A0A3Q0KL20_SCHMA Loading...

RUN domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KL20, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 544 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.2	Very low	45.4	Very low	117 Å²	117	83.2 Å²	83.2	58%	0.576	52%	0.515	S	S	*	.				0	109.4	0	-175.8	-173.4	-172.5	0	0	107	I3 R15 F16 L114	M1-I3 HydrophobicContact CE-CD1 3.65Å; M1-I3 HydrophobicContact CE-CG1 3.68Å; M1-I3 HydrophobicContact CG-CG1 3.93Å; M1-I3 HydrophobicContact SD-CD1 3.92Å; M1-I3 HydrophobicContact SD-CG1 3.98Å; M1-R15 VanDerWaalsContact CE-CD 3.49Å; M1-R15 HydrophobicContact CE-CG 4.23Å; M1-F16 CarbonylContact C-O 3.6Å; M1-L114 HydrophobicContact CG-CD1 4.42Å
2	C	48.1	Very low	46.1	Very low	15 Å²	15	79.4 Å²	79.4	10%	0.101	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	102.5	170.5	-56.2	0	0	0	0	106.1	F16 N68	C2-F16 PolarHBondContact N-O 3.24Å; C2-F16 PolarHBondContact O-N 3Å; C2-N68 PolarHBondContact SG-O 3.01Å
3	I	46.9	Very low	47.3	Very low	83 Å²	83	83.6 Å²	83.6	43%	0.426	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	110.7	165.3	-57.6	174.6	0	0	0	104.6	M1 R15	M1-I3 HydrophobicContact CE-CD1 3.65Å; M1-I3 HydrophobicContact CE-CG1 3.68Å; M1-I3 HydrophobicContact CG-CG1 3.93Å; M1-I3 HydrophobicContact SD-CD1 3.92Å; M1-I3 HydrophobicContact SD-CG1 3.98Å; I3-R15 HydrophobicContact CG1-CG 4.46Å
4	L	48.8	Very low	48.3	Very low	59 Å²	59	77.6 Å²	77.6	31%	0.309	46%	0.456	S	S	.	.			trans	-94.1	111.5	171.9	-61.7	168.5	0	0	0	107.1	F6 I155	L4-F6 HydrophobicContact CB-CD1 4.36Å; L4-F6 HydrophobicContact CB-CE1 3.34Å; L4-F6 HydrophobicContact CB-CE2 3.9Å; L4-F6 HydrophobicContact CB-CZ 3.07Å; L4-F6 HydrophobicContact CD1-CE1 4.4Å; L4-F6 HydrophobicContact CD1-CZ 3.95Å; L4-F6 HydrophobicContact CG-CE1 4.37Å; L4-F6 HydrophobicContact CG-CZ 4.12Å; L4-F6 WeakPolarHBondContact O-CE2 3.45Å; L4-I155 HydrophobicContact CD1-CD1 3.4Å; L4-I155 VanDerWaalsContact CD1-CD1 3.4Å; L4-I155 HydrophobicContact CD1-CG1 3.66Å; L4-I155 HydrophobicContact CD1-CG2 4.2Å
5	S	41.3	Very low	49.5	Very low	93 Å²	93	79.9 Å²	79.9	65%	0.65	45%	0.454	S	S	*	.			trans	-92.6	132.7	173.5	44.9	0	0	0	0	109.2
6	F	49	Very low	50.3	Low	40 Å²	40	75.2 Å²	75.2	18%	0.175	43%	0.427	C	S	.	.			trans	-122.5	132.7	-169.6	-54.3	-51.2	0	0	0	112.1	L4 E151 R154 I155	L4-F6 HydrophobicContact CB-CD1 4.36Å; L4-F6 HydrophobicContact CB-CE1 3.34Å; L4-F6 HydrophobicContact CB-CE2 3.9Å; L4-F6 HydrophobicContact CB-CZ 3.07Å; L4-F6 HydrophobicContact CD1-CE1 4.4Å; L4-F6 HydrophobicContact CD1-CZ 3.95Å; L4-F6 HydrophobicContact CG-CE1 4.37Å; L4-F6 HydrophobicContact CG-CZ 4.12Å; L4-F6 WeakPolarHBondContact O-CE2 3.45Å; F6-E151 HydrophobicContact CD2-CG 4.23Å; F6-E151 WeakPolarHBondContact CE1-OE1 3.43Å; F6-E151 HydrophobicContact CE2-CG 3.58Å; F6-E151 WeakPolarHBondContact CE2-OE1 3.37Å; F6-E151 HydrophobicContact CZ-CG 4.08Å; F6-E151 WeakPolarHBondContact CZ-OE1 3.36Å; F6-R154 VanDerWaalsContact CZ-NH2 3.27Å; F6-I155 HydrophobicContact CZ-CD1 4.2Å; F6-I155 HydrophobicContact CZ-CG1 4.47Å
7	P	42.1	Very low	50.7	Low	117 Å²	117	72.2 Å²	72.2	76%	0.76	41%	0.412	S	S	*	.	S	Bend	trans	-74.9	131.2	173.8	28.8	-30.3	0	0	0	110.7	S9	P7-S9 PolarHBondContact O-N 3.42Å
8	N	48.4	Very low	51	Low	175 Å²	175	69.6 Å²	69.6	94%	0.936	40%	0.398	S	S	*	.	S	Bend	trans	73.4	11.2	164.8	-63.3	-11.1	0	0	0	120.4
9	S	42.4	Very low	50.9	Low	52 Å²	52	72.2 Å²	72.2	36%	0.364	40%	0.401	S	S	.	.	S	Bend	trans	-106.7	136.7	161	60.4	0	0	0	0	109.8	P7 S11	P7-S9 PolarHBondContact O-N 3.42Å; S9-S11 PolarHBondContact O-N 2.99Å
10	G	44.3	Very low	50.5	Low	66 Å²	66	74.5 Å²	74.5	68%	0.68	41%	0.408	S	S	*	.			trans	-55.7	99.2	179.4	0	0	0	0	0	112	L12	G10-L12 VanDerWaalsContact C-N 3.34Å; G10-L12 PolarHBondContact O-N 3.06Å
11	S	50.1	Low	50	Low	98 Å²	98	73.7 Å²	73.7	69%	0.685	40%	0.403	S	S	*	.	S	Bend	trans	40.6	35.5	154.9	64.5	0	0	0	0	119.6	S9	S9-S11 PolarHBondContact O-N 2.99Å
12	L	54	Low	50	Low	38 Å²	38	75.8 Å²	75.8	20%	0.199	41%	0.412	C	S	.	.			trans	-95.9	96.5	167.4	-152.5	150.1	0	0	0	109.5	G10 L14 I144 L147	G10-L12 VanDerWaalsContact C-N 3.34Å; G10-L12 PolarHBondContact O-N 3.06Å; L12-L14 HydrophobicContact CD2-CD2 3.34Å; L12-L14 HydrophobicContact CD2-CG 3.93Å; L12-L14 PolarHBondContact O-N 3.34Å; L12-I144 HydrophobicContact CD1-CG2 4.45Å; L12-L147 HydrophobicContact CD1-CB 4.31Å
13	Y	61	Low	49.3	Very low	134 Å²	134	76 Å²	76	53%	0.525	42%	0.416	S	S	.	.			trans	-83.2	102.4	176.7	-65	-85.6	0	0	0	109.8
14	L	61.8	Low	48.8	Very low	0 Å²	0	77.6 Å²	77.6	0%	0	44%	0.435	C	S	.	.			trans	-75.5	130.2	166.9	-64.4	-168.2	0	0	0	109.8	L12 F16 D115 A118 E151 L152 I155	L12-L14 HydrophobicContact CD2-CD2 3.34Å; L12-L14 HydrophobicContact CD2-CG 3.93Å; L12-L14 PolarHBondContact O-N 3.34Å; L14-F16 HydrophobicContact CB-CE2 3.62Å; L14-F16 HydrophobicContact CB-CZ 4.01Å; L14-F16 HydrophobicContact CD1-CE2 4.09Å; L14-F16 HydrophobicContact CD1-CZ 3.94Å; L14-D115 WeakPolarHBondContact CD2-OD2 3.3Å; L14-A118 HydrophobicContact CD2-CB 4.49Å; L14-E151 HydrophobicContact CD1-CB 3.81Å; L14-E151 HydrophobicContact CD1-CG 3.42Å; L14-E151 VanDerWaalsContact CD1-CG 3.42Å; L14-E151 HydrophobicContact CG-CB 4.43Å; L14-E151 HydrophobicContact CG-CG 3.81Å; L14-L152 HydrophobicContact CD1-CD2 3.85Å; L14-L152 HydrophobicContact CD1-CG 3.97Å; L14-I155 HydrophobicContact CD1-CD1 3.97Å
15	R	65.6	Low	48.2	Very low	112 Å²	112	84.3 Å²	84.3	42%	0.423	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121.7	179.8	-73.8	178.5	174.2	178.2	2.3	108.7	M1 I3 L114	M1-R15 VanDerWaalsContact CE-CD 3.49Å; M1-R15 HydrophobicContact CE-CG 4.23Å; I3-R15 HydrophobicContact CG1-CG 4.46Å; R15-L114 HydrophobicContact CB-CB 3.81Å; R15-L114 HydrophobicContact CB-CD1 4.27Å; R15-L114 WeakPolarHBondContact O-CB 3.45Å; R15-L114 PolarHBondContact O-N 3.1Å
16	F	62.5	Low	48	Very low	4 Å²	4	83 Å²	83	2%	0.018	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.6	174.3	-59.3	-76.7	0	0	0	109.7	M1 C2 L14 P113 L152 I155 L157	M1-F16 CarbonylContact C-O 3.6Å; C2-F16 PolarHBondContact N-O 3.24Å; C2-F16 PolarHBondContact O-N 3Å; L14-F16 HydrophobicContact CB-CE2 3.62Å; L14-F16 HydrophobicContact CB-CZ 4.01Å; L14-F16 HydrophobicContact CD1-CE2 4.09Å; L14-F16 HydrophobicContact CD1-CZ 3.94Å; F16-P113 HydrophobicContact CE1-CB 4.31Å; F16-L152 HydrophobicContact CE1-CD2 4.12Å; F16-L152 HydrophobicContact CZ-CD2 3.53Å; F16-I155 HydrophobicContact CE2-CD1 3.72Å; F16-I155 HydrophobicContact CZ-CD1 4.48Å; F16-L157 HydrophobicContact CE1-CD2 3.96Å; F16-L157 HydrophobicContact CZ-CD2 4.36Å
17	S	58.1	Low	47.1	Very low	25 Å²	25	88 Å²	88	18%	0.175	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	122.2	161.7	51.6	0	0	0	0	109.6	R19 W111 R112	S17-R19 PolarHBondContact O-N 3.37Å; S17-W111 WeakPolarHBondContact O-CA 3.35Å; S17-R112 PolarHBondContact N-O 3.03Å; S17-R112 PolarHBondContact O-N 3.31Å; S17-R112 VanDerWaalsContact OG-CG 3.27Å; S17-R112 WeakPolarHBondContact OG-CG 3.32Å
18	P	54.7	Low	46.6	Very low	25 Å²	25	89.2 Å²	89.2	16%	0.162	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	129.5	155.6	27.7	-30.5	0	0	0	106.6	Q20	P18-Q20 PolarHBondContact O-N 3.33Å; P18-Q20 VanDerWaalsContact O-N 3.09Å
19	R	49.4	Very low	45.8	Very low	118 Å²	118	84.3 Å²	84.3	45%	0.445	46%	0.455	S	S	.	.			trans	-76.6	100.1	174.7	-171.1	175.3	158.1	148.2	0.7	107.6	S17 D21 G110	S17-R19 PolarHBondContact O-N 3.37Å; R19-D21 IonicContact CZ-OD1 2.61Å; R19-D21 IonicContact NE-OD1 3.36Å; R19-D21 PolarHBondContact NE-OD1 3.44Å; R19-D21 IonicContact NE-OD2 3.18Å; R19-D21 IonicContact NH2-OD1 3.19Å; R19-D21 PolarHBondContact NH2-OD1 2.98Å; R19-D21 PolarHBondContact O-N 3.03Å; R19-G110 WeakPolarHBondContact CB-O 3.29Å; R19-G110 PolarHBondContact N-O 2.77Å
20	Q	42.4	Very low	45.1	Very low	119 Å²	119	91 Å²	91	56%	0.556	48%	0.478	S	S	*	.			trans	-84.9	99	164.7	-72.5	-179.7	-6.5	0	0	107.2	P18 H22	P18-Q20 PolarHBondContact O-N 3.33Å; P18-Q20 VanDerWaalsContact O-N 3.09Å; Q20-H22 PolarHBondContact O-N 3.42Å; Q20-H22 VanDerWaalsContact O-N 3.17Å
21	D	40.9	Very low	44.5	Very low	57 Å²	57	92 Å²	92	31%	0.305	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	115.7	165.7	-70.6	-29.7	0	0	0	106.8	R19	R19-D21 IonicContact CZ-OD1 2.61Å; R19-D21 IonicContact NE-OD1 3.36Å; R19-D21 PolarHBondContact NE-OD1 3.44Å; R19-D21 IonicContact NE-OD2 3.18Å; R19-D21 IonicContact NH2-OD1 3.19Å; R19-D21 PolarHBondContact NH2-OD1 2.98Å; R19-D21 PolarHBondContact O-N 3.03Å
22	H	37.4	Very low	43.7	Very low	162 Å²	162	93.6 Å²	93.6	75%	0.75	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	22.2	178.3	-49.1	-64	0	0	0	121.1	Q20	Q20-H22 PolarHBondContact O-N 3.42Å; Q20-H22 VanDerWaalsContact O-N 3.17Å
23	G	33.9	Very low	42.8	Very low	19 Å²	19	99.6 Å²	99.6	20%	0.196	49%	0.491	C	S	.	.			trans	-86	127.5	161.7	0	0	0	0	0	111.3	Y25 S26	G23-Y25 PolarHBondContact O-N 2.96Å; G23-S26 WeakPolarHBondContact O-CB 3.24Å; G23-S26 PolarHBondContact O-N 3.13Å; G23-S26 PolarHBondContact O-OG 3.15Å
24	S	35.9	Very low	41.3	Very low	116 Å²	116	101.3 Å²	101.3	81%	0.811	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-52.5	-12	177.9	-47.1	0	0	0	0	115.2	S26	S24-S26 VanDerWaalsContact C-N 3.31Å
25	Y	38.1	Very low	39.7	Very low	201 Å²	201	108.7 Å²	108.7	79%	0.788	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-76.9	-7.3	172.1	-64.6	-76.8	0	0	0	114.6	G23 N27	G23-Y25 PolarHBondContact O-N 2.96Å; Y25-N27 PolarHBondContact O-N 3.38Å
26	S	35.2	Very low	38	Very low	66 Å²	66	108.8 Å²	108.8	46%	0.462	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-68	-18.7	-179.5	63.2	0	0	0	0	114.3	G23 S24 L28	G23-S26 WeakPolarHBondContact O-CB 3.24Å; G23-S26 PolarHBondContact O-N 3.13Å; G23-S26 PolarHBondContact O-OG 3.15Å; S24-S26 VanDerWaalsContact C-N 3.31Å; S26-L28 VanDerWaalsContact C-N 3.35Å
27	N	30.4	Very low	36.4	Very low	143 Å²	143	114.1 Å²	114.1	77%	0.765	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-89.1	3.3	-175.7	-66.7	-8.2	0	0	0	114.1	Y25	Y25-N27 PolarHBondContact O-N 3.38Å
28	L	31.5	Very low	34.8	Very low	144 Å²	144	121.9 Å²	121.9	75%	0.754	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-110.9	0.9	-180	-66.6	175.4	0	0	0	114.1	S26 F30	S26-L28 VanDerWaalsContact C-N 3.35Å; L28-F30 PolarHBondContact O-N 3Å
29	S	31.6	Very low	33.5	Very low	71 Å²	71	129.1 Å²	129.1	50%	0.497	66%	0.658	S	S	.	*	S	Bend	trans	-89.9	105.6	170.8	59.6	0	0	0	0	109.9	D31	S29-D31 PolarHBondContact O-N 3.27Å; S29-D31 VanDerWaalsContact O-N 3.16Å
30	F	28.1	Very low	32.6	Very low	194 Å²	194	131.4 Å²	131.4	85%	0.851	68%	0.677	S	S	*	*			trans	-50.9	117.3	168.8	-67.5	-86.2	0	0	0	110	L28 M32	L28-F30 PolarHBondContact O-N 3Å; F30-M32 PolarHBondContact O-N 3.28Å
31	D	31.4	Very low	31.7	Very low	85 Å²	85	133.7 Å²	133.7	46%	0.455	69%	0.693	S	S	.	*			trans	-75.6	111.2	170.9	-97.9	-27.9	0	0	0	108.1	S29 F33 E34 R112	S29-D31 PolarHBondContact O-N 3.27Å; S29-D31 VanDerWaalsContact O-N 3.16Å; D31-F33 PolarHBondContact O-N 3.02Å; D31-E34 PolarHBondContact O-N 3.2Å; D31-E34 VanDerWaalsContact O-N 3.11Å; D31-R112 IonicContact OD1-CZ 2.84Å; D31-R112 IonicContact OD1-NH1 3.73Å; D31-R112 PolarHBondContact OD1-NH1 3.12Å; D31-R112 IonicContact OD1-NH2 3.01Å; D31-R112 PolarHBondContact OD1-NH2 3Å
32	M	33.6	Very low	30.9	Very low	133 Å²	133	139 Å²	139	66%	0.655	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-63.6	6.4	179.3	-171.1	160	152.5	0	0	114.2	F30 E34	F30-M32 PolarHBondContact O-N 3.28Å; M32-E34 VanDerWaalsContact C-N 3.29Å
33	F	34.6	Very low	30.2	Very low	163 Å²	163	139.5 Å²	139.5	72%	0.715	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-81.3	-6.7	168.6	-70.4	-72.8	0	0	0	113.2	D31 L35	D31-F33 PolarHBondContact O-N 3.02Å; F33-L35 PolarHBondContact O-N 2.61Å
34	E	29.6	Very low	29.7	Very low	170 Å²	170	143.2 Å²	143.2	79%	0.794	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-74	-5.4	173.2	-158.2	170.6	-170	0	0	113.5	D31 M32	D31-E34 PolarHBondContact O-N 3.2Å; D31-E34 VanDerWaalsContact O-N 3.11Å; M32-E34 VanDerWaalsContact C-N 3.29Å
35	L	28.1	Very low	29.2	Very low	156 Å²	156	144.8 Å²	144.8	82%	0.817	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-110.5	13.1	180	-69.4	174.2	0	0	0	115	F33	F33-L35 PolarHBondContact O-N 2.61Å
36	V	31.4	Very low	28.7	Very low	114 Å²	114	140.8 Å²	140.8	69%	0.691	73%	0.734	S	S	*	*	S	Bend	trans	-124.3	85.8	169.9	-173.3	0	0	0	0	109.1
37	S	27.9	Very low	28.4	Very low	115 Å²	115	144.4 Å²	144.4	80%	0.804	75%	0.748	S	S	*	*			trans	50.6	115.7	160.3	-58.6	0	0	0	0	118.9
38	E	24.7	Very low	28.5	Very low	188 Å²	188	144.4 Å²	144.4	88%	0.879	75%	0.748	S	S	*	*			trans	-45.4	156.3	147.2	-78.5	-179.3	131.9	0	0	111.9
39	E	27	Very low	28.5	Very low	178 Å²	178	144.1 Å²	144.1	83%	0.832	75%	0.747	S	S	*	*			trans	85.8	89.1	178	-56.4	-177.2	156.3	0	0	115.5
40	I	30.9	Very low	28.7	Very low	166 Å²	166	146.1 Å²	146.1	85%	0.851	75%	0.752	S	S	*	*				-178.4	87	114.9	-77.8	145.7	0	0	0	106.2
41	L	23.4	Very low	29.1	Very low	167 Å²	167	143 Å²	143	87%	0.874	74%	0.735	S	S	*	*			trans	-93.4	117.9	151.3	-81.4	171.3	0	0	0	106.3
42	K	23.4	Very low	29	Very low	168 Å²	168	141.5 Å²	141.5	73%	0.73	74%	0.74	S	S	*	*				161.3	129.2	126.4	-88	169.1	-176.8	-175.4	0	111.2
43	E	24	Very low	29.1	Very low	173 Å²	173	137.4 Å²	137.4	81%	0.808	72%	0.72	S	S	*	*			trans	65.8	133.1	147.5	-64.6	163.9	-163.6	0	0	116.4
44	S	23.9	Very low	28.9	Very low	97 Å²	97	133.3 Å²	133.3	68%	0.678	70%	0.703	S	S	*	*			cis	-174.2	150.5	1.9	48.1	0	0	0	0	106.5
45	N	24	Very low	29	Very low	148 Å²	148	132.7 Å²	132.7	79%	0.791	70%	0.698	S	S	*	*			trans	61.9	124.5	142.1	-69.9	-15.9	0	0	0	122
46	V	27.2	Very low	29.1	Very low	118 Å²	118	126.9 Å²	126.9	72%	0.715	68%	0.676	S	S	*	*			trans	114.4	116.6	137.7	-175.7	0	0	0	0	117.1
47	D	30.2	Very low	29.1	Very low	141 Å²	141	126.1 Å²	126.1	75%	0.754	67%	0.665	S	S	*	*			trans	76.1	105.1	151.2	-60.6	-11.1	0	0	0	123.3
48	D	33.1	Very low	29.5	Very low	143 Å²	143	123.1 Å²	123.1	77%	0.765	64%	0.637	S	S	*	*				22.7	119.5	128.6	-71.1	-19.1	0	0	0	118.8
49	N	31.4	Very low	29.7	Very low	138 Å²	138	117 Å²	117	74%	0.738	61%	0.61	S	S	*	*			trans	174.2	71.2	138	-85.4	-44.3	0	0	0	110.6
50	D	35.6	Very low	29.9	Very low	113 Å²	113	114 Å²	114	60%	0.604	59%	0.591	S	S	*	*			trans	-106.6	77.1	178.7	-161.4	0.6	0	0	0	111.8	G52 L53	D50-G52 PolarHBondContact O-N 3.34Å; D50-G52 PolarHBondContact OD1-N 3.08Å; D50-L53 HydrophobicContact CB-CD1 3.84Å; D50-L53 WeakPolarHBondContact OD2-CD1 3.45Å
51	W	35.1	Very low	29.7	Very low	129 Å²	129	112.1 Å²	112.1	49%	0.489	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.4	0	177	-109	82.9	0	0	0	113.7	L53 F211 S213	W51-L53 VanDerWaalsContact C-N 3.34Å; W51-F211 WeakPolarHBondContact CH2-O 3.38Å; W51-S213 WeakPolarHBondContact CZ2-OG 3.42Å
52	G	30.3	Very low	29.8	Very low	53 Å²	53	111.5 Å²	111.5	55%	0.546	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79	-17	174.1	0	0	0	0	0	113.9	D50	D50-G52 PolarHBondContact O-N 3.34Å; D50-G52 PolarHBondContact OD1-N 3.08Å
53	L	35.1	Very low	30	Very low	47 Å²	47	106.9 Å²	106.9	25%	0.246	55%	0.553	C	S	.	*	H	α-helix	trans	-80.6	-25.5	-172.9	-98.5	148.5	0	0	0	115.2	D50 W51 F55 H98	D50-L53 HydrophobicContact CB-CD1 3.84Å; D50-L53 WeakPolarHBondContact OD2-CD1 3.45Å; W51-L53 VanDerWaalsContact C-N 3.34Å; L53-F55 VanDerWaalsContact C-N 3.31Å; L53-F55 PolarHBondContact O-N 3.38Å; L53-H98 WeakPolarHBondContact CD2-CE1 3.38Å; L53-H98 WeakPolarHBondContact CD2-NE2 3.32Å; L53-H98 VanDerWaalsContact CG-CE1 3.45Å; L53-H98 WeakPolarHBondContact CG-CE1 3.49Å
54	E	30.4	Very low	30.2	Very low	78 Å²	78	103.6 Å²	103.6	36%	0.364	54%	0.54	S	S	.	.	H	α-helix	trans	-74.5	-21.2	-176.4	-75.6	-143	156.4	0	0	113.3	R215	E54-R215 IonicContact OE1-NH2 3.47Å
55	F	32.6	Very low	30.2	Very low	156 Å²	156	106.9 Å²	106.9	68%	0.684	54%	0.544	S	S	*	.	H	α-helix	trans	-74.5	-40.2	-178.7	-160.4	-98	0	0	0	112	L53	L53-F55 VanDerWaalsContact C-N 3.31Å; L53-F55 PolarHBondContact O-N 3.38Å
56	G	30	Very low	30.4	Very low	34 Å²	34	107.7 Å²	107.7	35%	0.351	54%	0.543	S	S	.	.	H	α-helix	trans	-78	-24.6	-179.1	0	0	0	0	0	114.1	K58	G56-K58 VanDerWaalsContact C-N 3.3Å; G56-K58 PolarHBondContact O-N 2.82Å
57	Q	31.6	Very low	30.4	Very low	98 Å²	98	108.8 Å²	108.8	46%	0.458	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-11.7	-177.7	-78.4	-165.6	20.3	0	0	114.5	R60	Q57-R60 WeakPolarHBondContact O-CD 3.2Å; Q57-R60 VanDerWaalsContact O-CG 3.25Å; Q57-R60 WeakPolarHBondContact O-CG 3.4Å; Q57-R60 VanDerWaalsContact O-CZ 3.31Å; Q57-R60 PolarHBondContact O-NE 3.15Å
58	K	35	Very low	30.7	Very low	52 Å²	52	107 Å²	107	23%	0.226	54%	0.535	C	S	.	.	S	Bend	trans	-104.6	-13.5	-169.2	-78.2	177.4	179.1	167.3	0	116.5	G56 R60 F211	G56-K58 VanDerWaalsContact C-N 3.3Å; G56-K58 PolarHBondContact O-N 2.82Å; K58-R60 PolarHBondContact O-N 2.71Å; K58-F211 HydrophobicContact CD-CE2 4.4Å
59	I	29.4	Very low	30.7	Very low	59 Å²	59	107.3 Å²	107.3	30%	0.303	53%	0.532	S	S	.	.			trans	-79.3	53.7	176.8	-50.7	177.7	0	0	0	110.2	M203	I59-M203 HydrophobicContact CG2-CE 3.67Å; I59-M203 HydrophobicContact CG2-SD 4.12Å
60	R	31	Very low	31.1	Very low	116 Å²	116	102.4 Å²	102.4	44%	0.438	51%	0.506	S	S	.	.			trans	-106.9	95.5	-170.7	-73.5	179.6	-178.6	176.6	16	110.1	Q57 K58 N108	Q57-R60 WeakPolarHBondContact O-CD 3.2Å; Q57-R60 VanDerWaalsContact O-CG 3.25Å; Q57-R60 WeakPolarHBondContact O-CG 3.4Å; Q57-R60 VanDerWaalsContact O-CZ 3.31Å; Q57-R60 PolarHBondContact O-NE 3.15Å; K58-R60 PolarHBondContact O-N 2.71Å; R60-N108 WeakPolarHBondContact CD-ND2 3.35Å; R60-N108 PolarHBondContact NE-ND2 3.1Å
61	Q	26.1	Very low	31	Very low	126 Å²	126	101.1 Å²	101.1	59%	0.589	50%	0.501	S	S	*	.			trans	160.8	135.2	141.3	-89.4	162.5	-12.1	0	0	107.9
62	F	27.2	Very low	31.5	Very low	154 Å²	154	96 Å²	96	68%	0.675	48%	0.483	S	S	*	.	S	Bend	trans	102.2	114.8	171.4	-63.1	-79.5	0	0	0	118.3
63	N	26.2	Very low	32.2	Very low	72 Å²	72	97.7 Å²	97.7	39%	0.385	48%	0.484	S	S	.	.			trans	95.1	59.8	157.5	-56.5	-11.8	0	0	0	118.5
64	L	28.3	Very low	33	Very low	103 Å²	103	100.1 Å²	100.1	54%	0.539	50%	0.497	S	S	.	.			trans	-120.4	53.9	143.3	-71.6	168	0	0	0	109.8	G109	L64-G109 VanDerWaalsContact CD1-CA 3.43Å
65	H	24.7	Very low	34.1	Very low	167 Å²	167	100.3 Å²	100.3	77%	0.773	50%	0.497	S	S	*	.			trans	-104.4	108.1	166.8	-89.1	-65.7	0	0	0	109.6
66	H	27.3	Very low	35.6	Very low	164 Å²	164	98.5 Å²	98.5	76%	0.759	49%	0.494	S	S	*	.	S	Bend	trans	65.5	115.5	161.8	-71.5	52	0	0	0	116.4
67	N	26.9	Very low	37.4	Very low	141 Å²	141	100.1 Å²	100.1	75%	0.754	50%	0.499	S	S	*	.	S	Bend	trans	73	85.8	172	-60.4	-16	0	0	0	116.8	Q69	N67-Q69 PolarHBondContact O-N 3.49Å
68	N	38.2	Very low	39.3	Very low	103 Å²	103	96.5 Å²	96.5	55%	0.551	48%	0.482	S	S	*	.	S	Bend	trans	27.9	23.1	146.8	-75.3	-9.2	0	0	0	121.1	C2	C2-N68 PolarHBondContact SG-O 3.01Å
69	Q	32.6	Very low	41.3	Very low	150 Å²	150	96.2 Å²	96.2	70%	0.701	49%	0.487	S	S	*	.			trans	-120.1	114.3	172.9	-66.4	-176.1	-2.5	0	0	105	N67 V71	N67-Q69 PolarHBondContact O-N 3.49Å; Q69-V71 HydrophobicContact CB-CG2 3.62Å; Q69-V71 PolarHBondContact O-N 3.2Å
70	I	40.4	Very low	43.4	Very low	36 Å²	36	99.9 Å²	99.9	19%	0.185	50%	0.503	C	S	.	.			trans	-69.6	84.7	167.3	-56.6	165.2	0	0	0	104.9	F72 W111	I70-F72 HydrophobicContact CB-CE2 4.34Å; I70-F72 HydrophobicContact CB-CZ 4.49Å; I70-F72 HydrophobicContact CG2-CD1 4.42Å; I70-F72 HydrophobicContact CG2-CD2 4.11Å; I70-F72 HydrophobicContact CG2-CE1 3.77Å; I70-F72 HydrophobicContact CG2-CE2 3.42Å; I70-F72 VanDerWaalsContact CG2-CE2 3.42Å; I70-F72 HydrophobicContact CG2-CZ 3.23Å; I70-F72 PolarHBondContact O-N 3.48Å; I70-W111 HydrophobicContact CD1-CB 4.37Å; I70-W111 HydrophobicContact CD1-CD2 4.06Å; I70-W111 HydrophobicContact CD1-CE3 3.7Å; I70-W111 HydrophobicContact CD1-CG 4.36Å; I70-W111 HydrophobicContact CD1-CZ3 4.35Å; I70-W111 HydrophobicContact CG1-CE3 4.16Å; I70-W111 HydrophobicContact CG1-CZ3 4.47Å; I70-W111 HydrophobicContact CG2-CE3 4.01Å; I70-W111 HydrophobicContact CG2-CH2 4.07Å; I70-W111 HydrophobicContact CG2-CZ3 3.53Å
71	V	33.1	Very low	45.5	Very low	85 Å²	85	99.2 Å²	99.2	52%	0.515	52%	0.515	S	S	.	.			trans	-91.5	100	176.6	-175.6	0	0	0	0	107.3	Q69	Q69-V71 HydrophobicContact CB-CG2 3.62Å; Q69-V71 PolarHBondContact O-N 3.2Å
72	F	45.5	Very low	47.8	Very low	23 Å²	23	97.4 Å²	97.4	10%	0.101	51%	0.507	C	S	.	.			trans	-64.9	132.1	172.4	-64.1	-74.3	0	0	0	109.4	I70 N74 I92 A93 W111 I155 G156 L157	I70-F72 HydrophobicContact CB-CE2 4.34Å; I70-F72 HydrophobicContact CB-CZ 4.49Å; I70-F72 HydrophobicContact CG2-CD1 4.42Å; I70-F72 HydrophobicContact CG2-CD2 4.11Å; I70-F72 HydrophobicContact CG2-CE1 3.77Å; I70-F72 HydrophobicContact CG2-CE2 3.42Å; I70-F72 VanDerWaalsContact CG2-CE2 3.42Å; I70-F72 HydrophobicContact CG2-CZ 3.23Å; I70-F72 PolarHBondContact O-N 3.48Å; F72-N74 PolarHBondContact O-N 2.99Å; F72-I92 HydrophobicContact CD1-CG2 4.44Å; F72-A93 HydrophobicContact CD1-CB 4.42Å; F72-A93 HydrophobicContact CE1-CB 3.55Å; F72-A93 HydrophobicContact CZ-CB 4.31Å; F72-W111 AromaticContact CE1-CH2 3.5Å; F72-W111 HydrophobicContact CE1-CH2 3.5Å; F72-W111 VanDerWaalsContact CE1-CH2 3.5Å; F72-W111 HydrophobicContact CE1-CZ2 4.16Å; F72-W111 HydrophobicContact CE1-CZ3 4.23Å; F72-W111 AromaticContact CZ-CH2 3.58Å; F72-W111 HydrophobicContact CZ-CH2 3.58Å; F72-W111 AromaticContact CZ-CZ2 3.97Å; F72-W111 HydrophobicContact CZ-CZ2 3.97Å; F72-W111 HydrophobicContact CZ-CZ3 4.2Å; F72-I155 WeakPolarHBondContact CD2-O 3.29Å; F72-G156 VanDerWaalsContact CD2-C 3.43Å; F72-G156 WeakPolarHBondContact CD2-O 3.47Å; F72-G156 VanDerWaalsContact CE2-C 3.41Å; F72-G156 VanDerWaalsContact CE2-O 3.26Å; F72-G156 WeakPolarHBondContact CE2-O 3.49Å; F72-G156 WeakPolarHBondContact CG-O 3.15Å; F72-L157 HydrophobicContact CE2-CB 4.37Å; F72-L157 HydrophobicContact CZ-CB 4.42Å; F72-L157 HydrophobicContact CZ-CD1 3.85Å
73	P	44.2	Very low	50.4	Low	88 Å²	88	90.6 Å²	90.6	57%	0.571	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-9.8	-165.2	19.4	-29.9	0	0	0	115.3
74	N	51.2	Low	53.1	Low	98 Å²	98	90.5 Å²	90.5	52%	0.524	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.5	76.6	-179.8	-69.7	-78.3	0	0	0	112	F72 R190	F72-N74 PolarHBondContact O-N 2.99Å; N74-R190 VanDerWaalsContact CG-NH1 3.27Å; N74-R190 PolarHBondContact ND2-NH2 3.44Å; N74-R190 PolarHBondContact OD1-NH1 3.23Å; N74-R190 PolarHBondContact OD1-NH2 3.46Å
75	F	53.8	Low	55.7	Low	81 Å²	81	88.2 Å²	88.2	36%	0.355	47%	0.468	S	S	.	.			trans	-97.8	103.7	178.3	-174.1	-116.9	0	0	0	110.6	P77 A153 R154 G156	F75-P77 HydrophobicContact CD1-CB 4.23Å; F75-P77 HydrophobicContact CD1-CG 4.37Å; F75-P77 VanDerWaalsContact CE1-CA 3.47Å; F75-P77 HydrophobicContact CE1-CB 3.4Å; F75-P77 HydrophobicContact CE1-CG 3.96Å; F75-P77 HydrophobicContact CZ-CB 3.59Å; F75-P77 WeakPolarHBondContact O-CD 3.45Å; F75-A153 WeakPolarHBondContact CE2-O 3.23Å; F75-A153 WeakPolarHBondContact CZ-O 3.17Å; F75-R154 WeakPolarHBondContact CE1-O 3.46Å; F75-R154 VanDerWaalsContact CZ-C 3.41Å; F75-R154 WeakPolarHBondContact CZ-O 3.46Å; F75-G156 VanDerWaalsContact CE2-CA 3.44Å
76	N	64.8	Low	58.6	Low	118 Å²	118	82 Å²	82	63%	0.631	44%	0.441	S	S	*	.			trans	-87.7	110.2	152.1	-171.6	19.7	0	0	0	106.6	Q78	N76-Q78 PolarHBondContact O-N 3.19Å; N76-Q78 VanDerWaalsContact O-N 3.16Å
77	P	67	Low	61.4	Low	69 Å²	69	74.6 Å²	74.6	45%	0.448	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-54.1	124.1	174.5	16.3	-25.5	0	0	0	110.5	F75 S79	F75-P77 HydrophobicContact CD1-CB 4.23Å; F75-P77 HydrophobicContact CD1-CG 4.37Å; F75-P77 VanDerWaalsContact CE1-CA 3.47Å; F75-P77 HydrophobicContact CE1-CB 3.4Å; F75-P77 HydrophobicContact CE1-CG 3.96Å; F75-P77 HydrophobicContact CZ-CB 3.59Å; F75-P77 WeakPolarHBondContact O-CD 3.45Å; P77-S79 PolarHBondContact O-N 2.82Å
78	Q	73.1	Confident	64.4	Low	22 Å²	22	68 Å²	68	10%	0.103	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-71.9	130.7	167.8	-63.2	-167.3	-71.8	0	0	108.1	N76 E82 R159 A160	N76-Q78 PolarHBondContact O-N 3.19Å; N76-Q78 VanDerWaalsContact O-N 3.16Å; Q78-E82 HydrophobicContact CB-CB 4.46Å; Q78-E82 WeakPolarHBondContact CG-OE2 3.32Å; Q78-E82 PolarHBondContact NE2-OE2 3.17Å; Q78-R159 VanDerWaalsContact NE2-NE 3.12Å; Q78-A160 PolarHBondContact NE2-O 3.31Å; Q78-A160 PolarHBondContact OE1-O 3.15Å
79	S	76.6	Confident	66.9	Low	46 Å²	46	63.1 Å²	63.1	32%	0.322	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-64.1	151.1	170.4	59.6	0	0	0	0	110	P77 S81 E82	P77-S79 PolarHBondContact O-N 2.82Å; S79-S81 WeakPolarHBondContact CB-OG 3.43Å; S79-S81 PolarHBondContact O-N 3.02Å; S79-S81 VanDerWaalsContact O-N 3.14Å; S79-S81 PolarHBondContact OG-OG 2.88Å; S79-E82 PolarHBondContact N-OE1 3.34Å; S79-E82 WeakPolarHBondContact O-CB 3.38Å; S79-E82 PolarHBondContact O-N 2.83Å; S79-E82 WeakPolarHBondContact OG-CG 3.3Å; S79-E82 PolarHBondContact OG-OE1 2.77Å
80	E	74.1	Confident	69.5	Low	136 Å²	136	57.1 Å²	57.1	64%	0.636	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-56.4	-31.2	175.1	-59.9	-175.8	171.8	0	0	111.6	E82 I83 I150	E80-E82 VanDerWaalsContact C-N 3.3Å; E80-E82 PolarHBondContact O-N 2.66Å; E80-I83 PolarHBondContact O-N 3.17Å; E80-I150 HydrophobicContact CG-CG2 3.9Å
81	S	73.3	Confident	71.6	Confident	101 Å²	101	57.5 Å²	57.5	71%	0.706	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-65.3	-24.3	175.8	40.9	0	0	0	0	115	S79 I83	S79-S81 WeakPolarHBondContact CB-OG 3.43Å; S79-S81 PolarHBondContact O-N 3.02Å; S79-S81 VanDerWaalsContact O-N 3.14Å; S79-S81 PolarHBondContact OG-OG 2.88Å; S81-I83 VanDerWaalsContact C-N 3.29Å
82	E	75.6	Confident	73.7	Confident	88 Å²	88	56 Å²	56	41%	0.411	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-76.4	-21.4	175.1	-76.9	163.8	-123.9	0	0	112.2	Q78 S79 E80 T84 C87	Q78-E82 HydrophobicContact CB-CB 4.46Å; Q78-E82 WeakPolarHBondContact CG-OE2 3.32Å; Q78-E82 PolarHBondContact NE2-OE2 3.17Å; S79-E82 PolarHBondContact N-OE1 3.34Å; S79-E82 WeakPolarHBondContact O-CB 3.38Å; S79-E82 PolarHBondContact O-N 2.83Å; S79-E82 WeakPolarHBondContact OG-CG 3.3Å; S79-E82 PolarHBondContact OG-OE1 2.77Å; E80-E82 VanDerWaalsContact C-N 3.3Å; E80-E82 PolarHBondContact O-N 2.66Å; E82-T84 PolarHBondContact O-N 2.91Å; E82-T84 VanDerWaalsContact O-N 3.17Å; E82-C87 PolarHBondContact O-SG 3.33Å; E82-C87 VanDerWaalsContact O-SG 3.35Å
83	I	82.2	Confident	74.7	Confident	12 Å²	12	55.6 Å²	55.6	6%	0.062	31%	0.31	C	S	.	.			trans	-91	84.8	-174.6	-54.9	179.3	0	0	0	108.5	E80 S81 F89 I150 A153 A160	E80-I83 PolarHBondContact O-N 3.17Å; S81-I83 VanDerWaalsContact C-N 3.29Å; I83-F89 HydrophobicContact CG2-CE1 3.91Å; I83-F89 HydrophobicContact CG2-CZ 3.84Å; I83-I150 HydrophobicContact CB-CG1 4.07Å; I83-I150 HydrophobicContact CD1-CB 4.17Å; I83-I150 HydrophobicContact CD1-CG1 3.85Å; I83-I150 HydrophobicContact CD1-CG2 4.39Å; I83-I150 HydrophobicContact CG2-CG1 3.85Å; I83-A153 HydrophobicContact CD1-CB 3.67Å; I83-A160 HydrophobicContact CG1-CB 4.01Å
84	T	82.8	Confident	75.4	Confident	69 Å²	69	53.1 Å²	53.1	42%	0.423	30%	0.296	S	S	.	.			trans	-88.2	160.8	174.6	68.8	0	0	0	0	111.5	E82 N86 C87	E82-T84 PolarHBondContact O-N 2.91Å; E82-T84 VanDerWaalsContact O-N 3.17Å; T84-N86 PolarHBondContact O-N 3.48Å; T84-N86 VanDerWaalsContact O-N 3.08Å; T84-C87 PolarHBondContact N-SG 3Å; T84-C87 VanDerWaalsContact N-SG 3.38Å; T84-C87 VanDerWaalsContact O-CB 3.26Å; T84-C87 WeakPolarHBondContact O-CB 3.18Å; T84-C87 PolarHBondContact O-N 3.44Å; T84-C87 PolarHBondContact OG1-SG 3.17Å
85	D	82.7	Confident	75.6	Confident	55 Å²	55	48.8 Å²	48.8	29%	0.294	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.3	177	-65.9	-12.4	0	0	0	113.4	C87 L131 R146	D85-C87 VanDerWaalsContact C-N 3.35Å; D85-L131 HydrophobicContact CB-CD2 4.36Å; D85-L131 WeakPolarHBondContact OD1-CD2 3.36Å; D85-R146 IonicContact OD1-CZ 3.61Å; D85-R146 IonicContact OD1-NE 3.36Å; D85-R146 PolarHBondContact OD1-NE 3.03Å; D85-R146 IonicContact OD1-NH2 3Å; D85-R146 PolarHBondContact OD1-NH2 3.12Å; D85-R146 IonicContact OD2-CZ 2.77Å; D85-R146 IonicContact OD2-NH2 3.03Å; D85-R146 PolarHBondContact OD2-NH2 2.78Å
86	N	84.3	Confident	75.6	Confident	38 Å²	38	47.3 Å²	47.3	20%	0.203	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-8.9	177.8	-68.8	-23	0	0	0	112.9	T84 Y163 T423	T84-N86 PolarHBondContact O-N 3.48Å; T84-N86 VanDerWaalsContact O-N 3.08Å; N86-Y163 WeakPolarHBondContact O-CB 3.48Å; N86-T423 HydrophobicContact CB-CG2 3.71Å; N86-T423 VanDerWaalsContact CG-CG2 3.46Å; N86-T423 WeakPolarHBondContact OD1-CG2 3.26Å
87	C	87.7	Confident	74.8	Confident	8 Å²	8	46.9 Å²	46.9	5%	0.054	26%	0.261	C	S	.	.			trans	-68.3	149.8	178.3	-68.7	0	0	0	0	111.8	E82 T84 D85 F89 R130 A160 L161	E82-C87 PolarHBondContact O-SG 3.33Å; E82-C87 VanDerWaalsContact O-SG 3.35Å; T84-C87 PolarHBondContact N-SG 3Å; T84-C87 VanDerWaalsContact N-SG 3.38Å; T84-C87 VanDerWaalsContact O-CB 3.26Å; T84-C87 WeakPolarHBondContact O-CB 3.18Å; T84-C87 PolarHBondContact O-N 3.44Å; T84-C87 PolarHBondContact OG1-SG 3.17Å; D85-C87 VanDerWaalsContact C-N 3.35Å; C87-F89 HydrophobicContact CB-CE2 4.5Å; C87-F89 HydrophobicContact CB-CZ 4.34Å; C87-R130 WeakPolarHBondContact O-CA 2.85Å; C87-A160 HydrophobicContact CB-CB 4.15Å; C87-L161 CarbonylContact C-O 3.58Å; C87-L161 VanDerWaalsContact CA-O 3.24Å; C87-L161 WeakPolarHBondContact CA-O 2.93Å; C87-L161 WeakPolarHBondContact CB-O 3.47Å
88	V	90.2	Very high	73.8	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	154.2	164.1	-58.1	0	0	0	0	109	G127 A160 L161 Y163	V88-G127 WeakPolarHBondContact CB-O 3.39Å; V88-G127 VanDerWaalsContact CG2-O 3.27Å; V88-G127 WeakPolarHBondContact CG2-O 3.37Å; V88-A160 CarbonylContact O-C 3.57Å; V88-A160 WeakPolarHBondContact O-CA 3.4Å; V88-L161 HydrophobicContact CG2-CB 3.92Å; V88-L161 PolarHBondContact N-O 3.23Å; V88-L161 PolarHBondContact O-N 2.91Å; V88-Y163 HydrophobicContact CG1-CD2 3.59Å; V88-Y163 HydrophobicContact CG1-CE2 4.28Å; V88-Y163 HydrophobicContact CG1-CG 4.47Å
89	F	89.8	Confident	72.1	Confident	1 Å²	1	57 Å²	57	0%	0.004	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.3	-174.8	-63.5	-85.4	0	0	0	109.8	I83 C87 I125 G127 L131 L134 L149 V158 R159 A160	I83-F89 HydrophobicContact CG2-CE1 3.91Å; I83-F89 HydrophobicContact CG2-CZ 3.84Å; C87-F89 HydrophobicContact CB-CE2 4.5Å; C87-F89 HydrophobicContact CB-CZ 4.34Å; F89-I125 HydrophobicContact CB-CG2 3.91Å; F89-I125 WeakPolarHBondContact O-CG2 3.42Å; F89-G127 WeakPolarHBondContact O-CA 3.43Å; F89-G127 PolarHBondContact O-N 2.75Å; F89-L131 HydrophobicContact CE2-CB 4.1Å; F89-L131 HydrophobicContact CE2-CD1 4.22Å; F89-L131 HydrophobicContact CZ-CD1 4.46Å; F89-L134 HydrophobicContact CB-CD1 4.36Å; F89-L134 HydrophobicContact CD2-CD1 3.62Å; F89-L134 HydrophobicContact CE2-CD1 4.39Å; F89-L134 HydrophobicContact CG-CD1 4.37Å; F89-L149 HydrophobicContact CB-CD2 4.25Å; F89-L149 HydrophobicContact CD1-CB 4.18Å; F89-L149 HydrophobicContact CD1-CD2 3.9Å; F89-L149 HydrophobicContact CD1-CG 4.42Å; F89-L149 HydrophobicContact CD2-CD1 3.88Å; F89-L149 HydrophobicContact CD2-CD2 4.27Å; F89-L149 HydrophobicContact CE1-CB 3.74Å; F89-L149 HydrophobicContact CE1-CD1 4.35Å; F89-L149 HydrophobicContact CE1-CD2 4.31Å; F89-L149 HydrophobicContact CE1-CG 4.35Å; F89-L149 HydrophobicContact CE2-CD1 3.71Å; F89-L149 HydrophobicContact CG-CD1 4.28Å; F89-L149 HydrophobicContact CG-CD2 3.85Å; F89-L149 HydrophobicContact CZ-CB 3.93Å; F89-L149 HydrophobicContact CZ-CD1 3.94Å; F89-L149 HydrophobicContact CZ-CG 4.4Å; F89-V158 HydrophobicContact CB-CG1 3.62Å; F89-V158 HydrophobicContact CD1-CG1 3.64Å; F89-V158 HydrophobicContact CG-CG1 4.08Å; F89-R159 WeakPolarHBondContact CA-O 3.32Å; F89-A160 HydrophobicContact CD1-CB 4.08Å; F89-A160 HydrophobicContact CE1-CB 3.82Å
