Q99PG9_MOUSE Loading...

Zinc finger 202 m1

AlphaFold DB , UniProt , Accession Q99PG9, Species MOUSE (Mus musculus, Mouse), Gene Zfp202, Length 641 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.2	Very low	38.5	Very low	243 Å²	243	150.3 Å²	150.3	100%	1.197	83%	0.83	S	S	*	*				0	151.9	0	-81.7	-176	168.1	0	0	108
2	A	32.8	Very low	37.8	Very low	94 Å²	94	148.8 Å²	148.8	78%	0.777	82%	0.819	S	S	*	*			trans	65.2	126.2	-171.1	0	0	0	0	0	113.9
3	T	34.9	Very low	37.1	Very low	142 Å²	142	156.7 Å²	156.7	87%	0.871	83%	0.829	S	S	*	*			cis	-151.2	156.4	-19.3	-26	0	0	0	0	108.4
4	A	51.1	Low	37.3	Very low	92 Å²	92	158.3 Å²	158.3	76%	0.76	83%	0.829	S	S	*	*			trans	-80.5	157.3	-177.7	0	0	0	0	0	113.6
5	L	33.6	Very low	37	Very low	177 Å²	177	160.6 Å²	160.6	93%	0.927	83%	0.834	S	S	*	*			trans	-137.6	160.8	157.7	-89	174.9	0	0	0	109.5
6	E	39.1	Very low	37	Very low	183 Å²	183	162.7 Å²	162.7	86%	0.855	84%	0.839	S	S	*	*			trans	-90.3	171.2	-162.8	-79	-86.3	98.8	0	0	114.2
7	P	64.6	Low	36.5	Very low	103 Å²	103	157.8 Å²	157.8	67%	0.669	84%	0.838	S	S	*	*			trans	-102.5	180	-167.4	41.3	-36.6	0	0	0	114.5
8	E	32.7	Very low	36.1	Very low	191 Å²	191	156.7 Å²	156.7	89%	0.893	84%	0.838	S	S	*	*			trans	-154.1	149.6	150.8	-113.6	167.1	-173.5	0	0	109.6
9	D	34.8	Very low	35.6	Very low	151 Å²	151	156.8 Å²	156.8	81%	0.807	84%	0.838	S	S	*	*			trans	-82.7	168.2	-172.9	-57.5	-77.9	0	0	0	112.5
10	Q	31.6	Very low	35.1	Very low	161 Å²	161	157.6 Å²	157.6	75%	0.752	84%	0.838	S	S	*	*				178.9	171.2	61.2	-132.1	-178.3	-70.7	0	0	112.2
11	D	28.2	Very low	34.7	Very low	116 Å²	116	155.8 Å²	155.8	62%	0.62	83%	0.833	S	S	*	*			trans	65.2	153.3	154.5	-63	-10	0	0	0	120.2
12	L	30	Very low	34.2	Very low	133 Å²	133	151.7 Å²	151.7	70%	0.696	81%	0.808	S	S	*	*			cis	-166	138.7	-33.7	-116.7	170.4	0	0	0	106.4
13	W	29.2	Very low	33.9	Very low	251 Å²	251	155.2 Å²	155.2	95%	0.951	81%	0.813	S	S	*	*			trans	-146	120.7	171.1	-70.7	95.7	0	0	0	111.8
14	E	39.3	Very low	33.9	Very low	179 Å²	179	154.7 Å²	154.7	84%	0.836	80%	0.801	S	S	*	*			trans	-105.6	139.9	161.8	-63.3	-179.6	126.6	0	0	108.3
15	E	33.8	Very low	33.6	Very low	193 Å²	193	157.4 Å²	157.4	90%	0.902	80%	0.803	S	S	*	*				-174.2	174.8	114	-104.2	-173.9	177.7	0	0	111.7
16	E	35.8	Very low	33.4	Very low	194 Å²	194	155.8 Å²	155.8	91%	0.907	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-73.9	148.2	-152.7	-55.2	-176	124.6	0	0	116
17	G	29.4	Very low	32.9	Very low	80 Å²	80	157.4 Å²	157.4	83%	0.825	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-95.8	130.5	-176.2	0	0	0	0	0	114.8
18	V	28.8	Very low	31.3	Very low	137 Å²	137	158.6 Å²	158.6	83%	0.83	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-85.7	123.5	169.2	177.5	0	0	0	0	110.4	M20	V18-M20 PolarHBondContact O-N 3.06Å
19	L	26.1	Very low	31.4	Very low	160 Å²	160	156.1 Å²	156.1	84%	0.838	81%	0.807	S	S	*	*			trans	-83.4	98.7	-179.8	-113.9	169.2	0	0	0	111.9	V21	L19-V21 HydrophobicContact CD2-CG2 4.43Å
20	M	26	Very low	31.1	Very low	171 Å²	171	151.7 Å²	151.7	84%	0.842	80%	0.797	S	S	*	*			trans	-76.9	127.7	164.9	-76.9	-78.8	-76.7	0	0	110.3	V18	V18-M20 PolarHBondContact O-N 3.06Å
21	V	26.3	Very low	32.1	Very low	120 Å²	120	150.4 Å²	150.4	73%	0.727	80%	0.803	S	S	*	*			trans	-125.8	118.7	164.7	179.6	0	0	0	0	108.9	L19	L19-V21 HydrophobicContact CD2-CG2 4.43Å
22	K	29.4	Very low	32.1	Very low	157 Å²	157	154.3 Å²	154.3	68%	0.683	82%	0.817	S	S	*	*			trans	-95.4	143.5	173.2	-168	-169.5	-170.2	-167.8	0	108.8	E24	K22-E24 HydrophobicContact CD-CG 4.09Å; K22-E24 VanDerWaalsContact CE-OE1 3.31Å; K22-E24 WeakPolarHBondContact CE-OE1 3.34Å; K22-E24 HydrophobicContact CG-CG 4.32Å; K22-E24 IonicContact NZ-OE1 2.6Å; K22-E24 PolarHBondContact NZ-OE1 2.84Å
23	L	27.3	Very low	32.2	Very low	169 Å²	169	153.3 Å²	153.3	89%	0.885	82%	0.822	S	S	*	*			trans	-141.4	138.2	161.3	-107.2	148.1	0	0	0	107.4
24	E	35.8	Very low	32.8	Very low	130 Å²	130	145.8 Å²	145.8	61%	0.607	81%	0.813	S	S	*	*			trans	-106.4	146.2	-165.1	-68.8	170.1	137.6	0	0	111.8	K22	K22-E24 HydrophobicContact CD-CG 4.09Å; K22-E24 VanDerWaalsContact CE-OE1 3.31Å; K22-E24 WeakPolarHBondContact CE-OE1 3.34Å; K22-E24 HydrophobicContact CG-CG 4.32Å; K22-E24 IonicContact NZ-OE1 2.6Å; K22-E24 PolarHBondContact NZ-OE1 2.84Å
25	D	43	Very low	32.5	Very low	150 Å²	150	145.9 Å²	145.9	80%	0.802	82%	0.818	S	S	*	*			trans	23.9	121	144.9	-51.1	-30.4	0	0	0	119.7
26	D	30.3	Very low	33.2	Very low	143 Å²	143	146.3 Å²	146.3	77%	0.765	82%	0.82	S	S	*	*				-162.8	120.1	123.3	-127.5	-20.3	0	0	0	110.9
27	F	29.2	Very low	33.2	Very low	216 Å²	216	140.2 Å²	140.2	95%	0.947	81%	0.81	S	S	*	*			trans	-161.8	120.8	150.9	-100.7	-61.8	0	0	0	110.9
28	T	29.5	Very low	34.1	Very low	128 Å²	128	141.5 Å²	141.5	79%	0.785	80%	0.797	S	S	*	*			trans	-85	149.8	-174.1	41	0	0	0	0	113
29	C	35.6	Very low	35.4	Very low	139 Å²	139	137.8 Å²	137.8	94%	0.939	77%	0.773	S	S	*	*			trans	-75.4	123.7	174	-175.3	0	0	0	0	110.8
30	G	27.8	Very low	36.8	Very low	58 Å²	58	134.6 Å²	134.6	60%	0.598	76%	0.762	S	S	*	*			trans	-135.7	137.7	172.7	0	0	0	0	0	110.7	E32	G30-E32 PolarHBondContact O-N 2.81Å
31	P	53.7	Low	38.3	Very low	134 Å²	134	130.6 Å²	130.6	87%	0.87	75%	0.747	S	S	*	*			trans	-91.5	100.6	-176.5	34	-31.9	0	0	0	111.7
32	E	29	Very low	39.9	Very low	198 Å²	198	126.6 Å²	126.6	93%	0.925	72%	0.721	S	S	*	*			trans	-117.1	144.1	167.3	-69.1	-158	132	0	0	112.4	G30	G30-E32 PolarHBondContact O-N 2.81Å
33	S	31.7	Very low	41.5	Very low	113 Å²	113	121.6 Å²	121.6	79%	0.79	70%	0.7	S	S	*	*			trans	-103.5	137.7	-169.8	56.1	0	0	0	0	112.5
34	A	40.2	Very low	43.4	Very low	93 Å²	93	117.1 Å²	117.1	77%	0.769	68%	0.68	S	S	*	*			trans	50	97.4	150.3	0	0	0	0	0	118
35	L	34.5	Very low	44.9	Very low	180 Å²	180	111.3 Å²	111.3	94%	0.942	65%	0.654	S	S	*	*				-133.6	143.7	129.4	-79.1	-176.9	0	0	0	109.5
36	E	47.8	Very low	46.4	Very low	202 Å²	202	105.3 Å²	105.3	94%	0.944	62%	0.621	S	S	*	*			trans	-82.4	143	168.3	-65.9	164.9	139.5	0	0	109
37	G	37	Very low	48.4	Very low	67 Å²	67	101.2 Å²	101.2	69%	0.691	60%	0.597	S	S	*	*			trans	160.3	138.9	179.2	0	0	0	0	0	112.1	D39	G37-D39 PolarHBondContact O-N 3.45Å
38	D	48.1	Very low	50.5	Low	106 Å²	106	94.3 Å²	94.3	57%	0.567	57%	0.57	S	S	*	*			trans	-35.9	118.4	-174.5	-67.8	-116.1	0	0	0	114.3	P40 R110	D38-P40 WeakPolarHBondContact O-CD 3.19Å; D38-R110 IonicContact OD1-CZ 2.82Å; D38-R110 IonicContact OD1-NH1 3.02Å; D38-R110 PolarHBondContact OD1-NH1 2.81Å
39	D	55.2	Low	52.9	Low	60 Å²	60	90.9 Å²	90.9	32%	0.321	55%	0.545	S	S	.	.			trans	-81.3	106.6	164.7	-179.1	-27.5	0	0	0	108.9	G37 V41 L42 R76	G37-D39 PolarHBondContact O-N 3.45Å; D39-V41 PolarHBondContact O-N 3.21Å; D39-V41 WeakPolarHBondContact OD1-CA 3.43Å; D39-V41 WeakPolarHBondContact OD1-CB 3.48Å; D39-V41 PolarHBondContact OD1-N 2.95Å; D39-L42 HydrophobicContact CB-CB 4.04Å; D39-L42 VanDerWaalsContact O-CB 3.29Å; D39-L42 WeakPolarHBondContact O-CB 3.47Å; D39-L42 PolarHBondContact O-N 3.02Å; D39-L42 VanDerWaalsContact O-N 3.1Å; D39-L42 PolarHBondContact OD1-N 2.67Å; D39-R76 IonicContact OD1-NH2 3.15Å; D39-R76 IonicContact OD2-CZ 3.51Å; D39-R76 IonicContact OD2-NH1 3.83Å; D39-R76 PolarHBondContact OD2-NH1 3.25Å; D39-R76 IonicContact OD2-NH2 2.71Å; D39-R76 PolarHBondContact OD2-NH2 2.82Å
40	P	56.1	Low	54.5	Low	92 Å²	92	88.4 Å²	88.4	60%	0.597	52%	0.515	S	S	*	.	H	α-helix	trans	-69.7	-20.2	-175.6	30.7	-36.5	0	0	0	112.6	D38 L42 T44	D38-P40 WeakPolarHBondContact O-CD 3.19Å; P40-L42 VanDerWaalsContact C-N 3.33Å; P40-T44 WeakPolarHBondContact O-CB 3.27Å; P40-T44 PolarHBondContact O-N 3.08Å; P40-T44 VanDerWaalsContact O-N 3.11Å; P40-T44 PolarHBondContact O-OG1 3.07Å
41	V	56.2	Low	56.7	Low	87 Å²	87	93 Å²	93	53%	0.527	52%	0.515	S	S	.	.	H	α-helix	trans	-70.1	-36.2	174.8	-168.8	0	0	0	0	109.6	D39 T44 S45	D39-V41 PolarHBondContact O-N 3.21Å; D39-V41 WeakPolarHBondContact OD1-CA 3.43Å; D39-V41 WeakPolarHBondContact OD1-CB 3.48Å; D39-V41 PolarHBondContact OD1-N 2.95Å; V41-T44 PolarHBondContact O-N 3.03Å; V41-S45 PolarHBondContact O-N 3.06Å; V41-S45 PolarHBondContact O-OG 3.06Å
42	L	59.8	Low	57.9	Low	37 Å²	37	88.4 Å²	88.4	19%	0.194	48%	0.481	C	S	.	.	H	α-helix	trans	-63	-50.9	177.9	-166.1	93.8	0	0	0	112.3	D39 P40 T44 S45 H46 W74 R76	D39-L42 HydrophobicContact CB-CB 4.04Å; D39-L42 VanDerWaalsContact O-CB 3.29Å; D39-L42 WeakPolarHBondContact O-CB 3.47Å; D39-L42 PolarHBondContact O-N 3.02Å; D39-L42 VanDerWaalsContact O-N 3.1Å; D39-L42 PolarHBondContact OD1-N 2.67Å; P40-L42 VanDerWaalsContact C-N 3.33Å; L42-T44 VanDerWaalsContact C-N 3.27Å; L42-T44 PolarHBondContact O-N 3.09Å; L42-S45 PolarHBondContact O-N 3.13Å; L42-H46 PolarHBondContact O-N 3.42Å; L42-W74 VanDerWaalsContact CD1-O 3.31Å; L42-W74 WeakPolarHBondContact CD1-O 3.24Å; L42-R76 HydrophobicContact CD1-CG 4.24Å
43	E	63.8	Low	60	Low	52 Å²	52	86.2 Å²	86.2	24%	0.243	46%	0.464	C	S	.	.	H	α-helix	trans	-63.7	-35.2	177	175.3	57.8	-159.9	0	0	111.1	H46 Q47	E43-H46 PolarHBondContact O-N 2.96Å; E43-H46 IonicContact OE2-ND1 2.71Å; E43-Q47 WeakPolarHBondContact O-CG 3.42Å; E43-Q47 PolarHBondContact O-N 3.32Å; E43-Q47 WeakPolarHBondContact OE1-CG 3.42Å; E43-Q47 PolarHBondContact OE1-NE2 3.41Å
44	T	66.7	Low	61.5	Low	75 Å²	75	87.7 Å²	87.7	46%	0.46	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-47.1	174.1	-58.4	0	0	0	0	111.4	P40 V41 L42 H46 Q47 N48	P40-T44 WeakPolarHBondContact O-CB 3.27Å; P40-T44 PolarHBondContact O-N 3.08Å; P40-T44 VanDerWaalsContact O-N 3.11Å; P40-T44 PolarHBondContact O-OG1 3.07Å; V41-T44 PolarHBondContact O-N 3.03Å; L42-T44 VanDerWaalsContact C-N 3.27Å; L42-T44 PolarHBondContact O-N 3.09Å; T44-H46 VanDerWaalsContact C-N 3.34Å; T44-H46 PolarHBondContact O-N 2.86Å; T44-Q47 PolarHBondContact O-N 3.11Å; T44-N48 WeakPolarHBondContact O-CB 3.45Å; T44-N48 PolarHBondContact O-N 3.02Å; T44-N48 PolarHBondContact O-ND2 3.26Å; T44-N48 PolarHBondContact O-OD1 3.49Å
45	S	68.4	Low	62.8	Low	8 Å²	8	91.1 Å²	91.1	6%	0.056	45%	0.454	C	S	.	.	H	α-helix	trans	-64	-36.1	174.6	-67.5	0	0	0	0	112.6	V41 L42 N48 F49 Q73	V41-S45 PolarHBondContact O-N 3.06Å; V41-S45 PolarHBondContact O-OG 3.06Å; L42-S45 PolarHBondContact O-N 3.13Å; S45-N48 PolarHBondContact O-N 3.17Å; S45-F49 WeakPolarHBondContact O-CB 3.21Å; S45-F49 PolarHBondContact O-N 2.72Å; S45-Q73 WeakPolarHBondContact OG-CB 3.28Å; S45-Q73 PolarHBondContact OG-OE1 3.12Å
46	H	74.7	Confident	64.4	Low	23 Å²	23	87 Å²	87	11%	0.106	43%	0.43	C	S	.	.	H	α-helix	trans	-64.2	-45.4	174.8	-168.7	-172.8	0	0	0	112.2	L42 E43 T44 F49 R50 W74 E92	L42-H46 PolarHBondContact O-N 3.42Å; E43-H46 PolarHBondContact O-N 2.96Å; E43-H46 IonicContact OE2-ND1 2.71Å; T44-H46 VanDerWaalsContact C-N 3.34Å; T44-H46 PolarHBondContact O-N 2.86Å; H46-F49 PolarHBondContact O-N 3.3Å; H46-R50 PolarHBondContact CE1-NH1 2.91Å; H46-R50 PolarHBondContact CE1-NH2 2.86Å; H46-R50 VanDerWaalsContact CE1-NH2 3.26Å; H46-R50 VanDerWaalsContact NE2-CZ 3.29Å; H46-R50 PolarHBondContact NE2-NE 3.4Å; H46-R50 PolarHBondContact NE2-NH2 3.4Å; H46-R50 WeakPolarHBondContact O-CG 3.39Å; H46-R50 PolarHBondContact O-N 2.89Å; H46-W74 VanDerWaalsContact CB-CD1 3.48Å; H46-W74 HydrophobicContact CB-CG 4.1Å; H46-W74 AromaticContact CD2-CD1 3.86Å; H46-W74 AromaticContact CD2-CD2 3.8Å; H46-W74 AromaticContact CD2-CE2 3.35Å; H46-W74 AromaticContact CD2-CZ2 3.69Å; H46-W74 AromaticContact CD2-NE1 3.36Å; H46-W74 PolarHBondContact CD2-NE1 2.8Å; H46-W74 AromaticContact CE1-CE2 3.89Å; H46-W74 AromaticContact CE1-CZ2 3.83Å; H46-W74 AromaticContact CE1-NE1 3.66Å; H46-W74 AromaticContact CG-CD1 3.61Å; H46-W74 AromaticContact CG-CE2 3.8Å; H46-W74 AromaticContact CG-NE1 3.28Å; H46-W74 VanDerWaalsContact CG-NE1 3.28Å; H46-W74 AromaticContact ND1-NE1 3.51Å; H46-W74 AromaticContact NE2-CE2 3.43Å; H46-W74 AromaticContact NE2-CZ2 3.28Å; H46-W74 VanDerWaalsContact NE2-CZ2 3.28Å; H46-W74 WeakPolarHBondContact NE2-CZ2 3.28Å; H46-W74 AromaticContact NE2-NE1 3.6Å; H46-E92 IonicContact CE1-OE2 2.71Å; H46-E92 PolarHBondContact CE1-OE2 3.03Å; H46-E92 IonicContact NE2-OE2 2.76Å; H46-E92 PolarHBondContact NE2-OE2 2.95Å
47	Q	70.6	Confident	65.4	Low	58 Å²	58	78 Å²	78	27%	0.271	39%	0.39	S	S	.	.	H	α-helix	trans	-66.1	-37.2	175.1	-71.5	-172.4	29.5	0	0	112.3	E43 T44 R50 R51	E43-Q47 WeakPolarHBondContact O-CG 3.42Å; E43-Q47 PolarHBondContact O-N 3.32Å; E43-Q47 WeakPolarHBondContact OE1-CG 3.42Å; E43-Q47 PolarHBondContact OE1-NE2 3.41Å; T44-Q47 PolarHBondContact O-N 3.11Å; Q47-R50 PolarHBondContact O-N 3.29Å; Q47-R51 VanDerWaalsContact O-CB 3.28Å; Q47-R51 WeakPolarHBondContact O-CB 3.33Å; Q47-R51 VanDerWaalsContact O-CG 3.26Å; Q47-R51 WeakPolarHBondContact O-CG 3.46Å; Q47-R51 PolarHBondContact O-N 3.16Å; Q47-R51 VanDerWaalsContact OE1-CZ 3.23Å
48	N	74.4	Confident	66.9	Low	71 Å²	71	80.5 Å²	80.5	38%	0.38	40%	0.397	S	S	.	.	H	α-helix	trans	-66.8	-42.3	176.2	-70.2	-13.4	0	0	0	111.5	T44 S45 R50 R51 F52 L70	T44-N48 WeakPolarHBondContact O-CB 3.45Å; T44-N48 PolarHBondContact O-N 3.02Å; T44-N48 PolarHBondContact O-ND2 3.26Å; T44-N48 PolarHBondContact O-OD1 3.49Å; S45-N48 PolarHBondContact O-N 3.17Å; N48-R50 PolarHBondContact O-N 3.08Å; N48-R51 PolarHBondContact O-N 3.07Å; N48-F52 PolarHBondContact O-N 3.12Å; N48-L70 HydrophobicContact CB-CD2 3.84Å
49	F	78.6	Confident	67.8	Low	56 Å²	56	77.7 Å²	77.7	25%	0.246	39%	0.385	C	S	.	.	H	α-helix	trans	-58	-47.6	171.8	179.5	-110.1	0	0	0	112.1	S45 H46 R51 L67 L70 C71 W74	S45-F49 WeakPolarHBondContact O-CB 3.21Å; S45-F49 PolarHBondContact O-N 2.72Å; H46-F49 PolarHBondContact O-N 3.3Å; F49-R51 VanDerWaalsContact C-N 3.3Å; F49-R51 PolarHBondContact O-N 3.43Å; F49-L67 HydrophobicContact CD2-CD2 4.14Å; F49-L67 HydrophobicContact CE2-CD2 3.75Å; F49-L70 HydrophobicContact CB-CB 4.11Å; F49-L70 HydrophobicContact CD2-CB 3.95Å; F49-C71 WeakPolarHBondContact CE2-SG 3.16Å; F49-C71 VanDerWaalsContact CZ-SG 3.59Å; F49-W74 AromaticContact CD1-CE3 3.91Å; F49-W74 HydrophobicContact CD1-CE3 3.91Å; F49-W74 HydrophobicContact CD1-CZ3 4.02Å; F49-W74 HydrophobicContact CE1-CE3 4.23Å; F49-W74 AromaticContact CE1-CZ3 3.96Å; F49-W74 HydrophobicContact CE1-CZ3 3.96Å; F49-W74 HydrophobicContact CG-CE3 4.48Å
50	R	70.9	Confident	68.3	Low	87 Å²	87	79.1 Å²	79.1	33%	0.328	40%	0.398	S	S	.	.	H	α-helix	trans	-65.4	-26.5	177	-76	170	165.9	158	-5.8	114.3	H46 Q47 N48 E92	H46-R50 PolarHBondContact CE1-NH1 2.91Å; H46-R50 PolarHBondContact CE1-NH2 2.86Å; H46-R50 VanDerWaalsContact CE1-NH2 3.26Å; H46-R50 VanDerWaalsContact NE2-CZ 3.29Å; H46-R50 PolarHBondContact NE2-NE 3.4Å; H46-R50 PolarHBondContact NE2-NH2 3.4Å; H46-R50 WeakPolarHBondContact O-CG 3.39Å; H46-R50 PolarHBondContact O-N 2.89Å; Q47-R50 PolarHBondContact O-N 3.29Å; N48-R50 PolarHBondContact O-N 3.08Å; R50-E92 IonicContact CZ-OE1 3.87Å; R50-E92 IonicContact CZ-OE2 2.85Å; R50-E92 VanDerWaalsContact CZ-OE2 3.25Å; R50-E92 IonicContact NE-OE1 3.18Å; R50-E92 PolarHBondContact NE-OE1 2.96Å; R50-E92 IonicContact NE-OE2 3.13Å; R50-E92 PolarHBondContact NE-OE2 3.35Å; R50-E92 IonicContact NH2-OE1 2.66Å; R50-E92 PolarHBondContact NH2-OE1 2.87Å; R50-E92 IonicContact NH2-OE2 3.9Å; R50-E92 PolarHBondContact NH2-OE2 3.25Å
51	R	73.9	Confident	68.8	Low	154 Å²	154	82.8 Å²	82.8	58%	0.581	40%	0.4	S	S	*	.	H	α-helix	trans	-94.9	-19	-176.6	-75.1	179.3	-176.6	130.5	9.7	114.1	Q47 N48 F49 R53	Q47-R51 VanDerWaalsContact O-CB 3.28Å; Q47-R51 WeakPolarHBondContact O-CB 3.33Å; Q47-R51 VanDerWaalsContact O-CG 3.26Å; Q47-R51 WeakPolarHBondContact O-CG 3.46Å; Q47-R51 PolarHBondContact O-N 3.16Å; Q47-R51 VanDerWaalsContact OE1-CZ 3.23Å; N48-R51 PolarHBondContact O-N 3.07Å; F49-R51 VanDerWaalsContact C-N 3.3Å; F49-R51 PolarHBondContact O-N 3.43Å; R51-R53 WeakPolarHBondContact O-CG 3.25Å; R51-R53 PolarHBondContact O-N 3.41Å
52	F	77.6	Confident	69.8	Low	38 Å²	38	81.4 Å²	81.4	17%	0.167	39%	0.388	C	S	.	.			trans	-49.6	126.4	-177.2	177.1	-94.1	0	0	0	112.4	N48 A57 A63 R66 L67 L70	N48-F52 PolarHBondContact O-N 3.12Å; F52-A57 HydrophobicContact CZ-CB 4.16Å; F52-A63 HydrophobicContact CE1-CB 4.35Å; F52-A63 HydrophobicContact CZ-CB 4.15Å; F52-R66 HydrophobicContact CE2-CB 3.94Å; F52-R66 HydrophobicContact CZ-CB 4.39Å; F52-L67 HydrophobicContact CB-CD2 4.45Å; F52-L67 HydrophobicContact CD1-CD1 4.21Å; F52-L67 HydrophobicContact CD1-CD2 3.55Å; F52-L67 HydrophobicContact CD1-CG 3.75Å; F52-L67 HydrophobicContact CE1-CD1 3.94Å; F52-L67 HydrophobicContact CE1-CD2 4.07Å; F52-L67 HydrophobicContact CE1-CG 3.71Å; F52-L67 HydrophobicContact CG-CD2 4.11Å; F52-L67 HydrophobicContact CG-CG 4.48Å; F52-L67 HydrophobicContact CZ-CG 4.43Å; F52-L70 HydrophobicContact CB-CD1 4.11Å; F52-L70 HydrophobicContact CD2-CD1 4.05Å; F52-L70 HydrophobicContact CG-CD1 4.29Å
53	R	73.1	Confident	70.5	Confident	152 Å²	152	80 Å²	80	57%	0.574	38%	0.381	S	S	*	.			trans	-110.1	140	176.4	-56.7	-178.8	175.6	-173	-0.9	110.2	R51 Q55 E56	R51-R53 WeakPolarHBondContact O-CG 3.25Å; R51-R53 PolarHBondContact O-N 3.41Å; R53-Q55 HydrophobicContact CB-CB 4.38Å; R53-Q55 PolarHBondContact O-N 2.79Å; R53-E56 HydrophobicContact CB-CG 4.21Å; R53-E56 WeakPolarHBondContact CB-OE1 3.49Å; R53-E56 WeakPolarHBondContact CG-OE1 3.38Å; R53-E56 PolarHBondContact N-OE2 3.19Å; R53-E56 VanDerWaalsContact O-CB 3.31Å; R53-E56 WeakPolarHBondContact O-CB 3.37Å; R53-E56 PolarHBondContact O-N 3.45Å
54	Y	64.7	Low	71	Confident	143 Å²	143	83.3 Å²	83.3	56%	0.561	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-53.6	-28.6	172.2	-177.5	-96.2	0	0	0	113.1	E56 A57 P60 A63	Y54-E56 PolarHBondContact O-N 2.8Å; Y54-A57 PolarHBondContact O-N 3.05Å; Y54-P60 WeakPolarHBondContact OH-CG 3.43Å; Y54-A63 HydrophobicContact CD2-CB 3.97Å; Y54-A63 HydrophobicContact CE2-CB 4.09Å
55	Q	67.1	Low	71.6	Confident	165 Å²	165	83.6 Å²	83.6	77%	0.771	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-64.4	-15.9	175.3	-66.7	163.2	-22	0	0	114.3	R53	R53-Q55 HydrophobicContact CB-CB 4.38Å; R53-Q55 PolarHBondContact O-N 2.79Å
56	E	67.2	Low	71.9	Confident	94 Å²	94	87.3 Å²	87.3	44%	0.439	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-89	-3	-180	-64.8	151.7	-165.8	0	0	112.6	R53 Y54 R66	R53-E56 HydrophobicContact CB-CG 4.21Å; R53-E56 WeakPolarHBondContact CB-OE1 3.49Å; R53-E56 WeakPolarHBondContact CG-OE1 3.38Å; R53-E56 PolarHBondContact N-OE2 3.19Å; R53-E56 VanDerWaalsContact O-CB 3.31Å; R53-E56 WeakPolarHBondContact O-CB 3.37Å; R53-E56 PolarHBondContact O-N 3.45Å; Y54-E56 PolarHBondContact O-N 2.8Å; E56-R66 PolarHBondContact O-NH1 2.85Å
57	A	69.6	Low	72.1	Confident	13 Å²	13	89 Å²	89	11%	0.107	42%	0.42	C	S	.	.	S	Bend	trans	-118.5	131.5	-177.4	0	0	0	0	0	112.3	F52 Y54 S59 E62 A63	F52-A57 HydrophobicContact CZ-CB 4.16Å; Y54-A57 PolarHBondContact O-N 3.05Å; A57-S59 PolarHBondContact O-N 2.89Å; A57-E62 HydrophobicContact CB-CB 4.21Å; A57-E62 HydrophobicContact CB-CG 4.01Å; A57-A63 HydrophobicContact CB-CB 3.72Å
58	S	69.1	Low	72.5	Confident	120 Å²	120	94.4 Å²	94.4	84%	0.839	44%	0.438	S	S	*	.	S	Bend	trans	-71.1	-11	-176.8	-42.6	0	0	0	0	114.5
59	S	67.1	Low	72.8	Confident	46 Å²	46	96 Å²	96	32%	0.322	44%	0.443	S	S	.	.	S	Bend	trans	-159.6	164.2	178.5	73.9	0	0	0	0	112.2	A57 R61 E62 A63	A57-S59 PolarHBondContact O-N 2.89Å; S59-R61 VanDerWaalsContact C-N 3.27Å; S59-R61 PolarHBondContact O-N 3.06Å; S59-R61 PolarHBondContact OG-N 2.99Å; S59-E62 WeakPolarHBondContact O-CB 3.35Å; S59-E62 PolarHBondContact O-N 3.31Å; S59-E62 WeakPolarHBondContact OG-CB 3.48Å; S59-E62 PolarHBondContact OG-N 3.2Å; S59-E62 VanDerWaalsContact OG-N 3.07Å; S59-A63 PolarHBondContact O-N 3.42Å
60	P	65.6	Low	72.8	Confident	90 Å²	90	94.4 Å²	94.4	58%	0.584	44%	0.437	S	S	*	.	H	α-helix	trans	-58.9	-34.4	172.2	-22	30.6	0	0	0	113.9	Y54 L64	Y54-P60 WeakPolarHBondContact OH-CG 3.43Å; P60-L64 PolarHBondContact O-N 3.4Å; P60-L64 VanDerWaalsContact O-N 3.1Å
61	R	66.4	Low	73.2	Confident	169 Å²	169	91.9 Å²	91.9	64%	0.638	43%	0.432	S	S	*	.	H	α-helix	trans	-67.9	-44.2	175.9	-97.4	-176.6	176.4	-107.8	2.8	111.2	S59 A63 L64 I65 D241	S59-R61 VanDerWaalsContact C-N 3.27Å; S59-R61 PolarHBondContact O-N 3.06Å; S59-R61 PolarHBondContact OG-N 2.99Å; R61-A63 VanDerWaalsContact C-N 3.31Å; R61-A63 PolarHBondContact O-N 3.12Å; R61-L64 PolarHBondContact O-N 3.18Å; R61-I65 VanDerWaalsContact O-CG1 3.28Å; R61-I65 WeakPolarHBondContact O-CG1 3.46Å; R61-I65 PolarHBondContact O-N 2.96Å; R61-D241 PolarHBondContact NH2-O 3.41Å
62	E	75.6	Confident	73.5	Confident	59 Å²	59	88.1 Å²	88.1	28%	0.276	42%	0.421	S	S	.	.	H	α-helix	trans	-60.4	-42.2	175.7	-177.1	66.7	-176.6	0	0	111.2	A57 S59 L64 I65 R66	A57-E62 HydrophobicContact CB-CB 4.21Å; A57-E62 HydrophobicContact CB-CG 4.01Å; S59-E62 WeakPolarHBondContact O-CB 3.35Å; S59-E62 PolarHBondContact O-N 3.31Å; S59-E62 WeakPolarHBondContact OG-CB 3.48Å; S59-E62 PolarHBondContact OG-N 3.2Å; S59-E62 VanDerWaalsContact OG-N 3.07Å; E62-L64 PolarHBondContact O-N 3.43Å; E62-I65 PolarHBondContact O-N 3.31Å; E62-R66 WeakPolarHBondContact O-CG 3.33Å; E62-R66 PolarHBondContact O-N 3.21Å; E62-R66 IonicContact OE1-CZ 3.76Å; E62-R66 IonicContact OE1-NE 3.24Å; E62-R66 PolarHBondContact OE1-NE 2.87Å; E62-R66 IonicContact OE1-NH2 2.71Å; E62-R66 PolarHBondContact OE1-NH2 3.12Å
63	A	76.3	Confident	73.6	Confident	6 Å²	6	90.9 Å²	90.9	5%	0.05	44%	0.435	C	S	.	.	H	α-helix	trans	-61.4	-44.2	176.6	0	0	0	0	0	112	F52 Y54 A57 S59 R61 L67	F52-A63 HydrophobicContact CE1-CB 4.35Å; F52-A63 HydrophobicContact CZ-CB 4.15Å; Y54-A63 HydrophobicContact CD2-CB 3.97Å; Y54-A63 HydrophobicContact CE2-CB 4.09Å; A57-A63 HydrophobicContact CB-CB 3.72Å; S59-A63 PolarHBondContact O-N 3.42Å; R61-A63 VanDerWaalsContact C-N 3.31Å; R61-A63 PolarHBondContact O-N 3.12Å; A63-L67 VanDerWaalsContact O-CB 3.3Å; A63-L67 WeakPolarHBondContact O-CB 3.16Å; A63-L67 WeakPolarHBondContact O-CD1 3.33Å; A63-L67 VanDerWaalsContact O-CG 3.28Å; A63-L67 WeakPolarHBondContact O-CG 3.47Å; A63-L67 PolarHBondContact O-N 2.76Å
64	L	74.3	Confident	74	Confident	122 Å²	122	84 Å²	84	64%	0.639	41%	0.409	S	S	*	.	H	α-helix	trans	-66.2	-39	177.8	-177.4	61.8	0	0	0	112.5	P60 R61 E62 R68	P60-L64 PolarHBondContact O-N 3.4Å; P60-L64 VanDerWaalsContact O-N 3.1Å; R61-L64 PolarHBondContact O-N 3.18Å; E62-L64 PolarHBondContact O-N 3.43Å; L64-R68 WeakPolarHBondContact O-CB 3.38Å; L64-R68 PolarHBondContact O-N 3.31Å
65	I	78.9	Confident	74.7	Confident	81 Å²	81	78.2 Å²	78.2	42%	0.415	39%	0.387	S	S	.	.	H	α-helix	trans	-64.2	-52.1	177.2	-69.6	163.7	0	0	0	110.1	R61 E62 L67 R68 E69	R61-I65 VanDerWaalsContact O-CG1 3.28Å; R61-I65 WeakPolarHBondContact O-CG1 3.46Å; R61-I65 PolarHBondContact O-N 2.96Å; E62-I65 PolarHBondContact O-N 3.31Å; I65-L67 PolarHBondContact O-N 2.81Å; I65-R68 WeakPolarHBondContact O-CB 3.46Å; I65-R68 PolarHBondContact O-N 2.93Å; I65-R68 VanDerWaalsContact O-N 3.1Å; I65-E69 WeakPolarHBondContact O-CG 3.4Å; I65-E69 PolarHBondContact O-N 2.72Å
66	R	74.4	Confident	75.2	Confident	87 Å²	87	72.6 Å²	72.6	33%	0.328	36%	0.359	S	S	.	.	H	α-helix	trans	-62.7	-40	178.8	-68.2	-174.2	-171.9	-178.5	8.8	112.9	F52 E56 E62 R68 E69 L70	F52-R66 HydrophobicContact CE2-CB 3.94Å; F52-R66 HydrophobicContact CZ-CB 4.39Å; E56-R66 PolarHBondContact O-NH1 2.85Å; E62-R66 WeakPolarHBondContact O-CG 3.33Å; E62-R66 PolarHBondContact O-N 3.21Å; E62-R66 IonicContact OE1-CZ 3.76Å; E62-R66 IonicContact OE1-NE 3.24Å; E62-R66 PolarHBondContact OE1-NE 2.87Å; E62-R66 IonicContact OE1-NH2 2.71Å; E62-R66 PolarHBondContact OE1-NH2 3.12Å; R66-R68 VanDerWaalsContact C-N 3.33Å; R66-R68 PolarHBondContact O-N 3.3Å; R66-E69 PolarHBondContact O-N 3.17Å; R66-L70 WeakPolarHBondContact O-CB 3.33Å; R66-L70 VanDerWaalsContact O-CG 3.29Å; R66-L70 WeakPolarHBondContact O-CG 3.5Å; R66-L70 PolarHBondContact O-N 2.98Å
67	L	78.3	Confident	75.6	Confident	58 Å²	58	70.9 Å²	70.9	30%	0.304	36%	0.356	S	S	.	.	H	α-helix	trans	-61.7	-40.9	173.4	-79.6	167.2	0	0	0	111.7	F49 F52 A63 I65 C71	F49-L67 HydrophobicContact CD2-CD2 4.14Å; F49-L67 HydrophobicContact CE2-CD2 3.75Å; F52-L67 HydrophobicContact CB-CD2 4.45Å; F52-L67 HydrophobicContact CD1-CD1 4.21Å; F52-L67 HydrophobicContact CD1-CD2 3.55Å; F52-L67 HydrophobicContact CD1-CG 3.75Å; F52-L67 HydrophobicContact CE1-CD1 3.94Å; F52-L67 HydrophobicContact CE1-CD2 4.07Å; F52-L67 HydrophobicContact CE1-CG 3.71Å; F52-L67 HydrophobicContact CG-CD2 4.11Å; F52-L67 HydrophobicContact CG-CG 4.48Å; F52-L67 HydrophobicContact CZ-CG 4.43Å; A63-L67 VanDerWaalsContact O-CB 3.3Å; A63-L67 WeakPolarHBondContact O-CB 3.16Å; A63-L67 WeakPolarHBondContact O-CD1 3.33Å; A63-L67 VanDerWaalsContact O-CG 3.28Å; A63-L67 WeakPolarHBondContact O-CG 3.47Å; A63-L67 PolarHBondContact O-N 2.76Å; I65-L67 PolarHBondContact O-N 2.81Å; L67-C71 WeakPolarHBondContact O-CB 3.23Å; L67-C71 PolarHBondContact O-N 3.07Å; L67-C71 PolarHBondContact O-SG 3.32Å
68	R	78.6	Confident	76.1	Confident	172 Å²	172	76.9 Å²	76.9	65%	0.649	38%	0.382	S	S	*	.	H	α-helix	trans	-63	-44.9	175.2	-178.4	180	174.8	179.6	-0.4	111.4	L64 I65 R66 C71 H72	L64-R68 WeakPolarHBondContact O-CB 3.38Å; L64-R68 PolarHBondContact O-N 3.31Å; I65-R68 WeakPolarHBondContact O-CB 3.46Å; I65-R68 PolarHBondContact O-N 2.93Å; I65-R68 VanDerWaalsContact O-N 3.1Å; R66-R68 VanDerWaalsContact C-N 3.33Å; R66-R68 PolarHBondContact O-N 3.3Å; R68-C71 WeakPolarHBondContact O-CB 3.39Å; R68-C71 PolarHBondContact O-N 2.91Å; R68-H72 PolarHBondContact O-N 3.03Å; R68-H72 PolarHBondContact O-ND1 3.16Å
69	E	80.6	Confident	76.3	Confident	103 Å²	103	80.8 Å²	80.8	48%	0.481	38%	0.378	S	S	.	.	H	α-helix	trans	-63.3	-48	178.4	-71.5	169.7	175.1	0	0	112	I65 R66 C71 H72 Q73	I65-E69 WeakPolarHBondContact O-CG 3.4Å; I65-E69 PolarHBondContact O-N 2.72Å; R66-E69 PolarHBondContact O-N 3.17Å; E69-C71 VanDerWaalsContact C-N 3.32Å; E69-C71 PolarHBondContact O-N 3.11Å; E69-H72 PolarHBondContact O-N 2.8Å; E69-H72 VanDerWaalsContact O-N 3.08Å; E69-Q73 WeakPolarHBondContact O-CG 3.49Å; E69-Q73 PolarHBondContact O-N 3.09Å
70	L	79.8	Confident	76.8	Confident	24 Å²	24	81.4 Å²	81.4	13%	0.126	37%	0.374	C	S	.	.	H	α-helix	trans	-60.4	-40.3	175.7	-71.2	169.2	0	0	0	111.8	N48 F49 F52 R66 Q73 W74	N48-L70 HydrophobicContact CB-CD2 3.84Å; F49-L70 HydrophobicContact CB-CB 4.11Å; F49-L70 HydrophobicContact CD2-CB 3.95Å; F52-L70 HydrophobicContact CB-CD1 4.11Å; F52-L70 HydrophobicContact CD2-CD1 4.05Å; F52-L70 HydrophobicContact CG-CD1 4.29Å; R66-L70 WeakPolarHBondContact O-CB 3.33Å; R66-L70 VanDerWaalsContact O-CG 3.29Å; R66-L70 WeakPolarHBondContact O-CG 3.5Å; R66-L70 PolarHBondContact O-N 2.98Å; L70-Q73 PolarHBondContact O-N 3Å; L70-W74 WeakPolarHBondContact O-CB 3.04Å; L70-W74 PolarHBondContact O-N 3.43Å
71	C	79.6	Confident	77.5	Confident	34 Å²	34	80.4 Å²	80.4	23%	0.23	37%	0.366	C	S	.	.	H	α-helix	trans	-58.8	-44.1	170.5	-86.2	0	0	0	0	112.9	F49 L67 R68 E69 L75	F49-C71 WeakPolarHBondContact CE2-SG 3.16Å; F49-C71 VanDerWaalsContact CZ-SG 3.59Å; L67-C71 WeakPolarHBondContact O-CB 3.23Å; L67-C71 PolarHBondContact O-N 3.07Å; L67-C71 PolarHBondContact O-SG 3.32Å; R68-C71 WeakPolarHBondContact O-CB 3.39Å; R68-C71 PolarHBondContact O-N 2.91Å; E69-C71 VanDerWaalsContact C-N 3.32Å; E69-C71 PolarHBondContact O-N 3.11Å; C71-L75 VanDerWaalsContact O-CB 3.27Å; C71-L75 WeakPolarHBondContact O-CB 3.49Å; C71-L75 WeakPolarHBondContact O-CG 3.38Å; C71-L75 PolarHBondContact O-N 3.01Å
72	H	78.7	Confident	77.9	Confident	75 Å²	75	80.2 Å²	80.2	35%	0.347	37%	0.37	S	S	.	.	H	α-helix	trans	-68.6	-40.8	179.4	-74.1	61.1	0	0	0	111.2	R68 E69 W74 R76	R68-H72 PolarHBondContact O-N 3.03Å; R68-H72 PolarHBondContact O-ND1 3.16Å; E69-H72 PolarHBondContact O-N 2.8Å; E69-H72 VanDerWaalsContact O-N 3.08Å; H72-W74 PolarHBondContact O-N 3.29Å; H72-R76 VanDerWaalsContact O-CA 3.25Å; H72-R76 WeakPolarHBondContact O-CA 3.41Å; H72-R76 PolarHBondContact O-N 2.89Å
73	Q	80.1	Confident	77.8	Confident	96 Å²	96	83.4 Å²	83.4	45%	0.449	39%	0.385	S	S	.	.	H	α-helix	trans	-64	-37.7	177	-67.2	174.5	16.2	0	0	113.3	S45 E69 L70 R76	S45-Q73 WeakPolarHBondContact OG-CB 3.28Å; S45-Q73 PolarHBondContact OG-OE1 3.12Å; E69-Q73 WeakPolarHBondContact O-CG 3.49Å; E69-Q73 PolarHBondContact O-N 3.09Å; L70-Q73 PolarHBondContact O-N 3Å; Q73-R76 VanDerWaalsContact O-CG 3.26Å; Q73-R76 WeakPolarHBondContact O-CG 3.31Å; Q73-R76 PolarHBondContact O-NE 3.4Å
74	W	80.9	Confident	77.7	Confident	7 Å²	7	88 Å²	88	3%	0.027	41%	0.405	C	S	.	.	H	α-helix	trans	-75.2	-52.2	176.4	170.2	43.6	0	0	0	112.5	L42 H46 F49 L70 H72 R80 L89 E92	L42-W74 VanDerWaalsContact CD1-O 3.31Å; L42-W74 WeakPolarHBondContact CD1-O 3.24Å; H46-W74 VanDerWaalsContact CB-CD1 3.48Å; H46-W74 HydrophobicContact CB-CG 4.1Å; H46-W74 AromaticContact CD2-CD1 3.86Å; H46-W74 AromaticContact CD2-CD2 3.8Å; H46-W74 AromaticContact CD2-CE2 3.35Å; H46-W74 AromaticContact CD2-CZ2 3.69Å; H46-W74 AromaticContact CD2-NE1 3.36Å; H46-W74 PolarHBondContact CD2-NE1 2.8Å; H46-W74 AromaticContact CE1-CE2 3.89Å; H46-W74 AromaticContact CE1-CZ2 3.83Å; H46-W74 AromaticContact CE1-NE1 3.66Å; H46-W74 AromaticContact CG-CD1 3.61Å; H46-W74 AromaticContact CG-CE2 3.8Å; H46-W74 AromaticContact CG-NE1 3.28Å; H46-W74 VanDerWaalsContact CG-NE1 3.28Å; H46-W74 AromaticContact ND1-NE1 3.51Å; H46-W74 AromaticContact NE2-CE2 3.43Å; H46-W74 AromaticContact NE2-CZ2 3.28Å; H46-W74 VanDerWaalsContact NE2-CZ2 3.28Å; H46-W74 WeakPolarHBondContact NE2-CZ2 3.28Å; H46-W74 AromaticContact NE2-NE1 3.6Å; F49-W74 AromaticContact CD1-CE3 3.91Å; F49-W74 HydrophobicContact CD1-CE3 3.91Å; F49-W74 HydrophobicContact CD1-CZ3 4.02Å; F49-W74 HydrophobicContact CE1-CE3 4.23Å; F49-W74 AromaticContact CE1-CZ3 3.96Å; F49-W74 HydrophobicContact CE1-CZ3 3.96Å; F49-W74 HydrophobicContact CG-CE3 4.48Å; L70-W74 WeakPolarHBondContact O-CB 3.04Å; L70-W74 PolarHBondContact O-N 3.43Å; H72-W74 PolarHBondContact O-N 3.29Å; W74-R80 PolarHBondContact O-NH1 2.83Å; W74-L89 HydrophobicContact CH2-CD2 3.95Å; W74-L89 HydrophobicContact CZ3-CD2 3.96Å; W74-E92 HydrophobicContact CH2-CB 4.14Å; W74-E92 HydrophobicContact CH2-CG 4.31Å
75	L	79.5	Confident	78	Confident	21 Å²	21	83.6 Å²	83.6	11%	0.11	38%	0.382	C	S	.	.	H	α-helix	trans	-80.8	-25.1	-172.8	-61.6	174	0	0	0	113	C71 R80 I85 L88 L89	C71-L75 VanDerWaalsContact O-CB 3.27Å; C71-L75 WeakPolarHBondContact O-CB 3.49Å; C71-L75 WeakPolarHBondContact O-CG 3.38Å; C71-L75 PolarHBondContact O-N 3.01Å; L75-R80 WeakPolarHBondContact O-CD 3.37Å; L75-R80 PolarHBondContact O-NH1 3.04Å; L75-I85 HydrophobicContact CB-CG2 4.46Å; L75-I85 HydrophobicContact CD1-CG2 4.19Å; L75-I85 HydrophobicContact CD2-CG2 4.37Å; L75-L88 HydrophobicContact CD2-CB 4.36Å; L75-L89 HydrophobicContact CD1-CD2 4.3Å; L75-L89 HydrophobicContact CD2-CD2 4.34Å; L75-L89 HydrophobicContact CD2-CG 4.38Å
76	R	78.9	Confident	78.1	Confident	47 Å²	47	84.7 Å²	84.7	18%	0.177	39%	0.388	C	S	.	.			trans	43.8	64.1	-179.7	-59.4	-169.8	-175.5	168.3	0.9	112.8	D39 L42 H72 Q73 E78 R79 R80	D39-R76 IonicContact OD1-NH2 3.15Å; D39-R76 IonicContact OD2-CZ 3.51Å; D39-R76 IonicContact OD2-NH1 3.83Å; D39-R76 PolarHBondContact OD2-NH1 3.25Å; D39-R76 IonicContact OD2-NH2 2.71Å; D39-R76 PolarHBondContact OD2-NH2 2.82Å; L42-R76 HydrophobicContact CD1-CG 4.24Å; H72-R76 VanDerWaalsContact O-CA 3.25Å; H72-R76 WeakPolarHBondContact O-CA 3.41Å; H72-R76 PolarHBondContact O-N 2.89Å; Q73-R76 VanDerWaalsContact O-CG 3.26Å; Q73-R76 WeakPolarHBondContact O-CG 3.31Å; Q73-R76 PolarHBondContact O-NE 3.4Å; R76-E78 WeakPolarHBondContact CA-OE2 3.29Å; R76-E78 PolarHBondContact O-N 3.08Å; R76-R79 HydrophobicContact CB-CB 4.45Å; R76-R79 PolarHBondContact O-N 2.8Å; R76-R80 PolarHBondContact O-N 3.37Å
77	P	75.9	Confident	78.3	Confident	59 Å²	59	85 Å²	85	38%	0.383	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-11.7	-176.7	27.9	-35.1	0	0	0	114	R79 I85	P77-R79 VanDerWaalsContact C-N 3.32Å; P77-I85 HydrophobicContact CB-CD1 4.03Å
