A0A3Q0KCQ8_SCHMA Loading...

Putative gtp-binding protein hflx

AlphaFold DB , UniProt , Accession A0A3Q0KCQ8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 559 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.2	Very low	31.7	Very low	238 Å²	238	188.9 Å²	188.9	100%	1.172	88%	0.876	S	S	*	*				0	-6.2	0	-85.7	-177.1	178.8	0	0	115	R3	M1-R3 VanDerWaalsContact C-N 3.35Å; M1-R3 PolarHBondContact O-N 3.24Å; M1-R3 VanDerWaalsContact O-N 3.14Å
2	F	35.4	Very low	31.5	Very low	214 Å²	214	188.2 Å²	188.2	94%	0.939	87%	0.869	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	31.7	-173.1	-76.9	-81.2	0	0	0	116.8
3	R	31	Very low	31.5	Very low	237 Å²	237	181.2 Å²	181.2	89%	0.894	85%	0.851	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	0.3	-173	-139	173.7	168.6	175.3	-4.1	116.3	M1	M1-R3 VanDerWaalsContact C-N 3.35Å; M1-R3 PolarHBondContact O-N 3.24Å; M1-R3 VanDerWaalsContact O-N 3.14Å
4	N	33.9	Very low	31.3	Very low	153 Å²	153	179.8 Å²	179.8	82%	0.818	85%	0.852	S	S	*	*	S	Bend	trans	-114.1	9.2	-173.3	-83	-10.3	0	0	0	117.1
5	V	38.8	Very low	31.5	Very low	124 Å²	124	182.6 Å²	182.6	75%	0.752	85%	0.851	S	S	*	*	S	Bend	trans	-90.6	-10	177.2	-172.7	0	0	0	0	113	R7	V5-R7 PolarHBondContact O-N 2.93Å
6	G	30.1	Very low	31.2	Very low	74 Å²	74	186.4 Å²	186.4	76%	0.763	86%	0.855	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-2.5	-174.3	0	0	0	0	0	117.5
7	R	31	Very low	31.1	Very low	240 Å²	240	181.5 Å²	181.5	91%	0.906	85%	0.846	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	-0.9	-171.3	-79.2	-171.6	-179.5	177.8	0.7	116.7	V5	V5-R7 PolarHBondContact O-N 2.93Å
8	L	31.4	Very low	31.4	Very low	163 Å²	163	176.2 Å²	176.2	85%	0.853	83%	0.832	S	S	*	*	S	Bend	trans	-104.4	-3.2	179.2	-100.7	111.9	0	0	0	116.2	R10	L8-R10 PolarHBondContact O-N 3.14Å
9	F	29.6	Very low	31.7	Very low	181 Å²	181	172.3 Å²	172.3	79%	0.794	83%	0.826	S	S	*	*			trans	-101.1	67.8	175.1	-78.1	-81.5	0	0	0	111.9
10	R	26.2	Very low	31.6	Very low	233 Å²	233	171.3 Å²	171.3	88%	0.879	82%	0.824	S	S	*	*			trans	-132.7	71.8	159.7	-80	-170	-174.1	165.2	0.6	109.5	L8	L8-R10 PolarHBondContact O-N 3.14Å
11	Y	30.1	Very low	31.9	Very low	221 Å²	221	166 Å²	166	87%	0.867	80%	0.802	S	S	*	*			trans	-145.1	90.3	155.2	-110.8	-87.2	0	0	0	106.4	P13	Y11-P13 VanDerWaalsContact O-CD 3.32Å; Y11-P13 WeakPolarHBondContact O-CD 3.49Å
12	F	29.4	Very low	32.8	Very low	180 Å²	180	158.9 Å²	158.9	79%	0.789	77%	0.769	S	S	*	*			trans	-93.1	104.4	165.7	-90.2	-83.8	0	0	0	106.9
13	P	31	Very low	33.6	Very low	98 Å²	98	151.8 Å²	151.8	64%	0.636	75%	0.75	S	S	*	*			trans	-79.4	146.5	164.1	33.4	-30.5	0	0	0	109.6	Y11	Y11-P13 VanDerWaalsContact O-CD 3.32Å; Y11-P13 WeakPolarHBondContact O-CD 3.49Å
14	D	29.1	Very low	34.6	Very low	161 Å²	161	144 Å²	144	86%	0.861	73%	0.726	S	S	*	*			trans	-49	133.1	-172.4	-87.1	-48.8	0	0	0	115.5	R16	D14-R16 VanDerWaalsContact C-N 3.26Å; D14-R16 PolarHBondContact O-N 3.42Å; D14-R16 VanDerWaalsContact O-N 3.1Å
15	R	33.9	Very low	35.7	Very low	222 Å²	222	137.4 Å²	137.4	84%	0.838	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	17.1	-177.3	-80	-166.3	-177.2	-161	3	116
16	R	27.4	Very low	36.7	Very low	243 Å²	243	135.5 Å²	135.5	92%	0.917	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	-1.7	-174.9	-70.2	-165.1	-157	178.1	8.1	116.9	D14	D14-R16 VanDerWaalsContact C-N 3.26Å; D14-R16 PolarHBondContact O-N 3.42Å; D14-R16 VanDerWaalsContact O-N 3.1Å
17	C	29.6	Very low	38.4	Very low	103 Å²	103	138.1 Å²	138.1	70%	0.696	67%	0.668	S	S	*	*			trans	-123.9	61.8	178.9	-73	0	0	0	0	112.2	V21	C17-V21 HydrophobicContact CB-CG2 4.32Å
18	S	36.1	Very low	39.8	Very low	86 Å²	86	128 Å²	128	60%	0.601	63%	0.633	S	S	*	*	S	Bend	trans	-107.1	-5.8	175.9	68.6	0	0	0	0	115.5	D22	S18-D22 VanDerWaalsContact O-OD2 3.1Å
19	S	37.4	Very low	41.4	Very low	103 Å²	103	121.1 Å²	121.1	72%	0.72	60%	0.596	S	S	*	*	S	Bend	trans	-104.1	-33.3	-177	60.7	0	0	0	0	115
20	L	29.3	Very low	43.1	Very low	151 Å²	151	116.4 Å²	116.4	79%	0.791	58%	0.579	S	S	*	*	S	Bend	trans	-90.7	-19	-176.7	-71.5	169.4	0	0	0	113.8
21	V	38.7	Very low	44.9	Very low	60 Å²	60	109.3 Å²	109.3	36%	0.364	56%	0.556	S	S	.	*	H	α-helix	trans	-83.7	-20.5	-176.9	-176.2	0	0	0	0	112	C17 S25	C17-V21 HydrophobicContact CB-CG2 4.32Å; V21-S25 WeakPolarHBondContact O-CB 3.28Å; V21-S25 PolarHBondContact O-N 3.09Å; V21-S25 VanDerWaalsContact O-N 3.08Å; V21-S25 PolarHBondContact O-OG 2.82Å
22	D	49.9	Very low	46.4	Very low	90 Å²	90	100 Å²	100	48%	0.481	52%	0.521	S	S	.	.	H	α-helix	trans	-73.7	-33.6	-168.5	-73.6	0	0	0	0	113.5	S18 S25 N26	S18-D22 VanDerWaalsContact O-OD2 3.1Å; D22-S25 PolarHBondContact O-OG 2.98Å; D22-N26 WeakPolarHBondContact O-CB 3.31Å; D22-N26 VanDerWaalsContact O-CG 3.26Å; D22-N26 PolarHBondContact O-N 3.44Å; D22-N26 PolarHBondContact O-ND2 3.02Å
23	A	51.8	Low	48	Very low	64 Å²	64	92.7 Å²	92.7	53%	0.529	49%	0.489	S	S	.	.	H	α-helix	trans	-74.7	-42.1	-178.8	0	0	0	0	0	112.5	K27	A23-K27 WeakPolarHBondContact O-CG 3.3Å; A23-K27 PolarHBondContact O-N 3.35Å
24	D	52.4	Low	49.5	Very low	75 Å²	75	94.8 Å²	94.8	40%	0.401	49%	0.489	S	S	.	.	H	α-helix	trans	-82.4	-31.2	-176.7	-70.8	-24.2	0	0	0	112.6	K27 V28	D24-K27 PolarHBondContact O-N 3.49Å; D24-K27 IonicContact OD1-NZ 3.75Å; D24-K27 PolarHBondContact OD1-NZ 3.03Å; D24-V28 WeakPolarHBondContact O-CG2 3.18Å; D24-V28 PolarHBondContact O-N 3.07Å; D24-V28 VanDerWaalsContact O-N 3.1Å
25	S	56.3	Low	51	Low	13 Å²	13	93.1 Å²	93.1	9%	0.091	47%	0.474	C	S	.	.	H	α-helix	trans	-63.6	-41	172.3	57	0	0	0	0	112.4	V21 D22 V28 Y29	V21-S25 WeakPolarHBondContact O-CB 3.28Å; V21-S25 PolarHBondContact O-N 3.09Å; V21-S25 VanDerWaalsContact O-N 3.08Å; V21-S25 PolarHBondContact O-OG 2.82Å; D22-S25 PolarHBondContact O-OG 2.98Å; S25-V28 PolarHBondContact O-N 2.93Å; S25-Y29 WeakPolarHBondContact O-CB 3.18Å; S25-Y29 PolarHBondContact O-N 3.32Å
26	N	60	Low	52.1	Low	84 Å²	84	83.7 Å²	83.7	45%	0.449	44%	0.442	S	S	.	.	H	α-helix	trans	-63.7	-40.4	175.2	-76.2	-35.1	0	0	0	111.9	D22 V28 Y29 D30	D22-N26 WeakPolarHBondContact O-CB 3.31Å; D22-N26 VanDerWaalsContact O-CG 3.26Å; D22-N26 PolarHBondContact O-N 3.44Å; D22-N26 PolarHBondContact O-ND2 3.02Å; N26-V28 PolarHBondContact O-N 3.44Å; N26-Y29 WeakPolarHBondContact O-CB 3.46Å; N26-Y29 PolarHBondContact O-N 3.2Å; N26-D30 WeakPolarHBondContact O-CB 3.46Å; N26-D30 VanDerWaalsContact O-CG 3.28Å; N26-D30 PolarHBondContact O-N 3.3Å
27	K	65.2	Low	53.7	Low	129 Å²	129	72.5 Å²	72.5	56%	0.561	40%	0.4	S	S	*	.	H	α-helix	trans	-60.9	-43.2	174.8	-72.8	174.6	-168	157.3	0	112.5	A23 D24 D30 E31	A23-K27 WeakPolarHBondContact O-CG 3.3Å; A23-K27 PolarHBondContact O-N 3.35Å; D24-K27 PolarHBondContact O-N 3.49Å; D24-K27 IonicContact OD1-NZ 3.75Å; D24-K27 PolarHBondContact OD1-NZ 3.03Å; K27-D30 PolarHBondContact O-N 2.8Å; K27-E31 WeakPolarHBondContact O-CB 3.41Å; K27-E31 PolarHBondContact O-N 2.86Å
28	V	61.7	Low	55	Low	28 Å²	28	72.7 Å²	72.7	17%	0.17	39%	0.393	C	S	.	.	H	α-helix	trans	-64.6	-43.4	178.1	173.1	0	0	0	0	110.6	D24 S25 N26 E31 L32 F235 I244	D24-V28 WeakPolarHBondContact O-CG2 3.18Å; D24-V28 PolarHBondContact O-N 3.07Å; D24-V28 VanDerWaalsContact O-N 3.1Å; S25-V28 PolarHBondContact O-N 2.93Å; N26-V28 PolarHBondContact O-N 3.44Å; V28-E31 PolarHBondContact O-N 3.46Å; V28-L32 HydrophobicContact CG1-CD1 4.04Å; V28-L32 WeakPolarHBondContact O-CB 3.44Å; V28-L32 VanDerWaalsContact O-CG 3.28Å; V28-L32 WeakPolarHBondContact O-CG 3.43Å; V28-L32 PolarHBondContact O-N 2.9Å; V28-F235 HydrophobicContact CG2-CD1 4.21Å; V28-F235 HydrophobicContact CG2-CG 4.41Å; V28-I244 HydrophobicContact CG1-CD1 4.46Å
29	Y	63.7	Low	56.4	Low	19 Å²	19	69.9 Å²	69.9	8%	0.075	37%	0.371	C	S	.	.	H	α-helix	trans	-58.3	-50	174.8	178.2	-95.1	0	0	0	111.5	S25 N26 L32 L33 E208 I209 L212 L245	S25-Y29 WeakPolarHBondContact O-CB 3.18Å; S25-Y29 PolarHBondContact O-N 3.32Å; N26-Y29 WeakPolarHBondContact O-CB 3.46Å; N26-Y29 PolarHBondContact O-N 3.2Å; Y29-L32 PolarHBondContact O-N 2.74Å; Y29-L33 HydrophobicContact CD1-CD1 3.76Å; Y29-L33 HydrophobicContact CD1-CG 4.42Å; Y29-L33 HydrophobicContact CE1-CD1 3.16Å; Y29-L33 HydrophobicContact CE1-CG 4.03Å; Y29-L33 PolarHBondContact O-N 3.5Å; Y29-E208 WeakPolarHBondContact OH-CB 3.36Å; Y29-E208 PolarHBondContact OH-OE2 3.06Å; Y29-I209 HydrophobicContact CE2-CG1 3.98Å; Y29-L212 HydrophobicContact CD2-CD1 3.89Å; Y29-L212 HydrophobicContact CE2-CD1 3.37Å; Y29-L245 HydrophobicContact CD2-CD2 3.95Å; Y29-L245 HydrophobicContact CE2-CD2 4.2Å
30	D	65.6	Low	57.8	Low	81 Å²	81	67.3 Å²	67.3	43%	0.433	35%	0.352	S	S	.	.	H	α-helix	trans	-62.6	-45.4	179.2	-71.5	-17.8	0	0	0	111.3	N26 K27 L32 L33 K34	N26-D30 WeakPolarHBondContact O-CB 3.46Å; N26-D30 VanDerWaalsContact O-CG 3.28Å; N26-D30 PolarHBondContact O-N 3.3Å; K27-D30 PolarHBondContact O-N 2.8Å; D30-L32 VanDerWaalsContact C-N 3.31Å; D30-L32 PolarHBondContact O-N 2.89Å; D30-L33 WeakPolarHBondContact O-CB 3.43Å; D30-L33 PolarHBondContact O-N 3.11Å; D30-K34 VanDerWaalsContact O-CG 3.25Å; D30-K34 WeakPolarHBondContact O-CG 3.43Å; D30-K34 PolarHBondContact O-N 3.1Å
31	E	65	Low	59.6	Low	85 Å²	85	68.9 Å²	68.9	40%	0.397	36%	0.355	S	S	.	.	H	α-helix	trans	-61.8	-39.4	179.1	-166.1	-175	171.1	0	0	112	K27 V28 K34 K35	K27-E31 WeakPolarHBondContact O-CB 3.41Å; K27-E31 PolarHBondContact O-N 2.86Å; V28-E31 PolarHBondContact O-N 3.46Å; E31-K34 PolarHBondContact O-N 3.49Å; E31-K35 HydrophobicContact CG-CD 4.47Å; E31-K35 WeakPolarHBondContact O-CG 3.25Å; E31-K35 PolarHBondContact O-N 2.77Å; E31-K35 WeakPolarHBondContact OE1-CE 3.48Å; E31-K35 IonicContact OE1-NZ 2.84Å; E31-K35 PolarHBondContact OE1-NZ 3.03Å
32	L	61.8	Low	61.4	Low	26 Å²	26	73 Å²	73	14%	0.136	38%	0.376	C	S	.	.	H	α-helix	trans	-64.6	-46.9	175.1	-74.4	169.8	0	0	0	111.4	V28 Y29 D30 K34 K35 S36 L212 F219 L241	V28-L32 HydrophobicContact CG1-CD1 4.04Å; V28-L32 WeakPolarHBondContact O-CB 3.44Å; V28-L32 VanDerWaalsContact O-CG 3.28Å; V28-L32 WeakPolarHBondContact O-CG 3.43Å; V28-L32 PolarHBondContact O-N 2.9Å; Y29-L32 PolarHBondContact O-N 2.74Å; D30-L32 VanDerWaalsContact C-N 3.31Å; D30-L32 PolarHBondContact O-N 2.89Å; L32-K34 VanDerWaalsContact C-N 3.34Å; L32-K34 PolarHBondContact O-N 3.49Å; L32-K35 PolarHBondContact O-N 3.25Å; L32-S36 PolarHBondContact O-N 3.02Å; L32-S36 PolarHBondContact O-OG 3.35Å; L32-L212 HydrophobicContact CB-CD2 4.11Å; L32-F219 HydrophobicContact CD2-CE2 4.45Å; L32-F219 HydrophobicContact CD2-CZ 4.43Å; L32-L241 HydrophobicContact CD1-CD1 3.15Å; L32-L241 HydrophobicContact CD1-CD2 3.81Å; L32-L241 HydrophobicContact CD1-CG 4.11Å; L32-L241 HydrophobicContact CD2-CD2 4.48Å
33	L	61.3	Low	63	Low	25 Å²	25	69.3 Å²	69.3	13%	0.131	36%	0.359	C	S	.	.	H	α-helix	trans	-55.5	-48.9	174.4	-77.4	177.7	0	0	0	111.5	Y29 D30 K35 S36 Y37 E208 L212	Y29-L33 HydrophobicContact CD1-CD1 3.76Å; Y29-L33 HydrophobicContact CD1-CG 4.42Å; Y29-L33 HydrophobicContact CE1-CD1 3.16Å; Y29-L33 HydrophobicContact CE1-CG 4.03Å; Y29-L33 PolarHBondContact O-N 3.5Å; D30-L33 WeakPolarHBondContact O-CB 3.43Å; D30-L33 PolarHBondContact O-N 3.11Å; L33-K35 PolarHBondContact O-N 3.12Å; L33-S36 PolarHBondContact O-N 3.23Å; L33-Y37 HydrophobicContact CD2-CD2 4.34Å; L33-Y37 PolarHBondContact O-N 3.41Å; L33-E208 HydrophobicContact CD2-CB 4.32Å; L33-L212 HydrophobicContact CD2-CD1 3.71Å; L33-L212 HydrophobicContact CD2-CD2 4.11Å; L33-L212 HydrophobicContact CD2-CG 3.99Å; L33-L212 HydrophobicContact CG-CD1 4.08Å
34	K	64.3	Low	64.8	Low	143 Å²	143	67.3 Å²	67.3	62%	0.622	34%	0.338	S	S	*	.	H	α-helix	trans	-58.1	-46	179.8	-64.8	-153.7	-178.3	173.8	0	112.3	D30 E31 L32 S36 L38	D30-K34 VanDerWaalsContact O-CG 3.25Å; D30-K34 WeakPolarHBondContact O-CG 3.43Å; D30-K34 PolarHBondContact O-N 3.1Å; E31-K34 PolarHBondContact O-N 3.49Å; L32-K34 VanDerWaalsContact C-N 3.34Å; L32-K34 PolarHBondContact O-N 3.49Å; K34-S36 VanDerWaalsContact C-N 3.25Å; K34-S36 PolarHBondContact O-N 3.16Å; K34-L38 HydrophobicContact CB-CD1 3.7Å; K34-L38 HydrophobicContact CB-CG 4.4Å; K34-L38 HydrophobicContact CD-CD1 3.74Å; K34-L38 HydrophobicContact CG-CD1 3.41Å; K34-L38 VanDerWaalsContact CG-CD1 3.41Å; K34-L38 HydrophobicContact CG-CG 4.24Å
35	K	60.2	Low	66.6	Low	125 Å²	125	65.6 Å²	65.6	54%	0.543	33%	0.329	S	S	.	.	H	α-helix	trans	-68.5	-22.6	-177.4	-78.2	179.8	-175	165.4	0	114	E31 L32 L33	E31-K35 HydrophobicContact CG-CD 4.47Å; E31-K35 WeakPolarHBondContact O-CG 3.25Å; E31-K35 PolarHBondContact O-N 2.77Å; E31-K35 WeakPolarHBondContact OE1-CE 3.48Å; E31-K35 IonicContact OE1-NZ 2.84Å; E31-K35 PolarHBondContact OE1-NZ 3.03Å; L32-K35 PolarHBondContact O-N 3.25Å; L33-K35 PolarHBondContact O-N 3.12Å
36	S	56.9	Low	68.4	Low	24 Å²	24	65 Å²	65	17%	0.168	33%	0.325	C	S	.	.	H	α-helix	trans	-116	-17.5	-171.1	43.6	0	0	0	0	115.7	L32 L33 K34 R215	L32-S36 PolarHBondContact O-N 3.02Å; L32-S36 PolarHBondContact O-OG 3.35Å; L33-S36 PolarHBondContact O-N 3.23Å; K34-S36 VanDerWaalsContact C-N 3.25Å; K34-S36 PolarHBondContact O-N 3.16Å; S36-R215 PolarHBondContact O-NH1 2.96Å
37	Y	59.9	Low	70	Confident	8 Å²	8	61 Å²	61	3%	0.031	30%	0.303	C	S	.	.	H	α-helix	trans	-147.2	-16.7	-166.1	-59	-83.2	0	0	0	118.2	L33 L39 T185 L211 L212 R215	L33-Y37 HydrophobicContact CD2-CD2 4.34Å; L33-Y37 PolarHBondContact O-N 3.41Å; Y37-L39 PolarHBondContact O-N 3.1Å; Y37-T185 HydrophobicContact CD1-CG2 3.97Å; Y37-T185 HydrophobicContact CE1-CG2 4.48Å; Y37-L211 HydrophobicContact CD1-CD2 3.55Å; Y37-L211 HydrophobicContact CD1-CG 4.1Å; Y37-L211 HydrophobicContact CE1-CB 4.47Å; Y37-L211 HydrophobicContact CE1-CD1 3.81Å; Y37-L211 HydrophobicContact CE1-CD2 3.2Å; Y37-L211 HydrophobicContact CE1-CG 3.22Å; Y37-L211 HydrophobicContact CE2-CG 4.49Å; Y37-L211 HydrophobicContact CG-CD2 4.4Å; Y37-L211 WeakPolarHBondContact OH-CG 3.01Å; Y37-L211 PolarHBondContact OH-O 3.14Å; Y37-L211 VanDerWaalsContact OH-O 3.1Å; Y37-L212 HydrophobicContact CD2-CD2 4.32Å; Y37-L212 HydrophobicContact CE2-CD2 3.71Å; Y37-L212 HydrophobicContact CE2-CG 4.28Å; Y37-R215 VanDerWaalsContact CD1-NH1 3.26Å; Y37-R215 VanDerWaalsContact CZ-CD 3.46Å; Y37-R215 VanDerWaalsContact CZ-CZ 3.47Å; Y37-R215 WeakPolarHBondContact OH-CB 3.2Å; Y37-R215 WeakPolarHBondContact OH-CD 3.39Å; Y37-R215 WeakPolarHBondContact OH-CG 3.35Å; Y37-R215 PolarHBondContact OH-NE 2.75Å; Y37-R215 VanDerWaalsContact OH-NE 3.14Å
38	L	57.2	Low	71.4	Confident	107 Å²	107	54.9 Å²	54.9	56%	0.56	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-54.9	120.1	-175.9	-90.2	175.7	0	0	0	109.6	K34	K34-L38 HydrophobicContact CB-CD1 3.7Å; K34-L38 HydrophobicContact CB-CG 4.4Å; K34-L38 HydrophobicContact CD-CD1 3.74Å; K34-L38 HydrophobicContact CG-CD1 3.41Å; K34-L38 VanDerWaalsContact CG-CD1 3.41Å; K34-L38 HydrophobicContact CG-CG 4.24Å
39	L	65.5	Low	72.9	Confident	27 Å²	27	53.5 Å²	53.5	14%	0.141	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-61.9	135.4	170.3	-58.7	172.9	0	0	0	107.4	Y37 L85 W88 Y181 L186 Q189 L193	Y37-L39 PolarHBondContact O-N 3.1Å; L39-L85 HydrophobicContact CD1-CD2 3.86Å; L39-W88 HydrophobicContact CB-CZ2 3.93Å; L39-W88 HydrophobicContact CD1-CZ2 4.35Å; L39-W88 HydrophobicContact CD2-CH2 3.31Å; L39-W88 HydrophobicContact CD2-CZ2 3.27Å; L39-W88 HydrophobicContact CD2-CZ3 4.31Å; L39-W88 HydrophobicContact CG-CH2 4.48Å; L39-W88 HydrophobicContact CG-CZ2 4.01Å; L39-Y181 HydrophobicContact CD2-CE1 4.23Å; L39-L186 HydrophobicContact CD2-CD2 4.5Å; L39-Q189 HydrophobicContact CD1-CB 3.77Å; L39-Q189 HydrophobicContact CD1-CG 4.31Å; L39-Q189 HydrophobicContact CD2-CG 4.35Å; L39-Q189 HydrophobicContact CG-CB 4.25Å; L39-Q189 HydrophobicContact CG-CG 4.24Å; L39-L193 HydrophobicContact CD1-CD1 3.92Å
40	P	68.2	Low	74.2	Confident	49 Å²	49	53.2 Å²	53.2	32%	0.318	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-63	145.6	174.8	27.8	-35.7	0	0	0	110.6	N42 G43 H44	P40-N42 PolarHBondContact O-N 3.02Å; P40-G43 PolarHBondContact O-N 3.09Å; P40-H44 VanDerWaalsContact CG-NE2 3.27Å; P40-H44 WeakPolarHBondContact CG-NE2 3.28Å
41	E	67	Low	75.2	Confident	184 Å²	184	49.4 Å²	49.4	86%	0.86	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-32	179	-64.4	-175.6	169.4	0	0	112.5	G43	E41-G43 VanDerWaalsContact C-N 3.25Å; E41-G43 PolarHBondContact O-N 3.05Å
42	N	75.6	Confident	75.9	Confident	148 Å²	148	49.9 Å²	49.9	79%	0.791	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-0.6	-176.9	-63.9	-16.7	0	0	0	114.2	P40	P40-N42 PolarHBondContact O-N 3.02Å
43	G	83.2	Confident	76.3	Confident	12 Å²	12	49.2 Å²	49.2	12%	0.124	25%	0.246	C	C	.	.			trans	71.9	179.4	-175.2	0	0	0	0	0	114.9	P40 E41	P40-G43 PolarHBondContact O-N 3.09Å; E41-G43 VanDerWaalsContact C-N 3.25Å; E41-G43 PolarHBondContact O-N 3.05Å
44	H	89.3	Confident	76.3	Confident	22 Å²	22	54.7 Å²	54.7	10%	0.102	27%	0.269	C	S	.	.			trans	-131.4	134.6	178.9	-83.4	-54.8	0	0	0	112.4	P40 I46 W88 T89 T155 A156 Y181	P40-H44 VanDerWaalsContact CG-NE2 3.27Å; P40-H44 WeakPolarHBondContact CG-NE2 3.28Å; H44-I46 HydrophobicContact CB-CD1 4.42Å; H44-I46 HydrophobicContact CB-CG1 3.96Å; H44-W88 HydrophobicContact CB-CD2 4.06Å; H44-W88 HydrophobicContact CB-CE3 4.26Å; H44-W88 HydrophobicContact CB-CH2 4.2Å; H44-W88 HydrophobicContact CB-CZ2 4.13Å; H44-W88 HydrophobicContact CB-CZ3 4.3Å; H44-W88 AromaticContact CD2-CH2 3.53Å; H44-W88 AromaticContact CD2-CZ2 3.48Å; H44-W88 VanDerWaalsContact CD2-CZ2 3.48Å; H44-W88 WeakPolarHBondContact CD2-CZ2 3.39Å; H44-W88 CarbonylContact O-C 3.59Å; H44-W88 WeakPolarHBondContact O-CA 3.46Å; H44-T89 PolarHBondContact O-N 3.28Å; H44-T155 WeakPolarHBondContact CA-OG1 3.05Å; H44-T155 PolarHBondContact ND1-OG1 3.24Å; H44-A156 HydrophobicContact CB-CB 3.86Å; H44-Y181 AromaticContact CD2-CE2 3.95Å
45	D	91.3	Very high	75.7	Confident	39 Å²	39	50.4 Å²	50.4	21%	0.209	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	113.3	160.7	-78.2	-21.4	0	0	0	109	T89 V91 K152 R153 A154 T155 A156	D45-T89 CarbonylContact C-O 3.58Å; D45-T89 WeakPolarHBondContact CA-O 3.46Å; D45-T89 PolarHBondContact OD1-OG1 3.18Å; D45-V91 HydrophobicContact CB-CG2 3.58Å; D45-K152 IonicContact OD1-NZ 3.66Å; D45-R153 WeakPolarHBondContact CB-O 3.48Å; D45-A154 CarbonylContact O-C 3.5Å; D45-A154 WeakPolarHBondContact O-CA 3.48Å; D45-T155 HydrophobicContact CB-CG2 4.45Å; D45-T155 PolarHBondContact N-OG1 2.81Å; D45-T155 PolarHBondContact O-N 3.08Å; D45-T155 PolarHBondContact O-OG1 3Å; D45-A156 PolarHBondContact O-N 3.47Å
46	I	92.6	Very high	75.2	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.7	-166.4	-67.9	163.6	0	0	0	112.3	H44 I48 V82 W88 T89 V91 A156 L158	H44-I46 HydrophobicContact CB-CD1 4.42Å; H44-I46 HydrophobicContact CB-CG1 3.96Å; I46-I48 HydrophobicContact CG2-CG1 4.07Å; I46-V82 HydrophobicContact CB-CG1 4.34Å; I46-V82 HydrophobicContact CD1-CB 4.22Å; I46-V82 HydrophobicContact CD1-CG1 3.44Å; I46-V82 VanDerWaalsContact CD1-CG1 3.44Å; I46-V82 HydrophobicContact CD1-CG2 3.76Å; I46-V82 HydrophobicContact CG1-CG1 4.41Å; I46-V82 HydrophobicContact CG2-CG2 4.45Å; I46-W88 HydrophobicContact CD1-CB 4.45Å; I46-W88 HydrophobicContact CD1-CD2 4.03Å; I46-W88 HydrophobicContact CD1-CE3 3.05Å; I46-W88 HydrophobicContact CD1-CZ3 3.43Å; I46-W88 VanDerWaalsContact CD1-CZ3 3.43Å; I46-W88 HydrophobicContact CG1-CE3 4.17Å; I46-W88 HydrophobicContact CG1-CZ3 4.35Å; I46-T89 PolarHBondContact N-O 2.85Å; I46-V91 PolarHBondContact O-N 3.01Å; I46-A156 WeakPolarHBondContact CA-O 3.44Å; I46-A156 HydrophobicContact CG1-CB 4.17Å; I46-L158 HydrophobicContact CG2-CB 3.67Å
47	V	94.2	Very high	74.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	127.2	159	62.7	0	0	0	0	109.9	G92 I94 V121 Y124 A154 A156 V157 L158	V47-G92 WeakPolarHBondContact CA-O 3.33Å; V47-I94 HydrophobicContact CG2-CD1 3.58Å; V47-I94 HydrophobicContact CG2-CG1 3.85Å; V47-V121 HydrophobicContact CG1-CG2 4.48Å; V47-Y124 HydrophobicContact CB-CD1 4.38Å; V47-Y124 HydrophobicContact CB-CG 4.22Å; V47-Y124 HydrophobicContact CG2-CD1 4.18Å; V47-Y124 HydrophobicContact CG2-CD2 3.82Å; V47-Y124 HydrophobicContact CG2-CE1 4.42Å; V47-Y124 HydrophobicContact CG2-CE2 4.07Å; V47-Y124 HydrophobicContact CG2-CG 3.91Å; V47-A154 HydrophobicContact CB-CB 4.23Å; V47-A154 HydrophobicContact CG1-CB 4.14Å; V47-A156 PolarHBondContact N-O 3.4Å; V47-A156 VanDerWaalsContact N-O 3.11Å; V47-V157 HydrophobicContact CG1-CB 4.26Å; V47-V157 HydrophobicContact CG1-CG1 4.22Å; V47-V157 HydrophobicContact CG1-CG2 3.77Å; V47-V157 WeakPolarHBondContact O-CA 3.25Å; V47-L158 PolarHBondContact O-N 2.9Å
48	I	94	Very high	74.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.3	178.9	-57.8	178.9	0	0	0	108.7	I46 A78 I79 V82 T90 G92 V93 I94 L158 N160	I46-I48 HydrophobicContact CG2-CG1 4.07Å; I48-A78 HydrophobicContact CD1-CB 4.29Å; I48-A78 HydrophobicContact CG2-CB 4.45Å; I48-I79 HydrophobicContact CD1-CG1 3.76Å; I48-V82 HydrophobicContact CD1-CG2 4.31Å; I48-T90 HydrophobicContact CD1-CG2 3.72Å; I48-T90 HydrophobicContact CG1-CG2 4Å; I48-G92 PolarHBondContact N-O 3.13Å; I48-V93 HydrophobicContact CB-CG1 4.46Å; I48-V93 HydrophobicContact CB-CG2 4.33Å; I48-V93 CarbonylContact O-C 3.5Å; I48-V93 VanDerWaalsContact O-CA 3.3Å; I48-V93 WeakPolarHBondContact O-CA 3.39Å; I48-I94 PolarHBondContact O-N 2.92Å; I48-L158 CarbonylContact C-O 3.52Å; I48-L158 WeakPolarHBondContact CA-O 3.5Å; I48-L158 HydrophobicContact CD1-CD2 4.47Å; I48-L158 HydrophobicContact CG1-CB 4.37Å; I48-L158 HydrophobicContact CG1-CD2 4.28Å; I48-N160 HydrophobicContact CG2-CB 4.14Å
49	I	93.6	Very high	73.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	115.3	166.8	-60.6	170.5	0	0	0	107.8	P51 I94 F109 V117 V121 V157 L158 V159 N160 W176	I49-P51 VanDerWaalsContact O-CD 3.26Å; I49-P51 WeakPolarHBondContact O-CD 3.32Å; I49-I94 WeakPolarHBondContact CA-O 3.45Å; I49-F109 HydrophobicContact CD1-CZ 4.32Å; I49-F109 HydrophobicContact CG2-CE1 4.25Å; I49-F109 HydrophobicContact CG2-CZ 3.99Å; I49-V117 HydrophobicContact CD1-CG1 3.64Å; I49-V117 HydrophobicContact CG1-CG1 4.29Å; I49-V121 HydrophobicContact CD1-CG2 4.05Å; I49-V121 HydrophobicContact CG1-CG2 4.48Å; I49-V157 HydrophobicContact CD1-CG1 3.54Å; I49-V157 HydrophobicContact CG1-CG1 3.88Å; I49-L158 PolarHBondContact N-O 3.26Å; I49-V159 HydrophobicContact CD1-CG2 4.24Å; I49-N160 PolarHBondContact O-N 2.81Å; I49-W176 HydrophobicContact CD1-CH2 3.46Å; I49-W176 VanDerWaalsContact CD1-CH2 3.46Å; I49-W176 HydrophobicContact CD1-CZ2 4.26Å; I49-W176 HydrophobicContact CD1-CZ3 3.92Å
50	Q	90.8	Very high	72.9	Confident	12 Å²	12	64.4 Å²	64.4	6%	0.056	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	105.2	177.7	-177.9	63.1	32.4	0	0	110.5	P73 V75 V93 I94 F95 C96 N160	Q50-P73 PolarHBondContact NE2-O 2.77Å; Q50-V75 HydrophobicContact CB-CG2 4.11Å; Q50-V75 HydrophobicContact CG-CG2 3.43Å; Q50-V75 VanDerWaalsContact CG-CG2 3.43Å; Q50-V93 HydrophobicContact CB-CG1 3.89Å; Q50-I94 PolarHBondContact N-O 3.48Å; Q50-F95 HydrophobicContact CB-CD1 3.78Å; Q50-F95 HydrophobicContact CB-CE1 3.98Å; Q50-F95 HydrophobicContact CB-CG 4.39Å; Q50-F95 HydrophobicContact CG-CD1 3.68Å; Q50-F95 HydrophobicContact CG-CE1 3.71Å; Q50-F95 WeakPolarHBondContact O-CA 3.28Å; Q50-C96 PolarHBondContact O-N 2.93Å; Q50-N160 PolarHBondContact OE1-ND2 3.4Å
51	P	86.7	Confident	71.9	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.006	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	135.4	172.9	32	-32.9	0	0	0	111	I49 C96 I98 N160 W161	I49-P51 VanDerWaalsContact O-CD 3.26Å; I49-P51 WeakPolarHBondContact O-CD 3.32Å; P51-C96 CarbonylContact C-O 3.54Å; P51-C96 WeakPolarHBondContact CA-O 3.35Å; P51-I98 HydrophobicContact CB-CD1 3.42Å; P51-I98 VanDerWaalsContact CB-CD1 3.42Å; P51-I98 HydrophobicContact CB-CG1 3.88Å; P51-N160 WeakPolarHBondContact CD-O 3.28Å; P51-N160 WeakPolarHBondContact CG-O 3.42Å; P51-W161 HydrophobicContact CB-CE3 4.3Å; P51-W161 HydrophobicContact CB-CZ3 4.46Å; P51-W161 HydrophobicContact CG-CE3 3.65Å; P51-W161 HydrophobicContact CG-CZ3 4.17Å
52	H	80.5	Confident	71	Confident	95 Å²	95	56.5 Å²	56.5	44%	0.44	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.3	169.4	-171.3	58.5	0	0	0	109.8	D72 C96 N97 I98	H52-D72 IonicContact CE1-OD2 3.9Å; H52-D72 IonicContact ND1-OD2 2.93Å; H52-C96 PolarHBondContact N-O 3.15Å; H52-N97 WeakPolarHBondContact O-CA 3.5Å; H52-I98 PolarHBondContact O-N 2.83Å
53	I	70.1	Confident	69.8	Low	12 Å²	12	56.6 Å²	56.6	6%	0.062	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	126.2	179.8	-52.9	173.7	0	0	0	108.2	G55 Y58 I61 W161	I53-G55 PolarHBondContact O-N 2.83Å; I53-G55 VanDerWaalsContact O-N 3.14Å; I53-Y58 HydrophobicContact CB-CD2 4.32Å; I53-Y58 HydrophobicContact CD1-CD2 4.04Å; I53-Y58 HydrophobicContact CD1-CE2 4.11Å; I53-Y58 HydrophobicContact CG2-CD2 4.22Å; I53-I61 HydrophobicContact CG2-CD1 4.42Å; I53-W161 HydrophobicContact CD1-CH2 3.72Å; I53-W161 HydrophobicContact CD1-CZ3 3.77Å; I53-W161 HydrophobicContact CG1-CH2 4.45Å; I53-W161 HydrophobicContact CG1-CZ3 4.24Å
54	K	60	Low	68	Low	141 Å²	141	63.8 Å²	63.8	61%	0.613	32%	0.322	S	S	*	.			trans	-61	120.4	174.6	-68.2	-169.6	176	-170.1	0	110.9	A56 L57	K54-A56 VanDerWaalsContact C-N 3.3Å; K54-A56 PolarHBondContact O-N 3.17Å; K54-L57 PolarHBondContact O-N 3.15Å
55	G	52.6	Low	66	Low	53 Å²	53	66.2 Å²	66.2	55%	0.546	33%	0.332	S	S	.	.	H	α-helix	trans	-54.6	-27.9	-169	0	0	0	0	0	117.5	I53 L57 Y58	I53-G55 PolarHBondContact O-N 2.83Å; I53-G55 VanDerWaalsContact O-N 3.14Å; G55-L57 VanDerWaalsContact C-N 3.27Å; G55-L57 PolarHBondContact O-N 2.82Å; G55-Y58 WeakPolarHBondContact O-CB 3.26Å; G55-Y58 PolarHBondContact O-N 2.82Å
56	A	50.6	Low	63.8	Low	96 Å²	96	69.5 Å²	69.5	79%	0.793	36%	0.356	S	S	*	.	H	α-helix	trans	-66	-28.6	176.5	0	0	0	0	0	113.2	K54	K54-A56 VanDerWaalsContact C-N 3.3Å; K54-A56 PolarHBondContact O-N 3.17Å
57	L	46.3	Very low	61.5	Low	83 Å²	83	76 Å²	76	44%	0.435	38%	0.381	S	S	.	.	H	α-helix	trans	-82.6	-32.3	176.7	-84.6	154.8	0	0	0	111.5	K54 G55 K59 R60 I61	K54-L57 PolarHBondContact O-N 3.15Å; G55-L57 VanDerWaalsContact C-N 3.27Å; G55-L57 PolarHBondContact O-N 2.82Å; L57-K59 PolarHBondContact O-N 2.9Å; L57-R60 WeakPolarHBondContact O-CB 3.36Å; L57-R60 PolarHBondContact O-N 2.85Å; L57-I61 VanDerWaalsContact C-CD1 3.45Å; L57-I61 HydrophobicContact CB-CD1 4.02Å; L57-I61 WeakPolarHBondContact O-CD1 3.46Å; L57-I61 WeakPolarHBondContact O-CG1 3.43Å; L57-I61 PolarHBondContact O-N 3.32Å
58	Y	48.6	Very low	59.1	Low	39 Å²	39	76.8 Å²	76.8	15%	0.153	39%	0.385	C	S	.	.	H	α-helix	trans	-53.4	-50.5	-177	-163.2	-96.9	0	0	0	113.8	I53 G55 R60 I61 N62 P69 K70 N71 D72	I53-Y58 HydrophobicContact CB-CD2 4.32Å; I53-Y58 HydrophobicContact CD1-CD2 4.04Å; I53-Y58 HydrophobicContact CD1-CE2 4.11Å; I53-Y58 HydrophobicContact CG2-CD2 4.22Å; G55-Y58 WeakPolarHBondContact O-CB 3.26Å; G55-Y58 PolarHBondContact O-N 2.82Å; Y58-R60 VanDerWaalsContact C-N 3.28Å; Y58-R60 PolarHBondContact O-N 3.41Å; Y58-I61 PolarHBondContact O-N 3.24Å; Y58-N62 PolarHBondContact O-N 3.12Å; Y58-P69 VanDerWaalsContact CZ-O 3.3Å; Y58-P69 VanDerWaalsContact OH-C 3.29Å; Y58-P69 PolarHBondContact OH-O 3.35Å; Y58-K70 WeakPolarHBondContact CE1-O 3.3Å; Y58-K70 PolarHBondContact OH-O 3.45Å; Y58-N71 WeakPolarHBondContact OH-CA 3.45Å; Y58-N71 PolarHBondContact OH-N 3.14Å; Y58-N71 PolarHBondContact OH-O 2.95Å; Y58-D72 WeakPolarHBondContact CE2-OD1 3.3Å; Y58-D72 PolarHBondContact OH-N 2.8Å
59	K	49.7	Very low	56.7	Low	171 Å²	171	77 Å²	77	74%	0.743	39%	0.386	S	S	*	.	H	α-helix	trans	-60.3	-35.8	177	-71	-175.7	178.3	178.8	0	112.9	L57	L57-K59 PolarHBondContact O-N 2.9Å
60	R	46.3	Very low	54.8	Low	196 Å²	196	82.6 Å²	82.6	74%	0.74	41%	0.411	S	S	*	.	H	α-helix	trans	-75.3	-28	-177.9	-147.6	173.9	-174.1	167.5	1.4	112.2	L57 Y58	L57-R60 WeakPolarHBondContact O-CB 3.36Å; L57-R60 PolarHBondContact O-N 2.85Å; Y58-R60 VanDerWaalsContact C-N 3.28Å; Y58-R60 PolarHBondContact O-N 3.41Å
61	I	47.2	Very low	53.1	Low	22 Å²	22	82.5 Å²	82.5	11%	0.113	41%	0.411	C	S	.	.	H	α-helix	trans	-79.4	-44.7	179.5	-68.2	154.6	0	0	0	111.1	I53 L57 Y58 N63 K64 F65 L68 A100	I53-I61 HydrophobicContact CG2-CD1 4.42Å; L57-I61 VanDerWaalsContact C-CD1 3.45Å; L57-I61 HydrophobicContact CB-CD1 4.02Å; L57-I61 WeakPolarHBondContact O-CD1 3.46Å; L57-I61 WeakPolarHBondContact O-CG1 3.43Å; L57-I61 PolarHBondContact O-N 3.32Å; Y58-I61 PolarHBondContact O-N 3.24Å; I61-N63 PolarHBondContact O-N 2.89Å; I61-K64 CarbonylContact O-C 3.51Å; I61-K64 WeakPolarHBondContact O-CA 3.43Å; I61-K64 PolarHBondContact O-N 3.08Å; I61-F65 HydrophobicContact CG2-CD2 4.19Å; I61-F65 PolarHBondContact O-N 2.9Å; I61-L68 HydrophobicContact CG2-CB 4.37Å; I61-L68 HydrophobicContact CG2-CD1 3.08Å; I61-L68 HydrophobicContact CG2-CG 4.28Å; I61-A100 HydrophobicContact CD1-CB 3.01Å; I61-A100 HydrophobicContact CG1-CB 3.74Å
62	N	46.8	Very low	51.9	Low	45 Å²	45	84.7 Å²	84.7	24%	0.241	42%	0.422	C	S	.	.	H	α-helix	trans	-59.4	-34.3	-179.1	-150	-0.9	0	0	0	111.2	Y58	Y58-N62 PolarHBondContact O-N 3.12Å
63	N	52.1	Low	51.1	Low	150 Å²	150	80.3 Å²	80.3	80%	0.802	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-25.8	172.5	-73	1.5	0	0	0	114.5	I61	I61-N63 PolarHBondContact O-N 2.89Å
64	K	45	Very low	51.5	Low	163 Å²	163	81.1 Å²	81.1	71%	0.709	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-25.9	179.7	-91.2	-171.8	175.1	-176	0	113.6	I61	I61-K64 CarbonylContact O-C 3.51Å; I61-K64 WeakPolarHBondContact O-CA 3.43Å; I61-K64 PolarHBondContact O-N 3.08Å
65	F	47.1	Very low	52.7	Low	73 Å²	73	75.6 Å²	75.6	32%	0.32	39%	0.385	S	S	.	.			trans	-144.3	82.6	-167.5	-60.8	-61.3	0	0	0	109.9	I61 Y67 L68	I61-F65 HydrophobicContact CG2-CD2 4.19Å; I61-F65 PolarHBondContact O-N 2.9Å; F65-Y67 HydrophobicContact CB-CE1 4.13Å; F65-Y67 HydrophobicContact CB-CE2 4.11Å; F65-Y67 AromaticContact CD1-CE1 3.98Å; F65-Y67 HydrophobicContact CD1-CE1 3.98Å; F65-Y67 HydrophobicContact CD1-CE2 4.44Å; F65-Y67 AromaticContact CD1-CZ 3.57Å; F65-Y67 WeakPolarHBondContact CD1-OH 3.19Å; F65-Y67 PolarHBondContact O-N 3.25Å; F65-L68 HydrophobicContact CB-CD1 3.66Å; F65-L68 HydrophobicContact CB-CG 4.28Å; F65-L68 HydrophobicContact CD2-CD1 4.2Å; F65-L68 HydrophobicContact CG-CD1 4.25Å; F65-L68 PolarHBondContact O-N 3.1Å; F65-L68 VanDerWaalsContact O-N 3.09Å
66	P	45.2	Very low	54.1	Low	108 Å²	108	75.7 Å²	75.7	70%	0.701	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-4.3	-173.6	26.8	-35.5	0	0	0	114.8
67	Y	44	Very low	55.7	Low	137 Å²	137	71.4 Å²	71.4	54%	0.537	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-5.5	175.8	51.6	-99.9	0	0	0	113.4	F65 N104	F65-Y67 HydrophobicContact CB-CE1 4.13Å; F65-Y67 HydrophobicContact CB-CE2 4.11Å; F65-Y67 AromaticContact CD1-CE1 3.98Å; F65-Y67 HydrophobicContact CD1-CE1 3.98Å; F65-Y67 HydrophobicContact CD1-CE2 4.44Å; F65-Y67 AromaticContact CD1-CZ 3.57Å; F65-Y67 WeakPolarHBondContact CD1-OH 3.19Å; F65-Y67 PolarHBondContact O-N 3.25Å; Y67-N104 PolarHBondContact OH-ND2 2.89Å
68	L	43.2	Very low	57.6	Low	16 Å²	16	67.6 Å²	67.6	8%	0.084	32%	0.317	C	S	.	.	S	Bend	trans	-77.6	150.4	169.8	-77.8	161.7	0	0	0	109.4	I61 F65 K70 W161	I61-L68 HydrophobicContact CG2-CB 4.37Å; I61-L68 HydrophobicContact CG2-CD1 3.08Å; I61-L68 HydrophobicContact CG2-CG 4.28Å; F65-L68 HydrophobicContact CB-CD1 3.66Å; F65-L68 HydrophobicContact CB-CG 4.28Å; F65-L68 HydrophobicContact CD2-CD1 4.2Å; F65-L68 HydrophobicContact CG-CD1 4.25Å; F65-L68 PolarHBondContact O-N 3.1Å; F65-L68 VanDerWaalsContact O-N 3.09Å; L68-K70 PolarHBondContact O-N 3.49Å; L68-W161 HydrophobicContact CD2-CH2 4.09Å; L68-W161 HydrophobicContact CD2-CZ2 3.5Å; L68-W161 VanDerWaalsContact CD2-CZ2 3.5Å
69	P	44.1	Very low	59.5	Low	3 Å²	3	68 Å²	68	2%	0.019	32%	0.321	C	S	.	.			trans	-46.3	135.7	175.8	-8.4	-4.3	0	0	0	111.6	Y58 N71 P162 D373	Y58-P69 VanDerWaalsContact CZ-O 3.3Å; Y58-P69 VanDerWaalsContact OH-C 3.29Å; Y58-P69 PolarHBondContact OH-O 3.35Å; P69-N71 VanDerWaalsContact C-N 3.26Å; P69-N71 WeakPolarHBondContact CB-O 3.23Å; P69-P162 HydrophobicContact CG-CG 3.57Å; P69-D373 WeakPolarHBondContact CA-OD1 3.48Å; P69-D373 VanDerWaalsContact CB-OD1 3.26Å; P69-D373 WeakPolarHBondContact CB-OD1 3.21Å; P69-D373 WeakPolarHBondContact CB-OD2 3.49Å; P69-D373 WeakPolarHBondContact CD-OD1 3.43Å; P69-D373 WeakPolarHBondContact CG-OD2 3.4Å
70	K	53.9	Low	61.2	Low	118 Å²	118	59.9 Å²	59.9	51%	0.513	29%	0.286	S	S	.	.	S	Bend	trans	-75.5	-19.1	164.3	-68.4	-174.7	179.2	178.2	0	111.8	Y58 L68	Y58-K70 WeakPolarHBondContact CE1-O 3.3Å; Y58-K70 PolarHBondContact OH-O 3.45Å; L68-K70 PolarHBondContact O-N 3.49Å
71	N	56.2	Low	63	Low	11 Å²	11	50.7 Å²	50.7	6%	0.059	25%	0.252	C	S	.	.	S	Bend	trans	-123.7	145.8	176.2	-56.8	-19	0	0	0	111.3	Y58 P69 L408	Y58-N71 WeakPolarHBondContact OH-CA 3.45Å; Y58-N71 PolarHBondContact OH-N 3.14Å; Y58-N71 PolarHBondContact OH-O 2.95Å; P69-N71 VanDerWaalsContact C-N 3.26Å; P69-N71 WeakPolarHBondContact CB-O 3.23Å; N71-L408 WeakPolarHBondContact OD1-CB 3.4Å
72	D	59.9	Low	65	Low	46 Å²	46	49.7 Å²	49.7	25%	0.246	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-57.5	136.7	169.3	-90.9	-7.8	0	0	0	109.2	H52 Y58 N74	H52-D72 IonicContact CE1-OD2 3.9Å; H52-D72 IonicContact ND1-OD2 2.93Å; Y58-D72 WeakPolarHBondContact CE2-OD1 3.3Å; Y58-D72 PolarHBondContact OH-N 2.8Å; D72-N74 PolarHBondContact O-N 2.76Å; D72-N74 VanDerWaalsContact O-N 3.17Å
73	P	64.4	Low	66.8	Low	3 Å²	3	50.3 Å²	50.3	2%	0.019	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-66.5	119.4	-178.1	26	-32.2	0	0	0	109.3	Q50 N160	Q50-P73 PolarHBondContact NE2-O 2.77Å; P73-N160 WeakPolarHBondContact CG-O 3.18Å; P73-N160 PolarHBondContact O-ND2 2.82Å
74	N	78.4	Confident	68.2	Low	30 Å²	30	43.4 Å²	43.4	16%	0.16	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-68.5	137	-177.6	-176.9	0.6	0	0	0	110.8	D72 D76 E77 A78 N160 Q403	D72-N74 PolarHBondContact O-N 2.76Å; D72-N74 VanDerWaalsContact O-N 3.17Å; N74-D76 PolarHBondContact OD1-N 2.92Å; N74-E77 HydrophobicContact CB-CB 3.91Å; N74-A78 PolarHBondContact O-N 2.79Å; N74-N160 PolarHBondContact O-ND2 3.31Å; N74-N160 VanDerWaalsContact O-ND2 3.15Å; N74-Q403 PolarHBondContact ND2-NE2 2.94Å; N74-Q403 PolarHBondContact ND2-OE1 2.81Å; N74-Q403 VanDerWaalsContact ND2-OE1 3.14Å
75	V	85.2	Confident	70	Confident	25 Å²	25	35.8 Å²	35.8	15%	0.152	18%	0.18	C	C	.	.	H	α-helix	trans	-66.7	-45.7	175.7	178	0	0	0	0	110.7	Q50 E77 A78 I79 V93 F95	Q50-V75 HydrophobicContact CB-CG2 4.11Å; Q50-V75 HydrophobicContact CG-CG2 3.43Å; Q50-V75 VanDerWaalsContact CG-CG2 3.43Å; V75-E77 PolarHBondContact O-N 2.98Å; V75-A78 WeakPolarHBondContact O-CA 2.88Å; V75-A78 WeakPolarHBondContact O-CB 3.24Å; V75-A78 PolarHBondContact O-N 2.9Å; V75-I79 HydrophobicContact CG1-CD1 3.77Å; V75-I79 HydrophobicContact CG1-CG1 4.23Å; V75-I79 WeakPolarHBondContact O-CG1 3.34Å; V75-I79 PolarHBondContact O-N 2.92Å; V75-V93 HydrophobicContact CG1-CG1 4.14Å; V75-V93 HydrophobicContact CG1-CG2 4.16Å; V75-F95 HydrophobicContact CG2-CE1 3.77Å; V75-F95 HydrophobicContact CG2-CZ 4.08Å
76	D	83.1	Confident	71.5	Confident	54 Å²	54	34.8 Å²	34.8	29%	0.289	19%	0.19	S	C	.	.	H	α-helix	trans	-59	-38	-179.5	-80.1	3.8	0	0	0	110.8	N74 A80 N289 R453	N74-D76 PolarHBondContact OD1-N 2.92Å; D76-A80 WeakPolarHBondContact O-CB 3.39Å; D76-A80 PolarHBondContact O-N 3.44Å; D76-N289 WeakPolarHBondContact CB-ND2 3.48Å; D76-R453 IonicContact OD2-CZ 3.99Å; D76-R453 IonicContact OD2-NH1 3.58Å; D76-R453 PolarHBondContact OD2-NH1 2.8Å
77	E	82.9	Confident	73.3	Confident	7 Å²	7	37.7 Å²	37.7	3%	0.033	19%	0.193	C	C	.	.	H	α-helix	trans	-67.2	-37.6	176.2	-170.5	-172.9	-169.9	0	0	112.2	N74 V75 L81 R183 T288 M371 S372	N74-E77 HydrophobicContact CB-CB 3.91Å; V75-E77 PolarHBondContact O-N 2.98Å; E77-L81 VanDerWaalsContact O-CB 3.31Å; E77-L81 WeakPolarHBondContact O-CB 3.36Å; E77-L81 PolarHBondContact O-N 2.98Å; E77-R183 IonicContact OE1-CZ 2.92Å; E77-R183 IonicContact OE1-NH2 2.66Å; E77-R183 PolarHBondContact OE1-NH2 3.3Å; E77-R183 IonicContact OE2-CZ 3.86Å; E77-R183 VanDerWaalsContact OE2-CZ 3.29Å; E77-R183 IonicContact OE2-NH1 3.97Å; E77-R183 PolarHBondContact OE2-NH1 3.49Å; E77-R183 IonicContact OE2-NH2 3.61Å; E77-R183 PolarHBondContact OE2-NH2 3.39Å; E77-T288 WeakPolarHBondContact CG-OG1 3.3Å; E77-T288 PolarHBondContact OE1-OG1 2.82Å; E77-M371 VanDerWaalsContact OE1-CA 3.26Å; E77-M371 WeakPolarHBondContact OE1-CA 3.39Å; E77-M371 WeakPolarHBondContact OE1-CB 3.38Å; E77-M371 WeakPolarHBondContact OE1-CG 3.24Å; E77-S372 PolarHBondContact OE1-N 2.74Å
78	A	86.9	Confident	75.4	Confident	2 Å²	2	31.8 Å²	31.8	2%	0.017	17%	0.169	C	C	.	.	H	α-helix	trans	-69.4	-42.6	176.7	0	0	0	0	0	112.2	I48 N74 V75 L81 V82 L158 N160	I48-A78 HydrophobicContact CD1-CB 4.29Å; I48-A78 HydrophobicContact CG2-CB 4.45Å; N74-A78 PolarHBondContact O-N 2.79Å; V75-A78 WeakPolarHBondContact O-CA 2.88Å; V75-A78 WeakPolarHBondContact O-CB 3.24Å; V75-A78 PolarHBondContact O-N 2.9Å; A78-L81 PolarHBondContact O-N 2.97Å; A78-V82 WeakPolarHBondContact O-CG2 3.31Å; A78-V82 PolarHBondContact O-N 3.18Å; A78-L158 HydrophobicContact CB-CD2 4.4Å; A78-N160 HydrophobicContact CB-CB 4.25Å; A78-N160 WeakPolarHBondContact CB-ND2 2.88Å
79	I	88.8	Confident	77.6	Confident	47 Å²	47	33.1 Å²	33.1	24%	0.241	18%	0.178	C	C	.	.	H	α-helix	trans	-59.1	-50.5	173.6	-65.8	170.4	0	0	0	109.5	I48 V75 L81 V82 D83 T90 V93	I48-I79 HydrophobicContact CD1-CG1 3.76Å; V75-I79 HydrophobicContact CG1-CD1 3.77Å; V75-I79 HydrophobicContact CG1-CG1 4.23Å; V75-I79 WeakPolarHBondContact O-CG1 3.34Å; V75-I79 PolarHBondContact O-N 2.92Å; I79-L81 PolarHBondContact O-N 3.43Å; I79-V82 WeakPolarHBondContact O-CB 3.4Å; I79-V82 PolarHBondContact O-N 3.01Å; I79-D83 PolarHBondContact O-N 3.24Å; I79-T90 HydrophobicContact CG1-CG2 4.37Å; I79-V93 HydrophobicContact CD1-CG2 4.43Å
80	A	83.7	Confident	79.8	Confident	2 Å²	2	34.8 Å²	34.8	2%	0.017	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-32	179.1	0	0	0	0	0	112.5	D76 S84 P309 V311	D76-A80 WeakPolarHBondContact O-CB 3.39Å; D76-A80 PolarHBondContact O-N 3.44Å; A80-S84 WeakPolarHBondContact O-CB 3.47Å; A80-S84 PolarHBondContact O-N 2.7Å; A80-S84 PolarHBondContact O-OG 2.91Å; A80-P309 VanDerWaalsContact CA-O 3.25Å; A80-P309 WeakPolarHBondContact CA-O 3.46Å; A80-P309 HydrophobicContact CB-CB 4.43Å; A80-P309 WeakPolarHBondContact CB-O 3.5Å; A80-V311 HydrophobicContact CB-CG2 3.34Å; A80-V311 WeakPolarHBondContact O-CG2 3.33Å; A80-V311 PolarHBondContact O-N 3.17Å
81	L	86	Confident	81.6	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-73.8	-37.1	174.6	175	156.7	0	0	0	112.5	E77 A78 I79 S84 L186 V187 L190 V311 M371	E77-L81 VanDerWaalsContact O-CB 3.31Å; E77-L81 WeakPolarHBondContact O-CB 3.36Å; E77-L81 PolarHBondContact O-N 2.98Å; A78-L81 PolarHBondContact O-N 2.97Å; I79-L81 PolarHBondContact O-N 3.43Å; L81-S84 WeakPolarHBondContact O-CB 3.44Å; L81-L186 HydrophobicContact CD2-CB 3.45Å; L81-L186 VanDerWaalsContact CD2-CB 3.45Å; L81-L186 HydrophobicContact CD2-CD1 3.38Å; L81-L186 HydrophobicContact CD2-CG 4.07Å; L81-L186 HydrophobicContact CG-CB 4.49Å; L81-V187 HydrophobicContact CD1-CG2 3.65Å; L81-L190 HydrophobicContact CG-CD2 4.14Å; L81-V311 HydrophobicContact CB-CB 4.37Å; L81-V311 HydrophobicContact CB-CG2 4.27Å; L81-M371 HydrophobicContact CD1-CE 3.8Å; L81-M371 HydrophobicContact CD1-SD 4.11Å
82	V	88.2	Confident	83.2	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.2	-50.2	173.8	168.5	0	0	0	0	110.4	I46 I48 A78 I79 S84 L85 W88 L158 L186	I46-V82 HydrophobicContact CB-CG1 4.34Å; I46-V82 HydrophobicContact CD1-CB 4.22Å; I46-V82 HydrophobicContact CD1-CG1 3.44Å; I46-V82 VanDerWaalsContact CD1-CG1 3.44Å; I46-V82 HydrophobicContact CD1-CG2 3.76Å; I46-V82 HydrophobicContact CG1-CG1 4.41Å; I46-V82 HydrophobicContact CG2-CG2 4.45Å; I48-V82 HydrophobicContact CD1-CG2 4.31Å; A78-V82 WeakPolarHBondContact O-CG2 3.31Å; A78-V82 PolarHBondContact O-N 3.18Å; I79-V82 WeakPolarHBondContact O-CB 3.4Å; I79-V82 PolarHBondContact O-N 3.01Å; V82-S84 PolarHBondContact O-N 2.9Å; V82-S84 VanDerWaalsContact O-N 3.15Å; V82-L85 WeakPolarHBondContact O-CB 3.3Å; V82-L85 PolarHBondContact O-N 3.1Å; V82-W88 HydrophobicContact CG1-CB 4.07Å; V82-W88 WeakPolarHBondContact O-CB 3.44Å; V82-L158 HydrophobicContact CG2-CD2 3.64Å; V82-L186 HydrophobicContact CG2-CD1 4.43Å
83	D	84.5	Confident	84.8	Confident	59 Å²	59	30.5 Å²	30.5	32%	0.316	18%	0.176	S	C	.	.	H	α-helix	trans	-63.9	-23.4	-177.5	-64.7	-13.2	0	0	0	112.3	I79 L85	I79-D83 PolarHBondContact O-N 3.24Å; D83-L85 VanDerWaalsContact C-N 3.33Å
84	S	81.7	Confident	86.1	Confident	5 Å²	5	31.1 Å²	31.1	4%	0.035	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-25	171.2	-88.5	0	0	0	0	115.3	A80 L81 V82 G86 R194 E310 V311	A80-S84 WeakPolarHBondContact O-CB 3.47Å; A80-S84 PolarHBondContact O-N 2.7Å; A80-S84 PolarHBondContact O-OG 2.91Å; L81-S84 WeakPolarHBondContact O-CB 3.44Å; V82-S84 PolarHBondContact O-N 2.9Å; V82-S84 VanDerWaalsContact O-N 3.15Å; S84-G86 PolarHBondContact O-N 2.78Å; S84-R194 VanDerWaalsContact CA-NH2 3.34Å; S84-R194 PolarHBondContact O-NH2 2.88Å; S84-R194 PolarHBondContact OG-NH1 2.91Å; S84-R194 PolarHBondContact OG-NH2 2.64Å; S84-E310 WeakPolarHBondContact OG-CA 3.23Å; S84-E310 VanDerWaalsContact OG-CB 3.28Å; S84-E310 WeakPolarHBondContact OG-CB 3.5Å; S84-V311 WeakPolarHBondContact CB-O 3.45Å; S84-V311 WeakPolarHBondContact OG-CA 3.31Å; S84-V311 PolarHBondContact OG-N 3.03Å; S84-V311 PolarHBondContact OG-O 3.24Å