90	V	87.6	Confident	70	Confident	23 Å²	23	63.1 Å²	63.1	14%	0.139	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	130.1	176.7	-178.7	0	0	0	0	108.5	I92 V158 R159 L161 Q304 V308	V90-I92 PolarHBondContact O-N 2.73Å; V90-V158 CarbonylContact O-C 3.53Å; V90-V158 WeakPolarHBondContact O-CA 3.25Å; V90-R159 PolarHBondContact N-O 3Å; V90-R159 PolarHBondContact O-N 2.86Å; V90-L161 HydrophobicContact CG2-CD1 3.59Å; V90-L161 HydrophobicContact CG2-CG 4.27Å; V90-Q304 HydrophobicContact CG2-CB 4.36Å; V90-Q304 HydrophobicContact CG2-CG 4.08Å; V90-V308 HydrophobicContact CB-CG2 4.11Å; V90-V308 HydrophobicContact CG1-CG2 4.08Å
91	L	84.2	Confident	68.2	Low	45 Å²	45	59.7 Å²	59.7	24%	0.236	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	120.5	171.8	-73.7	164.4	0	0	0	109	A93 L122 I125 V158	L91-A93 VanDerWaalsContact C-N 3.26Å; L91-L122 HydrophobicContact CD2-CD2 3.62Å; L91-I125 HydrophobicContact CD1-CB 4.2Å; L91-I125 HydrophobicContact CD1-CG2 4.41Å; L91-I125 HydrophobicContact CD2-CD1 4.3Å; L91-I125 HydrophobicContact CG-CB 4.1Å; L91-I125 HydrophobicContact CG-CG2 3.86Å; L91-V158 HydrophobicContact CD2-CG2 3.91Å
92	I	76.7	Confident	66.4	Low	54 Å²	54	65 Å²	65	28%	0.277	32%	0.317	S	S	.	.	S	Bend	trans	-74.7	-27.5	175.5	-55.4	-171.6	0	0	0	109.8	F72 V90 G156 L157 R159 V308	F72-I92 HydrophobicContact CD1-CG2 4.44Å; V90-I92 PolarHBondContact O-N 2.73Å; I92-G156 WeakPolarHBondContact CD1-O 3.36Å; I92-L157 PolarHBondContact N-O 3.26Å; I92-R159 HydrophobicContact CD1-CB 3.87Å; I92-R159 HydrophobicContact CG1-CB 3.99Å; I92-V308 HydrophobicContact CD1-CG1 4.23Å; I92-V308 HydrophobicContact CG1-CG1 3.99Å
93	A	66.5	Low	64.2	Low	13 Å²	13	66 Å²	66	11%	0.107	33%	0.329	C	S	.	.	S	Bend	trans	-147.3	149.3	174.6	0	0	0	0	0	113.3	F72 L91 P95 W111	F72-A93 HydrophobicContact CD1-CB 4.42Å; F72-A93 HydrophobicContact CE1-CB 3.55Å; F72-A93 HydrophobicContact CZ-CB 4.31Å; L91-A93 VanDerWaalsContact C-N 3.26Å; A93-P95 VanDerWaalsContact O-CD 3.26Å; A93-P95 WeakPolarHBondContact O-CD 3.41Å; A93-W111 HydrophobicContact CB-CH2 3.13Å; A93-W111 HydrophobicContact CB-CZ2 3.24Å; A93-W111 HydrophobicContact CB-CZ3 4.43Å
94	S	59.9	Low	61.9	Low	37 Å²	37	67.4 Å²	67.4	26%	0.259	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-77.1	120	-170.9	-169.1	0	0	0	0	110.7
95	P	54.8	Low	59.3	Low	6 Å²	6	71.9 Å²	71.9	4%	0.039	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-58.7	146.1	156.9	26.6	-34.6	0	0	0	110	A93 Y97	A93-P95 VanDerWaalsContact O-CD 3.26Å; A93-P95 WeakPolarHBondContact O-CD 3.41Å; P95-Y97 HydrophobicContact CB-CD2 4.28Å; P95-Y97 HydrophobicContact CB-CE1 4.24Å; P95-Y97 HydrophobicContact CB-CE2 3.69Å; P95-Y97 HydrophobicContact CG-CD2 4.04Å; P95-Y97 HydrophobicContact CG-CE2 3.2Å; P95-Y97 VanDerWaalsContact CG-CZ 3.48Å; P95-Y97 WeakPolarHBondContact CG-OH 3.37Å
96	T	54	Low	57.1	Low	50 Å²	50	72.7 Å²	72.7	31%	0.307	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-93.8	118.2	168.7	37.7	0	0	0	0	109.5	G110 W111	T96-G110 VanDerWaalsContact OG1-CA 3.31Å; T96-G110 WeakPolarHBondContact OG1-CA 3.39Å; T96-W111 PolarHBondContact N-O 3.06Å; T96-W111 PolarHBondContact OG1-O 3.09Å
97	Y	47.1	Very low	54.7	Low	110 Å²	110	78.3 Å²	78.3	43%	0.431	39%	0.39	S	S	.	.			trans	-106.6	7.8	-178.9	-68	-65.8	0	0	0	115.3	P95 R99 P113 L122	P95-Y97 HydrophobicContact CB-CD2 4.28Å; P95-Y97 HydrophobicContact CB-CE1 4.24Å; P95-Y97 HydrophobicContact CB-CE2 3.69Å; P95-Y97 HydrophobicContact CG-CD2 4.04Å; P95-Y97 HydrophobicContact CG-CE2 3.2Å; P95-Y97 VanDerWaalsContact CG-CZ 3.48Å; P95-Y97 WeakPolarHBondContact CG-OH 3.37Å; Y97-R99 PolarHBondContact O-N 2.93Å; Y97-P113 HydrophobicContact CE1-CG 4.38Å; Y97-L122 WeakPolarHBondContact OH-CB 2.99Å
98	H	45.8	Very low	52.5	Low	86 Å²	86	82.8 Å²	82.8	40%	0.398	41%	0.413	S	S	.	.			trans	-69.2	119.7	-168.3	-69	-44.1	0	0	0	116.1	L53	L53-H98 WeakPolarHBondContact CD2-CE1 3.38Å; L53-H98 WeakPolarHBondContact CD2-NE2 3.32Å; L53-H98 VanDerWaalsContact CG-CE1 3.45Å; L53-H98 WeakPolarHBondContact CG-CE1 3.49Å
99	R	37.6	Very low	50.6	Low	216 Å²	216	84 Å²	84	82%	0.815	43%	0.426	S	S	*	.			trans	-70.4	118.8	160.1	-140.7	179.5	-166.8	-176.4	3.4	108.2	Y97	Y97-R99 PolarHBondContact O-N 2.93Å
100	H	34	Very low	49.2	Very low	176 Å²	176	84.6 Å²	84.6	82%	0.815	43%	0.432	S	S	*	.			trans	39.8	75	165.2	-59.1	-76	0	0	0	118.4	K102	H100-K102 PolarHBondContact O-N 3.18Å
101	S	35.8	Very low	48.2	Very low	63 Å²	63	84.7 Å²	84.7	44%	0.441	43%	0.431	S	S	.	.			trans	-76.5	117.1	145.4	70.3	0	0	0	0	107.1	V103	S101-V103 PolarHBondContact O-N 3.2Å; S101-V103 PolarHBondContact OG-O 3.36Å
102	K	36.1	Very low	47.5	Very low	212 Å²	212	86.3 Å²	86.3	92%	0.922	43%	0.434	S	S	*	.	S	Bend	trans	-62.7	-3.2	174	-82.1	-176.1	176.3	178.8	0	113.5	H100	H100-K102 PolarHBondContact O-N 3.18Å
103	V	29.2	Very low	47.3	Very low	110 Å²	110	83.9 Å²	83.9	67%	0.667	42%	0.421	S	S	*	.	S	Bend	trans	-116.9	98.2	174	-173.4	0	0	0	0	106.6	S101 Y105	S101-V103 PolarHBondContact O-N 3.2Å; S101-V103 PolarHBondContact OG-O 3.36Å; V103-Y105 HydrophobicContact CG1-CD2 4.17Å; V103-Y105 HydrophobicContact CG1-CE2 4.45Å; V103-Y105 PolarHBondContact O-N 3.24Å; V103-Y105 VanDerWaalsContact O-N 3.14Å
104	G	34.1	Very low	47.7	Very low	41 Å²	41	85.9 Å²	85.9	42%	0.423	43%	0.43	S	S	.	.			trans	-85.5	62.6	-163.5	0	0	0	0	0	115.1
105	Y	27.2	Very low	48.6	Very low	164 Å²	164	85 Å²	85	64%	0.643	42%	0.422	S	S	*	.			trans	-137.4	89.2	172	-50.8	-75.1	0	0	0	110.9	V103	V103-Y105 HydrophobicContact CG1-CD2 4.17Å; V103-Y105 HydrophobicContact CG1-CE2 4.45Å; V103-Y105 PolarHBondContact O-N 3.24Å; V103-Y105 VanDerWaalsContact O-N 3.14Å
106	N	36.1	Very low	49.9	Very low	71 Å²	71	86.9 Å²	86.9	38%	0.38	44%	0.438	S	S	.	.			trans	-99.7	76.1	163.2	-73.7	-21.4	0	0	0	108.1	N108	N106-N108 PolarHBondContact O-N 2.97Å
107	L	34.3	Very low	51.5	Low	157 Å²	157	85.9 Å²	85.9	82%	0.822	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	1.7	-175.8	-82.8	151.4	0	0	0	116.3
108	N	42.7	Very low	53.4	Low	101 Å²	101	80.7 Å²	80.7	54%	0.54	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	26.7	-162.9	-59.7	-2.7	0	0	0	114.6	R60 N106	R60-N108 WeakPolarHBondContact CD-ND2 3.35Å; R60-N108 PolarHBondContact NE-ND2 3.1Å; N106-N108 PolarHBondContact O-N 2.97Å
109	G	49.5	Very low	55.3	Low	28 Å²	28	80 Å²	80	29%	0.289	41%	0.408	S	S	.	.			trans	56	82.1	157.9	0	0	0	0	0	116.8	L64	L64-G109 VanDerWaalsContact CD1-CA 3.43Å
110	G	59.6	Low	57.6	Low	13 Å²	13	75.6 Å²	75.6	13%	0.134	39%	0.392	C	S	.	.			trans	-99.7	170.3	168.7	0	0	0	0	0	113	R19 T96	R19-G110 WeakPolarHBondContact CB-O 3.29Å; R19-G110 PolarHBondContact N-O 2.77Å; T96-G110 VanDerWaalsContact OG1-CA 3.31Å; T96-G110 WeakPolarHBondContact OG1-CA 3.39Å
111	W	67.2	Low	60.2	Low	26 Å²	26	67.2 Å²	67.2	10%	0.098	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	157.9	169.6	54	71.7	0	0	0	111.7	S17 I70 F72 A93 T96 L157	S17-W111 WeakPolarHBondContact O-CA 3.35Å; I70-W111 HydrophobicContact CD1-CB 4.37Å; I70-W111 HydrophobicContact CD1-CD2 4.06Å; I70-W111 HydrophobicContact CD1-CE3 3.7Å; I70-W111 HydrophobicContact CD1-CG 4.36Å; I70-W111 HydrophobicContact CD1-CZ3 4.35Å; I70-W111 HydrophobicContact CG1-CE3 4.16Å; I70-W111 HydrophobicContact CG1-CZ3 4.47Å; I70-W111 HydrophobicContact CG2-CE3 4.01Å; I70-W111 HydrophobicContact CG2-CH2 4.07Å; I70-W111 HydrophobicContact CG2-CZ3 3.53Å; F72-W111 AromaticContact CE1-CH2 3.5Å; F72-W111 HydrophobicContact CE1-CH2 3.5Å; F72-W111 VanDerWaalsContact CE1-CH2 3.5Å; F72-W111 HydrophobicContact CE1-CZ2 4.16Å; F72-W111 HydrophobicContact CE1-CZ3 4.23Å; F72-W111 AromaticContact CZ-CH2 3.58Å; F72-W111 HydrophobicContact CZ-CH2 3.58Å; F72-W111 AromaticContact CZ-CZ2 3.97Å; F72-W111 HydrophobicContact CZ-CZ2 3.97Å; F72-W111 HydrophobicContact CZ-CZ3 4.2Å; A93-W111 HydrophobicContact CB-CH2 3.13Å; A93-W111 HydrophobicContact CB-CZ2 3.24Å; A93-W111 HydrophobicContact CB-CZ3 4.43Å; T96-W111 PolarHBondContact N-O 3.06Å; T96-W111 PolarHBondContact OG1-O 3.09Å; W111-L157 HydrophobicContact CH2-CD1 4.2Å; W111-L157 HydrophobicContact CZ2-CD1 3.18Å
112	R	69.8	Low	62.7	Low	79 Å²	79	64.3 Å²	64.3	30%	0.298	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.4	165.8	62.6	-173.6	-98.1	-162.1	0.3	110.4	S17 D31 L114	S17-R112 PolarHBondContact N-O 3.03Å; S17-R112 PolarHBondContact O-N 3.31Å; S17-R112 VanDerWaalsContact OG-CG 3.27Å; S17-R112 WeakPolarHBondContact OG-CG 3.32Å; D31-R112 IonicContact OD1-CZ 2.84Å; D31-R112 IonicContact OD1-NH1 3.73Å; D31-R112 PolarHBondContact OD1-NH1 3.12Å; D31-R112 IonicContact OD1-NH2 3.01Å; D31-R112 PolarHBondContact OD1-NH2 3Å; R112-L114 HydrophobicContact CG-CD2 4.32Å
113	P	73	Confident	65	Low	3 Å²	3	57.8 Å²	57.8	2%	0.019	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	135.4	164	30.6	-37.1	0	0	0	109.4	F16 Y97 A118 Q119 L122	F16-P113 HydrophobicContact CE1-CB 4.31Å; Y97-P113 HydrophobicContact CE1-CG 4.38Å; P113-A118 HydrophobicContact CB-CB 3.77Å; P113-Q119 HydrophobicContact CB-CG 4.01Å; P113-Q119 HydrophobicContact CG-CB 4.41Å; P113-Q119 HydrophobicContact CG-CG 3.64Å; P113-Q119 WeakPolarHBondContact O-CG 3.24Å; P113-Q119 PolarHBondContact O-NE2 3.18Å; P113-L122 HydrophobicContact CB-CD1 3.78Å; P113-L122 HydrophobicContact CG-CD1 3.65Å
114	L	73.3	Confident	67.8	Low	54 Å²	54	56.6 Å²	56.6	28%	0.283	30%	0.296	S	S	.	.			trans	-100	-21	173.5	-63.5	175.7	0	0	0	111.9	M1 R15 R112	M1-L114 HydrophobicContact CG-CD1 4.42Å; R15-L114 HydrophobicContact CB-CB 3.81Å; R15-L114 HydrophobicContact CB-CD1 4.27Å; R15-L114 WeakPolarHBondContact O-CB 3.45Å; R15-L114 PolarHBondContact O-N 3.1Å; R112-L114 HydrophobicContact CG-CD2 4.32Å
115	D	79.4	Confident	70.3	Confident	19 Å²	19	55.4 Å²	55.4	10%	0.102	28%	0.28	C	S	.	.	S	Bend	trans	-80.7	141.8	175.8	66.8	-76.6	0	0	0	111.5	L14 V117 A118 Q119	L14-D115 WeakPolarHBondContact CD2-OD2 3.3Å; D115-V117 PolarHBondContact O-N 3.23Å; D115-A118 WeakPolarHBondContact OD1-CB 3.41Å; D115-A118 WeakPolarHBondContact OD2-CA 3.38Å; D115-A118 WeakPolarHBondContact OD2-CB 3.47Å; D115-A118 PolarHBondContact OD2-N 2.94Å; D115-Q119 WeakPolarHBondContact O-CB 3.28Å; D115-Q119 VanDerWaalsContact O-CG 3.26Å; D115-Q119 WeakPolarHBondContact O-CG 3.42Å; D115-Q119 PolarHBondContact O-N 3.35Å; D115-Q119 VanDerWaalsContact O-N 3.08Å
116	A	83.3	Confident	72.9	Confident	45 Å²	45	50.1 Å²	50.1	37%	0.372	26%	0.263	S	S	.	.	H	α-helix	trans	-65.2	-27.2	-176.5	0	0	0	0	0	112.9	R120	A116-R120 WeakPolarHBondContact O-CG 3.43Å; A116-R120 PolarHBondContact O-N 2.69Å
117	V	87.1	Confident	75.3	Confident	30 Å²	30	46.8 Å²	46.8	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-73.1	-53.8	-177.6	-173.5	0	0	0	0	110.1	D115 Q119 R120 V121 L140 I144 C148	D115-V117 PolarHBondContact O-N 3.23Å; V117-Q119 VanDerWaalsContact C-N 3.3Å; V117-Q119 PolarHBondContact O-N 2.88Å; V117-R120 PolarHBondContact O-N 2.64Å; V117-R120 VanDerWaalsContact O-N 3.08Å; V117-V121 WeakPolarHBondContact O-CG2 3.46Å; V117-V121 PolarHBondContact O-N 3.05Å; V117-L140 HydrophobicContact CG1-CD1 3.76Å; V117-I144 HydrophobicContact CG1-CG2 3.93Å; V117-I144 HydrophobicContact CG2-CG2 4.29Å; V117-C148 HydrophobicContact CG1-CB 3.63Å
118	A	85.6	Confident	77.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.7	-36.3	176.5	0	0	0	0	0	111.6	L14 P113 D115 R120 V121 L122	L14-A118 HydrophobicContact CD2-CB 4.49Å; P113-A118 HydrophobicContact CB-CB 3.77Å; D115-A118 WeakPolarHBondContact OD1-CB 3.41Å; D115-A118 WeakPolarHBondContact OD2-CA 3.38Å; D115-A118 WeakPolarHBondContact OD2-CB 3.47Å; D115-A118 PolarHBondContact OD2-N 2.94Å; A118-R120 PolarHBondContact O-N 2.7Å; A118-V121 PolarHBondContact O-N 3.08Å; A118-L122 HydrophobicContact CB-CD1 3.92Å; A118-L122 HydrophobicContact CB-CG 4.34Å; A118-L122 VanDerWaalsContact O-CB 3.23Å; A118-L122 WeakPolarHBondContact O-CB 3.24Å; A118-L122 WeakPolarHBondContact O-CD1 3.19Å; A118-L122 WeakPolarHBondContact O-CG 3.3Å; A118-L122 PolarHBondContact O-N 3.32Å
119	Q	85.7	Confident	79.8	Confident	71 Å²	71	38.6 Å²	38.6	33%	0.332	20%	0.196	S	C	.	.	H	α-helix	trans	-56.4	-36.6	172.3	-80.5	175.1	9.7	0	0	112.9	P113 D115 V117 P123	P113-Q119 HydrophobicContact CB-CG 4.01Å; P113-Q119 HydrophobicContact CG-CB 4.41Å; P113-Q119 HydrophobicContact CG-CG 3.64Å; P113-Q119 WeakPolarHBondContact O-CG 3.24Å; P113-Q119 PolarHBondContact O-NE2 3.18Å; D115-Q119 WeakPolarHBondContact O-CB 3.28Å; D115-Q119 VanDerWaalsContact O-CG 3.26Å; D115-Q119 WeakPolarHBondContact O-CG 3.42Å; D115-Q119 PolarHBondContact O-N 3.35Å; D115-Q119 VanDerWaalsContact O-N 3.08Å; V117-Q119 VanDerWaalsContact C-N 3.3Å; V117-Q119 PolarHBondContact O-N 2.88Å; Q119-P123 WeakPolarHBondContact O-CD 3.5Å; Q119-P123 WeakPolarHBondContact O-CG 3.36Å
120	R	87.1	Confident	81.6	Confident	125 Å²	125	38.4 Å²	38.4	47%	0.472	19%	0.186	S	C	.	.	H	α-helix	trans	-80.9	-39	177.2	-71	-177.6	-170.1	178	3.2	113.1	A116 V117 A118 Y124 A138 L140	A116-R120 WeakPolarHBondContact O-CG 3.43Å; A116-R120 PolarHBondContact O-N 2.69Å; V117-R120 PolarHBondContact O-N 2.64Å; V117-R120 VanDerWaalsContact O-N 3.08Å; A118-R120 PolarHBondContact O-N 2.7Å; R120-Y124 WeakPolarHBondContact O-CD2 3.32Å; R120-Y124 WeakPolarHBondContact O-CE2 2.93Å; R120-A138 HydrophobicContact CB-CB 4.14Å; R120-A138 WeakPolarHBondContact CD-O 3.32Å; R120-L140 HydrophobicContact CB-CD1 4.34Å
121	V	88.7	Confident	83.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-77	-46.9	-175.1	178.3	0	0	0	0	112.2	V117 A118 P123 Y124 I125 A138 L140 L149	V117-V121 WeakPolarHBondContact O-CG2 3.46Å; V117-V121 PolarHBondContact O-N 3.05Å; A118-V121 PolarHBondContact O-N 3.08Å; V121-P123 VanDerWaalsContact C-CD 3.44Å; V121-Y124 PolarHBondContact O-N 2.9Å; V121-I125 HydrophobicContact CG1-CD1 4.22Å; V121-I125 HydrophobicContact CG1-CG1 4.23Å; V121-A138 HydrophobicContact CG2-CB 4.17Å; V121-L140 HydrophobicContact CG2-CD1 3.37Å; V121-L149 HydrophobicContact CG1-CD1 4.16Å; V121-L149 HydrophobicContact CG1-CD2 3.82Å; V121-L149 HydrophobicContact CG1-CG 4.03Å
122	L	86.8	Confident	84.1	Confident	2 Å²	2	39 Å²	39	1%	0.01	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-56	-40	-169.9	-71	167	0	0	0	114.6	L91 Y97 P113 A118 Y124 I125 L152 L157 V158	L91-L122 HydrophobicContact CD2-CD2 3.62Å; Y97-L122 WeakPolarHBondContact OH-CB 2.99Å; P113-L122 HydrophobicContact CB-CD1 3.78Å; P113-L122 HydrophobicContact CG-CD1 3.65Å; A118-L122 HydrophobicContact CB-CD1 3.92Å; A118-L122 HydrophobicContact CB-CG 4.34Å; A118-L122 VanDerWaalsContact O-CB 3.23Å; A118-L122 WeakPolarHBondContact O-CB 3.24Å; A118-L122 WeakPolarHBondContact O-CD1 3.19Å; A118-L122 WeakPolarHBondContact O-CG 3.3Å; A118-L122 PolarHBondContact O-N 3.32Å; L122-Y124 PolarHBondContact O-N 3.42Å; L122-Y124 VanDerWaalsContact O-N 3.16Å; L122-I125 HydrophobicContact CD2-CD1 3.9Å; L122-I125 PolarHBondContact O-N 3.06Å; L122-L152 HydrophobicContact CD2-CD1 3.93Å; L122-L152 HydrophobicContact CG-CD1 4.38Å; L122-L157 HydrophobicContact CD2-CD2 4.18Å; L122-V158 HydrophobicContact CD2-CG2 4.38Å
123	P	85.3	Confident	85.1	Confident	75 Å²	75	36.8 Å²	36.8	49%	0.487	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-61.9	-22.7	178.4	-24.7	35.5	0	0	0	114.6	Q119 V121	Q119-P123 WeakPolarHBondContact O-CD 3.5Å; Q119-P123 WeakPolarHBondContact O-CG 3.36Å; V121-P123 VanDerWaalsContact C-CD 3.44Å
124	Y	87.4	Confident	85.9	Confident	85 Å²	85	36.7 Å²	36.7	33%	0.333	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-94.7	-8.6	-178.1	-57	-64.3	0	0	0	113.2	R120 V121 L122 N126 L134 L137 A138	R120-Y124 WeakPolarHBondContact O-CD2 3.32Å; R120-Y124 WeakPolarHBondContact O-CE2 2.93Å; V121-Y124 PolarHBondContact O-N 2.9Å; L122-Y124 PolarHBondContact O-N 3.42Å; L122-Y124 VanDerWaalsContact O-N 3.16Å; Y124-N126 PolarHBondContact O-N 3.42Å; Y124-L134 VanDerWaalsContact C-CD2 3.48Å; Y124-L134 WeakPolarHBondContact O-CD2 3.39Å; Y124-L137 HydrophobicContact CD1-CB 4.1Å; Y124-L137 HydrophobicContact CD2-CB 4.25Å; Y124-L137 HydrophobicContact CE1-CB 4.35Å; Y124-L137 WeakPolarHBondContact CE2-O 3.33Å; Y124-L137 HydrophobicContact CG-CB 4.04Å; Y124-A138 HydrophobicContact CD2-CB 4.05Å; Y124-A138 HydrophobicContact CE2-CB 4.2Å
125	I	86.6	Confident	86.7	Confident	15 Å²	15	34.1 Å²	34.1	8%	0.077	17%	0.167	C	C	.	.			trans	-71.3	109.4	178.5	-57.6	-174	0	0	0	109.3	F89 L91 V121 L122 L149 V158	F89-I125 HydrophobicContact CB-CG2 3.91Å; F89-I125 WeakPolarHBondContact O-CG2 3.42Å; L91-I125 HydrophobicContact CD1-CB 4.2Å; L91-I125 HydrophobicContact CD1-CG2 4.41Å; L91-I125 HydrophobicContact CD2-CD1 4.3Å; L91-I125 HydrophobicContact CG-CB 4.1Å; L91-I125 HydrophobicContact CG-CG2 3.86Å; V121-I125 HydrophobicContact CG1-CD1 4.22Å; V121-I125 HydrophobicContact CG1-CG1 4.23Å; L122-I125 HydrophobicContact CD2-CD1 3.9Å; L122-I125 PolarHBondContact O-N 3.06Å; I125-L149 HydrophobicContact CD1-CD2 3.76Å; I125-V158 HydrophobicContact CD1-CG2 3.83Å
126	N	81.9	Confident	87.3	Confident	54 Å²	54	39.7 Å²	39.7	29%	0.289	19%	0.192	S	C	.	.			trans	-132.2	8.9	-178.4	67.5	-4.1	0	0	0	113.1	Y124 R128 R129	Y124-N126 PolarHBondContact O-N 3.42Å; N126-R128 PolarHBondContact O-N 2.76Å; N126-R128 PolarHBondContact OD1-N 3.18Å; N126-R129 PolarHBondContact OD1-N 2.9Å; N126-R129 VanDerWaalsContact OD1-N 3.11Å
127	G	86.5	Confident	87.7	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.01	19%	0.192	C	C	.	.	S	Bend	trans	69.4	6.4	-177.8	0	0	0	0	0	115.9	V88 F89 Q304	V88-G127 WeakPolarHBondContact CB-O 3.39Å; V88-G127 VanDerWaalsContact CG2-O 3.27Å; V88-G127 WeakPolarHBondContact CG2-O 3.37Å; F89-G127 WeakPolarHBondContact O-CA 3.43Å; F89-G127 PolarHBondContact O-N 2.75Å; G127-Q304 VanDerWaalsContact C-NE2 3.26Å; G127-Q304 PolarHBondContact O-NE2 2.93Å
128	R	84.9	Confident	87.8	Confident	47 Å²	47	39.6 Å²	39.6	18%	0.177	19%	0.185	C	C	.	.	S	Bend	trans	-115.8	-29.6	178.1	-65.7	-178.7	177.3	151.1	-2.7	113.4	N126 Y163 E255 C256 L300	N126-R128 PolarHBondContact O-N 2.76Å; N126-R128 PolarHBondContact OD1-N 3.18Å; R128-Y163 WeakPolarHBondContact O-CE2 3.41Å; R128-E255 IonicContact CZ-OE1 2.67Å; R128-E255 VanDerWaalsContact CZ-OE1 3.23Å; R128-E255 IonicContact NE-OE1 3.36Å; R128-E255 PolarHBondContact NE-OE1 3.31Å; R128-E255 IonicContact NH2-OE1 2.64Å; R128-E255 PolarHBondContact NH2-OE1 2.86Å; R128-C256 PolarHBondContact NH1-O 2.68Å; R128-C256 PolarHBondContact NH2-O 3.28Å; R128-L300 HydrophobicContact CG-CD2 3.38Å
129	R	86.3	Confident	88.2	Confident	38 Å²	38	47.3 Å²	47.3	14%	0.143	22%	0.221	C	C	.	.	S	Bend	trans	-84.8	135.7	-176.5	-69.1	168.5	178	173.4	-3.3	110.4	N126 E133 L134	N126-R129 PolarHBondContact OD1-N 2.9Å; N126-R129 VanDerWaalsContact OD1-N 3.11Å; R129-E133 WeakPolarHBondContact CA-OE2 3.5Å; R129-E133 HydrophobicContact CB-CB 4.23Å; R129-L134 HydrophobicContact CB-CD2 3.81Å; R129-L134 HydrophobicContact CB-CG 3.91Å
130	R	89	Confident	88.4	Confident	25 Å²	25	45.4 Å²	45.4	9%	0.094	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-76.1	166.5	173.8	-67.2	176.6	-64	178.1	4.4	111	C87 I132 E133 L134 Y163 T423	C87-R130 WeakPolarHBondContact O-CA 2.85Å; R130-I132 VanDerWaalsContact C-N 3.29Å; R130-I132 PolarHBondContact O-N 3.42Å; R130-E133 IonicContact CZ-OE1 3.06Å; R130-E133 PolarHBondContact N-OE2 3.05Å; R130-E133 VanDerWaalsContact N-OE2 3.15Å; R130-E133 IonicContact NE-OE1 3.85Å; R130-E133 PolarHBondContact NE-OE1 2.79Å; R130-E133 IonicContact NH2-OE1 3.15Å; R130-E133 PolarHBondContact NH2-OE1 3.34Å; R130-E133 PolarHBondContact O-N 3.21Å; R130-E133 VanDerWaalsContact O-N 3.12Å; R130-L134 WeakPolarHBondContact O-CG 3.25Å; R130-L134 PolarHBondContact O-N 3.12Å; R130-Y163 HydrophobicContact CG-CD2 3.45Å; R130-Y163 VanDerWaalsContact CG-CD2 3.45Å; R130-Y163 HydrophobicContact CG-CE2 3.73Å; R130-Y163 HydrophobicContact CG-CG 4.43Å; R130-T423 PolarHBondContact NH1-O 2.77Å
131	L	90.1	Very high	88.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-49.8	-48	177.1	179.1	64.1	0	0	0	112.9	D85 F89 E133 L134 A135 V142 A145 R146 L149	D85-L131 HydrophobicContact CB-CD2 4.36Å; D85-L131 WeakPolarHBondContact OD1-CD2 3.36Å; F89-L131 HydrophobicContact CE2-CB 4.1Å; F89-L131 HydrophobicContact CE2-CD1 4.22Å; F89-L131 HydrophobicContact CZ-CD1 4.46Å; L131-E133 VanDerWaalsContact C-N 3.33Å; L131-E133 PolarHBondContact O-N 3.46Å; L131-L134 PolarHBondContact O-N 3.41Å; L131-A135 WeakPolarHBondContact O-CB 3.47Å; L131-A135 PolarHBondContact O-N 2.98Å; L131-V142 HydrophobicContact CD2-CG1 4.12Å; L131-V142 HydrophobicContact CG-CG1 4.27Å; L131-A145 HydrophobicContact CD1-CB 4.27Å; L131-R146 HydrophobicContact CD1-CB 4.37Å; L131-R146 HydrophobicContact CD2-CB 3.85Å; L131-R146 HydrophobicContact CD2-CG 3.81Å; L131-L149 HydrophobicContact CD1-CD1 3.35Å
132	I	89.4	Confident	88.6	Confident	52 Å²	52	46.3 Å²	46.3	27%	0.267	23%	0.228	S	C	.	.	H	α-helix	trans	-63.3	-41.2	-177.6	-58.8	168	0	0	0	111	R130 A135 Q136 V142 T427	R130-I132 VanDerWaalsContact C-N 3.29Å; R130-I132 PolarHBondContact O-N 3.42Å; I132-A135 PolarHBondContact O-N 3.34Å; I132-Q136 VanDerWaalsContact O-CG 3.29Å; I132-Q136 WeakPolarHBondContact O-CG 3.43Å; I132-Q136 PolarHBondContact O-N 2.7Å; I132-V142 HydrophobicContact CG1-CG1 4.38Å; I132-T427 HydrophobicContact CD1-CG2 4.44Å
133	E	89.8	Confident	88.7	Confident	31 Å²	31	48.4 Å²	48.4	15%	0.145	25%	0.246	C	C	.	.	H	α-helix	trans	-69.1	-40	179	-67.8	160.9	-163.1	0	0	111.3	R129 R130 L131 Q136 L137	R129-E133 WeakPolarHBondContact CA-OE2 3.5Å; R129-E133 HydrophobicContact CB-CB 4.23Å; R130-E133 IonicContact CZ-OE1 3.06Å; R130-E133 PolarHBondContact N-OE2 3.05Å; R130-E133 VanDerWaalsContact N-OE2 3.15Å; R130-E133 IonicContact NE-OE1 3.85Å; R130-E133 PolarHBondContact NE-OE1 2.79Å; R130-E133 IonicContact NH2-OE1 3.15Å; R130-E133 PolarHBondContact NH2-OE1 3.34Å; R130-E133 PolarHBondContact O-N 3.21Å; R130-E133 VanDerWaalsContact O-N 3.12Å; L131-E133 VanDerWaalsContact C-N 3.33Å; L131-E133 PolarHBondContact O-N 3.46Å; E133-Q136 PolarHBondContact O-N 2.99Å; E133-L137 WeakPolarHBondContact O-CB 3.41Å; E133-L137 WeakPolarHBondContact O-CD1 3.41Å; E133-L137 VanDerWaalsContact O-CG 3.25Å; E133-L137 WeakPolarHBondContact O-CG 3.27Å; E133-L137 PolarHBondContact O-N 2.91Å
134	L	90.1	Very high	89	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-45	173.7	-70.4	173.5	0	0	0	111.3	F89 Y124 R129 R130 L131 L137 A138 L149	F89-L134 HydrophobicContact CB-CD1 4.36Å; F89-L134 HydrophobicContact CD2-CD1 3.62Å; F89-L134 HydrophobicContact CE2-CD1 4.39Å; F89-L134 HydrophobicContact CG-CD1 4.37Å; Y124-L134 VanDerWaalsContact C-CD2 3.48Å; Y124-L134 WeakPolarHBondContact O-CD2 3.39Å; R129-L134 HydrophobicContact CB-CD2 3.81Å; R129-L134 HydrophobicContact CB-CG 3.91Å; R130-L134 WeakPolarHBondContact O-CG 3.25Å; R130-L134 PolarHBondContact O-N 3.12Å; L131-L134 PolarHBondContact O-N 3.41Å; L134-L137 PolarHBondContact O-N 3.32Å; L134-A138 WeakPolarHBondContact O-CB 3.46Å; L134-A138 PolarHBondContact O-N 2.8Å; L134-L149 HydrophobicContact CD1-CD1 4.11Å
135	A	90.5	Very high	89.1	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.8	-45.9	177.9	0	0	0	0	0	111.5	L131 I132 A138 Q139 L140 V142 A145	L131-A135 WeakPolarHBondContact O-CB 3.47Å; L131-A135 PolarHBondContact O-N 2.98Å; I132-A135 PolarHBondContact O-N 3.34Å; A135-A138 PolarHBondContact O-N 3.04Å; A135-Q139 PolarHBondContact O-N 3.09Å; A135-L140 CarbonylContact C-O 3.59Å; A135-L140 PolarHBondContact O-N 3.39Å; A135-V142 HydrophobicContact CB-CB 4.42Å; A135-V142 HydrophobicContact CB-CG2 3.99Å; A135-A145 HydrophobicContact CB-CB 3.74Å
136	Q	91.6	Very high	89.3	Confident	136 Å²	136	47.6 Å²	47.6	64%	0.636	24%	0.236	S	C	*	.	H	α-helix	trans	-61.5	-45.8	176.8	-74.2	174.4	-4.2	0	0	112.4	I132 E133 Q139	I132-Q136 VanDerWaalsContact O-CG 3.29Å; I132-Q136 WeakPolarHBondContact O-CG 3.43Å; I132-Q136 PolarHBondContact O-N 2.7Å; E133-Q136 PolarHBondContact O-N 2.99Å; Q136-Q139 PolarHBondContact O-N 3.11Å
137	L	90.7	Very high	89.6	Confident	70 Å²	70	49.2 Å²	49.2	37%	0.366	24%	0.244	S	C	.	.	H	α-helix	trans	-68.9	-36.7	179.8	-71.7	168	0	0	0	112.6	Y124 E133 L134 Q139	Y124-L137 HydrophobicContact CD1-CB 4.1Å; Y124-L137 HydrophobicContact CD2-CB 4.25Å; Y124-L137 HydrophobicContact CE1-CB 4.35Å; Y124-L137 WeakPolarHBondContact CE2-O 3.33Å; Y124-L137 HydrophobicContact CG-CB 4.04Å; E133-L137 WeakPolarHBondContact O-CB 3.41Å; E133-L137 WeakPolarHBondContact O-CD1 3.41Å; E133-L137 VanDerWaalsContact O-CG 3.25Å; E133-L137 WeakPolarHBondContact O-CG 3.27Å; E133-L137 PolarHBondContact O-N 2.91Å; L134-L137 PolarHBondContact O-N 3.32Å; L137-Q139 PolarHBondContact O-N 3.42Å
138	A	90.6	Very high	89.7	Confident	4 Å²	4	49.1 Å²	49.1	3%	0.033	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-4.1	175.2	0	0	0	0	0	113.4	R120 V121 Y124 L134 A135 L140	R120-A138 HydrophobicContact CB-CB 4.14Å; R120-A138 WeakPolarHBondContact CD-O 3.32Å; V121-A138 HydrophobicContact CG2-CB 4.17Å; Y124-A138 HydrophobicContact CD2-CB 4.05Å; Y124-A138 HydrophobicContact CE2-CB 4.2Å; L134-A138 WeakPolarHBondContact O-CB 3.46Å; L134-A138 PolarHBondContact O-N 2.8Å; A135-A138 PolarHBondContact O-N 3.04Å; A138-L140 VanDerWaalsContact C-N 3.29Å; A138-L140 HydrophobicContact CB-CD1 3.88Å; A138-L140 HydrophobicContact CB-CG 4.08Å; A138-L140 PolarHBondContact O-N 2.85Å
139	Q	92.6	Very high	89.9	Confident	162 Å²	162	46.9 Å²	46.9	76%	0.757	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	46.8	-174.5	-56.6	175.9	-4.8	0	0	111.9	A135 Q136 L137	A135-Q139 PolarHBondContact O-N 3.09Å; Q136-Q139 PolarHBondContact O-N 3.11Å; L137-Q139 PolarHBondContact O-N 3.42Å
140	L	90.9	Very high	89.9	Confident	30 Å²	30	46.1 Å²	46.1	16%	0.157	23%	0.234	C	C	.	.			trans	-120.5	153.8	178.7	-67.2	172.7	0	0	0	110.3	V117 R120 V121 A135 A138 A145	V117-L140 HydrophobicContact CG1-CD1 3.76Å; R120-L140 HydrophobicContact CB-CD1 4.34Å; V121-L140 HydrophobicContact CG2-CD1 3.37Å; A135-L140 CarbonylContact C-O 3.59Å; A135-L140 PolarHBondContact O-N 3.39Å; A138-L140 VanDerWaalsContact C-N 3.29Å; A138-L140 HydrophobicContact CB-CD1 3.88Å; A138-L140 HydrophobicContact CB-CG 4.08Å; A138-L140 PolarHBondContact O-N 2.85Å; L140-A145 HydrophobicContact CB-CB 4.41Å
141	D	90.3	Very high	89.6	Confident	102 Å²	102	45.6 Å²	45.6	55%	0.545	23%	0.232	S	C	.	.			trans	-60.7	139.1	164.2	-168.6	-33.4	0	0	0	109.3	A143 I144 A145	D141-A143 PolarHBondContact O-N 3.42Å; D141-A143 PolarHBondContact OD1-N 2.75Å; D141-I144 HydrophobicContact CB-CB 4.35Å; D141-I144 HydrophobicContact CB-CD1 3.97Å; D141-I144 HydrophobicContact CB-CG1 4.07Å; D141-I144 PolarHBondContact O-N 2.84Å; D141-I144 VanDerWaalsContact O-N 3.14Å; D141-A145 WeakPolarHBondContact O-CB 3.25Å; D141-A145 PolarHBondContact O-N 3.1Å
142	V	89.9	Confident	89.3	Confident	43 Å²	43	45.6 Å²	45.6	26%	0.261	23%	0.232	S	C	.	.	H	α-helix	trans	-54.5	-38.7	175.3	-177.7	0	0	0	0	110.7	L131 I132 A135 R146	L131-V142 HydrophobicContact CD2-CG1 4.12Å; L131-V142 HydrophobicContact CG-CG1 4.27Å; I132-V142 HydrophobicContact CG1-CG1 4.38Å; A135-V142 HydrophobicContact CB-CB 4.42Å; A135-V142 HydrophobicContact CB-CG2 3.99Å; V142-R146 VanDerWaalsContact O-CB 3.26Å; V142-R146 WeakPolarHBondContact O-CB 3.33Å; V142-R146 PolarHBondContact O-N 3.02Å
143	A	89.6	Confident	89	Confident	46 Å²	46	43.1 Å²	43.1	38%	0.38	22%	0.22	S	C	.	.	H	α-helix	trans	-65	-42.8	178.6	0	0	0	0	0	112.4	D141 R146 L147	D141-A143 PolarHBondContact O-N 3.42Å; D141-A143 PolarHBondContact OD1-N 2.75Å; A143-R146 WeakPolarHBondContact O-CB 3.38Å; A143-R146 PolarHBondContact O-N 3.15Å; A143-L147 WeakPolarHBondContact O-CG 3.36Å; A143-L147 PolarHBondContact O-N 3.45Å
144	I	89.6	Confident	88.5	Confident	73 Å²	73	46 Å²	46	37%	0.374	23%	0.23	S	C	.	.	H	α-helix	trans	-69.2	-43.9	178.7	-62.3	172.3	0	0	0	110.3	L12 V117 D141 R146 L147 C148	L12-I144 HydrophobicContact CD1-CG2 4.45Å; V117-I144 HydrophobicContact CG1-CG2 3.93Å; V117-I144 HydrophobicContact CG2-CG2 4.29Å; D141-I144 HydrophobicContact CB-CB 4.35Å; D141-I144 HydrophobicContact CB-CD1 3.97Å; D141-I144 HydrophobicContact CB-CG1 4.07Å; D141-I144 PolarHBondContact O-N 2.84Å; D141-I144 VanDerWaalsContact O-N 3.14Å; I144-R146 VanDerWaalsContact C-N 3.29Å; I144-R146 PolarHBondContact O-N 2.68Å; I144-L147 PolarHBondContact O-N 3.26Å; I144-C148 WeakPolarHBondContact O-CB 3.3Å; I144-C148 PolarHBondContact O-N 2.82Å
145	A	90.5	Very high	87.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-40.4	175.2	0	0	0	0	0	111.3	L131 A135 L140 D141 C148 L149	L131-A145 HydrophobicContact CD1-CB 4.27Å; A135-A145 HydrophobicContact CB-CB 3.74Å; L140-A145 HydrophobicContact CB-CB 4.41Å; D141-A145 WeakPolarHBondContact O-CB 3.25Å; D141-A145 PolarHBondContact O-N 3.1Å; A145-C148 PolarHBondContact O-N 3.26Å; A145-L149 WeakPolarHBondContact O-CB 3.37Å; A145-L149 WeakPolarHBondContact O-CG 3.28Å; A145-L149 PolarHBondContact O-N 3.04Å
146	R	89.9	Confident	87.1	Confident	84 Å²	84	47.5 Å²	47.5	32%	0.317	24%	0.237	S	C	.	.	H	α-helix	trans	-59.4	-52.5	176	-165.4	-173.8	-69.8	144.3	-2.6	111	D85 L131 V142 A143 I144 C148 L149 I150	D85-R146 IonicContact OD1-CZ 3.61Å; D85-R146 IonicContact OD1-NE 3.36Å; D85-R146 PolarHBondContact OD1-NE 3.03Å; D85-R146 IonicContact OD1-NH2 3Å; D85-R146 PolarHBondContact OD1-NH2 3.12Å; D85-R146 IonicContact OD2-CZ 2.77Å; D85-R146 IonicContact OD2-NH2 3.03Å; D85-R146 PolarHBondContact OD2-NH2 2.78Å; L131-R146 HydrophobicContact CD1-CB 4.37Å; L131-R146 HydrophobicContact CD2-CB 3.85Å; L131-R146 HydrophobicContact CD2-CG 3.81Å; V142-R146 VanDerWaalsContact O-CB 3.26Å; V142-R146 WeakPolarHBondContact O-CB 3.33Å; V142-R146 PolarHBondContact O-N 3.02Å; A143-R146 WeakPolarHBondContact O-CB 3.38Å; A143-R146 PolarHBondContact O-N 3.15Å; I144-R146 VanDerWaalsContact C-N 3.29Å; I144-R146 PolarHBondContact O-N 2.68Å; R146-C148 VanDerWaalsContact C-N 3.32Å; R146-C148 PolarHBondContact O-N 3.36Å; R146-L149 PolarHBondContact O-N 3.39Å; R146-I150 HydrophobicContact CG-CD1 3.83Å; R146-I150 HydrophobicContact CG-CG1 4.36Å; R146-I150 WeakPolarHBondContact O-CB 3.48Å; R146-I150 VanDerWaalsContact O-CG1 3.28Å; R146-I150 WeakPolarHBondContact O-CG1 3.18Å; R146-I150 PolarHBondContact O-N 3.02Å
