A0A077ZJL7_TRITR Loading...

EGF-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZJL7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 611 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	39.9	Very low	245 Å²	245	125.7 Å²	125.7	100%	1.207	70%	0.699	S	S	*	*				0	132.1	0	-61.7	166.7	71.9	0	0	107.5
2	S	40	Very low	39.3	Very low	93 Å²	93	124.3 Å²	124.3	65%	0.65	70%	0.701	S	S	*	*			cis	-146.7	161.6	-8.9	65.2	0	0	0	0	108.5	G4	S2-G4 PolarHBondContact O-N 3.5Å
3	L	44.7	Very low	39	Very low	168 Å²	168	123.8 Å²	123.8	88%	0.88	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-67.8	3.9	-177.7	-80.1	81.5	0	0	0	114.6	L5	L3-L5 PolarHBondContact O-N 3.41Å
4	G	45.2	Very low	38.5	Very low	44 Å²	44	124.8 Å²	124.8	45%	0.454	70%	0.697	S	S	.	*	G	3₁₀ helix	trans	-72	-20	-171.9	0	0	0	0	0	116.5	S2	S2-G4 PolarHBondContact O-N 3.5Å
5	L	43.2	Very low	38.2	Very low	141 Å²	141	126.4 Å²	126.4	74%	0.738	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-86	-18.1	-172.4	-94.3	136.9	0	0	0	115.2	L3	L3-L5 PolarHBondContact O-N 3.41Å
6	I	42.6	Very low	37.9	Very low	127 Å²	127	125.8 Å²	125.8	65%	0.651	70%	0.696	S	S	*	*	H	α-helix	trans	-84.8	-22.4	178.8	-61.9	175.4	0	0	0	111.4	T9	I6-T9 PolarHBondContact O-OG1 3.3Å
7	L	38.1	Very low	37.8	Very low	129 Å²	129	128.2 Å²	128.2	68%	0.675	69%	0.692	S	S	*	*	H	α-helix	trans	-75.7	-25.2	177.6	-151.4	75.8	0	0	0	112.9	I11	L7-I11 VanDerWaalsContact O-CD1 3.31Å; L7-I11 WeakPolarHBondContact O-CD1 3.42Å; L7-I11 WeakPolarHBondContact O-CG1 3.49Å
8	V	38.2	Very low	37.6	Very low	94 Å²	94	130.1 Å²	130.1	57%	0.57	70%	0.695	S	S	*	*	H	α-helix	trans	-82	-29.4	-175.4	179.8	0	0	0	0	112.3
9	T	37.3	Very low	37.7	Very low	94 Å²	94	125.7 Å²	125.7	58%	0.577	67%	0.674	S	S	*	*	H	α-helix	trans	-82.5	-23.6	179	42.1	0	0	0	0	113.8	I6	I6-T9 PolarHBondContact O-OG1 3.3Å
10	L	34.1	Very low	37.6	Very low	126 Å²	126	123 Å²	123	66%	0.66	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-80	-11.9	173.7	-79.6	165.3	0	0	0	114.2	C12	L10-C12 VanDerWaalsContact C-N 3.32Å
11	I	36.4	Very low	38	Very low	122 Å²	122	118.6 Å²	118.6	63%	0.626	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-82.7	-11.6	175	-68.1	168.9	0	0	0	111.9	L7	L7-I11 VanDerWaalsContact O-CD1 3.31Å; L7-I11 WeakPolarHBondContact O-CD1 3.42Å; L7-I11 WeakPolarHBondContact O-CG1 3.49Å
12	C	32.1	Very low	38.2	Very low	108 Å²	108	109.8 Å²	109.8	73%	0.73	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-96.9	5.8	-173.7	-69.1	0	0	0	0	115.3	L10	L10-C12 VanDerWaalsContact C-N 3.32Å
13	I	35.7	Very low	39	Very low	119 Å²	119	109.1 Å²	109.1	61%	0.61	60%	0.603	S	S	*	*	S	Bend	trans	-110.9	135.4	179.4	-54	178.4	0	0	0	109.1
14	N	32.2	Very low	40.1	Very low	137 Å²	137	104 Å²	104	73%	0.733	58%	0.579	S	S	*	*			trans	73.9	42.3	-177.7	-60	-42.1	0	0	0	117.9	T16	N14-T16 VanDerWaalsContact C-N 3.29Å
15	F	33.7	Very low	41.4	Very low	149 Å²	149	106.7 Å²	106.7	65%	0.654	58%	0.576	S	S	*	*			trans	-92.4	26.3	155.7	-110.6	-88.8	0	0	0	114.3	R17	F15-R17 HydrophobicContact CD1-CG 3.98Å; F15-R17 HydrophobicContact CE1-CG 4Å; F15-R17 VanDerWaalsContact CE1-NE 3.35Å; F15-R17 PolarHBondContact O-N 3.02Å
16	T	33.6	Very low	42.9	Very low	117 Å²	117	103.9 Å²	103.9	72%	0.718	56%	0.556	S	S	*	*			trans	-66.6	70.2	152.2	37.5	0	0	0	0	109.3	N14 Q18	N14-T16 VanDerWaalsContact C-N 3.29Å; T16-Q18 PolarHBondContact O-N 3.16Å
17	R	36.8	Very low	44.6	Very low	167 Å²	167	97.9 Å²	97.9	63%	0.63	53%	0.525	S	S	*	.			trans	-66.3	79.5	166.7	-87.8	-171	174.2	169.9	0.4	109	F15 V19	F15-R17 HydrophobicContact CD1-CG 3.98Å; F15-R17 HydrophobicContact CE1-CG 4Å; F15-R17 VanDerWaalsContact CE1-NE 3.35Å; F15-R17 PolarHBondContact O-N 3.02Å; R17-V19 PolarHBondContact O-N 3.22Å
18	Q	33.8	Very low	45.9	Very low	162 Å²	162	91.9 Å²	91.9	76%	0.757	49%	0.494	S	S	*	.			trans	-51.5	102.9	136.9	-80.5	-168.1	-10.1	0	0	106	T16 S20	T16-Q18 PolarHBondContact O-N 3.16Å; Q18-S20 PolarHBondContact O-N 3.43Å
19	V	39.7	Very low	47.2	Very low	47 Å²	47	87.5 Å²	87.5	29%	0.285	47%	0.467	S	S	.	.			trans	-71.6	68.5	147.4	-172.1	0	0	0	0	105.7	R17 T21 W274	R17-V19 PolarHBondContact O-N 3.22Å; V19-T21 HydrophobicContact CG1-CG2 4.37Å; V19-T21 PolarHBondContact O-N 2.97Å; V19-W274 HydrophobicContact CB-CH2 4.44Å; V19-W274 HydrophobicContact CB-CZ2 3.92Å; V19-W274 HydrophobicContact CG1-CZ2 4.04Å; V19-W274 HydrophobicContact CG2-CZ2 3.87Å
20	S	36	Very low	48.7	Very low	70 Å²	70	85 Å²	85	49%	0.49	45%	0.449	S	S	.	.			trans	-63.3	110.9	154	178.7	0	0	0	0	104	Q18 G22	Q18-S20 PolarHBondContact O-N 3.43Å; S20-G22 PolarHBondContact O-N 3.5Å
21	T	45.1	Very low	50	Low	32 Å²	32	80.2 Å²	80.2	20%	0.196	43%	0.428	C	S	.	.			trans	-67.5	83.2	165.7	47.6	0	0	0	0	106.1	V19 D23 Y232	V19-T21 HydrophobicContact CG1-CG2 4.37Å; V19-T21 PolarHBondContact O-N 2.97Å; T21-D23 CarbonylContact O-C 3.41Å; T21-D23 PolarHBondContact O-N 3.4Å; T21-Y232 HydrophobicContact CG2-CE1 4.21Å
22	G	44.2	Very low	51.2	Low	59 Å²	59	81.2 Å²	81.2	61%	0.608	43%	0.427	S	S	*	.	S	Bend	trans	-69.9	29.1	-154.2	0	0	0	0	0	117.6	S20	S20-G22 PolarHBondContact O-N 3.5Å
23	D	56.6	Low	52.5	Low	80 Å²	80	79.3 Å²	79.3	43%	0.428	41%	0.409	S	S	.	.			trans	-145.8	103.6	160.6	-97.2	-39.3	0	0	0	106.9	T21 Y25 R26 N229	T21-D23 CarbonylContact O-C 3.41Å; T21-D23 PolarHBondContact O-N 3.4Å; D23-Y25 PolarHBondContact O-N 3.46Å; D23-R26 HydrophobicContact CB-CG 4.31Å; D23-N229 PolarHBondContact O-ND2 3.16Å
24	T	67.1	Low	54	Low	60 Å²	60	74.7 Å²	74.7	37%	0.368	39%	0.388	S	S	.	.	S	Bend	trans	-64	-17.1	177.9	45.7	0	0	0	0	112.4	R228 N229	T24-R228 CarbonylContact O-C 3.59Å; T24-R228 VanDerWaalsContact O-CA 3.25Å; T24-R228 WeakPolarHBondContact O-CA 3.49Å; T24-N229 PolarHBondContact O-N 3.04Å
25	Y	73.8	Confident	56.1	Low	101 Å²	101	68.6 Å²	68.6	40%	0.396	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132	175.8	-64.7	-93.3	0	0	0	111	D23 Y227 R228	D23-Y25 PolarHBondContact O-N 3.46Å; Y25-Y227 CarbonylContact C-O 3.53Å; Y25-Y227 VanDerWaalsContact CA-O 3.24Å; Y25-Y227 WeakPolarHBondContact CA-O 3.49Å; Y25-R228 HydrophobicContact CD1-CB 4.05Å; Y25-R228 HydrophobicContact CE1-CB 3.82Å; Y25-R228 HydrophobicContact CE1-CG 4.33Å; Y25-R228 PolarHBondContact OH-NE 3.26Å; Y25-R228 PolarHBondContact OH-NH2 3.08Å
26	R	74.4	Confident	58.4	Low	81 Å²	81	61.5 Å²	61.5	31%	0.306	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	159.2	174.2	-73.3	-176.9	-176	-175.8	-2	113.7	D23 E30 Y227 N229	D23-R26 HydrophobicContact CB-CG 4.31Å; R26-E30 WeakPolarHBondContact CA-OE2 3.35Å; R26-E30 HydrophobicContact CB-CB 4.14Å; R26-E30 WeakPolarHBondContact CB-OE2 3.48Å; R26-E30 HydrophobicContact CG-CB 4.34Å; R26-E30 WeakPolarHBondContact CG-OE2 3.35Å; R26-Y227 PolarHBondContact N-O 2.95Å; R26-Y227 PolarHBondContact O-N 3.29Å; R26-N229 VanDerWaalsContact CB-ND2 3.32Å; R26-N229 WeakPolarHBondContact CB-ND2 3.11Å; R26-N229 WeakPolarHBondContact CD-ND2 3.33Å; R26-N229 WeakPolarHBondContact CG-ND2 3.31Å
27	C	76.9	Confident	60.7	Low	2 Å²	2	55.9 Å²	55.9	1%	0.014	29%	0.29	C	S	.	.			trans	-77.3	148.2	167.2	-53.8	0	0	0	0	110.6	S29 E30 A31 C43 W90	C27-S29 WeakPolarHBondContact CB-OG 3.28Å; C27-S29 PolarHBondContact O-N 3.07Å; C27-E30 HydrophobicContact CB-CG 4.24Å; C27-E30 PolarHBondContact N-OE2 3.01Å; C27-E30 WeakPolarHBondContact O-CB 3.44Å; C27-E30 PolarHBondContact O-N 3.49Å; C27-A31 PolarHBondContact O-N 3.26Å; C27-C43 WeakPolarHBondContact CA-SG 3.44Å; C27-C43 HydrophobicContact CB-CB 3.68Å; C27-C43 WeakPolarHBondContact CB-SG 3.31Å; C27-C43 VanDerWaalsContact SG-CA 3.54Å; C27-C43 WeakPolarHBondContact SG-CB 3.45Å; C27-C43 CovalentContact SG-SG 2.03Å; C27-C43 PolarHBondContact SG-SG 3.4Å; C27-W90 HydrophobicContact CB-CH2 4.31Å; C27-W90 HydrophobicContact CB-CZ3 3.77Å
28	P	66.9	Low	62.9	Low	2 Å²	2	50 Å²	50	1%	0.013	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.4	175.3	-23.5	32.3	0	0	0	112.5	A31 K32 M33 A34 F70 Y227 Y262	P28-A31 CarbonylContact O-C 3.56Å; P28-A31 WeakPolarHBondContact O-CB 3.48Å; P28-A31 PolarHBondContact O-N 3.48Å; P28-K32 PolarHBondContact O-N 3.18Å; P28-M33 HydrophobicContact CB-CB 4.33Å; P28-M33 WeakPolarHBondContact O-CB 3.4Å; P28-M33 PolarHBondContact O-N 3.45Å; P28-A34 HydrophobicContact CB-CB 4.11Å; P28-A34 PolarHBondContact O-N 3.12Å; P28-F70 HydrophobicContact CG-CE1 4.49Å; P28-Y227 HydrophobicContact CG-CD2 4.12Å; P28-Y227 HydrophobicContact CG-CE2 4.21Å; P28-Y262 HydrophobicContact CG-CD1 4.35Å; P28-Y262 HydrophobicContact CG-CG 4.4Å
29	S	65.9	Low	65.2	Low	3 Å²	3	46.3 Å²	46.3	2%	0.021	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-35.2	175.9	43.7	0	0	0	0	114.4	C27 A31 K32 A34 W90	C27-S29 WeakPolarHBondContact CB-OG 3.28Å; C27-S29 PolarHBondContact O-N 3.07Å; S29-A31 PolarHBondContact O-N 3.35Å; S29-K32 PolarHBondContact O-N 3.32Å; S29-A34 VanDerWaalsContact CA-O 3.32Å; S29-A34 WeakPolarHBondContact CA-O 3.38Å; S29-A34 WeakPolarHBondContact CB-O 3.38Å; S29-W90 WeakPolarHBondContact OG-CZ3 3.4Å
30	E	68.8	Low	67.2	Low	42 Å²	42	47 Å²	47	20%	0.196	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-29.9	168.4	-69.8	168.8	147	0	0	111.3	R26 C27 K32 K38 W90	R26-E30 WeakPolarHBondContact CA-OE2 3.35Å; R26-E30 HydrophobicContact CB-CB 4.14Å; R26-E30 WeakPolarHBondContact CB-OE2 3.48Å; R26-E30 HydrophobicContact CG-CB 4.34Å; R26-E30 WeakPolarHBondContact CG-OE2 3.35Å; C27-E30 HydrophobicContact CB-CG 4.24Å; C27-E30 PolarHBondContact N-OE2 3.01Å; C27-E30 WeakPolarHBondContact O-CB 3.44Å; C27-E30 PolarHBondContact O-N 3.49Å; E30-K32 VanDerWaalsContact C-N 3.29Å; E30-K38 IonicContact OE1-NZ 3.98Å; E30-K38 PolarHBondContact OE1-NZ 3.45Å; E30-K38 IonicContact OE2-NZ 2.66Å; E30-W90 VanDerWaalsContact CD-CH2 3.42Å; E30-W90 HydrophobicContact CG-CD2 3.88Å; E30-W90 VanDerWaalsContact CG-CE2 3.48Å; E30-W90 HydrophobicContact CG-CE3 3.99Å; E30-W90 HydrophobicContact CG-CH2 3.24Å; E30-W90 HydrophobicContact CG-CZ2 3.18Å; E30-W90 HydrophobicContact CG-CZ3 3.68Å; E30-W90 VanDerWaalsContact OE1-CH2 3.29Å; E30-W90 WeakPolarHBondContact OE1-CH2 3.08Å; E30-W90 VanDerWaalsContact OE1-CZ2 3.26Å; E30-W90 WeakPolarHBondContact OE1-CZ2 3.03Å
31	A	60.6	Low	69.2	Low	25 Å²	25	48.7 Å²	48.7	21%	0.207	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-1.2	173.4	0	0	0	0	0	114.1	C27 P28 S29 M33 I264	C27-A31 PolarHBondContact O-N 3.26Å; P28-A31 CarbonylContact O-C 3.56Å; P28-A31 WeakPolarHBondContact O-CB 3.48Å; P28-A31 PolarHBondContact O-N 3.48Å; S29-A31 PolarHBondContact O-N 3.35Å; A31-M33 HydrophobicContact CB-CE 4.07Å; A31-M33 HydrophobicContact CB-CG 3.93Å; A31-M33 HydrophobicContact CB-SD 3.9Å; A31-M33 PolarHBondContact O-N 3.36Å; A31-I264 HydrophobicContact CB-CD1 3.73Å; A31-I264 HydrophobicContact CB-CG1 3.58Å
32	K	61.7	Low	71.2	Confident	142 Å²	142	48.5 Å²	48.5	62%	0.617	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	21.7	-173.5	-53.7	-176.3	179.4	-176.2	0	115	P28 S29 E30 D92	P28-K32 PolarHBondContact O-N 3.18Å; S29-K32 PolarHBondContact O-N 3.32Å; E30-K32 VanDerWaalsContact C-N 3.29Å; K32-D92 HydrophobicContact CB-CB 4.34Å
33	M	59.7	Low	73.2	Confident	69 Å²	69	45.7 Å²	45.7	34%	0.34	24%	0.244	S	C	.	.	S	Bend	trans	-83.7	-25.1	175.9	-59.9	171	173.8	0	0	112.2	P28 A31 I264	P28-M33 HydrophobicContact CB-CB 4.33Å; P28-M33 WeakPolarHBondContact O-CB 3.4Å; P28-M33 PolarHBondContact O-N 3.45Å; A31-M33 HydrophobicContact CB-CE 4.07Å; A31-M33 HydrophobicContact CB-CG 3.93Å; A31-M33 HydrophobicContact CB-SD 3.9Å; A31-M33 PolarHBondContact O-N 3.36Å; M33-I264 HydrophobicContact CE-CG1 4.28Å
34	A	66.5	Low	74.7	Confident	21 Å²	21	41.9 Å²	41.9	17%	0.174	22%	0.224	C	C	.	.	S	Bend	trans	-146.4	178.4	-179.1	0	0	0	0	0	111.9	P28 S29 T45	P28-A34 HydrophobicContact CB-CB 4.11Å; P28-A34 PolarHBondContact O-N 3.12Å; S29-A34 VanDerWaalsContact CA-O 3.32Å; S29-A34 WeakPolarHBondContact CA-O 3.38Å; S29-A34 WeakPolarHBondContact CB-O 3.38Å; A34-T45 HydrophobicContact CB-CG2 3.57Å
35	I	76.1	Confident	75.6	Confident	9 Å²	9	39.1 Å²	39.1	5%	0.046	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	138.5	173.1	-54.9	162.2	0	0	0	108.1	T45 F46 W89 F91 I96 I106	I35-T45 WeakPolarHBondContact O-CA 3.38Å; I35-F46 HydrophobicContact CB-CB 4.3Å; I35-F46 HydrophobicContact CG2-CB 4.46Å; I35-F46 HydrophobicContact CG2-CD2 4.34Å; I35-F46 PolarHBondContact O-N 3.08Å; I35-W89 HydrophobicContact CG2-CH2 4.43Å; I35-W89 HydrophobicContact CG2-CZ2 4.08Å; I35-F91 HydrophobicContact CG2-CD2 4.1Å; I35-I96 HydrophobicContact CD1-CD1 3.62Å; I35-I96 HydrophobicContact CD1-CG1 3.67Å; I35-I96 HydrophobicContact CG1-CD1 4.22Å; I35-I96 HydrophobicContact CG1-CG1 4.38Å; I35-I106 HydrophobicContact CD1-CG2 3.82Å; I35-I106 HydrophobicContact CG2-CD1 4.21Å
36	G	82	Confident	76.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.5	-175	-176.9	0	0	0	0	0	115.7	V44 W90	G36-V44 CarbonylContact C-O 3.57Å; G36-V44 WeakPolarHBondContact CA-O 3.3Å; G36-W90 PolarHBondContact N-O 3.3Å; G36-W90 PolarHBondContact O-N 3.47Å
37	F	83.1	Confident	76.3	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	160.2	171.8	66	-81.5	0	0	0	112.6	W39 V44 F46 Y76 I84 K88 W89 W90	F37-W39 HydrophobicContact CD2-CB 4.49Å; F37-W39 HydrophobicContact CE2-CB 4.12Å; F37-V44 HydrophobicContact CD1-CB 3.87Å; F37-V44 HydrophobicContact CD1-CG1 4.07Å; F37-V44 HydrophobicContact CE1-CB 3.63Å; F37-V44 HydrophobicContact CE1-CG1 3.51Å; F37-V44 HydrophobicContact CE1-CG2 4.11Å; F37-V44 HydrophobicContact CE2-CB 4.33Å; F37-V44 HydrophobicContact CE2-CG2 4.08Å; F37-V44 HydrophobicContact CG-CB 4.33Å; F37-V44 HydrophobicContact CZ-CB 3.87Å; F37-V44 HydrophobicContact CZ-CG1 3.99Å; F37-V44 HydrophobicContact CZ-CG2 3.81Å; F37-V44 PolarHBondContact N-O 3.38Å; F37-V44 PolarHBondContact O-N 3.39Å; F37-F46 AromaticContact CD1-CE2 3.94Å; F37-F46 HydrophobicContact CD1-CE2 3.94Å; F37-F46 AromaticContact CE1-CE2 3.94Å; F37-F46 HydrophobicContact CE1-CE2 3.94Å; F37-F46 HydrophobicContact CE1-CZ 4.12Å; F37-Y76 HydrophobicContact CE1-CE1 4.28Å; F37-Y76 HydrophobicContact CZ-CD1 4.3Å; F37-Y76 AromaticContact CZ-CE1 3.57Å; F37-Y76 HydrophobicContact CZ-CE1 3.57Å; F37-Y76 AromaticContact CZ-CZ 3.86Å; F37-I84 HydrophobicContact CD1-CG2 4.11Å; F37-I84 HydrophobicContact CE1-CB 4.4Å; F37-I84 HydrophobicContact CE1-CD1 4.13Å; F37-I84 HydrophobicContact CE1-CG1 3.8Å; F37-I84 HydrophobicContact CE1-CG2 4.14Å; F37-I84 HydrophobicContact CG-CG2 4.32Å; F37-I84 HydrophobicContact CZ-CB 4.3Å; F37-I84 HydrophobicContact CZ-CG1 3.81Å; F37-I84 HydrophobicContact CZ-CG2 4.37Å; F37-K88 WeakPolarHBondContact CA-O 3.47Å; F37-K88 HydrophobicContact CB-CB 4.47Å; F37-K88 WeakPolarHBondContact CB-O 3.49Å; F37-W89 HydrophobicContact CB-CE3 4.06Å; F37-W89 AromaticContact CD1-CE3 3.69Å; F37-W89 HydrophobicContact CD1-CE3 3.69Å; F37-W89 AromaticContact CD1-CZ3 3.63Å; F37-W89 HydrophobicContact CD1-CZ3 3.63Å; F37-W89 HydrophobicContact CE1-CZ3 4.14Å; F37-W89 HydrophobicContact CG-CE3 4.21Å; F37-W90 VanDerWaalsContact CA-CE3 3.45Å; F37-W90 VanDerWaalsContact CA-CZ3 3.41Å
38	K	82.3	Confident	76.2	Confident	43 Å²	43	34 Å²	34	19%	0.187	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	134.6	172.4	-130.5	171.3	-174.1	140.5	0	109.7	E30 K88 W90	E30-K38 IonicContact OE1-NZ 3.98Å; E30-K38 PolarHBondContact OE1-NZ 3.45Å; E30-K38 IonicContact OE2-NZ 2.66Å; K38-K88 HydrophobicContact CB-CB 4.1Å; K38-K88 HydrophobicContact CB-CD 3.55Å; K38-K88 HydrophobicContact CB-CG 4.42Å; K38-W90 HydrophobicContact CB-CH2 3.47Å; K38-W90 VanDerWaalsContact CB-CH2 3.47Å; K38-W90 HydrophobicContact CB-CZ2 4.17Å; K38-W90 HydrophobicContact CB-CZ3 4.25Å; K38-W90 HydrophobicContact CD-CH2 4.22Å; K38-W90 HydrophobicContact CG-CH2 3.88Å
39	W	81.5	Confident	76.7	Confident	85 Å²	85	33.9 Å²	33.9	32%	0.322	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	103	172.3	-173	80.6	0	0	0	108.6	F37 S41 Q42 V44 Y76 E142 L223	F37-W39 HydrophobicContact CD2-CB 4.49Å; F37-W39 HydrophobicContact CE2-CB 4.12Å; W39-S41 PolarHBondContact O-N 3.14Å; W39-Q42 PolarHBondContact N-O 2.95Å; W39-Q42 CarbonylContact O-C 3.51Å; W39-Q42 WeakPolarHBondContact O-CA 3.35Å; W39-Q42 WeakPolarHBondContact O-CB 3.41Å; W39-Q42 PolarHBondContact O-N 2.86Å; W39-V44 HydrophobicContact CB-CG2 3.88Å; W39-Y76 HydrophobicContact CD2-CE2 4.11Å; W39-Y76 HydrophobicContact CG-CE2 4.09Å; W39-E142 WeakPolarHBondContact CH2-OE1 3.44Å; W39-E142 WeakPolarHBondContact CH2-OE2 3.45Å; W39-E142 WeakPolarHBondContact CZ3-OE1 3.27Å; W39-L223 HydrophobicContact CB-CD1 4.43Å; W39-L223 HydrophobicContact CE3-CD1 3.82Å; W39-L223 HydrophobicContact CE3-CD2 3.97Å; W39-L223 HydrophobicContact CZ3-CD2 3.95Å
40	G	81	Confident	76.7	Confident	62 Å²	62	39.7 Å²	39.7	64%	0.639	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	-125.7	-167.7	0	0	0	0	0	112.1	Q42	G40-Q42 VanDerWaalsContact C-N 3.34Å
41	S	79.6	Confident	76.3	Confident	104 Å²	104	40.7 Å²	40.7	73%	0.727	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.3	171.9	55.3	0	0	0	0	113.8	W39	W39-S41 PolarHBondContact O-N 3.14Å
42	Q	86.5	Confident	76.2	Confident	28 Å²	28	39.6 Å²	39.6	13%	0.131	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	171.9	-177.2	-60.6	-162.7	-63	0	0	111.9	W39 G40 L223 H224 N225	W39-Q42 PolarHBondContact N-O 2.95Å; W39-Q42 CarbonylContact O-C 3.51Å; W39-Q42 WeakPolarHBondContact O-CA 3.35Å; W39-Q42 WeakPolarHBondContact O-CB 3.41Å; W39-Q42 PolarHBondContact O-N 2.86Å; G40-Q42 VanDerWaalsContact C-N 3.34Å; Q42-L223 HydrophobicContact CB-CD1 3.54Å; Q42-L223 HydrophobicContact CB-CG 4.35Å; Q42-L223 HydrophobicContact CG-CD1 4.46Å; Q42-H224 WeakPolarHBondContact CB-O 3.3Å; Q42-N225 PolarHBondContact NE2-OD1 3.03Å
43	C	86.3	Confident	75.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.8	-176.5	-63.1	0	0	0	0	109.9	C27 L223 H224 A226	C27-C43 WeakPolarHBondContact CA-SG 3.44Å; C27-C43 HydrophobicContact CB-CB 3.68Å; C27-C43 WeakPolarHBondContact CB-SG 3.31Å; C27-C43 VanDerWaalsContact SG-CA 3.54Å; C27-C43 WeakPolarHBondContact SG-CB 3.45Å; C27-C43 CovalentContact SG-SG 2.03Å; C27-C43 PolarHBondContact SG-SG 3.4Å; C43-L223 CarbonylContact O-C 3.48Å; C43-L223 VanDerWaalsContact O-CA 3.31Å; C43-L223 WeakPolarHBondContact O-CA 3.13Å; C43-H224 WeakPolarHBondContact CB-CE1 3.49Å; C43-H224 PolarHBondContact N-O 3.23Å; C43-H224 PolarHBondContact O-CD2 3.49Å; C43-H224 PolarHBondContact O-N 3.22Å; C43-A226 VanDerWaalsContact SG-CA 3.55Å
44	V	88.7	Confident	75.6	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	114.8	167.2	179.7	0	0	0	0	108.1	G36 F37 W39 F46 Y76 A221 C222 L223	G36-V44 CarbonylContact C-O 3.57Å; G36-V44 WeakPolarHBondContact CA-O 3.3Å; F37-V44 HydrophobicContact CD1-CB 3.87Å; F37-V44 HydrophobicContact CD1-CG1 4.07Å; F37-V44 HydrophobicContact CE1-CB 3.63Å; F37-V44 HydrophobicContact CE1-CG1 3.51Å; F37-V44 HydrophobicContact CE1-CG2 4.11Å; F37-V44 HydrophobicContact CE2-CB 4.33Å; F37-V44 HydrophobicContact CE2-CG2 4.08Å; F37-V44 HydrophobicContact CG-CB 4.33Å; F37-V44 HydrophobicContact CZ-CB 3.87Å; F37-V44 HydrophobicContact CZ-CG1 3.99Å; F37-V44 HydrophobicContact CZ-CG2 3.81Å; F37-V44 PolarHBondContact N-O 3.38Å; F37-V44 PolarHBondContact O-N 3.39Å; W39-V44 HydrophobicContact CB-CG2 3.88Å; V44-F46 HydrophobicContact CG1-CE2 4.12Å; V44-Y76 HydrophobicContact CB-CD1 4.4Å; V44-Y76 HydrophobicContact CB-CG 4.36Å; V44-Y76 HydrophobicContact CG1-CD1 3.59Å; V44-Y76 HydrophobicContact CG1-CE1 4.27Å; V44-Y76 HydrophobicContact CG1-CG 3.76Å; V44-Y76 HydrophobicContact CG2-CD1 3.88Å; V44-Y76 HydrophobicContact CG2-CD2 3.57Å; V44-Y76 HydrophobicContact CG2-CE1 4.09Å; V44-Y76 HydrophobicContact CG2-CE2 3.77Å; V44-Y76 HydrophobicContact CG2-CG 3.59Å; V44-A221 HydrophobicContact CG1-CB 4Å; V44-C222 CarbonylContact C-O 3.54Å; V44-C222 WeakPolarHBondContact CA-O 3.47Å; V44-L223 HydrophobicContact CG2-CD1 3.8Å