85	L	82.9	Confident	86.6	Confident	2 Å²	2	36 Å²	36	1%	0.01	20%	0.2	C	C	.	.	S	Bend	trans	-80.6	104.3	174.3	-65.1	166.2	0	0	0	106	L39 V82 D83 F87 W88 L186 L190 L193	L39-L85 HydrophobicContact CD1-CD2 3.86Å; V82-L85 WeakPolarHBondContact O-CB 3.3Å; V82-L85 PolarHBondContact O-N 3.1Å; D83-L85 VanDerWaalsContact C-N 3.33Å; L85-F87 PolarHBondContact O-N 3.26Å; L85-W88 HydrophobicContact CB-CB 3.94Å; L85-W88 HydrophobicContact CB-CD2 3.72Å; L85-W88 HydrophobicContact CB-CE3 4.12Å; L85-W88 HydrophobicContact CB-CG 3.52Å; L85-W88 HydrophobicContact CD1-CD2 3.89Å; L85-W88 HydrophobicContact CD1-CE3 3.45Å; L85-W88 VanDerWaalsContact CD1-CE3 3.45Å; L85-W88 HydrophobicContact CD1-CZ3 3.86Å; L85-W88 HydrophobicContact CG-CD2 4.44Å; L85-W88 HydrophobicContact CG-CE3 4.43Å; L85-W88 WeakPolarHBondContact O-CB 3.48Å; L85-W88 PolarHBondContact O-N 3.04Å; L85-L186 HydrophobicContact CD1-CB 4.43Å; L85-L186 HydrophobicContact CD1-CD1 4.38Å; L85-L186 HydrophobicContact CD1-CD2 3.94Å; L85-L186 HydrophobicContact CD1-CG 4.48Å; L85-L190 HydrophobicContact CD2-CB 4.01Å; L85-L190 HydrophobicContact CD2-CD1 3.83Å; L85-L190 HydrophobicContact CD2-CG 4.42Å; L85-L190 HydrophobicContact CG-CD1 4.37Å; L85-L193 HydrophobicContact CD2-CD1 3.93Å
86	G	77.4	Confident	86.7	Confident	52 Å²	52	35.4 Å²	35.4	54%	0.536	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	137.1	-176.3	0	0	0	0	0	111.8	S84 W88	S84-G86 PolarHBondContact O-N 2.78Å; G86-W88 VanDerWaalsContact O-CD1 3.31Å; G86-W88 PolarHBondContact O-N 2.92Å
87	F	83.6	Confident	86.7	Confident	170 Å²	170	37.2 Å²	37.2	75%	0.746	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.4	0.8	-173	-47.9	-77.1	0	0	0	116.3	L85	L85-F87 PolarHBondContact O-N 3.26Å
88	W	89	Confident	86.5	Confident	12 Å²	12	37.4 Å²	37.4	5%	0.045	21%	0.207	C	C	.	.			trans	-91.3	140	173.9	-63.7	40.4	0	0	0	109.3	L39 H44 I46 V82 L85 G86 Y181 L186	L39-W88 HydrophobicContact CB-CZ2 3.93Å; L39-W88 HydrophobicContact CD1-CZ2 4.35Å; L39-W88 HydrophobicContact CD2-CH2 3.31Å; L39-W88 HydrophobicContact CD2-CZ2 3.27Å; L39-W88 HydrophobicContact CD2-CZ3 4.31Å; L39-W88 HydrophobicContact CG-CH2 4.48Å; L39-W88 HydrophobicContact CG-CZ2 4.01Å; H44-W88 HydrophobicContact CB-CD2 4.06Å; H44-W88 HydrophobicContact CB-CE3 4.26Å; H44-W88 HydrophobicContact CB-CH2 4.2Å; H44-W88 HydrophobicContact CB-CZ2 4.13Å; H44-W88 HydrophobicContact CB-CZ3 4.3Å; H44-W88 AromaticContact CD2-CH2 3.53Å; H44-W88 AromaticContact CD2-CZ2 3.48Å; H44-W88 VanDerWaalsContact CD2-CZ2 3.48Å; H44-W88 WeakPolarHBondContact CD2-CZ2 3.39Å; H44-W88 CarbonylContact O-C 3.59Å; H44-W88 WeakPolarHBondContact O-CA 3.46Å; I46-W88 HydrophobicContact CD1-CB 4.45Å; I46-W88 HydrophobicContact CD1-CD2 4.03Å; I46-W88 HydrophobicContact CD1-CE3 3.05Å; I46-W88 HydrophobicContact CD1-CZ3 3.43Å; I46-W88 VanDerWaalsContact CD1-CZ3 3.43Å; I46-W88 HydrophobicContact CG1-CE3 4.17Å; I46-W88 HydrophobicContact CG1-CZ3 4.35Å; V82-W88 HydrophobicContact CG1-CB 4.07Å; V82-W88 WeakPolarHBondContact O-CB 3.44Å; L85-W88 HydrophobicContact CB-CB 3.94Å; L85-W88 HydrophobicContact CB-CD2 3.72Å; L85-W88 HydrophobicContact CB-CE3 4.12Å; L85-W88 HydrophobicContact CB-CG 3.52Å; L85-W88 HydrophobicContact CD1-CD2 3.89Å; L85-W88 HydrophobicContact CD1-CE3 3.45Å; L85-W88 VanDerWaalsContact CD1-CE3 3.45Å; L85-W88 HydrophobicContact CD1-CZ3 3.86Å; L85-W88 HydrophobicContact CG-CD2 4.44Å; L85-W88 HydrophobicContact CG-CE3 4.43Å; L85-W88 WeakPolarHBondContact O-CB 3.48Å; L85-W88 PolarHBondContact O-N 3.04Å; G86-W88 VanDerWaalsContact O-CD1 3.31Å; G86-W88 PolarHBondContact O-N 2.92Å; W88-Y181 HydrophobicContact CH2-CD2 4.25Å; W88-Y181 AromaticContact CH2-CE2 3.8Å; W88-Y181 HydrophobicContact CH2-CE2 3.8Å; W88-Y181 AromaticContact CH2-CZ 3.95Å; W88-Y181 HydrophobicContact CZ3-CD2 4.37Å; W88-Y181 HydrophobicContact CZ3-CE2 4.33Å; W88-L186 HydrophobicContact CH2-CD2 4.14Å; W88-L186 HydrophobicContact CZ3-CD2 3.69Å
89	T	89.3	Confident	85.7	Confident	45 Å²	45	43.8 Å²	43.8	28%	0.276	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	142.1	176.3	77	0	0	0	0	111.4	H44 D45 I46 K152	H44-T89 PolarHBondContact O-N 3.28Å; D45-T89 CarbonylContact C-O 3.58Å; D45-T89 WeakPolarHBondContact CA-O 3.46Å; D45-T89 PolarHBondContact OD1-OG1 3.18Å; I46-T89 PolarHBondContact N-O 2.85Å; T89-K152 PolarHBondContact OG1-NZ 3.38Å
90	T	90.8	Very high	84.4	Confident	38 Å²	38	42.3 Å²	42.3	23%	0.233	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	121.2	175	-56.4	0	0	0	0	110.1	I48 I79	I48-T90 HydrophobicContact CD1-CG2 3.72Å; I48-T90 HydrophobicContact CG1-CG2 4Å; I79-T90 HydrophobicContact CG1-CG2 4.37Å
91	V	90.5	Very high	83.2	Confident	33 Å²	33	46.5 Å²	46.5	20%	0.2	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-30	178.3	-178	0	0	0	0	112	D45 I46 Y124 K152	D45-V91 HydrophobicContact CB-CG2 3.58Å; I46-V91 PolarHBondContact O-N 3.01Å; V91-Y124 HydrophobicContact CG1-CD1 3.92Å; V91-Y124 HydrophobicContact CG1-CE1 4.18Å; V91-K152 HydrophobicContact CG1-CB 4.3Å; V91-K152 WeakPolarHBondContact CG1-O 3.49Å; V91-K152 HydrophobicContact CG2-CB 4.16Å
92	G	90.1	Very high	81.8	Confident	13 Å²	13	47.9 Å²	47.9	13%	0.134	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.1	169.9	179.7	0	0	0	0	0	113.3	V47 I48	V47-G92 WeakPolarHBondContact CA-O 3.33Å; I48-G92 PolarHBondContact N-O 3.13Å
93	V	92.7	Very high	80.7	Confident	38 Å²	38	48.1 Å²	48.1	23%	0.23	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	130.1	-178.9	-173.1	0	0	0	0	109.5	I48 Q50 V75 I79 F95	I48-V93 HydrophobicContact CB-CG1 4.46Å; I48-V93 HydrophobicContact CB-CG2 4.33Å; I48-V93 CarbonylContact O-C 3.5Å; I48-V93 VanDerWaalsContact O-CA 3.3Å; I48-V93 WeakPolarHBondContact O-CA 3.39Å; Q50-V93 HydrophobicContact CB-CG1 3.89Å; V75-V93 HydrophobicContact CG1-CG1 4.14Å; V75-V93 HydrophobicContact CG1-CG2 4.16Å; I79-V93 HydrophobicContact CD1-CG2 4.43Å; V93-F95 HydrophobicContact CB-CE2 4.15Å; V93-F95 HydrophobicContact CG1-CD2 4.22Å; V93-F95 HydrophobicContact CG1-CE1 4.4Å; V93-F95 HydrophobicContact CG1-CE2 3.73Å; V93-F95 HydrophobicContact CG1-CZ 3.83Å
94	I	92	Very high	79.7	Confident	17 Å²	17	47.9 Å²	47.9	9%	0.087	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	111.5	177	-59.5	168.7	0	0	0	108.3	V47 I48 I49 Q50 V121 Y124	V47-I94 HydrophobicContact CG2-CD1 3.58Å; V47-I94 HydrophobicContact CG2-CG1 3.85Å; I48-I94 PolarHBondContact O-N 2.92Å; I49-I94 WeakPolarHBondContact CA-O 3.45Å; Q50-I94 PolarHBondContact N-O 3.48Å; I94-V121 HydrophobicContact CD1-CG2 3.8Å; I94-Y124 HydrophobicContact CD1-CD2 3.99Å; I94-Y124 HydrophobicContact CD1-CE2 4.03Å; I94-Y124 HydrophobicContact CG1-CD2 4.37Å; I94-Y124 HydrophobicContact CG1-CE2 3.9Å
95	F	89.9	Confident	79	Confident	133 Å²	133	59.3 Å²	59.3	58%	0.583	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	134.2	175.8	-65.7	-91.1	0	0	0	111.1	Q50 V75 V93	Q50-F95 HydrophobicContact CB-CD1 3.78Å; Q50-F95 HydrophobicContact CB-CE1 3.98Å; Q50-F95 HydrophobicContact CB-CG 4.39Å; Q50-F95 HydrophobicContact CG-CD1 3.68Å; Q50-F95 HydrophobicContact CG-CE1 3.71Å; Q50-F95 WeakPolarHBondContact O-CA 3.28Å; V75-F95 HydrophobicContact CG2-CE1 3.77Å; V75-F95 HydrophobicContact CG2-CZ 4.08Å; V93-F95 HydrophobicContact CB-CE2 4.15Å; V93-F95 HydrophobicContact CG1-CD2 4.22Å; V93-F95 HydrophobicContact CG1-CE1 4.4Å; V93-F95 HydrophobicContact CG1-CE2 3.73Å; V93-F95 HydrophobicContact CG1-CZ 3.83Å
96	C	86.9	Confident	78.6	Confident	12 Å²	12	60.5 Å²	60.5	8%	0.081	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	141	178.1	63.9	0	0	0	0	112.5	Q50 P51 H52 I113 V117	Q50-C96 PolarHBondContact O-N 2.93Å; P51-C96 CarbonylContact C-O 3.54Å; P51-C96 WeakPolarHBondContact CA-O 3.35Å; H52-C96 PolarHBondContact N-O 3.15Å; C96-I113 HydrophobicContact CB-CG2 4.13Å; C96-V117 HydrophobicContact CB-CG2 3.98Å
97	N	82.9	Confident	78.7	Confident	91 Å²	91	62 Å²	62	49%	0.487	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	122.1	177.9	-72.2	-49.9	0	0	0	110.4	H52 I113	H52-N97 WeakPolarHBondContact O-CA 3.5Å; N97-I113 WeakPolarHBondContact O-CD1 3.4Å
98	I	79.1	Confident	78.7	Confident	12 Å²	12	54.1 Å²	54.1	6%	0.062	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	143.2	-178.2	-56.1	-167.1	0	0	0	111.9	P51 H52 F108 F109	P51-I98 HydrophobicContact CB-CD1 3.42Å; P51-I98 VanDerWaalsContact CB-CD1 3.42Å; P51-I98 HydrophobicContact CB-CG1 3.88Å; H52-I98 PolarHBondContact O-N 2.83Å; I98-F108 HydrophobicContact CD1-CD1 3.69Å; I98-F108 HydrophobicContact CD1-CE1 3.07Å; I98-F108 HydrophobicContact CD1-CE2 4.43Å; I98-F108 HydrophobicContact CD1-CZ 3.51Å; I98-F109 HydrophobicContact CD1-CD1 3.97Å; I98-F109 HydrophobicContact CD1-CE1 3.71Å; I98-F109 HydrophobicContact CG1-CD1 4.4Å; I98-F109 HydrophobicContact CG1-CE1 4.44Å
99	K	70.8	Confident	78.5	Confident	135 Å²	135	53.9 Å²	53.9	59%	0.587	29%	0.292	S	S	*	.			trans	-85.8	122.7	168.8	-66.9	-175.7	-179	-179.4	0	109.1	A101 N102	K99-A101 PolarHBondContact O-N 3.18Å; K99-A101 VanDerWaalsContact O-N 3.07Å; K99-N102 VanDerWaalsContact O-CB 3.31Å; K99-N102 WeakPolarHBondContact O-CB 3.28Å; K99-N102 PolarHBondContact O-N 3.02Å
100	A	61.1	Low	78.3	Confident	17 Å²	17	53.4 Å²	53.4	14%	0.14	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-58.3	-26	-177.2	0	0	0	0	0	116.5	I61 N102 T103	I61-A100 HydrophobicContact CD1-CB 3.01Å; I61-A100 HydrophobicContact CG1-CB 3.74Å; A100-N102 PolarHBondContact O-N 2.89Å; A100-N102 VanDerWaalsContact O-N 3.09Å; A100-T103 WeakPolarHBondContact O-CG2 3.33Å; A100-T103 PolarHBondContact O-N 2.92Å; A100-T103 PolarHBondContact O-OG1 2.92Å
101	A	56.9	Low	78.1	Confident	89 Å²	89	60.7 Å²	60.7	74%	0.736	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-59.1	-22.1	176.5	0	0	0	0	0	113	K99	K99-A101 PolarHBondContact O-N 3.18Å; K99-A101 VanDerWaalsContact O-N 3.07Å
102	N	58.6	Low	77.8	Confident	32 Å²	32	61.3 Å²	61.3	17%	0.171	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-85.5	-6.8	-173.4	-78.9	23.4	0	0	0	114.6	K99 A100 P107 F108 Q168	K99-N102 VanDerWaalsContact O-CB 3.31Å; K99-N102 WeakPolarHBondContact O-CB 3.28Å; K99-N102 PolarHBondContact O-N 3.02Å; A100-N102 PolarHBondContact O-N 2.89Å; A100-N102 VanDerWaalsContact O-N 3.09Å; N102-P107 WeakPolarHBondContact CB-O 3.26Å; N102-P107 VanDerWaalsContact CG-O 3.24Å; N102-P107 PolarHBondContact ND2-O 3.39Å; N102-F108 WeakPolarHBondContact CB-O 3.41Å; N102-Q168 PolarHBondContact O-NE2 3.46Å
103	T	63.7	Low	77.7	Confident	6 Å²	6	62.5 Å²	62.5	4%	0.037	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-33.5	-168	64.2	0	0	0	0	112.9	A100 W161 Q168	A100-T103 WeakPolarHBondContact O-CG2 3.33Å; A100-T103 PolarHBondContact O-N 2.92Å; A100-T103 PolarHBondContact O-OG1 2.92Å; T103-W161 HydrophobicContact CG2-CH2 3.71Å; T103-W161 HydrophobicContact CG2-CZ2 3.32Å; T103-Q168 PolarHBondContact O-NE2 2.97Å
104	N	63.8	Low	77.5	Confident	53 Å²	53	64.1 Å²	64.1	28%	0.283	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-28.6	-164.6	-61.5	-8.2	0	0	0	115.6	Y67	Y67-N104 PolarHBondContact OH-ND2 2.89Å
105	R	66.2	Low	77.5	Confident	246 Å²	246	68.1 Å²	68.1	93%	0.928	36%	0.355	S	S	*	.	S	Bend	trans	-125.1	6.4	-171.6	-67	-171.6	-179.3	177.2	-0.1	114.5
106	G	74.7	Confident	77.5	Confident	27 Å²	27	67 Å²	67	28%	0.278	36%	0.355	S	S	.	.	S	Bend	trans	-157.3	-169	-172.6	0	0	0	0	0	113.5	F108 Q168	G106-F108 PolarHBondContact O-N 3.02Å; G106-Q168 PolarHBondContact O-NE2 3.43Å
107	P	80.1	Confident	77.8	Confident	84 Å²	84	66.7 Å²	66.7	55%	0.545	35%	0.353	S	S	.	.			trans	-64.7	129.7	177.8	28.2	-34	0	0	0	109.4	N102 F109	N102-P107 WeakPolarHBondContact CB-O 3.26Å; N102-P107 VanDerWaalsContact CG-O 3.24Å; N102-P107 PolarHBondContact ND2-O 3.39Å; P107-F109 PolarHBondContact O-N 3.46Å
108	F	83.9	Confident	78.2	Confident	3 Å²	3	62.7 Å²	62.7	1%	0.013	33%	0.332	C	S	.	.	S	Bend	trans	-55.9	-40.5	-177.4	-172.5	-102.7	0	0	0	112.1	I98 N102 G106 V159 W161 L164 Q168 M172	I98-F108 HydrophobicContact CD1-CD1 3.69Å; I98-F108 HydrophobicContact CD1-CE1 3.07Å; I98-F108 HydrophobicContact CD1-CE2 4.43Å; I98-F108 HydrophobicContact CD1-CZ 3.51Å; N102-F108 WeakPolarHBondContact CB-O 3.41Å; G106-F108 PolarHBondContact O-N 3.02Å; F108-V159 HydrophobicContact CE1-CG1 3.77Å; F108-V159 HydrophobicContact CZ-CG1 3.91Å; F108-W161 HydrophobicContact CE2-CB 4.36Å; F108-W161 AromaticContact CE2-CD1 3.75Å; F108-W161 AromaticContact CE2-CD2 3.68Å; F108-W161 HydrophobicContact CE2-CD2 3.68Å; F108-W161 AromaticContact CE2-CE2 3.8Å; F108-W161 HydrophobicContact CE2-CE3 4.29Å; F108-W161 AromaticContact CE2-CG 3.68Å; F108-W161 HydrophobicContact CE2-CG 3.68Å; F108-W161 HydrophobicContact CE2-CZ2 4.48Å; F108-W161 AromaticContact CE2-NE1 3.83Å; F108-W161 HydrophobicContact CZ-CB 4.08Å; F108-W161 AromaticContact CZ-CD2 3.79Å; F108-W161 HydrophobicContact CZ-CD2 3.79Å; F108-W161 HydrophobicContact CZ-CE3 4.05Å; F108-W161 AromaticContact CZ-CG 3.8Å; F108-W161 HydrophobicContact CZ-CG 3.8Å; F108-L164 HydrophobicContact CD2-CD2 3.73Å; F108-L164 HydrophobicContact CE2-CD2 3.82Å; F108-L164 HydrophobicContact CG-CD2 4.15Å; F108-L164 HydrophobicContact CZ-CD2 4.28Å; F108-Q168 HydrophobicContact CB-CG 4.05Å; F108-M172 HydrophobicContact CB-CE 3.62Å; F108-M172 HydrophobicContact CD1-CE 3.83Å; F108-M172 HydrophobicContact CG-CE 3.92Å
109	F	85.2	Confident	78.9	Confident	7 Å²	7	66 Å²	66	3%	0.031	35%	0.35	C	S	.	.	S	Bend	trans	-101.2	148.5	176.1	-56.8	-72.1	0	0	0	111.6	I49 I98 P107 I113 W114 V117 M172 W176	I49-F109 HydrophobicContact CD1-CZ 4.32Å; I49-F109 HydrophobicContact CG2-CE1 4.25Å; I49-F109 HydrophobicContact CG2-CZ 3.99Å; I98-F109 HydrophobicContact CD1-CD1 3.97Å; I98-F109 HydrophobicContact CD1-CE1 3.71Å; I98-F109 HydrophobicContact CG1-CD1 4.4Å; I98-F109 HydrophobicContact CG1-CE1 4.44Å; P107-F109 PolarHBondContact O-N 3.46Å; F109-I113 HydrophobicContact CB-CB 4.41Å; F109-I113 HydrophobicContact CB-CG2 4.26Å; F109-I113 HydrophobicContact CD1-CG2 3.72Å; F109-I113 HydrophobicContact CG-CG2 4.35Å; F109-W114 HydrophobicContact CB-CB 3.94Å; F109-W114 HydrophobicContact CB-CE3 4.29Å; F109-W114 AromaticContact CD2-CE3 3.51Å; F109-W114 HydrophobicContact CD2-CE3 3.51Å; F109-W114 AromaticContact CD2-CZ3 3.88Å; F109-W114 HydrophobicContact CD2-CZ3 3.88Å; F109-W114 HydrophobicContact CE2-CE3 4.23Å; F109-W114 HydrophobicContact CE2-CZ3 4.23Å; F109-W114 HydrophobicContact CG-CE3 4.28Å; F109-V117 HydrophobicContact CE1-CG2 4.32Å; F109-V117 HydrophobicContact CE2-CG1 4.38Å; F109-V117 HydrophobicContact CZ-CG1 4.15Å; F109-M172 HydrophobicContact CD2-CE 3.93Å; F109-M172 HydrophobicContact CE2-CE 3.46Å; F109-M172 VanDerWaalsContact CE2-CE 3.46Å; F109-M172 HydrophobicContact CE2-SD 4.33Å; F109-M172 HydrophobicContact CZ-CE 4.35Å; F109-W176 HydrophobicContact CE2-CH2 4.21Å; F109-W176 HydrophobicContact CE2-CZ2 4.49Å
110	S	85.5	Confident	79.9	Confident	36 Å²	36	61.6 Å²	61.6	25%	0.252	34%	0.336	S	S	.	.			trans	-72.2	158.3	165.5	82.6	0	0	0	0	110.4	G112 I113 W114	S110-G112 VanDerWaalsContact C-N 3.31Å; S110-G112 PolarHBondContact O-N 3.37Å; S110-G112 VanDerWaalsContact O-N 3.16Å; S110-I113 PolarHBondContact O-N 3.4Å; S110-I113 VanDerWaalsContact O-N 3.08Å; S110-I113 WeakPolarHBondContact OG-CD1 3.35Å; S110-W114 WeakPolarHBondContact O-CB 3.16Å; S110-W114 PolarHBondContact O-N 2.91Å
111	K	84.7	Confident	81.4	Confident	191 Å²	191	60.8 Å²	60.8	83%	0.83	33%	0.329	S	S	*	.	H	α-helix	trans	-50.1	-44.1	-174.6	-170.1	178.3	178.8	-178.6	0	114.3	Q115	K111-Q115 PolarHBondContact O-N 2.91Å
112	G	84.9	Confident	83.2	Confident	46 Å²	46	59 Å²	59	47%	0.474	31%	0.307	S	S	.	.	H	α-helix	trans	-71.9	-40.9	179.1	0	0	0	0	0	113.5	S110 W114 Q115 N116	S110-G112 VanDerWaalsContact C-N 3.31Å; S110-G112 PolarHBondContact O-N 3.37Å; S110-G112 VanDerWaalsContact O-N 3.16Å; G112-W114 VanDerWaalsContact C-N 3.32Å; G112-Q115 PolarHBondContact O-N 2.98Å; G112-N116 PolarHBondContact O-N 3.46Å
113	I	87.9	Confident	84.8	Confident	38 Å²	38	58.8 Å²	58.8	20%	0.195	31%	0.309	C	S	.	.	H	α-helix	trans	-65.8	-41.1	177	-62.5	162.1	0	0	0	110.2	C96 N97 F109 S110 Q115 N116 V117	C96-I113 HydrophobicContact CB-CG2 4.13Å; N97-I113 WeakPolarHBondContact O-CD1 3.4Å; F109-I113 HydrophobicContact CB-CB 4.41Å; F109-I113 HydrophobicContact CB-CG2 4.26Å; F109-I113 HydrophobicContact CD1-CG2 3.72Å; F109-I113 HydrophobicContact CG-CG2 4.35Å; S110-I113 PolarHBondContact O-N 3.4Å; S110-I113 VanDerWaalsContact O-N 3.08Å; S110-I113 WeakPolarHBondContact OG-CD1 3.35Å; I113-Q115 VanDerWaalsContact C-N 3.3Å; I113-Q115 PolarHBondContact O-N 3.37Å; I113-N116 PolarHBondContact O-N 3.05Å; I113-V117 HydrophobicContact CG2-CG2 3.89Å; I113-V117 WeakPolarHBondContact O-CB 3.48Å; I113-V117 VanDerWaalsContact O-CG2 3.27Å; I113-V117 WeakPolarHBondContact O-CG2 3.46Å; I113-V117 PolarHBondContact O-N 3.27Å
114	W	89.8	Confident	86.1	Confident	72 Å²	72	60.6 Å²	60.6	27%	0.273	32%	0.316	S	S	.	.	H	α-helix	trans	-55.2	-46	177.3	172.2	-106.7	0	0	0	112	F109 S110 G112 S118 M172 A175 W176	F109-W114 HydrophobicContact CB-CB 3.94Å; F109-W114 HydrophobicContact CB-CE3 4.29Å; F109-W114 AromaticContact CD2-CE3 3.51Å; F109-W114 HydrophobicContact CD2-CE3 3.51Å; F109-W114 AromaticContact CD2-CZ3 3.88Å; F109-W114 HydrophobicContact CD2-CZ3 3.88Å; F109-W114 HydrophobicContact CE2-CE3 4.23Å; F109-W114 HydrophobicContact CE2-CZ3 4.23Å; F109-W114 HydrophobicContact CG-CE3 4.28Å; S110-W114 WeakPolarHBondContact O-CB 3.16Å; S110-W114 PolarHBondContact O-N 2.91Å; G112-W114 VanDerWaalsContact C-N 3.32Å; W114-S118 WeakPolarHBondContact O-CB 3.04Å; W114-S118 PolarHBondContact O-N 3.31Å; W114-S118 PolarHBondContact O-OG 3.48Å; W114-M172 HydrophobicContact CH2-CG 4.11Å; W114-M172 HydrophobicContact CZ3-CG 3.9Å; W114-A175 HydrophobicContact CH2-CB 3.84Å; W114-A175 HydrophobicContact CZ2-CB 3.48Å; W114-A175 VanDerWaalsContact CZ2-CB 3.48Å; W114-W176 HydrophobicContact CE3-CZ2 4.34Å; W114-W176 AromaticContact CH2-CZ2 3.95Å; W114-W176 HydrophobicContact CH2-CZ2 3.95Å; W114-W176 HydrophobicContact CZ3-CH2 4.24Å; W114-W176 AromaticContact CZ3-CZ2 3.53Å; W114-W176 HydrophobicContact CZ3-CZ2 3.53Å
115	Q	90.5	Very high	87.4	Confident	100 Å²	100	61 Å²	61	47%	0.467	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-53.3	179.1	-168.5	61.3	37.8	0	0	110.7	K111 G112 I113 V117 S118 D119	K111-Q115 PolarHBondContact O-N 2.91Å; G112-Q115 PolarHBondContact O-N 2.98Å; I113-Q115 VanDerWaalsContact C-N 3.3Å; I113-Q115 PolarHBondContact O-N 3.37Å; Q115-V117 PolarHBondContact O-N 2.75Å; Q115-S118 PolarHBondContact O-N 2.95Å; Q115-S118 VanDerWaalsContact O-N 3.14Å; Q115-D119 PolarHBondContact NE2-OD1 2.98Å; Q115-D119 PolarHBondContact NE2-OD2 3.45Å; Q115-D119 WeakPolarHBondContact O-CB 3.43Å; Q115-D119 PolarHBondContact O-N 3.31Å
116	N	90.6	Very high	88.6	Confident	110 Å²	110	51.4 Å²	51.4	59%	0.588	28%	0.281	S	S	*	.	H	α-helix	trans	-59.8	-43.4	-179.1	-65.4	-1.7	0	0	0	113	G112 I113 S120	G112-N116 PolarHBondContact O-N 3.46Å; I113-N116 PolarHBondContact O-N 3.05Å; N116-S120 WeakPolarHBondContact O-CB 3.47Å; N116-S120 PolarHBondContact O-N 3.37Å; N116-S120 VanDerWaalsContact O-N 3.08Å; N116-S120 PolarHBondContact O-OG 2.58Å
117	V	92.3	Very high	89.1	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.03	28%	0.28	C	S	.	.	H	α-helix	trans	-66	-43.8	177.3	171.3	0	0	0	0	110.1	I49 C96 F109 I113 Q115 S120 V121 W176	I49-V117 HydrophobicContact CD1-CG1 3.64Å; I49-V117 HydrophobicContact CG1-CG1 4.29Å; C96-V117 HydrophobicContact CB-CG2 3.98Å; F109-V117 HydrophobicContact CE1-CG2 4.32Å; F109-V117 HydrophobicContact CE2-CG1 4.38Å; F109-V117 HydrophobicContact CZ-CG1 4.15Å; I113-V117 HydrophobicContact CG2-CG2 3.89Å; I113-V117 WeakPolarHBondContact O-CB 3.48Å; I113-V117 VanDerWaalsContact O-CG2 3.27Å; I113-V117 WeakPolarHBondContact O-CG2 3.46Å; I113-V117 PolarHBondContact O-N 3.27Å; Q115-V117 PolarHBondContact O-N 2.75Å; V117-S120 PolarHBondContact O-N 3.48Å; V117-V121 HydrophobicContact CG1-CG2 4.24Å; V117-V121 WeakPolarHBondContact O-CB 3.4Å; V117-V121 VanDerWaalsContact O-CG2 3.27Å; V117-V121 WeakPolarHBondContact O-CG2 3.47Å; V117-V121 PolarHBondContact O-N 3.14Å; V117-W176 HydrophobicContact CG1-CH2 4.39Å; V117-W176 HydrophobicContact CG1-CZ2 4.01Å
118	S	92.6	Very high	89.2	Confident	7 Å²	7	54.8 Å²	54.8	5%	0.049	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-44.3	179.7	-61.4	0	0	0	0	112.2	W114 Q115 S120 V121 I122 W176	W114-S118 WeakPolarHBondContact O-CB 3.04Å; W114-S118 PolarHBondContact O-N 3.31Å; W114-S118 PolarHBondContact O-OG 3.48Å; Q115-S118 PolarHBondContact O-N 2.95Å; Q115-S118 VanDerWaalsContact O-N 3.14Å; S118-S120 VanDerWaalsContact C-N 3.29Å; S118-S120 PolarHBondContact O-N 3.43Å; S118-V121 PolarHBondContact O-N 3.13Å; S118-I122 WeakPolarHBondContact O-CB 3.28Å; S118-I122 WeakPolarHBondContact O-CD1 3.32Å; S118-I122 WeakPolarHBondContact O-CG1 3.5Å; S118-I122 PolarHBondContact O-N 3.34Å; S118-W176 PolarHBondContact OG-NE1 2.89Å
119	D	92.9	Very high	88.5	Confident	81 Å²	81	56.4 Å²	56.4	43%	0.433	29%	0.294	S	S	.	.	H	α-helix	trans	-61.9	-41.1	177.6	-64.7	-23.8	0	0	0	110.7	Q115 A123	Q115-D119 PolarHBondContact NE2-OD1 2.98Å; Q115-D119 PolarHBondContact NE2-OD2 3.45Å; Q115-D119 WeakPolarHBondContact O-CB 3.43Å; Q115-D119 PolarHBondContact O-N 3.31Å; D119-A123 WeakPolarHBondContact O-CB 3.29Å; D119-A123 PolarHBondContact O-N 3.08Å
120	S	92.3	Very high	87.2	Confident	43 Å²	43	60.3 Å²	60.3	30%	0.301	32%	0.322	S	S	.	.	H	α-helix	trans	-63.9	-49.4	175.4	-58.5	0	0	0	0	111.7	N116 V117 S118 I122 A123 Y124	N116-S120 WeakPolarHBondContact O-CB 3.47Å; N116-S120 PolarHBondContact O-N 3.37Å; N116-S120 VanDerWaalsContact O-N 3.08Å; N116-S120 PolarHBondContact O-OG 2.58Å; V117-S120 PolarHBondContact O-N 3.48Å; S118-S120 VanDerWaalsContact C-N 3.29Å; S118-S120 PolarHBondContact O-N 3.43Å; S120-I122 VanDerWaalsContact C-N 3.33Å; S120-I122 PolarHBondContact O-N 2.96Å; S120-A123 WeakPolarHBondContact O-CB 3.48Å; S120-A123 PolarHBondContact O-N 2.99Å; S120-A123 VanDerWaalsContact O-N 3.13Å; S120-Y124 VanDerWaalsContact O-CD2 3.26Å; S120-Y124 WeakPolarHBondContact O-CD2 3.36Å; S120-Y124 PolarHBondContact O-N 3.47Å
121	V	93.2	Very high	85.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.1	-43.2	178.7	170.5	0	0	0	0	111.2	V47 I49 I94 V117 S118 A123 Y124 R125 V157 W176 I178	V47-V121 HydrophobicContact CG1-CG2 4.48Å; I49-V121 HydrophobicContact CD1-CG2 4.05Å; I49-V121 HydrophobicContact CG1-CG2 4.48Å; I94-V121 HydrophobicContact CD1-CG2 3.8Å; V117-V121 HydrophobicContact CG1-CG2 4.24Å; V117-V121 WeakPolarHBondContact O-CB 3.4Å; V117-V121 VanDerWaalsContact O-CG2 3.27Å; V117-V121 WeakPolarHBondContact O-CG2 3.47Å; V117-V121 PolarHBondContact O-N 3.14Å; S118-V121 PolarHBondContact O-N 3.13Å; V121-A123 VanDerWaalsContact C-N 3.31Å; V121-A123 PolarHBondContact O-N 3.24Å; V121-Y124 WeakPolarHBondContact O-CB 3.35Å; V121-Y124 PolarHBondContact O-N 3.47Å; V121-R125 WeakPolarHBondContact O-CB 3.35Å; V121-R125 PolarHBondContact O-N 2.91Å; V121-V157 HydrophobicContact CG1-CG2 3.66Å; V121-W176 HydrophobicContact CB-CD2 4.26Å; V121-W176 HydrophobicContact CB-CG 4.3Å; V121-W176 HydrophobicContact CG1-CB 3.91Å; V121-W176 HydrophobicContact CG1-CD2 3.73Å; V121-W176 HydrophobicContact CG1-CE3 4.09Å; V121-W176 HydrophobicContact CG1-CG 3.64Å; V121-W176 HydrophobicContact CG2-CD2 4.42Å; V121-W176 HydrophobicContact CG2-CZ2 4.35Å; V121-I178 HydrophobicContact CG1-CD1 4.02Å
122	I	93.4	Very high	82.9	Confident	52 Å²	52	62.5 Å²	62.5	27%	0.267	34%	0.339	S	S	.	.	H	α-helix	trans	-63.5	-38.8	176.6	-69	165.1	0	0	0	110.6	S118 S120 R125 D126	S118-I122 WeakPolarHBondContact O-CB 3.28Å; S118-I122 WeakPolarHBondContact O-CD1 3.32Å; S118-I122 WeakPolarHBondContact O-CG1 3.5Å; S118-I122 PolarHBondContact O-N 3.34Å; S120-I122 VanDerWaalsContact C-N 3.33Å; S120-I122 PolarHBondContact O-N 2.96Å; I122-R125 PolarHBondContact O-N 3.43Å; I122-D126 WeakPolarHBondContact O-CB 3.49Å; I122-D126 PolarHBondContact O-N 3.29Å
123	A	91.7	Very high	80.1	Confident	27 Å²	27	66.6 Å²	66.6	22%	0.223	36%	0.355	C	S	.	.	H	α-helix	trans	-63.9	-41.2	173.9	0	0	0	0	0	112.5	D119 S120 V121 G127 K128	D119-A123 WeakPolarHBondContact O-CB 3.29Å; D119-A123 PolarHBondContact O-N 3.08Å; S120-A123 WeakPolarHBondContact O-CB 3.48Å; S120-A123 PolarHBondContact O-N 2.99Å; S120-A123 VanDerWaalsContact O-N 3.13Å; V121-A123 VanDerWaalsContact C-N 3.31Å; V121-A123 PolarHBondContact O-N 3.24Å; A123-G127 CarbonylContact O-C 3.59Å; A123-G127 PolarHBondContact O-N 2.83Å; A123-K128 PolarHBondContact O-N 3.37Å
124	Y	92.7	Very high	77.3	Confident	45 Å²	45	68 Å²	68	18%	0.176	37%	0.372	C	S	.	.	H	α-helix	trans	-62	-43.9	173	-87.4	-82.7	0	0	0	112	V47 V91 I94 S120 V121 G127 Q129 A154	V47-Y124 HydrophobicContact CB-CD1 4.38Å; V47-Y124 HydrophobicContact CB-CG 4.22Å; V47-Y124 HydrophobicContact CG2-CD1 4.18Å; V47-Y124 HydrophobicContact CG2-CD2 3.82Å; V47-Y124 HydrophobicContact CG2-CE1 4.42Å; V47-Y124 HydrophobicContact CG2-CE2 4.07Å; V47-Y124 HydrophobicContact CG2-CG 3.91Å; V91-Y124 HydrophobicContact CG1-CD1 3.92Å; V91-Y124 HydrophobicContact CG1-CE1 4.18Å; I94-Y124 HydrophobicContact CD1-CD2 3.99Å; I94-Y124 HydrophobicContact CD1-CE2 4.03Å; I94-Y124 HydrophobicContact CG1-CD2 4.37Å; I94-Y124 HydrophobicContact CG1-CE2 3.9Å; S120-Y124 VanDerWaalsContact O-CD2 3.26Å; S120-Y124 WeakPolarHBondContact O-CD2 3.36Å; S120-Y124 PolarHBondContact O-N 3.47Å; V121-Y124 WeakPolarHBondContact O-CB 3.35Å; V121-Y124 PolarHBondContact O-N 3.47Å; Y124-G127 PolarHBondContact O-N 3.35Å; Y124-Q129 HydrophobicContact CD1-CG 3.82Å; Y124-Q129 HydrophobicContact CD2-CG 4.46Å; Y124-Q129 HydrophobicContact CE1-CG 4.01Å; Y124-Q129 HydrophobicContact CG-CG 4.04Å; Y124-A154 PolarHBondContact O-N 2.79Å
125	R	90.7	Very high	74.3	Confident	60 Å²	60	71.8 Å²	71.8	23%	0.226	40%	0.398	C	S	.	.	H	α-helix	trans	-62	-48.9	177.6	-176.4	-164.8	71.9	-175.8	2.7	112.2	V121 I122 G127 R153 W176 I178	V121-R125 WeakPolarHBondContact O-CB 3.35Å; V121-R125 PolarHBondContact O-N 2.91Å; I122-R125 PolarHBondContact O-N 3.43Å; R125-G127 PolarHBondContact O-N 3.02Å; R125-R153 WeakPolarHBondContact O-CG 3.04Å; R125-W176 WeakPolarHBondContact CD-O 3.46Å; R125-W176 PolarHBondContact NH1-O 2.93Å; R125-I178 HydrophobicContact CB-CD1 4.41Å; R125-I178 HydrophobicContact CG-CG2 3.9Å
126	D	90.1	Very high	71.2	Confident	45 Å²	45	73.2 Å²	73.2	24%	0.241	41%	0.413	C	S	.	.	H	α-helix	trans	-75.4	-13.1	-177.3	-68.9	5.3	0	0	0	112.1	I122 K128 R153	I122-D126 WeakPolarHBondContact O-CB 3.49Å; I122-D126 PolarHBondContact O-N 3.29Å; D126-K128 VanDerWaalsContact C-N 3.34Å; D126-K128 HydrophobicContact CB-CD 4.06Å; D126-K128 HydrophobicContact CB-CG 4.04Å; D126-K128 IonicContact OD2-NZ 3.92Å; D126-R153 PolarHBondContact O-NE 2.94Å; D126-R153 PolarHBondContact O-NH2 3.44Å
127	G	85.4	Confident	68.1	Low	25 Å²	25	75.4 Å²	75.4	26%	0.258	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	19.3	-175.1	0	0	0	0	0	113.3	A123 Y124 R125	A123-G127 CarbonylContact O-C 3.59Å; A123-G127 PolarHBondContact O-N 2.83Å; Y124-G127 PolarHBondContact O-N 3.35Å; R125-G127 PolarHBondContact O-N 3.02Å
128	K	82.1	Confident	64.9	Low	158 Å²	158	80.6 Å²	80.6	69%	0.687	46%	0.458	S	S	*	.			trans	-99	31.3	-175.7	-64.1	178	-179.2	166.7	0	112.8	A123 D126 S130	A123-K128 PolarHBondContact O-N 3.37Å; D126-K128 VanDerWaalsContact C-N 3.34Å; D126-K128 HydrophobicContact CB-CD 4.06Å; D126-K128 HydrophobicContact CB-CG 4.04Å; D126-K128 IonicContact OD2-NZ 3.92Å; K128-S130 PolarHBondContact O-N 3.42Å
129	Q	70.3	Confident	61.7	Low	36 Å²	36	87.7 Å²	87.7	17%	0.168	50%	0.495	C	S	.	.			trans	-63.6	127	-176.8	-56.6	163.4	19.1	0	0	110.8	Y124 K151 K152	Y124-Q129 HydrophobicContact CD1-CG 3.82Å; Y124-Q129 HydrophobicContact CD2-CG 4.46Å; Y124-Q129 HydrophobicContact CE1-CG 4.01Å; Y124-Q129 HydrophobicContact CG-CG 4.04Å; Q129-K151 HydrophobicContact CB-CD 4.2Å; Q129-K151 PolarHBondContact O-NZ 3.36Å; Q129-K152 PolarHBondContact NE2-O 2.95Å
130	S	56.5	Low	58.6	Low	89 Å²	89	93.3 Å²	93.3	62%	0.622	52%	0.519	S	S	*	.			trans	-68.7	141.9	166.5	51.1	0	0	0	0	109.9	K128 Q132	K128-S130 PolarHBondContact O-N 3.42Å; S130-Q132 PolarHBondContact O-N 3.43Å
131	V	42.1	Very low	55.5	Low	112 Å²	112	99.7 Å²	99.7	68%	0.679	54%	0.544	S	S	*	.			trans	-67.6	101.5	169.9	178.6	0	0	0	0	106.7	T133	V131-T133 HydrophobicContact CG1-CG2 4.32Å
132	Q	39.5	Very low	52.2	Low	162 Å²	162	106.1 Å²	106.1	76%	0.757	58%	0.578	S	S	*	*			trans	-88.2	102	158.8	-67.9	-174	22.3	0	0	106.1	S130 A134	S130-Q132 PolarHBondContact O-N 3.43Å; Q132-A134 PolarHBondContact O-N 3.38Å
133	T	26.2	Very low	49.1	Very low	132 Å²	132	111.5 Å²	111.5	81%	0.81	61%	0.607	S	S	*	*			trans	-62.7	88	159.1	30.4	0	0	0	0	107.8	V131	V131-T133 HydrophobicContact CG1-CG2 4.32Å
134	A	27.8	Very low	45.9	Very low	67 Å²	67	116.3 Å²	116.3	55%	0.554	64%	0.635	S	S	*	*			trans	-141	130.4	164.1	0	0	0	0	0	107.2	Q132	Q132-A134 PolarHBondContact O-N 3.38Å
135	D	27	Very low	42.8	Very low	152 Å²	152	123.2 Å²	123.2	81%	0.813	67%	0.666	S	S	*	*			trans	84.6	31	170.6	-46.2	-20.2	0	0	0	117.9
136	T	25	Very low	39.8	Very low	129 Å²	129	126.1 Å²	126.1	79%	0.791	70%	0.695	S	S	*	*			trans	-83.6	113.4	148.7	-32	0	0	0	0	107.5
137	L	25.4	Very low	36.9	Very low	157 Å²	157	131.5 Å²	131.5	82%	0.822	72%	0.719	S	S	*	*			trans	-51.7	135.3	167.7	-83.1	116.7	0	0	0	108.9	N139	L137-N139 PolarHBondContact O-N 2.99Å
138	P	26.5	Very low	34.3	Very low	113 Å²	113	139.3 Å²	139.3	73%	0.734	75%	0.748	S	S	*	*	S	Bend	trans	-71.5	106.9	179.8	28.6	-29.5	0	0	0	107.3
139	N	23.9	Very low	32.2	Very low	156 Å²	156	138.9 Å²	138.9	83%	0.834	75%	0.752	S	S	*	*			trans	166.9	88.5	147.9	-79.8	-14.7	0	0	0	107.8	L137	L137-N139 PolarHBondContact O-N 2.99Å
140	E	28.3	Very low	30.9	Very low	199 Å²	199	143.3 Å²	143.3	93%	0.93	78%	0.781	S	S	*	*			trans	-169.2	105.9	139.2	-106	173.7	-152.8	0	0	108
141	E	26.7	Very low	31.2	Very low	177 Å²	177	142.9 Å²	142.9	83%	0.827	77%	0.768	S	S	*	*			trans	-69.1	135.2	173.2	-69.8	-176.8	158.2	0	0	110.1
142	N	25	Very low	33.1	Very low	135 Å²	135	142.7 Å²	142.7	72%	0.722	76%	0.758	S	S	*	*			trans	62.6	99	147.3	-54.9	-26.5	0	0	0	117.9
143	N	28	Very low	35.6	Very low	165 Å²	165	142.8 Å²	142.8	88%	0.882	75%	0.752	S	S	*	*				-153.6	124.1	124.4	-98.5	-30.5	0	0	0	112.3	F145	N143-F145 PolarHBondContact O-N 2.77Å
144	T	24.5	Very low	38.7	Very low	129 Å²	129	136.6 Å²	136.6	79%	0.791	71%	0.714	S	S	*	*			trans	-72.5	96.4	177.7	45.3	0	0	0	0	111.3
145	F	27	Very low	41.7	Very low	189 Å²	189	136.1 Å²	136.1	83%	0.829	70%	0.704	S	S	*	*			trans	-144.7	90.8	151.9	-91.2	-82.3	0	0	0	107.9	N143 E147	N143-F145 PolarHBondContact O-N 2.77Å; F145-E147 PolarHBondContact O-N 2.79Å
146	S	28.6	Very low	44.9	Very low	122 Å²	122	128.9 Å²	128.9	85%	0.853	67%	0.666	S	S	*	*			trans	-75.2	69.6	168.6	54.8	0	0	0	0	109	H148	S146-H148 PolarHBondContact O-N 2.82Å
147	E	28.9	Very low	48.2	Very low	158 Å²	158	122.7 Å²	122.7	74%	0.738	63%	0.628	S	S	*	*			trans	-61.1	130.6	161.2	-79.6	-173.8	160	0	0	107.8	F145 I149	F145-E147 PolarHBondContact O-N 2.79Å; E147-I149 PolarHBondContact O-N 2.81Å
148	H	31.2	Very low	51.4	Low	188 Å²	188	115.3 Å²	115.3	87%	0.87	59%	0.589	S	S	*	*			trans	-57.5	86.2	170.9	-82.6	-78.7	0	0	0	109.6	S146 V150	S146-H148 PolarHBondContact O-N 2.82Å; H148-V150 VanDerWaalsContact C-N 3.34Å; H148-V150 PolarHBondContact O-N 3.39Å
149	I	38	Very low	54.6	Low	149 Å²	149	110 Å²	110	76%	0.764	55%	0.554	S	S	*	*			trans	-63.8	101.8	167.8	-58.7	172.7	0	0	0	105.7	E147 K151	E147-I149 PolarHBondContact O-N 2.81Å; I149-K151 PolarHBondContact O-N 3.22Å
150	V	42.5	Very low	57.7	Low	129 Å²	129	102.6 Å²	102.6	78%	0.782	52%	0.515	S	S	*	.			trans	-57.3	102.8	170	177.3	0	0	0	0	106.6	H148 K152	H148-V150 VanDerWaalsContact C-N 3.34Å; H148-V150 PolarHBondContact O-N 3.39Å; V150-K152 PolarHBondContact O-N 3.24Å; V150-K152 VanDerWaalsContact O-N 3.14Å
151	K	63.7	Low	60.5	Low	81 Å²	81	93.4 Å²	93.4	35%	0.352	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-63.1	117.6	179.3	-64.5	-170.5	-176.1	-172.7	0	108.4	Q129 I149	Q129-K151 HydrophobicContact CB-CD 4.2Å; Q129-K151 PolarHBondContact O-NZ 3.36Å; I149-K151 PolarHBondContact O-N 3.22Å
152	K	82.4	Confident	63.2	Low	108 Å²	108	85.7 Å²	85.7	47%	0.47	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-58.8	140.7	177.8	-73.9	-172.8	174	-169.2	0	110.6	D45 T89 V91 Q129 V150	D45-K152 IonicContact OD1-NZ 3.66Å; T89-K152 PolarHBondContact OG1-NZ 3.38Å; V91-K152 HydrophobicContact CG1-CB 4.3Å; V91-K152 WeakPolarHBondContact CG1-O 3.49Å; V91-K152 HydrophobicContact CG2-CB 4.16Å; Q129-K152 PolarHBondContact NE2-O 2.95Å; V150-K152 PolarHBondContact O-N 3.24Å; V150-K152 VanDerWaalsContact O-N 3.14Å
153	R	90.3	Very high	66	Low	163 Å²	163	84.2 Å²	84.2	62%	0.615	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-83.8	135.6	174.8	-75.1	-176.4	166.8	152.3	-1.2	109.9	D45 R125 D126	D45-R153 WeakPolarHBondContact CB-O 3.48Å; R125-R153 WeakPolarHBondContact O-CG 3.04Å; D126-R153 PolarHBondContact O-NE 2.94Å; D126-R153 PolarHBondContact O-NH2 3.44Å
154	A	92	Very high	68.8	Low	3 Å²	3	76.9 Å²	76.9	3%	0.025	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-73	133.7	172.1	0	0	0	0	0	110.6	D45 V47 Y124	D45-A154 CarbonylContact O-C 3.5Å; D45-A154 WeakPolarHBondContact O-CA 3.48Å; V47-A154 HydrophobicContact CB-CB 4.23Å; V47-A154 HydrophobicContact CG1-CB 4.14Å; Y124-A154 PolarHBondContact O-N 2.79Å
155	T	91.6	Very high	71.7	Confident	56 Å²	56	73.1 Å²	73.1	34%	0.344	36%	0.359	S	S	.	.			trans	-108.8	-15	177.7	59.9	0	0	0	0	112.5	H44 D45 P179	H44-T155 WeakPolarHBondContact CA-OG1 3.05Å; H44-T155 PolarHBondContact ND1-OG1 3.24Å; D45-T155 HydrophobicContact CB-CG2 4.45Å; D45-T155 PolarHBondContact N-OG1 2.81Å; D45-T155 PolarHBondContact O-N 3.08Å; D45-T155 PolarHBondContact O-OG1 3Å; T155-P179 VanDerWaalsContact O-CD 3.31Å; T155-P179 WeakPolarHBondContact O-CD 3.38Å
156	A	92.9	Very high	74.3	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	163.5	176.6	0	0	0	0	0	111.5	H44 D45 I46 V47 P179 Y181	H44-A156 HydrophobicContact CB-CB 3.86Å; D45-A156 PolarHBondContact O-N 3.47Å; I46-A156 WeakPolarHBondContact CA-O 3.44Å; I46-A156 HydrophobicContact CG1-CB 4.17Å; V47-A156 PolarHBondContact N-O 3.4Å; V47-A156 VanDerWaalsContact N-O 3.11Å; A156-P179 WeakPolarHBondContact CA-O 3.49Å; A156-P179 HydrophobicContact CB-CG 3.88Å; A156-Y181 HydrophobicContact CB-CD2 4.17Å; A156-Y181 HydrophobicContact CB-CE2 3.88Å
157	V	94.2	Very high	76.9	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.7	173.9	-174.8	0	0	0	0	109.8	V47 I49 V121 V159 W176 I178 P179 V180 Y181	V47-V157 HydrophobicContact CG1-CB 4.26Å; V47-V157 HydrophobicContact CG1-CG1 4.22Å; V47-V157 HydrophobicContact CG1-CG2 3.77Å; V47-V157 WeakPolarHBondContact O-CA 3.25Å; I49-V157 HydrophobicContact CD1-CG1 3.54Å; I49-V157 HydrophobicContact CG1-CG1 3.88Å; V121-V157 HydrophobicContact CG1-CG2 3.66Å; V157-V159 HydrophobicContact CG1-CG2 4.5Å; V157-W176 HydrophobicContact CB-CE3 4.27Å; V157-W176 HydrophobicContact CB-CZ3 4.19Å; V157-W176 HydrophobicContact CG1-CE3 4.34Å; V157-W176 HydrophobicContact CG1-CZ3 3.84Å; V157-W176 HydrophobicContact CG2-CE3 3.78Å; V157-W176 HydrophobicContact CG2-CZ3 4.14Å; V157-I178 HydrophobicContact CG2-CD1 3.47Å; V157-I178 VanDerWaalsContact CG2-CD1 3.47Å; V157-I178 HydrophobicContact CG2-CG1 3.99Å; V157-P179 PolarHBondContact N-O 2.64Å; V157-V180 HydrophobicContact CB-CG2 4.21Å; V157-V180 CarbonylContact O-C 3.55Å; V157-V180 WeakPolarHBondContact O-CA 3.43Å; V157-Y181 PolarHBondContact O-N 2.79Å
158	L	94.2	Very high	79.8	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119	164.6	171.4	58.5	0	0	0	108.7	I46 V47 I48 I49 A78 V82 Y181 L186	I46-L158 HydrophobicContact CG2-CB 3.67Å; V47-L158 PolarHBondContact O-N 2.9Å; I48-L158 CarbonylContact C-O 3.52Å; I48-L158 WeakPolarHBondContact CA-O 3.5Å; I48-L158 HydrophobicContact CD1-CD2 4.47Å; I48-L158 HydrophobicContact CG1-CB 4.37Å; I48-L158 HydrophobicContact CG1-CD2 4.28Å; I49-L158 PolarHBondContact N-O 3.26Å; A78-L158 HydrophobicContact CB-CD2 4.4Å; V82-L158 HydrophobicContact CG2-CD2 3.64Å; L158-Y181 WeakPolarHBondContact CA-O 3.2Å; L158-L186 HydrophobicContact CB-CD1 4.46Å; L158-L186 HydrophobicContact CD1-CD1 3.48Å; L158-L186 VanDerWaalsContact CD1-CD1 3.48Å; L158-L186 HydrophobicContact CD1-CG 4.13Å; L158-L186 HydrophobicContact CD2-CD1 3.67Å; L158-L186 HydrophobicContact CG-CD1 4.04Å
159	V	92.7	Very high	82.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	114.8	163.9	-172.5	0	0	0	0	107.1	I49 F108 V157 W161 L164 M172 V180 Y181	I49-V159 HydrophobicContact CD1-CG2 4.24Å; F108-V159 HydrophobicContact CE1-CG1 3.77Å; F108-V159 HydrophobicContact CZ-CG1 3.91Å; V157-V159 HydrophobicContact CG1-CG2 4.5Å; V159-W161 HydrophobicContact CG1-CB 3.87Å; V159-W161 PolarHBondContact O-N 3.06Å; V159-L164 HydrophobicContact CB-CD1 3.99Å; V159-L164 HydrophobicContact CG1-CD2 4.38Å; V159-L164 HydrophobicContact CG2-CD1 3.91Å; V159-M172 HydrophobicContact CG2-SD 4.01Å; V159-V180 HydrophobicContact CG2-CG1 4.01Å; V159-Y181 PolarHBondContact N-O 3.12Å
160	N	89.8	Confident	84.5	Confident	1 Å²	1	44 Å²	44	1%	0.005	22%	0.221	C	C	.	.			trans	-72.8	69.1	178.4	-168.7	17.4	0	0	0	110.5	I48 I49 Q50 P51 P73 N74 A78	I48-N160 HydrophobicContact CG2-CB 4.14Å; I49-N160 PolarHBondContact O-N 2.81Å; Q50-N160 PolarHBondContact OE1-ND2 3.4Å; P51-N160 WeakPolarHBondContact CD-O 3.28Å; P51-N160 WeakPolarHBondContact CG-O 3.42Å; P73-N160 WeakPolarHBondContact CG-O 3.18Å; P73-N160 PolarHBondContact O-ND2 2.82Å; N74-N160 PolarHBondContact O-ND2 3.31Å; N74-N160 VanDerWaalsContact O-ND2 3.15Å; A78-N160 HydrophobicContact CB-CB 4.25Å; A78-N160 WeakPolarHBondContact CB-ND2 2.88Å
161	W	86.7	Confident	86.6	Confident	6 Å²	6	41.7 Å²	41.7	2%	0.023	20%	0.204	C	C	.	.	S	Bend	trans	-138.4	141	-176.8	-167.7	-103.5	0	0	0	108.7	P51 I53 L68 T103 F108 V159 R163 R183	P51-W161 HydrophobicContact CB-CE3 4.3Å; P51-W161 HydrophobicContact CB-CZ3 4.46Å; P51-W161 HydrophobicContact CG-CE3 3.65Å; P51-W161 HydrophobicContact CG-CZ3 4.17Å; I53-W161 HydrophobicContact CD1-CH2 3.72Å; I53-W161 HydrophobicContact CD1-CZ3 3.77Å; I53-W161 HydrophobicContact CG1-CH2 4.45Å; I53-W161 HydrophobicContact CG1-CZ3 4.24Å; L68-W161 HydrophobicContact CD2-CH2 4.09Å; L68-W161 HydrophobicContact CD2-CZ2 3.5Å; L68-W161 VanDerWaalsContact CD2-CZ2 3.5Å; T103-W161 HydrophobicContact CG2-CH2 3.71Å; T103-W161 HydrophobicContact CG2-CZ2 3.32Å; F108-W161 HydrophobicContact CE2-CB 4.36Å; F108-W161 AromaticContact CE2-CD1 3.75Å; F108-W161 AromaticContact CE2-CD2 3.68Å; F108-W161 HydrophobicContact CE2-CD2 3.68Å; F108-W161 AromaticContact CE2-CE2 3.8Å; F108-W161 HydrophobicContact CE2-CE3 4.29Å; F108-W161 AromaticContact CE2-CG 3.68Å; F108-W161 HydrophobicContact CE2-CG 3.68Å; F108-W161 HydrophobicContact CE2-CZ2 4.48Å; F108-W161 AromaticContact CE2-NE1 3.83Å; F108-W161 HydrophobicContact CZ-CB 4.08Å; F108-W161 AromaticContact CZ-CD2 3.79Å; F108-W161 HydrophobicContact CZ-CD2 3.79Å; F108-W161 HydrophobicContact CZ-CE3 4.05Å; F108-W161 AromaticContact CZ-CG 3.8Å; F108-W161 HydrophobicContact CZ-CG 3.8Å; V159-W161 HydrophobicContact CG1-CB 3.87Å; V159-W161 PolarHBondContact O-N 3.06Å; W161-R163 VanDerWaalsContact CD1-O 3.25Å; W161-R163 PolarHBondContact O-N 3.49Å; W161-R183 WeakPolarHBondContact O-CB 3.22Å; W161-R183 PolarHBondContact O-N 2.85Å
162	P	83.2	Confident	87.9	Confident	15 Å²	15	38 Å²	38	10%	0.097	19%	0.188	C	C	.	.	S	Bend	trans	-48.6	-58.8	-176.3	-25.3	26.2	0	0	0	112.6	P69 Y184 D373	P69-P162 HydrophobicContact CG-CG 3.57Å; P162-Y184 WeakPolarHBondContact O-CB 3.45Å; P162-Y184 PolarHBondContact O-N 3.3Å; P162-D373 HydrophobicContact CB-CB 3.82Å; P162-D373 HydrophobicContact CG-CB 3.93Å
163	R	84.8	Confident	88.2	Confident	104 Å²	104	36.2 Å²	36.2	39%	0.392	18%	0.181	S	C	.	.			trans	-150	126.6	-177.8	-174.3	-178.3	-76.7	-166.3	-6.9	110.5	W161 D182 Y184	W161-R163 VanDerWaalsContact CD1-O 3.25Å; W161-R163 PolarHBondContact O-N 3.49Å; R163-D182 WeakPolarHBondContact CA-OD2 3.29Å; R163-Y184 PolarHBondContact NH2-OH 3.38Å
164	L	86.6	Confident	88	Confident	11 Å²	11	35.5 Å²	35.5	6%	0.058	19%	0.185	C	C	.	.			trans	-86.6	148.9	170.1	-69	174.2	0	0	0	110.1	F108 V159 M172 V180 D182	F108-L164 HydrophobicContact CD2-CD2 3.73Å; F108-L164 HydrophobicContact CE2-CD2 3.82Å; F108-L164 HydrophobicContact CG-CD2 4.15Å; F108-L164 HydrophobicContact CZ-CD2 4.28Å; V159-L164 HydrophobicContact CB-CD1 3.99Å; V159-L164 HydrophobicContact CG1-CD2 4.38Å; V159-L164 HydrophobicContact CG2-CD1 3.91Å; L164-M172 HydrophobicContact CD1-SD 4.06Å; L164-M172 HydrophobicContact CD2-CE 4.33Å; L164-V180 HydrophobicContact CD1-CG1 4.31Å; L164-D182 HydrophobicContact CB-CB 4.25Å; L164-D182 HydrophobicContact CD1-CB 4.15Å; L164-D182 HydrophobicContact CG-CB 3.93Å; L164-D182 PolarHBondContact N-OD2 2.79Å
165	T	84.5	Confident	87.9	Confident	51 Å²	51	37.4 Å²	37.4	31%	0.313	20%	0.2	S	C	.	.			trans	-71.9	154.3	168.4	66.7	0	0	0	0	110	L167 Q168 L169	T165-L167 PolarHBondContact O-N 3.3Å; T165-Q168 WeakPolarHBondContact O-CB 3.42Å; T165-Q168 PolarHBondContact O-N 3.18Å; T165-Q168 VanDerWaalsContact O-N 3.09Å; T165-Q168 WeakPolarHBondContact OG1-CB 3.34Å; T165-Q168 WeakPolarHBondContact OG1-CG 3.32Å; T165-Q168 PolarHBondContact OG1-N 3.14Å; T165-Q168 PolarHBondContact OG1-OE1 3.05Å; T165-Q168 VanDerWaalsContact OG1-OE1 3.09Å; T165-L169 PolarHBondContact O-N 3.34Å
166	T	82.7	Confident	88	Confident	26 Å²	26	34.8 Å²	34.8	16%	0.16	18%	0.184	C	C	.	.	H	α-helix	trans	-62.2	-35.4	-176.9	-40.9	0	0	0	0	112.4	A170 A214 R215 A218	T166-A170 WeakPolarHBondContact O-CB 3.47Å; T166-A170 PolarHBondContact O-N 3.14Å; T166-A214 PolarHBondContact OG1-O 2.66Å; T166-R215 HydrophobicContact CG2-CB 4.11Å; T166-R215 HydrophobicContact CG2-CG 4.04Å; T166-A218 HydrophobicContact CG2-CB 3.18Å