147	L	88.4	Confident	86.5	Confident	88 Å²	88	41.3 Å²	41.3	46%	0.461	21%	0.208	S	C	.	.	H	α-helix	trans	-59.2	-43.7	179	-70.7	173.4	0	0	0	111.8	L12 A143 I144 L149 E151	L12-L147 HydrophobicContact CD1-CB 4.31Å; A143-L147 WeakPolarHBondContact O-CG 3.36Å; A143-L147 PolarHBondContact O-N 3.45Å; I144-L147 PolarHBondContact O-N 3.26Å; L147-L149 PolarHBondContact O-N 3.43Å; L147-E151 VanDerWaalsContact O-CB 3.28Å; L147-E151 WeakPolarHBondContact O-CB 3.42Å; L147-E151 PolarHBondContact O-N 2.84Å
148	C	88.3	Confident	86.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.4	-46.1	176.1	-178.1	0	0	0	0	111.7	V117 I144 A145 R146 E151 L152	V117-C148 HydrophobicContact CG1-CB 3.63Å; I144-C148 WeakPolarHBondContact O-CB 3.3Å; I144-C148 PolarHBondContact O-N 2.82Å; A145-C148 PolarHBondContact O-N 3.26Å; R146-C148 VanDerWaalsContact C-N 3.32Å; R146-C148 PolarHBondContact O-N 3.36Å; C148-E151 PolarHBondContact O-N 2.86Å; C148-L152 WeakPolarHBondContact O-CB 3.38Å; C148-L152 WeakPolarHBondContact O-CG 3.19Å; C148-L152 PolarHBondContact O-N 2.63Å
149	L	89.5	Confident	86	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-72.3	-36.5	-178.3	-75.4	163.5	0	0	0	113.4	F89 V121 I125 L131 L134 A145 R146 L147 E151 L152 A153 V158	F89-L149 HydrophobicContact CB-CD2 4.25Å; F89-L149 HydrophobicContact CD1-CB 4.18Å; F89-L149 HydrophobicContact CD1-CD2 3.9Å; F89-L149 HydrophobicContact CD1-CG 4.42Å; F89-L149 HydrophobicContact CD2-CD1 3.88Å; F89-L149 HydrophobicContact CD2-CD2 4.27Å; F89-L149 HydrophobicContact CE1-CB 3.74Å; F89-L149 HydrophobicContact CE1-CD1 4.35Å; F89-L149 HydrophobicContact CE1-CD2 4.31Å; F89-L149 HydrophobicContact CE1-CG 4.35Å; F89-L149 HydrophobicContact CE2-CD1 3.71Å; F89-L149 HydrophobicContact CG-CD1 4.28Å; F89-L149 HydrophobicContact CG-CD2 3.85Å; F89-L149 HydrophobicContact CZ-CB 3.93Å; F89-L149 HydrophobicContact CZ-CD1 3.94Å; F89-L149 HydrophobicContact CZ-CG 4.4Å; V121-L149 HydrophobicContact CG1-CD1 4.16Å; V121-L149 HydrophobicContact CG1-CD2 3.82Å; V121-L149 HydrophobicContact CG1-CG 4.03Å; I125-L149 HydrophobicContact CD1-CD2 3.76Å; L131-L149 HydrophobicContact CD1-CD1 3.35Å; L134-L149 HydrophobicContact CD1-CD1 4.11Å; A145-L149 WeakPolarHBondContact O-CB 3.37Å; A145-L149 WeakPolarHBondContact O-CG 3.28Å; A145-L149 PolarHBondContact O-N 3.04Å; R146-L149 PolarHBondContact O-N 3.39Å; L147-L149 PolarHBondContact O-N 3.43Å; L149-E151 VanDerWaalsContact C-N 3.26Å; L149-E151 PolarHBondContact O-N 3.36Å; L149-L152 HydrophobicContact CD2-CD1 4.28Å; L149-L152 PolarHBondContact O-N 3.05Å; L149-A153 VanDerWaalsContact O-CB 3.25Å; L149-A153 WeakPolarHBondContact O-CB 3.45Å; L149-A153 PolarHBondContact O-N 3.2Å; L149-V158 HydrophobicContact CD2-CG1 4.46Å
150	I	87	Confident	85.9	Confident	21 Å²	21	32.9 Å²	32.9	11%	0.108	17%	0.165	C	C	.	.	H	α-helix	trans	-57	-46.6	170	-71.7	170.2	0	0	0	109.5	E80 I83 R146 A153 R154	E80-I150 HydrophobicContact CG-CG2 3.9Å; I83-I150 HydrophobicContact CB-CG1 4.07Å; I83-I150 HydrophobicContact CD1-CB 4.17Å; I83-I150 HydrophobicContact CD1-CG1 3.85Å; I83-I150 HydrophobicContact CD1-CG2 4.39Å; I83-I150 HydrophobicContact CG2-CG1 3.85Å; R146-I150 HydrophobicContact CG-CD1 3.83Å; R146-I150 HydrophobicContact CG-CG1 4.36Å; R146-I150 WeakPolarHBondContact O-CB 3.48Å; R146-I150 VanDerWaalsContact O-CG1 3.28Å; R146-I150 WeakPolarHBondContact O-CG1 3.18Å; R146-I150 PolarHBondContact O-N 3.02Å; I150-A153 PolarHBondContact O-N 3.44Å; I150-R154 WeakPolarHBondContact O-CB 3.16Å; I150-R154 PolarHBondContact O-N 2.77Å
151	E	81.9	Confident	85.8	Confident	14 Å²	14	31.9 Å²	31.9	7%	0.065	16%	0.16	C	C	.	.	H	α-helix	trans	-69.9	-42.8	-177.5	-172.8	47.9	-126	0	0	112.2	F6 L14 L147 C148 L149 A153 R154 I155	F6-E151 HydrophobicContact CD2-CG 4.23Å; F6-E151 WeakPolarHBondContact CE1-OE1 3.43Å; F6-E151 HydrophobicContact CE2-CG 3.58Å; F6-E151 WeakPolarHBondContact CE2-OE1 3.37Å; F6-E151 HydrophobicContact CZ-CG 4.08Å; F6-E151 WeakPolarHBondContact CZ-OE1 3.36Å; L14-E151 HydrophobicContact CD1-CB 3.81Å; L14-E151 HydrophobicContact CD1-CG 3.42Å; L14-E151 VanDerWaalsContact CD1-CG 3.42Å; L14-E151 HydrophobicContact CG-CB 4.43Å; L14-E151 HydrophobicContact CG-CG 3.81Å; L147-E151 VanDerWaalsContact O-CB 3.28Å; L147-E151 WeakPolarHBondContact O-CB 3.42Å; L147-E151 PolarHBondContact O-N 2.84Å; C148-E151 PolarHBondContact O-N 2.86Å; L149-E151 VanDerWaalsContact C-N 3.26Å; L149-E151 PolarHBondContact O-N 3.36Å; E151-A153 PolarHBondContact O-N 3.27Å; E151-R154 PolarHBondContact O-N 3.44Å; E151-R154 VanDerWaalsContact O-N 3.09Å; E151-R154 IonicContact OE1-CZ 3.17Å; E151-R154 IonicContact OE1-NE 2.64Å; E151-R154 IonicContact OE1-NH1 3.99Å; E151-R154 IonicContact OE1-NH2 3.23Å; E151-R154 PolarHBondContact OE1-NH2 2.73Å; E151-R154 IonicContact OE2-CZ 3.74Å; E151-R154 VanDerWaalsContact OE2-CZ 3.29Å; E151-R154 IonicContact OE2-NE 3.41Å; E151-R154 PolarHBondContact OE2-NE 2.87Å; E151-R154 VanDerWaalsContact OE2-NE 3.1Å; E151-R154 IonicContact OE2-NH2 3.69Å; E151-R154 PolarHBondContact OE2-NH2 3.27Å; E151-I155 HydrophobicContact CG-CD1 4.25Å; E151-I155 VanDerWaalsContact O-CG1 3.31Å; E151-I155 WeakPolarHBondContact O-CG1 3.48Å; E151-I155 PolarHBondContact O-N 2.77Å; E151-I155 WeakPolarHBondContact OE1-CD1 3.25Å; E151-I155 WeakPolarHBondContact OE1-CG1 3.48Å
152	L	84.4	Confident	85.7	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.9	-37.1	171.8	-73.5	174.7	0	0	0	112.7	L14 F16 L122 C148 L149 G156 L157 V158	L14-L152 HydrophobicContact CD1-CD2 3.85Å; L14-L152 HydrophobicContact CD1-CG 3.97Å; F16-L152 HydrophobicContact CE1-CD2 4.12Å; F16-L152 HydrophobicContact CZ-CD2 3.53Å; L122-L152 HydrophobicContact CD2-CD1 3.93Å; L122-L152 HydrophobicContact CG-CD1 4.38Å; C148-L152 WeakPolarHBondContact O-CB 3.38Å; C148-L152 WeakPolarHBondContact O-CG 3.19Å; C148-L152 PolarHBondContact O-N 2.63Å; L149-L152 HydrophobicContact CD2-CD1 4.28Å; L149-L152 PolarHBondContact O-N 3.05Å; L152-G156 PolarHBondContact O-N 2.89Å; L152-L157 HydrophobicContact CD2-CB 4.4Å; L152-L157 HydrophobicContact CD2-CD2 3.76Å; L152-L157 PolarHBondContact O-N 2.84Å; L152-V158 HydrophobicContact CB-CB 4.08Å; L152-V158 HydrophobicContact CB-CG2 3.84Å; L152-V158 HydrophobicContact CD1-CG2 4.24Å; L152-V158 PolarHBondContact O-N 3.44Å
153	A	84	Confident	85.5	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-69.3	-40.1	174.2	0	0	0	0	0	111.5	F75 I83 L149 I150 E151 I155 G156 V158	F75-A153 WeakPolarHBondContact CE2-O 3.23Å; F75-A153 WeakPolarHBondContact CZ-O 3.17Å; I83-A153 HydrophobicContact CD1-CB 3.67Å; L149-A153 VanDerWaalsContact O-CB 3.25Å; L149-A153 WeakPolarHBondContact O-CB 3.45Å; L149-A153 PolarHBondContact O-N 3.2Å; I150-A153 PolarHBondContact O-N 3.44Å; E151-A153 PolarHBondContact O-N 3.27Å; A153-I155 VanDerWaalsContact C-N 3.27Å; A153-I155 PolarHBondContact O-N 3.4Å; A153-G156 PolarHBondContact O-N 2.81Å; A153-V158 VanDerWaalsContact CA-O 3.28Å; A153-V158 WeakPolarHBondContact CA-O 3.32Å
154	R	78.9	Confident	85.2	Confident	92 Å²	92	27.1 Å²	27.1	35%	0.347	13%	0.127	S	C	.	.	H	α-helix	trans	-67.6	-25.6	177.6	-162	177.8	57.3	70.8	-7.3	113.6	F6 F75 I150 E151 G156	F6-R154 VanDerWaalsContact CZ-NH2 3.27Å; F75-R154 WeakPolarHBondContact CE1-O 3.46Å; F75-R154 VanDerWaalsContact CZ-C 3.41Å; F75-R154 WeakPolarHBondContact CZ-O 3.46Å; I150-R154 WeakPolarHBondContact O-CB 3.16Å; I150-R154 PolarHBondContact O-N 2.77Å; E151-R154 PolarHBondContact O-N 3.44Å; E151-R154 VanDerWaalsContact O-N 3.09Å; E151-R154 IonicContact OE1-CZ 3.17Å; E151-R154 IonicContact OE1-NE 2.64Å; E151-R154 IonicContact OE1-NH1 3.99Å; E151-R154 IonicContact OE1-NH2 3.23Å; E151-R154 PolarHBondContact OE1-NH2 2.73Å; E151-R154 IonicContact OE2-CZ 3.74Å; E151-R154 VanDerWaalsContact OE2-CZ 3.29Å; E151-R154 IonicContact OE2-NE 3.41Å; E151-R154 PolarHBondContact OE2-NE 2.87Å; E151-R154 VanDerWaalsContact OE2-NE 3.1Å; E151-R154 IonicContact OE2-NH2 3.69Å; E151-R154 PolarHBondContact OE2-NH2 3.27Å; R154-G156 VanDerWaalsContact C-N 3.3Å
155	I	75.5	Confident	84.7	Confident	32 Å²	32	23.6 Å²	23.6	16%	0.164	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-15.3	172.9	-62.9	163.5	0	0	0	111.3	L4 F6 L14 F16 F72 E151 A153	L4-I155 HydrophobicContact CD1-CD1 3.4Å; L4-I155 VanDerWaalsContact CD1-CD1 3.4Å; L4-I155 HydrophobicContact CD1-CG1 3.66Å; L4-I155 HydrophobicContact CD1-CG2 4.2Å; F6-I155 HydrophobicContact CZ-CD1 4.2Å; F6-I155 HydrophobicContact CZ-CG1 4.47Å; L14-I155 HydrophobicContact CD1-CD1 3.97Å; F16-I155 HydrophobicContact CE2-CD1 3.72Å; F16-I155 HydrophobicContact CZ-CD1 4.48Å; F72-I155 WeakPolarHBondContact CD2-O 3.29Å; E151-I155 HydrophobicContact CG-CD1 4.25Å; E151-I155 VanDerWaalsContact O-CG1 3.31Å; E151-I155 WeakPolarHBondContact O-CG1 3.48Å; E151-I155 PolarHBondContact O-N 2.77Å; E151-I155 WeakPolarHBondContact OE1-CD1 3.25Å; E151-I155 WeakPolarHBondContact OE1-CG1 3.48Å; A153-I155 VanDerWaalsContact C-N 3.27Å; A153-I155 PolarHBondContact O-N 3.4Å
156	G	74.2	Confident	84.1	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	13.5	-175.6	0	0	0	0	0	114.1	F72 F75 I92 L152 A153 R154	F72-G156 VanDerWaalsContact CD2-C 3.43Å; F72-G156 WeakPolarHBondContact CD2-O 3.47Å; F72-G156 VanDerWaalsContact CE2-C 3.41Å; F72-G156 VanDerWaalsContact CE2-O 3.26Å; F72-G156 WeakPolarHBondContact CE2-O 3.49Å; F72-G156 WeakPolarHBondContact CG-O 3.15Å; F75-G156 VanDerWaalsContact CE2-CA 3.44Å; I92-G156 WeakPolarHBondContact CD1-O 3.36Å; L152-G156 PolarHBondContact O-N 2.89Å; A153-G156 PolarHBondContact O-N 2.81Å; R154-G156 VanDerWaalsContact C-N 3.3Å
157	L	79.2	Confident	83.4	Confident	5 Å²	5	20.7 Å²	20.7	3%	0.026	10%	0.1	C	C	.	.	S	Bend	trans	-75.4	-33.9	174.4	-176.3	58.3	0	0	0	111.4	F16 F72 I92 W111 L122 L152	F16-L157 HydrophobicContact CE1-CD2 3.96Å; F16-L157 HydrophobicContact CZ-CD2 4.36Å; F72-L157 HydrophobicContact CE2-CB 4.37Å; F72-L157 HydrophobicContact CZ-CB 4.42Å; F72-L157 HydrophobicContact CZ-CD1 3.85Å; I92-L157 PolarHBondContact N-O 3.26Å; W111-L157 HydrophobicContact CH2-CD1 4.2Å; W111-L157 HydrophobicContact CZ2-CD1 3.18Å; L122-L157 HydrophobicContact CD2-CD2 4.18Å; L152-L157 HydrophobicContact CD2-CB 4.4Å; L152-L157 HydrophobicContact CD2-CD2 3.76Å; L152-L157 PolarHBondContact O-N 2.84Å
158	V	84.6	Confident	82.3	Confident	1 Å²	1	16.9 Å²	16.9	1%	0.006	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	148.7	-177.7	175	0	0	0	0	109	F89 V90 L91 L122 I125 L149 L152 A153	F89-V158 HydrophobicContact CB-CG1 3.62Å; F89-V158 HydrophobicContact CD1-CG1 3.64Å; F89-V158 HydrophobicContact CG-CG1 4.08Å; V90-V158 CarbonylContact O-C 3.53Å; V90-V158 WeakPolarHBondContact O-CA 3.25Å; L91-V158 HydrophobicContact CD2-CG2 3.91Å; L122-V158 HydrophobicContact CD2-CG2 4.38Å; I125-V158 HydrophobicContact CD1-CG2 3.83Å; L149-V158 HydrophobicContact CD2-CG1 4.46Å; L152-V158 HydrophobicContact CB-CB 4.08Å; L152-V158 HydrophobicContact CB-CG2 3.84Å; L152-V158 HydrophobicContact CD1-CG2 4.24Å; L152-V158 PolarHBondContact O-N 3.44Å; A153-V158 VanDerWaalsContact CA-O 3.28Å; A153-V158 WeakPolarHBondContact CA-O 3.32Å
159	R	86.3	Confident	80.9	Confident	53 Å²	53	17.7 Å²	17.7	20%	0.2	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.3	167	-166.4	67.2	-178.2	-85.1	-4.3	109.9	Q78 F89 V90 I92 L161 V308	Q78-R159 VanDerWaalsContact NE2-NE 3.12Å; F89-R159 WeakPolarHBondContact CA-O 3.32Å; V90-R159 PolarHBondContact N-O 3Å; V90-R159 PolarHBondContact O-N 2.86Å; I92-R159 HydrophobicContact CD1-CB 3.87Å; I92-R159 HydrophobicContact CG1-CB 3.99Å; R159-L161 HydrophobicContact CG-CD2 4.01Å; R159-V308 HydrophobicContact CB-CG1 4.35Å; R159-V308 HydrophobicContact CB-CG2 4Å; R159-V308 HydrophobicContact CG-CG2 4.14Å; R159-V308 PolarHBondContact NH1-O 2.77Å
160	A	90.3	Very high	79.4	Confident	5 Å²	5	18.1 Å²	18.1	4%	0.041	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	126.1	167.5	0	0	0	0	0	109.6	Q78 I83 C87 V88 F89	Q78-A160 PolarHBondContact NE2-O 3.31Å; Q78-A160 PolarHBondContact OE1-O 3.15Å; I83-A160 HydrophobicContact CG1-CB 4.01Å; C87-A160 HydrophobicContact CB-CB 4.15Å; V88-A160 CarbonylContact O-C 3.57Å; V88-A160 WeakPolarHBondContact O-CA 3.4Å; F89-A160 HydrophobicContact CD1-CB 4.08Å; F89-A160 HydrophobicContact CE1-CB 3.82Å
161	L	90.1	Very high	77.8	Confident	9 Å²	9	20.3 Å²	20.3	5%	0.047	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	157	174.8	-60.6	-179.6	0	0	0	110.1	C87 V88 V90 R159 Q304 E307 V308	C87-L161 CarbonylContact C-O 3.58Å; C87-L161 VanDerWaalsContact CA-O 3.24Å; C87-L161 WeakPolarHBondContact CA-O 2.93Å; C87-L161 WeakPolarHBondContact CB-O 3.47Å; V88-L161 HydrophobicContact CG2-CB 3.92Å; V88-L161 PolarHBondContact N-O 3.23Å; V88-L161 PolarHBondContact O-N 2.91Å; V90-L161 HydrophobicContact CG2-CD1 3.59Å; V90-L161 HydrophobicContact CG2-CG 4.27Å; R159-L161 HydrophobicContact CG-CD2 4.01Å; L161-Q304 HydrophobicContact CD1-CB 4.12Å; L161-Q304 HydrophobicContact CD1-CG 3.89Å; L161-E307 HydrophobicContact CD1-CB 4.35Å; L161-E307 HydrophobicContact CD2-CB 3.75Å; L161-V308 HydrophobicContact CD1-CG2 4Å; L161-V308 HydrophobicContact CD2-CG2 4.25Å; L161-V308 HydrophobicContact CG-CG2 4.4Å
162	P	86.7	Confident	76.4	Confident	46 Å²	46	21.6 Å²	21.6	30%	0.299	10%	0.103	S	C	.	.			trans	-56.8	150.2	168.1	-21.5	33.3	0	0	0	111.4
163	Y	87.1	Confident	74.5	Confident	33 Å²	33	24.6 Å²	24.6	13%	0.129	13%	0.128	C	C	.	.			trans	-55.7	131.4	174.1	-171.4	-106.2	0	0	0	110.7	N86 V88 R128 R130 T165 R314 T423 L426	N86-Y163 WeakPolarHBondContact O-CB 3.48Å; V88-Y163 HydrophobicContact CG1-CD2 3.59Å; V88-Y163 HydrophobicContact CG1-CE2 4.28Å; V88-Y163 HydrophobicContact CG1-CG 4.47Å; R128-Y163 WeakPolarHBondContact O-CE2 3.41Å; R130-Y163 HydrophobicContact CG-CD2 3.45Å; R130-Y163 VanDerWaalsContact CG-CD2 3.45Å; R130-Y163 HydrophobicContact CG-CE2 3.73Å; R130-Y163 HydrophobicContact CG-CG 4.43Å; Y163-T165 HydrophobicContact CD1-CG2 3.68Å; Y163-T165 HydrophobicContact CE1-CG2 4.45Å; Y163-T165 PolarHBondContact O-N 2.92Å; Y163-R314 PolarHBondContact O-NH1 3.31Å; Y163-T423 HydrophobicContact CG-CG2 4.4Å; Y163-L426 HydrophobicContact CE1-CD1 4.22Å
164	P	83.5	Confident	72.8	Confident	12 Å²	12	32.1 Å²	32.1	8%	0.078	17%	0.168	C	C	.	.			trans	-77.2	63.4	-177.3	32.9	-36.5	0	0	0	111.1	F166 I167 L300	P164-F166 HydrophobicContact CB-CD1 4.03Å; P164-F166 HydrophobicContact CB-CE1 3.52Å; P164-F166 HydrophobicContact CB-CZ 4.14Å; P164-F166 PolarHBondContact O-N 2.99Å; P164-F166 VanDerWaalsContact O-N 3.09Å; P164-I167 HydrophobicContact CB-CD1 3.87Å; P164-I167 HydrophobicContact CB-CG1 4.31Å; P164-I167 HydrophobicContact CG-CD1 4.2Å; P164-I167 WeakPolarHBondContact O-CB 3.46Å; P164-I167 PolarHBondContact O-N 2.95Å; P164-L300 HydrophobicContact CB-CD1 3.83Å; P164-L300 HydrophobicContact CG-CD1 4.06Å
165	T	78.6	Confident	71.2	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-53.1	-29.7	178.1	49	0	0	0	0	112.4	Y163 I167 M168 R314 D419 I422	Y163-T165 HydrophobicContact CD1-CG2 3.68Å; Y163-T165 HydrophobicContact CE1-CG2 4.45Å; Y163-T165 PolarHBondContact O-N 2.92Å; T165-I167 PolarHBondContact O-N 2.91Å; T165-M168 WeakPolarHBondContact O-CB 3.44Å; T165-M168 PolarHBondContact O-N 3.11Å; T165-R314 PolarHBondContact OG1-NH1 2.81Å; T165-R314 VanDerWaalsContact OG1-NH1 3.13Å; T165-R314 PolarHBondContact OG1-NH2 3.49Å; T165-D419 HydrophobicContact CG2-CB 4.43Å; T165-D419 PolarHBondContact OG1-OD1 3.25Å; T165-I422 HydrophobicContact CG2-CG2 4.1Å
166	F	77.8	Confident	69.8	Low	4 Å²	4	32.2 Å²	32.2	2%	0.018	17%	0.17	C	C	.	.	H	α-helix	trans	-57.6	-34.9	176.5	71.4	-90.2	0	0	0	112.4	P164 Q169 L170 I182 W185 L299 L300 V303	P164-F166 HydrophobicContact CB-CD1 4.03Å; P164-F166 HydrophobicContact CB-CE1 3.52Å; P164-F166 HydrophobicContact CB-CZ 4.14Å; P164-F166 PolarHBondContact O-N 2.99Å; P164-F166 VanDerWaalsContact O-N 3.09Å; F166-Q169 PolarHBondContact O-N 3.37Å; F166-L170 HydrophobicContact CD2-CD1 3.94Å; F166-L170 WeakPolarHBondContact O-CD1 3.23Å; F166-L170 WeakPolarHBondContact O-CG 3.41Å; F166-L170 PolarHBondContact O-N 3.14Å; F166-I182 HydrophobicContact CB-CD1 4.29Å; F166-I182 HydrophobicContact CB-CG2 3.9Å; F166-W185 HydrophobicContact CB-CH2 4.38Å; F166-W185 HydrophobicContact CD1-CH2 4.29Å; F166-W185 AromaticContact CD1-CZ2 3.89Å; F166-W185 HydrophobicContact CD1-CZ2 3.89Å; F166-W185 HydrophobicContact CD2-CH2 4.33Å; F166-W185 HydrophobicContact CE1-CZ2 4.08Å; F166-W185 HydrophobicContact CG-CH2 4.1Å; F166-W185 HydrophobicContact CG-CZ2 4.17Å; F166-L299 HydrophobicContact CD2-CD2 4.32Å; F166-L299 HydrophobicContact CE2-CD2 4.11Å; F166-L299 HydrophobicContact CE2-CG 4.09Å; F166-L300 HydrophobicContact CZ-CD1 4.21Å; F166-V303 HydrophobicContact CE1-CB 4.25Å; F166-V303 HydrophobicContact CE1-CG1 3.86Å; F166-V303 HydrophobicContact CE1-CG2 4.36Å; F166-V303 HydrophobicContact CE2-CG2 4.11Å; F166-V303 HydrophobicContact CZ-CB 3.79Å; F166-V303 HydrophobicContact CZ-CG1 3.94Å; F166-V303 HydrophobicContact CZ-CG2 3.74Å
167	I	74.7	Confident	68.4	Low	18 Å²	18	37.2 Å²	37.2	9%	0.092	21%	0.205	C	C	.	.	H	α-helix	trans	-67.4	-42	179.2	-66.1	174.5	0	0	0	111.5	P164 T165 Q169 L170 L171 E255 L300	P164-I167 HydrophobicContact CB-CD1 3.87Å; P164-I167 HydrophobicContact CB-CG1 4.31Å; P164-I167 HydrophobicContact CG-CD1 4.2Å; P164-I167 WeakPolarHBondContact O-CB 3.46Å; P164-I167 PolarHBondContact O-N 2.95Å; T165-I167 PolarHBondContact O-N 2.91Å; I167-Q169 PolarHBondContact O-N 2.87Å; I167-L170 WeakPolarHBondContact O-CA 3.46Å; I167-L170 WeakPolarHBondContact O-CB 3.23Å; I167-L170 PolarHBondContact O-N 3.38Å; I167-L171 HydrophobicContact CG2-CD1 3.46Å; I167-L171 VanDerWaalsContact CG2-CD1 3.46Å; I167-L171 WeakPolarHBondContact O-CD1 3.38Å; I167-L171 PolarHBondContact O-N 3.45Å; I167-L171 VanDerWaalsContact O-N 3.1Å; I167-E255 HydrophobicContact CG2-CG 3.96Å; I167-L300 HydrophobicContact CD1-CB 3.51Å; I167-L300 HydrophobicContact CD1-CD1 3.22Å; I167-L300 HydrophobicContact CD1-CD2 3.85Å; I167-L300 HydrophobicContact CD1-CG 3.66Å
168	M	66	Low	66.9	Low	8 Å²	8	39.8 Å²	39.8	4%	0.039	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-37.2	-177.3	-156.5	-174.9	53.7	0	0	111.2	T165 L171 I422 L426 F440 I442 I446	T165-M168 WeakPolarHBondContact O-CB 3.44Å; T165-M168 PolarHBondContact O-N 3.11Å; M168-L171 PolarHBondContact O-N 3.34Å; M168-I422 HydrophobicContact CE-CG2 4.14Å; M168-L426 HydrophobicContact CE-CD1 3.57Å; M168-L426 HydrophobicContact CE-CD2 3.88Å; M168-L426 HydrophobicContact CE-CG 4.2Å; M168-L426 HydrophobicContact SD-CD1 3.45Å; M168-L426 WeakPolarHBondContact SD-CD1 3.46Å; M168-L426 HydrophobicContact SD-CD2 3.49Å; M168-L426 WeakPolarHBondContact SD-CD2 3.33Å; M168-L426 HydrophobicContact SD-CG 4.1Å; M168-F440 HydrophobicContact CG-CD1 4.12Å; M168-F440 HydrophobicContact CG-CE1 4.34Å; M168-I442 HydrophobicContact CB-CD1 4.4Å; M168-I442 HydrophobicContact CE-CD1 3.94Å; M168-I442 HydrophobicContact CE-CG1 3.9Å; M168-I442 HydrophobicContact CE-CG2 4.36Å; M168-I442 HydrophobicContact CG-CD1 3.78Å; M168-I442 HydrophobicContact CG-CG1 3.76Å; M168-I442 VanDerWaalsContact O-CD1 3.25Å; M168-I442 WeakPolarHBondContact O-CD1 3.46Å; M168-I442 HydrophobicContact SD-CD1 4.32Å; M168-I442 HydrophobicContact SD-CG1 3.88Å; M168-I446 HydrophobicContact CE-CG2 4.42Å
169	Q	57.8	Low	65.3	Low	17 Å²	17	43.6 Å²	43.6	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-69.9	-35.5	176.8	-57.5	-175	30.2	0	0	112	F166 I167 L171 Q172 T180 I182 L450	F166-Q169 PolarHBondContact O-N 3.37Å; I167-Q169 PolarHBondContact O-N 2.87Å; Q169-L171 VanDerWaalsContact C-N 3.31Å; Q169-L171 PolarHBondContact O-N 3.43Å; Q169-Q172 PolarHBondContact O-N 2.83Å; Q169-T180 PolarHBondContact OE1-OG1 3.42Å; Q169-I182 HydrophobicContact CB-CD1 4.09Å; Q169-I182 VanDerWaalsContact CD-CG1 3.46Å; Q169-I182 HydrophobicContact CG-CD1 4.45Å; Q169-L450 HydrophobicContact CG-CD1 3.84Å
170	L	58.4	Low	63.8	Low	10 Å²	10	42.7 Å²	42.7	5%	0.052	25%	0.246	C	C	.	.	H	α-helix	trans	-68.5	-26.4	177	-64.7	168.9	0	0	0	113.5	F166 I167 Q172 F176 F239 L241 L272 L299	F166-L170 HydrophobicContact CD2-CD1 3.94Å; F166-L170 WeakPolarHBondContact O-CD1 3.23Å; F166-L170 WeakPolarHBondContact O-CG 3.41Å; F166-L170 PolarHBondContact O-N 3.14Å; I167-L170 WeakPolarHBondContact O-CA 3.46Å; I167-L170 WeakPolarHBondContact O-CB 3.23Å; I167-L170 PolarHBondContact O-N 3.38Å; L170-Q172 PolarHBondContact O-N 3.09Å; L170-F176 HydrophobicContact CD2-CE1 4.5Å; L170-F176 WeakPolarHBondContact O-CZ 3.27Å; L170-F239 HydrophobicContact CD1-CE1 4.35Å; L170-F239 HydrophobicContact CD2-CE1 4.32Å; L170-L241 HydrophobicContact CD1-CD1 4.41Å; L170-L241 HydrophobicContact CD2-CB 3.6Å; L170-L241 HydrophobicContact CD2-CD1 3.68Å; L170-L241 HydrophobicContact CD2-CD2 3.27Å; L170-L241 HydrophobicContact CD2-CG 3.63Å; L170-L272 HydrophobicContact CB-CD2 3.91Å; L170-L272 HydrophobicContact CD1-CD1 4.38Å; L170-L299 HydrophobicContact CD1-CD2 3.43Å; L170-L299 VanDerWaalsContact CD1-CD2 3.43Å
171	L	53.5	Low	62.3	Low	66 Å²	66	43.5 Å²	43.5	35%	0.346	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-12.7	175.5	-85.1	81.3	0	0	0	112.9	I167 M168 Q169 A173 F440	I167-L171 HydrophobicContact CG2-CD1 3.46Å; I167-L171 VanDerWaalsContact CG2-CD1 3.46Å; I167-L171 WeakPolarHBondContact O-CD1 3.38Å; I167-L171 PolarHBondContact O-N 3.45Å; I167-L171 VanDerWaalsContact O-N 3.1Å; M168-L171 PolarHBondContact O-N 3.34Å; Q169-L171 VanDerWaalsContact C-N 3.31Å; Q169-L171 PolarHBondContact O-N 3.43Å; L171-A173 PolarHBondContact O-N 3.24Å; L171-F440 HydrophobicContact CD2-CB 4.43Å; L171-F440 HydrophobicContact CD2-CD2 3.99Å
172	Q	52.4	Low	61.4	Low	41 Å²	41	43.4 Å²	43.4	19%	0.192	25%	0.249	C	C	.	.			trans	-84.4	78.4	-178.4	-134.4	172.8	16.5	0	0	111	Q169 L170 D174 K175 I442	Q169-Q172 PolarHBondContact O-N 2.83Å; L170-Q172 PolarHBondContact O-N 3.09Å; Q172-D174 PolarHBondContact O-N 3.22Å; Q172-K175 PolarHBondContact O-N 3.13Å; Q172-I442 HydrophobicContact CB-CD1 4.47Å; Q172-I442 HydrophobicContact CG-CD1 4.44Å; Q172-I442 PolarHBondContact NE2-O 3.33Å
173	A	45.3	Very low	60.9	Low	63 Å²	63	41.5 Å²	41.5	52%	0.521	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-57.4	-24.6	-173.7	0	0	0	0	0	116.1	L171 K175 F176	L171-A173 PolarHBondContact O-N 3.24Å; A173-K175 PolarHBondContact O-N 3.48Å; A173-F176 VanDerWaalsContact CA-CE2 3.48Å; A173-F176 HydrophobicContact CB-CE2 4.2Å; A173-F176 VanDerWaalsContact O-CD2 3.3Å; A173-F176 WeakPolarHBondContact O-CD2 3.38Å
174	D	47.9	Very low	60.8	Low	159 Å²	159	39.9 Å²	39.9	85%	0.85	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-83.4	-6.6	-172.1	-70.3	-20.6	0	0	0	114.3	Q172	Q172-D174 PolarHBondContact O-N 3.22Å
175	K	45.6	Very low	61.2	Low	74 Å²	74	39.4 Å²	39.4	32%	0.322	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-129.6	23.8	-176.2	-67.1	-173	-175.3	-179.7	0	115	Q172 A173 S177 N178 S447	Q172-K175 PolarHBondContact O-N 3.13Å; A173-K175 PolarHBondContact O-N 3.48Å; K175-S177 PolarHBondContact O-N 2.94Å; K175-N178 PolarHBondContact O-N 3.34Å; K175-N178 VanDerWaalsContact O-N 3.12Å; K175-S447 PolarHBondContact NZ-OG 3.47Å
176	F	46.5	Very low	61.7	Low	52 Å²	52	44 Å²	44	23%	0.228	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-15.2	173.7	-82.5	-68.9	0	0	0	115	L170 A173 L241 P273	L170-F176 HydrophobicContact CD2-CE1 4.5Å; L170-F176 WeakPolarHBondContact O-CZ 3.27Å; A173-F176 VanDerWaalsContact CA-CE2 3.48Å; A173-F176 HydrophobicContact CB-CE2 4.2Å; A173-F176 VanDerWaalsContact O-CD2 3.3Å; A173-F176 WeakPolarHBondContact O-CD2 3.38Å; F176-L241 HydrophobicContact CE1-CD2 3.78Å; F176-P273 HydrophobicContact CD2-CG 3.68Å; F176-P273 HydrophobicContact CE2-CB 4.44Å; F176-P273 HydrophobicContact CE2-CG 3.04Å; F176-P273 HydrophobicContact CZ-CG 3.57Å
177	S	44.7	Very low	62.4	Low	106 Å²	106	45.3 Å²	45.3	74%	0.741	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-23.8	177.5	62.7	0	0	0	0	113.8	K175	K175-S177 PolarHBondContact O-N 2.94Å
178	N	47.3	Very low	63.1	Low	59 Å²	59	46.9 Å²	46.9	32%	0.316	27%	0.273	S	S	.	.	S	Bend	trans	-96.5	117.1	-178.3	-65.4	-0.6	0	0	0	107.1	K175 T180	K175-N178 PolarHBondContact O-N 3.34Å; K175-N178 VanDerWaalsContact O-N 3.12Å; N178-T180 PolarHBondContact O-N 3.44Å
179	S	50.8	Low	64.1	Low	81 Å²	81	52.4 Å²	52.4	57%	0.566	31%	0.31	S	S	*	.			trans	-62.5	84.4	169.2	-172.6	0	0	0	0	108.5	L181	S179-L181 PolarHBondContact O-N 2.96Å; S179-L181 WeakPolarHBondContact OG-CD2 3.36Å
180	T	54.1	Low	65.6	Low	34 Å²	34	55 Å²	55	21%	0.209	32%	0.319	C	S	.	.			trans	-68.7	108.3	163.3	47.6	0	0	0	0	105.4	Q169 N178 I182 L450	Q169-T180 PolarHBondContact OE1-OG1 3.42Å; N178-T180 PolarHBondContact O-N 3.44Å; T180-I182 PolarHBondContact O-N 3.28Å; T180-L450 HydrophobicContact CG2-CB 4.39Å
181	L	59.6	Low	67.1	Low	21 Å²	21	55.2 Å²	55.2	11%	0.11	32%	0.32	C	S	.	.			trans	-69.9	96.9	-178.5	-55.6	177.1	0	0	0	108.4	S179 N238 Y453 F455	S179-L181 PolarHBondContact O-N 2.96Å; S179-L181 WeakPolarHBondContact OG-CD2 3.36Å; L181-N238 HydrophobicContact CB-CB 4.49Å; L181-N238 HydrophobicContact CD2-CB 4.14Å; L181-Y453 HydrophobicContact CB-CD1 4.03Å; L181-Y453 HydrophobicContact CB-CG 3.83Å; L181-Y453 HydrophobicContact CD1-CD1 3.84Å; L181-Y453 HydrophobicContact CD1-CG 4.2Å; L181-Y453 WeakPolarHBondContact CD1-O 3.43Å; L181-Y453 HydrophobicContact CG-CD1 4.45Å; L181-Y453 HydrophobicContact CG-CG 4.39Å; L181-F455 HydrophobicContact CD1-CD2 4.08Å
182	I	71.1	Confident	68.9	Low	8 Å²	8	54.8 Å²	54.8	4%	0.041	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	135.7	168.6	-64.7	162.6	0	0	0	106.8	F166 Q169 T180 G184 N238 F239	F166-I182 HydrophobicContact CB-CD1 4.29Å; F166-I182 HydrophobicContact CB-CG2 3.9Å; Q169-I182 HydrophobicContact CB-CD1 4.09Å; Q169-I182 VanDerWaalsContact CD-CG1 3.46Å; Q169-I182 HydrophobicContact CG-CD1 4.45Å; T180-I182 PolarHBondContact O-N 3.28Å; I182-G184 PolarHBondContact O-N 3.45Å; I182-N238 CarbonylContact O-C 3.56Å; I182-N238 WeakPolarHBondContact O-CA 3.44Å; I182-F239 HydrophobicContact CB-CB 4.02Å; I182-F239 HydrophobicContact CB-CD1 4.03Å; I182-F239 HydrophobicContact CD1-CD1 3.63Å; I182-F239 HydrophobicContact CD1-CE1 4.07Å; I182-F239 HydrophobicContact CG1-CD1 4.42Å; I182-F239 HydrophobicContact CG2-CB 4.1Å; I182-F239 HydrophobicContact CG2-CD1 4.03Å; I182-F239 PolarHBondContact O-N 3.24Å
183	P	76.6	Confident	70.7	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.032	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	132	172.9	28.6	-35.6	0	0	0	110.3	I315 W543	P183-I315 WeakPolarHBondContact CB-O 3.34Å; P183-W543 HydrophobicContact CB-CZ3 3.86Å
184	G	85.3	Confident	72.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	31%	0.307	C	S	.	.			trans	-78.4	-158.4	-175.5	0	0	0	0	0	113.2	I182 S237 I315	I182-G184 PolarHBondContact O-N 3.45Å; G184-S237 WeakPolarHBondContact CA-O 2.92Å; G184-S237 PolarHBondContact N-O 3.33Å; G184-I315 PolarHBondContact O-N 2.95Å
185	W	90.7	Very high	74.8	Confident	1 Å²	1	48 Å²	48	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	149.1	179.7	-67.3	-96.6	0	0	0	110.7	F166 L233 C234 F239 V303 E307 I312 R313	F166-W185 HydrophobicContact CB-CH2 4.38Å; F166-W185 HydrophobicContact CD1-CH2 4.29Å; F166-W185 AromaticContact CD1-CZ2 3.89Å; F166-W185 HydrophobicContact CD1-CZ2 3.89Å; F166-W185 HydrophobicContact CD2-CH2 4.33Å; F166-W185 HydrophobicContact CE1-CZ2 4.08Å; F166-W185 HydrophobicContact CG-CH2 4.1Å; F166-W185 HydrophobicContact CG-CZ2 4.17Å; W185-L233 HydrophobicContact CB-CD2 4.38Å; W185-L233 HydrophobicContact CB-CG 4.31Å; W185-L233 HydrophobicContact CD2-CD1 4.11Å; W185-L233 HydrophobicContact CD2-CD2 3.88Å; W185-L233 HydrophobicContact CD2-CG 3.83Å; W185-L233 HydrophobicContact CE3-CD1 3.29Å; W185-L233 HydrophobicContact CE3-CD2 3.91Å; W185-L233 HydrophobicContact CE3-CG 3.35Å; W185-L233 HydrophobicContact CG-CD2 4.09Å; W185-L233 HydrophobicContact CG-CG 4.25Å; W185-L233 HydrophobicContact CH2-CD1 4.03Å; W185-L233 HydrophobicContact CZ3-CD1 3.22Å; W185-L233 HydrophobicContact CZ3-CD2 4.43Å; W185-L233 HydrophobicContact CZ3-CG 3.87Å; W185-C234 VanDerWaalsContact O-CA 3.27Å; W185-C234 WeakPolarHBondContact O-CA 3.48Å; W185-F239 HydrophobicContact CE3-CB 4.23Å; W185-F239 HydrophobicContact CE3-CD2 4.43Å; W185-F239 HydrophobicContact CE3-CG 4.48Å; W185-F239 HydrophobicContact CH2-CB 4.26Å; W185-F239 HydrophobicContact CH2-CD1 4.13Å; W185-F239 HydrophobicContact CH2-CD2 4.17Å; W185-F239 AromaticContact CH2-CG 3.94Å; W185-F239 HydrophobicContact CH2-CG 3.94Å; W185-F239 HydrophobicContact CZ3-CB 3.49Å; W185-F239 VanDerWaalsContact CZ3-CB 3.49Å; W185-F239 HydrophobicContact CZ3-CD1 4.07Å; W185-F239 AromaticContact CZ3-CD2 3.46Å; W185-F239 HydrophobicContact CZ3-CD2 3.46Å; W185-F239 VanDerWaalsContact CZ3-CD2 3.46Å; W185-F239 HydrophobicContact CZ3-CE2 4.12Å; W185-F239 AromaticContact CZ3-CG 3.4Å; W185-F239 HydrophobicContact CZ3-CG 3.4Å; W185-F239 VanDerWaalsContact CZ3-CG 3.4Å; W185-V303 HydrophobicContact CH2-CG2 4.22Å; W185-V303 HydrophobicContact CZ2-CB 4.44Å; W185-V303 HydrophobicContact CZ2-CG1 3.76Å; W185-V303 HydrophobicContact CZ2-CG2 3.76Å; W185-E307 PolarHBondContact NE1-OE1 3.08Å; W185-E307 VanDerWaalsContact NE1-OE1 3.12Å; W185-I312 HydrophobicContact CB-CB 4.28Å; W185-I312 HydrophobicContact CB-CD1 4.43Å; W185-I312 HydrophobicContact CG-CD1 4.02Å; W185-R313 CarbonylContact C-O 3.5Å; W185-R313 WeakPolarHBondContact CA-O 3.27Å
186	L	90.3	Very high	76.9	Confident	98 Å²	98	50 Å²	50	51%	0.513	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.3	169.6	-179.3	66.3	0	0	0	108.7	L188 I312 R313 I315	L186-L188 PolarHBondContact O-N 3.43Å; L186-I312 CarbonylContact O-C 3.55Å; L186-I312 VanDerWaalsContact O-CA 3.29Å; L186-I312 WeakPolarHBondContact O-CA 3.49Å; L186-R313 PolarHBondContact N-O 3.13Å; L186-R313 PolarHBondContact O-N 2.83Å; L186-I315 HydrophobicContact CB-CG1 4.22Å
187	G	91.2	Very high	78.9	Confident	30 Å²	30	50.2 Å²	50.2	31%	0.309	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	124.6	171	0	0	0	0	0	109.9	C234	G187-C234 PolarHBondContact N-SG 3.44Å; G187-C234 VanDerWaalsContact N-SG 3.44Å
188	L	89.8	Confident	80.9	Confident	52 Å²	52	49.7 Å²	49.7	27%	0.272	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-88.3	154.8	175.3	-64.3	171.1	0	0	0	109.8	L186 R190 L191 G310 L311 R313	L186-L188 PolarHBondContact O-N 3.43Å; L188-R190 PolarHBondContact O-N 3Å; L188-L191 WeakPolarHBondContact O-CB 3.3Å; L188-L191 PolarHBondContact O-N 2.98Å; L188-G310 WeakPolarHBondContact CB-O 3.48Å; L188-G310 WeakPolarHBondContact CD1-O 3.27Å; L188-L311 WeakPolarHBondContact CB-O 3.48Å; L188-L311 PolarHBondContact N-O 2.98Å; L188-R313 HydrophobicContact CD1-CB 4.18Å; L188-R313 HydrophobicContact CD2-CB 4.44Å; L188-R313 HydrophobicContact CG-CB 4.39Å
189	P	88.2	Confident	82.5	Confident	123 Å²	123	49.3 Å²	49.3	80%	0.799	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-53.4	-30.8	179.6	-27.9	35.2	0	0	0	113.6	L191 A192	P189-L191 PolarHBondContact O-N 3.39Å; P189-A192 PolarHBondContact O-N 3.08Å