45	T	85.1	Confident	75.1	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.012	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	131.4	176.9	-61.7	0	0	0	0	110.3	A34 I35 M47 F70 C222 H224	A34-T45 HydrophobicContact CB-CG2 3.57Å; I35-T45 WeakPolarHBondContact O-CA 3.38Å; T45-M47 HydrophobicContact CG2-CG 4.5Å; T45-F70 HydrophobicContact CG2-CE1 4.26Å; T45-F70 HydrophobicContact CG2-CE2 4.38Å; T45-F70 HydrophobicContact CG2-CZ 3.58Å; T45-C222 PolarHBondContact N-O 3.47Å; T45-C222 PolarHBondContact O-N 3.46Å; T45-H224 PolarHBondContact OG1-NE2 2.97Å
46	F	83.8	Confident	74.5	Confident	8 Å²	8	46.2 Å²	46.2	4%	0.035	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	118.9	174.2	-66.9	-100.2	0	0	0	109.2	I35 F37 V44 F78 I84 W89 I106 P108 L195 H219 V220 A221	I35-F46 HydrophobicContact CB-CB 4.3Å; I35-F46 HydrophobicContact CG2-CB 4.46Å; I35-F46 HydrophobicContact CG2-CD2 4.34Å; I35-F46 PolarHBondContact O-N 3.08Å; F37-F46 AromaticContact CD1-CE2 3.94Å; F37-F46 HydrophobicContact CD1-CE2 3.94Å; F37-F46 AromaticContact CE1-CE2 3.94Å; F37-F46 HydrophobicContact CE1-CE2 3.94Å; F37-F46 HydrophobicContact CE1-CZ 4.12Å; V44-F46 HydrophobicContact CG1-CE2 4.12Å; F46-F78 AromaticContact CE1-CE1 3.83Å; F46-F78 HydrophobicContact CE1-CE1 3.83Å; F46-F78 HydrophobicContact CE1-CZ 4.48Å; F46-F78 HydrophobicContact CZ-CE1 4.18Å; F46-I84 HydrophobicContact CZ-CD1 4.25Å; F46-W89 AromaticContact CD2-CH2 3.89Å; F46-W89 HydrophobicContact CD2-CH2 3.89Å; F46-W89 HydrophobicContact CD2-CZ3 4.13Å; F46-W89 HydrophobicContact CE1-CH2 4.29Å; F46-W89 HydrophobicContact CE2-CE3 4.45Å; F46-W89 AromaticContact CE2-CH2 3.37Å; F46-W89 HydrophobicContact CE2-CH2 3.37Å; F46-W89 AromaticContact CE2-CZ3 3.26Å; F46-W89 HydrophobicContact CE2-CZ3 3.26Å; F46-W89 AromaticContact CZ-CH2 3.58Å; F46-W89 HydrophobicContact CZ-CH2 3.58Å; F46-W89 AromaticContact CZ-CZ3 3.58Å; F46-W89 HydrophobicContact CZ-CZ3 3.58Å; F46-I106 HydrophobicContact CB-CD1 4.1Å; F46-I106 HydrophobicContact CD1-CD1 3.58Å; F46-I106 HydrophobicContact CD2-CD1 4.38Å; F46-I106 HydrophobicContact CE1-CD1 4.08Å; F46-I106 HydrophobicContact CG-CD1 3.74Å; F46-P108 HydrophobicContact CD1-CB 3.85Å; F46-P108 HydrophobicContact CD1-CG 4.41Å; F46-P108 HydrophobicContact CE1-CB 3.76Å; F46-P108 HydrophobicContact CE1-CG 4.03Å; F46-L195 HydrophobicContact CE1-CD1 3.89Å; F46-L195 HydrophobicContact CZ-CD1 4.05Å; F46-H219 HydrophobicContact CD1-CB 4.5Å; F46-V220 WeakPolarHBondContact CA-O 3.33Å; F46-A221 HydrophobicContact CD1-CB 3.95Å; F46-A221 HydrophobicContact CE1-CB 3.72Å; F46-A221 HydrophobicContact CZ-CB 4.03Å
47	M	78.7	Confident	74.1	Confident	26 Å²	26	48.2 Å²	48.2	13%	0.128	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.2	177.8	-58.5	-155.2	-68.5	0	0	110.3	T45 L49 L65 T69 F70 H219 V220 C222	T45-M47 HydrophobicContact CG2-CG 4.5Å; M47-L49 PolarHBondContact O-N 3.26Å; M47-L65 HydrophobicContact CE-CD1 4.29Å; M47-L65 HydrophobicContact CE-CG 3.95Å; M47-L65 WeakPolarHBondContact CE-O 3.26Å; M47-T69 HydrophobicContact CE-CG2 3.95Å; M47-T69 WeakPolarHBondContact CE-OG1 3.42Å; M47-T69 HydrophobicContact SD-CG2 3.3Å; M47-T69 WeakPolarHBondContact SD-CG2 3.48Å; M47-F70 HydrophobicContact CE-CD2 4.41Å; M47-F70 HydrophobicContact CE-CE2 3.83Å; M47-F70 HydrophobicContact CG-CE2 3.71Å; M47-F70 HydrophobicContact CG-CZ 3.81Å; M47-F70 HydrophobicContact SD-CD2 4.27Å; M47-F70 HydrophobicContact SD-CE2 3.3Å; M47-F70 WeakPolarHBondContact SD-CE2 3.49Å; M47-F70 HydrophobicContact SD-CZ 3.51Å; M47-F70 VanDerWaalsContact SD-CZ 3.51Å; M47-H219 CarbonylContact O-C 3.53Å; M47-H219 WeakPolarHBondContact O-CA 3.23Å; M47-H219 WeakPolarHBondContact O-CB 3.03Å; M47-V220 HydrophobicContact CB-CG1 4.02Å; M47-V220 HydrophobicContact CE-CG1 4.14Å; M47-V220 PolarHBondContact N-O 2.86Å; M47-V220 PolarHBondContact O-N 3.45Å; M47-C222 WeakPolarHBondContact CE-SG 3.5Å
48	L	76.3	Confident	73.9	Confident	43 Å²	43	48.5 Å²	48.5	23%	0.225	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	127.6	170.3	176.9	55.7	0	0	0	110.2	Q50 W100 S216 Y218	L48-Q50 PolarHBondContact O-N 2.96Å; L48-Q50 PolarHBondContact O-NE2 2.94Å; L48-W100 HydrophobicContact CB-CZ2 4.27Å; L48-W100 HydrophobicContact CD1-CH2 3.42Å; L48-W100 VanDerWaalsContact CD1-CH2 3.42Å; L48-W100 HydrophobicContact CD1-CZ2 3.31Å; L48-W100 HydrophobicContact CD2-CZ2 3.86Å; L48-W100 HydrophobicContact CG-CZ2 3.99Å; L48-S216 VanDerWaalsContact CD1-C 3.43Å; L48-S216 WeakPolarHBondContact CD1-O 3.48Å; L48-Y218 WeakPolarHBondContact CD1-O 3.39Å
49	L	75.9	Confident	73.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-60.9	122.6	175.6	-64.3	-176.5	0	0	0	109.7	M47 F61 L62 L65 I109 V212 Y218 V220	M47-L49 PolarHBondContact O-N 3.26Å; L49-F61 HydrophobicContact CD2-CE1 4.2Å; L49-L62 HydrophobicContact CD1-CD2 4.32Å; L49-L62 HydrophobicContact CD2-CD2 3.7Å; L49-L65 HydrophobicContact CD2-CD2 3.49Å; L49-L65 VanDerWaalsContact CD2-CD2 3.49Å; L49-I109 HydrophobicContact CD1-CD1 3.58Å; L49-I109 HydrophobicContact CD1-CG1 4.33Å; L49-V212 HydrophobicContact CD1-CG1 4.42Å; L49-Y218 WeakPolarHBondContact CB-O 3.43Å; L49-Y218 WeakPolarHBondContact CG-O 3.17Å; L49-Y218 PolarHBondContact N-O 3.36Å; L49-V220 HydrophobicContact CD2-CB 3.82Å; L49-V220 HydrophobicContact CD2-CG1 3.94Å
50	Q	65.8	Low	73.4	Confident	125 Å²	125	47.2 Å²	47.2	58%	0.584	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-75	138.1	165.5	-62.1	-54.9	-69.9	0	0	108.4	L48 M52	L48-Q50 PolarHBondContact O-N 2.96Å; L48-Q50 PolarHBondContact O-NE2 2.94Å; Q50-M52 PolarHBondContact O-N 2.95Å
51	P	62.1	Low	73.4	Confident	62 Å²	62	44.5 Å²	44.5	40%	0.403	23%	0.226	S	C	.	.			trans	-49	115.1	-175	-31.8	36.4	0	0	0	111.8	R53	P51-R53 WeakPolarHBondContact O-CG 3.35Å; P51-R53 PolarHBondContact O-N 3.27Å
52	M	58.6	Low	73.4	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	19%	0.192	C	C	.	.			trans	-73.7	133.1	-171	-155.3	-91.6	-92.7	0	0	110.3	Q50 V54 F61 M213	Q50-M52 PolarHBondContact O-N 2.95Å; M52-V54 VanDerWaalsContact SD-O 3.41Å; M52-F61 HydrophobicContact CB-CD2 4.4Å; M52-F61 HydrophobicContact CB-CE1 4.19Å; M52-F61 HydrophobicContact CB-CE2 4.09Å; M52-F61 HydrophobicContact CB-CZ 3.96Å; M52-F61 HydrophobicContact CE-CB 3.93Å; M52-F61 HydrophobicContact CE-CD1 4.38Å; M52-F61 HydrophobicContact CE-CD2 3.96Å; M52-F61 HydrophobicContact CE-CG 3.79Å; M52-F61 HydrophobicContact CG-CD1 3.8Å; M52-F61 HydrophobicContact CG-CD2 3.07Å; M52-F61 HydrophobicContact CG-CE1 3.7Å; M52-F61 HydrophobicContact CG-CE2 3.05Å; M52-F61 HydrophobicContact CG-CG 3.54Å; M52-F61 HydrophobicContact CG-CZ 3.37Å; M52-F61 HydrophobicContact SD-CD2 3.67Å; M52-F61 HydrophobicContact SD-CE2 4.16Å; M52-F61 HydrophobicContact SD-CG 4.11Å; M52-M213 WeakPolarHBondContact CA-O 3.03Å; M52-M213 HydrophobicContact CB-CB 3.59Å; M52-M213 WeakPolarHBondContact CB-O 3.43Å; M52-M213 HydrophobicContact CE-CB 4.19Å; M52-M213 HydrophobicContact CE-CE 3.31Å; M52-M213 HydrophobicContact CE-CG 4.35Å; M52-M213 HydrophobicContact CE-SD 3.33Å; M52-M213 WeakPolarHBondContact CE-SD 3.31Å; M52-M213 HydrophobicContact CG-CB 4.21Å; M52-M213 PolarHBondContact N-O 3.43Å
53	R	52.5	Low	73.1	Confident	133 Å²	133	38.9 Å²	38.9	50%	0.502	19%	0.189	S	C	.	.			trans	-130.3	146.9	178.8	-56.6	-148.8	-151.1	168.3	1.7	106.7	P51 R400 G600 S601	P51-R53 WeakPolarHBondContact O-CG 3.35Å; P51-R53 PolarHBondContact O-N 3.27Å; R53-R400 PolarHBondContact O-NH2 3.43Å; R53-G600 VanDerWaalsContact CA-N 3.35Å; R53-G600 VanDerWaalsContact CB-C 3.42Å; R53-G600 VanDerWaalsContact CB-CA 3.5Å; R53-G600 WeakPolarHBondContact CD-O 3.4Å; R53-S601 WeakPolarHBondContact CB-O 3.32Å; R53-S601 WeakPolarHBondContact CD-O 3.28Å
54	V	55.3	Low	72.7	Confident	33 Å²	33	41 Å²	41	20%	0.2	20%	0.198	C	C	.	.	S	Bend	trans	85.1	156.7	-169.4	-85	0	0	0	0	121	M52 E56 R400 S601 S602	M52-V54 VanDerWaalsContact SD-O 3.41Å; V54-E56 PolarHBondContact O-N 2.97Å; V54-R400 HydrophobicContact CG2-CG 4.29Å; V54-S601 WeakPolarHBondContact CG1-OG 3.46Å; V54-S602 VanDerWaalsContact CG2-O 3.3Å; V54-S602 WeakPolarHBondContact CG2-O 3.48Å
55	H	56.8	Low	72.2	Confident	188 Å²	188	41.9 Å²	41.9	87%	0.87	20%	0.203	S	C	*	.	S	Bend	trans	-71.8	16.5	-176.2	-55.2	-93.8	0	0	0	115.7
56	E	63.5	Low	72.1	Confident	26 Å²	26	41.8 Å²	41.8	12%	0.121	20%	0.202	C	C	.	.			trans	-67.1	152	175.1	-64.2	-167.3	151.7	0	0	111.3	V54 F61 K64 R400	V54-E56 PolarHBondContact O-N 2.97Å; E56-F61 WeakPolarHBondContact OE2-CA 3.46Å; E56-K64 WeakPolarHBondContact OE1-CE 3.48Å; E56-K64 IonicContact OE1-NZ 3.98Å; E56-K64 PolarHBondContact OE1-NZ 3.35Å; E56-R400 VanDerWaalsContact CD-CD 3.48Å; E56-R400 WeakPolarHBondContact OE1-CD 3.5Å; E56-R400 IonicContact OE1-NE 3.78Å; E56-R400 WeakPolarHBondContact OE2-CD 3.28Å; E56-R400 IonicContact OE2-CZ 1.83Å; E56-R400 IonicContact OE2-NE 2.53Å; E56-R400 PolarHBondContact OE2-NE 3.21Å; E56-R400 IonicContact OE2-NH1 3.52Å; E56-R400 PolarHBondContact OE2-NH1 3.33Å; E56-R400 IonicContact OE2-NH2 2.82Å
57	T	73.2	Confident	72	Confident	43 Å²	43	45.3 Å²	45.3	26%	0.264	22%	0.218	S	C	.	.			trans	-63.3	150.2	168.3	68.6	0	0	0	0	109.6	N59 E60 F61	T57-N59 PolarHBondContact O-N 2.99Å; T57-N59 VanDerWaalsContact O-N 3.09Å; T57-E60 VanDerWaalsContact CB-OE2 3.29Å; T57-E60 WeakPolarHBondContact CB-OE2 3.37Å; T57-E60 WeakPolarHBondContact CG2-OE2 3.26Å; T57-E60 PolarHBondContact N-OE2 3.5Å; T57-E60 PolarHBondContact O-N 3.23Å; T57-E60 WeakPolarHBondContact OG1-CG 3.48Å; T57-E60 PolarHBondContact OG1-N 3.31Å; T57-E60 PolarHBondContact OG1-OE2 3.22Å; T57-F61 WeakPolarHBondContact O-CB 3.4Å; T57-F61 PolarHBondContact O-N 3.47Å
58	P	77.7	Confident	71.6	Confident	6 Å²	6	46.3 Å²	46.3	4%	0.039	23%	0.231	C	C	.	.	H	α-helix	trans	-57.6	-26.9	179.3	-28.9	38.5	0	0	0	114.4	L62 I113 W188 C209 M213	P58-L62 WeakPolarHBondContact O-CD1 3.13Å; P58-L62 VanDerWaalsContact O-CG 3.27Å; P58-L62 WeakPolarHBondContact O-CG 3.23Å; P58-I113 VanDerWaalsContact C-CD1 3.4Å; P58-I113 HydrophobicContact CB-CD1 3.53Å; P58-I113 HydrophobicContact CB-CG2 4.35Å; P58-W188 HydrophobicContact CG-CB 3.69Å; P58-W188 HydrophobicContact CG-CG 3.88Å; P58-C209 HydrophobicContact CB-CB 3.65Å; P58-C209 VanDerWaalsContact CB-SG 3.55Å; P58-C209 HydrophobicContact CG-CB 3.42Å; P58-C209 VanDerWaalsContact CG-CB 3.42Å; P58-M213 VanDerWaalsContact CA-SD 3.53Å; P58-M213 HydrophobicContact CB-CE 3.95Å; P58-M213 HydrophobicContact CB-SD 3.54Å; P58-M213 VanDerWaalsContact CB-SD 3.54Å; P58-M213 HydrophobicContact CG-CE 3.67Å; P58-M213 HydrophobicContact CG-SD 3.98Å
59	N	77.7	Confident	71.3	Confident	7 Å²	7	46.4 Å²	46.4	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-75.9	-54.1	-178.1	-164.6	35.5	0	0	0	110.6	T57 F61 L62 N63 R75 I113 D138	T57-N59 PolarHBondContact O-N 2.99Å; T57-N59 VanDerWaalsContact O-N 3.09Å; N59-F61 PolarHBondContact O-N 3Å; N59-L62 PolarHBondContact O-N 2.86Å; N59-N63 PolarHBondContact O-N 3.12Å; N59-N63 VanDerWaalsContact O-N 3.07Å; N59-N63 PolarHBondContact O-ND2 2.92Å; N59-N63 PolarHBondContact O-OD1 3.31Å; N59-R75 PolarHBondContact OD1-NH1 2.95Å; N59-I113 HydrophobicContact CB-CD1 3.9Å; N59-D138 VanDerWaalsContact CB-OD2 3.27Å; N59-D138 WeakPolarHBondContact CB-OD2 3.38Å; N59-D138 PolarHBondContact ND2-OD1 2.95Å; N59-D138 PolarHBondContact ND2-OD2 2.04Å
60	E	77	Confident	71.2	Confident	94 Å²	94	46.8 Å²	46.8	44%	0.439	24%	0.235	S	C	.	.	H	α-helix	trans	-53.3	-43.2	174.7	-66.6	163.2	140	0	0	111.7	T57 L62 N63 K64	T57-E60 VanDerWaalsContact CB-OE2 3.29Å; T57-E60 WeakPolarHBondContact CB-OE2 3.37Å; T57-E60 WeakPolarHBondContact CG2-OE2 3.26Å; T57-E60 PolarHBondContact N-OE2 3.5Å; T57-E60 PolarHBondContact O-N 3.23Å; T57-E60 WeakPolarHBondContact OG1-CG 3.48Å; T57-E60 PolarHBondContact OG1-N 3.31Å; T57-E60 PolarHBondContact OG1-OE2 3.22Å; E60-L62 VanDerWaalsContact C-N 3.32Å; E60-L62 PolarHBondContact O-N 3.38Å; E60-N63 PolarHBondContact O-N 3.47Å; E60-K64 WeakPolarHBondContact O-CG 3.42Å; E60-K64 PolarHBondContact O-N 3.44Å
61	F	79.9	Confident	71.3	Confident	5 Å²	5	47.8 Å²	47.8	2%	0.022	24%	0.235	C	C	.	.	H	α-helix	trans	-49.1	-54.5	178.2	172	-107.2	0	0	0	112.4	L49 M52 E56 T57 N59 L65 M213 K603	L49-F61 HydrophobicContact CD2-CE1 4.2Å; M52-F61 HydrophobicContact CB-CD2 4.4Å; M52-F61 HydrophobicContact CB-CE1 4.19Å; M52-F61 HydrophobicContact CB-CE2 4.09Å; M52-F61 HydrophobicContact CB-CZ 3.96Å; M52-F61 HydrophobicContact CE-CB 3.93Å; M52-F61 HydrophobicContact CE-CD1 4.38Å; M52-F61 HydrophobicContact CE-CD2 3.96Å; M52-F61 HydrophobicContact CE-CG 3.79Å; M52-F61 HydrophobicContact CG-CD1 3.8Å; M52-F61 HydrophobicContact CG-CD2 3.07Å; M52-F61 HydrophobicContact CG-CE1 3.7Å; M52-F61 HydrophobicContact CG-CE2 3.05Å; M52-F61 HydrophobicContact CG-CG 3.54Å; M52-F61 HydrophobicContact CG-CZ 3.37Å; M52-F61 HydrophobicContact SD-CD2 3.67Å; M52-F61 HydrophobicContact SD-CE2 4.16Å; M52-F61 HydrophobicContact SD-CG 4.11Å; E56-F61 WeakPolarHBondContact OE2-CA 3.46Å; T57-F61 WeakPolarHBondContact O-CB 3.4Å; T57-F61 PolarHBondContact O-N 3.47Å; N59-F61 PolarHBondContact O-N 3Å; F61-L65 HydrophobicContact CE1-CD2 4.09Å; F61-L65 HydrophobicContact CZ-CD2 4.01Å; F61-L65 WeakPolarHBondContact O-CB 3.12Å; F61-L65 PolarHBondContact O-N 3.38Å; F61-M213 HydrophobicContact CB-SD 4.41Å; F61-M213 HydrophobicContact CD1-CG 4.29Å; F61-M213 HydrophobicContact CD1-SD 4.12Å; F61-M213 HydrophobicContact CG-SD 4.4Å; F61-K603 PolarHBondContact O-NZ 2.97Å
62	L	81.4	Confident	71.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-71.2	-35.3	-175	-64.1	170.6	0	0	0	111.1	L49 P58 N59 E60 L65 I109 I113 V220	L49-L62 HydrophobicContact CD1-CD2 4.32Å; L49-L62 HydrophobicContact CD2-CD2 3.7Å; P58-L62 WeakPolarHBondContact O-CD1 3.13Å; P58-L62 VanDerWaalsContact O-CG 3.27Å; P58-L62 WeakPolarHBondContact O-CG 3.23Å; N59-L62 PolarHBondContact O-N 2.86Å; E60-L62 VanDerWaalsContact C-N 3.32Å; E60-L62 PolarHBondContact O-N 3.38Å; L62-L65 WeakPolarHBondContact O-CB 3.26Å; L62-L65 PolarHBondContact O-N 3.32Å; L62-I109 HydrophobicContact CD1-CB 4.39Å; L62-I109 HydrophobicContact CD1-CD1 3.64Å; L62-I109 HydrophobicContact CD1-CG2 3.96Å; L62-I109 HydrophobicContact CD2-CD1 3.67Å; L62-I109 HydrophobicContact CG-CD1 4.3Å; L62-I113 HydrophobicContact CD1-CD1 4.14Å; L62-V220 HydrophobicContact CB-CG2 4.3Å; L62-V220 HydrophobicContact CD2-CB 4.24Å; L62-V220 HydrophobicContact CD2-CG2 4.28Å
63	N	78.4	Confident	73.1	Confident	13 Å²	13	47.4 Å²	47.4	7%	0.07	24%	0.242	C	C	.	.	H	α-helix	trans	-66.1	-56.4	179	-58.6	-21.4	0	0	0	110.9	N59 E60 L65 C66 E67 R75 H140	N59-N63 PolarHBondContact O-N 3.12Å; N59-N63 VanDerWaalsContact O-N 3.07Å; N59-N63 PolarHBondContact O-ND2 2.92Å; N59-N63 PolarHBondContact O-OD1 3.31Å; E60-N63 PolarHBondContact O-N 3.47Å; N63-L65 PolarHBondContact O-N 3.39Å; N63-C66 PolarHBondContact O-N 2.96Å; N63-E67 PolarHBondContact O-N 3.5Å; N63-R75 WeakPolarHBondContact OD1-CB 3.43Å; N63-R75 WeakPolarHBondContact OD1-CD 3.23Å; N63-H140 PolarHBondContact ND2-CD2 3.1Å
64	K	77.9	Confident	74.6	Confident	44 Å²	44	44.8 Å²	44.8	19%	0.191	23%	0.232	C	C	.	.	H	α-helix	trans	-68.7	-6.3	175.8	12.5	175.3	159.6	165.5	0	114.2	E56 E60 A68 K402 K603	E56-K64 WeakPolarHBondContact OE1-CE 3.48Å; E56-K64 IonicContact OE1-NZ 3.98Å; E56-K64 PolarHBondContact OE1-NZ 3.35Å; E60-K64 WeakPolarHBondContact O-CG 3.42Å; E60-K64 PolarHBondContact O-N 3.44Å; K64-A68 VanDerWaalsContact O-CB 3.22Å; K64-A68 WeakPolarHBondContact O-CB 3.43Å; K64-A68 PolarHBondContact O-N 3.13Å; K64-K402 HydrophobicContact CB-CD 4.47Å; K64-K402 HydrophobicContact CD-CD 4.17Å; K64-K603 PolarHBondContact O-NZ 3.45Å
65	L	79.5	Confident	76	Confident	19 Å²	19	43.7 Å²	43.7	10%	0.099	22%	0.224	C	C	.	.	H	α-helix	trans	-74.5	-42.4	173.1	178.6	55.5	0	0	0	110.5	M47 L49 F61 L62 N63 T69 V220 K603	M47-L65 HydrophobicContact CE-CD1 4.29Å; M47-L65 HydrophobicContact CE-CG 3.95Å; M47-L65 WeakPolarHBondContact CE-O 3.26Å; L49-L65 HydrophobicContact CD2-CD2 3.49Å; L49-L65 VanDerWaalsContact CD2-CD2 3.49Å; F61-L65 HydrophobicContact CE1-CD2 4.09Å; F61-L65 HydrophobicContact CZ-CD2 4.01Å; F61-L65 WeakPolarHBondContact O-CB 3.12Å; F61-L65 PolarHBondContact O-N 3.38Å; L62-L65 WeakPolarHBondContact O-CB 3.26Å; L62-L65 PolarHBondContact O-N 3.32Å; N63-L65 PolarHBondContact O-N 3.39Å; L65-T69 WeakPolarHBondContact O-CB 3.23Å; L65-T69 PolarHBondContact O-N 3.48Å; L65-T69 PolarHBondContact O-OG1 3.06Å; L65-V220 HydrophobicContact CD2-CB 4.46Å; L65-V220 HydrophobicContact CD2-CG1 3.6Å; L65-V220 HydrophobicContact CG-CG1 4.02Å; L65-K603 VanDerWaalsContact N-NZ 3.11Å
66	C	82	Confident	77.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67	-45.1	174.2	-62.5	0	0	0	0	112.5	N63 A68 T69 F70 R74 C222	N63-C66 PolarHBondContact O-N 2.96Å; C66-A68 VanDerWaalsContact C-N 3.34Å; C66-A68 PolarHBondContact O-N 3.19Å; C66-T69 PolarHBondContact O-N 3.48Å; C66-F70 PolarHBondContact O-N 3.3Å; C66-R74 VanDerWaalsContact CB-C 3.5Å; C66-C222 WeakPolarHBondContact CA-SG 3.11Å; C66-C222 HydrophobicContact CB-CB 3.56Å; C66-C222 WeakPolarHBondContact CB-SG 3.27Å; C66-C222 WeakPolarHBondContact SG-CA 3.26Å; C66-C222 WeakPolarHBondContact SG-CB 3.34Å; C66-C222 CovalentContact SG-SG 2.03Å; C66-C222 PolarHBondContact SG-SG 3.34Å
67	E	81.8	Confident	77.8	Confident	82 Å²	82	34.5 Å²	34.5	38%	0.383	18%	0.184	S	C	.	.	H	α-helix	trans	-60.6	-40	178.5	-64.6	164.8	-163.1	0	0	113.1	N63 T69 G73 K402	N63-E67 PolarHBondContact O-N 3.5Å; E67-T69 VanDerWaalsContact C-N 3.28Å; E67-T69 PolarHBondContact O-N 3.47Å; E67-G73 WeakPolarHBondContact CA-O 3.21Å; E67-G73 WeakPolarHBondContact CG-O 3.43Å; E67-G73 PolarHBondContact N-O 3.33Å; E67-K402 IonicContact OE2-NZ 3.35Å; E67-K402 PolarHBondContact OE2-NZ 2.7Å
68	A	70.6	Confident	77.7	Confident	48 Å²	48	32.7 Å²	32.7	40%	0.397	17%	0.172	S	C	.	.	H	α-helix	trans	-74.9	-18.6	-179.3	0	0	0	0	0	113.2	K64 C66	K64-A68 VanDerWaalsContact O-CB 3.22Å; K64-A68 WeakPolarHBondContact O-CB 3.43Å; K64-A68 PolarHBondContact O-N 3.13Å; C66-A68 VanDerWaalsContact C-N 3.34Å; C66-A68 PolarHBondContact O-N 3.19Å
69	T	70.2	Confident	76.8	Confident	44 Å²	44	34.2 Å²	34.2	27%	0.27	18%	0.179	S	C	.	.	H	α-helix	trans	-105.3	-31.8	-172.4	-47.1	0	0	0	0	112.9	M47 L65 C66 E67 Y262	M47-T69 HydrophobicContact CE-CG2 3.95Å; M47-T69 WeakPolarHBondContact CE-OG1 3.42Å; M47-T69 HydrophobicContact SD-CG2 3.3Å; M47-T69 WeakPolarHBondContact SD-CG2 3.48Å; L65-T69 WeakPolarHBondContact O-CB 3.23Å; L65-T69 PolarHBondContact O-N 3.48Å; L65-T69 PolarHBondContact O-OG1 3.06Å; C66-T69 PolarHBondContact O-N 3.48Å; E67-T69 VanDerWaalsContact C-N 3.28Å; E67-T69 PolarHBondContact O-N 3.47Å; T69-Y262 WeakPolarHBondContact CG2-OH 3.43Å; T69-Y262 VanDerWaalsContact O-CE2 3.27Å; T69-Y262 WeakPolarHBondContact O-CE2 3.46Å; T69-Y262 PolarHBondContact O-OH 2.99Å