78	E	80.1	Confident	78.4	Confident	138 Å²	138	83.6 Å²	83.6	65%	0.645	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-16.6	173.2	-45	73.1	-160.2	0	0	112.6	R76	R76-E78 WeakPolarHBondContact CA-OE2 3.29Å; R76-E78 PolarHBondContact O-N 3.08Å
79	R	72.6	Confident	78.6	Confident	202 Å²	202	78.9 Å²	78.9	76%	0.762	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.3	-11.5	-176.2	-63.5	-168.5	-177.6	-165.5	2.2	114.8	R76 P77	R76-R79 HydrophobicContact CB-CB 4.45Å; R76-R79 PolarHBondContact O-N 2.8Å; P77-R79 VanDerWaalsContact C-N 3.32Å
80	R	77.5	Confident	78.6	Confident	60 Å²	60	77.9 Å²	77.9	23%	0.226	37%	0.374	C	S	.	.	S	Bend	trans	-118.4	145	-176.8	-66.7	-163.6	178.7	108.1	-8.6	112.5	W74 L75 R76 Q84 I85 L88	W74-R80 PolarHBondContact O-NH1 2.83Å; L75-R80 WeakPolarHBondContact O-CD 3.37Å; L75-R80 PolarHBondContact O-NH1 3.04Å; R76-R80 PolarHBondContact O-N 3.37Å; R80-Q84 HydrophobicContact CB-CB 4.17Å; R80-I85 HydrophobicContact CB-CD1 4.28Å; R80-I85 HydrophobicContact CB-CG1 3.8Å; R80-L88 VanDerWaalsContact CZ-CD1 3.49Å
81	T	79.6	Confident	78.6	Confident	69 Å²	69	77.3 Å²	77.3	42%	0.423	37%	0.371	S	S	.	.			trans	-72	163	171.1	83.4	0	0	0	0	111	E83 Q84 I85	T81-E83 WeakPolarHBondContact CB-OE2 3.44Å; T81-E83 PolarHBondContact O-N 3.23Å; T81-E83 PolarHBondContact OG1-N 3.06Å; T81-E83 PolarHBondContact OG1-OE2 3.43Å; T81-Q84 PolarHBondContact O-N 3.1Å; T81-Q84 VanDerWaalsContact O-N 3.16Å; T81-Q84 PolarHBondContact OG1-N 2.97Å; T81-I85 WeakPolarHBondContact O-CG1 3.41Å; T81-I85 PolarHBondContact O-N 2.74Å
82	K	74.6	Confident	78.8	Confident	165 Å²	165	77.1 Å²	77.1	72%	0.717	37%	0.367	S	S	*	.	H	α-helix	trans	-60.7	-34.4	179.6	-66.3	-175.5	178.4	-177.1	0	111.7	I85 L86	K82-I85 PolarHBondContact O-N 3.3Å; K82-L86 WeakPolarHBondContact O-CB 3.33Å; K82-L86 VanDerWaalsContact O-CG 3.26Å; K82-L86 WeakPolarHBondContact O-CG 3.34Å; K82-L86 PolarHBondContact O-N 2.87Å
83	E	75	Confident	78.9	Confident	126 Å²	126	79.2 Å²	79.2	59%	0.589	38%	0.376	S	S	*	.	H	α-helix	trans	-64.8	-47.8	176	-57.8	69.4	-152.1	0	0	110.8	T81 I85 L86 E87	T81-E83 WeakPolarHBondContact CB-OE2 3.44Å; T81-E83 PolarHBondContact O-N 3.23Å; T81-E83 PolarHBondContact OG1-N 3.06Å; T81-E83 PolarHBondContact OG1-OE2 3.43Å; E83-I85 VanDerWaalsContact C-N 3.34Å; E83-I85 PolarHBondContact O-N 3.28Å; E83-L86 PolarHBondContact O-N 2.78Å; E83-E87 PolarHBondContact O-N 3.11Å
84	Q	73.5	Confident	78.8	Confident	102 Å²	102	77.4 Å²	77.4	48%	0.477	37%	0.367	S	S	.	.	H	α-helix	trans	-64.1	-36.6	177.4	-67.9	171.5	-35.6	0	0	112.7	R80 T81 L88	R80-Q84 HydrophobicContact CB-CB 4.17Å; T81-Q84 PolarHBondContact O-N 3.1Å; T81-Q84 VanDerWaalsContact O-N 3.16Å; T81-Q84 PolarHBondContact OG1-N 2.97Å; Q84-L88 WeakPolarHBondContact O-CG 3.34Å; Q84-L88 PolarHBondContact O-N 3.33Å; Q84-L88 VanDerWaalsContact O-N 3.16Å
85	I	81.1	Confident	78.6	Confident	29 Å²	29	77.5 Å²	77.5	15%	0.149	37%	0.368	C	S	.	.	H	α-helix	trans	-66.4	-41.3	174.6	-64.6	163.9	0	0	0	110.6	L75 P77 R80 T81 K82 E83 L88 L89	L75-I85 HydrophobicContact CB-CG2 4.46Å; L75-I85 HydrophobicContact CD1-CG2 4.19Å; L75-I85 HydrophobicContact CD2-CG2 4.37Å; P77-I85 HydrophobicContact CB-CD1 4.03Å; R80-I85 HydrophobicContact CB-CD1 4.28Å; R80-I85 HydrophobicContact CB-CG1 3.8Å; T81-I85 WeakPolarHBondContact O-CG1 3.41Å; T81-I85 PolarHBondContact O-N 2.74Å; K82-I85 PolarHBondContact O-N 3.3Å; E83-I85 VanDerWaalsContact C-N 3.34Å; E83-I85 PolarHBondContact O-N 3.28Å; I85-L88 PolarHBondContact O-N 3.08Å; I85-L89 HydrophobicContact CG2-CD1 4.14Å; I85-L89 WeakPolarHBondContact O-CG 3.05Å; I85-L89 PolarHBondContact O-N 3.41Å; I85-L89 VanDerWaalsContact O-N 3.14Å
86	L	80.3	Confident	78.5	Confident	105 Å²	105	79.7 Å²	79.7	55%	0.55	38%	0.382	S	S	.	.	H	α-helix	trans	-65.4	-41.6	175.9	-74	168.8	0	0	0	112	K82 E83 L88 L89 V90	K82-L86 WeakPolarHBondContact O-CB 3.33Å; K82-L86 VanDerWaalsContact O-CG 3.26Å; K82-L86 WeakPolarHBondContact O-CG 3.34Å; K82-L86 PolarHBondContact O-N 2.87Å; E83-L86 PolarHBondContact O-N 2.78Å; L86-L88 PolarHBondContact O-N 3Å; L86-L89 PolarHBondContact O-N 2.89Å; L86-V90 WeakPolarHBondContact O-CB 3.44Å; L86-V90 VanDerWaalsContact O-CG2 3.28Å; L86-V90 WeakPolarHBondContact O-CG2 3.44Å; L86-V90 PolarHBondContact O-N 3.02Å
87	E	80.2	Confident	78.5	Confident	92 Å²	92	82.8 Å²	82.8	43%	0.43	41%	0.406	S	S	.	.	H	α-helix	trans	-61.1	-40.9	175.7	-74.7	-56.8	135.5	0	0	112.4	E83 L89 V90 L91	E83-E87 PolarHBondContact O-N 3.11Å; E87-L89 PolarHBondContact O-N 3.37Å; E87-V90 PolarHBondContact O-N 2.89Å; E87-L91 VanDerWaalsContact O-CB 3.22Å; E87-L91 WeakPolarHBondContact O-CB 3.22Å; E87-L91 PolarHBondContact O-N 3.21Å
88	L	79.6	Confident	78.6	Confident	30 Å²	30	81 Å²	81	16%	0.157	39%	0.393	C	S	.	.	H	α-helix	trans	-65	-36.9	175.1	-70.5	171.1	0	0	0	112.9	L75 R80 Q84 I85 L86 E92	L75-L88 HydrophobicContact CD2-CB 4.36Å; R80-L88 VanDerWaalsContact CZ-CD1 3.49Å; Q84-L88 WeakPolarHBondContact O-CG 3.34Å; Q84-L88 PolarHBondContact O-N 3.33Å; Q84-L88 VanDerWaalsContact O-N 3.16Å; I85-L88 PolarHBondContact O-N 3.08Å; L86-L88 PolarHBondContact O-N 3Å; L88-E92 PolarHBondContact O-N 2.81Å
89	L	81.9	Confident	78.3	Confident	73 Å²	73	78.5 Å²	78.5	38%	0.382	39%	0.389	S	S	.	.	H	α-helix	trans	-71.9	-37.8	175.2	-69.3	169.1	0	0	0	112.2	W74 L75 I85 L86 E87 E92 Q93	W74-L89 HydrophobicContact CH2-CD2 3.95Å; W74-L89 HydrophobicContact CZ3-CD2 3.96Å; L75-L89 HydrophobicContact CD1-CD2 4.3Å; L75-L89 HydrophobicContact CD2-CD2 4.34Å; L75-L89 HydrophobicContact CD2-CG 4.38Å; I85-L89 HydrophobicContact CG2-CD1 4.14Å; I85-L89 WeakPolarHBondContact O-CG 3.05Å; I85-L89 PolarHBondContact O-N 3.41Å; I85-L89 VanDerWaalsContact O-N 3.14Å; L86-L89 PolarHBondContact O-N 2.89Å; E87-L89 PolarHBondContact O-N 3.37Å; L89-E92 PolarHBondContact O-N 3.44Å; L89-Q93 WeakPolarHBondContact O-CB 3.17Å; L89-Q93 PolarHBondContact O-N 3.2Å
90	V	80.6	Confident	78.4	Confident	81 Å²	81	71.1 Å²	71.1	49%	0.491	38%	0.376	S	S	.	.	H	α-helix	trans	-67	-40.3	174.2	167.9	0	0	0	0	110.7	L86 E87 Q93 F94	L86-V90 WeakPolarHBondContact O-CB 3.44Å; L86-V90 VanDerWaalsContact O-CG2 3.28Å; L86-V90 WeakPolarHBondContact O-CG2 3.44Å; L86-V90 PolarHBondContact O-N 3.02Å; E87-V90 PolarHBondContact O-N 2.89Å; V90-Q93 PolarHBondContact O-N 3.3Å; V90-F94 WeakPolarHBondContact O-CB 3.21Å; V90-F94 PolarHBondContact O-N 3.31Å
91	L	81.1	Confident	78.2	Confident	12 Å²	12	75.2 Å²	75.2	6%	0.063	40%	0.398	C	S	.	.	H	α-helix	trans	-60.9	-47.4	172.7	173.6	60.8	0	0	0	111.6	E87 Q93 F94 L95 P111 A117	E87-L91 VanDerWaalsContact O-CB 3.22Å; E87-L91 WeakPolarHBondContact O-CB 3.22Å; E87-L91 PolarHBondContact O-N 3.21Å; L91-Q93 VanDerWaalsContact C-N 3.31Å; L91-Q93 PolarHBondContact O-N 3.07Å; L91-F94 PolarHBondContact O-N 3.37Å; L91-L95 HydrophobicContact CD1-CD1 3.94Å; L91-L95 HydrophobicContact CD1-CD2 4.45Å; L91-L95 HydrophobicContact CD1-CG 3.96Å; L91-L95 HydrophobicContact CG-CD1 4.08Å; L91-L95 HydrophobicContact CG-CG 4.49Å; L91-L95 WeakPolarHBondContact O-CB 3.4Å; L91-L95 VanDerWaalsContact O-CG 3.28Å; L91-L95 WeakPolarHBondContact O-CG 3.31Å; L91-L95 PolarHBondContact O-N 3.35Å; L91-P111 HydrophobicContact CD1-CG 4.23Å; L91-P111 WeakPolarHBondContact CD2-O 3.34Å; L91-A117 HydrophobicContact CD1-CB 3.59Å
92	E	82.4	Confident	77.9	Confident	31 Å²	31	74.9 Å²	74.9	15%	0.145	39%	0.393	C	S	.	.	H	α-helix	trans	-58.4	-44.5	174.9	-171.3	62.4	-150.3	0	0	111.6	H46 R50 W74 L88 L89 F94 L95 T96	H46-E92 IonicContact CE1-OE2 2.71Å; H46-E92 PolarHBondContact CE1-OE2 3.03Å; H46-E92 IonicContact NE2-OE2 2.76Å; H46-E92 PolarHBondContact NE2-OE2 2.95Å; R50-E92 IonicContact CZ-OE1 3.87Å; R50-E92 IonicContact CZ-OE2 2.85Å; R50-E92 VanDerWaalsContact CZ-OE2 3.25Å; R50-E92 IonicContact NE-OE1 3.18Å; R50-E92 PolarHBondContact NE-OE1 2.96Å; R50-E92 IonicContact NE-OE2 3.13Å; R50-E92 PolarHBondContact NE-OE2 3.35Å; R50-E92 IonicContact NH2-OE1 2.66Å; R50-E92 PolarHBondContact NH2-OE1 2.87Å; R50-E92 IonicContact NH2-OE2 3.9Å; R50-E92 PolarHBondContact NH2-OE2 3.25Å; W74-E92 HydrophobicContact CH2-CB 4.14Å; W74-E92 HydrophobicContact CH2-CG 4.31Å; L88-E92 PolarHBondContact O-N 2.81Å; L89-E92 PolarHBondContact O-N 3.44Å; E92-F94 VanDerWaalsContact C-N 3.34Å; E92-F94 PolarHBondContact O-N 3.28Å; E92-L95 PolarHBondContact O-N 3.05Å; E92-T96 WeakPolarHBondContact O-CG2 3.49Å; E92-T96 PolarHBondContact O-N 3.47Å; E92-T96 VanDerWaalsContact O-N 3.07Å; E92-T96 PolarHBondContact O-OG1 3.41Å
93	Q	81.7	Confident	78	Confident	118 Å²	118	68.9 Å²	68.9	55%	0.551	37%	0.368	S	S	*	.	H	α-helix	trans	-68.7	-31.3	178.6	-173.3	57.6	92.6	0	0	112.7	L89 V90 L91 T96 V97	L89-Q93 WeakPolarHBondContact O-CB 3.17Å; L89-Q93 PolarHBondContact O-N 3.2Å; V90-Q93 PolarHBondContact O-N 3.3Å; L91-Q93 VanDerWaalsContact C-N 3.31Å; L91-Q93 PolarHBondContact O-N 3.07Å; Q93-T96 WeakPolarHBondContact CA-OG1 3.41Å; Q93-T96 PolarHBondContact NE2-OG1 3.07Å; Q93-T96 VanDerWaalsContact NE2-OG1 3.09Å; Q93-T96 PolarHBondContact O-OG1 2.92Å; Q93-V97 VanDerWaalsContact O-CG2 3.31Å; Q93-V97 WeakPolarHBondContact O-CG2 3.27Å
94	F	77.6	Confident	78.1	Confident	58 Å²	58	66.6 Å²	66.6	25%	0.254	37%	0.366	S	S	.	.	H	α-helix	trans	-70.2	-49.4	173.5	178.9	-107.5	0	0	0	111.1	V90 L91 E92 T96 V97 L98 A117 V118 V121	V90-F94 WeakPolarHBondContact O-CB 3.21Å; V90-F94 PolarHBondContact O-N 3.31Å; L91-F94 PolarHBondContact O-N 3.37Å; E92-F94 VanDerWaalsContact C-N 3.34Å; E92-F94 PolarHBondContact O-N 3.28Å; F94-T96 VanDerWaalsContact C-N 3.27Å; F94-T96 PolarHBondContact O-N 2.96Å; F94-V97 PolarHBondContact O-N 2.66Å; F94-L98 HydrophobicContact CD1-CD1 4.45Å; F94-L98 HydrophobicContact CE1-CD1 4.05Å; F94-L98 HydrophobicContact CE1-CD2 4.25Å; F94-L98 HydrophobicContact CE1-CG 4.35Å; F94-L98 HydrophobicContact CE2-CD2 4.39Å; F94-L98 HydrophobicContact CZ-CD2 3.95Å; F94-L98 HydrophobicContact CZ-CG 4.49Å; F94-L98 PolarHBondContact O-N 3.12Å; F94-A117 HydrophobicContact CD1-CB 3.83Å; F94-A117 HydrophobicContact CE1-CB 3.79Å; F94-V118 HydrophobicContact CE1-CG2 4.02Å; F94-V118 HydrophobicContact CE2-CG2 3.9Å; F94-V118 HydrophobicContact CZ-CG2 3.58Å; F94-V121 HydrophobicContact CE1-CG2 4.42Å; F94-V121 HydrophobicContact CZ-CG2 4.39Å
95	L	77.4	Confident	78.4	Confident	9 Å²	9	66.2 Å²	66.2	5%	0.047	36%	0.36	C	S	.	.	H	α-helix	trans	-59.3	-36.9	179.4	-69	173.4	0	0	0	112.2	L91 E92 V97 L98 Q103 V106 R107	L91-L95 HydrophobicContact CD1-CD1 3.94Å; L91-L95 HydrophobicContact CD1-CD2 4.45Å; L91-L95 HydrophobicContact CD1-CG 3.96Å; L91-L95 HydrophobicContact CG-CD1 4.08Å; L91-L95 HydrophobicContact CG-CG 4.49Å; L91-L95 WeakPolarHBondContact O-CB 3.4Å; L91-L95 VanDerWaalsContact O-CG 3.28Å; L91-L95 WeakPolarHBondContact O-CG 3.31Å; L91-L95 PolarHBondContact O-N 3.35Å; E92-L95 PolarHBondContact O-N 3.05Å; L95-V97 VanDerWaalsContact C-N 3.31Å; L95-V97 PolarHBondContact O-N 3.17Å; L95-L98 HydrophobicContact CD2-CD1 4.25Å; L95-Q103 VanDerWaalsContact O-CG 3.31Å; L95-Q103 WeakPolarHBondContact O-CG 3.17Å; L95-Q103 PolarHBondContact O-NE2 3.08Å; L95-V106 HydrophobicContact CD2-CB 4.13Å; L95-V106 HydrophobicContact CD2-CG1 3.51Å; L95-R107 HydrophobicContact CD1-CG 4.34Å; L95-R107 HydrophobicContact CD2-CG 4.4Å
96	T	76.4	Confident	78.2	Confident	67 Å²	67	64.8 Å²	64.8	41%	0.411	35%	0.353	S	S	.	.	H	α-helix	trans	-70.1	-21.7	176.5	46.3	0	0	0	0	114.2	E92 Q93 F94 Q103	E92-T96 WeakPolarHBondContact O-CG2 3.49Å; E92-T96 PolarHBondContact O-N 3.47Å; E92-T96 VanDerWaalsContact O-N 3.07Å; E92-T96 PolarHBondContact O-OG1 3.41Å; Q93-T96 WeakPolarHBondContact CA-OG1 3.41Å; Q93-T96 PolarHBondContact NE2-OG1 3.07Å; Q93-T96 VanDerWaalsContact NE2-OG1 3.09Å; Q93-T96 PolarHBondContact O-OG1 2.92Å; F94-T96 VanDerWaalsContact C-N 3.27Å; F94-T96 PolarHBondContact O-N 2.96Å; T96-Q103 PolarHBondContact O-NE2 2.82Å
97	V	80.3	Confident	78.1	Confident	112 Å²	112	63.9 Å²	63.9	68%	0.679	34%	0.342	S	S	*	.	H	α-helix	trans	-88.4	-18.4	179	170.1	0	0	0	0	113	Q93 F94 L95	Q93-V97 VanDerWaalsContact O-CG2 3.31Å; Q93-V97 WeakPolarHBondContact O-CG2 3.27Å; F94-V97 PolarHBondContact O-N 2.66Å; L95-V97 VanDerWaalsContact C-N 3.31Å; L95-V97 PolarHBondContact O-N 3.17Å
98	L	77.5	Confident	77.9	Confident	21 Å²	21	62.1 Å²	62.1	11%	0.11	35%	0.348	C	S	.	.	S	Bend	trans	-64.8	142.5	177.8	-68	177.1	0	0	0	112.5	F94 L95 Q103 V106 V121	F94-L98 HydrophobicContact CD1-CD1 4.45Å; F94-L98 HydrophobicContact CE1-CD1 4.05Å; F94-L98 HydrophobicContact CE1-CD2 4.25Å; F94-L98 HydrophobicContact CE1-CG 4.35Å; F94-L98 HydrophobicContact CE2-CD2 4.39Å; F94-L98 HydrophobicContact CZ-CD2 3.95Å; F94-L98 HydrophobicContact CZ-CG 4.49Å; F94-L98 PolarHBondContact O-N 3.12Å; L95-L98 HydrophobicContact CD2-CD1 4.25Å; L98-Q103 HydrophobicContact CB-CB 3.87Å; L98-Q103 WeakPolarHBondContact O-CB 3.5Å; L98-Q103 PolarHBondContact O-NE2 2.82Å; L98-V106 HydrophobicContact CD1-CB 4.11Å; L98-V106 HydrophobicContact CD1-CG1 4.4Å; L98-V106 HydrophobicContact CD1-CG2 3.9Å; L98-V121 HydrophobicContact CD1-CG2 3.99Å; L98-V121 HydrophobicContact CD2-CG2 3.97Å
99	P	74.1	Confident	77.7	Confident	86 Å²	86	65.5 Å²	65.5	56%	0.558	36%	0.363	S	S	*	.			trans	-58.5	144.9	172.3	-24.4	34.2	0	0	0	112.5	E101 L102 Q103	P99-E101 PolarHBondContact O-N 3.39Å; P99-E101 VanDerWaalsContact O-N 3.09Å; P99-L102 HydrophobicContact CG-CD1 4.3Å; P99-L102 CarbonylContact O-C 3.49Å; P99-L102 WeakPolarHBondContact O-CA 3.44Å; P99-L102 WeakPolarHBondContact O-CB 3.49Å; P99-L102 PolarHBondContact O-N 3.14Å; P99-Q103 WeakPolarHBondContact O-CB 3.39Å; P99-Q103 PolarHBondContact O-N 3.39Å
100	G	74.8	Confident	77.3	Confident	48 Å²	48	68.8 Å²	68.8	50%	0.495	37%	0.371	S	S	.	.	H	α-helix	trans	-48	-44.1	-163.2	0	0	0	0	0	117.5	S104	G100-S104 WeakPolarHBondContact O-CB 3.46Å; G100-S104 PolarHBondContact O-N 3.25Å; G100-S104 PolarHBondContact O-OG 3.44Å
101	E	72.3	Confident	77	Confident	146 Å²	146	65.6 Å²	65.6	68%	0.682	35%	0.352	S	S	*	.	H	α-helix	trans	-68.6	-44.4	177.7	-64.6	-176.5	159.1	0	0	111.9	P99 S104 W105 H151	P99-E101 PolarHBondContact O-N 3.39Å; P99-E101 VanDerWaalsContact O-N 3.09Å; E101-S104 PolarHBondContact O-N 2.98Å; E101-W105 WeakPolarHBondContact O-CB 3.29Å; E101-W105 PolarHBondContact O-N 3.34Å; E101-H151 IonicContact OE1-CE1 3.65Å; E101-H151 PolarHBondContact OE1-CE1 2.82Å; E101-H151 IonicContact OE1-ND1 3.79Å
102	L	73.4	Confident	76.5	Confident	61 Å²	61	72.3 Å²	72.3	32%	0.319	38%	0.383	S	S	.	.	H	α-helix	trans	-65.8	-42.2	175.4	-67.7	171.4	0	0	0	111.3	P99 S104 W105 V106 L124	P99-L102 HydrophobicContact CG-CD1 4.3Å; P99-L102 CarbonylContact O-C 3.49Å; P99-L102 WeakPolarHBondContact O-CA 3.44Å; P99-L102 WeakPolarHBondContact O-CB 3.49Å; P99-L102 PolarHBondContact O-N 3.14Å; L102-S104 VanDerWaalsContact C-N 3.31Å; L102-S104 PolarHBondContact O-N 3.22Å; L102-W105 PolarHBondContact O-N 3.46Å; L102-V106 WeakPolarHBondContact O-CB 3.44Å; L102-V106 VanDerWaalsContact O-CG2 3.26Å; L102-V106 WeakPolarHBondContact O-CG2 3.47Å; L102-V106 PolarHBondContact O-N 3.34Å; L102-L124 HydrophobicContact CD2-CD1 3.55Å
103	Q	77.4	Confident	76.2	Confident	39 Å²	39	72.8 Å²	72.8	18%	0.182	39%	0.389	C	S	.	.	H	α-helix	trans	-57.4	-45.1	174.4	173	175.5	112.2	0	0	111.4	L95 T96 L98 P99 R107	L95-Q103 VanDerWaalsContact O-CG 3.31Å; L95-Q103 WeakPolarHBondContact O-CG 3.17Å; L95-Q103 PolarHBondContact O-NE2 3.08Å; T96-Q103 PolarHBondContact O-NE2 2.82Å; L98-Q103 HydrophobicContact CB-CB 3.87Å; L98-Q103 WeakPolarHBondContact O-CB 3.5Å; L98-Q103 PolarHBondContact O-NE2 2.82Å; P99-Q103 WeakPolarHBondContact O-CB 3.39Å; P99-Q103 PolarHBondContact O-N 3.39Å; Q103-R107 VanDerWaalsContact CD-CZ 3.5Å; Q103-R107 VanDerWaalsContact CG-CZ 3.42Å; Q103-R107 VanDerWaalsContact CG-NH1 3.25Å; Q103-R107 WeakPolarHBondContact O-CB 3.48Å; Q103-R107 VanDerWaalsContact O-CG 3.23Å; Q103-R107 WeakPolarHBondContact O-CG 3.34Å; Q103-R107 PolarHBondContact O-N 3.48Å; Q103-R107 VanDerWaalsContact O-N 3.09Å
104	S	76.8	Confident	75.9	Confident	78 Å²	78	67.6 Å²	67.6	55%	0.545	37%	0.368	S	S	.	.	H	α-helix	trans	-69.3	-42.9	179.6	-57	0	0	0	0	111.5	G100 E101 L102 G108	G100-S104 WeakPolarHBondContact O-CB 3.46Å; G100-S104 PolarHBondContact O-N 3.25Å; G100-S104 PolarHBondContact O-OG 3.44Å; E101-S104 PolarHBondContact O-N 2.98Å; L102-S104 VanDerWaalsContact C-N 3.31Å; L102-S104 PolarHBondContact O-N 3.22Å; S104-G108 PolarHBondContact O-N 3.37Å
105	W	79	Confident	75.9	Confident	94 Å²	94	72.4 Å²	72.4	36%	0.356	39%	0.391	S	S	.	.	H	α-helix	trans	-65.2	-49.1	177.3	179.8	83.6	0	0	0	112.4	E101 L102 R107 G108 Q109 L120 L124	E101-W105 WeakPolarHBondContact O-CB 3.29Å; E101-W105 PolarHBondContact O-N 3.34Å; L102-W105 PolarHBondContact O-N 3.46Å; W105-R107 PolarHBondContact O-N 2.79Å; W105-G108 CarbonylContact O-C 3.5Å; W105-G108 WeakPolarHBondContact O-CA 3.44Å; W105-G108 PolarHBondContact O-N 3.06Å; W105-Q109 HydrophobicContact CD2-CG 4.34Å; W105-Q109 HydrophobicContact CH2-CG 4.24Å; W105-Q109 HydrophobicContact CZ2-CG 3.97Å; W105-Q109 PolarHBondContact O-N 3.27Å; W105-L120 HydrophobicContact CH2-CB 4.12Å; W105-L120 HydrophobicContact CH2-CD2 4.08Å; W105-L120 HydrophobicContact CZ3-CB 3.86Å; W105-L124 HydrophobicContact CD2-CD1 3.76Å; W105-L124 HydrophobicContact CD2-CG 4.5Å; W105-L124 HydrophobicContact CE3-CD1 3.35Å; W105-L124 HydrophobicContact CE3-CG 4.07Å; W105-L124 HydrophobicContact CH2-CD1 3.96Å; W105-L124 HydrophobicContact CH2-CD2 4.03Å; W105-L124 HydrophobicContact CH2-CG 3.71Å; W105-L124 HydrophobicContact CZ2-CD1 4.32Å; W105-L124 HydrophobicContact CZ2-CD2 3.99Å; W105-L124 HydrophobicContact CZ2-CG 4.17Å; W105-L124 HydrophobicContact CZ3-CD1 3.44Å; W105-L124 VanDerWaalsContact CZ3-CD1 3.44Å; W105-L124 HydrophobicContact CZ3-CD2 4.37Å; W105-L124 HydrophobicContact CZ3-CG 3.64Å
106	V	77.6	Confident	76	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-62.9	-41	178.8	178.9	0	0	0	0	111	L95 L98 L102 G108 Q109 R110 P111 A117 L120 V121	L95-V106 HydrophobicContact CD2-CB 4.13Å; L95-V106 HydrophobicContact CD2-CG1 3.51Å; L98-V106 HydrophobicContact CD1-CB 4.11Å; L98-V106 HydrophobicContact CD1-CG1 4.4Å; L98-V106 HydrophobicContact CD1-CG2 3.9Å; L102-V106 WeakPolarHBondContact O-CB 3.44Å; L102-V106 VanDerWaalsContact O-CG2 3.26Å; L102-V106 WeakPolarHBondContact O-CG2 3.47Å; L102-V106 PolarHBondContact O-N 3.34Å; V106-G108 VanDerWaalsContact C-N 3.27Å; V106-G108 PolarHBondContact O-N 3.16Å; V106-Q109 PolarHBondContact O-N 2.78Å; V106-R110 PolarHBondContact O-N 2.88Å; V106-P111 HydrophobicContact CG1-CG 3.87Å; V106-P111 WeakPolarHBondContact O-CD 3.21Å; V106-A117 HydrophobicContact CG1-CB 4.19Å; V106-L120 HydrophobicContact CG1-CD1 4.37Å; V106-V121 HydrophobicContact CG2-CG2 3.6Å
107	R	78.1	Confident	76.1	Confident	85 Å²	85	72.5 Å²	72.5	32%	0.321	39%	0.387	S	S	.	.	H	α-helix	trans	-59.9	-37.7	172.1	-76.9	175.1	179.2	150.1	5.7	112.1	L95 Q103 W105 Q109 R110	L95-R107 HydrophobicContact CD1-CG 4.34Å; L95-R107 HydrophobicContact CD2-CG 4.4Å; Q103-R107 VanDerWaalsContact CD-CZ 3.5Å; Q103-R107 VanDerWaalsContact CG-CZ 3.42Å; Q103-R107 VanDerWaalsContact CG-NH1 3.25Å; Q103-R107 WeakPolarHBondContact O-CB 3.48Å; Q103-R107 VanDerWaalsContact O-CG 3.23Å; Q103-R107 WeakPolarHBondContact O-CG 3.34Å; Q103-R107 PolarHBondContact O-N 3.48Å; Q103-R107 VanDerWaalsContact O-N 3.09Å; W105-R107 PolarHBondContact O-N 2.79Å; R107-Q109 PolarHBondContact O-N 2.97Å; R107-R110 PolarHBondContact O-N 3.05Å
108	G	75.4	Confident	76.1	Confident	55 Å²	55	69.9 Å²	69.9	57%	0.567	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-7.9	173	0	0	0	0	0	115.1	S104 W105 V106	S104-G108 PolarHBondContact O-N 3.37Å; W105-G108 CarbonylContact O-C 3.5Å; W105-G108 WeakPolarHBondContact O-CA 3.44Å; W105-G108 PolarHBondContact O-N 3.06Å; V106-G108 VanDerWaalsContact C-N 3.27Å; V106-G108 PolarHBondContact O-N 3.16Å
109	Q	75.7	Confident	76.3	Confident	101 Å²	101	73 Å²	73	47%	0.472	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-2.1	173.1	-60.1	-61.9	-100.6	0	0	113.6	W105 V106 R107 L120	W105-Q109 HydrophobicContact CD2-CG 4.34Å; W105-Q109 HydrophobicContact CH2-CG 4.24Å; W105-Q109 HydrophobicContact CZ2-CG 3.97Å; W105-Q109 PolarHBondContact O-N 3.27Å; V106-Q109 PolarHBondContact O-N 2.78Å; R107-Q109 PolarHBondContact O-N 2.97Å; Q109-L120 HydrophobicContact CB-CD1 3.8Å; Q109-L120 HydrophobicContact CB-CD2 4.39Å; Q109-L120 HydrophobicContact CG-CD2 4.46Å
110	R	73.6	Confident	76.7	Confident	143 Å²	143	70.7 Å²	70.7	54%	0.54	37%	0.374	S	S	.	.			trans	44.7	55.8	177.7	-62.9	-174.2	173.5	-167.5	-1.6	115.5	D38 V106 R107 E112	D38-R110 IonicContact OD1-CZ 2.82Å; D38-R110 IonicContact OD1-NH1 3.02Å; D38-R110 PolarHBondContact OD1-NH1 2.81Å; V106-R110 PolarHBondContact O-N 2.88Å; R107-R110 PolarHBondContact O-N 3.05Å; R110-E112 PolarHBondContact O-N 3.22Å
111	P	73.9	Confident	77	Confident	13 Å²	13	69.7 Å²	69.7	8%	0.084	36%	0.358	C	S	.	.			trans	-60.1	136.1	172	26.7	-34.8	0	0	0	111.1	L91 V106 E116 A117 L120	L91-P111 HydrophobicContact CD1-CG 4.23Å; L91-P111 WeakPolarHBondContact CD2-O 3.34Å; V106-P111 HydrophobicContact CG1-CG 3.87Å; V106-P111 WeakPolarHBondContact O-CD 3.21Å; P111-E116 VanDerWaalsContact CA-OE2 3.27Å; P111-E116 WeakPolarHBondContact CA-OE2 3.35Å; P111-E116 HydrophobicContact CB-CB 4.05Å; P111-E116 HydrophobicContact CB-CG 3.89Å; P111-A117 HydrophobicContact CB-CB 3.87Å; P111-A117 HydrophobicContact CG-CB 3.74Å; P111-L120 HydrophobicContact CB-CD1 4.05Å; P111-L120 HydrophobicContact CG-CD1 4.28Å
112	E	71.3	Confident	77.4	Confident	153 Å²	153	66.7 Å²	66.7	72%	0.715	34%	0.344	S	S	*	.	S	Bend	trans	-86.2	-16.5	176.2	-62.3	-162.5	144.8	0	0	112.5	R110 E116	R110-E112 PolarHBondContact O-N 3.22Å; E112-E116 PolarHBondContact N-OE2 3.41Å
113	S	76.5	Confident	77.5	Confident	41 Å²	41	65.4 Å²	65.4	29%	0.287	35%	0.346	S	S	.	.	S	Bend	trans	-135.2	157.7	-176.9	68.6	0	0	0	0	113.8	E115 E116 A117	S113-E115 VanDerWaalsContact C-N 3.3Å; S113-E115 PolarHBondContact O-N 3.29Å; S113-E116 PolarHBondContact O-N 3.45Å; S113-E116 VanDerWaalsContact OG-CB 3.26Å; S113-E116 WeakPolarHBondContact OG-CB 3.46Å; S113-E116 PolarHBondContact OG-N 3.3Å; S113-E116 VanDerWaalsContact OG-N 3.13Å; S113-A117 PolarHBondContact O-N 3.38Å; S113-A117 VanDerWaalsContact O-N 3.08Å
114	G	75	Confident	77.1	Confident	10 Å²	10	66.6 Å²	66.6	10%	0.103	35%	0.353	C	S	.	.	H	α-helix	trans	-61.8	-36.8	173.1	0	0	0	0	0	112.8	V118	G114-V118 VanDerWaalsContact O-CG2 3.32Å; G114-V118 WeakPolarHBondContact O-CG2 3.47Å; G114-V118 PolarHBondContact O-N 2.89Å
115	E	76.6	Confident	76.3	Confident	158 Å²	158	70.6 Å²	70.6	74%	0.738	36%	0.363	S	S	*	.	H	α-helix	trans	-63.7	-46.2	176.3	-61.9	-165	157.3	0	0	111.6	S113 V118 T119	S113-E115 VanDerWaalsContact C-N 3.3Å; S113-E115 PolarHBondContact O-N 3.29Å; E115-V118 PolarHBondContact O-N 3.34Å; E115-T119 WeakPolarHBondContact O-CG2 3.44Å; E115-T119 PolarHBondContact O-N 2.88Å
116	E	79.6	Confident	75.5	Confident	78 Å²	78	73.1 Å²	73.1	36%	0.364	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-47.5	176.9	-175.2	176.2	-156.2	0	0	111.9	P111 E112 S113 V118 T119 L120	P111-E116 VanDerWaalsContact CA-OE2 3.27Å; P111-E116 WeakPolarHBondContact CA-OE2 3.35Å; P111-E116 HydrophobicContact CB-CB 4.05Å; P111-E116 HydrophobicContact CB-CG 3.89Å; E112-E116 PolarHBondContact N-OE2 3.41Å; S113-E116 PolarHBondContact O-N 3.45Å; S113-E116 VanDerWaalsContact OG-CB 3.26Å; S113-E116 WeakPolarHBondContact OG-CB 3.46Å; S113-E116 PolarHBondContact OG-N 3.3Å; S113-E116 VanDerWaalsContact OG-N 3.13Å; E116-V118 VanDerWaalsContact C-N 3.26Å; E116-V118 PolarHBondContact O-N 2.82Å; E116-T119 PolarHBondContact O-N 2.99Å; E116-T119 PolarHBondContact O-OG1 3.27Å; E116-L120 HydrophobicContact CG-CD1 4.41Å; E116-L120 WeakPolarHBondContact O-CG 3.39Å; E116-L120 PolarHBondContact O-N 3.27Å
117	A	80.1	Confident	74.2	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-57.7	-38.6	175.9	0	0	0	0	0	112.2	L91 F94 V106 P111 S113 V121	L91-A117 HydrophobicContact CD1-CB 3.59Å; F94-A117 HydrophobicContact CD1-CB 3.83Å; F94-A117 HydrophobicContact CE1-CB 3.79Å; V106-A117 HydrophobicContact CG1-CB 4.19Å; P111-A117 HydrophobicContact CB-CB 3.87Å; P111-A117 HydrophobicContact CG-CB 3.74Å; S113-A117 PolarHBondContact O-N 3.38Å; S113-A117 VanDerWaalsContact O-N 3.08Å; A117-V121 WeakPolarHBondContact O-CG2 3.38Å; A117-V121 PolarHBondContact O-N 3.18Å
118	V	79.8	Confident	72.5	Confident	57 Å²	57	80.4 Å²	80.4	35%	0.345	42%	0.423	S	S	.	.	H	α-helix	trans	-66.3	-43.7	172.1	168.7	0	0	0	0	111.3	F94 G114 E115 E116 L120 V121 E122	F94-V118 HydrophobicContact CE1-CG2 4.02Å; F94-V118 HydrophobicContact CE2-CG2 3.9Å; F94-V118 HydrophobicContact CZ-CG2 3.58Å; G114-V118 VanDerWaalsContact O-CG2 3.32Å; G114-V118 WeakPolarHBondContact O-CG2 3.47Å; G114-V118 PolarHBondContact O-N 2.89Å; E115-V118 PolarHBondContact O-N 3.34Å; E116-V118 VanDerWaalsContact C-N 3.26Å; E116-V118 PolarHBondContact O-N 2.82Å; V118-L120 VanDerWaalsContact C-N 3.3Å; V118-L120 PolarHBondContact O-N 2.93Å; V118-V121 PolarHBondContact O-N 2.91Å; V118-E122 HydrophobicContact CG1-CG 4.26Å; V118-E122 WeakPolarHBondContact O-CB 3.36Å; V118-E122 PolarHBondContact O-N 3.28Å
119	T	82.3	Confident	71	Confident	87 Å²	87	89.2 Å²	89.2	53%	0.534	44%	0.439	S	S	.	.	H	α-helix	trans	-65.3	-32.2	178.9	64.7	0	0	0	0	113.2	E115 E116 G123	E115-T119 WeakPolarHBondContact O-CG2 3.44Å; E115-T119 PolarHBondContact O-N 2.88Å; E116-T119 PolarHBondContact O-N 2.99Å; E116-T119 PolarHBondContact O-OG1 3.27Å; T119-G123 WeakPolarHBondContact O-CA 3.4Å; T119-G123 PolarHBondContact O-N 3.24Å
120	L	82.5	Confident	69.2	Low	37 Å²	37	95.4 Å²	95.4	19%	0.194	46%	0.458	C	S	.	.	H	α-helix	trans	-64.7	-46.1	173.8	-72.6	169.2	0	0	0	111.2	W105 V106 Q109 P111 E116 V118 G123 L124	W105-L120 HydrophobicContact CH2-CB 4.12Å; W105-L120 HydrophobicContact CH2-CD2 4.08Å; W105-L120 HydrophobicContact CZ3-CB 3.86Å; V106-L120 HydrophobicContact CG1-CD1 4.37Å; Q109-L120 HydrophobicContact CB-CD1 3.8Å; Q109-L120 HydrophobicContact CB-CD2 4.39Å; Q109-L120 HydrophobicContact CG-CD2 4.46Å; P111-L120 HydrophobicContact CB-CD1 4.05Å; P111-L120 HydrophobicContact CG-CD1 4.28Å; E116-L120 HydrophobicContact CG-CD1 4.41Å; E116-L120 WeakPolarHBondContact O-CG 3.39Å; E116-L120 PolarHBondContact O-N 3.27Å; V118-L120 VanDerWaalsContact C-N 3.3Å; V118-L120 PolarHBondContact O-N 2.93Å; L120-G123 PolarHBondContact O-N 3.02Å; L120-L124 PolarHBondContact O-N 3.08Å; L120-L124 VanDerWaalsContact O-N 3.14Å
121	V	79.7	Confident	67.4	Low	27 Å²	27	94.4 Å²	94.4	16%	0.164	47%	0.47	C	S	.	.	H	α-helix	trans	-65.5	-45.9	176.3	174.2	0	0	0	0	111.5	F94 L98 V106 A117 V118 G123 L124 Q125	F94-V121 HydrophobicContact CE1-CG2 4.42Å; F94-V121 HydrophobicContact CZ-CG2 4.39Å; L98-V121 HydrophobicContact CD1-CG2 3.99Å; L98-V121 HydrophobicContact CD2-CG2 3.97Å; V106-V121 HydrophobicContact CG2-CG2 3.6Å; A117-V121 WeakPolarHBondContact O-CG2 3.38Å; A117-V121 PolarHBondContact O-N 3.18Å; V118-V121 PolarHBondContact O-N 2.91Å; V121-G123 VanDerWaalsContact C-N 3.27Å; V121-G123 PolarHBondContact O-N 2.71Å; V121-L124 PolarHBondContact O-N 3.44Å; V121-Q125 PolarHBondContact O-N 3.31Å
122	E	80.1	Confident	65.7	Low	83 Å²	83	101.1 Å²	101.1	39%	0.388	49%	0.494	S	S	.	.	H	α-helix	trans	-63.4	-33.8	175	-75.1	-161.1	174.2	0	0	112.1	V118 Q125 K126	V118-E122 HydrophobicContact CG1-CG 4.26Å; V118-E122 WeakPolarHBondContact O-CB 3.36Å; V118-E122 PolarHBondContact O-N 3.28Å; E122-Q125 PolarHBondContact O-N 3Å; E122-K126 WeakPolarHBondContact O-CB 3.49Å; E122-K126 WeakPolarHBondContact O-CD 3.38Å; E122-K126 WeakPolarHBondContact O-CG 3.17Å; E122-K126 PolarHBondContact O-N 3.06Å; E122-K126 WeakPolarHBondContact OE2-CE 3.5Å; E122-K126 IonicContact OE2-NZ 3.6Å; E122-K126 PolarHBondContact OE2-NZ 2.93Å
123	G	76.3	Confident	63.8	Low	35 Å²	35	104.3 Å²	104.3	36%	0.361	50%	0.5	S	S	.	.	H	α-helix	trans	-61	-46.5	175.4	0	0	0	0	0	112	T119 L120 V121 K126 Q127	T119-G123 WeakPolarHBondContact O-CA 3.4Å; T119-G123 PolarHBondContact O-N 3.24Å; L120-G123 PolarHBondContact O-N 3.02Å; V121-G123 VanDerWaalsContact C-N 3.27Å; V121-G123 PolarHBondContact O-N 2.71Å; G123-K126 PolarHBondContact O-N 3.26Å; G123-Q127 PolarHBondContact O-N 3.14Å
124	L	68.8	Low	61.9	Low	63 Å²	63	111.3 Å²	111.3	33%	0.33	52%	0.52	S	S	.	.	H	α-helix	trans	-62.2	-40.7	171	-71.5	-175.4	0	0	0	112.2	L102 W105 L120 V121 K126 Q127	L102-L124 HydrophobicContact CD2-CD1 3.55Å; W105-L124 HydrophobicContact CD2-CD1 3.76Å; W105-L124 HydrophobicContact CD2-CG 4.5Å; W105-L124 HydrophobicContact CE3-CD1 3.35Å; W105-L124 HydrophobicContact CE3-CG 4.07Å; W105-L124 HydrophobicContact CH2-CD1 3.96Å; W105-L124 HydrophobicContact CH2-CD2 4.03Å; W105-L124 HydrophobicContact CH2-CG 3.71Å; W105-L124 HydrophobicContact CZ2-CD1 4.32Å; W105-L124 HydrophobicContact CZ2-CD2 3.99Å; W105-L124 HydrophobicContact CZ2-CG 4.17Å; W105-L124 HydrophobicContact CZ3-CD1 3.44Å; W105-L124 VanDerWaalsContact CZ3-CD1 3.44Å; W105-L124 HydrophobicContact CZ3-CD2 4.37Å; W105-L124 HydrophobicContact CZ3-CG 3.64Å; L120-L124 PolarHBondContact O-N 3.08Å; L120-L124 VanDerWaalsContact O-N 3.14Å; V121-L124 PolarHBondContact O-N 3.44Å; L124-K126 VanDerWaalsContact C-N 3.26Å; L124-K126 PolarHBondContact O-N 2.92Å; L124-Q127 WeakPolarHBondContact O-CB 3.19Å; L124-Q127 PolarHBondContact O-N 3.34Å
125	Q	61.1	Low	60.1	Low	163 Å²	163	115.8 Å²	115.8	76%	0.762	55%	0.545	S	S	*	.	H	α-helix	trans	-69.8	-23.9	-179.9	-161	173.8	18	0	0	113.1	V121 E122	V121-Q125 PolarHBondContact O-N 3.31Å; E122-Q125 PolarHBondContact O-N 3Å
126	K	61.9	Low	58.2	Low	146 Å²	146	113.7 Å²	113.7	64%	0.635	54%	0.543	S	S	*	.	H	α-helix	trans	-90.7	-6.9	176.3	-68.7	163.2	-167.9	168.3	0	113.6	E122 G123 L124	E122-K126 WeakPolarHBondContact O-CB 3.49Å; E122-K126 WeakPolarHBondContact O-CD 3.38Å; E122-K126 WeakPolarHBondContact O-CG 3.17Å; E122-K126 PolarHBondContact O-N 3.06Å; E122-K126 WeakPolarHBondContact OE2-CE 3.5Å; E122-K126 IonicContact OE2-NZ 3.6Å; E122-K126 PolarHBondContact OE2-NZ 2.93Å; G123-K126 PolarHBondContact O-N 3.26Å; L124-K126 VanDerWaalsContact C-N 3.26Å; L124-K126 PolarHBondContact O-N 2.92Å
127	Q	50.9	Low	56.2	Low	134 Å²	134	115.6 Å²	115.6	63%	0.626	56%	0.559	S	S	*	*	S	Bend	trans	-58.4	125.2	170	-79.5	-73.8	-11.3	0	0	109.7	G123 L124 R129	G123-Q127 PolarHBondContact O-N 3.14Å; L124-Q127 WeakPolarHBondContact O-CB 3.19Å; L124-Q127 PolarHBondContact O-N 3.34Å; Q127-R129 PolarHBondContact O-N 3.47Å
128	P	41.8	Very low	54.3	Low	104 Å²	104	123.8 Å²	123.8	68%	0.675	60%	0.597	S	S	*	*			trans	-67.2	112.1	179.5	26.7	-33	0	0	0	109.3	R130	P128-R130 PolarHBondContact O-N 3.46Å
129	R	42.8	Very low	52.3	Low	240 Å²	240	127 Å²	127	91%	0.906	62%	0.617	S	S	*	*			trans	-49.5	111.8	164.7	-77.1	-175	171	-169	-4.6	107.5	Q127	Q127-R129 PolarHBondContact O-N 3.47Å
130	R	38	Very low	50.5	Low	231 Å²	231	132.4 Å²	132.4	87%	0.872	64%	0.636	S	S	*	*			trans	-50.5	138	-178.9	-71.6	-172.9	178.4	-166.2	1.5	108.8	P128 R132	P128-R130 PolarHBondContact O-N 3.46Å; R130-R132 PolarHBondContact O-N 3.31Å; R130-R132 VanDerWaalsContact O-N 3.13Å
131	P	35.9	Very low	48.8	Very low	122 Å²	122	134.1 Å²	134.1	79%	0.792	66%	0.663	S	S	*	*			trans	-56.4	124.1	-174.2	22.4	-33.4	0	0	0	109.7	R133	P131-R133 PolarHBondContact O-N 2.89Å
132	R	38.7	Very low	46.7	Very low	155 Å²	155	141.4 Å²	141.4	59%	0.585	70%	0.695	S	S	*	*			trans	-58.7	100.4	172.5	-86.1	-170.9	167.3	170.9	0.3	108.1	R130 W134 E147	R130-R132 PolarHBondContact O-N 3.31Å; R130-R132 VanDerWaalsContact O-N 3.13Å; R132-W134 VanDerWaalsContact C-N 3.28Å; R132-W134 PolarHBondContact O-N 3.01Å; R132-E147 IonicContact CZ-OE1 2.87Å; R132-E147 IonicContact NH1-OE1 3.6Å; R132-E147 PolarHBondContact NH1-OE1 2.81Å; R132-E147 IonicContact NH2-OE1 3.29Å; R132-E147 PolarHBondContact NH2-OE1 3.06Å