190	R	87.6	Confident	84.1	Confident	72 Å²	72	46 Å²	46	27%	0.272	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-64.5	-19.2	176.9	-167.1	176.9	173.2	146.5	4.9	113.5	N74 L188 A192 T193 N309 L311	N74-R190 VanDerWaalsContact CG-NH1 3.27Å; N74-R190 PolarHBondContact ND2-NH2 3.44Å; N74-R190 PolarHBondContact OD1-NH1 3.23Å; N74-R190 PolarHBondContact OD1-NH2 3.46Å; L188-R190 PolarHBondContact O-N 3Å; R190-A192 PolarHBondContact O-N 3.22Å; R190-A192 VanDerWaalsContact O-N 3.16Å; R190-T193 HydrophobicContact CG-CG2 4.33Å; R190-T193 WeakPolarHBondContact CG-OG1 3.33Å; R190-T193 PolarHBondContact O-N 3.14Å; R190-T193 PolarHBondContact O-OG1 3.4Å; R190-N309 WeakPolarHBondContact CD-O 3.43Å; R190-N309 PolarHBondContact NE-O 3.17Å; R190-L311 HydrophobicContact CB-CD2 4.44Å; R190-L311 HydrophobicContact CG-CD2 4.01Å
191	L	90.5	Very high	85.7	Confident	14 Å²	14	45.1 Å²	45.1	7%	0.073	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-54.2	-35.4	173.5	-179.5	58.6	0	0	0	111.9	L188 P189 T193 L194 F227 Y230 L311	L188-L191 WeakPolarHBondContact O-CB 3.3Å; L188-L191 PolarHBondContact O-N 2.98Å; P189-L191 PolarHBondContact O-N 3.39Å; L191-T193 VanDerWaalsContact C-N 3.29Å; L191-T193 PolarHBondContact O-N 2.91Å; L191-L194 HydrophobicContact CD1-CD2 4.47Å; L191-L194 WeakPolarHBondContact O-CB 3.49Å; L191-L194 PolarHBondContact O-N 3.42Å; L191-F227 HydrophobicContact CD1-CD2 4.38Å; L191-F227 HydrophobicContact CD1-CE2 4.49Å; L191-F227 HydrophobicContact CG-CD2 4.32Å; L191-F227 HydrophobicContact CG-CE2 3.94Å; L191-Y230 HydrophobicContact CD1-CD1 4.49Å; L191-Y230 HydrophobicContact CD1-CD2 3.76Å; L191-Y230 HydrophobicContact CD1-CG 3.71Å; L191-L311 HydrophobicContact CB-CB 4.49Å; L191-L311 HydrophobicContact CD1-CB 4.05Å
192	A	91.1	Very high	86.8	Confident	58 Å²	58	48.2 Å²	48.2	48%	0.479	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-65.7	-29.7	176.5	0	0	0	0	0	113	P189 R190 L194 L195	P189-A192 PolarHBondContact O-N 3.08Å; R190-A192 PolarHBondContact O-N 3.22Å; R190-A192 VanDerWaalsContact O-N 3.16Å; A192-L194 PolarHBondContact O-N 3.46Å; A192-L195 PolarHBondContact O-N 2.83Å; A192-L195 VanDerWaalsContact O-N 3.13Å
193	T	89.9	Confident	87.3	Confident	50 Å²	50	50 Å²	50	31%	0.307	30%	0.297	S	S	.	.	H	α-helix	trans	-68	-16	178.6	73.7	0	0	0	0	112.5	R190 L191 L195 T196 D197	R190-T193 HydrophobicContact CG-CG2 4.33Å; R190-T193 WeakPolarHBondContact CG-OG1 3.33Å; R190-T193 PolarHBondContact O-N 3.14Å; R190-T193 PolarHBondContact O-OG1 3.4Å; L191-T193 VanDerWaalsContact C-N 3.29Å; L191-T193 PolarHBondContact O-N 2.91Å; T193-L195 PolarHBondContact O-N 3.49Å; T193-T196 WeakPolarHBondContact CA-OG1 3.47Å; T193-T196 PolarHBondContact O-N 3.28Å; T193-T196 PolarHBondContact O-OG1 3.48Å; T193-D197 VanDerWaalsContact O-CB 3.31Å; T193-D197 WeakPolarHBondContact O-CB 3.03Å; T193-D197 PolarHBondContact O-N 2.86Å
194	L	88.6	Confident	87.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.6	-29.5	172.7	-170.7	66.5	0	0	0	112.1	L191 A192 L200 S201 C204 I223 I226 Y230 L311	L191-L194 HydrophobicContact CD1-CD2 4.47Å; L191-L194 WeakPolarHBondContact O-CB 3.49Å; L191-L194 PolarHBondContact O-N 3.42Å; A192-L194 PolarHBondContact O-N 3.46Å; L194-L200 HydrophobicContact CD1-CD2 4.2Å; L194-L200 HydrophobicContact CD1-CG 3.99Å; L194-S201 WeakPolarHBondContact O-CB 3.45Å; L194-C204 HydrophobicContact CD1-CB 3.86Å; L194-I223 HydrophobicContact CD1-CD1 3.93Å; L194-I223 HydrophobicContact CD2-CD1 4.05Å; L194-I223 HydrophobicContact CG-CD1 3.78Å; L194-I223 HydrophobicContact CG-CG1 4.06Å; L194-I226 HydrophobicContact CD2-CG2 4.36Å; L194-Y230 HydrophobicContact CD2-CD2 3.86Å; L194-Y230 HydrophobicContact CD2-CE2 3.83Å; L194-L311 HydrophobicContact CD1-CD1 4.13Å; L194-L311 HydrophobicContact CD2-CD1 4.4Å
195	L	90.9	Very high	87.7	Confident	69 Å²	69	51.8 Å²	51.8	36%	0.361	31%	0.306	S	S	.	.	H	α-helix	trans	-85	-25.2	178.7	-62.7	-179.9	0	0	0	113.1	A192 T193 I223 F227	A192-L195 PolarHBondContact O-N 2.83Å; A192-L195 VanDerWaalsContact O-N 3.13Å; T193-L195 PolarHBondContact O-N 3.49Å; L195-I223 HydrophobicContact CD2-CG2 4.41Å; L195-F227 HydrophobicContact CD1-CD1 3.99Å; L195-F227 HydrophobicContact CD1-CD2 3.95Å; L195-F227 HydrophobicContact CD1-CE1 3.98Å; L195-F227 HydrophobicContact CD1-CE2 3.94Å; L195-F227 HydrophobicContact CD1-CG 3.97Å; L195-F227 HydrophobicContact CD1-CZ 3.96Å; L195-F227 HydrophobicContact CD2-CB 3.75Å; L195-F227 HydrophobicContact CD2-CD1 4.43Å; L195-F227 HydrophobicContact CD2-CD2 4.06Å; L195-F227 HydrophobicContact CD2-CG 3.82Å; L195-F227 HydrophobicContact CG-CB 4.41Å; L195-F227 HydrophobicContact CG-CD1 4.48Å; L195-F227 HydrophobicContact CG-CD2 3.76Å; L195-F227 HydrophobicContact CG-CE2 4.11Å; L195-F227 HydrophobicContact CG-CG 3.96Å
196	T	90.9	Very high	87.2	Confident	117 Å²	117	54.1 Å²	54.1	72%	0.718	32%	0.317	S	S	*	.	H	α-helix	trans	-96.3	-33.7	-176.4	59.1	0	0	0	0	112.8	T193 S198	T193-T196 WeakPolarHBondContact CA-OG1 3.47Å; T193-T196 PolarHBondContact O-N 3.28Å; T193-T196 PolarHBondContact O-OG1 3.48Å; T196-S198 PolarHBondContact O-N 3.12Å
197	D	87.8	Confident	86.7	Confident	57 Å²	57	51.4 Å²	51.4	31%	0.305	30%	0.304	S	S	.	.			trans	-89.2	106.5	-177.7	-175.6	-9.2	0	0	0	111	T193 S199 L200 S201	T193-D197 VanDerWaalsContact O-CB 3.31Å; T193-D197 WeakPolarHBondContact O-CB 3.03Å; T193-D197 PolarHBondContact O-N 2.86Å; D197-S199 PolarHBondContact O-N 3.45Å; D197-S199 WeakPolarHBondContact OD1-CB 3.44Å; D197-S199 PolarHBondContact OD1-N 3.18Å; D197-S199 PolarHBondContact OD1-OG 3.01Å; D197-S199 PolarHBondContact OD2-OG 3.23Å; D197-L200 HydrophobicContact CB-CB 3.9Å; D197-L200 PolarHBondContact OD1-N 3.25Å; D197-L200 WeakPolarHBondContact OD2-CB 3.39Å; D197-S201 WeakPolarHBondContact O-CB 3.04Å; D197-S201 PolarHBondContact O-N 3.4Å; D197-S201 PolarHBondContact O-OG 3.31Å
198	S	86.8	Confident	86.3	Confident	94 Å²	94	50 Å²	50	66%	0.657	29%	0.29	S	S	*	.	H	α-helix	trans	-63.4	-27.4	178.3	-176.3	0	0	0	0	113.3	T196 S201 K202	T196-S198 PolarHBondContact O-N 3.12Å; S198-S201 VanDerWaalsContact C-OG 3.23Å; S198-S201 WeakPolarHBondContact CA-OG 3.49Å; S198-S201 PolarHBondContact O-OG 2.92Å; S198-K202 WeakPolarHBondContact O-CB 3.4Å; S198-K202 PolarHBondContact O-N 3.17Å
199	S	81.8	Confident	86	Confident	52 Å²	52	49 Å²	49	36%	0.364	28%	0.284	S	S	.	.	H	α-helix	trans	-77.4	-47.1	-179	72.1	0	0	0	0	110.9	D197 K202 M203	D197-S199 PolarHBondContact O-N 3.45Å; D197-S199 WeakPolarHBondContact OD1-CB 3.44Å; D197-S199 PolarHBondContact OD1-N 3.18Å; D197-S199 PolarHBondContact OD1-OG 3.01Å; D197-S199 PolarHBondContact OD2-OG 3.23Å; S199-K202 PolarHBondContact O-N 3.13Å; S199-M203 WeakPolarHBondContact O-CG 3.37Å; S199-M203 PolarHBondContact O-N 3.16Å
200	L	83.7	Confident	85.3	Confident	10 Å²	10	44.2 Å²	44.2	5%	0.052	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-43.8	176.9	-178.4	67.8	0	0	0	111.7	L194 D197 M203 C204 F305 N309 L311	L194-L200 HydrophobicContact CD1-CD2 4.2Å; L194-L200 HydrophobicContact CD1-CG 3.99Å; D197-L200 HydrophobicContact CB-CB 3.9Å; D197-L200 PolarHBondContact OD1-N 3.25Å; D197-L200 WeakPolarHBondContact OD2-CB 3.39Å; L200-M203 PolarHBondContact O-N 2.84Å; L200-C204 VanDerWaalsContact O-CB 3.32Å; L200-C204 WeakPolarHBondContact O-CB 3.18Å; L200-C204 PolarHBondContact O-N 2.8Å; L200-F305 HydrophobicContact CD1-CE1 4.22Å; L200-F305 HydrophobicContact CD1-CZ 3.89Å; L200-N309 HydrophobicContact CD1-CB 4.23Å; L200-L311 HydrophobicContact CD2-CD2 4.17Å
201	S	87.3	Confident	84.3	Confident	16 Å²	16	44.4 Å²	44.4	11%	0.112	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-44.2	177.1	50.6	0	0	0	0	112.6	L194 D197 S198 C204 L205	L194-S201 WeakPolarHBondContact O-CB 3.45Å; D197-S201 WeakPolarHBondContact O-CB 3.04Å; D197-S201 PolarHBondContact O-N 3.4Å; D197-S201 PolarHBondContact O-OG 3.31Å; S198-S201 VanDerWaalsContact C-OG 3.23Å; S198-S201 WeakPolarHBondContact CA-OG 3.49Å; S198-S201 PolarHBondContact O-OG 2.92Å; S201-C204 WeakPolarHBondContact O-CB 3.43Å; S201-C204 PolarHBondContact O-N 3.23Å; S201-L205 WeakPolarHBondContact O-CG 3.18Å; S201-L205 PolarHBondContact O-N 3.4Å
202	K	82.7	Confident	82.8	Confident	86 Å²	86	45.4 Å²	45.4	37%	0.374	26%	0.262	S	S	.	.	H	α-helix	trans	-61.4	-48	175.6	-177.1	-178.3	171.9	-169.8	0	111.7	S198 S199 C204 L205 E206	S198-K202 WeakPolarHBondContact O-CB 3.4Å; S198-K202 PolarHBondContact O-N 3.17Å; S199-K202 PolarHBondContact O-N 3.13Å; K202-C204 VanDerWaalsContact C-N 3.27Å; K202-C204 PolarHBondContact O-N 2.89Å; K202-L205 PolarHBondContact O-N 3.24Å; K202-E206 WeakPolarHBondContact CE-OE1 3.41Å; K202-E206 WeakPolarHBondContact O-CG 3.45Å; K202-E206 PolarHBondContact O-N 2.81Å
203	M	81.6	Confident	80.9	Confident	47 Å²	47	46.5 Å²	46.5	23%	0.232	27%	0.266	C	S	.	.	H	α-helix	trans	-60	-38.4	175.6	-72	-68.5	-145.8	0	0	111.9	I59 S199 L200 E206 T207 F305	I59-M203 HydrophobicContact CG2-CE 3.67Å; I59-M203 HydrophobicContact CG2-SD 4.12Å; S199-M203 WeakPolarHBondContact O-CG 3.37Å; S199-M203 PolarHBondContact O-N 3.16Å; L200-M203 PolarHBondContact O-N 2.84Å; M203-E206 PolarHBondContact O-N 3.19Å; M203-T207 WeakPolarHBondContact O-CB 3.48Å; M203-T207 VanDerWaalsContact O-CG2 3.23Å; M203-T207 WeakPolarHBondContact O-CG2 3.31Å; M203-T207 PolarHBondContact O-N 3.12Å; M203-T207 PolarHBondContact O-OG1 2.76Å; M203-F305 HydrophobicContact CB-CE2 4.1Å; M203-F305 HydrophobicContact CB-CZ 4.25Å
204	C	84.6	Confident	79.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-49.6	176.3	-167.1	0	0	0	0	111.3	L194 L200 S201 K202 E206 T207 V208 I223 F305	L194-C204 HydrophobicContact CD1-CB 3.86Å; L200-C204 VanDerWaalsContact O-CB 3.32Å; L200-C204 WeakPolarHBondContact O-CB 3.18Å; L200-C204 PolarHBondContact O-N 2.8Å; S201-C204 WeakPolarHBondContact O-CB 3.43Å; S201-C204 PolarHBondContact O-N 3.23Å; K202-C204 VanDerWaalsContact C-N 3.27Å; K202-C204 PolarHBondContact O-N 2.89Å; C204-E206 VanDerWaalsContact C-N 3.32Å; C204-E206 PolarHBondContact O-N 3.48Å; C204-T207 PolarHBondContact O-N 2.9Å; C204-T207 PolarHBondContact O-OG1 3.12Å; C204-V208 VanDerWaalsContact O-CB 3.23Å; C204-V208 WeakPolarHBondContact O-CB 3.32Å; C204-V208 WeakPolarHBondContact O-CG2 3.4Å; C204-V208 PolarHBondContact O-N 2.9Å; C204-I223 HydrophobicContact CB-CD1 4.28Å; C204-F305 HydrophobicContact CB-CD1 4Å; C204-F305 HydrophobicContact CB-CE1 3.33Å; C204-F305 HydrophobicContact CB-CE2 4.27Å; C204-F305 HydrophobicContact CB-CZ 3.49Å; C204-F305 VanDerWaalsContact CB-CZ 3.49Å; C204-F305 WeakPolarHBondContact SG-CD1 3.34Å; C204-F305 WeakPolarHBondContact SG-CE1 3.47Å
205	L	85.2	Confident	77.1	Confident	41 Å²	41	58 Å²	58	22%	0.215	31%	0.313	C	S	.	.	H	α-helix	trans	-59.5	-43.6	177.9	-71.6	162.9	0	0	0	111.5	S201 K202 T207 I209 I223 I226	S201-L205 WeakPolarHBondContact O-CG 3.18Å; S201-L205 PolarHBondContact O-N 3.4Å; K202-L205 PolarHBondContact O-N 3.24Å; L205-T207 PolarHBondContact O-N 2.75Å; L205-I209 HydrophobicContact CB-CD1 4.16Å; L205-I209 HydrophobicContact CD2-CD1 3.77Å; L205-I209 WeakPolarHBondContact O-CB 3.36Å; L205-I209 WeakPolarHBondContact O-CD1 3.28Å; L205-I209 WeakPolarHBondContact O-CG1 3.35Å; L205-I209 PolarHBondContact O-N 3.26Å; L205-I209 VanDerWaalsContact O-N 3.12Å; L205-I223 HydrophobicContact CD1-CB 4.45Å; L205-I223 HydrophobicContact CG-CD1 4.31Å; L205-I226 HydrophobicContact CD2-CD1 3.52Å; L205-I226 HydrophobicContact CD2-CG1 4.34Å; L205-I226 HydrophobicContact CG-CD1 4.16Å
206	E	80.7	Confident	74.9	Confident	51 Å²	51	62.1 Å²	62.1	24%	0.238	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-33	-178.5	-73.6	173.1	168.7	0	0	113.6	K202 M203 C204	K202-E206 WeakPolarHBondContact CE-OE1 3.41Å; K202-E206 WeakPolarHBondContact O-CG 3.45Å; K202-E206 PolarHBondContact O-N 2.81Å; M203-E206 PolarHBondContact O-N 3.19Å; C204-E206 VanDerWaalsContact C-N 3.32Å; C204-E206 PolarHBondContact O-N 3.48Å
207	T	80.6	Confident	72.9	Confident	41 Å²	41	65.5 Å²	65.5	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-83.9	-35.5	-179.2	50.9	0	0	0	0	113.1	M203 C204 L205 F305	M203-T207 WeakPolarHBondContact O-CB 3.48Å; M203-T207 VanDerWaalsContact O-CG2 3.23Å; M203-T207 WeakPolarHBondContact O-CG2 3.31Å; M203-T207 PolarHBondContact O-N 3.12Å; M203-T207 PolarHBondContact O-OG1 2.76Å; C204-T207 PolarHBondContact O-N 2.9Å; C204-T207 PolarHBondContact O-OG1 3.12Å; L205-T207 PolarHBondContact O-N 2.75Å; T207-F305 HydrophobicContact CG2-CD2 4.06Å; T207-F305 HydrophobicContact CG2-CE2 4.32Å; T207-F305 WeakPolarHBondContact OG1-CD2 3.26Å
208	V	83.1	Confident	71.2	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-86.1	-36.7	-172.9	174.2	0	0	0	0	112	C204 I226 I297 S298 L302 F305	C204-V208 VanDerWaalsContact O-CB 3.23Å; C204-V208 WeakPolarHBondContact O-CB 3.32Å; C204-V208 WeakPolarHBondContact O-CG2 3.4Å; C204-V208 PolarHBondContact O-N 2.9Å; V208-I226 HydrophobicContact CB-CD1 4.27Å; V208-I226 HydrophobicContact CG1-CD1 4.22Å; V208-I297 HydrophobicContact CG1-CB 4.37Å; V208-I297 HydrophobicContact CG1-CD1 4.43Å; V208-I297 HydrophobicContact CG1-CG1 4.32Å; V208-I297 HydrophobicContact CG1-CG2 3.39Å; V208-S298 PolarHBondContact O-N 3.01Å; V208-S298 VanDerWaalsContact O-N 3.12Å; V208-L302 HydrophobicContact CG1-CB 4.09Å; V208-L302 HydrophobicContact CG1-CD1 3.85Å; V208-L302 HydrophobicContact CG2-CB 4.37Å; V208-L302 HydrophobicContact CG2-CD1 4.05Å; V208-F305 HydrophobicContact CG2-CB 4.41Å
209	I	81.8	Confident	69.8	Low	31 Å²	31	67.5 Å²	67.5	16%	0.159	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-79.8	123.2	-177.8	-60.9	172.2	0	0	0	109.8	L205 F211 L221	L205-I209 HydrophobicContact CB-CD1 4.16Å; L205-I209 HydrophobicContact CD2-CD1 3.77Å; L205-I209 WeakPolarHBondContact O-CB 3.36Å; L205-I209 WeakPolarHBondContact O-CD1 3.28Å; L205-I209 WeakPolarHBondContact O-CG1 3.35Å; L205-I209 PolarHBondContact O-N 3.26Å; L205-I209 VanDerWaalsContact O-N 3.12Å; I209-F211 HydrophobicContact CB-CE2 4.45Å; I209-F211 HydrophobicContact CB-CZ 4.39Å; I209-F211 HydrophobicContact CG2-CD1 4.34Å; I209-F211 HydrophobicContact CG2-CE1 4.15Å; I209-F211 HydrophobicContact CG2-CE2 4.49Å; I209-F211 HydrophobicContact CG2-CZ 4.23Å; I209-F211 PolarHBondContact O-N 2.96Å; I209-L221 HydrophobicContact CD1-CB 3.97Å; I209-L221 HydrophobicContact CD1-CD2 4.04Å; I209-L221 HydrophobicContact CG1-CD2 3.92Å
210	V	74.9	Confident	69.2	Low	22 Å²	22	70.1 Å²	70.1	13%	0.133	35%	0.352	C	S	.	.			trans	-84	98.4	172.3	-177.2	0	0	0	0	108.4	T212 Y269 K296	V210-T212 PolarHBondContact O-N 3.1Å; V210-Y269 HydrophobicContact CG1-CE1 3.8Å; V210-Y269 HydrophobicContact CG1-CE2 4.21Å; V210-K296 HydrophobicContact CB-CB 4.19Å; V210-K296 PolarHBondContact N-O 2.89Å
211	F	66.3	Low	68.8	Low	77 Å²	77	70.1 Å²	70.1	34%	0.338	35%	0.352	S	S	.	.			trans	-68	117	173	-62.4	-78.8	0	0	0	109.7	W51 K58 I209	W51-F211 WeakPolarHBondContact CH2-O 3.38Å; K58-F211 HydrophobicContact CD-CE2 4.4Å; I209-F211 HydrophobicContact CB-CE2 4.45Å; I209-F211 HydrophobicContact CB-CZ 4.39Å; I209-F211 HydrophobicContact CG2-CD1 4.34Å; I209-F211 HydrophobicContact CG2-CE1 4.15Å; I209-F211 HydrophobicContact CG2-CE2 4.49Å; I209-F211 HydrophobicContact CG2-CZ 4.23Å; I209-F211 PolarHBondContact O-N 2.96Å
212	T	58.2	Low	68.8	Low	35 Å²	35	71.9 Å²	71.9	22%	0.215	36%	0.363	C	S	.	.			trans	-89.9	144.1	163.3	59.3	0	0	0	0	108.6	V210 N214 K296	V210-T212 PolarHBondContact O-N 3.1Å; T212-N214 CarbonylContact O-C 3.55Å; T212-N214 PolarHBondContact O-N 2.78Å; T212-K296 HydrophobicContact CG2-CD 3.83Å
213	S	52.6	Low	69.1	Low	80 Å²	80	69 Å²	69	56%	0.559	35%	0.352	S	S	*	.	S	Bend	trans	-49.1	-19.3	-177.7	-55.1	0	0	0	0	115.4	W51 R215	W51-S213 WeakPolarHBondContact CZ2-OG 3.42Å; S213-R215 VanDerWaalsContact C-N 3.28Å; S213-R215 PolarHBondContact O-N 3.34Å
214	N	50.2	Low	69.5	Low	115 Å²	115	72.4 Å²	72.4	62%	0.615	37%	0.367	S	S	*	.			trans	-72.8	79	170.5	-68.3	-10.8	0	0	0	111.3	T212 H216	T212-N214 CarbonylContact O-C 3.55Å; T212-N214 PolarHBondContact O-N 2.78Å; N214-H216 PolarHBondContact O-N 3.45Å; N214-H216 VanDerWaalsContact O-N 3.17Å
215	R	47.7	Very low	69.8	Low	178 Å²	178	75.2 Å²	75.2	67%	0.672	38%	0.382	S	S	*	.			trans	-68.5	-2.1	172.9	-63.5	-165	-179	-178.5	4.3	113.9	E54 S213 K217	E54-R215 IonicContact OE1-NH2 3.47Å; S213-R215 VanDerWaalsContact C-N 3.28Å; S213-R215 PolarHBondContact O-N 3.34Å; R215-K217 PolarHBondContact O-N 2.96Å
216	H	45.2	Very low	70	Confident	154 Å²	154	73.3 Å²	73.3	71%	0.713	37%	0.372	S	S	*	.	S	Bend	trans	-84.5	104.6	-175.8	-59.8	-71.9	0	0	0	110.6	N214 L218	N214-H216 PolarHBondContact O-N 3.45Å; N214-H216 VanDerWaalsContact O-N 3.17Å; H216-L218 PolarHBondContact O-N 3.22Å
217	K	47.4	Very low	70.6	Confident	188 Å²	188	73.2 Å²	73.2	82%	0.817	37%	0.371	S	S	*	.	S	Bend	trans	61.5	39.9	167.5	-60.4	-177.6	179.2	179.1	0	116.7	R215	R215-K217 PolarHBondContact O-N 2.96Å
218	L	52.2	Low	71.2	Confident	61 Å²	61	76.9 Å²	76.9	32%	0.319	38%	0.38	S	S	.	.			trans	-66.7	133.9	157.6	-72.2	162.2	0	0	0	108.2	H216 S220 H293	H216-L218 PolarHBondContact O-N 3.22Å; L218-S220 PolarHBondContact O-N 3.24Å; L218-S220 VanDerWaalsContact O-N 3.13Å; L218-H293 HydrophobicContact CD2-CB 4.16Å
219	Q	59.1	Low	71.6	Confident	133 Å²	133	76.9 Å²	76.9	62%	0.621	38%	0.38	S	S	*	.			trans	-54.2	122.2	166.7	-174.3	160.4	-1.3	0	0	106.8	L221 C295	Q219-L221 PolarHBondContact O-N 3.48Å; Q219-L221 VanDerWaalsContact O-N 3.08Å; Q219-C295 PolarHBondContact O-SG 2.85Å
220	S	67.3	Low	72.1	Confident	107 Å²	107	75.4 Å²	75.4	75%	0.748	37%	0.372	S	S	*	.			trans	-70.7	109.4	179.8	-174.5	0	0	0	0	107.1	L218 C222	L218-S220 PolarHBondContact O-N 3.24Å; L218-S220 VanDerWaalsContact O-N 3.13Å; S220-C222 PolarHBondContact O-N 3.08Å
221	L	77.2	Confident	72.9	Confident	10 Å²	10	77.2 Å²	77.2	5%	0.052	38%	0.383	C	S	.	.			trans	-58.9	128.7	168.7	-170.4	79.4	0	0	0	107.7	I209 Q219 D225 I226 I251 C295 I297	I209-L221 HydrophobicContact CD1-CB 3.97Å; I209-L221 HydrophobicContact CD1-CD2 4.04Å; I209-L221 HydrophobicContact CG1-CD2 3.92Å; Q219-L221 PolarHBondContact O-N 3.48Å; Q219-L221 VanDerWaalsContact O-N 3.08Å; L221-D225 HydrophobicContact CD1-CB 3.44Å; L221-D225 VanDerWaalsContact CD1-CB 3.44Å; L221-D225 HydrophobicContact CG-CB 3.95Å; L221-I226 HydrophobicContact CD2-CD1 3.86Å; L221-I226 HydrophobicContact CD2-CG1 3.53Å; L221-I226 HydrophobicContact CG-CG1 4.31Å; L221-I251 HydrophobicContact CD1-CD1 3.71Å; L221-I251 HydrophobicContact CD1-CG1 3.98Å; L221-C295 HydrophobicContact CB-CB 4.41Å; L221-C295 HydrophobicContact CD1-CB 4.43Å; L221-I297 HydrophobicContact CD1-CD1 4.26Å; L221-I297 HydrophobicContact CD2-CD1 3.37Å; L221-I297 HydrophobicContact CD2-CG1 4.02Å; L221-I297 HydrophobicContact CG-CD1 4.48Å
222	C	85.5	Confident	74	Confident	53 Å²	53	74.4 Å²	74.4	36%	0.358	37%	0.372	S	S	.	.			trans	-94.8	163.3	176.3	73.1	0	0	0	0	110.6	S220 H224 D225 I226	S220-C222 PolarHBondContact O-N 3.08Å; C222-H224 PolarHBondContact O-N 2.86Å; C222-D225 PolarHBondContact N-OD2 2.92Å; C222-D225 WeakPolarHBondContact O-CB 3.32Å; C222-D225 PolarHBondContact O-N 3.38Å; C222-D225 VanDerWaalsContact O-N 3.09Å; C222-D225 PolarHBondContact SG-OD2 3.42Å; C222-I226 PolarHBondContact O-N 2.99Å
223	I	89.6	Confident	75.5	Confident	26 Å²	26	72.9 Å²	72.9	13%	0.133	36%	0.362	C	S	.	.	H	α-helix	trans	-61.7	-30.2	178.8	-168.6	62.9	0	0	0	112.3	L194 L195 C204 L205 D225 I226 F227	L194-I223 HydrophobicContact CD1-CD1 3.93Å; L194-I223 HydrophobicContact CD2-CD1 4.05Å; L194-I223 HydrophobicContact CG-CD1 3.78Å; L194-I223 HydrophobicContact CG-CG1 4.06Å; L195-I223 HydrophobicContact CD2-CG2 4.41Å; C204-I223 HydrophobicContact CB-CD1 4.28Å; L205-I223 HydrophobicContact CD1-CB 4.45Å; L205-I223 HydrophobicContact CG-CD1 4.31Å; I223-D225 VanDerWaalsContact C-N 3.27Å; I223-D225 PolarHBondContact O-N 3.23Å; I223-I226 HydrophobicContact CD1-CB 4.4Å; I223-I226 PolarHBondContact O-N 2.91Å; I223-F227 WeakPolarHBondContact O-CB 3.27Å; I223-F227 PolarHBondContact O-N 3.15Å
224	H	91.1	Very high	77.3	Confident	118 Å²	118	70.4 Å²	70.4	55%	0.546	35%	0.345	S	S	.	.	H	α-helix	trans	-63.6	-33.1	176.4	-62.3	-73.3	0	0	0	112.4	C222 F227 R228	C222-H224 PolarHBondContact O-N 2.86Å; H224-F227 PolarHBondContact O-N 3.47Å; H224-R228 WeakPolarHBondContact O-CB 3.15Å; H224-R228 PolarHBondContact O-N 3.36Å
225	D	89.5	Confident	78.8	Confident	59 Å²	59	68.1 Å²	68.1	32%	0.316	35%	0.348	S	S	.	.	H	α-helix	trans	-66.4	-43.8	175.1	-59.2	-44.7	0	0	0	110.7	L221 C222 I223 R228 L229 I251	L221-D225 HydrophobicContact CD1-CB 3.44Å; L221-D225 VanDerWaalsContact CD1-CB 3.44Å; L221-D225 HydrophobicContact CG-CB 3.95Å; C222-D225 PolarHBondContact N-OD2 2.92Å; C222-D225 WeakPolarHBondContact O-CB 3.32Å; C222-D225 PolarHBondContact O-N 3.38Å; C222-D225 VanDerWaalsContact O-N 3.09Å; C222-D225 PolarHBondContact SG-OD2 3.42Å; I223-D225 VanDerWaalsContact C-N 3.27Å; I223-D225 PolarHBondContact O-N 3.23Å; D225-R228 WeakPolarHBondContact O-CB 3.37Å; D225-R228 PolarHBondContact O-N 3.17Å; D225-L229 WeakPolarHBondContact O-CG 3.14Å; D225-L229 PolarHBondContact O-N 3.13Å; D225-I251 HydrophobicContact CB-CD1 4.48Å
226	I	90.6	Very high	80.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-42.1	175.4	-64	-174.7	0	0	0	111.1	L194 L205 V208 L221 C222 I223 R228 L229 Y230 L302	L194-I226 HydrophobicContact CD2-CG2 4.36Å; L205-I226 HydrophobicContact CD2-CD1 3.52Å; L205-I226 HydrophobicContact CD2-CG1 4.34Å; L205-I226 HydrophobicContact CG-CD1 4.16Å; V208-I226 HydrophobicContact CB-CD1 4.27Å; V208-I226 HydrophobicContact CG1-CD1 4.22Å; L221-I226 HydrophobicContact CD2-CD1 3.86Å; L221-I226 HydrophobicContact CD2-CG1 3.53Å; L221-I226 HydrophobicContact CG-CG1 4.31Å; C222-I226 PolarHBondContact O-N 2.99Å; I223-I226 HydrophobicContact CD1-CB 4.4Å; I223-I226 PolarHBondContact O-N 2.91Å; I226-R228 VanDerWaalsContact C-N 3.31Å; I226-R228 PolarHBondContact O-N 2.6Å; I226-L229 WeakPolarHBondContact O-CB 3.45Å; I226-L229 PolarHBondContact O-N 3.12Å; I226-L229 VanDerWaalsContact O-N 3.14Å; I226-Y230 HydrophobicContact CG2-CD2 3.85Å; I226-Y230 HydrophobicContact CG2-CE2 3.5Å; I226-Y230 VanDerWaalsContact O-CD2 3.3Å; I226-Y230 WeakPolarHBondContact O-CD2 3.39Å; I226-Y230 PolarHBondContact O-N 3.23Å; I226-L302 HydrophobicContact CG2-CD1 3.86Å
227	F	93.2	Very high	82	Confident	50 Å²	50	57.7 Å²	57.7	22%	0.219	32%	0.32	C	S	.	.	H	α-helix	trans	-59.3	-45.4	175.2	-179	-95	0	0	0	110.9	L191 L195 I223 H224 L229 Y230 T231	L191-F227 HydrophobicContact CD1-CD2 4.38Å; L191-F227 HydrophobicContact CD1-CE2 4.49Å; L191-F227 HydrophobicContact CG-CD2 4.32Å; L191-F227 HydrophobicContact CG-CE2 3.94Å; L195-F227 HydrophobicContact CD1-CD1 3.99Å; L195-F227 HydrophobicContact CD1-CD2 3.95Å; L195-F227 HydrophobicContact CD1-CE1 3.98Å; L195-F227 HydrophobicContact CD1-CE2 3.94Å; L195-F227 HydrophobicContact CD1-CG 3.97Å; L195-F227 HydrophobicContact CD1-CZ 3.96Å; L195-F227 HydrophobicContact CD2-CB 3.75Å; L195-F227 HydrophobicContact CD2-CD1 4.43Å; L195-F227 HydrophobicContact CD2-CD2 4.06Å; L195-F227 HydrophobicContact CD2-CG 3.82Å; L195-F227 HydrophobicContact CG-CB 4.41Å; L195-F227 HydrophobicContact CG-CD1 4.48Å; L195-F227 HydrophobicContact CG-CD2 3.76Å; L195-F227 HydrophobicContact CG-CE2 4.11Å; L195-F227 HydrophobicContact CG-CG 3.96Å; I223-F227 WeakPolarHBondContact O-CB 3.27Å; I223-F227 PolarHBondContact O-N 3.15Å; H224-F227 PolarHBondContact O-N 3.47Å; F227-L229 VanDerWaalsContact C-N 3.29Å; F227-L229 PolarHBondContact O-N 3.04Å; F227-Y230 PolarHBondContact O-N 3.47Å; F227-Y230 VanDerWaalsContact O-N 3.11Å; F227-T231 HydrophobicContact CD1-CG2 3.98Å; F227-T231 HydrophobicContact CE1-CG2 3.59Å; F227-T231 HydrophobicContact CZ-CG2 3.97Å; F227-T231 WeakPolarHBondContact O-CG2 3.09Å; F227-T231 PolarHBondContact O-N 3.28Å
228	R	91.8	Very high	83.6	Confident	118 Å²	118	50.4 Å²	50.4	45%	0.445	29%	0.29	S	S	.	.	H	α-helix	trans	-58.2	-41.6	174	-174.8	175.7	179.8	-111.8	1.6	111.6	H224 D225 I226 Y230 T231 I232 A247 N248	H224-R228 WeakPolarHBondContact O-CB 3.15Å; H224-R228 PolarHBondContact O-N 3.36Å; D225-R228 WeakPolarHBondContact O-CB 3.37Å; D225-R228 PolarHBondContact O-N 3.17Å; I226-R228 VanDerWaalsContact C-N 3.31Å; I226-R228 PolarHBondContact O-N 2.6Å; R228-Y230 PolarHBondContact O-N 2.74Å; R228-T231 WeakPolarHBondContact CA-OG1 3.18Å; R228-T231 PolarHBondContact O-N 2.93Å; R228-T231 PolarHBondContact O-OG1 3.44Å; R228-I232 HydrophobicContact CG-CD1 4.02Å; R228-I232 WeakPolarHBondContact O-CG1 3.42Å; R228-I232 PolarHBondContact O-N 2.77Å; R228-A247 PolarHBondContact NH1-O 2.8Å; R228-A247 PolarHBondContact NH2-O 2.9Å; R228-A247 VanDerWaalsContact NH2-O 3.12Å; R228-N248 PolarHBondContact NH1-OD1 3.48Å
229	L	92	Very high	85	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-57.9	-46.2	173.8	-71.8	175	0	0	0	112.3	D225 I226 F227 I232 L233 L244 N248 I251 F253 I297 L302	D225-L229 WeakPolarHBondContact O-CG 3.14Å; D225-L229 PolarHBondContact O-N 3.13Å; I226-L229 WeakPolarHBondContact O-CB 3.45Å; I226-L229 PolarHBondContact O-N 3.12Å; I226-L229 VanDerWaalsContact O-N 3.14Å; F227-L229 VanDerWaalsContact C-N 3.29Å; F227-L229 PolarHBondContact O-N 3.04Å; L229-I232 PolarHBondContact O-N 2.84Å; L229-L233 WeakPolarHBondContact O-CB 3.48Å; L229-L233 PolarHBondContact O-N 3.27Å; L229-L244 HydrophobicContact CD2-CD2 4.02Å; L229-N248 HydrophobicContact CD2-CB 4.13Å; L229-N248 VanDerWaalsContact CD2-ND2 3.35Å; L229-N248 WeakPolarHBondContact CD2-ND2 3.29Å; L229-I251 HydrophobicContact CD1-CD1 3.76Å; L229-I251 HydrophobicContact CD2-CD1 4.16Å; L229-I251 HydrophobicContact CG-CD1 4.07Å; L229-F253 HydrophobicContact CD1-CE1 4.34Å; L229-F253 HydrophobicContact CD1-CZ 4.3Å; L229-F253 HydrophobicContact CD2-CE1 4.32Å; L229-F253 HydrophobicContact CD2-CZ 3.66Å; L229-I297 HydrophobicContact CD1-CD1 3.65Å; L229-L302 HydrophobicContact CB-CD2 4.26Å; L229-L302 HydrophobicContact CD1-CD2 4.3Å
230	Y	93.8	Very high	86	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-39.8	175.3	-74.3	-62.3	0	0	0	112.6	L191 L194 I226 F227 R228 I232 L233 C234 L302 G306 L311 I312	L191-Y230 HydrophobicContact CD1-CD1 4.49Å; L191-Y230 HydrophobicContact CD1-CD2 3.76Å; L191-Y230 HydrophobicContact CD1-CG 3.71Å; L194-Y230 HydrophobicContact CD2-CD2 3.86Å; L194-Y230 HydrophobicContact CD2-CE2 3.83Å; I226-Y230 HydrophobicContact CG2-CD2 3.85Å; I226-Y230 HydrophobicContact CG2-CE2 3.5Å; I226-Y230 VanDerWaalsContact O-CD2 3.3Å; I226-Y230 WeakPolarHBondContact O-CD2 3.39Å; I226-Y230 PolarHBondContact O-N 3.23Å; F227-Y230 PolarHBondContact O-N 3.47Å; F227-Y230 VanDerWaalsContact O-N 3.11Å; R228-Y230 PolarHBondContact O-N 2.74Å; Y230-I232 VanDerWaalsContact C-N 3.31Å; Y230-I232 PolarHBondContact O-N 3.2Å; Y230-L233 HydrophobicContact CD1-CD2 4.28Å; Y230-L233 WeakPolarHBondContact O-CB 3.21Å; Y230-L233 PolarHBondContact O-N 2.76Å; Y230-C234 WeakPolarHBondContact O-CB 3.21Å; Y230-C234 PolarHBondContact O-N 3Å; Y230-C234 PolarHBondContact O-SG 3.38Å; Y230-L302 HydrophobicContact CE1-CD1 3.93Å; Y230-L302 HydrophobicContact CE1-CG 4.09Å; Y230-L302 HydrophobicContact CE2-CD1 3.87Å; Y230-L302 PolarHBondContact OH-O 2.99Å; Y230-G306 PolarHBondContact OH-N 3.05Å; Y230-L311 HydrophobicContact CE2-CD1 4.3Å; Y230-I312 HydrophobicContact CD1-CD1 4.18Å; Y230-I312 HydrophobicContact CD1-CG2 3.73Å; Y230-I312 HydrophobicContact CE1-CD1 3.97Å; Y230-I312 HydrophobicContact CE1-CG2 4.24Å
231	T	91.1	Very high	86.6	Confident	59 Å²	59	38.8 Å²	38.8	36%	0.362	23%	0.227	S	C	.	.	H	α-helix	trans	-63.9	-36.2	177.3	61.8	0	0	0	0	112.5	F227 R228 G235	F227-T231 HydrophobicContact CD1-CG2 3.98Å; F227-T231 HydrophobicContact CE1-CG2 3.59Å; F227-T231 HydrophobicContact CZ-CG2 3.97Å; F227-T231 WeakPolarHBondContact O-CG2 3.09Å; F227-T231 PolarHBondContact O-N 3.28Å; R228-T231 WeakPolarHBondContact CA-OG1 3.18Å; R228-T231 PolarHBondContact O-N 2.93Å; R228-T231 PolarHBondContact O-OG1 3.44Å; T231-G235 WeakPolarHBondContact O-CA 3.34Å; T231-G235 PolarHBondContact O-N 2.96Å
232	I	89.8	Confident	86.7	Confident	19 Å²	19	40.2 Å²	40.2	10%	0.097	24%	0.238	C	C	.	.	H	α-helix	trans	-69.8	-42.4	174.6	-70.3	162.9	0	0	0	110.3	R228 L229 Y230 C234 G235 Y243 L244 A247 N248	R228-I232 HydrophobicContact CG-CD1 4.02Å; R228-I232 WeakPolarHBondContact O-CG1 3.42Å; R228-I232 PolarHBondContact O-N 2.77Å; L229-I232 PolarHBondContact O-N 2.84Å; Y230-I232 VanDerWaalsContact C-N 3.31Å; Y230-I232 PolarHBondContact O-N 3.2Å; I232-C234 PolarHBondContact O-N 3.2Å; I232-G235 PolarHBondContact O-N 3.4Å; I232-Y243 HydrophobicContact CG2-CD1 3.78Å; I232-Y243 HydrophobicContact CG2-CE1 3.74Å; I232-L244 HydrophobicContact CG2-CB 4.42Å; I232-L244 HydrophobicContact CG2-CG 4.33Å; I232-A247 HydrophobicContact CD1-CB 3.68Å; I232-N248 VanDerWaalsContact CD1-ND2 3.29Å; I232-N248 WeakPolarHBondContact CD1-ND2 3.23Å
233	L	89.2	Confident	86.5	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.016	25%	0.246	C	C	.	.	H	α-helix	trans	-59.5	-36.2	177.1	-167.3	72.5	0	0	0	112.4	W185 L229 Y230 F239 L244 V303 I312	W185-L233 HydrophobicContact CB-CD2 4.38Å; W185-L233 HydrophobicContact CB-CG 4.31Å; W185-L233 HydrophobicContact CD2-CD1 4.11Å; W185-L233 HydrophobicContact CD2-CD2 3.88Å; W185-L233 HydrophobicContact CD2-CG 3.83Å; W185-L233 HydrophobicContact CE3-CD1 3.29Å; W185-L233 HydrophobicContact CE3-CD2 3.91Å; W185-L233 HydrophobicContact CE3-CG 3.35Å; W185-L233 HydrophobicContact CG-CD2 4.09Å; W185-L233 HydrophobicContact CG-CG 4.25Å; W185-L233 HydrophobicContact CH2-CD1 4.03Å; W185-L233 HydrophobicContact CZ3-CD1 3.22Å; W185-L233 HydrophobicContact CZ3-CD2 4.43Å; W185-L233 HydrophobicContact CZ3-CG 3.87Å; L229-L233 WeakPolarHBondContact O-CB 3.48Å; L229-L233 PolarHBondContact O-N 3.27Å; Y230-L233 HydrophobicContact CD1-CD2 4.28Å; Y230-L233 WeakPolarHBondContact O-CB 3.21Å; Y230-L233 PolarHBondContact O-N 2.76Å; L233-F239 HydrophobicContact CD1-CD2 3.87Å; L233-F239 HydrophobicContact CD1-CE2 3.94Å; L233-L244 HydrophobicContact CD1-CD1 3.84Å; L233-V303 HydrophobicContact CD2-CG2 4.33Å; L233-I312 HydrophobicContact CD2-CD1 3.63Å
234	C	89.5	Confident	86.3	Confident	28 Å²	28	43 Å²	43	19%	0.189	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-3.4	-178.6	-54.4	0	0	0	0	114	W185 G187 Y230 I232 S236 I312	W185-C234 VanDerWaalsContact O-CA 3.27Å; W185-C234 WeakPolarHBondContact O-CA 3.48Å; G187-C234 PolarHBondContact N-SG 3.44Å; G187-C234 VanDerWaalsContact N-SG 3.44Å; Y230-C234 WeakPolarHBondContact O-CB 3.21Å; Y230-C234 PolarHBondContact O-N 3Å; Y230-C234 PolarHBondContact O-SG 3.38Å; I232-C234 PolarHBondContact O-N 3.2Å; C234-S236 VanDerWaalsContact C-N 3.28Å; C234-S236 PolarHBondContact O-N 3.09Å; C234-I312 WeakPolarHBondContact SG-CG2 3.37Å
235	G	83.1	Confident	85.9	Confident	67 Å²	67	38.7 Å²	38.7	69%	0.691	22%	0.221	S	C	*	.	S	Bend	trans	-74.8	-18.7	-172.9	0	0	0	0	0	113.6	T231 I232	T231-G235 WeakPolarHBondContact O-CA 3.34Å; T231-G235 PolarHBondContact O-N 2.96Å; I232-G235 PolarHBondContact O-N 3.4Å