167	L	82.7	Confident	87.8	Confident	113 Å²	113	41.2 Å²	41.2	59%	0.592	22%	0.218	S	C	*	.	H	α-helix	trans	-65.2	-45.1	173.6	-179.1	63.8	0	0	0	111.9	T165 L169 A170 L171	T165-L167 PolarHBondContact O-N 3.3Å; L167-L169 VanDerWaalsContact C-N 3.35Å; L167-L169 PolarHBondContact O-N 2.97Å; L167-A170 PolarHBondContact O-N 2.87Å; L167-L171 HydrophobicContact CD1-CD1 4.2Å; L167-L171 HydrophobicContact CD1-CG 4.22Å; L167-L171 HydrophobicContact CG-CD1 4.01Å; L167-L171 HydrophobicContact CG-CG 4.44Å; L167-L171 WeakPolarHBondContact O-CB 3.47Å; L167-L171 VanDerWaalsContact O-CG 3.27Å; L167-L171 WeakPolarHBondContact O-CG 3.49Å; L167-L171 PolarHBondContact O-N 2.96Å
168	Q	88.2	Confident	87.7	Confident	6 Å²	6	42.1 Å²	42.1	3%	0.028	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-46.8	177.5	-74.5	162.2	-11.1	0	0	111	N102 T103 G106 F108 T165 L171 M172	N102-Q168 PolarHBondContact O-NE2 3.46Å; T103-Q168 PolarHBondContact O-NE2 2.97Å; G106-Q168 PolarHBondContact O-NE2 3.43Å; F108-Q168 HydrophobicContact CB-CG 4.05Å; T165-Q168 WeakPolarHBondContact O-CB 3.42Å; T165-Q168 PolarHBondContact O-N 3.18Å; T165-Q168 VanDerWaalsContact O-N 3.09Å; T165-Q168 WeakPolarHBondContact OG1-CB 3.34Å; T165-Q168 WeakPolarHBondContact OG1-CG 3.32Å; T165-Q168 PolarHBondContact OG1-N 3.14Å; T165-Q168 PolarHBondContact OG1-OE1 3.05Å; T165-Q168 VanDerWaalsContact OG1-OE1 3.09Å; Q168-L171 PolarHBondContact O-N 3.15Å; Q168-M172 HydrophobicContact CB-CE 4.4Å; Q168-M172 WeakPolarHBondContact O-CB 3.37Å; Q168-M172 WeakPolarHBondContact O-CG 3.39Å; Q168-M172 PolarHBondContact O-N 3.23Å
169	L	86.5	Confident	87.5	Confident	9 Å²	9	44 Å²	44	5%	0.047	24%	0.235	C	C	.	.	H	α-helix	trans	-60.8	-46.9	178.1	-170	158.4	0	0	0	111.2	T165 L167 L171 M172 Q173	T165-L169 PolarHBondContact O-N 3.34Å; L167-L169 VanDerWaalsContact C-N 3.35Å; L167-L169 PolarHBondContact O-N 2.97Å; L169-L171 PolarHBondContact O-N 3.43Å; L169-M172 PolarHBondContact O-N 3Å; L169-Q173 HydrophobicContact CD2-CG 4Å; L169-Q173 WeakPolarHBondContact O-CG 3.29Å; L169-Q173 PolarHBondContact O-N 3.42Å
170	A	82.2	Confident	87.4	Confident	40 Å²	40	44 Å²	44	33%	0.331	24%	0.235	S	C	.	.	H	α-helix	trans	-60.5	-46	178.8	0	0	0	0	0	112.5	T166 L167 M172 Q173 Q174	T166-A170 WeakPolarHBondContact O-CB 3.47Å; T166-A170 PolarHBondContact O-N 3.14Å; L167-A170 PolarHBondContact O-N 2.87Å; A170-M172 PolarHBondContact O-N 3.38Å; A170-Q173 PolarHBondContact O-N 3.18Å; A170-Q174 WeakPolarHBondContact O-CB 3.36Å; A170-Q174 PolarHBondContact O-N 2.91Å
171	L	86.4	Confident	87.5	Confident	80 Å²	80	45 Å²	45	42%	0.419	24%	0.239	S	C	.	.	H	α-helix	trans	-61.6	-42.5	177.3	-71.3	172.4	0	0	0	111.9	L167 Q168 L169 Q174 A175	L167-L171 HydrophobicContact CD1-CD1 4.2Å; L167-L171 HydrophobicContact CD1-CG 4.22Å; L167-L171 HydrophobicContact CG-CD1 4.01Å; L167-L171 HydrophobicContact CG-CG 4.44Å; L167-L171 WeakPolarHBondContact O-CB 3.47Å; L167-L171 VanDerWaalsContact O-CG 3.27Å; L167-L171 WeakPolarHBondContact O-CG 3.49Å; L167-L171 PolarHBondContact O-N 2.96Å; Q168-L171 PolarHBondContact O-N 3.15Å; L169-L171 PolarHBondContact O-N 3.43Å; L171-Q174 PolarHBondContact O-N 2.93Å; L171-A175 WeakPolarHBondContact O-CB 3.3Å; L171-A175 PolarHBondContact O-N 3.4Å
172	M	90.5	Very high	87.6	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.02	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-48.2	177.3	-69.9	177.8	-168.1	0	0	112.3	F108 F109 W114 V159 L164 Q168 L169 A170 Q174 A175 W176 V180	F108-M172 HydrophobicContact CB-CE 3.62Å; F108-M172 HydrophobicContact CD1-CE 3.83Å; F108-M172 HydrophobicContact CG-CE 3.92Å; F109-M172 HydrophobicContact CD2-CE 3.93Å; F109-M172 HydrophobicContact CE2-CE 3.46Å; F109-M172 VanDerWaalsContact CE2-CE 3.46Å; F109-M172 HydrophobicContact CE2-SD 4.33Å; F109-M172 HydrophobicContact CZ-CE 4.35Å; W114-M172 HydrophobicContact CH2-CG 4.11Å; W114-M172 HydrophobicContact CZ3-CG 3.9Å; V159-M172 HydrophobicContact CG2-SD 4.01Å; L164-M172 HydrophobicContact CD1-SD 4.06Å; L164-M172 HydrophobicContact CD2-CE 4.33Å; Q168-M172 HydrophobicContact CB-CE 4.4Å; Q168-M172 WeakPolarHBondContact O-CB 3.37Å; Q168-M172 WeakPolarHBondContact O-CG 3.39Å; Q168-M172 PolarHBondContact O-N 3.23Å; L169-M172 PolarHBondContact O-N 3Å; A170-M172 PolarHBondContact O-N 3.38Å; M172-Q174 VanDerWaalsContact C-N 3.34Å; M172-Q174 PolarHBondContact O-N 2.86Å; M172-A175 PolarHBondContact O-N 3.34Å; M172-W176 HydrophobicContact CB-CE3 3.92Å; M172-W176 HydrophobicContact CB-CH2 4.02Å; M172-W176 HydrophobicContact CB-CZ3 3.65Å; M172-W176 HydrophobicContact CG-CH2 3.76Å; M172-W176 HydrophobicContact CG-CZ2 4.32Å; M172-W176 HydrophobicContact CG-CZ3 3.9Å; M172-W176 PolarHBondContact O-N 3.37Å; M172-W176 HydrophobicContact SD-CH2 3.9Å; M172-W176 HydrophobicContact SD-CZ3 4.03Å; M172-V180 HydrophobicContact CB-CB 4.4Å; M172-V180 HydrophobicContact CB-CG1 4.23Å; M172-V180 HydrophobicContact CB-CG2 3.87Å; M172-V180 HydrophobicContact SD-CG1 4.1Å
173	Q	89.9	Confident	87.8	Confident	70 Å²	70	44.4 Å²	44.4	33%	0.327	24%	0.235	S	C	.	.	H	α-helix	trans	-63.9	-39	178	-69.8	-173.4	158.8	0	0	112.4	L169 A170 A175 L177 V180	L169-Q173 HydrophobicContact CD2-CG 4Å; L169-Q173 WeakPolarHBondContact O-CG 3.29Å; L169-Q173 PolarHBondContact O-N 3.42Å; A170-Q173 PolarHBondContact O-N 3.18Å; Q173-A175 VanDerWaalsContact C-N 3.34Å; Q173-L177 VanDerWaalsContact O-CA 3.32Å; Q173-L177 WeakPolarHBondContact O-CA 3.48Å; Q173-L177 PolarHBondContact O-N 2.94Å; Q173-V180 HydrophobicContact CG-CB 3.76Å; Q173-V180 HydrophobicContact CG-CG2 3.65Å; Q173-V180 VanDerWaalsContact OE1-N 3.16Å
174	Q	86.5	Confident	87.9	Confident	149 Å²	149	40.2 Å²	40.2	70%	0.696	22%	0.219	S	C	*	.	H	α-helix	trans	-65.8	-38.5	177.6	-175.7	178.4	-3.6	0	0	111.8	A170 L171 M172 L177	A170-Q174 WeakPolarHBondContact O-CB 3.36Å; A170-Q174 PolarHBondContact O-N 2.91Å; L171-Q174 PolarHBondContact O-N 2.93Å; M172-Q174 VanDerWaalsContact C-N 3.34Å; M172-Q174 PolarHBondContact O-N 2.86Å; Q174-L177 WeakPolarHBondContact O-CD2 3.28Å
175	A	89.8	Confident	87.9	Confident	42 Å²	42	39.7 Å²	39.7	35%	0.347	22%	0.216	S	C	.	.	H	α-helix	trans	-73.9	-41.3	-179.6	0	0	0	0	0	112.9	W114 L171 M172 Q173	W114-A175 HydrophobicContact CH2-CB 3.84Å; W114-A175 HydrophobicContact CZ2-CB 3.48Å; W114-A175 VanDerWaalsContact CZ2-CB 3.48Å; L171-A175 WeakPolarHBondContact O-CB 3.3Å; L171-A175 PolarHBondContact O-N 3.4Å; M172-A175 PolarHBondContact O-N 3.34Å; Q173-A175 VanDerWaalsContact C-N 3.34Å
176	W	93.4	Very high	88.1	Confident	1 Å²	1	37.3 Å²	37.3	0%	0.004	20%	0.202	C	C	.	.	H	α-helix	trans	-95.2	-14.8	-173.5	-54.2	-30.2	0	0	0	113.6	I49 F109 W114 V117 S118 V121 R125 V157 M172 I178 V180	I49-W176 HydrophobicContact CD1-CH2 3.46Å; I49-W176 VanDerWaalsContact CD1-CH2 3.46Å; I49-W176 HydrophobicContact CD1-CZ2 4.26Å; I49-W176 HydrophobicContact CD1-CZ3 3.92Å; F109-W176 HydrophobicContact CE2-CH2 4.21Å; F109-W176 HydrophobicContact CE2-CZ2 4.49Å; W114-W176 HydrophobicContact CE3-CZ2 4.34Å; W114-W176 AromaticContact CH2-CZ2 3.95Å; W114-W176 HydrophobicContact CH2-CZ2 3.95Å; W114-W176 HydrophobicContact CZ3-CH2 4.24Å; W114-W176 AromaticContact CZ3-CZ2 3.53Å; W114-W176 HydrophobicContact CZ3-CZ2 3.53Å; V117-W176 HydrophobicContact CG1-CH2 4.39Å; V117-W176 HydrophobicContact CG1-CZ2 4.01Å; S118-W176 PolarHBondContact OG-NE1 2.89Å; V121-W176 HydrophobicContact CB-CD2 4.26Å; V121-W176 HydrophobicContact CB-CG 4.3Å; V121-W176 HydrophobicContact CG1-CB 3.91Å; V121-W176 HydrophobicContact CG1-CD2 3.73Å; V121-W176 HydrophobicContact CG1-CE3 4.09Å; V121-W176 HydrophobicContact CG1-CG 3.64Å; V121-W176 HydrophobicContact CG2-CD2 4.42Å; V121-W176 HydrophobicContact CG2-CZ2 4.35Å; R125-W176 WeakPolarHBondContact CD-O 3.46Å; R125-W176 PolarHBondContact NH1-O 2.93Å; V157-W176 HydrophobicContact CB-CE3 4.27Å; V157-W176 HydrophobicContact CB-CZ3 4.19Å; V157-W176 HydrophobicContact CG1-CE3 4.34Å; V157-W176 HydrophobicContact CG1-CZ3 3.84Å; V157-W176 HydrophobicContact CG2-CE3 3.78Å; V157-W176 HydrophobicContact CG2-CZ3 4.14Å; M172-W176 HydrophobicContact CB-CE3 3.92Å; M172-W176 HydrophobicContact CB-CH2 4.02Å; M172-W176 HydrophobicContact CB-CZ3 3.65Å; M172-W176 HydrophobicContact CG-CH2 3.76Å; M172-W176 HydrophobicContact CG-CZ2 4.32Å; M172-W176 HydrophobicContact CG-CZ3 3.9Å; M172-W176 PolarHBondContact O-N 3.37Å; M172-W176 HydrophobicContact SD-CH2 3.9Å; M172-W176 HydrophobicContact SD-CZ3 4.03Å; W176-I178 HydrophobicContact CB-CG1 3.88Å; W176-I178 PolarHBondContact O-N 2.66Å; W176-V180 HydrophobicContact CE3-CG2 3.61Å; W176-V180 HydrophobicContact CZ3-CG1 4.31Å; W176-V180 HydrophobicContact CZ3-CG2 3.84Å
177	L	89.5	Confident	88.2	Confident	136 Å²	136	36.1 Å²	36.1	71%	0.712	19%	0.194	S	C	*	.	S	Bend	trans	57.6	27.1	-178.9	-54.7	174.6	0	0	0	113.7	Q173 Q174	Q173-L177 VanDerWaalsContact O-CA 3.32Å; Q173-L177 WeakPolarHBondContact O-CA 3.48Å; Q173-L177 PolarHBondContact O-N 2.94Å; Q174-L177 WeakPolarHBondContact O-CD2 3.28Å
178	I	90.5	Very high	88.4	Confident	19 Å²	19	30.7 Å²	30.7	10%	0.097	17%	0.166	C	C	.	.	S	Bend	trans	-135.4	153	173.9	52.3	175.6	0	0	0	108.9	V121 R125 V157 W176	V121-I178 HydrophobicContact CG1-CD1 4.02Å; R125-I178 HydrophobicContact CB-CD1 4.41Å; R125-I178 HydrophobicContact CG-CG2 3.9Å; V157-I178 HydrophobicContact CG2-CD1 3.47Å; V157-I178 VanDerWaalsContact CG2-CD1 3.47Å; V157-I178 HydrophobicContact CG2-CG1 3.99Å; W176-I178 HydrophobicContact CB-CG1 3.88Å; W176-I178 PolarHBondContact O-N 2.66Å
179	P	89.9	Confident	88.1	Confident	40 Å²	40	31.4 Å²	31.4	26%	0.26	17%	0.169	S	C	.	.			trans	-60.7	143.9	178.2	24.4	-34.9	0	0	0	111.7	T155 A156 V157 Y181	T155-P179 VanDerWaalsContact O-CD 3.31Å; T155-P179 WeakPolarHBondContact O-CD 3.38Å; A156-P179 WeakPolarHBondContact CA-O 3.49Å; A156-P179 HydrophobicContact CB-CG 3.88Å; V157-P179 PolarHBondContact N-O 2.64Å; P179-Y181 HydrophobicContact CB-CE2 3.84Å; P179-Y181 HydrophobicContact CG-CE2 4.18Å
180	V	90.9	Very high	88	Confident	1 Å²	1	31 Å²	31	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.1	-179.6	-179.2	0	0	0	0	108.9	V157 V159 L164 M172 Q173 W176	V157-V180 HydrophobicContact CB-CG2 4.21Å; V157-V180 CarbonylContact O-C 3.55Å; V157-V180 WeakPolarHBondContact O-CA 3.43Å; V159-V180 HydrophobicContact CG2-CG1 4.01Å; L164-V180 HydrophobicContact CD1-CG1 4.31Å; M172-V180 HydrophobicContact CB-CB 4.4Å; M172-V180 HydrophobicContact CB-CG1 4.23Å; M172-V180 HydrophobicContact CB-CG2 3.87Å; M172-V180 HydrophobicContact SD-CG1 4.1Å; Q173-V180 HydrophobicContact CG-CB 3.76Å; Q173-V180 HydrophobicContact CG-CG2 3.65Å; Q173-V180 VanDerWaalsContact OE1-N 3.16Å; W176-V180 HydrophobicContact CE3-CG2 3.61Å; W176-V180 HydrophobicContact CZ3-CG1 4.31Å; W176-V180 HydrophobicContact CZ3-CG2 3.84Å
181	Y	91.7	Very high	88	Confident	21 Å²	21	29.3 Å²	29.3	8%	0.082	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	144.5	179.7	-60	-80.5	0	0	0	110.2	L39 H44 W88 A156 V157 L158 V159 P179 T185 L186	L39-Y181 HydrophobicContact CD2-CE1 4.23Å; H44-Y181 AromaticContact CD2-CE2 3.95Å; W88-Y181 HydrophobicContact CH2-CD2 4.25Å; W88-Y181 AromaticContact CH2-CE2 3.8Å; W88-Y181 HydrophobicContact CH2-CE2 3.8Å; W88-Y181 AromaticContact CH2-CZ 3.95Å; W88-Y181 HydrophobicContact CZ3-CD2 4.37Å; W88-Y181 HydrophobicContact CZ3-CE2 4.33Å; A156-Y181 HydrophobicContact CB-CD2 4.17Å; A156-Y181 HydrophobicContact CB-CE2 3.88Å; V157-Y181 PolarHBondContact O-N 2.79Å; L158-Y181 WeakPolarHBondContact CA-O 3.2Å; V159-Y181 PolarHBondContact N-O 3.12Å; P179-Y181 HydrophobicContact CB-CE2 3.84Å; P179-Y181 HydrophobicContact CG-CE2 4.18Å; Y181-T185 HydrophobicContact CD1-CG2 3.88Å; Y181-T185 HydrophobicContact CE1-CG2 4.49Å; Y181-L186 HydrophobicContact CD1-CD2 3.93Å; Y181-L186 HydrophobicContact CD2-CD2 4.48Å; Y181-L186 HydrophobicContact CG-CD2 3.81Å
182	D	88.9	Confident	87.7	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.016	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	169.3	163.2	63.8	6.9	0	0	0	109.8	R163 L164 Y184 T185 L186	R163-D182 WeakPolarHBondContact CA-OD2 3.29Å; L164-D182 HydrophobicContact CB-CB 4.25Å; L164-D182 HydrophobicContact CD1-CB 4.15Å; L164-D182 HydrophobicContact CG-CB 3.93Å; L164-D182 PolarHBondContact N-OD2 2.79Å; D182-Y184 PolarHBondContact O-N 3.23Å; D182-T185 PolarHBondContact O-N 2.84Å; D182-T185 WeakPolarHBondContact OD1-CB 3.39Å; D182-T185 PolarHBondContact OD1-N 3.07Å; D182-T185 PolarHBondContact OD1-OG1 2.86Å; D182-L186 PolarHBondContact O-N 2.8Å
183	R	87.7	Confident	87.3	Confident	7 Å²	7	32.9 Å²	32.9	3%	0.026	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-45.4	-178.2	-173.2	170.5	163.7	134.7	-2.4	111.3	E77 W161 T185 L186 V187 S372	E77-R183 IonicContact OE1-CZ 2.92Å; E77-R183 IonicContact OE1-NH2 2.66Å; E77-R183 PolarHBondContact OE1-NH2 3.3Å; E77-R183 IonicContact OE2-CZ 3.86Å; E77-R183 VanDerWaalsContact OE2-CZ 3.29Å; E77-R183 IonicContact OE2-NH1 3.97Å; E77-R183 PolarHBondContact OE2-NH1 3.49Å; E77-R183 IonicContact OE2-NH2 3.61Å; E77-R183 PolarHBondContact OE2-NH2 3.39Å; W161-R183 WeakPolarHBondContact O-CB 3.22Å; W161-R183 PolarHBondContact O-N 2.85Å; R183-T185 VanDerWaalsContact C-N 3.3Å; R183-T185 PolarHBondContact O-N 3.38Å; R183-L186 PolarHBondContact O-N 2.79Å; R183-V187 HydrophobicContact CG-CG2 4.26Å; R183-V187 WeakPolarHBondContact O-CB 3.02Å; R183-V187 WeakPolarHBondContact O-CG2 3.41Å; R183-V187 PolarHBondContact O-N 3.18Å; R183-S372 PolarHBondContact NE-O 3.1Å; R183-S372 PolarHBondContact NH2-O 2.86Å
184	Y	86.7	Confident	86.7	Confident	16 Å²	16	31.7 Å²	31.7	6%	0.063	17%	0.167	C	C	.	.	H	α-helix	trans	-53.7	-46	177.3	-175	-70.4	0	0	0	112	P162 R163 D182 V187 V188 A207 L211 P375	P162-Y184 WeakPolarHBondContact O-CB 3.45Å; P162-Y184 PolarHBondContact O-N 3.3Å; R163-Y184 PolarHBondContact NH2-OH 3.38Å; D182-Y184 PolarHBondContact O-N 3.23Å; Y184-V187 PolarHBondContact O-N 3.46Å; Y184-V188 HydrophobicContact CD1-CG2 3.86Å; Y184-V188 HydrophobicContact CE1-CB 4.49Å; Y184-V188 HydrophobicContact CE1-CG2 3.41Å; Y184-V188 VanDerWaalsContact CE1-CG2 3.41Å; Y184-V188 WeakPolarHBondContact O-CG2 3.36Å; Y184-V188 PolarHBondContact O-N 3.39Å; Y184-A207 PolarHBondContact OH-O 3.27Å; Y184-L211 HydrophobicContact CD1-CB 4.46Å; Y184-L211 HydrophobicContact CD1-CD1 3.77Å; Y184-L211 HydrophobicContact CD1-CD2 4.43Å; Y184-L211 HydrophobicContact CD1-CG 4.39Å; Y184-L211 HydrophobicContact CE1-CB 3.86Å; Y184-L211 HydrophobicContact CE1-CD1 4.02Å; Y184-L211 HydrophobicContact CE1-CD2 4.44Å; Y184-L211 HydrophobicContact CE1-CG 4.27Å; Y184-P375 HydrophobicContact CD2-CB 4.02Å; Y184-P375 HydrophobicContact CD2-CG 3.47Å; Y184-P375 VanDerWaalsContact CD2-CG 3.47Å; Y184-P375 HydrophobicContact CE1-CG 4.39Å; Y184-P375 HydrophobicContact CE2-CB 3.28Å; Y184-P375 HydrophobicContact CE2-CG 3.22Å; Y184-P375 HydrophobicContact CG-CG 4.15Å
185	T	86.7	Confident	86.2	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.3	-50.4	-179.6	-60.4	0	0	0	0	110.7	Y37 Y181 D182 R183 V187 V188 Q189 L211 R215	Y37-T185 HydrophobicContact CD1-CG2 3.97Å; Y37-T185 HydrophobicContact CE1-CG2 4.48Å; Y181-T185 HydrophobicContact CD1-CG2 3.88Å; Y181-T185 HydrophobicContact CE1-CG2 4.49Å; D182-T185 PolarHBondContact O-N 2.84Å; D182-T185 WeakPolarHBondContact OD1-CB 3.39Å; D182-T185 PolarHBondContact OD1-N 3.07Å; D182-T185 PolarHBondContact OD1-OG1 2.86Å; R183-T185 VanDerWaalsContact C-N 3.3Å; R183-T185 PolarHBondContact O-N 3.38Å; T185-V187 VanDerWaalsContact C-N 3.33Å; T185-V187 PolarHBondContact O-N 3.01Å; T185-V188 PolarHBondContact O-N 2.71Å; T185-Q189 VanDerWaalsContact O-CG 3.28Å; T185-Q189 WeakPolarHBondContact O-CG 3.28Å; T185-Q189 PolarHBondContact O-N 3.31Å; T185-Q189 VanDerWaalsContact O-N 3.09Å; T185-L211 HydrophobicContact CG2-CD2 4.23Å; T185-R215 PolarHBondContact OG1-NH2 3.42Å; T185-R215 VanDerWaalsContact OG1-NH2 3.08Å
186	L	88.1	Confident	85.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.3	-39	-179.2	-64.2	-169.2	0	0	0	112.3	L39 L81 V82 L85 W88 L158 Y181 D182 R183 Q189 L190	L39-L186 HydrophobicContact CD2-CD2 4.5Å; L81-L186 HydrophobicContact CD2-CB 3.45Å; L81-L186 VanDerWaalsContact CD2-CB 3.45Å; L81-L186 HydrophobicContact CD2-CD1 3.38Å; L81-L186 HydrophobicContact CD2-CG 4.07Å; L81-L186 HydrophobicContact CG-CB 4.49Å; V82-L186 HydrophobicContact CG2-CD1 4.43Å; L85-L186 HydrophobicContact CD1-CB 4.43Å; L85-L186 HydrophobicContact CD1-CD1 4.38Å; L85-L186 HydrophobicContact CD1-CD2 3.94Å; L85-L186 HydrophobicContact CD1-CG 4.48Å; W88-L186 HydrophobicContact CH2-CD2 4.14Å; W88-L186 HydrophobicContact CZ3-CD2 3.69Å; L158-L186 HydrophobicContact CB-CD1 4.46Å; L158-L186 HydrophobicContact CD1-CD1 3.48Å; L158-L186 VanDerWaalsContact CD1-CD1 3.48Å; L158-L186 HydrophobicContact CD1-CG 4.13Å; L158-L186 HydrophobicContact CD2-CD1 3.67Å; L158-L186 HydrophobicContact CG-CD1 4.04Å; Y181-L186 HydrophobicContact CD1-CD2 3.93Å; Y181-L186 HydrophobicContact CD2-CD2 4.48Å; Y181-L186 HydrophobicContact CG-CD2 3.81Å; D182-L186 PolarHBondContact O-N 2.8Å; R183-L186 PolarHBondContact O-N 2.79Å; L186-Q189 PolarHBondContact O-N 3.35Å; L186-L190 WeakPolarHBondContact O-CB 3.34Å; L186-L190 PolarHBondContact O-N 3.42Å
187	V	86.2	Confident	85	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	17%	0.174	C	C	.	.	H	α-helix	trans	-60.3	-51.9	176.5	173.8	0	0	0	0	111.2	L81 R183 Y184 T185 Q189 L190 F191 F312 M371 L374 P375 L378	L81-V187 HydrophobicContact CD1-CG2 3.65Å; R183-V187 HydrophobicContact CG-CG2 4.26Å; R183-V187 WeakPolarHBondContact O-CB 3.02Å; R183-V187 WeakPolarHBondContact O-CG2 3.41Å; R183-V187 PolarHBondContact O-N 3.18Å; Y184-V187 PolarHBondContact O-N 3.46Å; T185-V187 VanDerWaalsContact C-N 3.33Å; T185-V187 PolarHBondContact O-N 3.01Å; V187-Q189 VanDerWaalsContact C-N 3.27Å; V187-Q189 PolarHBondContact O-N 2.89Å; V187-L190 PolarHBondContact O-N 2.93Å; V187-F191 HydrophobicContact CG1-CD2 3.67Å; V187-F191 HydrophobicContact CG1-CE2 3.82Å; V187-F191 WeakPolarHBondContact O-CB 3.44Å; V187-F191 VanDerWaalsContact O-CD2 3.29Å; V187-F191 WeakPolarHBondContact O-CD2 3.37Å; V187-F191 PolarHBondContact O-N 3.11Å; V187-F312 HydrophobicContact CG1-CZ 4.49Å; V187-M371 HydrophobicContact CB-CE 4.33Å; V187-M371 HydrophobicContact CG1-CE 4.31Å; V187-M371 HydrophobicContact CG2-CE 3.05Å; V187-L374 HydrophobicContact CG1-CD1 3.82Å; V187-P375 HydrophobicContact CG1-CG 4.48Å; V187-L378 HydrophobicContact CG1-CD1 3.76Å
188	V	85.9	Confident	84.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.5	-40.3	-179.2	171.8	0	0	0	0	111.3	Y184 T185 F191 S192 A207 E208 P375 L378	Y184-V188 HydrophobicContact CD1-CG2 3.86Å; Y184-V188 HydrophobicContact CE1-CB 4.49Å; Y184-V188 HydrophobicContact CE1-CG2 3.41Å; Y184-V188 VanDerWaalsContact CE1-CG2 3.41Å; Y184-V188 WeakPolarHBondContact O-CG2 3.36Å; Y184-V188 PolarHBondContact O-N 3.39Å; T185-V188 PolarHBondContact O-N 2.71Å; V188-F191 WeakPolarHBondContact O-CB 3.28Å; V188-F191 PolarHBondContact O-N 2.63Å; V188-S192 WeakPolarHBondContact O-CB 3.38Å; V188-S192 PolarHBondContact O-N 3.29Å; V188-A207 HydrophobicContact CG1-CB 4.2Å; V188-A207 HydrophobicContact CG2-CB 3.72Å; V188-E208 HydrophobicContact CG1-CB 4.28Å; V188-E208 HydrophobicContact CG1-CG 3.48Å; V188-E208 VanDerWaalsContact CG1-CG 3.48Å; V188-P375 HydrophobicContact CG2-CG 4.19Å; V188-L378 HydrophobicContact CG2-CD1 4.19Å
189	Q	82.5	Confident	84.3	Confident	21 Å²	21	33.2 Å²	33.2	10%	0.098	17%	0.167	C	C	.	.	H	α-helix	trans	-66.9	-46.8	177.7	-67.7	-60.6	-38	0	0	112.3	L39 T185 L186 V187 F191 S192 L193	L39-Q189 HydrophobicContact CD1-CB 3.77Å; L39-Q189 HydrophobicContact CD1-CG 4.31Å; L39-Q189 HydrophobicContact CD2-CG 4.35Å; L39-Q189 HydrophobicContact CG-CB 4.25Å; L39-Q189 HydrophobicContact CG-CG 4.24Å; T185-Q189 VanDerWaalsContact O-CG 3.28Å; T185-Q189 WeakPolarHBondContact O-CG 3.28Å; T185-Q189 PolarHBondContact O-N 3.31Å; T185-Q189 VanDerWaalsContact O-N 3.09Å; L186-Q189 PolarHBondContact O-N 3.35Å; V187-Q189 VanDerWaalsContact C-N 3.27Å; V187-Q189 PolarHBondContact O-N 2.89Å; Q189-F191 PolarHBondContact O-N 2.93Å; Q189-S192 WeakPolarHBondContact O-CB 3.48Å; Q189-S192 PolarHBondContact O-N 3.43Å; Q189-S192 VanDerWaalsContact O-N 3.12Å; Q189-L193 WeakPolarHBondContact O-CG 3.41Å; Q189-L193 PolarHBondContact O-N 3.24Å
190	L	84.3	Confident	83.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.7	-38	175.6	-173.2	52.2	0	0	0	111.1	L81 L85 L186 V187 R194 F312	L81-L190 HydrophobicContact CG-CD2 4.14Å; L85-L190 HydrophobicContact CD2-CB 4.01Å; L85-L190 HydrophobicContact CD2-CD1 3.83Å; L85-L190 HydrophobicContact CD2-CG 4.42Å; L85-L190 HydrophobicContact CG-CD1 4.37Å; L186-L190 WeakPolarHBondContact O-CB 3.34Å; L186-L190 PolarHBondContact O-N 3.42Å; V187-L190 PolarHBondContact O-N 2.93Å; L190-R194 HydrophobicContact CD1-CG 4.25Å; L190-R194 VanDerWaalsContact CD1-NE 3.31Å; L190-R194 PolarHBondContact O-N 3.34Å; L190-R194 VanDerWaalsContact O-N 3.14Å; L190-F312 HydrophobicContact CD2-CD2 3.47Å; L190-F312 VanDerWaalsContact CD2-CD2 3.47Å; L190-F312 HydrophobicContact CD2-CE2 4.13Å; L190-F312 HydrophobicContact CD2-CG 4.48Å; L190-F312 HydrophobicContact CG-CB 4.46Å; L190-F312 HydrophobicContact CG-CD2 3.87Å
191	F	81.2	Confident	83.6	Confident	5 Å²	5	36.6 Å²	36.6	2%	0.022	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-48.7	172	-96.2	-93.5	0	0	0	112.8	V187 V188 Q189 L193 R194 S195 A204 F312 L315 I368 L374 L378	V187-F191 HydrophobicContact CG1-CD2 3.67Å; V187-F191 HydrophobicContact CG1-CE2 3.82Å; V187-F191 WeakPolarHBondContact O-CB 3.44Å; V187-F191 VanDerWaalsContact O-CD2 3.29Å; V187-F191 WeakPolarHBondContact O-CD2 3.37Å; V187-F191 PolarHBondContact O-N 3.11Å; V188-F191 WeakPolarHBondContact O-CB 3.28Å; V188-F191 PolarHBondContact O-N 2.63Å; Q189-F191 PolarHBondContact O-N 2.93Å; F191-L193 PolarHBondContact O-N 2.92Å; F191-R194 PolarHBondContact O-N 2.78Å; F191-S195 VanDerWaalsContact O-CB 3.22Å; F191-S195 WeakPolarHBondContact O-CB 3.37Å; F191-S195 PolarHBondContact O-N 2.62Å; F191-S195 PolarHBondContact O-OG 3.11Å; F191-A204 HydrophobicContact CB-CB 4.42Å; F191-F312 HydrophobicContact CD2-CE1 4.28Å; F191-F312 HydrophobicContact CD2-CE2 4.35Å; F191-F312 HydrophobicContact CD2-CZ 4.13Å; F191-F312 AromaticContact CE2-CD1 3.87Å; F191-F312 HydrophobicContact CE2-CD1 3.87Å; F191-F312 HydrophobicContact CE2-CD2 4.47Å; F191-F312 AromaticContact CE2-CE1 3.27Å; F191-F312 HydrophobicContact CE2-CE1 3.27Å; F191-F312 AromaticContact CE2-CE2 3.96Å; F191-F312 HydrophobicContact CE2-CE2 3.96Å; F191-F312 HydrophobicContact CE2-CG 4.43Å; F191-F312 AromaticContact CE2-CZ 3.32Å; F191-F312 HydrophobicContact CE2-CZ 3.32Å; F191-F312 HydrophobicContact CZ-CD1 4.01Å; F191-F312 AromaticContact CZ-CE1 3.54Å; F191-F312 HydrophobicContact CZ-CE1 3.54Å; F191-F312 HydrophobicContact CZ-CZ 4.07Å; F191-L315 VanDerWaalsContact CA-CD1 3.41Å; F191-L315 HydrophobicContact CB-CD1 4.23Å; F191-L315 HydrophobicContact CD1-CD1 3.84Å; F191-L315 HydrophobicContact CD1-CD2 3.66Å; F191-L315 HydrophobicContact CD1-CG 4.41Å; F191-L315 HydrophobicContact CD2-CD2 4.31Å; F191-L315 HydrophobicContact CE1-CD1 4.44Å; F191-L315 HydrophobicContact CE1-CD2 3.44Å; F191-L315 VanDerWaalsContact CE1-CD2 3.44Å; F191-L315 HydrophobicContact CE2-CD2 4.16Å; F191-L315 HydrophobicContact CG-CD1 4.03Å; F191-L315 HydrophobicContact CG-CD2 4.12Å; F191-L315 HydrophobicContact CZ-CD2 3.72Å; F191-L315 VanDerWaalsContact O-CD1 3.22Å; F191-L315 WeakPolarHBondContact O-CD1 3.47Å; F191-I368 HydrophobicContact CE1-CD1 4.37Å; F191-I368 HydrophobicContact CZ-CG2 4.09Å; F191-L374 HydrophobicContact CE2-CD1 3.84Å; F191-L374 HydrophobicContact CZ-CD1 4.18Å; F191-L378 HydrophobicContact CB-CD1 4.17Å; F191-L378 HydrophobicContact CB-CD2 4.33Å; F191-L378 HydrophobicContact CD1-CD1 4.25Å; F191-L378 HydrophobicContact CD1-CD2 3.85Å; F191-L378 HydrophobicContact CD2-CD1 3.58Å; F191-L378 HydrophobicContact CE1-CD2 4.27Å; F191-L378 HydrophobicContact CE2-CD1 3.89Å; F191-L378 HydrophobicContact CG-CD1 3.74Å; F191-L378 HydrophobicContact CG-CD2 4.03Å; F191-L378 HydrophobicContact CZ-CD1 4.38Å
192	S	81.3	Confident	83.4	Confident	43 Å²	43	36.3 Å²	36.3	30%	0.301	18%	0.18	S	C	.	.	H	α-helix	trans	-60.4	-45.7	178.7	-157.1	0	0	0	0	111.1	V188 Q189 R194 S195 E208	V188-S192 WeakPolarHBondContact O-CB 3.38Å; V188-S192 PolarHBondContact O-N 3.29Å; Q189-S192 WeakPolarHBondContact O-CB 3.48Å; Q189-S192 PolarHBondContact O-N 3.43Å; Q189-S192 VanDerWaalsContact O-N 3.12Å; S192-R194 PolarHBondContact O-N 2.88Å; S192-S195 PolarHBondContact O-OG 2.78Å; S192-E208 WeakPolarHBondContact CB-OE1 3.2Å; S192-E208 PolarHBondContact OG-OE1 3.28Å
193	L	82	Confident	83.3	Confident	116 Å²	116	36.6 Å²	36.6	61%	0.607	18%	0.181	S	C	*	.	H	α-helix	trans	-63.7	-39.4	-179.4	-73.5	174.7	0	0	0	114.1	L39 L85 Q189 F191	L39-L193 HydrophobicContact CD1-CD1 3.92Å; L85-L193 HydrophobicContact CD2-CD1 3.93Å; Q189-L193 WeakPolarHBondContact O-CG 3.41Å; Q189-L193 PolarHBondContact O-N 3.24Å; F191-L193 PolarHBondContact O-N 2.92Å
194	R	77.4	Confident	83.2	Confident	44 Å²	44	36.3 Å²	36.3	17%	0.166	18%	0.18	C	C	.	.	H	α-helix	trans	-98.8	-9.3	-172.5	-63.3	-179.2	176.9	-161.6	-10.8	113.8	S84 L190 F191 S192 R196 E310 V311 F312 L315	S84-R194 VanDerWaalsContact CA-NH2 3.34Å; S84-R194 PolarHBondContact O-NH2 2.88Å; S84-R194 PolarHBondContact OG-NH1 2.91Å; S84-R194 PolarHBondContact OG-NH2 2.64Å; L190-R194 HydrophobicContact CD1-CG 4.25Å; L190-R194 VanDerWaalsContact CD1-NE 3.31Å; L190-R194 PolarHBondContact O-N 3.34Å; L190-R194 VanDerWaalsContact O-N 3.14Å; F191-R194 PolarHBondContact O-N 2.78Å; S192-R194 PolarHBondContact O-N 2.88Å; R194-R196 PolarHBondContact O-N 3.25Å; R194-E310 IonicContact CZ-OE2 2.82Å; R194-E310 IonicContact NH1-OE2 3.77Å; R194-E310 IonicContact NH2-OE2 2.72Å; R194-E310 PolarHBondContact NH2-OE2 2.92Å; R194-V311 PolarHBondContact NH1-O 2.59Å; R194-F312 WeakPolarHBondContact CD-O 3.29Å; R194-F312 PolarHBondContact NH1-O 2.93Å; R194-L315 HydrophobicContact CB-CB 4.28Å; R194-L315 HydrophobicContact CB-CD1 3.4Å; R194-L315 VanDerWaalsContact CB-CD1 3.4Å; R194-L315 HydrophobicContact CB-CG 3.78Å
195	S	76.1	Confident	83.3	Confident	10 Å²	10	40.4 Å²	40.4	7%	0.07	20%	0.198	C	C	.	.			trans	-67.1	115.1	178.9	63	0	0	0	0	111.6	F191 S192 K201	F191-S195 VanDerWaalsContact O-CB 3.22Å; F191-S195 WeakPolarHBondContact O-CB 3.37Å; F191-S195 PolarHBondContact O-N 2.62Å; F191-S195 PolarHBondContact O-OG 3.11Å; S192-S195 PolarHBondContact O-OG 2.78Å; S195-K201 WeakPolarHBondContact O-CE 3.49Å; S195-K201 VanDerWaalsContact OG-CG 3.28Å; S195-K201 WeakPolarHBondContact OG-CG 3.37Å
196	R	78.5	Confident	83.4	Confident	202 Å²	202	40.8 Å²	40.8	76%	0.762	20%	0.2	S	C	*	.			trans	-102.7	-39.3	177.3	-39.7	177.2	167.9	175.7	-3.3	111.2	R194 D316	R194-R196 PolarHBondContact O-N 3.25Å; R196-D316 VanDerWaalsContact CA-OD2 3.24Å; R196-D316 WeakPolarHBondContact CA-OD2 3.48Å; R196-D316 WeakPolarHBondContact CB-OD2 3.43Å; R196-D316 VanDerWaalsContact CG-OD2 3.26Å; R196-D316 WeakPolarHBondContact CG-OD2 3.32Å; R196-D316 PolarHBondContact N-OD2 3.26Å
197	T	78.4	Confident	83.4	Confident	57 Å²	57	40.8 Å²	40.8	35%	0.35	20%	0.2	S	C	.	.	S	Bend	trans	-67.3	148.6	177.3	61.1	0	0	0	0	112.2	E199 A200 K201 D316	T197-E199 PolarHBondContact O-N 3.02Å; T197-A200 PolarHBondContact O-N 2.72Å; T197-A200 WeakPolarHBondContact OG1-CB 3.03Å; T197-A200 PolarHBondContact OG1-N 2.82Å; T197-K201 WeakPolarHBondContact O-CG 3.28Å; T197-K201 PolarHBondContact O-N 3.11Å; T197-K201 VanDerWaalsContact O-N 3.09Å; T197-D316 VanDerWaalsContact CB-OD1 3.28Å; T197-D316 WeakPolarHBondContact CB-OD1 3.47Å; T197-D316 HydrophobicContact CG2-CB 4.07Å; T197-D316 VanDerWaalsContact CG2-CG 3.46Å; T197-D316 WeakPolarHBondContact CG2-OD1 3.48Å; T197-D316 PolarHBondContact N-OD1 3.39Å; T197-D316 PolarHBondContact N-OD2 3.21Å; T197-D316 VanDerWaalsContact N-OD2 3.13Å; T197-D316 PolarHBondContact OG1-OD1 3.21Å
198	P	83.4	Confident	83.4	Confident	89 Å²	89	41.4 Å²	41.4	58%	0.578	20%	0.203	S	C	*	.	H	α-helix	trans	-62.6	-33	175.9	26.2	-34.5	0	0	0	111.9	K201 L202 I259	P198-K201 PolarHBondContact O-N 3.38Å; P198-L202 WeakPolarHBondContact O-CG 3.39Å; P198-L202 PolarHBondContact O-N 3.01Å; P198-I259 HydrophobicContact CB-CD1 4.05Å; P198-I259 HydrophobicContact CG-CD1 4.31Å
199	E	83	Confident	83.5	Confident	21 Å²	21	41.4 Å²	41.4	10%	0.098	20%	0.203	C	C	.	.	H	α-helix	trans	-62.4	-53.8	176.7	-163.1	-172.6	147.1	0	0	111.5	T197 K201 L202 Q203 L256 I259 R263 A384	T197-E199 PolarHBondContact O-N 3.02Å; E199-K201 VanDerWaalsContact C-N 3.27Å; E199-K201 PolarHBondContact O-N 2.75Å; E199-L202 PolarHBondContact O-N 2.84Å; E199-L202 VanDerWaalsContact O-N 3.15Å; E199-Q203 WeakPolarHBondContact O-CG 3.39Å; E199-Q203 PolarHBondContact O-N 2.74Å; E199-Q203 PolarHBondContact O-OE1 2.82Å; E199-Q203 PolarHBondContact OE1-NE2 3.37Å; E199-Q203 VanDerWaalsContact OE1-NE2 3.09Å; E199-L256 HydrophobicContact CG-CD1 3.72Å; E199-I259 HydrophobicContact CB-CG2 4.02Å; E199-I259 HydrophobicContact CG-CG2 4.1Å; E199-R263 VanDerWaalsContact CD-NH1 3.34Å; E199-R263 IonicContact OE1-NH1 2.77Å; E199-R263 PolarHBondContact OE1-NH1 2.88Å; E199-R263 WeakPolarHBondContact OE2-CD 3.42Å; E199-R263 IonicContact OE2-CZ 2.98Å; E199-R263 IonicContact OE2-NE 3.29Å; E199-R263 IonicContact OE2-NH1 2.65Å; E199-R263 PolarHBondContact OE2-NH1 2.84Å; E199-A384 WeakPolarHBondContact OE1-CB 3.4Å
200	A	79.8	Confident	83.7	Confident	11 Å²	11	41.1 Å²	41.1	9%	0.091	21%	0.206	C	C	.	.	H	α-helix	trans	-60.5	-38.5	179.3	0	0	0	0	0	111.7	T197 Q203 A204	T197-A200 PolarHBondContact O-N 2.72Å; T197-A200 WeakPolarHBondContact OG1-CB 3.03Å; T197-A200 PolarHBondContact OG1-N 2.82Å; A200-Q203 PolarHBondContact O-N 3.42Å; A200-A204 WeakPolarHBondContact O-CB 3.38Å; A200-A204 PolarHBondContact O-N 2.99Å
201	K	85.2	Confident	83.6	Confident	101 Å²	101	41.4 Å²	41.4	44%	0.439	21%	0.207	S	C	.	.	H	α-helix	trans	-61.9	-43.3	175.5	-75.9	175.4	179.9	177.2	0	112.6	S195 T197 P198 E199 Q203 A204 K205	S195-K201 WeakPolarHBondContact O-CE 3.49Å; S195-K201 VanDerWaalsContact OG-CG 3.28Å; S195-K201 WeakPolarHBondContact OG-CG 3.37Å; T197-K201 WeakPolarHBondContact O-CG 3.28Å; T197-K201 PolarHBondContact O-N 3.11Å; T197-K201 VanDerWaalsContact O-N 3.09Å; P198-K201 PolarHBondContact O-N 3.38Å; E199-K201 VanDerWaalsContact C-N 3.27Å; E199-K201 PolarHBondContact O-N 2.75Å; K201-Q203 VanDerWaalsContact C-N 3.32Å; K201-A204 PolarHBondContact O-N 3.26Å; K201-K205 WeakPolarHBondContact O-CG 3.05Å; K201-K205 PolarHBondContact O-N 3.25Å
202	L	88.6	Confident	83.8	Confident	16 Å²	16	41.3 Å²	41.3	8%	0.084	21%	0.207	C	C	.	.	H	α-helix	trans	-64.4	-40.2	177	-70	175.7	0	0	0	111.5	P198 E199 K205 L206 L252 Q255 L256 I259	P198-L202 WeakPolarHBondContact O-CG 3.39Å; P198-L202 PolarHBondContact O-N 3.01Å; E199-L202 PolarHBondContact O-N 2.84Å; E199-L202 VanDerWaalsContact O-N 3.15Å; L202-K205 PolarHBondContact O-N 2.82Å; L202-L206 WeakPolarHBondContact O-CG 3.22Å; L202-L206 PolarHBondContact O-N 3.28Å; L202-L252 HydrophobicContact CD2-CD2 3.47Å; L202-L252 VanDerWaalsContact CD2-CD2 3.47Å; L202-Q255 HydrophobicContact CD1-CB 3.7Å; L202-Q255 HydrophobicContact CD2-CB 4.25Å; L202-Q255 VanDerWaalsContact CD2-OE1 3.23Å; L202-L256 HydrophobicContact CD1-CB 4.43Å; L202-I259 HydrophobicContact CD1-CD1 3.68Å
203	Q	86.3	Confident	84	Confident	9 Å²	9	42.8 Å²	42.8	4%	0.042	21%	0.206	C	C	.	.	H	α-helix	trans	-69.1	-39.1	178.8	-70	155.8	-13.9	0	0	112.3	E199 A200 K201 L206 A207 L256 A381	E199-Q203 WeakPolarHBondContact O-CG 3.39Å; E199-Q203 PolarHBondContact O-N 2.74Å; E199-Q203 PolarHBondContact O-OE1 2.82Å; E199-Q203 PolarHBondContact OE1-NE2 3.37Å; E199-Q203 VanDerWaalsContact OE1-NE2 3.09Å; A200-Q203 PolarHBondContact O-N 3.42Å; K201-Q203 VanDerWaalsContact C-N 3.32Å; Q203-L206 PolarHBondContact O-N 3.24Å; Q203-A207 PolarHBondContact O-N 3.36Å; Q203-L256 HydrophobicContact CG-CD1 3.99Å; Q203-L256 HydrophobicContact CG-CD2 4.09Å; Q203-A381 HydrophobicContact CB-CB 3.7Å; Q203-A381 HydrophobicContact CG-CB 3.82Å; Q203-A381 VanDerWaalsContact NE2-CA 3.35Å
204	A	85.4	Confident	84.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.7	-48.1	172	0	0	0	0	0	111.2	F191 A200 K201 L206 A207 E208	F191-A204 HydrophobicContact CB-CB 4.42Å; A200-A204 WeakPolarHBondContact O-CB 3.38Å; A200-A204 PolarHBondContact O-N 2.99Å; K201-A204 PolarHBondContact O-N 3.26Å; A204-L206 VanDerWaalsContact C-N 3.34Å; A204-L206 PolarHBondContact O-N 2.7Å; A204-A207 WeakPolarHBondContact O-CA 3.2Å; A204-A207 WeakPolarHBondContact O-CB 3.22Å; A204-A207 PolarHBondContact O-N 2.79Å; A204-E208 WeakPolarHBondContact O-CG 3.24Å; A204-E208 PolarHBondContact O-N 2.95Å
205	K	88.3	Confident	84.2	Confident	102 Å²	102	38 Å²	38	44%	0.443	19%	0.187	S	C	.	.	H	α-helix	trans	-59.2	-41	174.7	-72.7	-178	176.9	-166.5	0	113	K201 L202 A207 E208 I209 L252	K201-K205 WeakPolarHBondContact O-CG 3.05Å; K201-K205 PolarHBondContact O-N 3.25Å; L202-K205 PolarHBondContact O-N 2.82Å; K205-A207 VanDerWaalsContact C-N 3.26Å; K205-A207 PolarHBondContact O-N 3.15Å; K205-E208 WeakPolarHBondContact O-CB 2.96Å; K205-E208 PolarHBondContact O-N 3.42Å; K205-I209 PolarHBondContact O-N 3.45Å; K205-I209 VanDerWaalsContact O-N 3.13Å; K205-L252 HydrophobicContact CB-CD1 3.83Å; K205-L252 HydrophobicContact CB-CD2 4.38Å; K205-L252 HydrophobicContact CD-CD2 4.23Å
206	L	89.5	Confident	84.4	Confident	8 Å²	8	37.9 Å²	37.9	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-62.2	-34.7	174.3	-76.3	169.7	0	0	0	112.1	L202 Q203 A204 E249 L252 L253 L256 N377	L202-L206 WeakPolarHBondContact O-CG 3.22Å; L202-L206 PolarHBondContact O-N 3.28Å; Q203-L206 PolarHBondContact O-N 3.24Å; A204-L206 VanDerWaalsContact C-N 3.34Å; A204-L206 PolarHBondContact O-N 2.7Å; L206-E249 HydrophobicContact CD2-CG 3.94Å; L206-L252 HydrophobicContact CD1-CB 4.5Å; L206-L252 HydrophobicContact CD2-CB 3.64Å; L206-L252 HydrophobicContact CD2-CD1 3.98Å; L206-L252 HydrophobicContact CD2-CG 4.49Å; L206-L252 HydrophobicContact CG-CB 3.93Å; L206-L252 HydrophobicContact CG-CD1 4.13Å; L206-L253 HydrophobicContact CD1-CD2 3.92Å; L206-L253 HydrophobicContact CD2-CD2 4.26Å; L206-L253 HydrophobicContact CD2-CG 4.15Å; L206-L256 HydrophobicContact CD1-CD2 3.98Å; L206-N377 HydrophobicContact CB-CB 4.43Å; L206-N377 PolarHBondContact O-ND2 3.47Å
207	A	87.4	Confident	84.2	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-73.2	-33.5	176.5	0	0	0	0	0	112.7	Y184 V188 Q203 A204 K205 G210 L211 N377 L378	Y184-A207 PolarHBondContact OH-O 3.27Å; V188-A207 HydrophobicContact CG1-CB 4.2Å; V188-A207 HydrophobicContact CG2-CB 3.72Å; Q203-A207 PolarHBondContact O-N 3.36Å; A204-A207 WeakPolarHBondContact O-CA 3.2Å; A204-A207 WeakPolarHBondContact O-CB 3.22Å; A204-A207 PolarHBondContact O-N 2.79Å; K205-A207 VanDerWaalsContact C-N 3.26Å; K205-A207 PolarHBondContact O-N 3.15Å; A207-G210 PolarHBondContact O-N 3.36Å; A207-L211 PolarHBondContact O-N 2.86Å; A207-N377 HydrophobicContact CB-CB 4.26Å; A207-L378 HydrophobicContact CB-CD1 4.2Å; A207-L378 HydrophobicContact CB-CD2 3.8Å; A207-L378 HydrophobicContact CB-CG 3.67Å
208	E	87.2	Confident	83.9	Confident	15 Å²	15	28.7 Å²	28.7	7%	0.07	15%	0.154	C	C	.	.	H	α-helix	trans	-61.5	-40.7	171.9	-70.4	171.8	-177.5	0	0	111.9	Y29 L33 V188 S192 A204 K205 G210 L211 L212	Y29-E208 WeakPolarHBondContact OH-CB 3.36Å; Y29-E208 PolarHBondContact OH-OE2 3.06Å; L33-E208 HydrophobicContact CD2-CB 4.32Å; V188-E208 HydrophobicContact CG1-CB 4.28Å; V188-E208 HydrophobicContact CG1-CG 3.48Å; V188-E208 VanDerWaalsContact CG1-CG 3.48Å; S192-E208 WeakPolarHBondContact CB-OE1 3.2Å; S192-E208 PolarHBondContact OG-OE1 3.28Å; A204-E208 WeakPolarHBondContact O-CG 3.24Å; A204-E208 PolarHBondContact O-N 2.95Å; K205-E208 WeakPolarHBondContact O-CB 2.96Å; K205-E208 PolarHBondContact O-N 3.42Å; E208-G210 VanDerWaalsContact C-N 3.29Å; E208-G210 PolarHBondContact O-N 3.33Å; E208-L211 WeakPolarHBondContact O-CA 3.26Å; E208-L211 VanDerWaalsContact O-CB 3.27Å; E208-L211 WeakPolarHBondContact O-CB 3.01Å; E208-L211 PolarHBondContact O-N 3.27Å; E208-L212 PolarHBondContact O-N 3.36Å
209	I	88.5	Confident	83.1	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.5	-43.6	175.2	-68.2	173.9	0	0	0	111.1	Y29 K205 L211 L212 R213 L245 E249 L252	Y29-I209 HydrophobicContact CE2-CG1 3.98Å; K205-I209 PolarHBondContact O-N 3.45Å; K205-I209 VanDerWaalsContact O-N 3.13Å; I209-L211 PolarHBondContact O-N 3.48Å; I209-L212 PolarHBondContact O-N 3.13Å; I209-R213 HydrophobicContact CG2-CG 4.4Å; I209-R213 WeakPolarHBondContact O-CB 3.27Å; I209-R213 WeakPolarHBondContact O-CG 3.02Å; I209-R213 PolarHBondContact O-N 2.64Å; I209-L245 HydrophobicContact CG2-CB 4.29Å; I209-E249 HydrophobicContact CD1-CB 3.94Å; I209-E249 HydrophobicContact CG2-CB 4.49Å; I209-L252 HydrophobicContact CD1-CD1 3.69Å
210	G	85.8	Confident	82.4	Confident	15 Å²	15	27.3 Å²	27.3	16%	0.155	14%	0.139	C	C	.	.	H	α-helix	trans	-60.2	-31	177.1	0	0	0	0	0	113.1	A207 E208	A207-G210 PolarHBondContact O-N 3.36Å; E208-G210 VanDerWaalsContact C-N 3.29Å; E208-G210 PolarHBondContact O-N 3.33Å
211	L	82.8	Confident	81.8	Confident	5 Å²	5	33.3 Å²	33.3	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-76.3	-49.5	177.1	-168.6	49.8	0	0	0	111.7	Y37 Y184 T185 A207 E208 I209 R213 A214 R215	Y37-L211 HydrophobicContact CD1-CD2 3.55Å; Y37-L211 HydrophobicContact CD1-CG 4.1Å; Y37-L211 HydrophobicContact CE1-CB 4.47Å; Y37-L211 HydrophobicContact CE1-CD1 3.81Å; Y37-L211 HydrophobicContact CE1-CD2 3.2Å; Y37-L211 HydrophobicContact CE1-CG 3.22Å; Y37-L211 HydrophobicContact CE2-CG 4.49Å; Y37-L211 HydrophobicContact CG-CD2 4.4Å; Y37-L211 WeakPolarHBondContact OH-CG 3.01Å; Y37-L211 PolarHBondContact OH-O 3.14Å; Y37-L211 VanDerWaalsContact OH-O 3.1Å; Y184-L211 HydrophobicContact CD1-CB 4.46Å; Y184-L211 HydrophobicContact CD1-CD1 3.77Å; Y184-L211 HydrophobicContact CD1-CD2 4.43Å; Y184-L211 HydrophobicContact CD1-CG 4.39Å; Y184-L211 HydrophobicContact CE1-CB 3.86Å; Y184-L211 HydrophobicContact CE1-CD1 4.02Å; Y184-L211 HydrophobicContact CE1-CD2 4.44Å; Y184-L211 HydrophobicContact CE1-CG 4.27Å; T185-L211 HydrophobicContact CG2-CD2 4.23Å; A207-L211 PolarHBondContact O-N 2.86Å; E208-L211 WeakPolarHBondContact O-CA 3.26Å; E208-L211 VanDerWaalsContact O-CB 3.27Å; E208-L211 WeakPolarHBondContact O-CB 3.01Å; E208-L211 PolarHBondContact O-N 3.27Å; I209-L211 PolarHBondContact O-N 3.48Å; L211-R213 VanDerWaalsContact C-N 3.32Å; L211-R213 PolarHBondContact O-N 3.47Å; L211-A214 WeakPolarHBondContact O-CB 3.28Å; L211-A214 PolarHBondContact O-N 3.38Å; L211-A214 VanDerWaalsContact O-N 3.11Å; L211-R215 PolarHBondContact O-N 2.72Å
212	L	85	Confident	80.5	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-54.2	-49.3	176	-77	166.2	0	0	0	111	Y29 L32 L33 Y37 E208 I209 A214 R215 I216 L245	Y29-L212 HydrophobicContact CD2-CD1 3.89Å; Y29-L212 HydrophobicContact CE2-CD1 3.37Å; L32-L212 HydrophobicContact CB-CD2 4.11Å; L33-L212 HydrophobicContact CD2-CD1 3.71Å; L33-L212 HydrophobicContact CD2-CD2 4.11Å; L33-L212 HydrophobicContact CD2-CG 3.99Å; L33-L212 HydrophobicContact CG-CD1 4.08Å; Y37-L212 HydrophobicContact CD2-CD2 4.32Å; Y37-L212 HydrophobicContact CE2-CD2 3.71Å; Y37-L212 HydrophobicContact CE2-CG 4.28Å; E208-L212 PolarHBondContact O-N 3.36Å; I209-L212 PolarHBondContact O-N 3.13Å; L212-A214 VanDerWaalsContact C-N 3.27Å; L212-A214 PolarHBondContact O-N 3.24Å; L212-R215 PolarHBondContact O-N 3.28Å; L212-I216 WeakPolarHBondContact O-CG1 3.49Å; L212-I216 PolarHBondContact O-N 2.94Å; L212-L245 HydrophobicContact CB-CD1 4.01Å; L212-L245 HydrophobicContact CD1-CD2 4.13Å
213	R	85.9	Confident	78.9	Confident	73 Å²	73	35.2 Å²	35.2	28%	0.275	19%	0.188	S	C	.	.	H	α-helix	trans	-53.6	-42.6	177	-79.1	-177.5	174.8	147.9	1.9	112.9	I209 L211 R215 I216 L245 N246 E249	I209-R213 HydrophobicContact CG2-CG 4.4Å; I209-R213 WeakPolarHBondContact O-CB 3.27Å; I209-R213 WeakPolarHBondContact O-CG 3.02Å; I209-R213 PolarHBondContact O-N 2.64Å; L211-R213 VanDerWaalsContact C-N 3.32Å; L211-R213 PolarHBondContact O-N 3.47Å; R213-R215 VanDerWaalsContact C-N 3.29Å; R213-R215 PolarHBondContact O-N 3.12Å; R213-I216 PolarHBondContact O-N 2.81Å; R213-L245 HydrophobicContact CG-CD1 3.64Å; R213-N246 PolarHBondContact NH2-OD1 3.36Å; R213-E249 IonicContact CZ-OE1 4Å; R213-E249 IonicContact CZ-OE2 3.01Å; R213-E249 IonicContact NH1-OE1 3.2Å; R213-E249 PolarHBondContact NH1-OE1 3.22Å; R213-E249 IonicContact NH1-OE2 2.64Å; R213-E249 PolarHBondContact NH1-OE2 2.97Å; R213-E249 IonicContact NH2-OE1 2.87Å; R213-E249 IonicContact NH2-OE2 2.64Å; R213-E249 PolarHBondContact NH2-OE2 3.24Å
214	A	82.9	Confident	77.4	Confident	34 Å²	34	41 Å²	41	28%	0.281	22%	0.22	S	C	.	.	H	α-helix	trans	-65.3	-34	179.4	0	0	0	0	0	111.9	T166 L211 L212 P217	T166-A214 PolarHBondContact OG1-O 2.66Å; L211-A214 WeakPolarHBondContact O-CB 3.28Å; L211-A214 PolarHBondContact O-N 3.38Å; L211-A214 VanDerWaalsContact O-N 3.11Å; L212-A214 VanDerWaalsContact C-N 3.27Å; L212-A214 PolarHBondContact O-N 3.24Å; A214-P217 WeakPolarHBondContact O-CD 3.14Å