70	F	74.4	Confident	76.2	Confident	9 Å²	9	35.4 Å²	35.4	4%	0.039	19%	0.186	C	C	.	.	S	Bend	trans	-122.3	145.8	179.6	-54.8	-71.4	0	0	0	112.6	P28 T45 M47 C66 G72 G73 C222 H224 Y227 Y262	P28-F70 HydrophobicContact CG-CE1 4.49Å; T45-F70 HydrophobicContact CG2-CE1 4.26Å; T45-F70 HydrophobicContact CG2-CE2 4.38Å; T45-F70 HydrophobicContact CG2-CZ 3.58Å; M47-F70 HydrophobicContact CE-CD2 4.41Å; M47-F70 HydrophobicContact CE-CE2 3.83Å; M47-F70 HydrophobicContact CG-CE2 3.71Å; M47-F70 HydrophobicContact CG-CZ 3.81Å; M47-F70 HydrophobicContact SD-CD2 4.27Å; M47-F70 HydrophobicContact SD-CE2 3.3Å; M47-F70 WeakPolarHBondContact SD-CE2 3.49Å; M47-F70 HydrophobicContact SD-CZ 3.51Å; M47-F70 VanDerWaalsContact SD-CZ 3.51Å; C66-F70 PolarHBondContact O-N 3.3Å; F70-G72 PolarHBondContact O-N 3.47Å; F70-G73 WeakPolarHBondContact O-CA 3.43Å; F70-G73 PolarHBondContact O-N 2.73Å; F70-C222 HydrophobicContact CD2-CB 3.69Å; F70-C222 HydrophobicContact CE2-CB 3.56Å; F70-H224 HydrophobicContact CB-CB 3.43Å; F70-H224 VanDerWaalsContact CB-CB 3.43Å; F70-H224 AromaticContact CD1-CD2 3.7Å; F70-H224 AromaticContact CD1-CG 3.96Å; F70-H224 AromaticContact CD1-NE2 3.85Å; F70-H224 HydrophobicContact CD2-CB 4.47Å; F70-H224 AromaticContact CD2-CD2 3.69Å; F70-H224 AromaticContact CE1-NE2 3.89Å; F70-H224 HydrophobicContact CG-CB 3.98Å; F70-H224 AromaticContact CG-CD2 3.51Å; F70-H224 AromaticContact CG-CG 3.69Å; F70-Y227 WeakPolarHBondContact CA-OH 3.33Å; F70-Y227 HydrophobicContact CD1-CE2 4.18Å; F70-Y262 HydrophobicContact CD1-CD2 4.46Å; F70-Y262 AromaticContact CD1-CE2 3.94Å; F70-Y262 HydrophobicContact CD1-CE2 3.94Å; F70-Y262 HydrophobicContact CE1-CE1 4.17Å; F70-Y262 HydrophobicContact CE1-CE2 4.32Å; F70-Y262 AromaticContact CE1-CZ 3.98Å
71	Y	67.1	Low	75.6	Confident	146 Å²	146	32.9 Å²	32.9	57%	0.573	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	115.8	178.6	-175.7	-88	0	0	0	110.1	G73 Y227 R259	Y71-G73 PolarHBondContact O-N 3.28Å; Y71-Y227 PolarHBondContact N-OH 3.17Å; Y71-R259 VanDerWaalsContact CD2-NH2 3.27Å; Y71-R259 VanDerWaalsContact CE2-NH2 3.3Å; Y71-R259 VanDerWaalsContact CG-NH2 3.31Å
72	G	75.9	Confident	75.1	Confident	50 Å²	50	38.7 Å²	38.7	52%	0.515	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	24.1	-168.5	0	0	0	0	0	113	F70	F70-G72 PolarHBondContact O-N 3.47Å
73	G	81.8	Confident	74.5	Confident	5 Å²	5	43 Å²	43	5%	0.052	22%	0.221	C	C	.	.			trans	-67.7	136	178.2	0	0	0	0	0	112.1	E67 F70 Y71 L223	E67-G73 WeakPolarHBondContact CA-O 3.21Å; E67-G73 WeakPolarHBondContact CG-O 3.43Å; E67-G73 PolarHBondContact N-O 3.33Å; F70-G73 WeakPolarHBondContact O-CA 3.43Å; F70-G73 PolarHBondContact O-N 2.73Å; Y71-G73 PolarHBondContact O-N 3.28Å; G73-L223 CarbonylContact C-O 3.54Å; G73-L223 WeakPolarHBondContact CA-O 3.32Å
74	R	85	Confident	74.2	Confident	78 Å²	78	42.6 Å²	42.6	29%	0.294	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	157.6	172.8	57.9	-171.7	170.4	159	6.3	109.3	C66 Y76 E142 C222 L223	C66-R74 VanDerWaalsContact CB-C 3.5Å; R74-Y76 PolarHBondContact O-N 3.46Å; R74-E142 IonicContact CZ-OE1 3.97Å; R74-E142 IonicContact NH1-OE1 2.61Å; R74-E142 PolarHBondContact NH1-OE1 3.08Å; R74-E142 IonicContact NH2-OE1 2.94Å; R74-E142 PolarHBondContact NH2-OE1 2.04Å; R74-C222 CarbonylContact O-C 3.59Å; R74-C222 WeakPolarHBondContact O-CA 3.2Å; R74-L223 HydrophobicContact CG-CB 4Å; R74-L223 HydrophobicContact CG-CD2 4.4Å; R74-L223 HydrophobicContact CG-CG 4.43Å; R74-L223 PolarHBondContact N-O 2.86Å; R74-L223 PolarHBondContact O-N 2.95Å
75	R	85.3	Confident	73.9	Confident	10 Å²	10	43.2 Å²	43.2	4%	0.038	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	130	177.1	-175.5	177.2	174.7	-171.1	-7.4	110.2	N59 N63 G110 V220	N59-R75 PolarHBondContact OD1-NH1 2.95Å; N63-R75 WeakPolarHBondContact OD1-CB 3.43Å; N63-R75 WeakPolarHBondContact OD1-CD 3.23Å; R75-G110 PolarHBondContact NH2-O 3.1Å; R75-V220 HydrophobicContact CG-CG2 4.2Å
76	Y	83.1	Confident	73.4	Confident	13 Å²	13	48.5 Å²	48.5	5%	0.051	24%	0.243	C	C	.	.			trans	-95.9	108.7	169.6	-171.3	-99.1	0	0	0	109.2	F37 W39 V44 R74 F78 R83 A221 L223	F37-Y76 HydrophobicContact CE1-CE1 4.28Å; F37-Y76 HydrophobicContact CZ-CD1 4.3Å; F37-Y76 AromaticContact CZ-CE1 3.57Å; F37-Y76 HydrophobicContact CZ-CE1 3.57Å; F37-Y76 AromaticContact CZ-CZ 3.86Å; W39-Y76 HydrophobicContact CD2-CE2 4.11Å; W39-Y76 HydrophobicContact CG-CE2 4.09Å; V44-Y76 HydrophobicContact CB-CD1 4.4Å; V44-Y76 HydrophobicContact CB-CG 4.36Å; V44-Y76 HydrophobicContact CG1-CD1 3.59Å; V44-Y76 HydrophobicContact CG1-CE1 4.27Å; V44-Y76 HydrophobicContact CG1-CG 3.76Å; V44-Y76 HydrophobicContact CG2-CD1 3.88Å; V44-Y76 HydrophobicContact CG2-CD2 3.57Å; V44-Y76 HydrophobicContact CG2-CE1 4.09Å; V44-Y76 HydrophobicContact CG2-CE2 3.77Å; V44-Y76 HydrophobicContact CG2-CG 3.59Å; R74-Y76 PolarHBondContact O-N 3.46Å; Y76-F78 HydrophobicContact CD1-CD1 4.11Å; Y76-F78 HydrophobicContact CE1-CB 4.14Å; Y76-F78 HydrophobicContact CE1-CD1 4.18Å; Y76-R83 PolarHBondContact OH-O 2.84Å; Y76-A221 HydrophobicContact CD1-CB 4.29Å; Y76-A221 PolarHBondContact N-O 2.95Å; Y76-A221 WeakPolarHBondContact O-CB 3.39Å; Y76-L223 HydrophobicContact CD2-CB 3.99Å; Y76-L223 HydrophobicContact CD2-CD1 4.26Å; Y76-L223 HydrophobicContact CD2-CD2 4.06Å; Y76-L223 HydrophobicContact CD2-CG 4.36Å; Y76-L223 HydrophobicContact CG-CB 4.42Å
77	G	74	Confident	72.8	Confident	8 Å²	8	53.2 Å²	53.2	8%	0.082	28%	0.276	C	S	.	.			trans	-94.6	124.8	170.5	0	0	0	0	0	111.4	R83 H111	G77-R83 PolarHBondContact O-NH1 3.18Å; G77-H111 PolarHBondContact O-CD2 2.85Å; G77-H111 VanDerWaalsContact O-CD2 3.28Å
78	F	71	Confident	72.4	Confident	5 Å²	5	53 Å²	53	2%	0.022	27%	0.274	C	S	.	.			trans	-102	147.4	161.3	50.6	-96.5	0	0	0	109.3	F46 Y76 R83 I84 P108 Y201 A221	F46-F78 AromaticContact CE1-CE1 3.83Å; F46-F78 HydrophobicContact CE1-CE1 3.83Å; F46-F78 HydrophobicContact CE1-CZ 4.48Å; F46-F78 HydrophobicContact CZ-CE1 4.18Å; Y76-F78 HydrophobicContact CD1-CD1 4.11Å; Y76-F78 HydrophobicContact CE1-CB 4.14Å; Y76-F78 HydrophobicContact CE1-CD1 4.18Å; F78-R83 HydrophobicContact CB-CB 4.13Å; F78-I84 HydrophobicContact CD1-CD1 4.42Å; F78-P108 HydrophobicContact CE1-CB 4.18Å; F78-P108 HydrophobicContact CE1-CG 4.3Å; F78-P108 HydrophobicContact CE2-CG 4.4Å; F78-P108 HydrophobicContact CZ-CB 3.69Å; F78-P108 HydrophobicContact CZ-CG 3.56Å; F78-Y201 AromaticContact CD2-CE1 3.51Å; F78-Y201 HydrophobicContact CD2-CE1 3.51Å; F78-Y201 AromaticContact CD2-CZ 3.71Å; F78-Y201 WeakPolarHBondContact CD2-OH 3.11Å; F78-Y201 AromaticContact CE2-CE1 3.67Å; F78-Y201 HydrophobicContact CE2-CE1 3.67Å; F78-Y201 HydrophobicContact CG-CE1 4.46Å; F78-Y201 WeakPolarHBondContact CG-OH 3Å; F78-A221 HydrophobicContact CD1-CB 4.49Å; F78-A221 HydrophobicContact CE1-CB 3.99Å
79	M	60	Low	72.5	Confident	38 Å²	38	52 Å²	52	19%	0.187	26%	0.26	C	S	.	.	S	Bend	trans	-108.7	-23.7	174.1	-63.7	-178.6	179.6	0	0	111.9	H111 F112 L168 K171	M79-H111 HydrophobicContact CG-CB 4.26Å; M79-F112 HydrophobicContact CG-CE1 4.21Å; M79-L168 HydrophobicContact CE-CD1 3.95Å; M79-L168 HydrophobicContact CE-CD2 4.15Å; M79-L168 HydrophobicContact CE-CG 4.37Å; M79-L168 HydrophobicContact CG-CD2 4.31Å; M79-L168 HydrophobicContact SD-CD1 4.46Å; M79-L168 HydrophobicContact SD-CD2 3.9Å; M79-L168 HydrophobicContact SD-CG 4.26Å; M79-K171 PolarHBondContact O-NZ 3.47Å
80	N	63.6	Low	72.5	Confident	33 Å²	33	52.8 Å²	52.8	18%	0.176	26%	0.258	C	S	.	.	S	Bend	trans	-148.5	160.2	-172.1	55.9	-31.6	0	0	0	110.3	D82 R83 Y201	N80-D82 PolarHBondContact ND2-OD2 3.34Å; N80-D82 PolarHBondContact O-N 3.44Å; N80-R83 PolarHBondContact O-N 3.08Å; N80-R83 WeakPolarHBondContact OD1-CD 3.01Å; N80-R83 WeakPolarHBondContact OD1-CG 3.49Å; N80-R83 PolarHBondContact OD1-NE 3.36Å; N80-Y201 PolarHBondContact O-OH 2.84Å
81	Q	65.5	Low	72.1	Confident	40 Å²	40	54.2 Å²	54.2	19%	0.187	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-59.7	-30.8	179	-173.9	168.7	9	0	0	112.9	R83 I84 G199 D200 Y201	Q81-R83 PolarHBondContact O-N 3.07Å; Q81-R83 VanDerWaalsContact O-N 3.15Å; Q81-I84 PolarHBondContact O-N 3.12Å; Q81-G199 PolarHBondContact NE2-O 2.03Å; Q81-G199 VanDerWaalsContact NE2-O 3.14Å; Q81-D200 VanDerWaalsContact NE2-CA 3.29Å; Q81-D200 PolarHBondContact NE2-OD1 3.18Å; Q81-Y201 HydrophobicContact CB-CD2 3.5Å; Q81-Y201 VanDerWaalsContact CB-CD2 3.5Å; Q81-Y201 HydrophobicContact CB-CE2 3.71Å; Q81-Y201 HydrophobicContact CB-CG 4.18Å; Q81-Y201 HydrophobicContact CG-CD2 3.55Å; Q81-Y201 HydrophobicContact CG-CE2 3.78Å
82	D	69.3	Low	71.8	Confident	128 Å²	128	48.6 Å²	48.6	68%	0.684	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-67.8	-15.2	-176	-34.3	-61.9	0	0	0	113.4	N80	N80-D82 PolarHBondContact ND2-OD2 3.34Å; N80-D82 PolarHBondContact O-N 3.44Å
83	R	68.9	Low	70.9	Confident	90 Å²	90	48.5 Å²	48.5	34%	0.34	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-79.3	-18.5	170.4	-74.9	177.9	-170.5	-152.8	0	113.5	Y76 G77 F78 N80 Q81	Y76-R83 PolarHBondContact OH-O 2.84Å; G77-R83 PolarHBondContact O-NH1 3.18Å; F78-R83 HydrophobicContact CB-CB 4.13Å; N80-R83 PolarHBondContact O-N 3.08Å; N80-R83 WeakPolarHBondContact OD1-CD 3.01Å; N80-R83 WeakPolarHBondContact OD1-CG 3.49Å; N80-R83 PolarHBondContact OD1-NE 3.36Å; Q81-R83 PolarHBondContact O-N 3.07Å; Q81-R83 VanDerWaalsContact O-N 3.15Å
84	I	71.1	Confident	69.6	Low	5 Å²	5	55.8 Å²	55.8	3%	0.026	26%	0.264	C	S	.	.	S	Bend	trans	-93.4	108.9	172.8	-61.1	-171.4	0	0	0	108.2	F37 F46 F78 Q81 R86 W89 L195 Y201	F37-I84 HydrophobicContact CD1-CG2 4.11Å; F37-I84 HydrophobicContact CE1-CB 4.4Å; F37-I84 HydrophobicContact CE1-CD1 4.13Å; F37-I84 HydrophobicContact CE1-CG1 3.8Å; F37-I84 HydrophobicContact CE1-CG2 4.14Å; F37-I84 HydrophobicContact CG-CG2 4.32Å; F37-I84 HydrophobicContact CZ-CB 4.3Å; F37-I84 HydrophobicContact CZ-CG1 3.81Å; F37-I84 HydrophobicContact CZ-CG2 4.37Å; F46-I84 HydrophobicContact CZ-CD1 4.25Å; F78-I84 HydrophobicContact CD1-CD1 4.42Å; Q81-I84 PolarHBondContact O-N 3.12Å; I84-R86 PolarHBondContact O-N 3.1Å; I84-W89 HydrophobicContact CD1-CZ3 3.89Å; I84-W89 HydrophobicContact CG2-CD2 4.44Å; I84-W89 HydrophobicContact CG2-CE3 3.55Å; I84-W89 HydrophobicContact CG2-CZ3 3.92Å; I84-L195 HydrophobicContact CD1-CD1 3.85Å; I84-Y201 HydrophobicContact CD1-CE2 3.79Å; I84-Y201 WeakPolarHBondContact CD1-OH 3.25Å; I84-Y201 HydrophobicContact CG1-CE2 4.3Å; I84-Y201 WeakPolarHBondContact CG1-OH 3.17Å
85	D	71	Confident	68.1	Low	56 Å²	56	54.7 Å²	54.7	30%	0.299	27%	0.266	S	S	.	.			trans	-68.4	97.6	169.1	-174	-17.4	0	0	0	109.5	S87 K88 W89	D85-S87 PolarHBondContact O-N 3.41Å; D85-S87 VanDerWaalsContact O-N 3.16Å; D85-S87 WeakPolarHBondContact OD1-CB 3.5Å; D85-S87 PolarHBondContact OD1-N 3.35Å; D85-S87 PolarHBondContact OD1-OG 3.13Å; D85-K88 HydrophobicContact CB-CB 4.42Å; D85-K88 HydrophobicContact CB-CG 4.38Å; D85-K88 PolarHBondContact O-N 3.16Å; D85-K88 IonicContact OD2-NZ 3.72Å; D85-K88 PolarHBondContact OD2-NZ 2.91Å; D85-W89 PolarHBondContact O-N 3.08Å
86	R	69.7	Low	66.5	Low	130 Å²	130	54.3 Å²	54.3	49%	0.491	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-58.4	-27.8	-178.5	-51.5	-172.9	-143.6	-172.2	8.8	112.3	I84 K88 W89 D200	I84-R86 PolarHBondContact O-N 3.1Å; R86-K88 PolarHBondContact O-N 3.5Å; R86-W89 WeakPolarHBondContact O-CB 3.42Å; R86-W89 PolarHBondContact O-N 3.47Å; R86-D200 IonicContact CZ-OD1 3.73Å; R86-D200 IonicContact NH1-OD1 2.71Å; R86-D200 PolarHBondContact NH1-OD1 3.07Å
87	S	70	Confident	65	Low	100 Å²	100	62.8 Å²	62.8	70%	0.699	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-69.1	-20.9	177.3	77	0	0	0	0	112.9	D85	D85-S87 PolarHBondContact O-N 3.41Å; D85-S87 VanDerWaalsContact O-N 3.16Å; D85-S87 WeakPolarHBondContact OD1-CB 3.5Å; D85-S87 PolarHBondContact OD1-N 3.35Å; D85-S87 PolarHBondContact OD1-OG 3.13Å
88	K	73.6	Confident	63.9	Low	76 Å²	76	71.7 Å²	71.7	33%	0.33	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-107.1	9.3	178.9	-53.1	-162.7	-174.8	88	0	112.8	F37 K38 D85 R86 W90	F37-K88 WeakPolarHBondContact CA-O 3.47Å; F37-K88 HydrophobicContact CB-CB 4.47Å; F37-K88 WeakPolarHBondContact CB-O 3.49Å; K38-K88 HydrophobicContact CB-CB 4.1Å; K38-K88 HydrophobicContact CB-CD 3.55Å; K38-K88 HydrophobicContact CB-CG 4.42Å; D85-K88 HydrophobicContact CB-CB 4.42Å; D85-K88 HydrophobicContact CB-CG 4.38Å; D85-K88 PolarHBondContact O-N 3.16Å; D85-K88 IonicContact OD2-NZ 3.72Å; D85-K88 PolarHBondContact OD2-NZ 2.91Å; R86-K88 PolarHBondContact O-N 3.5Å; K88-W90 HydrophobicContact CB-CZ2 4.5Å
89	W	72.3	Confident	62.9	Low	28 Å²	28	75.5 Å²	75.5	11%	0.106	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	129.7	179.2	-173.6	-105.4	0	0	0	112	I35 F37 F46 I84 D85 R86 F91 I106 L195 Q197	I35-W89 HydrophobicContact CG2-CH2 4.43Å; I35-W89 HydrophobicContact CG2-CZ2 4.08Å; F37-W89 HydrophobicContact CB-CE3 4.06Å; F37-W89 AromaticContact CD1-CE3 3.69Å; F37-W89 HydrophobicContact CD1-CE3 3.69Å; F37-W89 AromaticContact CD1-CZ3 3.63Å; F37-W89 HydrophobicContact CD1-CZ3 3.63Å; F37-W89 HydrophobicContact CE1-CZ3 4.14Å; F37-W89 HydrophobicContact CG-CE3 4.21Å; F46-W89 AromaticContact CD2-CH2 3.89Å; F46-W89 HydrophobicContact CD2-CH2 3.89Å; F46-W89 HydrophobicContact CD2-CZ3 4.13Å; F46-W89 HydrophobicContact CE1-CH2 4.29Å; F46-W89 HydrophobicContact CE2-CE3 4.45Å; F46-W89 AromaticContact CE2-CH2 3.37Å; F46-W89 HydrophobicContact CE2-CH2 3.37Å; F46-W89 AromaticContact CE2-CZ3 3.26Å; F46-W89 HydrophobicContact CE2-CZ3 3.26Å; F46-W89 AromaticContact CZ-CH2 3.58Å; F46-W89 HydrophobicContact CZ-CH2 3.58Å; F46-W89 AromaticContact CZ-CZ3 3.58Å; F46-W89 HydrophobicContact CZ-CZ3 3.58Å; I84-W89 HydrophobicContact CD1-CZ3 3.89Å; I84-W89 HydrophobicContact CG2-CD2 4.44Å; I84-W89 HydrophobicContact CG2-CE3 3.55Å; I84-W89 HydrophobicContact CG2-CZ3 3.92Å; D85-W89 PolarHBondContact O-N 3.08Å; R86-W89 WeakPolarHBondContact O-CB 3.42Å; R86-W89 PolarHBondContact O-N 3.47Å; W89-F91 HydrophobicContact CZ2-CD2 4.46Å; W89-F91 AromaticContact NE1-CD2 3.93Å; W89-I106 HydrophobicContact CH2-CD1 4.11Å; W89-I106 HydrophobicContact CZ2-CD1 4.24Å; W89-L195 HydrophobicContact CH2-CD1 3.71Å; W89-L195 HydrophobicContact CZ2-CD1 4.37Å; W89-L195 HydrophobicContact CZ3-CD1 4.39Å; W89-Q197 PolarHBondContact NE1-O 2.66Å
90	W	69	Low	62.4	Low	61 Å²	61	75.1 Å²	75.1	23%	0.231	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	119.8	179.4	-48.8	-64.9	0	0	0	110.9	C27 S29 E30 G36 F37 K38 K88	C27-W90 HydrophobicContact CB-CH2 4.31Å; C27-W90 HydrophobicContact CB-CZ3 3.77Å; S29-W90 WeakPolarHBondContact OG-CZ3 3.4Å; E30-W90 VanDerWaalsContact CD-CH2 3.42Å; E30-W90 HydrophobicContact CG-CD2 3.88Å; E30-W90 VanDerWaalsContact CG-CE2 3.48Å; E30-W90 HydrophobicContact CG-CE3 3.99Å; E30-W90 HydrophobicContact CG-CH2 3.24Å; E30-W90 HydrophobicContact CG-CZ2 3.18Å; E30-W90 HydrophobicContact CG-CZ3 3.68Å; E30-W90 VanDerWaalsContact OE1-CH2 3.29Å; E30-W90 WeakPolarHBondContact OE1-CH2 3.08Å; E30-W90 VanDerWaalsContact OE1-CZ2 3.26Å; E30-W90 WeakPolarHBondContact OE1-CZ2 3.03Å; G36-W90 PolarHBondContact N-O 3.3Å; G36-W90 PolarHBondContact O-N 3.47Å; F37-W90 VanDerWaalsContact CA-CE3 3.45Å; F37-W90 VanDerWaalsContact CA-CZ3 3.41Å; K38-W90 HydrophobicContact CB-CH2 3.47Å; K38-W90 VanDerWaalsContact CB-CH2 3.47Å; K38-W90 HydrophobicContact CB-CZ2 4.17Å; K38-W90 HydrophobicContact CB-CZ3 4.25Å; K38-W90 HydrophobicContact CD-CH2 4.22Å; K38-W90 HydrophobicContact CG-CH2 3.88Å; K88-W90 HydrophobicContact CB-CZ2 4.5Å
91	F	66.5	Low	61.7	Low	38 Å²	38	78.7 Å²	78.7	17%	0.167	38%	0.378	C	S	.	.			trans	-133	102.3	-172.2	-171.3	-95.5	0	0	0	109.7	I35 W89 T93 I96 N104 Q197	I35-F91 HydrophobicContact CG2-CD2 4.1Å; W89-F91 HydrophobicContact CZ2-CD2 4.46Å; W89-F91 AromaticContact NE1-CD2 3.93Å; F91-T93 HydrophobicContact CD1-CG2 3.95Å; F91-T93 HydrophobicContact CE1-CG2 3.9Å; F91-T93 PolarHBondContact O-N 3.4Å; F91-I96 HydrophobicContact CD1-CD1 4.11Å; F91-I96 HydrophobicContact CD2-CD1 3.79Å; F91-I96 HydrophobicContact CE1-CD1 3.58Å; F91-I96 HydrophobicContact CE2-CD1 3.23Å; F91-I96 HydrophobicContact CG-CD1 4.21Å; F91-I96 HydrophobicContact CZ-CD1 3.12Å; F91-N104 HydrophobicContact CE1-CB 4.14Å; F91-N104 HydrophobicContact CZ-CB 4.16Å; F91-Q197 HydrophobicContact CD1-CB 3.81Å; F91-Q197 HydrophobicContact CE1-CB 3.48Å; F91-Q197 VanDerWaalsContact CE1-CB 3.48Å; F91-Q197 HydrophobicContact CE2-CB 4.49Å; F91-Q197 HydrophobicContact CG-CB 4.44Å; F91-Q197 HydrophobicContact CZ-CB 3.85Å
92	D	61.2	Low	61.2	Low	28 Å²	28	82.6 Å²	82.6	15%	0.15	40%	0.396	C	S	.	.			trans	-88.4	101.9	173.2	-162.6	-18.5	0	0	0	111.4	K32 K94 V95 I96	K32-D92 HydrophobicContact CB-CB 4.34Å; D92-K94 PolarHBondContact O-N 3.23Å; D92-K94 VanDerWaalsContact O-N 3.07Å; D92-K94 VanDerWaalsContact OD1-CB 3.24Å; D92-K94 WeakPolarHBondContact OD1-CB 3.45Å; D92-K94 WeakPolarHBondContact OD1-CG 3.04Å; D92-K94 PolarHBondContact OD1-N 3.47Å; D92-V95 HydrophobicContact CB-CB 4.38Å; D92-V95 HydrophobicContact CB-CG2 3.91Å; D92-V95 PolarHBondContact O-N 3.38Å; D92-I96 PolarHBondContact O-N 3.31Å
93	T	56.1	Low	60.7	Low	49 Å²	49	78.2 Å²	78.2	30%	0.301	38%	0.381	S	S	.	.	H	α-helix	trans	-53.3	-24.5	172.4	58.1	0	0	0	0	113.8	F91 R97	F91-T93 HydrophobicContact CD1-CG2 3.95Å; F91-T93 HydrophobicContact CE1-CG2 3.9Å; F91-T93 PolarHBondContact O-N 3.4Å; T93-R97 VanDerWaalsContact O-CB 3.26Å; T93-R97 WeakPolarHBondContact O-CB 3.42Å; T93-R97 WeakPolarHBondContact O-CG 3.02Å; T93-R97 PolarHBondContact O-N 3.2Å
94	K	56.2	Low	60.5	Low	158 Å²	158	76.4 Å²	76.4	69%	0.687	38%	0.378	S	S	*	.	H	α-helix	trans	-74.3	-33.9	176.7	-61.3	-178.2	178.3	-176.8	0	112.9	D92	D92-K94 PolarHBondContact O-N 3.23Å; D92-K94 VanDerWaalsContact O-N 3.07Å; D92-K94 VanDerWaalsContact OD1-CB 3.24Å; D92-K94 WeakPolarHBondContact OD1-CB 3.45Å; D92-K94 WeakPolarHBondContact OD1-CG 3.04Å; D92-K94 PolarHBondContact OD1-N 3.47Å
95	V	53.4	Low	60.6	Low	54 Å²	54	82.2 Å²	82.2	33%	0.327	40%	0.4	S	S	.	.	H	α-helix	trans	-69.4	-39.5	175.1	176.7	0	0	0	0	109.8	D92 T99	D92-V95 HydrophobicContact CB-CB 4.38Å; D92-V95 HydrophobicContact CB-CG2 3.91Å; D92-V95 PolarHBondContact O-N 3.38Å; V95-T99 PolarHBondContact O-OG1 2.97Å
96	I	51.2	Low	60.9	Low	2 Å²	2	79.6 Å²	79.6	1%	0.01	39%	0.386	C	S	.	.	H	α-helix	trans	-74.1	-46	-179.1	-63	167.9	0	0	0	111.6	I35 F91 D92 K98 T99 W100 G103	I35-I96 HydrophobicContact CD1-CD1 3.62Å; I35-I96 HydrophobicContact CD1-CG1 3.67Å; I35-I96 HydrophobicContact CG1-CD1 4.22Å; I35-I96 HydrophobicContact CG1-CG1 4.38Å; F91-I96 HydrophobicContact CD1-CD1 4.11Å; F91-I96 HydrophobicContact CD2-CD1 3.79Å; F91-I96 HydrophobicContact CE1-CD1 3.58Å; F91-I96 HydrophobicContact CE2-CD1 3.23Å; F91-I96 HydrophobicContact CG-CD1 4.21Å; F91-I96 HydrophobicContact CZ-CD1 3.12Å; D92-I96 PolarHBondContact O-N 3.31Å; I96-K98 PolarHBondContact O-N 3.27Å; I96-K98 VanDerWaalsContact O-N 3.08Å; I96-T99 PolarHBondContact O-N 3.34Å; I96-W100 HydrophobicContact CG2-CB 4.21Å; I96-W100 HydrophobicContact CG2-CG 4.22Å; I96-W100 PolarHBondContact O-N 3.36Å; I96-G103 WeakPolarHBondContact CG2-O 3.4Å
97	R	51.4	Low	61.6	Low	192 Å²	192	76.1 Å²	76.1	73%	0.725	37%	0.373	S	S	*	.	H	α-helix	trans	-59.5	-21.8	-179.8	-81.4	177.4	178.2	-169.9	-0	114.9	T93	T93-R97 VanDerWaalsContact O-CB 3.26Å; T93-R97 WeakPolarHBondContact O-CB 3.42Å; T93-R97 WeakPolarHBondContact O-CG 3.02Å; T93-R97 PolarHBondContact O-N 3.2Å
98	K	50	Low	62.3	Low	194 Å²	194	71.3 Å²	71.3	84%	0.843	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-14	175.2	-86.6	-168.4	171	-171	0	114.3	I96	I96-K98 PolarHBondContact O-N 3.27Å; I96-K98 VanDerWaalsContact O-N 3.08Å
99	T	50.1	Low	62.9	Low	85 Å²	85	67.8 Å²	67.8	52%	0.521	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.3	-7.8	-158.1	-28.1	0	0	0	0	113.8	V95 I96	V95-T99 PolarHBondContact O-OG1 2.97Å; I96-T99 PolarHBondContact O-N 3.34Å