236	S	81.9	Confident	85.5	Confident	51 Å²	51	39.4 Å²	39.4	36%	0.357	23%	0.23	S	C	.	.	S	Bend	trans	-131.8	150.8	177.7	51.6	0	0	0	0	111.1	C234 N238	C234-S236 VanDerWaalsContact C-N 3.28Å; C234-S236 PolarHBondContact O-N 3.09Å; S236-N238 PolarHBondContact O-N 3.12Å; S236-N238 PolarHBondContact OG-O 3.49Å
237	S	77.5	Confident	85.2	Confident	61 Å²	61	40.4 Å²	40.4	43%	0.427	24%	0.238	S	C	.	.	S	Bend	trans	-61.8	-22.3	173.3	61.8	0	0	0	0	112.7	G184 W543	G184-S237 WeakPolarHBondContact CA-O 2.92Å; G184-S237 PolarHBondContact N-O 3.33Å; S237-W543 WeakPolarHBondContact O-CZ3 3.45Å
238	N	80.1	Confident	84.6	Confident	35 Å²	35	38.3 Å²	38.3	19%	0.187	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	136.6	-176.3	-54.7	-20	0	0	0	109.5	L181 I182 S236 W543	L181-N238 HydrophobicContact CB-CB 4.49Å; L181-N238 HydrophobicContact CD2-CB 4.14Å; I182-N238 CarbonylContact O-C 3.56Å; I182-N238 WeakPolarHBondContact O-CA 3.44Å; S236-N238 PolarHBondContact O-N 3.12Å; S236-N238 PolarHBondContact OG-O 3.49Å; N238-W543 WeakPolarHBondContact OD1-CH2 3.47Å; N238-W543 WeakPolarHBondContact OD1-CZ3 3.38Å
239	F	82	Confident	84	Confident	8 Å²	8	35.9 Å²	35.9	4%	0.035	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	125.1	172.1	170.6	-121.8	0	0	0	111	L170 I182 W185 L233 L241 L244 L299	L170-F239 HydrophobicContact CD1-CE1 4.35Å; L170-F239 HydrophobicContact CD2-CE1 4.32Å; I182-F239 HydrophobicContact CB-CB 4.02Å; I182-F239 HydrophobicContact CB-CD1 4.03Å; I182-F239 HydrophobicContact CD1-CD1 3.63Å; I182-F239 HydrophobicContact CD1-CE1 4.07Å; I182-F239 HydrophobicContact CG1-CD1 4.42Å; I182-F239 HydrophobicContact CG2-CB 4.1Å; I182-F239 HydrophobicContact CG2-CD1 4.03Å; I182-F239 PolarHBondContact O-N 3.24Å; W185-F239 HydrophobicContact CE3-CB 4.23Å; W185-F239 HydrophobicContact CE3-CD2 4.43Å; W185-F239 HydrophobicContact CE3-CG 4.48Å; W185-F239 HydrophobicContact CH2-CB 4.26Å; W185-F239 HydrophobicContact CH2-CD1 4.13Å; W185-F239 HydrophobicContact CH2-CD2 4.17Å; W185-F239 AromaticContact CH2-CG 3.94Å; W185-F239 HydrophobicContact CH2-CG 3.94Å; W185-F239 HydrophobicContact CZ3-CB 3.49Å; W185-F239 VanDerWaalsContact CZ3-CB 3.49Å; W185-F239 HydrophobicContact CZ3-CD1 4.07Å; W185-F239 AromaticContact CZ3-CD2 3.46Å; W185-F239 HydrophobicContact CZ3-CD2 3.46Å; W185-F239 VanDerWaalsContact CZ3-CD2 3.46Å; W185-F239 HydrophobicContact CZ3-CE2 4.12Å; W185-F239 AromaticContact CZ3-CG 3.4Å; W185-F239 HydrophobicContact CZ3-CG 3.4Å; W185-F239 VanDerWaalsContact CZ3-CG 3.4Å; L233-F239 HydrophobicContact CD1-CD2 3.87Å; L233-F239 HydrophobicContact CD1-CE2 3.94Å; F239-L241 HydrophobicContact CE1-CB 4.23Å; F239-L241 HydrophobicContact CZ-CB 3.89Å; F239-L241 HydrophobicContact CZ-CD1 3.87Å; F239-L244 HydrophobicContact CE2-CD1 3.83Å; F239-L299 HydrophobicContact CZ-CD2 4.03Å
240	S	80.8	Confident	83.3	Confident	40 Å²	40	41.9 Å²	41.9	28%	0.28	26%	0.257	S	S	.	.			trans	-121.8	109.7	168.7	175.8	0	0	0	0	109.6	S242 Y243 L244	S240-S242 PolarHBondContact O-N 2.86Å; S240-Y243 PolarHBondContact O-N 2.65Å; S240-Y243 PolarHBondContact OG-N 3.1Å; S240-L244 PolarHBondContact O-N 3.43Å
241	L	80.5	Confident	82.7	Confident	10 Å²	10	42.7 Å²	42.7	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-59.7	-40.3	172.2	-174.8	81.1	0	0	0	111.1	L170 F176 F239 Y243 L244 I245 L272 L299	L170-L241 HydrophobicContact CD1-CD1 4.41Å; L170-L241 HydrophobicContact CD2-CB 3.6Å; L170-L241 HydrophobicContact CD2-CD1 3.68Å; L170-L241 HydrophobicContact CD2-CD2 3.27Å; L170-L241 HydrophobicContact CD2-CG 3.63Å; F176-L241 HydrophobicContact CE1-CD2 3.78Å; F239-L241 HydrophobicContact CE1-CB 4.23Å; F239-L241 HydrophobicContact CZ-CB 3.89Å; F239-L241 HydrophobicContact CZ-CD1 3.87Å; L241-Y243 VanDerWaalsContact C-N 3.27Å; L241-Y243 PolarHBondContact O-N 3.27Å; L241-L244 PolarHBondContact O-N 3Å; L241-L244 VanDerWaalsContact O-N 3.12Å; L241-I245 HydrophobicContact CD1-CD1 4.25Å; L241-I245 HydrophobicContact CD1-CG1 4.42Å; L241-I245 HydrophobicContact CD2-CD1 3.56Å; L241-I245 HydrophobicContact CG-CD1 3.62Å; L241-I245 HydrophobicContact CG-CG1 4.09Å; L241-I245 WeakPolarHBondContact O-CG1 3.49Å; L241-I245 PolarHBondContact O-N 2.98Å; L241-L272 HydrophobicContact CD1-CD1 3.7Å; L241-L272 HydrophobicContact CD2-CB 4.45Å; L241-L272 HydrophobicContact CD2-CD1 4.06Å; L241-L272 HydrophobicContact CG-CD1 4.49Å; L241-L299 HydrophobicContact CD1-CD2 3.86Å
242	S	78.9	Confident	82.2	Confident	40 Å²	40	45 Å²	45	28%	0.28	26%	0.263	S	S	.	.	H	α-helix	trans	-57.8	-43.7	179.9	-55.7	0	0	0	0	111.3	S240 S246	S240-S242 PolarHBondContact O-N 2.86Å; S242-S246 VanDerWaalsContact O-CB 3.3Å; S242-S246 WeakPolarHBondContact O-CB 3.33Å; S242-S246 PolarHBondContact O-N 2.93Å; S242-S246 PolarHBondContact O-OG 3.25Å
243	Y	81	Confident	81.8	Confident	136 Å²	136	44.4 Å²	44.4	53%	0.533	26%	0.259	S	S	.	.	H	α-helix	trans	-64.3	-47.7	174.6	-176.4	-115	0	0	0	111.2	I232 S240 L241 I245 S246 A247	I232-Y243 HydrophobicContact CG2-CD1 3.78Å; I232-Y243 HydrophobicContact CG2-CE1 3.74Å; S240-Y243 PolarHBondContact O-N 2.65Å; S240-Y243 PolarHBondContact OG-N 3.1Å; L241-Y243 VanDerWaalsContact C-N 3.27Å; L241-Y243 PolarHBondContact O-N 3.27Å; Y243-I245 VanDerWaalsContact C-N 3.34Å; Y243-I245 PolarHBondContact O-N 3.32Å; Y243-S246 WeakPolarHBondContact CA-OG 3.32Å; Y243-S246 PolarHBondContact O-N 2.65Å; Y243-S246 VanDerWaalsContact O-N 3.17Å; Y243-S246 PolarHBondContact O-OG 2.77Å; Y243-A247 WeakPolarHBondContact O-CB 3.42Å; Y243-A247 PolarHBondContact O-N 3.16Å
244	L	84.2	Confident	81.2	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-59.3	-41.9	-178.9	-164.1	156.6	0	0	0	112.7	L229 I232 L233 F239 S240 L241 N248 F253	L229-L244 HydrophobicContact CD2-CD2 4.02Å; I232-L244 HydrophobicContact CG2-CB 4.42Å; I232-L244 HydrophobicContact CG2-CG 4.33Å; L233-L244 HydrophobicContact CD1-CD1 3.84Å; F239-L244 HydrophobicContact CE2-CD1 3.83Å; S240-L244 PolarHBondContact O-N 3.43Å; L241-L244 PolarHBondContact O-N 3Å; L241-L244 VanDerWaalsContact O-N 3.12Å; L244-N248 PolarHBondContact O-N 3.07Å; L244-N248 PolarHBondContact O-ND2 3.2Å; L244-F253 HydrophobicContact CD2-CD1 4.31Å; L244-F253 HydrophobicContact CD2-CD2 3.97Å; L244-F253 HydrophobicContact CD2-CE1 3.57Å; L244-F253 HydrophobicContact CD2-CE2 3.18Å; L244-F253 HydrophobicContact CD2-CG 4.49Å; L244-F253 HydrophobicContact CD2-CZ 2.97Å; L244-F253 HydrophobicContact CG-CZ 4.43Å
245	I	82.7	Confident	80.2	Confident	27 Å²	27	43.7 Å²	43.7	14%	0.138	25%	0.254	C	S	.	.	H	α-helix	trans	-66.8	-48.2	174.4	-68.2	172.5	0	0	0	110.8	L241 Y243 A247 N248 F253 V275	L241-I245 HydrophobicContact CD1-CD1 4.25Å; L241-I245 HydrophobicContact CD1-CG1 4.42Å; L241-I245 HydrophobicContact CD2-CD1 3.56Å; L241-I245 HydrophobicContact CG-CD1 3.62Å; L241-I245 HydrophobicContact CG-CG1 4.09Å; L241-I245 WeakPolarHBondContact O-CG1 3.49Å; L241-I245 PolarHBondContact O-N 2.98Å; Y243-I245 VanDerWaalsContact C-N 3.34Å; Y243-I245 PolarHBondContact O-N 3.32Å; I245-A247 VanDerWaalsContact C-N 3.27Å; I245-A247 PolarHBondContact O-N 3.17Å; I245-N248 CarbonylContact O-C 3.36Å; I245-N248 PolarHBondContact O-N 2.8Å; I245-F253 HydrophobicContact CG1-CD2 3.93Å; I245-F253 HydrophobicContact CG1-CE2 4.37Å; I245-V275 HydrophobicContact CD1-CG2 4.37Å
246	S	81.8	Confident	78.7	Confident	74 Å²	74	42 Å²	42	52%	0.517	23%	0.231	S	C	.	.	H	α-helix	trans	-61.6	-35.6	-178.6	70.9	0	0	0	0	113	S242 Y243 N248	S242-S246 VanDerWaalsContact O-CB 3.3Å; S242-S246 WeakPolarHBondContact O-CB 3.33Å; S242-S246 PolarHBondContact O-N 2.93Å; S242-S246 PolarHBondContact O-OG 3.25Å; Y243-S246 WeakPolarHBondContact CA-OG 3.32Å; Y243-S246 PolarHBondContact O-N 2.65Å; Y243-S246 VanDerWaalsContact O-N 3.17Å; Y243-S246 PolarHBondContact O-OG 2.77Å; S246-N248 VanDerWaalsContact C-N 3.31Å; S246-N248 PolarHBondContact O-N 2.73Å
247	A	83.4	Confident	77.1	Confident	20 Å²	20	41.9 Å²	41.9	17%	0.165	23%	0.23	C	C	.	.	H	α-helix	trans	-75.4	-20.2	-179.5	0	0	0	0	0	113	R228 I232 Y243 I245	R228-A247 PolarHBondContact NH1-O 2.8Å; R228-A247 PolarHBondContact NH2-O 2.9Å; R228-A247 VanDerWaalsContact NH2-O 3.12Å; I232-A247 HydrophobicContact CD1-CB 3.68Å; Y243-A247 WeakPolarHBondContact O-CB 3.42Å; Y243-A247 PolarHBondContact O-N 3.16Å; I245-A247 VanDerWaalsContact C-N 3.27Å; I245-A247 PolarHBondContact O-N 3.17Å
248	N	82.5	Confident	75.4	Confident	7 Å²	7	41 Å²	41	4%	0.037	22%	0.224	C	C	.	.			trans	-131.5	67.6	-175.5	-58.7	-81.4	0	0	0	111.6	R228 L229 I232 L244 I245 S246 H250 I251	R228-N248 PolarHBondContact NH1-OD1 3.48Å; L229-N248 HydrophobicContact CD2-CB 4.13Å; L229-N248 VanDerWaalsContact CD2-ND2 3.35Å; L229-N248 WeakPolarHBondContact CD2-ND2 3.29Å; I232-N248 VanDerWaalsContact CD1-ND2 3.29Å; I232-N248 WeakPolarHBondContact CD1-ND2 3.23Å; L244-N248 PolarHBondContact O-N 3.07Å; L244-N248 PolarHBondContact O-ND2 3.2Å; I245-N248 CarbonylContact O-C 3.36Å; I245-N248 PolarHBondContact O-N 2.8Å; S246-N248 VanDerWaalsContact C-N 3.31Å; S246-N248 PolarHBondContact O-N 2.73Å; N248-H250 PolarHBondContact O-N 2.82Å; N248-H250 VanDerWaalsContact O-N 3.15Å; N248-I251 HydrophobicContact CB-CB 4.22Å; N248-I251 HydrophobicContact CB-CD1 4.13Å; N248-I251 HydrophobicContact CB-CG1 4.36Å; N248-I251 PolarHBondContact O-N 3.5Å; N248-I251 VanDerWaalsContact O-N 3.1Å
249	P	78.1	Confident	73.2	Confident	66 Å²	66	44.6 Å²	44.6	43%	0.429	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-20	-175.2	27.1	-35.9	0	0	0	114	I251	P249-I251 VanDerWaalsContact C-N 3.33Å
250	H	77.4	Confident	70.8	Confident	127 Å²	127	51.8 Å²	51.8	59%	0.588	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-11.1	178.4	-54.7	-64.1	0	0	0	113.6	N248	N248-H250 PolarHBondContact O-N 2.82Å; N248-H250 VanDerWaalsContact O-N 3.15Å
251	I	81.7	Confident	68.2	Low	16 Å²	16	56.9 Å²	56.9	8%	0.082	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.7	-175	-62.2	178.7	0	0	0	109.6	L221 D225 L229 N248 P249 F253 I297	L221-I251 HydrophobicContact CD1-CD1 3.71Å; L221-I251 HydrophobicContact CD1-CG1 3.98Å; D225-I251 HydrophobicContact CB-CD1 4.48Å; L229-I251 HydrophobicContact CD1-CD1 3.76Å; L229-I251 HydrophobicContact CD2-CD1 4.16Å; L229-I251 HydrophobicContact CG-CD1 4.07Å; N248-I251 HydrophobicContact CB-CB 4.22Å; N248-I251 HydrophobicContact CB-CD1 4.13Å; N248-I251 HydrophobicContact CB-CG1 4.36Å; N248-I251 PolarHBondContact O-N 3.5Å; N248-I251 VanDerWaalsContact O-N 3.1Å; P249-I251 VanDerWaalsContact C-N 3.33Å; I251-F253 HydrophobicContact CB-CE2 4.48Å; I251-F253 HydrophobicContact CB-CZ 4.42Å; I251-F253 HydrophobicContact CG2-CE1 4.08Å; I251-F253 HydrophobicContact CG2-CE2 3.95Å; I251-F253 HydrophobicContact CG2-CZ 3.62Å; I251-I297 HydrophobicContact CD1-CD1 4.12Å; I251-I297 HydrophobicContact CG1-CD1 4.47Å; I251-I297 HydrophobicContact CG2-CB 4.12Å; I251-I297 HydrophobicContact CG2-CD1 3.43Å; I251-I297 VanDerWaalsContact CG2-CD1 3.43Å; I251-I297 HydrophobicContact CG2-CG1 3.9Å
252	R	79.9	Confident	65.7	Low	109 Å²	109	59.6 Å²	59.6	41%	0.411	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	114.4	175.1	-165.1	176.5	-152.7	152.6	2.7	110.5	I254 C295 K296 I297	R252-I254 HydrophobicContact CG-CG1 4.43Å; R252-C295 PolarHBondContact N-O 3.45Å; R252-K296 WeakPolarHBondContact O-CA 3.48Å; R252-I297 PolarHBondContact O-N 3.22Å
253	F	81.6	Confident	63.4	Low	5 Å²	5	63.3 Å²	63.3	2%	0.022	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	129	171.8	-61.1	-78.8	0	0	0	110.5	L229 L244 I245 I251 L272 I297 L299	L229-F253 HydrophobicContact CD1-CE1 4.34Å; L229-F253 HydrophobicContact CD1-CZ 4.3Å; L229-F253 HydrophobicContact CD2-CE1 4.32Å; L229-F253 HydrophobicContact CD2-CZ 3.66Å; L244-F253 HydrophobicContact CD2-CD1 4.31Å; L244-F253 HydrophobicContact CD2-CD2 3.97Å; L244-F253 HydrophobicContact CD2-CE1 3.57Å; L244-F253 HydrophobicContact CD2-CE2 3.18Å; L244-F253 HydrophobicContact CD2-CG 4.49Å; L244-F253 HydrophobicContact CD2-CZ 2.97Å; L244-F253 HydrophobicContact CG-CZ 4.43Å; I245-F253 HydrophobicContact CG1-CD2 3.93Å; I245-F253 HydrophobicContact CG1-CE2 4.37Å; I251-F253 HydrophobicContact CB-CE2 4.48Å; I251-F253 HydrophobicContact CB-CZ 4.42Å; I251-F253 HydrophobicContact CG2-CE1 4.08Å; I251-F253 HydrophobicContact CG2-CE2 3.95Å; I251-F253 HydrophobicContact CG2-CZ 3.62Å; F253-L272 HydrophobicContact CB-CD1 3.63Å; F253-L272 HydrophobicContact CB-CG 4.3Å; F253-L272 PolarHBondContact O-N 3.2Å; F253-L272 VanDerWaalsContact O-N 3.14Å; F253-I297 CarbonylContact C-O 3.6Å; F253-I297 WeakPolarHBondContact CA-O 3.41Å; F253-I297 HydrophobicContact CD1-CG2 4.29Å; F253-I297 HydrophobicContact CE1-CB 4.49Å; F253-I297 HydrophobicContact CE1-CG2 4.19Å; F253-L299 HydrophobicContact CD1-CB 4.1Å; F253-L299 HydrophobicContact CD1-CD1 4.11Å; F253-L299 HydrophobicContact CE1-CD1 4.35Å
254	I	76.9	Confident	61.1	Low	4 Å²	4	65.5 Å²	65.5	2%	0.021	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.3	179.7	-66.6	-166.2	0	0	0	107.9	R252 Y269 K296 I297 S298	R252-I254 HydrophobicContact CG-CG1 4.43Å; I254-Y269 VanDerWaalsContact CG2-CB 3.44Å; I254-Y269 HydrophobicContact CG2-CD1 3.32Å; I254-Y269 HydrophobicContact CG2-CE1 4.35Å; I254-Y269 HydrophobicContact CG2-CG 3.69Å; I254-K296 HydrophobicContact CD1-CB 3.7Å; I254-K296 HydrophobicContact CD1-CD 3.38Å; I254-K296 HydrophobicContact CD1-CG 3.45Å; I254-K296 VanDerWaalsContact CD1-CG 3.45Å; I254-K296 HydrophobicContact CG1-CB 4.38Å; I254-K296 HydrophobicContact CG1-CG 4.39Å; I254-I297 PolarHBondContact N-O 3.42Å; I254-S298 WeakPolarHBondContact O-CA 3.24Å
255	E	67.6	Low	58.5	Low	13 Å²	13	70 Å²	70	6%	0.061	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.4	166.3	-167.9	60.6	-153.5	0	0	108.5	R128 I167 H270 L300	R128-E255 IonicContact CZ-OE1 2.67Å; R128-E255 VanDerWaalsContact CZ-OE1 3.23Å; R128-E255 IonicContact NE-OE1 3.36Å; R128-E255 PolarHBondContact NE-OE1 3.31Å; R128-E255 IonicContact NH2-OE1 2.64Å; R128-E255 PolarHBondContact NH2-OE1 2.86Å; I167-E255 HydrophobicContact CG2-CG 3.96Å; E255-H270 PolarHBondContact N-O 2.79Å; E255-H270 PolarHBondContact O-N 3.04Å; E255-L300 WeakPolarHBondContact OE1-CB 3.45Å; E255-L300 WeakPolarHBondContact OE1-CD2 3.45Å; E255-L300 WeakPolarHBondContact OE2-CB 3.5Å; E255-L300 PolarHBondContact OE2-N 3.34Å
256	C	51.4	Low	56	Low	32 Å²	32	74.7 Å²	74.7	22%	0.216	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	135.7	170.4	178.7	0	0	0	0	108.6	R128 S267 Y269	R128-C256 PolarHBondContact NH1-O 2.68Å; R128-C256 PolarHBondContact NH2-O 3.28Å; C256-S267 PolarHBondContact SG-OG 3.31Å; C256-S267 VanDerWaalsContact SG-OG 3.39Å; C256-Y269 HydrophobicContact CB-CD1 3.86Å; C256-Y269 HydrophobicContact CB-CE1 3.75Å
257	S	49.8	Very low	54	Low	48 Å²	48	73.9 Å²	73.9	34%	0.336	41%	0.413	S	S	.	.			trans	-86.6	130.3	163	-176	0	0	0	0	108.4	H259 S268	S257-H259 VanDerWaalsContact C-N 3.26Å; S257-H259 PolarHBondContact O-N 3.02Å; S257-S268 PolarHBondContact N-O 2.79Å
258	S	40.5	Very low	51.9	Low	43 Å²	43	75.7 Å²	75.7	30%	0.301	43%	0.425	S	S	.	.			trans	-75.9	78	177.4	75.3	0	0	0	0	110.8
259	H	35.6	Very low	50	Low	109 Å²	109	79.1 Å²	79.1	51%	0.505	44%	0.438	S	S	.	.			trans	-92.6	98.5	161.7	-96.1	-95.9	0	0	0	108.4	S257	S257-H259 VanDerWaalsContact C-N 3.26Å; S257-H259 PolarHBondContact O-N 3.02Å
260	M	29.9	Very low	48.6	Very low	159 Å²	159	82 Å²	82	78%	0.783	45%	0.445	S	S	*	.			trans	-90.5	16.3	165.1	-87.2	-72	157.9	0	0	112.3
261	N	27.6	Very low	47.3	Very low	148 Å²	148	78.4 Å²	78.4	79%	0.791	43%	0.434	S	S	*	.	S	Bend	trans	-125.4	64.4	173.7	-71	2.5	0	0	0	109.9
262	S	27.1	Very low	45.8	Very low	66 Å²	66	78.6 Å²	78.6	46%	0.462	44%	0.435	S	S	.	.			trans	-163.9	92.5	148.9	63.1	0	0	0	0	108.6	F264	S262-F264 PolarHBondContact O-N 3.04Å
263	S	30.5	Very low	44.4	Very low	119 Å²	119	75.9 Å²	75.9	83%	0.832	43%	0.432	S	S	*	.	S	Bend	trans	-43.7	125.6	146	-44.4	0	0	0	0	107.2
264	F	32.4	Very low	42.3	Very low	182 Å²	182	81.7 Å²	81.7	80%	0.798	46%	0.458	S	S	*	.	S	Bend	trans	70.5	74.6	-174.6	-65.3	-92.8	0	0	0	117.3	S262	S262-F264 PolarHBondContact O-N 3.04Å
265	S	30.2	Very low	40.6	Very low	95 Å²	95	83.2 Å²	83.2	66%	0.664	47%	0.467	S	S	*	.	S	Bend		174.2	131.9	129.7	-83.5	0	0	0	0	109.2	S267	S265-S267 PolarHBondContact O-N 3.45Å
266	T	31.3	Very low	38.8	Very low	127 Å²	127	93.4 Å²	93.4	78%	0.779	51%	0.505	S	S	*	.			trans	-3	115	163.9	54.8	0	0	0	0	114.7	S268	T266-S268 PolarHBondContact O-N 3.31Å
267	S	38.2	Very low	37.9	Very low	56 Å²	56	94.6 Å²	94.6	39%	0.392	51%	0.513	S	S	.	.			trans	-35.7	109.4	164.8	175	0	0	0	0	109.1	C256 S265 Y269	C256-S267 PolarHBondContact SG-OG 3.31Å; C256-S267 VanDerWaalsContact SG-OG 3.39Å; S265-S267 PolarHBondContact O-N 3.45Å; S267-Y269 WeakPolarHBondContact O-CD2 3.43Å; S267-Y269 PolarHBondContact O-N 2.89Å
268	S	39.1	Very low	37.1	Very low	59 Å²	59	96.9 Å²	96.9	41%	0.413	53%	0.529	S	S	.	.			trans	-76.1	80.6	-174.9	50.3	0	0	0	0	107.9	S257 T266 H270	S257-S268 PolarHBondContact N-O 2.79Å; T266-S268 PolarHBondContact O-N 3.31Å; S268-H270 PolarHBondContact O-N 3.42Å; S268-H270 VanDerWaalsContact O-N 3.16Å
269	Y	42.5	Very low	37	Very low	79 Å²	79	104.8 Å²	104.8	31%	0.31	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65	106.8	167.3	-71.9	-64.7	0	0	0	108.1	V210 I254 C256 S267 S271	V210-Y269 HydrophobicContact CG1-CE1 3.8Å; V210-Y269 HydrophobicContact CG1-CE2 4.21Å; I254-Y269 VanDerWaalsContact CG2-CB 3.44Å; I254-Y269 HydrophobicContact CG2-CD1 3.32Å; I254-Y269 HydrophobicContact CG2-CE1 4.35Å; I254-Y269 HydrophobicContact CG2-CG 3.69Å; C256-Y269 HydrophobicContact CB-CD1 3.86Å; C256-Y269 HydrophobicContact CB-CE1 3.75Å; S267-Y269 WeakPolarHBondContact O-CD2 3.43Å; S267-Y269 PolarHBondContact O-N 2.89Å; Y269-S271 PolarHBondContact O-N 3.22Å
270	H	48.8	Very low	37	Very low	127 Å²	127	107.5 Å²	107.5	59%	0.588	58%	0.576	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.1	115.9	164.1	-83.9	-75.8	0	0	0	107	E255 S268 L272	E255-H270 PolarHBondContact N-O 2.79Å; E255-H270 PolarHBondContact O-N 3.04Å; S268-H270 PolarHBondContact O-N 3.42Å; S268-H270 VanDerWaalsContact O-N 3.16Å; H270-L272 PolarHBondContact O-N 2.85Å
271	S	50.7	Low	37	Very low	51 Å²	51	102.8 Å²	102.8	36%	0.357	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-64.5	129.9	161.5	58.8	0	0	0	0	107.5	Y269	Y269-S271 PolarHBondContact O-N 3.22Å
272	L	51.1	Low	37.1	Very low	19 Å²	19	102.2 Å²	102.2	10%	0.099	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-56.5	132.9	165.9	-64	178.2	0	0	0	107.3	L170 L241 F253 H270 L299	L170-L272 HydrophobicContact CB-CD2 3.91Å; L170-L272 HydrophobicContact CD1-CD1 4.38Å; L241-L272 HydrophobicContact CD1-CD1 3.7Å; L241-L272 HydrophobicContact CD2-CB 4.45Å; L241-L272 HydrophobicContact CD2-CD1 4.06Å; L241-L272 HydrophobicContact CG-CD1 4.49Å; F253-L272 HydrophobicContact CB-CD1 3.63Å; F253-L272 HydrophobicContact CB-CG 4.3Å; F253-L272 PolarHBondContact O-N 3.2Å; F253-L272 VanDerWaalsContact O-N 3.14Å; H270-L272 PolarHBondContact O-N 2.85Å; L272-L299 HydrophobicContact CD1-CD2 4.25Å
273	P	49.3	Very low	37.2	Very low	53 Å²	53	104 Å²	104	34%	0.344	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-62.8	147.1	-175.3	22.7	-30.1	0	0	0	110.5	F176 V275	F176-P273 HydrophobicContact CD2-CG 3.68Å; F176-P273 HydrophobicContact CE2-CB 4.44Å; F176-P273 HydrophobicContact CE2-CG 3.04Å; F176-P273 HydrophobicContact CZ-CG 3.57Å; P273-V275 PolarHBondContact O-N 3.07Å
274	F	38	Very low	37.6	Very low	127 Å²	127	104 Å²	104	56%	0.557	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-59.6	119.5	169.1	-172.5	-99.6	0	0	0	107.7	R276 Y284	F274-R276 VanDerWaalsContact C-N 3.32Å; F274-R276 PolarHBondContact O-N 2.86Å; F274-Y284 AromaticContact CZ-CD1 4Å; F274-Y284 HydrophobicContact CZ-CD1 4Å; F274-Y284 AromaticContact CZ-CE1 3.95Å; F274-Y284 HydrophobicContact CZ-CE1 3.95Å; F274-Y284 HydrophobicContact CZ-CG 4.47Å
275	V	40.4	Very low	37.5	Very low	35 Å²	35	101.8 Å²	101.8	21%	0.212	55%	0.55	C	S	.	*			trans	-62.6	103.4	166.1	178.2	0	0	0	0	105.3	I245 P273 S277	I245-V275 HydrophobicContact CD1-CG2 4.37Å; P273-V275 PolarHBondContact O-N 3.07Å; V275-S277 PolarHBondContact O-N 3.36Å
276	R	31.5	Very low	37.4	Very low	227 Å²	227	101.8 Å²	101.8	86%	0.857	55%	0.55	S	S	*	*			trans	-59.5	98.5	162.4	-73.6	-177.3	-177.7	144.7	-0.1	104.5	F274 S278	F274-R276 VanDerWaalsContact C-N 3.32Å; F274-R276 PolarHBondContact O-N 2.86Å; R276-S278 PolarHBondContact O-N 3.27Å
277	S	32.6	Very low	37.5	Very low	57 Å²	57	103.4 Å²	103.4	40%	0.399	54%	0.543	S	S	.	.			trans	-42.5	130.1	166.5	-57.1	0	0	0	0	106.8	V275	V275-S277 PolarHBondContact O-N 3.36Å
278	S	33	Very low	37.1	Very low	96 Å²	96	108.4 Å²	108.4	67%	0.671	56%	0.56	S	S	*	*			trans	-45.5	154.1	173.8	66.2	0	0	0	0	109.3	R276 L280 C281	R276-S278 PolarHBondContact O-N 3.27Å; S278-L280 PolarHBondContact O-N 3.4Å; S278-C281 PolarHBondContact O-N 3.4Å
279	K	38.5	Very low	37	Very low	209 Å²	209	115 Å²	115	91%	0.909	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	13.6	-172.6	-71.2	176.7	173.6	175.8	0	116.9
280	L	35.6	Very low	36.5	Very low	167 Å²	167	114.9 Å²	114.9	87%	0.874	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-11.3	175.3	-131.1	75.4	0	0	0	114.9	S278	S278-L280 PolarHBondContact O-N 3.4Å
281	C	29.2	Very low	36	Very low	59 Å²	59	117.3 Å²	117.3	40%	0.399	60%	0.603	S	S	.	*			trans	-106.4	89.5	173.9	-163.8	0	0	0	0	111.1	S278 C283	S278-C281 PolarHBondContact O-N 3.4Å; C281-C283 PolarHBondContact O-N 3.25Å; C281-C283 VanDerWaalsContact O-N 3.08Å
282	N	28.8	Very low	35.7	Very low	137 Å²	137	121 Å²	121	73%	0.733	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-71.5	13.2	176.5	-92.2	0.5	0	0	0	114.4	Y284	N282-Y284 VanDerWaalsContact C-N 3.29Å; N282-Y284 PolarHBondContact O-N 2.99Å
283	C	30.3	Very low	35.8	Very low	103 Å²	103	124.7 Å²	124.7	70%	0.696	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-84.5	10	177.5	-64.5	0	0	0	0	114.5	C281	C281-C283 PolarHBondContact O-N 3.25Å; C281-C283 VanDerWaalsContact O-N 3.08Å
284	Y	37.2	Very low	36.5	Very low	119 Å²	119	126.4 Å²	126.4	47%	0.467	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-123.3	13.2	-171.7	-74.1	-73.6	0	0	0	116.7	F274 N282	F274-Y284 AromaticContact CZ-CD1 4Å; F274-Y284 HydrophobicContact CZ-CD1 4Å; F274-Y284 AromaticContact CZ-CE1 3.95Å; F274-Y284 HydrophobicContact CZ-CE1 3.95Å; F274-Y284 HydrophobicContact CZ-CG 4.47Å; N282-Y284 VanDerWaalsContact C-N 3.29Å; N282-Y284 PolarHBondContact O-N 2.99Å
285	T	30.4	Very low	38.1	Very low	136 Å²	136	120.9 Å²	120.9	83%	0.834	60%	0.604	S	S	*	*	S	Bend	trans	-88.9	5.3	175.7	52.3	0	0	0	0	114.7
286	S	29.3	Very low	40.1	Very low	95 Å²	95	122.6 Å²	122.6	66%	0.664	61%	0.608	S	S	*	*			trans	-143	54	178	69.6	0	0	0	0	113.2
287	Y	33.5	Very low	42.6	Very low	160 Å²	160	111.8 Å²	111.8	63%	0.627	57%	0.567	S	S	*	*			trans	-122.1	83.3	156.4	-110.5	-97.1	0	0	0	108	Y292	Y287-Y292 HydrophobicContact CD1-CD2 4.32Å; Y287-Y292 HydrophobicContact CD1-CE2 4.1Å; Y287-Y292 AromaticContact CE1-CD2 3.89Å; Y287-Y292 HydrophobicContact CE1-CD2 3.89Å; Y287-Y292 AromaticContact CE1-CE2 3.39Å; Y287-Y292 HydrophobicContact CE1-CE2 3.39Å; Y287-Y292 AromaticContact CE1-CZ 3.89Å
288	H	29.5	Very low	45	Very low	162 Å²	162	109.5 Å²	109.5	75%	0.75	55%	0.551	S	S	*	*			trans	-46	146.4	166.4	-105.8	-100.5	0	0	0	110.5	T290	H288-T290 HydrophobicContact CB-CG2 4.23Å; H288-T290 PolarHBondContact O-N 2.94Å; H288-T290 PolarHBondContact O-OG1 3.12Å
289	Q	38	Very low	47.6	Very low	198 Å²	198	104.9 Å²	104.9	93%	0.925	52%	0.519	S	S	*	.	S	Bend	trans	-51.2	64.8	170.1	-168.7	155.5	-5.8	0	0	113
290	T	31.6	Very low	50	Low	75 Å²	75	95.1 Å²	95.1	46%	0.46	48%	0.477	S	S	.	.			trans	-108.8	133.3	178.7	51.5	0	0	0	0	106.5	H288 Y292	H288-T290 HydrophobicContact CB-CG2 4.23Å; H288-T290 PolarHBondContact O-N 2.94Å; H288-T290 PolarHBondContact O-OG1 3.12Å; T290-Y292 PolarHBondContact O-N 3.41Å; T290-Y292 WeakPolarHBondContact OG1-CE2 3.37Å
291	H	38.3	Very low	52.5	Low	178 Å²	178	88.5 Å²	88.5	82%	0.824	45%	0.445	S	S	*	.			trans	-62.9	63.9	-173.5	-76.9	-96	0	0	0	113.2	H293	H291-H293 PolarHBondContact O-CD2 2.82Å; H291-H293 PolarHBondContact O-N 2.64Å
292	Y	43.4	Very low	55.4	Low	128 Å²	128	85.7 Å²	85.7	50%	0.502	43%	0.426	S	S	.	.			trans	-69.5	118	162.5	-76	-83.1	0	0	0	107.5	Y287 T290 Y294	Y287-Y292 HydrophobicContact CD1-CD2 4.32Å; Y287-Y292 HydrophobicContact CD1-CE2 4.1Å; Y287-Y292 AromaticContact CE1-CD2 3.89Å; Y287-Y292 HydrophobicContact CE1-CD2 3.89Å; Y287-Y292 AromaticContact CE1-CE2 3.39Å; Y287-Y292 HydrophobicContact CE1-CE2 3.39Å; Y287-Y292 AromaticContact CE1-CZ 3.89Å; T290-Y292 PolarHBondContact O-N 3.41Å; T290-Y292 WeakPolarHBondContact OG1-CE2 3.37Å; Y292-Y294 WeakPolarHBondContact O-CD2 3.34Å; Y292-Y294 WeakPolarHBondContact O-CE2 3.38Å; Y292-Y294 PolarHBondContact O-N 3.15Å
293	H	53.3	Low	58.4	Low	97 Å²	97	79.3 Å²	79.3	45%	0.449	39%	0.392	S	S	.	.			trans	-70.2	73	-178.3	-74	-94.8	0	0	0	110.3	L218 H291 C295	L218-H293 HydrophobicContact CD2-CB 4.16Å; H291-H293 PolarHBondContact O-CD2 2.82Å; H291-H293 PolarHBondContact O-N 2.64Å; H293-C295 PolarHBondContact O-N 3.43Å
294	Y	64.8	Low	61.2	Low	90 Å²	90	75.3 Å²	75.3	35%	0.353	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-60.5	132.1	176.7	-60.7	-79.8	0	0	0	110.9	Y292 K296	Y292-Y294 WeakPolarHBondContact O-CD2 3.34Å; Y292-Y294 WeakPolarHBondContact O-CE2 3.38Å; Y292-Y294 PolarHBondContact O-N 3.15Å; Y294-K296 PolarHBondContact O-N 3.45Å
295	C	72	Confident	63.7	Low	11 Å²	11	70.5 Å²	70.5	7%	0.074	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	128.7	169.8	-52.5	0	0	0	0	108.7	Q219 L221 R252 H293	Q219-C295 PolarHBondContact O-SG 2.85Å; L221-C295 HydrophobicContact CB-CB 4.41Å; L221-C295 HydrophobicContact CD1-CB 4.43Å; R252-C295 PolarHBondContact N-O 3.45Å; H293-C295 PolarHBondContact O-N 3.43Å
296	K	80.7	Confident	66.5	Low	70 Å²	70	64 Å²	64	30%	0.304	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	118.4	179.9	-69.2	178.7	167.2	-174.5	0	109.3	V210 T212 R252 I254 Y294	V210-K296 HydrophobicContact CB-CB 4.19Å; V210-K296 PolarHBondContact N-O 2.89Å; T212-K296 HydrophobicContact CG2-CD 3.83Å; R252-K296 WeakPolarHBondContact O-CA 3.48Å; I254-K296 HydrophobicContact CD1-CB 3.7Å; I254-K296 HydrophobicContact CD1-CD 3.38Å; I254-K296 HydrophobicContact CD1-CG 3.45Å; I254-K296 VanDerWaalsContact CD1-CG 3.45Å; I254-K296 HydrophobicContact CG1-CB 4.38Å; I254-K296 HydrophobicContact CG1-CG 4.39Å; Y294-K296 PolarHBondContact O-N 3.45Å
297	I	84.2	Confident	69.4	Low	0 Å²	0	60.5 Å²	60.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.5	179	-68.1	-178	0	0	0	109.6	V208 L221 L229 I251 R252 F253 I254	V208-I297 HydrophobicContact CG1-CB 4.37Å; V208-I297 HydrophobicContact CG1-CD1 4.43Å; V208-I297 HydrophobicContact CG1-CG1 4.32Å; V208-I297 HydrophobicContact CG1-CG2 3.39Å; L221-I297 HydrophobicContact CD1-CD1 4.26Å; L221-I297 HydrophobicContact CD2-CD1 3.37Å; L221-I297 HydrophobicContact CD2-CG1 4.02Å; L221-I297 HydrophobicContact CG-CD1 4.48Å; L229-I297 HydrophobicContact CD1-CD1 3.65Å; I251-I297 HydrophobicContact CD1-CD1 4.12Å; I251-I297 HydrophobicContact CG1-CD1 4.47Å; I251-I297 HydrophobicContact CG2-CB 4.12Å; I251-I297 HydrophobicContact CG2-CD1 3.43Å; I251-I297 VanDerWaalsContact CG2-CD1 3.43Å; I251-I297 HydrophobicContact CG2-CG1 3.9Å; R252-I297 PolarHBondContact O-N 3.22Å; F253-I297 CarbonylContact C-O 3.6Å; F253-I297 WeakPolarHBondContact CA-O 3.41Å; F253-I297 HydrophobicContact CD1-CG2 4.29Å; F253-I297 HydrophobicContact CE1-CB 4.49Å; F253-I297 HydrophobicContact CE1-CG2 4.19Å; I254-I297 PolarHBondContact N-O 3.42Å
298	S	84.3	Confident	71.9	Confident	9 Å²	9	53.7 Å²	53.7	6%	0.063	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	114.6	168.2	172.4	0	0	0	0	109.8	V208 I254 L300 S301 L302	V208-S298 PolarHBondContact O-N 3.01Å; V208-S298 VanDerWaalsContact O-N 3.12Å; I254-S298 WeakPolarHBondContact O-CA 3.24Å; S298-L300 VanDerWaalsContact C-N 3.32Å; S298-S301 VanDerWaalsContact CB-OG 3.3Å; S298-S301 WeakPolarHBondContact CB-OG 3.49Å; S298-S301 PolarHBondContact O-N 2.79Å; S298-S301 WeakPolarHBondContact OG-CB 3.21Å; S298-S301 PolarHBondContact OG-N 3.05Å; S298-S301 PolarHBondContact OG-OG 3.48Å; S298-L302 WeakPolarHBondContact O-CB 3.2Å; S298-L302 PolarHBondContact O-N 2.99Å
299	L	87.5	Confident	74.6	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65	-40	179.2	-178.9	65.3	0	0	0	110.8	F166 L170 F239 L241 F253 L272 L302 V303	F166-L299 HydrophobicContact CD2-CD2 4.32Å; F166-L299 HydrophobicContact CE2-CD2 4.11Å; F166-L299 HydrophobicContact CE2-CG 4.09Å; L170-L299 HydrophobicContact CD1-CD2 3.43Å; L170-L299 VanDerWaalsContact CD1-CD2 3.43Å; F239-L299 HydrophobicContact CZ-CD2 4.03Å; L241-L299 HydrophobicContact CD1-CD2 3.86Å; F253-L299 HydrophobicContact CD1-CB 4.1Å; F253-L299 HydrophobicContact CD1-CD1 4.11Å; F253-L299 HydrophobicContact CE1-CD1 4.35Å; L272-L299 HydrophobicContact CD1-CD2 4.25Å; L299-L302 HydrophobicContact CD1-CD2 4.31Å; L299-L302 WeakPolarHBondContact O-CB 3.43Å; L299-L302 PolarHBondContact O-N 3.39Å; L299-V303 WeakPolarHBondContact O-CG2 3.48Å; L299-V303 PolarHBondContact O-N 3.12Å
300	L	88.3	Confident	77	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-59.1	-48.9	174.4	178.5	61.4	0	0	0	111.8	R128 P164 F166 I167 E255 S298 L302 V303 Q304	R128-L300 HydrophobicContact CG-CD2 3.38Å; P164-L300 HydrophobicContact CB-CD1 3.83Å; P164-L300 HydrophobicContact CG-CD1 4.06Å; F166-L300 HydrophobicContact CZ-CD1 4.21Å; I167-L300 HydrophobicContact CD1-CB 3.51Å; I167-L300 HydrophobicContact CD1-CD1 3.22Å; I167-L300 HydrophobicContact CD1-CD2 3.85Å; I167-L300 HydrophobicContact CD1-CG 3.66Å; E255-L300 WeakPolarHBondContact OE1-CB 3.45Å; E255-L300 WeakPolarHBondContact OE1-CD2 3.45Å; E255-L300 WeakPolarHBondContact OE2-CB 3.5Å; E255-L300 PolarHBondContact OE2-N 3.34Å; S298-L300 VanDerWaalsContact C-N 3.32Å; L300-L302 VanDerWaalsContact C-N 3.27Å; L300-L302 PolarHBondContact O-N 3.47Å; L300-V303 PolarHBondContact O-N 3.26Å; L300-Q304 HydrophobicContact CD1-CG 3.74Å; L300-Q304 HydrophobicContact CG-CG 4.12Å; L300-Q304 WeakPolarHBondContact O-CB 3.4Å; L300-Q304 VanDerWaalsContact O-CG 3.29Å; L300-Q304 WeakPolarHBondContact O-CG 3.47Å; L300-Q304 PolarHBondContact O-N 3.42Å
301	S	87.6	Confident	79.7	Confident	28 Å²	28	36 Å²	36	20%	0.196	17%	0.173	C	C	.	.	H	α-helix	trans	-65.5	-34.7	-177.4	-54	0	0	0	0	111.2	S298 F305	S298-S301 VanDerWaalsContact CB-OG 3.3Å; S298-S301 WeakPolarHBondContact CB-OG 3.49Å; S298-S301 PolarHBondContact O-N 2.79Å; S298-S301 WeakPolarHBondContact OG-CB 3.21Å; S298-S301 PolarHBondContact OG-N 3.05Å; S298-S301 PolarHBondContact OG-OG 3.48Å; S301-F305 WeakPolarHBondContact O-CB 3.29Å; S301-F305 PolarHBondContact O-N 3.16Å