215	R	79.8	Confident	75.7	Confident	27 Å²	27	43.7 Å²	43.7	10%	0.102	23%	0.232	C	C	.	.	H	α-helix	trans	-89.4	-11.7	-178.8	-62.9	-158.4	-162.4	165.7	-3.8	115.2	S36 Y37 T166 T185 L211 L212 R213 P217 A218 F219	S36-R215 PolarHBondContact O-NH1 2.96Å; Y37-R215 VanDerWaalsContact CD1-NH1 3.26Å; Y37-R215 VanDerWaalsContact CZ-CD 3.46Å; Y37-R215 VanDerWaalsContact CZ-CZ 3.47Å; Y37-R215 WeakPolarHBondContact OH-CB 3.2Å; Y37-R215 WeakPolarHBondContact OH-CD 3.39Å; Y37-R215 WeakPolarHBondContact OH-CG 3.35Å; Y37-R215 PolarHBondContact OH-NE 2.75Å; Y37-R215 VanDerWaalsContact OH-NE 3.14Å; T166-R215 HydrophobicContact CG2-CB 4.11Å; T166-R215 HydrophobicContact CG2-CG 4.04Å; T185-R215 PolarHBondContact OG1-NH2 3.42Å; T185-R215 VanDerWaalsContact OG1-NH2 3.08Å; L211-R215 PolarHBondContact O-N 2.72Å; L212-R215 PolarHBondContact O-N 3.28Å; R213-R215 VanDerWaalsContact C-N 3.29Å; R213-R215 PolarHBondContact O-N 3.12Å; R215-P217 VanDerWaalsContact C-CD 3.43Å; R215-P217 VanDerWaalsContact C-N 3.34Å; R215-A218 PolarHBondContact O-N 2.63Å; R215-A218 VanDerWaalsContact O-N 3.15Å; R215-F219 HydrophobicContact CB-CE2 4.37Å; R215-F219 WeakPolarHBondContact O-CD2 3.48Å
216	I	80.1	Confident	73.7	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-43	-52.5	174.7	-74.2	-177.8	0	0	0	113.1	L212 R213 A218 F219 F220 K238 L241 I242 L245	L212-I216 WeakPolarHBondContact O-CG1 3.49Å; L212-I216 PolarHBondContact O-N 2.94Å; R213-I216 PolarHBondContact O-N 2.81Å; I216-A218 VanDerWaalsContact C-N 3.28Å; I216-A218 PolarHBondContact O-N 3.27Å; I216-F219 PolarHBondContact O-N 3.36Å; I216-F219 VanDerWaalsContact O-N 3.14Å; I216-F220 HydrophobicContact CG2-CD2 4Å; I216-F220 HydrophobicContact CG2-CE2 3.91Å; I216-F220 VanDerWaalsContact O-CD2 3.29Å; I216-F220 WeakPolarHBondContact O-CD2 3.26Å; I216-K238 HydrophobicContact CG2-CG 3.92Å; I216-L241 HydrophobicContact CD1-CD2 3.86Å; I216-L241 HydrophobicContact CD1-CG 3.8Å; I216-L241 HydrophobicContact CG1-CD2 3.76Å; I216-L241 HydrophobicContact CG1-CG 4.27Å; I216-I242 HydrophobicContact CD1-CG1 3.83Å; I216-L245 HydrophobicContact CD1-CD1 3.63Å; I216-L245 HydrophobicContact CG1-CD1 4.49Å
217	P	75.4	Confident	71.7	Confident	45 Å²	45	48.7 Å²	48.7	29%	0.292	26%	0.256	S	S	.	.	H	α-helix	trans	-54.7	-39.6	-175.8	-27	36.3	0	0	0	114.1	A214 R215 F219 F220 E221	A214-P217 WeakPolarHBondContact O-CD 3.14Å; R215-P217 VanDerWaalsContact C-CD 3.43Å; R215-P217 VanDerWaalsContact C-N 3.34Å; P217-F219 PolarHBondContact O-N 2.9Å; P217-F220 PolarHBondContact O-N 3.31Å; P217-F220 VanDerWaalsContact O-N 3.11Å; P217-E221 WeakPolarHBondContact O-CG 3.36Å; P217-E221 PolarHBondContact O-N 3.21Å
218	A	71.1	Confident	70	Confident	21 Å²	21	58 Å²	58	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-71.7	-27.3	-177.5	0	0	0	0	0	114.1	T166 R215 I216 F220 E221 T222	T166-A218 HydrophobicContact CG2-CB 3.18Å; R215-A218 PolarHBondContact O-N 2.63Å; R215-A218 VanDerWaalsContact O-N 3.15Å; I216-A218 VanDerWaalsContact C-N 3.28Å; I216-A218 PolarHBondContact O-N 3.27Å; A218-F220 PolarHBondContact O-N 3.26Å; A218-E221 PolarHBondContact O-N 3.09Å; A218-T222 PolarHBondContact O-N 3.44Å; A218-T222 PolarHBondContact O-OG1 3.31Å
219	F	67.6	Low	68	Low	27 Å²	27	59.5 Å²	59.5	12%	0.118	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-29.5	172.5	-67.5	-64.8	0	0	0	111.8	L32 R215 I216 P217 M225 L229	L32-F219 HydrophobicContact CD2-CE2 4.45Å; L32-F219 HydrophobicContact CD2-CZ 4.43Å; R215-F219 HydrophobicContact CB-CE2 4.37Å; R215-F219 WeakPolarHBondContact O-CD2 3.48Å; I216-F219 PolarHBondContact O-N 3.36Å; I216-F219 VanDerWaalsContact O-N 3.14Å; P217-F219 PolarHBondContact O-N 2.9Å; F219-M225 HydrophobicContact CD1-CE 3.92Å; F219-M225 HydrophobicContact CE1-CE 4.32Å; F219-L229 WeakPolarHBondContact O-CD1 3.09Å
220	F	68.3	Low	66.2	Low	54 Å²	54	65.4 Å²	65.4	24%	0.237	33%	0.33	C	S	.	.	H	α-helix	trans	-97.2	-18.2	-178.5	-67.5	-75	0	0	0	114.2	I216 P217 A218 I226 A236 K238 L241	I216-F220 HydrophobicContact CG2-CD2 4Å; I216-F220 HydrophobicContact CG2-CE2 3.91Å; I216-F220 VanDerWaalsContact O-CD2 3.29Å; I216-F220 WeakPolarHBondContact O-CD2 3.26Å; P217-F220 PolarHBondContact O-N 3.31Å; P217-F220 VanDerWaalsContact O-N 3.11Å; A218-F220 PolarHBondContact O-N 3.26Å; F220-I226 VanDerWaalsContact O-CD1 3.22Å; F220-I226 WeakPolarHBondContact O-CD1 3.16Å; F220-I226 WeakPolarHBondContact O-CG1 3.22Å; F220-A236 VanDerWaalsContact CE1-O 3.31Å; F220-A236 WeakPolarHBondContact CE1-O 3.38Å; F220-K238 HydrophobicContact CD1-CB 4.34Å; F220-K238 HydrophobicContact CD2-CB 3.88Å; F220-K238 HydrophobicContact CD2-CD 4.42Å; F220-K238 HydrophobicContact CD2-CG 3.96Å; F220-K238 HydrophobicContact CE1-CB 4.16Å; F220-K238 HydrophobicContact CE2-CB 3.7Å; F220-K238 HydrophobicContact CE2-CG 3.98Å; F220-K238 HydrophobicContact CG-CB 4.22Å; F220-K238 HydrophobicContact CZ-CB 3.85Å; F220-L241 HydrophobicContact CE2-CD2 4.45Å
221	E	66.7	Low	64.6	Low	138 Å²	138	70.5 Å²	70.5	65%	0.645	35%	0.354	S	S	*	.	H	α-helix	trans	-88.5	-22.6	178	-73.4	169.5	-168.6	0	0	113.1	P217 A218 P223	P217-E221 WeakPolarHBondContact O-CG 3.36Å; P217-E221 PolarHBondContact O-N 3.21Å; A218-E221 PolarHBondContact O-N 3.09Å; E221-P223 WeakPolarHBondContact O-CD 3.37Å
222	T	58.8	Low	63.1	Low	60 Å²	60	79.4 Å²	79.4	37%	0.368	39%	0.387	S	S	.	.			trans	-84.6	118	-175.4	-45.6	0	0	0	0	111.5	A218 N224 M225 I226	A218-T222 PolarHBondContact O-N 3.44Å; A218-T222 PolarHBondContact O-OG1 3.31Å; T222-N224 VanDerWaalsContact C-N 3.33Å; T222-N224 PolarHBondContact O-N 3.41Å; T222-M225 HydrophobicContact CG2-CG 4.38Å; T222-M225 PolarHBondContact O-N 3.15Å; T222-I226 WeakPolarHBondContact O-CG1 2.99Å; T222-I226 PolarHBondContact O-N 2.9Å; T222-I226 VanDerWaalsContact O-N 3.14Å
223	P	53.9	Low	61.5	Low	96 Å²	96	82.7 Å²	82.7	62%	0.623	41%	0.411	S	S	*	.	H	α-helix	trans	-61.3	-35.4	-172.2	21	-31.9	0	0	0	114	E221 M225 K227	E221-P223 WeakPolarHBondContact O-CD 3.37Å; P223-M225 VanDerWaalsContact C-N 3.3Å; P223-M225 PolarHBondContact O-N 3.22Å; P223-K227 PolarHBondContact O-N 3.48Å
224	N	54	Low	59.8	Low	132 Å²	132	86 Å²	86	71%	0.706	43%	0.434	S	S	*	.	H	α-helix	trans	-69.8	-25	177.8	-71.7	-8.9	0	0	0	113.3	T222	T222-N224 VanDerWaalsContact C-N 3.33Å; T222-N224 PolarHBondContact O-N 3.41Å
225	M	49.9	Very low	58.5	Low	55 Å²	55	88 Å²	88	27%	0.271	44%	0.436	S	S	.	.	H	α-helix	trans	-85.7	-38.7	178.6	-70.1	-65.8	-77.8	0	0	111.4	F219 T222 P223 K227 R228 L229	F219-M225 HydrophobicContact CD1-CE 3.92Å; F219-M225 HydrophobicContact CE1-CE 4.32Å; T222-M225 HydrophobicContact CG2-CG 4.38Å; T222-M225 PolarHBondContact O-N 3.15Å; P223-M225 VanDerWaalsContact C-N 3.3Å; P223-M225 PolarHBondContact O-N 3.22Å; M225-K227 PolarHBondContact O-N 3.16Å; M225-R228 PolarHBondContact O-N 3.02Å; M225-R228 VanDerWaalsContact O-N 3.12Å; M225-L229 HydrophobicContact CB-CD1 4.43Å; M225-L229 WeakPolarHBondContact O-CB 3.27Å; M225-L229 WeakPolarHBondContact O-CD1 3.43Å; M225-L229 VanDerWaalsContact O-CG 3.28Å; M225-L229 WeakPolarHBondContact O-CG 2.88Å; M225-L229 PolarHBondContact O-N 3.35Å
226	I	46.9	Very low	57.7	Low	65 Å²	65	88.4 Å²	88.4	33%	0.333	45%	0.446	S	S	.	.	H	α-helix	trans	-52.2	-45.8	171.8	-62.7	169.3	0	0	0	109.8	F220 T222 R228 L229 I230	F220-I226 VanDerWaalsContact O-CD1 3.22Å; F220-I226 WeakPolarHBondContact O-CD1 3.16Å; F220-I226 WeakPolarHBondContact O-CG1 3.22Å; T222-I226 WeakPolarHBondContact O-CG1 2.99Å; T222-I226 PolarHBondContact O-N 2.9Å; T222-I226 VanDerWaalsContact O-N 3.14Å; I226-R228 PolarHBondContact O-N 3.27Å; I226-L229 PolarHBondContact O-N 3.28Å; I226-I230 HydrophobicContact CG2-CD1 3.52Å; I226-I230 HydrophobicContact CG2-CG1 4.22Å; I226-I230 WeakPolarHBondContact O-CB 3.25Å; I226-I230 WeakPolarHBondContact O-CD1 3.44Å; I226-I230 WeakPolarHBondContact O-CG1 3.03Å; I226-I230 PolarHBondContact O-N 3.09Å
227	K	47.4	Very low	57.3	Low	151 Å²	151	91.7 Å²	91.7	66%	0.657	47%	0.466	S	S	*	.	H	α-helix	trans	-61.2	-42.5	178.9	-160.8	171.8	-176.8	177.6	0	113.2	P223 M225 D231	P223-K227 PolarHBondContact O-N 3.48Å; M225-K227 PolarHBondContact O-N 3.16Å; K227-D231 PolarHBondContact O-N 3.04Å
228	R	51.1	Low	57.4	Low	195 Å²	195	93.7 Å²	93.7	74%	0.736	47%	0.47	S	S	*	.	H	α-helix	trans	-72.7	-27.6	176.3	-72.9	-175.2	171.2	-167.7	-2.2	113.8	M225 I226	M225-R228 PolarHBondContact O-N 3.02Å; M225-R228 VanDerWaalsContact O-N 3.12Å; I226-R228 PolarHBondContact O-N 3.27Å
229	L	46.9	Very low	57.9	Low	46 Å²	46	98.1 Å²	98.1	24%	0.241	49%	0.487	C	S	.	.	H	α-helix	trans	-77.6	-34.9	177.7	-75.9	161.6	0	0	0	111.5	F219 M225 I226 A236	F219-L229 WeakPolarHBondContact O-CD1 3.09Å; M225-L229 HydrophobicContact CB-CD1 4.43Å; M225-L229 WeakPolarHBondContact O-CB 3.27Å; M225-L229 WeakPolarHBondContact O-CD1 3.43Å; M225-L229 VanDerWaalsContact O-CG 3.28Å; M225-L229 WeakPolarHBondContact O-CG 2.88Å; M225-L229 PolarHBondContact O-N 3.35Å; I226-L229 PolarHBondContact O-N 3.28Å; L229-A236 HydrophobicContact CB-CB 4.47Å
230	I	49.6	Very low	58.5	Low	124 Å²	124	101.1 Å²	101.1	64%	0.636	50%	0.498	S	S	*	.	H	α-helix	trans	-66.5	-38	175.3	-69	165.2	0	0	0	111.2	I226 R232	I226-I230 HydrophobicContact CG2-CD1 3.52Å; I226-I230 HydrophobicContact CG2-CG1 4.22Å; I226-I230 WeakPolarHBondContact O-CB 3.25Å; I226-I230 WeakPolarHBondContact O-CD1 3.44Å; I226-I230 WeakPolarHBondContact O-CG1 3.03Å; I226-I230 PolarHBondContact O-N 3.09Å; I230-R232 VanDerWaalsContact C-N 3.29Å; I230-R232 PolarHBondContact O-N 2.73Å
231	D	52.6	Low	59.2	Low	123 Å²	123	99.1 Å²	99.1	66%	0.658	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-11.8	-174.6	-72.8	-15.9	0	0	0	114.7	K227	K227-D231 PolarHBondContact O-N 3.04Å
232	R	51.3	Low	60.1	Low	191 Å²	191	95.3 Å²	95.3	72%	0.721	47%	0.473	S	S	*	.	S	Bend	trans	-130.5	90	178.9	-77.7	-134.5	-94.1	-126.7	2.7	113	I230	I230-R232 VanDerWaalsContact C-N 3.29Å; I230-R232 PolarHBondContact O-N 2.73Å
233	S	50.9	Low	61.5	Low	74 Å²	74	97.9 Å²	97.9	52%	0.517	48%	0.481	S	S	.	.			trans	66.9	154.7	152.8	61.5	0	0	0	0	118.8	F235	S233-F235 PolarHBondContact O-N 3.02Å; S233-F235 WeakPolarHBondContact OG-CD2 3.17Å
234	D	51.2	Low	63	Low	143 Å²	143	94 Å²	94	77%	0.765	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	8.7	-171.3	-60.5	-38.1	0	0	0	117.7	A236 R240	D234-A236 VanDerWaalsContact C-N 3.34Å; D234-R240 PolarHBondContact O-NH1 3.23Å
235	F	55.3	Low	64.6	Low	74 Å²	74	87.7 Å²	87.7	33%	0.325	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-3.3	-179.5	-59.9	-83.7	0	0	0	113.6	V28 S233 T237	V28-F235 HydrophobicContact CG2-CD1 4.21Å; V28-F235 HydrophobicContact CG2-CG 4.41Å; S233-F235 PolarHBondContact O-N 3.02Å; S233-F235 WeakPolarHBondContact OG-CD2 3.17Å; F235-T237 PolarHBondContact O-N 2.76Å
236	A	61.9	Low	66.6	Low	37 Å²	37	88.6 Å²	88.6	31%	0.306	43%	0.427	S	S	.	.			trans	-91.5	15.4	-160.5	0	0	0	0	0	116.7	F220 L229 D234	F220-A236 VanDerWaalsContact CE1-O 3.31Å; F220-A236 WeakPolarHBondContact CE1-O 3.38Å; L229-A236 HydrophobicContact CB-CB 4.47Å; D234-A236 VanDerWaalsContact C-N 3.34Å
237	T	71.9	Confident	68.7	Low	75 Å²	75	90.6 Å²	90.6	46%	0.46	44%	0.435	S	S	.	.			trans	-87	139.7	169.9	63	0	0	0	0	110.8	F235 E239 R240 L241	F235-T237 PolarHBondContact O-N 2.76Å; T237-E239 PolarHBondContact O-N 2.82Å; T237-R240 PolarHBondContact O-N 3.06Å; T237-R240 VanDerWaalsContact O-N 3.12Å; T237-R240 VanDerWaalsContact OG1-CB 3.23Å; T237-R240 WeakPolarHBondContact OG1-CB 3.46Å; T237-R240 PolarHBondContact OG1-N 3.21Å; T237-L241 PolarHBondContact O-N 2.75Å; T237-L241 VanDerWaalsContact O-N 3.14Å
238	K	77.4	Confident	70.6	Confident	86 Å²	86	84.4 Å²	84.4	37%	0.374	41%	0.41	S	S	.	.	H	α-helix	trans	-52.2	-39.7	174.9	179.7	-177.8	175.6	-178.3	0	111.2	I216 F220 L241 I242	I216-K238 HydrophobicContact CG2-CG 3.92Å; F220-K238 HydrophobicContact CD1-CB 4.34Å; F220-K238 HydrophobicContact CD2-CB 3.88Å; F220-K238 HydrophobicContact CD2-CD 4.42Å; F220-K238 HydrophobicContact CD2-CG 3.96Å; F220-K238 HydrophobicContact CE1-CB 4.16Å; F220-K238 HydrophobicContact CE2-CB 3.7Å; F220-K238 HydrophobicContact CE2-CG 3.98Å; F220-K238 HydrophobicContact CG-CB 4.22Å; F220-K238 HydrophobicContact CZ-CB 3.85Å; K238-L241 PolarHBondContact O-N 2.88Å; K238-I242 HydrophobicContact CG-CD1 4.04Å; K238-I242 VanDerWaalsContact O-CG1 3.28Å; K238-I242 WeakPolarHBondContact O-CG1 3.4Å; K238-I242 PolarHBondContact O-N 3.18Å; K238-I242 VanDerWaalsContact O-N 3.08Å
239	E	82.6	Confident	72.5	Confident	114 Å²	114	77.3 Å²	77.3	53%	0.533	39%	0.385	S	S	.	.	H	α-helix	trans	-65.1	-44.8	179.7	-65.4	67.3	-144.8	0	0	111.8	T237 L241 I242 Q243	T237-E239 PolarHBondContact O-N 2.82Å; E239-L241 VanDerWaalsContact C-N 3.34Å; E239-L241 PolarHBondContact O-N 2.88Å; E239-I242 PolarHBondContact O-N 3.26Å; E239-Q243 VanDerWaalsContact O-CG 3.31Å; E239-Q243 WeakPolarHBondContact O-CG 3.41Å; E239-Q243 PolarHBondContact O-N 3.21Å
240	R	80.5	Confident	74.7	Confident	90 Å²	90	77.4 Å²	77.4	34%	0.34	39%	0.392	S	S	.	.	H	α-helix	trans	-64.7	-39.9	179	-174.2	169.5	-179.1	168.8	6.6	111.3	D234 T237 Q243 I244	D234-R240 PolarHBondContact O-NH1 3.23Å; T237-R240 PolarHBondContact O-N 3.06Å; T237-R240 VanDerWaalsContact O-N 3.12Å; T237-R240 VanDerWaalsContact OG1-CB 3.23Å; T237-R240 WeakPolarHBondContact OG1-CB 3.46Å; T237-R240 PolarHBondContact OG1-N 3.21Å; R240-Q243 WeakPolarHBondContact O-CB 3.39Å; R240-Q243 PolarHBondContact O-N 2.73Å; R240-I244 HydrophobicContact CG-CD1 4.23Å; R240-I244 WeakPolarHBondContact O-CG1 3.49Å; R240-I244 PolarHBondContact O-N 2.72Å
241	L	81.7	Confident	76.8	Confident	13 Å²	13	74.4 Å²	74.4	7%	0.068	38%	0.382	C	S	.	.	H	α-helix	trans	-62.6	-45.4	175.1	178.6	53.1	0	0	0	111.9	L32 I216 F220 T237 K238 E239 Q243 I244 L245	L32-L241 HydrophobicContact CD1-CD1 3.15Å; L32-L241 HydrophobicContact CD1-CD2 3.81Å; L32-L241 HydrophobicContact CD1-CG 4.11Å; L32-L241 HydrophobicContact CD2-CD2 4.48Å; I216-L241 HydrophobicContact CD1-CD2 3.86Å; I216-L241 HydrophobicContact CD1-CG 3.8Å; I216-L241 HydrophobicContact CG1-CD2 3.76Å; I216-L241 HydrophobicContact CG1-CG 4.27Å; F220-L241 HydrophobicContact CE2-CD2 4.45Å; T237-L241 PolarHBondContact O-N 2.75Å; T237-L241 VanDerWaalsContact O-N 3.14Å; K238-L241 PolarHBondContact O-N 2.88Å; E239-L241 VanDerWaalsContact C-N 3.34Å; E239-L241 PolarHBondContact O-N 2.88Å; L241-Q243 VanDerWaalsContact C-N 3.28Å; L241-Q243 PolarHBondContact O-N 2.83Å; L241-I244 PolarHBondContact O-N 2.82Å; L241-L245 HydrophobicContact CD1-CG 4.34Å; L241-L245 WeakPolarHBondContact O-CG 3.21Å; L241-L245 PolarHBondContact O-N 3.14Å
242	I	86.1	Confident	78.6	Confident	58 Å²	58	69.6 Å²	69.6	30%	0.297	36%	0.356	S	S	.	.	H	α-helix	trans	-59.8	-41.5	175.8	-68.8	166.3	0	0	0	110.8	I216 K238 E239 L245 N246	I216-I242 HydrophobicContact CD1-CG1 3.83Å; K238-I242 HydrophobicContact CG-CD1 4.04Å; K238-I242 VanDerWaalsContact O-CG1 3.28Å; K238-I242 WeakPolarHBondContact O-CG1 3.4Å; K238-I242 PolarHBondContact O-N 3.18Å; K238-I242 VanDerWaalsContact O-N 3.08Å; E239-I242 PolarHBondContact O-N 3.26Å; I242-L245 PolarHBondContact O-N 2.79Å; I242-N246 PolarHBondContact O-N 2.92Å; I242-N246 PolarHBondContact O-ND2 2.96Å; I242-N246 PolarHBondContact O-OD1 2.93Å
243	Q	87.6	Confident	80.5	Confident	113 Å²	113	64.6 Å²	64.6	53%	0.528	34%	0.344	S	S	.	.	H	α-helix	trans	-61.6	-45	176.8	-73.6	173	1.1	0	0	112.4	E239 R240 L241 L245 N246 Q247	E239-Q243 VanDerWaalsContact O-CG 3.31Å; E239-Q243 WeakPolarHBondContact O-CG 3.41Å; E239-Q243 PolarHBondContact O-N 3.21Å; R240-Q243 WeakPolarHBondContact O-CB 3.39Å; R240-Q243 PolarHBondContact O-N 2.73Å; L241-Q243 VanDerWaalsContact C-N 3.28Å; L241-Q243 PolarHBondContact O-N 2.83Å; Q243-L245 VanDerWaalsContact C-N 3.34Å; Q243-L245 PolarHBondContact O-N 3Å; Q243-N246 PolarHBondContact O-N 3.15Å; Q243-Q247 WeakPolarHBondContact O-CG 3.49Å; Q243-Q247 PolarHBondContact O-N 2.88Å
244	I	86.3	Confident	82.5	Confident	14 Å²	14	65.5 Å²	65.5	7%	0.072	34%	0.342	C	S	.	.	H	α-helix	trans	-60.4	-44.3	176.2	-68.1	165.7	0	0	0	110.5	V28 R240 L241 N246 Q247 T248	V28-I244 HydrophobicContact CG1-CD1 4.46Å; R240-I244 HydrophobicContact CG-CD1 4.23Å; R240-I244 WeakPolarHBondContact O-CG1 3.49Å; R240-I244 PolarHBondContact O-N 2.72Å; L241-I244 PolarHBondContact O-N 2.82Å; I244-N246 VanDerWaalsContact C-N 3.32Å; I244-N246 PolarHBondContact O-N 3.19Å; I244-Q247 PolarHBondContact O-N 2.78Å; I244-T248 HydrophobicContact CG2-CG2 4.42Å; I244-T248 WeakPolarHBondContact O-CB 3.5Å; I244-T248 WeakPolarHBondContact O-CG2 3.46Å; I244-T248 PolarHBondContact O-N 2.68Å; I244-T248 PolarHBondContact O-OG1 3.41Å
245	L	88.3	Confident	84.4	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-63.4	-36.9	176.4	-68.1	-170.3	0	0	0	112.7	Y29 I209 L212 R213 I216 L241 I242 Q243 T248 E249	Y29-L245 HydrophobicContact CD2-CD2 3.95Å; Y29-L245 HydrophobicContact CE2-CD2 4.2Å; I209-L245 HydrophobicContact CG2-CB 4.29Å; L212-L245 HydrophobicContact CB-CD1 4.01Å; L212-L245 HydrophobicContact CD1-CD2 4.13Å; R213-L245 HydrophobicContact CG-CD1 3.64Å; I216-L245 HydrophobicContact CD1-CD1 3.63Å; I216-L245 HydrophobicContact CG1-CD1 4.49Å; L241-L245 HydrophobicContact CD1-CG 4.34Å; L241-L245 WeakPolarHBondContact O-CG 3.21Å; L241-L245 PolarHBondContact O-N 3.14Å; I242-L245 PolarHBondContact O-N 2.79Å; Q243-L245 VanDerWaalsContact C-N 3.34Å; Q243-L245 PolarHBondContact O-N 3Å; L245-T248 VanDerWaalsContact CA-OG1 3.3Å; L245-T248 WeakPolarHBondContact CA-OG1 3.49Å; L245-T248 PolarHBondContact O-OG1 2.76Å; L245-E249 VanDerWaalsContact O-CB 3.31Å; L245-E249 WeakPolarHBondContact O-CB 3.45Å; L245-E249 PolarHBondContact O-N 2.87Å
246	N	90.8	Very high	86.1	Confident	74 Å²	74	60.6 Å²	60.6	40%	0.396	32%	0.317	S	S	.	.	H	α-helix	trans	-68.9	-41	176.7	-65.6	-9.8	0	0	0	112.1	R213 I242 Q243 I244 A250	R213-N246 PolarHBondContact NH2-OD1 3.36Å; I242-N246 PolarHBondContact O-N 2.92Å; I242-N246 PolarHBondContact O-ND2 2.96Å; I242-N246 PolarHBondContact O-OD1 2.93Å; Q243-N246 PolarHBondContact O-N 3.15Å; I244-N246 VanDerWaalsContact C-N 3.32Å; I244-N246 PolarHBondContact O-N 3.19Å; N246-A250 WeakPolarHBondContact O-CB 3.47Å; N246-A250 PolarHBondContact O-N 2.97Å
247	Q	90.3	Very high	87.4	Confident	107 Å²	107	63.3 Å²	63.3	50%	0.5	32%	0.323	S	S	.	.	H	α-helix	trans	-66	-43.9	177.9	-73.4	176	-9.8	0	0	111.7	Q243 I244 A250 S251	Q243-Q247 WeakPolarHBondContact O-CG 3.49Å; Q243-Q247 PolarHBondContact O-N 2.88Å; I244-Q247 PolarHBondContact O-N 2.78Å; Q247-A250 PolarHBondContact O-N 3.31Å; Q247-S251 PolarHBondContact O-N 2.71Å
248	T	89.3	Confident	88.3	Confident	21 Å²	21	66.4 Å²	66.4	13%	0.129	33%	0.33	C	S	.	.	H	α-helix	trans	-64	-44.3	176.3	50.1	0	0	0	0	111.5	I244 L245 A250 S251 L252	I244-T248 HydrophobicContact CG2-CG2 4.42Å; I244-T248 WeakPolarHBondContact O-CB 3.5Å; I244-T248 WeakPolarHBondContact O-CG2 3.46Å; I244-T248 PolarHBondContact O-N 2.68Å; I244-T248 PolarHBondContact O-OG1 3.41Å; L245-T248 VanDerWaalsContact CA-OG1 3.3Å; L245-T248 WeakPolarHBondContact CA-OG1 3.49Å; L245-T248 PolarHBondContact O-OG1 2.76Å; T248-A250 PolarHBondContact O-N 3.03Å; T248-S251 PolarHBondContact O-N 2.61Å; T248-L252 WeakPolarHBondContact O-CG 3.48Å; T248-L252 PolarHBondContact O-N 3.21Å
249	E	90.9	Very high	88.8	Confident	46 Å²	46	64.1 Å²	64.1	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-57	-47	174.1	-176.1	179.3	-133.5	0	0	111.7	L206 I209 R213 L245 S251 L252 L253	L206-E249 HydrophobicContact CD2-CG 3.94Å; I209-E249 HydrophobicContact CD1-CB 3.94Å; I209-E249 HydrophobicContact CG2-CB 4.49Å; R213-E249 IonicContact CZ-OE1 4Å; R213-E249 IonicContact CZ-OE2 3.01Å; R213-E249 IonicContact NH1-OE1 3.2Å; R213-E249 PolarHBondContact NH1-OE1 3.22Å; R213-E249 IonicContact NH1-OE2 2.64Å; R213-E249 PolarHBondContact NH1-OE2 2.97Å; R213-E249 IonicContact NH2-OE1 2.87Å; R213-E249 IonicContact NH2-OE2 2.64Å; R213-E249 PolarHBondContact NH2-OE2 3.24Å; L245-E249 VanDerWaalsContact O-CB 3.31Å; L245-E249 WeakPolarHBondContact O-CB 3.45Å; L245-E249 PolarHBondContact O-N 2.87Å; E249-S251 VanDerWaalsContact C-N 3.33Å; E249-S251 PolarHBondContact O-N 3.26Å; E249-L252 PolarHBondContact O-N 2.9Å; E249-L253 HydrophobicContact CG-CD1 4.11Å; E249-L253 HydrophobicContact CG-CG 4.47Å; E249-L253 WeakPolarHBondContact O-CG 3.49Å; E249-L253 PolarHBondContact O-N 3.12Å
250	A	92.6	Very high	88.8	Confident	48 Å²	48	60.9 Å²	60.9	40%	0.397	31%	0.311	S	S	.	.	H	α-helix	trans	-61.8	-40.3	178.3	0	0	0	0	0	112.4	N246 Q247 T248 N254	N246-A250 WeakPolarHBondContact O-CB 3.47Å; N246-A250 PolarHBondContact O-N 2.97Å; Q247-A250 PolarHBondContact O-N 3.31Å; T248-A250 PolarHBondContact O-N 3.03Å; A250-N254 VanDerWaalsContact O-CG 3.25Å; A250-N254 PolarHBondContact O-N 2.66Å; A250-N254 VanDerWaalsContact O-N 3.1Å; A250-N254 PolarHBondContact O-ND2 2.78Å; A250-N254 VanDerWaalsContact O-ND2 3.17Å
251	S	92.6	Very high	89	Confident	61 Å²	61	62.5 Å²	62.5	43%	0.427	32%	0.321	S	S	.	.	H	α-helix	trans	-63.7	-45.6	176.1	-172.5	0	0	0	0	112	Q247 T248 E249 N254 Q255	Q247-S251 PolarHBondContact O-N 2.71Å; T248-S251 PolarHBondContact O-N 2.61Å; E249-S251 VanDerWaalsContact C-N 3.33Å; E249-S251 PolarHBondContact O-N 3.26Å; S251-N254 PolarHBondContact O-N 3.25Å; S251-Q255 WeakPolarHBondContact O-CG 3.47Å; S251-Q255 PolarHBondContact O-N 2.84Å
252	L	91.8	Very high	89.2	Confident	21 Å²	21	67.5 Å²	67.5	11%	0.11	34%	0.344	C	S	.	.	H	α-helix	trans	-64.1	-41.9	178.1	-68.7	174	0	0	0	112.1	L202 K205 L206 I209 T248 E249 N254 Q255 L256	L202-L252 HydrophobicContact CD2-CD2 3.47Å; L202-L252 VanDerWaalsContact CD2-CD2 3.47Å; K205-L252 HydrophobicContact CB-CD1 3.83Å; K205-L252 HydrophobicContact CB-CD2 4.38Å; K205-L252 HydrophobicContact CD-CD2 4.23Å; L206-L252 HydrophobicContact CD1-CB 4.5Å; L206-L252 HydrophobicContact CD2-CB 3.64Å; L206-L252 HydrophobicContact CD2-CD1 3.98Å; L206-L252 HydrophobicContact CD2-CG 4.49Å; L206-L252 HydrophobicContact CG-CB 3.93Å; L206-L252 HydrophobicContact CG-CD1 4.13Å; I209-L252 HydrophobicContact CD1-CD1 3.69Å; T248-L252 WeakPolarHBondContact O-CG 3.48Å; T248-L252 PolarHBondContact O-N 3.21Å; E249-L252 PolarHBondContact O-N 2.9Å; L252-N254 VanDerWaalsContact C-N 3.34Å; L252-N254 PolarHBondContact O-N 3.29Å; L252-Q255 PolarHBondContact O-N 3.31Å; L252-L256 WeakPolarHBondContact O-CB 3.49Å; L252-L256 PolarHBondContact O-N 3.05Å
253	L	90.7	Very high	88.8	Confident	87 Å²	87	67 Å²	67	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-61.3	-41.9	175.8	-73.2	174.1	0	0	0	111.9	L206 E249 Q255 L256 E257	L206-L253 HydrophobicContact CD1-CD2 3.92Å; L206-L253 HydrophobicContact CD2-CD2 4.26Å; L206-L253 HydrophobicContact CD2-CG 4.15Å; E249-L253 HydrophobicContact CG-CD1 4.11Å; E249-L253 HydrophobicContact CG-CG 4.47Å; E249-L253 WeakPolarHBondContact O-CG 3.49Å; E249-L253 PolarHBondContact O-N 3.12Å; L253-Q255 VanDerWaalsContact C-N 3.34Å; L253-Q255 PolarHBondContact O-N 2.88Å; L253-L256 PolarHBondContact O-N 3.48Å; L253-E257 PolarHBondContact O-N 2.94Å
254	N	92.7	Very high	88.3	Confident	92 Å²	92	66.1 Å²	66.1	49%	0.492	34%	0.336	S	S	.	.	H	α-helix	trans	-64.1	-37.6	175.8	-72.7	-28.6	0	0	0	112.4	A250 S251 L252 K258	A250-N254 VanDerWaalsContact O-CG 3.25Å; A250-N254 PolarHBondContact O-N 2.66Å; A250-N254 VanDerWaalsContact O-N 3.1Å; A250-N254 PolarHBondContact O-ND2 2.78Å; A250-N254 VanDerWaalsContact O-ND2 3.17Å; S251-N254 PolarHBondContact O-N 3.25Å; L252-N254 VanDerWaalsContact C-N 3.34Å; L252-N254 PolarHBondContact O-N 3.29Å; N254-K258 WeakPolarHBondContact O-CG 3.36Å; N254-K258 PolarHBondContact O-N 3.47Å
255	Q	92.2	Very high	87.9	Confident	88 Å²	88	70.5 Å²	70.5	41%	0.411	36%	0.356	S	S	.	.	H	α-helix	trans	-68	-41.5	174.9	-69.7	179.4	9.6	0	0	111.2	L202 S251 L252 L253 E257 K258 I259	L202-Q255 HydrophobicContact CD1-CB 3.7Å; L202-Q255 HydrophobicContact CD2-CB 4.25Å; L202-Q255 VanDerWaalsContact CD2-OE1 3.23Å; S251-Q255 WeakPolarHBondContact O-CG 3.47Å; S251-Q255 PolarHBondContact O-N 2.84Å; L252-Q255 PolarHBondContact O-N 3.31Å; L253-Q255 VanDerWaalsContact C-N 3.34Å; L253-Q255 PolarHBondContact O-N 2.88Å; Q255-E257 VanDerWaalsContact C-N 3.35Å; Q255-E257 PolarHBondContact O-N 3.12Å; Q255-K258 WeakPolarHBondContact O-CB 3.36Å; Q255-K258 PolarHBondContact O-N 3.33Å; Q255-I259 PolarHBondContact O-N 3.31Å; Q255-I259 VanDerWaalsContact O-N 3.15Å
256	L	89.5	Confident	87.3	Confident	27 Å²	27	76.5 Å²	76.5	14%	0.141	38%	0.384	C	S	.	.	H	α-helix	trans	-63.3	-41.1	177.8	-173.8	63.2	0	0	0	111.6	E199 L202 Q203 L206 L252 L253 K258 I259 S260	E199-L256 HydrophobicContact CG-CD1 3.72Å; L202-L256 HydrophobicContact CD1-CB 4.43Å; Q203-L256 HydrophobicContact CG-CD1 3.99Å; Q203-L256 HydrophobicContact CG-CD2 4.09Å; L206-L256 HydrophobicContact CD1-CD2 3.98Å; L252-L256 WeakPolarHBondContact O-CB 3.49Å; L252-L256 PolarHBondContact O-N 3.05Å; L253-L256 PolarHBondContact O-N 3.48Å; L256-K258 VanDerWaalsContact C-N 3.3Å; L256-K258 PolarHBondContact O-N 3.37Å; L256-I259 PolarHBondContact O-N 2.82Å; L256-S260 WeakPolarHBondContact O-CB 3.19Å; L256-S260 PolarHBondContact O-N 3.26Å; L256-S260 PolarHBondContact O-OG 3.27Å
257	E	89.4	Confident	86.4	Confident	93 Å²	93	75.9 Å²	75.9	44%	0.435	38%	0.376	S	S	.	.	H	α-helix	trans	-62.4	-35.5	175.9	-165.3	-166.7	159.7	0	0	112.5	L253 Q255 S260 K261	L253-E257 PolarHBondContact O-N 2.94Å; Q255-E257 VanDerWaalsContact C-N 3.35Å; Q255-E257 PolarHBondContact O-N 3.12Å; E257-S260 WeakPolarHBondContact CA-OG 3.36Å; E257-S260 PolarHBondContact O-OG 2.93Å; E257-K261 WeakPolarHBondContact O-CG 3.39Å; E257-K261 PolarHBondContact O-N 3.5Å; E257-K261 WeakPolarHBondContact OE1-CE 3.49Å; E257-K261 IonicContact OE1-NZ 3.02Å; E257-K261 PolarHBondContact OE1-NZ 3.15Å
258	K	91.2	Very high	85.4	Confident	141 Å²	141	78.9 Å²	78.9	61%	0.613	38%	0.383	S	S	*	.	H	α-helix	trans	-66.3	-45.3	175.4	-71.1	172.4	-177.1	-179.8	0	111.4	N254 Q255 L256 Q262	N254-K258 WeakPolarHBondContact O-CG 3.36Å; N254-K258 PolarHBondContact O-N 3.47Å; Q255-K258 WeakPolarHBondContact O-CB 3.36Å; Q255-K258 PolarHBondContact O-N 3.33Å; L256-K258 VanDerWaalsContact C-N 3.3Å; L256-K258 PolarHBondContact O-N 3.37Å; K258-Q262 WeakPolarHBondContact O-CG 3.09Å; K258-Q262 PolarHBondContact O-N 2.83Å; K258-Q262 VanDerWaalsContact O-N 3.16Å
259	I	87.4	Confident	84.6	Confident	38 Å²	38	81 Å²	81	20%	0.195	39%	0.393	C	S	.	.	H	α-helix	trans	-65.9	-42.7	179.2	-66.1	179.3	0	0	0	110.7	P198 E199 L202 Q255 L256 K261 Q262 R263	P198-I259 HydrophobicContact CB-CD1 4.05Å; P198-I259 HydrophobicContact CG-CD1 4.31Å; E199-I259 HydrophobicContact CB-CG2 4.02Å; E199-I259 HydrophobicContact CG-CG2 4.1Å; L202-I259 HydrophobicContact CD1-CD1 3.68Å; Q255-I259 PolarHBondContact O-N 3.31Å; Q255-I259 VanDerWaalsContact O-N 3.15Å; L256-I259 PolarHBondContact O-N 2.82Å; I259-K261 PolarHBondContact O-N 2.69Å; I259-Q262 WeakPolarHBondContact O-CB 3.17Å; I259-Q262 PolarHBondContact O-N 2.96Å; I259-Q262 VanDerWaalsContact O-N 3.15Å; I259-R263 WeakPolarHBondContact O-CB 3.1Å; I259-R263 PolarHBondContact O-N 3.1Å
260	S	83.2	Confident	83.4	Confident	45 Å²	45	83.8 Å²	83.8	32%	0.315	41%	0.406	S	S	.	.	H	α-helix	trans	-62.5	-41.3	179.7	69.8	0	0	0	0	112.2	L256 E257 Q262 R263 I264	L256-S260 WeakPolarHBondContact O-CB 3.19Å; L256-S260 PolarHBondContact O-N 3.26Å; L256-S260 PolarHBondContact O-OG 3.27Å; E257-S260 WeakPolarHBondContact CA-OG 3.36Å; E257-S260 PolarHBondContact O-OG 2.93Å; S260-Q262 PolarHBondContact O-N 3.4Å; S260-R263 PolarHBondContact O-N 3.15Å; S260-I264 WeakPolarHBondContact O-CG1 3.13Å; S260-I264 PolarHBondContact O-N 2.82Å; S260-I264 VanDerWaalsContact O-N 3.09Å
261	K	85.2	Confident	82	Confident	124 Å²	124	85.8 Å²	85.8	54%	0.539	40%	0.404	S	S	.	.	H	α-helix	trans	-61	-42.4	173.2	-74.3	175	-175.1	169.4	0	112.3	E257 I259 H265	E257-K261 WeakPolarHBondContact O-CG 3.39Å; E257-K261 PolarHBondContact O-N 3.5Å; E257-K261 WeakPolarHBondContact OE1-CE 3.49Å; E257-K261 IonicContact OE1-NZ 3.02Å; E257-K261 PolarHBondContact OE1-NZ 3.15Å; I259-K261 PolarHBondContact O-N 2.69Å; K261-H265 PolarHBondContact O-N 3.03Å
262	Q	85.2	Confident	80.6	Confident	118 Å²	118	91 Å²	91	55%	0.551	41%	0.414	S	S	*	.	H	α-helix	trans	-64.4	-41.3	177.1	-73.2	174.3	-9.5	0	0	111.8	K258 I259 S260 H265 H266	K258-Q262 WeakPolarHBondContact O-CG 3.09Å; K258-Q262 PolarHBondContact O-N 2.83Å; K258-Q262 VanDerWaalsContact O-N 3.16Å; I259-Q262 WeakPolarHBondContact O-CB 3.17Å; I259-Q262 PolarHBondContact O-N 2.96Å; I259-Q262 VanDerWaalsContact O-N 3.15Å; S260-Q262 PolarHBondContact O-N 3.4Å; Q262-H265 PolarHBondContact O-N 3.33Å; Q262-H266 PolarHBondContact O-N 3.49Å; Q262-H266 PolarHBondContact O-ND1 3.07Å
263	R	77.6	Confident	79.1	Confident	47 Å²	47	94.9 Å²	94.9	18%	0.177	44%	0.435	C	S	.	.	H	α-helix	trans	-62.6	-44.9	178.9	-172	171.8	178.4	-157.6	-7.7	112.5	E199 I259 S260 H265 H266 R267 A384 E388	E199-R263 VanDerWaalsContact CD-NH1 3.34Å; E199-R263 IonicContact OE1-NH1 2.77Å; E199-R263 PolarHBondContact OE1-NH1 2.88Å; E199-R263 WeakPolarHBondContact OE2-CD 3.42Å; E199-R263 IonicContact OE2-CZ 2.98Å; E199-R263 IonicContact OE2-NE 3.29Å; E199-R263 IonicContact OE2-NH1 2.65Å; E199-R263 PolarHBondContact OE2-NH1 2.84Å; I259-R263 WeakPolarHBondContact O-CB 3.1Å; I259-R263 PolarHBondContact O-N 3.1Å; S260-R263 PolarHBondContact O-N 3.15Å; R263-H265 VanDerWaalsContact C-N 3.25Å; R263-H265 PolarHBondContact O-N 3.41Å; R263-H266 PolarHBondContact O-N 3.02Å; R263-R267 VanDerWaalsContact O-CB 3.26Å; R263-R267 WeakPolarHBondContact O-CB 3.15Å; R263-R267 PolarHBondContact O-N 3.15Å; R263-A384 VanDerWaalsContact NH1-C 3.32Å; R263-A384 VanDerWaalsContact NH1-CB 3.32Å; R263-A384 PolarHBondContact NH1-O 2.95Å; R263-A384 VanDerWaalsContact NH1-O 3.15Å; R263-A384 PolarHBondContact NH2-O 3.11Å; R263-E388 IonicContact CZ-OE1 2.8Å; R263-E388 IonicContact NE-OE1 3.75Å; R263-E388 PolarHBondContact NE-OE1 2.97Å; R263-E388 VanDerWaalsContact NH2-CG 3.31Å; R263-E388 IonicContact NH2-OE1 3.04Å; R263-E388 PolarHBondContact NH2-OE1 2.84Å
264	I	76.4	Confident	77.5	Confident	95 Å²	95	93.1 Å²	93.1	49%	0.487	43%	0.425	S	S	.	.	H	α-helix	trans	-57.9	-40.4	175.5	-66.3	165.4	0	0	0	111	S260 R268	S260-I264 WeakPolarHBondContact O-CG1 3.13Å; S260-I264 PolarHBondContact O-N 2.82Å; S260-I264 VanDerWaalsContact O-N 3.09Å; I264-R268 PolarHBondContact O-N 3.04Å
265	H	78.8	Confident	75.9	Confident	107 Å²	107	96 Å²	96	50%	0.495	44%	0.435	S	S	.	.	H	α-helix	trans	-69	-44.6	177.2	-170.8	71.1	0	0	0	112.4	K261 Q262 R263 R267 R268 N269	K261-H265 PolarHBondContact O-N 3.03Å; Q262-H265 PolarHBondContact O-N 3.33Å; R263-H265 VanDerWaalsContact C-N 3.25Å; R263-H265 PolarHBondContact O-N 3.41Å; H265-R267 VanDerWaalsContact C-N 3.3Å; H265-R267 PolarHBondContact O-N 3.4Å; H265-R268 PolarHBondContact O-N 3.07Å; H265-N269 PolarHBondContact NE2-ND2 2.9Å; H265-N269 PolarHBondContact O-N 3.04Å
266	H	74.8	Confident	74.1	Confident	127 Å²	127	99.2 Å²	99.2	59%	0.588	45%	0.448	S	S	*	.	H	α-helix	trans	-61.2	-41	177.4	-79.6	58.8	0	0	0	111.6	Q262 R263 R268 N269 H270	Q262-H266 PolarHBondContact O-N 3.49Å; Q262-H266 PolarHBondContact O-ND1 3.07Å; R263-H266 PolarHBondContact O-N 3.02Å; H266-R268 PolarHBondContact O-N 2.88Å; H266-N269 PolarHBondContact O-N 3.31Å; H266-H270 WeakPolarHBondContact O-CB 3.49Å; H266-H270 PolarHBondContact O-N 3.28Å
267	R	72.1	Confident	72.1	Confident	61 Å²	61	106.6 Å²	106.6	23%	0.23	48%	0.481	C	S	.	.	H	α-helix	trans	-60.2	-44.5	178.7	-169.6	176.9	166.4	-171.6	-8.1	112.9	R263 H265 N269 H270 R271 D387 D391	R263-R267 VanDerWaalsContact O-CB 3.26Å; R263-R267 WeakPolarHBondContact O-CB 3.15Å; R263-R267 PolarHBondContact O-N 3.15Å; H265-R267 VanDerWaalsContact C-N 3.3Å; H265-R267 PolarHBondContact O-N 3.4Å; R267-N269 VanDerWaalsContact C-N 3.3Å; R267-N269 PolarHBondContact O-N 3.42Å; R267-H270 PolarHBondContact O-N 3.4Å; R267-R271 WeakPolarHBondContact O-CB 3.22Å; R267-R271 PolarHBondContact O-N 3.18Å; R267-D387 PolarHBondContact NH1-O 3.37Å; R267-D387 PolarHBondContact NH2-O 3.26Å; R267-D391 WeakPolarHBondContact CD-OD2 3.48Å; R267-D391 WeakPolarHBondContact CG-OD2 3.5Å; R267-D391 IonicContact CZ-OD1 3.87Å; R267-D391 IonicContact CZ-OD2 2.75Å; R267-D391 IonicContact NE-OD1 3.01Å; R267-D391 PolarHBondContact NE-OD1 3.09Å; R267-D391 VanDerWaalsContact NE-OD1 3.12Å; R267-D391 IonicContact NE-OD2 2.9Å; R267-D391 PolarHBondContact NE-OD2 2.77Å; R267-D391 IonicContact NH2-OD1 2.74Å; R267-D391 PolarHBondContact NH2-OD1 2.9Å; R267-D391 IonicContact NH2-OD2 3.65Å
268	R	70.7	Confident	70.9	Confident	169 Å²	169	106.5 Å²	106.5	64%	0.638	48%	0.481	S	S	*	.	H	α-helix	trans	-61.2	-37.9	175.5	-73	179	179.4	168.3	0.8	112.6	I264 H265 H266 R272	I264-R268 PolarHBondContact O-N 3.04Å; H265-R268 PolarHBondContact O-N 3.07Å; H266-R268 PolarHBondContact O-N 2.88Å; R268-R272 WeakPolarHBondContact O-CG 3.22Å
269	N	71.3	Confident	70.4	Confident	65 Å²	65	101.8 Å²	101.8	35%	0.348	46%	0.462	S	S	.	.	H	α-helix	trans	-73.5	-46.5	177.7	-67.3	-13.4	0	0	0	111	H265 H266 R267 R271 R272 D273	H265-N269 PolarHBondContact NE2-ND2 2.9Å; H265-N269 PolarHBondContact O-N 3.04Å; H266-N269 PolarHBondContact O-N 3.31Å; R267-N269 VanDerWaalsContact C-N 3.3Å; R267-N269 PolarHBondContact O-N 3.42Å; N269-R271 VanDerWaalsContact C-N 3.29Å; N269-R271 PolarHBondContact O-N 3Å; N269-R272 WeakPolarHBondContact O-CB 3.36Å; N269-R272 PolarHBondContact O-N 2.87Å; N269-R272 VanDerWaalsContact O-N 3.12Å; N269-D273 PolarHBondContact O-N 3.15Å
270	H	66.2	Low	70.4	Confident	105 Å²	105	100 Å²	100	49%	0.486	45%	0.453	S	S	.	.	H	α-helix	trans	-57.8	-42.6	180	-164.4	62	0	0	0	111.8	H266 R267 R272 D273 M274	H266-H270 WeakPolarHBondContact O-CB 3.49Å; H266-H270 PolarHBondContact O-N 3.28Å; R267-H270 PolarHBondContact O-N 3.4Å; H270-R272 PolarHBondContact O-N 3.48Å; H270-D273 WeakPolarHBondContact O-CB 3.49Å; H270-D273 PolarHBondContact O-N 3.22Å; H270-D273 VanDerWaalsContact O-N 3.08Å; H270-M274 WeakPolarHBondContact CE1-CE 3.42Å; H270-M274 WeakPolarHBondContact O-CG 3.36Å; H270-M274 PolarHBondContact O-N 2.9Å
271	R	62.4	Low	70.6	Confident	91 Å²	91	99.3 Å²	99.3	34%	0.343	45%	0.445	S	S	.	.	H	α-helix	trans	-60.2	-40.7	177.1	-176	171.2	163.5	171.7	-7.1	113.6	R267 N269 D273 M274 E275 F439	R267-R271 WeakPolarHBondContact O-CB 3.22Å; R267-R271 PolarHBondContact O-N 3.18Å; N269-R271 VanDerWaalsContact C-N 3.29Å; N269-R271 PolarHBondContact O-N 3Å; R271-D273 PolarHBondContact O-N 3.28Å; R271-M274 PolarHBondContact O-N 3.39Å; R271-E275 PolarHBondContact O-N 3.44Å; R271-F439 VanDerWaalsContact CZ-CD2 3.44Å; R271-F439 VanDerWaalsContact NH1-CD2 3.34Å; R271-F439 VanDerWaalsContact NH1-CE2 3.25Å
272	R	63.3	Low	70.9	Confident	170 Å²	170	93.4 Å²	93.4	64%	0.642	42%	0.42	S	S	*	.	H	α-helix	trans	-64.8	-30.1	175.8	-69.8	174.7	176.1	175.7	-2	112.3	R268 N269 H270	R268-R272 WeakPolarHBondContact O-CG 3.22Å; N269-R272 WeakPolarHBondContact O-CB 3.36Å; N269-R272 PolarHBondContact O-N 2.87Å; N269-R272 VanDerWaalsContact O-N 3.12Å; H270-R272 PolarHBondContact O-N 3.48Å
273	D	59.9	Low	71.2	Confident	102 Å²	102	87.8 Å²	87.8	55%	0.545	39%	0.394	S	S	.	.	H	α-helix	trans	-77.8	-34	175.9	-67.3	-18.7	0	0	0	111.8	N269 H270 R271 E275 K276	N269-D273 PolarHBondContact O-N 3.15Å; H270-D273 WeakPolarHBondContact O-CB 3.49Å; H270-D273 PolarHBondContact O-N 3.22Å; H270-D273 VanDerWaalsContact O-N 3.08Å; R271-D273 PolarHBondContact O-N 3.28Å; D273-E275 PolarHBondContact O-N 3.29Å; D273-K276 PolarHBondContact O-N 3.41Å
274	M	59.1	Low	72	Confident	51 Å²	51	85.5 Å²	85.5	25%	0.251	39%	0.385	S	S	.	.	H	α-helix	trans	-62.3	-39.4	177.8	-66.1	-59	95	0	0	112.8	H270 R271 K276 H278	H270-M274 WeakPolarHBondContact CE1-CE 3.42Å; H270-M274 WeakPolarHBondContact O-CG 3.36Å; H270-M274 PolarHBondContact O-N 2.9Å; R271-M274 PolarHBondContact O-N 3.39Å; M274-K276 PolarHBondContact O-N 3.45Å; M274-H278 HydrophobicContact CB-CB 4.27Å; M274-H278 HydrophobicContact CE-CB 4.44Å; M274-H278 VanDerWaalsContact CE-CE1 3.46Å; M274-H278 WeakPolarHBondContact CE-CE1 3.5Å; M274-H278 VanDerWaalsContact CE-ND1 3.33Å; M274-H278 WeakPolarHBondContact CE-ND1 3.39Å; M274-H278 WeakPolarHBondContact O-CB 3.44Å; M274-H278 PolarHBondContact O-N 3.44Å; M274-H278 HydrophobicContact SD-CB 3.72Å; M274-H278 PolarHBondContact SD-CD2 3.45Å
275	E	57.6	Low	72.7	Confident	152 Å²	152	81 Å²	81	71%	0.71	36%	0.362	S	S	*	.	H	α-helix	trans	-57.6	-21.9	-178.8	-74.2	175.9	-178.4	0	0	113.5	R271 D273	R271-E275 PolarHBondContact O-N 3.44Å; D273-E275 PolarHBondContact O-N 3.29Å
276	K	53.7	Low	73.2	Confident	155 Å²	155	75.9 Å²	75.9	67%	0.674	34%	0.338	S	S	*	.	H	α-helix	trans	-90.3	-35.9	-172.7	-70.5	179.4	-179.4	172.6	0	114.4	D273 M274	D273-K276 PolarHBondContact O-N 3.41Å; M274-K276 PolarHBondContact O-N 3.45Å
277	H	49	Very low	73.7	Confident	183 Å²	183	70.4 Å²	70.4	85%	0.847	31%	0.313	S	S	*	.	H	α-helix	trans	-155.9	20.2	-168.1	-75.4	-61.5	0	0	0	117
278	H	63.7	Low	74.1	Confident	90 Å²	90	68.1 Å²	68.1	42%	0.417	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-97	154.9	-166.4	-130.2	70.8	0	0	0	117.6	M274 L363	M274-H278 HydrophobicContact CB-CB 4.27Å; M274-H278 HydrophobicContact CE-CB 4.44Å; M274-H278 VanDerWaalsContact CE-CE1 3.46Å; M274-H278 WeakPolarHBondContact CE-CE1 3.5Å; M274-H278 VanDerWaalsContact CE-ND1 3.33Å; M274-H278 WeakPolarHBondContact CE-ND1 3.39Å; M274-H278 WeakPolarHBondContact O-CB 3.44Å; M274-H278 PolarHBondContact O-N 3.44Å; M274-H278 HydrophobicContact SD-CB 3.72Å; M274-H278 PolarHBondContact SD-CD2 3.45Å; H278-L363 WeakPolarHBondContact NE2-CD1 3.34Å
279	L	80.2	Confident	74.7	Confident	42 Å²	42	61.9 Å²	61.9	22%	0.22	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-67.1	140.1	165.9	-62.8	178.1	0	0	0	109.4	L281 Q361 L363	L279-L281 PolarHBondContact O-N 3.5Å; L279-Q361 HydrophobicContact CD2-CB 3.49Å; L279-Q361 VanDerWaalsContact CD2-CB 3.49Å; L279-L363 HydrophobicContact CB-CG 4.2Å; L279-L363 HydrophobicContact CD1-CD2 4.34Å; L279-L363 HydrophobicContact CD1-CG 4.21Å
280	P	87.6	Confident	75.5	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.013	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-47.4	133.4	170.3	-21.4	19.9	0	0	0	112.3	I360 Q361 M362 L363 D393 I486 L490 W492	P280-I360 HydrophobicContact CG-CG2 4.08Å; P280-Q361 VanDerWaalsContact CD-O 3.31Å; P280-Q361 WeakPolarHBondContact CD-O 3.26Å; P280-M362 HydrophobicContact CB-CB 4.2Å; P280-M362 CarbonylContact O-C 3.55Å; P280-M362 VanDerWaalsContact O-CA 3.31Å; P280-M362 WeakPolarHBondContact O-CA 3.49Å; P280-M362 WeakPolarHBondContact O-CB 3.43Å; P280-L363 PolarHBondContact O-N 3.4Å; P280-D393 VanDerWaalsContact CA-OD2 3.29Å; P280-D393 WeakPolarHBondContact CA-OD2 3.46Å; P280-I486 HydrophobicContact CB-CD1 4.29Å; P280-I486 HydrophobicContact CB-CG2 3.71Å; P280-I486 HydrophobicContact CG-CG2 3.72Å; P280-L490 HydrophobicContact CB-CD1 3.95Å; P280-L490 HydrophobicContact CG-CD1 3.65Å; P280-W492 HydrophobicContact CG-CH2 3.58Å; P280-W492 HydrophobicContact CG-CZ2 4.16Å; P280-W492 HydrophobicContact CG-CZ3 4.19Å
281	L	87.8	Confident	76.5	Confident	29 Å²	29	54.4 Å²	54.4	15%	0.152	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	122.9	177.5	-176.5	64.9	0	0	0	110.1	L279 L363 L365 A392 D393 L394	L279-L281 PolarHBondContact O-N 3.5Å; L281-L363 WeakPolarHBondContact CA-O 3.47Å; L281-L363 HydrophobicContact CD1-CB 3.77Å; L281-L365 HydrophobicContact CD1-CB 4.01Å; L281-L365 HydrophobicContact CD1-CD1 4.32Å; L281-L365 HydrophobicContact CD2-CD1 4.29Å; L281-A392 HydrophobicContact CD2-CB 4.47Å; L281-A392 HydrophobicContact CG-CB 4.29Å; L281-D393 PolarHBondContact N-OD2 2.55Å; L281-D393 PolarHBondContact O-N 2.98Å; L281-L394 PolarHBondContact O-N 2.73Å
282	V	92	Very high	77.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	112.8	-178.2	-179.9	0	0	0	0	109	M362 L363 L364 L365 L394 L396 I486	V282-M362 HydrophobicContact CG2-CE 4.42Å; V282-M362 HydrophobicContact CG2-SD 3.92Å; V282-L363 PolarHBondContact N-O 2.91Å; V282-L364 HydrophobicContact CB-CD2 4.03Å; V282-L364 HydrophobicContact CG1-CD2 4.16Å; V282-L364 CarbonylContact O-C 3.53Å; V282-L364 VanDerWaalsContact O-CA 3.28Å; V282-L364 WeakPolarHBondContact O-CA 3.37Å; V282-L365 PolarHBondContact O-N 3.42Å; V282-L394 CarbonylContact C-O 3.59Å; V282-L394 VanDerWaalsContact CA-O 3.3Å; V282-L394 WeakPolarHBondContact CA-O 3.34Å; V282-L394 HydrophobicContact CG1-CB 4.28Å; V282-L394 HydrophobicContact CG1-CD2 4.23Å; V282-L394 HydrophobicContact CG1-CG 4.41Å; V282-L394 HydrophobicContact CG2-CB 4.23Å; V282-L394 HydrophobicContact CG2-CD2 4.48Å; V282-L396 HydrophobicContact CG1-CD1 3.72Å; V282-L396 HydrophobicContact CG1-CD2 4.11Å; V282-L396 HydrophobicContact CG1-CG 3.56Å; V282-I486 HydrophobicContact CG2-CD1 3.66Å; V282-I486 HydrophobicContact CG2-CG1 4.3Å
283	A	91.9	Very high	78.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	140.1	178.1	0	0	0	0	0	111.8	L365 C389 A392 L394 I395 L396	A283-L365 HydrophobicContact CB-CB 4.22Å; A283-L365 HydrophobicContact CB-CD2 4.14Å; A283-C389 HydrophobicContact CB-CB 4.06Å; A283-A392 HydrophobicContact CB-CB 3.9Å; A283-L394 PolarHBondContact N-O 3.38Å; A283-I395 HydrophobicContact CB-CG1 4.32Å; A283-I395 CarbonylContact O-C 3.42Å; A283-I395 WeakPolarHBondContact O-CA 3.43Å; A283-L396 PolarHBondContact O-N 3.15Å
284	V	92.8	Very high	80.2	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	114.8	178.1	-173.4	0	0	0	0	108.7	K292 L295 I296 L365 T367 L396 I398	V284-K292 HydrophobicContact CG1-CB 3.94Å; V284-K292 HydrophobicContact CG1-CD 4.23Å; V284-K292 HydrophobicContact CG1-CG 3.9Å; V284-L295 HydrophobicContact CG1-CD2 4.4Å; V284-I296 HydrophobicContact CB-CD1 4.11Å; V284-I296 HydrophobicContact CB-CG1 4.37Å; V284-I296 HydrophobicContact CG1-CD1 4.47Å; V284-I296 HydrophobicContact CG2-CD1 4.09Å; V284-I296 HydrophobicContact CG2-CG1 3.93Å; V284-L365 PolarHBondContact N-O 2.93Å; V284-T367 PolarHBondContact O-N 2.85Å; V284-T367 PolarHBondContact O-OG1 3.42Å; V284-L396 WeakPolarHBondContact CA-O 3.43Å; V284-L396 HydrophobicContact CG2-CB 4.43Å; V284-L396 HydrophobicContact CG2-CD1 4.34Å; V284-I398 HydrophobicContact CG1-CD1 4.27Å; V284-I398 HydrophobicContact CG1-CG1 3.61Å