133	R	31.6	Very low	44.6	Very low	220 Å²	220	147 Å²	147	83%	0.83	72%	0.721	S	S	*	*			trans	-73.5	89.4	170.4	-175.6	-174.9	179.1	-161.4	-1	107.5	P131 V135	P131-R133 PolarHBondContact O-N 2.89Å; R133-V135 HydrophobicContact CG-CG2 4.48Å; R133-V135 PolarHBondContact O-N 2.83Å; R133-V135 VanDerWaalsContact O-N 3.08Å
134	W	36	Very low	42.4	Very low	188 Å²	188	151 Å²	151	71%	0.712	74%	0.738	S	S	*	*			trans	-54.4	114.1	166.4	-55.8	94.5	0	0	0	108.4	R132 L145	R132-W134 VanDerWaalsContact C-N 3.28Å; R132-W134 PolarHBondContact O-N 3.01Å; W134-L145 HydrophobicContact CZ3-CD2 4.35Å
135	V	36.9	Very low	40.7	Very low	104 Å²	104	155.5 Å²	155.5	63%	0.63	76%	0.762	S	S	*	*			trans	-96	100.5	169.8	177.5	0	0	0	0	106.3	R133 V137	R133-V135 HydrophobicContact CG-CG2 4.48Å; R133-V135 PolarHBondContact O-N 2.83Å; R133-V135 VanDerWaalsContact O-N 3.08Å; V135-V137 HydrophobicContact CG1-CG2 4.16Å; V135-V137 PolarHBondContact O-N 3.19Å
136	T	37	Very low	39.2	Very low	114 Å²	114	153.2 Å²	153.2	70%	0.699	76%	0.764	S	S	*	*			trans	-70.7	94.8	178.7	-34.4	0	0	0	0	109.6	H138	T136-H138 PolarHBondContact O-N 2.78Å
137	V	38.9	Very low	37.7	Very low	117 Å²	117	153 Å²	153	71%	0.709	77%	0.765	S	S	*	*			trans	-83.3	103.1	171.7	-175.9	0	0	0	0	108.2	V135 V139	V135-V137 HydrophobicContact CG1-CG2 4.16Å; V135-V137 PolarHBondContact O-N 3.19Å; V137-V139 HydrophobicContact CG1-CG2 4.3Å; V137-V139 PolarHBondContact O-N 3.03Å
138	H	39.2	Very low	36.7	Very low	172 Å²	172	154.9 Å²	154.9	80%	0.796	77%	0.774	S	S	*	*			trans	-79	99.1	171.4	-78.2	-24.1	0	0	0	110.8	T136	T136-H138 PolarHBondContact O-N 2.78Å
139	V	38.4	Very low	36	Very low	125 Å²	125	155.6 Å²	155.6	76%	0.758	78%	0.777	S	S	*	*			trans	-102.4	147.6	150.8	-176.2	0	0	0	0	107.3	V137 G141	V137-V139 HydrophobicContact CG1-CG2 4.3Å; V137-V139 PolarHBondContact O-N 3.03Å; V139-G141 PolarHBondContact O-N 2.81Å
140	Q	43.6	Very low	35.3	Very low	201 Å²	201	151.7 Å²	151.7	94%	0.939	77%	0.773	S	S	*	*	S	Bend	trans	-72.4	114.1	-166.9	-64.6	176.9	-3.8	0	0	112.2
141	G	47.3	Very low	35	Very low	73 Å²	73	147.7 Å²	147.7	75%	0.753	76%	0.764	S	S	*	*	S	Bend	trans	121.9	3.8	143.7	0	0	0	0	0	120.4	V139	V139-G141 PolarHBondContact O-N 2.81Å
142	Q	36.1	Very low	34.6	Very low	180 Å²	180	150.1 Å²	150.1	84%	0.841	77%	0.769	S	S	*	*			trans	-155.9	140	168.6	-124.4	167.8	-107	0	0	113.9
143	E	35	Very low	34.1	Very low	200 Å²	200	146 Å²	146	94%	0.935	78%	0.775	S	S	*	*			trans	-83.7	127.7	167.1	-74.3	-170.5	124.2	0	0	110.3
144	V	31.8	Very low	33.9	Very low	118 Å²	118	143.7 Å²	143.7	72%	0.715	78%	0.778	S	S	*	*			trans	-138	130	166	-178.5	0	0	0	0	107.7
145	L	32.7	Very low	33.7	Very low	159 Å²	159	143.5 Å²	143.5	83%	0.832	79%	0.785	S	S	*	*			trans	-100.1	118.9	171.4	-74.4	168.1	0	0	0	109	W134	W134-L145 HydrophobicContact CZ3-CD2 4.35Å
146	S	29.1	Very low	33.7	Very low	114 Å²	114	143.5 Å²	143.5	80%	0.797	79%	0.787	S	S	*	*			trans	-121	150.5	167.9	53.6	0	0	0	0	110.2
147	E	31	Very low	33.2	Very low	141 Å²	141	146.8 Å²	146.8	66%	0.659	80%	0.795	S	S	*	*			trans	-126.8	115.8	179.2	177.5	160.5	-122	0	0	108.4	R132	R132-E147 IonicContact CZ-OE1 2.87Å; R132-E147 IonicContact NH1-OE1 3.6Å; R132-E147 PolarHBondContact NH1-OE1 2.81Å; R132-E147 IonicContact NH2-OE1 3.29Å; R132-E147 PolarHBondContact NH2-OE1 3.06Å
148	E	28.9	Very low	32.7	Very low	175 Å²	175	145.7 Å²	145.7	82%	0.818	79%	0.792	S	S	*	*			trans	-121.3	137.4	-174.9	-165.9	164.3	-133.8	0	0	109.8
149	T	28.1	Very low	32	Very low	119 Å²	119	142.6 Å²	142.6	73%	0.73	79%	0.79	S	S	*	*			trans	-114.6	124.2	-173.1	-62.4	0	0	0	0	109.6
150	L	27.7	Very low	31.4	Very low	157 Å²	157	142 Å²	142	82%	0.822	79%	0.791	S	S	*	*			trans	-115.5	127.4	175.8	-67.2	177.6	0	0	0	110.3
151	H	30.9	Very low	30.7	Very low	147 Å²	147	139.8 Å²	139.8	68%	0.681	78%	0.781	S	S	*	*			trans	-76.7	134	168.6	-77.8	-99.8	0	0	0	110.5	E101	E101-H151 IonicContact OE1-CE1 3.65Å; E101-H151 PolarHBondContact OE1-CE1 2.82Å; E101-H151 IonicContact OE1-ND1 3.79Å
152	L	28.5	Very low	29.8	Very low	173 Å²	173	143.3 Å²	143.3	91%	0.906	78%	0.778	S	S	*	*			trans	-141.1	140.6	150.7	-66.6	175.6	0	0	0	105.7
153	G	26.6	Very low	29.4	Very low	69 Å²	69	143.1 Å²	143.1	71%	0.711	78%	0.777	S	S	*	*			cis	106.1	93.4	19.3	0	0	0	0	0	108.5
154	L	28.2	Very low	29.3	Very low	171 Å²	171	140.7 Å²	140.7	90%	0.895	77%	0.77	S	S	*	*			trans	-122.1	110.6	-178.8	-78.4	174.4	0	0	0	109.9
155	E	30.9	Very low	30.3	Very low	185 Å²	185	139.6 Å²	139.6	86%	0.864	77%	0.765	S	S	*	*			trans	-149.1	136.1	155.2	-78.4	-56.1	162.6	0	0	107.7
156	P	38.5	Very low	30.1	Very low	103 Å²	103	137 Å²	137	67%	0.669	76%	0.756	S	S	*	*			trans	-120.3	137.7	176.4	37.5	-25.7	0	0	0	114.4
157	E	26.8	Very low	30.3	Very low	183 Å²	183	139.7 Å²	139.7	86%	0.855	76%	0.756	S	S	*	*			trans	69.1	137.3	162.9	-52.1	-64.2	104.8	0	0	117
158	S	26.7	Very low	30.2	Very low	95 Å²	95	138.1 Å²	138.1	66%	0.664	76%	0.756	S	S	*	*			cis	-164.2	164.2	0.7	51.3	0	0	0	0	114.5
159	S	25.5	Very low	30.3	Very low	106 Å²	106	137.1 Å²	137.1	74%	0.741	76%	0.756	S	S	*	*			trans	81.6	121	151.6	68.9	0	0	0	0	123
160	S	26.1	Very low	30.1	Very low	112 Å²	112	136.8 Å²	136.8	78%	0.783	75%	0.754	S	S	*	*			trans	61	149.6	155.4	86.5	0	0	0	0	119.9
161	E	28.4	Very low	30	Very low	156 Å²	156	134.8 Å²	134.8	73%	0.729	75%	0.749	S	S	*	*			cis	-157.4	169.9	-10	-134.5	-178.1	91.3	0	0	112.1
162	Q	28.9	Very low	29.9	Very low	147 Å²	147	135 Å²	135	69%	0.687	75%	0.75	S	S	*	*			trans	74.2	109.6	155.6	-67.2	166.2	27.1	0	0	123.6
163	Q	27.8	Very low	29.9	Very low	175 Å²	175	134.6 Å²	134.6	82%	0.818	74%	0.743	S	S	*	*				66.2	98.9	125.1	-62.6	175.5	-4.8	0	0	123.8
164	D	31.4	Very low	31	Very low	150 Å²	150	136 Å²	136	80%	0.802	74%	0.74	S	S	*	*				44.9	156.7	106.7	-142.6	44.1	0	0	0	122.4
165	P	54	Low	31	Very low	94 Å²	94	135.8 Å²	135.8	61%	0.61	73%	0.734	S	S	*	*				-118.9	-164.6	-66.1	35.6	-19.1	0	0	0	113
166	T	28.1	Very low	30.9	Very low	104 Å²	104	135.2 Å²	135.2	64%	0.638	73%	0.731	S	S	*	*				170.7	114.3	92.3	-61.5	0	0	0	0	114.7
167	Q	33.9	Very low	30.4	Very low	171 Å²	171	138.2 Å²	138.2	80%	0.799	74%	0.736	S	S	*	*			trans	56.8	166.5	142.3	-53.5	176.7	32.1	0	0	121.3
168	T	27.7	Very low	30.6	Very low	108 Å²	108	133.4 Å²	133.4	66%	0.663	73%	0.728	S	S	*	*			cis	-165.6	147.6	3	-0.8	0	0	0	0	112.9
169	L	31.3	Very low	30.6	Very low	154 Å²	154	135.8 Å²	135.8	81%	0.806	73%	0.732	S	S	*	*			trans	40	172.7	144.6	-89.4	51	0	0	0	122.3
170	T	25	Very low	30.7	Very low	112 Å²	112	141.9 Å²	141.9	69%	0.687	74%	0.739	S	S	*	*			cis	-158.5	159.1	-1.7	14.2	0	0	0	0	107.2
171	T	25.1	Very low	30.9	Very low	116 Å²	116	142 Å²	142	71%	0.712	74%	0.74	S	S	*	*			cis	92.8	126.5	30.7	-52.2	0	0	0	0	114.4
172	E	28.7	Very low	32	Very low	151 Å²	151	140.3 Å²	140.3	71%	0.706	74%	0.742	S	S	*	*			cis	-168.8	165.9	-14	-115.5	-167	85.9	0	0	113.4
173	Q	28.8	Very low	32	Very low	164 Å²	164	140.1 Å²	140.1	77%	0.766	75%	0.746	S	S	*	*			trans	66	173.5	150.9	-86.9	-167.8	10.8	0	0	123
174	P	48.6	Very low	31.9	Very low	98 Å²	98	139.6 Å²	139.6	64%	0.636	75%	0.748	S	S	*	*			cis	-143.2	171	-27	35.2	-15	0	0	0	119.1
175	H	29	Very low	31.7	Very low	168 Å²	168	135.5 Å²	135.5	78%	0.778	74%	0.741	S	S	*	*			trans	65.9	161.3	147.5	-85.4	-129.2	0	0	0	122.3
176	E	28.5	Very low	30.4	Very low	172 Å²	172	137.6 Å²	137.6	80%	0.804	75%	0.752	S	S	*	*			cis	-154	-165.9	14	-152.1	141.1	-116.1	0	0	116.5
177	E	28.7	Very low	30.4	Very low	167 Å²	167	140.3 Å²	140.3	78%	0.78	76%	0.758	S	S	*	*			trans	-63.4	166	-172.3	-80.9	-146.3	105.7	0	0	118.9
178	A	29.6	Very low	30	Very low	81 Å²	81	139.6 Å²	139.6	67%	0.669	75%	0.754	S	S	*	*			cis	97.5	159.1	25.1	0	0	0	0	0	115.6
179	L	28.6	Very low	30.1	Very low	146 Å²	146	141 Å²	141	76%	0.764	75%	0.753	S	S	*	*			cis	-164.9	165.6	2	-136.7	179.7	0	0	0	112.6
180	R	26.6	Very low	30	Very low	234 Å²	234	140.9 Å²	140.9	88%	0.883	75%	0.749	S	S	*	*			trans	84.2	159	164.8	-60.3	-167.5	-175.4	-152.1	1.4	122.3
181	S	31	Very low	30	Very low	115 Å²	115	140.7 Å²	140.7	80%	0.804	75%	0.747	S	S	*	*			trans	-126.4	-168.6	-174	-39.8	0	0	0	0	110.9
182	P	50.3	Low	30	Very low	119 Å²	119	141.6 Å²	141.6	77%	0.773	75%	0.747	S	S	*	*			cis	-146.5	-169.8	5.8	40	-16.2	0	0	0	118.8
183	D	28.6	Very low	30	Very low	144 Å²	144	141.5 Å²	141.5	77%	0.77	75%	0.747	S	S	*	*			trans	106.1	153.6	137.5	-134.2	-11.1	0	0	0	124.2
184	L	26.5	Very low	30	Very low	164 Å²	164	140.3 Å²	140.3	86%	0.859	74%	0.741	S	S	*	*			trans	71.4	151.4	170.9	-48	179.6	0	0	0	120
185	G	26.2	Very low	28.9	Very low	63 Å²	63	141.7 Å²	141.7	65%	0.649	74%	0.743	S	S	*	*			cis	156.7	122.2	-18.2	0	0	0	0	0	117.7
186	T	27.9	Very low	29	Very low	139 Å²	139	141.4 Å²	141.4	85%	0.853	74%	0.742	S	S	*	*			trans	61.8	161	161.2	43.2	0	0	0	0	120.6
187	Q	27.4	Very low	28.9	Very low	160 Å²	160	140 Å²	140	75%	0.748	74%	0.735	S	S	*	*			cis	-171.6	176.2	-24.4	-171.1	174.5	-28.6	0	0	110.2
188	E	27.2	Very low	28.8	Very low	156 Å²	156	139.6 Å²	139.6	73%	0.729	73%	0.733	S	S	*	*			trans	79	152.8	162.7	-53.2	-170.7	131.1	0	0	118
189	Q	29.6	Very low	28.6	Very low	138 Å²	138	143.3 Å²	143.3	65%	0.645	74%	0.741	S	S	*	*			cis	-162	139.2	-12.9	-120.1	-177.9	-46.8	0	0	111.6
190	E	28.8	Very low	28.9	Very low	152 Å²	152	142.1 Å²	142.1	71%	0.71	74%	0.742	S	S	*	*			trans	53.6	168.9	142.8	-74.4	177.3	-95.7	0	0	121.6
191	T	23.9	Very low	28.9	Very low	107 Å²	107	138.4 Å²	138.4	66%	0.656	74%	0.739	S	S	*	*			cis	-157	163.9	-3.1	2.9	0	0	0	0	112.7
192	L	25.1	Very low	29	Very low	135 Å²	135	138.2 Å²	138.2	71%	0.707	74%	0.735	S	S	*	*			trans	53.8	114.7	149.3	-64.6	164.3	0	0	0	123.7
193	Q	29.6	Very low	27.7	Very low	150 Å²	150	140.9 Å²	140.9	70%	0.701	74%	0.737	S	S	*	*				46.8	152.8	125.8	-63.8	-176.2	-100.1	0	0	121.4
194	H	27.9	Very low	27.3	Very low	139 Å²	139	139 Å²	139	64%	0.644	73%	0.734	S	S	*	*			cis	-153.6	-151.9	8.2	-136.2	-147.1	0	0	0	110.8
195	D	26.5	Very low	27.1	Very low	126 Å²	126	139.6 Å²	139.6	67%	0.674	73%	0.732	S	S	*	*			cis	-158.5	-166.2	11.2	-134.8	-40.6	0	0	0	114.1
196	E	30.3	Very low	27.2	Very low	163 Å²	163	142.3 Å²	142.3	76%	0.762	74%	0.736	S	S	*	*			trans	-54.1	167.3	175.5	-79.6	-170.1	142.6	0	0	118.8
197	E	27.2	Very low	27.1	Very low	141 Å²	141	141.2 Å²	141.2	66%	0.659	73%	0.731	S	S	*	*			cis	-159.9	-176.2	5.5	-131.1	-145.9	111.1	0	0	115.4
198	H	26.5	Very low	27	Very low	160 Å²	160	139.5 Å²	139.5	74%	0.741	73%	0.732	S	S	*	*			trans	87.5	144.3	155.3	-83.4	21.2	0	0	0	123.2
199	L	26.2	Very low	26.9	Very low	158 Å²	158	137.2 Å²	137.2	83%	0.827	73%	0.733	S	S	*	*			trans	-135	156.7	-177.5	-94.3	168.3	0	0	0	108.6
200	P	33	Very low	26.8	Very low	121 Å²	121	139.8 Å²	139.8	79%	0.786	75%	0.745	S	S	*	*				-154.8	-179	85.7	40.1	-18.5	0	0	0	118.4
201	L	26.6	Very low	26.8	Very low	156 Å²	156	140.1 Å²	140.1	82%	0.817	75%	0.752	S	S	*	*			trans	-62.6	170	176.5	-67.4	175.1	0	0	0	114.2
202	P	33.5	Very low	26.9	Very low	111 Å²	111	141.8 Å²	141.8	72%	0.721	76%	0.761	S	S	*	*			cis	-156.3	176.4	43.2	45.5	-23	0	0	0	122.6
203	E	23.3	Very low	26.9	Very low	175 Å²	175	141.6 Å²	141.6	82%	0.818	76%	0.761	S	S	*	*			trans	72.5	123.1	143.5	-80.8	165.7	-170.4	0	0	125.1
204	C	20.9	Very low	26.9	Very low	106 Å²	106	140.4 Å²	140.4	72%	0.716	76%	0.759	S	S	*	*			trans	31	125.5	140.4	-54.7	0	0	0	0	123.2
205	E	22.4	Very low	27.1	Very low	175 Å²	175	140 Å²	140	82%	0.818	77%	0.769	S	S	*	*				-176.2	173	96.6	-94	-55.6	124.3	0	0	110.7
206	V	27.3	Very low	27.2	Very low	121 Å²	121	138.4 Å²	138.4	73%	0.733	76%	0.763	S	S	*	*			trans	-122.5	145.5	-177.8	-150.9	0	0	0	0	111.2
207	P	26.6	Very low	27.1	Very low	115 Å²	115	139.7 Å²	139.7	75%	0.747	77%	0.769	S	S	*	*				-152.3	137	112.4	35.6	-17.3	0	0	0	117.4
208	V	23.8	Very low	27.3	Very low	125 Å²	125	142 Å²	142	76%	0.758	78%	0.78	S	S	*	*				49.4	128.4	127.3	-179.5	0	0	0	0	121.9
209	S	26.8	Very low	27.4	Very low	107 Å²	107	137.9 Å²	137.9	75%	0.748	78%	0.781	S	S	*	*			trans	72.6	117.9	157.4	-67.1	0	0	0	0	121
210	Q	27.2	Very low	27.9	Very low	193 Å²	193	136.7 Å²	136.7	90%	0.902	79%	0.786	S	S	*	*				-179.1	154.3	109	-98.1	173.2	-5.8	0	0	112.4
211	D	27.9	Very low	28	Very low	159 Å²	159	133.5 Å²	133.5	85%	0.85	78%	0.776	S	S	*	*			trans	-82.8	140.7	175.6	-51.3	-97.4	0	0	0	112.5
212	V	26.9	Very low	28.5	Very low	142 Å²	142	132 Å²	132	86%	0.861	76%	0.764	S	S	*	*			trans	-145.8	132.3	151.9	-179.2	0	0	0	0	111.3
213	D	25.2	Very low	28.8	Very low	130 Å²	130	131.5 Å²	131.5	70%	0.695	76%	0.761	S	S	*	*			trans	-23.8	135	170.1	-73.8	-84.9	0	0	0	123.6
214	L	28.9	Very low	29.5	Very low	125 Å²	125	129.2 Å²	129.2	65%	0.654	75%	0.75	S	S	*	*				62.8	159.6	111.2	-119.4	72	0	0	0	120.1	T216	L214-T216 WeakPolarHBondContact CD2-OG1 3.38Å; L214-T216 WeakPolarHBondContact CG-OG1 3.34Å
215	P	32.5	Very low	30.3	Very low	132 Å²	132	130.2 Å²	130.2	86%	0.857	75%	0.746	S	S	*	*				-129.4	156.1	65.5	34.6	-19.2	0	0	0	115.9
216	T	28.3	Very low	31.4	Very low	91 Å²	91	126.1 Å²	126.1	56%	0.558	73%	0.733	S	S	*	*			trans	-113.1	124	-179.7	-71.9	0	0	0	0	110.3	L214	L214-T216 WeakPolarHBondContact CD2-OG1 3.38Å; L214-T216 WeakPolarHBondContact CG-OG1 3.34Å
217	E	28.9	Very low	32	Very low	191 Å²	191	123.2 Å²	123.2	89%	0.893	72%	0.721	S	S	*	*			trans	-80.4	126.6	166.8	-80	-78.1	88.7	0	0	110.1	G219	E217-G219 PolarHBondContact O-N 3.47Å
218	Q	29.8	Very low	32.7	Very low	188 Å²	188	123 Å²	123	88%	0.879	71%	0.713	S	S	*	*			trans	-85.2	111.8	-168.5	-66.7	179.1	-13.3	0	0	112.9
219	G	30	Very low	33.7	Very low	75 Å²	75	122.8 Å²	122.8	77%	0.773	71%	0.707	S	S	*	*			trans	-90.1	118.5	166.1	0	0	0	0	0	111.6	E217 G221	E217-G219 PolarHBondContact O-N 3.47Å; G219-G221 PolarHBondContact O-N 2.89Å
220	S	36.8	Very low	34.3	Very low	132 Å²	132	120.6 Å²	120.6	92%	0.923	69%	0.689	S	S	*	*			trans	-73.9	84	-175.7	61.3	0	0	0	0	113.5
221	G	33.8	Very low	35	Very low	55 Å²	55	114.5 Å²	114.5	57%	0.567	67%	0.672	S	S	*	*			trans	-96.2	139.4	163.6	0	0	0	0	0	111.3	G219 P223	G219-G221 PolarHBondContact O-N 2.89Å; G221-P223 VanDerWaalsContact O-CD 3.31Å; G221-P223 WeakPolarHBondContact O-CD 3.39Å
222	H	38.5	Very low	35.7	Very low	123 Å²	123	113.1 Å²	113.1	57%	0.569	66%	0.664	S	S	*	*			trans	-63.9	119	177.6	-136	-106.1	0	0	0	109.7	E224 M225	H222-E224 IonicContact CE1-OE2 3.25Å; H222-E224 PolarHBondContact CE1-OE2 3.06Å; H222-E224 IonicContact ND1-OE2 3.14Å; H222-E224 PolarHBondContact ND1-OE2 2.85Å; H222-E224 PolarHBondContact O-N 3.1Å; H222-E224 VanDerWaalsContact O-N 3.15Å; H222-M225 PolarHBondContact O-N 3.38Å; H222-M225 VanDerWaalsContact O-N 3.13Å
223	P	39.1	Very low	36.4	Very low	102 Å²	102	110.7 Å²	110.7	66%	0.662	65%	0.653	S	S	*	*	H	α-helix	trans	-58.4	-32.8	-174.7	-27.6	36.4	0	0	0	113.3	G221 M225 V226 A227	G221-P223 VanDerWaalsContact O-CD 3.31Å; G221-P223 WeakPolarHBondContact O-CD 3.39Å; P223-M225 PolarHBondContact O-N 3.37Å; P223-V226 PolarHBondContact O-N 3.15Å; P223-A227 WeakPolarHBondContact O-CB 3.35Å; P223-A227 PolarHBondContact O-N 2.9Å
224	E	37.1	Very low	37.2	Very low	126 Å²	126	112 Å²	112	59%	0.589	66%	0.655	S	S	*	*	H	α-helix	trans	-61	-37.8	178.1	-64.8	172.5	122.8	0	0	113.7	H222 V226 A227 L228	H222-E224 IonicContact CE1-OE2 3.25Å; H222-E224 PolarHBondContact CE1-OE2 3.06Å; H222-E224 IonicContact ND1-OE2 3.14Å; H222-E224 PolarHBondContact ND1-OE2 2.85Å; H222-E224 PolarHBondContact O-N 3.1Å; H222-E224 VanDerWaalsContact O-N 3.15Å; E224-V226 VanDerWaalsContact C-N 3.33Å; E224-A227 PolarHBondContact O-N 3.38Å; E224-L228 WeakPolarHBondContact O-CB 3.31Å; E224-L228 WeakPolarHBondContact O-CG 3.4Å; E224-L228 PolarHBondContact O-N 3.19Å
225	M	39.3	Very low	38.1	Very low	128 Å²	128	108 Å²	108	63%	0.631	64%	0.644	S	S	*	*	H	α-helix	trans	-68.8	-35.3	176.3	-94.8	-155.3	-65.8	0	0	111.7	H222 P223 L229	H222-M225 PolarHBondContact O-N 3.38Å; H222-M225 VanDerWaalsContact O-N 3.13Å; P223-M225 PolarHBondContact O-N 3.37Å; M225-L229 WeakPolarHBondContact O-CB 3.25Å; M225-L229 VanDerWaalsContact O-CG 3.26Å; M225-L229 WeakPolarHBondContact O-CG 3.48Å; M225-L229 PolarHBondContact O-N 3.17Å
226	V	44.3	Very low	38.6	Very low	89 Å²	89	109.3 Å²	109.3	54%	0.539	64%	0.643	S	S	.	*	H	α-helix	trans	-68.4	-40.4	173.9	-174.7	0	0	0	0	110	P223 E224 L229 T230	P223-V226 PolarHBondContact O-N 3.15Å; E224-V226 VanDerWaalsContact C-N 3.33Å; V226-L229 PolarHBondContact O-N 3.16Å; V226-T230 VanDerWaalsContact O-CB 3.3Å; V226-T230 WeakPolarHBondContact O-CB 3.34Å; V226-T230 PolarHBondContact O-N 2.9Å; V226-T230 PolarHBondContact O-OG1 2.82Å
227	A	40.3	Very low	39.3	Very low	59 Å²	59	109.4 Å²	109.4	49%	0.488	64%	0.643	S	S	.	*	H	α-helix	trans	-64.6	-43.6	176.5	0	0	0	0	0	112.6	P223 E224 T230 A231	P223-A227 WeakPolarHBondContact O-CB 3.35Å; P223-A227 PolarHBondContact O-N 2.9Å; E224-A227 PolarHBondContact O-N 3.38Å; A227-T230 PolarHBondContact O-N 2.82Å; A227-A231 WeakPolarHBondContact O-CB 3.49Å; A227-A231 PolarHBondContact O-N 2.8Å
228	L	41.3	Very low	40.2	Very low	112 Å²	112	103.7 Å²	103.7	59%	0.586	62%	0.622	S	S	*	*	H	α-helix	trans	-61.5	-48.3	174.8	-78.4	166.1	0	0	0	111.9	E224 T230 A231 L232	E224-L228 WeakPolarHBondContact O-CB 3.31Å; E224-L228 WeakPolarHBondContact O-CG 3.4Å; E224-L228 PolarHBondContact O-N 3.19Å; L228-T230 VanDerWaalsContact C-N 3.27Å; L228-T230 PolarHBondContact O-N 3.38Å; L228-A231 PolarHBondContact O-N 3.42Å; L228-L232 WeakPolarHBondContact O-CB 3.26Å; L228-L232 VanDerWaalsContact O-CG 3.31Å; L228-L232 WeakPolarHBondContact O-CG 3.44Å; L228-L232 PolarHBondContact O-N 3.05Å
229	L	43.8	Very low	40.7	Very low	120 Å²	120	100.2 Å²	100.2	63%	0.628	60%	0.604	S	S	*	*	H	α-helix	trans	-63.6	-34.1	176.1	-69.8	169.1	0	0	0	112	M225 V226 S233	M225-L229 WeakPolarHBondContact O-CB 3.25Å; M225-L229 VanDerWaalsContact O-CG 3.26Å; M225-L229 WeakPolarHBondContact O-CG 3.48Å; M225-L229 PolarHBondContact O-N 3.17Å; V226-L229 PolarHBondContact O-N 3.16Å; L229-S233 WeakPolarHBondContact O-CB 3.34Å; L229-S233 PolarHBondContact O-N 3.22Å
230	T	41.3	Very low	41.5	Very low	61 Å²	61	105.6 Å²	105.6	37%	0.374	61%	0.606	S	S	.	*	H	α-helix	trans	-70.4	-44	175.5	-56.4	0	0	0	0	111.6	V226 A227 L228 S233 Q234	V226-T230 VanDerWaalsContact O-CB 3.3Å; V226-T230 WeakPolarHBondContact O-CB 3.34Å; V226-T230 PolarHBondContact O-N 2.9Å; V226-T230 PolarHBondContact O-OG1 2.82Å; A227-T230 PolarHBondContact O-N 2.82Å; L228-T230 VanDerWaalsContact C-N 3.27Å; L228-T230 PolarHBondContact O-N 3.38Å; T230-S233 WeakPolarHBondContact O-CB 3.29Å; T230-S233 PolarHBondContact O-N 3Å; T230-S233 VanDerWaalsContact O-N 3.07Å; T230-S233 PolarHBondContact O-OG 3.48Å; T230-Q234 WeakPolarHBondContact O-CG 3.46Å; T230-Q234 PolarHBondContact O-N 3.43Å
231	A	41.4	Very low	42	Very low	65 Å²	65	103.4 Å²	103.4	54%	0.537	58%	0.584	S	S	.	*	H	α-helix	trans	-62.4	-44.6	177	0	0	0	0	0	111.7	A227 L228 S233 Q234	A227-A231 WeakPolarHBondContact O-CB 3.49Å; A227-A231 PolarHBondContact O-N 2.8Å; L228-A231 PolarHBondContact O-N 3.42Å; A231-S233 PolarHBondContact O-N 2.7Å; A231-Q234 PolarHBondContact O-N 2.89Å; A231-Q234 VanDerWaalsContact O-N 3.1Å
232	L	41.4	Very low	42.7	Very low	130 Å²	130	104.1 Å²	104.1	68%	0.681	58%	0.577	S	S	*	*	H	α-helix	trans	-62.5	-21.7	174.1	-69.8	170.7	0	0	0	113.2	L228	L228-L232 WeakPolarHBondContact O-CB 3.26Å; L228-L232 VanDerWaalsContact O-CG 3.31Å; L228-L232 WeakPolarHBondContact O-CG 3.44Å; L228-L232 PolarHBondContact O-N 3.05Å
233	S	42.1	Very low	43.2	Very low	90 Å²	90	99.3 Å²	99.3	63%	0.629	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-10.4	175.9	77.7	0	0	0	0	114.6	L229 T230 A231	L229-S233 WeakPolarHBondContact O-CB 3.34Å; L229-S233 PolarHBondContact O-N 3.22Å; T230-S233 WeakPolarHBondContact O-CB 3.29Å; T230-S233 PolarHBondContact O-N 3Å; T230-S233 VanDerWaalsContact O-N 3.07Å; T230-S233 PolarHBondContact O-OG 3.48Å; A231-S233 PolarHBondContact O-N 2.7Å
234	Q	43.2	Very low	43.9	Very low	157 Å²	157	100.1 Å²	100.1	73%	0.734	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-9.1	-174	-69.7	178.3	7.8	0	0	114.3	T230 A231	T230-Q234 WeakPolarHBondContact O-CG 3.46Å; T230-Q234 PolarHBondContact O-N 3.43Å; A231-Q234 PolarHBondContact O-N 2.89Å; A231-Q234 VanDerWaalsContact O-N 3.1Å
235	G	46.3	Very low	44.4	Very low	42 Å²	42	99.4 Å²	99.4	43%	0.433	57%	0.565	S	S	.	*	S	Bend	trans	-122	117.7	173.7	0	0	0	0	0	111.7	V237	G235-V237 VanDerWaalsContact C-N 3.34Å; G235-V237 PolarHBondContact O-N 2.84Å
236	L	44.1	Very low	45.3	Very low	160 Å²	160	97.4 Å²	97.4	84%	0.838	55%	0.553	S	S	*	*			trans	-75.7	82.5	176.6	-74.1	170.5	0	0	0	111.1	T238	L236-T238 PolarHBondContact O-N 3.33Å
237	V	41.7	Very low	46.2	Very low	92 Å²	92	95.4 Å²	95.4	56%	0.558	54%	0.543	S	S	*	.			trans	-70.7	121.1	166.9	-176.9	0	0	0	0	108.6	G235 D241 V242	G235-V237 VanDerWaalsContact C-N 3.34Å; G235-V237 PolarHBondContact O-N 2.84Å; V237-D241 HydrophobicContact CG1-CB 4.09Å; V237-V242 HydrophobicContact CG1-CG2 3.87Å
238	T	47.9	Very low	46.9	Very low	72 Å²	72	99.4 Å²	99.4	44%	0.442	55%	0.551	S	S	.	*			trans	-98.9	166.7	176.8	79.3	0	0	0	0	110.9	L236 K240 D241	L236-T238 PolarHBondContact O-N 3.33Å; T238-K240 PolarHBondContact O-N 3.26Å; T238-K240 VanDerWaalsContact O-N 3.16Å; T238-K240 PolarHBondContact OG1-N 2.99Å; T238-D241 WeakPolarHBondContact CA-OD2 3.49Å; T238-D241 VanDerWaalsContact CB-OD2 3.28Å; T238-D241 WeakPolarHBondContact CB-OD2 3.47Å; T238-D241 PolarHBondContact N-OD2 3.08Å; T238-D241 PolarHBondContact O-N 3.28Å; T238-D241 PolarHBondContact OG1-OD2 3.21Å
239	F	41.4	Very low	47.6	Very low	115 Å²	115	99.6 Å²	99.6	50%	0.504	55%	0.553	S	S	.	*	H	α-helix	trans	-58.3	-28.5	176.2	-173.4	-111	0	0	0	113	D241 V242 A243 V274	F239-D241 VanDerWaalsContact C-N 3.28Å; F239-D241 PolarHBondContact O-N 3.46Å; F239-V242 PolarHBondContact O-N 3.17Å; F239-A243 HydrophobicContact CD1-CB 4.48Å; F239-A243 HydrophobicContact CE1-CB 4.2Å; F239-A243 HydrophobicContact CZ-CB 4.37Å; F239-A243 VanDerWaalsContact O-CB 3.31Å; F239-A243 WeakPolarHBondContact O-CB 3.32Å; F239-A243 PolarHBondContact O-N 3.38Å; F239-V274 HydrophobicContact CD2-CG2 4.16Å
240	K	46.9	Very low	48.5	Very low	187 Å²	187	99 Å²	99	81%	0.813	55%	0.547	S	S	*	.	H	α-helix	trans	-69.7	-19.9	176.2	-81.1	-169.3	171	-172.6	0	114.2	T238 V242	T238-K240 PolarHBondContact O-N 3.26Å; T238-K240 VanDerWaalsContact O-N 3.16Å; T238-K240 PolarHBondContact OG1-N 2.99Å; K240-V242 VanDerWaalsContact C-N 3.35Å
241	D	46.9	Very low	49.7	Very low	87 Å²	87	100.6 Å²	100.6	47%	0.465	55%	0.546	S	S	.	.	H	α-helix	trans	-86.4	-13.8	-176.9	-54.2	-63.2	0	0	0	112.6	R61 V237 T238 F239	R61-D241 PolarHBondContact NH2-O 3.41Å; V237-D241 HydrophobicContact CG1-CB 4.09Å; T238-D241 WeakPolarHBondContact CA-OD2 3.49Å; T238-D241 VanDerWaalsContact CB-OD2 3.28Å; T238-D241 WeakPolarHBondContact CB-OD2 3.47Å; T238-D241 PolarHBondContact N-OD2 3.08Å; T238-D241 PolarHBondContact O-N 3.28Å; T238-D241 PolarHBondContact OG1-OD2 3.21Å; F239-D241 VanDerWaalsContact C-N 3.28Å; F239-D241 PolarHBondContact O-N 3.46Å
242	V	47.3	Very low	50.6	Low	69 Å²	69	100.9 Å²	100.9	42%	0.418	54%	0.544	S	S	.	.	H	α-helix	trans	-108.5	-41.8	-179.6	-170.7	0	0	0	0	111.6	V237 F239 K240 L244 D270	V237-V242 HydrophobicContact CG1-CG2 3.87Å; F239-V242 PolarHBondContact O-N 3.17Å; K240-V242 VanDerWaalsContact C-N 3.35Å; V242-L244 PolarHBondContact O-N 3.17Å; V242-D270 VanDerWaalsContact CG1-OD1 3.28Å; V242-D270 WeakPolarHBondContact CG1-OD1 3.25Å
243	A	50.1	Low	51.8	Low	23 Å²	23	101.5 Å²	101.5	19%	0.19	55%	0.548	C	S	.	.			trans	-62.4	125.4	-174.8	0	0	0	0	0	113.9	F239 C245	F239-A243 HydrophobicContact CD1-CB 4.48Å; F239-A243 HydrophobicContact CE1-CB 4.2Å; F239-A243 HydrophobicContact CZ-CB 4.37Å; F239-A243 VanDerWaalsContact O-CB 3.31Å; F239-A243 WeakPolarHBondContact O-CB 3.32Å; F239-A243 PolarHBondContact O-N 3.38Å; A243-C245 PolarHBondContact O-N 2.85Å; A243-C245 VanDerWaalsContact O-N 3.15Å
244	L	53.4	Low	53	Low	118 Å²	118	98.8 Å²	98.8	62%	0.618	53%	0.527	S	S	*	.			trans	-85	77.6	176.5	-69.4	174.4	0	0	0	111.7	V242 F246 Y262	V242-L244 PolarHBondContact O-N 3.17Å; L244-F246 PolarHBondContact O-N 3.42Å; L244-Y262 HydrophobicContact CB-CE2 4.42Å; L244-Y262 PolarHBondContact O-OH 2.92Å
245	C	47.2	Very low	54.1	Low	111 Å²	111	94.1 Å²	94.1	75%	0.75	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-68.8	120.3	176.6	-61.5	0	0	0	0	112.5	A243	A243-C245 PolarHBondContact O-N 2.85Å; A243-C245 VanDerWaalsContact O-N 3.15Å
246	F	58.5	Low	54.8	Low	86 Å²	86	97.2 Å²	97.2	38%	0.377	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-82.2	154.8	167.6	-65.1	-82.6	0	0	0	111.8	L244 Q250 W251 L254 Y262	L244-F246 PolarHBondContact O-N 3.42Å; F246-Q250 HydrophobicContact CB-CB 4.23Å; F246-Q250 HydrophobicContact CD1-CB 4.18Å; F246-W251 HydrophobicContact CB-CB 4.26Å; F246-W251 HydrophobicContact CB-CE3 4.34Å; F246-W251 AromaticContact CD2-CE3 3.73Å; F246-W251 HydrophobicContact CD2-CE3 3.73Å; F246-W251 AromaticContact CD2-CZ3 4Å; F246-W251 HydrophobicContact CD2-CZ3 4Å; F246-W251 HydrophobicContact CE2-CE3 4.39Å; F246-W251 HydrophobicContact CE2-CZ3 4.31Å; F246-W251 HydrophobicContact CG-CE3 4.25Å; F246-L254 HydrophobicContact CD1-CD1 4.31Å; F246-L254 HydrophobicContact CD2-CD1 4.18Å; F246-L254 HydrophobicContact CE1-CD1 4.11Å; F246-L254 HydrophobicContact CE1-CD2 4.42Å; F246-L254 HydrophobicContact CE2-CD1 3.96Å; F246-L254 HydrophobicContact CG-CD1 4.34Å; F246-L254 HydrophobicContact CZ-CD1 3.93Å; F246-Y262 HydrophobicContact CD2-CE2 4.26Å; F246-Y262 AromaticContact CE2-CD2 3.7Å; F246-Y262 HydrophobicContact CE2-CD2 3.7Å; F246-Y262 AromaticContact CE2-CE2 3.68Å; F246-Y262 HydrophobicContact CE2-CE2 3.68Å; F246-Y262 HydrophobicContact CE2-CG 4.29Å
247	S	63.8	Low	55.6	Low	48 Å²	48	94.1 Å²	94.1	34%	0.336	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-72.1	163.8	162.8	81.9	0	0	0	0	111.3	D249 Q250 W251	S247-D249 PolarHBondContact O-N 3.23Å; S247-Q250 PolarHBondContact O-N 2.98Å; S247-Q250 WeakPolarHBondContact OG-CG 3.43Å; S247-Q250 PolarHBondContact OG-N 2.87Å; S247-W251 WeakPolarHBondContact O-CB 3.5Å; S247-W251 PolarHBondContact O-N 2.74Å
248	Q	54.5	Low	56.5	Low	143 Å²	143	94 Å²	94	67%	0.668	50%	0.5	S	S	*	.	H	α-helix	trans	-60	-35.3	178.6	-176.6	60.9	32.1	0	0	112.5	S252	Q248-S252 PolarHBondContact O-N 3.02Å; Q248-S252 VanDerWaalsContact O-N 3.1Å; Q248-S252 PolarHBondContact O-OG 3.33Å
249	D	57.1	Low	57.6	Low	116 Å²	116	93.4 Å²	93.4	62%	0.62	49%	0.492	S	S	*	.	H	α-helix	trans	-73.3	-49.2	178.6	-40.5	-67.1	0	0	0	110.5	S247 W251 S252 D253	S247-D249 PolarHBondContact O-N 3.23Å; D249-W251 VanDerWaalsContact C-N 3.28Å; D249-W251 PolarHBondContact O-N 3.24Å; D249-S252 WeakPolarHBondContact O-CA 3.28Å; D249-S252 VanDerWaalsContact O-CB 3.26Å; D249-S252 WeakPolarHBondContact O-CB 3.3Å; D249-S252 PolarHBondContact O-N 2.88Å; D249-D253 PolarHBondContact O-N 3.45Å; D249-D253 VanDerWaalsContact O-N 3.11Å
250	Q	61	Low	58.5	Low	108 Å²	108	94.1 Å²	94.1	51%	0.505	50%	0.497	S	S	.	.	H	α-helix	trans	-57.7	-41	175.1	-70.6	170.8	-14.3	0	0	111.9	F246 S247 S252 D253 L254	F246-Q250 HydrophobicContact CB-CB 4.23Å; F246-Q250 HydrophobicContact CD1-CB 4.18Å; S247-Q250 PolarHBondContact O-N 2.98Å; S247-Q250 WeakPolarHBondContact OG-CG 3.43Å; S247-Q250 PolarHBondContact OG-N 2.87Å; Q250-S252 VanDerWaalsContact C-N 3.26Å; Q250-S252 PolarHBondContact O-N 3.44Å; Q250-D253 PolarHBondContact O-N 3.19Å; Q250-L254 PolarHBondContact O-N 3.09Å
251	W	66.8	Low	59.1	Low	93 Å²	93	91.8 Å²	91.8	35%	0.352	49%	0.486	S	S	.	.	H	α-helix	trans	-66.6	-28.4	174.5	-173.7	-99.8	0	0	0	112.1	F246 S247 D249 L254 K259 Y262	F246-W251 HydrophobicContact CB-CB 4.26Å; F246-W251 HydrophobicContact CB-CE3 4.34Å; F246-W251 AromaticContact CD2-CE3 3.73Å; F246-W251 HydrophobicContact CD2-CE3 3.73Å; F246-W251 AromaticContact CD2-CZ3 4Å; F246-W251 HydrophobicContact CD2-CZ3 4Å; F246-W251 HydrophobicContact CE2-CE3 4.39Å; F246-W251 HydrophobicContact CE2-CZ3 4.31Å; F246-W251 HydrophobicContact CG-CE3 4.25Å; S247-W251 WeakPolarHBondContact O-CB 3.5Å; S247-W251 PolarHBondContact O-N 2.74Å; D249-W251 VanDerWaalsContact C-N 3.28Å; D249-W251 PolarHBondContact O-N 3.24Å; W251-L254 HydrophobicContact CD2-CD1 4.45Å; W251-L254 HydrophobicContact CE3-CD1 3.68Å; W251-L254 HydrophobicContact CZ3-CD1 3.98Å; W251-K259 HydrophobicContact CH2-CB 4.49Å; W251-K259 HydrophobicContact CH2-CG 4.15Å; W251-K259 HydrophobicContact CZ2-CB 4.47Å; W251-K259 HydrophobicContact CZ2-CG 3.99Å; W251-K259 WeakPolarHBondContact O-CE 3.24Å; W251-K259 PolarHBondContact O-NZ 2.8Å; W251-Y262 AromaticContact CH2-CD1 3.66Å; W251-Y262 HydrophobicContact CH2-CD1 3.66Å; W251-Y262 HydrophobicContact CH2-CE1 4.13Å; W251-Y262 HydrophobicContact CH2-CG 4.46Å; W251-Y262 AromaticContact CZ3-CD1 3.57Å; W251-Y262 HydrophobicContact CZ3-CD1 3.57Å; W251-Y262 AromaticContact CZ3-CE1 3.87Å; W251-Y262 HydrophobicContact CZ3-CE1 3.87Å; W251-Y262 HydrophobicContact CZ3-CG 4.12Å
252	S	60.4	Low	59.9	Low	71 Å²	71	90.5 Å²	90.5	50%	0.497	48%	0.476	S	S	.	.	H	α-helix	trans	-68.6	-42.5	175.3	-60	0	0	0	0	111	Q248 D249 Q250 L254 K259	Q248-S252 PolarHBondContact O-N 3.02Å; Q248-S252 VanDerWaalsContact O-N 3.1Å; Q248-S252 PolarHBondContact O-OG 3.33Å; D249-S252 WeakPolarHBondContact O-CA 3.28Å; D249-S252 VanDerWaalsContact O-CB 3.26Å; D249-S252 WeakPolarHBondContact O-CB 3.3Å; D249-S252 PolarHBondContact O-N 2.88Å; Q250-S252 VanDerWaalsContact C-N 3.26Å; Q250-S252 PolarHBondContact O-N 3.44Å; S252-L254 PolarHBondContact O-N 2.97Å; S252-K259 PolarHBondContact O-NZ 2.86Å
253	D	66.3	Low	60.4	Low	144 Å²	144	88.5 Å²	88.5	77%	0.77	47%	0.469	S	S	*	.	H	α-helix	trans	-70.6	-23.7	-177.4	-67.6	-28.2	0	0	0	115.4	D249 Q250	D249-D253 PolarHBondContact O-N 3.45Å; D249-D253 VanDerWaalsContact O-N 3.11Å; Q250-D253 PolarHBondContact O-N 3.19Å
254	L	68.4	Low	60.7	Low	33 Å²	33	93.7 Å²	93.7	17%	0.173	49%	0.489	C	S	.	.	S	Bend	trans	-61	138.4	178.1	-68.3	174.2	0	0	0	112.2	F246 Q250 W251 S252 Q258 K259	F246-L254 HydrophobicContact CD1-CD1 4.31Å; F246-L254 HydrophobicContact CD2-CD1 4.18Å; F246-L254 HydrophobicContact CE1-CD1 4.11Å; F246-L254 HydrophobicContact CE1-CD2 4.42Å; F246-L254 HydrophobicContact CE2-CD1 3.96Å; F246-L254 HydrophobicContact CG-CD1 4.34Å; F246-L254 HydrophobicContact CZ-CD1 3.93Å; Q250-L254 PolarHBondContact O-N 3.09Å; W251-L254 HydrophobicContact CD2-CD1 4.45Å; W251-L254 HydrophobicContact CE3-CD1 3.68Å; W251-L254 HydrophobicContact CZ3-CD1 3.98Å; S252-L254 PolarHBondContact O-N 2.97Å; L254-Q258 HydrophobicContact CB-CB 4.3Å; L254-Q258 HydrophobicContact CD2-CB 4.28Å; L254-Q258 VanDerWaalsContact CD2-OE1 3.22Å; L254-K259 HydrophobicContact CB-CD 4.34Å; L254-K259 HydrophobicContact CB-CG 3.97Å; L254-K259 WeakPolarHBondContact O-CE 3.48Å; L254-K259 PolarHBondContact O-NZ 3.46Å
255	D	65.4	Low	60.7	Low	59 Å²	59	93.2 Å²	93.2	32%	0.316	48%	0.48	S	S	.	.			trans	-72.4	163	176.3	79.1	56.4	0	0	0	112.4	T257 Q258 K259	D255-T257 VanDerWaalsContact C-N 3.28Å; D255-T257 PolarHBondContact O-N 3.43Å; D255-T257 VanDerWaalsContact OD1-CA 3.32Å; D255-T257 WeakPolarHBondContact OD1-CA 3.42Å; D255-T257 WeakPolarHBondContact OD1-CB 3.37Å; D255-T257 PolarHBondContact OD1-N 3.49Å; D255-T257 PolarHBondContact OD1-OG1 3.32Å; D255-Q258 VanDerWaalsContact N-OE1 3.17Å; D255-Q258 PolarHBondContact O-N 3.32Å; D255-Q258 PolarHBondContact OD1-N 3.46Å; D255-Q258 VanDerWaalsContact OD2-CG 3.24Å; D255-Q258 WeakPolarHBondContact OD2-CG 3.45Å; D255-Q258 PolarHBondContact OD2-NE2 3.06Å; D255-K259 PolarHBondContact O-N 3.11Å
256	P	62.3	Low	61.1	Low	106 Å²	106	89 Å²	89	69%	0.688	45%	0.451	S	S	*	.	H	α-helix	trans	-59	-34.8	-178.2	-26.1	36	0	0	0	114.2	K259 E260	P256-K259 PolarHBondContact O-N 3.47Å; P256-E260 WeakPolarHBondContact O-CB 3.41Å; P256-E260 PolarHBondContact O-N 3.49Å