100	W	49.4	Very low	63.2	Low	31 Å²	31	66.8 Å²	66.8	12%	0.117	32%	0.322	C	S	.	.			trans	-137.1	128.7	-170.5	-67.7	78.1	0	0	0	114.1	L48 I96 H102 D217 H219	L48-W100 HydrophobicContact CB-CZ2 4.27Å; L48-W100 HydrophobicContact CD1-CH2 3.42Å; L48-W100 VanDerWaalsContact CD1-CH2 3.42Å; L48-W100 HydrophobicContact CD1-CZ2 3.31Å; L48-W100 HydrophobicContact CD2-CZ2 3.86Å; L48-W100 HydrophobicContact CG-CZ2 3.99Å; I96-W100 HydrophobicContact CG2-CB 4.21Å; I96-W100 HydrophobicContact CG2-CG 4.22Å; I96-W100 PolarHBondContact O-N 3.36Å; W100-H102 VanDerWaalsContact C-N 3.28Å; W100-H102 PolarHBondContact O-N 3.17Å; W100-D217 VanDerWaalsContact CH2-CA 3.47Å; W100-D217 HydrophobicContact CH2-CB 4.49Å; W100-D217 WeakPolarHBondContact CH2-O 3.03Å; W100-D217 VanDerWaalsContact CZ3-CA 3.43Å; W100-D217 HydrophobicContact CZ3-CB 3.97Å; W100-D217 WeakPolarHBondContact CZ3-O 2.97Å; W100-H219 AromaticContact CE2-CE1 3.95Å; W100-H219 AromaticContact CH2-CE1 3.07Å; W100-H219 WeakPolarHBondContact CH2-CE1 3.45Å; W100-H219 AromaticContact CH2-ND1 3.56Å; W100-H219 AromaticContact CH2-NE2 4Å; W100-H219 AromaticContact CZ2-CE1 3.03Å; W100-H219 WeakPolarHBondContact CZ2-CE1 3.42Å; W100-H219 AromaticContact CZ2-ND1 3.88Å; W100-H219 AromaticContact CZ2-NE2 3.51Å
101	P	49.8	Very low	63.4	Low	107 Å²	107	64 Å²	64	70%	0.695	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-9.2	173.6	29.7	-32.5	0	0	0	114.2
102	H	56	Low	63.9	Low	122 Å²	122	62.2 Å²	62.2	57%	0.565	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	15.6	-169	-64.5	-53.2	0	0	0	116.1	W100	W100-H102 VanDerWaalsContact C-N 3.28Å; W100-H102 PolarHBondContact O-N 3.17Å
103	G	57.3	Low	64.8	Low	36 Å²	36	60.9 Å²	60.9	37%	0.371	30%	0.297	S	S	.	.			trans	78	-150.9	168.4	0	0	0	0	0	115.5	I96 R105	I96-G103 WeakPolarHBondContact CG2-O 3.4Å; G103-R105 PolarHBondContact O-N 2.92Å
104	N	64.6	Low	65.7	Low	53 Å²	53	58.7 Å²	58.7	28%	0.283	28%	0.283	S	S	.	.	S	Bend	trans	-82	48.3	-168.8	-63.9	0.8	0	0	0	113.5	F91 Q197	F91-N104 HydrophobicContact CE1-CB 4.14Å; F91-N104 HydrophobicContact CZ-CB 4.16Å; N104-Q197 HydrophobicContact CB-CB 4.27Å; N104-Q197 PolarHBondContact ND2-OE1 2.66Å; N104-Q197 PolarHBondContact O-N 3.22Å
105	R	73.8	Confident	66.6	Low	127 Å²	127	53.9 Å²	53.9	48%	0.479	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151.5	178.2	-59.9	-175.2	-171.8	-173	2.9	111.4	G103 L195	G103-R105 PolarHBondContact O-N 2.92Å; R105-L195 CarbonylContact C-O 3.54Å; R105-L195 VanDerWaalsContact CA-O 3.25Å; R105-L195 WeakPolarHBondContact CA-O 3.22Å
106	I	78.2	Confident	67.1	Low	0 Å²	0	52 Å²	52	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	152.6	168.9	61.2	168.4	0	0	0	110.5	I35 F46 W89 P108 L195 H219	I35-I106 HydrophobicContact CD1-CG2 3.82Å; I35-I106 HydrophobicContact CG2-CD1 4.21Å; F46-I106 HydrophobicContact CB-CD1 4.1Å; F46-I106 HydrophobicContact CD1-CD1 3.58Å; F46-I106 HydrophobicContact CD2-CD1 4.38Å; F46-I106 HydrophobicContact CE1-CD1 4.08Å; F46-I106 HydrophobicContact CG-CD1 3.74Å; W89-I106 HydrophobicContact CH2-CD1 4.11Å; W89-I106 HydrophobicContact CZ2-CD1 4.24Å; I106-P108 WeakPolarHBondContact O-CD 3.36Å; I106-L195 HydrophobicContact CD1-CB 4.47Å; I106-L195 HydrophobicContact CD1-CD1 4.2Å; I106-L195 HydrophobicContact CG1-CB 3.81Å; I106-L195 HydrophobicContact CG1-CD1 4.37Å; I106-L195 HydrophobicContact CG1-CG 4.45Å; I106-L195 PolarHBondContact N-O 3.03Å; I106-L195 PolarHBondContact O-N 3.18Å; I106-H219 VanDerWaalsContact CB-CE1 3.44Å; I106-H219 WeakPolarHBondContact CB-CE1 3.28Å; I106-H219 WeakPolarHBondContact CG2-CE1 3.4Å
107	W	83.6	Confident	67.7	Low	57 Å²	57	53.8 Å²	53.8	22%	0.216	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	70.2	-175.9	-57.3	79.4	0	0	0	111.7	V192 C193 T194 D217 Y218 H219	W107-V192 HydrophobicContact CB-CG1 3.9Å; W107-V192 HydrophobicContact CE3-CG1 4.17Å; W107-C193 WeakPolarHBondContact CA-O 3.23Å; W107-T194 HydrophobicContact CD2-CG2 3.83Å; W107-T194 HydrophobicContact CE3-CG2 3.47Å; W107-T194 VanDerWaalsContact CE3-CG2 3.47Å; W107-T194 HydrophobicContact CH2-CG2 3.53Å; W107-T194 HydrophobicContact CZ2-CG2 3.89Å; W107-T194 HydrophobicContact CZ3-CG2 3.31Å; W107-D217 WeakPolarHBondContact CB-O 3.24Å; W107-Y218 HydrophobicContact CB-CD1 3.75Å; W107-Y218 HydrophobicContact CB-CE1 4.25Å; W107-Y218 CarbonylContact O-C 3.57Å; W107-Y218 VanDerWaalsContact O-CA 3.32Å; W107-Y218 WeakPolarHBondContact O-CA 3.44Å; W107-H219 PolarHBondContact O-N 2.98Å
108	P	85	Confident	67.9	Low	0 Å²	0	47 Å²	47	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	142.1	-177	33.8	-39.4	0	0	0	112.5	F46 F78 I106 C193 L195 H219	F46-P108 HydrophobicContact CD1-CB 3.85Å; F46-P108 HydrophobicContact CD1-CG 4.41Å; F46-P108 HydrophobicContact CE1-CB 3.76Å; F46-P108 HydrophobicContact CE1-CG 4.03Å; F78-P108 HydrophobicContact CE1-CB 4.18Å; F78-P108 HydrophobicContact CE1-CG 4.3Å; F78-P108 HydrophobicContact CE2-CG 4.4Å; F78-P108 HydrophobicContact CZ-CB 3.69Å; F78-P108 HydrophobicContact CZ-CG 3.56Å; I106-P108 WeakPolarHBondContact O-CD 3.36Å; P108-C193 VanDerWaalsContact CD-O 3.31Å; P108-C193 WeakPolarHBondContact CD-O 3.37Å; P108-C193 PolarHBondContact O-N 3.46Å; P108-L195 HydrophobicContact CG-CD1 3.73Å; P108-L195 HydrophobicContact CG-CG 3.8Å; P108-H219 CarbonylContact C-O 3.23Å; P108-H219 VanDerWaalsContact CA-O 3.31Å; P108-H219 WeakPolarHBondContact CA-O 3.48Å; P108-H219 HydrophobicContact CB-CB 4.18Å
109	I	85.4	Confident	68	Low	2 Å²	2	47.1 Å²	47.1	1%	0.01	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-72.2	133.5	170.1	-53.7	178.6	0	0	0	108.6	L49 L62 C190 P191 V192 V212 H219	L49-I109 HydrophobicContact CD1-CD1 3.58Å; L49-I109 HydrophobicContact CD1-CG1 4.33Å; L62-I109 HydrophobicContact CD1-CB 4.39Å; L62-I109 HydrophobicContact CD1-CD1 3.64Å; L62-I109 HydrophobicContact CD1-CG2 3.96Å; L62-I109 HydrophobicContact CD2-CD1 3.67Å; L62-I109 HydrophobicContact CG-CD1 4.3Å; I109-C190 HydrophobicContact CG2-CB 4.47Å; I109-P191 CarbonylContact C-O 3.47Å; I109-P191 VanDerWaalsContact CA-O 3.27Å; I109-P191 WeakPolarHBondContact CA-O 3.46Å; I109-P191 HydrophobicContact CG2-CG 4.49Å; I109-P191 WeakPolarHBondContact CG2-O 3.4Å; I109-V192 HydrophobicContact CG1-CG2 4.49Å; I109-V212 HydrophobicContact CD1-CG1 3.45Å; I109-V212 VanDerWaalsContact CD1-CG1 3.45Å; I109-V212 HydrophobicContact CG1-CG1 3.66Å; I109-H219 PolarHBondContact N-O 2.8Å
110	G	78.2	Confident	68.3	Low	6 Å²	6	50.3 Å²	50.3	6%	0.062	26%	0.26	C	S	.	.			trans	-66	-172.5	172.9	0	0	0	0	0	113.7	R75 P191	R75-G110 PolarHBondContact NH2-O 3.1Å; G110-P191 PolarHBondContact N-O 2.67Å
111	H	74.3	Confident	68.8	Low	2 Å²	2	51.3 Å²	51.3	1%	0.009	27%	0.268	C	S	.	.	S	Bend	trans	-78.9	-31.3	-165.1	179.5	-50.7	0	0	0	115.2	G77 M79 H140 V141	G77-H111 PolarHBondContact O-CD2 2.85Å; G77-H111 VanDerWaalsContact O-CD2 3.28Å; M79-H111 HydrophobicContact CG-CB 4.26Å; H111-H140 PolarHBondContact CE1-O 3.2Å; H111-H140 PolarHBondContact ND1-O 2.92Å; H111-H140 PolarHBondContact O-N 3.34Å; H111-V141 WeakPolarHBondContact CE1-CA 3.29Å; H111-V141 WeakPolarHBondContact CE1-CG2 3.3Å; H111-V141 PolarHBondContact CE1-N 3.19Å; H111-V141 VanDerWaalsContact CE1-N 3.29Å; H111-V141 WeakPolarHBondContact NE2-CA 3.22Å
112	F	76.3	Confident	69.6	Low	1 Å²	1	48.8 Å²	48.8	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	169.6	-170	44.3	-87.9	0	0	0	109.2	M79 F114 I137 D138 A139 L168 Y172 P191 Y204	M79-F112 HydrophobicContact CG-CE1 4.21Å; F112-F114 HydrophobicContact CD2-CD2 4.28Å; F112-F114 HydrophobicContact CD2-CE1 4.28Å; F112-F114 AromaticContact CD2-CE2 3.6Å; F112-F114 HydrophobicContact CD2-CE2 3.6Å; F112-F114 AromaticContact CD2-CZ 3.59Å; F112-F114 HydrophobicContact CD2-CZ 3.59Å; F112-F114 HydrophobicContact CE2-CD2 4.44Å; F112-F114 HydrophobicContact CE2-CE1 4.39Å; F112-F114 AromaticContact CE2-CE2 3.4Å; F112-F114 HydrophobicContact CE2-CE2 3.4Å; F112-F114 AromaticContact CE2-CZ 3.36Å; F112-F114 HydrophobicContact CE2-CZ 3.36Å; F112-I137 HydrophobicContact CB-CG2 3.85Å; F112-I137 HydrophobicContact CG-CG2 4.38Å; F112-D138 CarbonylContact C-O 3.52Å; F112-D138 VanDerWaalsContact CA-O 3.24Å; F112-D138 WeakPolarHBondContact CA-O 3.31Å; F112-A139 HydrophobicContact CB-CB 3.76Å; F112-L168 HydrophobicContact CD1-CD1 4.38Å; F112-L168 HydrophobicContact CD1-CD2 3.39Å; F112-L168 HydrophobicContact CE1-CD2 3.24Å; F112-L168 HydrophobicContact CE2-CD2 4.37Å; F112-L168 HydrophobicContact CG-CD2 4.1Å; F112-L168 HydrophobicContact CZ-CD2 3.8Å; F112-Y172 HydrophobicContact CE1-CE2 4.44Å; F112-Y172 HydrophobicContact CE2-CD2 4.46Å; F112-Y172 AromaticContact CE2-CE2 3.72Å; F112-Y172 HydrophobicContact CE2-CE2 3.72Å; F112-Y172 AromaticContact CZ-CE2 3.45Å; F112-Y172 HydrophobicContact CZ-CE2 3.45Å; F112-Y172 VanDerWaalsContact CZ-CE2 3.45Å; F112-Y172 AromaticContact CZ-CZ 3.73Å; F112-Y172 WeakPolarHBondContact CZ-OH 3.3Å; F112-P191 HydrophobicContact CD2-CG 4.05Å; F112-P191 HydrophobicContact CE2-CB 3.81Å; F112-P191 HydrophobicContact CE2-CG 3.69Å; F112-P191 HydrophobicContact CZ-CB 4.14Å; F112-P191 HydrophobicContact CZ-CG 4.12Å; F112-P191 WeakPolarHBondContact O-CD 3.47Å; F112-P191 WeakPolarHBondContact O-CG 3.24Å; F112-Y204 WeakPolarHBondContact CE2-OH 3.46Å; F112-Y204 HydrophobicContact CZ-CE2 4.43Å
113	I	79.9	Confident	70.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	131.6	176.1	-47.9	-173.7	0	0	0	106.7	P58 N59 L62 D138 W188 L189 C209	P58-I113 VanDerWaalsContact C-CD1 3.4Å; P58-I113 HydrophobicContact CB-CD1 3.53Å; P58-I113 HydrophobicContact CB-CG2 4.35Å; N59-I113 HydrophobicContact CB-CD1 3.9Å; L62-I113 HydrophobicContact CD1-CD1 4.14Å; I113-D138 PolarHBondContact N-O 3.07Å; I113-D138 PolarHBondContact O-N 3.07Å; I113-W188 HydrophobicContact CB-CE3 4.07Å; I113-W188 HydrophobicContact CB-CZ3 4.39Å; I113-W188 HydrophobicContact CG2-CB 4.18Å; I113-W188 HydrophobicContact CG2-CD2 4.42Å; I113-W188 HydrophobicContact CG2-CE3 3.64Å; I113-W188 HydrophobicContact CG2-CZ3 4.44Å; I113-L189 VanDerWaalsContact CG2-O 3.22Å; I113-L189 WeakPolarHBondContact CG2-O 3.32Å; I113-C209 WeakPolarHBondContact CG2-SG 3.13Å
114	F	76	Confident	71.3	Confident	3 Å²	3	49.2 Å²	49.2	1%	0.013	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	148.4	-178.4	-52	-97.4	0	0	0	110.2	F112 I137 L169 Y172 F181 W188 L189 L206	F112-F114 HydrophobicContact CD2-CD2 4.28Å; F112-F114 HydrophobicContact CD2-CE1 4.28Å; F112-F114 AromaticContact CD2-CE2 3.6Å; F112-F114 HydrophobicContact CD2-CE2 3.6Å; F112-F114 AromaticContact CD2-CZ 3.59Å; F112-F114 HydrophobicContact CD2-CZ 3.59Å; F112-F114 HydrophobicContact CE2-CD2 4.44Å; F112-F114 HydrophobicContact CE2-CE1 4.39Å; F112-F114 AromaticContact CE2-CE2 3.4Å; F112-F114 HydrophobicContact CE2-CE2 3.4Å; F112-F114 AromaticContact CE2-CZ 3.36Å; F112-F114 HydrophobicContact CE2-CZ 3.36Å; F114-I137 HydrophobicContact CD1-CD1 3.58Å; F114-I137 HydrophobicContact CD1-CG1 3.72Å; F114-I137 HydrophobicContact CE1-CD1 3.51Å; F114-I137 HydrophobicContact CE1-CG1 4.17Å; F114-L169 HydrophobicContact CD1-CD2 4.27Å; F114-L169 HydrophobicContact CE1-CD2 3.93Å; F114-Y172 AromaticContact CZ-CD2 3.74Å; F114-Y172 HydrophobicContact CZ-CD2 3.74Å; F114-Y172 HydrophobicContact CZ-CE2 4.15Å; F114-F181 HydrophobicContact CB-CE2 3.38Å; F114-F181 HydrophobicContact CB-CZ 3.72Å; F114-F181 HydrophobicContact CD1-CE2 4.11Å; F114-F181 HydrophobicContact CD1-CZ 4.29Å; F114-F181 HydrophobicContact CD2-CE2 4.47Å; F114-F181 AromaticContact CG-CE2 3.78Å; F114-F181 HydrophobicContact CG-CE2 3.78Å; F114-F181 HydrophobicContact CG-CZ 4.27Å; F114-W188 CarbonylContact O-C 3.57Å; F114-W188 VanDerWaalsContact O-CA 3.3Å; F114-W188 WeakPolarHBondContact O-CA 3.03Å; F114-L189 HydrophobicContact CB-CB 4.37Å; F114-L189 PolarHBondContact N-O 3.08Å; F114-L189 VanDerWaalsContact N-O 3.08Å; F114-L189 PolarHBondContact O-N 2.91Å; F114-L206 HydrophobicContact CD2-CD2 3.85Å; F114-L206 HydrophobicContact CE2-CD2 3.48Å; F114-L206 VanDerWaalsContact CE2-CD2 3.48Å; F114-L206 HydrophobicContact CZ-CD2 4.44Å
115	K	74.4	Confident	71.6	Confident	58 Å²	58	50.2 Å²	50.2	25%	0.252	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	131.9	166.5	176.3	-176	162	-144.2	0	108.1	V117 E136 W188	K115-V117 PolarHBondContact O-N 3.15Å; K115-E136 HydrophobicContact CB-CB 4.38Å; K115-E136 PolarHBondContact N-O 2.99Å; K115-E136 IonicContact NZ-OE2 3.11Å; K115-E136 PolarHBondContact NZ-OE2 2.92Å; K115-E136 CarbonylContact O-C 3.25Å; K115-E136 WeakPolarHBondContact O-CA 3.33Å; K115-E136 WeakPolarHBondContact O-CB 3.16Å; K115-E136 PolarHBondContact O-N 3.39Å; K115-W188 HydrophobicContact CB-CD2 3.88Å; K115-W188 HydrophobicContact CB-CE3 3.62Å; K115-W188 HydrophobicContact CB-CH2 4.08Å; K115-W188 HydrophobicContact CB-CZ2 4.32Å; K115-W188 HydrophobicContact CB-CZ3 3.71Å; K115-W188 HydrophobicContact CD-CD2 4.17Å; K115-W188 HydrophobicContact CD-CH2 3.99Å; K115-W188 HydrophobicContact CD-CZ2 3.59Å; K115-W188 HydrophobicContact CD-CZ3 4.43Å; K115-W188 HydrophobicContact CG-CD2 4.37Å
116	I	64.4	Low	71.7	Confident	14 Å²	14	53.6 Å²	53.6	7%	0.072	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	119	168.1	-68	158.9	0	0	0	107	A118 F181 L182 G186	I116-A118 HydrophobicContact CG2-CB 4.35Å; I116-A118 PolarHBondContact O-N 3.05Å; I116-F181 HydrophobicContact CD1-CD1 3.86Å; I116-F181 HydrophobicContact CD1-CE1 3.71Å; I116-F181 HydrophobicContact CD1-CG 4.38Å; I116-F181 HydrophobicContact CD1-CZ 4.13Å; I116-F181 WeakPolarHBondContact CD1-O 3.22Å; I116-F181 HydrophobicContact CG1-CD1 4.04Å; I116-F181 HydrophobicContact CG1-CE1 3.36Å; I116-F181 HydrophobicContact CG1-CZ 3.63Å; I116-L182 HydrophobicContact CD1-CD2 4.33Å; I116-G186 PolarHBondContact O-N 3.46Å
117	V	63	Low	71.7	Confident	40 Å²	40	58.2 Å²	58.2	24%	0.242	29%	0.291	C	S	.	.			trans	-62.7	123.6	166.3	-167.5	0	0	0	0	105.8	K115 D121 E136	K115-V117 PolarHBondContact O-N 3.15Å; V117-D121 VanDerWaalsContact C-OD2 3.31Å; V117-D121 HydrophobicContact CB-CB 4.43Å; V117-D121 WeakPolarHBondContact CG1-OD1 3.24Å; V117-D121 VanDerWaalsContact O-CB 3.25Å; V117-D121 WeakPolarHBondContact O-CB 3.47Å; V117-E136 HydrophobicContact CG2-CB 3.62Å
118	A	56.6	Low	71	Confident	49 Å²	49	61.2 Å²	61.2	41%	0.405	30%	0.302	S	S	.	.			trans	-145.9	84.5	-173.7	0	0	0	0	0	110.8	I116 D121 K185	I116-A118 HydrophobicContact CG2-CB 4.35Å; I116-A118 PolarHBondContact O-N 3.05Å; A118-D121 VanDerWaalsContact CA-OD2 3.25Å; A118-D121 WeakPolarHBondContact CA-OD2 3.09Å; A118-D121 PolarHBondContact N-OD2 3.12Å; A118-K185 HydrophobicContact CB-CB 4.02Å
119	K	51.2	Low	70.5	Confident	197 Å²	197	68 Å²	68	86%	0.857	34%	0.336	S	S	*	.	S	Bend	trans	-115.8	-41.2	146.6	-89.3	-172.4	169.8	-176.2	0	111.8	D121	K119-D121 PolarHBondContact N-OD2 2.84Å
120	N	57.8	Low	69.7	Low	152 Å²	152	68 Å²	68	81%	0.813	34%	0.336	S	S	*	.	S	Bend	trans	-144.9	10.1	-179.6	-74.9	-42.6	0	0	0	113.8	C122	N120-C122 VanDerWaalsContact C-N 3.26Å; N120-C122 PolarHBondContact O-N 3.05Å
121	D	58.7	Low	69.3	Low	52 Å²	52	73.6 Å²	73.6	28%	0.278	36%	0.355	S	S	.	.			trans	-81.3	16.7	-141.8	-57.9	-88.8	0	0	0	117.7	V117 A118 K119 C133 S134	V117-D121 VanDerWaalsContact C-OD2 3.31Å; V117-D121 HydrophobicContact CB-CB 4.43Å; V117-D121 WeakPolarHBondContact CG1-OD1 3.24Å; V117-D121 VanDerWaalsContact O-CB 3.25Å; V117-D121 WeakPolarHBondContact O-CB 3.47Å; A118-D121 VanDerWaalsContact CA-OD2 3.25Å; A118-D121 WeakPolarHBondContact CA-OD2 3.09Å; A118-D121 PolarHBondContact N-OD2 3.12Å; K119-D121 PolarHBondContact N-OD2 2.84Å; D121-C133 VanDerWaalsContact O-CA 3.22Å; D121-C133 WeakPolarHBondContact O-CA 3.01Å; D121-S134 PolarHBondContact O-N 2.77Å; D121-S134 VanDerWaalsContact O-N 3.12Å
122	C	67.8	Low	69.2	Low	53 Å²	53	73.6 Å²	73.6	36%	0.358	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	103	167.6	-79.9	0	0	0	0	109	N120 W131 S132 C133	N120-C122 VanDerWaalsContact C-N 3.26Å; N120-C122 PolarHBondContact O-N 3.05Å; C122-W131 HydrophobicContact CB-CE3 4.26Å; C122-S132 CarbonylContact C-O 3.5Å; C122-S132 WeakPolarHBondContact CA-O 3.44Å; C122-C133 WeakPolarHBondContact CA-SG 3.48Å; C122-C133 HydrophobicContact CB-CB 4.19Å; C122-C133 WeakPolarHBondContact CB-SG 3.42Å; C122-C133 WeakPolarHBondContact SG-CB 3Å; C122-C133 CovalentContact SG-SG 2.03Å; C122-C133 PolarHBondContact SG-SG 3.1Å
123	S	72.4	Confident	68.9	Low	68 Å²	68	73.7 Å²	73.7	48%	0.476	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	146.1	176.4	59	0	0	0	0	111.1	Y125 S132	S123-Y125 PolarHBondContact O-N 2.81Å; S123-S132 PolarHBondContact N-O 3Å; S123-S132 PolarHBondContact O-N 3.13Å
124	W	75.3	Confident	68.4	Low	100 Å²	100	74.9 Å²	74.9	38%	0.379	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	119.5	170.2	-176.8	-105.4	0	0	0	109.7	W126 M129 W131	W124-W126 AromaticContact CD1-CD1 3.92Å; W124-W126 AromaticContact CD1-CD2 3.57Å; W124-W126 AromaticContact CD1-CE2 3.52Å; W124-W126 AromaticContact CD1-CG 3.86Å; W124-W126 AromaticContact CD1-CZ2 3.97Å; W124-W126 AromaticContact CD1-NE1 3.73Å; W124-W126 AromaticContact NE1-CD2 3.63Å; W124-W126 AromaticContact NE1-CE2 3.93Å; W124-W126 AromaticContact NE1-CE3 3.61Å; W124-W126 AromaticContact NE1-CZ3 3.92Å; W124-W126 PolarHBondContact O-N 2.83Å; W124-M129 HydrophobicContact CH2-CB 4.44Å; W124-M129 WeakPolarHBondContact CH2-O 3.33Å; W124-M129 HydrophobicContact CZ2-CB 4Å; W124-W131 HydrophobicContact CB-CZ3 4.5Å; W124-W131 AromaticContact CE3-CD2 4Å; W124-W131 HydrophobicContact CE3-CD2 4Å; W124-W131 AromaticContact CE3-CE2 3.75Å; W124-W131 HydrophobicContact CE3-CG 4.17Å; W124-W131 HydrophobicContact CE3-CZ2 4.21Å; W124-W131 AromaticContact CE3-NE1 3.75Å; W124-W131 AromaticContact CZ3-CD1 3.87Å; W124-W131 HydrophobicContact CZ3-CG 4.44Å; W124-W131 AromaticContact CZ3-NE1 3.65Å
125	Y	72.6	Confident	68.1	Low	73 Å²	73	75 Å²	75	29%	0.286	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	89.8	-179.5	-175.5	-107.2	0	0	0	110	S123 P127 R128 M129 T130 Y153	S123-Y125 PolarHBondContact O-N 2.81Å; Y125-P127 VanDerWaalsContact C-N 3.33Å; Y125-P127 HydrophobicContact CD1-CB 4.34Å; Y125-P127 HydrophobicContact CD1-CG 4.42Å; Y125-P127 HydrophobicContact CD2-CG 4.4Å; Y125-P127 HydrophobicContact CE1-CB 3.7Å; Y125-P127 HydrophobicContact CE1-CG 3.94Å; Y125-P127 HydrophobicContact CE2-CG 3.9Å; Y125-R128 HydrophobicContact CD1-CB 4.03Å; Y125-R128 HydrophobicContact CD1-CG 4.43Å; Y125-R128 HydrophobicContact CE1-CB 4.24Å; Y125-R128 HydrophobicContact CE1-CG 4.13Å; Y125-R128 PolarHBondContact O-N 3.04Å; Y125-M129 PolarHBondContact O-N 2.86Å; Y125-M129 VanDerWaalsContact O-N 3.14Å; Y125-T130 HydrophobicContact CD1-CG2 4.01Å; Y125-T130 PolarHBondContact N-O 2.79Å; Y125-T130 PolarHBondContact O-N 3.25Å; Y125-Y153 AromaticContact CD1-CD1 3.82Å; Y125-Y153 HydrophobicContact CD1-CD1 3.82Å; Y125-Y153 AromaticContact CD1-CE1 3.39Å; Y125-Y153 HydrophobicContact CD1-CE1 3.39Å; Y125-Y153 HydrophobicContact CD2-CE1 4.04Å; Y125-Y153 HydrophobicContact CE1-CD1 4.45Å; Y125-Y153 AromaticContact CE1-CE1 3.8Å; Y125-Y153 HydrophobicContact CE1-CE1 3.8Å; Y125-Y153 HydrophobicContact CE2-CE1 4.41Å; Y125-Y153 HydrophobicContact CG-CD1 4.13Å; Y125-Y153 AromaticContact CG-CE1 3.52Å; Y125-Y153 HydrophobicContact CG-CE1 3.52Å
126	W	75.5	Confident	68	Low	198 Å²	198	73 Å²	73	75%	0.75	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-44.8	-43.9	179.7	-69.6	100.1	0	0	0	115.2	W124 R128 M129	W124-W126 AromaticContact CD1-CD1 3.92Å; W124-W126 AromaticContact CD1-CD2 3.57Å; W124-W126 AromaticContact CD1-CE2 3.52Å; W124-W126 AromaticContact CD1-CG 3.86Å; W124-W126 AromaticContact CD1-CZ2 3.97Å; W124-W126 AromaticContact CD1-NE1 3.73Å; W124-W126 AromaticContact NE1-CD2 3.63Å; W124-W126 AromaticContact NE1-CE2 3.93Å; W124-W126 AromaticContact NE1-CE3 3.61Å; W124-W126 AromaticContact NE1-CZ3 3.92Å; W124-W126 PolarHBondContact O-N 2.83Å; W126-R128 PolarHBondContact O-N 2.84Å; W126-M129 PolarHBondContact O-N 2.87Å; W126-M129 VanDerWaalsContact O-N 3.15Å
127	P	77.5	Confident	68.4	Low	97 Å²	97	72.3 Å²	72.3	63%	0.63	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-64	-15.1	-175.5	-23.6	34.9	0	0	0	115.9	Y125	Y125-P127 VanDerWaalsContact C-N 3.33Å; Y125-P127 HydrophobicContact CD1-CB 4.34Å; Y125-P127 HydrophobicContact CD1-CG 4.42Å; Y125-P127 HydrophobicContact CD2-CG 4.4Å; Y125-P127 HydrophobicContact CE1-CB 3.7Å; Y125-P127 HydrophobicContact CE1-CG 3.94Å; Y125-P127 HydrophobicContact CE2-CG 3.9Å
