PolarHBondContact O-N 2.83Å; S440-S444 PolarHBondContact O-OG 3.47Å; S444-L447 PolarHBondContact O-N 2.74Å; S444-F448 WeakPolarHBondContact O-CB 3.44Å; S444-F448 VanDerWaalsContact O-CD2 3.3Å; S444-F448 WeakPolarHBondContact O-CD2 3.19Å; S444-F448 PolarHBondContact O-N 2.82Å
445	A	85.8	Confident	84.4	Confident	37 Å²	37	65.3 Å²	65.3	31%	0.306	35%	0.352	S	S	.	.	H	α-helix	trans	-62.6	-47.8	177.4	0	0	0	0	0	111.8	V441 L442 G443 L447 I449	V441-A445 VanDerWaalsContact O-CB 3.26Å; V441-A445 WeakPolarHBondContact O-CB 3.35Å; V441-A445 PolarHBondContact O-N 3.28Å; L442-A445 PolarHBondContact O-N 2.88Å; G443-A445 PolarHBondContact O-N 3.43Å; A445-L447 VanDerWaalsContact C-N 3.29Å; A445-L447 PolarHBondContact O-N 2.86Å; A445-I449 HydrophobicContact CB-CD1 3.92Å; A445-I449 WeakPolarHBondContact O-CB 3.47Å; A445-I449 VanDerWaalsContact O-CD1 3.29Å; A445-I449 WeakPolarHBondContact O-CD1 3.3Å; A445-I449 WeakPolarHBondContact O-CG1 3.39Å; A445-I449 PolarHBondContact O-N 2.81Å; A445-I449 VanDerWaalsContact O-N 3.07Å
446	L	84.9	Confident	83.6	Confident	131 Å²	131	67.2 Å²	67.2	69%	0.686	37%	0.367	S	S	*	.	H	α-helix	trans	-62	-35.8	-179.4	-75	168.2	0	0	0	112.7	L442 G443 P450	L442-L446 WeakPolarHBondContact O-CB 3.4Å; L442-L446 VanDerWaalsContact O-CG 3.27Å; L442-L446 WeakPolarHBondContact O-CG 3.27Å; L442-L446 PolarHBondContact O-N 3.33Å; G443-L446 PolarHBondContact O-N 2.87Å; L446-P450 WeakPolarHBondContact O-CD 3.39Å; L446-P450 VanDerWaalsContact O-CG 3.3Å; L446-P450 WeakPolarHBondContact O-CG 3.35Å
447	L	80.2	Confident	82.8	Confident	25 Å²	25	69.7 Å²	69.7	13%	0.131	39%	0.386	C	S	.	.	H	α-helix	trans	-85.8	-40.9	-176.8	-70.4	167.4	0	0	0	113.1	E302 Y303 G443 S444 A445 V451	E302-L447 HydrophobicContact CG-CD2 4.48Å; Y303-L447 HydrophobicContact CD2-CD1 3.75Å; Y303-L447 HydrophobicContact CG-CD1 4.38Å; G443-L447 WeakPolarHBondContact O-CB 3.23Å; G443-L447 WeakPolarHBondContact O-CG 3.31Å; G443-L447 PolarHBondContact O-N 3.42Å; G443-L447 VanDerWaalsContact O-N 3.08Å; S444-L447 PolarHBondContact O-N 2.74Å; A445-L447 VanDerWaalsContact C-N 3.29Å; A445-L447 PolarHBondContact O-N 2.86Å; L447-V451 WeakPolarHBondContact O-CG2 3.5Å
448	F	81.3	Confident	81.7	Confident	48 Å²	48	69.1 Å²	69.1	21%	0.211	38%	0.383	C	S	.	.	H	α-helix	trans	-88.6	-26.3	-175.2	-71.5	-75.6	0	0	0	114.3	I245 Y303 S444 V451 I452	I245-F448 HydrophobicContact CG2-CE1 4.38Å; Y303-F448 HydrophobicContact CD1-CZ 4.41Å; Y303-F448 AromaticContact CD2-CE2 3.99Å; Y303-F448 HydrophobicContact CD2-CE2 3.99Å; Y303-F448 HydrophobicContact CE1-CE2 4.47Å; Y303-F448 AromaticContact CE2-CE2 3.94Å; Y303-F448 HydrophobicContact CE2-CE2 3.94Å; Y303-F448 HydrophobicContact CG-CE2 4.28Å; Y303-F448 HydrophobicContact CG-CZ 4.41Å; S444-F448 WeakPolarHBondContact O-CB 3.44Å; S444-F448 VanDerWaalsContact O-CD2 3.3Å; S444-F448 WeakPolarHBondContact O-CD2 3.19Å; S444-F448 PolarHBondContact O-N 2.82Å; F448-V451 WeakPolarHBondContact O-CB 3.49Å; F448-V451 PolarHBondContact O-N 3.5Å; F448-I452 WeakPolarHBondContact O-CG1 3.43Å; F448-I452 PolarHBondContact O-N 3.42Å