257	T	60.5	Low	60.8	Low	95 Å²	95	90.9 Å²	90.9	58%	0.583	46%	0.464	S	S	*	.	H	α-helix	trans	-76.6	-29.6	177.5	38.5	0	0	0	0	112.8	D255 F261	D255-T257 VanDerWaalsContact C-N 3.28Å; D255-T257 PolarHBondContact O-N 3.43Å; D255-T257 VanDerWaalsContact OD1-CA 3.32Å; D255-T257 WeakPolarHBondContact OD1-CA 3.42Å; D255-T257 WeakPolarHBondContact OD1-CB 3.37Å; D255-T257 PolarHBondContact OD1-N 3.49Å; D255-T257 PolarHBondContact OD1-OG1 3.32Å; T257-F261 VanDerWaalsContact O-CB 3.22Å; T257-F261 WeakPolarHBondContact O-CB 3.38Å; T257-F261 PolarHBondContact O-N 3.33Å
258	Q	60.3	Low	60.3	Low	91 Å²	91	96.3 Å²	96.3	43%	0.425	48%	0.484	S	S	.	.	H	α-helix	trans	-67.9	-40.5	168.7	-71.4	169.4	3.9	0	0	111.6	L254 D255 F261 Y262	L254-Q258 HydrophobicContact CB-CB 4.3Å; L254-Q258 HydrophobicContact CD2-CB 4.28Å; L254-Q258 VanDerWaalsContact CD2-OE1 3.22Å; D255-Q258 VanDerWaalsContact N-OE1 3.17Å; D255-Q258 PolarHBondContact O-N 3.32Å; D255-Q258 PolarHBondContact OD1-N 3.46Å; D255-Q258 VanDerWaalsContact OD2-CG 3.24Å; D255-Q258 WeakPolarHBondContact OD2-CG 3.45Å; D255-Q258 PolarHBondContact OD2-NE2 3.06Å; Q258-F261 PolarHBondContact O-N 3.04Å; Q258-Y262 WeakPolarHBondContact O-CB 3.08Å; Q258-Y262 PolarHBondContact O-N 2.91Å
259	K	71.4	Confident	60.1	Low	59 Å²	59	94.1 Å²	94.1	26%	0.257	47%	0.474	S	S	.	.	H	α-helix	trans	-63.8	-42.2	173.9	-77.2	161.9	165.6	140.5	0	112.1	W251 S252 L254 D255 P256 G263	W251-K259 HydrophobicContact CH2-CB 4.49Å; W251-K259 HydrophobicContact CH2-CG 4.15Å; W251-K259 HydrophobicContact CZ2-CB 4.47Å; W251-K259 HydrophobicContact CZ2-CG 3.99Å; W251-K259 WeakPolarHBondContact O-CE 3.24Å; W251-K259 PolarHBondContact O-NZ 2.8Å; S252-K259 PolarHBondContact O-NZ 2.86Å; L254-K259 HydrophobicContact CB-CD 4.34Å; L254-K259 HydrophobicContact CB-CG 3.97Å; L254-K259 WeakPolarHBondContact O-CE 3.48Å; L254-K259 PolarHBondContact O-NZ 3.46Å; D255-K259 PolarHBondContact O-N 3.11Å; P256-K259 PolarHBondContact O-N 3.47Å; K259-G263 PolarHBondContact O-N 3.09Å
260	E	61	Low	59.7	Low	130 Å²	130	89.7 Å²	89.7	61%	0.607	45%	0.45	S	S	*	.	H	α-helix	trans	-66.2	-44.5	174.8	-168.7	164.4	-137	0	0	111.4	P256 G263 E264	P256-E260 WeakPolarHBondContact O-CB 3.41Å; P256-E260 PolarHBondContact O-N 3.49Å; E260-G263 CarbonylContact O-C 3.5Å; E260-G263 WeakPolarHBondContact O-CA 3.44Å; E260-G263 PolarHBondContact O-N 3.21Å; E260-G263 VanDerWaalsContact O-N 3.13Å; E260-E264 PolarHBondContact O-N 3.28Å
261	F	59.4	Low	59	Low	137 Å²	137	86.2 Å²	86.2	60%	0.601	44%	0.438	S	S	*	.	H	α-helix	trans	-63.5	-41.4	176.2	-176.1	-98.2	0	0	0	113.1	T257 Q258 G263 E264 Y265	T257-F261 VanDerWaalsContact O-CB 3.22Å; T257-F261 WeakPolarHBondContact O-CB 3.38Å; T257-F261 PolarHBondContact O-N 3.33Å; Q258-F261 PolarHBondContact O-N 3.04Å; F261-G263 VanDerWaalsContact C-N 3.3Å; F261-G263 PolarHBondContact O-N 3.23Å; F261-E264 PolarHBondContact O-N 3.1Å; F261-Y265 HydrophobicContact CZ-CD2 4.41Å; F261-Y265 WeakPolarHBondContact O-CB 3.38Å; F261-Y265 PolarHBondContact O-N 3Å
262	Y	63.8	Low	57.9	Low	61 Å²	61	83 Å²	83	24%	0.239	43%	0.434	C	S	.	.	H	α-helix	trans	-62	-40	171.8	177.6	-95	0	0	0	111.3	L244 F246 W251 Q258 V266	L244-Y262 HydrophobicContact CB-CE2 4.42Å; L244-Y262 PolarHBondContact O-OH 2.92Å; F246-Y262 HydrophobicContact CD2-CE2 4.26Å; F246-Y262 AromaticContact CE2-CD2 3.7Å; F246-Y262 HydrophobicContact CE2-CD2 3.7Å; F246-Y262 AromaticContact CE2-CE2 3.68Å; F246-Y262 HydrophobicContact CE2-CE2 3.68Å; F246-Y262 HydrophobicContact CE2-CG 4.29Å; W251-Y262 AromaticContact CH2-CD1 3.66Å; W251-Y262 HydrophobicContact CH2-CD1 3.66Å; W251-Y262 HydrophobicContact CH2-CE1 4.13Å; W251-Y262 HydrophobicContact CH2-CG 4.46Å; W251-Y262 AromaticContact CZ3-CD1 3.57Å; W251-Y262 HydrophobicContact CZ3-CD1 3.57Å; W251-Y262 AromaticContact CZ3-CE1 3.87Å; W251-Y262 HydrophobicContact CZ3-CE1 3.87Å; W251-Y262 HydrophobicContact CZ3-CG 4.12Å; Q258-Y262 WeakPolarHBondContact O-CB 3.08Å; Q258-Y262 PolarHBondContact O-N 2.91Å; Y262-V266 HydrophobicContact CD1-CG2 4.35Å; Y262-V266 HydrophobicContact CD2-CG2 3.95Å; Y262-V266 HydrophobicContact CE1-CG2 4.08Å; Y262-V266 HydrophobicContact CE2-CG2 3.65Å; Y262-V266 HydrophobicContact CG-CG2 4.3Å; Y262-V266 WeakPolarHBondContact O-CB 3.43Å; Y262-V266 WeakPolarHBondContact O-CG2 3.37Å; Y262-V266 PolarHBondContact O-N 3.14Å
263	G	57.6	Low	57.2	Low	27 Å²	27	84 Å²	84	28%	0.278	43%	0.433	S	S	.	.	H	α-helix	trans	-57.7	-52.3	172.6	0	0	0	0	0	112.7	K259 E260 F261 L267	K259-G263 PolarHBondContact O-N 3.09Å; E260-G263 CarbonylContact O-C 3.5Å; E260-G263 WeakPolarHBondContact O-CA 3.44Å; E260-G263 PolarHBondContact O-N 3.21Å; E260-G263 VanDerWaalsContact O-N 3.13Å; F261-G263 VanDerWaalsContact C-N 3.3Å; F261-G263 PolarHBondContact O-N 3.23Å; G263-L267 WeakPolarHBondContact O-CB 3.24Å; G263-L267 WeakPolarHBondContact O-CD1 3.4Å; G263-L267 WeakPolarHBondContact O-CG 3.32Å; G263-L267 PolarHBondContact O-N 3.37Å; G263-L267 VanDerWaalsContact O-N 3.16Å
264	E	56.2	Low	56.1	Low	131 Å²	131	78.7 Å²	78.7	61%	0.612	41%	0.405	S	S	*	.	H	α-helix	trans	-65.1	-43.4	177.9	-68.1	-159.8	136	0	0	112.1	E260 F261 L267 E268	E260-E264 PolarHBondContact O-N 3.28Å; F261-E264 PolarHBondContact O-N 3.1Å; E264-L267 PolarHBondContact O-N 3.18Å; E264-E268 WeakPolarHBondContact O-CB 3.36Å; E264-E268 PolarHBondContact O-N 3.27Å
265	Y	54	Low	55	Low	108 Å²	108	81.6 Å²	81.6	42%	0.424	42%	0.424	S	S	.	.	H	α-helix	trans	-67.3	-42.8	-176.1	-164.1	-108.6	0	0	0	112.9	F261 L267 E269	F261-Y265 HydrophobicContact CZ-CD2 4.41Å; F261-Y265 WeakPolarHBondContact O-CB 3.38Å; F261-Y265 PolarHBondContact O-N 3Å; Y265-L267 VanDerWaalsContact C-N 3.33Å; Y265-L267 PolarHBondContact O-N 3.05Å; Y265-E269 HydrophobicContact CD2-CG 4.21Å; Y265-E269 HydrophobicContact CE2-CB 4.25Å; Y265-E269 HydrophobicContact CE2-CG 3.83Å; Y265-E269 VanDerWaalsContact CE2-OE2 3.24Å; Y265-E269 WeakPolarHBondContact CE2-OE2 3.44Å; Y265-E269 PolarHBondContact O-N 3.15Å; Y265-E269 PolarHBondContact OH-OE2 3.09Å
266	V	55.2	Low	54	Low	24 Å²	24	83.3 Å²	83.3	15%	0.145	44%	0.441	C	S	.	.	I	π-helix	trans	-71.9	-26.9	176.1	176.9	0	0	0	0	111.9	Y262 D270 C271	Y262-V266 HydrophobicContact CD1-CG2 4.35Å; Y262-V266 HydrophobicContact CD2-CG2 3.95Å; Y262-V266 HydrophobicContact CE1-CG2 4.08Å; Y262-V266 HydrophobicContact CE2-CG2 3.65Å; Y262-V266 HydrophobicContact CG-CG2 4.3Å; Y262-V266 WeakPolarHBondContact O-CB 3.43Å; Y262-V266 WeakPolarHBondContact O-CG2 3.37Å; Y262-V266 PolarHBondContact O-N 3.14Å; V266-D270 HydrophobicContact CG1-CB 4.27Å; V266-C271 WeakPolarHBondContact O-CB 3.49Å; V266-C271 PolarHBondContact O-N 2.93Å; V266-C271 PolarHBondContact O-SG 3.23Å
267	L	52.5	Low	53.1	Low	125 Å²	125	83.7 Å²	83.7	65%	0.654	44%	0.436	S	S	*	.	I	π-helix	trans	-86.9	-28.5	177.9	-68.4	173.6	0	0	0	114.4	G263 E264 Y265 C271	G263-L267 WeakPolarHBondContact O-CB 3.24Å; G263-L267 WeakPolarHBondContact O-CD1 3.4Å; G263-L267 WeakPolarHBondContact O-CG 3.32Å; G263-L267 PolarHBondContact O-N 3.37Å; G263-L267 VanDerWaalsContact O-N 3.16Å; E264-L267 PolarHBondContact O-N 3.18Å; Y265-L267 VanDerWaalsContact C-N 3.33Å; Y265-L267 PolarHBondContact O-N 3.05Å; L267-C271 WeakPolarHBondContact O-CB 3.27Å
268	E	53.4	Low	52.5	Low	162 Å²	162	83 Å²	83	76%	0.757	44%	0.435	S	S	*	.	I	π-helix	trans	-93.2	-45.4	174.4	-71.7	-144.3	124.9	0	0	113.4	E264 G272	E264-E268 WeakPolarHBondContact O-CB 3.36Å; E264-E268 PolarHBondContact O-N 3.27Å; E268-G272 VanDerWaalsContact O-CA 3.26Å; E268-G272 WeakPolarHBondContact O-CA 3.5Å; E268-G272 PolarHBondContact O-N 2.85Å
269	E	49.6	Very low	51.4	Low	96 Å²	96	84.3 Å²	84.3	45%	0.449	44%	0.44	S	S	.	.	I	π-helix	trans	-89.1	-63.2	-177.9	-66.7	-158.7	-176	0	0	112.8	Y265 C271 G272 I273	Y265-E269 HydrophobicContact CD2-CG 4.21Å; Y265-E269 HydrophobicContact CE2-CB 4.25Å; Y265-E269 HydrophobicContact CE2-CG 3.83Å; Y265-E269 VanDerWaalsContact CE2-OE2 3.24Å; Y265-E269 WeakPolarHBondContact CE2-OE2 3.44Å; Y265-E269 PolarHBondContact O-N 3.15Å; Y265-E269 PolarHBondContact OH-OE2 3.09Å; E269-C271 PolarHBondContact O-N 3.33Å; E269-G272 CarbonylContact O-C 3.58Å; E269-G272 WeakPolarHBondContact O-CA 3.38Å; E269-G272 PolarHBondContact O-N 3.45Å; E269-G272 VanDerWaalsContact O-N 3.1Å; E269-I273 WeakPolarHBondContact O-CB 3.34Å; E269-I273 VanDerWaalsContact O-CG1 3.24Å; E269-I273 WeakPolarHBondContact O-CG1 3.47Å; E269-I273 PolarHBondContact O-N 2.95Å
270	D	47.5	Very low	49.5	Very low	23 Å²	23	87 Å²	87	12%	0.123	46%	0.464	C	S	.	.	I	π-helix	trans	-61.1	-50.9	-176.9	-76.8	-32.7	0	0	0	111.7	V242 V266 G272 I273 V274	V242-D270 VanDerWaalsContact CG1-OD1 3.28Å; V242-D270 WeakPolarHBondContact CG1-OD1 3.25Å; V266-D270 HydrophobicContact CG1-CB 4.27Å; D270-G272 VanDerWaalsContact C-N 3.31Å; D270-G272 PolarHBondContact O-N 3.4Å; D270-I273 PolarHBondContact O-N 2.86Å; D270-V274 WeakPolarHBondContact O-CB 3.27Å; D270-V274 VanDerWaalsContact O-CG2 3.3Å; D270-V274 WeakPolarHBondContact O-CG2 3.27Å; D270-V274 PolarHBondContact O-N 3.09Å
271	C	47.3	Very low	48.2	Very low	36 Å²	36	85.7 Å²	85.7	24%	0.243	46%	0.459	C	S	.	.	H	α-helix	trans	-65.6	-32.8	174.9	-72.7	0	0	0	0	112.1	V266 L267 E269 V275	V266-C271 WeakPolarHBondContact O-CB 3.49Å; V266-C271 PolarHBondContact O-N 2.93Å; V266-C271 PolarHBondContact O-SG 3.23Å; L267-C271 WeakPolarHBondContact O-CB 3.27Å; E269-C271 PolarHBondContact O-N 3.33Å; C271-V275 WeakPolarHBondContact O-CB 3.15Å; C271-V275 WeakPolarHBondContact O-CG2 3.34Å; C271-V275 PolarHBondContact O-N 3.14Å
272	G	44.4	Very low	46.9	Very low	26 Å²	26	84 Å²	84	27%	0.268	46%	0.462	S	S	.	.	H	α-helix	trans	-64.9	-41.4	174.1	0	0	0	0	0	113.1	E268 E269 D270 S276	E268-G272 VanDerWaalsContact O-CA 3.26Å; E268-G272 WeakPolarHBondContact O-CA 3.5Å; E268-G272 PolarHBondContact O-N 2.85Å; E269-G272 CarbonylContact O-C 3.58Å; E269-G272 WeakPolarHBondContact O-CA 3.38Å; E269-G272 PolarHBondContact O-N 3.45Å; E269-G272 VanDerWaalsContact O-N 3.1Å; D270-G272 VanDerWaalsContact C-N 3.31Å; D270-G272 PolarHBondContact O-N 3.4Å; G272-S276 VanDerWaalsContact O-CB 3.24Å; G272-S276 WeakPolarHBondContact O-CB 3.44Å; G272-S276 PolarHBondContact O-N 2.81Å; G272-S276 PolarHBondContact O-OG 3.25Å
273	I	44.3	Very low	45.3	Very low	92 Å²	92	90.7 Å²	90.7	47%	0.472	49%	0.487	S	S	.	.	H	α-helix	trans	-70	-48.8	177.7	-68.9	163.4	0	0	0	110	E269 D270 V275 S276 L277	E269-I273 WeakPolarHBondContact O-CB 3.34Å; E269-I273 VanDerWaalsContact O-CG1 3.24Å; E269-I273 WeakPolarHBondContact O-CG1 3.47Å; E269-I273 PolarHBondContact O-N 2.95Å; D270-I273 PolarHBondContact O-N 2.86Å; I273-V275 PolarHBondContact O-N 3.17Å; I273-S276 PolarHBondContact O-N 3.37Å; I273-S276 VanDerWaalsContact O-N 3.11Å; I273-L277 HydrophobicContact CG2-CD1 3.85Å; I273-L277 HydrophobicContact CG2-CG 4.47Å; I273-L277 WeakPolarHBondContact O-CG 3.46Å; I273-L277 PolarHBondContact O-N 2.91Å
274	V	44.7	Very low	44.4	Very low	32 Å²	32	96.8 Å²	96.8	19%	0.194	51%	0.513	C	S	.	.	H	α-helix	trans	-62.1	-41.5	178.5	172.7	0	0	0	0	111.9	F239 D270 S276 L277 S278 F279 I281	F239-V274 HydrophobicContact CD2-CG2 4.16Å; D270-V274 WeakPolarHBondContact O-CB 3.27Å; D270-V274 VanDerWaalsContact O-CG2 3.3Å; D270-V274 WeakPolarHBondContact O-CG2 3.27Å; D270-V274 PolarHBondContact O-N 3.09Å; V274-S276 VanDerWaalsContact C-N 3.34Å; V274-L277 PolarHBondContact O-N 3.19Å; V274-S278 PolarHBondContact O-N 3.45Å; V274-S278 VanDerWaalsContact O-N 3.16Å; V274-F279 HydrophobicContact CG1-CB 4.4Å; V274-I281 HydrophobicContact CG1-CD1 4.14Å; V274-I281 HydrophobicContact CG1-CG1 3.84Å
275	V	43.9	Very low	43.1	Very low	94 Å²	94	95.6 Å²	95.6	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-67.3	-33.8	174.1	169.9	0	0	0	0	111.9	C271 I273 I281	C271-V275 WeakPolarHBondContact O-CB 3.15Å; C271-V275 WeakPolarHBondContact O-CG2 3.34Å; C271-V275 PolarHBondContact O-N 3.14Å; I273-V275 PolarHBondContact O-N 3.17Å; V275-I281 HydrophobicContact CG2-CD1 3.82Å
276	S	44.8	Very low	42	Very low	95 Å²	95	96.3 Å²	96.3	66%	0.664	52%	0.522	S	S	*	.	H	α-helix	trans	-72	-33.6	176.3	-63.1	0	0	0	0	112.9	G272 I273 V274	G272-S276 VanDerWaalsContact O-CB 3.24Å; G272-S276 WeakPolarHBondContact O-CB 3.44Å; G272-S276 PolarHBondContact O-N 2.81Å; G272-S276 PolarHBondContact O-OG 3.25Å; I273-S276 PolarHBondContact O-N 3.37Å; I273-S276 VanDerWaalsContact O-N 3.11Å; V274-S276 VanDerWaalsContact C-N 3.34Å
277	L	43	Very low	40.8	Very low	113 Å²	113	100 Å²	100	59%	0.592	55%	0.545	S	S	*	.	H	α-helix	trans	-87.5	-0.4	178.7	-63.7	176.8	0	0	0	114	I273 V274 F279	I273-L277 HydrophobicContact CG2-CD1 3.85Å; I273-L277 HydrophobicContact CG2-CG 4.47Å; I273-L277 WeakPolarHBondContact O-CG 3.46Å; I273-L277 PolarHBondContact O-N 2.91Å; V274-L277 PolarHBondContact O-N 3.19Å; L277-F279 HydrophobicContact CB-CD2 4.18Å; L277-F279 HydrophobicContact CB-CE2 4.28Å; L277-F279 PolarHBondContact O-N 2.85Å
278	S	48.5	Very low	39.8	Very low	80 Å²	80	98.8 Å²	98.8	56%	0.559	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	30.6	169.1	-56	0	0	0	0	116.4	V274	V274-S278 PolarHBondContact O-N 3.45Å; V274-S278 VanDerWaalsContact O-N 3.16Å
279	F	36.7	Very low	38.7	Very low	119 Å²	119	99.1 Å²	99.1	52%	0.522	55%	0.548	S	S	.	.			trans	-75.8	145.3	167	-72.9	-80.1	0	0	0	111.6	V274 L277 I281	V274-F279 HydrophobicContact CG1-CB 4.4Å; L277-F279 HydrophobicContact CB-CD2 4.18Å; L277-F279 HydrophobicContact CB-CE2 4.28Å; L277-F279 PolarHBondContact O-N 2.85Å; F279-I281 PolarHBondContact O-N 3.39Å
280	P	32.6	Very low	37.8	Very low	117 Å²	117	101.9 Å²	101.9	76%	0.76	56%	0.564	S	S	*	*			trans	-74.4	107.3	176.5	30	-33	0	0	0	110.6	P282	P280-P282 WeakPolarHBondContact O-CD 3.21Å
281	I	33.9	Very low	37.1	Very low	101 Å²	101	111.4 Å²	111.4	52%	0.518	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-67.6	120.5	172	-59.8	172.7	0	0	0	108.8	V274 V275 F279	V274-I281 HydrophobicContact CG1-CD1 4.14Å; V274-I281 HydrophobicContact CG1-CG1 3.84Å; V275-I281 HydrophobicContact CG2-CD1 3.82Å; F279-I281 PolarHBondContact O-N 3.39Å
282	P	31.8	Very low	36.6	Very low	103 Å²	103	118.8 Å²	118.8	67%	0.669	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-60	145.5	169.1	-20	33.2	0	0	0	110	P280	P280-P282 WeakPolarHBondContact O-CD 3.21Å
283	R	30	Very low	35.7	Very low	200 Å²	200	127.1 Å²	127.1	76%	0.755	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-68.2	144.9	-179.1	-74.9	-166.2	175.3	-172.8	0.6	111.4	D285	R283-D285 HydrophobicContact CB-CB 4.43Å; R283-D285 WeakPolarHBondContact CB-OD2 3.48Å; R283-D285 VanDerWaalsContact CD-OD2 3.23Å; R283-D285 WeakPolarHBondContact CD-OD2 3.38Å; R283-D285 PolarHBondContact O-N 3.01Å
284	L	38	Very low	35.1	Very low	156 Å²	156	131.6 Å²	131.6	82%	0.817	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	42.7	174.7	-151.3	87.2	0	0	0	112.4
285	D	29.7	Very low	34.3	Very low	106 Å²	106	135.8 Å²	135.8	57%	0.567	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-21.7	177	-65.5	-51.1	0	0	0	111	R283 T287 S288	R283-D285 HydrophobicContact CB-CB 4.43Å; R283-D285 WeakPolarHBondContact CB-OD2 3.48Å; R283-D285 VanDerWaalsContact CD-OD2 3.23Å; R283-D285 WeakPolarHBondContact CD-OD2 3.38Å; R283-D285 PolarHBondContact O-N 3.01Å; D285-T287 PolarHBondContact O-N 3.23Å; D285-S288 PolarHBondContact O-OG 3.3Å
286	D	29.9	Very low	33.5	Very low	123 Å²	123	140.3 Å²	140.3	66%	0.658	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-83.5	2.8	-175.6	-70	-34.7	0	0	0	115	S288	D286-S288 PolarHBondContact O-N 3.36Å; D286-S288 VanDerWaalsContact O-N 3.08Å
287	T	30.5	Very low	32.8	Very low	102 Å²	102	142 Å²	142	63%	0.626	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-74.8	10	174	51.9	0	0	0	0	113.7	D285	D285-T287 PolarHBondContact O-N 3.23Å
288	S	30.7	Very low	32.1	Very low	98 Å²	98	142.6 Å²	142.6	69%	0.685	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-87.9	-3.5	176.8	50.9	0	0	0	0	114.1	D285 D286	D285-S288 PolarHBondContact O-OG 3.3Å; D286-S288 PolarHBondContact O-N 3.36Å; D286-S288 VanDerWaalsContact O-N 3.08Å
289	Q	32	Very low	31	Very low	170 Å²	170	142 Å²	142	79%	0.794	75%	0.746	S	S	*	*	S	Bend	trans	-112.8	25.9	179.8	-68.3	-170.8	-24.6	0	0	114.4
290	I	29.5	Very low	30.4	Very low	154 Å²	154	143 Å²	143	79%	0.79	76%	0.762	S	S	*	*	S	Bend	trans	-123.4	42	172.1	-37.5	-177.5	0	0	0	111
291	R	32.6	Very low	30.1	Very low	223 Å²	223	145.8 Å²	145.8	84%	0.842	76%	0.764	S	S	*	*	S	Bend	trans	-136.6	149.7	156.6	-64	-176.8	73.3	175.1	1.8	106.1
292	E	37.7	Very low	29.7	Very low	191 Å²	191	150.1 Å²	150.1	89%	0.893	78%	0.782	S	S	*	*			trans	71.4	74.8	-174.9	-54.8	179.2	-175.5	0	0	115.5
293	E	26.1	Very low	29.4	Very low	201 Å²	201	149.8 Å²	149.8	94%	0.939	78%	0.782	S	S	*	*				-136.7	103.6	125.5	-76.4	-153.9	130.7	0	0	108.4
294	E	30.6	Very low	29.2	Very low	186 Å²	186	149.2 Å²	149.2	87%	0.869	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-86.7	138.6	166	-83.4	-164.8	117.9	0	0	110.2	Q296	E294-Q296 PolarHBondContact O-N 3.49Å
295	P	29.1	Very low	28.7	Very low	119 Å²	119	150 Å²	150	77%	0.773	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-68.3	125.3	174.4	-17.2	31	0	0	0	111.8
296	Q	25.7	Very low	29	Very low	190 Å²	190	150.6 Å²	150.6	89%	0.888	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-73.6	132.8	172.4	-67.6	-164.5	-3.2	0	0	112	E294	E294-Q296 PolarHBondContact O-N 3.49Å
297	V	29.6	Very low	28.8	Very low	130 Å²	130	148.1 Å²	148.1	79%	0.788	79%	0.794	S	S	*	*			trans	-120.1	119.8	171.6	-177.1	0	0	0	0	109
298	P	28.3	Very low	28.7	Very low	126 Å²	126	152 Å²	152	82%	0.818	81%	0.805	S	S	*	*			trans	-89.8	130.8	-176.9	-7.2	25.7	0	0	0	114.3
299	G	25.9	Very low	29	Very low	68 Å²	68	152 Å²	152	70%	0.701	80%	0.803	S	S	*	*			trans	91.3	152	164.8	0	0	0	0	0	115.3
300	V	24.4	Very low	28.8	Very low	140 Å²	140	151.9 Å²	151.9	85%	0.848	80%	0.802	S	S	*	*			cis	-141.2	157.1	4.8	174.4	0	0	0	0	109.9
301	H	26.5	Very low	28.6	Very low	175 Å²	175	151.1 Å²	151.1	81%	0.81	80%	0.798	S	S	*	*			trans	-32.5	140.9	170.5	-71.2	-106.2	0	0	0	116.2
302	E	25.6	Very low	28.2	Very low	192 Å²	192	148.2 Å²	148.2	90%	0.897	80%	0.798	S	S	*	*				-151.3	173.3	104.6	-128.1	178.7	106.9	0	0	113.1
303	S	25.2	Very low	27.6	Very low	96 Å²	96	143.5 Å²	143.5	67%	0.671	79%	0.786	S	S	*	*			trans	-86.4	155.2	-156.5	-48	0	0	0	0	115
304	Q	26.7	Very low	27.5	Very low	187 Å²	187	142.9 Å²	142.9	87%	0.874	78%	0.781	S	S	*	*				141.7	110.6	106.6	-165.3	153	-11.5	0	0	115.6
305	E	25.8	Very low	27.2	Very low	174 Å²	174	139.5 Å²	139.5	81%	0.813	77%	0.773	S	S	*	*			trans	-77	172.6	159.8	-93	-161.1	156.3	0	0	111.6
306	P	36.7	Very low	26.9	Very low	117 Å²	117	143.6 Å²	143.6	76%	0.76	78%	0.775	S	S	*	*			cis	-138.2	-161.2	25.7	45.6	-25.6	0	0	0	113.5
307	A	26.7	Very low	26.8	Very low	72 Å²	72	140 Å²	140	60%	0.595	77%	0.766	S	S	*	*			cis	-151.6	141.5	1.9	0	0	0	0	0	108.7
308	E	28.2	Very low	26.6	Very low	184 Å²	184	136.8 Å²	136.8	86%	0.86	76%	0.76	S	S	*	*				67.4	159.6	97.1	-69.3	-166.5	167	0	0	117.7
309	P	37.2	Very low	26.4	Very low	98 Å²	98	138.1 Å²	138.1	64%	0.636	76%	0.76	S	S	*	*			cis	-129.1	162.7	-6.2	16.2	9	0	0	0	116.7
310	E	26.5	Very low	26.3	Very low	166 Å²	166	142.3 Å²	142.3	78%	0.776	76%	0.763	S	S	*	*			trans	46	112.7	138.9	-57.9	-155.8	124.6	0	0	121.3
311	I	25.2	Very low	26.6	Very low	139 Å²	139	140 Å²	140	71%	0.713	75%	0.753	S	S	*	*				73.6	115.5	79.7	-66	164.3	0	0	0	114.1
312	L	25	Very low	26.7	Very low	161 Å²	161	140.3 Å²	140.3	84%	0.843	76%	0.755	S	S	*	*				-161.9	128.1	118.9	-108.5	172.6	0	0	0	111.6
313	S	25.7	Very low	26.7	Very low	92 Å²	92	134.9 Å²	134.9	64%	0.643	74%	0.742	S	S	*	*			trans	-94.6	167.5	166.1	56.6	0	0	0	0	110.1
314	F	23.3	Very low	26.8	Very low	189 Å²	189	138.8 Å²	138.8	83%	0.829	75%	0.75	S	S	*	*			trans	-163.5	175.1	131.5	-128.6	-97.7	0	0	0	112.1
315	T	23.5	Very low	26.8	Very low	115 Å²	115	137.4 Å²	137.4	71%	0.706	74%	0.744	S	S	*	*			trans	-139.2	163.9	-164	55	0	0	0	0	114
316	Y	22.4	Very low	26.8	Very low	205 Å²	205	136.7 Å²	136.7	80%	0.804	74%	0.74	S	S	*	*			trans	81.7	140.5	144.2	-161	-116	0	0	0	121.1
317	T	24.9	Very low	26.1	Very low	113 Å²	113	134.9 Å²	134.9	69%	0.693	73%	0.73	S	S	*	*			trans	60.2	159.9	167.9	36.4	0	0	0	0	119.5
318	G	24.1	Very low	25.9	Very low	64 Å²	64	136.8 Å²	136.8	66%	0.66	74%	0.735	S	S	*	*			cis	147.2	120.5	-14.9	0	0	0	0	0	116.2
319	D	24.2	Very low	25.8	Very low	154 Å²	154	135.6 Å²	135.6	82%	0.824	73%	0.729	S	S	*	*			trans	70.5	168.1	163.8	-148.1	3.4	0	0	0	119
320	M	24.8	Very low	25.2	Very low	156 Å²	156	137.2 Å²	137.2	77%	0.768	73%	0.728	S	S	*	*			trans	73.1	142	-179.6	-48.8	-94.8	78	0	0	115.6
321	S	30.5	Very low	25.2	Very low	91 Å²	91	136.9 Å²	136.9	64%	0.636	73%	0.727	S	S	*	*			cis	-165.8	169	-16.3	52.8	0	0	0	0	110.7
322	E	28.8	Very low	25.2	Very low	182 Å²	182	136.1 Å²	136.1	85%	0.85	72%	0.724	S	S	*	*			trans	10.4	149.4	140.9	-66.9	171.8	176.9	0	0	120.8
323	A	26.3	Very low	25.2	Very low	77 Å²	77	133.1 Å²	133.1	64%	0.636	71%	0.712	S	S	*	*			cis	-172.3	-168.1	-9.4	0	0	0	0	0	108.9
324	E	26.6	Very low	25.2	Very low	178 Å²	178	136.8 Å²	136.8	83%	0.832	72%	0.719	S	S	*	*			trans	67.2	152.9	157.7	-70.4	170.8	-176.6	0	0	117
325	E	27.3	Very low	25.4	Very low	158 Å²	158	136.6 Å²	136.6	74%	0.738	72%	0.718	S	S	*	*			cis	-149.4	-170.9	-20.1	-135.4	-178.3	-173.9	0	0	109.3
326	E	24.1	Very low	25.4	Very low	160 Å²	160	136 Å²	136	75%	0.748	72%	0.718	S	S	*	*			trans	32.3	148.5	144	-71.3	-117.9	135.3	0	0	123.2
327	S	22	Very low	25.6	Very low	78 Å²	78	132.2 Å²	132.2	55%	0.545	72%	0.717	S	S	.	*			cis	-168.9	163.5	-11.1	48.4	0	0	0	0	111.7
328	V	24.3	Very low	25.6	Very low	113 Å²	113	135.2 Å²	135.2	69%	0.685	73%	0.728	S	S	*	*			trans	55.1	112.4	136.7	167.9	0	0	0	0	120.7
329	E	24.1	Very low	25.6	Very low	158 Å²	158	135.9 Å²	135.9	74%	0.738	73%	0.727	S	S	*	*			trans	66.6	159.9	141	-67.1	-171.4	125.9	0	0	119.4
330	Q	26.4	Very low	25.6	Very low	133 Å²	133	136.8 Å²	136.8	62%	0.621	73%	0.732	S	S	*	*			cis	-144.1	157.1	-6.9	-116.6	154.6	25.1	0	0	107
331	Q	25.6	Very low	25.6	Very low	159 Å²	159	135 Å²	135	74%	0.743	73%	0.729	S	S	*	*				34.6	135.6	101.1	-69.5	177.1	-17.7	0	0	115.8
332	D	25.6	Very low	25.3	Very low	122 Å²	122	139.8 Å²	139.8	65%	0.652	74%	0.742	S	S	*	*			cis	-164.8	170.2	9.9	-137.3	-33.2	0	0	0	115.3
333	T	24	Very low	25.1	Very low	98 Å²	98	136.2 Å²	136.2	60%	0.601	73%	0.732	S	S	*	*			trans	64.9	138.6	151.3	58.3	0	0	0	0	124.5
334	H	26.6	Very low	25.1	Very low	170 Å²	170	141.7 Å²	141.7	79%	0.787	74%	0.744	S	S	*	*			trans	65	157.8	146.3	-65.2	-38.3	0	0	0	121.4
335	K	27.6	Very low	25.1	Very low	184 Å²	184	141.4 Å²	141.4	80%	0.8	74%	0.743	S	S	*	*			cis	-180	154.2	-33.7	179.8	174	176.4	-173.6	0	107.6
336	S	23.8	Very low	25	Very low	102 Å²	102	139.3 Å²	139.3	71%	0.713	75%	0.745	S	S	*	*			trans	83.5	111.5	171.7	-151	0	0	0	0	113.4
337	T	25.1	Very low	25.4	Very low	127 Å²	127	137.5 Å²	137.5	78%	0.779	75%	0.748	S	S	*	*				73.1	97.5	66.1	-51.7	0	0	0	0	113.7
338	L	25.9	Very low	25.6	Very low	176 Å²	176	141.1 Å²	141.1	92%	0.921	76%	0.761	S	S	*	*				-159.6	170.3	122.2	-110.3	167.4	0	0	0	110.3
339	A	23.5	Very low	25.8	Very low	77 Å²	77	146.5 Å²	146.5	64%	0.636	77%	0.769	S	S	*	*			trans	-95.7	162.9	-168.2	0	0	0	0	0	113.5
340	N	24.9	Very low	25.7	Very low	174 Å²	174	147.2 Å²	147.2	93%	0.93	77%	0.772	S	S	*	*			trans	-146.4	156	133.1	-102.8	-21.9	0	0	0	109.9
341	T	24.5	Very low	25.8	Very low	118 Å²	118	147.3 Å²	147.3	72%	0.724	78%	0.776	S	S	*	*			trans	-111	130.1	-169.2	-57.4	0	0	0	0	109.8
342	E	23.8	Very low	25.7	Very low	192 Å²	192	144.7 Å²	144.7	90%	0.897	77%	0.771	S	S	*	*			trans	-153	103.7	151.3	-120.5	153.2	-140.4	0	0	113.1
343	V	25	Very low	25.8	Very low	106 Å²	106	146.3 Å²	146.3	64%	0.642	78%	0.777	S	S	*	*			trans	13.3	121.2	142.3	-173.5	0	0	0	0	117.7	Q345	V343-Q345 HydrophobicContact CG1-CG 4.38Å
344	H	25.6	Very low	25.9	Very low	193 Å²	193	150 Å²	150	89%	0.894	79%	0.788	S	S	*	*			trans	-135.8	141	136.3	-122.4	-86.7	0	0	0	110.3
345	Q	27.1	Very low	25.8	Very low	172 Å²	172	148 Å²	148	80%	0.804	78%	0.783	S	S	*	*			trans	-80.4	144.6	-167.5	-67.4	160.8	-18.4	0	0	112.2	V343	V343-Q345 HydrophobicContact CG1-CG 4.38Å
346	S	25.5	Very low	25.6	Very low	113 Å²	113	146 Å²	146	79%	0.79	78%	0.781	S	S	*	*			trans	-108.5	137	164.1	-60.2	0	0	0	0	108.9
347	P	33.3	Very low	25.7	Very low	122 Å²	122	146.9 Å²	146.9	79%	0.792	78%	0.782	S	S	*	*			trans	-92.8	135.3	162.4	33.3	-28.1	0	0	0	110.7
348	D	25	Very low	25.8	Very low	155 Å²	155	145.2 Å²	145.2	83%	0.829	78%	0.776	S	S	*	*			trans	-59.8	147	-172	-47.3	-68.4	0	0	0	115.2
349	W	28	Very low	26	Very low	226 Å²	226	148.4 Å²	148.4	86%	0.856	78%	0.776	S	S	*	*			trans	-141.7	103.3	130.6	59.7	-86	0	0	0	109.3
350	E	22.5	Very low	26.1	Very low	172 Å²	172	153.2 Å²	153.2	80%	0.804	79%	0.789	S	S	*	*			trans	-95.7	117.8	173.9	-172	172.7	-124.7	0	0	109	V352	E350-V352 HydrophobicContact CG-CG2 4.37Å
351	I	28.3	Very low	26	Very low	136 Å²	136	152.5 Å²	152.5	70%	0.697	79%	0.786	S	S	*	*			trans	-126	103.4	163.8	-62.5	-177.1	0	0	0	107.4	I353	I351-I353 PolarHBondContact O-N 3.46Å
352	V	24.1	Very low	26.1	Very low	104 Å²	104	155.1 Å²	155.1	63%	0.63	79%	0.79	S	S	*	*			trans	-61.3	129.5	174.4	179.9	0	0	0	0	109.5	E350 E354	E350-V352 HydrophobicContact CG-CG2 4.37Å; V352-E354 HydrophobicContact CG1-CG 3.96Å
353	I	26.6	Very low	26.3	Very low	155 Å²	155	156 Å²	156	80%	0.795	79%	0.785	S	S	*	*			trans	-116.5	106.3	159.6	-60.7	179.8	0	0	0	105.7	I351 D355	I351-I353 PolarHBondContact O-N 3.46Å; I353-D355 PolarHBondContact O-N 2.84Å
354	E	26.6	Very low	26.3	Very low	177 Å²	177	159.9 Å²	159.9	83%	0.827	79%	0.793	S	S	*	*			trans	-65	130.8	175	-66.3	-170.4	132.7	0	0	110.2	V352	V352-E354 HydrophobicContact CG1-CG 3.96Å
355	D	24.9	Very low	26.2	Very low	126 Å²	126	153.3 Å²	153.3	67%	0.674	78%	0.778	S	S	*	*			trans	-77.6	126.4	175.3	-169.1	-14.9	0	0	0	109.6	I353 T357	I353-D355 PolarHBondContact O-N 2.84Å; D355-T357 WeakPolarHBondContact OD1-CB 3.49Å; D355-T357 WeakPolarHBondContact OD1-CG2 3.48Å; D355-T357 PolarHBondContact OD1-N 3.39Å; D355-T357 PolarHBondContact OD1-OG1 3.16Å
356	N	24.5	Very low	26.3	Very low	144 Å²	144	151.4 Å²	151.4	77%	0.77	78%	0.779	S	S	*	*			trans	-136.2	49.5	166.2	-151	-28.3	0	0	0	111.6	S358	N356-S358 PolarHBondContact O-N 3.49Å
357	T	25.8	Very low	26.2	Very low	120 Å²	120	153.4 Å²	153.4	74%	0.736	78%	0.78	S	S	*	*			trans	-70.9	70.9	167.5	49.3	0	0	0	0	111.4	D355	D355-T357 WeakPolarHBondContact OD1-CB 3.49Å; D355-T357 WeakPolarHBondContact OD1-CG2 3.48Å; D355-T357 PolarHBondContact OD1-N 3.39Å; D355-T357 PolarHBondContact OD1-OG1 3.16Å
358	S	26	Very low	26	Very low	92 Å²	92	154.3 Å²	154.3	64%	0.643	78%	0.784	S	S	*	*			trans	-145.4	68.3	-176.6	-86.2	0	0	0	0	115.8	N356	N356-S358 PolarHBondContact O-N 3.49Å
359	R	29.7	Very low	26.1	Very low	243 Å²	243	151.9 Å²	151.9	92%	0.917	78%	0.779	S	S	*	*	S	Bend		173.5	160.9	129.2	-95.1	160.7	-178	-149.5	-1.7	113.5
360	L	26	Very low	26.2	Very low	177 Å²	177	150.9 Å²	150.9	93%	0.927	78%	0.78	S	S	*	*			trans	64.8	71.4	172.5	-61.7	178.9	0	0	0	116.9
361	N	23.1	Very low	26.4	Very low	160 Å²	160	149 Å²	149	86%	0.856	78%	0.78	S	S	*	*			trans	-117.4	96.7	148.4	-174.5	31.3	0	0	0	108.4
362	E	26.2	Very low	26.2	Very low	173 Å²	173	149.4 Å²	149.4	81%	0.808	78%	0.784	S	S	*	*			trans	-175.9	142.6	157	-114.4	179.5	-154.1	0	0	113
363	R	28.7	Very low	26.2	Very low	209 Å²	209	149.4 Å²	149.4	79%	0.789	79%	0.788	S	S	*	*			trans	59.6	138.7	173	-91.4	171.2	167.2	152.7	-3.4	116.8
364	F	25	Very low	26.2	Very low	188 Å²	188	152 Å²	152	83%	0.825	79%	0.794	S	S	*	*			cis	-123.1	171.7	1.7	-90.4	-91.5	0	0	0	111.3
365	G	23.8	Very low	26.2	Very low	56 Å²	56	149.5 Å²	149.5	58%	0.577	79%	0.791	S	S	*	*			trans	-129	177.9	171.6	0	0	0	0	0	113.5
366	T	27.8	Very low	26.3	Very low	132 Å²	132	149.9 Å²	149.9	81%	0.81	79%	0.793	S	S	*	*			trans	84.4	145.8	171.1	75.4	0	0	0	0	119
367	N	25.1	Very low	26.7	Very low	154 Å²	154	151.4 Å²	151.4	82%	0.824	80%	0.799	S	S	*	*			trans	71.5	99.9	159.1	-60.7	-37.9	0	0	0	120.6
368	V	28.5	Very low	26.9	Very low	142 Å²	142	154.1 Å²	154.1	86%	0.861	80%	0.796	S	S	*	*			trans	-81.2	121.1	149.4	173.4	0	0	0	0	108.8
369	S	26.7	Very low	27.2	Very low	104 Å²	104	156.3 Å²	156.3	73%	0.727	80%	0.796	S	S	*	*			trans	177.8	131.6	152.4	-87.2	0	0	0	0	113.3
370	K	29.3	Very low	27.2	Very low	204 Å²	204	151.8 Å²	151.8	89%	0.887	80%	0.796	S	S	*	*			trans	65.5	150.8	169	-59	-177.7	179.8	-179.9	0	115.7
371	V	26.8	Very low	27.4	Very low	132 Å²	132	152 Å²	152	80%	0.8	79%	0.794	S	S	*	*			cis	-151	170.3	-15.9	121.6	0	0	0	0	108.5
372	N	24.1	Very low	28.1	Very low	146 Å²	146	149.2 Å²	149.2	78%	0.781	79%	0.785	S	S	*	*			trans	-53.6	167.9	-178.8	-79.2	-5.8	0	0	0	117.2
373	S	25.7	Very low	28.2	Very low	103 Å²	103	147.5 Å²	147.5	72%	0.72	79%	0.786	S	S	*	*			trans	70.9	113.3	158.3	39.7	0	0	0	0	118.7
374	F	25.3	Very low	28.8	Very low	210 Å²	210	146.4 Å²	146.4	92%	0.921	79%	0.79	S	S	*	*				-150.2	158.1	106.4	-107.3	-74.3	0	0	0	110.9
375	T	27.9	Very low	29.1	Very low	125 Å²	125	142.3 Å²	142.3	77%	0.767	79%	0.785	S	S	*	*			trans	-112.9	139.2	-170.4	49.9	0	0	0	0	113.4
376	N	27	Very low	30	Very low	134 Å²	134	148.8 Å²	148.8	72%	0.717	80%	0.8	S	S	*	*			trans	63	106.3	145.4	-162.9	4.3	0	0	0	119.3
377	I	31.2	Very low	30.8	Very low	175 Å²	175	148.4 Å²	148.4	90%	0.897	80%	0.802	S	S	*	*			trans	-130	144.8	145.7	-63.4	-176.8	0	0	0	107.2
378	R	30.9	Very low	32	Very low	178 Å²	178	144.2 Å²	144.2	67%	0.672	80%	0.796	S	S	*	*			trans	-93.9	151.5	-166	-68.3	175.5	84.4	163.6	1.3	114.9
379	E	31.8	Very low	33.3	Very low	137 Å²	137	148 Å²	148	64%	0.64	80%	0.795	S	S	*	*			trans	43.9	104.8	134.3	-62.5	153.2	-159	0	0	120.1
380	T	31.1	Very low	35.6	Very low	148 Å²	148	148.4 Å²	148.4	91%	0.908	79%	0.785	S	S	*	*				-143.4	126.4	123.9	49	0	0	0	0	110.1
381	M	29.1	Very low	37.9	Very low	181 Å²	181	141.6 Å²	141.6	89%	0.892	76%	0.756	S	S	*	*			trans	-90.9	179	173.5	-72	-80.1	-150.4	0	0	110.7
382	P	38.4	Very low	40.4	Very low	103 Å²	103	141.2 Å²	141.2	67%	0.669	75%	0.745	S	S	*	*				-128.3	171.6	-51.4	37	-23.5	0	0	0	111.5
383	V	27.2	Very low	43.1	Very low	137 Å²	137	134.7 Å²	134.7	83%	0.83	71%	0.711	S	S	*	*			trans	-130	117	163.2	-179.1	0	0	0	0	109.3
384	H	42.1	Very low	45.4	Very low	185 Å²	185	135.2 Å²	135.2	86%	0.856	71%	0.712	S	S	*	*			trans	-68.1	136.5	172.4	-77.6	-74.2	0	0	0	110.9
385	S	31.3	Very low	47.7	Very low	103 Å²	103	129.9 Å²	129.9	72%	0.72	69%	0.693	S	S	*	*			trans	-154.9	91.7	163.3	-78.7	0	0	0	0	111.4
386	Q	43.1	Very low	50.3	Low	192 Å²	192	125.6 Å²	125.6	90%	0.897	67%	0.667	S	S	*	*			trans	58.2	117.9	151.3	-63.3	172.2	-14.6	0	0	118.9	G388	Q386-G388 PolarHBondContact O-N 3.2Å
387	S	44.9	Very low	52.7	Low	123 Å²	123	124.7 Å²	124.7	86%	0.86	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-63.4	117.1	163.3	38.1	0	0	0	0	110.9	R389	S387-R389 PolarHBondContact O-N 3.16Å
388	G	49.3	Very low	54.8	Low	67 Å²	67	121.6 Å²	121.6	69%	0.691	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-69.7	124	179.3	0	0	0	0	0	112.1	Q386 Q390	Q386-G388 PolarHBondContact O-N 3.2Å; G388-Q390 PolarHBondContact O-N 2.94Å
389	R	55.8	Low	57	Low	222 Å²	222	115.5 Å²	115.5	84%	0.838	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-53.4	121.5	171.9	-77.4	-176.9	172.8	177	-2.9	110.1	S387 H391	S387-R389 PolarHBondContact O-N 3.16Å; R389-H391 PolarHBondContact O-CD2 3.36Å
390	Q	76.1	Confident	59.6	Low	112 Å²	112	111.1 Å²	111.1	52%	0.523	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-77.1	141.4	171.1	-62.1	-168.2	33.5	0	0	109.9	G388 H392 S399	G388-Q390 PolarHBondContact O-N 2.94Å; Q390-H392 PolarHBondContact O-CD2 3.09Å; Q390-S399 VanDerWaalsContact OE1-CB 3.26Å; Q390-S399 PolarHBondContact OE1-OG 3.47Å