128	R	68.3	Low	68.9	Low	120 Å²	120	71.1 Å²	71.1	45%	0.453	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-127.5	10.7	173	-73.3	-178.7	-179.5	-172	0.2	113.3	Y125 W126 T130 S161	Y125-R128 HydrophobicContact CD1-CB 4.03Å; Y125-R128 HydrophobicContact CD1-CG 4.43Å; Y125-R128 HydrophobicContact CE1-CB 4.24Å; Y125-R128 HydrophobicContact CE1-CG 4.13Å; Y125-R128 PolarHBondContact O-N 3.04Å; W126-R128 PolarHBondContact O-N 2.84Å; R128-T130 VanDerWaalsContact C-N 3.31Å; R128-T130 HydrophobicContact CB-CG2 3.4Å; R128-T130 PolarHBondContact O-N 3.46Å; R128-S161 PolarHBondContact NH1-OG 3.22Å
129	M	74.4	Confident	69.5	Low	143 Å²	143	68.9 Å²	68.9	70%	0.704	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	49.9	-178.3	-58.7	-173.6	179.7	0	0	113.3	W124 Y125 W126	W124-M129 HydrophobicContact CH2-CB 4.44Å; W124-M129 WeakPolarHBondContact CH2-O 3.33Å; W124-M129 HydrophobicContact CZ2-CB 4Å; Y125-M129 PolarHBondContact O-N 2.86Å; Y125-M129 VanDerWaalsContact O-N 3.14Å; W126-M129 PolarHBondContact O-N 2.87Å; W126-M129 VanDerWaalsContact O-N 3.15Å
130	T	69.6	Low	70.2	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.012	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	161.4	-163.9	177.7	0	0	0	0	110.8	Y125 R128 Y153 D154 W155	Y125-T130 HydrophobicContact CD1-CG2 4.01Å; Y125-T130 PolarHBondContact N-O 2.79Å; Y125-T130 PolarHBondContact O-N 3.25Å; R128-T130 VanDerWaalsContact C-N 3.31Å; R128-T130 HydrophobicContact CB-CG2 3.4Å; R128-T130 PolarHBondContact O-N 3.46Å; T130-Y153 HydrophobicContact CG2-CD1 3.71Å; T130-Y153 HydrophobicContact CG2-CG 4.32Å; T130-D154 WeakPolarHBondContact CB-O 3.42Å; T130-D154 PolarHBondContact OG1-N 2.97Å; T130-D154 PolarHBondContact OG1-O 3.18Å; T130-W155 WeakPolarHBondContact CB-O 3.48Å; T130-W155 PolarHBondContact OG1-O 3.25Å
131	W	70	Confident	70.4	Confident	123 Å²	123	55.9 Å²	55.9	47%	0.466	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	120.7	172.4	-67.4	92.7	0	0	0	111.5	C122 W124 Y153 D154	C122-W131 HydrophobicContact CB-CE3 4.26Å; W124-W131 HydrophobicContact CB-CZ3 4.5Å; W124-W131 AromaticContact CE3-CD2 4Å; W124-W131 HydrophobicContact CE3-CD2 4Å; W124-W131 AromaticContact CE3-CE2 3.75Å; W124-W131 HydrophobicContact CE3-CG 4.17Å; W124-W131 HydrophobicContact CE3-CZ2 4.21Å; W124-W131 AromaticContact CE3-NE1 3.75Å; W124-W131 AromaticContact CZ3-CD1 3.87Å; W124-W131 HydrophobicContact CZ3-CG 4.44Å; W124-W131 AromaticContact CZ3-NE1 3.65Å; W131-Y153 VanDerWaalsContact O-CA 3.28Å; W131-Y153 WeakPolarHBondContact O-CA 3Å; W131-D154 HydrophobicContact CB-CB 4.19Å; W131-D154 PolarHBondContact O-N 2.79Å; W131-D154 VanDerWaalsContact O-N 3.07Å
132	S	71.9	Confident	70.1	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.014	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	119.9	171.9	161.4	0	0	0	0	110.2	C122 S123 R151 Y152	C122-S132 CarbonylContact C-O 3.5Å; C122-S132 WeakPolarHBondContact CA-O 3.44Å; S123-S132 PolarHBondContact N-O 3Å; S123-S132 PolarHBondContact O-N 3.13Å; S132-R151 VanDerWaalsContact OG-CD 3.28Å; S132-R151 WeakPolarHBondContact OG-CD 3.29Å; S132-Y152 WeakPolarHBondContact CA-O 3.37Å
133	C	70.6	Confident	69.4	Low	4 Å²	4	59 Å²	59	3%	0.027	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	145.5	-173.8	-63.1	0	0	0	0	113.3	D121 C122 R151 Y152	D121-C133 VanDerWaalsContact O-CA 3.22Å; D121-C133 WeakPolarHBondContact O-CA 3.01Å; C122-C133 WeakPolarHBondContact CA-SG 3.48Å; C122-C133 HydrophobicContact CB-CB 4.19Å; C122-C133 WeakPolarHBondContact CB-SG 3.42Å; C122-C133 WeakPolarHBondContact SG-CB 3Å; C122-C133 CovalentContact SG-SG 2.03Å; C122-C133 PolarHBondContact SG-SG 3.1Å; C133-R151 WeakPolarHBondContact O-CA 3.38Å; C133-Y152 HydrophobicContact CB-CD1 3.93Å; C133-Y152 HydrophobicContact CB-CE1 3.18Å; C133-Y152 HydrophobicContact CB-CE2 4.1Å; C133-Y152 WeakPolarHBondContact CB-OH 3.28Å; C133-Y152 PolarHBondContact N-O 2.65Å; C133-Y152 WeakPolarHBondContact O-CD1 3.33Å; C133-Y152 PolarHBondContact O-N 3.44Å; C133-Y152 PolarHBondContact SG-OH 2.96Å
134	S	69.4	Low	69	Low	25 Å²	25	57 Å²	57	18%	0.175	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.8	-175.3	-56.3	0	0	0	0	113.4	D121 Y150	D121-S134 PolarHBondContact O-N 2.77Å; D121-S134 VanDerWaalsContact O-N 3.12Å; S134-Y150 CarbonylContact C-O 3.43Å; S134-Y150 WeakPolarHBondContact CA-O 3.19Å
135	I	68.9	Low	68.5	Low	5 Å²	5	54.7 Å²	54.7	3%	0.026	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126.7	179.2	-56.8	174.2	0	0	0	110	I137 V149 Y150 Y152 L169 F181	I135-I137 HydrophobicContact CG2-CG1 4.25Å; I135-V149 CarbonylContact O-C 3.57Å; I135-V149 VanDerWaalsContact O-CA 3.3Å; I135-V149 WeakPolarHBondContact O-CA 3.13Å; I135-Y150 PolarHBondContact N-O 2.79Å; I135-Y150 PolarHBondContact O-N 2.79Å; I135-Y152 HydrophobicContact CD1-CD1 3.41Å; I135-Y152 VanDerWaalsContact CD1-CD1 3.41Å; I135-Y152 HydrophobicContact CD1-CE1 3.69Å; I135-Y152 HydrophobicContact CD1-CG 4.41Å; I135-Y152 HydrophobicContact CG1-CD1 3.79Å; I135-Y152 HydrophobicContact CG1-CE1 3.85Å; I135-L169 HydrophobicContact CD1-CD1 4.24Å; I135-L169 HydrophobicContact CD1-CD2 4.12Å; I135-F181 HydrophobicContact CB-CE1 4.4Å; I135-F181 HydrophobicContact CD1-CD1 4.18Å; I135-F181 HydrophobicContact CD1-CE1 3.56Å; I135-F181 HydrophobicContact CD1-CZ 4.44Å; I135-F181 HydrophobicContact CG1-CE1 3.82Å; I135-F181 HydrophobicContact CG2-CE1 3.71Å; I135-F181 HydrophobicContact CG2-CZ 3.57Å
136	E	72	Confident	68.2	Low	15 Å²	15	55.3 Å²	55.3	7%	0.07	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	128.8	171.5	-172.4	-169	150.6	0	0	109.7	K115 V117 R147 Y148	K115-E136 HydrophobicContact CB-CB 4.38Å; K115-E136 PolarHBondContact N-O 2.99Å; K115-E136 IonicContact NZ-OE2 3.11Å; K115-E136 PolarHBondContact NZ-OE2 2.92Å; K115-E136 CarbonylContact O-C 3.25Å; K115-E136 WeakPolarHBondContact O-CA 3.33Å; K115-E136 WeakPolarHBondContact O-CB 3.16Å; K115-E136 PolarHBondContact O-N 3.39Å; V117-E136 HydrophobicContact CG2-CB 3.62Å; E136-R147 HydrophobicContact CG-CG 3.79Å; E136-R147 WeakPolarHBondContact OE1-CD 3.44Å; E136-R147 IonicContact OE1-CZ 2.78Å; E136-R147 IonicContact OE1-NE 3.9Å; E136-R147 PolarHBondContact OE1-NE 3.43Å; E136-R147 IonicContact OE1-NH2 2.62Å; E136-Y148 CarbonylContact C-O 3.49Å; E136-Y148 WeakPolarHBondContact CA-O 3.33Å
137	I	73.6	Confident	68.1	Low	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	116.9	171.3	-58.8	-167.5	0	0	0	107.9	F112 F114 I135 A139 R147 Y148 Y150 L169	F112-I137 HydrophobicContact CB-CG2 3.85Å; F112-I137 HydrophobicContact CG-CG2 4.38Å; F114-I137 HydrophobicContact CD1-CD1 3.58Å; F114-I137 HydrophobicContact CD1-CG1 3.72Å; F114-I137 HydrophobicContact CE1-CD1 3.51Å; F114-I137 HydrophobicContact CE1-CG1 4.17Å; I135-I137 HydrophobicContact CG2-CG1 4.25Å; I137-A139 HydrophobicContact CG2-CB 4.48Å; I137-R147 WeakPolarHBondContact O-CA 3.48Å; I137-Y148 PolarHBondContact N-O 3.35Å; I137-Y148 PolarHBondContact O-N 3.35Å; I137-Y150 HydrophobicContact CB-CD2 4.43Å; I137-Y150 HydrophobicContact CB-CE2 4.2Å; I137-Y150 HydrophobicContact CD1-CD2 3.65Å; I137-Y150 HydrophobicContact CD1-CE2 3.64Å; I137-Y150 HydrophobicContact CG1-CD2 3.87Å; I137-Y150 HydrophobicContact CG1-CE2 4.01Å; I137-L169 HydrophobicContact CD1-CD1 4.33Å; I137-L169 HydrophobicContact CD1-CD2 4.06Å; I137-L169 HydrophobicContact CD1-CG 3.83Å
138	D	74.1	Confident	67.6	Low	16 Å²	16	53.4 Å²	53.4	9%	0.086	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	105.5	171.3	-174.2	3.6	0	0	0	109.1	N59 F112 I113 W188	N59-D138 VanDerWaalsContact CB-OD2 3.27Å; N59-D138 WeakPolarHBondContact CB-OD2 3.38Å; N59-D138 PolarHBondContact ND2-OD1 2.95Å; N59-D138 PolarHBondContact ND2-OD2 2.04Å; F112-D138 CarbonylContact C-O 3.52Å; F112-D138 VanDerWaalsContact CA-O 3.24Å; F112-D138 WeakPolarHBondContact CA-O 3.31Å; I113-D138 PolarHBondContact N-O 3.07Å; I113-D138 PolarHBondContact O-N 3.07Å; D138-W188 HydrophobicContact CB-CH2 3.86Å; D138-W188 HydrophobicContact CB-CZ3 3.68Å
139	A	68.8	Low	67.6	Low	1 Å²	1	51.9 Å²	51.9	1%	0.008	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	110.4	-176.8	0	0	0	0	0	110.5	F112 I137 V141 F146 Y148	F112-A139 HydrophobicContact CB-CB 3.76Å; I137-A139 HydrophobicContact CG2-CB 4.48Å; A139-V141 PolarHBondContact O-N 3.07Å; A139-F146 PolarHBondContact N-O 3.1Å; A139-F146 PolarHBondContact O-N 2.86Å; A139-Y148 HydrophobicContact CB-CE2 4.41Å
140	H	64.9	Low	67.1	Low	41 Å²	41	45.9 Å²	45.9	19%	0.19	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	93.1	174.3	-166.4	-67	0	0	0	111.3	N63 H111	N63-H140 PolarHBondContact ND2-CD2 3.1Å; H111-H140 PolarHBondContact CE1-O 3.2Å; H111-H140 PolarHBondContact ND1-O 2.92Å; H111-H140 PolarHBondContact O-N 3.34Å
141	V	61.6	Low	66.9	Low	36 Å²	36	51.4 Å²	51.4	22%	0.218	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	162.5	-179.9	-158.8	0	0	0	0	110	H111 A139 G143 G144 F146	H111-V141 WeakPolarHBondContact CE1-CA 3.29Å; H111-V141 WeakPolarHBondContact CE1-CG2 3.3Å; H111-V141 PolarHBondContact CE1-N 3.19Å; H111-V141 VanDerWaalsContact CE1-N 3.29Å; H111-V141 WeakPolarHBondContact NE2-CA 3.22Å; A139-V141 PolarHBondContact O-N 3.07Å; V141-G143 PolarHBondContact O-N 2.95Å; V141-G143 VanDerWaalsContact O-N 3.15Å; V141-G144 CarbonylContact C-O 3.56Å; V141-G144 PolarHBondContact N-O 3.36Å; V141-G144 PolarHBondContact O-N 2.03Å; V141-G144 VanDerWaalsContact O-N 3.09Å; V141-F146 HydrophobicContact CB-CD2 3.9Å; V141-F146 HydrophobicContact CB-CE2 3.73Å; V141-F146 HydrophobicContact CG2-CD2 3.34Å; V141-F146 HydrophobicContact CG2-CE2 3.62Å; V141-F146 HydrophobicContact CG2-CG 4.25Å
142	E	52.9	Low	66.7	Low	90 Å²	90	46.2 Å²	46.2	42%	0.421	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	114.9	163	-162.7	-177.5	169.8	0	0	110.1	W39 R74	W39-E142 WeakPolarHBondContact CH2-OE1 3.44Å; W39-E142 WeakPolarHBondContact CH2-OE2 3.45Å; W39-E142 WeakPolarHBondContact CZ3-OE1 3.27Å; R74-E142 IonicContact CZ-OE1 3.97Å; R74-E142 IonicContact NH1-OE1 2.61Å; R74-E142 PolarHBondContact NH1-OE1 3.08Å; R74-E142 IonicContact NH2-OE1 2.94Å; R74-E142 PolarHBondContact NH2-OE1 2.04Å
143	G	54.1	Low	66.3	Low	80 Å²	80	46.5 Å²	46.5	83%	0.825	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.3	-13.3	-174.6	0	0	0	0	0	114.8	V141	V141-G143 PolarHBondContact O-N 2.95Å; V141-G143 VanDerWaalsContact O-N 3.15Å
144	G	62.7	Low	66	Low	25 Å²	25	49 Å²	49	26%	0.258	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	158.7	172.4	172.5	0	0	0	0	0	115.4	V141 F146	V141-G144 CarbonylContact C-O 3.56Å; V141-G144 PolarHBondContact N-O 3.36Å; V141-G144 PolarHBondContact O-N 2.03Å; V141-G144 VanDerWaalsContact O-N 3.09Å; G144-F146 VanDerWaalsContact O-CD2 3.31Å; G144-F146 WeakPolarHBondContact O-CD2 3.49Å; G144-F146 WeakPolarHBondContact O-CE2 3.29Å
145	G	65.5	Low	65.5	Low	52 Å²	52	55.9 Å²	55.9	54%	0.536	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	133.4	166.2	0	0	0	0	0	111.2
146	F	66.9	Low	64.7	Low	86 Å²	86	59.9 Å²	59.9	38%	0.377	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	118.9	175.1	-63.1	-103.7	0	0	0	108.5	A139 V141 G144 Y148	A139-F146 PolarHBondContact N-O 3.1Å; A139-F146 PolarHBondContact O-N 2.86Å; V141-F146 HydrophobicContact CB-CD2 3.9Å; V141-F146 HydrophobicContact CB-CE2 3.73Å; V141-F146 HydrophobicContact CG2-CD2 3.34Å; V141-F146 HydrophobicContact CG2-CE2 3.62Å; V141-F146 HydrophobicContact CG2-CG 4.25Å; G144-F146 VanDerWaalsContact O-CD2 3.31Å; G144-F146 WeakPolarHBondContact O-CD2 3.49Å; G144-F146 WeakPolarHBondContact O-CE2 3.29Å; F146-Y148 HydrophobicContact CB-CD2 4.16Å; F146-Y148 HydrophobicContact CB-CE2 3.41Å; F146-Y148 VanDerWaalsContact CB-CE2 3.41Å; F146-Y148 WeakPolarHBondContact CD1-OH 3.37Å; F146-Y148 HydrophobicContact CG-CE2 4.28Å
147	R	72.3	Confident	63.5	Low	166 Å²	166	62.3 Å²	62.3	63%	0.626	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	111.4	171.6	179.9	177.2	-77.6	147.8	5	108.7	E136 I137	E136-R147 HydrophobicContact CG-CG 3.79Å; E136-R147 WeakPolarHBondContact OE1-CD 3.44Å; E136-R147 IonicContact OE1-CZ 2.78Å; E136-R147 IonicContact OE1-NE 3.9Å; E136-R147 PolarHBondContact OE1-NE 3.43Å; E136-R147 IonicContact OE1-NH2 2.62Å; I137-R147 WeakPolarHBondContact O-CA 3.48Å
148	Y	66.9	Low	62.1	Low	89 Å²	89	70.3 Å²	70.3	35%	0.349	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	138.8	174.4	-58.9	-78.8	0	0	0	109.7	E136 I137 A139 F146 Y150	E136-Y148 CarbonylContact C-O 3.49Å; E136-Y148 WeakPolarHBondContact CA-O 3.33Å; I137-Y148 PolarHBondContact N-O 3.35Å; I137-Y148 PolarHBondContact O-N 3.35Å; A139-Y148 HydrophobicContact CB-CE2 4.41Å; F146-Y148 HydrophobicContact CB-CD2 4.16Å; F146-Y148 HydrophobicContact CB-CE2 3.41Å; F146-Y148 VanDerWaalsContact CB-CE2 3.41Å; F146-Y148 WeakPolarHBondContact CD1-OH 3.37Å; F146-Y148 HydrophobicContact CG-CE2 4.28Å; Y148-Y150 HydrophobicContact CD2-CE2 4.5Å; Y148-Y150 HydrophobicContact CG-CE2 4.06Å; Y148-Y150 AromaticContact CG-CZ 3.96Å
149	V	69	Low	61	Low	89 Å²	89	71.4 Å²	71.4	54%	0.539	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	117.3	166.4	-177	0	0	0	0	107.7	I135	I135-V149 CarbonylContact O-C 3.57Å; I135-V149 VanDerWaalsContact O-CA 3.3Å; I135-V149 WeakPolarHBondContact O-CA 3.13Å
150	Y	63.5	Low	60.2	Low	16 Å²	16	73.3 Å²	73.3	6%	0.063	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	139	-178	-69.2	-68.6	0	0	0	111.1	S134 I135 I137 Y148 D164 D165 L169	S134-Y150 CarbonylContact C-O 3.43Å; S134-Y150 WeakPolarHBondContact CA-O 3.19Å; I135-Y150 PolarHBondContact N-O 2.79Å; I135-Y150 PolarHBondContact O-N 2.79Å; I137-Y150 HydrophobicContact CB-CD2 4.43Å; I137-Y150 HydrophobicContact CB-CE2 4.2Å; I137-Y150 HydrophobicContact CD1-CD2 3.65Å; I137-Y150 HydrophobicContact CD1-CE2 3.64Å; I137-Y150 HydrophobicContact CG1-CD2 3.87Å; I137-Y150 HydrophobicContact CG1-CE2 4.01Å; Y148-Y150 HydrophobicContact CD2-CE2 4.5Å; Y148-Y150 HydrophobicContact CG-CE2 4.06Å; Y148-Y150 AromaticContact CG-CZ 3.96Å; Y150-D164 HydrophobicContact CD1-CB 4.05Å; Y150-D165 WeakPolarHBondContact CE1-O 3.35Å; Y150-L169 HydrophobicContact CD2-CD1 3.91Å; Y150-L169 HydrophobicContact CG-CD1 3.84Å
151	R	64.9	Low	59.6	Low	118 Å²	118	73.9 Å²	73.9	45%	0.445	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	132.9	171.1	-167.4	173.2	-71.1	-178	4.1	111.1	S132 C133 Y153 D164	S132-R151 VanDerWaalsContact OG-CD 3.28Å; S132-R151 WeakPolarHBondContact OG-CD 3.29Å; C133-R151 WeakPolarHBondContact O-CA 3.38Å; R151-Y153 WeakPolarHBondContact CD-OH 3.29Å; R151-Y153 HydrophobicContact CG-CE2 4.09Å; R151-D164 PolarHBondContact N-OD2 3.24Å
152	Y	66.8	Low	59.2	Low	15 Å²	15	75.9 Å²	75.9	6%	0.059	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	159.2	172.6	81	-88.1	0	0	0	111.2	S132 C133 I135 L182	S132-Y152 WeakPolarHBondContact CA-O 3.37Å; C133-Y152 HydrophobicContact CB-CD1 3.93Å; C133-Y152 HydrophobicContact CB-CE1 3.18Å; C133-Y152 HydrophobicContact CB-CE2 4.1Å; C133-Y152 WeakPolarHBondContact CB-OH 3.28Å; C133-Y152 PolarHBondContact N-O 2.65Å; C133-Y152 WeakPolarHBondContact O-CD1 3.33Å; C133-Y152 PolarHBondContact O-N 3.44Å; C133-Y152 PolarHBondContact SG-OH 2.96Å; I135-Y152 HydrophobicContact CD1-CD1 3.41Å; I135-Y152 VanDerWaalsContact CD1-CD1 3.41Å; I135-Y152 HydrophobicContact CD1-CE1 3.69Å; I135-Y152 HydrophobicContact CD1-CG 4.41Å; I135-Y152 HydrophobicContact CG1-CD1 3.79Å; I135-Y152 HydrophobicContact CG1-CE1 3.85Å; Y152-L182 HydrophobicContact CE1-CD1 4.42Å; Y152-L182 HydrophobicContact CE1-CD2 3.53Å; Y152-L182 HydrophobicContact CE2-CD1 3.83Å; Y152-L182 HydrophobicContact CE2-CD2 4.47Å; Y152-L182 VanDerWaalsContact CZ-CD1 3.49Å; Y152-L182 VanDerWaalsContact CZ-CD2 3.4Å; Y152-L182 WeakPolarHBondContact OH-CD1 3.17Å; Y152-L182 WeakPolarHBondContact OH-CD2 3.46Å
153	Y	63.9	Low	59.2	Low	8 Å²	8	75.6 Å²	75.6	3%	0.031	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	138.7	-178.1	-60	-90.7	0	0	0	111.2	Y125 T130 W131 R151 I163	Y125-Y153 AromaticContact CD1-CD1 3.82Å; Y125-Y153 HydrophobicContact CD1-CD1 3.82Å; Y125-Y153 AromaticContact CD1-CE1 3.39Å; Y125-Y153 HydrophobicContact CD1-CE1 3.39Å; Y125-Y153 HydrophobicContact CD2-CE1 4.04Å; Y125-Y153 HydrophobicContact CE1-CD1 4.45Å; Y125-Y153 AromaticContact CE1-CE1 3.8Å; Y125-Y153 HydrophobicContact CE1-CE1 3.8Å; Y125-Y153 HydrophobicContact CE2-CE1 4.41Å; Y125-Y153 HydrophobicContact CG-CD1 4.13Å; Y125-Y153 AromaticContact CG-CE1 3.52Å; Y125-Y153 HydrophobicContact CG-CE1 3.52Å; T130-Y153 HydrophobicContact CG2-CD1 3.71Å; T130-Y153 HydrophobicContact CG2-CG 4.32Å; W131-Y153 VanDerWaalsContact O-CA 3.28Å; W131-Y153 WeakPolarHBondContact O-CA 3Å; R151-Y153 WeakPolarHBondContact CD-OH 3.29Å; R151-Y153 HydrophobicContact CG-CE2 4.09Å; Y153-I163 HydrophobicContact CD2-CD1 4.09Å; Y153-I163 HydrophobicContact CD2-CG1 4.09Å; Y153-I163 HydrophobicContact CE2-CB 4.08Å; Y153-I163 HydrophobicContact CE2-CD1 3.27Å; Y153-I163 HydrophobicContact CE2-CG1 3.5Å
154	D	63	Low	59.2	Low	56 Å²	56	74.6 Å²	74.6	30%	0.299	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	109.4	-176.7	-168.4	14.2	0	0	0	112.4	T130 W131	T130-D154 WeakPolarHBondContact CB-O 3.42Å; T130-D154 PolarHBondContact OG1-N 2.97Å; T130-D154 PolarHBondContact OG1-O 3.18Å; W131-D154 HydrophobicContact CB-CB 4.19Å; W131-D154 PolarHBondContact O-N 2.79Å; W131-D154 VanDerWaalsContact O-N 3.07Å
155	W	60.1	Low	58.7	Low	170 Å²	170	81.1 Å²	81.1	64%	0.644	42%	0.421	S	S	*	.			trans	68.7	164.9	168.9	-152.3	-117	0	0	0	117.3	T130	T130-W155 WeakPolarHBondContact CB-O 3.48Å; T130-W155 PolarHBondContact OG1-O 3.25Å
156	P	51.5	Low	58.1	Low	88 Å²	88	79.2 Å²	79.2	57%	0.571	40%	0.4	S	S	*	.	S	Bend	cis	-100.4	167.6	-28.7	7.7	14.4	0	0	0	112.2
157	A	46.6	Very low	57.6	Low	67 Å²	67	84.4 Å²	84.4	55%	0.554	42%	0.418	S	S	*	.	S	Bend	cis	-133	-0.9	3	0	0	0	0	0	113.1
158	D	44.9	Very low	56.9	Low	168 Å²	168	77.5 Å²	77.5	90%	0.898	39%	0.393	S	S	*	.	S	Bend	trans	-113.4	16.5	-166.5	-47.9	-26.2	0	0	0	112.8
159	G	51.1	Low	56.4	Low	38 Å²	38	73.9 Å²	73.9	39%	0.392	38%	0.38	S	S	.	.	S	Bend	trans	108.3	172.5	-178.6	0	0	0	0	0	114.8	S161	G159-S161 PolarHBondContact O-N 3.23Å
160	Y	51.1	Low	55.8	Low	41 Å²	41	72.2 Å²	72.2	16%	0.161	38%	0.376	C	S	.	.			trans	-66.9	113.2	-177.9	-54.7	-87	0	0	0	111.2	D175 V178 K179	Y160-D175 HydrophobicContact CE2-CB 4.39Å; Y160-D175 WeakPolarHBondContact CE2-OD1 3.38Å; Y160-V178 HydrophobicContact CD1-CG1 4.27Å; Y160-V178 HydrophobicContact CD2-CG2 4.3Å; Y160-V178 HydrophobicContact CE1-CB 4.4Å; Y160-V178 HydrophobicContact CE1-CG1 3.84Å; Y160-V178 HydrophobicContact CE2-CB 4.05Å; Y160-V178 HydrophobicContact CE2-CG1 4.32Å; Y160-V178 HydrophobicContact CE2-CG2 4.06Å; Y160-K179 WeakPolarHBondContact OH-CE 3.23Å; Y160-K179 WeakPolarHBondContact OH-CG 2.96Å
161	S	52.3	Low	55.6	Low	54 Å²	54	75.8 Å²	75.8	38%	0.378	39%	0.391	S	S	.	.			trans	-88.2	139.1	176.3	60.4	0	0	0	0	111.6	R128 G159	R128-S161 PolarHBondContact NH1-OG 3.22Å; G159-S161 PolarHBondContact O-N 3.23Å
162	R	53.6	Low	55.3	Low	77 Å²	77	71.1 Å²	71.1	29%	0.291	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-120.5	139	-166.4	-166.1	163.3	171.8	-64.1	-35.3	109.5	D164 G166	R162-D164 PolarHBondContact NH1-O 2.78Å; R162-D164 PolarHBondContact NH2-O 2.03Å; R162-G166 PolarHBondContact NE-O 3.48Å; R162-G166 VanDerWaalsContact NH1-C 3.34Å; R162-G166 PolarHBondContact NH1-O 2.95Å; R162-G166 VanDerWaalsContact NH2-N 3.12Å; R162-G166 PolarHBondContact NH2-O 3.23Å