302	L	90.6	Very high	82.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.2	-53.7	171.2	-178.5	70.7	0	0	0	111.4	V208 I226 L229 Y230 S298 L299 L300 F305 G306	V208-L302 HydrophobicContact CG1-CB 4.09Å; V208-L302 HydrophobicContact CG1-CD1 3.85Å; V208-L302 HydrophobicContact CG2-CB 4.37Å; V208-L302 HydrophobicContact CG2-CD1 4.05Å; I226-L302 HydrophobicContact CG2-CD1 3.86Å; L229-L302 HydrophobicContact CB-CD2 4.26Å; L229-L302 HydrophobicContact CD1-CD2 4.3Å; Y230-L302 HydrophobicContact CE1-CD1 3.93Å; Y230-L302 HydrophobicContact CE1-CG 4.09Å; Y230-L302 HydrophobicContact CE2-CD1 3.87Å; Y230-L302 PolarHBondContact OH-O 2.99Å; S298-L302 WeakPolarHBondContact O-CB 3.2Å; S298-L302 PolarHBondContact O-N 2.99Å; L299-L302 HydrophobicContact CD1-CD2 4.31Å; L299-L302 WeakPolarHBondContact O-CB 3.43Å; L299-L302 PolarHBondContact O-N 3.39Å; L300-L302 VanDerWaalsContact C-N 3.27Å; L300-L302 PolarHBondContact O-N 3.47Å; L302-F305 PolarHBondContact O-N 2.96Å; L302-G306 PolarHBondContact O-N 3.44Å
303	V	90.9	Very high	84.5	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.012	14%	0.139	C	C	.	.	H	α-helix	trans	-63.7	-47.7	-178.8	173.1	0	0	0	0	111.1	F166 W185 L233 L299 L300 F305 G306 E307 I312	F166-V303 HydrophobicContact CE1-CB 4.25Å; F166-V303 HydrophobicContact CE1-CG1 3.86Å; F166-V303 HydrophobicContact CE1-CG2 4.36Å; F166-V303 HydrophobicContact CE2-CG2 4.11Å; F166-V303 HydrophobicContact CZ-CB 3.79Å; F166-V303 HydrophobicContact CZ-CG1 3.94Å; F166-V303 HydrophobicContact CZ-CG2 3.74Å; W185-V303 HydrophobicContact CH2-CG2 4.22Å; W185-V303 HydrophobicContact CZ2-CB 4.44Å; W185-V303 HydrophobicContact CZ2-CG1 3.76Å; W185-V303 HydrophobicContact CZ2-CG2 3.76Å; L233-V303 HydrophobicContact CD2-CG2 4.33Å; L299-V303 WeakPolarHBondContact O-CG2 3.48Å; L299-V303 PolarHBondContact O-N 3.12Å; L300-V303 PolarHBondContact O-N 3.26Å; V303-F305 PolarHBondContact O-N 3.01Å; V303-G306 PolarHBondContact O-N 2.87Å; V303-E307 HydrophobicContact CG1-CG 4.32Å; V303-E307 WeakPolarHBondContact O-CG 3.16Å; V303-E307 PolarHBondContact O-N 2.65Å; V303-I312 HydrophobicContact CG1-CD1 4.47Å
304	Q	90.3	Very high	86.2	Confident	20 Å²	20	25.3 Å²	25.3	9%	0.093	12%	0.12	C	C	.	.	H	α-helix	trans	-60.9	-44.9	179.1	-73.5	176.7	-23.7	0	0	112.1	V90 G127 L161 L300 G306 E307 V308	V90-Q304 HydrophobicContact CG2-CB 4.36Å; V90-Q304 HydrophobicContact CG2-CG 4.08Å; G127-Q304 VanDerWaalsContact C-NE2 3.26Å; G127-Q304 PolarHBondContact O-NE2 2.93Å; L161-Q304 HydrophobicContact CD1-CB 4.12Å; L161-Q304 HydrophobicContact CD1-CG 3.89Å; L300-Q304 HydrophobicContact CD1-CG 3.74Å; L300-Q304 HydrophobicContact CG-CG 4.12Å; L300-Q304 WeakPolarHBondContact O-CB 3.4Å; L300-Q304 VanDerWaalsContact O-CG 3.29Å; L300-Q304 WeakPolarHBondContact O-CG 3.47Å; L300-Q304 PolarHBondContact O-N 3.42Å; Q304-G306 VanDerWaalsContact C-N 3.29Å; Q304-G306 PolarHBondContact O-N 3.45Å; Q304-E307 PolarHBondContact O-N 3.32Å; Q304-V308 VanDerWaalsContact O-CB 3.29Å; Q304-V308 WeakPolarHBondContact O-CB 2.97Å; Q304-V308 WeakPolarHBondContact O-CG2 3.4Å; Q304-V308 PolarHBondContact O-N 2.81Å
305	F	88.9	Confident	87.2	Confident	18 Å²	18	22.2 Å²	22.2	8%	0.079	11%	0.109	C	C	.	.	H	α-helix	trans	-60.1	-44.7	177.5	-177.1	-86.7	0	0	0	110.7	L200 M203 C204 T207 V208 S301 L302 V303 N309 L311	L200-F305 HydrophobicContact CD1-CE1 4.22Å; L200-F305 HydrophobicContact CD1-CZ 3.89Å; M203-F305 HydrophobicContact CB-CE2 4.1Å; M203-F305 HydrophobicContact CB-CZ 4.25Å; C204-F305 HydrophobicContact CB-CD1 4Å; C204-F305 HydrophobicContact CB-CE1 3.33Å; C204-F305 HydrophobicContact CB-CE2 4.27Å; C204-F305 HydrophobicContact CB-CZ 3.49Å; C204-F305 VanDerWaalsContact CB-CZ 3.49Å; C204-F305 WeakPolarHBondContact SG-CD1 3.34Å; C204-F305 WeakPolarHBondContact SG-CE1 3.47Å; T207-F305 HydrophobicContact CG2-CD2 4.06Å; T207-F305 HydrophobicContact CG2-CE2 4.32Å; T207-F305 WeakPolarHBondContact OG1-CD2 3.26Å; V208-F305 HydrophobicContact CG2-CB 4.41Å; S301-F305 WeakPolarHBondContact O-CB 3.29Å; S301-F305 PolarHBondContact O-N 3.16Å; L302-F305 PolarHBondContact O-N 2.96Å; V303-F305 PolarHBondContact O-N 3.01Å; F305-N309 WeakPolarHBondContact CD2-ND2 3.5Å; F305-N309 VanDerWaalsContact CE2-ND2 3.28Å; F305-N309 WeakPolarHBondContact CE2-ND2 3.24Å; F305-N309 WeakPolarHBondContact CZ-ND2 3.4Å; F305-N309 WeakPolarHBondContact O-CB 3.39Å; F305-N309 PolarHBondContact O-N 2.93Å; F305-N309 PolarHBondContact O-ND2 3.27Å; F305-L311 HydrophobicContact CD1-CD1 4.22Å; F305-L311 HydrophobicContact CE1-CD1 4.03Å
306	G	89.3	Confident	87.8	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-44.6	177	0	0	0	0	0	112.9	Y230 L302 V303 Q304 G310 L311 I312	Y230-G306 PolarHBondContact OH-N 3.05Å; L302-G306 PolarHBondContact O-N 3.44Å; V303-G306 PolarHBondContact O-N 2.87Å; Q304-G306 VanDerWaalsContact C-N 3.29Å; Q304-G306 PolarHBondContact O-N 3.45Å; G306-G310 PolarHBondContact O-N 3.24Å; G306-L311 PolarHBondContact O-N 3.48Å; G306-I312 PolarHBondContact O-N 3.4Å
307	E	89.7	Confident	87.7	Confident	20 Å²	20	21.1 Å²	21.1	9%	0.093	11%	0.105	C	C	.	.	H	α-helix	trans	-71.7	-42.5	-179.8	-70.1	-177.9	171.3	0	0	112.6	L161 W185 V303 Q304 N309 G310 I312 R314	L161-E307 HydrophobicContact CD1-CB 4.35Å; L161-E307 HydrophobicContact CD2-CB 3.75Å; W185-E307 PolarHBondContact NE1-OE1 3.08Å; W185-E307 VanDerWaalsContact NE1-OE1 3.12Å; V303-E307 HydrophobicContact CG1-CG 4.32Å; V303-E307 WeakPolarHBondContact O-CG 3.16Å; V303-E307 PolarHBondContact O-N 2.65Å; Q304-E307 PolarHBondContact O-N 3.32Å; E307-N309 VanDerWaalsContact C-N 3.34Å; E307-N309 PolarHBondContact O-N 2.92Å; E307-G310 PolarHBondContact O-N 2.74Å; E307-I312 HydrophobicContact CG-CD1 4.39Å; E307-I312 HydrophobicContact CG-CG1 3.98Å; E307-R314 WeakPolarHBondContact OE1-CB 3.08Å
308	V	87.1	Confident	87.5	Confident	18 Å²	18	22.6 Å²	22.6	11%	0.109	11%	0.11	C	C	.	.	H	α-helix	trans	-62.5	-43	178.8	172	0	0	0	0	110.8	V90 I92 R159 L161 Q304 G310	V90-V308 HydrophobicContact CB-CG2 4.11Å; V90-V308 HydrophobicContact CG1-CG2 4.08Å; I92-V308 HydrophobicContact CD1-CG1 4.23Å; I92-V308 HydrophobicContact CG1-CG1 3.99Å; R159-V308 HydrophobicContact CB-CG1 4.35Å; R159-V308 HydrophobicContact CB-CG2 4Å; R159-V308 HydrophobicContact CG-CG2 4.14Å; R159-V308 PolarHBondContact NH1-O 2.77Å; L161-V308 HydrophobicContact CD1-CG2 4Å; L161-V308 HydrophobicContact CD2-CG2 4.25Å; L161-V308 HydrophobicContact CG-CG2 4.4Å; Q304-V308 VanDerWaalsContact O-CB 3.29Å; Q304-V308 WeakPolarHBondContact O-CB 2.97Å; Q304-V308 WeakPolarHBondContact O-CG2 3.4Å; Q304-V308 PolarHBondContact O-N 2.81Å; V308-G310 VanDerWaalsContact C-N 3.29Å; V308-G310 PolarHBondContact O-N 3.38Å
309	N	86.1	Confident	87.1	Confident	42 Å²	42	22.1 Å²	22.1	23%	0.225	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	2.7	-179.5	-67.7	-76.3	0	0	0	113.7	R190 L200 F305 E307 L311	R190-N309 WeakPolarHBondContact CD-O 3.43Å; R190-N309 PolarHBondContact NE-O 3.17Å; L200-N309 HydrophobicContact CD1-CB 4.23Å; F305-N309 WeakPolarHBondContact CD2-ND2 3.5Å; F305-N309 VanDerWaalsContact CE2-ND2 3.28Å; F305-N309 WeakPolarHBondContact CE2-ND2 3.24Å; F305-N309 WeakPolarHBondContact CZ-ND2 3.4Å; F305-N309 WeakPolarHBondContact O-CB 3.39Å; F305-N309 PolarHBondContact O-N 2.93Å; F305-N309 PolarHBondContact O-ND2 3.27Å; E307-N309 VanDerWaalsContact C-N 3.34Å; E307-N309 PolarHBondContact O-N 2.92Å; N309-L311 VanDerWaalsContact C-N 3.31Å; N309-L311 HydrophobicContact CB-CD2 4.42Å; N309-L311 HydrophobicContact CB-CG 4.08Å; N309-L311 PolarHBondContact O-N 2.94Å
310	G	87.1	Confident	86.5	Confident	22 Å²	22	25 Å²	25	23%	0.227	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	32.8	179.5	0	0	0	0	0	113.7	L188 G306 E307 V308	L188-G310 WeakPolarHBondContact CB-O 3.48Å; L188-G310 WeakPolarHBondContact CD1-O 3.27Å; G306-G310 PolarHBondContact O-N 3.24Å; E307-G310 PolarHBondContact O-N 2.74Å; V308-G310 VanDerWaalsContact C-N 3.29Å; V308-G310 PolarHBondContact O-N 3.38Å
311	L	89.8	Confident	85.5	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	-84.1	-38	172.7	-49.9	-175.9	0	0	0	111.1	L188 R190 L191 L194 L200 Y230 F305 G306 N309	L188-L311 WeakPolarHBondContact CB-O 3.48Å; L188-L311 PolarHBondContact N-O 2.98Å; R190-L311 HydrophobicContact CB-CD2 4.44Å; R190-L311 HydrophobicContact CG-CD2 4.01Å; L191-L311 HydrophobicContact CB-CB 4.49Å; L191-L311 HydrophobicContact CD1-CB 4.05Å; L194-L311 HydrophobicContact CD1-CD1 4.13Å; L194-L311 HydrophobicContact CD2-CD1 4.4Å; L200-L311 HydrophobicContact CD2-CD2 4.17Å; Y230-L311 HydrophobicContact CE2-CD1 4.3Å; F305-L311 HydrophobicContact CD1-CD1 4.22Å; F305-L311 HydrophobicContact CE1-CD1 4.03Å; G306-L311 PolarHBondContact O-N 3.48Å; N309-L311 VanDerWaalsContact C-N 3.31Å; N309-L311 HydrophobicContact CB-CD2 4.42Å; N309-L311 HydrophobicContact CB-CG 4.08Å; N309-L311 PolarHBondContact O-N 2.94Å
312	I	92.1	Very high	84.4	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.015	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	154.4	178.4	65.5	177.8	0	0	0	109.5	W185 L186 Y230 L233 C234 V303 G306 E307	W185-I312 HydrophobicContact CB-CB 4.28Å; W185-I312 HydrophobicContact CB-CD1 4.43Å; W185-I312 HydrophobicContact CG-CD1 4.02Å; L186-I312 CarbonylContact O-C 3.55Å; L186-I312 VanDerWaalsContact O-CA 3.29Å; L186-I312 WeakPolarHBondContact O-CA 3.49Å; Y230-I312 HydrophobicContact CD1-CD1 4.18Å; Y230-I312 HydrophobicContact CD1-CG2 3.73Å; Y230-I312 HydrophobicContact CE1-CD1 3.97Å; Y230-I312 HydrophobicContact CE1-CG2 4.24Å; L233-I312 HydrophobicContact CD2-CD1 3.63Å; C234-I312 WeakPolarHBondContact SG-CG2 3.37Å; V303-I312 HydrophobicContact CG1-CD1 4.47Å; G306-I312 PolarHBondContact O-N 3.4Å; E307-I312 HydrophobicContact CG-CD1 4.39Å; E307-I312 HydrophobicContact CG-CG1 3.98Å
313	R	90.3	Very high	82.9	Confident	162 Å²	162	35.7 Å²	35.7	61%	0.611	17%	0.172	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	133	172	-177.3	176.1	-179.3	173.1	0.9	109	W185 L186 L188 I315	W185-R313 CarbonylContact C-O 3.5Å; W185-R313 WeakPolarHBondContact CA-O 3.27Å; L186-R313 PolarHBondContact N-O 3.13Å; L186-R313 PolarHBondContact O-N 2.83Å; L188-R313 HydrophobicContact CD1-CB 4.18Å; L188-R313 HydrophobicContact CD2-CB 4.44Å; L188-R313 HydrophobicContact CG-CB 4.39Å; R313-I315 PolarHBondContact O-N 3.3Å
314	R	88.4	Confident	80.9	Confident	13 Å²	13	42.2 Å²	42.2	5%	0.049	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	131.1	175.8	-165	165.1	-171	-166.1	-8.7	111	Y163 T165 E307 D419	Y163-R314 PolarHBondContact O-NH1 3.31Å; T165-R314 PolarHBondContact OG1-NH1 2.81Å; T165-R314 VanDerWaalsContact OG1-NH1 3.13Å; T165-R314 PolarHBondContact OG1-NH2 3.49Å; E307-R314 WeakPolarHBondContact OE1-CB 3.08Å; R314-D419 IonicContact CZ-OD1 3.29Å; R314-D419 IonicContact CZ-OD2 2.81Å; R314-D419 IonicContact NE-OD2 2.88Å; R314-D419 PolarHBondContact NE-OD2 3.16Å; R314-D419 IonicContact NH1-OD1 3.86Å; R314-D419 IonicContact NH1-OD2 2.73Å; R314-D419 PolarHBondContact NH1-OD2 2.9Å; R314-D419 IonicContact NH2-OD1 3.15Å; R314-D419 PolarHBondContact NH2-OD1 3.5Å; R314-D419 VanDerWaalsContact NH2-OD1 3.17Å; R314-D419 IonicContact NH2-OD2 3.18Å; R314-D419 PolarHBondContact NH2-OD2 3.14Å; R314-D419 VanDerWaalsContact NH2-OD2 3.15Å
315	I	86.9	Confident	78.8	Confident	24 Å²	24	49 Å²	49	12%	0.123	24%	0.238	C	C	.	.			trans	-77	136	171.7	-56.2	169.9	0	0	0	107.3	P183 G184 L186 R313 W543	P183-I315 WeakPolarHBondContact CB-O 3.34Å; G184-I315 PolarHBondContact O-N 2.95Å; L186-I315 HydrophobicContact CB-CG1 4.22Å; R313-I315 PolarHBondContact O-N 3.3Å; I315-W543 HydrophobicContact CG2-CB 4.21Å; I315-W543 HydrophobicContact CG2-CE3 3.79Å
316	Q	83.6	Confident	76.6	Confident	57 Å²	57	54.1 Å²	54.1	27%	0.266	27%	0.265	S	S	.	.			trans	-108	136.1	177.2	-70.6	-178	-31.1	0	0	109.4	Y318 R544	Q316-Y318 HydrophobicContact CB-CD2 4.49Å; Q316-Y318 HydrophobicContact CB-CE2 3.69Å; Q316-Y318 PolarHBondContact OE1-OH 2.64Å; Q316-R544 PolarHBondContact N-O 3.11Å; Q316-R544 PolarHBondContact O-N 3.31Å
317	C	79.1	Confident	74.3	Confident	2 Å²	2	57 Å²	57	1%	0.014	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.1	174.8	-162.8	0	0	0	0	111.8	S417 L418 Y453 M542	C317-S417 CarbonylContact O-C 3.47Å; C317-S417 VanDerWaalsContact O-CA 3.32Å; C317-S417 WeakPolarHBondContact O-CA 3.38Å; C317-L418 PolarHBondContact O-N 3.46Å; C317-Y453 WeakPolarHBondContact CB-OH 3.41Å; C317-Y453 PolarHBondContact SG-OH 3.11Å; C317-M542 WeakPolarHBondContact CA-O 3.27Å
318	Y	79.8	Confident	72	Confident	30 Å²	30	59.8 Å²	59.8	12%	0.118	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	123.2	-178.2	-66.3	-96.9	0	0	0	109.6	Q316 Q415 M542 R544	Q316-Y318 HydrophobicContact CB-CD2 4.49Å; Q316-Y318 HydrophobicContact CB-CE2 3.69Å; Q316-Y318 PolarHBondContact OE1-OH 2.64Å; Y318-Q415 VanDerWaalsContact CE1-O 3.25Å; Y318-Q415 WeakPolarHBondContact CE1-O 3.47Å; Y318-M542 HydrophobicContact CD2-CE 4.32Å; Y318-M542 HydrophobicContact CG-CE 4.06Å; Y318-M542 PolarHBondContact N-O 3.49Å; Y318-M542 PolarHBondContact O-N 3.23Å; Y318-R544 HydrophobicContact CD2-CB 4.15Å; Y318-R544 HydrophobicContact CD2-CG 3.97Å; Y318-R544 HydrophobicContact CE2-CB 3.8Å; Y318-R544 HydrophobicContact CE2-CG 3.98Å
319	P	76.2	Confident	69.9	Low	0 Å²	0	67 Å²	67	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	131.9	172	30.5	-32.3	0	0	0	110	L411 G414 H416 I421 L539 Y540 W541	P319-L411 WeakPolarHBondContact CB-O 3.17Å; P319-L411 HydrophobicContact CG-CD2 4.18Å; P319-L411 VanDerWaalsContact CG-O 3.28Å; P319-L411 WeakPolarHBondContact CG-O 3.38Å; P319-G414 VanDerWaalsContact O-CA 3.25Å; P319-G414 WeakPolarHBondContact O-CA 3.28Å; P319-H416 WeakPolarHBondContact CD-O 3.48Å; P319-I421 HydrophobicContact CG-CD1 3.98Å; P319-L539 HydrophobicContact CB-CD2 4.25Å; P319-Y540 CarbonylContact C-O 3.58Å; P319-Y540 WeakPolarHBondContact CA-O 3.48Å; P319-W541 HydrophobicContact CB-CE3 4.11Å; P319-W541 HydrophobicContact CB-CH2 4.23Å; P319-W541 HydrophobicContact CB-CZ3 3.74Å; P319-W541 HydrophobicContact CG-CZ3 4.32Å
320	I	73.6	Confident	67.7	Low	61 Å²	61	71.1 Å²	71.1	31%	0.313	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	124.7	176.1	-56.9	177.7	0	0	0	107.3	L539 Y540 M542	I320-L539 CarbonylContact O-C 3.47Å; I320-L539 WeakPolarHBondContact O-CA 3.4Å; I320-Y540 PolarHBondContact N-O 3.17Å; I320-Y540 PolarHBondContact O-N 3.3Å; I320-M542 HydrophobicContact CD1-CB 3.5Å; I320-M542 HydrophobicContact CD1-CE 3.96Å; I320-M542 HydrophobicContact CD1-CG 4.31Å; I320-M542 HydrophobicContact CD1-SD 4.03Å; I320-M542 HydrophobicContact CG1-CB 4.22Å
321	S	68.5	Low	65.4	Low	21 Å²	21	77.6 Å²	77.6	15%	0.147	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132.5	171.6	166.4	0	0	0	0	109.8	K323	S321-K323 PolarHBondContact O-N 2.92Å; S321-K323 PolarHBondContact OG-N 3.27Å; S321-K323 PolarHBondContact OG-O 2.94Å
322	D	63.5	Low	63.2	Low	103 Å²	103	83.2 Å²	83.2	55%	0.551	42%	0.416	S	S	*	.	S	Bend	trans	-67.3	-24	168.8	-90.8	1.1	0	0	0	112.2	L324 Y540	D322-L324 VanDerWaalsContact C-N 3.33Å; D322-L324 PolarHBondContact O-N 3.36Å; D322-Y540 HydrophobicContact CB-CD2 4.5Å; D322-Y540 HydrophobicContact CB-CE2 3.87Å; D322-Y540 WeakPolarHBondContact OD1-CE2 3.44Å; D322-Y540 WeakPolarHBondContact OD2-CE2 3.39Å; D322-Y540 PolarHBondContact OD2-OH 2.79Å
323	K	59.1	Low	60.6	Low	131 Å²	131	90.7 Å²	90.7	57%	0.57	45%	0.448	S	S	*	.			trans	-74.1	94.8	175.4	-59.2	-165.3	-166.3	170.9	0	108	S321 E325 P537	S321-K323 PolarHBondContact O-N 2.92Å; S321-K323 PolarHBondContact OG-N 3.27Å; S321-K323 PolarHBondContact OG-O 2.94Å; K323-E325 PolarHBondContact O-N 3.47Å; K323-P537 HydrophobicContact CB-CB 4.35Å; K323-P537 HydrophobicContact CD-CB 3.7Å; K323-P537 HydrophobicContact CG-CB 3.89Å
324	L	49.9	Very low	57.9	Low	139 Å²	139	92.3 Å²	92.3	73%	0.728	46%	0.456	S	S	*	.			trans	-56.9	95.3	154.3	-172.9	70.9	0	0	0	105.8	D322 L326	D322-L324 VanDerWaalsContact C-N 3.33Å; D322-L324 PolarHBondContact O-N 3.36Å; L324-L326 HydrophobicContact CD2-CD1 4.13Å; L324-L326 HydrophobicContact CD2-CD2 3.55Å; L324-L326 HydrophobicContact CD2-CG 3.63Å; L324-L326 HydrophobicContact CG-CD2 3.95Å; L324-L326 HydrophobicContact CG-CG 3.85Å; L324-L326 PolarHBondContact O-N 3.39Å
325	E	46.3	Very low	55.1	Low	163 Å²	163	102 Å²	102	76%	0.762	49%	0.492	S	S	*	.			trans	-68.9	79	169.1	-145.5	171.8	-151.8	0	0	105.9	K323 S327	K323-E325 PolarHBondContact O-N 3.47Å; E325-S327 PolarHBondContact O-N 2.61Å
326	L	41.2	Very low	52.8	Low	125 Å²	125	108 Å²	108	65%	0.654	52%	0.521	S	S	*	.			trans	-62	82.1	162.5	-72	175.1	0	0	0	105.6	L324 A328	L324-L326 HydrophobicContact CD2-CD1 4.13Å; L324-L326 HydrophobicContact CD2-CD2 3.55Å; L324-L326 HydrophobicContact CD2-CG 3.63Å; L324-L326 HydrophobicContact CG-CD2 3.95Å; L324-L326 HydrophobicContact CG-CG 3.85Å; L324-L326 PolarHBondContact O-N 3.39Å; L326-A328 PolarHBondContact O-N 2.69Å
327	S	42.5	Very low	50.7	Low	62 Å²	62	109.9 Å²	109.9	43%	0.434	54%	0.541	S	S	.	.			trans	-62.3	95	161.7	59.2	0	0	0	0	106.2	E325 E329 Q330	E325-S327 PolarHBondContact O-N 2.61Å; S327-E329 PolarHBondContact O-N 3.18Å; S327-Q330 PolarHBondContact O-N 2.69Å; S327-Q330 VanDerWaalsContact O-N 3.12Å
328	A	40.7	Very low	48.6	Very low	78 Å²	78	114.7 Å²	114.7	65%	0.645	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-4.9	178.4	0	0	0	0	0	112.9	L326	L326-A328 PolarHBondContact O-N 2.69Å
329	E	44.2	Very low	46.3	Very low	168 Å²	168	117.4 Å²	117.4	79%	0.785	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-15.2	175.7	-73.5	-174	153.3	0	0	115.1	S327	S327-E329 PolarHBondContact O-N 3.18Å
330	Q	39.8	Very low	44.1	Very low	129 Å²	129	124 Å²	124	60%	0.603	64%	0.638	S	S	*	*	H	α-helix	trans	-84.8	-21.4	176.5	-70.3	-170.7	-6.5	0	0	113.5	S327 I332 Y334	S327-Q330 PolarHBondContact O-N 2.69Å; S327-Q330 VanDerWaalsContact O-N 3.12Å; Q330-I332 VanDerWaalsContact C-N 3.35Å; Q330-I332 PolarHBondContact O-N 3.37Å; Q330-Y334 WeakPolarHBondContact O-CD2 3.39Å
331	Q	37.8	Very low	41.7	Very low	159 Å²	159	129.9 Å²	129.9	74%	0.743	67%	0.667	S	S	*	*	H	α-helix	trans	-75.5	-18.5	173.5	-77.3	-169.7	-0.9	0	0	114.1
332	I	42.9	Very low	39.6	Very low	117 Å²	117	133.8 Å²	133.8	60%	0.6	69%	0.694	S	S	*	*	H	α-helix	trans	-86.2	-32.5	177.5	-60.8	176.8	0	0	0	111.4	Q330 M336	Q330-I332 VanDerWaalsContact C-N 3.35Å; Q330-I332 PolarHBondContact O-N 3.37Å; I332-M336 PolarHBondContact O-N 3.42Å
333	K	37.5	Very low	37.7	Very low	161 Å²	161	133.4 Å²	133.4	70%	0.7	70%	0.699	S	S	*	*	H	α-helix	trans	-74.8	-33.6	179.5	-101.4	177.5	178.8	175.8	0	114.4	R335 S337	K333-R335 VanDerWaalsContact C-N 3.32Å; K333-R335 PolarHBondContact O-N 3.47Å; K333-S337 WeakPolarHBondContact O-CB 3.37Å; K333-S337 PolarHBondContact O-N 2.87Å; K333-S337 PolarHBondContact O-OG 3.12Å
334	Y	33.6	Very low	36.2	Very low	196 Å²	196	136.6 Å²	136.6	77%	0.769	71%	0.713	S	S	*	*	H	α-helix	trans	-78	-14.7	176.7	-77.7	-73.5	0	0	0	114.1	Q330	Q330-Y334 WeakPolarHBondContact O-CD2 3.39Å
335	R	31.1	Very low	34.8	Very low	215 Å²	215	138.9 Å²	138.9	81%	0.811	72%	0.72	S	S	*	*	H	α-helix	trans	-91.5	-19.5	176	-139	178.2	-161.6	164.2	4.9	114.5	K333	K333-R335 VanDerWaalsContact C-N 3.32Å; K333-R335 PolarHBondContact O-N 3.47Å
336	M	39.2	Very low	33.8	Very low	150 Å²	150	136 Å²	136	74%	0.739	72%	0.724	S	S	*	*	H	α-helix	trans	-102	-10.4	176	-76.5	-162.8	-179.6	0	0	115.1	I332	I332-M336 PolarHBondContact O-N 3.42Å
337	S	39.3	Very low	33	Very low	97 Å²	97	137.7 Å²	137.7	68%	0.678	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-0.7	-176.5	-45.9	0	0	0	0	114.3	K333	K333-S337 WeakPolarHBondContact O-CB 3.37Å; K333-S337 PolarHBondContact O-N 2.87Å; K333-S337 PolarHBondContact O-OG 3.12Å
338	S	33.8	Very low	33	Very low	103 Å²	103	140.1 Å²	140.1	72%	0.72	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	8.1	176.9	59.5	0	0	0	0	114.4
339	S	31.2	Very low	32.2	Very low	87 Å²	87	141.3 Å²	141.3	61%	0.608	76%	0.757	S	S	*	*	S	Bend	trans	-129.5	44.3	-176	70.3	0	0	0	0	114.5
340	V	31.1	Very low	31.2	Very low	139 Å²	139	140.4 Å²	140.4	84%	0.842	76%	0.755	S	S	*	*			trans	-147.6	76.9	152.9	-169.8	0	0	0	0	109
341	M	22.5	Very low	30.7	Very low	185 Å²	185	142.2 Å²	142.2	91%	0.911	77%	0.768	S	S	*	*			trans	-96.2	141	147.9	-77.3	-165	74.7	0	0	107.8
342	S	23.6	Very low	29.9	Very low	102 Å²	102	139.8 Å²	139.8	71%	0.713	76%	0.764	S	S	*	*			trans	95.5	113.1	157.1	-163.2	0	0	0	0	118.8
343	S	24.9	Very low	29	Very low	96 Å²	96	140 Å²	140	67%	0.671	77%	0.77	S	S	*	*			trans	79.8	112.3	140.8	73.4	0	0	0	0	119.4
344	K	27.2	Very low	28.3	Very low	198 Å²	198	137.8 Å²	137.8	86%	0.861	77%	0.771	S	S	*	*				177.2	143.6	98.5	-95.4	175.7	178.6	179.3	0	112.9
345	E	20.8	Very low	27.8	Very low	187 Å²	187	133.9 Å²	133.9	87%	0.874	77%	0.768	S	S	*	*			trans	-61.9	146.9	174.4	-61.3	149.8	131.1	0	0	113.3
346	A	26.1	Very low	27.4	Very low	103 Å²	103	129.4 Å²	129.4	85%	0.851	76%	0.764	S	S	*	*			trans	-173.5	140.3	136.6	0	0	0	0	0	111.3
347	I	23.9	Very low	26.6	Very low	159 Å²	159	128 Å²	128	82%	0.815	76%	0.764	S	S	*	*			trans	-110.1	172.7	-175.9	-54.8	158	0	0	0	106.7
348	P	41.5	Very low	25.9	Very low	113 Å²	113	130.1 Å²	130.1	73%	0.734	77%	0.773	S	S	*	*				-122	171.2	-56.1	38.4	-23	0	0	0	112.8
349	A	25	Very low	25.2	Very low	104 Å²	104	130.4 Å²	130.4	86%	0.86	77%	0.77	S	S	*	*			trans	-154.1	116.8	147.2	0	0	0	0	0	111
350	I	21.9	Very low	24.8	Very low	148 Å²	148	132.4 Å²	132.4	76%	0.759	78%	0.779	S	S	*	*			trans	-74.5	126.9	169.1	-67.2	160.2	0	0	0	107.7
351	I	30	Very low	24.4	Very low	168 Å²	168	130.3 Å²	130.3	86%	0.862	77%	0.77	S	S	*	*			trans	-153.3	115.1	136.4	-88.2	145.9	0	0	0	106.4
352	T	20.9	Very low	24.4	Very low	108 Å²	108	126.3 Å²	126.3	66%	0.663	76%	0.761	S	S	*	*			trans	-82.1	162.5	172.3	-30.5	0	0	0	0	109.2
353	T	23.8	Very low	24.4	Very low	120 Å²	120	127.1 Å²	127.1	74%	0.736	76%	0.762	S	S	*	*			trans	88.4	133.1	167.1	76.1	0	0	0	0	114.9
354	T	22.8	Very low	24.2	Very low	116 Å²	116	127.7 Å²	127.7	71%	0.712	77%	0.766	S	S	*	*			cis	-174.9	154.4	-17.2	20.3	0	0	0	0	104.5
355	T	23.9	Very low	24.2	Very low	114 Å²	114	123.3 Å²	123.3	70%	0.699	76%	0.76	S	S	*	*			trans	63.5	97.1	152.8	38.7	0	0	0	0	117.3
356	T	21.1	Very low	24.3	Very low	121 Å²	121	121.1 Å²	121.1	74%	0.742	75%	0.754	S	S	*	*				72.5	135.4	84.7	58.6	0	0	0	0	115.2
357	V	22.3	Very low	24.4	Very low	121 Å²	121	122 Å²	122	73%	0.733	75%	0.75	S	S	*	*			trans	87.1	97	160.8	-155.6	0	0	0	0	115.6
358	T	25.5	Very low	24.3	Very low	141 Å²	141	119.5 Å²	119.5	87%	0.865	75%	0.746	S	S	*	*				-160.8	128.5	116.2	3.5	0	0	0	0	112.4
359	T	19.6	Very low	23.8	Very low	108 Å²	108	122.3 Å²	122.3	66%	0.663	75%	0.753	S	S	*	*			trans	-69.8	169.6	170.6	40.3	0	0	0	0	113
360	T	22.9	Very low	23.6	Very low	130 Å²	130	125.1 Å²	125.1	80%	0.798	75%	0.748	S	S	*	*			trans	81.9	139.1	162.2	75.3	0	0	0	0	114.1
361	S	22.1	Very low	24	Very low	94 Å²	94	127.7 Å²	127.7	66%	0.657	76%	0.757	S	S	*	*			cis	176.1	155.4	-3.8	40.1	0	0	0	0	104.7
362	S	23.4	Very low	23.5	Very low	102 Å²	102	127.5 Å²	127.5	71%	0.713	75%	0.752	S	S	*	*			trans	70.2	146.3	152.3	81.3	0	0	0	0	115.3
363	T	21.7	Very low	23.5	Very low	118 Å²	118	129.6 Å²	129.6	72%	0.724	76%	0.759	S	S	*	*			cis	-179.2	144.5	2.4	10.6	0	0	0	0	104.9
364	S	22.2	Very low	23.5	Very low	108 Å²	108	130.4 Å²	130.4	76%	0.755	76%	0.757	S	S	*	*			trans	43.4	122.7	144.4	64	0	0	0	0	121.3
365	S	26.2	Very low	23.4	Very low	107 Å²	107	132 Å²	132	75%	0.748	76%	0.757	S	S	*	*				171.1	150.1	129.5	47.5	0	0	0	0	107
366	N	23.9	Very low	23.2	Very low	140 Å²	140	136.5 Å²	136.5	75%	0.749	77%	0.767	S	S	*	*			cis	-175.4	171.7	-11.6	-105.6	-21.9	0	0	0	105.3
367	T	27.1	Very low	23.1	Very low	123 Å²	123	136.4 Å²	136.4	76%	0.755	76%	0.758	S	S	*	*			trans	73.7	105.3	157.7	59.6	0	0	0	0	117.4
368	S	22.2	Very low	23.2	Very low	105 Å²	105	137.5 Å²	137.5	73%	0.734	77%	0.765	S	S	*	*				70.5	94	66	76.9	0	0	0	0	114.2
369	I	30.6	Very low	23	Very low	172 Å²	172	139 Å²	139	88%	0.882	76%	0.76	S	S	*	*			trans	-135.6	124.9	147.6	-62.7	-176.9	0	0	0	108.4
370	Q	21.4	Very low	23.3	Very low	164 Å²	164	140.9 Å²	140.9	77%	0.766	77%	0.766	S	S	*	*			trans	-69.7	145.8	176.7	-62.7	166.4	-35.5	0	0	111.4
371	Q	29.2	Very low	23.3	Very low	202 Å²	202	139.4 Å²	139.4	94%	0.944	76%	0.761	S	S	*	*			trans	-150.7	126.8	137.7	-107.3	167.9	12.8	0	0	109.7
372	Q	21	Very low	23.4	Very low	163 Å²	163	139.7 Å²	139.7	76%	0.762	76%	0.763	S	S	*	*			trans	-95.9	171.3	-170.7	-80.9	173.6	-26.4	0	0	112.1
373	L	20.5	Very low	23.4	Very low	152 Å²	152	139.9 Å²	139.9	80%	0.796	76%	0.764	S	S	*	*			trans	79.9	128.8	159.5	-97.6	83.7	0	0	0	115.4
374	I	24.3	Very low	23.5	Very low	138 Å²	138	140 Å²	140	71%	0.708	76%	0.764	S	S	*	*			cis	-148.9	137.1	33.8	-65.5	178.2	0	0	0	110.8
375	Q	20	Very low	23.5	Very low	150 Å²	150	141.7 Å²	141.7	70%	0.701	76%	0.764	S	S	*	*			trans	-73.1	137.5	168	-76.6	170.6	-41.8	0	0	111.9
376	F	19.8	Very low	23.3	Very low	208 Å²	208	147.3 Å²	147.3	91%	0.912	77%	0.769	S	S	*	*			trans	-112.3	107.4	144.4	-86.2	-78.5	0	0	0	108.8
377	Q	19.6	Very low	23.3	Very low	118 Å²	118	148.9 Å²	148.9	55%	0.551	77%	0.772	S	S	*	*			trans	-93.5	129.4	165.6	-65.9	-178.7	10.5	0	0	108.4
378	T	24.8	Very low	23.2	Very low	145 Å²	145	149.9 Å²	149.9	89%	0.89	77%	0.772	S	S	*	*			trans	-143.5	113.1	139.4	47.1	0	0	0	0	109.3
379	K	19.5	Very low	23.2	Very low	172 Å²	172	149.9 Å²	149.9	75%	0.748	77%	0.773	S	S	*	*			trans	-73.2	152	168.5	-65.4	164.7	174.6	170.8	0	109.8
380	N	26.6	Very low	22.9	Very low	147 Å²	147	153.5 Å²	153.5	79%	0.786	78%	0.775	S	S	*	*			trans	-178.2	104.6	133.7	-87.1	-10.9	0	0	0	107
381	S	22.6	Very low	23	Very low	100 Å²	100	154 Å²	154	70%	0.699	78%	0.775	S	S	*	*				51.7	117.9	95.6	63.8	0	0	0	0	111.6
382	S	24.9	Very low	22.9	Very low	100 Å²	100	154.4 Å²	154.4	70%	0.699	77%	0.774	S	S	*	*			cis	-179.2	158.6	47.1	46	0	0	0	0	111.4
383	S	23.1	Very low	23.1	Very low	106 Å²	106	152.7 Å²	152.7	74%	0.741	77%	0.774	S	S	*	*			trans	72.2	140.5	141.3	68.2	0	0	0	0	119.1
384	V	23.3	Very low	23.5	Very low	120 Å²	120	153.5 Å²	153.5	73%	0.727	77%	0.772	S	S	*	*			cis	171.4	136.8	-11.7	125.1	0	0	0	0	104.7
385	L	23.7	Very low	23.6	Very low	144 Å²	144	156.5 Å²	156.5	75%	0.754	78%	0.779	S	S	*	*			trans	66	113.2	155.6	-58	168.6	0	0	0	119.4
386	R	20.6	Very low	24.3	Very low	224 Å²	224	152.8 Å²	152.8	85%	0.845	77%	0.769	S	S	*	*				69.1	95.8	60.9	-68.3	-170.2	-170	171.6	4.3	115.6
387	H	24.9	Very low	25.3	Very low	173 Å²	173	148.5 Å²	148.5	80%	0.801	75%	0.751	S	S	*	*			trans	-156.9	145.1	147.2	-86.2	-61	0	0	0	106.5
388	N	23.9	Very low	26.9	Very low	144 Å²	144	150.9 Å²	150.9	77%	0.77	77%	0.766	S	S	*	*			cis	-159.5	129.3	-2.8	-99.6	-27.8	0	0	0	106.5
389	S	22.9	Very low	28.4	Very low	106 Å²	106	145.2 Å²	145.2	74%	0.741	73%	0.73	S	S	*	*			trans	-94.9	113.8	176.5	60.2	0	0	0	0	111.4
390	R	24.5	Very low	30.9	Very low	247 Å²	247	141.4 Å²	141.4	93%	0.932	72%	0.718	S	S	*	*			trans	-109.9	115.1	157.4	-109.6	-179.4	179.4	177.5	0.2	109.3
391	K	22.6	Very low	33.1	Very low	176 Å²	176	141.7 Å²	141.7	77%	0.765	72%	0.715	S	S	*	*			trans	-80.2	122	-173.6	-64.2	172.1	176.5	177.6	0	110.2
392	F	28.6	Very low	35.7	Very low	209 Å²	209	143.7 Å²	143.7	92%	0.917	71%	0.713	S	S	*	*			trans	-111.6	114.4	152.6	-95.6	-79.8	0	0	0	107.2
393	T	24	Very low	38.1	Very low	127 Å²	127	139.5 Å²	139.5	78%	0.779	68%	0.683	S	S	*	*			trans	-93.6	97.6	-176.2	49.7	0	0	0	0	109.8
394	K	29.2	Very low	40.7	Very low	169 Å²	169	137 Å²	137	74%	0.735	66%	0.658	S	S	*	*			trans	-108.6	122.6	154.4	-75.1	-175.2	179	178.4	0	106.5	P396	K394-P396 WeakPolarHBondContact O-CD 3.05Å
395	K	26.4	Very low	43.2	Very low	201 Å²	201	134.4 Å²	134.4	87%	0.874	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-67.4	120.5	-178.8	-71.7	-178.8	176.6	-179	0	108.2
396	P	35.4	Very low	45.9	Very low	73 Å²	73	131.2 Å²	131.2	47%	0.474	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-66.6	136.9	-176.4	25.6	-32.3	0	0	0	110.5	K394 I398	K394-P396 WeakPolarHBondContact O-CD 3.05Å; P396-I398 PolarHBondContact O-N 3.44Å
397	Q	41.3	Very low	48.6	Very low	118 Å²	118	120.6 Å²	120.6	55%	0.551	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-60.3	116.7	170.4	-79.4	174.4	-25.4	0	0	108.8	I399	Q397-I399 PolarHBondContact O-N 3.39Å
398	I	51.2	Low	51	Low	167 Å²	167	116.1 Å²	116.1	86%	0.856	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-71.6	116.5	-173.4	-61.5	159.5	0	0	0	108.7	P396	P396-I398 PolarHBondContact O-N 3.44Å
399	I	58.2	Low	53.6	Low	27 Å²	27	112.6 Å²	112.6	14%	0.138	55%	0.55	C	S	.	.	P	Polyproline II helix	trans	-63.8	142.8	168.2	-49.9	176.8	0	0	0	107.8	Q397 E401 T403 W404 Y445	Q397-I399 PolarHBondContact O-N 3.39Å; I399-E401 PolarHBondContact O-N 2.74Å; I399-T403 HydrophobicContact CG2-CG2 4.19Å; I399-W404 HydrophobicContact CB-CB 4.34Å; I399-W404 HydrophobicContact CD1-CD2 4.38Å; I399-W404 HydrophobicContact CD1-CE3 3.69Å; I399-W404 HydrophobicContact CD1-CZ3 4.26Å; I399-W404 HydrophobicContact CG2-CB 4Å; I399-Y445 HydrophobicContact CD1-CD1 3.81Å; I399-Y445 HydrophobicContact CD1-CD2 3.35Å; I399-Y445 HydrophobicContact CD1-CE1 3.89Å; I399-Y445 HydrophobicContact CD1-CE2 3.46Å; I399-Y445 VanDerWaalsContact CD1-CE2 3.46Å; I399-Y445 HydrophobicContact CD1-CG 3.53Å; I399-Y445 HydrophobicContact CG1-CD1 3.66Å; I399-Y445 HydrophobicContact CG1-CD2 4.03Å; I399-Y445 HydrophobicContact CG1-CE1 3.4Å; I399-Y445 HydrophobicContact CG1-CE2 3.8Å; I399-Y445 HydrophobicContact CG1-CG 3.95Å; I399-Y445 VanDerWaalsContact CG1-CZ 3.46Å
400	N	71.9	Confident	56.4	Low	91 Å²	91	108.5 Å²	108.5	49%	0.487	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-55.5	128.4	165.6	-178.8	6.1	0	0	0	109.2	Q402 T403 W404	N400-Q402 PolarHBondContact O-N 3.07Å; N400-Q402 VanDerWaalsContact O-N 3.12Å; N400-Q402 PolarHBondContact OD1-N 2.86Å; N400-T403 WeakPolarHBondContact O-CB 3.25Å; N400-T403 PolarHBondContact O-N 2.65Å; N400-W404 PolarHBondContact O-N 3.01Å
401	E	72.2	Confident	58.9	Low	154 Å²	154	96.8 Å²	96.8	72%	0.72	48%	0.476	S	S	*	.	H	α-helix	trans	-53.7	-34.8	-178.1	-173.3	175.3	-174.7	0	0	112.3	I399 W404 S405	I399-E401 PolarHBondContact O-N 2.74Å; E401-W404 PolarHBondContact O-N 3.27Å; E401-S405 WeakPolarHBondContact O-CB 3.21Å; E401-S405 PolarHBondContact O-N 3.39Å; E401-S405 PolarHBondContact O-OG 3.49Å
402	Q	76.3	Confident	61.4	Low	142 Å²	142	90.5 Å²	90.5	66%	0.664	45%	0.449	S	S	*	.	H	α-helix	trans	-65.6	-48.8	174.7	-66.6	179.5	-19.5	0	0	112.2	N400 W404 S405 I406	N400-Q402 PolarHBondContact O-N 3.07Å; N400-Q402 VanDerWaalsContact O-N 3.12Å; N400-Q402 PolarHBondContact OD1-N 2.86Å; Q402-W404 VanDerWaalsContact C-N 3.27Å; Q402-W404 PolarHBondContact O-N 3.39Å; Q402-S405 PolarHBondContact O-N 3.45Å; Q402-I406 WeakPolarHBondContact O-CG1 3.01Å; Q402-I406 PolarHBondContact O-N 3.46Å
403	T	76.7	Confident	63.8	Low	12 Å²	12	83 Å²	83	7%	0.074	42%	0.419	C	S	.	.	H	α-helix	trans	-60.6	-40.4	177.3	-53	0	0	0	0	110.8	I399 N400 S407 F424 L425 N428	I399-T403 HydrophobicContact CG2-CG2 4.19Å; N400-T403 WeakPolarHBondContact O-CB 3.25Å; N400-T403 PolarHBondContact O-N 2.65Å; T403-S407 WeakPolarHBondContact O-CB 3.29Å; T403-S407 PolarHBondContact O-N 3.29Å; T403-S407 PolarHBondContact O-OG 2.63Å; T403-F424 HydrophobicContact CG2-CE1 4.12Å; T403-L425 HydrophobicContact CG2-CD2 4.24Å; T403-N428 HydrophobicContact CG2-CB 3.52Å