285	V	90.9	Very high	81.7	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	155.8	-177	-58.8	0	0	0	0	111.1	T367 L386 I395 L396 H397 I398 V413 L417	V285-T367 HydrophobicContact CG1-CG2 3.86Å; V285-L386 HydrophobicContact CG1-CD2 4.03Å; V285-I395 HydrophobicContact CB-CG2 4.48Å; V285-I395 HydrophobicContact CG1-CG2 4.15Å; V285-I395 HydrophobicContact CG2-CG2 3.52Å; V285-L396 PolarHBondContact N-O 3.43Å; V285-H397 HydrophobicContact CG2-CB 4.03Å; V285-H397 CarbonylContact O-C 3.55Å; V285-H397 WeakPolarHBondContact O-CA 3.28Å; V285-I398 PolarHBondContact O-N 2.96Å; V285-V413 HydrophobicContact CG2-CG1 4.44Å; V285-L417 HydrophobicContact CG2-CD1 4.42Å
286	G	89.5	Confident	83.3	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.3	170.4	-179	0	0	0	0	0	113.1	K292 G369 F370 I398	G286-K292 PolarHBondContact O-NZ 3.36Å; G286-G369 WeakPolarHBondContact O-CA 3.28Å; G286-F370 WeakPolarHBondContact O-CD2 3.47Å; G286-F370 PolarHBondContact O-N 2.88Å; G286-I398 WeakPolarHBondContact CA-O 3.4Å
287	Y	86.2	Confident	84.8	Confident	12 Å²	12	26.8 Å²	26.8	5%	0.047	13%	0.134	C	C	.	.	B	Isolated β-bridge	trans	-62.2	161.1	-179.7	-89.2	-105	0	0	0	112.6	A290 K292 F370 Q409 H412 V413	Y287-A290 WeakPolarHBondContact O-CB 3.5Å; Y287-A290 PolarHBondContact O-N 2.8Å; Y287-K292 PolarHBondContact O-NZ 3Å; Y287-F370 CarbonylContact C-O 3.56Å; Y287-F370 VanDerWaalsContact CA-O 3.25Å; Y287-F370 WeakPolarHBondContact CA-O 3.13Å; Y287-F370 HydrophobicContact CD1-CB 4.02Å; Y287-F370 VanDerWaalsContact CD1-O 3.23Å; Y287-F370 WeakPolarHBondContact CD1-O 3.32Å; Y287-F370 HydrophobicContact CD2-CB 3.98Å; Y287-F370 HydrophobicContact CE1-CB 4.17Å; Y287-F370 HydrophobicContact CE2-CB 4.12Å; Y287-F370 HydrophobicContact CG-CB 3.94Å; Y287-Q409 HydrophobicContact CD1-CG 4.38Å; Y287-Q409 HydrophobicContact CD2-CB 3.63Å; Y287-Q409 HydrophobicContact CD2-CG 3.98Å; Y287-Q409 HydrophobicContact CE1-CG 4.14Å; Y287-Q409 HydrophobicContact CE2-CB 3.4Å; Y287-Q409 VanDerWaalsContact CE2-CB 3.4Å; Y287-Q409 HydrophobicContact CE2-CG 3.74Å; Y287-Q409 WeakPolarHBondContact CE2-O 3.35Å; Y287-Q409 HydrophobicContact CG-CB 4.38Å; Y287-Q409 HydrophobicContact CG-CG 4.29Å; Y287-H412 AromaticContact CZ-ND1 3.82Å; Y287-H412 PolarHBondContact OH-ND1 3.08Å; Y287-V413 HydrophobicContact CD2-CG2 3.9Å; Y287-V413 HydrophobicContact CE2-CG2 3.77Å
288	T	79.4	Confident	86.6	Confident	12 Å²	12	23.1 Å²	23.1	7%	0.074	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	146.9	166.7	52.2	0	0	0	0	108.8	E77 A290 V311 F312 F370 M371	E77-T288 WeakPolarHBondContact CG-OG1 3.3Å; E77-T288 PolarHBondContact OE1-OG1 2.82Å; T288-A290 PolarHBondContact O-N 3.49Å; T288-V311 HydrophobicContact CG2-CG1 3.5Å; T288-V311 VanDerWaalsContact CG2-CG1 3.5Å; T288-F312 HydrophobicContact CG2-CE1 4.32Å; T288-F312 HydrophobicContact CG2-CZ 4.44Å; T288-F370 WeakPolarHBondContact CG2-O 3.49Å; T288-F370 PolarHBondContact N-O 3.14Å; T288-F370 PolarHBondContact OG1-O 3.31Å; T288-M371 HydrophobicContact CG2-CG 3.34Å; T288-M371 HydrophobicContact CG2-SD 4.06Å; T288-M371 WeakPolarHBondContact OG1-CG 3.45Å
289	N	83.2	Confident	87.7	Confident	38 Å²	38	19.3 Å²	19.3	20%	0.203	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	2.3	-171.6	-167.2	27.6	0	0	0	115	D76 G291 K450	D76-N289 WeakPolarHBondContact CB-ND2 3.48Å; N289-G291 PolarHBondContact O-N 2.99Å; N289-G291 VanDerWaalsContact O-N 3.11Å; N289-K450 VanDerWaalsContact CG-NZ 3.25Å; N289-K450 PolarHBondContact ND2-NZ 2.87Å; N289-K450 WeakPolarHBondContact O-CE 3.49Å; N289-K450 PolarHBondContact O-NZ 2.95Å; N289-K450 PolarHBondContact OD1-NZ 3.31Å
290	A	88.4	Confident	87.9	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.008	9%	0.094	C	C	.	.	S	Bend	trans	-66.4	-13.1	173.6	0	0	0	0	0	113.3	Y287 T288 I398 N449	Y287-A290 WeakPolarHBondContact O-CB 3.5Å; Y287-A290 PolarHBondContact O-N 2.8Å; T288-A290 PolarHBondContact O-N 3.49Å; A290-I398 HydrophobicContact CB-CG2 4.16Å; A290-I398 WeakPolarHBondContact O-CG2 3.4Å; A290-N449 PolarHBondContact O-ND2 3.46Å
291	G	88.8	Confident	87.4	Confident	12 Å²	12	24.4 Å²	24.4	12%	0.124	12%	0.119	C	C	.	.	S	Bend	trans	95	23.1	177.8	0	0	0	0	0	115	N289 S294 L295	N289-G291 PolarHBondContact O-N 2.99Å; N289-G291 VanDerWaalsContact O-N 3.11Å; G291-S294 PolarHBondContact O-N 2.91Å; G291-L295 WeakPolarHBondContact O-CB 3.18Å; G291-L295 PolarHBondContact O-N 3.24Å
292	K	89.8	Confident	86.2	Confident	13 Å²	13	24.5 Å²	24.5	6%	0.057	12%	0.122	C	C	.	.	H	α-helix	trans	-53.2	-54.7	174.5	-64.4	-168.8	-62.9	-67.2	0	112.4	V284 G286 Y287 S294 L295 I296 T367 I398	V284-K292 HydrophobicContact CG1-CB 3.94Å; V284-K292 HydrophobicContact CG1-CD 4.23Å; V284-K292 HydrophobicContact CG1-CG 3.9Å; G286-K292 PolarHBondContact O-NZ 3.36Å; Y287-K292 PolarHBondContact O-NZ 3Å; K292-S294 VanDerWaalsContact C-N 3.33Å; K292-S294 PolarHBondContact O-N 2.99Å; K292-L295 WeakPolarHBondContact O-CB 3.42Å; K292-L295 PolarHBondContact O-N 3.25Å; K292-I296 VanDerWaalsContact O-CG1 3.32Å; K292-I296 WeakPolarHBondContact O-CG1 3.48Å; K292-I296 PolarHBondContact O-N 3.15Å; K292-T367 WeakPolarHBondContact CE-O 3.33Å; K292-I398 HydrophobicContact CG-CB 4.26Å; K292-I398 HydrophobicContact CG-CG1 4.18Å
293	T	85	Confident	84.5	Confident	27 Å²	27	31.1 Å²	31.1	17%	0.166	16%	0.158	C	C	.	.	H	α-helix	trans	-63.3	-38.6	-179.3	-47.5	0	0	0	0	111.9	I296 R297 L305	T293-I296 PolarHBondContact O-N 2.78Å; T293-R297 WeakPolarHBondContact O-CB 3.18Å; T293-R297 PolarHBondContact O-N 3.19Å; T293-L305 HydrophobicContact CG2-CD2 4.38Å
294	S	87.6	Confident	82.7	Confident	31 Å²	31	40.8 Å²	40.8	22%	0.217	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-43.7	174.2	-54.6	0	0	0	0	112	G291 K292 R297 Y298 S307	G291-S294 PolarHBondContact O-N 2.91Å; K292-S294 VanDerWaalsContact C-N 3.33Å; K292-S294 PolarHBondContact O-N 2.99Å; S294-R297 PolarHBondContact O-N 2.85Å; S294-Y298 PolarHBondContact O-N 2.91Å; S294-S307 PolarHBondContact OG-OG 3.47Å
295	L	91.3	Very high	80.9	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.7	-46.5	175	175.7	64.6	0	0	0	111.6	V284 G291 K292 R297 Y298 L299 L396 I398 I467 A469 M475 L478	V284-L295 HydrophobicContact CG1-CD2 4.4Å; G291-L295 WeakPolarHBondContact O-CB 3.18Å; G291-L295 PolarHBondContact O-N 3.24Å; K292-L295 WeakPolarHBondContact O-CB 3.42Å; K292-L295 PolarHBondContact O-N 3.25Å; L295-R297 VanDerWaalsContact C-N 3.29Å; L295-R297 PolarHBondContact O-N 3.1Å; L295-Y298 PolarHBondContact O-N 2.88Å; L295-L299 HydrophobicContact CD1-CD1 3.94Å; L295-L299 HydrophobicContact CD1-CG 4.05Å; L295-L299 HydrophobicContact CG-CD1 3.99Å; L295-L299 HydrophobicContact CG-CG 4.43Å; L295-L299 WeakPolarHBondContact O-CG 3.33Å; L295-L299 PolarHBondContact O-N 3.27Å; L295-L396 HydrophobicContact CD2-CD1 4.38Å; L295-I398 HydrophobicContact CD2-CD1 3.3Å; L295-I398 HydrophobicContact CD2-CG1 3.98Å; L295-I467 HydrophobicContact CD1-CD1 3.93Å; L295-A469 HydrophobicContact CB-CB 4.33Å; L295-M475 HydrophobicContact CD1-CE 3.41Å; L295-M475 VanDerWaalsContact CD1-CE 3.41Å; L295-M475 HydrophobicContact CD1-SD 4.1Å; L295-L478 HydrophobicContact CD1-CD2 3.7Å
296	I	89.7	Confident	79	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-41.1	178.8	-69.6	172.8	0	0	0	110.5	V284 K292 T293 L299 S300 L305 H320 L364 D366	V284-I296 HydrophobicContact CB-CD1 4.11Å; V284-I296 HydrophobicContact CB-CG1 4.37Å; V284-I296 HydrophobicContact CG1-CD1 4.47Å; V284-I296 HydrophobicContact CG2-CD1 4.09Å; V284-I296 HydrophobicContact CG2-CG1 3.93Å; K292-I296 VanDerWaalsContact O-CG1 3.32Å; K292-I296 WeakPolarHBondContact O-CG1 3.48Å; K292-I296 PolarHBondContact O-N 3.15Å; T293-I296 PolarHBondContact O-N 2.78Å; I296-L299 PolarHBondContact O-N 2.76Å; I296-S300 WeakPolarHBondContact O-CB 3.49Å; I296-S300 PolarHBondContact O-N 3.21Å; I296-L305 HydrophobicContact CG2-CD1 3.85Å; I296-H320 HydrophobicContact CG2-CB 3.84Å; I296-H320 VanDerWaalsContact CG2-CD2 3.47Å; I296-H320 WeakPolarHBondContact CG2-CD2 3.31Å; I296-L364 HydrophobicContact CG1-CD1 4.45Å; I296-L364 HydrophobicContact CG2-CD1 4.22Å; I296-D366 HydrophobicContact CD1-CB 3.39Å; I296-D366 VanDerWaalsContact CD1-OD1 3.28Å; I296-D366 WeakPolarHBondContact CD1-OD1 3.33Å
297	R	86	Confident	77.2	Confident	70 Å²	70	49 Å²	49	26%	0.264	25%	0.251	S	S	.	.	H	α-helix	trans	-60.7	-48.1	175.5	-168.8	-177.3	-173.1	157.3	-3	111.3	T293 S294 L295 L299 S300 K301 S302 D303 L305	T293-R297 WeakPolarHBondContact O-CB 3.18Å; T293-R297 PolarHBondContact O-N 3.19Å; S294-R297 PolarHBondContact O-N 2.85Å; L295-R297 VanDerWaalsContact C-N 3.29Å; L295-R297 PolarHBondContact O-N 3.1Å; R297-L299 PolarHBondContact O-N 3.29Å; R297-S300 PolarHBondContact O-N 3.02Å; R297-K301 WeakPolarHBondContact O-CA 3.43Å; R297-K301 PolarHBondContact O-N 2.95Å; R297-S302 WeakPolarHBondContact CG-O 3.45Å; R297-D303 PolarHBondContact NH2-O 2.78Å; R297-D303 VanDerWaalsContact NH2-O 3.08Å; R297-D303 IonicContact NH2-OD1 3.12Å; R297-L305 HydrophobicContact CB-CB 4.32Å; R297-L305 HydrophobicContact CB-CD1 4.28Å; R297-L305 WeakPolarHBondContact CD-O 3.34Å; R297-L305 HydrophobicContact CG-CB 4.17Å; R297-L305 PolarHBondContact NE-O 3.22Å; R297-L305 VanDerWaalsContact NE-O 3.14Å; R297-L305 PolarHBondContact NH1-O 3.47Å
298	Y	86.9	Confident	75.6	Confident	106 Å²	106	50.6 Å²	50.6	42%	0.416	26%	0.264	S	S	.	.	H	α-helix	trans	-58.2	-48.8	178	-172.9	-78.6	0	0	0	111.4	S294 L295 M475	S294-Y298 PolarHBondContact O-N 2.91Å; L295-Y298 PolarHBondContact O-N 2.88Å; Y298-M475 HydrophobicContact CD1-CB 4.4Å; Y298-M475 HydrophobicContact CD1-CE 3.11Å; Y298-M475 HydrophobicContact CD1-CG 4.09Å; Y298-M475 HydrophobicContact CD1-SD 4.32Å; Y298-M475 HydrophobicContact CD2-CG 4.42Å; Y298-M475 HydrophobicContact CE1-CB 3.57Å; Y298-M475 HydrophobicContact CE1-CE 3.49Å; Y298-M475 VanDerWaalsContact CE1-CE 3.49Å; Y298-M475 HydrophobicContact CE1-CG 3.64Å; Y298-M475 HydrophobicContact CE1-SD 4.39Å; Y298-M475 HydrophobicContact CE2-CG 4.02Å; Y298-M475 HydrophobicContact CG-CE 3.73Å; Y298-M475 HydrophobicContact CG-CG 4.45Å
299	L	87.2	Confident	74.4	Confident	11 Å²	11	53.6 Å²	53.6	6%	0.058	28%	0.284	C	S	.	.	H	α-helix	trans	-70.2	-40.6	-178.3	-67.8	178	0	0	0	112.6	L295 I296 R297 K301 S322 L324 L364 M475	L295-L299 HydrophobicContact CD1-CD1 3.94Å; L295-L299 HydrophobicContact CD1-CG 4.05Å; L295-L299 HydrophobicContact CG-CD1 3.99Å; L295-L299 HydrophobicContact CG-CG 4.43Å; L295-L299 WeakPolarHBondContact O-CG 3.33Å; L295-L299 PolarHBondContact O-N 3.27Å; I296-L299 PolarHBondContact O-N 2.76Å; R297-L299 PolarHBondContact O-N 3.29Å; L299-K301 VanDerWaalsContact C-N 3.3Å; L299-K301 PolarHBondContact O-N 3Å; L299-S322 PolarHBondContact O-OG 3.26Å; L299-L324 HydrophobicContact CD2-CD2 3.86Å; L299-L364 HydrophobicContact CB-CD1 3.66Å; L299-L364 HydrophobicContact CD1-CD1 4.13Å; L299-L364 HydrophobicContact CD1-CD2 4.17Å; L299-M475 HydrophobicContact CD2-CE 3.98Å; L299-M475 HydrophobicContact CG-CE 4.33Å
300	S	84.2	Confident	73.3	Confident	26 Å²	26	54.8 Å²	54.8	18%	0.182	29%	0.288	C	S	.	.	H	α-helix	trans	-74.6	-19.2	180	-177.3	0	0	0	0	112.9	I296 R297 S302 R321	I296-S300 WeakPolarHBondContact O-CB 3.49Å; I296-S300 PolarHBondContact O-N 3.21Å; R297-S300 PolarHBondContact O-N 3.02Å; S300-S302 WeakPolarHBondContact CB-OG 3.29Å; S300-S302 PolarHBondContact O-N 2.74Å; S300-S302 VanDerWaalsContact O-N 3.13Å; S300-S302 PolarHBondContact OG-OG 2.95Å; S300-R321 PolarHBondContact OG-O 3.06Å
301	K	76	Confident	71.8	Confident	125 Å²	125	54.9 Å²	54.9	54%	0.543	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	28.1	-170.8	-57.3	-173.2	178.5	-171.1	0	113.2	R297 L299	R297-K301 WeakPolarHBondContact O-CA 3.43Å; R297-K301 PolarHBondContact O-N 2.95Å; L299-K301 VanDerWaalsContact C-N 3.3Å; L299-K301 PolarHBondContact O-N 3Å
302	S	64.3	Low	70.3	Confident	30 Å²	30	54.8 Å²	54.8	21%	0.21	29%	0.285	C	S	.	.			trans	-94.8	124.2	-178	52.1	0	0	0	0	110.7	R297 S300 K304	R297-S302 WeakPolarHBondContact CG-O 3.45Å; S300-S302 WeakPolarHBondContact CB-OG 3.29Å; S300-S302 PolarHBondContact O-N 2.74Å; S300-S302 VanDerWaalsContact O-N 3.13Å; S300-S302 PolarHBondContact OG-OG 2.95Å; S302-K304 PolarHBondContact O-N 3.42Å
303	D	55.5	Low	68.5	Low	139 Å²	139	56 Å²	56	74%	0.743	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-13.5	176.7	-68.5	-37.6	0	0	0	113.5	R297 L305	R297-D303 PolarHBondContact NH2-O 2.78Å; R297-D303 VanDerWaalsContact NH2-O 3.08Å; R297-D303 IonicContact NH2-OD1 3.12Å; D303-L305 VanDerWaalsContact C-N 3.32Å; D303-L305 PolarHBondContact O-N 3.2Å
304	K	55	Low	66.9	Low	203 Å²	203	55.8 Å²	55.8	88%	0.883	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-22.2	-175.2	-68.3	-173.6	179.1	-177.8	0	114.4	S302 T306	S302-K304 PolarHBondContact O-N 3.42Å; K304-T306 PolarHBondContact O-N 2.87Å
305	L	54	Low	65.2	Low	26 Å²	26	54.5 Å²	54.5	14%	0.136	29%	0.287	C	S	.	.	S	Bend	trans	-86.5	99.6	-179.7	-77.4	171	0	0	0	109.4	T293 I296 R297 D303 S307	T293-L305 HydrophobicContact CG2-CD2 4.38Å; I296-L305 HydrophobicContact CG2-CD1 3.85Å; R297-L305 HydrophobicContact CB-CB 4.32Å; R297-L305 HydrophobicContact CB-CD1 4.28Å; R297-L305 WeakPolarHBondContact CD-O 3.34Å; R297-L305 HydrophobicContact CG-CB 4.17Å; R297-L305 PolarHBondContact NE-O 3.22Å; R297-L305 VanDerWaalsContact NE-O 3.14Å; R297-L305 PolarHBondContact NH1-O 3.47Å; D303-L305 VanDerWaalsContact C-N 3.32Å; D303-L305 PolarHBondContact O-N 3.2Å; L305-S307 PolarHBondContact O-N 2.87Å; L305-S307 VanDerWaalsContact O-N 3.13Å
306	T	52.1	Low	63.9	Low	91 Å²	91	55.5 Å²	55.5	56%	0.558	29%	0.292	S	S	*	.			trans	-54.7	120.2	171.2	39.8	0	0	0	0	109.8	K304 S308	K304-T306 PolarHBondContact O-N 2.87Å; T306-S308 PolarHBondContact O-N 3.43Å
307	S	49.8	Very low	62.8	Low	55 Å²	55	56.7 Å²	56.7	39%	0.385	30%	0.299	S	S	.	.			trans	-85.9	27.5	176	-174.2	0	0	0	0	110.8	S294 L305	S294-S307 PolarHBondContact OG-OG 3.47Å; L305-S307 PolarHBondContact O-N 2.87Å; L305-S307 VanDerWaalsContact O-N 3.13Å
308	S	53.4	Low	62.3	Low	47 Å²	47	55 Å²	55	33%	0.329	30%	0.296	S	S	.	.	S	Bend	trans	-56.5	149.3	166.6	38.5	0	0	0	0	108.3	T306 E310	T306-S308 PolarHBondContact O-N 3.43Å; S308-E310 PolarHBondContact O-N 3.49Å; S308-E310 VanDerWaalsContact OG-CD 3.28Å; S308-E310 WeakPolarHBondContact OG-CG 3.42Å; S308-E310 PolarHBondContact OG-OE1 3.11Å
309	P	53.8	Low	61.9	Low	75 Å²	75	55.1 Å²	55.1	49%	0.487	30%	0.3	S	S	.	.			trans	-69	41.8	177	31.3	-36.4	0	0	0	111.8	A80 V311	A80-P309 VanDerWaalsContact CA-O 3.25Å; A80-P309 WeakPolarHBondContact CA-O 3.46Å; A80-P309 HydrophobicContact CB-CB 4.43Å; A80-P309 WeakPolarHBondContact CB-O 3.5Å; P309-V311 PolarHBondContact O-N 3.45Å
310	E	60.2	Low	61.7	Low	62 Å²	62	56 Å²	56	29%	0.29	30%	0.304	S	S	.	.			trans	-77.5	108.9	-178.5	-72.2	-179.4	-138.2	0	0	110.8	S84 R194 S308 A313	S84-E310 WeakPolarHBondContact OG-CA 3.23Å; S84-E310 VanDerWaalsContact OG-CB 3.28Å; S84-E310 WeakPolarHBondContact OG-CB 3.5Å; R194-E310 IonicContact CZ-OE2 2.82Å; R194-E310 IonicContact NH1-OE2 3.77Å; R194-E310 IonicContact NH2-OE2 2.72Å; R194-E310 PolarHBondContact NH2-OE2 2.92Å; S308-E310 PolarHBondContact O-N 3.49Å; S308-E310 VanDerWaalsContact OG-CD 3.28Å; S308-E310 WeakPolarHBondContact OG-CG 3.42Å; S308-E310 PolarHBondContact OG-OE1 3.11Å; E310-A313 HydrophobicContact CB-CB 4.37Å; E310-A313 PolarHBondContact O-N 3.01Å
311	V	57.1	Low	61.6	Low	4 Å²	4	63.8 Å²	63.8	2%	0.024	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	132.1	165.7	179.4	0	0	0	0	110.2	A80 L81 S84 R194 T288 P309 M371	A80-V311 HydrophobicContact CB-CG2 3.34Å; A80-V311 WeakPolarHBondContact O-CG2 3.33Å; A80-V311 PolarHBondContact O-N 3.17Å; L81-V311 HydrophobicContact CB-CB 4.37Å; L81-V311 HydrophobicContact CB-CG2 4.27Å; S84-V311 WeakPolarHBondContact CB-O 3.45Å; S84-V311 WeakPolarHBondContact OG-CA 3.31Å; S84-V311 PolarHBondContact OG-N 3.03Å; S84-V311 PolarHBondContact OG-O 3.24Å; R194-V311 PolarHBondContact NH1-O 2.59Å; T288-V311 HydrophobicContact CG2-CG1 3.5Å; T288-V311 VanDerWaalsContact CG2-CG1 3.5Å; P309-V311 PolarHBondContact O-N 3.45Å; V311-M371 HydrophobicContact CG1-CG 4.4Å; V311-M371 HydrophobicContact CG1-SD 3.49Å; V311-M371 WeakPolarHBondContact CG1-SD 3.25Å
312	F	56.6	Low	62.1	Low	9 Å²	9	58.2 Å²	58.2	4%	0.039	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	30.3	-177.3	-52.1	-69.4	0	0	0	114.8	V187 L190 F191 R194 T288 T314 L315 I368 M371	V187-F312 HydrophobicContact CG1-CZ 4.49Å; L190-F312 HydrophobicContact CD2-CD2 3.47Å; L190-F312 VanDerWaalsContact CD2-CD2 3.47Å; L190-F312 HydrophobicContact CD2-CE2 4.13Å; L190-F312 HydrophobicContact CD2-CG 4.48Å; L190-F312 HydrophobicContact CG-CB 4.46Å; L190-F312 HydrophobicContact CG-CD2 3.87Å; F191-F312 HydrophobicContact CD2-CE1 4.28Å; F191-F312 HydrophobicContact CD2-CE2 4.35Å; F191-F312 HydrophobicContact CD2-CZ 4.13Å; F191-F312 AromaticContact CE2-CD1 3.87Å; F191-F312 HydrophobicContact CE2-CD1 3.87Å; F191-F312 HydrophobicContact CE2-CD2 4.47Å; F191-F312 AromaticContact CE2-CE1 3.27Å; F191-F312 HydrophobicContact CE2-CE1 3.27Å; F191-F312 AromaticContact CE2-CE2 3.96Å; F191-F312 HydrophobicContact CE2-CE2 3.96Å; F191-F312 HydrophobicContact CE2-CG 4.43Å; F191-F312 AromaticContact CE2-CZ 3.32Å; F191-F312 HydrophobicContact CE2-CZ 3.32Å; F191-F312 HydrophobicContact CZ-CD1 4.01Å; F191-F312 AromaticContact CZ-CE1 3.54Å; F191-F312 HydrophobicContact CZ-CE1 3.54Å; F191-F312 HydrophobicContact CZ-CZ 4.07Å; R194-F312 WeakPolarHBondContact CD-O 3.29Å; R194-F312 PolarHBondContact NH1-O 2.93Å; T288-F312 HydrophobicContact CG2-CE1 4.32Å; T288-F312 HydrophobicContact CG2-CZ 4.44Å; F312-T314 PolarHBondContact O-N 3.43Å; F312-L315 HydrophobicContact CB-CD2 3.67Å; F312-L315 HydrophobicContact CB-CG 4.04Å; F312-L315 HydrophobicContact CD1-CD2 3.44Å; F312-L315 VanDerWaalsContact CD1-CD2 3.44Å; F312-L315 HydrophobicContact CE1-CD2 4.31Å; F312-L315 HydrophobicContact CG-CD2 3.77Å; F312-I368 HydrophobicContact CD1-CG2 3.81Å; F312-I368 HydrophobicContact CE1-CG2 3.91Å; F312-M371 HydrophobicContact CE1-CG 4.25Å; F312-M371 HydrophobicContact CE2-CE 4.03Å; F312-M371 HydrophobicContact CE2-CG 4.17Å; F312-M371 HydrophobicContact CE2-SD 3.4Å; F312-M371 WeakPolarHBondContact CE2-SD 3.45Å; F312-M371 HydrophobicContact CZ-CE 3.98Å; F312-M371 HydrophobicContact CZ-CG 3.54Å; F312-M371 HydrophobicContact CZ-SD 3.4Å; F312-M371 WeakPolarHBondContact CZ-SD 3.42Å
313	A	52.9	Low	63	Low	40 Å²	40	61.5 Å²	61.5	33%	0.331	31%	0.314	S	S	.	.	S	Bend	trans	-46.9	-31.6	176.6	0	0	0	0	0	112.1	E310	E310-A313 HydrophobicContact CB-CB 4.37Å; E310-A313 PolarHBondContact O-N 3.01Å
314	T	51.9	Low	64.3	Low	21 Å²	21	55 Å²	55	13%	0.129	28%	0.279	C	S	.	.			trans	-125.6	119.3	172.4	48.2	0	0	0	0	108.7	F312 T318 D366	F312-T314 PolarHBondContact O-N 3.43Å; T314-T318 HydrophobicContact CG2-CG2 3.76Å; T314-T318 WeakPolarHBondContact CG2-OG1 3.43Å; T314-D366 PolarHBondContact OG1-OD2 2.87Å
315	L	51.7	Low	65.3	Low	4 Å²	4	47.6 Å²	47.6	2%	0.021	25%	0.252	C	S	.	.	S	Bend	trans	-99.7	-26.2	168.5	-80.7	-175.2	0	0	0	113.2	F191 R194 F312 I368	F191-L315 VanDerWaalsContact CA-CD1 3.41Å; F191-L315 HydrophobicContact CB-CD1 4.23Å; F191-L315 HydrophobicContact CD1-CD1 3.84Å; F191-L315 HydrophobicContact CD1-CD2 3.66Å; F191-L315 HydrophobicContact CD1-CG 4.41Å; F191-L315 HydrophobicContact CD2-CD2 4.31Å; F191-L315 HydrophobicContact CE1-CD1 4.44Å; F191-L315 HydrophobicContact CE1-CD2 3.44Å; F191-L315 VanDerWaalsContact CE1-CD2 3.44Å; F191-L315 HydrophobicContact CE2-CD2 4.16Å; F191-L315 HydrophobicContact CG-CD1 4.03Å; F191-L315 HydrophobicContact CG-CD2 4.12Å; F191-L315 HydrophobicContact CZ-CD2 3.72Å; F191-L315 VanDerWaalsContact O-CD1 3.22Å; F191-L315 WeakPolarHBondContact O-CD1 3.47Å; R194-L315 HydrophobicContact CB-CB 4.28Å; R194-L315 HydrophobicContact CB-CD1 3.4Å; R194-L315 VanDerWaalsContact CB-CD1 3.4Å; R194-L315 HydrophobicContact CB-CG 3.78Å; F312-L315 HydrophobicContact CB-CD2 3.67Å; F312-L315 HydrophobicContact CB-CG 4.04Å; F312-L315 HydrophobicContact CD1-CD2 3.44Å; F312-L315 VanDerWaalsContact CD1-CD2 3.44Å; F312-L315 HydrophobicContact CE1-CD2 4.31Å; F312-L315 HydrophobicContact CG-CD2 3.77Å; L315-I368 HydrophobicContact CD2-CG2 4.07Å; L315-I368 WeakPolarHBondContact O-CD1 3.43Å; L315-I368 WeakPolarHBondContact O-CG1 3.27Å
316	D	63.2	Low	65.9	Low	21 Å²	21	47.8 Å²	47.8	11%	0.112	25%	0.253	C	S	.	.	S	Bend	trans	-90	150.9	167.4	-60	-51.7	0	0	0	108	R196 T197 T318	R196-D316 VanDerWaalsContact CA-OD2 3.24Å; R196-D316 WeakPolarHBondContact CA-OD2 3.48Å; R196-D316 WeakPolarHBondContact CB-OD2 3.43Å; R196-D316 VanDerWaalsContact CG-OD2 3.26Å; R196-D316 WeakPolarHBondContact CG-OD2 3.32Å; R196-D316 PolarHBondContact N-OD2 3.26Å; T197-D316 VanDerWaalsContact CB-OD1 3.28Å; T197-D316 WeakPolarHBondContact CB-OD1 3.47Å; T197-D316 HydrophobicContact CG2-CB 4.07Å; T197-D316 VanDerWaalsContact CG2-CG 3.46Å; T197-D316 WeakPolarHBondContact CG2-OD1 3.48Å; T197-D316 PolarHBondContact N-OD1 3.39Å; T197-D316 PolarHBondContact N-OD2 3.21Å; T197-D316 VanDerWaalsContact N-OD2 3.13Å; T197-D316 PolarHBondContact OG1-OD1 3.21Å; D316-T318 PolarHBondContact O-N 2.67Å
317	I	67.5	Low	66.3	Low	26 Å²	26	47.5 Å²	47.5	13%	0.133	25%	0.247	C	C	.	.			trans	-59.6	126.5	170.7	-68.9	165.5	0	0	0	108.1	L365 D366 T385 E388	I317-L365 HydrophobicContact CG1-CD2 4.38Å; I317-L365 HydrophobicContact CG2-CD1 3.78Å; I317-L365 HydrophobicContact CG2-CD2 3.48Å; I317-L365 VanDerWaalsContact CG2-CD2 3.48Å; I317-L365 HydrophobicContact CG2-CG 3.32Å; I317-D366 WeakPolarHBondContact CA-O 3.5Å; I317-T385 HydrophobicContact CD1-CG2 4.12Å; I317-T385 VanDerWaalsContact CD1-O 3.27Å; I317-T385 WeakPolarHBondContact CD1-O 3.47Å; I317-T385 HydrophobicContact CG1-CG2 4.26Å; I317-E388 HydrophobicContact CD1-CB 3.78Å; I317-E388 HydrophobicContact CD1-CG 4.03Å; I317-E388 WeakPolarHBondContact CD1-OE2 3.39Å
318	T	74.2	Confident	66.3	Low	35 Å²	35	49.7 Å²	49.7	22%	0.215	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	140.6	178.5	55.6	0	0	0	0	110.4	T314 D316 H320 L365 D366	T314-T318 HydrophobicContact CG2-CG2 3.76Å; T314-T318 WeakPolarHBondContact CG2-OG1 3.43Å; D316-T318 PolarHBondContact O-N 2.67Å; T318-H320 PolarHBondContact OG1-NE2 3.17Å; T318-H320 VanDerWaalsContact OG1-NE2 3.1Å; T318-L365 WeakPolarHBondContact O-CA 3.43Å; T318-D366 PolarHBondContact N-O 3.4Å; T318-D366 PolarHBondContact O-N 3.45Å; T318-D366 VanDerWaalsContact OG1-CB 3.29Å; T318-D366 WeakPolarHBondContact OG1-CB 3.19Å
319	H	79.6	Confident	65.7	Low	107 Å²	107	53.9 Å²	53.9	50%	0.495	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	121.4	178.7	-56.1	-79.7	0	0	0	109.3	L364	H319-L364 CarbonylContact C-O 3.32Å; H319-L364 WeakPolarHBondContact CA-O 3.48Å
320	H	82.9	Confident	64.7	Low	29 Å²	29	59.9 Å²	59.9	13%	0.134	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	122.9	175.7	-63.2	-82.1	0	0	0	109.6	I296 T318 S322 L364	I296-H320 HydrophobicContact CG2-CB 3.84Å; I296-H320 VanDerWaalsContact CG2-CD2 3.47Å; I296-H320 WeakPolarHBondContact CG2-CD2 3.31Å; T318-H320 PolarHBondContact OG1-NE2 3.17Å; T318-H320 VanDerWaalsContact OG1-NE2 3.1Å; H320-S322 PolarHBondContact O-N 2.85Å; H320-L364 HydrophobicContact CB-CB 4.19Å; H320-L364 PolarHBondContact N-O 3.13Å; H320-L364 PolarHBondContact O-N 3.18Å
321	R	82.4	Confident	63.2	Low	190 Å²	190	62.1 Å²	62.1	72%	0.717	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	132.3	168.4	-73.6	-177.4	179.9	-151.5	0.2	108.8	S300 L363	S300-R321 PolarHBondContact OG-O 3.06Å; R321-L363 HydrophobicContact CG-CD2 3.63Å
322	S	85.7	Confident	61.6	Low	8 Å²	8	71.1 Å²	71.1	6%	0.056	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	155.3	177	172.6	0	0	0	0	109.5	L299 H320 Q361 M362	L299-S322 PolarHBondContact O-OG 3.26Å; H320-S322 PolarHBondContact O-N 2.85Å; S322-Q361 WeakPolarHBondContact O-CA 3.4Å; S322-M362 PolarHBondContact N-O 3.24Å; S322-M362 PolarHBondContact O-N 2.88Å
323	R	84	Confident	60.2	Low	100 Å²	100	78.8 Å²	78.8	38%	0.377	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	109.8	174	-173.7	175.7	-179.4	106.2	-15.5	108.2	P325 L357 G359 I360 Q361	R323-P325 WeakPolarHBondContact O-CD 3.36Å; R323-L357 PolarHBondContact NE-O 3.02Å; R323-L357 PolarHBondContact NH2-O 3.31Å; R323-G359 PolarHBondContact NH1-O 3.38Å; R323-I360 CarbonylContact C-O 3.53Å; R323-I360 WeakPolarHBondContact CA-O 3.4Å; R323-Q361 HydrophobicContact CG-CG 4.42Å
324	L	83.2	Confident	58.8	Low	3 Å²	3	83.3 Å²	83.3	2%	0.016	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	119.2	174	-70.2	-174.3	0	0	0	109.3	L299 G359 I360 M362 T479 V482 R483	L299-L324 HydrophobicContact CD2-CD2 3.86Å; L324-G359 CarbonylContact O-C 3.49Å; L324-G359 WeakPolarHBondContact O-CA 3.22Å; L324-I360 PolarHBondContact N-O 3.09Å; L324-I360 PolarHBondContact O-N 3.34Å; L324-M362 HydrophobicContact CB-CE 4.35Å; L324-M362 HydrophobicContact CD1-CE 3.26Å; L324-M362 HydrophobicContact CD1-SD 4.25Å; L324-M362 HydrophobicContact CD2-CE 4.35Å; L324-M362 HydrophobicContact CD2-SD 4.4Å; L324-M362 HydrophobicContact CG-CE 3.38Å; L324-M362 HydrophobicContact CG-SD 3.97Å; L324-T479 HydrophobicContact CB-CG2 4.09Å; L324-T479 HydrophobicContact CD1-CG2 4.38Å; L324-T479 HydrophobicContact CD2-CG2 3.96Å; L324-T479 HydrophobicContact CG-CG2 4.35Å; L324-V482 HydrophobicContact CD1-CB 4.05Å; L324-V482 HydrophobicContact CD1-CG1 3.65Å; L324-R483 HydrophobicContact CD1-CB 4.41Å
325	P	75.3	Confident	57.4	Low	47 Å²	47	90.8 Å²	90.8	31%	0.305	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	143.6	174.1	28.4	-33.6	0	0	0	109.9	R323 T479	R323-P325 WeakPolarHBondContact O-CD 3.36Å; P325-T479 HydrophobicContact CG-CG2 4.47Å
326	I	67.2	Low	56	Low	30 Å²	30	98.5 Å²	98.5	15%	0.154	49%	0.489	C	S	.	.			trans	-90.5	108.4	163.3	-61.8	153.6	0	0	0	106.2	P358 M514 T516	I326-P358 HydrophobicContact CD1-CB 4.32Å; I326-P358 PolarHBondContact N-O 3.44Å; I326-M514 HydrophobicContact CD1-CE 3.12Å; I326-M514 HydrophobicContact CD1-SD 4.36Å; I326-M514 HydrophobicContact CG1-CE 4.03Å; I326-T516 HydrophobicContact CD1-CG2 3.53Å; I326-T516 HydrophobicContact CG1-CG2 4.37Å; I326-T516 HydrophobicContact CG2-CG2 4.26Å
327	L	59.8	Low	54	Low	84 Å²	84	103.5 Å²	103.5	44%	0.44	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-71.4	133.8	162.9	-69.9	164.8	0	0	0	107.1	N329 E476	L327-N329 PolarHBondContact O-N 3.39Å; L327-E476 HydrophobicContact CD1-CB 4.12Å; L327-E476 HydrophobicContact CD1-CG 3.87Å
328	P	49.5	Very low	51.8	Low	101 Å²	101	107.4 Å²	107.4	66%	0.656	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-55.8	131.4	166.2	23.7	-29.7	0	0	0	106.7	K330	P328-K330 PolarHBondContact O-N 2.88Å
329	N	40.5	Very low	49.3	Very low	135 Å²	135	113.1 Å²	113.1	72%	0.722	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-50.3	116.8	168.9	-76.9	-8.5	0	0	0	105.5	L327 T331	L327-N329 PolarHBondContact O-N 3.39Å; N329-T331 PolarHBondContact O-N 3.3Å
330	K	34.2	Very low	46.6	Very low	201 Å²	201	116.5 Å²	116.5	87%	0.874	60%	0.595	S	S	*	*			trans	-60.2	96.3	155.3	-72.1	-178.6	179.5	176.2	0	103.1	P328 E332	P328-K330 PolarHBondContact O-N 2.88Å; K330-E332 PolarHBondContact O-N 3Å
331	T	26.9	Very low	43.8	Very low	109 Å²	109	121.9 Å²	121.9	67%	0.669	62%	0.624	S	S	*	*			trans	-44.4	129.9	159.2	21.7	0	0	0	0	105.2	N329 E333	N329-T331 PolarHBondContact O-N 3.3Å; T331-E333 PolarHBondContact O-N 2.97Å
332	E	25.2	Very low	40.9	Very low	194 Å²	194	117.6 Å²	117.6	91%	0.907	62%	0.623	S	S	*	*			trans	-55.5	82.8	170.4	-63.8	-175.9	162.9	0	0	107.6	K330 N334	K330-E332 PolarHBondContact O-N 3Å; E332-N334 PolarHBondContact O-N 3.44Å
333	E	26.3	Very low	37.9	Very low	169 Å²	169	123.1 Å²	123.1	79%	0.79	66%	0.662	S	S	*	*			trans	-72.1	90.9	167.9	-82.2	-169.4	163.5	0	0	105.3	T331	T331-E333 PolarHBondContact O-N 2.97Å
334	N	24.3	Very low	35	Very low	135 Å²	135	121.4 Å²	121.4	72%	0.722	68%	0.675	S	S	*	*			trans	45.2	111.6	142.7	-65	-31.4	0	0	0	115.9	E332 M336	E332-N334 PolarHBondContact O-N 3.44Å; N334-M336 PolarHBondContact O-N 3.45Å
335	N	22.8	Very low	32	Very low	178 Å²	178	129 Å²	129	95%	0.952	72%	0.716	S	S	*	*			trans	-41.7	84.9	142	-71.5	-33.1	0	0	0	110.6
336	M	20.8	Very low	29.6	Very low	167 Å²	167	132.8 Å²	132.8	82%	0.823	74%	0.738	S	S	*	*			trans	-115.5	111.8	160.8	-91.6	-101.4	-112.3	0	0	106.5	N334	N334-M336 PolarHBondContact O-N 3.45Å
337	T	20.9	Very low	27.5	Very low	125 Å²	125	136.2 Å²	136.2	77%	0.767	77%	0.765	S	S	*	*			trans	-39	151.1	175.2	47.9	0	0	0	0	115.6
338	S	21.5	Very low	26	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	78%	0.782	S	S	*	*			trans	99.8	115.3	149.2	75.4	0	0	0	0	118.6
339	N	22.7	Very low	24.8	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	78%	0.781	S	S	*	*			trans	11.6	146	136.1	-73.6	-18.4	0	0	0	119.3
340	Q	23	Very low	24	Very low	179 Å²	179	137.2 Å²	137.2	84%	0.836	79%	0.788	S	S	*	*			trans	88.3	125.9	174.6	-48.9	-162.8	16.9	0	0	112.1
341	L	23.6	Very low	23.7	Very low	142 Å²	142	132.9 Å²	132.9	74%	0.743	78%	0.782	S	S	*	*			cis	-147.2	138.6	25.3	-79.6	95.8	0	0	0	108.5
342	S	21.5	Very low	23.7	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	78%	0.781	S	S	*	*				55.1	104.7	92.2	-38.6	0	0	0	0	115.4
343	S	23.3	Very low	24	Very low	124 Å²	124	128 Å²	128	87%	0.867	77%	0.773	S	S	*	*			trans	38.9	78.2	147.3	61.9	0	0	0	0	117.6
344	G	22.2	Very low	24.7	Very low	64 Å²	64	123 Å²	123	66%	0.66	76%	0.758	S	S	*	*			trans	-121.7	111.9	157.4	0	0	0	0	0	108.3	V346	G344-V346 PolarHBondContact O-N 2.91Å
345	N	20.4	Very low	25.2	Very low	163 Å²	163	124.4 Å²	124.4	87%	0.872	76%	0.763	S	S	*	*			trans	-53.9	102.7	176	-71	-25.9	0	0	0	109.7	S347	N345-S347 PolarHBondContact O-N 3.25Å
346	V	25.5	Very low	26.2	Very low	127 Å²	127	119.1 Å²	119.1	77%	0.77	75%	0.751	S	S	*	*			trans	-75.2	84.6	161.5	-177.1	0	0	0	0	105.1	G344 D348	G344-V346 PolarHBondContact O-N 2.91Å; V346-D348 PolarHBondContact O-N 2.8Å
347	S	22.9	Very low	27.7	Very low	102 Å²	102	115.7 Å²	115.7	71%	0.713	74%	0.736	S	S	*	*			trans	-56.4	109.2	158.1	51.9	0	0	0	0	106.1	N345 G349	N345-S347 PolarHBondContact O-N 3.25Å; S347-G349 VanDerWaalsContact C-N 3.32Å; S347-G349 PolarHBondContact O-N 3.29Å
348	D	27.2	Very low	29.9	Very low	151 Å²	151	112.4 Å²	112.4	81%	0.807	72%	0.716	S	S	*	*			trans	-47.5	102	167.7	-80	-35.1	0	0	0	107.8	V346 C350	V346-D348 PolarHBondContact O-N 2.8Å; D348-C350 PolarHBondContact O-N 3.39Å
349	G	25	Very low	32.5	Very low	62 Å²	62	107.4 Å²	107.4	64%	0.639	68%	0.682	S	S	*	*			trans	-64.1	90.6	176.9	0	0	0	0	0	107.6	S347 C351	S347-G349 VanDerWaalsContact C-N 3.32Å; S347-G349 PolarHBondContact O-N 3.29Å; G349-C351 PolarHBondContact O-N 3.23Å
350	C	24.1	Very low	35.3	Very low	127 Å²	127	100.1 Å²	100.1	86%	0.858	64%	0.643	S	S	*	*			trans	-61.3	81.8	159.8	-174	0	0	0	0	106.7	D348 S352	D348-C350 PolarHBondContact O-N 3.39Å; C350-S352 PolarHBondContact O-N 3.01Å
351	C	27	Very low	38.3	Very low	111 Å²	111	96.3 Å²	96.3	75%	0.75	63%	0.625	S	S	*	*			trans	-66.8	88.8	176.2	-74.5	0	0	0	0	108.9	G349	G349-C351 PolarHBondContact O-N 3.23Å
352	S	27.5	Very low	41.4	Very low	94 Å²	94	89.6 Å²	89.6	66%	0.657	59%	0.59	S	S	*	*			trans	4.3	117.5	135.8	52.4	0	0	0	0	115.6	C350 S354	C350-S352 PolarHBondContact O-N 3.01Å; S352-S354 PolarHBondContact O-N 2.97Å
353	S	32.7	Very low	44.5	Very low	105 Å²	105	86 Å²	86	73%	0.734	56%	0.562	S	S	*	*			trans	36.2	82.3	154.3	59.2	0	0	0	0	115.6	I355	S353-I355 PolarHBondContact O-N 3.02Å
354	S	39.7	Very low	47.7	Very low	66 Å²	66	80 Å²	80	46%	0.462	52%	0.521	S	S	.	.			trans	-66.4	88.5	178.3	41.3	0	0	0	0	112.6	S352 G356	S352-S354 PolarHBondContact O-N 2.97Å; S354-G356 PolarHBondContact O-N 3.48Å; S354-G356 VanDerWaalsContact O-N 3.17Å
355	I	35.7	Very low	50.8	Low	163 Å²	163	77.1 Å²	77.1	84%	0.836	49%	0.49	S	S	*	.			trans	-61.1	107.2	157.3	-77.1	155.6	0	0	0	107.3	S353 L357	S353-I355 PolarHBondContact O-N 3.02Å; I355-L357 PolarHBondContact O-N 3.39Å; I355-L357 VanDerWaalsContact O-N 3.15Å
356	G	42.8	Very low	53.8	Low	68 Å²	68	69.3 Å²	69.3	70%	0.701	45%	0.449	S	S	*	.	S	Bend	trans	68.6	15.8	153.8	0	0	0	0	0	120.2	S354	S354-G356 PolarHBondContact O-N 3.48Å; S354-G356 VanDerWaalsContact O-N 3.17Å
357	L	53.1	Low	56.4	Low	95 Å²	95	63.3 Å²	63.3	50%	0.497	41%	0.412	S	S	.	.			trans	-51.2	129.6	177.2	-77.4	166.9	0	0	0	111.6	R323 I355 G359	R323-L357 PolarHBondContact NE-O 3.02Å; R323-L357 PolarHBondContact NH2-O 3.31Å; I355-L357 PolarHBondContact O-N 3.39Å; I355-L357 VanDerWaalsContact O-N 3.15Å; L357-G359 PolarHBondContact O-N 3.33Å
358	P	66.1	Low	58.8	Low	55 Å²	55	58.6 Å²	58.6	36%	0.357	38%	0.379	S	S	.	.			trans	-60.5	135.6	173.2	24.9	-32	0	0	0	110.5	I326 V515	I326-P358 HydrophobicContact CD1-CB 4.32Å; I326-P358 PolarHBondContact N-O 3.44Å; P358-V515 VanDerWaalsContact CB-O 3.26Å; P358-V515 WeakPolarHBondContact CB-O 3.47Å
359	G	76.2	Confident	61.1	Low	3 Å²	3	51.7 Å²	51.7	3%	0.031	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.6	148.9	-175.6	0	0	0	0	0	114.3	R323 L324 L357 Q361 M514	R323-G359 PolarHBondContact NH1-O 3.38Å; L324-G359 CarbonylContact O-C 3.49Å; L324-G359 WeakPolarHBondContact O-CA 3.22Å; L357-G359 PolarHBondContact O-N 3.33Å; G359-Q361 PolarHBondContact O-N 3.43Å; G359-M514 VanDerWaalsContact O-CE 3.24Å; G359-M514 WeakPolarHBondContact O-CE 3.39Å
360	I	83	Confident	63.4	Low	2 Å²	2	49 Å²	49	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	115.6	-178.1	-66	-178.7	0	0	0	106.9	P280 R323 L324 M362 R483 M487 W492 M514 I533	P280-I360 HydrophobicContact CG-CG2 4.08Å; R323-I360 CarbonylContact C-O 3.53Å; R323-I360 WeakPolarHBondContact CA-O 3.4Å; L324-I360 PolarHBondContact N-O 3.09Å; L324-I360 PolarHBondContact O-N 3.34Å; I360-M362 HydrophobicContact CG2-CE 4.1Å; I360-R483 HydrophobicContact CD1-CG 3.75Å; I360-M487 HydrophobicContact CD1-CG 4.3Å; I360-W492 HydrophobicContact CD1-CE3 4.38Å; I360-W492 HydrophobicContact CD1-CZ3 4.21Å; I360-W492 HydrophobicContact CG1-CZ3 4.29Å; I360-W492 HydrophobicContact CG2-CH2 4.43Å; I360-W492 HydrophobicContact CG2-CZ3 3.88Å; I360-M514 HydrophobicContact CG1-CE 4.07Å; I360-M514 HydrophobicContact CG1-SD 3.72Å; I360-I533 HydrophobicContact CD1-CD1 4.48Å
361	Q	84.9	Confident	65.7	Low	100 Å²	100	43.1 Å²	43.1	47%	0.467	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	135.7	170.4	-69.2	-177	-23.5	0	0	109	L279 P280 S322 R323 G359	L279-Q361 HydrophobicContact CD2-CB 3.49Å; L279-Q361 VanDerWaalsContact CD2-CB 3.49Å; P280-Q361 VanDerWaalsContact CD-O 3.31Å; P280-Q361 WeakPolarHBondContact CD-O 3.26Å; S322-Q361 WeakPolarHBondContact O-CA 3.4Å; R323-Q361 HydrophobicContact CG-CG 4.42Å; G359-Q361 PolarHBondContact O-N 3.43Å
362	M	88.4	Confident	67.6	Low	1 Å²	1	38.3 Å²	38.3	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	164.7	-179.8	63.2	179.4	55	0	0	111.2	P280 V282 S322 L324 I360 L364 V482 I486	P280-M362 HydrophobicContact CB-CB 4.2Å; P280-M362 CarbonylContact O-C 3.55Å; P280-M362 VanDerWaalsContact O-CA 3.31Å; P280-M362 WeakPolarHBondContact O-CA 3.49Å; P280-M362 WeakPolarHBondContact O-CB 3.43Å; V282-M362 HydrophobicContact CG2-CE 4.42Å; V282-M362 HydrophobicContact CG2-SD 3.92Å; S322-M362 PolarHBondContact N-O 3.24Å; S322-M362 PolarHBondContact O-N 2.88Å; L324-M362 HydrophobicContact CB-CE 4.35Å; L324-M362 HydrophobicContact CD1-CE 3.26Å; L324-M362 HydrophobicContact CD1-SD 4.25Å; L324-M362 HydrophobicContact CD2-CE 4.35Å; L324-M362 HydrophobicContact CD2-SD 4.4Å; L324-M362 HydrophobicContact CG-CE 3.38Å; L324-M362 HydrophobicContact CG-SD 3.97Å; I360-M362 HydrophobicContact CG2-CE 4.1Å; M362-L364 HydrophobicContact SD-CD2 4.03Å; M362-V482 HydrophobicContact CE-CG1 4.28Å; M362-I486 HydrophobicContact CE-CD1 3.2Å; M362-I486 HydrophobicContact SD-CD1 4.31Å
363	L	87.4	Confident	69.4	Low	22 Å²	22	35.7 Å²	35.7	12%	0.115	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122	168.6	-66.7	173.3	0	0	0	108.8	H278 L279 P280 L281 V282 R321	H278-L363 WeakPolarHBondContact NE2-CD1 3.34Å; L279-L363 HydrophobicContact CB-CG 4.2Å; L279-L363 HydrophobicContact CD1-CD2 4.34Å; L279-L363 HydrophobicContact CD1-CG 4.21Å; P280-L363 PolarHBondContact O-N 3.4Å; L281-L363 WeakPolarHBondContact CA-O 3.47Å; L281-L363 HydrophobicContact CD1-CB 3.77Å; V282-L363 PolarHBondContact N-O 2.91Å; R321-L363 HydrophobicContact CG-CD2 3.63Å
364	L	89.8	Confident	71.2	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	124.2	167.9	-59.5	171.7	0	0	0	108.1	V282 I296 L299 H319 H320 M362	V282-L364 HydrophobicContact CB-CD2 4.03Å; V282-L364 HydrophobicContact CG1-CD2 4.16Å; V282-L364 CarbonylContact O-C 3.53Å; V282-L364 VanDerWaalsContact O-CA 3.28Å; V282-L364 WeakPolarHBondContact O-CA 3.37Å; I296-L364 HydrophobicContact CG1-CD1 4.45Å; I296-L364 HydrophobicContact CG2-CD1 4.22Å; L299-L364 HydrophobicContact CB-CD1 3.66Å; L299-L364 HydrophobicContact CD1-CD1 4.13Å; L299-L364 HydrophobicContact CD1-CD2 4.17Å; H319-L364 CarbonylContact C-O 3.32Å; H319-L364 WeakPolarHBondContact CA-O 3.48Å; H320-L364 HydrophobicContact CB-CB 4.19Å; H320-L364 PolarHBondContact N-O 3.13Å; H320-L364 PolarHBondContact O-N 3.18Å; M362-L364 HydrophobicContact SD-CD2 4.03Å
365	L	86.7	Confident	72.7	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	109.4	174	-173.8	156.9	0	0	0	107.9	L281 V282 A283 V284 I317 T318 T367	L281-L365 HydrophobicContact CD1-CB 4.01Å; L281-L365 HydrophobicContact CD1-CD1 4.32Å; L281-L365 HydrophobicContact CD2-CD1 4.29Å; V282-L365 PolarHBondContact O-N 3.42Å; A283-L365 HydrophobicContact CB-CB 4.22Å; A283-L365 HydrophobicContact CB-CD2 4.14Å; V284-L365 PolarHBondContact N-O 2.93Å; I317-L365 HydrophobicContact CG1-CD2 4.38Å; I317-L365 HydrophobicContact CG2-CD1 3.78Å; I317-L365 HydrophobicContact CG2-CD2 3.48Å; I317-L365 VanDerWaalsContact CG2-CD2 3.48Å; I317-L365 HydrophobicContact CG2-CG 3.32Å; T318-L365 WeakPolarHBondContact O-CA 3.43Å; L365-T367 HydrophobicContact CD2-CG2 3.51Å
366	D	85.1	Confident	74.4	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	119.7	172.9	-164	13.1	0	0	0	109.1	I296 T314 I317 T318	I296-D366 HydrophobicContact CD1-CB 3.39Å; I296-D366 VanDerWaalsContact CD1-OD1 3.28Å; I296-D366 WeakPolarHBondContact CD1-OD1 3.33Å; T314-D366 PolarHBondContact OG1-OD2 2.87Å; I317-D366 WeakPolarHBondContact CA-O 3.5Å; T318-D366 PolarHBondContact N-O 3.4Å; T318-D366 PolarHBondContact O-N 3.45Å; T318-D366 VanDerWaalsContact OG1-CB 3.29Å; T318-D366 WeakPolarHBondContact OG1-CB 3.19Å
367	T	79.5	Confident	75.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-93.3	159.6	173	73.3	0	0	0	0	111.4	V284 V285 K292 L365 G369 C389	V284-T367 PolarHBondContact O-N 2.85Å; V284-T367 PolarHBondContact O-OG1 3.42Å; V285-T367 HydrophobicContact CG1-CG2 3.86Å; K292-T367 WeakPolarHBondContact CE-O 3.33Å; L365-T367 HydrophobicContact CD2-CG2 3.51Å; T367-G369 PolarHBondContact O-N 3.38Å; T367-C389 WeakPolarHBondContact CG2-SG 3.39Å
368	I	73.1	Confident	76.8	Confident	4 Å²	4	21.3 Å²	21.3	2%	0.021	12%	0.12	C	C	.	.	P	Polyproline II helix	trans	-51.1	142	164.9	-49.4	-174.8	0	0	0	109	F191 F312 L315 F382 T385	F191-I368 HydrophobicContact CE1-CD1 4.37Å; F191-I368 HydrophobicContact CZ-CG2 4.09Å; F312-I368 HydrophobicContact CD1-CG2 3.81Å; F312-I368 HydrophobicContact CE1-CG2 3.91Å; L315-I368 HydrophobicContact CD2-CG2 4.07Å; L315-I368 WeakPolarHBondContact O-CD1 3.43Å; L315-I368 WeakPolarHBondContact O-CG1 3.27Å; I368-F382 VanDerWaalsContact C-CE2 3.45Å; I368-F382 HydrophobicContact CB-CD2 3.77Å; I368-F382 HydrophobicContact CB-CE2 3.52Å; I368-F382 HydrophobicContact CB-CZ 4.43Å; I368-F382 HydrophobicContact CG2-CD2 3.71Å; I368-F382 HydrophobicContact CG2-CE2 3.64Å; I368-F382 WeakPolarHBondContact O-CE2 3.44Å; I368-F382 WeakPolarHBondContact O-CZ 3.34Å; I368-T385 HydrophobicContact CD1-CG2 3.8Å; I368-T385 HydrophobicContact CG1-CG2 4.29Å
369	G	75.8	Confident	77.2	Confident	5 Å²	5	20.8 Å²	20.8	5%	0.052	11%	0.114	C	C	.	.	P	Polyproline II helix	trans	-80.7	139	173.2	0	0	0	0	0	113.7	G286 T367 F382	G286-G369 WeakPolarHBondContact O-CA 3.28Å; T367-G369 PolarHBondContact O-N 3.38Å; G369-F382 WeakPolarHBondContact O-CE2 3.29Å