449	I	83.3	Confident	80.1	Confident	107 Å²	107	71.2 Å²	71.2	55%	0.549	39%	0.393	S	S	.	.	H	α-helix	trans	-60.2	-46.7	178.2	-70.1	169.5	0	0	0	112.1	A445 V451 I452 H453	A445-I449 HydrophobicContact CB-CD1 3.92Å; A445-I449 WeakPolarHBondContact O-CB 3.47Å; A445-I449 VanDerWaalsContact O-CD1 3.29Å; A445-I449 WeakPolarHBondContact O-CD1 3.3Å; A445-I449 WeakPolarHBondContact O-CG1 3.39Å; A445-I449 PolarHBondContact O-N 2.81Å; A445-I449 VanDerWaalsContact O-N 3.07Å; I449-V451 VanDerWaalsContact C-N 3.27Å; I449-V451 PolarHBondContact O-N 3.32Å; I449-I452 PolarHBondContact O-N 3.35Å; I449-H453 WeakPolarHBondContact O-CB 3.32Å; I449-H453 PolarHBondContact O-N 2.95Å
450	P	81	Confident	78.5	Confident	63 Å²	63	70.8 Å²	70.8	41%	0.409	39%	0.391	S	S	.	.	H	α-helix	trans	-59.8	-36.9	176.7	-24.5	34.6	0	0	0	113	L446 K454	L446-P450 WeakPolarHBondContact O-CD 3.39Å; L446-P450 VanDerWaalsContact O-CG 3.3Å; L446-P450 WeakPolarHBondContact O-CG 3.35Å; P450-K454 VanDerWaalsContact O-CB 3.28Å; P450-K454 WeakPolarHBondContact O-CB 3.46Å; P450-K454 PolarHBondContact O-N 2.97Å
451	V	78.8	Confident	76.5	Confident	12 Å²	12	72.8 Å²	72.8	7%	0.073	40%	0.403	C	S	.	.	H	α-helix	trans	-65.1	-49.3	178.5	178.6	0	0	0	0	110.7	F163 F166 L299 L447 F448 I449 H453 K454 W455	F163-V451 HydrophobicContact CD1-CG2 4.25Å; F166-V451 HydrophobicContact CB-CG1 4.32Å; F166-V451 HydrophobicContact CD2-CG1 3.36Å; F166-V451 HydrophobicContact CE2-CG1 4.01Å; F166-V451 HydrophobicContact CG-CG1 4.16Å; L299-V451 HydrophobicContact CD2-CG2 3.55Å; L447-V451 WeakPolarHBondContact O-CG2 3.5Å; F448-V451 WeakPolarHBondContact O-CB 3.49Å; F448-V451 PolarHBondContact O-N 3.5Å; I449-V451 VanDerWaalsContact C-N 3.27Å; I449-V451 PolarHBondContact O-N 3.32Å; V451-H453 PolarHBondContact O-N 2.91Å; V451-K454 PolarHBondContact O-N 3.49Å; V451-W455 WeakPolarHBondContact O-CB 3.39Å; V451-W455 PolarHBondContact O-N 2.93Å
452	I	78.4	Confident	74	Confident	109 Å²	109	74.8 Å²	74.8	56%	0.559	42%	0.415	S	S	*	.	H	α-helix	trans	-63	-44.7	179.1	-65.6	165.7	0	0	0	110.4	F448 I449 W455 A456	F448-I452 WeakPolarHBondContact O-CG1 3.43Å; F448-I452 PolarHBondContact O-N 3.42Å; I449-I452 PolarHBondContact O-N 3.35Å; I452-W455 PolarHBondContact O-N 3.34Å; I452-A456 VanDerWaalsContact O-CB 3.31Å; I452-A456 WeakPolarHBondContact O-CB 3.19Å; I452-A456 PolarHBondContact O-N 2.94Å
453	H	81.5	Confident	71.8	Confident	137 Å²	137	77.5 Å²	77.5	63%	0.634	43%	0.425	S	S	*	.	H	α-helix	trans	-61.9	-45.7	177.5	-175.7	-81.1	0	0	0	111.4	I449 V451 A456 S457	I449-H453 WeakPolarHBondContact O-CB 3.32Å; I449-H453 PolarHBondContact O-N 2.95Å; V451-H453 PolarHBondContact O-N 2.91Å; H453-A456 PolarHBondContact O-N 2.81Å; H453-S457 WeakPolarHBondContact O-CB 3.5Å; H453-S457 PolarHBondContact O-N 3.31Å; H453-S457 PolarHBondContact O-OG 2.94Å