391	H	77.2	Confident	62.1	Low	61 Å²	61	109.7 Å²	109.7	28%	0.282	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.5	107.6	179.2	-68.1	-93.2	0	0	0	108.8	R389 S399 F400 C402 N403 L406	R389-H391 PolarHBondContact O-CD2 3.36Å; H391-S399 CarbonylContact O-C 3.17Å; H391-F400 PolarHBondContact N-O 3.18Å; H391-F400 PolarHBondContact O-N 3.33Å; H391-C402 VanDerWaalsContact CD2-CA 3.48Å; H391-C402 WeakPolarHBondContact CD2-CA 3.31Å; H391-N403 PolarHBondContact CD2-N 3.16Å; H391-N403 PolarHBondContact NE2-N 3.29Å; H391-L406 HydrophobicContact CB-CB 3.91Å; H391-L406 HydrophobicContact CB-CD2 3.85Å
392	H	78.6	Confident	64.6	Low	123 Å²	123	103 Å²	103	57%	0.569	58%	0.584	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.4	145.3	-174	-62.2	-104.1	0	0	0	111.4	Q390 L406	Q390-H392 PolarHBondContact O-CD2 3.09Å; H392-L406 VanDerWaalsContact O-CD2 3.26Å; H392-L406 WeakPolarHBondContact O-CD2 3.37Å
393	C	81.1	Confident	66.5	Low	10 Å²	10	101.8 Å²	101.8	7%	0.068	57%	0.572	C	S	.	*			trans	-84.6	122.4	174.1	-175.4	0	0	0	0	110.4	L395 C396 K398 L406 H409 L410	C393-L395 PolarHBondContact O-N 2.95Å; C393-L395 PolarHBondContact SG-N 2.99Å; C393-C396 WeakPolarHBondContact CB-O 3.44Å; C393-K398 WeakPolarHBondContact CB-O 3.35Å; C393-K398 PolarHBondContact N-O 3.2Å; C393-L406 HydrophobicContact CB-CD1 3.76Å; C393-H409 PolarHBondContact SG-NE2 3.16Å; C393-L410 VanDerWaalsContact SG-CD2 3.54Å
394	P	74.7	Confident	69	Low	114 Å²	114	99.2 Å²	99.2	74%	0.74	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-19	173.9	24.8	-34.3	0	0	0	113.4	L410	P394-L410 HydrophobicContact CG-CD2 4.47Å
395	L	73.9	Confident	70.9	Confident	98 Å²	98	93.3 Å²	93.3	51%	0.513	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	5.8	-174.8	-57.2	177	0	0	0	114.2	C393 H413	C393-L395 PolarHBondContact O-N 2.95Å; C393-L395 PolarHBondContact SG-N 2.99Å; L395-H413 HydrophobicContact CB-CB 4.41Å; L395-H413 HydrophobicContact CD1-CB 3.64Å; L395-H413 PolarHBondContact O-NE2 2.94Å
396	C	81.3	Confident	73.2	Confident	34 Å²	34	89.1 Å²	89.1	23%	0.23	50%	0.502	C	S	.	.	S	Bend	trans	-174.7	162.2	159.2	65.1	0	0	0	0	110.8	C393 K398 H409 H413	C393-C396 WeakPolarHBondContact CB-O 3.44Å; C396-K398 PolarHBondContact O-N 3.35Å; C396-K398 PolarHBondContact SG-NZ 3.17Å; C396-H409 PolarHBondContact SG-NE2 3.49Å; C396-H413 VanDerWaalsContact CB-NE2 3.27Å; C396-H413 WeakPolarHBondContact CB-NE2 3.49Å; C396-H413 PolarHBondContact SG-NE2 3.37Å
397	A	77.3	Confident	74.9	Confident	115 Å²	115	83.6 Å²	83.6	95%	0.95	48%	0.478	S	S	*	.	S	Bend	trans	-67.4	37.2	-176.2	0	0	0	0	0	117.1
398	K	75.6	Confident	76.6	Confident	110 Å²	110	81.4 Å²	81.4	48%	0.478	45%	0.451	S	S	.	.			trans	-105	123.4	178.4	-62.8	-178.2	-170.8	75.1	0	111.1	C393 C396 F400	C393-K398 WeakPolarHBondContact CB-O 3.35Å; C393-K398 PolarHBondContact N-O 3.2Å; C396-K398 PolarHBondContact O-N 3.35Å; C396-K398 PolarHBondContact SG-NZ 3.17Å; K398-F400 HydrophobicContact CB-CE2 3.76Å; K398-F400 HydrophobicContact CB-CZ 3.9Å; K398-F400 WeakPolarHBondContact O-CE2 3.45Å
399	S	77.8	Confident	78	Confident	51 Å²	51	79.2 Å²	79.2	36%	0.357	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	157	170.9	71.5	0	0	0	0	112.2	Q390 H391	Q390-S399 VanDerWaalsContact OE1-CB 3.26Å; Q390-S399 PolarHBondContact OE1-OG 3.47Å; H391-S399 CarbonylContact O-C 3.17Å
400	F	85.4	Confident	78.9	Confident	44 Å²	44	70.4 Å²	70.4	19%	0.193	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	143.1	-178.5	-61.7	-87.3	0	0	0	111.4	H391 K398 C402 H405 L406 H409	H391-F400 PolarHBondContact N-O 3.18Å; H391-F400 PolarHBondContact O-N 3.33Å; K398-F400 HydrophobicContact CB-CE2 3.76Å; K398-F400 HydrophobicContact CB-CZ 3.9Å; K398-F400 WeakPolarHBondContact O-CE2 3.45Å; F400-C402 PolarHBondContact O-N 3.05Å; F400-C402 VanDerWaalsContact O-N 3.13Å; F400-H405 HydrophobicContact CB-CB 3.83Å; F400-H405 HydrophobicContact CD1-CB 3.92Å; F400-H405 HydrophobicContact CG-CB 4.14Å; F400-L406 HydrophobicContact CB-CB 4.41Å; F400-L406 HydrophobicContact CD2-CB 4.11Å; F400-L406 HydrophobicContact CD2-CD1 4.2Å; F400-L406 HydrophobicContact CE2-CD1 4.48Å; F400-L406 HydrophobicContact CG-CB 4.47Å; F400-H409 HydrophobicContact CE1-CB 4.11Å; F400-H409 HydrophobicContact CE2-CB 3.92Å; F400-H409 AromaticContact CE2-CD2 3.21Å; F400-H409 WeakPolarHBondContact CE2-CD2 3.23Å; F400-H409 AromaticContact CE2-CG 3.8Å; F400-H409 HydrophobicContact CZ-CB 3.57Å; F400-H409 AromaticContact CZ-CD2 3.32Å; F400-H409 WeakPolarHBondContact CZ-CD2 3.35Å; F400-H409 AromaticContact CZ-CG 3.48Å; F400-H409 VanDerWaalsContact CZ-CG 3.48Å
401	T	83.9	Confident	79.2	Confident	119 Å²	119	67.6 Å²	67.6	73%	0.73	38%	0.376	S	S	*	.	S	Bend	trans	-70.1	-4.5	-178.9	51	0	0	0	0	115.2
402	C	81.2	Confident	79	Confident	39 Å²	39	69.1 Å²	69.1	26%	0.264	39%	0.39	S	S	.	.	S	Bend	trans	-160.8	154	173.6	63.7	0	0	0	0	112.1	H391 F400 S404 H405 L406	H391-C402 VanDerWaalsContact CD2-CA 3.48Å; H391-C402 WeakPolarHBondContact CD2-CA 3.31Å; F400-C402 PolarHBondContact O-N 3.05Å; F400-C402 VanDerWaalsContact O-N 3.13Å; C402-S404 VanDerWaalsContact C-N 3.3Å; C402-S404 PolarHBondContact O-N 3.45Å; C402-S404 PolarHBondContact SG-OG 2.77Å; C402-H405 WeakPolarHBondContact O-CB 3.43Å; C402-H405 PolarHBondContact O-N 3.44Å; C402-L406 PolarHBondContact O-N 3.08Å
403	N	78.1	Confident	78.8	Confident	79 Å²	79	67.7 Å²	67.7	42%	0.422	38%	0.384	S	S	.	.	H	α-helix	trans	-58.8	-38.6	-176.8	-161.4	20.2	0	0	0	113.1	H391 H405 L406 I407	H391-N403 PolarHBondContact CD2-N 3.16Å; H391-N403 PolarHBondContact NE2-N 3.29Å; N403-H405 PolarHBondContact O-N 3.03Å; N403-H405 VanDerWaalsContact O-N 3.16Å; N403-L406 CarbonylContact O-C 3.58Å; N403-L406 WeakPolarHBondContact O-CA 3.49Å; N403-L406 WeakPolarHBondContact O-CB 3.41Å; N403-L406 PolarHBondContact O-N 2.99Å; N403-I407 WeakPolarHBondContact O-CG1 3.43Å; N403-I407 PolarHBondContact O-N 3.47Å
404	S	80	Confident	78.5	Confident	82 Å²	82	70.9 Å²	70.9	57%	0.573	40%	0.403	S	S	*	.	H	α-helix	trans	-65	-20.6	178.9	66.7	0	0	0	0	113.3	C402 R408	C402-S404 VanDerWaalsContact C-N 3.3Å; C402-S404 PolarHBondContact O-N 3.45Å; C402-S404 PolarHBondContact SG-OG 2.77Å; S404-R408 VanDerWaalsContact O-CB 3.24Å; S404-R408 WeakPolarHBondContact O-CB 3.3Å; S404-R408 PolarHBondContact O-N 3.3Å
405	H	81.9	Confident	78.4	Confident	62 Å²	62	67.2 Å²	67.2	29%	0.287	39%	0.386	S	S	.	.	H	α-helix	trans	-80.7	-38	170.8	-75.9	-170.8	0	0	0	112.3	F400 C402 N403 R408 H409	F400-H405 HydrophobicContact CB-CB 3.83Å; F400-H405 HydrophobicContact CD1-CB 3.92Å; F400-H405 HydrophobicContact CG-CB 4.14Å; C402-H405 WeakPolarHBondContact O-CB 3.43Å; C402-H405 PolarHBondContact O-N 3.44Å; N403-H405 PolarHBondContact O-N 3.03Å; N403-H405 VanDerWaalsContact O-N 3.16Å; H405-R408 PolarHBondContact CD2-NH1 3.27Å; H405-R408 PolarHBondContact CD2-NH2 3.21Å; H405-R408 PolarHBondContact NE2-NH1 2.86Å; H405-R408 PolarHBondContact NE2-NH2 2.83Å; H405-H409 PolarHBondContact O-N 3.16Å; H405-H409 VanDerWaalsContact O-N 3.12Å
406	L	80.2	Confident	78.6	Confident	15 Å²	15	66.9 Å²	66.9	8%	0.079	38%	0.382	C	S	.	.	H	α-helix	trans	-63.1	-54.3	170.5	170	60	0	0	0	111.6	H391 H392 C393 F400 C402 N403 R408 H409 L410	H391-L406 HydrophobicContact CB-CB 3.91Å; H391-L406 HydrophobicContact CB-CD2 3.85Å; H392-L406 VanDerWaalsContact O-CD2 3.26Å; H392-L406 WeakPolarHBondContact O-CD2 3.37Å; C393-L406 HydrophobicContact CB-CD1 3.76Å; F400-L406 HydrophobicContact CB-CB 4.41Å; F400-L406 HydrophobicContact CD2-CB 4.11Å; F400-L406 HydrophobicContact CD2-CD1 4.2Å; F400-L406 HydrophobicContact CE2-CD1 4.48Å; F400-L406 HydrophobicContact CG-CB 4.47Å; C402-L406 PolarHBondContact O-N 3.08Å; N403-L406 CarbonylContact O-C 3.58Å; N403-L406 WeakPolarHBondContact O-CA 3.49Å; N403-L406 WeakPolarHBondContact O-CB 3.41Å; N403-L406 PolarHBondContact O-N 2.99Å; L406-R408 PolarHBondContact O-N 3.02Å; L406-H409 CarbonylContact O-C 3.6Å; L406-H409 WeakPolarHBondContact O-CA 3.33Å; L406-H409 WeakPolarHBondContact O-CB 3.32Å; L406-H409 PolarHBondContact O-N 3.18Å; L406-L410 HydrophobicContact CD1-CD1 4.16Å; L406-L410 HydrophobicContact CD1-CD2 4.23Å; L406-L410 HydrophobicContact CD1-CG 3.92Å; L406-L410 HydrophobicContact CG-CD1 4.11Å; L406-L410 HydrophobicContact CG-CG 4.34Å; L406-L410 PolarHBondContact O-N 3.47Å
407	I	78.1	Confident	78.7	Confident	75 Å²	75	71 Å²	71	39%	0.385	40%	0.395	S	S	.	.	H	α-helix	trans	-55.6	-37.8	178.2	-62.6	-65.8	0	0	0	111.4	N403 H409 L410	N403-I407 WeakPolarHBondContact O-CG1 3.43Å; N403-I407 PolarHBondContact O-N 3.47Å; I407-H409 VanDerWaalsContact C-N 3.31Å; I407-H409 PolarHBondContact O-N 2.84Å; I407-L410 HydrophobicContact CD1-CD1 4.28Å; I407-L410 PolarHBondContact O-N 3.13Å
408	R	81.1	Confident	78.9	Confident	77 Å²	77	68.8 Å²	68.8	29%	0.291	37%	0.372	S	S	.	.	H	α-helix	trans	-66.8	-30.5	174	-179.7	-176.3	68.9	-150.3	-3.5	113.1	S404 H405 L406 R430	S404-R408 VanDerWaalsContact O-CB 3.24Å; S404-R408 WeakPolarHBondContact O-CB 3.3Å; S404-R408 PolarHBondContact O-N 3.3Å; H405-R408 PolarHBondContact CD2-NH1 3.27Å; H405-R408 PolarHBondContact CD2-NH2 3.21Å; H405-R408 PolarHBondContact NE2-NH1 2.86Å; H405-R408 PolarHBondContact NE2-NH2 2.83Å; L406-R408 PolarHBondContact O-N 3.02Å; R408-R430 HydrophobicContact CG-CG 4.3Å
409	H	78.7	Confident	79.4	Confident	21 Å²	21	67.3 Å²	67.3	10%	0.097	36%	0.364	C	S	.	.	H	α-helix	trans	-80.2	-37.3	175	169.3	39.4	0	0	0	112.4	C393 C396 F400 H405 L406 I407 R411 T412 H413	C393-H409 PolarHBondContact SG-NE2 3.16Å; C396-H409 PolarHBondContact SG-NE2 3.49Å; F400-H409 HydrophobicContact CE1-CB 4.11Å; F400-H409 HydrophobicContact CE2-CB 3.92Å; F400-H409 AromaticContact CE2-CD2 3.21Å; F400-H409 WeakPolarHBondContact CE2-CD2 3.23Å; F400-H409 AromaticContact CE2-CG 3.8Å; F400-H409 HydrophobicContact CZ-CB 3.57Å; F400-H409 AromaticContact CZ-CD2 3.32Å; F400-H409 WeakPolarHBondContact CZ-CD2 3.35Å; F400-H409 AromaticContact CZ-CG 3.48Å; F400-H409 VanDerWaalsContact CZ-CG 3.48Å; H405-H409 PolarHBondContact O-N 3.16Å; H405-H409 VanDerWaalsContact O-N 3.12Å; L406-H409 CarbonylContact O-C 3.6Å; L406-H409 WeakPolarHBondContact O-CA 3.33Å; L406-H409 WeakPolarHBondContact O-CB 3.32Å; L406-H409 PolarHBondContact O-N 3.18Å; I407-H409 VanDerWaalsContact C-N 3.31Å; I407-H409 PolarHBondContact O-N 2.84Å; H409-R411 PolarHBondContact O-N 3.4Å; H409-R411 VanDerWaalsContact O-N 3.08Å; H409-T412 PolarHBondContact CE1-OG1 3.12Å; H409-T412 PolarHBondContact ND1-OG1 3.04Å; H409-T412 WeakPolarHBondContact O-CB 3.37Å; H409-T412 PolarHBondContact O-N 3.49Å; H409-T412 PolarHBondContact O-OG1 2.82Å; H409-H413 AromaticContact CE1-CD2 3.76Å
410	L	74.5	Confident	79.6	Confident	38 Å²	38	71.5 Å²	71.5	20%	0.199	38%	0.375	C	S	.	.	H	α-helix	trans	-55.7	-31.5	177.4	-69.9	172.5	0	0	0	112.6	C393 P394 L406 I407 T412 H413 T414	C393-L410 VanDerWaalsContact SG-CD2 3.54Å; P394-L410 HydrophobicContact CG-CD2 4.47Å; L406-L410 HydrophobicContact CD1-CD1 4.16Å; L406-L410 HydrophobicContact CD1-CD2 4.23Å; L406-L410 HydrophobicContact CD1-CG 3.92Å; L406-L410 HydrophobicContact CG-CD1 4.11Å; L406-L410 HydrophobicContact CG-CG 4.34Å; L406-L410 PolarHBondContact O-N 3.47Å; I407-L410 HydrophobicContact CD1-CD1 4.28Å; I407-L410 PolarHBondContact O-N 3.13Å; L410-T412 PolarHBondContact O-N 3.08Å; L410-T412 VanDerWaalsContact O-N 3.08Å; L410-H413 WeakPolarHBondContact O-CA 3.3Å; L410-H413 WeakPolarHBondContact O-CB 3.49Å; L410-H413 PolarHBondContact O-N 3.27Å; L410-T414 PolarHBondContact O-N 3.47Å
411	R	81.9	Confident	79.7	Confident	52 Å²	52	69.5 Å²	69.5	20%	0.196	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-6.8	170.5	-60.9	179.5	-176.2	158.2	5.5	115.7	H409 G415 E416	H409-R411 PolarHBondContact O-N 3.4Å; H409-R411 VanDerWaalsContact O-N 3.08Å; R411-G415 PolarHBondContact O-N 3.03Å; R411-E416 HydrophobicContact CB-CB 4.32Å; R411-E416 HydrophobicContact CG-CB 4.06Å; R411-E416 IonicContact NE-OE2 3.45Å
412	T	73	Confident	79.6	Confident	94 Å²	94	70 Å²	70	58%	0.577	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-21.6	166.9	66.7	0	0	0	0	112.6	H409 L410	H409-T412 PolarHBondContact CE1-OG1 3.12Å; H409-T412 PolarHBondContact ND1-OG1 3.04Å; H409-T412 WeakPolarHBondContact O-CB 3.37Å; H409-T412 PolarHBondContact O-N 3.49Å; H409-T412 PolarHBondContact O-OG1 2.82Å; L410-T412 PolarHBondContact O-N 3.08Å; L410-T412 VanDerWaalsContact O-N 3.08Å
413	H	74.9	Confident	79.4	Confident	92 Å²	92	72.6 Å²	72.6	43%	0.426	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-51.3	173.1	-59.8	-78.9	0	0	0	110.6	L395 C396 H409 L410 G415	L395-H413 HydrophobicContact CB-CB 4.41Å; L395-H413 HydrophobicContact CD1-CB 3.64Å; L395-H413 PolarHBondContact O-NE2 2.94Å; C396-H413 VanDerWaalsContact CB-NE2 3.27Å; C396-H413 WeakPolarHBondContact CB-NE2 3.49Å; C396-H413 PolarHBondContact SG-NE2 3.37Å; H409-H413 AromaticContact CE1-CD2 3.76Å; L410-H413 WeakPolarHBondContact O-CA 3.3Å; L410-H413 WeakPolarHBondContact O-CB 3.49Å; L410-H413 PolarHBondContact O-N 3.27Å; H413-G415 PolarHBondContact O-N 2.87Å
414	T	74.3	Confident	79.6	Confident	78 Å²	78	71.2 Å²	71.2	48%	0.479	37%	0.374	S	S	.	.	S	Bend	trans	-71.8	-8.1	178	67.9	0	0	0	0	113.9	L410 E416	L410-T414 PolarHBondContact O-N 3.47Å; T414-E416 WeakPolarHBondContact CB-OE1 3.27Å; T414-E416 PolarHBondContact O-N 2.81Å; T414-E416 VanDerWaalsContact OG1-CD 3.27Å; T414-E416 WeakPolarHBondContact OG1-CG 3.4Å; T414-E416 PolarHBondContact OG1-OE1 2.65Å
415	G	73.2	Confident	79.6	Confident	36 Å²	36	69.1 Å²	69.1	37%	0.371	37%	0.365	S	S	.	.			trans	67.6	-1.5	178.9	0	0	0	0	0	115.9	R411 H413 K417	R411-G415 PolarHBondContact O-N 3.03Å; H413-G415 PolarHBondContact O-N 2.87Å; G415-K417 WeakPolarHBondContact O-CE 3.42Å
416	E	78.8	Confident	79.5	Confident	92 Å²	92	72 Å²	72	43%	0.43	38%	0.376	S	S	.	.			trans	-52.4	134.2	-175.3	-82	167.9	-119.4	0	0	113.9	R411 T414 T429	R411-E416 HydrophobicContact CB-CB 4.32Å; R411-E416 HydrophobicContact CG-CB 4.06Å; R411-E416 IonicContact NE-OE2 3.45Å; T414-E416 WeakPolarHBondContact CB-OE1 3.27Å; T414-E416 PolarHBondContact O-N 2.81Å; T414-E416 VanDerWaalsContact OG1-CD 3.27Å; T414-E416 WeakPolarHBondContact OG1-CG 3.4Å; T414-E416 PolarHBondContact OG1-OE1 2.65Å; E416-T429 WeakPolarHBondContact O-CG2 3.37Å
417	K	83.2	Confident	79.8	Confident	120 Å²	120	73.6 Å²	73.6	52%	0.522	39%	0.389	S	S	.	.			trans	-127.4	72.4	177.4	-69.5	146.2	-168	150.3	0	111	G415 Y419 S427 Y428 T429	G415-K417 WeakPolarHBondContact O-CE 3.42Å; K417-Y419 PolarHBondContact O-N 3.44Å; K417-Y419 VanDerWaalsContact O-N 3.14Å; K417-S427 WeakPolarHBondContact O-CB 3.48Å; K417-Y428 CarbonylContact C-O 3.57Å; K417-Y428 VanDerWaalsContact C-O 3.25Å; K417-Y428 WeakPolarHBondContact CA-O 3.4Å; K417-T429 HydrophobicContact CG-CG2 3.89Å
418	P	81.9	Confident	80.1	Confident	69 Å²	69	72.7 Å²	72.7	45%	0.448	38%	0.381	S	S	.	.			trans	-63.6	-22.4	-172.9	-23.4	35.4	0	0	0	114.5	K420	P418-K420 PolarHBondContact O-N 3.4Å
419	Y	85	Confident	80.3	Confident	79 Å²	79	70.8 Å²	70.8	31%	0.31	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	85.5	-172.3	-53.8	-78.4	0	0	0	111	K417 Y428	K417-Y419 PolarHBondContact O-N 3.44Å; K417-Y419 VanDerWaalsContact O-N 3.14Å; Y419-Y428 WeakPolarHBondContact CD2-O 3.24Å; Y419-Y428 PolarHBondContact N-O 3.3Å; Y419-Y428 VanDerWaalsContact N-O 3.09Å; Y419-Y428 PolarHBondContact O-N 2.87Å
420	K	82.1	Confident	80.4	Confident	139 Å²	139	74.2 Å²	74.2	60%	0.604	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	136.3	177.5	-169.6	172.3	-177.7	-179.6	0	112.3	P418 G425	P418-K420 PolarHBondContact O-N 3.4Å; K420-G425 WeakPolarHBondContact CE-O 3.19Å
421	C	86.9	Confident	80.8	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.007	40%	0.403	C	S	.	.			trans	-81.6	120.9	172.1	-164.9	0	0	0	0	110.6	E423 G425 K426 L434	C421-E423 VanDerWaalsContact C-N 3.34Å; C421-E423 PolarHBondContact O-N 2.68Å; C421-G425 VanDerWaalsContact O-CA 3.25Å; C421-G425 WeakPolarHBondContact O-CA 3.36Å; C421-G425 PolarHBondContact O-N 3.38Å; C421-K426 VanDerWaalsContact CB-O 3.26Å; C421-K426 WeakPolarHBondContact CB-O 3.37Å; C421-K426 PolarHBondContact N-O 3.19Å; C421-L434 HydrophobicContact CB-CD1 3.5Å
422	T	83.1	Confident	80.7	Confident	129 Å²	129	76 Å²	76	79%	0.791	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-37.5	176.9	46.4	0	0	0	0	112.6	C424	T422-C424 VanDerWaalsContact C-N 3.35Å; T422-C424 PolarHBondContact O-N 3.33Å
423	E	76.8	Confident	81.2	Confident	95 Å²	95	74.2 Å²	74.2	44%	0.444	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-13.3	-174.1	-63	163.3	124.3	0	0	114.7	C421 H441	C421-E423 VanDerWaalsContact C-N 3.34Å; C421-E423 PolarHBondContact O-N 2.68Å; E423-H441 WeakPolarHBondContact OE2-CB 3.46Å; E423-H441 IonicContact OE2-CD2 3.4Å; E423-H441 PolarHBondContact OE2-CD2 2.79Å; E423-H441 IonicContact OE2-CG 3.05Å
424	C	81.2	Confident	81.6	Confident	50 Å²	50	70.8 Å²	70.8	34%	0.338	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-157.3	10.7	-177.5	73.6	0	0	0	0	115.6	T422 K426 H437 H441	T422-C424 VanDerWaalsContact C-N 3.35Å; T422-C424 PolarHBondContact O-N 3.33Å; C424-K426 PolarHBondContact O-N 3.22Å; C424-H437 PolarHBondContact SG-NE2 3.29Å; C424-H441 PolarHBondContact SG-NE2 3.4Å
425	G	80.4	Confident	81.9	Confident	37 Å²	37	69.3 Å²	69.3	38%	0.381	38%	0.379	S	S	.	.			trans	71.8	-9.3	178.7	0	0	0	0	0	117.1	K420 C421 S427	K420-G425 WeakPolarHBondContact CE-O 3.19Å; C421-G425 VanDerWaalsContact O-CA 3.25Å; C421-G425 WeakPolarHBondContact O-CA 3.36Å; C421-G425 PolarHBondContact O-N 3.38Å; G425-S427 PolarHBondContact O-N 2.81Å
426	K	80.8	Confident	82.1	Confident	122 Å²	122	73.5 Å²	73.5	53%	0.53	38%	0.384	S	S	.	.			trans	-69.3	126.8	-173.8	-68.1	176.4	-175.8	173.9	0	112.5	C421 C424 Y428	C421-K426 VanDerWaalsContact CB-O 3.26Å; C421-K426 WeakPolarHBondContact CB-O 3.37Å; C421-K426 PolarHBondContact N-O 3.19Å; C424-K426 PolarHBondContact O-N 3.22Å; K426-Y428 HydrophobicContact CB-CE2 3.87Å; K426-Y428 WeakPolarHBondContact O-CD2 3.32Å; K426-Y428 VanDerWaalsContact O-CE2 3.27Å; K426-Y428 WeakPolarHBondContact O-CE2 3.38Å
427	S	85.3	Confident	82.2	Confident	50 Å²	50	70.3 Å²	70.3	35%	0.35	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	143.5	-177.4	-55.6	0	0	0	0	113.6	K417 G425	K417-S427 WeakPolarHBondContact O-CB 3.48Å; G425-S427 PolarHBondContact O-N 2.81Å
428	Y	85.8	Confident	82.1	Confident	55 Å²	55	67.4 Å²	67.4	22%	0.216	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	148.7	-175.6	-62	-85.5	0	0	0	112.5	K417 Y419 K426 R430 H433 L434 H437	K417-Y428 CarbonylContact C-O 3.57Å; K417-Y428 VanDerWaalsContact C-O 3.25Å; K417-Y428 WeakPolarHBondContact CA-O 3.4Å; Y419-Y428 WeakPolarHBondContact CD2-O 3.24Å; Y419-Y428 PolarHBondContact N-O 3.3Å; Y419-Y428 VanDerWaalsContact N-O 3.09Å; Y419-Y428 PolarHBondContact O-N 2.87Å; K426-Y428 HydrophobicContact CB-CE2 3.87Å; K426-Y428 WeakPolarHBondContact O-CD2 3.32Å; K426-Y428 VanDerWaalsContact O-CE2 3.27Å; K426-Y428 WeakPolarHBondContact O-CE2 3.38Å; Y428-R430 VanDerWaalsContact C-N 3.26Å; Y428-R430 PolarHBondContact O-N 2.69Å; Y428-H433 HydrophobicContact CD1-CB 3.94Å; Y428-H433 HydrophobicContact CG-CB 4.21Å; Y428-L434 HydrophobicContact CD2-CB 4.03Å; Y428-L434 HydrophobicContact CD2-CD1 4.04Å; Y428-L434 HydrophobicContact CE2-CD1 4.31Å; Y428-L434 HydrophobicContact CG-CB 4.44Å; Y428-H437 HydrophobicContact CE1-CB 4.48Å; Y428-H437 HydrophobicContact CE2-CB 3.96Å; Y428-H437 AromaticContact CE2-CD2 3.44Å; Y428-H437 VanDerWaalsContact CE2-CD2 3.44Å; Y428-H437 WeakPolarHBondContact CE2-CD2 3.34Å; Y428-H437 AromaticContact CE2-CG 3.88Å; Y428-H437 AromaticContact CZ-CD2 3.64Å; Y428-H437 AromaticContact CZ-CG 3.71Å; Y428-H437 PolarHBondContact OH-CD2 2.71Å
429	T	84.3	Confident	81.9	Confident	38 Å²	38	70.9 Å²	70.9	23%	0.233	37%	0.365	C	S	.	.	S	Bend	trans	-71.2	-17.5	176.4	59.5	0	0	0	0	113.6	E416 K417	E416-T429 WeakPolarHBondContact O-CG2 3.37Å; K417-T429 HydrophobicContact CG-CG2 3.89Å
430	R	82.1	Confident	81.4	Confident	93 Å²	93	68.9 Å²	68.9	35%	0.351	36%	0.361	S	S	.	.	S	Bend	trans	-139.1	137.9	-175.2	-65.1	176.7	66.5	162.5	3.3	112	R408 Y428 S432 H433 L434	R408-R430 HydrophobicContact CG-CG 4.3Å; Y428-R430 VanDerWaalsContact C-N 3.26Å; Y428-R430 PolarHBondContact O-N 2.69Å; R430-S432 VanDerWaalsContact C-N 3.3Å; R430-S432 PolarHBondContact O-N 3.18Å; R430-H433 HydrophobicContact CB-CB 4.31Å; R430-H433 WeakPolarHBondContact O-CB 3.34Å; R430-H433 PolarHBondContact O-N 3.27Å; R430-L434 PolarHBondContact O-N 3.16Å
431	S	81.1	Confident	81	Confident	67 Å²	67	64.1 Å²	64.1	47%	0.469	34%	0.341	S	S	.	.	H	α-helix	trans	-55.4	-41.3	173.7	53.7	0	0	0	0	112.7	H433 L434 A435	S431-H433 PolarHBondContact O-N 3.11Å; S431-L434 PolarHBondContact O-N 3Å; S431-L434 VanDerWaalsContact O-N 3.17Å; S431-A435 WeakPolarHBondContact O-CB 3.46Å; S431-A435 PolarHBondContact O-N 3.48Å
432	S	79.8	Confident	80	Confident	59 Å²	59	71.6 Å²	71.6	41%	0.413	37%	0.373	S	S	.	.	H	α-helix	trans	-65.2	-24.8	176.4	63.7	0	0	0	0	113.8	R430 R436	R430-S432 VanDerWaalsContact C-N 3.3Å; R430-S432 PolarHBondContact O-N 3.18Å; S432-R436 VanDerWaalsContact O-CB 3.31Å; S432-R436 WeakPolarHBondContact O-CB 3.49Å; S432-R436 PolarHBondContact O-N 3.24Å; S432-R436 VanDerWaalsContact O-N 3.14Å
433	H	83.5	Confident	78.5	Confident	57 Å²	57	68.3 Å²	68.3	26%	0.264	35%	0.35	S	S	.	.	H	α-helix	trans	-77.2	-40.3	172.8	-68.1	-177	0	0	0	111.1	Y428 R430 S431 R436 H437	Y428-H433 HydrophobicContact CD1-CB 3.94Å; Y428-H433 HydrophobicContact CG-CB 4.21Å; R430-H433 HydrophobicContact CB-CB 4.31Å; R430-H433 WeakPolarHBondContact O-CB 3.34Å; R430-H433 PolarHBondContact O-N 3.27Å; S431-H433 PolarHBondContact O-N 3.11Å; H433-R436 PolarHBondContact CD2-NH2 2.99Å; H433-R436 VanDerWaalsContact CD2-NH2 3.26Å; H433-R436 PolarHBondContact NE2-NH2 3.42Å; H433-R436 PolarHBondContact O-N 2.94Å; H433-H437 WeakPolarHBondContact O-CB 3.21Å; H433-H437 PolarHBondContact O-N 2.88Å
434	L	84.3	Confident	77.3	Confident	20 Å²	20	68.3 Å²	68.3	11%	0.105	35%	0.353	C	S	.	.	H	α-helix	trans	-61.9	-48.7	171.4	173.2	60	0	0	0	111.4	C421 Y428 R430 S431 R436 H437 Q438	C421-L434 HydrophobicContact CB-CD1 3.5Å; Y428-L434 HydrophobicContact CD2-CB 4.03Å; Y428-L434 HydrophobicContact CD2-CD1 4.04Å; Y428-L434 HydrophobicContact CE2-CD1 4.31Å; Y428-L434 HydrophobicContact CG-CB 4.44Å; R430-L434 PolarHBondContact O-N 3.16Å; S431-L434 PolarHBondContact O-N 3Å; S431-L434 VanDerWaalsContact O-N 3.17Å; L434-R436 VanDerWaalsContact C-N 3.31Å; L434-R436 PolarHBondContact O-N 3.36Å; L434-H437 CarbonylContact O-C 3.49Å; L434-H437 WeakPolarHBondContact O-CA 3.37Å; L434-H437 WeakPolarHBondContact O-CB 3.42Å; L434-H437 PolarHBondContact O-N 3.26Å; L434-Q438 HydrophobicContact CD1-CG 3.92Å; L434-Q438 HydrophobicContact CG-CG 4.32Å; L434-Q438 PolarHBondContact O-N 3.1Å
435	A	80.1	Confident	75.5	Confident	47 Å²	47	69.7 Å²	69.7	39%	0.388	36%	0.36	S	S	.	.	H	α-helix	trans	-61.5	-37.7	178.6	0	0	0	0	0	112.5	S431 H437 K439	S431-A435 WeakPolarHBondContact O-CB 3.46Å; S431-A435 PolarHBondContact O-N 3.48Å; A435-H437 VanDerWaalsContact C-N 3.27Å; A435-H437 PolarHBondContact O-N 2.63Å; A435-K439 WeakPolarHBondContact O-CG 3.23Å; A435-K439 PolarHBondContact O-N 3.19Å
436	R	78.2	Confident	73.5	Confident	124 Å²	124	73.6 Å²	73.6	47%	0.468	38%	0.378	S	S	.	.	H	α-helix	trans	-65	-30.4	170.6	179.2	173.9	60.8	-173.3	-6.3	112.4	S432 H433 L434	S432-R436 VanDerWaalsContact O-CB 3.31Å; S432-R436 WeakPolarHBondContact O-CB 3.49Å; S432-R436 PolarHBondContact O-N 3.24Å; S432-R436 VanDerWaalsContact O-N 3.14Å; H433-R436 PolarHBondContact CD2-NH2 2.99Å; H433-R436 VanDerWaalsContact CD2-NH2 3.26Å; H433-R436 PolarHBondContact NE2-NH2 3.42Å; H433-R436 PolarHBondContact O-N 2.94Å; L434-R436 VanDerWaalsContact C-N 3.31Å; L434-R436 PolarHBondContact O-N 3.36Å
437	H	80.9	Confident	71.6	Confident	25 Å²	25	75.7 Å²	75.7	12%	0.116	39%	0.39	C	S	.	.	H	α-helix	trans	-78.5	-42.4	176.6	176.6	41.7	0	0	0	113	C424 Y428 H433 L434 A435 K439 V440 H441	C424-H437 PolarHBondContact SG-NE2 3.29Å; Y428-H437 HydrophobicContact CE1-CB 4.48Å; Y428-H437 HydrophobicContact CE2-CB 3.96Å; Y428-H437 AromaticContact CE2-CD2 3.44Å; Y428-H437 VanDerWaalsContact CE2-CD2 3.44Å; Y428-H437 WeakPolarHBondContact CE2-CD2 3.34Å; Y428-H437 AromaticContact CE2-CG 3.88Å; Y428-H437 AromaticContact CZ-CD2 3.64Å; Y428-H437 AromaticContact CZ-CG 3.71Å; Y428-H437 PolarHBondContact OH-CD2 2.71Å; H433-H437 WeakPolarHBondContact O-CB 3.21Å; H433-H437 PolarHBondContact O-N 2.88Å; L434-H437 CarbonylContact O-C 3.49Å; L434-H437 WeakPolarHBondContact O-CA 3.37Å; L434-H437 WeakPolarHBondContact O-CB 3.42Å; L434-H437 PolarHBondContact O-N 3.26Å; A435-H437 VanDerWaalsContact C-N 3.27Å; A435-H437 PolarHBondContact O-N 2.63Å; H437-K439 PolarHBondContact O-N 3.44Å; H437-V440 WeakPolarHBondContact O-CA 3.46Å; H437-V440 WeakPolarHBondContact O-CB 3.46Å; H437-V440 WeakPolarHBondContact O-CG2 3.44Å; H437-V440 PolarHBondContact O-N 3.43Å; H437-H441 AromaticContact CE1-CE1 3.95Å; H437-H441 AromaticContact CE1-NE2 3.46Å; H437-H441 PolarHBondContact CE1-NE2 2.8Å; H437-H441 AromaticContact NE2-NE2 3.22Å; H437-H441 PolarHBondContact NE2-NE2 3.29Å
438	Q	79.8	Confident	69.2	Low	60 Å²	60	83.1 Å²	83.1	28%	0.28	42%	0.416	S	S	.	.	H	α-helix	trans	-60.2	-30.3	176	-71.7	168.1	-43.6	0	0	112.4	L434 V440 H441 K442	L434-Q438 HydrophobicContact CD1-CG 3.92Å; L434-Q438 HydrophobicContact CG-CG 4.32Å; L434-Q438 PolarHBondContact O-N 3.1Å; Q438-V440 PolarHBondContact O-N 2.95Å; Q438-H441 PolarHBondContact O-N 2.92Å; Q438-K442 PolarHBondContact O-N 2.98Å
439	K	79.6	Confident	66.8	Low	142 Å²	142	88.3 Å²	88.3	62%	0.617	44%	0.442	S	S	*	.	H	α-helix	trans	-60.6	-18.8	169	-73	-176	179.6	-167.8	0	114.1	A435 H437 M443	A435-K439 WeakPolarHBondContact O-CG 3.23Å; A435-K439 PolarHBondContact O-N 3.19Å; H437-K439 PolarHBondContact O-N 3.44Å; K439-M443 WeakPolarHBondContact O-CB 3.49Å; K439-M443 VanDerWaalsContact O-CG 3.28Å; K439-M443 WeakPolarHBondContact O-CG 3.26Å; K439-M443 PolarHBondContact O-N 2.89Å
440	V	73	Confident	64.5	Low	37 Å²	37	92 Å²	92	22%	0.224	47%	0.466	C	S	.	.	H	α-helix	trans	-77	-38.2	172.4	-171.5	0	0	0	0	110.9	H437 Q438 M443 N444	H437-V440 WeakPolarHBondContact O-CA 3.46Å; H437-V440 WeakPolarHBondContact O-CB 3.46Å; H437-V440 WeakPolarHBondContact O-CG2 3.44Å; H437-V440 PolarHBondContact O-N 3.43Å; Q438-V440 PolarHBondContact O-N 2.95Å; V440-M443 PolarHBondContact O-N 3.49Å; V440-N444 PolarHBondContact O-N 3.17Å
441	H	74.4	Confident	62.6	Low	39 Å²	39	93.2 Å²	93.2	18%	0.181	49%	0.486	C	S	.	.	H	α-helix	trans	-69.2	-46	175.5	-62.7	-53.1	0	0	0	111.2	E423 C424 H437 Q438 M443 N444 T445	E423-H441 WeakPolarHBondContact OE2-CB 3.46Å; E423-H441 IonicContact OE2-CD2 3.4Å; E423-H441 PolarHBondContact OE2-CD2 2.79Å; E423-H441 IonicContact OE2-CG 3.05Å; C424-H441 PolarHBondContact SG-NE2 3.4Å; H437-H441 AromaticContact CE1-CE1 3.95Å; H437-H441 AromaticContact CE1-NE2 3.46Å; H437-H441 PolarHBondContact CE1-NE2 2.8Å; H437-H441 AromaticContact NE2-NE2 3.22Å; H437-H441 PolarHBondContact NE2-NE2 3.29Å; Q438-H441 PolarHBondContact O-N 2.92Å; H441-M443 PolarHBondContact O-N 3.16Å; H441-M443 VanDerWaalsContact O-N 3.08Å; H441-N444 CarbonylContact O-C 3.25Å; H441-N444 PolarHBondContact O-N 3.34Å; H441-T445 PolarHBondContact O-N 2.86Å
442	K	66	Low	60.2	Low	157 Å²	157	96.7 Å²	96.7	68%	0.683	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.3	174.6	-65.1	-168.6	176.4	-168	0	115.2	Q438 T445	Q438-K442 PolarHBondContact O-N 2.98Å; K442-T445 PolarHBondContact O-OG1 3.41Å
443	M	52.1	Low	58.2	Low	60 Å²	60	104.6 Å²	104.6	30%	0.296	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-4.1	171.9	-72.3	-178.3	174.5	0	0	113.3	K439 V440 H441 V469 E470	K439-M443 WeakPolarHBondContact O-CB 3.49Å; K439-M443 VanDerWaalsContact O-CG 3.28Å; K439-M443 WeakPolarHBondContact O-CG 3.26Å; K439-M443 PolarHBondContact O-N 2.89Å; V440-M443 PolarHBondContact O-N 3.49Å; H441-M443 PolarHBondContact O-N 3.16Å; H441-M443 VanDerWaalsContact O-N 3.08Å; M443-V469 HydrophobicContact SD-CG1 4.44Å; M443-E470 HydrophobicContact CE-CB 3.83Å
444	N	50	Low	55.9	Low	96 Å²	96	112 Å²	112	51%	0.513	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.5	-7.6	176.7	-75.1	6.9	0	0	0	112.8	V440 H441 P446	V440-N444 PolarHBondContact O-N 3.17Å; H441-N444 CarbonylContact O-C 3.25Å; H441-N444 PolarHBondContact O-N 3.34Å; N444-P446 WeakPolarHBondContact O-CD 3.46Å
445	T	43.5	Very low	53.6	Low	78 Å²	78	117.4 Å²	117.4	48%	0.479	59%	0.586	S	S	.	*	S	Bend	trans	-66.9	118.5	173.9	40.3	0	0	0	0	111.2	H441 K442 H447	H441-T445 PolarHBondContact O-N 2.86Å; K442-T445 PolarHBondContact O-OG1 3.41Å; T445-H447 PolarHBondContact O-N 3.08Å
446	P	39.3	Very low	51.6	Low	119 Å²	119	122 Å²	122	77%	0.773	61%	0.609	S	S	*	*			trans	-72.6	124	177.4	29	-33.3	0	0	0	110.8	N444 K448	N444-P446 WeakPolarHBondContact O-CD 3.46Å; P446-K448 PolarHBondContact O-N 3.32Å; P446-K448 VanDerWaalsContact O-N 3.16Å
447	H	41	Very low	49.6	Very low	166 Å²	166	123.8 Å²	123.8	77%	0.769	63%	0.628	S	S	*	*			trans	-66.6	112.1	173.5	-79.8	-88.4	0	0	0	110.6	T445 H449	T445-H447 PolarHBondContact O-N 3.08Å; H447-H449 PolarHBondContact O-N 3.22Å
448	K	34.8	Very low	47.3	Very low	207 Å²	207	125.7 Å²	125.7	90%	0.9	65%	0.654	S	S	*	*			trans	-70.3	96.7	170.4	-70.4	-174.5	177.7	-177.4	0	110	P446	P446-K448 PolarHBondContact O-N 3.32Å; P446-K448 VanDerWaalsContact O-N 3.16Å
449	H	36	Very low	45.3	Very low	163 Å²	163	129 Å²	129	76%	0.755	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-76.7	141.4	159.3	-74.3	-84.8	0	0	0	109.8	H447	H447-H449 PolarHBondContact O-N 3.22Å
450	P	34.6	Very low	43.6	Very low	116 Å²	116	129.7 Å²	129.7	75%	0.753	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-69.8	141.8	174.3	29.7	-34.2	0	0	0	110.5
451	P	43.1	Very low	41.7	Very low	118 Å²	118	133.6 Å²	133.6	77%	0.766	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-83.6	126.9	-174.3	31.5	-33.8	0	0	0	112.5
452	N	29.6	Very low	40	Very low	140 Å²	140	140.1 Å²	140.1	75%	0.749	75%	0.745	S	S	*	*			trans	-157.6	127.7	142.1	-123.3	-75.1	0	0	0	115.4
453	R	38.7	Very low	38.5	Very low	225 Å²	225	137 Å²	137	85%	0.849	74%	0.743	S	S	*	*			trans	25.5	118.9	150.5	-69	173.8	170.3	165.3	-5	119.3
454	K	34	Very low	37.7	Very low	214 Å²	214	142.2 Å²	142.2	93%	0.93	77%	0.766	S	S	*	*				-154.5	145.6	93.5	-101.6	164.4	-174.2	178.4	0	111.8
455	T	37.4	Very low	37.1	Very low	133 Å²	133	144 Å²	144	82%	0.816	78%	0.781	S	S	*	*			trans	-99	134.6	176.4	44.8	0	0	0	0	111
456	V	36.8	Very low	36.7	Very low	143 Å²	143	145.9 Å²	145.9	87%	0.867	79%	0.792	S	S	*	*			trans	-150.6	148.5	141.2	179.9	0	0	0	0	107.1
457	D	37.4	Very low	36.6	Very low	162 Å²	162	144.5 Å²	144.5	87%	0.866	78%	0.781	S	S	*	*			trans	-76.5	155.6	-167.3	-51.5	-98.7	0	0	0	116
458	G	33	Very low	36.8	Very low	65 Å²	65	148 Å²	148	67%	0.67	79%	0.788	S	S	*	*			trans	178.8	138.3	170.8	0	0	0	0	0	111.5
459	P	36.6	Very low	37.7	Very low	129 Å²	129	140.3 Å²	140.3	84%	0.838	76%	0.758	S	S	*	*			trans	-74.7	151.6	-169.7	29	-35.2	0	0	0	114.2	V461	P459-V461 PolarHBondContact O-N 2.71Å
460	L	43.3	Very low	38.5	Very low	156 Å²	156	139 Å²	139	82%	0.817	75%	0.752	S	S	*	*			trans	-50.1	103.1	-176.8	-179.1	69.9	0	0	0	114
461	V	35.1	Very low	40.1	Very low	120 Å²	120	138 Å²	138	73%	0.727	74%	0.736	S	S	*	*			trans	-86.3	129.2	153.6	176.9	0	0	0	0	107.8	P459 S463	P459-V461 PolarHBondContact O-N 2.71Å; V461-S463 PolarHBondContact O-N 2.68Å
462	Q	38.4	Very low	41.6	Very low	176 Å²	176	136.5 Å²	136.5	82%	0.822	73%	0.726	S	S	*	*			trans	-72.8	71.7	171	-70.9	179.8	-20.9	0	0	110.7	E464	Q462-E464 PolarHBondContact O-N 3.01Å; Q462-E464 VanDerWaalsContact O-N 3.08Å
463	S	33.8	Very low	43.9	Very low	92 Å²	92	134.3 Å²	134.3	64%	0.643	71%	0.708	S	S	*	*			trans	-72.7	94.7	162.3	57.5	0	0	0	0	108.3	V461 V465	V461-S463 PolarHBondContact O-N 2.68Å; S463-V465 PolarHBondContact O-N 2.88Å