163	I	53.7	Low	54.8	Low	84 Å²	84	73.6 Å²	73.6	43%	0.431	39%	0.386	S	S	.	.			trans	-108.2	-21.1	-173.5	-68.3	-165.4	0	0	0	113.8	Y153	Y153-I163 HydrophobicContact CD2-CD1 4.09Å; Y153-I163 HydrophobicContact CD2-CG1 4.09Å; Y153-I163 HydrophobicContact CE2-CB 4.08Å; Y153-I163 HydrophobicContact CE2-CD1 3.27Å; Y153-I163 HydrophobicContact CE2-CG1 3.5Å
164	D	53.3	Low	54.4	Low	60 Å²	60	76.5 Å²	76.5	32%	0.321	41%	0.406	S	S	.	.	S	Bend	trans	-111	157.3	-178.2	-45.4	-51.1	0	0	0	112.3	Y150 R151 R162 G166	Y150-D164 HydrophobicContact CD1-CB 4.05Å; R151-D164 PolarHBondContact N-OD2 3.24Å; R162-D164 PolarHBondContact NH1-O 2.78Å; R162-D164 PolarHBondContact NH2-O 2.03Å; D164-G166 PolarHBondContact O-N 2.86Å
165	D	52.5	Low	54	Low	162 Å²	162	78.2 Å²	78.2	87%	0.866	42%	0.415	S	S	*	.			trans	-79.9	118.6	177.1	-71.5	-39.4	0	0	0	112.8	Y150	Y150-D165 WeakPolarHBondContact CE1-O 3.35Å
166	G	53.2	Low	54	Low	11 Å²	11	76 Å²	76	11%	0.113	42%	0.416	C	S	.	.			trans	177	60.7	-169.3	0	0	0	0	0	111.9	R162 D164 L168 L169	R162-G166 PolarHBondContact NE-O 3.48Å; R162-G166 VanDerWaalsContact NH1-C 3.34Å; R162-G166 PolarHBondContact NH1-O 2.95Å; R162-G166 VanDerWaalsContact NH2-N 3.12Å; R162-G166 PolarHBondContact NH2-O 3.23Å; D164-G166 PolarHBondContact O-N 2.86Å; G166-L168 PolarHBondContact O-N 3.09Å; G166-L169 PolarHBondContact O-N 2.72Å
167	W	54.7	Low	54.5	Low	196 Å²	196	74.7 Å²	74.7	74%	0.742	40%	0.4	S	S	*	.	H	α-helix	trans	-35.9	-29.3	170	-151.9	75	0	0	0	114.8	L169 A170 K171	W167-L169 PolarHBondContact O-N 2.79Å; W167-A170 PolarHBondContact O-N 3.11Å; W167-K171 PolarHBondContact O-N 2.8Å
168	L	57.7	Low	55.2	Low	21 Å²	21	72 Å²	72	11%	0.11	38%	0.376	C	S	.	.	H	α-helix	trans	-53.6	-45	173.6	-89.3	166	0	0	0	114.6	M79 F112 G166 Y172	M79-L168 HydrophobicContact CE-CD1 3.95Å; M79-L168 HydrophobicContact CE-CD2 4.15Å; M79-L168 HydrophobicContact CE-CG 4.37Å; M79-L168 HydrophobicContact CG-CD2 4.31Å; M79-L168 HydrophobicContact SD-CD1 4.46Å; M79-L168 HydrophobicContact SD-CD2 3.9Å; M79-L168 HydrophobicContact SD-CG 4.26Å; F112-L168 HydrophobicContact CD1-CD1 4.38Å; F112-L168 HydrophobicContact CD1-CD2 3.39Å; F112-L168 HydrophobicContact CE1-CD2 3.24Å; F112-L168 HydrophobicContact CE2-CD2 4.37Å; F112-L168 HydrophobicContact CG-CD2 4.1Å; F112-L168 HydrophobicContact CZ-CD2 3.8Å; G166-L168 PolarHBondContact O-N 3.09Å; L168-Y172 HydrophobicContact CD2-CE2 4.47Å; L168-Y172 WeakPolarHBondContact O-CD2 3.49Å; L168-Y172 WeakPolarHBondContact O-CE2 3.39Å
169	L	56.4	Low	56.1	Low	12 Å²	12	69.4 Å²	69.4	6%	0.063	36%	0.357	C	S	.	.	H	α-helix	trans	-66.1	-56.4	178	-84.3	166.7	0	0	0	109.7	F114 I135 I137 Y150 G166 W167 K171 Y172 H173	F114-L169 HydrophobicContact CD1-CD2 4.27Å; F114-L169 HydrophobicContact CE1-CD2 3.93Å; I135-L169 HydrophobicContact CD1-CD1 4.24Å; I135-L169 HydrophobicContact CD1-CD2 4.12Å; I137-L169 HydrophobicContact CD1-CD1 4.33Å; I137-L169 HydrophobicContact CD1-CD2 4.06Å; I137-L169 HydrophobicContact CD1-CG 3.83Å; Y150-L169 HydrophobicContact CD2-CD1 3.91Å; Y150-L169 HydrophobicContact CG-CD1 3.84Å; G166-L169 PolarHBondContact O-N 2.72Å; W167-L169 PolarHBondContact O-N 2.79Å; L169-K171 PolarHBondContact O-N 2.66Å; L169-Y172 WeakPolarHBondContact O-CA 3.34Å; L169-Y172 PolarHBondContact O-N 2.82Å; L169-H173 VanDerWaalsContact C-CD2 3.5Å; L169-H173 PolarHBondContact O-CD2 3.44Å
170	A	57	Low	57	Low	55 Å²	55	71.6 Å²	71.6	46%	0.455	35%	0.353	S	S	.	.	H	α-helix	trans	-49.3	-35.9	-177	0	0	0	0	0	113.9	W167 Y172 H173	W167-A170 PolarHBondContact O-N 3.11Å; A170-Y172 PolarHBondContact O-N 3.27Å; A170-Y172 VanDerWaalsContact O-N 3.1Å; A170-H173 PolarHBondContact O-N 2.97Å; A170-H173 VanDerWaalsContact O-N 3.13Å
171	K	60.3	Low	57.7	Low	91 Å²	91	70.1 Å²	70.1	40%	0.396	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.8	175.8	-171.3	165.4	-173.4	170.2	0	114.5	M79 W167 L169	M79-K171 PolarHBondContact O-NZ 3.47Å; W167-K171 PolarHBondContact O-N 2.8Å; L169-K171 PolarHBondContact O-N 2.66Å
172	Y	58.8	Low	58.3	Low	19 Å²	19	69.1 Å²	69.1	8%	0.075	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	21	-179.1	-51.8	-52	0	0	0	113	F112 F114 L168 L169 A170 P174 Y177 Y204	F112-Y172 HydrophobicContact CE1-CE2 4.44Å; F112-Y172 HydrophobicContact CE2-CD2 4.46Å; F112-Y172 AromaticContact CE2-CE2 3.72Å; F112-Y172 HydrophobicContact CE2-CE2 3.72Å; F112-Y172 AromaticContact CZ-CE2 3.45Å; F112-Y172 HydrophobicContact CZ-CE2 3.45Å; F112-Y172 VanDerWaalsContact CZ-CE2 3.45Å; F112-Y172 AromaticContact CZ-CZ 3.73Å; F112-Y172 WeakPolarHBondContact CZ-OH 3.3Å; F114-Y172 AromaticContact CZ-CD2 3.74Å; F114-Y172 HydrophobicContact CZ-CD2 3.74Å; F114-Y172 HydrophobicContact CZ-CE2 4.15Å; L168-Y172 HydrophobicContact CD2-CE2 4.47Å; L168-Y172 WeakPolarHBondContact O-CD2 3.49Å; L168-Y172 WeakPolarHBondContact O-CE2 3.39Å; L169-Y172 WeakPolarHBondContact O-CA 3.34Å; L169-Y172 PolarHBondContact O-N 2.82Å; A170-Y172 PolarHBondContact O-N 3.27Å; A170-Y172 VanDerWaalsContact O-N 3.1Å; Y172-P174 VanDerWaalsContact O-CD 3.26Å; Y172-P174 WeakPolarHBondContact O-CD 3.17Å; Y172-Y177 WeakPolarHBondContact O-CB 3.19Å; Y172-Y204 AromaticContact CD1-CD1 3.26Å; Y172-Y204 HydrophobicContact CD1-CD1 3.26Å; Y172-Y204 HydrophobicContact CD1-CD2 4.05Å; Y172-Y204 AromaticContact CD1-CE1 3.01Å; Y172-Y204 HydrophobicContact CD1-CE1 3.01Å; Y172-Y204 AromaticContact CD1-CE2 3.81Å; Y172-Y204 HydrophobicContact CD1-CE2 3.81Å; Y172-Y204 AromaticContact CD1-CG 3.74Å; Y172-Y204 HydrophobicContact CD1-CG 3.74Å; Y172-Y204 AromaticContact CD1-CZ 3.24Å; Y172-Y204 HydrophobicContact CD2-CE1 4.16Å; Y172-Y204 AromaticContact CD2-CZ 3.86Å; Y172-Y204 VanDerWaalsContact CD2-OH 3.23Å; Y172-Y204 WeakPolarHBondContact CD2-OH 3.17Å; Y172-Y204 AromaticContact CE1-CD1 3.52Å; Y172-Y204 HydrophobicContact CE1-CD1 3.52Å; Y172-Y204 AromaticContact CE1-CD2 3.37Å; Y172-Y204 HydrophobicContact CE1-CD2 3.37Å; Y172-Y204 AromaticContact CE1-CE1 3.34Å; Y172-Y204 HydrophobicContact CE1-CE1 3.34Å; Y172-Y204 AromaticContact CE1-CE2 3.13Å; Y172-Y204 HydrophobicContact CE1-CE2 3.13Å; Y172-Y204 AromaticContact CE1-CG 3.49Å; Y172-Y204 HydrophobicContact CE1-CG 3.49Å; Y172-Y204 VanDerWaalsContact CE1-CG 3.49Å; Y172-Y204 AromaticContact CE1-CZ 3.06Å; Y172-Y204 WeakPolarHBondContact CE1-OH 3.16Å; Y172-Y204 HydrophobicContact CE2-CE1 4.41Å; Y172-Y204 HydrophobicContact CE2-CE2 4.12Å; Y172-Y204 AromaticContact CE2-CZ 3.71Å; Y172-Y204 WeakPolarHBondContact CE2-OH 3.38Å; Y172-Y204 HydrophobicContact CG-CD1 4.15Å; Y172-Y204 AromaticContact CG-CE1 3.48Å; Y172-Y204 HydrophobicContact CG-CE1 3.48Å; Y172-Y204 VanDerWaalsContact CG-CE1 3.48Å; Y172-Y204 AromaticContact CG-CZ 3.64Å; Y172-Y204 AromaticContact CZ-CD2 3.96Å; Y172-Y204 AromaticContact CZ-CE2 3.31Å; Y172-Y204 AromaticContact CZ-CZ 3.31Å; Y172-Y204 WeakPolarHBondContact OH-CE2 3.44Å
173	H	54.3	Low	59.1	Low	68 Å²	68	74.7 Å²	74.7	32%	0.315	36%	0.359	S	S	.	.			trans	-100	81.5	170	-68.8	-138.7	0	0	0	111.6	L169 A170 V178	L169-H173 VanDerWaalsContact C-CD2 3.5Å; L169-H173 PolarHBondContact O-CD2 3.44Å; A170-H173 PolarHBondContact O-N 2.97Å; A170-H173 VanDerWaalsContact O-N 3.13Å; H173-V178 HydrophobicContact CB-CG2 4.49Å; H173-V178 WeakPolarHBondContact ND1-CG2 3.03Å
174	P	56.6	Low	59.8	Low	69 Å²	69	72.1 Å²	72.1	45%	0.448	35%	0.346	S	S	.	.	S	Bend		-72	137.7	121.8	-10.7	27.8	0	0	0	107.3	Y172 D176 Y177	Y172-P174 VanDerWaalsContact O-CD 3.26Å; Y172-P174 WeakPolarHBondContact O-CD 3.17Å; P174-D176 PolarHBondContact O-N 3.03Å; P174-Y177 HydrophobicContact CB-CD2 3.97Å; P174-Y177 HydrophobicContact CG-CD2 3.58Å; P174-Y177 HydrophobicContact CG-CE2 3.99Å; P174-Y177 HydrophobicContact CG-CG 4.49Å; P174-Y177 WeakPolarHBondContact O-CB 3.07Å; P174-Y177 PolarHBondContact O-N 3.2Å
175	D	54.6	Low	60.5	Low	91 Å²	91	76.2 Å²	76.2	49%	0.487	36%	0.361	S	S	.	.	H	α-helix	trans	-57.4	-23.7	-172	-65.9	-61	0	0	0	114.5	Y160	Y160-D175 HydrophobicContact CE2-CB 4.39Å; Y160-D175 WeakPolarHBondContact CE2-OD1 3.38Å
176	D	59.4	Low	61.2	Low	125 Å²	125	70.5 Å²	70.5	67%	0.668	34%	0.339	S	S	*	.	H	α-helix	trans	-65.6	-34.4	174.2	-59.8	-42.6	0	0	0	113.3	P174 K179 W180	P174-D176 PolarHBondContact O-N 3.03Å; D176-K179 PolarHBondContact O-N 2.95Å; D176-W180 WeakPolarHBondContact O-CB 3Å; D176-W180 PolarHBondContact O-N 3.4Å
177	Y	62.2	Low	62.2	Low	60 Å²	60	72.8 Å²	72.8	24%	0.235	35%	0.349	C	S	.	.	H	α-helix	trans	-67.9	-40.7	-177.5	-91.5	-97.6	0	0	0	111.8	Y172 P174 W180 F181 Y204 L206	Y172-Y177 WeakPolarHBondContact O-CB 3.19Å; P174-Y177 HydrophobicContact CB-CD2 3.97Å; P174-Y177 HydrophobicContact CG-CD2 3.58Å; P174-Y177 HydrophobicContact CG-CE2 3.99Å; P174-Y177 HydrophobicContact CG-CG 4.49Å; P174-Y177 WeakPolarHBondContact O-CB 3.07Å; P174-Y177 PolarHBondContact O-N 3.2Å; Y177-W180 PolarHBondContact O-N 2.73Å; Y177-F181 WeakPolarHBondContact O-CA 2.98Å; Y177-F181 WeakPolarHBondContact O-CB 3.06Å; Y177-F181 PolarHBondContact O-N 2.74Å; Y177-Y204 PolarHBondContact OH-O 2.88Å; Y177-L206 HydrophobicContact CD1-CD1 4.04Å; Y177-L206 HydrophobicContact CD1-CG 4.04Å; Y177-L206 HydrophobicContact CE1-CB 4.34Å; Y177-L206 HydrophobicContact CE1-CG 4.11Å
178	V	61.7	Low	63.4	Low	9 Å²	9	65.5 Å²	65.5	6%	0.055	32%	0.321	C	S	.	.	H	α-helix	trans	-63.2	-48.2	177.8	-175.8	0	0	0	0	109.7	Y160 H173 W180 F181 L182	Y160-V178 HydrophobicContact CD1-CG1 4.27Å; Y160-V178 HydrophobicContact CD2-CG2 4.3Å; Y160-V178 HydrophobicContact CE1-CB 4.4Å; Y160-V178 HydrophobicContact CE1-CG1 3.84Å; Y160-V178 HydrophobicContact CE2-CB 4.05Å; Y160-V178 HydrophobicContact CE2-CG1 4.32Å; Y160-V178 HydrophobicContact CE2-CG2 4.06Å; H173-V178 HydrophobicContact CB-CG2 4.49Å; H173-V178 WeakPolarHBondContact ND1-CG2 3.03Å; V178-W180 VanDerWaalsContact C-N 3.33Å; V178-W180 PolarHBondContact O-N 3.31Å; V178-F181 WeakPolarHBondContact O-CB 3.41Å; V178-F181 PolarHBondContact O-N 2.71Å; V178-L182 HydrophobicContact CG1-CD1 3.75Å; V178-L182 HydrophobicContact CG1-CG 4.28Å; V178-L182 WeakPolarHBondContact O-CG 3.4Å; V178-L182 PolarHBondContact O-N 2.75Å
179	K	64	Low	64.5	Low	115 Å²	115	64.5 Å²	64.5	50%	0.5	32%	0.316	S	S	.	.	H	α-helix	trans	-62.2	-38.7	178.6	-69.3	175.5	-178.8	167.3	0	112.7	Y160 D176 R183	Y160-K179 WeakPolarHBondContact OH-CE 3.23Å; Y160-K179 WeakPolarHBondContact OH-CG 2.96Å; D176-K179 PolarHBondContact O-N 2.95Å; K179-R183 WeakPolarHBondContact O-CD 3.24Å; K179-R183 WeakPolarHBondContact O-CG 3.26Å
180	W	69	Low	65.8	Low	83 Å²	83	63.9 Å²	63.9	31%	0.314	31%	0.313	S	S	.	.	H	α-helix	trans	-68.5	-46.5	174.3	179.6	87.2	0	0	0	111.8	D176 Y177 V178 L182 R183 Q184 L189 L206 H208	D176-W180 WeakPolarHBondContact O-CB 3Å; D176-W180 PolarHBondContact O-N 3.4Å; Y177-W180 PolarHBondContact O-N 2.73Å; V178-W180 VanDerWaalsContact C-N 3.33Å; V178-W180 PolarHBondContact O-N 3.31Å; W180-L182 PolarHBondContact O-N 2.94Å; W180-R183 WeakPolarHBondContact O-CB 3.43Å; W180-R183 PolarHBondContact O-N 3.03Å; W180-Q184 HydrophobicContact CD2-CG 4.42Å; W180-Q184 HydrophobicContact CE3-CG 4.39Å; W180-Q184 HydrophobicContact CH2-CG 4.19Å; W180-Q184 HydrophobicContact CZ2-CG 4.18Å; W180-Q184 HydrophobicContact CZ3-CG 4.27Å; W180-L189 HydrophobicContact CE3-CD1 4.39Å; W180-L189 HydrophobicContact CH2-CD1 4.23Å; W180-L189 HydrophobicContact CH2-CD2 3.63Å; W180-L189 HydrophobicContact CZ3-CD1 3.63Å; W180-L189 HydrophobicContact CZ3-CD2 3.91Å; W180-L189 HydrophobicContact CZ3-CG 4.34Å; W180-L206 HydrophobicContact CE3-CB 4.28Å; W180-L206 HydrophobicContact CH2-CB 4.07Å; W180-L206 VanDerWaalsContact CH2-O 3.3Å; W180-L206 WeakPolarHBondContact CH2-O 3.47Å; W180-L206 HydrophobicContact CZ3-CB 3.45Å; W180-L206 VanDerWaalsContact CZ3-CB 3.45Å; W180-L206 HydrophobicContact CZ3-CD1 4.21Å; W180-L206 HydrophobicContact CZ3-CG 4.48Å; W180-H208 AromaticContact CZ2-CD2 3.95Å; W180-H208 AromaticContact CZ2-NE2 3.86Å
181	F	65.8	Low	67	Low	10 Å²	10	61.3 Å²	61.3	4%	0.044	29%	0.291	C	S	.	.	H	α-helix	trans	-50.7	-55.4	178.9	178.6	-99.7	0	0	0	110.2	F114 I116 I135 Y177 V178 R183 Q184 L189 L206	F114-F181 HydrophobicContact CB-CE2 3.38Å; F114-F181 HydrophobicContact CB-CZ 3.72Å; F114-F181 HydrophobicContact CD1-CE2 4.11Å; F114-F181 HydrophobicContact CD1-CZ 4.29Å; F114-F181 HydrophobicContact CD2-CE2 4.47Å; F114-F181 AromaticContact CG-CE2 3.78Å; F114-F181 HydrophobicContact CG-CE2 3.78Å; F114-F181 HydrophobicContact CG-CZ 4.27Å; I116-F181 HydrophobicContact CD1-CD1 3.86Å; I116-F181 HydrophobicContact CD1-CE1 3.71Å; I116-F181 HydrophobicContact CD1-CG 4.38Å; I116-F181 HydrophobicContact CD1-CZ 4.13Å; I116-F181 WeakPolarHBondContact CD1-O 3.22Å; I116-F181 HydrophobicContact CG1-CD1 4.04Å; I116-F181 HydrophobicContact CG1-CE1 3.36Å; I116-F181 HydrophobicContact CG1-CZ 3.63Å; I135-F181 HydrophobicContact CB-CE1 4.4Å; I135-F181 HydrophobicContact CD1-CD1 4.18Å; I135-F181 HydrophobicContact CD1-CE1 3.56Å; I135-F181 HydrophobicContact CD1-CZ 4.44Å; I135-F181 HydrophobicContact CG1-CE1 3.82Å; I135-F181 HydrophobicContact CG2-CE1 3.71Å; I135-F181 HydrophobicContact CG2-CZ 3.57Å; Y177-F181 WeakPolarHBondContact O-CA 2.98Å; Y177-F181 WeakPolarHBondContact O-CB 3.06Å; Y177-F181 PolarHBondContact O-N 2.74Å; V178-F181 WeakPolarHBondContact O-CB 3.41Å; V178-F181 PolarHBondContact O-N 2.71Å; F181-R183 PolarHBondContact O-N 3.34Å; F181-R183 VanDerWaalsContact O-N 3.09Å; F181-Q184 WeakPolarHBondContact O-CB 3.36Å; F181-Q184 PolarHBondContact O-N 2.96Å; F181-L189 HydrophobicContact CD2-CD1 3.34Å; F181-L189 HydrophobicContact CE2-CD1 3.61Å; F181-L189 HydrophobicContact CG-CD1 4.3Å; F181-L206 HydrophobicContact CD2-CD1 3.87Å
182	L	65.6	Low	68.1	Low	34 Å²	34	57 Å²	57	18%	0.178	27%	0.273	C	S	.	.	H	α-helix	trans	-62.9	-18.1	-176.1	-63	172.4	0	0	0	115.6	I116 Y152 V178 W180 Q184	I116-L182 HydrophobicContact CD1-CD2 4.33Å; Y152-L182 HydrophobicContact CE1-CD1 4.42Å; Y152-L182 HydrophobicContact CE1-CD2 3.53Å; Y152-L182 HydrophobicContact CE2-CD1 3.83Å; Y152-L182 HydrophobicContact CE2-CD2 4.47Å; Y152-L182 VanDerWaalsContact CZ-CD1 3.49Å; Y152-L182 VanDerWaalsContact CZ-CD2 3.4Å; Y152-L182 WeakPolarHBondContact OH-CD1 3.17Å; Y152-L182 WeakPolarHBondContact OH-CD2 3.46Å; V178-L182 HydrophobicContact CG1-CD1 3.75Å; V178-L182 HydrophobicContact CG1-CG 4.28Å; V178-L182 WeakPolarHBondContact O-CG 3.4Å; V178-L182 PolarHBondContact O-N 2.75Å; W180-L182 PolarHBondContact O-N 2.94Å; L182-Q184 VanDerWaalsContact C-N 3.33Å
183	R	69.9	Low	69.1	Low	194 Å²	194	56.4 Å²	56.4	73%	0.732	27%	0.271	S	S	*	.	H	α-helix	trans	-76	-22.5	172.4	-67	168.4	-176.9	-171.5	-0.3	112.1	K179 W180 F181 K185	K179-R183 WeakPolarHBondContact O-CD 3.24Å; K179-R183 WeakPolarHBondContact O-CG 3.26Å; W180-R183 WeakPolarHBondContact O-CB 3.43Å; W180-R183 PolarHBondContact O-N 3.03Å; F181-R183 PolarHBondContact O-N 3.34Å; F181-R183 VanDerWaalsContact O-N 3.09Å; R183-K185 PolarHBondContact O-N 2.94Å; R183-K185 VanDerWaalsContact O-N 3.09Å
184	Q	69.9	Low	70.4	Confident	30 Å²	30	53.3 Å²	53.3	14%	0.14	26%	0.257	C	S	.	.	S	Bend	trans	-87.3	46.1	-176.8	-46.6	-54.9	-18.4	0	0	112.5	W180 F181 L182 G186 I187 L189 H208	W180-Q184 HydrophobicContact CD2-CG 4.42Å; W180-Q184 HydrophobicContact CE3-CG 4.39Å; W180-Q184 HydrophobicContact CH2-CG 4.19Å; W180-Q184 HydrophobicContact CZ2-CG 4.18Å; W180-Q184 HydrophobicContact CZ3-CG 4.27Å; F181-Q184 WeakPolarHBondContact O-CB 3.36Å; F181-Q184 PolarHBondContact O-N 2.96Å; L182-Q184 VanDerWaalsContact C-N 3.33Å; Q184-G186 PolarHBondContact O-N 3.21Å; Q184-I187 HydrophobicContact CB-CB 4.17Å; Q184-I187 HydrophobicContact CB-CD1 4.4Å; Q184-I187 WeakPolarHBondContact O-CB 3.37Å; Q184-I187 PolarHBondContact O-N 3.05Å; Q184-L189 HydrophobicContact CB-CD1 3.89Å; Q184-L189 HydrophobicContact CB-CD2 4.16Å; Q184-L189 HydrophobicContact CB-CG 4.29Å; Q184-L189 HydrophobicContact CG-CD1 4.01Å; Q184-L189 HydrophobicContact CG-CD2 4.13Å; Q184-H208 PolarHBondContact OE1-CE1 2.86Å; Q184-H208 PolarHBondContact OE1-NE2 2.95Å
185	K	67.3	Low	71.4	Confident	146 Å²	146	50 Å²	50	64%	0.635	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	128	-176.5	-65.9	-171.5	177.8	-173.8	0	111.8	A118 R183 I187	A118-K185 HydrophobicContact CB-CB 4.02Å; R183-K185 PolarHBondContact O-N 2.94Å; R183-K185 VanDerWaalsContact O-N 3.09Å; K185-I187 PolarHBondContact O-N 2.96Å; K185-I187 VanDerWaalsContact O-N 3.14Å
186	G	66.8	Low	72.3	Confident	41 Å²	41	47.8 Å²	47.8	42%	0.423	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	-4	-179.3	0	0	0	0	0	116.1	I116 Q184	I116-G186 PolarHBondContact O-N 3.46Å; Q184-G186 PolarHBondContact O-N 3.21Å
187	I	74.1	Confident	72.7	Confident	60 Å²	60	46 Å²	46	31%	0.308	21%	0.211	S	C	.	.			trans	-90.6	134.2	-179.4	-59.4	175.6	0	0	0	109.6	Q184 K185 L189	Q184-I187 HydrophobicContact CB-CB 4.17Å; Q184-I187 HydrophobicContact CB-CD1 4.4Å; Q184-I187 WeakPolarHBondContact O-CB 3.37Å; Q184-I187 PolarHBondContact O-N 3.05Å; K185-I187 PolarHBondContact O-N 2.96Å; K185-I187 VanDerWaalsContact O-N 3.14Å; I187-L189 HydrophobicContact CG2-CD2 4.28Å
188	W	80	Confident	72.8	Confident	42 Å²	42	47.4 Å²	47.4	16%	0.159	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	125	170.3	-71.4	99.1	0	0	0	111.3	P58 I113 F114 K115 D138 C209	P58-W188 HydrophobicContact CG-CB 3.69Å; P58-W188 HydrophobicContact CG-CG 3.88Å; I113-W188 HydrophobicContact CB-CE3 4.07Å; I113-W188 HydrophobicContact CB-CZ3 4.39Å; I113-W188 HydrophobicContact CG2-CB 4.18Å; I113-W188 HydrophobicContact CG2-CD2 4.42Å; I113-W188 HydrophobicContact CG2-CE3 3.64Å; I113-W188 HydrophobicContact CG2-CZ3 4.44Å; F114-W188 CarbonylContact O-C 3.57Å; F114-W188 VanDerWaalsContact O-CA 3.3Å; F114-W188 WeakPolarHBondContact O-CA 3.03Å; K115-W188 HydrophobicContact CB-CD2 3.88Å; K115-W188 HydrophobicContact CB-CE3 3.62Å; K115-W188 HydrophobicContact CB-CH2 4.08Å; K115-W188 HydrophobicContact CB-CZ2 4.32Å; K115-W188 HydrophobicContact CB-CZ3 3.71Å; K115-W188 HydrophobicContact CD-CD2 4.17Å; K115-W188 HydrophobicContact CD-CH2 3.99Å; K115-W188 HydrophobicContact CD-CZ2 3.59Å; K115-W188 HydrophobicContact CD-CZ3 4.43Å; K115-W188 HydrophobicContact CG-CD2 4.37Å; D138-W188 HydrophobicContact CB-CH2 3.86Å; D138-W188 HydrophobicContact CB-CZ3 3.68Å; W188-C209 HydrophobicContact CB-CB 4.18Å; W188-C209 WeakPolarHBondContact O-CB 2.98Å; W188-C209 PolarHBondContact O-N 3.37Å; W188-C209 PolarHBondContact O-SG 2.82Å; W188-C209 VanDerWaalsContact O-SG 3.41Å
189	L	81.6	Confident	73	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	120.2	-179.3	-65.1	178.3	0	0	0	111.1	I113 F114 W180 F181 Q184 I187 H207 C209	I113-L189 VanDerWaalsContact CG2-O 3.22Å; I113-L189 WeakPolarHBondContact CG2-O 3.32Å; F114-L189 HydrophobicContact CB-CB 4.37Å; F114-L189 PolarHBondContact N-O 3.08Å; F114-L189 VanDerWaalsContact N-O 3.08Å; F114-L189 PolarHBondContact O-N 2.91Å; W180-L189 HydrophobicContact CE3-CD1 4.39Å; W180-L189 HydrophobicContact CH2-CD1 4.23Å; W180-L189 HydrophobicContact CH2-CD2 3.63Å; W180-L189 HydrophobicContact CZ3-CD1 3.63Å; W180-L189 HydrophobicContact CZ3-CD2 3.91Å; W180-L189 HydrophobicContact CZ3-CG 4.34Å; F181-L189 HydrophobicContact CD2-CD1 3.34Å; F181-L189 HydrophobicContact CE2-CD1 3.61Å; F181-L189 HydrophobicContact CG-CD1 4.3Å; Q184-L189 HydrophobicContact CB-CD1 3.89Å; Q184-L189 HydrophobicContact CB-CD2 4.16Å; Q184-L189 HydrophobicContact CB-CG 4.29Å; Q184-L189 HydrophobicContact CG-CD1 4.01Å; Q184-L189 HydrophobicContact CG-CD2 4.13Å; I187-L189 HydrophobicContact CG2-CD2 4.28Å; L189-H207 CarbonylContact C-O 2.85Å; L189-H207 WeakPolarHBondContact CA-O 3.26Å; L189-C209 VanDerWaalsContact C-SG 3.56Å