404	W	76.9	Confident	66.2	Low	54 Å²	54	77.9 Å²	77.9	21%	0.205	39%	0.391	C	S	.	.	H	α-helix	trans	-66.9	-43.5	175.9	179.3	-117.7	0	0	0	112.5	I399 N400 E401 Q402 I406 S407 R408	I399-W404 HydrophobicContact CB-CB 4.34Å; I399-W404 HydrophobicContact CD1-CD2 4.38Å; I399-W404 HydrophobicContact CD1-CE3 3.69Å; I399-W404 HydrophobicContact CD1-CZ3 4.26Å; I399-W404 HydrophobicContact CG2-CB 4Å; N400-W404 PolarHBondContact O-N 3.01Å; E401-W404 PolarHBondContact O-N 3.27Å; Q402-W404 VanDerWaalsContact C-N 3.27Å; Q402-W404 PolarHBondContact O-N 3.39Å; W404-I406 VanDerWaalsContact C-N 3.32Å; W404-I406 PolarHBondContact O-N 2.88Å; W404-S407 CarbonylContact O-C 3.48Å; W404-S407 PolarHBondContact O-N 3.44Å; W404-S407 VanDerWaalsContact O-N 3.16Å; W404-R408 WeakPolarHBondContact O-CB 3.18Å; W404-R408 PolarHBondContact O-N 2.86Å
405	S	75	Confident	68.6	Low	65 Å²	65	77 Å²	77	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-60	-43.3	178.2	-61.3	0	0	0	0	111.6	E401 Q402 R408 S409	E401-S405 WeakPolarHBondContact O-CB 3.21Å; E401-S405 PolarHBondContact O-N 3.39Å; E401-S405 PolarHBondContact O-OG 3.49Å; Q402-S405 PolarHBondContact O-N 3.45Å; S405-R408 PolarHBondContact O-N 2.78Å; S405-S409 PolarHBondContact O-N 2.9Å
406	I	81	Confident	71.3	Confident	77 Å²	77	70.8 Å²	70.8	40%	0.395	36%	0.363	S	S	.	.	H	α-helix	trans	-65.5	-46.5	174.3	-60.7	162.4	0	0	0	110	Q402 W404 R408 S409 L410 F424	Q402-I406 WeakPolarHBondContact O-CG1 3.01Å; Q402-I406 PolarHBondContact O-N 3.46Å; W404-I406 VanDerWaalsContact C-N 3.32Å; W404-I406 PolarHBondContact O-N 2.88Å; I406-R408 VanDerWaalsContact C-N 3.26Å; I406-R408 PolarHBondContact O-N 3.17Å; I406-S409 PolarHBondContact O-N 2.84Å; I406-S409 PolarHBondContact O-OG 3.02Å; I406-S409 VanDerWaalsContact O-OG 3.12Å; I406-L410 HydrophobicContact CG2-CD1 4.01Å; I406-L410 HydrophobicContact CG2-CG 4.16Å; I406-L410 VanDerWaalsContact O-CG 3.27Å; I406-L410 WeakPolarHBondContact O-CG 3.25Å; I406-L410 PolarHBondContact O-N 3.25Å; I406-F424 HydrophobicContact CB-CE1 3.99Å; I406-F424 HydrophobicContact CB-CZ 3.71Å; I406-F424 HydrophobicContact CD1-CZ 4.08Å; I406-F424 HydrophobicContact CG2-CE1 3.73Å; I406-F424 HydrophobicContact CG2-CE2 3.94Å; I406-F424 HydrophobicContact CG2-CZ 3.25Å
407	S	78.4	Confident	73.5	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-60.1	-38	178.8	-54.4	0	0	0	0	112.2	T403 W404 L410 L411 F424 L425	T403-S407 WeakPolarHBondContact O-CB 3.29Å; T403-S407 PolarHBondContact O-N 3.29Å; T403-S407 PolarHBondContact O-OG 2.63Å; W404-S407 CarbonylContact O-C 3.48Å; W404-S407 PolarHBondContact O-N 3.44Å; W404-S407 VanDerWaalsContact O-N 3.16Å; S407-L410 PolarHBondContact O-N 3.38Å; S407-L411 VanDerWaalsContact O-CG 3.27Å; S407-L411 WeakPolarHBondContact O-CG 3.08Å; S407-L411 PolarHBondContact O-N 2.86Å; S407-F424 WeakPolarHBondContact OG-CE1 3.4Å; S407-L425 WeakPolarHBondContact OG-CD2 3.41Å
408	R	74.6	Confident	75.2	Confident	80 Å²	80	61.9 Å²	61.9	30%	0.302	32%	0.316	S	S	.	.	H	α-helix	trans	-64.3	-43.9	173.7	-172.6	-172.8	-177.2	104.9	2	110.9	W404 S405 I406 L410 L411 M412	W404-R408 WeakPolarHBondContact O-CB 3.18Å; W404-R408 PolarHBondContact O-N 2.86Å; S405-R408 PolarHBondContact O-N 2.78Å; I406-R408 VanDerWaalsContact C-N 3.26Å; I406-R408 PolarHBondContact O-N 3.17Å; R408-L410 VanDerWaalsContact C-N 3.32Å; R408-L410 PolarHBondContact O-N 3.35Å; R408-L411 PolarHBondContact O-N 2.88Å; R408-M412 VanDerWaalsContact O-CG 3.25Å; R408-M412 WeakPolarHBondContact O-CG 3.45Å; R408-M412 PolarHBondContact O-N 3.43Å
409	S	78.8	Confident	76.5	Confident	69 Å²	69	54.3 Å²	54.3	48%	0.483	28%	0.277	S	S	.	.	H	α-helix	trans	-64	-40.1	176.2	92.1	0	0	0	0	111.4	S405 I406 L411 M412 D413	S405-S409 PolarHBondContact O-N 2.9Å; I406-S409 PolarHBondContact O-N 2.84Å; I406-S409 PolarHBondContact O-OG 3.02Å; I406-S409 VanDerWaalsContact O-OG 3.12Å; S409-L411 VanDerWaalsContact C-N 3.29Å; S409-L411 PolarHBondContact O-N 2.81Å; S409-M412 PolarHBondContact O-N 2.91Å; S409-M412 VanDerWaalsContact O-N 3.08Å; S409-D413 PolarHBondContact O-N 2.84Å; S409-D413 VanDerWaalsContact O-N 3.1Å
410	L	80.8	Confident	77.5	Confident	20 Å²	20	55 Å²	55	11%	0.105	28%	0.284	C	S	.	.	H	α-helix	trans	-64.9	-31.5	175.8	-62.6	173.1	0	0	0	112.5	I406 S407 R408 M412 D413 H416 I421 F424	I406-L410 HydrophobicContact CG2-CD1 4.01Å; I406-L410 HydrophobicContact CG2-CG 4.16Å; I406-L410 VanDerWaalsContact O-CG 3.27Å; I406-L410 WeakPolarHBondContact O-CG 3.25Å; I406-L410 PolarHBondContact O-N 3.25Å; S407-L410 PolarHBondContact O-N 3.38Å; R408-L410 VanDerWaalsContact C-N 3.32Å; R408-L410 PolarHBondContact O-N 3.35Å; L410-M412 VanDerWaalsContact C-N 3.28Å; L410-D413 WeakPolarHBondContact CA-OD2 3.41Å; L410-D413 VanDerWaalsContact O-OD1 3.05Å; L410-H416 HydrophobicContact CB-CB 4.47Å; L410-H416 HydrophobicContact CD2-CB 4.42Å; L410-H416 VanDerWaalsContact CD2-CE1 3.45Å; L410-H416 WeakPolarHBondContact CD2-CE1 3.26Å; L410-H416 WeakPolarHBondContact CD2-ND1 2.88Å; L410-I421 HydrophobicContact CB-CD1 4.28Å; L410-I421 HydrophobicContact CB-CG1 3.96Å; L410-I421 WeakPolarHBondContact O-CD1 3.47Å; L410-F424 HydrophobicContact CD1-CB 4.31Å; L410-F424 HydrophobicContact CD1-CD1 3.81Å; L410-F424 HydrophobicContact CD1-CD2 4.22Å; L410-F424 HydrophobicContact CD1-CE1 4.15Å; L410-F424 HydrophobicContact CD1-CE2 4.5Å; L410-F424 HydrophobicContact CD1-CG 3.85Å; L410-F424 HydrophobicContact CD1-CZ 4.48Å
411	L	77.7	Confident	77.9	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-70.8	-23.9	173.1	-75.2	166.8	0	0	0	113	P319 S407 R408 S409 I421 L449 L536	P319-L411 WeakPolarHBondContact CB-O 3.17Å; P319-L411 HydrophobicContact CG-CD2 4.18Å; P319-L411 VanDerWaalsContact CG-O 3.28Å; P319-L411 WeakPolarHBondContact CG-O 3.38Å; S407-L411 VanDerWaalsContact O-CG 3.27Å; S407-L411 WeakPolarHBondContact O-CG 3.08Å; S407-L411 PolarHBondContact O-N 2.86Å; R408-L411 PolarHBondContact O-N 2.88Å; S409-L411 VanDerWaalsContact C-N 3.29Å; S409-L411 PolarHBondContact O-N 2.81Å; L411-I421 HydrophobicContact CD2-CD1 3.72Å; L411-I421 HydrophobicContact CD2-CG2 4.34Å; L411-I421 HydrophobicContact CG-CD1 4.13Å; L411-I421 HydrophobicContact CG-CG2 4.39Å; L411-L449 HydrophobicContact CD1-CD1 4.21Å; L411-L449 HydrophobicContact CD2-CD2 4.03Å; L411-L536 HydrophobicContact CD1-CD2 4.43Å
412	M	74.5	Confident	78.2	Confident	44 Å²	44	43.3 Å²	43.3	22%	0.217	23%	0.227	C	C	.	.	H	α-helix	trans	-101	-9.2	-174.7	-61.6	-60.4	160.6	0	0	113.5	R408 S409 L410 L536 P537 L539	R408-M412 VanDerWaalsContact O-CG 3.25Å; R408-M412 WeakPolarHBondContact O-CG 3.45Å; R408-M412 PolarHBondContact O-N 3.43Å; S409-M412 PolarHBondContact O-N 2.91Å; S409-M412 VanDerWaalsContact O-N 3.08Å; L410-M412 VanDerWaalsContact C-N 3.28Å; M412-L536 HydrophobicContact CE-CD2 3.85Å; M412-P537 VanDerWaalsContact CE-CD 3.46Å; M412-P537 HydrophobicContact CE-CG 3.44Å; M412-P537 VanDerWaalsContact CE-CG 3.44Å; M412-P537 HydrophobicContact SD-CG 3.61Å; M412-L539 HydrophobicContact CE-CD2 4.22Å; M412-L539 HydrophobicContact SD-CD2 4.03Å
413	D	79	Confident	78.2	Confident	52 Å²	52	36.7 Å²	36.7	28%	0.278	20%	0.196	S	C	.	.	S	Bend	trans	-82	-18.1	-172.3	66	23.2	0	0	0	114.8	S409 L410 Q415 H416	S409-D413 PolarHBondContact O-N 2.84Å; S409-D413 VanDerWaalsContact O-N 3.1Å; L410-D413 WeakPolarHBondContact CA-OD2 3.41Å; L410-D413 VanDerWaalsContact O-OD1 3.05Å; D413-Q415 HydrophobicContact CB-CB 4.49Å; D413-Q415 PolarHBondContact O-N 3.11Å; D413-Q415 VanDerWaalsContact O-N 3.12Å; D413-Q415 WeakPolarHBondContact OD1-CA 3.25Å; D413-Q415 PolarHBondContact OD1-N 2.98Å; D413-H416 PolarHBondContact OD1-N 3.15Å; D413-H416 IonicContact OD1-ND1 3.9Å; D413-H416 IonicContact OD2-CE1 3.59Å; D413-H416 PolarHBondContact OD2-CE1 3.17Å; D413-H416 IonicContact OD2-CG 3.56Å; D413-H416 IonicContact OD2-ND1 3.1Å; D413-H416 PolarHBondContact OD2-ND1 3.01Å
414	G	74.8	Confident	78.3	Confident	18 Å²	18	38.2 Å²	38.2	19%	0.186	20%	0.201	C	C	.	.	S	Bend	trans	64.6	7.4	-174.7	0	0	0	0	0	114.9	P319	P319-G414 VanDerWaalsContact O-CA 3.25Å; P319-G414 WeakPolarHBondContact O-CA 3.28Å
415	Q	80.3	Confident	78.3	Confident	150 Å²	150	35.6 Å²	35.6	70%	0.701	19%	0.192	S	C	*	.	S	Bend	trans	-110.7	-26.1	-175.1	-68.4	-175.3	6.9	0	0	112.8	Y318 D413	Y318-Q415 VanDerWaalsContact CE1-O 3.25Å; Y318-Q415 WeakPolarHBondContact CE1-O 3.47Å; D413-Q415 HydrophobicContact CB-CB 4.49Å; D413-Q415 PolarHBondContact O-N 3.11Å; D413-Q415 VanDerWaalsContact O-N 3.12Å; D413-Q415 WeakPolarHBondContact OD1-CA 3.25Å; D413-Q415 PolarHBondContact OD1-N 2.98Å
416	H	82.5	Confident	78.1	Confident	71 Å²	71	33.6 Å²	33.6	33%	0.329	18%	0.176	S	C	.	.	S	Bend	trans	-97.7	129.6	177.6	-69	81.7	0	0	0	111.3	P319 L410 D413 I421	P319-H416 WeakPolarHBondContact CD-O 3.48Å; L410-H416 HydrophobicContact CB-CB 4.47Å; L410-H416 HydrophobicContact CD2-CB 4.42Å; L410-H416 VanDerWaalsContact CD2-CE1 3.45Å; L410-H416 WeakPolarHBondContact CD2-CE1 3.26Å; L410-H416 WeakPolarHBondContact CD2-ND1 2.88Å; D413-H416 PolarHBondContact OD1-N 3.15Å; D413-H416 IonicContact OD1-ND1 3.9Å; D413-H416 IonicContact OD2-CE1 3.59Å; D413-H416 PolarHBondContact OD2-CE1 3.17Å; D413-H416 IonicContact OD2-CG 3.56Å; D413-H416 IonicContact OD2-ND1 3.1Å; D413-H416 PolarHBondContact OD2-ND1 3.01Å; H416-I421 HydrophobicContact CB-CD1 4.39Å; H416-I421 HydrophobicContact CB-CG1 4.02Å
417	S	82	Confident	77.7	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.014	17%	0.168	C	C	.	.			trans	-66.7	151.6	172.3	78	0	0	0	0	109.9	C317 D419 S420 I421	C317-S417 CarbonylContact O-C 3.47Å; C317-S417 VanDerWaalsContact O-CA 3.32Å; C317-S417 WeakPolarHBondContact O-CA 3.38Å; S417-D419 PolarHBondContact O-N 2.87Å; S417-S420 WeakPolarHBondContact O-CA 3.14Å; S417-S420 VanDerWaalsContact O-CB 3.23Å; S417-S420 WeakPolarHBondContact O-CB 3.48Å; S417-S420 PolarHBondContact O-N 3.26Å; S417-S420 PolarHBondContact OG-N 3.17Å; S417-S420 VanDerWaalsContact OG-N 3.15Å; S417-S420 PolarHBondContact OG-OG 2.99Å; S417-I421 WeakPolarHBondContact O-CG1 3.46Å; S417-I421 PolarHBondContact O-N 3.38Å
418	L	76.4	Confident	77.2	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-55.5	-38.3	175.1	-179.1	61.7	0	0	0	112	C317 S420 I421 I422 L449 Y453 W541	C317-L418 PolarHBondContact O-N 3.46Å; L418-S420 VanDerWaalsContact C-N 3.29Å; L418-S420 PolarHBondContact O-N 3.38Å; L418-I421 PolarHBondContact O-N 2.87Å; L418-I422 HydrophobicContact CD1-CD1 4.23Å; L418-I422 HydrophobicContact CD1-CG1 4.33Å; L418-I422 HydrophobicContact CD2-CD1 4.5Å; L418-I422 HydrophobicContact CG-CD1 3.85Å; L418-I422 HydrophobicContact CG-CG1 4.41Å; L418-I422 WeakPolarHBondContact O-CB 3.39Å; L418-I422 VanDerWaalsContact O-CG1 3.27Å; L418-I422 WeakPolarHBondContact O-CG1 3.39Å; L418-I422 PolarHBondContact O-N 2.81Å; L418-L449 HydrophobicContact CD1-CD2 3.32Å; L418-Y453 HydrophobicContact CD2-CD2 4.38Å; L418-Y453 HydrophobicContact CD2-CE2 3.66Å; L418-W541 HydrophobicContact CB-CZ3 4.4Å; L418-W541 HydrophobicContact CD1-CH2 4.28Å; L418-W541 HydrophobicContact CD1-CZ3 4.32Å; L418-W541 HydrophobicContact CD2-CH2 4.29Å; L418-W541 HydrophobicContact CD2-CZ3 4.11Å
419	D	77.9	Confident	76.4	Confident	8 Å²	8	32.6 Å²	32.6	4%	0.043	18%	0.179	C	C	.	.	H	α-helix	trans	-60.9	-40.1	174.3	-78.6	-33.7	0	0	0	111.7	T165 R314 S417 T423	T165-D419 HydrophobicContact CG2-CB 4.43Å; T165-D419 PolarHBondContact OG1-OD1 3.25Å; R314-D419 IonicContact CZ-OD1 3.29Å; R314-D419 IonicContact CZ-OD2 2.81Å; R314-D419 IonicContact NE-OD2 2.88Å; R314-D419 PolarHBondContact NE-OD2 3.16Å; R314-D419 IonicContact NH1-OD1 3.86Å; R314-D419 IonicContact NH1-OD2 2.73Å; R314-D419 PolarHBondContact NH1-OD2 2.9Å; R314-D419 IonicContact NH2-OD1 3.15Å; R314-D419 PolarHBondContact NH2-OD1 3.5Å; R314-D419 VanDerWaalsContact NH2-OD1 3.17Å; R314-D419 IonicContact NH2-OD2 3.18Å; R314-D419 PolarHBondContact NH2-OD2 3.14Å; R314-D419 VanDerWaalsContact NH2-OD2 3.15Å; S417-D419 PolarHBondContact O-N 2.87Å; D419-T423 VanDerWaalsContact O-CB 3.32Å; D419-T423 WeakPolarHBondContact O-CB 3.26Å; D419-T423 PolarHBondContact O-N 3.35Å; D419-T423 PolarHBondContact O-OG1 2.73Å
420	S	80.6	Confident	75	Confident	40 Å²	40	32.1 Å²	32.1	28%	0.28	18%	0.184	S	C	.	.	H	α-helix	trans	-63.6	-42.8	174.3	-53.5	0	0	0	0	111.5	S417 L418 T423 F424	S417-S420 WeakPolarHBondContact O-CA 3.14Å; S417-S420 VanDerWaalsContact O-CB 3.23Å; S417-S420 WeakPolarHBondContact O-CB 3.48Å; S417-S420 PolarHBondContact O-N 3.26Å; S417-S420 PolarHBondContact OG-N 3.17Å; S417-S420 VanDerWaalsContact OG-N 3.15Å; S417-S420 PolarHBondContact OG-OG 2.99Å; L418-S420 VanDerWaalsContact C-N 3.29Å; L418-S420 PolarHBondContact O-N 3.38Å; S420-T423 PolarHBondContact O-N 2.96Å; S420-F424 WeakPolarHBondContact O-CB 3.39Å; S420-F424 PolarHBondContact O-N 3.36Å
421	I	79.8	Confident	73	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.5	-45.1	179.2	-60.6	170.4	0	0	0	111	P319 L410 L411 H416 S417 L418 T423 F424 L425	P319-I421 HydrophobicContact CG-CD1 3.98Å; L410-I421 HydrophobicContact CB-CD1 4.28Å; L410-I421 HydrophobicContact CB-CG1 3.96Å; L410-I421 WeakPolarHBondContact O-CD1 3.47Å; L411-I421 HydrophobicContact CD2-CD1 3.72Å; L411-I421 HydrophobicContact CD2-CG2 4.34Å; L411-I421 HydrophobicContact CG-CD1 4.13Å; L411-I421 HydrophobicContact CG-CG2 4.39Å; H416-I421 HydrophobicContact CB-CD1 4.39Å; H416-I421 HydrophobicContact CB-CG1 4.02Å; S417-I421 WeakPolarHBondContact O-CG1 3.46Å; S417-I421 PolarHBondContact O-N 3.38Å; L418-I421 PolarHBondContact O-N 2.87Å; I421-T423 VanDerWaalsContact C-N 3.29Å; I421-T423 PolarHBondContact O-N 2.96Å; I421-F424 WeakPolarHBondContact O-CB 3.47Å; I421-F424 PolarHBondContact O-N 3.08Å; I421-L425 HydrophobicContact CG2-CD1 4.42Å; I421-L425 WeakPolarHBondContact O-CG 3.28Å; I421-L425 PolarHBondContact O-N 2.88Å
422	I	77.5	Confident	70.9	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-45	174.5	-69	163.2	0	0	0	109.6	T165 M168 L418 F424 L425 L426 I446 L450	T165-I422 HydrophobicContact CG2-CG2 4.1Å; M168-I422 HydrophobicContact CE-CG2 4.14Å; L418-I422 HydrophobicContact CD1-CD1 4.23Å; L418-I422 HydrophobicContact CD1-CG1 4.33Å; L418-I422 HydrophobicContact CD2-CD1 4.5Å; L418-I422 HydrophobicContact CG-CD1 3.85Å; L418-I422 HydrophobicContact CG-CG1 4.41Å; L418-I422 WeakPolarHBondContact O-CB 3.39Å; L418-I422 VanDerWaalsContact O-CG1 3.27Å; L418-I422 WeakPolarHBondContact O-CG1 3.39Å; L418-I422 PolarHBondContact O-N 2.81Å; I422-F424 VanDerWaalsContact C-N 3.33Å; I422-F424 PolarHBondContact O-N 2.72Å; I422-L425 PolarHBondContact O-N 3Å; I422-L426 HydrophobicContact CG2-CD1 3.95Å; I422-L426 HydrophobicContact CG2-CG 4.44Å; I422-L426 VanDerWaalsContact O-CG 3.24Å; I422-L426 WeakPolarHBondContact O-CG 3.16Å; I422-L426 PolarHBondContact O-N 3.43Å; I422-I446 HydrophobicContact CG2-CG2 4.24Å; I422-L450 HydrophobicContact CD1-CD2 3.51Å; I422-L450 HydrophobicContact CD1-CG 4.19Å
423	T	75.8	Confident	68.9	Low	3 Å²	3	42.8 Å²	42.8	2%	0.018	26%	0.258	C	S	.	.	H	α-helix	trans	-64.3	-39.2	179.5	-51.7	0	0	0	0	111.8	N86 R130 Y163 D419 S420 I421 L426 T427	N86-T423 HydrophobicContact CB-CG2 3.71Å; N86-T423 VanDerWaalsContact CG-CG2 3.46Å; N86-T423 WeakPolarHBondContact OD1-CG2 3.26Å; R130-T423 PolarHBondContact NH1-O 2.77Å; Y163-T423 HydrophobicContact CG-CG2 4.4Å; D419-T423 VanDerWaalsContact O-CB 3.32Å; D419-T423 WeakPolarHBondContact O-CB 3.26Å; D419-T423 PolarHBondContact O-N 3.35Å; D419-T423 PolarHBondContact O-OG1 2.73Å; S420-T423 PolarHBondContact O-N 2.96Å; I421-T423 VanDerWaalsContact C-N 3.29Å; I421-T423 PolarHBondContact O-N 2.96Å; T423-L426 WeakPolarHBondContact O-CB 3.16Å; T423-L426 PolarHBondContact O-N 2.99Å; T423-T427 PolarHBondContact O-N 3.48Å; T423-T427 PolarHBondContact O-OG1 2.81Å
424	F	79.5	Confident	66.3	Low	43 Å²	43	49.2 Å²	49.2	19%	0.189	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-47.4	173.6	173.5	-94.6	0	0	0	112.2	T403 I406 S407 L410 S420 I421 I422 L426 T427 N428	T403-F424 HydrophobicContact CG2-CE1 4.12Å; I406-F424 HydrophobicContact CB-CE1 3.99Å; I406-F424 HydrophobicContact CB-CZ 3.71Å; I406-F424 HydrophobicContact CD1-CZ 4.08Å; I406-F424 HydrophobicContact CG2-CE1 3.73Å; I406-F424 HydrophobicContact CG2-CE2 3.94Å; I406-F424 HydrophobicContact CG2-CZ 3.25Å; S407-F424 WeakPolarHBondContact OG-CE1 3.4Å; L410-F424 HydrophobicContact CD1-CB 4.31Å; L410-F424 HydrophobicContact CD1-CD1 3.81Å; L410-F424 HydrophobicContact CD1-CD2 4.22Å; L410-F424 HydrophobicContact CD1-CE1 4.15Å; L410-F424 HydrophobicContact CD1-CE2 4.5Å; L410-F424 HydrophobicContact CD1-CG 3.85Å; L410-F424 HydrophobicContact CD1-CZ 4.48Å; S420-F424 WeakPolarHBondContact O-CB 3.39Å; S420-F424 PolarHBondContact O-N 3.36Å; I421-F424 WeakPolarHBondContact O-CB 3.47Å; I421-F424 PolarHBondContact O-N 3.08Å; I422-F424 VanDerWaalsContact C-N 3.33Å; I422-F424 PolarHBondContact O-N 2.72Å; F424-L426 VanDerWaalsContact C-N 3.27Å; F424-L426 PolarHBondContact O-N 3.31Å; F424-T427 WeakPolarHBondContact CA-OG1 3.47Å; F424-T427 PolarHBondContact O-N 2.92Å; F424-T427 PolarHBondContact O-OG1 3.43Å; F424-N428 WeakPolarHBondContact CD2-ND2 3.15Å; F424-N428 WeakPolarHBondContact CE1-ND2 3.23Å; F424-N428 WeakPolarHBondContact CE2-ND2 3.05Å; F424-N428 WeakPolarHBondContact CZ-ND2 3.39Å; F424-N428 PolarHBondContact O-N 3.12Å; F424-N428 VanDerWaalsContact O-N 3.11Å; F424-N428 PolarHBondContact O-ND2 3.42Å
425	L	76.4	Confident	64.3	Low	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.7	-42.6	175.2	-76.2	171.1	0	0	0	110.8	T403 S407 I421 I422 T427 N428 N429 Y445 I446 L449	T403-L425 HydrophobicContact CG2-CD2 4.24Å; S407-L425 WeakPolarHBondContact OG-CD2 3.41Å; I421-L425 HydrophobicContact CG2-CD1 4.42Å; I421-L425 WeakPolarHBondContact O-CG 3.28Å; I421-L425 PolarHBondContact O-N 2.88Å; I422-L425 PolarHBondContact O-N 3Å; L425-T427 PolarHBondContact O-N 3.25Å; L425-N428 PolarHBondContact O-N 2.88Å; L425-N429 PolarHBondContact O-N 3.19Å; L425-N429 PolarHBondContact O-ND2 3.19Å; L425-Y445 HydrophobicContact CD1-CE2 4.47Å; L425-Y445 HydrophobicContact CD2-CE2 4.19Å; L425-I446 HydrophobicContact CB-CD1 4.06Å; L425-I446 HydrophobicContact CB-CG1 4.18Å; L425-I446 HydrophobicContact CD1-CG1 4.15Å; L425-L449 HydrophobicContact CD1-CD1 3.71Å
426	L	71.7	Confident	61.6	Low	23 Å²	23	53.8 Å²	53.8	12%	0.12	30%	0.304	C	S	.	.	H	α-helix	trans	-64.6	-37.9	176.5	-67.7	166.9	0	0	0	113.1	Y163 M168 I422 T423 F424 I446	Y163-L426 HydrophobicContact CE1-CD1 4.22Å; M168-L426 HydrophobicContact CE-CD1 3.57Å; M168-L426 HydrophobicContact CE-CD2 3.88Å; M168-L426 HydrophobicContact CE-CG 4.2Å; M168-L426 HydrophobicContact SD-CD1 3.45Å; M168-L426 WeakPolarHBondContact SD-CD1 3.46Å; M168-L426 HydrophobicContact SD-CD2 3.49Å; M168-L426 WeakPolarHBondContact SD-CD2 3.33Å; M168-L426 HydrophobicContact SD-CG 4.1Å; I422-L426 HydrophobicContact CG2-CD1 3.95Å; I422-L426 HydrophobicContact CG2-CG 4.44Å; I422-L426 VanDerWaalsContact O-CG 3.24Å; I422-L426 WeakPolarHBondContact O-CG 3.16Å; I422-L426 PolarHBondContact O-N 3.43Å; T423-L426 WeakPolarHBondContact O-CB 3.16Å; T423-L426 PolarHBondContact O-N 2.99Å; F424-L426 VanDerWaalsContact C-N 3.27Å; F424-L426 PolarHBondContact O-N 3.31Å; L426-I446 HydrophobicContact CD2-CD1 3.84Å; L426-I446 HydrophobicContact CG-CD1 4.25Å
427	T	71.8	Confident	59.3	Low	39 Å²	39	56.3 Å²	56.3	24%	0.239	33%	0.33	C	S	.	.	H	α-helix	trans	-63.1	-43.2	175.7	47.1	0	0	0	0	112.5	I132 T423 F424 L425 N429	I132-T427 HydrophobicContact CD1-CG2 4.44Å; T423-T427 PolarHBondContact O-N 3.48Å; T423-T427 PolarHBondContact O-OG1 2.81Å; F424-T427 WeakPolarHBondContact CA-OG1 3.47Å; F424-T427 PolarHBondContact O-N 2.92Å; F424-T427 PolarHBondContact O-OG1 3.43Å; L425-T427 PolarHBondContact O-N 3.25Å; T427-N429 PolarHBondContact O-N 3.28Å
428	N	68.1	Low	56.6	Low	75 Å²	75	61.5 Å²	61.5	40%	0.401	37%	0.365	S	S	.	.	H	α-helix	trans	-88.1	-3.4	-168.9	-70.4	-33.6	0	0	0	114.4	T403 F424 L425 G430	T403-N428 HydrophobicContact CG2-CB 3.52Å; F424-N428 WeakPolarHBondContact CD2-ND2 3.15Å; F424-N428 WeakPolarHBondContact CE1-ND2 3.23Å; F424-N428 WeakPolarHBondContact CE2-ND2 3.05Å; F424-N428 WeakPolarHBondContact CZ-ND2 3.39Å; F424-N428 PolarHBondContact O-N 3.12Å; F424-N428 VanDerWaalsContact O-N 3.11Å; F424-N428 PolarHBondContact O-ND2 3.42Å; L425-N428 PolarHBondContact O-N 2.88Å; N428-G430 PolarHBondContact O-N 3.44Å
429	N	59.1	Low	54.5	Low	22 Å²	22	64.4 Å²	64.4	12%	0.118	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	13.3	173.7	-75.5	-37.5	0	0	0	114.5	L425 T427 S431 T432 Y445	L425-N429 PolarHBondContact O-N 3.19Å; L425-N429 PolarHBondContact O-ND2 3.19Å; T427-N429 PolarHBondContact O-N 3.28Å; N429-S431 PolarHBondContact O-N 3.45Å; N429-T432 PolarHBondContact O-N 2.83Å; N429-Y445 PolarHBondContact ND2-OH 3.27Å; N429-Y445 PolarHBondContact OD1-OH 2.88Å
430	G	49.2	Very low	52.5	Low	58 Å²	58	68.2 Å²	68.2	60%	0.598	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	9.1	-167.3	0	0	0	0	0	118.8	N428	N428-G430 PolarHBondContact O-N 3.44Å
431	S	39.2	Very low	50.6	Low	114 Å²	114	75.2 Å²	75.2	80%	0.797	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-6.9	171.1	63.7	0	0	0	0	115.1	N429	N429-S431 PolarHBondContact O-N 3.45Å
432	T	32.4	Very low	49.1	Very low	93 Å²	93	75.6 Å²	75.6	57%	0.571	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.9	-2.3	175.7	56.5	0	0	0	0	115.7	N429 K434	N429-T432 PolarHBondContact O-N 2.83Å; T432-K434 PolarHBondContact O-N 3.09Å; T432-K434 VanDerWaalsContact O-N 3.07Å
433	T	32.1	Very low	47.8	Very low	84 Å²	84	76.1 Å²	76.1	52%	0.515	44%	0.443	S	S	.	.			trans	-85.5	51.2	170	56.7	0	0	0	0	111.2
434	K	25.8	Very low	46.6	Very low	187 Å²	187	80 Å²	80	81%	0.813	46%	0.461	S	S	*	.			trans	-70.9	124.8	150.9	-74.2	-178.1	178.7	179	0	104.8	T432 S436	T432-K434 PolarHBondContact O-N 3.09Å; T432-K434 VanDerWaalsContact O-N 3.07Å; K434-S436 PolarHBondContact O-N 3Å
435	Y	31.9	Very low	45.3	Very low	170 Å²	170	79.1 Å²	79.1	67%	0.667	46%	0.456	S	S	*	.			trans	-57.7	79.5	167.9	-75.1	-93	0	0	0	108.5	F440	Y435-F440 AromaticContact CE1-CE2 3.94Å; Y435-F440 HydrophobicContact CE1-CE2 3.94Å; Y435-F440 HydrophobicContact CE1-CZ 4.05Å
436	S	24.6	Very low	44.2	Very low	94 Å²	94	79.1 Å²	79.1	66%	0.657	46%	0.456	S	S	*	.			trans	-70.3	133.7	169.6	-174.4	0	0	0	0	106.1	K434 C438	K434-S436 PolarHBondContact O-N 3Å; S436-C438 PolarHBondContact O-N 3.36Å
437	S	33.3	Very low	43.4	Very low	123 Å²	123	78.2 Å²	78.2	86%	0.86	45%	0.452	S	S	*	.	S	Bend	trans	-60.8	18.4	-169.6	43.5	0	0	0	0	116.2
438	C	26.6	Very low	42.5	Very low	112 Å²	112	78.6 Å²	78.6	76%	0.757	45%	0.453	S	S	*	.	S	Bend	trans	-154.5	98.9	176.6	-164.2	0	0	0	0	110.7	S436	S436-C438 PolarHBondContact O-N 3.36Å
439	G	32	Very low	41.9	Very low	64 Å²	64	75.5 Å²	75.5	66%	0.66	44%	0.436	S	S	*	.			trans	82.8	125.3	165.1	0	0	0	0	0	116.6	K441	G439-K441 PolarHBondContact O-N 3.27Å; G439-K441 VanDerWaalsContact O-N 3.07Å
440	F	35.6	Very low	41.5	Very low	88 Å²	88	74.8 Å²	74.8	39%	0.386	43%	0.432	S	S	.	.			trans	-61.2	106.6	163	-107.6	-95.8	0	0	0	108.9	M168 L171 Y435 I442	M168-F440 HydrophobicContact CG-CD1 4.12Å; M168-F440 HydrophobicContact CG-CE1 4.34Å; L171-F440 HydrophobicContact CD2-CB 4.43Å; L171-F440 HydrophobicContact CD2-CD2 3.99Å; Y435-F440 AromaticContact CE1-CE2 3.94Å; Y435-F440 HydrophobicContact CE1-CE2 3.94Å; Y435-F440 HydrophobicContact CE1-CZ 4.05Å; F440-I442 PolarHBondContact O-N 3.02Å
441	K	39.5	Very low	41.7	Very low	187 Å²	187	73.7 Å²	73.7	81%	0.813	41%	0.412	S	S	*	.			trans	-90.6	92.8	167	-75.8	-175.3	-179.8	175.8	0	108.7	G439 P443	G439-K441 PolarHBondContact O-N 3.27Å; G439-K441 VanDerWaalsContact O-N 3.07Å; K441-P443 WeakPolarHBondContact O-CD 3.06Å
442	I	48.4	Very low	42.1	Very low	8 Å²	8	68.7 Å²	68.7	4%	0.041	38%	0.377	C	S	.	.			trans	-62.6	129.2	164	-60.3	157.7	0	0	0	107.6	M168 Q172 F440 I446	M168-I442 HydrophobicContact CB-CD1 4.4Å; M168-I442 HydrophobicContact CE-CD1 3.94Å; M168-I442 HydrophobicContact CE-CG1 3.9Å; M168-I442 HydrophobicContact CE-CG2 4.36Å; M168-I442 HydrophobicContact CG-CD1 3.78Å; M168-I442 HydrophobicContact CG-CG1 3.76Å; M168-I442 VanDerWaalsContact O-CD1 3.25Å; M168-I442 WeakPolarHBondContact O-CD1 3.46Å; M168-I442 HydrophobicContact SD-CD1 4.32Å; M168-I442 HydrophobicContact SD-CG1 3.88Å; Q172-I442 HydrophobicContact CB-CD1 4.47Å; Q172-I442 HydrophobicContact CG-CD1 4.44Å; Q172-I442 PolarHBondContact NE2-O 3.33Å; F440-I442 PolarHBondContact O-N 3.02Å; I442-I446 HydrophobicContact CG2-CB 3.54Å; I442-I446 HydrophobicContact CG2-CD1 4.24Å; I442-I446 HydrophobicContact CG2-CG1 4.48Å; I442-I446 HydrophobicContact CG2-CG2 3.49Å; I442-I446 VanDerWaalsContact CG2-CG2 3.49Å
443	P	51.4	Low	42.7	Very low	12 Å²	12	64.7 Å²	64.7	8%	0.078	35%	0.351	C	S	.	.			trans	-51.3	138.1	172.3	-25.8	30.4	0	0	0	112.7	K441 Y445 I446 S447	K441-P443 WeakPolarHBondContact O-CD 3.06Å; P443-Y445 HydrophobicContact CB-CD1 3.75Å; P443-Y445 HydrophobicContact CB-CE1 3.19Å; P443-Y445 HydrophobicContact CB-CE2 4.19Å; P443-Y445 HydrophobicContact CB-CG 4.45Å; P443-Y445 VanDerWaalsContact CB-CZ 3.45Å; P443-Y445 HydrophobicContact CG-CE1 4.12Å; P443-Y445 PolarHBondContact O-N 2.97Å; P443-Y445 VanDerWaalsContact O-N 3.12Å; P443-I446 HydrophobicContact CB-CD1 4.47Å; P443-I446 HydrophobicContact CG-CD1 4.16Å; P443-I446 PolarHBondContact O-N 2.84Å; P443-S447 PolarHBondContact O-N 3.2Å
444	E	49.3	Very low	43	Very low	84 Å²	84	67.8 Å²	67.8	39%	0.393	35%	0.353	S	S	.	.	H	α-helix	trans	-54.7	-35.1	-174.3	-73.8	-177.4	162.1	0	0	113.2	I446 S447 D448	E444-I446 PolarHBondContact O-N 3.4Å; E444-S447 CarbonylContact O-C 3.55Å; E444-S447 WeakPolarHBondContact O-CA 2.98Å; E444-S447 VanDerWaalsContact O-CB 3.24Å; E444-S447 WeakPolarHBondContact O-CB 3.45Å; E444-S447 PolarHBondContact O-N 2.86Å; E444-S447 VanDerWaalsContact O-N 3.08Å; E444-D448 PolarHBondContact O-N 3.47Å
445	Y	53.9	Low	43.5	Very low	24 Å²	24	63.6 Å²	63.6	9%	0.094	34%	0.335	C	S	.	.	H	α-helix	trans	-70.5	-26.3	178.7	61.4	-96	0	0	0	114	I399 L425 N429 P443 S447 D448 L449	I399-Y445 HydrophobicContact CD1-CD1 3.81Å; I399-Y445 HydrophobicContact CD1-CD2 3.35Å; I399-Y445 HydrophobicContact CD1-CE1 3.89Å; I399-Y445 HydrophobicContact CD1-CE2 3.46Å; I399-Y445 VanDerWaalsContact CD1-CE2 3.46Å; I399-Y445 HydrophobicContact CD1-CG 3.53Å; I399-Y445 HydrophobicContact CG1-CD1 3.66Å; I399-Y445 HydrophobicContact CG1-CD2 4.03Å; I399-Y445 HydrophobicContact CG1-CE1 3.4Å; I399-Y445 HydrophobicContact CG1-CE2 3.8Å; I399-Y445 HydrophobicContact CG1-CG 3.95Å; I399-Y445 VanDerWaalsContact CG1-CZ 3.46Å; L425-Y445 HydrophobicContact CD1-CE2 4.47Å; L425-Y445 HydrophobicContact CD2-CE2 4.19Å; N429-Y445 PolarHBondContact ND2-OH 3.27Å; N429-Y445 PolarHBondContact OD1-OH 2.88Å; P443-Y445 HydrophobicContact CB-CD1 3.75Å; P443-Y445 HydrophobicContact CB-CE1 3.19Å; P443-Y445 HydrophobicContact CB-CE2 4.19Å; P443-Y445 HydrophobicContact CB-CG 4.45Å; P443-Y445 VanDerWaalsContact CB-CZ 3.45Å; P443-Y445 HydrophobicContact CG-CE1 4.12Å; P443-Y445 PolarHBondContact O-N 2.97Å; P443-Y445 VanDerWaalsContact O-N 3.12Å; Y445-S447 VanDerWaalsContact C-N 3.31Å; Y445-D448 PolarHBondContact O-N 3.5Å; Y445-L449 WeakPolarHBondContact O-CB 3.13Å; Y445-L449 PolarHBondContact O-N 2.84Å
446	I	53.3	Low	43.5	Very low	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-69.6	-38.6	170.2	-71.4	164.9	0	0	0	108.5	M168 I422 L425 L426 I442 P443 E444 D448 L449 L450	M168-I446 HydrophobicContact CE-CG2 4.42Å; I422-I446 HydrophobicContact CG2-CG2 4.24Å; L425-I446 HydrophobicContact CB-CD1 4.06Å; L425-I446 HydrophobicContact CB-CG1 4.18Å; L425-I446 HydrophobicContact CD1-CG1 4.15Å; L426-I446 HydrophobicContact CD2-CD1 3.84Å; L426-I446 HydrophobicContact CG-CD1 4.25Å; I442-I446 HydrophobicContact CG2-CB 3.54Å; I442-I446 HydrophobicContact CG2-CD1 4.24Å; I442-I446 HydrophobicContact CG2-CG1 4.48Å; I442-I446 HydrophobicContact CG2-CG2 3.49Å; I442-I446 VanDerWaalsContact CG2-CG2 3.49Å; P443-I446 HydrophobicContact CB-CD1 4.47Å; P443-I446 HydrophobicContact CG-CD1 4.16Å; P443-I446 PolarHBondContact O-N 2.84Å; E444-I446 PolarHBondContact O-N 3.4Å; I446-D448 VanDerWaalsContact C-N 3.27Å; I446-D448 PolarHBondContact O-N 2.91Å; I446-L449 PolarHBondContact O-N 3.44Å; I446-L450 HydrophobicContact CG2-CD1 4.07Å; I446-L450 WeakPolarHBondContact O-CB 2.76Å; I446-L450 WeakPolarHBondContact O-CD1 3.49Å; I446-L450 WeakPolarHBondContact O-CG 3.39Å; I446-L450 PolarHBondContact O-N 3.39Å
447	S	53.2	Low	43.7	Very low	4 Å²	4	61.7 Å²	61.7	3%	0.028	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-35.6	170.3	175.5	0	0	0	0	111.4	K175 P443 E444 Y445 L450 N451	K175-S447 PolarHBondContact NZ-OG 3.47Å; P443-S447 PolarHBondContact O-N 3.2Å; E444-S447 CarbonylContact O-C 3.55Å; E444-S447 WeakPolarHBondContact O-CA 2.98Å; E444-S447 VanDerWaalsContact O-CB 3.24Å; E444-S447 WeakPolarHBondContact O-CB 3.45Å; E444-S447 PolarHBondContact O-N 2.86Å; E444-S447 VanDerWaalsContact O-N 3.08Å; Y445-S447 VanDerWaalsContact C-N 3.31Å; S447-L450 CarbonylContact O-C 3.59Å; S447-L450 WeakPolarHBondContact O-CB 3.08Å; S447-L450 PolarHBondContact O-N 2.86Å; S447-N451 WeakPolarHBondContact O-CB 3.31Å; S447-N451 PolarHBondContact O-N 3.16Å; S447-N451 PolarHBondContact O-ND2 2.9Å; S447-N451 PolarHBondContact O-OD1 3.02Å
448	D	53.8	Low	43.5	Very low	48 Å²	48	62.6 Å²	62.6	26%	0.257	32%	0.315	S	S	.	.	H	α-helix	trans	-74.3	-37.6	177.5	-64.3	-28.7	0	0	0	113.1	E444 Y445 I446 L450 N451 L452	E444-D448 PolarHBondContact O-N 3.47Å; Y445-D448 PolarHBondContact O-N 3.5Å; I446-D448 VanDerWaalsContact C-N 3.27Å; I446-D448 PolarHBondContact O-N 2.91Å; D448-L450 PolarHBondContact O-N 3.38Å; D448-N451 CarbonylContact O-C 3.57Å; D448-N451 WeakPolarHBondContact O-CA 3.44Å; D448-N451 WeakPolarHBondContact O-CB 3.49Å; D448-N451 PolarHBondContact O-N 3.06Å; D448-N451 PolarHBondContact OD1-ND2 3.45Å; D448-L452 PolarHBondContact O-N 3.42Å; D448-L452 VanDerWaalsContact O-N 3.11Å
449	L	54.5	Low	43.7	Very low	10 Å²	10	60.4 Å²	60.4	5%	0.052	30%	0.3	C	S	.	.	H	α-helix	trans	-62.9	-35.6	171.8	-144.8	157.9	0	0	0	110.4	L411 L418 L425 Y445 I446 L452	L411-L449 HydrophobicContact CD1-CD1 4.21Å; L411-L449 HydrophobicContact CD2-CD2 4.03Å; L418-L449 HydrophobicContact CD1-CD2 3.32Å; L425-L449 HydrophobicContact CD1-CD1 3.71Å; Y445-L449 WeakPolarHBondContact O-CB 3.13Å; Y445-L449 PolarHBondContact O-N 2.84Å; I446-L449 PolarHBondContact O-N 3.44Å; L449-L452 HydrophobicContact CB-CD1 4.48Å; L449-L452 HydrophobicContact CD2-CD1 3.89Å; L449-L452 HydrophobicContact CG-CD1 3.91Å; L449-L452 VanDerWaalsContact O-CB 3.28Å; L449-L452 WeakPolarHBondContact O-CB 3.43Å; L449-L452 VanDerWaalsContact O-CD1 3.32Å; L449-L452 WeakPolarHBondContact O-CD1 3.34Å; L449-L452 VanDerWaalsContact O-CG 3.24Å; L449-L452 WeakPolarHBondContact O-CG 3.19Å; L449-L452 PolarHBondContact O-N 3.4Å