370	F	73.7	Confident	76.9	Confident	5 Å²	5	23.1 Å²	23.1	2%	0.022	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-68.1	139.2	170.8	-57.5	-88.2	0	0	0	110.1	G286 Y287 T288 F382 L386 V413 L416	G286-F370 WeakPolarHBondContact O-CD2 3.47Å; G286-F370 PolarHBondContact O-N 2.88Å; Y287-F370 CarbonylContact C-O 3.56Å; Y287-F370 VanDerWaalsContact CA-O 3.25Å; Y287-F370 WeakPolarHBondContact CA-O 3.13Å; Y287-F370 HydrophobicContact CD1-CB 4.02Å; Y287-F370 VanDerWaalsContact CD1-O 3.23Å; Y287-F370 WeakPolarHBondContact CD1-O 3.32Å; Y287-F370 HydrophobicContact CD2-CB 3.98Å; Y287-F370 HydrophobicContact CE1-CB 4.17Å; Y287-F370 HydrophobicContact CE2-CB 4.12Å; Y287-F370 HydrophobicContact CG-CB 3.94Å; T288-F370 WeakPolarHBondContact CG2-O 3.49Å; T288-F370 PolarHBondContact N-O 3.14Å; T288-F370 PolarHBondContact OG1-O 3.31Å; F370-F382 AromaticContact CD1-CD1 3.98Å; F370-F382 HydrophobicContact CD1-CD1 3.98Å; F370-F382 AromaticContact CD1-CE1 3.36Å; F370-F382 HydrophobicContact CD1-CE1 3.36Å; F370-F382 HydrophobicContact CD1-CE2 4.15Å; F370-F382 AromaticContact CD1-CZ 3.43Å; F370-F382 HydrophobicContact CD1-CZ 3.43Å; F370-F382 VanDerWaalsContact CD1-CZ 3.43Å; F370-F382 HydrophobicContact CD2-CE1 4.28Å; F370-F382 AromaticContact CD2-CZ 3.83Å; F370-F382 HydrophobicContact CD2-CZ 3.83Å; F370-F382 AromaticContact CE1-CD1 3.6Å; F370-F382 HydrophobicContact CE1-CD1 3.6Å; F370-F382 AromaticContact CE1-CE1 2.9Å; F370-F382 HydrophobicContact CE1-CE1 2.9Å; F370-F382 HydrophobicContact CE1-CE2 4.46Å; F370-F382 AromaticContact CE1-CZ 3.42Å; F370-F382 HydrophobicContact CE1-CZ 3.42Å; F370-F382 VanDerWaalsContact CE1-CZ 3.42Å; F370-F382 AromaticContact CE2-CE1 3.91Å; F370-F382 HydrophobicContact CE2-CE1 3.91Å; F370-F382 AromaticContact CE2-CZ 3.79Å; F370-F382 HydrophobicContact CE2-CZ 3.79Å; F370-F382 HydrophobicContact CG-CE1 4.05Å; F370-F382 HydrophobicContact CG-CE2 4.32Å; F370-F382 AromaticContact CG-CZ 3.66Å; F370-F382 HydrophobicContact CG-CZ 3.66Å; F370-F382 HydrophobicContact CZ-CD1 4.28Å; F370-F382 AromaticContact CZ-CE1 3.23Å; F370-F382 HydrophobicContact CZ-CE1 3.23Å; F370-F382 AromaticContact CZ-CZ 3.61Å; F370-F382 HydrophobicContact CZ-CZ 3.61Å; F370-L386 HydrophobicContact CE1-CD1 4.03Å; F370-L386 HydrophobicContact CZ-CD1 3.86Å; F370-L386 HydrophobicContact CZ-CD2 4.17Å; F370-L386 HydrophobicContact CZ-CG 4.47Å; F370-V413 HydrophobicContact CD2-CG1 4.49Å; F370-V413 HydrophobicContact CD2-CG2 3.54Å; F370-V413 HydrophobicContact CE2-CB 4.14Å; F370-V413 HydrophobicContact CE2-CG1 3.64Å; F370-V413 HydrophobicContact CE2-CG2 3.51Å; F370-V413 HydrophobicContact CG-CG2 4.14Å; F370-V413 HydrophobicContact CZ-CB 4.37Å; F370-V413 HydrophobicContact CZ-CG1 3.91Å; F370-V413 HydrophobicContact CZ-CG2 4.03Å; F370-L416 HydrophobicContact CD1-CD1 3.87Å; F370-L416 HydrophobicContact CE1-CB 4.45Å; F370-L416 HydrophobicContact CE1-CD1 3.36Å; F370-L416 HydrophobicContact CZ-CD1 4.33Å
371	M	71.1	Confident	76.2	Confident	5 Å²	5	23.2 Å²	23.2	3%	0.025	14%	0.135	C	C	.	.			trans	-117.8	154.7	166.7	-64.6	-149.3	-30.7	0	0	110.5	E77 L81 V187 T288 V311 F312 D373	E77-M371 VanDerWaalsContact OE1-CA 3.26Å; E77-M371 WeakPolarHBondContact OE1-CA 3.39Å; E77-M371 WeakPolarHBondContact OE1-CB 3.38Å; E77-M371 WeakPolarHBondContact OE1-CG 3.24Å; L81-M371 HydrophobicContact CD1-CE 3.8Å; L81-M371 HydrophobicContact CD1-SD 4.11Å; V187-M371 HydrophobicContact CB-CE 4.33Å; V187-M371 HydrophobicContact CG1-CE 4.31Å; V187-M371 HydrophobicContact CG2-CE 3.05Å; T288-M371 HydrophobicContact CG2-CG 3.34Å; T288-M371 HydrophobicContact CG2-SD 4.06Å; T288-M371 WeakPolarHBondContact OG1-CG 3.45Å; V311-M371 HydrophobicContact CG1-CG 4.4Å; V311-M371 HydrophobicContact CG1-SD 3.49Å; V311-M371 WeakPolarHBondContact CG1-SD 3.25Å; F312-M371 HydrophobicContact CE1-CG 4.25Å; F312-M371 HydrophobicContact CE2-CE 4.03Å; F312-M371 HydrophobicContact CE2-CG 4.17Å; F312-M371 HydrophobicContact CE2-SD 3.4Å; F312-M371 WeakPolarHBondContact CE2-SD 3.45Å; F312-M371 HydrophobicContact CZ-CE 3.98Å; F312-M371 HydrophobicContact CZ-CG 3.54Å; F312-M371 HydrophobicContact CZ-SD 3.4Å; F312-M371 WeakPolarHBondContact CZ-SD 3.42Å; M371-D373 PolarHBondContact O-N 3.46Å
372	S	67	Low	75.4	Confident	9 Å²	9	18.6 Å²	18.6	6%	0.063	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	135.7	161.1	-55.9	0	0	0	0	108.8	E77 R183 L374	E77-S372 PolarHBondContact OE1-N 2.74Å; R183-S372 PolarHBondContact NE-O 3.1Å; R183-S372 PolarHBondContact NH2-O 2.86Å; S372-L374 PolarHBondContact O-N 2.95Å
373	D	66.5	Low	74.8	Confident	39 Å²	39	24 Å²	24	21%	0.209	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	37.6	170.9	-47.1	-52.2	0	0	0	116.5	P69 P162 M371	P69-D373 WeakPolarHBondContact CA-OD1 3.48Å; P69-D373 VanDerWaalsContact CB-OD1 3.26Å; P69-D373 WeakPolarHBondContact CB-OD1 3.21Å; P69-D373 WeakPolarHBondContact CB-OD2 3.49Å; P69-D373 WeakPolarHBondContact CD-OD1 3.43Å; P69-D373 WeakPolarHBondContact CG-OD2 3.4Å; P162-D373 HydrophobicContact CB-CB 3.82Å; P162-D373 HydrophobicContact CG-CB 3.93Å; M371-D373 PolarHBondContact O-N 3.46Å
374	L	70.7	Confident	74.2	Confident	27 Å²	27	23.8 Å²	23.8	14%	0.141	13%	0.134	C	C	.	.			trans	-62.1	135.2	173.5	-166.1	71.4	0	0	0	110.7	V187 F191 S372 T376 L378 F382	V187-L374 HydrophobicContact CG1-CD1 3.82Å; F191-L374 HydrophobicContact CE2-CD1 3.84Å; F191-L374 HydrophobicContact CZ-CD1 4.18Å; S372-L374 PolarHBondContact O-N 2.95Å; L374-T376 PolarHBondContact O-N 3.23Å; L374-L378 HydrophobicContact CD1-CB 4.02Å; L374-L378 HydrophobicContact CD1-CD1 4.24Å; L374-L378 HydrophobicContact CD2-CB 4.05Å; L374-L378 HydrophobicContact CG-CB 3.84Å; L374-F382 HydrophobicContact CD2-CB 4.21Å; L374-F382 HydrophobicContact CD2-CD2 4.45Å
375	P	70.2	Confident	73.4	Confident	6 Å²	6	24.4 Å²	24.4	4%	0.039	14%	0.138	C	C	.	.			trans	-50.4	139.4	172.3	-29.1	36.9	0	0	0	112.2	Y184 V187 V188 N377 L378 L379	Y184-P375 HydrophobicContact CD2-CB 4.02Å; Y184-P375 HydrophobicContact CD2-CG 3.47Å; Y184-P375 VanDerWaalsContact CD2-CG 3.47Å; Y184-P375 HydrophobicContact CE1-CG 4.39Å; Y184-P375 HydrophobicContact CE2-CB 3.28Å; Y184-P375 HydrophobicContact CE2-CG 3.22Å; Y184-P375 HydrophobicContact CG-CG 4.15Å; V187-P375 HydrophobicContact CG1-CG 4.48Å; V188-P375 HydrophobicContact CG2-CG 4.19Å; P375-N377 PolarHBondContact O-N 3.05Å; P375-N377 VanDerWaalsContact O-N 3.14Å; P375-L378 HydrophobicContact CB-CB 4.15Å; P375-L378 HydrophobicContact CB-CD1 4.24Å; P375-L378 HydrophobicContact CB-CG 4.11Å; P375-L378 HydrophobicContact CG-CB 4.48Å; P375-L378 HydrophobicContact CG-CD1 3.83Å; P375-L378 HydrophobicContact CG-CG 4.26Å; P375-L378 CarbonylContact O-C 3.57Å; P375-L378 WeakPolarHBondContact O-CA 3.48Å; P375-L378 PolarHBondContact O-N 3.32Å; P375-L379 PolarHBondContact O-N 2.91Å
376	T	72.4	Confident	73	Confident	113 Å²	113	24.4 Å²	24.4	69%	0.693	14%	0.138	S	C	*	.	H	α-helix	trans	-55.8	-35.6	179.4	52.4	0	0	0	0	113.2	L374 L378 L379 A380	L374-T376 PolarHBondContact O-N 3.23Å; T376-L378 VanDerWaalsContact C-N 3.35Å; T376-L379 WeakPolarHBondContact O-CB 3.25Å; T376-L379 PolarHBondContact O-N 2.93Å; T376-A380 PolarHBondContact O-N 3.34Å
377	N	72.3	Confident	72.7	Confident	48 Å²	48	27.4 Å²	27.4	26%	0.257	15%	0.154	S	C	.	.	H	α-helix	trans	-69.6	-33.5	177.9	-65.4	-1.8	0	0	0	111.8	L206 A207 P375	L206-N377 HydrophobicContact CB-CB 4.43Å; L206-N377 PolarHBondContact O-ND2 3.47Å; A207-N377 HydrophobicContact CB-CB 4.26Å; P375-N377 PolarHBondContact O-N 3.05Å; P375-N377 VanDerWaalsContact O-N 3.14Å
378	L	73.9	Confident	72.6	Confident	1 Å²	1	30 Å²	30	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-81.2	-23.8	173	-65.5	-177.5	0	0	0	112.3	V187 V188 F191 A207 L374 P375 T376 A380 A381 F382	V187-L378 HydrophobicContact CG1-CD1 3.76Å; V188-L378 HydrophobicContact CG2-CD1 4.19Å; F191-L378 HydrophobicContact CB-CD1 4.17Å; F191-L378 HydrophobicContact CB-CD2 4.33Å; F191-L378 HydrophobicContact CD1-CD1 4.25Å; F191-L378 HydrophobicContact CD1-CD2 3.85Å; F191-L378 HydrophobicContact CD2-CD1 3.58Å; F191-L378 HydrophobicContact CE1-CD2 4.27Å; F191-L378 HydrophobicContact CE2-CD1 3.89Å; F191-L378 HydrophobicContact CG-CD1 3.74Å; F191-L378 HydrophobicContact CG-CD2 4.03Å; F191-L378 HydrophobicContact CZ-CD1 4.38Å; A207-L378 HydrophobicContact CB-CD1 4.2Å; A207-L378 HydrophobicContact CB-CD2 3.8Å; A207-L378 HydrophobicContact CB-CG 3.67Å; L374-L378 HydrophobicContact CD1-CB 4.02Å; L374-L378 HydrophobicContact CD1-CD1 4.24Å; L374-L378 HydrophobicContact CD2-CB 4.05Å; L374-L378 HydrophobicContact CG-CB 3.84Å; P375-L378 HydrophobicContact CB-CB 4.15Å; P375-L378 HydrophobicContact CB-CD1 4.24Å; P375-L378 HydrophobicContact CB-CG 4.11Å; P375-L378 HydrophobicContact CG-CB 4.48Å; P375-L378 HydrophobicContact CG-CD1 3.83Å; P375-L378 HydrophobicContact CG-CG 4.26Å; P375-L378 CarbonylContact O-C 3.57Å; P375-L378 WeakPolarHBondContact O-CA 3.48Å; P375-L378 PolarHBondContact O-N 3.32Å; T376-L378 VanDerWaalsContact C-N 3.35Å; L378-A380 VanDerWaalsContact C-N 3.28Å; L378-A380 PolarHBondContact O-N 3.35Å; L378-A381 WeakPolarHBondContact O-CB 3.42Å; L378-A381 PolarHBondContact O-N 3.1Å; L378-F382 WeakPolarHBondContact O-CB 3.34Å; L378-F382 PolarHBondContact O-N 3.1Å
379	L	73.9	Confident	73.1	Confident	44 Å²	44	29.8 Å²	29.8	23%	0.23	17%	0.165	C	C	.	.	H	α-helix	trans	-64.4	-35.8	171.6	-173.4	68.2	0	0	0	111.3	P375 T376 F382 R383	P375-L379 PolarHBondContact O-N 2.91Å; T376-L379 WeakPolarHBondContact O-CB 3.25Å; T376-L379 PolarHBondContact O-N 2.93Å; L379-F382 WeakPolarHBondContact O-CB 3.41Å; L379-F382 PolarHBondContact O-N 2.83Å; L379-R383 WeakPolarHBondContact O-CG 3.47Å; L379-R383 PolarHBondContact O-N 2.65Å
380	A	70.3	Confident	73.4	Confident	53 Å²	53	30.6 Å²	30.6	44%	0.438	17%	0.168	S	C	.	.	H	α-helix	trans	-63.8	-41.2	172.9	0	0	0	0	0	111.9	T376 L378 F382 R383 A384	T376-A380 PolarHBondContact O-N 3.34Å; L378-A380 VanDerWaalsContact C-N 3.28Å; L378-A380 PolarHBondContact O-N 3.35Å; A380-F382 VanDerWaalsContact C-N 3.29Å; A380-F382 PolarHBondContact O-N 3.28Å; A380-R383 PolarHBondContact O-N 2.69Å; A380-A384 PolarHBondContact O-N 2.98Å
381	A	66.7	Low	73.7	Confident	4 Å²	4	32.2 Å²	32.2	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-54.6	-48.7	170.9	0	0	0	0	0	112.3	Q203 L378 A384 T385	Q203-A381 HydrophobicContact CB-CB 3.7Å; Q203-A381 HydrophobicContact CG-CB 3.82Å; Q203-A381 VanDerWaalsContact NE2-CA 3.35Å; L378-A381 WeakPolarHBondContact O-CB 3.42Å; L378-A381 PolarHBondContact O-N 3.1Å; A381-A384 WeakPolarHBondContact O-CB 3.4Å; A381-A384 PolarHBondContact O-N 3.46Å; A381-T385 PolarHBondContact O-N 3.43Å; A381-T385 PolarHBondContact O-OG1 3.4Å
382	F	70	Confident	74.5	Confident	2 Å²	2	32 Å²	32	1%	0.009	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-46.7	-178.7	-162.7	-78.7	0	0	0	112.1	I368 G369 F370 L374 L378 L379 A380 A384 T385 L386	I368-F382 VanDerWaalsContact C-CE2 3.45Å; I368-F382 HydrophobicContact CB-CD2 3.77Å; I368-F382 HydrophobicContact CB-CE2 3.52Å; I368-F382 HydrophobicContact CB-CZ 4.43Å; I368-F382 HydrophobicContact CG2-CD2 3.71Å; I368-F382 HydrophobicContact CG2-CE2 3.64Å; I368-F382 WeakPolarHBondContact O-CE2 3.44Å; I368-F382 WeakPolarHBondContact O-CZ 3.34Å; G369-F382 WeakPolarHBondContact O-CE2 3.29Å; F370-F382 AromaticContact CD1-CD1 3.98Å; F370-F382 HydrophobicContact CD1-CD1 3.98Å; F370-F382 AromaticContact CD1-CE1 3.36Å; F370-F382 HydrophobicContact CD1-CE1 3.36Å; F370-F382 HydrophobicContact CD1-CE2 4.15Å; F370-F382 AromaticContact CD1-CZ 3.43Å; F370-F382 HydrophobicContact CD1-CZ 3.43Å; F370-F382 VanDerWaalsContact CD1-CZ 3.43Å; F370-F382 HydrophobicContact CD2-CE1 4.28Å; F370-F382 AromaticContact CD2-CZ 3.83Å; F370-F382 HydrophobicContact CD2-CZ 3.83Å; F370-F382 AromaticContact CE1-CD1 3.6Å; F370-F382 HydrophobicContact CE1-CD1 3.6Å; F370-F382 AromaticContact CE1-CE1 2.9Å; F370-F382 HydrophobicContact CE1-CE1 2.9Å; F370-F382 HydrophobicContact CE1-CE2 4.46Å; F370-F382 AromaticContact CE1-CZ 3.42Å; F370-F382 HydrophobicContact CE1-CZ 3.42Å; F370-F382 VanDerWaalsContact CE1-CZ 3.42Å; F370-F382 AromaticContact CE2-CE1 3.91Å; F370-F382 HydrophobicContact CE2-CE1 3.91Å; F370-F382 AromaticContact CE2-CZ 3.79Å; F370-F382 HydrophobicContact CE2-CZ 3.79Å; F370-F382 HydrophobicContact CG-CE1 4.05Å; F370-F382 HydrophobicContact CG-CE2 4.32Å; F370-F382 AromaticContact CG-CZ 3.66Å; F370-F382 HydrophobicContact CG-CZ 3.66Å; F370-F382 HydrophobicContact CZ-CD1 4.28Å; F370-F382 AromaticContact CZ-CE1 3.23Å; F370-F382 HydrophobicContact CZ-CE1 3.23Å; F370-F382 AromaticContact CZ-CZ 3.61Å; F370-F382 HydrophobicContact CZ-CZ 3.61Å; L374-F382 HydrophobicContact CD2-CB 4.21Å; L374-F382 HydrophobicContact CD2-CD2 4.45Å; L378-F382 WeakPolarHBondContact O-CB 3.34Å; L378-F382 PolarHBondContact O-N 3.1Å; L379-F382 WeakPolarHBondContact O-CB 3.41Å; L379-F382 PolarHBondContact O-N 2.83Å; A380-F382 VanDerWaalsContact C-N 3.29Å; A380-F382 PolarHBondContact O-N 3.28Å; F382-A384 VanDerWaalsContact C-N 3.3Å; F382-A384 PolarHBondContact O-N 3.08Å; F382-T385 WeakPolarHBondContact CA-OG1 3.46Å; F382-T385 CarbonylContact O-C 3.49Å; F382-T385 PolarHBondContact O-N 3.01Å; F382-T385 VanDerWaalsContact O-N 3.1Å; F382-T385 PolarHBondContact O-OG1 3.04Å; F382-L386 HydrophobicContact CD1-CD1 3.73Å; F382-L386 HydrophobicContact CD1-CG 3.74Å; F382-L386 HydrophobicContact CE1-CD1 3.52Å; F382-L386 HydrophobicContact CE1-CD2 3.76Å; F382-L386 HydrophobicContact CE1-CG 3.41Å; F382-L386 VanDerWaalsContact CE1-CG 3.41Å; F382-L386 HydrophobicContact CZ-CD2 4.47Å; F382-L386 HydrophobicContact CZ-CG 4.48Å; F382-L386 PolarHBondContact O-N 3.13Å
383	R	75.8	Confident	75.5	Confident	116 Å²	116	33.2 Å²	33.2	44%	0.438	18%	0.182	S	C	.	.	H	α-helix	trans	-57.9	-44.7	175.5	-76.8	179.5	174.9	-177.7	-2.5	111.6	L379 A380 T385 L386 D387	L379-R383 WeakPolarHBondContact O-CG 3.47Å; L379-R383 PolarHBondContact O-N 2.65Å; A380-R383 PolarHBondContact O-N 2.69Å; R383-T385 VanDerWaalsContact C-N 3.3Å; R383-T385 PolarHBondContact O-N 3.23Å; R383-L386 PolarHBondContact O-N 3.22Å; R383-L386 VanDerWaalsContact O-N 3.15Å; R383-D387 PolarHBondContact O-N 3.31Å
384	A	73	Confident	76.8	Confident	16 Å²	16	31.4 Å²	31.4	13%	0.132	17%	0.172	C	C	.	.	H	α-helix	trans	-58.9	-45.1	176.2	0	0	0	0	0	110	E199 R263 A380 A381 F382 L386 D387	E199-A384 WeakPolarHBondContact OE1-CB 3.4Å; R263-A384 VanDerWaalsContact NH1-C 3.32Å; R263-A384 VanDerWaalsContact NH1-CB 3.32Å; R263-A384 PolarHBondContact NH1-O 2.95Å; R263-A384 VanDerWaalsContact NH1-O 3.15Å; R263-A384 PolarHBondContact NH2-O 3.11Å; A380-A384 PolarHBondContact O-N 2.98Å; A381-A384 WeakPolarHBondContact O-CB 3.4Å; A381-A384 PolarHBondContact O-N 3.46Å; F382-A384 VanDerWaalsContact C-N 3.3Å; F382-A384 PolarHBondContact O-N 3.08Å; A384-L386 PolarHBondContact O-N 2.9Å; A384-D387 WeakPolarHBondContact O-CB 3.38Å; A384-D387 PolarHBondContact O-N 2.94Å
385	T	73.1	Confident	77.9	Confident	14 Å²	14	30.1 Å²	30.1	9%	0.086	17%	0.166	C	C	.	.	H	α-helix	trans	-64.4	-37.7	174.6	56.7	0	0	0	0	114	I317 I368 A381 F382 R383 D387 E388	I317-T385 HydrophobicContact CD1-CG2 4.12Å; I317-T385 VanDerWaalsContact CD1-O 3.27Å; I317-T385 WeakPolarHBondContact CD1-O 3.47Å; I317-T385 HydrophobicContact CG1-CG2 4.26Å; I368-T385 HydrophobicContact CD1-CG2 3.8Å; I368-T385 HydrophobicContact CG1-CG2 4.29Å; A381-T385 PolarHBondContact O-N 3.43Å; A381-T385 PolarHBondContact O-OG1 3.4Å; F382-T385 WeakPolarHBondContact CA-OG1 3.46Å; F382-T385 CarbonylContact O-C 3.49Å; F382-T385 PolarHBondContact O-N 3.01Å; F382-T385 VanDerWaalsContact O-N 3.1Å; F382-T385 PolarHBondContact O-OG1 3.04Å; R383-T385 VanDerWaalsContact C-N 3.3Å; R383-T385 PolarHBondContact O-N 3.23Å; T385-D387 VanDerWaalsContact C-N 3.28Å; T385-D387 PolarHBondContact O-N 3.17Å; T385-E388 PolarHBondContact O-N 3.36Å
386	L	78.8	Confident	79.1	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-66.4	-28.4	175	-76.7	-178.8	0	0	0	113.2	V285 F370 F382 R383 A384 E388 C389 L416 I420	V285-L386 HydrophobicContact CG1-CD2 4.03Å; F370-L386 HydrophobicContact CE1-CD1 4.03Å; F370-L386 HydrophobicContact CZ-CD1 3.86Å; F370-L386 HydrophobicContact CZ-CD2 4.17Å; F370-L386 HydrophobicContact CZ-CG 4.47Å; F382-L386 HydrophobicContact CD1-CD1 3.73Å; F382-L386 HydrophobicContact CD1-CG 3.74Å; F382-L386 HydrophobicContact CE1-CD1 3.52Å; F382-L386 HydrophobicContact CE1-CD2 3.76Å; F382-L386 HydrophobicContact CE1-CG 3.41Å; F382-L386 VanDerWaalsContact CE1-CG 3.41Å; F382-L386 HydrophobicContact CZ-CD2 4.47Å; F382-L386 HydrophobicContact CZ-CG 4.48Å; F382-L386 PolarHBondContact O-N 3.13Å; R383-L386 PolarHBondContact O-N 3.22Å; R383-L386 VanDerWaalsContact O-N 3.15Å; A384-L386 PolarHBondContact O-N 2.9Å; L386-E388 PolarHBondContact O-N 3.38Å; L386-E388 VanDerWaalsContact O-N 3.12Å; L386-C389 WeakPolarHBondContact O-CB 3.41Å; L386-C389 PolarHBondContact O-N 3.04Å; L386-L416 HydrophobicContact CD1-CB 4.35Å; L386-I420 HydrophobicContact CB-CD1 3.29Å; L386-I420 HydrophobicContact CD1-CD1 3.67Å; L386-I420 HydrophobicContact CG-CD1 4.19Å
387	D	79.5	Confident	80.1	Confident	62 Å²	62	24.6 Å²	24.6	33%	0.332	13%	0.131	S	C	.	.	H	α-helix	trans	-56.1	-29.5	176.1	-74.7	-24.9	0	0	0	111.3	R267 R383 A384 T385 C389 L390 I420	R267-D387 PolarHBondContact NH1-O 3.37Å; R267-D387 PolarHBondContact NH2-O 3.26Å; R383-D387 PolarHBondContact O-N 3.31Å; A384-D387 WeakPolarHBondContact O-CB 3.38Å; A384-D387 PolarHBondContact O-N 2.94Å; T385-D387 VanDerWaalsContact C-N 3.28Å; T385-D387 PolarHBondContact O-N 3.17Å; D387-C389 VanDerWaalsContact C-N 3.28Å; D387-C389 PolarHBondContact O-N 3.33Å; D387-L390 WeakPolarHBondContact O-CB 3.26Å; D387-L390 PolarHBondContact O-N 3.36Å; D387-I420 WeakPolarHBondContact OD1-CG2 3.28Å
388	E	76.9	Confident	81.2	Confident	54 Å²	54	22.3 Å²	22.3	25%	0.252	12%	0.119	S	C	.	.	G	3₁₀ helix	trans	-68.9	-24.2	175	-77.7	179.1	-150.2	0	0	113.4	R263 I317 T385 L386 L390 D391	R263-E388 IonicContact CZ-OE1 2.8Å; R263-E388 IonicContact NE-OE1 3.75Å; R263-E388 PolarHBondContact NE-OE1 2.97Å; R263-E388 VanDerWaalsContact NH2-CG 3.31Å; R263-E388 IonicContact NH2-OE1 3.04Å; R263-E388 PolarHBondContact NH2-OE1 2.84Å; I317-E388 HydrophobicContact CD1-CB 3.78Å; I317-E388 HydrophobicContact CD1-CG 4.03Å; I317-E388 WeakPolarHBondContact CD1-OE2 3.39Å; T385-E388 PolarHBondContact O-N 3.36Å; L386-E388 PolarHBondContact O-N 3.38Å; L386-E388 VanDerWaalsContact O-N 3.12Å; E388-L390 PolarHBondContact O-N 2.94Å; E388-D391 PolarHBondContact O-N 2.93Å; E388-D391 VanDerWaalsContact O-N 3.15Å
389	C	82.7	Confident	82.1	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-67	-22.6	177.1	-60.5	0	0	0	0	112.7	A283 T367 L386 D387 D391 A392 I395	A283-C389 HydrophobicContact CB-CB 4.06Å; T367-C389 WeakPolarHBondContact CG2-SG 3.39Å; L386-C389 WeakPolarHBondContact O-CB 3.41Å; L386-C389 PolarHBondContact O-N 3.04Å; D387-C389 VanDerWaalsContact C-N 3.28Å; D387-C389 PolarHBondContact O-N 3.33Å; C389-D391 PolarHBondContact O-N 3.22Å; C389-A392 VanDerWaalsContact O-CB 3.22Å; C389-A392 WeakPolarHBondContact O-CB 3.3Å; C389-A392 PolarHBondContact O-N 2.77Å; C389-A392 VanDerWaalsContact O-N 3.07Å; C389-I395 HydrophobicContact CB-CD1 4.08Å; C389-I395 HydrophobicContact CB-CG1 4.5Å
390	L	82.9	Confident	83	Confident	23 Å²	23	20.6 Å²	20.6	12%	0.12	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-62.4	-24.6	174.3	-76.6	170.6	0	0	0	112.7	D387 E388 A392 I420 V422 F439	D387-L390 WeakPolarHBondContact O-CB 3.26Å; D387-L390 PolarHBondContact O-N 3.36Å; E388-L390 PolarHBondContact O-N 2.94Å; L390-A392 VanDerWaalsContact C-N 3.32Å; L390-I420 HydrophobicContact CD1-CG2 3.47Å; L390-I420 VanDerWaalsContact CD1-CG2 3.47Å; L390-I420 WeakPolarHBondContact CD1-O 3.19Å; L390-I420 HydrophobicContact CD2-CG2 4.1Å; L390-I420 HydrophobicContact CG-CG2 3.61Å; L390-V422 HydrophobicContact CD2-CG2 3.6Å; L390-V422 HydrophobicContact CG-CG2 4.39Å; L390-F439 VanDerWaalsContact O-CE1 3.22Å; L390-F439 WeakPolarHBondContact O-CE1 3.49Å; L390-F439 VanDerWaalsContact O-CZ 3.22Å; L390-F439 WeakPolarHBondContact O-CZ 3.3Å
391	D	79.8	Confident	84	Confident	39 Å²	39	18.1 Å²	18.1	21%	0.209	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-87.7	-3.2	176.3	-66.8	-19.4	0	0	0	112.8	R267 E388 C389	R267-D391 WeakPolarHBondContact CD-OD2 3.48Å; R267-D391 WeakPolarHBondContact CG-OD2 3.5Å; R267-D391 IonicContact CZ-OD1 3.87Å; R267-D391 IonicContact CZ-OD2 2.75Å; R267-D391 IonicContact NE-OD1 3.01Å; R267-D391 PolarHBondContact NE-OD1 3.09Å; R267-D391 VanDerWaalsContact NE-OD1 3.12Å; R267-D391 IonicContact NE-OD2 2.9Å; R267-D391 PolarHBondContact NE-OD2 2.77Å; R267-D391 IonicContact NH2-OD1 2.74Å; R267-D391 PolarHBondContact NH2-OD1 2.9Å; R267-D391 IonicContact NH2-OD2 3.65Å; E388-D391 PolarHBondContact O-N 2.93Å; E388-D391 VanDerWaalsContact O-N 3.15Å; C389-D391 PolarHBondContact O-N 3.22Å
392	A	87.8	Confident	84.9	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.008	10%	0.099	C	C	.	.			trans	-68.2	154.6	174.6	0	0	0	0	0	111	L281 A283 C389 L390 I395 P442	L281-A392 HydrophobicContact CD2-CB 4.47Å; L281-A392 HydrophobicContact CG-CB 4.29Å; A283-A392 HydrophobicContact CB-CB 3.9Å; C389-A392 VanDerWaalsContact O-CB 3.22Å; C389-A392 WeakPolarHBondContact O-CB 3.3Å; C389-A392 PolarHBondContact O-N 2.77Å; C389-A392 VanDerWaalsContact O-N 3.07Å; L390-A392 VanDerWaalsContact C-N 3.32Å; A392-I395 HydrophobicContact CB-CG1 4.47Å; A392-P442 WeakPolarHBondContact O-CB 3.31Å
393	D	88.4	Confident	85.6	Confident	34 Å²	34	20.4 Å²	20.4	18%	0.182	10%	0.104	C	C	.	.	S	Bend	trans	-79.4	-28.9	168.6	-60.7	-58.5	0	0	0	111	P280 L281 R489 L490	P280-D393 VanDerWaalsContact CA-OD2 3.29Å; P280-D393 WeakPolarHBondContact CA-OD2 3.46Å; L281-D393 PolarHBondContact N-OD2 2.55Å; L281-D393 PolarHBondContact O-N 2.98Å; D393-R489 HydrophobicContact CB-CG 4.1Å; D393-L490 WeakPolarHBondContact OD1-CD2 3.36Å
394	L	92.8	Very high	85.8	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	141.2	-176.6	-174.7	65.8	0	0	0	110.5	L281 V282 A283 L396 Q443 L445 V482 A485 I486	L281-L394 PolarHBondContact O-N 2.73Å; V282-L394 CarbonylContact C-O 3.59Å; V282-L394 VanDerWaalsContact CA-O 3.3Å; V282-L394 WeakPolarHBondContact CA-O 3.34Å; V282-L394 HydrophobicContact CG1-CB 4.28Å; V282-L394 HydrophobicContact CG1-CD2 4.23Å; V282-L394 HydrophobicContact CG1-CG 4.41Å; V282-L394 HydrophobicContact CG2-CB 4.23Å; V282-L394 HydrophobicContact CG2-CD2 4.48Å; A283-L394 PolarHBondContact N-O 3.38Å; L394-L396 HydrophobicContact CD2-CD2 3.76Å; L394-L396 HydrophobicContact CG-CD2 3.99Å; L394-Q443 HydrophobicContact CD1-CB 4.13Å; L394-Q443 HydrophobicContact CD1-CG 4.38Å; L394-Q443 WeakPolarHBondContact CD1-O 3.45Å; L394-L445 HydrophobicContact CD1-CD1 4.03Å; L394-L445 HydrophobicContact CD1-CG 3.9Å; L394-L445 HydrophobicContact CD2-CD1 4.03Å; L394-L445 HydrophobicContact CG-CD1 4.46Å; L394-V482 HydrophobicContact CD2-CB 4.32Å; L394-V482 HydrophobicContact CD2-CG1 3.76Å; L394-V482 HydrophobicContact CD2-CG2 4.38Å; L394-A485 HydrophobicContact CD1-CB 3.69Å; L394-A485 HydrophobicContact CD2-CB 4.05Å; L394-I486 HydrophobicContact CD2-CG1 4.07Å
395	I	94.2	Very high	86	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.6	171.5	-62.2	175.4	0	0	0	108.9	A283 V285 C389 A392 L417 V422 P442 Q443 V444 L445	A283-I395 HydrophobicContact CB-CG1 4.32Å; A283-I395 CarbonylContact O-C 3.42Å; A283-I395 WeakPolarHBondContact O-CA 3.43Å; V285-I395 HydrophobicContact CB-CG2 4.48Å; V285-I395 HydrophobicContact CG1-CG2 4.15Å; V285-I395 HydrophobicContact CG2-CG2 3.52Å; C389-I395 HydrophobicContact CB-CD1 4.08Å; C389-I395 HydrophobicContact CB-CG1 4.5Å; A392-I395 HydrophobicContact CB-CG1 4.47Å; I395-L417 HydrophobicContact CD1-CD2 4.36Å; I395-V422 HydrophobicContact CD1-CG1 3.92Å; I395-V422 HydrophobicContact CD1-CG2 3.85Å; I395-P442 HydrophobicContact CD1-CB 4.12Å; I395-P442 HydrophobicContact CD1-CG 3.52Å; I395-P442 HydrophobicContact CG1-CB 4.07Å; I395-P442 HydrophobicContact CG1-CG 4.02Å; I395-Q443 PolarHBondContact N-O 3.34Å; I395-V444 HydrophobicContact CB-CG2 4.19Å; I395-V444 HydrophobicContact CD1-CG2 4.48Å; I395-V444 HydrophobicContact CG2-CG1 4.31Å; I395-V444 HydrophobicContact CG2-CG2 4.5Å; I395-V444 CarbonylContact O-C 3.58Å; I395-V444 WeakPolarHBondContact O-CA 3.34Å; I395-L445 PolarHBondContact O-N 3.34Å
396	L	95.4	Very high	86.6	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	108.1	172.5	-56	-170	0	0	0	108.5	V282 A283 V284 V285 L295 L394 I398 L445 I447 V482	V282-L396 HydrophobicContact CG1-CD1 3.72Å; V282-L396 HydrophobicContact CG1-CD2 4.11Å; V282-L396 HydrophobicContact CG1-CG 3.56Å; A283-L396 PolarHBondContact O-N 3.15Å; V284-L396 WeakPolarHBondContact CA-O 3.43Å; V284-L396 HydrophobicContact CG2-CB 4.43Å; V284-L396 HydrophobicContact CG2-CD1 4.34Å; V285-L396 PolarHBondContact N-O 3.43Å; L295-L396 HydrophobicContact CD2-CD1 4.38Å; L394-L396 HydrophobicContact CD2-CD2 3.76Å; L394-L396 HydrophobicContact CG-CD2 3.99Å; L396-I398 HydrophobicContact CB-CD1 4.18Å; L396-L445 HydrophobicContact CD2-CB 4.11Å; L396-L445 HydrophobicContact CD2-CD1 4.09Å; L396-I447 HydrophobicContact CB-CD1 3.81Å; L396-I447 HydrophobicContact CD1-CD1 4.26Å; L396-I447 HydrophobicContact CD2-CD1 4.04Å; L396-I447 HydrophobicContact CG-CD1 4.23Å; L396-V482 HydrophobicContact CD1-CG2 4.34Å; L396-V482 HydrophobicContact CD2-CG2 3.87Å
397	H	94.8	Very high	86.9	Confident	2 Å²	2	27 Å²	27	1%	0.009	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	105.3	176	-179.5	-167.9	0	0	0	109.9	V285 V413 V444 L445 K446 I447	V285-H397 HydrophobicContact CG2-CB 4.03Å; V285-H397 CarbonylContact O-C 3.55Å; V285-H397 WeakPolarHBondContact O-CA 3.28Å; H397-V413 WeakPolarHBondContact NE2-CB 3.27Å; H397-V413 WeakPolarHBondContact NE2-CG1 3.45Å; H397-V444 HydrophobicContact CB-CG1 3.9Å; H397-L445 PolarHBondContact N-O 2.77Å; H397-K446 HydrophobicContact CB-CG 4.45Å; H397-I447 PolarHBondContact O-N 3.01Å
398	I	94.8	Very high	87.1	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	126.2	-178.6	-46.8	-49.8	0	0	0	110.1	V284 V285 G286 A290 K292 L295 L396 I447 N449	V284-I398 HydrophobicContact CG1-CD1 4.27Å; V284-I398 HydrophobicContact CG1-CG1 3.61Å; V285-I398 PolarHBondContact O-N 2.96Å; G286-I398 WeakPolarHBondContact CA-O 3.4Å; A290-I398 HydrophobicContact CB-CG2 4.16Å; A290-I398 WeakPolarHBondContact O-CG2 3.4Å; K292-I398 HydrophobicContact CG-CB 4.26Å; K292-I398 HydrophobicContact CG-CG1 4.18Å; L295-I398 HydrophobicContact CD2-CD1 3.3Å; L295-I398 HydrophobicContact CD2-CG1 3.98Å; L396-I398 HydrophobicContact CB-CD1 4.18Å; I398-I447 HydrophobicContact CD1-CB 3.85Å; I398-I447 HydrophobicContact CD1-CD1 3.57Å; I398-I447 HydrophobicContact CD1-CG1 4.29Å; I398-I447 HydrophobicContact CD1-CG2 4.17Å; I398-N449 HydrophobicContact CG2-CB 3.84Å
399	V	93.5	Very high	87.5	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.024	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.1	-175.9	-176.8	0	0	0	0	108.6	V401 W406 V410 I447 N449 F463	V399-V401 PolarHBondContact O-N 3.17Å; V399-W406 HydrophobicContact CG1-CB 3.93Å; V399-W406 HydrophobicContact CG1-CD2 4.23Å; V399-W406 HydrophobicContact CG1-CE3 3.74Å; V399-W406 HydrophobicContact CG1-CG 4.37Å; V399-V410 HydrophobicContact CB-CG2 4.19Å; V399-V410 HydrophobicContact CG1-CG2 3.62Å; V399-V410 HydrophobicContact CG2-CG2 3.44Å; V399-V410 VanDerWaalsContact CG2-CG2 3.44Å; V399-I447 PolarHBondContact N-O 2.92Å; V399-N449 PolarHBondContact O-N 3.1Å; V399-F463 HydrophobicContact CB-CE1 3.78Å; V399-F463 HydrophobicContact CB-CZ 4.27Å; V399-F463 HydrophobicContact CG1-CE1 4.08Å; V399-F463 HydrophobicContact CG1-CZ 4.08Å; V399-F463 HydrophobicContact CG2-CE1 3.91Å
400	D	91.5	Very high	87.8	Confident	4 Å²	4	27 Å²	27	2%	0.021	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	103.4	170.7	-171.9	-13.1	0	0	0	109.4	S402 Q403 W406 K450	D400-S402 PolarHBondContact O-N 2.77Å; D400-S402 WeakPolarHBondContact OD1-CB 3.37Å; D400-S402 PolarHBondContact OD1-N 3.03Å; D400-S402 PolarHBondContact OD1-OG 2.87Å; D400-S402 PolarHBondContact OD2-OG 3.46Å; D400-Q403 HydrophobicContact CB-CG 3.99Å; D400-Q403 PolarHBondContact O-N 2.89Å; D400-W406 VanDerWaalsContact O-CB 3.29Å; D400-W406 WeakPolarHBondContact O-CB 3.41Å; D400-K450 WeakPolarHBondContact OD1-CD 3.42Å; D400-K450 WeakPolarHBondContact OD2-CD 3.4Å; D400-K450 VanDerWaalsContact OD2-CE 3.27Å; D400-K450 WeakPolarHBondContact OD2-CE 3.26Å; D400-K450 IonicContact OD2-NZ 2.71Å; D400-K450 PolarHBondContact OD2-NZ 3.41Å
401	V	91.1	Very high	87.9	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.012	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-11.7	-179.4	-78	0	0	0	0	113.1	V399 Q403 N449 V451 I454 Y460 F463	V399-V401 PolarHBondContact O-N 3.17Å; V401-Q403 PolarHBondContact O-N 2.89Å; V401-N449 WeakPolarHBondContact CG2-O 3.4Å; V401-N449 PolarHBondContact N-O 2.8Å; V401-V451 HydrophobicContact CG2-CG1 3.95Å; V401-I454 HydrophobicContact CB-CD1 3.49Å; V401-I454 VanDerWaalsContact CB-CD1 3.49Å; V401-I454 HydrophobicContact CG2-CD1 3.21Å; V401-I454 WeakPolarHBondContact O-CD1 3.49Å; V401-Y460 HydrophobicContact CB-CD1 4.12Å; V401-Y460 HydrophobicContact CB-CE1 3.9Å; V401-Y460 HydrophobicContact CG1-CD1 3.9Å; V401-Y460 HydrophobicContact CG1-CE1 4.17Å; V401-Y460 HydrophobicContact CG1-CG 4.43Å; V401-Y460 PolarHBondContact O-OH 2.74Å; V401-F463 HydrophobicContact CG1-CE1 4.16Å; V401-F463 HydrophobicContact CG1-CE2 3.67Å; V401-F463 HydrophobicContact CG1-CZ 3.43Å; V401-F463 VanDerWaalsContact CG1-CZ 3.43Å
402	S	86.9	Confident	88.1	Confident	33 Å²	33	31 Å²	31	23%	0.231	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-12.4	176.4	73.9	0	0	0	0	113	D400	D400-S402 PolarHBondContact O-N 2.77Å; D400-S402 WeakPolarHBondContact OD1-CB 3.37Å; D400-S402 PolarHBondContact OD1-N 3.03Å; D400-S402 PolarHBondContact OD1-OG 2.87Å; D400-S402 PolarHBondContact OD2-OG 3.46Å
403	Q	83.1	Confident	88	Confident	21 Å²	21	31 Å²	31	10%	0.098	16%	0.163	C	C	.	.	S	Bend	trans	-85.7	129	178	-64.8	-61.6	-40.3	0	0	111	N74 D400 V401 E405 W406	N74-Q403 PolarHBondContact ND2-NE2 2.94Å; N74-Q403 PolarHBondContact ND2-OE1 2.81Å; N74-Q403 VanDerWaalsContact ND2-OE1 3.14Å; D400-Q403 HydrophobicContact CB-CG 3.99Å; D400-Q403 PolarHBondContact O-N 2.89Å; V401-Q403 PolarHBondContact O-N 2.89Å; Q403-E405 VanDerWaalsContact C-N 3.25Å; Q403-E405 PolarHBondContact O-N 3.33Å; Q403-W406 HydrophobicContact CB-CB 4.48Å; Q403-W406 WeakPolarHBondContact O-CB 3.47Å; Q403-W406 PolarHBondContact O-N 3.11Å
404	P	80.1	Confident	87.9	Confident	97 Å²	97	30.8 Å²	30.8	63%	0.63	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-30.8	-178.5	15.8	-21.7	0	0	0	113.5
405	E	77.9	Confident	87.5	Confident	73 Å²	73	36.4 Å²	36.4	34%	0.341	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	23.7	178.6	-58.5	74.8	-158	0	0	114.2	Q403 Q407 L408 Q409	Q403-E405 VanDerWaalsContact C-N 3.25Å; Q403-E405 PolarHBondContact O-N 3.33Å; E405-Q407 PolarHBondContact O-N 3.42Å; E405-Q407 VanDerWaalsContact O-N 3.13Å; E405-L408 HydrophobicContact CB-CD1 4.25Å; E405-L408 HydrophobicContact CG-CD1 4.42Å; E405-L408 PolarHBondContact O-N 3.44Å; E405-Q409 PolarHBondContact O-N 2.77Å
406	W	85.8	Confident	87	Confident	29 Å²	29	36.9 Å²	36.9	11%	0.11	19%	0.19	C	C	.	.	H	α-helix	trans	-57.1	-31.8	-176.6	72.6	-102.8	0	0	0	113.1	V399 D400 Q403 L408 Q409 V410 Y460 F463	V399-W406 HydrophobicContact CG1-CB 3.93Å; V399-W406 HydrophobicContact CG1-CD2 4.23Å; V399-W406 HydrophobicContact CG1-CE3 3.74Å; V399-W406 HydrophobicContact CG1-CG 4.37Å; D400-W406 VanDerWaalsContact O-CB 3.29Å; D400-W406 WeakPolarHBondContact O-CB 3.41Å; Q403-W406 HydrophobicContact CB-CB 4.48Å; Q403-W406 WeakPolarHBondContact O-CB 3.47Å; Q403-W406 PolarHBondContact O-N 3.11Å; W406-L408 VanDerWaalsContact C-N 3.32Å; W406-L408 PolarHBondContact O-N 2.9Å; W406-Q409 WeakPolarHBondContact O-CB 3.48Å; W406-Q409 PolarHBondContact O-N 3.21Å; W406-V410 HydrophobicContact CE3-CB 4.49Å; W406-V410 HydrophobicContact CE3-CG2 3.68Å; W406-V410 HydrophobicContact CZ3-CG2 3.91Å; W406-V410 WeakPolarHBondContact O-CG2 3.16Å; W406-V410 PolarHBondContact O-N 3.42Å; W406-Y460 AromaticContact CE2-CD1 3.99Å; W406-Y460 AromaticContact CZ2-CD1 3.89Å; W406-Y460 HydrophobicContact CZ2-CD1 3.89Å; W406-Y460 AromaticContact NE1-CD1 3.78Å; W406-Y460 AromaticContact NE1-CE1 3.53Å; W406-F463 HydrophobicContact CD2-CZ 4.13Å; W406-F463 HydrophobicContact CE3-CE2 4.31Å; W406-F463 AromaticContact CE3-CZ 3.63Å; W406-F463 HydrophobicContact CE3-CZ 3.63Å; W406-F463 HydrophobicContact CH2-CD2 4.38Å; W406-F463 AromaticContact CH2-CE2 3.29Å; W406-F463 HydrophobicContact CH2-CE2 3.29Å; W406-F463 AromaticContact CH2-CZ 3.43Å; W406-F463 HydrophobicContact CH2-CZ 3.43Å; W406-F463 VanDerWaalsContact CH2-CZ 3.43Å; W406-F463 AromaticContact CZ2-CE2 3.61Å; W406-F463 HydrophobicContact CZ2-CE2 3.61Å; W406-F463 AromaticContact CZ2-CZ 3.93Å; W406-F463 HydrophobicContact CZ2-CZ 3.93Å; W406-F463 HydrophobicContact CZ3-CE1 4.18Å; W406-F463 AromaticContact CZ3-CE2 3.69Å; W406-F463 HydrophobicContact CZ3-CE2 3.69Å; W406-F463 AromaticContact CZ3-CZ 3.26Å; W406-F463 HydrophobicContact CZ3-CZ 3.26Å
407	Q	86.2	Confident	86.5	Confident	88 Å²	88	37 Å²	37	41%	0.411	19%	0.19	S	C	.	.	H	α-helix	trans	-64.7	-35.8	178.1	-65	83.8	-2.2	0	0	112.4	E405 Q409 V410 N411	E405-Q407 PolarHBondContact O-N 3.42Å; E405-Q407 VanDerWaalsContact O-N 3.13Å; Q407-Q409 VanDerWaalsContact C-N 3.34Å; Q407-V410 PolarHBondContact O-N 2.9Å; Q407-N411 PolarHBondContact O-N 3.09Å; Q407-N411 PolarHBondContact O-ND2 3.27Å
408	L	83.4	Confident	86.1	Confident	89 Å²	89	40 Å²	40	47%	0.466	21%	0.211	S	C	.	.	H	α-helix	trans	-67.3	-39.5	176.3	-68.1	178.1	0	0	0	110.9	N71 E405 W406 N411 H412	N71-L408 WeakPolarHBondContact OD1-CB 3.4Å; E405-L408 HydrophobicContact CB-CD1 4.25Å; E405-L408 HydrophobicContact CG-CD1 4.42Å; E405-L408 PolarHBondContact O-N 3.44Å; W406-L408 VanDerWaalsContact C-N 3.32Å; W406-L408 PolarHBondContact O-N 2.9Å; L408-N411 PolarHBondContact O-N 3.3Å; L408-H412 WeakPolarHBondContact O-CB 3.45Å; L408-H412 PolarHBondContact O-N 3.28Å
409	Q	84.9	Confident	85.5	Confident	19 Å²	19	43.5 Å²	43.5	9%	0.089	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-45.3	173.8	-66.4	-176.7	16.8	0	0	111.1	Y287 E405 W406 Q407 H412 V413	Y287-Q409 HydrophobicContact CD1-CG 4.38Å; Y287-Q409 HydrophobicContact CD2-CB 3.63Å; Y287-Q409 HydrophobicContact CD2-CG 3.98Å; Y287-Q409 HydrophobicContact CE1-CG 4.14Å; Y287-Q409 HydrophobicContact CE2-CB 3.4Å; Y287-Q409 VanDerWaalsContact CE2-CB 3.4Å; Y287-Q409 HydrophobicContact CE2-CG 3.74Å; Y287-Q409 WeakPolarHBondContact CE2-O 3.35Å; Y287-Q409 HydrophobicContact CG-CB 4.38Å; Y287-Q409 HydrophobicContact CG-CG 4.29Å; E405-Q409 PolarHBondContact O-N 2.77Å; W406-Q409 WeakPolarHBondContact O-CB 3.48Å; W406-Q409 PolarHBondContact O-N 3.21Å; Q407-Q409 VanDerWaalsContact C-N 3.34Å; Q409-H412 PolarHBondContact O-N 2.94Å; Q409-V413 WeakPolarHBondContact O-CG2 3.31Å; Q409-V413 PolarHBondContact O-N 2.81Å
410	V	87.7	Confident	85	Confident	8 Å²	8	44.6 Å²	44.6	5%	0.048	24%	0.241	C	C	.	.	H	α-helix	trans	-57	-54.8	175.5	168.1	0	0	0	0	110.6	V399 W406 Q407 H412 V413 E414	V399-V410 HydrophobicContact CB-CG2 4.19Å; V399-V410 HydrophobicContact CG1-CG2 3.62Å; V399-V410 HydrophobicContact CG2-CG2 3.44Å; V399-V410 VanDerWaalsContact CG2-CG2 3.44Å; W406-V410 HydrophobicContact CE3-CB 4.49Å; W406-V410 HydrophobicContact CE3-CG2 3.68Å; W406-V410 HydrophobicContact CZ3-CG2 3.91Å; W406-V410 WeakPolarHBondContact O-CG2 3.16Å; W406-V410 PolarHBondContact O-N 3.42Å; Q407-V410 PolarHBondContact O-N 2.9Å; V410-H412 PolarHBondContact O-N 3.46Å; V410-V413 PolarHBondContact O-N 2.93Å; V410-V413 VanDerWaalsContact O-N 3.1Å; V410-E414 HydrophobicContact CG1-CG 3.99Å; V410-E414 WeakPolarHBondContact CG1-OE1 3.41Å; V410-E414 VanDerWaalsContact O-CG 3.29Å; V410-E414 WeakPolarHBondContact O-CG 3.45Å; V410-E414 PolarHBondContact O-N 3.24Å
411	N	86.9	Confident	84.5	Confident	95 Å²	95	46.6 Å²	46.6	51%	0.508	26%	0.263	S	S	.	.	H	α-helix	trans	-56.2	-39.1	-179	-68.4	-19.3	0	0	0	112.2	Q407 L408 E415	Q407-N411 PolarHBondContact O-N 3.09Å; Q407-N411 PolarHBondContact O-ND2 3.27Å; L408-N411 PolarHBondContact O-N 3.3Å; N411-E415 VanDerWaalsContact O-CB 3.27Å; N411-E415 WeakPolarHBondContact O-CB 3.09Å; N411-E415 PolarHBondContact O-N 3Å
412	H	83.4	Confident	84.1	Confident	51 Å²	51	46.7 Å²	46.7	24%	0.236	26%	0.263	C	S	.	.	H	α-helix	trans	-67.2	-43.5	177.9	-179.3	-126.3	0	0	0	112.8	Y287 L408 Q409 V410 E415 L416	Y287-H412 AromaticContact CZ-ND1 3.82Å; Y287-H412 PolarHBondContact OH-ND1 3.08Å; L408-H412 WeakPolarHBondContact O-CB 3.45Å; L408-H412 PolarHBondContact O-N 3.28Å; Q409-H412 PolarHBondContact O-N 2.94Å; V410-H412 PolarHBondContact O-N 3.46Å; H412-E415 PolarHBondContact O-N 3.49Å; H412-L416 WeakPolarHBondContact O-CG 3.43Å; H412-L416 PolarHBondContact O-N 2.53Å; H412-L416 VanDerWaalsContact O-N 3.09Å
413	V	85.1	Confident	83.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.6	-43.1	175.6	176.2	0	0	0	0	110.6	V285 Y287 F370 H397 Q409 V410 E415 L416 L417	V285-V413 HydrophobicContact CG2-CG1 4.44Å; Y287-V413 HydrophobicContact CD2-CG2 3.9Å; Y287-V413 HydrophobicContact CE2-CG2 3.77Å; F370-V413 HydrophobicContact CD2-CG1 4.49Å; F370-V413 HydrophobicContact CD2-CG2 3.54Å; F370-V413 HydrophobicContact CE2-CB 4.14Å; F370-V413 HydrophobicContact CE2-CG1 3.64Å; F370-V413 HydrophobicContact CE2-CG2 3.51Å; F370-V413 HydrophobicContact CG-CG2 4.14Å; F370-V413 HydrophobicContact CZ-CB 4.37Å; F370-V413 HydrophobicContact CZ-CG1 3.91Å; F370-V413 HydrophobicContact CZ-CG2 4.03Å; H397-V413 WeakPolarHBondContact NE2-CB 3.27Å; H397-V413 WeakPolarHBondContact NE2-CG1 3.45Å; Q409-V413 WeakPolarHBondContact O-CG2 3.31Å; Q409-V413 PolarHBondContact O-N 2.81Å; V410-V413 PolarHBondContact O-N 2.93Å; V410-V413 VanDerWaalsContact O-N 3.1Å; V413-E415 VanDerWaalsContact C-N 3.34Å; V413-E415 PolarHBondContact O-N 2.84Å; V413-L416 PolarHBondContact O-N 2.93Å; V413-L417 HydrophobicContact CG1-CD1 4.04Å; V413-L417 HydrophobicContact CG1-CG 4.28Å; V413-L417 WeakPolarHBondContact O-CB 3.44Å; V413-L417 WeakPolarHBondContact O-CG 3.43Å; V413-L417 PolarHBondContact O-N 3.14Å
414	E	87.5	Confident	83	Confident	30 Å²	30	49.4 Å²	49.4	14%	0.14	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-39.2	177.4	-63.6	-166.7	172.1	0	0	111.9	V410 L416 L417 C418 V424 K446	V410-E414 HydrophobicContact CG1-CG 3.99Å; V410-E414 WeakPolarHBondContact CG1-OE1 3.41Å; V410-E414 VanDerWaalsContact O-CG 3.29Å; V410-E414 WeakPolarHBondContact O-CG 3.45Å; V410-E414 PolarHBondContact O-N 3.24Å; E414-L416 VanDerWaalsContact C-N 3.34Å; E414-L416 PolarHBondContact O-N 2.94Å; E414-L417 PolarHBondContact O-N 2.91Å; E414-C418 WeakPolarHBondContact O-CB 3.46Å; E414-C418 PolarHBondContact O-N 3.29Å; E414-C418 PolarHBondContact O-SG 2.81Å; E414-V424 HydrophobicContact CB-CB 4.33Å; E414-V424 HydrophobicContact CB-CG1 4.27Å; E414-V424 HydrophobicContact CB-CG2 4.2Å; E414-V424 VanDerWaalsContact CD-CG1 3.46Å; E414-V424 HydrophobicContact CG-CB 4.26Å; E414-V424 HydrophobicContact CG-CG1 3.66Å; E414-V424 HydrophobicContact CG-CG2 4.36Å; E414-V424 WeakPolarHBondContact OE1-CG1 3.48Å; E414-K446 WeakPolarHBondContact OE1-CD 3.33Å; E414-K446 IonicContact OE1-NZ 2.63Å; E414-K446 PolarHBondContact OE1-NZ 2.97Å
415	E	84.2	Confident	82.2	Confident	118 Å²	118	49.2 Å²	49.2	55%	0.551	27%	0.273	S	S	*	.	H	α-helix	trans	-61.4	-41.9	173.9	-175.4	179.2	-170.8	0	0	111.4	N411 H412 V413 C418 S419	N411-E415 VanDerWaalsContact O-CB 3.27Å; N411-E415 WeakPolarHBondContact O-CB 3.09Å; N411-E415 PolarHBondContact O-N 3Å; H412-E415 PolarHBondContact O-N 3.49Å; V413-E415 VanDerWaalsContact C-N 3.34Å; V413-E415 PolarHBondContact O-N 2.84Å; E415-C418 PolarHBondContact O-N 2.92Å; E415-S419 WeakPolarHBondContact O-CB 3.27Å; E415-S419 PolarHBondContact O-N 3.25Å
416	L	82.6	Confident	81	Confident	10 Å²	10	53.5 Å²	53.5	5%	0.052	29%	0.29	C	S	.	.	H	α-helix	trans	-70	-41.9	177.8	-71	174.5	0	0	0	112.5	F370 L386 H412 V413 E414 C418 S419 I420	F370-L416 HydrophobicContact CD1-CD1 3.87Å; F370-L416 HydrophobicContact CE1-CB 4.45Å; F370-L416 HydrophobicContact CE1-CD1 3.36Å; F370-L416 HydrophobicContact CZ-CD1 4.33Å; L386-L416 HydrophobicContact CD1-CB 4.35Å; H412-L416 WeakPolarHBondContact O-CG 3.43Å; H412-L416 PolarHBondContact O-N 2.53Å; H412-L416 VanDerWaalsContact O-N 3.09Å; V413-L416 PolarHBondContact O-N 2.93Å; E414-L416 VanDerWaalsContact C-N 3.34Å; E414-L416 PolarHBondContact O-N 2.94Å; L416-C418 VanDerWaalsContact C-N 3.34Å; L416-S419 PolarHBondContact O-N 3.37Å; L416-S419 PolarHBondContact O-OG 3.03Å; L416-I420 PolarHBondContact O-N 3.32Å
417	L	85.9	Confident	78.9	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-59.2	-46	172.7	-75	176.7	0	0	0	110.8	V285 I395 V413 E414 S419 I420 G421 V422 V424	V285-L417 HydrophobicContact CG2-CD1 4.42Å; I395-L417 HydrophobicContact CD1-CD2 4.36Å; V413-L417 HydrophobicContact CG1-CD1 4.04Å; V413-L417 HydrophobicContact CG1-CG 4.28Å; V413-L417 WeakPolarHBondContact O-CB 3.44Å; V413-L417 WeakPolarHBondContact O-CG 3.43Å; V413-L417 PolarHBondContact O-N 3.14Å; E414-L417 PolarHBondContact O-N 2.91Å; L417-S419 VanDerWaalsContact C-N 3.31Å; L417-S419 PolarHBondContact O-N 3.21Å; L417-I420 PolarHBondContact O-N 2.58Å; L417-G421 PolarHBondContact O-N 3.31Å; L417-G421 VanDerWaalsContact O-N 3.17Å; L417-V422 HydrophobicContact CB-CB 4Å; L417-V422 HydrophobicContact CB-CG1 4.29Å; L417-V422 HydrophobicContact CD2-CB 4.41Å; L417-V422 HydrophobicContact CD2-CG2 4.25Å; L417-V422 WeakPolarHBondContact O-CB 3.46Å; L417-V422 PolarHBondContact O-N 3.36Å; L417-V424 HydrophobicContact CB-CG2 3.82Å; L417-V424 HydrophobicContact CD1-CG2 4.04Å
418	C	86.5	Confident	76.6	Confident	66 Å²	66	57.6 Å²	57.6	45%	0.446	33%	0.328	S	S	.	.	H	α-helix	trans	-59.4	-40.9	173.8	-70.1	0	0	0	0	112	E414 E415 L416 I420 G421 V422	E414-C418 WeakPolarHBondContact O-CB 3.46Å; E414-C418 PolarHBondContact O-N 3.29Å; E414-C418 PolarHBondContact O-SG 2.81Å; E415-C418 PolarHBondContact O-N 2.92Å; L416-C418 VanDerWaalsContact C-N 3.34Å; C418-I420 PolarHBondContact O-N 3.24Å; C418-G421 PolarHBondContact O-N 2.99Å; C418-V422 WeakPolarHBondContact CA-O 3.37Å
419	S	82.1	Confident	74.4	Confident	74 Å²	74	59.5 Å²	59.5	52%	0.517	34%	0.339	S	S	.	.	H	α-helix	trans	-63.2	-24.6	-179.6	79.5	0	0	0	0	113.9	E415 L416 L417	E415-S419 WeakPolarHBondContact O-CB 3.27Å; E415-S419 PolarHBondContact O-N 3.25Å; L416-S419 PolarHBondContact O-N 3.37Å; L416-S419 PolarHBondContact O-OG 3.03Å; L417-S419 VanDerWaalsContact C-N 3.31Å; L417-S419 PolarHBondContact O-N 3.21Å