464	E	35.7	Very low	45.7	Very low	168 Å²	168	126.5 Å²	126.5	79%	0.785	69%	0.686	S	S	*	*			trans	-50	115.5	165.2	-66.7	-174.9	140.5	0	0	108	Q462 T466	Q462-E464 PolarHBondContact O-N 3.01Å; Q462-E464 VanDerWaalsContact O-N 3.08Å; E464-T466 PolarHBondContact O-N 3.17Å
465	V	38.2	Very low	48.1	Very low	135 Å²	135	116.3 Å²	116.3	82%	0.818	64%	0.641	S	S	*	*			trans	-73.2	78.4	179.3	-177.1	0	0	0	0	107.8	S463 T467	S463-V465 PolarHBondContact O-N 2.88Å; V465-T467 PolarHBondContact O-N 3.41Å
466	T	33.9	Very low	50.1	Low	117 Å²	117	116.2 Å²	116.2	72%	0.718	64%	0.636	S	S	*	*			trans	-59.4	106.7	171.7	39.4	0	0	0	0	107.4	E464 R468	E464-T466 PolarHBondContact O-N 3.17Å; T466-R468 PolarHBondContact O-N 3.13Å; T466-R468 VanDerWaalsContact O-N 3.17Å
467	T	36.6	Very low	51.9	Low	89 Å²	89	114.3 Å²	114.3	55%	0.546	62%	0.621	S	S	.	*			trans	-51.9	126.8	175.6	46.1	0	0	0	0	108	V465 V469	V465-T467 PolarHBondContact O-N 3.41Å; T467-V469 PolarHBondContact O-N 3.15Å
468	R	45.1	Very low	53.8	Low	240 Å²	240	109 Å²	109	91%	0.906	60%	0.596	S	S	*	*			trans	-74.7	69.7	-175.4	-168.6	-177.9	-178.8	-177.4	-0	109.4	T466 E470	T466-R468 PolarHBondContact O-N 3.13Å; T466-R468 VanDerWaalsContact O-N 3.17Å; R468-E470 PolarHBondContact O-N 2.86Å
469	V	54.3	Low	55.9	Low	46 Å²	46	108.1 Å²	108.1	28%	0.279	59%	0.586	S	S	.	*			trans	-57	109.3	174.1	179.3	0	0	0	0	106.9	M443 T467 K471	M443-V469 HydrophobicContact SD-CG1 4.44Å; T467-V469 PolarHBondContact O-N 3.15Å; V469-K471 HydrophobicContact CG1-CG 4.05Å; V469-K471 WeakPolarHBondContact O-CG 3.36Å; V469-K471 PolarHBondContact O-N 2.82Å; V469-K471 VanDerWaalsContact O-N 3.1Å
470	E	52.1	Low	57.8	Low	134 Å²	134	107.4 Å²	107.4	63%	0.626	57%	0.57	S	S	*	*			trans	-63.3	117.1	172.2	-62.9	-171.7	146.2	0	0	108.2	M443 R468 P472	M443-E470 HydrophobicContact CE-CB 3.83Å; R468-E470 PolarHBondContact O-N 2.86Å; E470-P472 VanDerWaalsContact O-CD 3.31Å; E470-P472 WeakPolarHBondContact O-CD 3.27Å
471	K	69.6	Low	59.6	Low	96 Å²	96	105.2 Å²	105.2	42%	0.417	56%	0.555	S	S	.	*			trans	-115.8	81.3	-179.3	-73.8	-178.3	-153.3	168.8	0	106.4	V469 Y473 H481 F482	V469-K471 HydrophobicContact CG1-CG 4.05Å; V469-K471 WeakPolarHBondContact O-CG 3.36Å; V469-K471 PolarHBondContact O-N 2.82Å; V469-K471 VanDerWaalsContact O-N 3.1Å; K471-Y473 PolarHBondContact O-N 3.06Å; K471-H481 HydrophobicContact CB-CB 3.56Å; K471-H481 HydrophobicContact CD-CB 4.15Å; K471-H481 WeakPolarHBondContact CD-O 3.4Å; K471-F482 CarbonylContact C-O 3.6Å; K471-F482 VanDerWaalsContact CA-O 3.27Å; K471-F482 WeakPolarHBondContact CA-O 3.26Å; K471-F482 WeakPolarHBondContact CB-O 3.49Å
472	P	74.9	Confident	61.8	Low	87 Å²	87	101.4 Å²	101.4	57%	0.565	53%	0.529	S	S	*	.			trans	-73.8	1.1	-164.2	30.2	-37.3	0	0	0	114.5	E470	E470-P472 VanDerWaalsContact O-CD 3.31Å; E470-P472 WeakPolarHBondContact O-CD 3.27Å
473	Y	75.9	Confident	63.7	Low	93 Å²	93	97.2 Å²	97.2	37%	0.365	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	98.8	180	-55.3	-69.4	0	0	0	109.7	K471 H481 F482 R483 W484 T485	K471-Y473 PolarHBondContact O-N 3.06Å; Y473-H481 CarbonylContact O-C 3.57Å; Y473-F482 PolarHBondContact N-O 3.31Å; Y473-F482 PolarHBondContact O-N 3.46Å; Y473-R483 WeakPolarHBondContact CE2-O 3.21Å; Y473-W484 VanDerWaalsContact CD2-C 3.46Å; Y473-T485 HydrophobicContact CD1-CG2 3.54Å; Y473-T485 HydrophobicContact CD2-CG2 4.48Å; Y473-T485 HydrophobicContact CE1-CG2 3.31Å; Y473-T485 HydrophobicContact CE2-CG2 4.29Å; Y473-T485 HydrophobicContact CG-CG2 4.13Å
474	T	78.3	Confident	65.8	Low	61 Å²	61	97.2 Å²	97.2	37%	0.374	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	146.1	176.2	44.1	0	0	0	0	111.7	L488	T474-L488 WeakPolarHBondContact O-CD1 3.15Å; T474-L488 VanDerWaalsContact O-CD2 3.22Å; T474-L488 WeakPolarHBondContact O-CD2 3.4Å
475	C	84.1	Confident	67.7	Low	0 Å²	0	93 Å²	93	0%	0	48%	0.477	C	S	.	.			trans	-95.8	117.1	164.6	168.8	0	0	0	0	109	D477 C478 G479 K480 F482 L488 H495	C475-D477 VanDerWaalsContact C-N 3.29Å; C475-D477 PolarHBondContact O-N 3.5Å; C475-D477 PolarHBondContact SG-OD2 3.07Å; C475-D477 VanDerWaalsContact SG-OD2 3.35Å; C475-C478 PolarHBondContact O-N 2.7Å; C475-C478 VanDerWaalsContact SG-SG 3.65Å; C475-G479 WeakPolarHBondContact O-CA 3.35Å; C475-G479 PolarHBondContact O-N 2.88Å; C475-K480 WeakPolarHBondContact CB-O 3.31Å; C475-K480 PolarHBondContact N-O 2.64Å; C475-F482 HydrophobicContact CB-CE2 4.05Å; C475-L488 HydrophobicContact CB-CD1 3.52Å; C475-H495 VanDerWaalsContact SG-CD2 3.54Å; C475-H495 PolarHBondContact SG-NE2 3.28Å
476	D	79.3	Confident	69.6	Low	131 Å²	131	90 Å²	90	70%	0.701	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-33.6	-173.2	-48	-61.4	0	0	0	111.7	C478	D476-C478 VanDerWaalsContact C-N 3.27Å; D476-C478 PolarHBondContact O-N 3.39Å
477	D	74.1	Confident	71.9	Confident	103 Å²	103	86 Å²	86	55%	0.551	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-22	-179	-40.4	-71.5	0	0	0	114.3	C475 H495	C475-D477 VanDerWaalsContact C-N 3.29Å; C475-D477 PolarHBondContact O-N 3.5Å; C475-D477 PolarHBondContact SG-OD2 3.07Å; C475-D477 VanDerWaalsContact SG-OD2 3.35Å; D477-H495 HydrophobicContact CB-CB 4.39Å; D477-H495 IonicContact OD2-CD2 3.24Å; D477-H495 PolarHBondContact OD2-CD2 3.19Å; D477-H495 VanDerWaalsContact OD2-CD2 3.25Å
478	C	78.4	Confident	74	Confident	52 Å²	52	82.8 Å²	82.8	35%	0.351	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.4	12	-174.4	73.7	0	0	0	0	116.3	C475 D476 K480 H491 H495	C475-C478 PolarHBondContact O-N 2.7Å; C475-C478 VanDerWaalsContact SG-SG 3.65Å; D476-C478 VanDerWaalsContact C-N 3.27Å; D476-C478 PolarHBondContact O-N 3.39Å; C478-K480 PolarHBondContact O-N 3.33Å; C478-H491 PolarHBondContact SG-NE2 3.21Å; C478-H495 VanDerWaalsContact SG-CE1 3.52Å; C478-H495 PolarHBondContact SG-NE2 2.87Å; C478-H495 VanDerWaalsContact SG-NE2 3.37Å
479	G	76.6	Confident	75.7	Confident	45 Å²	45	75 Å²	75	46%	0.464	40%	0.395	S	S	.	.			trans	65.5	4.8	178	0	0	0	0	0	116	C475 H481	C475-G479 WeakPolarHBondContact O-CA 3.35Å; C475-G479 PolarHBondContact O-N 2.88Å; G479-H481 PolarHBondContact O-CE1 2.98Å; G479-H481 PolarHBondContact O-N 3.42Å; G479-H481 PolarHBondContact O-ND1 2.64Å
480	K	76.9	Confident	77	Confident	115 Å²	115	78 Å²	78	50%	0.5	40%	0.402	S	S	.	.			trans	-71.1	129.6	-179.1	-73.1	174	-169.3	155.3	0	110.6	C475 C478 F482	C475-K480 WeakPolarHBondContact CB-O 3.31Å; C475-K480 PolarHBondContact N-O 2.64Å; C478-K480 PolarHBondContact O-N 3.33Å; K480-F482 HydrophobicContact CB-CE2 3.63Å; K480-F482 HydrophobicContact CB-CZ 3.82Å; K480-F482 WeakPolarHBondContact O-CD2 3.26Å; K480-F482 VanDerWaalsContact O-CE2 3.23Å; K480-F482 WeakPolarHBondContact O-CE2 3.24Å
481	H	80.4	Confident	78.5	Confident	109 Å²	109	72.8 Å²	72.8	51%	0.505	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	139.2	-179	-64.4	51.7	0	0	0	111.2	K471 Y473 G479	K471-H481 HydrophobicContact CB-CB 3.56Å; K471-H481 HydrophobicContact CD-CB 4.15Å; K471-H481 WeakPolarHBondContact CD-O 3.4Å; Y473-H481 CarbonylContact O-C 3.57Å; G479-H481 PolarHBondContact O-CE1 2.98Å; G479-H481 PolarHBondContact O-N 3.42Å; G479-H481 PolarHBondContact O-ND1 2.64Å
482	F	80.9	Confident	78.9	Confident	41 Å²	41	70.9 Å²	70.9	18%	0.18	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	150.8	-178	-62.4	-84.8	0	0	0	112.5	K471 Y473 C475 K480 D487 L488 H491	K471-F482 CarbonylContact C-O 3.6Å; K471-F482 VanDerWaalsContact CA-O 3.27Å; K471-F482 WeakPolarHBondContact CA-O 3.26Å; K471-F482 WeakPolarHBondContact CB-O 3.49Å; Y473-F482 PolarHBondContact N-O 3.31Å; Y473-F482 PolarHBondContact O-N 3.46Å; C475-F482 HydrophobicContact CB-CE2 4.05Å; K480-F482 HydrophobicContact CB-CE2 3.63Å; K480-F482 HydrophobicContact CB-CZ 3.82Å; K480-F482 WeakPolarHBondContact O-CD2 3.26Å; K480-F482 VanDerWaalsContact O-CE2 3.23Å; K480-F482 WeakPolarHBondContact O-CE2 3.24Å; F482-D487 HydrophobicContact CB-CB 4.05Å; F482-D487 HydrophobicContact CD1-CB 3.8Å; F482-D487 HydrophobicContact CG-CB 4.21Å; F482-L488 HydrophobicContact CB-CB 4.31Å; F482-L488 HydrophobicContact CD2-CB 4.18Å; F482-L488 HydrophobicContact CD2-CD1 4.13Å; F482-L488 HydrophobicContact CE2-CD1 4.48Å; F482-L488 HydrophobicContact CG-CB 4.39Å; F482-H491 HydrophobicContact CE1-CB 3.98Å; F482-H491 HydrophobicContact CE2-CB 4.03Å; F482-H491 AromaticContact CE2-CD2 3.21Å; F482-H491 WeakPolarHBondContact CE2-CD2 3.21Å; F482-H491 AromaticContact CE2-CG 3.78Å; F482-H491 HydrophobicContact CZ-CB 3.59Å; F482-H491 AromaticContact CZ-CD2 3.17Å; F482-H491 WeakPolarHBondContact CZ-CD2 3.49Å; F482-H491 AromaticContact CZ-CG 3.31Å; F482-H491 AromaticContact CZ-NE2 3.9Å
483	R	78.2	Confident	79.3	Confident	87 Å²	87	69.7 Å²	69.7	33%	0.328	35%	0.354	S	S	.	.	S	Bend	trans	-79.5	-21.3	-179.4	-165.8	167.8	68.1	174.4	-2.2	113.1	Y473	Y473-R483 WeakPolarHBondContact CE2-O 3.21Å
484	W	79.1	Confident	79.5	Confident	92 Å²	92	69.4 Å²	69.4	35%	0.348	36%	0.362	S	S	.	.	S	Bend	trans	-139.5	146.2	-177.1	-55.3	-47.2	0	0	0	111.5	Y473 S486 D487 L488	Y473-W484 VanDerWaalsContact CD2-C 3.46Å; W484-S486 PolarHBondContact O-N 3.45Å; W484-D487 WeakPolarHBondContact O-CB 3.3Å; W484-D487 PolarHBondContact O-N 2.84Å; W484-L488 PolarHBondContact O-N 3.38Å
485	T	75.4	Confident	79.4	Confident	79 Å²	79	70.1 Å²	70.1	49%	0.485	36%	0.361	S	S	.	.	H	α-helix	trans	-54.7	-38.4	174	48.4	0	0	0	0	112.7	Y473 D487 L488 V489	Y473-T485 HydrophobicContact CD1-CG2 3.54Å; Y473-T485 HydrophobicContact CD2-CG2 4.48Å; Y473-T485 HydrophobicContact CE1-CG2 3.31Å; Y473-T485 HydrophobicContact CE2-CG2 4.29Å; Y473-T485 HydrophobicContact CG-CG2 4.13Å; T485-D487 PolarHBondContact O-N 3.48Å; T485-L488 PolarHBondContact O-N 3Å; T485-V489 WeakPolarHBondContact O-CG2 3.34Å; T485-V489 PolarHBondContact O-N 3.03Å
486	S	77.7	Confident	79	Confident	74 Å²	74	74.1 Å²	74.1	52%	0.517	39%	0.385	S	S	.	.	H	α-helix	trans	-63.1	-26.9	177.5	58.1	0	0	0	0	113.8	W484 R490	W484-S486 PolarHBondContact O-N 3.45Å; S486-R490 WeakPolarHBondContact O-CB 3.46Å; S486-R490 PolarHBondContact O-N 3.48Å
487	D	80.9	Confident	78.9	Confident	31 Å²	31	70.1 Å²	70.1	17%	0.166	38%	0.375	C	S	.	.	H	α-helix	trans	-80.4	-39.3	174.1	-71.1	-24	0	0	0	111.3	F482 W484 T485 R490 H491	F482-D487 HydrophobicContact CB-CB 4.05Å; F482-D487 HydrophobicContact CD1-CB 3.8Å; F482-D487 HydrophobicContact CG-CB 4.21Å; W484-D487 WeakPolarHBondContact O-CB 3.3Å; W484-D487 PolarHBondContact O-N 2.84Å; T485-D487 PolarHBondContact O-N 3.48Å; D487-R490 PolarHBondContact O-N 3.36Å; D487-R490 IonicContact OD1-CZ 2.74Å; D487-R490 IonicContact OD1-NE 3.56Å; D487-R490 IonicContact OD1-NH2 2.77Å; D487-R490 PolarHBondContact OD1-NH2 2.87Å; D487-H491 VanDerWaalsContact O-CB 3.31Å; D487-H491 WeakPolarHBondContact O-CB 3.35Å; D487-H491 PolarHBondContact O-N 3.08Å
488	L	81.9	Confident	78.9	Confident	22 Å²	22	69.8 Å²	69.8	12%	0.115	37%	0.37	C	S	.	.	H	α-helix	trans	-60.2	-53.2	173.8	170.1	58.1	0	0	0	111.4	T474 C475 F482 W484 T485 R490 H491 Q492	T474-L488 WeakPolarHBondContact O-CD1 3.15Å; T474-L488 VanDerWaalsContact O-CD2 3.22Å; T474-L488 WeakPolarHBondContact O-CD2 3.4Å; C475-L488 HydrophobicContact CB-CD1 3.52Å; F482-L488 HydrophobicContact CB-CB 4.31Å; F482-L488 HydrophobicContact CD2-CB 4.18Å; F482-L488 HydrophobicContact CD2-CD1 4.13Å; F482-L488 HydrophobicContact CE2-CD1 4.48Å; F482-L488 HydrophobicContact CG-CB 4.39Å; W484-L488 PolarHBondContact O-N 3.38Å; T485-L488 PolarHBondContact O-N 3Å; L488-R490 VanDerWaalsContact C-N 3.29Å; L488-R490 PolarHBondContact O-N 2.97Å; L488-H491 CarbonylContact O-C 3.58Å; L488-H491 WeakPolarHBondContact O-CA 3.47Å; L488-H491 WeakPolarHBondContact O-CB 3.37Å; L488-H491 PolarHBondContact O-N 2.87Å; L488-Q492 HydrophobicContact CD1-CG 4.01Å; L488-Q492 PolarHBondContact O-N 3.13Å
489	V	80.7	Confident	79	Confident	76 Å²	76	73.4 Å²	73.4	46%	0.461	38%	0.38	S	S	.	.	H	α-helix	trans	-60.5	-40.4	178.7	172.9	0	0	0	0	111.2	T485 H491 Q492	T485-V489 WeakPolarHBondContact O-CG2 3.34Å; T485-V489 PolarHBondContact O-N 3.03Å; V489-H491 VanDerWaalsContact C-N 3.26Å; V489-H491 PolarHBondContact O-N 2.88Å; V489-Q492 PolarHBondContact O-N 2.94Å
490	R	82.3	Confident	79.2	Confident	111 Å²	111	74.4 Å²	74.4	42%	0.419	38%	0.379	S	S	.	.	H	α-helix	trans	-63.4	-31.4	173.4	171.9	167.1	58.3	152.7	-2	112.9	S486 D487 L488 Q512	S486-R490 WeakPolarHBondContact O-CB 3.46Å; S486-R490 PolarHBondContact O-N 3.48Å; D487-R490 PolarHBondContact O-N 3.36Å; D487-R490 IonicContact OD1-CZ 2.74Å; D487-R490 IonicContact OD1-NE 3.56Å; D487-R490 IonicContact OD1-NH2 2.77Å; D487-R490 PolarHBondContact OD1-NH2 2.87Å; L488-R490 VanDerWaalsContact C-N 3.29Å; L488-R490 PolarHBondContact O-N 2.97Å; R490-Q512 VanDerWaalsContact CD-CD 3.49Å; R490-Q512 VanDerWaalsContact CD-OE1 3.23Å; R490-Q512 HydrophobicContact CG-CG 4.22Å
491	H	82.3	Confident	79.6	Confident	23 Å²	23	71.9 Å²	71.9	11%	0.106	37%	0.368	C	S	.	.	H	α-helix	trans	-81.1	-34.2	176.9	174	48.6	0	0	0	113.2	C478 F482 D487 L488 V489 R493 T494 H495	C478-H491 PolarHBondContact SG-NE2 3.21Å; F482-H491 HydrophobicContact CE1-CB 3.98Å; F482-H491 HydrophobicContact CE2-CB 4.03Å; F482-H491 AromaticContact CE2-CD2 3.21Å; F482-H491 WeakPolarHBondContact CE2-CD2 3.21Å; F482-H491 AromaticContact CE2-CG 3.78Å; F482-H491 HydrophobicContact CZ-CB 3.59Å; F482-H491 AromaticContact CZ-CD2 3.17Å; F482-H491 WeakPolarHBondContact CZ-CD2 3.49Å; F482-H491 AromaticContact CZ-CG 3.31Å; F482-H491 AromaticContact CZ-NE2 3.9Å; D487-H491 VanDerWaalsContact O-CB 3.31Å; D487-H491 WeakPolarHBondContact O-CB 3.35Å; D487-H491 PolarHBondContact O-N 3.08Å; L488-H491 CarbonylContact O-C 3.58Å; L488-H491 WeakPolarHBondContact O-CA 3.47Å; L488-H491 WeakPolarHBondContact O-CB 3.37Å; L488-H491 PolarHBondContact O-N 2.87Å; V489-H491 VanDerWaalsContact C-N 3.26Å; V489-H491 PolarHBondContact O-N 2.88Å; H491-R493 PolarHBondContact O-N 3.13Å; H491-T494 PolarHBondContact CE1-OG1 2.84Å; H491-T494 VanDerWaalsContact CE1-OG1 3.28Å; H491-T494 PolarHBondContact ND1-OG1 2.96Å; H491-T494 WeakPolarHBondContact O-CA 3.37Å; H491-T494 WeakPolarHBondContact O-CB 3.14Å; H491-T494 PolarHBondContact O-N 2.92Å; H491-T494 PolarHBondContact O-OG1 3.18Å; H491-H495 AromaticContact CD2-NE2 3.85Å; H491-H495 AromaticContact CE1-CE1 3.62Å; H491-H495 AromaticContact CE1-NE2 3.31Å; H491-H495 PolarHBondContact CE1-NE2 3.34Å; H491-H495 VanDerWaalsContact CE1-NE2 3.31Å; H491-H495 AromaticContact NE2-CE1 3.72Å; H491-H495 AromaticContact NE2-NE2 3.07Å; H491-H495 PolarHBondContact NE2-NE2 3.22Å
492	Q	79.3	Confident	79.4	Confident	57 Å²	57	73 Å²	73	27%	0.266	37%	0.371	S	S	.	.	H	α-helix	trans	-58.4	-33.3	175.7	-76.3	167.6	-50.7	0	0	111.5	L488 V489 T494 H495 T496	L488-Q492 HydrophobicContact CD1-CG 4.01Å; L488-Q492 PolarHBondContact O-N 3.13Å; V489-Q492 PolarHBondContact O-N 2.94Å; Q492-T494 PolarHBondContact O-N 3.03Å; Q492-H495 PolarHBondContact O-N 3.29Å; Q492-T496 PolarHBondContact O-N 3.02Å
493	R	83.4	Confident	79.3	Confident	62 Å²	62	71 Å²	71	23%	0.234	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-13.7	169.4	-61.5	-173	-179.5	153.8	5.2	115.6	H491 G497 E498 S511	H491-R493 PolarHBondContact O-N 3.13Å; R493-G497 PolarHBondContact O-N 2.81Å; R493-E498 HydrophobicContact CB-CB 4.15Å; R493-E498 HydrophobicContact CG-CB 3.9Å; R493-E498 IonicContact NE-OE2 3.22Å; R493-S511 PolarHBondContact NH1-O 3.28Å; R493-S511 VanDerWaalsContact NH1-O 3.17Å
494	T	78.3	Confident	79.1	Confident	87 Å²	87	72 Å²	72	53%	0.534	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-11.4	171.9	67.7	0	0	0	0	113.3	H491 Q492	H491-T494 PolarHBondContact CE1-OG1 2.84Å; H491-T494 VanDerWaalsContact CE1-OG1 3.28Å; H491-T494 PolarHBondContact ND1-OG1 2.96Å; H491-T494 WeakPolarHBondContact O-CA 3.37Å; H491-T494 WeakPolarHBondContact O-CB 3.14Å; H491-T494 PolarHBondContact O-N 2.92Å; H491-T494 PolarHBondContact O-OG1 3.18Å; Q492-T494 PolarHBondContact O-N 3.03Å
495	H	77.4	Confident	78.8	Confident	75 Å²	75	72.4 Å²	72.4	35%	0.347	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-46.7	170.7	-51.5	-54.6	0	0	0	111.1	C475 D477 C478 H491 Q492 G497	C475-H495 VanDerWaalsContact SG-CD2 3.54Å; C475-H495 PolarHBondContact SG-NE2 3.28Å; D477-H495 HydrophobicContact CB-CB 4.39Å; D477-H495 IonicContact OD2-CD2 3.24Å; D477-H495 PolarHBondContact OD2-CD2 3.19Å; D477-H495 VanDerWaalsContact OD2-CD2 3.25Å; C478-H495 VanDerWaalsContact SG-CE1 3.52Å; C478-H495 PolarHBondContact SG-NE2 2.87Å; C478-H495 VanDerWaalsContact SG-NE2 3.37Å; H491-H495 AromaticContact CD2-NE2 3.85Å; H491-H495 AromaticContact CE1-CE1 3.62Å; H491-H495 AromaticContact CE1-NE2 3.31Å; H491-H495 PolarHBondContact CE1-NE2 3.34Å; H491-H495 VanDerWaalsContact CE1-NE2 3.31Å; H491-H495 AromaticContact NE2-CE1 3.72Å; H491-H495 AromaticContact NE2-NE2 3.07Å; H491-H495 PolarHBondContact NE2-NE2 3.22Å; Q492-H495 PolarHBondContact O-N 3.29Å; H495-G497 PolarHBondContact O-N 3.38Å
496	T	75.9	Confident	78.5	Confident	84 Å²	84	70.6 Å²	70.6	52%	0.515	38%	0.377	S	S	.	.	S	Bend	trans	-72	-12.2	177.5	66.7	0	0	0	0	113.6	Q492 E498	Q492-T496 PolarHBondContact O-N 3.02Å; T496-E498 WeakPolarHBondContact CB-OE1 3.43Å; T496-E498 PolarHBondContact O-N 2.6Å; T496-E498 VanDerWaalsContact O-N 3.16Å; T496-E498 VanDerWaalsContact OG1-CD 3.29Å; T496-E498 WeakPolarHBondContact OG1-CG 3.33Å; T496-E498 PolarHBondContact OG1-OE1 3.31Å
497	G	76.8	Confident	78.4	Confident	47 Å²	47	71.8 Å²	71.8	49%	0.485	39%	0.385	S	S	.	.			trans	70.9	1.1	-177.5	0	0	0	0	0	114.7	R493 H495 K499	R493-G497 PolarHBondContact O-N 2.81Å; H495-G497 PolarHBondContact O-N 3.38Å; G497-K499 WeakPolarHBondContact O-CG 3.45Å; G497-K499 PolarHBondContact O-N 3.39Å
498	E	73.7	Confident	78.1	Confident	96 Å²	96	76.2 Å²	76.2	45%	0.449	40%	0.403	S	S	.	.			trans	-52	126.7	-177.2	-86.9	168.1	-120.2	0	0	113.5	R493 T496 S511	R493-E498 HydrophobicContact CB-CB 4.15Å; R493-E498 HydrophobicContact CG-CB 3.9Å; R493-E498 IonicContact NE-OE2 3.22Å; T496-E498 WeakPolarHBondContact CB-OE1 3.43Å; T496-E498 PolarHBondContact O-N 2.6Å; T496-E498 VanDerWaalsContact O-N 3.16Å; T496-E498 VanDerWaalsContact OG1-CD 3.29Å; T496-E498 WeakPolarHBondContact OG1-CG 3.33Å; T496-E498 PolarHBondContact OG1-OE1 3.31Å; E498-S511 VanDerWaalsContact O-CB 3.28Å; E498-S511 WeakPolarHBondContact O-CB 3.3Å
499	K	81.8	Confident	78.1	Confident	128 Å²	128	77.6 Å²	77.6	56%	0.557	41%	0.414	S	S	*	.			trans	-129.5	71.8	-179.9	-74.9	157.2	170.6	-179.8	0	111.4	G497 F501 S509 F510	G497-K499 WeakPolarHBondContact O-CG 3.45Å; G497-K499 PolarHBondContact O-N 3.39Å; K499-F501 PolarHBondContact O-N 2.85Å; K499-S509 VanDerWaalsContact CD-O 3.3Å; K499-S509 WeakPolarHBondContact CD-O 3.47Å; K499-S509 WeakPolarHBondContact CG-O 3.48Å; K499-F510 CarbonylContact C-O 3.58Å; K499-F510 VanDerWaalsContact CA-O 3.27Å; K499-F510 WeakPolarHBondContact CA-O 3.31Å
500	P	81	Confident	78.3	Confident	67 Å²	67	75.9 Å²	75.9	44%	0.435	40%	0.4	S	S	.	.			trans	-69.4	-4.4	-172.2	-19.5	34.2	0	0	0	115.4
501	F	83.6	Confident	78.3	Confident	61 Å²	61	72.1 Å²	72.1	27%	0.268	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	97.3	-174.4	-53.5	-75	0	0	0	110	K499 F510 Q512 K513 L516	K499-F501 PolarHBondContact O-N 2.85Å; F501-F510 PolarHBondContact N-O 3.3Å; F501-F510 VanDerWaalsContact N-O 3.11Å; F501-F510 WeakPolarHBondContact O-CD2 3.49Å; F501-F510 PolarHBondContact O-N 3.01Å; F501-Q512 VanDerWaalsContact CD2-C 3.46Å; F501-K513 HydrophobicContact CD1-CB 3.85Å; F501-K513 HydrophobicContact CD1-CG 4.32Å; F501-K513 HydrophobicContact CD2-CB 4.46Å; F501-K513 VanDerWaalsContact CD2-N 3.3Å; F501-K513 HydrophobicContact CE1-CB 3.79Å; F501-K513 HydrophobicContact CE1-CG 4.45Å; F501-K513 HydrophobicContact CE2-CB 4.4Å; F501-K513 HydrophobicContact CG-CB 4.19Å; F501-K513 HydrophobicContact CZ-CB 4.07Å; F501-L516 HydrophobicContact CB-CB 4.08Å; F501-L516 HydrophobicContact CB-CD2 3.81Å
502	F	77.8	Confident	78.3	Confident	132 Å²	132	73.7 Å²	73.7	58%	0.579	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	151.5	179.5	58.8	-89.2	0	0	0	112.6	T504 L516	F502-T504 HydrophobicContact CE2-CG2 4.39Å; F502-L516 WeakPolarHBondContact O-CD1 3.24Å; F502-L516 VanDerWaalsContact O-CD2 3.3Å; F502-L516 WeakPolarHBondContact O-CD2 3.38Å
503	C	77.4	Confident	78.3	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	42%	0.415	C	S	.	.			trans	-92.1	120.2	174.1	-174.6	0	0	0	0	110.5	I505 C506 S507 K508 F510 L516 H523	C503-I505 PolarHBondContact O-N 3.37Å; C503-C506 PolarHBondContact O-N 3.25Å; C503-S507 VanDerWaalsContact O-CA 3.23Å; C503-S507 WeakPolarHBondContact O-CA 3.24Å; C503-S507 PolarHBondContact O-N 3.3Å; C503-K508 PolarHBondContact N-O 3.22Å; C503-F510 HydrophobicContact CB-CE2 4.38Å; C503-L516 HydrophobicContact CB-CD1 3.63Å; C503-H523 VanDerWaalsContact SG-CD2 3.56Å; C503-H523 PolarHBondContact SG-NE2 2.88Å; C503-H523 VanDerWaalsContact SG-NE2 3.39Å
504	T	75.1	Confident	78	Confident	108 Å²	108	78.2 Å²	78.2	66%	0.663	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.9	178.8	46	0	0	0	0	114.5	F502	F502-T504 HydrophobicContact CE2-CG2 4.39Å
505	I	71.4	Confident	78	Confident	100 Å²	100	76.8 Å²	76.8	51%	0.513	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-22.5	-173.6	-55.7	168.1	0	0	0	112.7	C503 H523	C503-I505 PolarHBondContact O-N 3.37Å; I505-H523 HydrophobicContact CB-CB 4.36Å; I505-H523 HydrophobicContact CD1-CB 3.69Å; I505-H523 HydrophobicContact CG2-CB 3.88Å
506	C	70.6	Confident	78.3	Confident	42 Å²	42	74.1 Å²	74.1	28%	0.284	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.5	14.2	-177.5	71.7	0	0	0	0	114.8	C503 K508 H519 H523	C503-C506 PolarHBondContact O-N 3.25Å; C506-K508 PolarHBondContact O-N 3Å; C506-H519 PolarHBondContact SG-NE2 3.23Å; C506-H523 PolarHBondContact SG-CE1 3.44Å; C506-H523 PolarHBondContact SG-NE2 3.06Å
507	S	76	Confident	78.4	Confident	98 Å²	98	72.8 Å²	72.8	69%	0.685	40%	0.4	S	S	*	.			trans	55.3	12	178.8	-54.4	0	0	0	0	116.5	C503	C503-S507 VanDerWaalsContact O-CA 3.23Å; C503-S507 WeakPolarHBondContact O-CA 3.24Å; C503-S507 PolarHBondContact O-N 3.3Å
508	K	73.4	Confident	78.2	Confident	125 Å²	125	72.4 Å²	72.4	54%	0.543	39%	0.388	S	S	.	.			trans	-73.6	130	177.4	-71	175.6	-174.2	169.6	0	110.9	C503 C506 F510	C503-K508 PolarHBondContact N-O 3.22Å; C506-K508 PolarHBondContact O-N 3Å; K508-F510 HydrophobicContact CB-CE2 3.96Å; K508-F510 HydrophobicContact CB-CZ 3.95Å; K508-F510 WeakPolarHBondContact O-CD2 3.4Å; K508-F510 WeakPolarHBondContact O-CE2 3.21Å
509	S	82.3	Confident	78.4	Confident	51 Å²	51	68.9 Å²	68.9	36%	0.357	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	140	-174.6	-49.7	0	0	0	0	113.3	K499	K499-S509 VanDerWaalsContact CD-O 3.3Å; K499-S509 WeakPolarHBondContact CD-O 3.47Å; K499-S509 WeakPolarHBondContact CG-O 3.48Å
510	F	84	Confident	78	Confident	39 Å²	39	65.9 Å²	65.9	17%	0.171	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.6	-172.8	-55.7	-85.1	0	0	0	111.8	K499 F501 C503 K508 Q512 V515 L516 H519	K499-F510 CarbonylContact C-O 3.58Å; K499-F510 VanDerWaalsContact CA-O 3.27Å; K499-F510 WeakPolarHBondContact CA-O 3.31Å; F501-F510 PolarHBondContact N-O 3.3Å; F501-F510 VanDerWaalsContact N-O 3.11Å; F501-F510 WeakPolarHBondContact O-CD2 3.49Å; F501-F510 PolarHBondContact O-N 3.01Å; C503-F510 HydrophobicContact CB-CE2 4.38Å; K508-F510 HydrophobicContact CB-CE2 3.96Å; K508-F510 HydrophobicContact CB-CZ 3.95Å; K508-F510 WeakPolarHBondContact O-CD2 3.4Å; K508-F510 WeakPolarHBondContact O-CE2 3.21Å; F510-Q512 VanDerWaalsContact C-N 3.34Å; F510-V515 HydrophobicContact CB-CB 4.47Å; F510-V515 HydrophobicContact CD1-CB 4.38Å; F510-V515 HydrophobicContact CD1-CG1 3.61Å; F510-V515 HydrophobicContact CE1-CG1 4.18Å; F510-V515 HydrophobicContact CG-CG1 4.29Å; F510-L516 HydrophobicContact CB-CB 4.48Å; F510-L516 HydrophobicContact CD2-CB 4.04Å; F510-L516 HydrophobicContact CD2-CD1 3.98Å; F510-L516 HydrophobicContact CE2-CD1 4.17Å; F510-H519 HydrophobicContact CE1-CB 4.22Å; F510-H519 HydrophobicContact CE2-CB 3.97Å; F510-H519 AromaticContact CE2-CD2 3.34Å; F510-H519 WeakPolarHBondContact CE2-CD2 3.41Å; F510-H519 AromaticContact CE2-CG 3.67Å; F510-H519 HydrophobicContact CZ-CB 3.67Å; F510-H519 AromaticContact CZ-CD2 3.38Å; F510-H519 WeakPolarHBondContact CZ-CD2 3.39Å; F510-H519 AromaticContact CZ-CG 3.29Å; F510-H519 AromaticContact CZ-ND1 3.81Å; F510-H519 AromaticContact CZ-NE2 3.92Å
511	S	82.3	Confident	77.6	Confident	32 Å²	32	65.7 Å²	65.7	22%	0.224	35%	0.35	C	S	.	.	S	Bend	trans	-81.5	-9.2	-179.8	57.5	0	0	0	0	114.4	R493 E498	R493-S511 PolarHBondContact NH1-O 3.28Å; R493-S511 VanDerWaalsContact NH1-O 3.17Å; E498-S511 VanDerWaalsContact O-CB 3.28Å; E498-S511 WeakPolarHBondContact O-CB 3.3Å
512	Q	83.6	Confident	76.8	Confident	56 Å²	56	68.2 Å²	68.2	26%	0.262	37%	0.365	S	S	.	.	S	Bend	trans	-139.7	130.4	-177.4	-67.9	177.5	76.4	0	0	111.6	R490 F501 F510 S514 V515 L516	R490-Q512 VanDerWaalsContact CD-CD 3.49Å; R490-Q512 VanDerWaalsContact CD-OE1 3.23Å; R490-Q512 HydrophobicContact CG-CG 4.22Å; F501-Q512 VanDerWaalsContact CD2-C 3.46Å; F510-Q512 VanDerWaalsContact C-N 3.34Å; Q512-S514 VanDerWaalsContact C-N 3.26Å; Q512-S514 PolarHBondContact O-N 3.45Å; Q512-V515 HydrophobicContact CB-CG2 4.07Å; Q512-V515 PolarHBondContact O-N 2.8Å; Q512-L516 PolarHBondContact O-N 2.81Å
513	K	79.1	Confident	76.2	Confident	141 Å²	141	65.2 Å²	65.2	61%	0.613	35%	0.352	S	S	*	.	H	α-helix	trans	-55	-38.3	178.5	-174	171.2	179.7	173.1	0	113	F501 V515 L516 T517	F501-K513 HydrophobicContact CD1-CB 3.85Å; F501-K513 HydrophobicContact CD1-CG 4.32Å; F501-K513 HydrophobicContact CD2-CB 4.46Å; F501-K513 VanDerWaalsContact CD2-N 3.3Å; F501-K513 HydrophobicContact CE1-CB 3.79Å; F501-K513 HydrophobicContact CE1-CG 4.45Å; F501-K513 HydrophobicContact CE2-CB 4.4Å; F501-K513 HydrophobicContact CG-CB 4.19Å; F501-K513 HydrophobicContact CZ-CB 4.07Å; K513-V515 VanDerWaalsContact C-N 3.28Å; K513-V515 PolarHBondContact O-N 3.2Å; K513-L516 WeakPolarHBondContact O-CB 3.33Å; K513-L516 PolarHBondContact O-N 3.32Å; K513-T517 PolarHBondContact O-N 3.34Å; K513-T517 PolarHBondContact O-OG1 3.03Å; K513-T517 VanDerWaalsContact O-OG1 3.1Å
514	S	77.6	Confident	75.5	Confident	73 Å²	73	69.6 Å²	69.6	51%	0.51	38%	0.379	S	S	.	.	H	α-helix	trans	-59.7	-35.6	177.5	48.1	0	0	0	0	113.5	Q512 T517 T518	Q512-S514 VanDerWaalsContact C-N 3.26Å; Q512-S514 PolarHBondContact O-N 3.45Å; S514-T517 PolarHBondContact O-N 3.01Å; S514-T518 PolarHBondContact O-N 3.28Å; S514-T518 PolarHBondContact O-OG1 3.46Å
515	V	78.2	Confident	74.9	Confident	58 Å²	58	66.9 Å²	66.9	35%	0.352	37%	0.373	S	S	.	.	H	α-helix	trans	-76.9	-34.5	178.6	-175.7	0	0	0	0	110.8	F510 Q512 K513 T518 H519	F510-V515 HydrophobicContact CB-CB 4.47Å; F510-V515 HydrophobicContact CD1-CB 4.38Å; F510-V515 HydrophobicContact CD1-CG1 3.61Å; F510-V515 HydrophobicContact CE1-CG1 4.18Å; F510-V515 HydrophobicContact CG-CG1 4.29Å; Q512-V515 HydrophobicContact CB-CG2 4.07Å; Q512-V515 PolarHBondContact O-N 2.8Å; K513-V515 VanDerWaalsContact C-N 3.28Å; K513-V515 PolarHBondContact O-N 3.2Å; V515-T518 PolarHBondContact O-OG1 3.48Å; V515-H519 WeakPolarHBondContact O-CB 3.16Å; V515-H519 PolarHBondContact O-N 2.94Å
516	L	82	Confident	74.1	Confident	19 Å²	19	63.6 Å²	63.6	10%	0.099	36%	0.364	C	S	.	.	H	α-helix	trans	-60.6	-47.3	168	171.7	61.6	0	0	0	110.7	F501 F502 C503 F510 Q512 K513 T518 H519 Q520	F501-L516 HydrophobicContact CB-CB 4.08Å; F501-L516 HydrophobicContact CB-CD2 3.81Å; F502-L516 WeakPolarHBondContact O-CD1 3.24Å; F502-L516 VanDerWaalsContact O-CD2 3.3Å; F502-L516 WeakPolarHBondContact O-CD2 3.38Å; C503-L516 HydrophobicContact CB-CD1 3.63Å; F510-L516 HydrophobicContact CB-CB 4.48Å; F510-L516 HydrophobicContact CD2-CB 4.04Å; F510-L516 HydrophobicContact CD2-CD1 3.98Å; F510-L516 HydrophobicContact CE2-CD1 4.17Å; Q512-L516 PolarHBondContact O-N 2.81Å; K513-L516 WeakPolarHBondContact O-CB 3.33Å; K513-L516 PolarHBondContact O-N 3.32Å; L516-T518 VanDerWaalsContact C-N 3.35Å; L516-T518 PolarHBondContact O-N 3.09Å; L516-H519 CarbonylContact O-C 3.57Å; L516-H519 WeakPolarHBondContact O-CB 3.33Å; L516-H519 PolarHBondContact O-N 3.4Å; L516-H519 VanDerWaalsContact O-N 3.09Å; L516-Q520 HydrophobicContact CD1-CG 3.89Å; L516-Q520 HydrophobicContact CG-CG 4.35Å; L516-Q520 WeakPolarHBondContact O-CG 3.46Å; L516-Q520 PolarHBondContact O-N 3.46Å; L516-Q520 PolarHBondContact O-OE1 3.2Å
517	T	78.6	Confident	73.7	Confident	56 Å²	56	67.1 Å²	67.1	34%	0.344	37%	0.374	S	S	.	.	H	α-helix	trans	-65.6	-31.3	-179.8	-56.4	0	0	0	0	113.4	K513 S514 R521	K513-T517 PolarHBondContact O-N 3.34Å; K513-T517 PolarHBondContact O-OG1 3.03Å; K513-T517 VanDerWaalsContact O-OG1 3.1Å; S514-T517 PolarHBondContact O-N 3.01Å; T517-R521 PolarHBondContact O-NE 2.74Å
518	T	73.1	Confident	73.1	Confident	38 Å²	38	66.1 Å²	66.1	23%	0.233	37%	0.365	C	S	.	.	H	α-helix	trans	-77.5	-30.9	169.9	54.8	0	0	0	0	112.6	S514 V515 L516 R521 E540	S514-T518 PolarHBondContact O-N 3.28Å; S514-T518 PolarHBondContact O-OG1 3.46Å; V515-T518 PolarHBondContact O-OG1 3.48Å; L516-T518 VanDerWaalsContact C-N 3.35Å; L516-T518 PolarHBondContact O-N 3.09Å; T518-R521 WeakPolarHBondContact O-CB 3.35Å; T518-E540 HydrophobicContact CG2-CG 4.12Å
519	H	77	Confident	72.7	Confident	22 Å²	22	62.7 Å²	62.7	10%	0.102	35%	0.349	C	S	.	.	H	α-helix	trans	-69.9	-39.8	175.5	173.5	64.4	0	0	0	113.3	C506 F510 V515 L516 R521 I522 H523	C506-H519 PolarHBondContact SG-NE2 3.23Å; F510-H519 HydrophobicContact CE1-CB 4.22Å; F510-H519 HydrophobicContact CE2-CB 3.97Å; F510-H519 AromaticContact CE2-CD2 3.34Å; F510-H519 WeakPolarHBondContact CE2-CD2 3.41Å; F510-H519 AromaticContact CE2-CG 3.67Å; F510-H519 HydrophobicContact CZ-CB 3.67Å; F510-H519 AromaticContact CZ-CD2 3.38Å; F510-H519 WeakPolarHBondContact CZ-CD2 3.39Å; F510-H519 AromaticContact CZ-CG 3.29Å; F510-H519 AromaticContact CZ-ND1 3.81Å; F510-H519 AromaticContact CZ-NE2 3.92Å; V515-H519 WeakPolarHBondContact O-CB 3.16Å; V515-H519 PolarHBondContact O-N 2.94Å; L516-H519 CarbonylContact O-C 3.57Å; L516-H519 WeakPolarHBondContact O-CB 3.33Å; L516-H519 PolarHBondContact O-N 3.4Å; L516-H519 VanDerWaalsContact O-N 3.09Å; H519-R521 PolarHBondContact O-N 3Å; H519-R521 VanDerWaalsContact O-N 3.16Å; H519-I522 VanDerWaalsContact O-CB 3.27Å; H519-I522 WeakPolarHBondContact O-CB 3.37Å; H519-I522 WeakPolarHBondContact O-CG1 3.48Å; H519-I522 PolarHBondContact O-N 2.82Å; H519-H523 AromaticContact CD2-NE2 3.77Å; H519-H523 AromaticContact CE1-CE1 3.9Å; H519-H523 AromaticContact CE1-NE2 3.49Å; H519-H523 PolarHBondContact CE1-NE2 3.35Å; H519-H523 AromaticContact NE2-CE1 3.75Å; H519-H523 AromaticContact NE2-NE2 3.01Å; H519-H523 PolarHBondContact NE2-NE2 3.38Å
520	Q	74	Confident	71.7	Confident	65 Å²	65	64.1 Å²	64.1	30%	0.304	36%	0.356	S	S	.	.	H	α-helix	trans	-57.4	-31.2	179	-76.5	169.7	-63.7	0	0	112.6	L516 I522 H523 V524	L516-Q520 HydrophobicContact CD1-CG 3.89Å; L516-Q520 HydrophobicContact CG-CG 4.35Å; L516-Q520 WeakPolarHBondContact O-CG 3.46Å; L516-Q520 PolarHBondContact O-N 3.46Å; L516-Q520 PolarHBondContact O-OE1 3.2Å; Q520-I522 PolarHBondContact O-N 2.82Å; Q520-H523 PolarHBondContact O-N 3.47Å; Q520-H523 VanDerWaalsContact O-N 3.16Å; Q520-V524 PolarHBondContact O-N 2.9Å
521	R	72.4	Confident	70.7	Confident	64 Å²	64	62.3 Å²	62.3	24%	0.242	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-21.3	174.9	-60.7	171.1	-171.4	-157.8	-12	114.1	T517 T518 H519 G525 G526 Y529 S539	T517-R521 PolarHBondContact O-NE 2.74Å; T518-R521 WeakPolarHBondContact O-CB 3.35Å; H519-R521 PolarHBondContact O-N 3Å; H519-R521 VanDerWaalsContact O-N 3.16Å; R521-G525 CarbonylContact O-C 3.15Å; R521-G525 PolarHBondContact O-N 3.43Å; R521-G526 PolarHBondContact O-N 3.1Å; R521-Y529 VanDerWaalsContact NH1-CE2 3.26Å; R521-Y529 PolarHBondContact NH1-OH 3.35Å; R521-S539 WeakPolarHBondContact CD-O 3.49Å; R521-S539 PolarHBondContact NH1-O 3.28Å