190	C	83.1	Confident	73.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	122.6	-175.5	-85.6	0	0	0	0	109.5	I109 V192 H207 C209 V212	I109-C190 HydrophobicContact CG2-CB 4.47Å; C190-V192 PolarHBondContact O-N 2.86Å; C190-H207 PolarHBondContact N-O 3.34Å; C190-H207 PolarHBondContact O-N 3.34Å; C190-C209 WeakPolarHBondContact CA-SG 3.35Å; C190-C209 HydrophobicContact CB-CB 4Å; C190-C209 WeakPolarHBondContact CB-SG 3.46Å; C190-C209 PolarHBondContact N-SG 3.11Å; C190-C209 WeakPolarHBondContact SG-CA 3.27Å; C190-C209 WeakPolarHBondContact SG-CB 3.18Å; C190-C209 CovalentContact SG-SG 2.04Å; C190-C209 PolarHBondContact SG-SG 2.94Å; C190-V212 HydrophobicContact CB-CB 4.28Å; C190-V212 HydrophobicContact CB-CG1 4.48Å; C190-V212 HydrophobicContact CB-CG2 3.85Å
191	P	81.3	Confident	73.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	124.9	173.3	32	-36	0	0	0	110	I109 G110 F112 Y204 L206	I109-P191 CarbonylContact C-O 3.47Å; I109-P191 VanDerWaalsContact CA-O 3.27Å; I109-P191 WeakPolarHBondContact CA-O 3.46Å; I109-P191 HydrophobicContact CG2-CG 4.49Å; I109-P191 WeakPolarHBondContact CG2-O 3.4Å; G110-P191 PolarHBondContact N-O 2.67Å; F112-P191 HydrophobicContact CD2-CG 4.05Å; F112-P191 HydrophobicContact CE2-CB 3.81Å; F112-P191 HydrophobicContact CE2-CG 3.69Å; F112-P191 HydrophobicContact CZ-CB 4.14Å; F112-P191 HydrophobicContact CZ-CG 4.12Å; F112-P191 WeakPolarHBondContact O-CD 3.47Å; F112-P191 WeakPolarHBondContact O-CG 3.24Å; P191-Y204 HydrophobicContact CB-CE1 4.48Å; P191-Y204 HydrophobicContact CB-CE2 3.38Å; P191-Y204 WeakPolarHBondContact CB-OH 3.31Å; P191-L206 HydrophobicContact CB-CD2 4.34Å
192	V	83.3	Confident	73.3	Confident	2 Å²	2	44 Å²	44	1%	0.012	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.2	171.4	-175.9	0	0	0	0	108.1	W107 I109 C190 Y204 K205 V212 Y218	W107-V192 HydrophobicContact CB-CG1 3.9Å; W107-V192 HydrophobicContact CE3-CG1 4.17Å; I109-V192 HydrophobicContact CG1-CG2 4.49Å; C190-V192 PolarHBondContact O-N 2.86Å; V192-Y204 CarbonylContact O-C 3.5Å; V192-Y204 WeakPolarHBondContact O-CA 3.43Å; V192-K205 PolarHBondContact N-O 2.03Å; V192-K205 PolarHBondContact O-N 3.07Å; V192-V212 HydrophobicContact CG2-CG1 3.98Å; V192-V212 HydrophobicContact CG2-CG2 4Å; V192-Y218 HydrophobicContact CB-CD1 4.41Å; V192-Y218 HydrophobicContact CB-CE1 4.28Å; V192-Y218 HydrophobicContact CG1-CD1 3.71Å; V192-Y218 HydrophobicContact CG1-CE1 3.78Å; V192-Y218 HydrophobicContact CG2-CD1 3.85Å; V192-Y218 HydrophobicContact CG2-CE1 3.82Å
193	C	80.3	Confident	73.4	Confident	6 Å²	6	46.4 Å²	46.4	4%	0.041	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	162.6	163.4	62.6	0	0	0	0	110	W107 P108 Y201	W107-C193 WeakPolarHBondContact CA-O 3.23Å; P108-C193 VanDerWaalsContact CD-O 3.31Å; P108-C193 WeakPolarHBondContact CD-O 3.37Å; P108-C193 PolarHBondContact O-N 3.46Å; C193-Y201 HydrophobicContact CB-CD1 4.12Å
194	T	81.2	Confident	73.6	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	132.1	163.2	67.7	0	0	0	0	109.3	W107 Y201 A202 D203	W107-T194 HydrophobicContact CD2-CG2 3.83Å; W107-T194 HydrophobicContact CE3-CG2 3.47Å; W107-T194 VanDerWaalsContact CE3-CG2 3.47Å; W107-T194 HydrophobicContact CH2-CG2 3.53Å; W107-T194 HydrophobicContact CZ2-CG2 3.89Å; W107-T194 HydrophobicContact CZ3-CG2 3.31Å; T194-Y201 WeakPolarHBondContact O-CA 3.49Å; T194-A202 PolarHBondContact N-O 2.75Å; T194-A202 PolarHBondContact O-N 3.05Å; T194-A202 VanDerWaalsContact OG1-C 3.26Å; T194-A202 WeakPolarHBondContact OG1-CB 3.02Å; T194-A202 PolarHBondContact OG1-O 2.97Å; T194-D203 HydrophobicContact CG2-CB 4.24Å
195	L	78.5	Confident	73.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.6	163.5	-58.6	-178.4	0	0	0	109.2	F46 I84 W89 R105 I106 P108 D200 Y201	F46-L195 HydrophobicContact CE1-CD1 3.89Å; F46-L195 HydrophobicContact CZ-CD1 4.05Å; I84-L195 HydrophobicContact CD1-CD1 3.85Å; W89-L195 HydrophobicContact CH2-CD1 3.71Å; W89-L195 HydrophobicContact CZ2-CD1 4.37Å; W89-L195 HydrophobicContact CZ3-CD1 4.39Å; R105-L195 CarbonylContact C-O 3.54Å; R105-L195 VanDerWaalsContact CA-O 3.25Å; R105-L195 WeakPolarHBondContact CA-O 3.22Å; I106-L195 HydrophobicContact CD1-CB 4.47Å; I106-L195 HydrophobicContact CD1-CD1 4.2Å; I106-L195 HydrophobicContact CG1-CB 3.81Å; I106-L195 HydrophobicContact CG1-CD1 4.37Å; I106-L195 HydrophobicContact CG1-CG 4.45Å; I106-L195 PolarHBondContact N-O 3.03Å; I106-L195 PolarHBondContact O-N 3.18Å; P108-L195 HydrophobicContact CG-CD1 3.73Å; P108-L195 HydrophobicContact CG-CG 3.8Å; L195-D200 WeakPolarHBondContact CA-O 3.4Å; L195-Y201 HydrophobicContact CD2-CD1 3.71Å; L195-Y201 HydrophobicContact CD2-CD2 3.29Å; L195-Y201 HydrophobicContact CD2-CE1 3.75Å; L195-Y201 HydrophobicContact CD2-CE2 3.3Å; L195-Y201 HydrophobicContact CD2-CG 3.51Å
196	N	74.1	Confident	74.4	Confident	45 Å²	45	35.4 Å²	35.4	24%	0.241	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	177.1	168.8	78	8.4	0	0	0	111.2	N198 G199 D200	N196-N198 PolarHBondContact O-N 2.59Å; N196-N198 VanDerWaalsContact O-N 3.14Å; N196-N198 WeakPolarHBondContact OD1-CA 3.4Å; N196-N198 VanDerWaalsContact OD1-CB 3.31Å; N196-N198 WeakPolarHBondContact OD1-CB 3.26Å; N196-N198 PolarHBondContact OD1-N 3.25Å; N196-G199 PolarHBondContact O-N 2.95Å; N196-G199 PolarHBondContact OD1-N 2.85Å; N196-D200 PolarHBondContact N-O 3.4Å; N196-D200 WeakPolarHBondContact ND2-CB 3.03Å; N196-D200 PolarHBondContact ND2-OD2 3.14Å; N196-D200 PolarHBondContact OD1-N 2.7Å
197	Q	67.5	Low	75.1	Confident	88 Å²	88	35.2 Å²	35.2	41%	0.411	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-24.6	176.7	70.7	-166.2	7.7	0	0	115.5	W89 F91 N104 G199	W89-Q197 PolarHBondContact NE1-O 2.66Å; F91-Q197 HydrophobicContact CD1-CB 3.81Å; F91-Q197 HydrophobicContact CE1-CB 3.48Å; F91-Q197 VanDerWaalsContact CE1-CB 3.48Å; F91-Q197 HydrophobicContact CE2-CB 4.49Å; F91-Q197 HydrophobicContact CG-CB 4.44Å; F91-Q197 HydrophobicContact CZ-CB 3.85Å; N104-Q197 HydrophobicContact CB-CB 4.27Å; N104-Q197 PolarHBondContact ND2-OE1 2.66Å; N104-Q197 PolarHBondContact O-N 3.22Å; Q197-G199 VanDerWaalsContact C-N 3.34Å
198	N	64.8	Low	75.6	Confident	88 Å²	88	33.6 Å²	33.6	47%	0.471	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-4	179.7	-52.5	-18.3	0	0	0	112.6	N196 D200	N196-N198 PolarHBondContact O-N 2.59Å; N196-N198 VanDerWaalsContact O-N 3.14Å; N196-N198 WeakPolarHBondContact OD1-CA 3.4Å; N196-N198 VanDerWaalsContact OD1-CB 3.31Å; N196-N198 WeakPolarHBondContact OD1-CB 3.26Å; N196-N198 PolarHBondContact OD1-N 3.25Å; N198-D200 VanDerWaalsContact C-N 3.31Å; N198-D200 VanDerWaalsContact CB-OD2 3.29Å; N198-D200 WeakPolarHBondContact CB-OD2 3.42Å; N198-D200 PolarHBondContact ND2-OD2 2.91Å; N198-D200 VanDerWaalsContact ND2-OD2 3.11Å
199	G	64.7	Low	75.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.	S	Bend	trans	75.5	17.5	-167.8	0	0	0	0	0	113.6	Q81 N196 Q197 Y201	Q81-G199 PolarHBondContact NE2-O 2.03Å; Q81-G199 VanDerWaalsContact NE2-O 3.14Å; N196-G199 PolarHBondContact O-N 2.95Å; N196-G199 PolarHBondContact OD1-N 2.85Å; Q197-G199 VanDerWaalsContact C-N 3.34Å; G199-Y201 WeakPolarHBondContact O-CD2 3.18Å
200	D	69	Low	75.6	Confident	43 Å²	43	33.5 Å²	33.5	23%	0.23	17%	0.174	C	C	.	.			trans	-79.1	137.4	170.9	-45.6	-56.1	0	0	0	111.8	Q81 R86 L195 N196 N198	Q81-D200 VanDerWaalsContact NE2-CA 3.29Å; Q81-D200 PolarHBondContact NE2-OD1 3.18Å; R86-D200 IonicContact CZ-OD1 3.73Å; R86-D200 IonicContact NH1-OD1 2.71Å; R86-D200 PolarHBondContact NH1-OD1 3.07Å; L195-D200 WeakPolarHBondContact CA-O 3.4Å; N196-D200 PolarHBondContact N-O 3.4Å; N196-D200 WeakPolarHBondContact ND2-CB 3.03Å; N196-D200 PolarHBondContact ND2-OD2 3.14Å; N196-D200 PolarHBondContact OD1-N 2.7Å; N198-D200 VanDerWaalsContact C-N 3.31Å; N198-D200 VanDerWaalsContact CB-OD2 3.29Å; N198-D200 WeakPolarHBondContact CB-OD2 3.42Å; N198-D200 PolarHBondContact ND2-OD2 2.91Å; N198-D200 VanDerWaalsContact ND2-OD2 3.11Å
201	Y	71.3	Confident	75.5	Confident	54 Å²	54	35.8 Å²	35.8	21%	0.212	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	126.4	-179.1	-73.6	-120.6	0	0	0	108.7	F78 N80 Q81 I84 C193 T194 L195 G199	F78-Y201 AromaticContact CD2-CE1 3.51Å; F78-Y201 HydrophobicContact CD2-CE1 3.51Å; F78-Y201 AromaticContact CD2-CZ 3.71Å; F78-Y201 WeakPolarHBondContact CD2-OH 3.11Å; F78-Y201 AromaticContact CE2-CE1 3.67Å; F78-Y201 HydrophobicContact CE2-CE1 3.67Å; F78-Y201 HydrophobicContact CG-CE1 4.46Å; F78-Y201 WeakPolarHBondContact CG-OH 3Å; N80-Y201 PolarHBondContact O-OH 2.84Å; Q81-Y201 HydrophobicContact CB-CD2 3.5Å; Q81-Y201 VanDerWaalsContact CB-CD2 3.5Å; Q81-Y201 HydrophobicContact CB-CE2 3.71Å; Q81-Y201 HydrophobicContact CB-CG 4.18Å; Q81-Y201 HydrophobicContact CG-CD2 3.55Å; Q81-Y201 HydrophobicContact CG-CE2 3.78Å; I84-Y201 HydrophobicContact CD1-CE2 3.79Å; I84-Y201 WeakPolarHBondContact CD1-OH 3.25Å; I84-Y201 HydrophobicContact CG1-CE2 4.3Å; I84-Y201 WeakPolarHBondContact CG1-OH 3.17Å; C193-Y201 HydrophobicContact CB-CD1 4.12Å; T194-Y201 WeakPolarHBondContact O-CA 3.49Å; L195-Y201 HydrophobicContact CD2-CD1 3.71Å; L195-Y201 HydrophobicContact CD2-CD2 3.29Å; L195-Y201 HydrophobicContact CD2-CE1 3.75Å; L195-Y201 HydrophobicContact CD2-CE2 3.3Å; L195-Y201 HydrophobicContact CD2-CG 3.51Å; G199-Y201 WeakPolarHBondContact O-CD2 3.18Å
202	A	65.2	Low	75.4	Confident	48 Å²	48	35.8 Å²	35.8	40%	0.397	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	161.2	164.5	0	0	0	0	0	109.3	T194	T194-A202 PolarHBondContact N-O 2.75Å; T194-A202 PolarHBondContact O-N 3.05Å; T194-A202 VanDerWaalsContact OG1-C 3.26Å; T194-A202 WeakPolarHBondContact OG1-CB 3.02Å; T194-A202 PolarHBondContact OG1-O 2.97Å
203	D	68.5	Low	75	Confident	85 Å²	85	35.7 Å²	35.7	46%	0.455	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	48.2	72.8	169.8	-72.5	17.9	0	0	0	114.2	T194 K205	T194-D203 HydrophobicContact CG2-CB 4.24Å; D203-K205 PolarHBondContact O-N 2.93Å; D203-K205 IonicContact OD2-NZ 2.99Å; D203-K205 PolarHBondContact OD2-NZ 2.92Å
204	Y	73	Confident	74.5	Confident	51 Å²	51	37.7 Å²	37.7	20%	0.2	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	126.9	160	-178.9	-82.2	0	0	0	109.3	F112 Y172 Y177 P191 V192 L206	F112-Y204 WeakPolarHBondContact CE2-OH 3.46Å; F112-Y204 HydrophobicContact CZ-CE2 4.43Å; Y172-Y204 AromaticContact CD1-CD1 3.26Å; Y172-Y204 HydrophobicContact CD1-CD1 3.26Å; Y172-Y204 HydrophobicContact CD1-CD2 4.05Å; Y172-Y204 AromaticContact CD1-CE1 3.01Å; Y172-Y204 HydrophobicContact CD1-CE1 3.01Å; Y172-Y204 AromaticContact CD1-CE2 3.81Å; Y172-Y204 HydrophobicContact CD1-CE2 3.81Å; Y172-Y204 AromaticContact CD1-CG 3.74Å; Y172-Y204 HydrophobicContact CD1-CG 3.74Å; Y172-Y204 AromaticContact CD1-CZ 3.24Å; Y172-Y204 HydrophobicContact CD2-CE1 4.16Å; Y172-Y204 AromaticContact CD2-CZ 3.86Å; Y172-Y204 VanDerWaalsContact CD2-OH 3.23Å; Y172-Y204 WeakPolarHBondContact CD2-OH 3.17Å; Y172-Y204 AromaticContact CE1-CD1 3.52Å; Y172-Y204 HydrophobicContact CE1-CD1 3.52Å; Y172-Y204 AromaticContact CE1-CD2 3.37Å; Y172-Y204 HydrophobicContact CE1-CD2 3.37Å; Y172-Y204 AromaticContact CE1-CE1 3.34Å; Y172-Y204 HydrophobicContact CE1-CE1 3.34Å; Y172-Y204 AromaticContact CE1-CE2 3.13Å; Y172-Y204 HydrophobicContact CE1-CE2 3.13Å; Y172-Y204 AromaticContact CE1-CG 3.49Å; Y172-Y204 HydrophobicContact CE1-CG 3.49Å; Y172-Y204 VanDerWaalsContact CE1-CG 3.49Å; Y172-Y204 AromaticContact CE1-CZ 3.06Å; Y172-Y204 WeakPolarHBondContact CE1-OH 3.16Å; Y172-Y204 HydrophobicContact CE2-CE1 4.41Å; Y172-Y204 HydrophobicContact CE2-CE2 4.12Å; Y172-Y204 AromaticContact CE2-CZ 3.71Å; Y172-Y204 WeakPolarHBondContact CE2-OH 3.38Å; Y172-Y204 HydrophobicContact CG-CD1 4.15Å; Y172-Y204 AromaticContact CG-CE1 3.48Å; Y172-Y204 HydrophobicContact CG-CE1 3.48Å; Y172-Y204 VanDerWaalsContact CG-CE1 3.48Å; Y172-Y204 AromaticContact CG-CZ 3.64Å; Y172-Y204 AromaticContact CZ-CD2 3.96Å; Y172-Y204 AromaticContact CZ-CE2 3.31Å; Y172-Y204 AromaticContact CZ-CZ 3.31Å; Y172-Y204 WeakPolarHBondContact OH-CE2 3.44Å; Y177-Y204 PolarHBondContact OH-O 2.88Å; P191-Y204 HydrophobicContact CB-CE1 4.48Å; P191-Y204 HydrophobicContact CB-CE2 3.38Å; P191-Y204 WeakPolarHBondContact CB-OH 3.31Å; V192-Y204 CarbonylContact O-C 3.5Å; V192-Y204 WeakPolarHBondContact O-CA 3.43Å; Y204-L206 HydrophobicContact CE1-CD2 3.6Å; Y204-L206 HydrophobicContact CE1-CG 4.01Å; Y204-L206 WeakPolarHBondContact OH-CD2 3.15Å
205	K	76.9	Confident	73.8	Confident	73 Å²	73	43.3 Å²	43.3	32%	0.317	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	141	178.5	-68	175.8	-176.7	156.4	0	109.9	V192 D203	V192-K205 PolarHBondContact N-O 2.03Å; V192-K205 PolarHBondContact O-N 3.07Å; D203-K205 PolarHBondContact O-N 2.93Å; D203-K205 IonicContact OD2-NZ 2.99Å; D203-K205 PolarHBondContact OD2-NZ 2.92Å
206	L	78	Confident	73.2	Confident	15 Å²	15	46.3 Å²	46.3	8%	0.079	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	124.9	168	-63.9	-177.8	0	0	0	107.8	F114 Y177 W180 F181 P191 Y204	F114-L206 HydrophobicContact CD2-CD2 3.85Å; F114-L206 HydrophobicContact CE2-CD2 3.48Å; F114-L206 VanDerWaalsContact CE2-CD2 3.48Å; F114-L206 HydrophobicContact CZ-CD2 4.44Å; Y177-L206 HydrophobicContact CD1-CD1 4.04Å; Y177-L206 HydrophobicContact CD1-CG 4.04Å; Y177-L206 HydrophobicContact CE1-CB 4.34Å; Y177-L206 HydrophobicContact CE1-CG 4.11Å; W180-L206 HydrophobicContact CE3-CB 4.28Å; W180-L206 HydrophobicContact CH2-CB 4.07Å; W180-L206 VanDerWaalsContact CH2-O 3.3Å; W180-L206 WeakPolarHBondContact CH2-O 3.47Å; W180-L206 HydrophobicContact CZ3-CB 3.45Å; W180-L206 VanDerWaalsContact CZ3-CB 3.45Å; W180-L206 HydrophobicContact CZ3-CD1 4.21Å; W180-L206 HydrophobicContact CZ3-CG 4.48Å; F181-L206 HydrophobicContact CD2-CD1 3.87Å; P191-L206 HydrophobicContact CB-CD2 4.34Å; Y204-L206 HydrophobicContact CE1-CD2 3.6Å; Y204-L206 HydrophobicContact CE1-CG 4.01Å; Y204-L206 WeakPolarHBondContact OH-CD2 3.15Å
207	H	81.1	Confident	73.3	Confident	37 Å²	37	46.2 Å²	46.2	17%	0.171	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	155.4	175	-73.9	-95.4	0	0	0	109.4	L189 C190 C209 V212 Y218	L189-H207 CarbonylContact C-O 2.85Å; L189-H207 WeakPolarHBondContact CA-O 3.26Å; C190-H207 PolarHBondContact N-O 3.34Å; C190-H207 PolarHBondContact O-N 3.34Å; H207-C209 PolarHBondContact O-N 2.87Å; H207-V212 HydrophobicContact CB-CG2 3.22Å; H207-Y218 PolarHBondContact CE1-OH 3.29Å; H207-Y218 PolarHBondContact ND1-OH 2.85Å
208	H	84.1	Confident	73.9	Confident	26 Å²	26	42.3 Å²	42.3	12%	0.12	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	123.6	168.8	-70	-128.1	0	0	0	107.6	W180 Q184 S210 E211 V212	W180-H208 AromaticContact CZ2-CD2 3.95Å; W180-H208 AromaticContact CZ2-NE2 3.86Å; Q184-H208 PolarHBondContact OE1-CE1 2.86Å; Q184-H208 PolarHBondContact OE1-NE2 2.95Å; H208-S210 PolarHBondContact O-N 2.81Å; H208-E211 HydrophobicContact CB-CB 4.49Å; H208-E211 HydrophobicContact CB-CG 4.09Å; H208-E211 WeakPolarHBondContact O-CB 3.31Å; H208-E211 PolarHBondContact O-N 3.45Å; H208-V212 PolarHBondContact O-N 2.95Å
209	C	83.6	Confident	74.9	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.007	20%	0.198	C	C	.	.	H	α-helix	trans	-55.8	-31.4	-179.1	-73.1	0	0	0	0	112.2	P58 I113 W188 L189 C190 H207 E211 V212 M213	P58-C209 HydrophobicContact CB-CB 3.65Å; P58-C209 VanDerWaalsContact CB-SG 3.55Å; P58-C209 HydrophobicContact CG-CB 3.42Å; P58-C209 VanDerWaalsContact CG-CB 3.42Å; I113-C209 WeakPolarHBondContact CG2-SG 3.13Å; W188-C209 HydrophobicContact CB-CB 4.18Å; W188-C209 WeakPolarHBondContact O-CB 2.98Å; W188-C209 PolarHBondContact O-N 3.37Å; W188-C209 PolarHBondContact O-SG 2.82Å; W188-C209 VanDerWaalsContact O-SG 3.41Å; L189-C209 VanDerWaalsContact C-SG 3.56Å; C190-C209 WeakPolarHBondContact CA-SG 3.35Å; C190-C209 HydrophobicContact CB-CB 4Å; C190-C209 WeakPolarHBondContact CB-SG 3.46Å; C190-C209 PolarHBondContact N-SG 3.11Å; C190-C209 WeakPolarHBondContact SG-CA 3.27Å; C190-C209 WeakPolarHBondContact SG-CB 3.18Å; C190-C209 CovalentContact SG-SG 2.04Å; C190-C209 PolarHBondContact SG-SG 2.94Å; H207-C209 PolarHBondContact O-N 2.87Å; C209-E211 PolarHBondContact O-N 2.8Å; C209-V212 PolarHBondContact O-N 3.26Å; C209-M213 HydrophobicContact CB-CE 3.85Å; C209-M213 HydrophobicContact CB-SD 4.29Å; C209-M213 VanDerWaalsContact O-CB 3.23Å; C209-M213 WeakPolarHBondContact O-CB 3.49Å; C209-M213 WeakPolarHBondContact O-CE 3.33Å; C209-M213 WeakPolarHBondContact O-CG 3.37Å; C209-M213 PolarHBondContact O-N 2.04Å
210	S	79.1	Confident	75.8	Confident	40 Å²	40	38.4 Å²	38.4	28%	0.28	20%	0.198	S	C	.	.	H	α-helix	trans	-55.7	-35.4	173.4	48.3	0	0	0	0	114.1	H208 T214	H208-S210 PolarHBondContact O-N 2.81Å; S210-T214 VanDerWaalsContact O-CG2 3.29Å; S210-T214 WeakPolarHBondContact O-CG2 3.47Å; S210-T214 PolarHBondContact O-OG1 2.85Å
211	E	80.3	Confident	76.7	Confident	47 Å²	47	36.4 Å²	36.4	22%	0.22	19%	0.188	C	C	.	.	H	α-helix	trans	-80.1	-52.5	179.2	-62.5	173.2	163.8	0	0	109.5	H208 C209 M213 T214 W215 R595	H208-E211 HydrophobicContact CB-CB 4.49Å; H208-E211 HydrophobicContact CB-CG 4.09Å; H208-E211 WeakPolarHBondContact O-CB 3.31Å; H208-E211 PolarHBondContact O-N 3.45Å; C209-E211 PolarHBondContact O-N 2.8Å; E211-M213 PolarHBondContact O-N 2.97Å; E211-M213 VanDerWaalsContact O-N 3.16Å; E211-T214 PolarHBondContact O-N 3.42Å; E211-T214 PolarHBondContact O-OG1 3.05Å; E211-W215 VanDerWaalsContact O-CD1 3.3Å; E211-W215 PolarHBondContact O-N 3.18Å; E211-R595 IonicContact OE1-CZ 2.62Å; E211-R595 IonicContact OE1-NH2 2.65Å; E211-R595 PolarHBondContact OE1-NH2 3.46Å
212	V	80	Confident	77.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-51	-44.8	177.9	-173.6	0	0	0	0	112.6	L49 I109 C190 V192 H207 H208 C209 T214 Y218	L49-V212 HydrophobicContact CD1-CG1 4.42Å; I109-V212 HydrophobicContact CD1-CG1 3.45Å; I109-V212 VanDerWaalsContact CD1-CG1 3.45Å; I109-V212 HydrophobicContact CG1-CG1 3.66Å; C190-V212 HydrophobicContact CB-CB 4.28Å; C190-V212 HydrophobicContact CB-CG1 4.48Å; C190-V212 HydrophobicContact CB-CG2 3.85Å; V192-V212 HydrophobicContact CG2-CG1 3.98Å; V192-V212 HydrophobicContact CG2-CG2 4Å; H207-V212 HydrophobicContact CB-CG2 3.22Å; H208-V212 PolarHBondContact O-N 2.95Å; C209-V212 PolarHBondContact O-N 3.26Å; V212-T214 VanDerWaalsContact C-N 3.33Å; V212-T214 PolarHBondContact O-N 2.87Å; V212-Y218 HydrophobicContact CB-CD2 4.21Å; V212-Y218 HydrophobicContact CB-CE2 4.3Å; V212-Y218 HydrophobicContact CB-CG 4.41Å; V212-Y218 HydrophobicContact CG1-CD1 3.84Å; V212-Y218 HydrophobicContact CG1-CD2 3.78Å; V212-Y218 HydrophobicContact CG1-CE1 4.32Å; V212-Y218 HydrophobicContact CG1-CE2 4.25Å; V212-Y218 HydrophobicContact CG1-CG 3.52Å; V212-Y218 WeakPolarHBondContact O-CD2 3.06Å
213	M	74.1	Confident	78.5	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-20	-175.8	-62	-179.7	-53.1	0	0	112.2	M52 P58 F61 C209 E211	M52-M213 WeakPolarHBondContact CA-O 3.03Å; M52-M213 HydrophobicContact CB-CB 3.59Å; M52-M213 WeakPolarHBondContact CB-O 3.43Å; M52-M213 HydrophobicContact CE-CB 4.19Å; M52-M213 HydrophobicContact CE-CE 3.31Å; M52-M213 HydrophobicContact CE-CG 4.35Å; M52-M213 HydrophobicContact CE-SD 3.33Å; M52-M213 WeakPolarHBondContact CE-SD 3.31Å; M52-M213 HydrophobicContact CG-CB 4.21Å; M52-M213 PolarHBondContact N-O 3.43Å; P58-M213 VanDerWaalsContact CA-SD 3.53Å; P58-M213 HydrophobicContact CB-CE 3.95Å; P58-M213 HydrophobicContact CB-SD 3.54Å; P58-M213 VanDerWaalsContact CB-SD 3.54Å; P58-M213 HydrophobicContact CG-CE 3.67Å; P58-M213 HydrophobicContact CG-SD 3.98Å; F61-M213 HydrophobicContact CB-SD 4.41Å; F61-M213 HydrophobicContact CD1-CG 4.29Å; F61-M213 HydrophobicContact CD1-SD 4.12Å; F61-M213 HydrophobicContact CG-SD 4.4Å; C209-M213 HydrophobicContact CB-CE 3.85Å; C209-M213 HydrophobicContact CB-SD 4.29Å; C209-M213 VanDerWaalsContact O-CB 3.23Å; C209-M213 WeakPolarHBondContact O-CB 3.49Å; C209-M213 WeakPolarHBondContact O-CE 3.33Å; C209-M213 WeakPolarHBondContact O-CG 3.37Å; C209-M213 PolarHBondContact O-N 2.04Å; E211-M213 PolarHBondContact O-N 2.97Å; E211-M213 VanDerWaalsContact O-N 3.16Å