454	K	76.3	Confident	69.6	Low	83 Å²	83	86.3 Å²	86.3	36%	0.361	48%	0.481	S	S	.	.	H	α-helix	trans	-61.3	-48.3	178.3	-169.4	177.2	-177.8	-175.4	0	110.7	F163 P450 V451 A456 S457 I458	F163-K454 HydrophobicContact CD1-CB 4.43Å; F163-K454 HydrophobicContact CD1-CD 3.6Å; F163-K454 HydrophobicContact CD2-CD 3.64Å; F163-K454 HydrophobicContact CE1-CB 4.3Å; F163-K454 HydrophobicContact CE1-CD 3.5Å; F163-K454 HydrophobicContact CE2-CD 3.56Å; F163-K454 HydrophobicContact CG-CD 3.65Å; F163-K454 HydrophobicContact CZ-CD 3.48Å; F163-K454 VanDerWaalsContact CZ-CD 3.48Å; P450-K454 VanDerWaalsContact O-CB 3.28Å; P450-K454 WeakPolarHBondContact O-CB 3.46Å; P450-K454 PolarHBondContact O-N 2.97Å; V451-K454 PolarHBondContact O-N 3.49Å; K454-A456 PolarHBondContact O-N 3.39Å; K454-S457 WeakPolarHBondContact CA-OG 3.31Å; K454-S457 CarbonylContact O-C 3.59Å; K454-S457 PolarHBondContact O-N 2.97Å; K454-S457 VanDerWaalsContact O-N 3.1Å; K454-S457 PolarHBondContact O-OG 3.48Å; K454-I458 WeakPolarHBondContact O-CG1 3.25Å; K454-I458 PolarHBondContact O-N 2.95Å
455	W	74.4	Confident	68.8	Low	105 Å²	105	89.1 Å²	89.1	40%	0.398	50%	0.495	S	S	.	.	H	α-helix	trans	-60.4	-45.5	178.1	-174	9.9	0	0	0	112.3	F166 P237 V451 I452 S457 I458	F166-W455 HydrophobicContact CB-CB 4.42Å; F166-W455 HydrophobicContact CB-CD2 4.35Å; F166-W455 HydrophobicContact CB-CE3 4.42Å; F166-W455 HydrophobicContact CB-CG 4.39Å; F166-W455 AromaticContact CD1-CD2 3.57Å; F166-W455 HydrophobicContact CD1-CD2 3.57Å; F166-W455 AromaticContact CD1-CE2 3.95Å; F166-W455 AromaticContact CD1-CE3 3.13Å; F166-W455 HydrophobicContact CD1-CE3 3.13Å; F166-W455 HydrophobicContact CD1-CG 4.43Å; F166-W455 AromaticContact CD1-CH2 3.6Å; F166-W455 HydrophobicContact CD1-CH2 3.6Å; F166-W455 AromaticContact CD1-CZ2 3.97Å; F166-W455 HydrophobicContact CD1-CZ2 3.97Å; F166-W455 AromaticContact CD1-CZ3 3.19Å; F166-W455 HydrophobicContact CD1-CZ3 3.19Å; F166-W455 HydrophobicContact CD2-CE3 4.47Å; F166-W455 HydrophobicContact CE1-CD2 4.19Å; F166-W455 AromaticContact CE1-CE3 3.36Å; F166-W455 HydrophobicContact CE1-CE3 3.36Å; F166-W455 AromaticContact CE1-CH2 3.34Å; F166-W455 HydrophobicContact CE1-CH2 3.34Å; F166-W455 HydrophobicContact CE1-CZ2 4.16Å; F166-W455 AromaticContact CE1-CZ3 2.89Å; F166-W455 HydrophobicContact CE1-CZ3 2.89Å; F166-W455 HydrophobicContact CG-CD2 4.14Å; F166-W455 AromaticContact CG-CE3 3.76Å; F166-W455 HydrophobicContact CG-CE3 3.76Å; F166-W455 HydrophobicContact CG-CZ3 4.19Å; F166-W455 HydrophobicContact CZ-CE3 4.1Å; F166-W455 HydrophobicContact CZ-CH2 4.42Å; F166-W455 AromaticContact CZ-CZ3 3.68Å; F166-W455 HydrophobicContact CZ-CZ3 3.68Å; P237-W455 HydrophobicContact CG-CH2 3.57Å; P237-W455 HydrophobicContact CG-CZ2 3.69Å; P237-W455 HydrophobicContact CG-CZ3 4.44Å; V451-W455 WeakPolarHBondContact O-CB 3.39Å; V451-W455 PolarHBondContact O-N 2.93Å; I452-W455 PolarHBondContact O-N 3.34Å; W455-S457 PolarHBondContact O-N 3.38Å; W455-I458 WeakPolarHBondContact O-CB 3.47Å; W455-I458 PolarHBondContact O-N 3.36Å; W455-I458 VanDerWaalsContact O-N 3.09Å