420	I	81.8	Confident	72.2	Confident	28 Å²	28	63.3 Å²	63.3	14%	0.144	37%	0.367	C	S	.	.	H	α-helix	trans	-94.3	-13.4	178.9	-68.5	169.2	0	0	0	111.4	L386 D387 L390 L416 L417 C418	L386-I420 HydrophobicContact CB-CD1 3.29Å; L386-I420 HydrophobicContact CD1-CD1 3.67Å; L386-I420 HydrophobicContact CG-CD1 4.19Å; D387-I420 WeakPolarHBondContact OD1-CG2 3.28Å; L390-I420 HydrophobicContact CD1-CG2 3.47Å; L390-I420 VanDerWaalsContact CD1-CG2 3.47Å; L390-I420 WeakPolarHBondContact CD1-O 3.19Å; L390-I420 HydrophobicContact CD2-CG2 4.1Å; L390-I420 HydrophobicContact CG-CG2 3.61Å; L416-I420 PolarHBondContact O-N 3.32Å; L417-I420 PolarHBondContact O-N 2.58Å; C418-I420 PolarHBondContact O-N 3.24Å
421	G	81.3	Confident	69.7	Low	46 Å²	46	66.2 Å²	66.2	47%	0.474	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.2	12	176.4	0	0	0	0	0	115	L417 C418	L417-G421 PolarHBondContact O-N 3.31Å; L417-G421 VanDerWaalsContact O-N 3.17Å; C418-G421 PolarHBondContact O-N 2.99Å
422	V	83.1	Confident	67.3	Low	3 Å²	3	69.4 Å²	69.4	2%	0.018	41%	0.41	C	S	.	.			trans	-82.6	125	170	176.7	0	0	0	0	109.1	L390 I395 L417 C418 V424 P442 V444	L390-V422 HydrophobicContact CD2-CG2 3.6Å; L390-V422 HydrophobicContact CG-CG2 4.39Å; I395-V422 HydrophobicContact CD1-CG1 3.92Å; I395-V422 HydrophobicContact CD1-CG2 3.85Å; L417-V422 HydrophobicContact CB-CB 4Å; L417-V422 HydrophobicContact CB-CG1 4.29Å; L417-V422 HydrophobicContact CD2-CB 4.41Å; L417-V422 HydrophobicContact CD2-CG2 4.25Å; L417-V422 WeakPolarHBondContact O-CB 3.46Å; L417-V422 PolarHBondContact O-N 3.36Å; C418-V422 WeakPolarHBondContact CA-O 3.37Å; V422-V424 HydrophobicContact CG1-CG2 4.38Å; V422-V424 PolarHBondContact O-N 2.9Å; V422-P442 HydrophobicContact CG1-CG 4.43Å; V422-P442 HydrophobicContact CG2-CG 4.16Å; V422-V444 HydrophobicContact CG1-CG2 3.49Å; V422-V444 VanDerWaalsContact CG1-CG2 3.49Å
423	L	76	Confident	65.1	Low	95 Å²	95	72.1 Å²	72.1	50%	0.497	43%	0.431	S	S	.	.			trans	-85.5	109	176	-174.1	70.7	0	0	0	110.1	P441	L423-P441 HydrophobicContact CB-CB 4.49Å; L423-P441 HydrophobicContact CB-CG 3.74Å
424	V	70.5	Confident	62.8	Low	17 Å²	17	77.3 Å²	77.3	10%	0.103	47%	0.467	C	S	.	.			trans	-90.6	-27.2	-178.9	-168.6	0	0	0	0	113.1	E414 L417 V422 K426 V444	E414-V424 HydrophobicContact CB-CB 4.33Å; E414-V424 HydrophobicContact CB-CG1 4.27Å; E414-V424 HydrophobicContact CB-CG2 4.2Å; E414-V424 VanDerWaalsContact CD-CG1 3.46Å; E414-V424 HydrophobicContact CG-CB 4.26Å; E414-V424 HydrophobicContact CG-CG1 3.66Å; E414-V424 HydrophobicContact CG-CG2 4.36Å; E414-V424 WeakPolarHBondContact OE1-CG1 3.48Å; L417-V424 HydrophobicContact CB-CG2 3.82Å; L417-V424 HydrophobicContact CD1-CG2 4.04Å; V422-V424 HydrophobicContact CG1-CG2 4.38Å; V422-V424 PolarHBondContact O-N 2.9Å; V424-K426 PolarHBondContact O-N 2.66Å; V424-V444 HydrophobicContact CG1-CB 4.34Å; V424-V444 HydrophobicContact CG1-CG1 4.33Å; V424-V444 HydrophobicContact CG2-CG2 4.27Å
425	T	63.9	Low	60.7	Low	92 Å²	92	81.6 Å²	81.6	56%	0.564	49%	0.491	S	S	*	.	S	Bend	trans	-71.8	132.7	178.3	50.8	0	0	0	0	110.4	S427	T425-S427 PolarHBondContact O-N 3.33Å
426	K	53.4	Low	58.9	Low	163 Å²	163	81.8 Å²	81.8	71%	0.709	51%	0.505	S	S	*	.			trans	-65.7	83.3	165.9	-65.2	-179.2	-179	178.4	0	106.7	V424 T428 D464	V424-K426 PolarHBondContact O-N 2.66Å; K426-T428 PolarHBondContact O-N 3.01Å; K426-D464 IonicContact NZ-OD1 3.9Å; K426-D464 PolarHBondContact NZ-OD1 2.87Å
427	S	41.3	Very low	57.1	Low	72 Å²	72	89.1 Å²	89.1	50%	0.503	54%	0.544	S	S	.	.			trans	-63.6	109	-179.1	-171.9	0	0	0	0	109.1	T425 N429	T425-S427 PolarHBondContact O-N 3.33Å; S427-N429 PolarHBondContact OG-N 2.98Å; S427-N429 VanDerWaalsContact OG-N 3.15Å; S427-N429 PolarHBondContact OG-O 3.32Å
428	T	37.2	Very low	55.4	Low	131 Å²	131	93.9 Å²	93.9	80%	0.804	57%	0.574	S	S	*	*	S	Bend	trans	-78.8	1	161.1	45.8	0	0	0	0	112.1	K426	K426-T428 PolarHBondContact O-N 3.01Å
429	N	37.9	Very low	54.2	Low	130 Å²	130	94.5 Å²	94.5	70%	0.695	57%	0.569	S	S	*	*			trans	-125.4	92.6	-178.3	-69.2	-12.5	0	0	0	110.5	S427 G431	S427-N429 PolarHBondContact OG-N 2.98Å; S427-N429 VanDerWaalsContact OG-N 3.15Å; S427-N429 PolarHBondContact OG-O 3.32Å; N429-G431 VanDerWaalsContact C-N 3.26Å; N429-G431 PolarHBondContact O-N 2.93Å
430	S	37.9	Very low	53.7	Low	98 Å²	98	97.6 Å²	97.6	69%	0.685	58%	0.575	S	S	*	*			trans	-61.9	83.4	163.9	52	0	0	0	0	110.5	H432	S430-H432 PolarHBondContact O-N 2.88Å
431	G	35.9	Very low	53.4	Low	69 Å²	69	98 Å²	98	71%	0.711	58%	0.58	S	S	*	*			trans	-77.1	92.5	155.3	0	0	0	0	0	108	N429 T433	N429-G431 VanDerWaalsContact C-N 3.26Å; N429-G431 PolarHBondContact O-N 2.93Å; G431-T433 PolarHBondContact O-N 3Å
432	H	35.9	Very low	53.6	Low	162 Å²	162	96 Å²	96	75%	0.75	56%	0.558	S	S	*	*			trans	-61	102.9	172.3	-72.4	-72.3	0	0	0	109.8	S430	S430-H432 PolarHBondContact O-N 2.88Å
433	T	37.2	Very low	53.9	Low	109 Å²	109	99.6 Å²	99.6	67%	0.669	58%	0.575	S	S	*	*			trans	-91.2	100	153	52.2	0	0	0	0	107.1	G431 D435	G431-T433 PolarHBondContact O-N 3Å; T433-D435 PolarHBondContact O-N 3.42Å
434	S	37.1	Very low	54.7	Low	109 Å²	109	96 Å²	96	76%	0.762	56%	0.556	S	S	*	*			trans	-70.9	62.6	179.2	-54.1	0	0	0	0	111.9
435	D	42.1	Very low	55.8	Low	119 Å²	119	95.5 Å²	95.5	64%	0.636	55%	0.554	S	S	*	*			trans	-96.5	109.8	165.4	-79.9	-11.7	0	0	0	108.2	T433 N437 T438	T433-D435 PolarHBondContact O-N 3.42Å; D435-N437 PolarHBondContact O-N 3.03Å; D435-T438 PolarHBondContact O-N 3.37Å; D435-T438 VanDerWaalsContact O-N 3.11Å; D435-T438 PolarHBondContact O-OG1 3.42Å
436	S	47.5	Very low	57.3	Low	122 Å²	122	93.6 Å²	93.6	85%	0.853	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	13.5	-165.2	52.6	0	0	0	0	117.4
437	N	44.5	Very low	59.4	Low	164 Å²	164	85.8 Å²	85.8	88%	0.877	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.8	20.8	174.2	-85	-29.6	0	0	0	112.7	D435 F439	D435-N437 PolarHBondContact O-N 3.03Å; N437-F439 PolarHBondContact O-N 3.22Å
438	T	50.9	Low	62	Low	102 Å²	102	82.4 Å²	82.4	63%	0.626	48%	0.479	S	S	*	.			trans	-69.5	105.8	-177.7	18.4	0	0	0	0	110.9	D435 E440	D435-T438 PolarHBondContact O-N 3.37Å; D435-T438 VanDerWaalsContact O-N 3.11Å; D435-T438 PolarHBondContact O-OG1 3.42Å; T438-E440 PolarHBondContact O-N 3.17Å
439	F	60.6	Low	64.7	Low	80 Å²	80	76.3 Å²	76.3	35%	0.351	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-59.9	122.2	168.2	175.1	-123.9	0	0	0	109.8	R271 L390 N437 P441	R271-F439 VanDerWaalsContact CZ-CD2 3.44Å; R271-F439 VanDerWaalsContact NH1-CD2 3.34Å; R271-F439 VanDerWaalsContact NH1-CE2 3.25Å; L390-F439 VanDerWaalsContact O-CE1 3.22Å; L390-F439 WeakPolarHBondContact O-CE1 3.49Å; L390-F439 VanDerWaalsContact O-CZ 3.22Å; L390-F439 WeakPolarHBondContact O-CZ 3.3Å; N437-F439 PolarHBondContact O-N 3.22Å; F439-P441 WeakPolarHBondContact O-CD 3.5Å
440	E	70.7	Confident	67.3	Low	139 Å²	139	71 Å²	71	65%	0.65	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-69.1	121.6	173.2	-171.2	-174.5	-161	0	0	108.7	T438 R489	T438-E440 PolarHBondContact O-N 3.17Å; E440-R489 PolarHBondContact O-NH1 2.87Å; E440-R489 PolarHBondContact O-NH2 2.71Å; E440-R489 IonicContact OE2-NH1 3.8Å; E440-R489 PolarHBondContact OE2-NH1 3.35Å
441	P	77.4	Confident	69.9	Low	37 Å²	37	68.2 Å²	68.2	24%	0.24	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-64.2	156.4	-179.1	26.6	-33.9	0	0	0	111.7	L423 F439 R489	L423-P441 HydrophobicContact CB-CB 4.49Å; L423-P441 HydrophobicContact CB-CG 3.74Å; F439-P441 WeakPolarHBondContact O-CD 3.5Å; P441-R489 PolarHBondContact O-NH1 2.89Å
442	P	83.9	Confident	72.5	Confident	2 Å²	2	68 Å²	68	1%	0.013	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-61.9	144.2	175	23.6	-32.4	0	0	0	111.9	A392 I395 V422	A392-P442 WeakPolarHBondContact O-CB 3.31Å; I395-P442 HydrophobicContact CD1-CB 4.12Å; I395-P442 HydrophobicContact CD1-CG 3.52Å; I395-P442 HydrophobicContact CG1-CB 4.07Å; I395-P442 HydrophobicContact CG1-CG 4.02Å; V422-P442 HydrophobicContact CG1-CG 4.43Å; V422-P442 HydrophobicContact CG2-CG 4.16Å
443	Q	89.7	Confident	75	Confident	80 Å²	80	66.7 Å²	66.7	37%	0.374	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	140.6	170.7	-177.6	177.9	-17.4	0	0	109.8	L394 I395	L394-Q443 HydrophobicContact CD1-CB 4.13Å; L394-Q443 HydrophobicContact CD1-CG 4.38Å; L394-Q443 WeakPolarHBondContact CD1-O 3.45Å; I395-Q443 PolarHBondContact N-O 3.34Å
444	V	92.9	Very high	77.3	Confident	18 Å²	18	63.1 Å²	63.1	11%	0.109	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.8	173.8	-173.4	0	0	0	0	109.4	I395 H397 V422 V424	I395-V444 HydrophobicContact CB-CG2 4.19Å; I395-V444 HydrophobicContact CD1-CG2 4.48Å; I395-V444 HydrophobicContact CG2-CG1 4.31Å; I395-V444 HydrophobicContact CG2-CG2 4.5Å; I395-V444 CarbonylContact O-C 3.58Å; I395-V444 WeakPolarHBondContact O-CA 3.34Å; H397-V444 HydrophobicContact CB-CG1 3.9Å; V422-V444 HydrophobicContact CG1-CG2 3.49Å; V422-V444 VanDerWaalsContact CG1-CG2 3.49Å; V424-V444 HydrophobicContact CG1-CB 4.34Å; V424-V444 HydrophobicContact CG1-CG1 4.33Å; V424-V444 HydrophobicContact CG2-CG2 4.27Å
445	L	94.4	Very high	79.2	Confident	8 Å²	8	60.3 Å²	60.3	4%	0.042	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.6	168.8	-66.6	-179.6	0	0	0	109.8	L394 I395 L396 H397 D464 V482 A485	L394-L445 HydrophobicContact CD1-CD1 4.03Å; L394-L445 HydrophobicContact CD1-CG 3.9Å; L394-L445 HydrophobicContact CD2-CD1 4.03Å; L394-L445 HydrophobicContact CG-CD1 4.46Å; I395-L445 PolarHBondContact O-N 3.34Å; L396-L445 HydrophobicContact CD2-CB 4.11Å; L396-L445 HydrophobicContact CD2-CD1 4.09Å; H397-L445 PolarHBondContact N-O 2.77Å; L445-D464 WeakPolarHBondContact CA-OD2 3.21Å; L445-D464 HydrophobicContact CB-CB 4.46Å; L445-D464 HydrophobicContact CD2-CB 4Å; L445-V482 HydrophobicContact CD1-CG2 4.18Å; L445-A485 HydrophobicContact CD1-CB 4.13Å
446	K	95.3	Very high	80.6	Confident	51 Å²	51	60.5 Å²	60.5	22%	0.222	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	122.7	178.7	-65.9	-166	-75.3	-168.2	0	110.6	H397 E414 G462 F463 D464 A465	H397-K446 HydrophobicContact CB-CG 4.45Å; E414-K446 WeakPolarHBondContact OE1-CD 3.33Å; E414-K446 IonicContact OE1-NZ 2.63Å; E414-K446 PolarHBondContact OE1-NZ 2.97Å; K446-G462 WeakPolarHBondContact CE-O 3.09Å; K446-F463 HydrophobicContact CB-CD1 4.2Å; K446-D464 PolarHBondContact N-OD2 2.72Å; K446-D464 PolarHBondContact O-N 2.88Å; K446-A465 PolarHBondContact O-N 3.37Å
447	I	96.4	Very high	81.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	115.2	-172.2	-58.9	161.9	0	0	0	108.5	L396 H397 I398 V399 A465 I467 L478	L396-I447 HydrophobicContact CB-CD1 3.81Å; L396-I447 HydrophobicContact CD1-CD1 4.26Å; L396-I447 HydrophobicContact CD2-CD1 4.04Å; L396-I447 HydrophobicContact CG-CD1 4.23Å; H397-I447 PolarHBondContact O-N 3.01Å; I398-I447 HydrophobicContact CD1-CB 3.85Å; I398-I447 HydrophobicContact CD1-CD1 3.57Å; I398-I447 HydrophobicContact CD1-CG1 4.29Å; I398-I447 HydrophobicContact CD1-CG2 4.17Å; V399-I447 PolarHBondContact N-O 2.92Å; I447-A465 CarbonylContact C-O 3.51Å; I447-A465 WeakPolarHBondContact CA-O 3.4Å; I447-I467 HydrophobicContact CG2-CD1 3.66Å; I447-I467 HydrophobicContact CG2-CG1 3.66Å; I447-I467 HydrophobicContact CG2-CG2 4.32Å; I447-L478 HydrophobicContact CD1-CD1 3.44Å; I447-L478 VanDerWaalsContact CD1-CD1 3.44Å; I447-L478 HydrophobicContact CD1-CD2 4.26Å; I447-L478 HydrophobicContact CG1-CD1 3.8Å; I447-L478 HydrophobicContact CG2-CD2 4.45Å
448	G	95.6	Very high	82.7	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	118.2	171.1	0	0	0	0	0	109.1	A465 L466 I467	G448-A465 PolarHBondContact N-O 2.88Å; G448-L466 CarbonylContact O-C 3.54Å; G448-L466 WeakPolarHBondContact O-CA 3.43Å; G448-I467 PolarHBondContact O-N 3.24Å
449	N	95.4	Very high	83.8	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.021	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	162.1	179.4	-174.1	36.8	0	0	0	111.4	A290 I398 V399 V401 I467 A469	A290-N449 PolarHBondContact O-ND2 3.46Å; I398-N449 HydrophobicContact CG2-CB 3.84Å; V399-N449 PolarHBondContact O-N 3.1Å; V401-N449 WeakPolarHBondContact CG2-O 3.4Å; V401-N449 PolarHBondContact N-O 2.8Å; N449-I467 CarbonylContact C-O 3.59Å; N449-I467 VanDerWaalsContact CA-O 3.28Å; N449-I467 WeakPolarHBondContact CA-O 3.2Å; N449-I467 HydrophobicContact CB-CD1 4.31Å; N449-I467 HydrophobicContact CB-CG1 3.97Å; N449-I467 PolarHBondContact OD1-O 2.89Å; N449-A469 PolarHBondContact OD1-N 3.14Å
450	K	92.7	Very high	84.6	Confident	17 Å²	17	58.3 Å²	58.3	7%	0.074	32%	0.318	C	S	.	.			trans	68.3	35.7	-175.5	-48.8	-165.7	-167.6	165.4	0	114	N289 D400 D452 R453 I467	N289-K450 VanDerWaalsContact CG-NZ 3.25Å; N289-K450 PolarHBondContact ND2-NZ 2.87Å; N289-K450 WeakPolarHBondContact O-CE 3.49Å; N289-K450 PolarHBondContact O-NZ 2.95Å; N289-K450 PolarHBondContact OD1-NZ 3.31Å; D400-K450 WeakPolarHBondContact OD1-CD 3.42Å; D400-K450 WeakPolarHBondContact OD2-CD 3.4Å; D400-K450 VanDerWaalsContact OD2-CE 3.27Å; D400-K450 WeakPolarHBondContact OD2-CE 3.26Å; D400-K450 IonicContact OD2-NZ 2.71Å; D400-K450 PolarHBondContact OD2-NZ 3.41Å; K450-D452 WeakPolarHBondContact CA-OD1 3.39Å; K450-D452 PolarHBondContact O-N 3.32Å; K450-D452 VanDerWaalsContact O-N 3.11Å; K450-R453 PolarHBondContact O-N 3.08Å; K450-I467 PolarHBondContact N-O 3.13Å; K450-I467 VanDerWaalsContact N-O 3.11Å
451	V	92.4	Very high	85.1	Confident	41 Å²	41	56.9 Å²	56.9	25%	0.248	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-60.7	-18.4	173.9	-57.8	0	0	0	0	112.9	V401 R453 I454 L466 I467	V401-V451 HydrophobicContact CG2-CG1 3.95Å; V451-R453 PolarHBondContact O-N 3.42Å; V451-I454 PolarHBondContact O-N 2.93Å; V451-L466 HydrophobicContact CG1-CB 4.03Å; V451-L466 HydrophobicContact CG1-CD2 4.33Å; V451-I467 WeakPolarHBondContact CG1-O 3.38Å; V451-I467 VanDerWaalsContact CG2-C 3.46Å; V451-I467 WeakPolarHBondContact CG2-O 3.41Å; V451-I467 PolarHBondContact N-O 2.9Å
452	D	90.6	Very high	85.5	Confident	63 Å²	63	57.8 Å²	57.8	34%	0.337	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-64.7	-17.9	172.9	56.2	-74.7	0	0	0	114.1	K450 S468 N471	K450-D452 WeakPolarHBondContact CA-OD1 3.39Å; K450-D452 PolarHBondContact O-N 3.32Å; K450-D452 VanDerWaalsContact O-N 3.11Å; D452-S468 VanDerWaalsContact OD1-CB 3.28Å; D452-S468 WeakPolarHBondContact OD1-CB 3.18Å; D452-S468 PolarHBondContact OD1-OG 3.45Å; D452-N471 WeakPolarHBondContact CB-ND2 3.21Å
453	R	88.1	Confident	85.9	Confident	135 Å²	135	59.1 Å²	59.1	51%	0.509	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-96.3	4.5	178.7	-65.6	-174.9	172	-164.4	-7.6	113.5	D76 K450 V451	D76-R453 IonicContact OD2-CZ 3.99Å; D76-R453 IonicContact OD2-NH1 3.58Å; D76-R453 PolarHBondContact OD2-NH1 2.8Å; K450-R453 PolarHBondContact O-N 3.08Å; V451-R453 PolarHBondContact O-N 3.42Å
454	I	84.9	Confident	86.1	Confident	35 Å²	35	56.4 Å²	56.4	18%	0.179	33%	0.328	C	S	.	.	S	Bend	trans	-118.2	145.2	-169.8	-58.7	169.7	0	0	0	109.9	V401 V451 D458 Y460	V401-I454 HydrophobicContact CB-CD1 3.49Å; V401-I454 VanDerWaalsContact CB-CD1 3.49Å; V401-I454 HydrophobicContact CG2-CD1 3.21Å; V401-I454 WeakPolarHBondContact O-CD1 3.49Å; V451-I454 PolarHBondContact O-N 2.93Å; I454-D458 HydrophobicContact CG2-CB 4.06Å; I454-Y460 HydrophobicContact CD1-CE2 4.01Å; I454-Y460 HydrophobicContact CG2-CE2 3.62Å; I454-Y460 WeakPolarHBondContact CG2-OH 3.34Å
455	G	77.1	Confident	86.1	Confident	50 Å²	50	55.7 Å²	55.7	52%	0.515	32%	0.324	S	S	.	.			trans	-71	146.2	174.2	0	0	0	0	0	111.8	N457 D458	G455-N457 PolarHBondContact O-N 3.39Å; G455-D458 PolarHBondContact O-N 3.2Å
456	S	70.8	Confident	86.2	Confident	123 Å²	123	58.2 Å²	58.2	86%	0.86	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-10.7	-177.7	52.4	0	0	0	0	115.8
457	N	66.4	Low	86.2	Confident	144 Å²	144	55.8 Å²	55.8	77%	0.77	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-9.5	-171.6	-67.8	-3.8	0	0	0	114.3	G455	G455-N457 PolarHBondContact O-N 3.39Å
458	D	70.5	Confident	86.1	Confident	98 Å²	98	55.8 Å²	55.8	52%	0.524	33%	0.327	S	S	.	.			trans	-84.5	118.8	-176.3	-70.4	-36.1	0	0	0	111.4	I454 G455 Y460	I454-D458 HydrophobicContact CG2-CB 4.06Å; G455-D458 PolarHBondContact O-N 3.2Å; D458-Y460 HydrophobicContact CB-CD2 4.22Å; D458-Y460 HydrophobicContact CB-CE2 3.37Å; D458-Y460 WeakPolarHBondContact O-CD2 2.95Å; D458-Y460 PolarHBondContact O-N 2.81Å
459	V	73.2	Confident	85.8	Confident	128 Å²	128	56.1 Å²	56.1	78%	0.776	33%	0.33	S	S	*	.			trans	-87.8	103	177.6	-176.5	0	0	0	0	109.8	T461	V459-T461 HydrophobicContact CG1-CG2 3.97Å; V459-T461 PolarHBondContact O-N 3.01Å
460	Y	78.9	Confident	85.4	Confident	52 Å²	52	64.1 Å²	64.1	20%	0.204	36%	0.364	C	S	.	.			trans	-88.3	104.3	173.7	-63.6	-88.3	0	0	0	110.5	V401 W406 I454 D458 F463	V401-Y460 HydrophobicContact CB-CD1 4.12Å; V401-Y460 HydrophobicContact CB-CE1 3.9Å; V401-Y460 HydrophobicContact CG1-CD1 3.9Å; V401-Y460 HydrophobicContact CG1-CE1 4.17Å; V401-Y460 HydrophobicContact CG1-CG 4.43Å; V401-Y460 PolarHBondContact O-OH 2.74Å; W406-Y460 AromaticContact CE2-CD1 3.99Å; W406-Y460 AromaticContact CZ2-CD1 3.89Å; W406-Y460 HydrophobicContact CZ2-CD1 3.89Å; W406-Y460 AromaticContact NE1-CD1 3.78Å; W406-Y460 AromaticContact NE1-CE1 3.53Å; I454-Y460 HydrophobicContact CD1-CE2 4.01Å; I454-Y460 HydrophobicContact CG2-CE2 3.62Å; I454-Y460 WeakPolarHBondContact CG2-OH 3.34Å; D458-Y460 HydrophobicContact CB-CD2 4.22Å; D458-Y460 HydrophobicContact CB-CE2 3.37Å; D458-Y460 WeakPolarHBondContact O-CD2 2.95Å; D458-Y460 PolarHBondContact O-N 2.81Å; Y460-F463 HydrophobicContact CD1-CE2 4.17Å; Y460-F463 HydrophobicContact CG-CE2 4.44Å
461	T	81.2	Confident	85.2	Confident	108 Å²	108	68 Å²	68	66%	0.663	39%	0.386	S	S	*	.			trans	-91.2	154.1	175.3	60.5	0	0	0	0	111.5	V459	V459-T461 HydrophobicContact CG1-CG2 3.97Å; V459-T461 PolarHBondContact O-N 3.01Å
462	G	85.7	Confident	85	Confident	56 Å²	56	67.1 Å²	67.1	58%	0.577	38%	0.384	S	S	*	.	S	Bend	trans	85.8	3.8	173.4	0	0	0	0	0	115.9	K446	K446-G462 WeakPolarHBondContact CE-O 3.09Å
463	F	91.6	Very high	85.1	Confident	30 Å²	30	67.2 Å²	67.2	13%	0.132	39%	0.387	C	S	.	.			trans	-89.9	141.4	169.1	-67.6	-77.5	0	0	0	111.2	V399 V401 W406 K446 Y460 L466	V399-F463 HydrophobicContact CB-CE1 3.78Å; V399-F463 HydrophobicContact CB-CZ 4.27Å; V399-F463 HydrophobicContact CG1-CE1 4.08Å; V399-F463 HydrophobicContact CG1-CZ 4.08Å; V399-F463 HydrophobicContact CG2-CE1 3.91Å; V401-F463 HydrophobicContact CG1-CE1 4.16Å; V401-F463 HydrophobicContact CG1-CE2 3.67Å; V401-F463 HydrophobicContact CG1-CZ 3.43Å; V401-F463 VanDerWaalsContact CG1-CZ 3.43Å; W406-F463 HydrophobicContact CD2-CZ 4.13Å; W406-F463 HydrophobicContact CE3-CE2 4.31Å; W406-F463 AromaticContact CE3-CZ 3.63Å; W406-F463 HydrophobicContact CE3-CZ 3.63Å; W406-F463 HydrophobicContact CH2-CD2 4.38Å; W406-F463 AromaticContact CH2-CE2 3.29Å; W406-F463 HydrophobicContact CH2-CE2 3.29Å; W406-F463 AromaticContact CH2-CZ 3.43Å; W406-F463 HydrophobicContact CH2-CZ 3.43Å; W406-F463 VanDerWaalsContact CH2-CZ 3.43Å; W406-F463 AromaticContact CZ2-CE2 3.61Å; W406-F463 HydrophobicContact CZ2-CE2 3.61Å; W406-F463 AromaticContact CZ2-CZ 3.93Å; W406-F463 HydrophobicContact CZ2-CZ 3.93Å; W406-F463 HydrophobicContact CZ3-CE1 4.18Å; W406-F463 AromaticContact CZ3-CE2 3.69Å; W406-F463 HydrophobicContact CZ3-CE2 3.69Å; W406-F463 AromaticContact CZ3-CZ 3.26Å; W406-F463 HydrophobicContact CZ3-CZ 3.26Å; K446-F463 HydrophobicContact CB-CD1 4.2Å; Y460-F463 HydrophobicContact CD1-CE2 4.17Å; Y460-F463 HydrophobicContact CG-CE2 4.44Å; F463-L466 HydrophobicContact CB-CD2 4.14Å; F463-L466 HydrophobicContact CD2-CD2 4.02Å; F463-L466 HydrophobicContact CG-CD2 4.08Å
464	D	93.9	Very high	85.2	Confident	24 Å²	24	62.1 Å²	62.1	13%	0.128	38%	0.377	C	S	.	.	S	Bend	trans	-80.8	-24.6	168.9	-55.9	-70.9	0	0	0	110.6	K426 L445 K446 K481	K426-D464 IonicContact NZ-OD1 3.9Å; K426-D464 PolarHBondContact NZ-OD1 2.87Å; L445-D464 WeakPolarHBondContact CA-OD2 3.21Å; L445-D464 HydrophobicContact CB-CB 4.46Å; L445-D464 HydrophobicContact CD2-CB 4Å; K446-D464 PolarHBondContact N-OD2 2.72Å; K446-D464 PolarHBondContact O-N 2.88Å; D464-K481 WeakPolarHBondContact O-CD 3.39Å; D464-K481 WeakPolarHBondContact O-CE 3.47Å; D464-K481 PolarHBondContact O-NZ 3.41Å
465	A	93.7	Very high	85.5	Confident	3 Å²	3	60.5 Å²	60.5	3%	0.025	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	152.6	170.3	0	0	0	0	0	111.7	K446 I447 G448 L478	K446-A465 PolarHBondContact O-N 3.37Å; I447-A465 CarbonylContact C-O 3.51Å; I447-A465 WeakPolarHBondContact CA-O 3.4Å; G448-A465 PolarHBondContact N-O 2.88Å; A465-L478 HydrophobicContact CB-CB 4.18Å; A465-L478 HydrophobicContact CB-CD1 4.07Å
466	L	95.3	Very high	86.1	Confident	61 Å²	61	64.3 Å²	64.3	32%	0.319	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124	174.9	-71.8	179	0	0	0	109.1	G448 V451 F463 G474	G448-L466 CarbonylContact O-C 3.54Å; G448-L466 WeakPolarHBondContact O-CA 3.43Å; V451-L466 HydrophobicContact CG1-CB 4.03Å; V451-L466 HydrophobicContact CG1-CD2 4.33Å; F463-L466 HydrophobicContact CB-CD2 4.14Å; F463-L466 HydrophobicContact CD2-CD2 4.02Å; F463-L466 HydrophobicContact CG-CD2 4.08Å; L466-G474 WeakPolarHBondContact O-CA 3.32Å
467	I	95.3	Very high	87	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	158.2	-171.3	67.2	164.7	0	0	0	113.3	L295 I447 G448 N449 K450 V451 A469 T473 M475 L478	L295-I467 HydrophobicContact CD1-CD1 3.93Å; I447-I467 HydrophobicContact CG2-CD1 3.66Å; I447-I467 HydrophobicContact CG2-CG1 3.66Å; I447-I467 HydrophobicContact CG2-CG2 4.32Å; G448-I467 PolarHBondContact O-N 3.24Å; N449-I467 CarbonylContact C-O 3.59Å; N449-I467 VanDerWaalsContact CA-O 3.28Å; N449-I467 WeakPolarHBondContact CA-O 3.2Å; N449-I467 HydrophobicContact CB-CD1 4.31Å; N449-I467 HydrophobicContact CB-CG1 3.97Å; N449-I467 PolarHBondContact OD1-O 2.89Å; K450-I467 PolarHBondContact N-O 3.13Å; K450-I467 VanDerWaalsContact N-O 3.11Å; V451-I467 WeakPolarHBondContact CG1-O 3.38Å; V451-I467 VanDerWaalsContact CG2-C 3.46Å; V451-I467 WeakPolarHBondContact CG2-O 3.41Å; V451-I467 PolarHBondContact N-O 2.9Å; I467-A469 HydrophobicContact CD1-CB 4.32Å; I467-T473 CarbonylContact C-O 3.6Å; I467-T473 WeakPolarHBondContact CA-O 3.26Å; I467-T473 WeakPolarHBondContact CB-O 2.95Å; I467-M475 HydrophobicContact CB-SD 4.07Å; I467-M475 HydrophobicContact CD1-SD 3.92Å; I467-M475 HydrophobicContact CG2-SD 4.04Å; I467-L478 HydrophobicContact CD1-CD2 4.01Å; I467-L478 HydrophobicContact CG2-CB 3.99Å; I467-L478 HydrophobicContact CG2-CD2 4.04Å
468	S	94	Very high	88.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-115.5	104.1	152.7	-179.1	0	0	0	0	108	D452 K470 N471 G472 T473	D452-S468 VanDerWaalsContact OD1-CB 3.28Å; D452-S468 WeakPolarHBondContact OD1-CB 3.18Å; D452-S468 PolarHBondContact OD1-OG 3.45Å; S468-K470 PolarHBondContact O-N 3.35Å; S468-K470 VanDerWaalsContact O-N 3.14Å; S468-N471 PolarHBondContact O-N 3.22Å; S468-N471 PolarHBondContact OG-N 3.43Å; S468-G472 WeakPolarHBondContact O-CA 3.34Å; S468-G472 PolarHBondContact O-N 2.99Å; S468-T473 WeakPolarHBondContact CB-OG1 3.32Å; S468-T473 PolarHBondContact N-O 3.1Å; S468-T473 PolarHBondContact N-OG1 3.39Å; S468-T473 PolarHBondContact O-N 3.11Å
469	A	89.9	Confident	89.3	Confident	7 Å²	7	52 Å²	52	6%	0.058	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.9	174.8	0	0	0	0	0	112.7	L295 N449 I467	L295-A469 HydrophobicContact CB-CB 4.33Å; N449-A469 PolarHBondContact OD1-N 3.14Å; I467-A469 HydrophobicContact CD1-CB 4.32Å
470	K	87.4	Confident	90.1	Very high	171 Å²	171	48.3 Å²	48.3	74%	0.743	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-48.3	176.4	-175.1	-175.5	174.9	-172	0	111.8	S468	S468-K470 PolarHBondContact O-N 3.35Å; S468-K470 VanDerWaalsContact O-N 3.14Å
471	N	88.7	Confident	90.8	Very high	100 Å²	100	49.3 Å²	49.3	54%	0.535	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-8.7	-174.2	-61.9	-3.9	0	0	0	113.1	D452 S468 T473	D452-N471 WeakPolarHBondContact CB-ND2 3.21Å; S468-N471 PolarHBondContact O-N 3.22Å; S468-N471 PolarHBondContact OG-N 3.43Å; N471-T473 VanDerWaalsContact C-N 3.3Å; N471-T473 HydrophobicContact CB-CG2 4.19Å; N471-T473 PolarHBondContact O-N 3.26Å
472	G	88.4	Confident	91.3	Very high	21 Å²	21	44.3 Å²	44.3	22%	0.216	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	4.5	-176.3	0	0	0	0	0	114.8	S468 M475	S468-G472 WeakPolarHBondContact O-CA 3.34Å; S468-G472 PolarHBondContact O-N 2.99Å; G472-M475 WeakPolarHBondContact O-CB 3.03Å; G472-M475 VanDerWaalsContact O-CG 3.25Å; G472-M475 WeakPolarHBondContact O-CG 2.88Å; G472-M475 PolarHBondContact O-N 3.26Å
473	T	91.8	Very high	91.6	Very high	65 Å²	65	44.2 Å²	44.2	40%	0.399	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-67.2	140.8	179.9	63.7	0	0	0	0	111.2	I467 S468 N471 M475	I467-T473 CarbonylContact C-O 3.6Å; I467-T473 WeakPolarHBondContact CA-O 3.26Å; I467-T473 WeakPolarHBondContact CB-O 2.95Å; S468-T473 WeakPolarHBondContact CB-OG1 3.32Å; S468-T473 PolarHBondContact N-O 3.1Å; S468-T473 PolarHBondContact N-OG1 3.39Å; S468-T473 PolarHBondContact O-N 3.11Å; N471-T473 VanDerWaalsContact C-N 3.3Å; N471-T473 HydrophobicContact CB-CG2 4.19Å; N471-T473 PolarHBondContact O-N 3.26Å; T473-M475 PolarHBondContact O-N 3.05Å; T473-M475 VanDerWaalsContact O-N 3.15Å
474	G	91.3	Very high	91.5	Very high	28 Å²	28	47.4 Å²	47.4	29%	0.289	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	0.5	179.5	0	0	0	0	0	115.7	L466 E476 E477 L478	L466-G474 WeakPolarHBondContact O-CA 3.32Å; G474-E476 VanDerWaalsContact C-N 3.33Å; G474-E476 PolarHBondContact O-N 3Å; G474-E477 PolarHBondContact O-N 2.87Å; G474-L478 PolarHBondContact O-N 3.39Å
475	M	90.6	Very high	91.4	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-68.8	-28.4	-174.5	-69	-55.1	-66.2	0	0	113.8	L295 Y298 L299 I467 G472 T473 L478 T479	L295-M475 HydrophobicContact CD1-CE 3.41Å; L295-M475 VanDerWaalsContact CD1-CE 3.41Å; L295-M475 HydrophobicContact CD1-SD 4.1Å; Y298-M475 HydrophobicContact CD1-CB 4.4Å; Y298-M475 HydrophobicContact CD1-CE 3.11Å; Y298-M475 HydrophobicContact CD1-CG 4.09Å; Y298-M475 HydrophobicContact CD1-SD 4.32Å; Y298-M475 HydrophobicContact CD2-CG 4.42Å; Y298-M475 HydrophobicContact CE1-CB 3.57Å; Y298-M475 HydrophobicContact CE1-CE 3.49Å; Y298-M475 VanDerWaalsContact CE1-CE 3.49Å; Y298-M475 HydrophobicContact CE1-CG 3.64Å; Y298-M475 HydrophobicContact CE1-SD 4.39Å; Y298-M475 HydrophobicContact CE2-CG 4.02Å; Y298-M475 HydrophobicContact CG-CE 3.73Å; Y298-M475 HydrophobicContact CG-CG 4.45Å; L299-M475 HydrophobicContact CD2-CE 3.98Å; L299-M475 HydrophobicContact CG-CE 4.33Å; I467-M475 HydrophobicContact CB-SD 4.07Å; I467-M475 HydrophobicContact CD1-SD 3.92Å; I467-M475 HydrophobicContact CG2-SD 4.04Å; G472-M475 WeakPolarHBondContact O-CB 3.03Å; G472-M475 VanDerWaalsContact O-CG 3.25Å; G472-M475 WeakPolarHBondContact O-CG 2.88Å; G472-M475 PolarHBondContact O-N 3.26Å; T473-M475 PolarHBondContact O-N 3.05Å; T473-M475 VanDerWaalsContact O-N 3.15Å; M475-L478 HydrophobicContact CE-CD2 4.07Å; M475-L478 HydrophobicContact SD-CD2 4.12Å; M475-T479 VanDerWaalsContact O-CB 3.28Å; M475-T479 WeakPolarHBondContact O-CB 3.37Å; M475-T479 PolarHBondContact O-N 3Å; M475-T479 PolarHBondContact O-OG1 2.95Å
476	E	89.2	Confident	91.2	Very high	129 Å²	129	46.5 Å²	46.5	60%	0.603	25%	0.245	S	C	*	.	H	α-helix	trans	-68.2	-43.7	175.2	-61.5	-171.1	165.9	0	0	112	L327 G474 T479 S480	L327-E476 HydrophobicContact CD1-CB 4.12Å; L327-E476 HydrophobicContact CD1-CG 3.87Å; G474-E476 VanDerWaalsContact C-N 3.33Å; G474-E476 PolarHBondContact O-N 3Å; E476-T479 PolarHBondContact O-N 2.94Å; E476-S480 WeakPolarHBondContact O-CB 2.97Å; E476-S480 PolarHBondContact O-N 3.34Å; E476-S480 PolarHBondContact O-OG 2.93Å
477	E	91.1	Very high	91	Very high	94 Å²	94	44.4 Å²	44.4	44%	0.439	23%	0.234	S	C	.	.	H	α-helix	trans	-63.3	-46.5	175.8	-173.4	-173.2	170.4	0	0	110.5	G474 T479 S480 K481	G474-E477 PolarHBondContact O-N 2.87Å; E477-T479 PolarHBondContact O-N 3.19Å; E477-S480 WeakPolarHBondContact O-CB 3.46Å; E477-S480 PolarHBondContact O-N 3.42Å; E477-K481 HydrophobicContact CG-CD 4.29Å; E477-K481 WeakPolarHBondContact O-CG 3.43Å; E477-K481 PolarHBondContact O-N 3.24Å; E477-K481 WeakPolarHBondContact OE1-CE 3.34Å; E477-K481 IonicContact OE1-NZ 3.82Å; E477-K481 PolarHBondContact OE1-NZ 3.27Å
478	L	93.3	Very high	90.7	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-49.6	175.5	174.8	60.1	0	0	0	111.4	L295 I447 A465 I467 G474 M475 S480 K481 V482	L295-L478 HydrophobicContact CD1-CD2 3.7Å; I447-L478 HydrophobicContact CD1-CD1 3.44Å; I447-L478 VanDerWaalsContact CD1-CD1 3.44Å; I447-L478 HydrophobicContact CD1-CD2 4.26Å; I447-L478 HydrophobicContact CG1-CD1 3.8Å; I447-L478 HydrophobicContact CG2-CD2 4.45Å; A465-L478 HydrophobicContact CB-CB 4.18Å; A465-L478 HydrophobicContact CB-CD1 4.07Å; I467-L478 HydrophobicContact CD1-CD2 4.01Å; I467-L478 HydrophobicContact CG2-CB 3.99Å; I467-L478 HydrophobicContact CG2-CD2 4.04Å; G474-L478 PolarHBondContact O-N 3.39Å; M475-L478 HydrophobicContact CE-CD2 4.07Å; M475-L478 HydrophobicContact SD-CD2 4.12Å; L478-S480 VanDerWaalsContact C-N 3.25Å; L478-S480 PolarHBondContact O-N 3.33Å; L478-K481 PolarHBondContact O-N 2.64Å; L478-K481 VanDerWaalsContact O-N 3.14Å; L478-V482 HydrophobicContact CD1-CG2 3.76Å; L478-V482 HydrophobicContact CG-CG2 4.23Å; L478-V482 VanDerWaalsContact O-CG2 3.29Å; L478-V482 WeakPolarHBondContact O-CG2 3.47Å; L478-V482 PolarHBondContact O-N 3.14Å
479	T	91.1	Very high	90.4	Very high	12 Å²	12	55.1 Å²	55.1	7%	0.074	28%	0.279	C	S	.	.	H	α-helix	trans	-57.3	-41.8	179.2	-64.6	0	0	0	0	111.3	L324 P325 M475 E476 E477 R483	L324-T479 HydrophobicContact CB-CG2 4.09Å; L324-T479 HydrophobicContact CD1-CG2 4.38Å; L324-T479 HydrophobicContact CD2-CG2 3.96Å; L324-T479 HydrophobicContact CG-CG2 4.35Å; P325-T479 HydrophobicContact CG-CG2 4.47Å; M475-T479 VanDerWaalsContact O-CB 3.28Å; M475-T479 WeakPolarHBondContact O-CB 3.37Å; M475-T479 PolarHBondContact O-N 3Å; M475-T479 PolarHBondContact O-OG1 2.95Å; E476-T479 PolarHBondContact O-N 2.94Å; E477-T479 PolarHBondContact O-N 3.19Å; T479-R483 VanDerWaalsContact O-CB 3.28Å; T479-R483 WeakPolarHBondContact O-CB 3.35Å; T479-R483 PolarHBondContact O-N 2.94Å
480	S	90.1	Very high	90.2	Very high	50 Å²	50	57.3 Å²	57.3	35%	0.35	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-43.5	177.3	-62.1	0	0	0	0	112.2	E476 E477 L478 R483 L484	E476-S480 WeakPolarHBondContact O-CB 2.97Å; E476-S480 PolarHBondContact O-N 3.34Å; E476-S480 PolarHBondContact O-OG 2.93Å; E477-S480 WeakPolarHBondContact O-CB 3.46Å; E477-S480 PolarHBondContact O-N 3.42Å; L478-S480 VanDerWaalsContact C-N 3.25Å; L478-S480 PolarHBondContact O-N 3.33Å; S480-R483 PolarHBondContact O-N 3.47Å; S480-L484 WeakPolarHBondContact O-CG 3.49Å; S480-L484 PolarHBondContact O-N 3.48Å
481	K	92.4	Very high	90.2	Very high	74 Å²	74	50.2 Å²	50.2	32%	0.322	27%	0.265	S	S	.	.	H	α-helix	trans	-68.4	-42.3	178.6	-73.3	178.7	172.6	170.5	0	112.6	D464 E477 L478 L484 A485	D464-K481 WeakPolarHBondContact O-CD 3.39Å; D464-K481 WeakPolarHBondContact O-CE 3.47Å; D464-K481 PolarHBondContact O-NZ 3.41Å; E477-K481 HydrophobicContact CG-CD 4.29Å; E477-K481 WeakPolarHBondContact O-CG 3.43Å; E477-K481 PolarHBondContact O-N 3.24Å; E477-K481 WeakPolarHBondContact OE1-CE 3.34Å; E477-K481 IonicContact OE1-NZ 3.82Å; E477-K481 PolarHBondContact OE1-NZ 3.27Å; L478-K481 PolarHBondContact O-N 2.64Å; L478-K481 VanDerWaalsContact O-N 3.14Å; K481-L484 PolarHBondContact O-N 2.71Å; K481-A485 WeakPolarHBondContact O-CB 3.48Å; K481-A485 PolarHBondContact O-N 2.67Å
482	V	93.1	Very high	90.2	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.018	25%	0.249	C	C	.	.	H	α-helix	trans	-61.4	-45.5	174.6	174.7	0	0	0	0	110.5	L324 M362 L394 L396 L445 L478 L484 A485 I486	L324-V482 HydrophobicContact CD1-CB 4.05Å; L324-V482 HydrophobicContact CD1-CG1 3.65Å; M362-V482 HydrophobicContact CE-CG1 4.28Å; L394-V482 HydrophobicContact CD2-CB 4.32Å; L394-V482 HydrophobicContact CD2-CG1 3.76Å; L394-V482 HydrophobicContact CD2-CG2 4.38Å; L396-V482 HydrophobicContact CD1-CG2 4.34Å; L396-V482 HydrophobicContact CD2-CG2 3.87Å; L445-V482 HydrophobicContact CD1-CG2 4.18Å; L478-V482 HydrophobicContact CD1-CG2 3.76Å; L478-V482 HydrophobicContact CG-CG2 4.23Å; L478-V482 VanDerWaalsContact O-CG2 3.29Å; L478-V482 WeakPolarHBondContact O-CG2 3.47Å; L478-V482 PolarHBondContact O-N 3.14Å; V482-L484 PolarHBondContact O-N 3.47Å; V482-A485 PolarHBondContact O-N 2.97Å; V482-I486 HydrophobicContact CG1-CD1 3.76Å; V482-I486 HydrophobicContact CG1-CG1 4.43Å; V482-I486 WeakPolarHBondContact O-CG1 3.46Å; V482-I486 PolarHBondContact O-N 3.26Å
483	R	90.4	Very high	90.2	Very high	54 Å²	54	49.8 Å²	49.8	20%	0.204	25%	0.251	C	S	.	.	H	α-helix	trans	-55.9	-51.1	176.1	-179.3	-175.8	65.2	74.6	-3.2	111.5	L324 I360 T479 S480 A485 I486 M487	L324-R483 HydrophobicContact CD1-CB 4.41Å; I360-R483 HydrophobicContact CD1-CG 3.75Å; T479-R483 VanDerWaalsContact O-CB 3.28Å; T479-R483 WeakPolarHBondContact O-CB 3.35Å; T479-R483 PolarHBondContact O-N 2.94Å; S480-R483 PolarHBondContact O-N 3.47Å; R483-A485 PolarHBondContact O-N 2.92Å; R483-I486 PolarHBondContact O-N 3.29Å; R483-M487 HydrophobicContact CG-SD 3.95Å; R483-M487 PolarHBondContact NH1-SD 2.86Å; R483-M487 WeakPolarHBondContact O-CB 3.32Å; R483-M487 VanDerWaalsContact O-CG 3.26Å; R483-M487 WeakPolarHBondContact O-CG 3.49Å; R483-M487 PolarHBondContact O-N 2.71Å
484	L	90.4	Very high	90.1	Very high	97 Å²	97	49.4 Å²	49.4	51%	0.508	25%	0.251	S	S	.	.	H	α-helix	trans	-62.4	-41.5	-179.8	-71.3	173.9	0	0	0	112.2	S480 K481 V482 M487 K488	S480-L484 WeakPolarHBondContact O-CG 3.49Å; S480-L484 PolarHBondContact O-N 3.48Å; K481-L484 PolarHBondContact O-N 2.71Å; V482-L484 PolarHBondContact O-N 3.47Å; L484-M487 PolarHBondContact O-N 2.94Å; L484-K488 WeakPolarHBondContact O-CB 3.48Å; L484-K488 PolarHBondContact O-N 2.79Å
485	A	91.9	Very high	90	Very high	7 Å²	7	52 Å²	52	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-63.7	-44.6	178.4	0	0	0	0	0	112.2	L394 L445 K481 V482 R483 K488 R489	L394-A485 HydrophobicContact CD1-CB 3.69Å; L394-A485 HydrophobicContact CD2-CB 4.05Å; L445-A485 HydrophobicContact CD1-CB 4.13Å; K481-A485 WeakPolarHBondContact O-CB 3.48Å; K481-A485 PolarHBondContact O-N 2.67Å; V482-A485 PolarHBondContact O-N 2.97Å; R483-A485 PolarHBondContact O-N 2.92Å; A485-K488 PolarHBondContact O-N 3.14Å; A485-R489 WeakPolarHBondContact O-CB 3.4Å; A485-R489 PolarHBondContact O-N 3.02Å
486	I	90.4	Very high	90	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-45.6	176.7	-68.3	171.7	0	0	0	111	P280 V282 M362 L394 V482 R483 K488 R489 L490	P280-I486 HydrophobicContact CB-CD1 4.29Å; P280-I486 HydrophobicContact CB-CG2 3.71Å; P280-I486 HydrophobicContact CG-CG2 3.72Å; V282-I486 HydrophobicContact CG2-CD1 3.66Å; V282-I486 HydrophobicContact CG2-CG1 4.3Å; M362-I486 HydrophobicContact CE-CD1 3.2Å; M362-I486 HydrophobicContact SD-CD1 4.31Å; L394-I486 HydrophobicContact CD2-CG1 4.07Å; V482-I486 HydrophobicContact CG1-CD1 3.76Å; V482-I486 HydrophobicContact CG1-CG1 4.43Å; V482-I486 WeakPolarHBondContact O-CG1 3.46Å; V482-I486 PolarHBondContact O-N 3.26Å; R483-I486 PolarHBondContact O-N 3.29Å; I486-K488 VanDerWaalsContact C-N 3.33Å; I486-K488 PolarHBondContact O-N 3.14Å; I486-R489 PolarHBondContact O-N 3Å; I486-L490 HydrophobicContact CG2-CD1 3.76Å; I486-L490 HydrophobicContact CG2-CG 4.41Å; I486-L490 WeakPolarHBondContact O-CB 3.41Å; I486-L490 PolarHBondContact O-N 3.24Å
487	M	90	Very high	90.1	Very high	17 Å²	17	50.5 Å²	50.5	8%	0.084	25%	0.251	C	S	.	.	H	α-helix	trans	-59.5	-46	178.6	-75.4	179.6	67.9	0	0	111.2	I360 R483 L484 G491 W492 I533	I360-M487 HydrophobicContact CD1-CG 4.3Å; R483-M487 HydrophobicContact CG-SD 3.95Å; R483-M487 PolarHBondContact NH1-SD 2.86Å; R483-M487 WeakPolarHBondContact O-CB 3.32Å; R483-M487 VanDerWaalsContact O-CG 3.26Å; R483-M487 WeakPolarHBondContact O-CG 3.49Å; R483-M487 PolarHBondContact O-N 2.71Å; L484-M487 PolarHBondContact O-N 2.94Å; M487-G491 CarbonylContact O-C 3.59Å; M487-G491 WeakPolarHBondContact O-CA 3.48Å; M487-G491 PolarHBondContact O-N 3Å; M487-W492 HydrophobicContact CB-CB 4.31Å; M487-W492 HydrophobicContact CG-CB 4.2Å; M487-W492 PolarHBondContact O-N 3.29Å; M487-I533 HydrophobicContact CE-CD1 4.24Å; M487-I533 HydrophobicContact CE-CG1 4Å; M487-I533 HydrophobicContact CE-CG2 4.15Å; M487-I533 HydrophobicContact SD-CD1 3.96Å; M487-I533 HydrophobicContact SD-CG1 4.39Å
488	K	89.1	Confident	90	Very high	166 Å²	166	48.7 Å²	48.7	72%	0.722	25%	0.245	S	C	*	.	H	α-helix	trans	-60.5	-47.5	176.6	-174.4	179	-179.8	179.9	0	111.7	L484 A485 I486 G491	L484-K488 WeakPolarHBondContact O-CB 3.48Å; L484-K488 PolarHBondContact O-N 2.79Å; A485-K488 PolarHBondContact O-N 3.14Å; I486-K488 VanDerWaalsContact C-N 3.33Å; I486-K488 PolarHBondContact O-N 3.14Å; K488-G491 PolarHBondContact O-N 2.99Å
489	R	87.2	Confident	89.8	Confident	60 Å²	60	49.1 Å²	49.1	23%	0.226	25%	0.247	C	C	.	.	H	α-helix	trans	-63.8	-44	-177.9	179.2	60.4	170.7	-165.2	-9.9	112.9	D393 E440 P441 A485 I486 G491	D393-R489 HydrophobicContact CB-CG 4.1Å; E440-R489 PolarHBondContact O-NH1 2.87Å; E440-R489 PolarHBondContact O-NH2 2.71Å; E440-R489 IonicContact OE2-NH1 3.8Å; E440-R489 PolarHBondContact OE2-NH1 3.35Å; P441-R489 PolarHBondContact O-NH1 2.89Å; A485-R489 WeakPolarHBondContact O-CB 3.4Å; A485-R489 PolarHBondContact O-N 3.02Å; I486-R489 PolarHBondContact O-N 3Å; R489-G491 VanDerWaalsContact C-N 3.3Å
490	L	86.4	Confident	89.8	Confident	52 Å²	52	56.1 Å²	56.1	27%	0.272	27%	0.272	S	S	.	.	H	α-helix	trans	-87.4	-0.1	-178	-62.3	177.6	0	0	0	113.2	P280 D393 I486 W492	P280-L490 HydrophobicContact CB-CD1 3.95Å; P280-L490 HydrophobicContact CG-CD1 3.65Å; D393-L490 WeakPolarHBondContact OD1-CD2 3.36Å; I486-L490 HydrophobicContact CG2-CD1 3.76Å; I486-L490 HydrophobicContact CG2-CG 4.41Å; I486-L490 WeakPolarHBondContact O-CB 3.41Å; I486-L490 PolarHBondContact O-N 3.24Å; L490-W492 HydrophobicContact CB-CD2 4.28Å; L490-W492 HydrophobicContact CB-CG 4.07Å; L490-W492 HydrophobicContact CD1-CD2 4.31Å; L490-W492 HydrophobicContact CD1-CH2 4.16Å; L490-W492 HydrophobicContact CD1-CZ2 3.58Å; L490-W492 VanDerWaalsContact O-CD1 3.31Å; L490-W492 PolarHBondContact O-N 3.03Å
491	G	86.9	Confident	89.7	Confident	23 Å²	23	59.6 Å²	59.6	24%	0.237	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	26.1	-175.3	0	0	0	0	0	113.3	M487 K488 R489 F493 P536	M487-G491 CarbonylContact O-C 3.59Å; M487-G491 WeakPolarHBondContact O-CA 3.48Å; M487-G491 PolarHBondContact O-N 3Å; K488-G491 PolarHBondContact O-N 2.99Å; R489-G491 VanDerWaalsContact C-N 3.3Å; G491-F493 WeakPolarHBondContact O-CD1 3.27Å; G491-P536 WeakPolarHBondContact O-CD 3.27Å; G491-P536 VanDerWaalsContact O-CG 3.3Å; G491-P536 WeakPolarHBondContact O-CG 3.49Å
492	W	89.7	Confident	89.4	Confident	51 Å²	51	58.9 Å²	58.9	19%	0.193	30%	0.297	C	S	.	.			trans	-79.8	141.7	174.9	-60.8	2.8	0	0	0	109.8	P280 I360 M487 L490 I533 F534 T535	P280-W492 HydrophobicContact CG-CH2 3.58Å; P280-W492 HydrophobicContact CG-CZ2 4.16Å; P280-W492 HydrophobicContact CG-CZ3 4.19Å; I360-W492 HydrophobicContact CD1-CE3 4.38Å; I360-W492 HydrophobicContact CD1-CZ3 4.21Å; I360-W492 HydrophobicContact CG1-CZ3 4.29Å; I360-W492 HydrophobicContact CG2-CH2 4.43Å; I360-W492 HydrophobicContact CG2-CZ3 3.88Å; M487-W492 HydrophobicContact CB-CB 4.31Å; M487-W492 HydrophobicContact CG-CB 4.2Å; M487-W492 PolarHBondContact O-N 3.29Å; L490-W492 HydrophobicContact CB-CD2 4.28Å; L490-W492 HydrophobicContact CB-CG 4.07Å; L490-W492 HydrophobicContact CD1-CD2 4.31Å; L490-W492 HydrophobicContact CD1-CH2 4.16Å; L490-W492 HydrophobicContact CD1-CZ2 3.58Å; L490-W492 VanDerWaalsContact O-CD1 3.31Å; L490-W492 PolarHBondContact O-N 3.03Å; W492-I533 HydrophobicContact CB-CG2 3.87Å; W492-I533 HydrophobicContact CE3-CG2 4.11Å; W492-F534 WeakPolarHBondContact CA-O 3.1Å; W492-T535 HydrophobicContact CZ2-CG2 4.47Å
493	F	88.1	Confident	89.2	Confident	60 Å²	60	59 Å²	59	26%	0.263	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	150.6	-177.4	55.4	-91.1	0	0	0	111.2	G491 R495 I533 F534 W539	G491-F493 WeakPolarHBondContact O-CD1 3.27Å; F493-R495 HydrophobicContact CD2-CG 3.77Å; F493-R495 HydrophobicContact CE2-CG 3.77Å; F493-I533 WeakPolarHBondContact O-CA 3.32Å; F493-F534 HydrophobicContact CE2-CB 4.08Å; F493-F534 HydrophobicContact CZ-CB 4.22Å; F493-F534 PolarHBondContact N-O 3.35Å; F493-F534 VanDerWaalsContact N-O 3.15Å; F493-F534 PolarHBondContact O-N 3.44Å; F493-W539 HydrophobicContact CE1-CB 4.38Å; F493-W539 HydrophobicContact CE2-CB 4.21Å; F493-W539 AromaticContact CE2-CD2 3.97Å; F493-W539 HydrophobicContact CE2-CD2 3.97Å; F493-W539 HydrophobicContact CE2-CE3 4.34Å; F493-W539 AromaticContact CE2-CG 3.91Å; F493-W539 HydrophobicContact CE2-CG 3.91Å; F493-W539 HydrophobicContact CZ-CB 3.49Å; F493-W539 VanDerWaalsContact CZ-CB 3.49Å; F493-W539 AromaticContact CZ-CD1 3.72Å; F493-W539 HydrophobicContact CZ-CD2 4.03Å; F493-W539 AromaticContact CZ-CG 3.46Å; F493-W539 HydrophobicContact CZ-CG 3.46Å; F493-W539 VanDerWaalsContact CZ-CG 3.46Å
494	S	88.6	Confident	89.3	Confident	57 Å²	57	60.9 Å²	60.9	40%	0.399	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	133.8	176.1	-168.8	0	0	0	0	109.7	T531 A532	S494-T531 WeakPolarHBondContact OG-CG2 3.35Å; S494-A532 CarbonylContact C-O 3.42Å; S494-A532 WeakPolarHBondContact CA-O 2.96Å