522	I	66.3	Low	69.3	Low	113 Å²	113	65.5 Å²	65.5	58%	0.579	38%	0.376	S	S	*	.	H	α-helix	trans	-70.1	-36.8	177.4	-57.2	178.5	0	0	0	110.4	H519 Q520 G525	H519-I522 VanDerWaalsContact O-CB 3.27Å; H519-I522 WeakPolarHBondContact O-CB 3.37Å; H519-I522 WeakPolarHBondContact O-CG1 3.48Å; H519-I522 PolarHBondContact O-N 2.82Å; Q520-I522 PolarHBondContact O-N 2.82Å; I522-G525 PolarHBondContact O-N 3.27Å
523	H	65.8	Low	68	Low	69 Å²	69	67.9 Å²	67.9	32%	0.319	39%	0.391	S	S	.	.	H	α-helix	trans	-75.7	-34.9	-180	-55.1	-56.8	0	0	0	112.7	C503 I505 C506 H519 Q520 G525	C503-H523 VanDerWaalsContact SG-CD2 3.56Å; C503-H523 PolarHBondContact SG-NE2 2.88Å; C503-H523 VanDerWaalsContact SG-NE2 3.39Å; I505-H523 HydrophobicContact CB-CB 4.36Å; I505-H523 HydrophobicContact CD1-CB 3.69Å; I505-H523 HydrophobicContact CG2-CB 3.88Å; C506-H523 PolarHBondContact SG-CE1 3.44Å; C506-H523 PolarHBondContact SG-NE2 3.06Å; H519-H523 AromaticContact CD2-NE2 3.77Å; H519-H523 AromaticContact CE1-CE1 3.9Å; H519-H523 AromaticContact CE1-NE2 3.49Å; H519-H523 PolarHBondContact CE1-NE2 3.35Å; H519-H523 AromaticContact NE2-CE1 3.75Å; H519-H523 AromaticContact NE2-NE2 3.01Å; H519-H523 PolarHBondContact NE2-NE2 3.38Å; Q520-H523 PolarHBondContact O-N 3.47Å; Q520-H523 VanDerWaalsContact O-N 3.16Å; H523-G525 PolarHBondContact O-N 2.96Å
524	V	63.7	Low	67	Low	92 Å²	92	64.2 Å²	64.2	56%	0.558	38%	0.382	S	S	*	.	S	Bend	trans	-81	-5.4	177.1	-171.1	0	0	0	0	111.5	Q520 G526	Q520-V524 PolarHBondContact O-N 2.9Å; V524-G526 PolarHBondContact O-N 3.39Å
525	G	61.5	Low	65.9	Low	52 Å²	52	63 Å²	63	54%	0.536	38%	0.381	S	S	.	.			trans	66.6	-15.2	-172.4	0	0	0	0	0	115.2	R521 I522 H523 K527	R521-G525 CarbonylContact O-C 3.15Å; R521-G525 PolarHBondContact O-N 3.43Å; I522-G525 PolarHBondContact O-N 3.27Å; H523-G525 PolarHBondContact O-N 2.96Å; G525-K527 PolarHBondContact O-N 3.48Å
526	G	54.9	Low	65	Low	31 Å²	31	65.3 Å²	65.3	32%	0.32	39%	0.388	S	S	.	.			trans	-53.7	112.8	-175	0	0	0	0	0	114	R521 V524 P528	R521-G526 PolarHBondContact O-N 3.1Å; V524-G526 PolarHBondContact O-N 3.39Å; G526-P528 VanDerWaalsContact C-CD 3.47Å; G526-P528 WeakPolarHBondContact O-CD 3.42Å
527	K	61.8	Low	64.2	Low	116 Å²	116	67.7 Å²	67.7	50%	0.504	40%	0.401	S	S	.	.			trans	-110.5	76.1	172.4	-74.1	165.3	151.9	-137.2	0	109.3	G525 Y529 N537 F538	G525-K527 PolarHBondContact O-N 3.48Å; K527-Y529 PolarHBondContact O-N 3.02Å; K527-N537 HydrophobicContact CB-CB 3.76Å; K527-N537 HydrophobicContact CD-CB 3.79Å; K527-N537 VanDerWaalsContact CD-O 3.31Å; K527-N537 WeakPolarHBondContact CD-O 3.33Å; K527-N537 WeakPolarHBondContact CE-O 3.4Å; K527-N537 HydrophobicContact CG-CB 4.4Å; K527-N537 PolarHBondContact NZ-O 3.38Å; K527-F538 CarbonylContact C-O 3.53Å; K527-F538 WeakPolarHBondContact CA-O 3.28Å
528	P	62.8	Low	63.9	Low	77 Å²	77	66.6 Å²	66.6	50%	0.5	39%	0.391	S	S	.	.			trans	-72.2	-1.5	-165.1	30.5	-38.3	0	0	0	114.7	G526	G526-P528 VanDerWaalsContact C-CD 3.47Å; G526-P528 WeakPolarHBondContact O-CD 3.42Å
529	Y	65.1	Low	63.6	Low	52 Å²	52	66.3 Å²	66.3	20%	0.204	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	88.3	177.3	-45.9	-71.5	0	0	0	110	R521 K527 F538 S539 E540 Q541 Y544	R521-Y529 VanDerWaalsContact NH1-CE2 3.26Å; R521-Y529 PolarHBondContact NH1-OH 3.35Å; K527-Y529 PolarHBondContact O-N 3.02Å; Y529-F538 WeakPolarHBondContact CD2-O 3.41Å; Y529-F538 PolarHBondContact N-O 2.81Å; Y529-F538 PolarHBondContact O-N 3.16Å; Y529-S539 WeakPolarHBondContact CE2-O 3.26Å; Y529-E540 VanDerWaalsContact CE2-C 3.45Å; Y529-Q541 HydrophobicContact CD1-CB 4.44Å; Y529-Q541 HydrophobicContact CD1-CG 4.32Å; Y529-Q541 HydrophobicContact CD2-CB 4.4Å; Y529-Q541 HydrophobicContact CE1-CB 3.91Å; Y529-Q541 HydrophobicContact CE1-CG 3.91Å; Y529-Q541 HydrophobicContact CE2-CB 3.86Å; Y529-Y544 VanDerWaalsContact CB-CB 3.45Å; Y529-Y544 HydrophobicContact CG-CG 4.31Å
530	V	61.3	Low	63.1	Low	82 Å²	82	68.2 Å²	68.2	50%	0.497	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	131.9	174	-178.1	0	0	0	0	109.5	N537 Y544	V530-N537 WeakPolarHBondContact CG1-OD1 3.42Å; V530-N537 WeakPolarHBondContact CG2-OD1 3.32Å; V530-Y544 VanDerWaalsContact O-CE2 3.3Å; V530-Y544 WeakPolarHBondContact O-CE2 3.31Å
531	C	64.7	Low	62.8	Low	1 Å²	1	70.6 Å²	70.6	1%	0.007	41%	0.411	C	S	.	.			trans	-80.8	116.1	168.8	-169	0	0	0	0	111.3	N533 C534 G535 E536 H547 H551	C531-N533 PolarHBondContact O-N 2.62Å; C531-C534 PolarHBondContact O-N 2.77Å; C531-G535 WeakPolarHBondContact O-CA 3.31Å; C531-G535 PolarHBondContact O-N 2.6Å; C531-E536 PolarHBondContact N-O 2.82Å; C531-H547 VanDerWaalsContact CB-NE2 3.27Å; C531-H547 WeakPolarHBondContact CB-NE2 3.42Å; C531-H547 PolarHBondContact SG-NE2 2.96Å; C531-H551 PolarHBondContact SG-CD2 3.39Å; C531-H551 PolarHBondContact SG-NE2 3.02Å; C531-H551 VanDerWaalsContact SG-NE2 3.43Å
532	A	52.2	Low	62.7	Low	98 Å²	98	75.2 Å²	75.2	81%	0.81	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-29	175.6	0	0	0	0	0	113.4
533	N	55.4	Low	63.1	Low	107 Å²	107	73.6 Å²	73.6	57%	0.572	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-21.1	-176.7	-59.6	78.4	0	0	0	114.2	C531 H551	C531-N533 PolarHBondContact O-N 2.62Å; N533-H551 HydrophobicContact CB-CB 4.12Å
534	C	59.5	Low	63.4	Low	63 Å²	63	72.3 Å²	72.3	43%	0.426	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.2	8.2	-175.5	74.7	0	0	0	0	116.2	C531 E536 H547 H551	C531-C534 PolarHBondContact O-N 2.77Å; C534-E536 PolarHBondContact O-N 3.18Å; C534-E536 VanDerWaalsContact O-N 3.17Å; C534-H547 PolarHBondContact SG-CE1 2.74Å; C534-H547 PolarHBondContact SG-NE2 2.82Å; C534-H551 PolarHBondContact SG-NE2 3.46Å
535	G	53.3	Low	63.8	Low	47 Å²	47	71.4 Å²	71.4	49%	0.485	41%	0.407	S	S	.	.			trans	68.9	7.2	177.9	0	0	0	0	0	116.2	C531 N537	C531-G535 WeakPolarHBondContact O-CA 3.31Å; C531-G535 PolarHBondContact O-N 2.6Å; G535-N537 PolarHBondContact O-OD1 3.15Å
536	E	59.9	Low	64.2	Low	107 Å²	107	72.2 Å²	72.2	50%	0.5	40%	0.401	S	S	.	.			trans	-72.4	132.2	177.5	-78.3	-151.1	127.7	0	0	111.9	C531 C534 F538 H547	C531-E536 PolarHBondContact N-O 2.82Å; C534-E536 PolarHBondContact O-N 3.18Å; C534-E536 VanDerWaalsContact O-N 3.17Å; E536-F538 HydrophobicContact CB-CE2 3.6Å; E536-F538 HydrophobicContact CB-CZ 3.8Å; E536-F538 WeakPolarHBondContact O-CD2 3.42Å; E536-F538 WeakPolarHBondContact O-CE2 3.47Å; E536-H547 IonicContact OE2-CE1 3.51Å; E536-H547 PolarHBondContact OE2-CE1 3.23Å; E536-H547 IonicContact OE2-ND1 3.3Å; E536-H547 PolarHBondContact OE2-ND1 3.44Å
537	N	64.4	Low	65.1	Low	70 Å²	70	71.4 Å²	71.4	37%	0.374	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.5	-170.2	-65.3	-22	0	0	0	111.4	K527 V530 G535	K527-N537 HydrophobicContact CB-CB 3.76Å; K527-N537 HydrophobicContact CD-CB 3.79Å; K527-N537 VanDerWaalsContact CD-O 3.31Å; K527-N537 WeakPolarHBondContact CD-O 3.33Å; K527-N537 WeakPolarHBondContact CE-O 3.4Å; K527-N537 HydrophobicContact CG-CB 4.4Å; K527-N537 PolarHBondContact NZ-O 3.38Å; V530-N537 WeakPolarHBondContact CG1-OD1 3.42Å; V530-N537 WeakPolarHBondContact CG2-OD1 3.32Å; G535-N537 PolarHBondContact O-OD1 3.15Å
538	F	73.4	Confident	65	Low	33 Å²	33	71.6 Å²	71.6	15%	0.145	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	143.4	-176.1	-58.3	-88.4	0	0	0	112.7	K527 Y529 E536 Q543 Y544 H547	K527-F538 CarbonylContact C-O 3.53Å; K527-F538 WeakPolarHBondContact CA-O 3.28Å; Y529-F538 WeakPolarHBondContact CD2-O 3.41Å; Y529-F538 PolarHBondContact N-O 2.81Å; Y529-F538 PolarHBondContact O-N 3.16Å; E536-F538 HydrophobicContact CB-CE2 3.6Å; E536-F538 HydrophobicContact CB-CZ 3.8Å; E536-F538 WeakPolarHBondContact O-CD2 3.42Å; E536-F538 WeakPolarHBondContact O-CE2 3.47Å; F538-Q543 HydrophobicContact CB-CB 4.5Å; F538-Q543 HydrophobicContact CD1-CB 3.9Å; F538-Q543 HydrophobicContact CG-CB 4.48Å; F538-Y544 HydrophobicContact CD2-CD2 4.36Å; F538-H547 HydrophobicContact CE1-CB 4.19Å; F538-H547 HydrophobicContact CE2-CB 3.9Å; F538-H547 AromaticContact CE2-CD2 3.53Å; F538-H547 AromaticContact CE2-CE1 3.98Å; F538-H547 AromaticContact CE2-CG 3.49Å; F538-H547 VanDerWaalsContact CE2-CG 3.49Å; F538-H547 AromaticContact CE2-ND1 3.81Å; F538-H547 AromaticContact CE2-NE2 3.85Å; F538-H547 HydrophobicContact CZ-CB 3.64Å; F538-H547 AromaticContact CZ-CD2 3.87Å; F538-H547 AromaticContact CZ-CE1 3.83Å; F538-H547 AromaticContact CZ-CG 3.35Å; F538-H547 AromaticContact CZ-ND1 3.34Å; F538-H547 VanDerWaalsContact CZ-ND1 3.34Å; F538-H547 WeakPolarHBondContact CZ-ND1 3.22Å
539	S	65.5	Low	65.2	Low	31 Å²	31	75 Å²	75	22%	0.217	39%	0.394	C	S	.	.	S	Bend	trans	-83.4	-23.7	175.3	52.4	0	0	0	0	113.6	R521 Y529	R521-S539 WeakPolarHBondContact CD-O 3.49Å; R521-S539 PolarHBondContact NH1-O 3.28Å; Y529-S539 WeakPolarHBondContact CE2-O 3.26Å
540	E	67.6	Low	65.1	Low	63 Å²	63	74 Å²	74	29%	0.294	39%	0.393	S	S	.	.	S	Bend	trans	-117.2	132.4	-177.3	-69.9	-174.8	179.2	0	0	112.9	T518 Y529 K542 Q543 Y544	T518-E540 HydrophobicContact CG2-CG 4.12Å; Y529-E540 VanDerWaalsContact CE2-C 3.45Å; E540-K542 PolarHBondContact O-N 2.74Å; E540-Q543 HydrophobicContact CB-CB 4.25Å; E540-Q543 HydrophobicContact CB-CG 3.88Å; E540-Q543 PolarHBondContact O-N 3.14Å; E540-Q543 VanDerWaalsContact O-N 3.08Å; E540-Q543 PolarHBondContact OE2-NE2 3.06Å; E540-Y544 PolarHBondContact O-N 2.97Å; E540-Y544 VanDerWaalsContact O-N 3.09Å
541	Q	66.6	Low	64.9	Low	114 Å²	114	73.4 Å²	73.4	53%	0.533	39%	0.385	S	S	.	.	H	α-helix	trans	-60.9	-32.9	179.1	-163.3	-176.4	17.9	0	0	112	Y529 L545	Y529-Q541 HydrophobicContact CD1-CB 4.44Å; Y529-Q541 HydrophobicContact CD1-CG 4.32Å; Y529-Q541 HydrophobicContact CD2-CB 4.4Å; Y529-Q541 HydrophobicContact CE1-CB 3.91Å; Y529-Q541 HydrophobicContact CE1-CG 3.91Å; Y529-Q541 HydrophobicContact CE2-CB 3.86Å; Q541-L545 HydrophobicContact CG-CD1 4.08Å; Q541-L545 HydrophobicContact CG-CG 4.39Å; Q541-L545 WeakPolarHBondContact O-CB 3.28Å; Q541-L545 VanDerWaalsContact O-CG 3.24Å; Q541-L545 WeakPolarHBondContact O-CG 3.35Å; Q541-L545 PolarHBondContact O-N 2.94Å
542	K	71.9	Confident	64.4	Low	161 Å²	161	79 Å²	79	70%	0.7	42%	0.419	S	S	*	.	H	α-helix	trans	-63.9	-43.5	176.9	-174.3	-175.5	175.4	-170.2	0	111.5	E540 L545 T546	E540-K542 PolarHBondContact O-N 2.74Å; K542-L545 PolarHBondContact O-N 2.91Å; K542-T546 PolarHBondContact O-N 3.44Å; K542-T546 PolarHBondContact O-OG1 3.25Å
543	Q	73.3	Confident	64.1	Low	79 Å²	79	76.6 Å²	76.6	37%	0.369	40%	0.396	S	S	.	.	H	α-helix	trans	-66.8	-47.1	179.6	-63	177.2	23.2	0	0	110.3	F538 E540 L545 T546 H547	F538-Q543 HydrophobicContact CB-CB 4.5Å; F538-Q543 HydrophobicContact CD1-CB 3.9Å; F538-Q543 HydrophobicContact CG-CB 4.48Å; E540-Q543 HydrophobicContact CB-CB 4.25Å; E540-Q543 HydrophobicContact CB-CG 3.88Å; E540-Q543 PolarHBondContact O-N 3.14Å; E540-Q543 VanDerWaalsContact O-N 3.08Å; E540-Q543 PolarHBondContact OE2-NE2 3.06Å; Q543-L545 PolarHBondContact O-N 3.35Å; Q543-T546 WeakPolarHBondContact CA-OG1 3.17Å; Q543-T546 PolarHBondContact O-N 3.09Å; Q543-T546 PolarHBondContact O-OG1 2.81Å; Q543-H547 WeakPolarHBondContact O-CB 3.32Å; Q543-H547 PolarHBondContact O-N 2.85Å
544	Y	72.3	Confident	63.7	Low	42 Å²	42	80.3 Å²	80.3	17%	0.165	41%	0.41	C	S	.	.	H	α-helix	trans	-56.1	-45	171.5	167.4	-98.5	0	0	0	112.7	Y529 V530 F538 E540 T546 H547 R548	Y529-Y544 VanDerWaalsContact CB-CB 3.45Å; Y529-Y544 HydrophobicContact CG-CG 4.31Å; V530-Y544 VanDerWaalsContact O-CE2 3.3Å; V530-Y544 WeakPolarHBondContact O-CE2 3.31Å; F538-Y544 HydrophobicContact CD2-CD2 4.36Å; E540-Y544 PolarHBondContact O-N 2.97Å; E540-Y544 VanDerWaalsContact O-N 3.09Å; Y544-T546 VanDerWaalsContact C-N 3.33Å; Y544-T546 PolarHBondContact O-N 2.93Å; Y544-H547 PolarHBondContact O-N 3.37Å; Y544-R548 WeakPolarHBondContact O-CB 3.28Å; Y544-R548 PolarHBondContact O-N 3.33Å; Y544-R548 WeakPolarHBondContact OH-CD 2.8Å
545	L	72.3	Confident	63.3	Low	73 Å²	73	85.4 Å²	85.4	38%	0.382	43%	0.427	S	S	.	.	H	α-helix	trans	-70.4	-26.5	179.1	-73	173.2	0	0	0	113.2	Q541 K542 Q543 K549	Q541-L545 HydrophobicContact CG-CD1 4.08Å; Q541-L545 HydrophobicContact CG-CG 4.39Å; Q541-L545 WeakPolarHBondContact O-CB 3.28Å; Q541-L545 VanDerWaalsContact O-CG 3.24Å; Q541-L545 WeakPolarHBondContact O-CG 3.35Å; Q541-L545 PolarHBondContact O-N 2.94Å; K542-L545 PolarHBondContact O-N 2.91Å; Q543-L545 PolarHBondContact O-N 3.35Å; L545-K549 VanDerWaalsContact O-CG 3.32Å; L545-K549 WeakPolarHBondContact O-CG 3.42Å
546	T	70.6	Confident	63.6	Low	69 Å²	69	87.8 Å²	87.8	42%	0.423	43%	0.426	S	S	.	.	H	α-helix	trans	-77	-32.2	169.6	44.9	0	0	0	0	112.8	K542 Q543 Y544 T550	K542-T546 PolarHBondContact O-N 3.44Å; K542-T546 PolarHBondContact O-OG1 3.25Å; Q543-T546 WeakPolarHBondContact CA-OG1 3.17Å; Q543-T546 PolarHBondContact O-N 3.09Å; Q543-T546 PolarHBondContact O-OG1 2.81Å; Y544-T546 VanDerWaalsContact C-N 3.33Å; Y544-T546 PolarHBondContact O-N 2.93Å; T546-T550 WeakPolarHBondContact O-CG2 3.43Å
547	H	72.6	Confident	63.7	Low	15 Å²	15	86.2 Å²	86.2	7%	0.069	42%	0.418	C	S	.	.	H	α-helix	trans	-74.7	-45.9	174.9	169.4	96.6	0	0	0	111.8	C531 C534 E536 F538 Q543 Y544 K549 T550 H551	C531-H547 VanDerWaalsContact CB-NE2 3.27Å; C531-H547 WeakPolarHBondContact CB-NE2 3.42Å; C531-H547 PolarHBondContact SG-NE2 2.96Å; C534-H547 PolarHBondContact SG-CE1 2.74Å; C534-H547 PolarHBondContact SG-NE2 2.82Å; E536-H547 IonicContact OE2-CE1 3.51Å; E536-H547 PolarHBondContact OE2-CE1 3.23Å; E536-H547 IonicContact OE2-ND1 3.3Å; E536-H547 PolarHBondContact OE2-ND1 3.44Å; F538-H547 HydrophobicContact CE1-CB 4.19Å; F538-H547 HydrophobicContact CE2-CB 3.9Å; F538-H547 AromaticContact CE2-CD2 3.53Å; F538-H547 AromaticContact CE2-CE1 3.98Å; F538-H547 AromaticContact CE2-CG 3.49Å; F538-H547 VanDerWaalsContact CE2-CG 3.49Å; F538-H547 AromaticContact CE2-ND1 3.81Å; F538-H547 AromaticContact CE2-NE2 3.85Å; F538-H547 HydrophobicContact CZ-CB 3.64Å; F538-H547 AromaticContact CZ-CD2 3.87Å; F538-H547 AromaticContact CZ-CE1 3.83Å; F538-H547 AromaticContact CZ-CG 3.35Å; F538-H547 AromaticContact CZ-ND1 3.34Å; F538-H547 VanDerWaalsContact CZ-ND1 3.34Å; F538-H547 WeakPolarHBondContact CZ-ND1 3.22Å; Q543-H547 WeakPolarHBondContact O-CB 3.32Å; Q543-H547 PolarHBondContact O-N 2.85Å; Y544-H547 PolarHBondContact O-N 3.37Å; H547-K549 PolarHBondContact O-N 3.08Å; H547-K549 VanDerWaalsContact O-N 3.09Å; H547-T550 WeakPolarHBondContact O-CB 3.5Å; H547-T550 PolarHBondContact O-N 3.46Å; H547-T550 PolarHBondContact O-OG1 3.07Å; H547-H551 AromaticContact CD2-CD2 3.92Å; H547-H551 AromaticContact CD2-NE2 3.69Å; H547-H551 AromaticContact CE1-NE2 3.46Å; H547-H551 PolarHBondContact CE1-NE2 2.67Å; H547-H551 AromaticContact NE2-CD2 3.67Å; H547-H551 AromaticContact NE2-NE2 2.97Å; H547-H551 PolarHBondContact NE2-NE2 3.24Å
548	R	61.4	Low	63.2	Low	119 Å²	119	87.8 Å²	87.8	45%	0.449	43%	0.426	S	S	.	.	H	α-helix	trans	-58.5	-28.7	176.9	-161	179.6	86.3	178.7	9.3	112.4	Y544 T550 H551	Y544-R548 WeakPolarHBondContact O-CB 3.28Å; Y544-R548 PolarHBondContact O-N 3.33Å; Y544-R548 WeakPolarHBondContact OH-CD 2.8Å; R548-T550 VanDerWaalsContact C-N 3.3Å; R548-T550 PolarHBondContact O-N 2.86Å; R548-H551 PolarHBondContact O-N 3.13Å
549	K	66.5	Low	62.5	Low	149 Å²	149	86.3 Å²	86.3	65%	0.648	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-65.5	-29.1	172.2	-78.1	179.4	177.2	-160.2	0	113.3	L545 H547 H551 V552 S553	L545-K549 VanDerWaalsContact O-CG 3.32Å; L545-K549 WeakPolarHBondContact O-CG 3.42Å; H547-K549 PolarHBondContact O-N 3.08Å; H547-K549 VanDerWaalsContact O-N 3.09Å; K549-H551 PolarHBondContact O-N 2.88Å; K549-V552 PolarHBondContact O-N 2.77Å; K549-V552 VanDerWaalsContact O-N 3.1Å; K549-S553 PolarHBondContact O-N 3.22Å; K549-S553 PolarHBondContact O-OG 3.29Å; K549-S553 VanDerWaalsContact O-OG 3.08Å
550	T	61.8	Low	61.8	Low	31 Å²	31	92.6 Å²	92.6	19%	0.19	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-74.3	-15.3	178.5	76.9	0	0	0	0	113.7	T546 H547 R548 S567 H568	T546-T550 WeakPolarHBondContact O-CG2 3.43Å; H547-T550 WeakPolarHBondContact O-CB 3.5Å; H547-T550 PolarHBondContact O-N 3.46Å; H547-T550 PolarHBondContact O-OG1 3.07Å; R548-T550 VanDerWaalsContact C-N 3.3Å; R548-T550 PolarHBondContact O-N 2.86Å; T550-S567 WeakPolarHBondContact CG2-O 3.41Å; T550-H568 WeakPolarHBondContact CG2-CE1 3.26Å; T550-H568 WeakPolarHBondContact CG2-ND1 3.44Å
551	H	57.9	Low	61.1	Low	70 Å²	70	96.3 Å²	96.3	32%	0.324	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-89.7	-8.1	170.1	-61.2	-73.4	0	0	0	113	C531 N533 C534 H547 R548 K549	C531-H551 PolarHBondContact SG-CD2 3.39Å; C531-H551 PolarHBondContact SG-NE2 3.02Å; C531-H551 VanDerWaalsContact SG-NE2 3.43Å; N533-H551 HydrophobicContact CB-CB 4.12Å; C534-H551 PolarHBondContact SG-NE2 3.46Å; H547-H551 AromaticContact CD2-CD2 3.92Å; H547-H551 AromaticContact CD2-NE2 3.69Å; H547-H551 AromaticContact CE1-NE2 3.46Å; H547-H551 PolarHBondContact CE1-NE2 2.67Å; H547-H551 AromaticContact NE2-CD2 3.67Å; H547-H551 AromaticContact NE2-NE2 2.97Å; H547-H551 PolarHBondContact NE2-NE2 3.24Å; R548-H551 PolarHBondContact O-N 3.13Å; K549-H551 PolarHBondContact O-N 2.88Å
552	V	53.9	Low	60.6	Low	118 Å²	118	93.6 Å²	93.6	72%	0.715	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-20.2	-179.4	178.6	0	0	0	0	111.5	K549	K549-V552 PolarHBondContact O-N 2.77Å; K549-V552 VanDerWaalsContact O-N 3.1Å
553	S	46.8	Very low	59.6	Low	47 Å²	47	88.9 Å²	88.9	33%	0.329	46%	0.458	S	S	.	.			trans	-94.4	95.6	171.1	62.4	0	0	0	0	111.1	K549 E555	K549-S553 PolarHBondContact O-N 3.22Å; K549-S553 PolarHBondContact O-OG 3.29Å; K549-S553 VanDerWaalsContact O-OG 3.08Å; S553-E555 PolarHBondContact O-N 3.16Å
554	E	47.3	Very low	58.8	Low	185 Å²	185	92.9 Å²	92.9	86%	0.864	47%	0.47	S	S	*	.			trans	-63.8	-24.8	165.3	-67.1	-164.8	118.3	0	0	111.8	H556	E554-H556 PolarHBondContact O-N 3.45Å; E554-H556 PolarHBondContact O-ND1 2.85Å
555	E	49.1	Very low	57.8	Low	171 Å²	171	94 Å²	94	80%	0.799	48%	0.484	S	S	*	.			trans	-65.5	79.3	165.6	-67.9	-156.1	139.3	0	0	112.2	S553	S553-E555 PolarHBondContact O-N 3.16Å
556	H	61.2	Low	57.6	Low	97 Å²	97	92.4 Å²	92.4	45%	0.449	47%	0.474	S	S	.	.			trans	-57.7	137.5	156.8	-67.1	76.9	0	0	0	109.3	E554 L558	E554-H556 PolarHBondContact O-N 3.45Å; E554-H556 PolarHBondContact O-ND1 2.85Å; H556-L558 VanDerWaalsContact C-N 3.35Å; H556-L558 PolarHBondContact O-N 3Å
557	H	61.1	Low	56.7	Low	73 Å²	73	92 Å²	92	34%	0.338	47%	0.474	S	S	.	.			trans	-71.7	95.1	169.4	-58.9	-56	0	0	0	109.5	F566 S569 F572	H557-F566 HydrophobicContact CB-CB 4.43Å; H557-F566 PolarHBondContact N-O 3.47Å; H557-F566 PolarHBondContact O-N 3.14Å; H557-S569 VanDerWaalsContact CD2-CA 3.44Å; H557-S569 WeakPolarHBondContact CD2-CA 3.44Å; H557-S569 PolarHBondContact CD2-N 3.45Å; H557-S569 WeakPolarHBondContact NE2-CA 3.46Å; H557-S569 WeakPolarHBondContact NE2-CB 3.31Å; H557-S569 PolarHBondContact NE2-N 3.37Å; H557-F572 HydrophobicContact CB-CB 3.75Å; H557-F572 HydrophobicContact CB-CD1 3.66Å; H557-F572 HydrophobicContact CB-CD2 3.56Å; H557-F572 HydrophobicContact CB-CE1 4.04Å; H557-F572 HydrophobicContact CB-CE2 3.97Å; H557-F572 HydrophobicContact CB-CG 3.38Å; H557-F572 HydrophobicContact CB-CZ 4.18Å; H557-F572 WeakPolarHBondContact O-CD2 3.48Å
558	L	53.7	Low	56.3	Low	104 Å²	104	95 Å²	95	55%	0.545	49%	0.488	S	S	.	.			trans	-75.9	129.2	177.6	-69.6	168.3	0	0	0	110.1	H556 F572	H556-L558 VanDerWaalsContact C-N 3.35Å; H556-L558 PolarHBondContact O-N 3Å; L558-F572 WeakPolarHBondContact O-CE2 3.26Å
559	C	60.3	Low	56.2	Low	2 Å²	2	93 Å²	93	1%	0.014	49%	0.492	C	S	.	.			trans	-89.8	106.1	170.5	-174.6	0	0	0	0	110.5	E561 C562 G563 R564 F572 H575 H579	C559-E561 PolarHBondContact O-N 3.38Å; C559-E561 VanDerWaalsContact O-N 3.07Å; C559-C562 PolarHBondContact O-N 3.5Å; C559-G563 PolarHBondContact O-N 3.16Å; C559-R564 PolarHBondContact N-O 3.02Å; C559-F572 HydrophobicContact CB-CE2 3.97Å; C559-H575 VanDerWaalsContact CB-NE2 3.33Å; C559-H575 WeakPolarHBondContact CB-NE2 3.35Å; C559-H575 PolarHBondContact SG-NE2 3.4Å; C559-H575 VanDerWaalsContact SG-NE2 3.43Å; C559-H579 VanDerWaalsContact SG-CD2 3.51Å; C559-H579 PolarHBondContact SG-NE2 2.8Å
560	N	50.1	Low	56.1	Low	163 Å²	163	89.6 Å²	89.6	87%	0.872	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-24	180	-63	-4.6	0	0	0	113.5
561	E	52.3	Low	56.3	Low	140 Å²	140	90.1 Å²	90.1	65%	0.654	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-16.4	177.4	-66.1	-178.8	-137.3	0	0	114.5	C559 H579	C559-E561 PolarHBondContact O-N 3.38Å; C559-E561 VanDerWaalsContact O-N 3.07Å; E561-H579 WeakPolarHBondContact OE2-CB 3.36Å; E561-H579 IonicContact OE2-CG 3.13Å; E561-H579 IonicContact OE2-ND1 2.88Å; E561-H579 PolarHBondContact OE2-ND1 3.28Å
562	C	56.4	Low	56.9	Low	58 Å²	58	88.8 Å²	88.8	39%	0.392	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.6	10.5	-177.8	74.2	0	0	0	0	116.6	C559 R564 H575	C559-C562 PolarHBondContact O-N 3.5Å; C562-R564 PolarHBondContact O-N 2.95Å; C562-R564 VanDerWaalsContact O-N 3.08Å; C562-H575 VanDerWaalsContact SG-CE1 3.5Å; C562-H575 PolarHBondContact SG-NE2 2.99Å
563	G	50.3	Low	57.4	Low	61 Å²	61	85.4 Å²	85.4	63%	0.629	48%	0.477	S	S	*	.			trans	66.6	5.9	176.5	0	0	0	0	0	115.5	C559	C559-G563 PolarHBondContact O-N 3.16Å
564	R	56.5	Low	58.4	Low	163 Å²	163	91.4 Å²	91.4	62%	0.615	50%	0.497	S	S	*	.			trans	-80.8	125.1	-178.5	-75.8	-172.6	167.3	-145.2	-7	111.8	C559 C562 F566	C559-R564 PolarHBondContact N-O 3.02Å; C562-R564 PolarHBondContact O-N 2.95Å; C562-R564 VanDerWaalsContact O-N 3.08Å; R564-F566 HydrophobicContact CB-CD2 4.33Å; R564-F566 HydrophobicContact CB-CE2 3.49Å; R564-F566 VanDerWaalsContact CB-CE2 3.49Å; R564-F566 HydrophobicContact CB-CZ 4.04Å; R564-F566 WeakPolarHBondContact O-CD2 3.47Å
565	S	52	Low	59.7	Low	66 Å²	66	84.4 Å²	84.4	46%	0.462	46%	0.464	S	S	.	.			trans	-78.7	142.5	167.1	46.1	0	0	0	0	111.6
566	F	67.6	Low	60.3	Low	40 Å²	40	79.4 Å²	79.4	18%	0.175	44%	0.443	C	S	.	.			trans	-134.4	127.7	174.1	-67.3	-96.4	0	0	0	110.7	H557 R564 H568 A571 F572 H575	H557-F566 HydrophobicContact CB-CB 4.43Å; H557-F566 PolarHBondContact N-O 3.47Å; H557-F566 PolarHBondContact O-N 3.14Å; R564-F566 HydrophobicContact CB-CD2 4.33Å; R564-F566 HydrophobicContact CB-CE2 3.49Å; R564-F566 VanDerWaalsContact CB-CE2 3.49Å; R564-F566 HydrophobicContact CB-CZ 4.04Å; R564-F566 WeakPolarHBondContact O-CD2 3.47Å; F566-H568 PolarHBondContact O-N 2.71Å; F566-A571 HydrophobicContact CD1-CB 4.17Å; F566-F572 HydrophobicContact CB-CB 4.04Å; F566-F572 HydrophobicContact CB-CD2 4.45Å; F566-F572 AromaticContact CD2-CD2 3.9Å; F566-F572 HydrophobicContact CD2-CD2 3.9Å; F566-F572 HydrophobicContact CG-CB 4.39Å; F566-F572 HydrophobicContact CG-CD2 4.41Å; F566-H575 AromaticContact CD2-CD2 3.94Å; F566-H575 HydrophobicContact CE1-CB 4.03Å; F566-H575 HydrophobicContact CE2-CB 4.16Å; F566-H575 AromaticContact CE2-CD2 3.05Å; F566-H575 WeakPolarHBondContact CE2-CD2 3.35Å; F566-H575 AromaticContact CE2-CG 3.59Å; F566-H575 AromaticContact CE2-NE2 3.47Å; F566-H575 WeakPolarHBondContact CE2-NE2 3.24Å; F566-H575 HydrophobicContact CZ-CB 3.72Å; F566-H575 AromaticContact CZ-CD2 3.34Å; F566-H575 WeakPolarHBondContact CZ-CD2 3.47Å; F566-H575 AromaticContact CZ-CG 3.33Å; F566-H575 AromaticContact CZ-ND1 3.8Å; F566-H575 AromaticContact CZ-NE2 3.76Å
567	S	52.4	Low	60.5	Low	60 Å²	60	82.7 Å²	82.7	42%	0.42	46%	0.456	S	S	.	.	S	Bend	trans	-75.1	-6.8	178.8	56.3	0	0	0	0	114.5	T550	T550-S567 WeakPolarHBondContact CG2-O 3.41Å
568	H	62.8	Low	60.5	Low	79 Å²	79	80.5 Å²	80.5	37%	0.366	45%	0.453	S	S	.	.			trans	-138.6	125.1	-176.3	-66.6	-28.7	0	0	0	112.1	T550 F566 A570 A571 F572	T550-H568 WeakPolarHBondContact CG2-CE1 3.26Å; T550-H568 WeakPolarHBondContact CG2-ND1 3.44Å; F566-H568 PolarHBondContact O-N 2.71Å; H568-A570 VanDerWaalsContact C-N 3.26Å; H568-A570 PolarHBondContact O-N 3.36Å; H568-A571 HydrophobicContact CB-CB 4.16Å; H568-A571 WeakPolarHBondContact O-CB 3.48Å; H568-A571 PolarHBondContact O-N 3.43Å; H568-F572 PolarHBondContact O-N 3.11Å
569	S	60.3	Low	60.7	Low	77 Å²	77	77 Å²	77	54%	0.538	43%	0.434	S	S	.	.	H	α-helix	trans	-55.7	-35.5	178.9	60.1	0	0	0	0	113.9	H557 F572 A573	H557-S569 VanDerWaalsContact CD2-CA 3.44Å; H557-S569 WeakPolarHBondContact CD2-CA 3.44Å; H557-S569 PolarHBondContact CD2-N 3.45Å; H557-S569 WeakPolarHBondContact NE2-CA 3.46Å; H557-S569 WeakPolarHBondContact NE2-CB 3.31Å; H557-S569 PolarHBondContact NE2-N 3.37Å; S569-F572 PolarHBondContact O-N 3.3Å; S569-A573 VanDerWaalsContact O-CB 3.29Å; S569-A573 WeakPolarHBondContact O-CB 3.39Å; S569-A573 PolarHBondContact O-N 2.85Å
570	A	64.8	Low	60.5	Low	76 Å²	76	81.4 Å²	81.4	63%	0.628	47%	0.47	S	S	*	.	H	α-helix	trans	-69.2	-34.1	176.1	0	0	0	0	0	113	H568 K574	H568-A570 VanDerWaalsContact C-N 3.26Å; H568-A570 PolarHBondContact O-N 3.36Å; A570-K574 WeakPolarHBondContact O-CB 3.22Å; A570-K574 PolarHBondContact O-N 2.77Å; A570-K574 VanDerWaalsContact O-N 3.11Å
571	A	66.4	Low	60.6	Low	43 Å²	43	78 Å²	78	36%	0.355	46%	0.46	S	S	.	.	H	α-helix	trans	-72.3	-42	174	0	0	0	0	0	110.7	F566 H568 K574 H575	F566-A571 HydrophobicContact CD1-CB 4.17Å; H568-A571 HydrophobicContact CB-CB 4.16Å; H568-A571 WeakPolarHBondContact O-CB 3.48Å; H568-A571 PolarHBondContact O-N 3.43Å; A571-K574 PolarHBondContact O-N 2.88Å; A571-H575 WeakPolarHBondContact O-CB 3.35Å; A571-H575 PolarHBondContact O-N 3.31Å
572	F	69.6	Low	60.5	Low	41 Å²	41	73.4 Å²	73.4	18%	0.18	44%	0.441	C	S	.	.	H	α-helix	trans	-60	-48.3	173.2	-177.1	-117.4	0	0	0	112.5	H557 L558 C559 F566 H568 S569 K574 H575 L576	H557-F572 HydrophobicContact CB-CB 3.75Å; H557-F572 HydrophobicContact CB-CD1 3.66Å; H557-F572 HydrophobicContact CB-CD2 3.56Å; H557-F572 HydrophobicContact CB-CE1 4.04Å; H557-F572 HydrophobicContact CB-CE2 3.97Å; H557-F572 HydrophobicContact CB-CG 3.38Å; H557-F572 HydrophobicContact CB-CZ 4.18Å; H557-F572 WeakPolarHBondContact O-CD2 3.48Å; L558-F572 WeakPolarHBondContact O-CE2 3.26Å; C559-F572 HydrophobicContact CB-CE2 3.97Å; F566-F572 HydrophobicContact CB-CB 4.04Å; F566-F572 HydrophobicContact CB-CD2 4.45Å; F566-F572 AromaticContact CD2-CD2 3.9Å; F566-F572 HydrophobicContact CD2-CD2 3.9Å; F566-F572 HydrophobicContact CG-CB 4.39Å; F566-F572 HydrophobicContact CG-CD2 4.41Å; H568-F572 PolarHBondContact O-N 3.11Å; S569-F572 PolarHBondContact O-N 3.3Å; F572-K574 VanDerWaalsContact C-N 3.32Å; F572-K574 PolarHBondContact O-N 3.1Å; F572-H575 CarbonylContact O-C 3.2Å; F572-H575 WeakPolarHBondContact O-CA 3.45Å; F572-H575 WeakPolarHBondContact O-CB 3.28Å; F572-H575 PolarHBondContact O-N 3.36Å; F572-L576 HydrophobicContact CD1-CD1 4Å; F572-L576 HydrophobicContact CD1-CG 4.42Å; F572-L576 HydrophobicContact CD2-CG 4.49Å; F572-L576 HydrophobicContact CE1-CD1 3.51Å; F572-L576 HydrophobicContact CE1-CG 4.15Å; F572-L576 HydrophobicContact CE2-CD1 4.4Å; F572-L576 HydrophobicContact CE2-CD2 4.18Å; F572-L576 HydrophobicContact CE2-CG 4.21Å; F572-L576 HydrophobicContact CZ-CD1 3.75Å; F572-L576 HydrophobicContact CZ-CD2 4.11Å; F572-L576 HydrophobicContact CZ-CG 4.05Å; F572-L576 PolarHBondContact O-N 3.25Å
573	A	64.4	Low	60.1	Low	47 Å²	47	81.7 Å²	81.7	39%	0.388	46%	0.464	S	S	.	.	H	α-helix	trans	-63.5	-35.7	176.9	0	0	0	0	0	112.6	S569 H575 K577	S569-A573 VanDerWaalsContact O-CB 3.29Å; S569-A573 WeakPolarHBondContact O-CB 3.39Å; S569-A573 PolarHBondContact O-N 2.85Å; A573-H575 VanDerWaalsContact C-N 3.31Å; A573-K577 WeakPolarHBondContact O-CB 3.41Å; A573-K577 WeakPolarHBondContact O-CG 3.26Å; A573-K577 PolarHBondContact O-N 2.99Å
574	K	68.6	Low	60.4	Low	173 Å²	173	83.8 Å²	83.8	75%	0.752	46%	0.461	S	S	*	.	H	α-helix	trans	-67.8	-32.2	171.4	-172.9	175	-179.2	178.4	0	112	A570 A571 F572 G578	A570-K574 WeakPolarHBondContact O-CB 3.22Å; A570-K574 PolarHBondContact O-N 2.77Å; A570-K574 VanDerWaalsContact O-N 3.11Å; A571-K574 PolarHBondContact O-N 2.88Å; F572-K574 VanDerWaalsContact C-N 3.32Å; F572-K574 PolarHBondContact O-N 3.1Å; K574-G578 PolarHBondContact O-N 3.38Å; K574-G578 VanDerWaalsContact O-N 3.11Å
575	H	73.8	Confident	60.7	Low	38 Å²	38	77.2 Å²	77.2	18%	0.176	44%	0.44	C	S	.	.	H	α-helix	trans	-73.9	-43.3	176.1	170	56.8	0	0	0	112.9	C559 C562 F566 A571 F572 A573 G578 H579	C559-H575 VanDerWaalsContact CB-NE2 3.33Å; C559-H575 WeakPolarHBondContact CB-NE2 3.35Å; C559-H575 PolarHBondContact SG-NE2 3.4Å; C559-H575 VanDerWaalsContact SG-NE2 3.43Å; C562-H575 VanDerWaalsContact SG-CE1 3.5Å; C562-H575 PolarHBondContact SG-NE2 2.99Å; F566-H575 AromaticContact CD2-CD2 3.94Å; F566-H575 HydrophobicContact CE1-CB 4.03Å; F566-H575 HydrophobicContact CE2-CB 4.16Å; F566-H575 AromaticContact CE2-CD2 3.05Å; F566-H575 WeakPolarHBondContact CE2-CD2 3.35Å; F566-H575 AromaticContact CE2-CG 3.59Å; F566-H575 AromaticContact CE2-NE2 3.47Å; F566-H575 WeakPolarHBondContact CE2-NE2 3.24Å; F566-H575 HydrophobicContact CZ-CB 3.72Å; F566-H575 AromaticContact CZ-CD2 3.34Å; F566-H575 WeakPolarHBondContact CZ-CD2 3.47Å; F566-H575 AromaticContact CZ-CG 3.33Å; F566-H575 AromaticContact CZ-ND1 3.8Å; F566-H575 AromaticContact CZ-NE2 3.76Å; A571-H575 WeakPolarHBondContact O-CB 3.35Å; A571-H575 PolarHBondContact O-N 3.31Å; F572-H575 CarbonylContact O-C 3.2Å; F572-H575 WeakPolarHBondContact O-CA 3.45Å; F572-H575 WeakPolarHBondContact O-CB 3.28Å; F572-H575 PolarHBondContact O-N 3.36Å; A573-H575 VanDerWaalsContact C-N 3.31Å; H575-G578 CarbonylContact O-C 3.19Å; H575-G578 WeakPolarHBondContact O-CA 3.39Å; H575-G578 PolarHBondContact O-N 3.43Å; H575-H579 AromaticContact CE1-CD2 3.65Å; H575-H579 AromaticContact CE1-CE1 3.98Å; H575-H579 AromaticContact CE1-NE2 3.09Å; H575-H579 PolarHBondContact CE1-NE2 3.42Å; H575-H579 AromaticContact ND1-NE2 3.95Å; H575-H579 AromaticContact NE2-CD2 3.71Å; H575-H579 AromaticContact NE2-NE2 3.16Å; H575-H579 PolarHBondContact NE2-NE2 3.26Å; H575-H579 VanDerWaalsContact NE2-NE2 3.16Å; H575-H579 PolarHBondContact O-N 3.45Å; H575-H579 VanDerWaalsContact O-N 3.07Å
576	L	62.3	Low	61.6	Low	66 Å²	66	81.4 Å²	81.4	35%	0.346	45%	0.445	S	S	.	.	H	α-helix	trans	-63.2	-39	171.6	-67.4	-176.5	0	0	0	112.1	F572 G578 H579 A580	F572-L576 HydrophobicContact CD1-CD1 4Å; F572-L576 HydrophobicContact CD1-CG 4.42Å; F572-L576 HydrophobicContact CD2-CG 4.49Å; F572-L576 HydrophobicContact CE1-CD1 3.51Å; F572-L576 HydrophobicContact CE1-CG 4.15Å; F572-L576 HydrophobicContact CE2-CD1 4.4Å; F572-L576 HydrophobicContact CE2-CD2 4.18Å; F572-L576 HydrophobicContact CE2-CG 4.21Å; F572-L576 HydrophobicContact CZ-CD1 3.75Å; F572-L576 HydrophobicContact CZ-CD2 4.11Å; F572-L576 HydrophobicContact CZ-CG 4.05Å; F572-L576 PolarHBondContact O-N 3.25Å; L576-G578 PolarHBondContact O-N 3.19Å; L576-H579 PolarHBondContact O-N 3.02Å; L576-H579 VanDerWaalsContact O-N 3.11Å; L576-A580 PolarHBondContact O-N 3.43Å
577	K	65.6	Low	62.1	Low	166 Å²	166	79.5 Å²	79.5	72%	0.722	44%	0.437	S	S	*	.	H	α-helix	trans	-63.6	-22.9	168.3	-75.2	-178.6	177.7	-173.1	0	113	A573	A573-K577 WeakPolarHBondContact O-CB 3.41Å; A573-K577 WeakPolarHBondContact O-CG 3.26Å; A573-K577 PolarHBondContact O-N 2.99Å
578	G	59.8	Low	63.1	Low	28 Å²	28	83.2 Å²	83.2	29%	0.289	45%	0.452	S	S	.	.	H	α-helix	trans	-61.5	-62.3	163.8	0	0	0	0	0	110.6	K574 H575 L576 A580 S581 V582	K574-G578 PolarHBondContact O-N 3.38Å; K574-G578 VanDerWaalsContact O-N 3.11Å; H575-G578 CarbonylContact O-C 3.19Å; H575-G578 WeakPolarHBondContact O-CA 3.39Å; H575-G578 PolarHBondContact O-N 3.43Å; L576-G578 PolarHBondContact O-N 3.19Å; G578-A580 VanDerWaalsContact C-N 3.33Å; G578-A580 PolarHBondContact O-N 3.49Å; G578-S581 WeakPolarHBondContact O-CA 3.23Å; G578-S581 WeakPolarHBondContact O-CB 3.32Å; G578-S581 PolarHBondContact O-N 3.37Å; G578-S581 PolarHBondContact O-OG 3.02Å; G578-V582 WeakPolarHBondContact O-CG2 3.33Å; G578-V582 PolarHBondContact O-N 3.09Å