450	L	51.8	Low	43.5	Very low	7 Å²	7	62.2 Å²	62.2	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-72.4	-29.4	170.2	-71.6	168.3	0	0	0	113.4	Q169 T180 I422 I446 S447 D448 L452	Q169-L450 HydrophobicContact CG-CD1 3.84Å; T180-L450 HydrophobicContact CG2-CB 4.39Å; I422-L450 HydrophobicContact CD1-CD2 3.51Å; I422-L450 HydrophobicContact CD1-CG 4.19Å; I446-L450 HydrophobicContact CG2-CD1 4.07Å; I446-L450 WeakPolarHBondContact O-CB 2.76Å; I446-L450 WeakPolarHBondContact O-CD1 3.49Å; I446-L450 WeakPolarHBondContact O-CG 3.39Å; I446-L450 PolarHBondContact O-N 3.39Å; S447-L450 CarbonylContact O-C 3.59Å; S447-L450 WeakPolarHBondContact O-CB 3.08Å; S447-L450 PolarHBondContact O-N 2.86Å; D448-L450 PolarHBondContact O-N 3.38Å; L450-L452 PolarHBondContact O-N 3.1Å
451	N	52.1	Low	43	Very low	35 Å²	35	60.2 Å²	60.2	19%	0.187	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-75.5	-6	173.5	-66	-35	0	0	0	112.9	S447 D448 Y453 R454	S447-N451 WeakPolarHBondContact O-CB 3.31Å; S447-N451 PolarHBondContact O-N 3.16Å; S447-N451 PolarHBondContact O-ND2 2.9Å; S447-N451 PolarHBondContact O-OD1 3.02Å; D448-N451 CarbonylContact O-C 3.57Å; D448-N451 WeakPolarHBondContact O-CA 3.44Å; D448-N451 WeakPolarHBondContact O-CB 3.49Å; D448-N451 PolarHBondContact O-N 3.06Å; D448-N451 PolarHBondContact OD1-ND2 3.45Å; N451-Y453 PolarHBondContact O-N 3.22Å; N451-R454 PolarHBondContact O-N 2.84Å
452	L	47.6	Very low	42.4	Very low	9 Å²	9	59.5 Å²	59.5	5%	0.047	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-58.6	-8.5	172.2	-65.8	170.5	0	0	0	112.9	D448 L449 L450 L527 L529 W541	D448-L452 PolarHBondContact O-N 3.42Å; D448-L452 VanDerWaalsContact O-N 3.11Å; L449-L452 HydrophobicContact CB-CD1 4.48Å; L449-L452 HydrophobicContact CD2-CD1 3.89Å; L449-L452 HydrophobicContact CG-CD1 3.91Å; L449-L452 VanDerWaalsContact O-CB 3.28Å; L449-L452 WeakPolarHBondContact O-CB 3.43Å; L449-L452 VanDerWaalsContact O-CD1 3.32Å; L449-L452 WeakPolarHBondContact O-CD1 3.34Å; L449-L452 VanDerWaalsContact O-CG 3.24Å; L449-L452 WeakPolarHBondContact O-CG 3.19Å; L449-L452 PolarHBondContact O-N 3.4Å; L450-L452 PolarHBondContact O-N 3.1Å; L452-L527 HydrophobicContact CB-CD1 4.07Å; L452-L527 HydrophobicContact CD2-CB 4.46Å; L452-L527 HydrophobicContact CD2-CD1 3.71Å; L452-L527 HydrophobicContact CG-CD1 4.49Å; L452-L527 VanDerWaalsContact O-CD1 3.32Å; L452-L527 WeakPolarHBondContact O-CD1 3.28Å; L452-L529 HydrophobicContact CD2-CD1 4Å; L452-W541 HydrophobicContact CB-CZ2 3.9Å; L452-W541 HydrophobicContact CD1-CH2 4.26Å; L452-W541 HydrophobicContact CD1-CZ2 4.13Å
453	Y	46.6	Very low	41.5	Very low	9 Å²	9	64.9 Å²	64.9	4%	0.035	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-98.2	25	178.4	-89.9	-69.1	0	0	0	115.5	L181 C317 L418 N451 F455 W541 W543	L181-Y453 HydrophobicContact CB-CD1 4.03Å; L181-Y453 HydrophobicContact CB-CG 3.83Å; L181-Y453 HydrophobicContact CD1-CD1 3.84Å; L181-Y453 HydrophobicContact CD1-CG 4.2Å; L181-Y453 WeakPolarHBondContact CD1-O 3.43Å; L181-Y453 HydrophobicContact CG-CD1 4.45Å; L181-Y453 HydrophobicContact CG-CG 4.39Å; C317-Y453 WeakPolarHBondContact CB-OH 3.41Å; C317-Y453 PolarHBondContact SG-OH 3.11Å; L418-Y453 HydrophobicContact CD2-CD2 4.38Å; L418-Y453 HydrophobicContact CD2-CE2 3.66Å; N451-Y453 PolarHBondContact O-N 3.22Å; Y453-F455 VanDerWaalsContact C-N 3.31Å; Y453-F455 PolarHBondContact O-N 2.67Å; Y453-W541 HydrophobicContact CE1-CB 4.42Å; Y453-W541 HydrophobicContact CE1-CD2 4.17Å; Y453-W541 AromaticContact CE1-CG 3.99Å; Y453-W541 HydrophobicContact CE1-CG 3.99Å; Y453-W541 HydrophobicContact CE2-CD2 4.18Å; Y453-W541 HydrophobicContact CE2-CE3 4.22Å; Y453-W541 HydrophobicContact CE2-CH2 4.22Å; Y453-W541 HydrophobicContact CE2-CZ2 4.21Å; Y453-W541 HydrophobicContact CE2-CZ3 4.23Å; Y453-W541 AromaticContact CZ-CD2 3.62Å; Y453-W541 AromaticContact CZ-CE2 3.94Å; Y453-W541 AromaticContact CZ-CE3 3.86Å; Y453-W541 AromaticContact CZ-CG 3.89Å; Y453-W543 HydrophobicContact CE1-CH2 4.21Å; Y453-W543 AromaticContact CE1-CZ2 3.77Å; Y453-W543 HydrophobicContact CE1-CZ2 3.77Å
454	R	37.2	Very low	40.4	Very low	148 Å²	148	70.1 Å²	70.1	56%	0.558	34%	0.341	S	S	*	.			trans	-65.3	98.6	164.9	-87.3	-162.7	177	-168.3	-2.4	109.7	N451 D456	N451-R454 PolarHBondContact O-N 2.84Å; R454-D456 PolarHBondContact O-N 2.64Å
455	F	36.7	Very low	39.4	Very low	99 Å²	99	69.3 Å²	69.3	43%	0.434	35%	0.345	S	S	.	.			trans	-69.9	113.3	142.7	-97.9	-93.5	0	0	0	106.5	L181 Y453 E457 T522	L181-F455 HydrophobicContact CD1-CD2 4.08Å; Y453-F455 VanDerWaalsContact C-N 3.31Å; Y453-F455 PolarHBondContact O-N 2.67Å; F455-E457 PolarHBondContact O-N 3.33Å; F455-T522 HydrophobicContact CE1-CG2 3.46Å; F455-T522 VanDerWaalsContact CE1-CG2 3.46Å; F455-T522 VanDerWaalsContact CZ-CB 3.43Å; F455-T522 HydrophobicContact CZ-CG2 3.79Å; F455-T522 VanDerWaalsContact CZ-OG1 3.23Å; F455-T522 WeakPolarHBondContact CZ-OG1 3.35Å
456	D	31.2	Very low	38.2	Very low	61 Å²	61	76.3 Å²	76.3	33%	0.326	37%	0.372	S	S	.	.			trans	-57.5	123.8	169.5	-74.6	-43.7	0	0	0	109	R454 E458 C459	R454-D456 PolarHBondContact O-N 2.64Å; D456-E458 HydrophobicContact CB-CB 4.3Å; D456-E458 PolarHBondContact O-N 2.98Å; D456-C459 PolarHBondContact O-N 3.03Å
457	E	30.1	Very low	37	Very low	163 Å²	163	80 Å²	80	76%	0.762	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-12.1	170	-75.4	-157	158.2	0	0	112.1	F455 C459 L460 G461	F455-E457 PolarHBondContact O-N 3.33Å; E457-C459 PolarHBondContact O-N 3.37Å; E457-L460 PolarHBondContact O-N 2.85Å; E457-L460 VanDerWaalsContact O-N 3.13Å; E457-G461 PolarHBondContact O-N 3.32Å
458	E	28.9	Very low	35.9	Very low	143 Å²	143	86 Å²	86	67%	0.668	43%	0.43	S	S	*	.	H	α-helix	trans	-61	-25.7	170.2	-65.5	-164.5	175	0	0	112.9	D456 G461 R462	D456-E458 HydrophobicContact CB-CB 4.3Å; D456-E458 PolarHBondContact O-N 2.98Å; E458-G461 PolarHBondContact O-N 3.4Å; E458-R462 PolarHBondContact O-N 2.88Å
459	C	29.8	Very low	34.7	Very low	66 Å²	66	93 Å²	93	45%	0.446	45%	0.452	S	S	.	.	H	α-helix	trans	-72.9	-29.7	174.7	-76.1	0	0	0	0	113	D456 E457 Q463	D456-C459 PolarHBondContact O-N 3.03Å; E457-C459 PolarHBondContact O-N 3.37Å; C459-Q463 WeakPolarHBondContact O-CB 3.31Å; C459-Q463 WeakPolarHBondContact O-CG 3.44Å; C459-Q463 PolarHBondContact O-N 3.07Å
460	L	28.4	Very low	33.4	Very low	101 Å²	101	98.4 Å²	98.4	53%	0.529	48%	0.481	S	S	.	.	H	α-helix	trans	-71.6	-35	169.2	-79.4	163.4	0	0	0	110.9	E457 R462 Q463 I464	E457-L460 PolarHBondContact O-N 2.85Å; E457-L460 VanDerWaalsContact O-N 3.13Å; L460-R462 VanDerWaalsContact C-N 3.34Å; L460-R462 PolarHBondContact O-N 2.77Å; L460-Q463 PolarHBondContact O-N 2.92Å; L460-I464 WeakPolarHBondContact O-CD1 3.06Å; L460-I464 VanDerWaalsContact O-CG1 3.24Å; L460-I464 WeakPolarHBondContact O-CG1 3.37Å; L460-I464 PolarHBondContact O-N 2.9Å
461	G	25	Very low	32.4	Very low	46 Å²	46	103.4 Å²	103.4	47%	0.474	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-37.3	173	0	0	0	0	0	113.5	E457 E458 S465	E457-G461 PolarHBondContact O-N 3.32Å; E458-G461 PolarHBondContact O-N 3.4Å; G461-S465 PolarHBondContact O-N 2.74Å
462	R	27.5	Very low	31.2	Very low	173 Å²	173	105.4 Å²	105.4	65%	0.653	52%	0.524	S	S	*	.	H	α-helix	trans	-82.1	-27.6	175.8	-71.8	-173	-173.3	173.9	7.1	113.9	E458 L460 S465 Y466	E458-R462 PolarHBondContact O-N 2.88Å; L460-R462 VanDerWaalsContact C-N 3.34Å; L460-R462 PolarHBondContact O-N 2.77Å; R462-S465 PolarHBondContact O-N 3.14Å; R462-S465 PolarHBondContact O-OG 3.29Å; R462-Y466 PolarHBondContact O-N 2.96Å
463	Q	28.8	Very low	30.3	Very low	120 Å²	120	111.7 Å²	111.7	56%	0.561	56%	0.557	S	S	*	*	H	α-helix	trans	-70.8	-31.8	170.7	-78.9	-176.7	-6.1	0	0	112.2	C459 L460 S465 C467	C459-Q463 WeakPolarHBondContact O-CB 3.31Å; C459-Q463 WeakPolarHBondContact O-CG 3.44Å; C459-Q463 PolarHBondContact O-N 3.07Å; L460-Q463 PolarHBondContact O-N 2.92Å; Q463-S465 VanDerWaalsContact C-N 3.33Å; Q463-C467 VanDerWaalsContact O-CB 3.3Å; Q463-C467 WeakPolarHBondContact O-CB 3.38Å; Q463-C467 PolarHBondContact O-N 3.43Å; Q463-C467 VanDerWaalsContact O-N 3.1Å; Q463-C467 PolarHBondContact O-SG 3.27Å
464	I	29	Very low	29.5	Very low	122 Å²	122	119.9 Å²	119.9	63%	0.626	59%	0.593	S	S	*	*	H	α-helix	trans	-69.6	-30.6	172.9	-65.4	163.2	0	0	0	111.2	L460	L460-I464 WeakPolarHBondContact O-CD1 3.06Å; L460-I464 VanDerWaalsContact O-CG1 3.24Å; L460-I464 WeakPolarHBondContact O-CG1 3.37Å; L460-I464 PolarHBondContact O-N 2.9Å
465	S	28.5	Very low	28.8	Very low	68 Å²	68	118.6 Å²	118.6	48%	0.476	60%	0.598	S	S	.	*	H	α-helix	trans	-86.7	-23.7	178.6	77.7	0	0	0	0	115.2	G461 R462 Q463	G461-S465 PolarHBondContact O-N 2.74Å; R462-S465 PolarHBondContact O-N 3.14Å; R462-S465 PolarHBondContact O-OG 3.29Å; Q463-S465 VanDerWaalsContact C-N 3.33Å
466	Y	27.8	Very low	28.3	Very low	170 Å²	170	123 Å²	123	67%	0.667	62%	0.616	S	S	*	*	H	α-helix	trans	-91.4	-23.5	176.4	-92.5	-86.9	0	0	0	114.1	R462 D468	R462-Y466 PolarHBondContact O-N 2.96Å; Y466-D468 PolarHBondContact O-N 3.33Å
467	C	28.6	Very low	28	Very low	79 Å²	79	125.7 Å²	125.7	53%	0.534	64%	0.635	S	S	.	*	H	α-helix	trans	-71.3	-14.6	171.7	-72.9	0	0	0	0	113.6	Q463	Q463-C467 VanDerWaalsContact O-CB 3.3Å; Q463-C467 WeakPolarHBondContact O-CB 3.38Å; Q463-C467 PolarHBondContact O-N 3.43Å; Q463-C467 VanDerWaalsContact O-N 3.1Å; Q463-C467 PolarHBondContact O-SG 3.27Å
468	D	29.1	Very low	27.8	Very low	130 Å²	130	126.8 Å²	126.8	70%	0.695	64%	0.637	S	S	*	*	H	α-helix	trans	-84.5	-9.1	178.4	-95.1	-10.4	0	0	0	114.8	Y466	Y466-D468 PolarHBondContact O-N 3.33Å
469	R	29.3	Very low	27.6	Very low	194 Å²	194	125.9 Å²	125.9	73%	0.732	64%	0.642	S	S	*	*	H	α-helix	trans	-95.3	-30.3	177.6	-73.9	-168	-178.4	-172.8	2.1	114.6	S472	R469-S472 PolarHBondContact O-OG 3.14Å
470	D	28	Very low	27.3	Very low	123 Å²	123	128.5 Å²	128.5	66%	0.658	66%	0.661	S	S	*	*	H	α-helix	trans	-98.7	-4.4	-173.8	-67.3	-25.3	0	0	0	115.1	S472	D470-S472 PolarHBondContact O-N 3.06Å
471	L	29.3	Very low	27	Very low	112 Å²	112	126.6 Å²	126.6	59%	0.586	67%	0.666	S	S	*	*	H	α-helix	trans	-76.5	-8.2	167.7	-83.9	162.3	0	0	0	113.7
472	S	27.9	Very low	27.1	Very low	77 Å²	77	129.8 Å²	129.8	54%	0.538	68%	0.681	S	S	.	*	H	α-helix	trans	-84.1	-15.5	-178.5	70.7	0	0	0	0	114.7	R469 D470	R469-S472 PolarHBondContact O-OG 3.14Å; D470-S472 PolarHBondContact O-N 3.06Å
473	L	29.3	Very low	26.9	Very low	142 Å²	142	131.5 Å²	131.5	74%	0.743	69%	0.693	S	S	*	*	H	α-helix	trans	-98.8	-19.1	179.2	-90.9	126.3	0	0	0	114.4
474	F	28.3	Very low	26.6	Very low	180 Å²	180	130.4 Å²	130.4	79%	0.789	70%	0.699	S	S	*	*	H	α-helix	trans	-101	-3.1	-179.3	-95.7	-80.5	0	0	0	116.1
475	N	24.2	Very low	26.3	Very low	122 Å²	122	134.9 Å²	134.9	65%	0.652	71%	0.714	S	S	*	*			trans	-127.1	38	177.1	-80.5	-28.3	0	0	0	114.4	T477	N475-T477 VanDerWaalsContact C-N 3.28Å
476	K	24.6	Very low	25.9	Very low	191 Å²	191	137 Å²	137	83%	0.83	73%	0.729	S	S	*	*			trans	-86.4	8.9	160.6	-93.1	-176.3	179.3	175.2	0	114	K478	K476-K478 PolarHBondContact O-N 2.97Å
477	T	26.6	Very low	25.7	Very low	117 Å²	117	134.3 Å²	134.3	72%	0.718	73%	0.732	S	S	*	*	S	Bend	trans	-83.1	94.8	163.3	48.4	0	0	0	0	109.8	N475	N475-T477 VanDerWaalsContact C-N 3.28Å
478	K	24.8	Very low	25.3	Very low	186 Å²	186	137.7 Å²	137.7	81%	0.809	75%	0.745	S	S	*	*			trans	4.4	114.8	157.2	-71.5	174.5	175	176.9	0	117.2	K476	K476-K478 PolarHBondContact O-N 2.97Å
479	T	24.9	Very low	25.1	Very low	124 Å²	124	140.2 Å²	140.2	76%	0.761	75%	0.753	S	S	*	*			trans	70.1	115.1	132.6	60.7	0	0	0	0	120.1
480	S	23.9	Very low	24.8	Very low	121 Å²	121	136.4 Å²	136.4	85%	0.846	75%	0.751	S	S	*	*			trans	55.2	93.4	139.3	61	0	0	0	0	117.7
481	G	22.3	Very low	24.4	Very low	61 Å²	61	137.2 Å²	137.2	63%	0.629	76%	0.756	S	S	*	*			trans	-156.9	72.2	164	0	0	0	0	0	109.5	F483	G481-F483 WeakPolarHBondContact O-CD2 3.48Å; G481-F483 PolarHBondContact O-N 3.08Å
482	S	26.4	Very low	24.1	Very low	113 Å²	113	140.8 Å²	140.8	79%	0.79	77%	0.767	S	S	*	*			trans	-60.6	103.5	166.7	39	0	0	0	0	108.9	S484	S482-S484 VanDerWaalsContact C-N 3.33Å; S482-S484 PolarHBondContact O-N 3.4Å
483	F	24.2	Very low	23.7	Very low	209 Å²	209	141.9 Å²	141.9	92%	0.917	77%	0.77	S	S	*	*			trans	-70.5	87.8	170.7	-83.6	-91	0	0	0	109.6	G481	G481-F483 WeakPolarHBondContact O-CD2 3.48Å; G481-F483 PolarHBondContact O-N 3.08Å
484	S	22.8	Very low	23.3	Very low	97 Å²	97	141.4 Å²	141.4	68%	0.678	77%	0.767	S	S	*	*			trans	-113.9	119.6	158.2	55.1	0	0	0	0	107.7	S482 S486	S482-S484 VanDerWaalsContact C-N 3.33Å; S482-S484 PolarHBondContact O-N 3.4Å; S484-S486 PolarHBondContact O-N 3.23Å; S484-S486 VanDerWaalsContact O-N 3.15Å
485	F	20.9	Very low	23.1	Very low	216 Å²	216	140 Å²	140	95%	0.947	76%	0.763	S	S	*	*			trans	-55.4	114.9	174.5	-84.6	-95.1	0	0	0	110.6
486	S	21.3	Very low	23.1	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	76%	0.762	S	S	*	*			trans	-136.1	135.9	153.5	-91.1	0	0	0	0	108.8	S484	S484-S486 PolarHBondContact O-N 3.23Å; S484-S486 VanDerWaalsContact O-N 3.15Å
487	P	23.9	Very low	23.1	Very low	114 Å²	114	136.5 Å²	136.5	74%	0.74	75%	0.753	S	S	*	*			trans	-85.4	143.7	-173	34	-31.8	0	0	0	111.9
488	D	20	Very low	23.1	Very low	151 Å²	151	137 Å²	137	81%	0.807	75%	0.752	S	S	*	*			trans	54	103.6	152.6	-56.9	-21.2	0	0	0	119.6
489	E	24.6	Very low	23.4	Very low	182 Å²	182	135.6 Å²	135.6	85%	0.85	75%	0.753	S	S	*	*			trans	-152	112.4	132	-82.3	-149.2	154.9	0	0	111.2
490	T	23.2	Very low	23.3	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	75%	0.754	S	S	*	*			trans	49.3	116.2	138	61	0	0	0	0	122
491	N	18.9	Very low	23.5	Very low	141 Å²	141	138.1 Å²	138.1	75%	0.754	76%	0.755	S	S	*	*				36.6	118.4	129.9	-63.4	-17.7	0	0	0	119.4
492	F	22.5	Very low	23.8	Very low	187 Å²	187	141.1 Å²	141.1	82%	0.82	76%	0.761	S	S	*	*				179.4	114.2	110.3	-104.6	-83.8	0	0	0	111.1
493	T	20.2	Very low	23.7	Very low	99 Å²	99	142.9 Å²	142.9	61%	0.607	77%	0.767	S	S	*	*			trans	56.9	118.3	133.2	56.6	0	0	0	0	124.2
494	I	22	Very low	23.8	Very low	132 Å²	132	141.7 Å²	141.7	68%	0.677	76%	0.764	S	S	*	*				70.7	111.4	122.9	-49.4	165.5	0	0	0	117.8
495	H	23.3	Very low	23.9	Very low	151 Å²	151	145.7 Å²	145.7	70%	0.699	77%	0.772	S	S	*	*				173.1	134.6	96.1	-114.8	-52.1	0	0	0	112
496	N	25	Very low	24.2	Very low	120 Å²	120	142.9 Å²	142.9	64%	0.642	77%	0.766	S	S	*	*			trans	64.6	145.6	139.6	-73.6	-0.8	0	0	0	119.2
497	N	23.4	Very low	24.4	Very low	120 Å²	120	144 Å²	144	64%	0.642	76%	0.761	S	S	*	*			cis	-177.2	154	-16.2	-123.2	-6.4	0	0	0	103.1
498	N	25.9	Very low	24.5	Very low	128 Å²	128	144.4 Å²	144.4	68%	0.684	76%	0.761	S	S	*	*			trans	70.4	95.3	155.6	-53.7	-10.1	0	0	0	117.2
499	N	32.1	Very low	24.7	Very low	156 Å²	156	144.7 Å²	144.7	83%	0.834	76%	0.758	S	S	*	*				-178.5	116.4	94.2	-88.6	-19.9	0	0	0	110.5
500	S	23.5	Very low	24.8	Very low	113 Å²	113	142.7 Å²	142.7	79%	0.79	75%	0.753	S	S	*	*			trans	-60.7	125.8	165.1	48.8	0	0	0	0	111.3
501	Q	28.2	Very low	24.9	Very low	184 Å²	184	148.5 Å²	148.5	86%	0.86	76%	0.762	S	S	*	*			trans	-157.9	95	146.4	-112.8	160.3	1.2	0	0	110.9
502	T	27.3	Very low	25.2	Very low	125 Å²	125	148.8 Å²	148.8	77%	0.767	76%	0.762	S	S	*	*			trans	40.4	101.1	138.6	54.9	0	0	0	0	118.5
503	V	24.2	Very low	25.5	Very low	149 Å²	149	151 Å²	151	90%	0.903	77%	0.765	S	S	*	*			trans	-64.5	113.9	158.2	177.1	0	0	0	0	108.7
504	E	27.5	Very low	25.7	Very low	184 Å²	184	150.9 Å²	150.9	86%	0.86	77%	0.768	S	S	*	*			trans	-117.8	139.1	163.9	-88.6	-173.8	169.5	0	0	110.3
505	E	25	Very low	25.8	Very low	182 Å²	182	154.1 Å²	154.1	85%	0.85	78%	0.777	S	S	*	*			trans	-63.9	139.4	-154.8	-77.6	168.1	127.6	0	0	116.1	I507	E505-I507 PolarHBondContact O-N 3.18Å; E505-I507 VanDerWaalsContact O-N 3.08Å
506	I	25.9	Very low	26.1	Very low	157 Å²	157	150.7 Å²	150.7	81%	0.805	77%	0.768	S	S	*	*			trans	-73.5	93	173	-59	161.6	0	0	0	108.4	V508	I506-V508 HydrophobicContact CG2-CG2 4.12Å; I506-V508 PolarHBondContact O-N 2.96Å
507	I	26.4	Very low	26.1	Very low	136 Å²	136	153.6 Å²	153.6	70%	0.697	78%	0.778	S	S	*	*			trans	-77.3	105.8	162.9	-60.7	176.3	0	0	0	107	E505 H509	E505-I507 PolarHBondContact O-N 3.18Å; E505-I507 VanDerWaalsContact O-N 3.08Å; I507-H509 VanDerWaalsContact C-N 3.28Å; I507-H509 PolarHBondContact O-N 3.41Å
508	V	25.9	Very low	26.5	Very low	122 Å²	122	152.7 Å²	152.7	74%	0.739	78%	0.781	S	S	*	*			trans	-66	85.4	176.2	-178.2	0	0	0	0	108.5	I506 D510	I506-V508 HydrophobicContact CG2-CG2 4.12Å; I506-V508 PolarHBondContact O-N 2.96Å; V508-D510 PolarHBondContact O-N 3.49Å
509	H	24.7	Very low	26.7	Very low	157 Å²	157	153.5 Å²	153.5	73%	0.727	79%	0.786	S	S	*	*			trans	-65.7	127.8	156.9	-78.6	-66.7	0	0	0	107.4	I507 R511	I507-H509 VanDerWaalsContact C-N 3.28Å; I507-H509 PolarHBondContact O-N 3.41Å; H509-R511 PolarHBondContact O-N 3.47Å
510	D	25.8	Very low	26.3	Very low	140 Å²	140	153.3 Å²	153.3	75%	0.749	78%	0.782	S	S	*	*			trans	-33.6	126.6	160.7	-73.4	-43	0	0	0	108.3	V508 I512	V508-D510 PolarHBondContact O-N 3.49Å; D510-I512 PolarHBondContact O-N 3.07Å
511	R	25.2	Very low	26.4	Very low	235 Å²	235	151.3 Å²	151.3	89%	0.887	77%	0.765	S	S	*	*			trans	-64.6	70.2	176.7	-70.7	-179.6	-173.2	169.8	1.4	109.2	H509 W513	H509-R511 PolarHBondContact O-N 3.47Å; R511-W513 VanDerWaalsContact C-N 3.3Å; R511-W513 PolarHBondContact O-N 2.58Å
512	I	25.4	Very low	26.3	Very low	147 Å²	147	146.6 Å²	146.6	75%	0.754	75%	0.748	S	S	*	*			trans	-56.3	108.7	147.6	-58.5	171.5	0	0	0	101.8	D510 S514	D510-I512 PolarHBondContact O-N 3.07Å; I512-S514 PolarHBondContact O-N 2.82Å
513	W	28.8	Very low	26.2	Very low	233 Å²	233	149 Å²	149	88%	0.883	75%	0.749	S	S	*	*			trans	-49.7	100.1	170.2	-67.3	80.1	0	0	0	105.7	R511 K515	R511-W513 VanDerWaalsContact C-N 3.3Å; R511-W513 PolarHBondContact O-N 2.58Å; W513-K515 PolarHBondContact O-N 3.22Å
514	S	24.5	Very low	26.3	Very low	98 Å²	98	144.3 Å²	144.3	69%	0.685	72%	0.72	S	S	*	*			trans	-53.1	133.5	-179.7	47.1	0	0	0	0	106.1	I512 P516	I512-S514 PolarHBondContact O-N 2.82Å; S514-P516 WeakPolarHBondContact O-CD 3.44Å
515	K	23.4	Very low	26.3	Very low	199 Å²	199	142.2 Å²	142.2	87%	0.865	71%	0.71	S	S	*	*			trans	-27.4	105.7	173	-89.6	179.7	170.4	177.4	0	109.2	W513 E517	W513-K515 PolarHBondContact O-N 3.22Å; K515-E517 PolarHBondContact O-N 2.9Å; K515-E517 VanDerWaalsContact O-N 3.15Å
516	P	29.9	Very low	26.4	Very low	79 Å²	79	138.1 Å²	138.1	51%	0.513	70%	0.7	S	S	.	*			trans	-69.5	123.1	-173.2	23	-28.6	0	0	0	107	S514 S518 M520	S514-P516 WeakPolarHBondContact O-CD 3.44Å; P516-S518 VanDerWaalsContact C-N 3.32Å; P516-S518 PolarHBondContact O-N 2.8Å; P516-M520 HydrophobicContact CB-CB 3.99Å
517	E	25.6	Very low	26.7	Very low	181 Å²	181	133.7 Å²	133.7	85%	0.846	68%	0.677	S	S	*	*			trans	-54.8	96.9	171.7	-66.7	178.9	159.4	0	0	108.6	K515 N519	K515-E517 PolarHBondContact O-N 2.9Å; K515-E517 VanDerWaalsContact O-N 3.15Å; E517-N519 PolarHBondContact O-N 3.34Å
518	S	30.9	Very low	26.8	Very low	101 Å²	101	133.1 Å²	133.1	71%	0.706	68%	0.676	S	S	*	*	S	Bend	trans	51.5	-12.9	166.8	46.1	0	0	0	0	121.1	P516	P516-S518 VanDerWaalsContact C-N 3.32Å; P516-S518 PolarHBondContact O-N 2.8Å
519	N	30.3	Very low	27.2	Very low	146 Å²	146	129 Å²	129	78%	0.781	65%	0.649	S	S	*	*	S	Bend	trans	-137	15.9	-163.4	-75.5	-20.4	0	0	0	117	E517	E517-N519 PolarHBondContact O-N 3.34Å
520	M	24.2	Very low	27.7	Very low	152 Å²	152	126.4 Å²	126.4	75%	0.749	64%	0.64	S	S	*	*			trans	-115.4	11.3	172.3	-82.2	-130.3	172.4	0	0	115.4	P516 T522	P516-M520 HydrophobicContact CB-CB 3.99Å; M520-T522 PolarHBondContact O-N 3.4Å
521	T	25.5	Very low	28.3	Very low	71 Å²	71	128.9 Å²	128.9	44%	0.436	65%	0.645	S	S	.	*			trans	-77.1	99	159	50.8	0	0	0	0	107.8	F523	T521-F523 WeakPolarHBondContact O-CD2 3.1Å; T521-F523 PolarHBondContact O-N 3.24Å
522	T	25.8	Very low	28.9	Very low	84 Å²	84	120.5 Å²	120.5	52%	0.515	62%	0.617	S	S	.	*			trans	-69.1	99.5	168.1	38.2	0	0	0	0	107.2	F455 M520 V524	F455-T522 HydrophobicContact CE1-CG2 3.46Å; F455-T522 VanDerWaalsContact CE1-CG2 3.46Å; F455-T522 VanDerWaalsContact CZ-CB 3.43Å; F455-T522 HydrophobicContact CZ-CG2 3.79Å; F455-T522 VanDerWaalsContact CZ-OG1 3.23Å; F455-T522 WeakPolarHBondContact CZ-OG1 3.35Å; M520-T522 PolarHBondContact O-N 3.4Å; T522-V524 PolarHBondContact O-N 3.19Å
523	F	24.6	Very low	29.1	Very low	177 Å²	177	120.1 Å²	120.1	78%	0.776	62%	0.616	S	S	*	*			trans	-60.6	107.6	172.2	-67.5	-85	0	0	0	107.8	T521 E525	T521-F523 WeakPolarHBondContact O-CD2 3.1Å; T521-F523 PolarHBondContact O-N 3.24Å; F523-E525 PolarHBondContact O-N 3.09Å
524	V	27.6	Very low	29.6	Very low	49 Å²	49	113.4 Å²	113.4	30%	0.297	59%	0.594	S	S	.	*			trans	-75.5	116.7	156.8	-179.2	0	0	0	0	104.3	T522 L527	T522-V524 PolarHBondContact O-N 3.19Å; V524-L527 HydrophobicContact CG1-CD1 4.03Å; V524-L527 HydrophobicContact CG1-CG 4.49Å
525	E	26.5	Very low	30.3	Very low	141 Å²	141	115.5 Å²	115.5	66%	0.659	60%	0.595	S	S	*	*			trans	-50.2	139.3	170	-79.2	-168	162	0	0	108.7	F523 L527	F523-E525 PolarHBondContact O-N 3.09Å; E525-L527 PolarHBondContact O-N 3.49Å
526	P	28.2	Very low	31.6	Very low	96 Å²	96	107.4 Å²	107.4	62%	0.623	56%	0.562	S	S	*	*			trans	-53.2	113.5	179.9	20.3	-31.1	0	0	0	108.4	N528	P526-N528 PolarHBondContact O-N 3.29Å
527	L	31.4	Very low	32.6	Very low	64 Å²	64	104.4 Å²	104.4	34%	0.335	54%	0.542	S	S	.	.			trans	-55.8	119.2	-176.9	-79.9	126.8	0	0	0	108.1	L452 V524 E525 L529	L452-L527 HydrophobicContact CB-CD1 4.07Å; L452-L527 HydrophobicContact CD2-CB 4.46Å; L452-L527 HydrophobicContact CD2-CD1 3.71Å; L452-L527 HydrophobicContact CG-CD1 4.49Å; L452-L527 VanDerWaalsContact O-CD1 3.32Å; L452-L527 WeakPolarHBondContact O-CD1 3.28Å; V524-L527 HydrophobicContact CG1-CD1 4.03Å; V524-L527 HydrophobicContact CG1-CG 4.49Å; E525-L527 PolarHBondContact O-N 3.49Å; L527-L529 HydrophobicContact CB-CG 4.41Å; L527-L529 PolarHBondContact O-N 3.08Å
528	N	28.6	Very low	34	Very low	124 Å²	124	100.1 Å²	100.1	66%	0.663	53%	0.525	S	S	*	.			trans	-73.9	73.4	-179.2	-151.3	-22.3	0	0	0	108.9	P526 D530	P526-N528 PolarHBondContact O-N 3.29Å; N528-D530 PolarHBondContact O-N 2.78Å; N528-D530 VanDerWaalsContact O-N 3.1Å; N528-D530 WeakPolarHBondContact OD1-CB 3.02Å; N528-D530 PolarHBondContact OD1-OD1 2.89Å; N528-D530 PolarHBondContact OD1-OD2 3Å
529	L	35.6	Very low	35.3	Very low	34 Å²	34	96.8 Å²	96.8	18%	0.178	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-73.2	18.4	172.8	-75.3	163.1	0	0	0	111.4	L452 L527 K531 I532 N533 F534 L536	L452-L529 HydrophobicContact CD2-CD1 4Å; L527-L529 HydrophobicContact CB-CG 4.41Å; L527-L529 PolarHBondContact O-N 3.08Å; L529-K531 PolarHBondContact O-N 2.77Å; L529-I532 CarbonylContact O-C 2.98Å; L529-I532 VanDerWaalsContact O-CA 3.32Å; L529-I532 WeakPolarHBondContact O-CA 3.47Å; L529-I532 PolarHBondContact O-N 3.03Å; L529-N533 PolarHBondContact O-N 3.01Å; L529-N533 VanDerWaalsContact O-N 3.09Å; L529-F534 WeakPolarHBondContact CB-O 3.34Å; L529-L536 HydrophobicContact CD1-CD1 3.15Å; L529-L536 HydrophobicContact CD1-CG 4.44Å
530	D	33.5	Very low	37.1	Very low	103 Å²	103	94.6 Å²	94.6	55%	0.551	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-57.3	-20.6	174.1	-79.5	-0.5	0	0	0	113.2	N528 I532 N533	N528-D530 PolarHBondContact O-N 2.78Å; N528-D530 VanDerWaalsContact O-N 3.1Å; N528-D530 WeakPolarHBondContact OD1-CB 3.02Å; N528-D530 PolarHBondContact OD1-OD1 2.89Å; N528-D530 PolarHBondContact OD1-OD2 3Å; D530-I532 PolarHBondContact O-N 3.17Å; D530-N533 PolarHBondContact O-N 3.29Å
531	K	39.3	Very low	39.2	Very low	193 Å²	193	89.3 Å²	89.3	84%	0.839	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-69.5	-18.8	170.2	-77.2	-175.1	-179.3	174.1	0	113.5	L529	L529-K531 PolarHBondContact O-N 2.77Å
532	I	36.9	Very low	41.3	Very low	58 Å²	58	88.3 Å²	88.3	30%	0.297	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-125	44.8	167.6	-42.4	176.9	0	0	0	108	L529 D530 F534	L529-I532 CarbonylContact O-C 2.98Å; L529-I532 VanDerWaalsContact O-CA 3.32Å; L529-I532 WeakPolarHBondContact O-CA 3.47Å; L529-I532 PolarHBondContact O-N 3.03Å; D530-I532 PolarHBondContact O-N 3.17Å; I532-F534 HydrophobicContact CG2-CD2 4.07Å; I532-F534 HydrophobicContact CG2-CE2 4.46Å; I532-F534 VanDerWaalsContact O-CB 3.32Å; I532-F534 WeakPolarHBondContact O-CB 3.33Å; I532-F534 WeakPolarHBondContact O-CD2 3.42Å; I532-F534 WeakPolarHBondContact O-CG 3.26Å; I532-F534 PolarHBondContact O-N 3.19Å
533	N	30.7	Very low	43.4	Very low	140 Å²	140	88.8 Å²	88.8	75%	0.749	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	36.9	32.3	162.3	-95.2	6.4	0	0	0	119.1	L529 D530	L529-N533 PolarHBondContact O-N 3.01Å; L529-N533 VanDerWaalsContact O-N 3.09Å; D530-N533 PolarHBondContact O-N 3.29Å
534	F	38.1	Very low	45.5	Very low	92 Å²	92	88.8 Å²	88.8	40%	0.404	43%	0.431	S	S	.	.			trans	-138.6	109.1	-171.7	-74.9	-63.2	0	0	0	111.5	L529 I532 L536	L529-F534 WeakPolarHBondContact CB-O 3.34Å; I532-F534 HydrophobicContact CG2-CD2 4.07Å; I532-F534 HydrophobicContact CG2-CE2 4.46Å; I532-F534 VanDerWaalsContact O-CB 3.32Å; I532-F534 WeakPolarHBondContact O-CB 3.33Å; I532-F534 WeakPolarHBondContact O-CD2 3.42Å; I532-F534 WeakPolarHBondContact O-CG 3.26Å; I532-F534 PolarHBondContact O-N 3.19Å; F534-L536 PolarHBondContact O-N 2.84Å; F534-L536 VanDerWaalsContact O-N 3.09Å
535	I	40.6	Very low	46.4	Very low	141 Å²	141	90.8 Å²	90.8	72%	0.723	44%	0.437	S	S	*	.			trans	-67.7	100.3	166	-54.6	164.2	0	0	0	106.6
536	L	50.1	Low	47.5	Very low	29 Å²	29	88.2 Å²	88.2	15%	0.152	43%	0.426	C	S	.	.			trans	-73.6	141.3	158.7	-85.4	108.6	0	0	0	108.2	L411 M412 L529 F534 L539	L411-L536 HydrophobicContact CD1-CD2 4.43Å; M412-L536 HydrophobicContact CE-CD2 3.85Å; L529-L536 HydrophobicContact CD1-CD1 3.15Å; L529-L536 HydrophobicContact CD1-CG 4.44Å; F534-L536 PolarHBondContact O-N 2.84Å; F534-L536 VanDerWaalsContact O-N 3.09Å; L536-L539 HydrophobicContact CD2-CD1 3.63Å
537	P	50.9	Low	48.5	Very low	17 Å²	17	87.7 Å²	87.7	11%	0.11	42%	0.415	C	S	.	.			trans	-58.8	160.9	165.9	28.2	-34.9	0	0	0	110.9	K323 M412 L539	K323-P537 HydrophobicContact CB-CB 4.35Å; K323-P537 HydrophobicContact CD-CB 3.7Å; K323-P537 HydrophobicContact CG-CB 3.89Å; M412-P537 VanDerWaalsContact CE-CD 3.46Å; M412-P537 HydrophobicContact CE-CG 3.44Å; M412-P537 VanDerWaalsContact CE-CG 3.44Å; M412-P537 HydrophobicContact SD-CG 3.61Å; P537-L539 PolarHBondContact O-N 2.87Å
538	D	54.7	Low	49.5	Very low	91 Å²	91	89.1 Å²	89.1	49%	0.487	42%	0.419	S	S	.	.			trans	-55.7	112	172.4	-58.9	-31.9	0	0	0	108.6	Y540	D538-Y540 HydrophobicContact CB-CE2 4.47Å
539	L	58.8	Low	50.8	Low	30 Å²	30	86.9 Å²	86.9	16%	0.157	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.2	178.2	-74.3	172.7	0	0	0	108.6	P319 I320 M412 L536 P537	P319-L539 HydrophobicContact CB-CD2 4.25Å; I320-L539 CarbonylContact O-C 3.47Å; I320-L539 WeakPolarHBondContact O-CA 3.4Å; M412-L539 HydrophobicContact CE-CD2 4.22Å; M412-L539 HydrophobicContact SD-CD2 4.03Å; L536-L539 HydrophobicContact CD2-CD1 3.63Å; P537-L539 PolarHBondContact O-N 2.87Å
540	Y	66.7	Low	51.9	Low	100 Å²	100	90.5 Å²	90.5	39%	0.392	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	152.9	166.7	-61.1	-96.3	0	0	0	109.2	P319 I320 D322 D538	P319-Y540 CarbonylContact C-O 3.58Å; P319-Y540 WeakPolarHBondContact CA-O 3.48Å; I320-Y540 PolarHBondContact N-O 3.17Å; I320-Y540 PolarHBondContact O-N 3.3Å; D322-Y540 HydrophobicContact CB-CD2 4.5Å; D322-Y540 HydrophobicContact CB-CE2 3.87Å; D322-Y540 WeakPolarHBondContact OD1-CE2 3.44Å; D322-Y540 WeakPolarHBondContact OD2-CE2 3.39Å; D322-Y540 PolarHBondContact OD2-OH 2.79Å; D538-Y540 HydrophobicContact CB-CE2 4.47Å
541	W	68.3	Low	53.2	Low	42 Å²	42	89.6 Å²	89.6	16%	0.159	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	114.9	-177.9	-66	103.8	0	0	0	109.2	P319 L418 L452 Y453	P319-W541 HydrophobicContact CB-CE3 4.11Å; P319-W541 HydrophobicContact CB-CH2 4.23Å; P319-W541 HydrophobicContact CB-CZ3 3.74Å; P319-W541 HydrophobicContact CG-CZ3 4.32Å; L418-W541 HydrophobicContact CB-CZ3 4.4Å; L418-W541 HydrophobicContact CD1-CH2 4.28Å; L418-W541 HydrophobicContact CD1-CZ3 4.32Å; L418-W541 HydrophobicContact CD2-CH2 4.29Å; L418-W541 HydrophobicContact CD2-CZ3 4.11Å; L452-W541 HydrophobicContact CB-CZ2 3.9Å; L452-W541 HydrophobicContact CD1-CH2 4.26Å; L452-W541 HydrophobicContact CD1-CZ2 4.13Å; Y453-W541 HydrophobicContact CE1-CB 4.42Å; Y453-W541 HydrophobicContact CE1-CD2 4.17Å; Y453-W541 AromaticContact CE1-CG 3.99Å; Y453-W541 HydrophobicContact CE1-CG 3.99Å; Y453-W541 HydrophobicContact CE2-CD2 4.18Å; Y453-W541 HydrophobicContact CE2-CE3 4.22Å; Y453-W541 HydrophobicContact CE2-CH2 4.22Å; Y453-W541 HydrophobicContact CE2-CZ2 4.21Å; Y453-W541 HydrophobicContact CE2-CZ3 4.23Å; Y453-W541 AromaticContact CZ-CD2 3.62Å; Y453-W541 AromaticContact CZ-CE2 3.94Å; Y453-W541 AromaticContact CZ-CE3 3.86Å; Y453-W541 AromaticContact CZ-CG 3.89Å
542	M	71.3	Confident	54.2	Low	50 Å²	50	81.6 Å²	81.6	25%	0.246	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.2	174.5	174.7	-176.4	56.7	0	0	109.8	C317 Y318 I320 R544	C317-M542 WeakPolarHBondContact CA-O 3.27Å; Y318-M542 HydrophobicContact CD2-CE 4.32Å; Y318-M542 HydrophobicContact CG-CE 4.06Å; Y318-M542 PolarHBondContact N-O 3.49Å; Y318-M542 PolarHBondContact O-N 3.23Å; I320-M542 HydrophobicContact CD1-CB 3.5Å; I320-M542 HydrophobicContact CD1-CE 3.96Å; I320-M542 HydrophobicContact CD1-CG 4.31Å; I320-M542 HydrophobicContact CD1-SD 4.03Å; I320-M542 HydrophobicContact CG1-CB 4.22Å; M542-R544 HydrophobicContact CE-CG 4.29Å; M542-R544 VanDerWaalsContact CE-NH2 3.29Å; M542-R544 HydrophobicContact CG-CG 4.17Å; M542-R544 HydrophobicContact SD-CG 4.29Å; M542-R544 PolarHBondContact SD-NE 3.16Å; M542-R544 VanDerWaalsContact SD-NE 3.4Å
543	W	69.8	Low	55.7	Low	94 Å²	94	83.6 Å²	83.6	36%	0.356	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	126.7	176	-56.2	78.6	0	0	0	109.1	P183 S237 N238 I315 Y453	P183-W543 HydrophobicContact CB-CZ3 3.86Å; S237-W543 WeakPolarHBondContact O-CZ3 3.45Å; N238-W543 WeakPolarHBondContact OD1-CH2 3.47Å; N238-W543 WeakPolarHBondContact OD1-CZ3 3.38Å; I315-W543 HydrophobicContact CG2-CB 4.21Å; I315-W543 HydrophobicContact CG2-CE3 3.79Å; Y453-W543 HydrophobicContact CE1-CH2 4.21Å; Y453-W543 AromaticContact CE1-CZ2 3.77Å; Y453-W543 HydrophobicContact CE1-CZ2 3.77Å
544	R	68.3	Low	58	Low	177 Å²	177	78.5 Å²	78.5	67%	0.668	35%	0.35	S	S	*	.			trans	-127.1	0	176.6	-67.9	-171.3	171.8	172.5	0.1	112.3	Q316 Y318 M542	Q316-R544 PolarHBondContact N-O 3.11Å; Q316-R544 PolarHBondContact O-N 3.31Å; Y318-R544 HydrophobicContact CD2-CB 4.15Å; Y318-R544 HydrophobicContact CD2-CG 3.97Å; Y318-R544 HydrophobicContact CE2-CB 3.8Å; Y318-R544 HydrophobicContact CE2-CG 3.98Å; M542-R544 HydrophobicContact CE-CG 4.29Å; M542-R544 VanDerWaalsContact CE-NH2 3.29Å; M542-R544 HydrophobicContact CG-CG 4.17Å; M542-R544 HydrophobicContact SD-CG 4.29Å; M542-R544 PolarHBondContact SD-NE 3.16Å; M542-R544 VanDerWaalsContact SD-NE 3.4Å

Retrieved 544 of 544 residues in 944 ms (Link to these results)

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