456	A	75.1	Confident	67.9	Low	85 Å²	85	91.8 Å²	91.8	70%	0.702	51%	0.505	S	S	*	.	H	α-helix	trans	-62.3	-29.4	176.2	0	0	0	0	0	112.9	I452 H453 K454	I452-A456 VanDerWaalsContact O-CB 3.31Å; I452-A456 WeakPolarHBondContact O-CB 3.19Å; I452-A456 PolarHBondContact O-N 2.94Å; H453-A456 PolarHBondContact O-N 2.81Å; K454-A456 PolarHBondContact O-N 3.39Å
457	S	71.8	Confident	67	Low	65 Å²	65	89.7 Å²	89.7	46%	0.455	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.9	176.9	73.6	0	0	0	0	114.6	H453 K454 W455 I459	H453-S457 WeakPolarHBondContact O-CB 3.5Å; H453-S457 PolarHBondContact O-N 3.31Å; H453-S457 PolarHBondContact O-OG 2.94Å; K454-S457 WeakPolarHBondContact CA-OG 3.31Å; K454-S457 CarbonylContact O-C 3.59Å; K454-S457 PolarHBondContact O-N 2.97Å; K454-S457 VanDerWaalsContact O-N 3.1Å; K454-S457 PolarHBondContact O-OG 3.48Å; W455-S457 PolarHBondContact O-N 3.38Å; S457-I459 VanDerWaalsContact C-N 3.3Å; S457-I459 PolarHBondContact O-N 3.34Å
458	I	67.8	Low	66.2	Low	44 Å²	44	93.5 Å²	93.5	23%	0.226	52%	0.516	C	S	.	.			trans	-71.1	92.1	173.7	-61.2	171.9	0	0	0	107.8	L168 K454 W455 V460	L168-I458 HydrophobicContact CD1-CG2 4.27Å; K454-I458 WeakPolarHBondContact O-CG1 3.25Å; K454-I458 PolarHBondContact O-N 2.95Å; W455-I458 WeakPolarHBondContact O-CB 3.47Å; W455-I458 PolarHBondContact O-N 3.36Å; W455-I458 VanDerWaalsContact O-N 3.09Å; I458-V460 PolarHBondContact O-N 3.28Å
459	I	56.8	Low	65.3	Low	152 Å²	152	96.3 Å²	96.3	78%	0.779	54%	0.535	S	S	*	.			trans	-70.8	98.9	169.1	-55.8	174	0	0	0	106.5	S457 P461	S457-I459 VanDerWaalsContact C-N 3.3Å; S457-I459 PolarHBondContact O-N 3.34Å; I459-P461 WeakPolarHBondContact O-CD 3.19Å
460	V	56.8	Low	64.1	Low	40 Å²	40	95.6 Å²	95.6	24%	0.242	53%	0.534	C	S	.	.			trans	-65.9	118.6	159.7	178.1	0	0	0	0	105.6	V208 I458 T462	V208-V460 HydrophobicContact CG1-CG1 4.23Å; I458-V460 PolarHBondContact O-N 3.28Å; V460-T462 VanDerWaalsContact C-N 3.32Å; V460-T462 PolarHBondContact O-N 3.14Å
461	P	44.1	Very low	62.8	Low	64 Å²	64	97.9 Å²	97.9	42%	0.416	54%	0.543	S	S	.	.			trans	-64	103.5	168.8	3.3	8.7	0	0	0	106.4	I459 H463	I459-P461 WeakPolarHBondContact O-CD 3.19Å; P461-H463 PolarHBondContact O-N 3.35Å
462	T	37.2	Very low	61.6	Low	131 Å²	131	104.5 Å²	104.5	80%	0.804	58%	0.579	S	S	*	*			trans	-66.6	92.9	162.1	40.1	0	0	0	0	105.9	V460	V460-T462 VanDerWaalsContact C-N 3.32Å; V460-T462 PolarHBondContact O-N 3.14Å
463	H	43.1	Very low	60.2	Low	150 Å²	150	104.2 Å²	104.2	69%	0.694	58%	0.581	S	S	*	*			trans	-71.7	135.6	164.5	-79.4	-57	0	0	0	108.3	P461	P461-H463 PolarHBondContact O-N 3.35Å
464	P	37.8	Very low	58.3	Low	194 Å²	194	101.2 Å²	101.2	100%	1.26	58%	0.576	S	S	*	*			trans	-66.9	0	-174.9	28.5	-35.7	0	0	0	113.8

Retrieved 464 of 464 residues in 402.7 ms (Link to these results)

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