579	H	59.4	Low	63.7	Low	30 Å²	30	85 Å²	85	14%	0.139	46%	0.46	C	S	.	.	H	α-helix	trans	-52.4	-44.5	179.4	-71.7	-66.6	0	0	0	113.8	C559 E561 H575 L576 S581 V582	C559-H579 VanDerWaalsContact SG-CD2 3.51Å; C559-H579 PolarHBondContact SG-NE2 2.8Å; E561-H579 WeakPolarHBondContact OE2-CB 3.36Å; E561-H579 IonicContact OE2-CG 3.13Å; E561-H579 IonicContact OE2-ND1 2.88Å; E561-H579 PolarHBondContact OE2-ND1 3.28Å; H575-H579 AromaticContact CE1-CD2 3.65Å; H575-H579 AromaticContact CE1-CE1 3.98Å; H575-H579 AromaticContact CE1-NE2 3.09Å; H575-H579 PolarHBondContact CE1-NE2 3.42Å; H575-H579 AromaticContact ND1-NE2 3.95Å; H575-H579 AromaticContact NE2-CD2 3.71Å; H575-H579 AromaticContact NE2-NE2 3.16Å; H575-H579 PolarHBondContact NE2-NE2 3.26Å; H575-H579 VanDerWaalsContact NE2-NE2 3.16Å; H575-H579 PolarHBondContact O-N 3.45Å; H575-H579 VanDerWaalsContact O-N 3.07Å; L576-H579 PolarHBondContact O-N 3.02Å; L576-H579 VanDerWaalsContact O-N 3.11Å; H579-S581 PolarHBondContact O-N 3.36Å; H579-V582 PolarHBondContact O-N 3.21Å
580	A	56.2	Low	64.6	Low	94 Å²	94	83.6 Å²	83.6	78%	0.777	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-9.8	174.8	0	0	0	0	0	114.8	L576 G578	L576-A580 PolarHBondContact O-N 3.43Å; G578-A580 VanDerWaalsContact C-N 3.33Å; G578-A580 PolarHBondContact O-N 3.49Å
581	S	50.5	Low	64.9	Low	93 Å²	93	81.1 Å²	81.1	65%	0.65	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-4.3	172.2	72.1	0	0	0	0	114.1	G578 H579 R583	G578-S581 WeakPolarHBondContact O-CA 3.23Å; G578-S581 WeakPolarHBondContact O-CB 3.32Å; G578-S581 PolarHBondContact O-N 3.37Å; G578-S581 PolarHBondContact O-OG 3.02Å; H579-S581 PolarHBondContact O-N 3.36Å; S581-R583 PolarHBondContact O-N 3.5Å; S581-R583 VanDerWaalsContact O-N 3.09Å
582	V	51.5	Low	65.3	Low	43 Å²	43	84.9 Å²	84.9	26%	0.261	44%	0.44	S	S	.	.			trans	-84.8	82.1	179.2	-175.5	0	0	0	0	110.3	G578 H579 N584 S595	G578-V582 WeakPolarHBondContact O-CG2 3.33Å; G578-V582 PolarHBondContact O-N 3.09Å; H579-V582 PolarHBondContact O-N 3.21Å; V582-N584 PolarHBondContact O-N 3.01Å; V582-S595 WeakPolarHBondContact CG2-O 3.2Å
583	R	48.5	Very low	65.2	Low	231 Å²	231	87.2 Å²	87.2	87%	0.872	46%	0.458	S	S	*	.			trans	-64.4	113	143	-168.1	174.1	-169.8	157.4	2.7	106.1	S581 C585	S581-R583 PolarHBondContact O-N 3.5Å; S581-R583 VanDerWaalsContact O-N 3.09Å; R583-C585 PolarHBondContact O-N 3.25Å
584	N	56.3	Low	65.6	Low	106 Å²	106	87.1 Å²	87.1	57%	0.567	45%	0.449	S	S	*	.			trans	-45.8	116.9	-173.1	-89.5	-39.2	0	0	0	111.4	V582 R586 T593	V582-N584 PolarHBondContact O-N 3.01Å; N584-R586 PolarHBondContact O-N 3.28Å; N584-T593 HydrophobicContact CB-CG2 4.29Å
585	C	62.4	Low	65.1	Low	25 Å²	25	82.2 Å²	82.2	17%	0.169	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	90.7	-173.5	-71.6	0	0	0	0	108.7	R583 F594 L600	R583-C585 PolarHBondContact O-N 3.25Å; C585-F594 WeakPolarHBondContact CB-O 3.27Å; C585-F594 PolarHBondContact N-O 3.41Å; C585-F594 PolarHBondContact O-N 2.97Å; C585-L600 HydrophobicContact CB-CB 4.04Å; C585-L600 HydrophobicContact CB-CD2 3.76Å
586	R	71.3	Confident	64.7	Low	154 Å²	154	86.7 Å²	86.7	58%	0.581	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	142.7	177.3	-157.7	-179.5	-169.9	-161.3	-1.5	110.5	N584 G591 K592 T593 L600	N584-R586 PolarHBondContact O-N 3.28Å; R586-G591 VanDerWaalsContact CG-O 3.27Å; R586-G591 WeakPolarHBondContact CG-O 3.28Å; R586-G591 PolarHBondContact NE-O 2.81Å; R586-K592 CarbonylContact C-O 3.55Å; R586-K592 WeakPolarHBondContact CA-O 3.43Å; R586-T593 HydrophobicContact CB-CG2 4.31Å; R586-T593 HydrophobicContact CG-CG2 4.12Å; R586-L600 WeakPolarHBondContact O-CD2 3.42Å
587	C	77.7	Confident	65.1	Low	0 Å²	0	92.6 Å²	92.6	0%	0	47%	0.469	C	S	.	.			trans	-86.9	121.6	164	-179.6	0	0	0	0	108.8	E589 C590 G591 K592 F594 L600 H607	C587-E589 VanDerWaalsContact C-N 3.32Å; C587-E589 PolarHBondContact O-N 2.96Å; C587-C590 VanDerWaalsContact SG-SG 3.64Å; C587-G591 WeakPolarHBondContact O-CA 3.45Å; C587-G591 PolarHBondContact O-N 2.88Å; C587-K592 PolarHBondContact N-O 2.85Å; C587-F594 HydrophobicContact CB-CE2 4.27Å; C587-L600 HydrophobicContact CB-CD1 3.51Å; C587-H607 PolarHBondContact SG-NE2 3.45Å; C587-H607 VanDerWaalsContact SG-NE2 3.42Å
588	D	73.1	Confident	65.3	Low	138 Å²	138	88.3 Å²	88.3	74%	0.738	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-30.3	-174.1	-52.5	-65.5	0	0	0	112.3
589	E	75.2	Confident	66.1	Low	116 Å²	116	89.6 Å²	89.6	54%	0.542	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-25.7	-177.9	-62.2	164.9	111.2	0	0	114.1	C587 H607	C587-E589 VanDerWaalsContact C-N 3.32Å; C587-E589 PolarHBondContact O-N 2.96Å; E589-H607 WeakPolarHBondContact OE1-CB 3.42Å; E589-H607 IonicContact OE2-CD2 2.68Å; E589-H607 PolarHBondContact OE2-CD2 3.41Å; E589-H607 IonicContact OE2-CG 3.01Å
590	C	79.4	Confident	67	Low	48 Å²	48	88.9 Å²	88.9	32%	0.324	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.1	4.2	-175	77.3	0	0	0	0	114.7	C587 K592 H603 H607	C587-C590 VanDerWaalsContact SG-SG 3.64Å; C590-K592 PolarHBondContact O-N 3.39Å; C590-H603 PolarHBondContact SG-NE2 3.24Å; C590-H607 PolarHBondContact SG-NE2 3.41Å
591	G	71.8	Confident	68	Low	23 Å²	23	87.4 Å²	87.4	24%	0.237	43%	0.431	C	S	.	.			trans	70.9	-7.2	177.8	0	0	0	0	0	117	R586 C587	R586-G591 VanDerWaalsContact CG-O 3.27Å; R586-G591 WeakPolarHBondContact CG-O 3.28Å; R586-G591 PolarHBondContact NE-O 2.81Å; C587-G591 WeakPolarHBondContact O-CA 3.45Å; C587-G591 PolarHBondContact O-N 2.88Å
592	K	74.1	Confident	69.4	Low	123 Å²	123	87.9 Å²	87.9	54%	0.535	42%	0.418	S	S	.	.			trans	-65.6	132.1	-175	-69.2	176.4	-176.2	173.9	0	112	R586 C587 C590 F594	R586-K592 CarbonylContact C-O 3.55Å; R586-K592 WeakPolarHBondContact CA-O 3.43Å; C587-K592 PolarHBondContact N-O 2.85Å; C590-K592 PolarHBondContact O-N 3.39Å; K592-F594 HydrophobicContact CB-CE2 3.74Å; K592-F594 HydrophobicContact CB-CZ 3.98Å; K592-F594 WeakPolarHBondContact O-CE2 3.39Å
593	T	66.9	Low	70.8	Confident	90 Å²	90	87.1 Å²	87.1	55%	0.552	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	137.8	178.5	42.5	0	0	0	0	111.8	N584 R586	N584-T593 HydrophobicContact CB-CG2 4.29Å; R586-T593 HydrophobicContact CB-CG2 4.31Å; R586-T593 HydrophobicContact CG-CG2 4.12Å
594	F	73.1	Confident	72.2	Confident	45 Å²	45	78.9 Å²	78.9	20%	0.197	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	134.1	176.3	-61	-89	0	0	0	110.1	C585 C587 K592 R596 H599 L600 H603	C585-F594 WeakPolarHBondContact CB-O 3.27Å; C585-F594 PolarHBondContact N-O 3.41Å; C585-F594 PolarHBondContact O-N 2.97Å; C587-F594 HydrophobicContact CB-CE2 4.27Å; K592-F594 HydrophobicContact CB-CE2 3.74Å; K592-F594 HydrophobicContact CB-CZ 3.98Å; K592-F594 WeakPolarHBondContact O-CE2 3.39Å; F594-R596 PolarHBondContact O-N 3.18Å; F594-R596 VanDerWaalsContact O-N 3.12Å; F594-H599 HydrophobicContact CB-CB 4.22Å; F594-H599 HydrophobicContact CD1-CB 3.97Å; F594-H599 HydrophobicContact CG-CB 4.39Å; F594-L600 HydrophobicContact CB-CB 4.26Å; F594-L600 HydrophobicContact CD2-CB 4.08Å; F594-L600 HydrophobicContact CD2-CD1 3.99Å; F594-L600 HydrophobicContact CE2-CD1 4.3Å; F594-L600 HydrophobicContact CG-CB 4.33Å; F594-H603 HydrophobicContact CE1-CB 4.18Å; F594-H603 HydrophobicContact CE2-CB 4.09Å; F594-H603 AromaticContact CE2-CD2 3.33Å; F594-H603 WeakPolarHBondContact CE2-CD2 3.27Å; F594-H603 AromaticContact CE2-CG 3.95Å; F594-H603 HydrophobicContact CZ-CB 3.69Å; F594-H603 AromaticContact CZ-CD2 3.25Å; F594-H603 WeakPolarHBondContact CZ-CD2 3.3Å; F594-H603 AromaticContact CZ-CG 3.52Å
595	S	58.9	Low	73.3	Confident	70 Å²	70	77.3 Å²	77.3	49%	0.49	37%	0.369	S	S	.	.	S	Bend	trans	-69.8	-1.3	175.7	54.1	0	0	0	0	113.9	V582	V582-S595 WeakPolarHBondContact CG2-O 3.2Å
596	R	64	Low	74	Confident	132 Å²	132	80 Å²	80	50%	0.498	39%	0.385	S	S	.	.	S	Bend	trans	-150.2	141.7	179	-59	172.3	51.1	95.6	-5.9	111.9	F594 D598 H599 L600	F594-R596 PolarHBondContact O-N 3.18Å; F594-R596 VanDerWaalsContact O-N 3.12Å; R596-D598 WeakPolarHBondContact CB-OD1 3.31Å; R596-D598 IonicContact CZ-OD1 2.67Å; R596-D598 IonicContact CZ-OD2 3.93Å; R596-D598 IonicContact NE-OD1 3.25Å; R596-D598 PolarHBondContact NE-OD1 2.99Å; R596-D598 IonicContact NE-OD2 3.44Å; R596-D598 PolarHBondContact NE-OD2 2.92Å; R596-D598 IonicContact NH2-OD1 3.48Å; R596-D598 IonicContact NH2-OD2 3.67Å; R596-D598 PolarHBondContact NH2-OD2 3.02Å; R596-D598 PolarHBondContact O-N 3.08Å; R596-H599 HydrophobicContact CB-CB 4.42Å; R596-H599 PolarHBondContact O-N 3.1Å; R596-L600 PolarHBondContact O-N 2.9Å
597	R	70.8	Confident	74.4	Confident	190 Å²	190	76.3 Å²	76.3	72%	0.717	38%	0.375	S	S	*	.	H	α-helix	trans	-64.6	-34.5	179.5	-166.1	178.4	-177.1	98.8	-0.8	113.6	H599 L600 V601	R597-H599 VanDerWaalsContact C-N 3.26Å; R597-H599 PolarHBondContact O-N 2.97Å; R597-L600 PolarHBondContact O-N 2.83Å; R597-V601 WeakPolarHBondContact O-CG2 3.28Å; R597-V601 PolarHBondContact O-N 2.76Å
598	D	70.9	Confident	74.3	Confident	75 Å²	75	80 Å²	80	40%	0.401	40%	0.397	S	S	.	.	H	α-helix	trans	-65.8	-29.6	175.8	66.8	-21	0	0	0	112.5	R596 R602	R596-D598 WeakPolarHBondContact CB-OD1 3.31Å; R596-D598 IonicContact CZ-OD1 2.67Å; R596-D598 IonicContact CZ-OD2 3.93Å; R596-D598 IonicContact NE-OD1 3.25Å; R596-D598 PolarHBondContact NE-OD1 2.99Å; R596-D598 IonicContact NE-OD2 3.44Å; R596-D598 PolarHBondContact NE-OD2 2.92Å; R596-D598 IonicContact NH2-OD1 3.48Å; R596-D598 IonicContact NH2-OD2 3.67Å; R596-D598 PolarHBondContact NH2-OD2 3.02Å; R596-D598 PolarHBondContact O-N 3.08Å; D598-R602 VanDerWaalsContact O-CB 3.24Å; D598-R602 WeakPolarHBondContact O-CB 3.48Å; D598-R602 PolarHBondContact O-N 3.1Å; D598-R602 VanDerWaalsContact O-N 3.17Å
599	H	76.3	Confident	74.5	Confident	56 Å²	56	75.6 Å²	75.6	26%	0.259	38%	0.384	S	S	.	.	H	α-helix	trans	-77.2	-36.9	175.8	-68.5	19.9	0	0	0	111.5	F594 R596 R597 H603	F594-H599 HydrophobicContact CB-CB 4.22Å; F594-H599 HydrophobicContact CD1-CB 3.97Å; F594-H599 HydrophobicContact CG-CB 4.39Å; R596-H599 HydrophobicContact CB-CB 4.42Å; R596-H599 PolarHBondContact O-N 3.1Å; R597-H599 VanDerWaalsContact C-N 3.26Å; R597-H599 PolarHBondContact O-N 2.97Å; H599-H603 WeakPolarHBondContact O-CB 3.4Å; H599-H603 PolarHBondContact O-N 2.99Å; H599-H603 VanDerWaalsContact O-N 3.12Å
600	L	78.2	Confident	74.5	Confident	15 Å²	15	74.1 Å²	74.1	8%	0.079	38%	0.377	C	S	.	.	H	α-helix	trans	-62.1	-52.9	170.6	171.7	59.9	0	0	0	111.7	C585 R586 C587 F594 R596 R597 R602 H603 Q604	C585-L600 HydrophobicContact CB-CB 4.04Å; C585-L600 HydrophobicContact CB-CD2 3.76Å; R586-L600 WeakPolarHBondContact O-CD2 3.42Å; C587-L600 HydrophobicContact CB-CD1 3.51Å; F594-L600 HydrophobicContact CB-CB 4.26Å; F594-L600 HydrophobicContact CD2-CB 4.08Å; F594-L600 HydrophobicContact CD2-CD1 3.99Å; F594-L600 HydrophobicContact CE2-CD1 4.3Å; F594-L600 HydrophobicContact CG-CB 4.33Å; R596-L600 PolarHBondContact O-N 2.9Å; R597-L600 PolarHBondContact O-N 2.83Å; L600-R602 VanDerWaalsContact C-N 3.28Å; L600-R602 PolarHBondContact O-N 3.45Å; L600-H603 CarbonylContact O-C 3.54Å; L600-H603 WeakPolarHBondContact O-CA 3.41Å; L600-H603 WeakPolarHBondContact O-CB 3.34Å; L600-H603 PolarHBondContact O-N 3.36Å; L600-Q604 HydrophobicContact CD1-CG 3.99Å; L600-Q604 HydrophobicContact CG-CG 4.44Å; L600-Q604 PolarHBondContact O-N 2.96Å
601	V	76.9	Confident	74.6	Confident	62 Å²	62	77.9 Å²	77.9	38%	0.376	39%	0.388	S	S	.	.	H	α-helix	trans	-60.3	-39.6	-179.2	172.7	0	0	0	0	111.3	R597 H603 Q604 R605	R597-V601 WeakPolarHBondContact O-CG2 3.28Å; R597-V601 PolarHBondContact O-N 2.76Å; V601-H603 PolarHBondContact O-N 3.48Å; V601-Q604 PolarHBondContact O-N 3.26Å; V601-R605 PolarHBondContact O-N 2.73Å
602	R	79.9	Confident	75.1	Confident	104 Å²	104	79.9 Å²	79.9	39%	0.392	40%	0.397	S	S	.	.	H	α-helix	trans	-63.8	-25	172.7	-176.7	-177.2	65.1	-171.1	-5.3	113.3	D598 L600	D598-R602 VanDerWaalsContact O-CB 3.24Å; D598-R602 WeakPolarHBondContact O-CB 3.48Å; D598-R602 PolarHBondContact O-N 3.1Å; D598-R602 VanDerWaalsContact O-N 3.17Å; L600-R602 VanDerWaalsContact C-N 3.28Å; L600-R602 PolarHBondContact O-N 3.45Å
603	H	81.1	Confident	75.5	Confident	26 Å²	26	77.7 Å²	77.7	12%	0.12	39%	0.387	C	S	.	.	H	α-helix	trans	-86.6	-36.3	176.1	177.2	40.3	0	0	0	112.9	C590 F594 H599 L600 V601 R605 T606 H607	C590-H603 PolarHBondContact SG-NE2 3.24Å; F594-H603 HydrophobicContact CE1-CB 4.18Å; F594-H603 HydrophobicContact CE2-CB 4.09Å; F594-H603 AromaticContact CE2-CD2 3.33Å; F594-H603 WeakPolarHBondContact CE2-CD2 3.27Å; F594-H603 AromaticContact CE2-CG 3.95Å; F594-H603 HydrophobicContact CZ-CB 3.69Å; F594-H603 AromaticContact CZ-CD2 3.25Å; F594-H603 WeakPolarHBondContact CZ-CD2 3.3Å; F594-H603 AromaticContact CZ-CG 3.52Å; H599-H603 WeakPolarHBondContact O-CB 3.4Å; H599-H603 PolarHBondContact O-N 2.99Å; H599-H603 VanDerWaalsContact O-N 3.12Å; L600-H603 CarbonylContact O-C 3.54Å; L600-H603 WeakPolarHBondContact O-CA 3.41Å; L600-H603 WeakPolarHBondContact O-CB 3.34Å; L600-H603 PolarHBondContact O-N 3.36Å; V601-H603 PolarHBondContact O-N 3.48Å; H603-R605 PolarHBondContact O-N 2.95Å; H603-T606 PolarHBondContact CE1-OG1 3.38Å; H603-T606 VanDerWaalsContact CE1-OG1 3.31Å; H603-T606 PolarHBondContact ND1-OG1 3.24Å; H603-T606 WeakPolarHBondContact O-CB 3.28Å; H603-T606 PolarHBondContact O-N 2.98Å; H603-T606 PolarHBondContact O-OG1 3.07Å; H603-H607 AromaticContact CE1-CE1 3.69Å; H603-H607 AromaticContact CE1-NE2 3.41Å; H603-H607 PolarHBondContact CE1-NE2 3.34Å; H603-H607 AromaticContact NE2-CE1 3.86Å; H603-H607 AromaticContact NE2-NE2 3.26Å; H603-H607 PolarHBondContact NE2-NE2 3.27Å
604	Q	77.4	Confident	76.2	Confident	58 Å²	58	77.6 Å²	77.6	27%	0.271	39%	0.387	S	S	.	.	H	α-helix	trans	-57.2	-34.3	174.7	-71.6	169.2	-60.6	0	0	111.3	L600 V601 T606 H607 T608	L600-Q604 HydrophobicContact CD1-CG 3.99Å; L600-Q604 HydrophobicContact CG-CG 4.44Å; L600-Q604 PolarHBondContact O-N 2.96Å; V601-Q604 PolarHBondContact O-N 3.26Å; Q604-T606 PolarHBondContact O-N 3.46Å; Q604-H607 PolarHBondContact O-N 3.34Å; Q604-T608 PolarHBondContact O-N 3.23Å
605	R	80.9	Confident	76.9	Confident	73 Å²	73	75.5 Å²	75.5	28%	0.275	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-10.6	169.8	-63.9	-169.8	174.9	148.9	6.6	116.2	V601 H603 G609 E610	V601-R605 PolarHBondContact O-N 2.73Å; H603-R605 PolarHBondContact O-N 2.95Å; R605-G609 PolarHBondContact O-N 2.91Å; R605-E610 HydrophobicContact CB-CB 4.07Å; R605-E610 HydrophobicContact CG-CB 3.81Å; R605-E610 WeakPolarHBondContact CG-OE2 3.39Å; R605-E610 IonicContact NE-OE2 2.6Å; R605-E610 PolarHBondContact NE-OE2 3.45Å
606	T	76.8	Confident	78	Confident	83 Å²	83	77 Å²	77	51%	0.509	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-13.4	170.2	67.5	0	0	0	0	113	H603 Q604	H603-T606 PolarHBondContact CE1-OG1 3.38Å; H603-T606 VanDerWaalsContact CE1-OG1 3.31Å; H603-T606 PolarHBondContact ND1-OG1 3.24Å; H603-T606 WeakPolarHBondContact O-CB 3.28Å; H603-T606 PolarHBondContact O-N 2.98Å; H603-T606 PolarHBondContact O-OG1 3.07Å; Q604-T606 PolarHBondContact O-N 3.46Å
607	H	78.8	Confident	78.8	Confident	76 Å²	76	75.2 Å²	75.2	35%	0.352	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-48.7	171.7	-55.2	-52.4	0	0	0	110.5	C587 E589 C590 H603 Q604 G609	C587-H607 PolarHBondContact SG-NE2 3.45Å; C587-H607 VanDerWaalsContact SG-NE2 3.42Å; E589-H607 WeakPolarHBondContact OE1-CB 3.42Å; E589-H607 IonicContact OE2-CD2 2.68Å; E589-H607 PolarHBondContact OE2-CD2 3.41Å; E589-H607 IonicContact OE2-CG 3.01Å; C590-H607 PolarHBondContact SG-NE2 3.41Å; H603-H607 AromaticContact CE1-CE1 3.69Å; H603-H607 AromaticContact CE1-NE2 3.41Å; H603-H607 PolarHBondContact CE1-NE2 3.34Å; H603-H607 AromaticContact NE2-CE1 3.86Å; H603-H607 AromaticContact NE2-NE2 3.26Å; H603-H607 PolarHBondContact NE2-NE2 3.27Å; Q604-H607 PolarHBondContact O-N 3.34Å; H607-G609 PolarHBondContact O-N 2.9Å
608	T	76.6	Confident	79.5	Confident	78 Å²	78	68.4 Å²	68.4	48%	0.479	38%	0.379	S	S	.	.	S	Bend	trans	-70.9	-10	177	67.5	0	0	0	0	114.1	Q604 E610	Q604-T608 PolarHBondContact O-N 3.23Å; T608-E610 PolarHBondContact O-N 3.43Å; T608-E610 VanDerWaalsContact O-N 3.12Å; T608-E610 WeakPolarHBondContact OG1-CG 3.25Å; T608-E610 PolarHBondContact OG1-OE1 3.38Å
609	G	75.8	Confident	80.1	Confident	44 Å²	44	67.4 Å²	67.4	45%	0.454	39%	0.387	S	S	.	.			trans	69.3	2.3	-178.4	0	0	0	0	0	115.2	R605 H607 K611	R605-G609 PolarHBondContact O-N 2.91Å; H607-G609 PolarHBondContact O-N 2.9Å; G609-K611 PolarHBondContact O-N 3.34Å
610	E	77	Confident	80.5	Confident	86 Å²	86	70.7 Å²	70.7	40%	0.402	40%	0.401	S	S	.	.			trans	-49.7	128.4	-176.3	-91.1	169.5	-116.6	0	0	113.9	R605 T608 S623	R605-E610 HydrophobicContact CB-CB 4.07Å; R605-E610 HydrophobicContact CG-CB 3.81Å; R605-E610 WeakPolarHBondContact CG-OE2 3.39Å; R605-E610 IonicContact NE-OE2 2.6Å; R605-E610 PolarHBondContact NE-OE2 3.45Å; T608-E610 PolarHBondContact O-N 3.43Å; T608-E610 VanDerWaalsContact O-N 3.12Å; T608-E610 WeakPolarHBondContact OG1-CG 3.25Å; T608-E610 PolarHBondContact OG1-OE1 3.38Å; E610-S623 VanDerWaalsContact O-CB 3.28Å; E610-S623 WeakPolarHBondContact O-CB 3.33Å
611	K	80.4	Confident	80.9	Confident	126 Å²	126	72.4 Å²	72.4	55%	0.548	41%	0.414	S	S	.	.			trans	-128.4	72	177.2	-71.6	157.9	-178	173.8	0	111.1	G609 F613 S621 F622	G609-K611 PolarHBondContact O-N 3.34Å; K611-F613 PolarHBondContact O-N 3.46Å; K611-F613 VanDerWaalsContact O-N 3.12Å; K611-S621 VanDerWaalsContact CB-CB 3.47Å; K611-S621 WeakPolarHBondContact CD-O 3.5Å; K611-S621 WeakPolarHBondContact O-CB 3.34Å; K611-F622 CarbonylContact C-O 3.51Å; K611-F622 VanDerWaalsContact CA-O 3.29Å; K611-F622 WeakPolarHBondContact CA-O 3.34Å
612	P	81.9	Confident	81.2	Confident	66 Å²	66	71.7 Å²	71.7	43%	0.429	41%	0.406	S	S	.	.			trans	-69.4	-10.8	-170.9	-20.1	34.3	0	0	0	115.2
613	F	82.8	Confident	81.1	Confident	76 Å²	76	68.6 Å²	68.6	33%	0.333	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	88.9	-174.9	-57.2	-80.8	0	0	0	109.9	K611 F622 L628	K611-F613 PolarHBondContact O-N 3.46Å; K611-F613 VanDerWaalsContact O-N 3.12Å; F613-F622 HydrophobicContact CB-CB 4.4Å; F613-F622 WeakPolarHBondContact CB-O 3.38Å; F613-F622 WeakPolarHBondContact CD2-O 3.44Å; F613-F622 PolarHBondContact N-O 2.9Å; F613-F622 PolarHBondContact O-N 3.44Å; F613-L628 HydrophobicContact CB-CB 4.1Å; F613-L628 HydrophobicContact CB-CD2 3.89Å
614	T	82.9	Confident	81.1	Confident	88 Å²	88	71.2 Å²	71.2	54%	0.54	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	144.4	178.4	49.7	0	0	0	0	112.1	L628	T614-L628 WeakPolarHBondContact O-CD2 3.46Å
615	C	87.8	Confident	81.2	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.007	41%	0.406	C	S	.	.			trans	-91.8	110.3	171.9	-170.3	0	0	0	0	110.5	T617 C618 G619 K620 F622 L628	C615-T617 PolarHBondContact O-N 2.91Å; C615-T617 VanDerWaalsContact O-N 3.15Å; C615-C618 PolarHBondContact O-N 2.99Å; C615-G619 WeakPolarHBondContact O-CA 3.28Å; C615-G619 PolarHBondContact O-N 2.91Å; C615-K620 WeakPolarHBondContact CB-O 3.44Å; C615-K620 PolarHBondContact N-O 3.39Å; C615-F622 HydrophobicContact CB-CE2 4.48Å; C615-L628 HydrophobicContact CB-CD1 3.53Å
616	A	81.8	Confident	81.2	Confident	103 Å²	103	72 Å²	72	85%	0.851	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-35.5	178.3	0	0	0	0	0	113.2	C618	A616-C618 PolarHBondContact O-N 2.88Å
617	T	79.6	Confident	81.4	Confident	93 Å²	93	70.4 Å²	70.4	57%	0.571	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-18.6	-176.2	-37.4	0	0	0	0	114.6	C615 H635	C615-T617 PolarHBondContact O-N 2.91Å; C615-T617 VanDerWaalsContact O-N 3.15Å; T617-H635 HydrophobicContact CG2-CB 4.09Å
618	C	86	Confident	81.6	Confident	47 Å²	47	67.8 Å²	67.8	32%	0.318	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.3	15.2	-176.8	72.6	0	0	0	0	116.1	C615 A616 K620 H631 H635	C615-C618 PolarHBondContact O-N 2.99Å; A616-C618 PolarHBondContact O-N 2.88Å; C618-K620 PolarHBondContact O-N 3.01Å; C618-H631 PolarHBondContact SG-NE2 2.7Å; C618-H635 WeakPolarHBondContact CB-NE2 3.31Å; C618-H635 PolarHBondContact SG-NE2 3.27Å
619	G	82.8	Confident	81.9	Confident	55 Å²	55	68.5 Å²	68.5	57%	0.567	39%	0.392	S	S	*	.			trans	68.7	-8.1	179.3	0	0	0	0	0	116.3	C615 S621	C615-G619 WeakPolarHBondContact O-CA 3.28Å; C615-G619 PolarHBondContact O-N 2.91Å; G619-S621 PolarHBondContact O-N 3.47Å; G619-S621 PolarHBondContact O-OG 3.45Å
620	K	85.6	Confident	82.3	Confident	124 Å²	124	74.2 Å²	74.2	54%	0.539	40%	0.4	S	S	.	.			trans	-67.5	121.5	-173	-71.4	179.5	-177.8	176.4	0	112.3	C615 C618 F622	C615-K620 WeakPolarHBondContact CB-O 3.44Å; C615-K620 PolarHBondContact N-O 3.39Å; C618-K620 PolarHBondContact O-N 3.01Å; K620-F622 HydrophobicContact CB-CE2 3.92Å; K620-F622 HydrophobicContact CB-CZ 4.08Å; K620-F622 WeakPolarHBondContact O-CD2 3.39Å; K620-F622 WeakPolarHBondContact O-CE2 3.26Å
621	S	85.3	Confident	82.6	Confident	52 Å²	52	71.6 Å²	71.6	36%	0.364	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	136	-176.3	-35.3	0	0	0	0	112.6	K611 G619	K611-S621 VanDerWaalsContact CB-CB 3.47Å; K611-S621 WeakPolarHBondContact CD-O 3.5Å; K611-S621 WeakPolarHBondContact O-CB 3.34Å; G619-S621 PolarHBondContact O-N 3.47Å; G619-S621 PolarHBondContact O-OG 3.45Å
622	F	83.7	Confident	82.6	Confident	46 Å²	46	69.3 Å²	69.3	20%	0.202	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147	-179.3	-58.3	-89	0	0	0	111.8	K611 F613 C615 K620 R624 H627 L628 H631	K611-F622 CarbonylContact C-O 3.51Å; K611-F622 VanDerWaalsContact CA-O 3.29Å; K611-F622 WeakPolarHBondContact CA-O 3.34Å; F613-F622 HydrophobicContact CB-CB 4.4Å; F613-F622 WeakPolarHBondContact CB-O 3.38Å; F613-F622 WeakPolarHBondContact CD2-O 3.44Å; F613-F622 PolarHBondContact N-O 2.9Å; F613-F622 PolarHBondContact O-N 3.44Å; C615-F622 HydrophobicContact CB-CE2 4.48Å; K620-F622 HydrophobicContact CB-CE2 3.92Å; K620-F622 HydrophobicContact CB-CZ 4.08Å; K620-F622 WeakPolarHBondContact O-CD2 3.39Å; K620-F622 WeakPolarHBondContact O-CE2 3.26Å; F622-R624 VanDerWaalsContact C-N 3.28Å; F622-R624 PolarHBondContact O-N 2.91Å; F622-H627 HydrophobicContact CB-CB 4.13Å; F622-H627 HydrophobicContact CD1-CB 3.76Å; F622-H627 HydrophobicContact CG-CB 4.13Å; F622-L628 HydrophobicContact CD2-CB 3.99Å; F622-L628 HydrophobicContact CD2-CD1 4.16Å; F622-L628 HydrophobicContact CE2-CD1 4.31Å; F622-L628 HydrophobicContact CG-CB 4.47Å; F622-H631 HydrophobicContact CE1-CB 4.32Å; F622-H631 HydrophobicContact CE2-CB 3.97Å; F622-H631 AromaticContact CE2-CD2 3.34Å; F622-H631 WeakPolarHBondContact CE2-CD2 3.28Å; F622-H631 AromaticContact CE2-CG 3.82Å; F622-H631 HydrophobicContact CZ-CB 3.65Å; F622-H631 AromaticContact CZ-CD2 3.37Å; F622-H631 WeakPolarHBondContact CZ-CD2 3.2Å; F622-H631 AromaticContact CZ-CG 3.46Å; F622-H631 VanDerWaalsContact CZ-CG 3.46Å
623	S	79.1	Confident	82.6	Confident	39 Å²	39	74.7 Å²	74.7	27%	0.273	39%	0.39	S	S	.	.	S	Bend	trans	-80.5	-5.3	175.7	56.8	0	0	0	0	114	E610	E610-S623 VanDerWaalsContact O-CB 3.28Å; E610-S623 WeakPolarHBondContact O-CB 3.33Å
624	R	80.1	Confident	82.4	Confident	82 Å²	82	75.2 Å²	75.2	31%	0.309	40%	0.399	S	S	.	.	S	Bend	trans	-143.7	128.9	-177.7	-55.6	-175.7	-176.5	-176.1	0.7	111.2	F622 Y626 H627 L628	F622-R624 VanDerWaalsContact C-N 3.28Å; F622-R624 PolarHBondContact O-N 2.91Å; R624-Y626 VanDerWaalsContact C-N 3.33Å; R624-Y626 HydrophobicContact CB-CD1 4.12Å; R624-Y626 HydrophobicContact CB-CE1 3.87Å; R624-Y626 WeakPolarHBondContact CD-OH 3.35Å; R624-Y626 HydrophobicContact CG-CE1 4.33Å; R624-Y626 PolarHBondContact NH1-OH 2.76Å; R624-Y626 PolarHBondContact O-N 3.48Å; R624-H627 WeakPolarHBondContact O-CB 3.45Å; R624-H627 PolarHBondContact O-N 3.21Å; R624-L628 PolarHBondContact O-N 3.27Å
625	G	79.4	Confident	82.1	Confident	20 Å²	20	74.3 Å²	74.3	21%	0.206	39%	0.389	C	S	.	.	H	α-helix	trans	-57.7	-36.2	-177.6	0	0	0	0	0	115	H627 L628 I629	G625-H627 VanDerWaalsContact C-N 3.26Å; G625-H627 PolarHBondContact O-N 2.91Å; G625-L628 WeakPolarHBondContact O-CA 3.4Å; G625-L628 WeakPolarHBondContact O-CB 3.31Å; G625-L628 PolarHBondContact O-N 3.1Å; G625-L628 VanDerWaalsContact O-N 3.08Å; G625-I629 WeakPolarHBondContact O-CG1 3.26Å; G625-I629 PolarHBondContact O-N 3.33Å
626	Y	80.9	Confident	81.1	Confident	126 Å²	126	79.2 Å²	79.2	49%	0.494	42%	0.419	S	S	.	.	H	α-helix	trans	-69.9	-20.9	177.3	76	-94.1	0	0	0	113.5	R624 R630	R624-Y626 VanDerWaalsContact C-N 3.33Å; R624-Y626 HydrophobicContact CB-CD1 4.12Å; R624-Y626 HydrophobicContact CB-CE1 3.87Å; R624-Y626 WeakPolarHBondContact CD-OH 3.35Å; R624-Y626 HydrophobicContact CG-CE1 4.33Å; R624-Y626 PolarHBondContact NH1-OH 2.76Å; R624-Y626 PolarHBondContact O-N 3.48Å; Y626-R630 WeakPolarHBondContact O-CB 3.36Å; Y626-R630 PolarHBondContact O-N 2.82Å
627	H	82.1	Confident	79.9	Confident	50 Å²	50	77.3 Å²	77.3	23%	0.231	41%	0.409	C	S	.	.	H	α-helix	trans	-72.1	-38.7	168.7	-71.4	176.1	0	0	0	111.1	F622 R624 G625 H631	F622-H627 HydrophobicContact CB-CB 4.13Å; F622-H627 HydrophobicContact CD1-CB 3.76Å; F622-H627 HydrophobicContact CG-CB 4.13Å; R624-H627 WeakPolarHBondContact O-CB 3.45Å; R624-H627 PolarHBondContact O-N 3.21Å; G625-H627 VanDerWaalsContact C-N 3.26Å; G625-H627 PolarHBondContact O-N 2.91Å; H627-H631 VanDerWaalsContact O-CB 3.25Å; H627-H631 WeakPolarHBondContact O-CB 3.29Å; H627-H631 PolarHBondContact O-N 2.71Å
628	L	82.4	Confident	78.6	Confident	21 Å²	21	81 Å²	81	11%	0.11	42%	0.418	C	S	.	.	H	α-helix	trans	-62.3	-48.8	172	171.5	61.4	0	0	0	111.2	F613 T614 C615 F622 R624 G625 R630 H631 Q632	F613-L628 HydrophobicContact CB-CB 4.1Å; F613-L628 HydrophobicContact CB-CD2 3.89Å; T614-L628 WeakPolarHBondContact O-CD2 3.46Å; C615-L628 HydrophobicContact CB-CD1 3.53Å; F622-L628 HydrophobicContact CD2-CB 3.99Å; F622-L628 HydrophobicContact CD2-CD1 4.16Å; F622-L628 HydrophobicContact CE2-CD1 4.31Å; F622-L628 HydrophobicContact CG-CB 4.47Å; R624-L628 PolarHBondContact O-N 3.27Å; G625-L628 WeakPolarHBondContact O-CA 3.4Å; G625-L628 WeakPolarHBondContact O-CB 3.31Å; G625-L628 PolarHBondContact O-N 3.1Å; G625-L628 VanDerWaalsContact O-N 3.08Å; L628-R630 VanDerWaalsContact C-N 3.34Å; L628-R630 PolarHBondContact O-N 2.92Å; L628-H631 CarbonylContact O-C 3.59Å; L628-H631 WeakPolarHBondContact O-CA 3.46Å; L628-H631 WeakPolarHBondContact O-CB 3.29Å; L628-H631 PolarHBondContact O-N 3.37Å; L628-Q632 HydrophobicContact CD1-CG 3.95Å; L628-Q632 HydrophobicContact CG-CG 4.39Å; L628-Q632 WeakPolarHBondContact O-CG 3.39Å; L628-Q632 PolarHBondContact O-N 3.11Å
629	I	82.9	Confident	76.7	Confident	93 Å²	93	84.4 Å²	84.4	48%	0.477	44%	0.437	S	S	.	.	H	α-helix	trans	-59.8	-43.3	178.4	-65.1	166.3	0	0	0	111.3	G625 H631 Q632	G625-I629 WeakPolarHBondContact O-CG1 3.26Å; G625-I629 PolarHBondContact O-N 3.33Å; I629-H631 VanDerWaalsContact C-N 3.28Å; I629-H631 PolarHBondContact O-N 3.2Å; I629-Q632 PolarHBondContact O-N 3.34Å
630	R	83.4	Confident	74.9	Confident	165 Å²	165	91.5 Å²	91.5	62%	0.623	45%	0.452	S	S	*	.	H	α-helix	trans	-64.6	-33.7	174.5	-172.4	179.1	67.5	-179.8	1.2	112.1	Y626 L628	Y626-R630 WeakPolarHBondContact O-CB 3.36Å; Y626-R630 PolarHBondContact O-N 2.82Å; L628-R630 VanDerWaalsContact C-N 3.34Å; L628-R630 PolarHBondContact O-N 2.92Å
631	H	82.9	Confident	72.5	Confident	30 Å²	30	95.6 Å²	95.6	14%	0.139	49%	0.488	C	S	.	.	H	α-helix	trans	-74.2	-39	177.9	177.1	48.7	0	0	0	113	C618 F622 H627 L628 I629 R633 V634 H635	C618-H631 PolarHBondContact SG-NE2 2.7Å; F622-H631 HydrophobicContact CE1-CB 4.32Å; F622-H631 HydrophobicContact CE2-CB 3.97Å; F622-H631 AromaticContact CE2-CD2 3.34Å; F622-H631 WeakPolarHBondContact CE2-CD2 3.28Å; F622-H631 AromaticContact CE2-CG 3.82Å; F622-H631 HydrophobicContact CZ-CB 3.65Å; F622-H631 AromaticContact CZ-CD2 3.37Å; F622-H631 WeakPolarHBondContact CZ-CD2 3.2Å; F622-H631 AromaticContact CZ-CG 3.46Å; F622-H631 VanDerWaalsContact CZ-CG 3.46Å; H627-H631 VanDerWaalsContact O-CB 3.25Å; H627-H631 WeakPolarHBondContact O-CB 3.29Å; H627-H631 PolarHBondContact O-N 2.71Å; L628-H631 CarbonylContact O-C 3.59Å; L628-H631 WeakPolarHBondContact O-CA 3.46Å; L628-H631 WeakPolarHBondContact O-CB 3.29Å; L628-H631 PolarHBondContact O-N 3.37Å; I629-H631 VanDerWaalsContact C-N 3.28Å; I629-H631 PolarHBondContact O-N 3.2Å; H631-R633 PolarHBondContact O-N 3.25Å; H631-V634 VanDerWaalsContact O-CB 3.24Å; H631-V634 WeakPolarHBondContact O-CB 3.4Å; H631-V634 WeakPolarHBondContact O-CG2 3.37Å; H631-V634 PolarHBondContact O-N 2.88Å; H631-H635 AromaticContact CE1-NE2 3.98Å
632	Q	80.9	Confident	71.8	Confident	79 Å²	79	97.8 Å²	97.8	37%	0.369	49%	0.494	S	S	.	.	H	α-helix	trans	-57.1	-35.1	176.6	-75	167.8	-53.9	0	0	112	L628 I629 V634 H635 T636	L628-Q632 HydrophobicContact CD1-CG 3.95Å; L628-Q632 HydrophobicContact CG-CG 4.39Å; L628-Q632 WeakPolarHBondContact O-CG 3.39Å; L628-Q632 PolarHBondContact O-N 3.11Å; I629-Q632 PolarHBondContact O-N 3.34Å; Q632-V634 PolarHBondContact O-N 3.5Å; Q632-V634 VanDerWaalsContact O-N 3.14Å; Q632-H635 WeakPolarHBondContact O-CB 3.19Å; Q632-H635 PolarHBondContact O-N 3.4Å; Q632-T636 PolarHBondContact O-N 2.66Å
633	R	82	Confident	71.2	Confident	179 Å²	179	100.5 Å²	100.5	68%	0.675	51%	0.509	S	S	*	.	H	α-helix	trans	-60.2	-19.8	173.2	-64.6	177.7	-174.9	-166.2	-2.1	114.5	H631 T636 G637	H631-R633 PolarHBondContact O-N 3.25Å; R633-T636 WeakPolarHBondContact CA-OG1 3.37Å; R633-T636 PolarHBondContact O-OG1 2.82Å; R633-G637 PolarHBondContact O-N 3.24Å; R633-G637 VanDerWaalsContact O-N 3.15Å
634	V	79.5	Confident	70.8	Confident	86 Å²	86	103.9 Å²	103.9	52%	0.521	52%	0.522	S	S	.	.	H	α-helix	trans	-78.3	-26.2	175.8	-173.1	0	0	0	0	111.4	H631 Q632	H631-V634 VanDerWaalsContact O-CB 3.24Å; H631-V634 WeakPolarHBondContact O-CB 3.4Å; H631-V634 WeakPolarHBondContact O-CG2 3.37Å; H631-V634 PolarHBondContact O-N 2.88Å; Q632-V634 PolarHBondContact O-N 3.5Å; Q632-V634 VanDerWaalsContact O-N 3.14Å
635	H	76.1	Confident	70.2	Confident	69 Å²	69	105.2 Å²	105.2	32%	0.319	54%	0.535	S	S	.	.	H	α-helix	trans	-77.4	-47.6	172.9	-59.8	-56.2	0	0	0	111	T617 C618 H631 Q632 G637 K638	T617-H635 HydrophobicContact CG2-CB 4.09Å; C618-H635 WeakPolarHBondContact CB-NE2 3.31Å; C618-H635 PolarHBondContact SG-NE2 3.27Å; H631-H635 AromaticContact CE1-NE2 3.98Å; Q632-H635 WeakPolarHBondContact O-CB 3.19Å; Q632-H635 PolarHBondContact O-N 3.4Å; H635-G637 PolarHBondContact O-N 2.71Å; H635-G637 VanDerWaalsContact O-N 3.16Å; H635-K638 PolarHBondContact O-N 3.46Å
636	T	65.9	Low	69.7	Low	105 Å²	105	110.5 Å²	110.5	64%	0.644	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-10.4	176.6	65	0	0	0	0	113.6	Q632 R633	Q632-T636 PolarHBondContact O-N 2.66Å; R633-T636 WeakPolarHBondContact CA-OG1 3.37Å; R633-T636 PolarHBondContact O-OG1 2.82Å
637	G	57	Low	68.9	Low	62 Å²	62	109.5 Å²	109.5	64%	0.639	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	2.1	178.5	0	0	0	0	0	115.2	R633 H635	R633-G637 PolarHBondContact O-N 3.24Å; R633-G637 VanDerWaalsContact O-N 3.15Å; H635-G637 PolarHBondContact O-N 2.71Å; H635-G637 VanDerWaalsContact O-N 3.16Å
638	K	52.2	Low	68	Low	172 Å²	172	113.7 Å²	113.7	75%	0.748	58%	0.583	S	S	*	*	S	Bend	trans	-107.9	-10.6	-177.8	-78	-161.9	168.6	-160.9	0	115.6	H635 K640	H635-K638 PolarHBondContact O-N 3.46Å; K638-K640 PolarHBondContact O-N 2.6Å
639	T	47.3	Very low	66.9	Low	118 Å²	118	120.8 Å²	120.8	72%	0.724	62%	0.619	S	S	*	*			trans	-90.4	73.6	175.3	50.1	0	0	0	0	110.5
640	K	43.6	Very low	65.5	Low	203 Å²	203	123.2 Å²	123.2	88%	0.883	63%	0.631	S	S	*	*			trans	-138.8	90.6	159.9	-93.5	-156.1	171.7	-164.7	0	109	K638	K638-K640 PolarHBondContact O-N 2.6Å
641	T	35.3	Very low	63.9	Low	210 Å²	210	119.4 Å²	119.4	100%	1.288	63%	0.632	S	S	*	*			trans	-143	0	166.5	48.7	0	0	0	0	105.1

Retrieved 641 of 641 residues in 241.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).