495	R	90.2	Very high	89.2	Confident	84 Å²	84	57.7 Å²	57.7	32%	0.317	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	143.3	168.2	-71.5	-62.9	-170.6	170	7	109.7	F493 T531 A532 F534 W539 E552	F493-R495 HydrophobicContact CD2-CG 3.77Å; F493-R495 HydrophobicContact CE2-CG 3.77Å; R495-T531 WeakPolarHBondContact O-CA 3.38Å; R495-A532 PolarHBondContact N-O 3.06Å; R495-A532 PolarHBondContact O-N 3.01Å; R495-F534 HydrophobicContact CB-CD2 4.12Å; R495-F534 HydrophobicContact CB-CE2 3.99Å; R495-W539 HydrophobicContact CB-CH2 4.5Å; R495-W539 HydrophobicContact CB-CZ3 4.28Å; R495-W539 HydrophobicContact CG-CH2 4.14Å; R495-W539 HydrophobicContact CG-CZ3 4.13Å; R495-E552 IonicContact CZ-OE2 2.97Å; R495-E552 IonicContact NH1-OE2 3.75Å; R495-E552 IonicContact NH2-OE2 3.39Å; R495-E552 PolarHBondContact NH2-OE2 3.05Å
496	T	90.6	Very high	89.2	Confident	77 Å²	77	59.3 Å²	59.3	47%	0.472	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.9	172.7	-56	0	0	0	0	108.8	R529 I530 T531	T496-R529 HydrophobicContact CG2-CG 3.33Å; T496-I530 CarbonylContact C-O 3.58Å; T496-I530 VanDerWaalsContact CA-O 3.28Å; T496-I530 WeakPolarHBondContact CA-O 3.31Å; T496-T531 PolarHBondContact OG1-OG1 3.45Å
497	L	90.6	Very high	89.2	Confident	21 Å²	21	65.6 Å²	65.6	11%	0.11	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	132.5	-174.4	-61.1	172.4	0	0	0	109.8	V499 I509 I530 F534 W539 F542 M548	L497-V499 HydrophobicContact CB-CG1 4.18Å; L497-V499 PolarHBondContact O-N 3.43Å; L497-I509 HydrophobicContact CD1-CD1 3.79Å; L497-I530 PolarHBondContact N-O 3.12Å; L497-I530 PolarHBondContact O-N 3.3Å; L497-F534 HydrophobicContact CD1-CE2 4.32Å; L497-F534 HydrophobicContact CD1-CZ 3.89Å; L497-W539 HydrophobicContact CD1-CZ3 4.24Å; L497-W539 HydrophobicContact CD2-CH2 4.21Å; L497-W539 HydrophobicContact CD2-CZ3 4.48Å; L497-F542 HydrophobicContact CD1-CD1 4.38Å; L497-F542 HydrophobicContact CD1-CE1 3.49Å; L497-F542 VanDerWaalsContact CD1-CE1 3.49Å; L497-F542 HydrophobicContact CD1-CZ 3.73Å; L497-M548 HydrophobicContact CD2-CE 4.18Å
498	D	89.5	Confident	89.3	Confident	57 Å²	57	66.7 Å²	66.7	31%	0.305	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	109.6	167.9	-76.3	-47.6	0	0	0	109.2	S521 R527 L528 R529	D498-S521 PolarHBondContact OD1-OG 3.49Å; D498-R527 PolarHBondContact O-NE 3.47Å; D498-R527 PolarHBondContact O-NH2 3.4Å; D498-L528 WeakPolarHBondContact CA-O 3.47Å; D498-R529 WeakPolarHBondContact OD1-CA 3.23Å; D498-R529 WeakPolarHBondContact OD1-CB 3.37Å; D498-R529 IonicContact OD1-NE 3.16Å
499	V	90.1	Very high	89.4	Confident	10 Å²	10	58.9 Å²	58.9	6%	0.061	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	150	-179.7	-63.5	0	0	0	0	111.2	L497 Q501 F506 I509 R527 L528 I530	L497-V499 HydrophobicContact CB-CG1 4.18Å; L497-V499 PolarHBondContact O-N 3.43Å; V499-Q501 PolarHBondContact O-N 2.95Å; V499-F506 HydrophobicContact CG2-CB 4.1Å; V499-F506 HydrophobicContact CG2-CD2 4.08Å; V499-I509 HydrophobicContact CG1-CD1 3.92Å; V499-R527 CarbonylContact O-C 3.5Å; V499-R527 VanDerWaalsContact O-CA 3.28Å; V499-R527 WeakPolarHBondContact O-CA 3.18Å; V499-L528 PolarHBondContact N-O 3.21Å; V499-L528 PolarHBondContact O-N 3.41Å; V499-I530 HydrophobicContact CG2-CD1 3.43Å; V499-I530 VanDerWaalsContact CG2-CD1 3.43Å; V499-I530 HydrophobicContact CG2-CG1 3.86Å
500	R	90	Very high	89.4	Confident	158 Å²	158	61.5 Å²	61.5	60%	0.596	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.6	174.7	-171.7	174.4	-174.6	-109.8	2.1	110	G502 G503	R500-G502 PolarHBondContact O-N 3.3Å; R500-G503 PolarHBondContact O-N 2.99Å
501	Q	87.2	Confident	89.4	Confident	123 Å²	123	63 Å²	63	58%	0.575	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	129.5	177.5	-174.9	177	12.8	0	0	110.5	V499 G503 E526 L528	V499-Q501 PolarHBondContact O-N 2.95Å; Q501-G503 PolarHBondContact O-N 3.47Å; Q501-G503 VanDerWaalsContact O-N 3.14Å; Q501-E526 PolarHBondContact N-O 2.86Å; Q501-L528 HydrophobicContact CB-CD1 4.1Å; Q501-L528 HydrophobicContact CB-CG 4.2Å; Q501-L528 HydrophobicContact CG-CD1 3.85Å; Q501-L528 HydrophobicContact CG-CG 4.4Å
502	G	86.1	Confident	89.4	Confident	59 Å²	59	66.3 Å²	66.3	61%	0.608	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	7.8	-178	0	0	0	0	0	115.3	R500	R500-G502 PolarHBondContact O-N 3.3Å
503	G	89.5	Confident	89.3	Confident	6 Å²	6	64.7 Å²	64.7	6%	0.062	34%	0.344	C	S	.	.			trans	-73.1	168.9	178.3	0	0	0	0	0	113.9	R500 Q501 S505 F506 Q507	R500-G503 PolarHBondContact O-N 2.99Å; Q501-G503 PolarHBondContact O-N 3.47Å; Q501-G503 VanDerWaalsContact O-N 3.14Å; G503-S505 VanDerWaalsContact C-N 3.29Å; G503-S505 PolarHBondContact O-N 3.49Å; G503-F506 VanDerWaalsContact O-CB 3.31Å; G503-F506 WeakPolarHBondContact O-CB 3.45Å; G503-F506 PolarHBondContact O-N 3.09Å; G503-F506 VanDerWaalsContact O-N 3.11Å; G503-Q507 PolarHBondContact O-N 3.09Å
504	P	92	Very high	89.2	Confident	94 Å²	94	63.7 Å²	63.7	61%	0.61	34%	0.34	S	S	*	.	H	α-helix	trans	-62.4	-35.5	179.2	25.7	-34.8	0	0	0	112.4	Q507 W508 F546	P504-Q507 PolarHBondContact O-N 3.01Å; P504-W508 VanDerWaalsContact O-CB 3.3Å; P504-W508 WeakPolarHBondContact O-CB 3.18Å; P504-W508 PolarHBondContact O-N 3.42Å; P504-F546 HydrophobicContact CB-CE1 4.01Å; P504-F546 HydrophobicContact CB-CZ 4.44Å; P504-F546 HydrophobicContact CG-CE1 4.19Å
505	S	90.1	Very high	89.1	Confident	30 Å²	30	61.9 Å²	61.9	21%	0.21	33%	0.327	C	S	.	.	H	α-helix	trans	-66.4	-39.4	174.6	-47.7	0	0	0	0	112.2	G503 W508 I509 F546	G503-S505 VanDerWaalsContact C-N 3.29Å; G503-S505 PolarHBondContact O-N 3.49Å; S505-W508 PolarHBondContact O-N 3.48Å; S505-I509 VanDerWaalsContact O-CG1 3.25Å; S505-I509 WeakPolarHBondContact O-CG1 3.47Å; S505-I509 PolarHBondContact O-N 3Å; S505-F546 VanDerWaalsContact CA-CZ 3.41Å; S505-F546 WeakPolarHBondContact OG-CD1 3.48Å; S505-F546 WeakPolarHBondContact OG-CE1 3.41Å; S505-F546 WeakPolarHBondContact OG-CG 3.27Å
506	F	90.5	Very high	88.8	Confident	41 Å²	41	59.3 Å²	59.3	18%	0.18	32%	0.32	C	S	.	.	H	α-helix	trans	-59.3	-53.2	174.7	175.4	-83.9	0	0	0	110.3	V499 G503 W508 I509 Y510 L528 I530	V499-F506 HydrophobicContact CG2-CB 4.1Å; V499-F506 HydrophobicContact CG2-CD2 4.08Å; G503-F506 VanDerWaalsContact O-CB 3.31Å; G503-F506 WeakPolarHBondContact O-CB 3.45Å; G503-F506 PolarHBondContact O-N 3.09Å; G503-F506 VanDerWaalsContact O-N 3.11Å; F506-W508 VanDerWaalsContact C-N 3.3Å; F506-W508 PolarHBondContact O-N 2.95Å; F506-I509 PolarHBondContact O-N 3.47Å; F506-Y510 HydrophobicContact CD1-CD2 4.08Å; F506-Y510 HydrophobicContact CD1-CE2 4.32Å; F506-Y510 HydrophobicContact CD2-CD2 4.46Å; F506-Y510 HydrophobicContact CD2-CE2 4.14Å; F506-Y510 AromaticContact CE1-CD2 3.73Å; F506-Y510 HydrophobicContact CE1-CD2 3.73Å; F506-Y510 AromaticContact CE1-CE2 3.67Å; F506-Y510 HydrophobicContact CE1-CE2 3.67Å; F506-Y510 HydrophobicContact CE2-CD2 4.13Å; F506-Y510 AromaticContact CE2-CE2 3.45Å; F506-Y510 HydrophobicContact CE2-CE2 3.45Å; F506-Y510 VanDerWaalsContact CE2-CE2 3.45Å; F506-Y510 HydrophobicContact CG-CD2 4.42Å; F506-Y510 AromaticContact CZ-CD2 3.75Å; F506-Y510 HydrophobicContact CZ-CD2 3.75Å; F506-Y510 AromaticContact CZ-CE2 3.17Å; F506-Y510 HydrophobicContact CZ-CE2 3.17Å; F506-Y510 AromaticContact CZ-CZ 3.85Å; F506-Y510 WeakPolarHBondContact O-CD2 3.43Å; F506-Y510 PolarHBondContact O-N 3.34Å; F506-Y510 VanDerWaalsContact O-N 3.16Å; F506-L528 HydrophobicContact CD2-CD1 4.23Å; F506-L528 HydrophobicContact CE2-CD1 3.68Å; F506-I530 HydrophobicContact CD2-CD1 3.4Å; F506-I530 HydrophobicContact CE2-CD1 3.61Å; F506-I530 HydrophobicContact CG-CD1 4.42Å
507	Q	90.5	Very high	88.5	Confident	132 Å²	132	57 Å²	57	62%	0.617	31%	0.308	S	S	*	.	H	α-helix	trans	-62.5	-37.5	-179.9	-171.5	175.8	5.7	0	0	112.3	G503 P504 Y510 S511	G503-Q507 PolarHBondContact O-N 3.09Å; P504-Q507 PolarHBondContact O-N 3.01Å; Q507-Y510 PolarHBondContact O-N 3.28Å; Q507-S511 WeakPolarHBondContact O-CB 3.36Å; Q507-S511 PolarHBondContact O-N 3.14Å; Q507-S511 VanDerWaalsContact O-N 3.12Å; Q507-S511 PolarHBondContact O-OG 2.93Å
508	W	92.4	Very high	88.4	Confident	40 Å²	40	58.9 Å²	58.9	15%	0.152	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-46.1	177	-169.3	101.7	0	0	0	111.9	P504 S505 F506 Y510 S511 N512 F534 G538 K541 F542 F546	P504-W508 VanDerWaalsContact O-CB 3.3Å; P504-W508 WeakPolarHBondContact O-CB 3.18Å; P504-W508 PolarHBondContact O-N 3.42Å; S505-W508 PolarHBondContact O-N 3.48Å; F506-W508 VanDerWaalsContact C-N 3.3Å; F506-W508 PolarHBondContact O-N 2.95Å; W508-Y510 PolarHBondContact O-N 2.7Å; W508-S511 PolarHBondContact O-N 3.01Å; W508-S511 VanDerWaalsContact O-N 3.1Å; W508-N512 HydrophobicContact CD2-CB 4.06Å; W508-N512 HydrophobicContact CE3-CB 3.89Å; W508-N512 HydrophobicContact CH2-CB 3.49Å; W508-N512 VanDerWaalsContact CH2-CB 3.49Å; W508-N512 HydrophobicContact CZ2-CB 3.7Å; W508-N512 HydrophobicContact CZ3-CB 3.6Å; W508-N512 WeakPolarHBondContact O-CB 3.45Å; W508-N512 PolarHBondContact O-N 3.34Å; W508-N512 PolarHBondContact O-ND2 2.98Å; W508-F534 HydrophobicContact CZ3-CE1 4.11Å; W508-G538 WeakPolarHBondContact CH2-O 3.21Å; W508-K541 HydrophobicContact CH2-CB 4.48Å; W508-K541 HydrophobicContact CZ2-CB 3.93Å; W508-F542 AromaticContact CD2-CD2 3.8Å; W508-F542 HydrophobicContact CD2-CD2 3.8Å; W508-F542 HydrophobicContact CE3-CB 4.16Å; W508-F542 AromaticContact CE3-CD2 3.26Å; W508-F542 HydrophobicContact CE3-CD2 3.26Å; W508-F542 HydrophobicContact CE3-CE2 4.01Å; W508-F542 HydrophobicContact CE3-CG 4.1Å; W508-F542 HydrophobicContact CG-CD2 4.5Å; W508-F542 HydrophobicContact CH2-CB 3.68Å; W508-F542 HydrophobicContact CH2-CD2 4.35Å; W508-F542 HydrophobicContact CH2-CG 4.48Å; W508-F542 HydrophobicContact CZ2-CB 4.24Å; W508-F542 HydrophobicContact CZ3-CB 3.62Å; W508-F542 AromaticContact CZ3-CD2 3.6Å; W508-F542 HydrophobicContact CZ3-CD2 3.6Å; W508-F542 AromaticContact CZ3-CG 3.96Å; W508-F542 HydrophobicContact CZ3-CG 3.96Å; W508-F546 HydrophobicContact CB-CE2 3.69Å; W508-F546 HydrophobicContact CB-CZ 3.78Å; W508-F546 HydrophobicContact CD2-CE2 4.24Å; W508-F546 AromaticContact CG-CE2 3.69Å; W508-F546 HydrophobicContact CG-CE2 3.69Å; W508-F546 HydrophobicContact CG-CZ 4.13Å
509	I	91.1	Very high	88.3	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-60.3	-46.7	179.5	-68.5	166.2	0	0	0	109.7	L497 V499 S505 F506 S511 N512 A513 V515 I530 A532 F534 F542	L497-I509 HydrophobicContact CD1-CD1 3.79Å; V499-I509 HydrophobicContact CG1-CD1 3.92Å; S505-I509 VanDerWaalsContact O-CG1 3.25Å; S505-I509 WeakPolarHBondContact O-CG1 3.47Å; S505-I509 PolarHBondContact O-N 3Å; F506-I509 PolarHBondContact O-N 3.47Å; I509-S511 PolarHBondContact O-N 3.41Å; I509-N512 PolarHBondContact O-N 3.09Å; I509-A513 HydrophobicContact CG2-CB 4.09Å; I509-A513 CarbonylContact O-C 3.48Å; I509-A513 WeakPolarHBondContact O-CA 3.33Å; I509-A513 WeakPolarHBondContact O-CB 3.46Å; I509-A513 PolarHBondContact O-N 3.22Å; I509-V515 HydrophobicContact CG2-CG2 3.83Å; I509-I530 HydrophobicContact CG2-CG2 4.14Å; I509-A532 HydrophobicContact CG2-CB 3.82Å; I509-F534 HydrophobicContact CG1-CZ 4.27Å; I509-F542 HydrophobicContact CD1-CE2 4.01Å; I509-F542 HydrophobicContact CD1-CZ 3.93Å; I509-F542 HydrophobicContact CG1-CD2 4.32Å; I509-F542 HydrophobicContact CG1-CE2 3.68Å; I509-F542 HydrophobicContact CG1-CZ 4.1Å
510	Y	88.3	Confident	88.2	Confident	115 Å²	115	64.6 Å²	64.6	45%	0.451	36%	0.358	S	S	.	.	H	α-helix	trans	-61.9	-27.4	176.7	-90.3	-90.2	0	0	0	114.1	F506 Q507 W508 V515 V518 I530	F506-Y510 HydrophobicContact CD1-CD2 4.08Å; F506-Y510 HydrophobicContact CD1-CE2 4.32Å; F506-Y510 HydrophobicContact CD2-CD2 4.46Å; F506-Y510 HydrophobicContact CD2-CE2 4.14Å; F506-Y510 AromaticContact CE1-CD2 3.73Å; F506-Y510 HydrophobicContact CE1-CD2 3.73Å; F506-Y510 AromaticContact CE1-CE2 3.67Å; F506-Y510 HydrophobicContact CE1-CE2 3.67Å; F506-Y510 HydrophobicContact CE2-CD2 4.13Å; F506-Y510 AromaticContact CE2-CE2 3.45Å; F506-Y510 HydrophobicContact CE2-CE2 3.45Å; F506-Y510 VanDerWaalsContact CE2-CE2 3.45Å; F506-Y510 HydrophobicContact CG-CD2 4.42Å; F506-Y510 AromaticContact CZ-CD2 3.75Å; F506-Y510 HydrophobicContact CZ-CD2 3.75Å; F506-Y510 AromaticContact CZ-CE2 3.17Å; F506-Y510 HydrophobicContact CZ-CE2 3.17Å; F506-Y510 AromaticContact CZ-CZ 3.85Å; F506-Y510 WeakPolarHBondContact O-CD2 3.43Å; F506-Y510 PolarHBondContact O-N 3.34Å; F506-Y510 VanDerWaalsContact O-N 3.16Å; Q507-Y510 PolarHBondContact O-N 3.28Å; W508-Y510 PolarHBondContact O-N 2.7Å; Y510-V515 HydrophobicContact CD1-CG2 4.14Å; Y510-V515 HydrophobicContact CD2-CG2 4.1Å; Y510-V515 HydrophobicContact CE1-CG2 4.19Å; Y510-V515 HydrophobicContact CE2-CG2 4.11Å; Y510-V515 HydrophobicContact CG-CG2 4.12Å; Y510-V518 WeakPolarHBondContact OH-CG2 3.44Å; Y510-I530 HydrophobicContact CE2-CD1 4.2Å
511	S	86.7	Confident	87.9	Confident	85 Å²	85	57.4 Å²	57.4	59%	0.594	33%	0.332	S	S	*	.	H	α-helix	trans	-89.6	-26.9	-177.4	-55.2	0	0	0	0	113.6	Q507 W508 I509	Q507-S511 WeakPolarHBondContact O-CB 3.36Å; Q507-S511 PolarHBondContact O-N 3.14Å; Q507-S511 VanDerWaalsContact O-N 3.12Å; Q507-S511 PolarHBondContact O-OG 2.93Å; W508-S511 PolarHBondContact O-N 3.01Å; W508-S511 VanDerWaalsContact O-N 3.1Å; I509-S511 PolarHBondContact O-N 3.41Å
512	N	86.8	Confident	87.8	Confident	91 Å²	91	56.7 Å²	56.7	49%	0.487	34%	0.338	S	S	.	.	H	α-helix	trans	-127.7	-16.7	-168.1	-63.7	-85.1	0	0	0	114.6	W508 I509	W508-N512 HydrophobicContact CD2-CB 4.06Å; W508-N512 HydrophobicContact CE3-CB 3.89Å; W508-N512 HydrophobicContact CH2-CB 3.49Å; W508-N512 VanDerWaalsContact CH2-CB 3.49Å; W508-N512 HydrophobicContact CZ2-CB 3.7Å; W508-N512 HydrophobicContact CZ3-CB 3.6Å; W508-N512 WeakPolarHBondContact O-CB 3.45Å; W508-N512 PolarHBondContact O-N 3.34Å; W508-N512 PolarHBondContact O-ND2 2.98Å; I509-N512 PolarHBondContact O-N 3.09Å
513	A	87	Confident	87.5	Confident	17 Å²	17	58.5 Å²	58.5	14%	0.14	34%	0.341	C	S	.	.	S	Bend	trans	-121.1	164.5	178.4	0	0	0	0	0	109.6	I509 A532 F534	I509-A513 HydrophobicContact CG2-CB 4.09Å; I509-A513 CarbonylContact O-C 3.48Å; I509-A513 WeakPolarHBondContact O-CA 3.33Å; I509-A513 WeakPolarHBondContact O-CB 3.46Å; I509-A513 PolarHBondContact O-N 3.22Å; A513-A532 HydrophobicContact CB-CB 4.28Å; A513-F534 HydrophobicContact CB-CD1 3.69Å; A513-F534 HydrophobicContact CB-CE1 3.53Å; A513-F534 HydrophobicContact CB-CG 4.29Å; A513-F534 HydrophobicContact CB-CZ 3.99Å
514	M	85.8	Confident	87.3	Confident	40 Å²	40	61.3 Å²	61.3	20%	0.197	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	99.4	-176.3	-178.2	-169.8	173.8	0	0	109.6	I326 G359 I360 T516 A532 I533	I326-M514 HydrophobicContact CD1-CE 3.12Å; I326-M514 HydrophobicContact CD1-SD 4.36Å; I326-M514 HydrophobicContact CG1-CE 4.03Å; G359-M514 VanDerWaalsContact O-CE 3.24Å; G359-M514 WeakPolarHBondContact O-CE 3.39Å; I360-M514 HydrophobicContact CG1-CE 4.07Å; I360-M514 HydrophobicContact CG1-SD 3.72Å; M514-T516 PolarHBondContact O-N 3.31Å; M514-A532 CarbonylContact O-C 3.51Å; M514-A532 VanDerWaalsContact O-CA 3.24Å; M514-A532 WeakPolarHBondContact O-CA 3.36Å; M514-I533 HydrophobicContact CB-CB 4.2Å; M514-I533 PolarHBondContact N-O 3.14Å; M514-I533 PolarHBondContact O-N 2.8Å; M514-I533 HydrophobicContact SD-CD1 4.13Å
515	V	86.1	Confident	86.8	Confident	19 Å²	19	62.3 Å²	62.3	12%	0.115	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	125.9	179.5	179.4	0	0	0	0	110.6	P358 I509 Y510 V518 I530	P358-V515 VanDerWaalsContact CB-O 3.26Å; P358-V515 WeakPolarHBondContact CB-O 3.47Å; I509-V515 HydrophobicContact CG2-CG2 3.83Å; Y510-V515 HydrophobicContact CD1-CG2 4.14Å; Y510-V515 HydrophobicContact CD2-CG2 4.1Å; Y510-V515 HydrophobicContact CE1-CG2 4.19Å; Y510-V515 HydrophobicContact CE2-CG2 4.11Å; Y510-V515 HydrophobicContact CG-CG2 4.12Å; V515-V518 HydrophobicContact CG1-CG2 3.57Å; V515-I530 HydrophobicContact CG1-CG2 4.06Å; V515-I530 HydrophobicContact CG2-CG2 4.27Å
516	T	83.9	Confident	86.7	Confident	29 Å²	29	66.1 Å²	66.1	18%	0.178	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-43.6	179	55.7	0	0	0	0	112.2	I326 M514 T531 I533	I326-T516 HydrophobicContact CD1-CG2 3.53Å; I326-T516 HydrophobicContact CG1-CG2 4.37Å; I326-T516 HydrophobicContact CG2-CG2 4.26Å; M514-T516 PolarHBondContact O-N 3.31Å; T516-T531 PolarHBondContact N-O 3.21Å; T516-T531 VanDerWaalsContact OG1-CB 3.3Å; T516-T531 WeakPolarHBondContact OG1-CB 3.29Å; T516-T531 VanDerWaalsContact OG1-CG2 3.23Å; T516-T531 WeakPolarHBondContact OG1-CG2 3.36Å; T516-T531 PolarHBondContact OG1-O 3.48Å; T516-I533 HydrophobicContact CG2-CD1 3.69Å; T516-I533 HydrophobicContact CG2-CG1 3.69Å
517	S	84.2	Confident	86.6	Confident	30 Å²	30	69.2 Å²	69.2	21%	0.21	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	152	176.5	76.1	0	0	0	0	111.2	T531	S517-T531 PolarHBondContact N-O 3.32Å; S517-T531 PolarHBondContact O-N 3.11Å; S517-T531 VanDerWaalsContact OG-CB 3.32Å; S517-T531 WeakPolarHBondContact OG-CB 3.44Å; S517-T531 PolarHBondContact OG-OG1 3.14Å
518	V	88	Confident	86.5	Confident	60 Å²	60	64.2 Å²	64.2	36%	0.364	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	119.3	173.7	-178.7	0	0	0	0	107.9	Y510 V515 L528 R529 I530	Y510-V518 WeakPolarHBondContact OH-CG2 3.44Å; V515-V518 HydrophobicContact CG1-CG2 3.57Å; V518-L528 HydrophobicContact CG1-CB 4.19Å; V518-L528 HydrophobicContact CG1-CD1 4.01Å; V518-L528 HydrophobicContact CG1-CD2 4.41Å; V518-L528 HydrophobicContact CG1-CG 4.44Å; V518-R529 WeakPolarHBondContact CA-O 3.28Å; V518-I530 HydrophobicContact CG1-CG1 4.29Å; V518-I530 HydrophobicContact CG2-CG1 4.21Å; V518-I530 HydrophobicContact CG2-CG2 4.41Å
519	E	88.6	Confident	86.3	Confident	104 Å²	104	66.3 Å²	66.3	49%	0.486	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	153.8	-179.3	-70.1	162.2	-151.3	0	0	109.4	L528 R529	E519-L528 CarbonylContact O-C 3.55Å; E519-L528 WeakPolarHBondContact O-CA 3.31Å; E519-R529 HydrophobicContact CB-CB 4.35Å; E519-R529 PolarHBondContact N-O 3.41Å; E519-R529 PolarHBondContact O-N 3.19Å
520	A	87.7	Confident	86.3	Confident	82 Å²	82	66.3 Å²	66.3	68%	0.678	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	135.2	171	0	0	0	0	0	109.5
521	S	84.7	Confident	86.3	Confident	7 Å²	7	61.9 Å²	61.9	5%	0.049	36%	0.359	C	S	.	.			trans	-72.2	126.9	177.8	-163.2	0	0	0	0	109.6	D498 S523 N524 R527	D498-S521 PolarHBondContact OD1-OG 3.49Å; S521-S523 PolarHBondContact O-N 3.15Å; S521-S523 PolarHBondContact OG-OG 3.12Å; S521-N524 PolarHBondContact O-N 3.43Å; S521-R527 WeakPolarHBondContact CB-O 3.5Å; S521-R527 PolarHBondContact N-O 3.28Å
522	P	83.2	Confident	86.5	Confident	109 Å²	109	57.9 Å²	57.9	71%	0.708	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-19.3	-178.1	26	-33.7	0	0	0	112.9
523	S	81.3	Confident	86.6	Confident	96 Å²	96	53.9 Å²	53.9	67%	0.671	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-22.4	-177.3	56.3	0	0	0	0	113.9	S521	S521-S523 PolarHBondContact O-N 3.15Å; S521-S523 PolarHBondContact OG-OG 3.12Å
524	N	83.9	Confident	86.7	Confident	65 Å²	65	53.1 Å²	53.1	35%	0.348	30%	0.303	S	S	.	.			trans	-157.6	121.8	-174	-171.6	-21.5	0	0	0	111.4	S521 E526 R527	S521-N524 PolarHBondContact O-N 3.43Å; N524-E526 PolarHBondContact O-N 3.29Å; N524-E526 WeakPolarHBondContact OD1-CB 3.28Å; N524-E526 PolarHBondContact OD1-N 3.35Å; N524-R527 HydrophobicContact CB-CB 4.31Å; N524-R527 HydrophobicContact CB-CG 4.11Å; N524-R527 PolarHBondContact O-N 3.08Å; N524-R527 VanDerWaalsContact O-N 3.09Å
525	S	82.1	Confident	86.7	Confident	115 Å²	115	53.8 Å²	53.8	80%	0.804	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.3	-180	58.3	0	0	0	0	113.9	R527	S525-R527 VanDerWaalsContact C-N 3.31Å
526	E	87	Confident	86.8	Confident	111 Å²	111	55.2 Å²	55.2	52%	0.519	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-2.6	176	-59.7	-169.7	173.6	0	0	113.5	Q501 N524	Q501-E526 PolarHBondContact N-O 2.86Å; N524-E526 PolarHBondContact O-N 3.29Å; N524-E526 WeakPolarHBondContact OD1-CB 3.28Å; N524-E526 PolarHBondContact OD1-N 3.35Å
527	R	88.7	Confident	86.9	Confident	106 Å²	106	58.1 Å²	58.1	40%	0.4	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	144.6	-178.5	-59.5	-174.8	84.5	117.5	-3.2	111.4	D498 V499 S521 N524 S525	D498-R527 PolarHBondContact O-NE 3.47Å; D498-R527 PolarHBondContact O-NH2 3.4Å; V499-R527 CarbonylContact O-C 3.5Å; V499-R527 VanDerWaalsContact O-CA 3.28Å; V499-R527 WeakPolarHBondContact O-CA 3.18Å; S521-R527 WeakPolarHBondContact CB-O 3.5Å; S521-R527 PolarHBondContact N-O 3.28Å; N524-R527 HydrophobicContact CB-CB 4.31Å; N524-R527 HydrophobicContact CB-CG 4.11Å; N524-R527 PolarHBondContact O-N 3.08Å; N524-R527 VanDerWaalsContact O-N 3.09Å; S525-R527 VanDerWaalsContact C-N 3.31Å
528	L	88.9	Confident	87.1	Confident	26 Å²	26	57.1 Å²	57.1	14%	0.136	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	134.1	173	-64.9	175	0	0	0	109.1	D498 V499 Q501 F506 V518 E519 I530	D498-L528 WeakPolarHBondContact CA-O 3.47Å; V499-L528 PolarHBondContact N-O 3.21Å; V499-L528 PolarHBondContact O-N 3.41Å; Q501-L528 HydrophobicContact CB-CD1 4.1Å; Q501-L528 HydrophobicContact CB-CG 4.2Å; Q501-L528 HydrophobicContact CG-CD1 3.85Å; Q501-L528 HydrophobicContact CG-CG 4.4Å; F506-L528 HydrophobicContact CD2-CD1 4.23Å; F506-L528 HydrophobicContact CE2-CD1 3.68Å; V518-L528 HydrophobicContact CG1-CB 4.19Å; V518-L528 HydrophobicContact CG1-CD1 4.01Å; V518-L528 HydrophobicContact CG1-CD2 4.41Å; V518-L528 HydrophobicContact CG1-CG 4.44Å; E519-L528 CarbonylContact O-C 3.55Å; E519-L528 WeakPolarHBondContact O-CA 3.31Å; L528-I530 HydrophobicContact CB-CG1 4.21Å; L528-I530 PolarHBondContact O-N 2.9Å
529	R	89.2	Confident	87.2	Confident	85 Å²	85	56.5 Å²	56.5	32%	0.321	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	108.5	168.3	-179.4	171	-70.1	-176.3	-1	108	T496 D498 V518 E519	T496-R529 HydrophobicContact CG2-CG 3.33Å; D498-R529 WeakPolarHBondContact OD1-CA 3.23Å; D498-R529 WeakPolarHBondContact OD1-CB 3.37Å; D498-R529 IonicContact OD1-NE 3.16Å; V518-R529 WeakPolarHBondContact CA-O 3.28Å; E519-R529 HydrophobicContact CB-CB 4.35Å; E519-R529 PolarHBondContact N-O 3.41Å; E519-R529 PolarHBondContact O-N 3.19Å
530	I	89.9	Confident	87.3	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.5	-179	-59.3	-170.1	0	0	0	109.2	T496 L497 V499 F506 I509 Y510 V515 V518 L528 A532	T496-I530 CarbonylContact C-O 3.58Å; T496-I530 VanDerWaalsContact CA-O 3.28Å; T496-I530 WeakPolarHBondContact CA-O 3.31Å; L497-I530 PolarHBondContact N-O 3.12Å; L497-I530 PolarHBondContact O-N 3.3Å; V499-I530 HydrophobicContact CG2-CD1 3.43Å; V499-I530 VanDerWaalsContact CG2-CD1 3.43Å; V499-I530 HydrophobicContact CG2-CG1 3.86Å; F506-I530 HydrophobicContact CD2-CD1 3.4Å; F506-I530 HydrophobicContact CE2-CD1 3.61Å; F506-I530 HydrophobicContact CG-CD1 4.42Å; I509-I530 HydrophobicContact CG2-CG2 4.14Å; Y510-I530 HydrophobicContact CE2-CD1 4.2Å; V515-I530 HydrophobicContact CG1-CG2 4.06Å; V515-I530 HydrophobicContact CG2-CG2 4.27Å; V518-I530 HydrophobicContact CG1-CG1 4.29Å; V518-I530 HydrophobicContact CG2-CG1 4.21Å; V518-I530 HydrophobicContact CG2-CG2 4.41Å; L528-I530 HydrophobicContact CB-CG1 4.21Å; L528-I530 PolarHBondContact O-N 2.9Å; I530-A532 HydrophobicContact CG2-CB 4.41Å
531	T	89.5	Confident	87.4	Confident	22 Å²	22	57 Å²	57	14%	0.135	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	129.5	165.8	-52.1	0	0	0	0	108.4	S494 R495 T496 T516 S517	S494-T531 WeakPolarHBondContact OG-CG2 3.35Å; R495-T531 WeakPolarHBondContact O-CA 3.38Å; T496-T531 PolarHBondContact OG1-OG1 3.45Å; T516-T531 PolarHBondContact N-O 3.21Å; T516-T531 VanDerWaalsContact OG1-CB 3.3Å; T516-T531 WeakPolarHBondContact OG1-CB 3.29Å; T516-T531 VanDerWaalsContact OG1-CG2 3.23Å; T516-T531 WeakPolarHBondContact OG1-CG2 3.36Å; T516-T531 PolarHBondContact OG1-O 3.48Å; S517-T531 PolarHBondContact N-O 3.32Å; S517-T531 PolarHBondContact O-N 3.11Å; S517-T531 VanDerWaalsContact OG-CB 3.32Å; S517-T531 WeakPolarHBondContact OG-CB 3.44Å; S517-T531 PolarHBondContact OG-OG1 3.14Å
532	A	89.5	Confident	87.7	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.008	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	146.8	179.9	0	0	0	0	0	111.3	S494 R495 I509 A513 M514 I530 F534	S494-A532 CarbonylContact C-O 3.42Å; S494-A532 WeakPolarHBondContact CA-O 2.96Å; R495-A532 PolarHBondContact N-O 3.06Å; R495-A532 PolarHBondContact O-N 3.01Å; I509-A532 HydrophobicContact CG2-CB 3.82Å; A513-A532 HydrophobicContact CB-CB 4.28Å; M514-A532 CarbonylContact O-C 3.51Å; M514-A532 VanDerWaalsContact O-CA 3.24Å; M514-A532 WeakPolarHBondContact O-CA 3.36Å; I530-A532 HydrophobicContact CG2-CB 4.41Å; A532-F534 HydrophobicContact CB-CD2 4.4Å; A532-F534 HydrophobicContact CB-CE2 3.73Å; A532-F534 HydrophobicContact CB-CZ 4.1Å; A532-F534 VanDerWaalsContact O-CD2 3.3Å; A532-F534 WeakPolarHBondContact O-CD2 3.15Å; A532-F534 WeakPolarHBondContact O-CE2 3.45Å
533	I	88.8	Confident	88.1	Confident	7 Å²	7	52.1 Å²	52.1	4%	0.036	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	126.6	170.7	-62.4	164.8	0	0	0	108.5	I360 M487 W492 F493 M514 T516	I360-I533 HydrophobicContact CD1-CD1 4.48Å; M487-I533 HydrophobicContact CE-CD1 4.24Å; M487-I533 HydrophobicContact CE-CG1 4Å; M487-I533 HydrophobicContact CE-CG2 4.15Å; M487-I533 HydrophobicContact SD-CD1 3.96Å; M487-I533 HydrophobicContact SD-CG1 4.39Å; W492-I533 HydrophobicContact CB-CG2 3.87Å; W492-I533 HydrophobicContact CE3-CG2 4.11Å; F493-I533 WeakPolarHBondContact O-CA 3.32Å; M514-I533 HydrophobicContact CB-CB 4.2Å; M514-I533 PolarHBondContact N-O 3.14Å; M514-I533 PolarHBondContact O-N 2.8Å; M514-I533 HydrophobicContact SD-CD1 4.13Å; T516-I533 HydrophobicContact CG2-CD1 3.69Å; T516-I533 HydrophobicContact CG2-CG1 3.69Å
534	F	88.8	Confident	88.5	Confident	1 Å²	1	57.2 Å²	57.2	0%	0.004	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	141.9	177.9	-67.1	-95.1	0	0	0	110.6	W492 F493 R495 L497 W508 I509 A513 A532 W539 F542	W492-F534 WeakPolarHBondContact CA-O 3.1Å; F493-F534 HydrophobicContact CE2-CB 4.08Å; F493-F534 HydrophobicContact CZ-CB 4.22Å; F493-F534 PolarHBondContact N-O 3.35Å; F493-F534 VanDerWaalsContact N-O 3.15Å; F493-F534 PolarHBondContact O-N 3.44Å; R495-F534 HydrophobicContact CB-CD2 4.12Å; R495-F534 HydrophobicContact CB-CE2 3.99Å; L497-F534 HydrophobicContact CD1-CE2 4.32Å; L497-F534 HydrophobicContact CD1-CZ 3.89Å; W508-F534 HydrophobicContact CZ3-CE1 4.11Å; I509-F534 HydrophobicContact CG1-CZ 4.27Å; A513-F534 HydrophobicContact CB-CD1 3.69Å; A513-F534 HydrophobicContact CB-CE1 3.53Å; A513-F534 HydrophobicContact CB-CG 4.29Å; A513-F534 HydrophobicContact CB-CZ 3.99Å; A532-F534 HydrophobicContact CB-CD2 4.4Å; A532-F534 HydrophobicContact CB-CE2 3.73Å; A532-F534 HydrophobicContact CB-CZ 4.1Å; A532-F534 VanDerWaalsContact O-CD2 3.3Å; A532-F534 WeakPolarHBondContact O-CD2 3.15Å; A532-F534 WeakPolarHBondContact O-CE2 3.45Å; F534-W539 HydrophobicContact CB-CB 4.16Å; F534-W539 HydrophobicContact CB-CE3 4.48Å; F534-W539 AromaticContact CD1-CE3 3.84Å; F534-W539 HydrophobicContact CD1-CE3 3.84Å; F534-W539 HydrophobicContact CD2-CE3 4.09Å; F534-W539 HydrophobicContact CD2-CZ3 4.38Å; F534-W539 HydrophobicContact CE1-CE3 4.02Å; F534-W539 HydrophobicContact CE1-CZ3 4.33Å; F534-W539 HydrophobicContact CE2-CE3 4.28Å; F534-W539 HydrophobicContact CE2-CZ3 4.18Å; F534-W539 AromaticContact CG-CE3 3.88Å; F534-W539 HydrophobicContact CG-CE3 3.88Å; F534-W539 HydrophobicContact CZ-CE3 4.24Å; F534-W539 HydrophobicContact CZ-CZ3 4.16Å; F534-F542 HydrophobicContact CE1-CB 4.48Å; F534-F542 HydrophobicContact CE1-CG 4.33Å
535	T	87.6	Confident	88.8	Confident	53 Å²	53	58 Å²	58	33%	0.325	29%	0.29	S	S	.	.			trans	-77.3	154.9	160.7	67	0	0	0	0	109.2	W492 V537 G538 W539	W492-T535 HydrophobicContact CZ2-CG2 4.47Å; T535-V537 PolarHBondContact O-N 3.34Å; T535-G538 PolarHBondContact O-N 3.28Å; T535-G538 VanDerWaalsContact O-N 3.1Å; T535-G538 PolarHBondContact OG1-N 3.29Å; T535-W539 PolarHBondContact O-N 3.39Å
536	P	86.8	Confident	89.2	Confident	50 Å²	50	55.4 Å²	55.4	33%	0.325	26%	0.264	S	S	.	.	H	α-helix	trans	-53.1	-43.4	176.4	-28.2	34.7	0	0	0	112.9	G491 I540	G491-P536 WeakPolarHBondContact O-CD 3.27Å; G491-P536 VanDerWaalsContact O-CG 3.3Å; G491-P536 WeakPolarHBondContact O-CG 3.49Å; P536-I540 WeakPolarHBondContact O-CG1 3.37Å; P536-I540 PolarHBondContact O-N 3.21Å
537	V	86.8	Confident	88.9	Confident	90 Å²	90	59.4 Å²	59.4	55%	0.545	28%	0.28	S	S	.	.	H	α-helix	trans	-69.3	-41.4	178.6	179.8	0	0	0	0	111.5	T535 W539 I540 K541	T535-V537 PolarHBondContact O-N 3.34Å; V537-W539 VanDerWaalsContact C-N 3.35Å; V537-I540 PolarHBondContact O-N 3.07Å; V537-K541 HydrophobicContact CG1-CD 4.37Å; V537-K541 WeakPolarHBondContact O-CG 3.12Å; V537-K541 PolarHBondContact O-N 3.4Å; V537-K541 VanDerWaalsContact O-N 3.1Å
538	G	88.1	Confident	88.1	Confident	9 Å²	9	58.1 Å²	58.1	9%	0.093	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-45.9	176.4	0	0	0	0	0	111.4	W508 T535 I540 K541 F542	W508-G538 WeakPolarHBondContact CH2-O 3.21Å; T535-G538 PolarHBondContact O-N 3.28Å; T535-G538 VanDerWaalsContact O-N 3.1Å; T535-G538 PolarHBondContact OG1-N 3.29Å; G538-I540 PolarHBondContact O-N 3.39Å; G538-K541 PolarHBondContact O-N 3.05Å; G538-F542 PolarHBondContact O-N 3.29Å
539	W	90.4	Very high	86.6	Confident	46 Å²	46	60.7 Å²	60.7	17%	0.174	30%	0.304	C	S	.	.	H	α-helix	trans	-61.8	-45.3	178	-177.5	-114.5	0	0	0	113.2	F493 R495 L497 F534 T535 V537 K541 F542 C543	F493-W539 HydrophobicContact CE1-CB 4.38Å; F493-W539 HydrophobicContact CE2-CB 4.21Å; F493-W539 AromaticContact CE2-CD2 3.97Å; F493-W539 HydrophobicContact CE2-CD2 3.97Å; F493-W539 HydrophobicContact CE2-CE3 4.34Å; F493-W539 AromaticContact CE2-CG 3.91Å; F493-W539 HydrophobicContact CE2-CG 3.91Å; F493-W539 HydrophobicContact CZ-CB 3.49Å; F493-W539 VanDerWaalsContact CZ-CB 3.49Å; F493-W539 AromaticContact CZ-CD1 3.72Å; F493-W539 HydrophobicContact CZ-CD2 4.03Å; F493-W539 AromaticContact CZ-CG 3.46Å; F493-W539 HydrophobicContact CZ-CG 3.46Å; F493-W539 VanDerWaalsContact CZ-CG 3.46Å; R495-W539 HydrophobicContact CB-CH2 4.5Å; R495-W539 HydrophobicContact CB-CZ3 4.28Å; R495-W539 HydrophobicContact CG-CH2 4.14Å; R495-W539 HydrophobicContact CG-CZ3 4.13Å; L497-W539 HydrophobicContact CD1-CZ3 4.24Å; L497-W539 HydrophobicContact CD2-CH2 4.21Å; L497-W539 HydrophobicContact CD2-CZ3 4.48Å; F534-W539 HydrophobicContact CB-CB 4.16Å; F534-W539 HydrophobicContact CB-CE3 4.48Å; F534-W539 AromaticContact CD1-CE3 3.84Å; F534-W539 HydrophobicContact CD1-CE3 3.84Å; F534-W539 HydrophobicContact CD2-CE3 4.09Å; F534-W539 HydrophobicContact CD2-CZ3 4.38Å; F534-W539 HydrophobicContact CE1-CE3 4.02Å; F534-W539 HydrophobicContact CE1-CZ3 4.33Å; F534-W539 HydrophobicContact CE2-CE3 4.28Å; F534-W539 HydrophobicContact CE2-CZ3 4.18Å; F534-W539 AromaticContact CG-CE3 3.88Å; F534-W539 HydrophobicContact CG-CE3 3.88Å; F534-W539 HydrophobicContact CZ-CE3 4.24Å; F534-W539 HydrophobicContact CZ-CZ3 4.16Å; T535-W539 PolarHBondContact O-N 3.39Å; V537-W539 VanDerWaalsContact C-N 3.35Å; W539-K541 VanDerWaalsContact C-N 3.28Å; W539-K541 PolarHBondContact O-N 3.31Å; W539-F542 HydrophobicContact CE3-CD1 4.09Å; W539-F542 HydrophobicContact CH2-CD1 4.41Å; W539-F542 AromaticContact CZ3-CD1 3.77Å; W539-F542 HydrophobicContact CZ3-CD1 3.77Å; W539-F542 HydrophobicContact CZ3-CE1 4.2Å; W539-F542 WeakPolarHBondContact O-CB 3.46Å; W539-F542 PolarHBondContact O-N 2.81Å; W539-F542 VanDerWaalsContact O-N 3.12Å; W539-C543 VanDerWaalsContact CZ2-SG 3.56Å; W539-C543 PolarHBondContact O-N 3.08Å; W539-C543 PolarHBondContact O-SG 3.16Å
540	I	89.9	Confident	84.6	Confident	71 Å²	71	61.5 Å²	61.5	36%	0.364	32%	0.323	S	S	.	.	H	α-helix	trans	-59.6	-41.8	177.2	-68	165.8	0	0	0	110.8	P536 V537 G538 R544	P536-I540 WeakPolarHBondContact O-CG1 3.37Å; P536-I540 PolarHBondContact O-N 3.21Å; V537-I540 PolarHBondContact O-N 3.07Å; G538-I540 PolarHBondContact O-N 3.39Å; I540-R544 WeakPolarHBondContact O-CB 3.47Å; I540-R544 VanDerWaalsContact O-CG 3.3Å; I540-R544 WeakPolarHBondContact O-CG 3.45Å; I540-R544 PolarHBondContact O-N 3.36Å; I540-R544 VanDerWaalsContact O-N 3.14Å
541	K	90.1	Very high	82.3	Confident	125 Å²	125	65.9 Å²	65.9	54%	0.543	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-41.8	175.5	-71.8	177.4	179.4	-179.7	0	111.7	W508 V537 G538 W539 T545	W508-K541 HydrophobicContact CH2-CB 4.48Å; W508-K541 HydrophobicContact CZ2-CB 3.93Å; V537-K541 HydrophobicContact CG1-CD 4.37Å; V537-K541 WeakPolarHBondContact O-CG 3.12Å; V537-K541 PolarHBondContact O-N 3.4Å; V537-K541 VanDerWaalsContact O-N 3.1Å; G538-K541 PolarHBondContact O-N 3.05Å; W539-K541 VanDerWaalsContact C-N 3.28Å; W539-K541 PolarHBondContact O-N 3.31Å; K541-T545 WeakPolarHBondContact O-CB 3.13Å; K541-T545 VanDerWaalsContact O-CG2 3.28Å; K541-T545 WeakPolarHBondContact O-CG2 3Å; K541-T545 PolarHBondContact O-N 3.04Å; K541-T545 PolarHBondContact O-OG1 3.07Å
542	F	91.9	Very high	79.9	Confident	3 Å²	3	71.1 Å²	71.1	1%	0.013	38%	0.377	C	S	.	.	H	α-helix	trans	-61	-51.9	177.1	-175.4	-109.2	0	0	0	112	L497 W508 I509 F534 G538 W539 R544 T545 F546 M548	L497-F542 HydrophobicContact CD1-CD1 4.38Å; L497-F542 HydrophobicContact CD1-CE1 3.49Å; L497-F542 VanDerWaalsContact CD1-CE1 3.49Å; L497-F542 HydrophobicContact CD1-CZ 3.73Å; W508-F542 AromaticContact CD2-CD2 3.8Å; W508-F542 HydrophobicContact CD2-CD2 3.8Å; W508-F542 HydrophobicContact CE3-CB 4.16Å; W508-F542 AromaticContact CE3-CD2 3.26Å; W508-F542 HydrophobicContact CE3-CD2 3.26Å; W508-F542 HydrophobicContact CE3-CE2 4.01Å; W508-F542 HydrophobicContact CE3-CG 4.1Å; W508-F542 HydrophobicContact CG-CD2 4.5Å; W508-F542 HydrophobicContact CH2-CB 3.68Å; W508-F542 HydrophobicContact CH2-CD2 4.35Å; W508-F542 HydrophobicContact CH2-CG 4.48Å; W508-F542 HydrophobicContact CZ2-CB 4.24Å; W508-F542 HydrophobicContact CZ3-CB 3.62Å; W508-F542 AromaticContact CZ3-CD2 3.6Å; W508-F542 HydrophobicContact CZ3-CD2 3.6Å; W508-F542 AromaticContact CZ3-CG 3.96Å; W508-F542 HydrophobicContact CZ3-CG 3.96Å; I509-F542 HydrophobicContact CD1-CE2 4.01Å; I509-F542 HydrophobicContact CD1-CZ 3.93Å; I509-F542 HydrophobicContact CG1-CD2 4.32Å; I509-F542 HydrophobicContact CG1-CE2 3.68Å; I509-F542 HydrophobicContact CG1-CZ 4.1Å; F534-F542 HydrophobicContact CE1-CB 4.48Å; F534-F542 HydrophobicContact CE1-CG 4.33Å; G538-F542 PolarHBondContact O-N 3.29Å; W539-F542 HydrophobicContact CE3-CD1 4.09Å; W539-F542 HydrophobicContact CH2-CD1 4.41Å; W539-F542 AromaticContact CZ3-CD1 3.77Å; W539-F542 HydrophobicContact CZ3-CD1 3.77Å; W539-F542 HydrophobicContact CZ3-CE1 4.2Å; W539-F542 WeakPolarHBondContact O-CB 3.46Å; W539-F542 PolarHBondContact O-N 2.81Å; W539-F542 VanDerWaalsContact O-N 3.12Å; F542-R544 VanDerWaalsContact C-N 3.31Å; F542-R544 PolarHBondContact O-N 3.05Å; F542-T545 WeakPolarHBondContact CA-OG1 3.31Å; F542-T545 PolarHBondContact O-N 3.25Å; F542-T545 PolarHBondContact O-OG1 3.04Å; F542-F546 AromaticContact CD2-CD2 3.51Å; F542-F546 HydrophobicContact CD2-CD2 3.51Å; F542-F546 AromaticContact CD2-CE2 3.71Å; F542-F546 HydrophobicContact CD2-CE2 3.71Å; F542-F546 AromaticContact CE2-CD2 3.39Å; F542-F546 HydrophobicContact CE2-CD2 3.39Å; F542-F546 AromaticContact CE2-CE2 3.61Å; F542-F546 HydrophobicContact CE2-CE2 3.61Å; F542-F546 HydrophobicContact CE2-CG 4.39Å; F542-F546 HydrophobicContact CG-CD2 4.3Å; F542-F546 HydrophobicContact CZ-CD2 4.07Å; F542-F546 PolarHBondContact O-N 3.25Å; F542-F546 VanDerWaalsContact O-N 3.09Å; F542-M548 HydrophobicContact CD1-SD 4.12Å; F542-M548 HydrophobicContact CE1-SD 3.5Å; F542-M548 VanDerWaalsContact CE1-SD 3.5Å; F542-M548 HydrophobicContact CZ-SD 4.37Å
543	C	90.7	Very high	77.1	Confident	11 Å²	11	76.5 Å²	76.5	7%	0.074	41%	0.405	C	S	.	.	H	α-helix	trans	-61	-40.1	-179.3	-66.8	0	0	0	0	112.2	W539 K547 M548	W539-C543 VanDerWaalsContact CZ2-SG 3.56Å; W539-C543 PolarHBondContact O-N 3.08Å; W539-C543 PolarHBondContact O-SG 3.16Å; C543-K547 WeakPolarHBondContact O-CA 3.22Å; C543-K547 PolarHBondContact O-N 3.09Å; C543-M548 HydrophobicContact CB-CB 4.38Å; C543-M548 PolarHBondContact O-N 2.82Å
544	R	89.7	Confident	74.7	Confident	204 Å²	204	80.8 Å²	80.8	77%	0.77	43%	0.432	S	S	*	.	H	α-helix	trans	-66.2	-43.5	177	-74.7	178.7	-179.5	179.7	1.7	112.8	I540 F542	I540-R544 WeakPolarHBondContact O-CB 3.47Å; I540-R544 VanDerWaalsContact O-CG 3.3Å; I540-R544 WeakPolarHBondContact O-CG 3.45Å; I540-R544 PolarHBondContact O-N 3.36Å; I540-R544 VanDerWaalsContact O-N 3.14Å; F542-R544 VanDerWaalsContact C-N 3.31Å; F542-R544 PolarHBondContact O-N 3.05Å
545	T	90.7	Very high	71.9	Confident	80 Å²	80	85.3 Å²	85.3	49%	0.491	46%	0.463	S	S	.	.	H	α-helix	trans	-67.9	-37.3	-177.4	45.8	0	0	0	0	112.4	K541 F542	K541-T545 WeakPolarHBondContact O-CB 3.13Å; K541-T545 VanDerWaalsContact O-CG2 3.28Å; K541-T545 WeakPolarHBondContact O-CG2 3Å; K541-T545 PolarHBondContact O-N 3.04Å; K541-T545 PolarHBondContact O-OG1 3.07Å; F542-T545 WeakPolarHBondContact CA-OG1 3.31Å; F542-T545 PolarHBondContact O-N 3.25Å; F542-T545 PolarHBondContact O-OG1 3.04Å
546	F	89.7	Confident	69	Low	61 Å²	61	90.4 Å²	90.4	27%	0.268	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	15	-178	-61.1	-71	0	0	0	114.4	P504 S505 W508 F542 M548	P504-F546 HydrophobicContact CB-CE1 4.01Å; P504-F546 HydrophobicContact CB-CZ 4.44Å; P504-F546 HydrophobicContact CG-CE1 4.19Å; S505-F546 VanDerWaalsContact CA-CZ 3.41Å; S505-F546 WeakPolarHBondContact OG-CD1 3.48Å; S505-F546 WeakPolarHBondContact OG-CE1 3.41Å; S505-F546 WeakPolarHBondContact OG-CG 3.27Å; W508-F546 HydrophobicContact CB-CE2 3.69Å; W508-F546 HydrophobicContact CB-CZ 3.78Å; W508-F546 HydrophobicContact CD2-CE2 4.24Å; W508-F546 AromaticContact CG-CE2 3.69Å; W508-F546 HydrophobicContact CG-CE2 3.69Å; W508-F546 HydrophobicContact CG-CZ 4.13Å; F542-F546 AromaticContact CD2-CD2 3.51Å; F542-F546 HydrophobicContact CD2-CD2 3.51Å; F542-F546 AromaticContact CD2-CE2 3.71Å; F542-F546 HydrophobicContact CD2-CE2 3.71Å; F542-F546 AromaticContact CE2-CD2 3.39Å; F542-F546 HydrophobicContact CE2-CD2 3.39Å; F542-F546 AromaticContact CE2-CE2 3.61Å; F542-F546 HydrophobicContact CE2-CE2 3.61Å; F542-F546 HydrophobicContact CE2-CG 4.39Å; F542-F546 HydrophobicContact CG-CD2 4.3Å; F542-F546 HydrophobicContact CZ-CD2 4.07Å; F542-F546 PolarHBondContact O-N 3.25Å; F542-F546 VanDerWaalsContact O-N 3.09Å; F546-M548 PolarHBondContact O-N 2.86Å; F546-M548 VanDerWaalsContact O-N 3.1Å
547	K	81.3	Confident	66.3	Low	195 Å²	195	92.3 Å²	92.3	85%	0.848	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	37	177.8	-59.5	-178.9	-179.7	178.4	0	113.4	C543	C543-K547 WeakPolarHBondContact O-CA 3.22Å; C543-K547 PolarHBondContact O-N 3.09Å
548	M	72.7	Confident	63.5	Low	80 Å²	80	95.9 Å²	95.9	39%	0.394	51%	0.506	S	S	.	.			trans	-71.8	137.5	171.1	-68.1	-173	71.2	0	0	108.5	L497 F542 C543 F546 S550	L497-M548 HydrophobicContact CD2-CE 4.18Å; F542-M548 HydrophobicContact CD1-SD 4.12Å; F542-M548 HydrophobicContact CE1-SD 3.5Å; F542-M548 VanDerWaalsContact CE1-SD 3.5Å; F542-M548 HydrophobicContact CZ-SD 4.37Å; C543-M548 HydrophobicContact CB-CB 4.38Å; C543-M548 PolarHBondContact O-N 2.82Å; F546-M548 PolarHBondContact O-N 2.86Å; F546-M548 VanDerWaalsContact O-N 3.1Å; M548-S550 PolarHBondContact O-N 3.38Å; M548-S550 VanDerWaalsContact O-N 3.08Å
549	A	55.6	Low	60.7	Low	79 Å²	79	107.5 Å²	107.5	65%	0.653	55%	0.554	S	S	*	*			trans	-55.9	120.7	169.1	0	0	0	0	0	107.7	S551	A549-S551 PolarHBondContact O-N 3.22Å
550	S	48.7	Very low	59.2	Low	103 Å²	103	110.6 Å²	110.6	72%	0.72	57%	0.573	S	S	*	*			trans	-72.1	49.2	163	61.5	0	0	0	0	108.8	M548 E552	M548-S550 PolarHBondContact O-N 3.38Å; M548-S550 VanDerWaalsContact O-N 3.08Å; S550-E552 PolarHBondContact O-N 2.99Å
551	S	40.4	Very low	57.6	Low	93 Å²	93	112.7 Å²	112.7	65%	0.65	58%	0.584	S	S	*	*			trans	-83	68.1	178.5	58.1	0	0	0	0	108.1	A549	A549-S551 PolarHBondContact O-N 3.22Å
552	E	39	Very low	55.7	Low	131 Å²	131	112 Å²	112	61%	0.612	59%	0.586	S	S	*	*	S	Bend	trans	-177.6	106.6	158	-105.6	165.5	-155.6	0	0	105.9	R495 S550 V554	R495-E552 IonicContact CZ-OE2 2.97Å; R495-E552 IonicContact NH1-OE2 3.75Å; R495-E552 IonicContact NH2-OE2 3.39Å; R495-E552 PolarHBondContact NH2-OE2 3.05Å; S550-E552 PolarHBondContact O-N 2.99Å; E552-V554 PolarHBondContact O-N 3Å
553	N	32.2	Very low	53.6	Low	114 Å²	114	118.4 Å²	118.4	61%	0.61	62%	0.62	S	S	*	*			trans	-45	120.3	179.2	-71.8	-49.9	0	0	0	111	S555 Q556	N553-S555 PolarHBondContact O-N 3.36Å; N553-Q556 PolarHBondContact O-N 2.94Å
554	V	37.1	Very low	51.3	Low	97 Å²	97	125.1 Å²	125.1	59%	0.588	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	-15.7	174	176.9	0	0	0	0	111.9	E552 F558	E552-V554 PolarHBondContact O-N 3Å; V554-F558 WeakPolarHBondContact O-CD2 3.47Å
555	S	29.8	Very low	48.7	Very low	96 Å²	96	119.9 Å²	119.9	67%	0.671	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-14.8	177.2	45.3	0	0	0	0	116.2	N553	N553-S555 PolarHBondContact O-N 3.36Å
556	Q	28.1	Very low	45.7	Very low	160 Å²	160	122.7 Å²	122.7	75%	0.748	66%	0.657	S	S	*	*	S	Bend	trans	-95.2	-9.6	179.8	-93.5	-177.5	-14.3	0	0	115.2	N553	N553-Q556 PolarHBondContact O-N 2.94Å
557	C	29.3	Very low	42.4	Very low	90 Å²	90	127.5 Å²	127.5	61%	0.608	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	4.7	175.8	-72.8	0	0	0	0	114.4	K559	C557-K559 VanDerWaalsContact C-N 3.34Å
558	F	28.4	Very low	39.1	Very low	165 Å²	165	121.8 Å²	121.8	72%	0.724	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	13.3	177	-84.5	-77.1	0	0	0	114	V554	V554-F558 WeakPolarHBondContact O-CD2 3.47Å
559	K	28.1	Very low	36.1	Very low	254 Å²	254	125.6 Å²	125.6	100%	1.104	70%	0.699	S	S	*	*			trans	-109.4	0	166.1	-74.3	-174.4	177.2	-177.7	0	108.9	C557	C557-K559 VanDerWaalsContact C-N 3.34Å

Retrieved 559 of 559 residues in 376.8 ms (Link to these results)

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