214	T	68.7	Low	79.4	Confident	48 Å²	48	27.6 Å²	27.6	29%	0.294	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-22.8	178.3	48.7	0	0	0	0	113.7	S210 E211 V212 K599	S210-T214 VanDerWaalsContact O-CG2 3.29Å; S210-T214 WeakPolarHBondContact O-CG2 3.47Å; S210-T214 PolarHBondContact O-OG1 2.85Å; E211-T214 PolarHBondContact O-N 3.42Å; E211-T214 PolarHBondContact O-OG1 3.05Å; V212-T214 VanDerWaalsContact C-N 3.33Å; V212-T214 PolarHBondContact O-N 2.87Å; T214-K599 HydrophobicContact CG2-CG 3.92Å
215	W	67.4	Low	79.9	Confident	120 Å²	120	28.8 Å²	28.8	46%	0.455	15%	0.147	S	C	.	.	S	Bend	trans	-88.9	135.6	-177.4	-59.3	5.6	0	0	0	111.7	E211 D217 Y218	E211-W215 VanDerWaalsContact O-CD1 3.3Å; E211-W215 PolarHBondContact O-N 3.18Å; W215-D217 PolarHBondContact O-N 3.48Å; W215-Y218 HydrophobicContact CB-CD2 3.84Å; W215-Y218 HydrophobicContact CB-CE2 3.73Å; W215-Y218 AromaticContact CD2-CE2 3.89Å; W215-Y218 HydrophobicContact CD2-CE2 3.89Å; W215-Y218 AromaticContact CE3-CE2 3.47Å; W215-Y218 HydrophobicContact CE3-CE2 3.47Å; W215-Y218 VanDerWaalsContact CE3-CE2 3.47Å; W215-Y218 AromaticContact CE3-CZ 3.86Å; W215-Y218 HydrophobicContact CG-CE2 4.05Å; W215-Y218 HydrophobicContact CZ3-CE2 4.3Å; W215-Y218 WeakPolarHBondContact CZ3-OH 3.24Å
216	S	66.2	Low	80.1	Confident	63 Å²	63	26.1 Å²	26.1	44%	0.441	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	35.8	173.8	61.1	0	0	0	0	112.9	L48	L48-S216 VanDerWaalsContact CD1-C 3.43Å; L48-S216 WeakPolarHBondContact CD1-O 3.48Å
217	D	75.4	Confident	80	Confident	44 Å²	44	25.7 Å²	25.7	24%	0.235	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.8	-5.7	178.6	-71.4	-53.3	0	0	0	113	W100 W107 W215	W100-D217 VanDerWaalsContact CH2-CA 3.47Å; W100-D217 HydrophobicContact CH2-CB 4.49Å; W100-D217 WeakPolarHBondContact CH2-O 3.03Å; W100-D217 VanDerWaalsContact CZ3-CA 3.43Å; W100-D217 HydrophobicContact CZ3-CB 3.97Å; W100-D217 WeakPolarHBondContact CZ3-O 2.97Å; W107-D217 WeakPolarHBondContact CB-O 3.24Å; W215-D217 PolarHBondContact O-N 3.48Å
218	Y	81.7	Confident	79.7	Confident	6 Å²	6	29.1 Å²	29.1	2%	0.024	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	154.8	-179.6	-60.6	-79	0	0	0	111.4	L48 L49 W107 V192 H207 V212 W215	L48-Y218 WeakPolarHBondContact CD1-O 3.39Å; L49-Y218 WeakPolarHBondContact CB-O 3.43Å; L49-Y218 WeakPolarHBondContact CG-O 3.17Å; L49-Y218 PolarHBondContact N-O 3.36Å; W107-Y218 HydrophobicContact CB-CD1 3.75Å; W107-Y218 HydrophobicContact CB-CE1 4.25Å; W107-Y218 CarbonylContact O-C 3.57Å; W107-Y218 VanDerWaalsContact O-CA 3.32Å; W107-Y218 WeakPolarHBondContact O-CA 3.44Å; V192-Y218 HydrophobicContact CB-CD1 4.41Å; V192-Y218 HydrophobicContact CB-CE1 4.28Å; V192-Y218 HydrophobicContact CG1-CD1 3.71Å; V192-Y218 HydrophobicContact CG1-CE1 3.78Å; V192-Y218 HydrophobicContact CG2-CD1 3.85Å; V192-Y218 HydrophobicContact CG2-CE1 3.82Å; H207-Y218 PolarHBondContact CE1-OH 3.29Å; H207-Y218 PolarHBondContact ND1-OH 2.85Å; V212-Y218 HydrophobicContact CB-CD2 4.21Å; V212-Y218 HydrophobicContact CB-CE2 4.3Å; V212-Y218 HydrophobicContact CB-CG 4.41Å; V212-Y218 HydrophobicContact CG1-CD1 3.84Å; V212-Y218 HydrophobicContact CG1-CD2 3.78Å; V212-Y218 HydrophobicContact CG1-CE1 4.32Å; V212-Y218 HydrophobicContact CG1-CE2 4.25Å; V212-Y218 HydrophobicContact CG1-CG 3.52Å; V212-Y218 WeakPolarHBondContact O-CD2 3.06Å; W215-Y218 HydrophobicContact CB-CD2 3.84Å; W215-Y218 HydrophobicContact CB-CE2 3.73Å; W215-Y218 AromaticContact CD2-CE2 3.89Å; W215-Y218 HydrophobicContact CD2-CE2 3.89Å; W215-Y218 AromaticContact CE3-CE2 3.47Å; W215-Y218 HydrophobicContact CE3-CE2 3.47Å; W215-Y218 VanDerWaalsContact CE3-CE2 3.47Å; W215-Y218 AromaticContact CE3-CZ 3.86Å; W215-Y218 HydrophobicContact CG-CE2 4.05Å; W215-Y218 HydrophobicContact CZ3-CE2 4.3Å; W215-Y218 WeakPolarHBondContact CZ3-OH 3.24Å
219	H	84.2	Confident	79.2	Confident	4 Å²	4	28.3 Å²	28.3	2%	0.019	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	151.6	178.5	-65.6	73.1	0	0	0	112.2	F46 M47 W100 I106 W107 P108 I109	F46-H219 HydrophobicContact CD1-CB 4.5Å; M47-H219 CarbonylContact O-C 3.53Å; M47-H219 WeakPolarHBondContact O-CA 3.23Å; M47-H219 WeakPolarHBondContact O-CB 3.03Å; W100-H219 AromaticContact CE2-CE1 3.95Å; W100-H219 AromaticContact CH2-CE1 3.07Å; W100-H219 WeakPolarHBondContact CH2-CE1 3.45Å; W100-H219 AromaticContact CH2-ND1 3.56Å; W100-H219 AromaticContact CH2-NE2 4Å; W100-H219 AromaticContact CZ2-CE1 3.03Å; W100-H219 WeakPolarHBondContact CZ2-CE1 3.42Å; W100-H219 AromaticContact CZ2-ND1 3.88Å; W100-H219 AromaticContact CZ2-NE2 3.51Å; I106-H219 VanDerWaalsContact CB-CE1 3.44Å; I106-H219 WeakPolarHBondContact CB-CE1 3.28Å; I106-H219 WeakPolarHBondContact CG2-CE1 3.4Å; W107-H219 PolarHBondContact O-N 2.98Å; P108-H219 CarbonylContact C-O 3.23Å; P108-H219 VanDerWaalsContact CA-O 3.31Å; P108-H219 WeakPolarHBondContact CA-O 3.48Å; P108-H219 HydrophobicContact CB-CB 4.18Å; I109-H219 PolarHBondContact N-O 2.8Å
220	V	84.7	Confident	78.7	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	137.9	158.4	64.4	0	0	0	0	108.6	F46 M47 L49 L62 L65 R75	F46-V220 WeakPolarHBondContact CA-O 3.33Å; M47-V220 HydrophobicContact CB-CG1 4.02Å; M47-V220 HydrophobicContact CE-CG1 4.14Å; M47-V220 PolarHBondContact N-O 2.86Å; M47-V220 PolarHBondContact O-N 3.45Å; L49-V220 HydrophobicContact CD2-CB 3.82Å; L49-V220 HydrophobicContact CD2-CG1 3.94Å; L62-V220 HydrophobicContact CB-CG2 4.3Å; L62-V220 HydrophobicContact CD2-CB 4.24Å; L62-V220 HydrophobicContact CD2-CG2 4.28Å; L65-V220 HydrophobicContact CD2-CB 4.46Å; L65-V220 HydrophobicContact CD2-CG1 3.6Å; L65-V220 HydrophobicContact CG-CG1 4.02Å; R75-V220 HydrophobicContact CG-CG2 4.2Å
221	A	87.6	Confident	78.7	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.008	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	133.2	167.3	0	0	0	0	0	109.1	V44 F46 Y76 F78	V44-A221 HydrophobicContact CG1-CB 4Å; F46-A221 HydrophobicContact CD1-CB 3.95Å; F46-A221 HydrophobicContact CE1-CB 3.72Å; F46-A221 HydrophobicContact CZ-CB 4.03Å; Y76-A221 HydrophobicContact CD1-CB 4.29Å; Y76-A221 PolarHBondContact N-O 2.95Å; Y76-A221 WeakPolarHBondContact O-CB 3.39Å; F78-A221 HydrophobicContact CD1-CB 4.49Å; F78-A221 HydrophobicContact CE1-CB 3.99Å
222	C	86.7	Confident	78.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.9	-174.5	-63.8	0	0	0	0	110.9	V44 T45 M47 C66 F70 R74	V44-C222 CarbonylContact C-O 3.54Å; V44-C222 WeakPolarHBondContact CA-O 3.47Å; T45-C222 PolarHBondContact N-O 3.47Å; T45-C222 PolarHBondContact O-N 3.46Å; M47-C222 WeakPolarHBondContact CE-SG 3.5Å; C66-C222 WeakPolarHBondContact CA-SG 3.11Å; C66-C222 HydrophobicContact CB-CB 3.56Å; C66-C222 WeakPolarHBondContact CB-SG 3.27Å; C66-C222 WeakPolarHBondContact SG-CA 3.26Å; C66-C222 WeakPolarHBondContact SG-CB 3.34Å; C66-C222 CovalentContact SG-SG 2.03Å; C66-C222 PolarHBondContact SG-SG 3.34Å; F70-C222 HydrophobicContact CD2-CB 3.69Å; F70-C222 HydrophobicContact CE2-CB 3.56Å; R74-C222 CarbonylContact O-C 3.59Å; R74-C222 WeakPolarHBondContact O-CA 3.2Å
223	L	88	Confident	79	Confident	2 Å²	2	32 Å²	32	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	127.6	174.8	-176.2	60.4	0	0	0	109.3	W39 Q42 C43 V44 G73 R74 Y76	W39-L223 HydrophobicContact CB-CD1 4.43Å; W39-L223 HydrophobicContact CE3-CD1 3.82Å; W39-L223 HydrophobicContact CE3-CD2 3.97Å; W39-L223 HydrophobicContact CZ3-CD2 3.95Å; Q42-L223 HydrophobicContact CB-CD1 3.54Å; Q42-L223 HydrophobicContact CB-CG 4.35Å; Q42-L223 HydrophobicContact CG-CD1 4.46Å; C43-L223 CarbonylContact O-C 3.48Å; C43-L223 VanDerWaalsContact O-CA 3.31Å; C43-L223 WeakPolarHBondContact O-CA 3.13Å; V44-L223 HydrophobicContact CG2-CD1 3.8Å; G73-L223 CarbonylContact C-O 3.54Å; G73-L223 WeakPolarHBondContact CA-O 3.32Å; R74-L223 HydrophobicContact CG-CB 4Å; R74-L223 HydrophobicContact CG-CD2 4.4Å; R74-L223 HydrophobicContact CG-CG 4.43Å; R74-L223 PolarHBondContact N-O 2.86Å; R74-L223 PolarHBondContact O-N 2.95Å; Y76-L223 HydrophobicContact CD2-CB 3.99Å; Y76-L223 HydrophobicContact CD2-CD1 4.26Å; Y76-L223 HydrophobicContact CD2-CD2 4.06Å; Y76-L223 HydrophobicContact CD2-CG 4.36Å; Y76-L223 HydrophobicContact CG-CB 4.42Å
224	H	86.1	Confident	79.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	169.2	178.9	64.2	84.3	0	0	0	111.2	Q42 C43 T45 F70 Y227	Q42-H224 WeakPolarHBondContact CB-O 3.3Å; C43-H224 WeakPolarHBondContact CB-CE1 3.49Å; C43-H224 PolarHBondContact N-O 3.23Å; C43-H224 PolarHBondContact O-CD2 3.49Å; C43-H224 PolarHBondContact O-N 3.22Å; T45-H224 PolarHBondContact OG1-NE2 2.97Å; F70-H224 HydrophobicContact CB-CB 3.43Å; F70-H224 VanDerWaalsContact CB-CB 3.43Å; F70-H224 AromaticContact CD1-CD2 3.7Å; F70-H224 AromaticContact CD1-CG 3.96Å; F70-H224 AromaticContact CD1-NE2 3.85Å; F70-H224 HydrophobicContact CD2-CB 4.47Å; F70-H224 AromaticContact CD2-CD2 3.69Å; F70-H224 AromaticContact CE1-NE2 3.89Å; F70-H224 HydrophobicContact CG-CB 3.98Å; F70-H224 AromaticContact CG-CD2 3.51Å; F70-H224 AromaticContact CG-CG 3.69Å; H224-Y227 AromaticContact CE1-CE2 3.53Å; H224-Y227 AromaticContact ND1-CE2 3.43Å; H224-Y227 WeakPolarHBondContact ND1-CE2 3.18Å
225	N	84.1	Confident	80.5	Confident	76 Å²	76	34.5 Å²	34.5	41%	0.406	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	150.9	176.3	-66.8	-19.1	0	0	0	111.4	Q42	Q42-N225 PolarHBondContact NE2-OD1 3.03Å
226	A	82.1	Confident	81.6	Confident	17 Å²	17	34.4 Å²	34.4	14%	0.14	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-63.8	147.2	173.8	0	0	0	0	0	111.7	C43	C43-A226 VanDerWaalsContact SG-CA 3.55Å
227	Y	74.5	Confident	82.4	Confident	6 Å²	6	32.4 Å²	32.4	2%	0.024	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	136.3	-176.8	-72.2	-83.7	0	0	0	111.3	Y25 R26 P28 F70 Y71 H224 N229 R259 Y262	Y25-Y227 CarbonylContact C-O 3.53Å; Y25-Y227 VanDerWaalsContact CA-O 3.24Å; Y25-Y227 WeakPolarHBondContact CA-O 3.49Å; R26-Y227 PolarHBondContact N-O 2.95Å; R26-Y227 PolarHBondContact O-N 3.29Å; P28-Y227 HydrophobicContact CG-CD2 4.12Å; P28-Y227 HydrophobicContact CG-CE2 4.21Å; F70-Y227 WeakPolarHBondContact CA-OH 3.33Å; F70-Y227 HydrophobicContact CD1-CE2 4.18Å; Y71-Y227 PolarHBondContact N-OH 3.17Å; H224-Y227 AromaticContact CE1-CE2 3.53Å; H224-Y227 AromaticContact ND1-CE2 3.43Å; H224-Y227 WeakPolarHBondContact ND1-CE2 3.18Å; Y227-N229 PolarHBondContact O-N 3.19Å; Y227-R259 HydrophobicContact CD1-CG 4.49Å; Y227-Y262 HydrophobicContact CD1-CD2 4.2Å; Y227-Y262 HydrophobicContact CD2-CD2 4.36Å; Y227-Y262 HydrophobicContact CD2-CG 4.33Å; Y227-Y262 AromaticContact CE1-CD2 3.55Å; Y227-Y262 HydrophobicContact CE1-CD2 3.55Å; Y227-Y262 HydrophobicContact CE1-CE2 4.43Å; Y227-Y262 HydrophobicContact CE1-CG 4.32Å; Y227-Y262 AromaticContact CE2-CD2 3.71Å; Y227-Y262 HydrophobicContact CE2-CD2 3.71Å; Y227-Y262 HydrophobicContact CE2-CG 4Å; Y227-Y262 AromaticContact CZ-CD2 3.27Å; Y227-Y262 AromaticContact CZ-CE2 3.95Å; Y227-Y262 VanDerWaalsContact OH-CD2 3.31Å; Y227-Y262 WeakPolarHBondContact OH-CD2 3.32Å; Y227-Y262 WeakPolarHBondContact OH-CE2 3.22Å
228	R	76.2	Confident	83	Confident	110 Å²	110	31.2 Å²	31.2	42%	0.415	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	124.2	175.2	-166.7	179.5	-63.7	-175.1	5	109.1	T24 Y25 A258 R259 G263	T24-R228 CarbonylContact O-C 3.59Å; T24-R228 VanDerWaalsContact O-CA 3.25Å; T24-R228 WeakPolarHBondContact O-CA 3.49Å; Y25-R228 HydrophobicContact CD1-CB 4.05Å; Y25-R228 HydrophobicContact CE1-CB 3.82Å; Y25-R228 HydrophobicContact CE1-CG 4.33Å; Y25-R228 PolarHBondContact OH-NE 3.26Å; Y25-R228 PolarHBondContact OH-NH2 3.08Å; R228-A258 CarbonylContact O-C 3.55Å; R228-A258 WeakPolarHBondContact O-CA 3.02Å; R228-R259 HydrophobicContact CB-CB 4.05Å; R228-R259 PolarHBondContact O-N 2.9Å; R228-G263 WeakPolarHBondContact O-CA 3.43Å
229	N	72.1	Confident	83.4	Confident	8 Å²	8	31 Å²	31	4%	0.043	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-83.9	165.2	171.6	-60.1	-50.6	0	0	0	110.4	D23 T24 R26 Y227 N231 I264	D23-N229 PolarHBondContact O-ND2 3.16Å; T24-N229 PolarHBondContact O-N 3.04Å; R26-N229 VanDerWaalsContact CB-ND2 3.32Å; R26-N229 WeakPolarHBondContact CB-ND2 3.11Å; R26-N229 WeakPolarHBondContact CD-ND2 3.33Å; R26-N229 WeakPolarHBondContact CG-ND2 3.31Å; Y227-N229 PolarHBondContact O-N 3.19Å; N229-N231 PolarHBondContact O-N 2.85Å; N229-I264 HydrophobicContact CB-CB 4.18Å; N229-I264 WeakPolarHBondContact OD1-CB 3.29Å; N229-I264 VanDerWaalsContact OD1-CG1 3.31Å; N229-I264 WeakPolarHBondContact OD1-CG1 3.37Å; N229-I264 PolarHBondContact OD1-N 2.66Å
230	C	72.9	Confident	83.7	Confident	4 Å²	4	32.2 Å²	32.2	3%	0.027	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-58	126.1	158.5	-176	0	0	0	0	109.8	Y232 S256 A258 I264 C266	C230-Y232 HydrophobicContact CB-CD1 4.43Å; C230-S256 CarbonylContact C-O 3.39Å; C230-S256 VanDerWaalsContact CA-O 3.31Å; C230-S256 WeakPolarHBondContact CA-O 3.18Å; C230-A258 HydrophobicContact CB-CB 4.36Å; C230-I264 WeakPolarHBondContact CB-O 3.29Å; C230-I264 PolarHBondContact N-O 3.1Å; C230-C266 VanDerWaalsContact CB-CA 3.49Å; C230-C266 HydrophobicContact CB-CB 3.81Å; C230-C266 WeakPolarHBondContact CB-SG 3.48Å; C230-C266 WeakPolarHBondContact SG-CA 2.96Å; C230-C266 WeakPolarHBondContact SG-CB 3.38Å; C230-C266 CovalentContact SG-SG 2.03Å; C230-C266 PolarHBondContact SG-SG 3.05Å
231	N	79.1	Confident	83.9	Confident	29 Å²	29	32.5 Å²	32.5	16%	0.155	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	123.8	167.2	-175.3	6.4	0	0	0	107.2	N229 L255 S256	N229-N231 PolarHBondContact O-N 2.85Å; N231-L255 HydrophobicContact CB-CB 4.2Å; N231-L255 WeakPolarHBondContact O-CA 3.25Å; N231-L255 WeakPolarHBondContact O-CB 3.25Å; N231-L255 PolarHBondContact O-N 2.94Å; N231-S256 VanDerWaalsContact CB-OG 3.32Å; N231-S256 WeakPolarHBondContact CB-OG 3.34Å; N231-S256 PolarHBondContact N-O 3.12Å; N231-S256 PolarHBondContact O-N 3.46Å
232	Y	81.8	Confident	83.9	Confident	44 Å²	44	33.9 Å²	33.9	17%	0.173	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	145.8	-179.8	63.6	-87.1	0	0	0	110.5	T21 C230 V252 S253 P267 W274	T21-Y232 HydrophobicContact CG2-CE1 4.21Å; C230-Y232 HydrophobicContact CB-CD1 4.43Å; Y232-V252 HydrophobicContact CD2-CG1 3.73Å; Y232-V252 HydrophobicContact CG-CG1 4.04Å; Y232-S253 CarbonylContact C-O 3.41Å; Y232-S253 WeakPolarHBondContact CA-O 3.36Å; Y232-S253 WeakPolarHBondContact CB-O 3.29Å; Y232-P267 HydrophobicContact CD1-CG 4.1Å; Y232-P267 HydrophobicContact CD2-CG 3.89Å; Y232-P267 HydrophobicContact CE1-CG 3.97Å; Y232-P267 HydrophobicContact CE2-CG 3.74Å; Y232-P267 HydrophobicContact CG-CG 4.06Å; Y232-W274 AromaticContact CD2-CH2 3.82Å; Y232-W274 HydrophobicContact CD2-CH2 3.82Å; Y232-W274 HydrophobicContact CD2-CZ3 4.2Å; Y232-W274 AromaticContact CE2-CH2 3.55Å; Y232-W274 HydrophobicContact CE2-CH2 3.55Å; Y232-W274 HydrophobicContact CE2-CZ2 4.28Å; Y232-W274 HydrophobicContact CE2-CZ3 4.12Å
233	K	86.2	Confident	83.6	Confident	88 Å²	88	38 Å²	38	38%	0.383	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	150.4	178.2	65.7	179.2	179.9	-169.5	0	111.7	V235 S253 L255	K233-V235 HydrophobicContact CD-CG2 4.32Å; K233-V235 HydrophobicContact CG-CG2 4.03Å; K233-S253 PolarHBondContact N-O 2.96Å; K233-S253 PolarHBondContact O-N 3.35Å; K233-L255 HydrophobicContact CB-CD1 4.19Å; K233-L255 HydrophobicContact CD-CD1 4.21Å; K233-L255 HydrophobicContact CD-CD2 3.96Å; K233-L255 HydrophobicContact CD-CG 4.45Å; K233-L255 HydrophobicContact CG-CD1 4.19Å; K233-L255 HydrophobicContact CG-CD2 4.16Å; K233-L255 HydrophobicContact CG-CG 4.27Å
234	M	86.8	Confident	83.5	Confident	52 Å²	52	40.6 Å²	40.6	26%	0.256	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	129.9	165.1	-169.8	177.9	71	0	0	108.8	Y250 W274	M234-Y250 HydrophobicContact CE-CD1 3.91Å; M234-Y250 HydrophobicContact CE-CE1 3.86Å; M234-Y250 HydrophobicContact CG-CD1 3.66Å; M234-Y250 HydrophobicContact CG-CG 3.95Å; M234-Y250 HydrophobicContact SD-CD1 3.68Å; M234-Y250 HydrophobicContact SD-CD2 4.43Å; M234-Y250 HydrophobicContact SD-CE1 4.16Å; M234-Y250 HydrophobicContact SD-CG 3.84Å; M234-W274 HydrophobicContact CB-CD2 4.36Å; M234-W274 HydrophobicContact CB-CE3 4.01Å; M234-W274 HydrophobicContact CB-CH2 3.8Å; M234-W274 HydrophobicContact CB-CZ2 4.16Å; M234-W274 HydrophobicContact CB-CZ3 3.71Å; M234-W274 HydrophobicContact CG-CD2 4.13Å; M234-W274 HydrophobicContact CG-CE3 3.9Å; M234-W274 HydrophobicContact CG-CZ3 4.13Å; M234-W274 HydrophobicContact SD-CD2 4.06Å; M234-W274 HydrophobicContact SD-CE3 4.44Å; M234-W274 HydrophobicContact SD-CG 4.13Å
235	V	87.3	Confident	83.7	Confident	49 Å²	49	46.6 Å²	46.6	30%	0.297	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	131.2	173.9	178.6	0	0	0	0	108.6	K233 H237 Y250 T251	K233-V235 HydrophobicContact CD-CG2 4.32Å; K233-V235 HydrophobicContact CG-CG2 4.03Å; V235-H237 PolarHBondContact O-N 3.29Å; V235-Y250 CarbonylContact O-C 3.51Å; V235-Y250 VanDerWaalsContact O-CA 3.29Å; V235-Y250 WeakPolarHBondContact O-CA 3.27Å; V235-T251 PolarHBondContact N-O 2.62Å; V235-T251 PolarHBondContact O-N 3.01Å
236	E	89	Confident	84	Confident	119 Å²	119	47.1 Å²	47.1	56%	0.556	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	102.4	175.9	-172.7	156.4	152.8	0	0	109.4	K249 Y250	E236-K249 HydrophobicContact CG-CG 4.37Å; E236-K249 WeakPolarHBondContact OE1-CE 3Å; E236-K249 IonicContact OE1-NZ 2.7Å; E236-K249 PolarHBondContact OE1-NZ 3.28Å; E236-K249 IonicContact OE2-NZ 3.47Å; E236-Y250 HydrophobicContact CB-CD1 4.09Å; E236-Y250 HydrophobicContact CB-CE1 3.81Å; E236-Y250 HydrophobicContact CG-CD1 4.38Å; E236-Y250 HydrophobicContact CG-CE1 3.85Å; E236-Y250 VanDerWaalsContact OE2-CE1 3.26Å; E236-Y250 WeakPolarHBondContact OE2-CE1 3.47Å; E236-Y250 PolarHBondContact OE2-OH 3.09Å; E236-Y250 VanDerWaalsContact OE2-OH 3.07Å
237	H	83.4	Confident	84.5	Confident	20 Å²	20	48 Å²	48	9%	0.093	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	119.5	178.6	178.6	62.3	0	0	0	108.6	V235 H239 K249 G322 C325	V235-H237 PolarHBondContact O-N 3.29Å; H237-H239 PolarHBondContact O-N 3.07Å; H237-K249 CarbonylContact C-O 3.49Å; H237-K249 VanDerWaalsContact C-O 3.3Å; H237-K249 PolarHBondContact N-O 3.34Å; H237-K249 CarbonylContact O-C 3.3Å; H237-G322 PolarHBondContact CE1-O 2.74Å; H237-G322 PolarHBondContact ND1-O 3.48Å; H237-C325 PolarHBondContact CE1-O 3.02Å; H237-C325 PolarHBondContact NE2-O 3.22Å
238	C	88.6	Confident	85.4	Confident	20 Å²	20	48.4 Å²	48.4	14%	0.135	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	119.8	178.6	-173.4	0	0	0	0	110	Y248 C278 E279 T281	C238-Y248 WeakPolarHBondContact CA-O 3.39Å; C238-C278 VanDerWaalsContact CA-SG 3.55Å; C238-C278 HydrophobicContact CB-CB 3.95Å; C238-C278 WeakPolarHBondContact CB-SG 3.07Å; C238-C278 WeakPolarHBondContact SG-CB 3.17Å; C238-C278 CovalentContact SG-SG 2.04Å; C238-C278 PolarHBondContact SG-SG 3.08Å; C238-E279 PolarHBondContact SG-O 3.06Å; C238-T281 HydrophobicContact CB-CG2 3.92Å
239	H	90.1	Very high	86.1	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.009	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	160.3	-176.8	74.7	-64.1	0	0	0	110.5	H237 W247 Y248 Y250 T251 I270 M327	H237-H239 PolarHBondContact O-N 3.07Å; H239-W247 VanDerWaalsContact C-CE3 3.44Å; H239-W247 CarbonylContact O-C 3.59Å; H239-W247 WeakPolarHBondContact O-CA 3.3Å; H239-Y248 PolarHBondContact N-O 3.14Å; H239-Y248 PolarHBondContact ND1-O 1.83Å; H239-Y248 PolarHBondContact O-N 3.41Å; H239-Y250 PolarHBondContact CE1-O 3.4Å; H239-T251 HydrophobicContact CB-CG2 4.01Å; H239-T251 VanDerWaalsContact CG-CG2 3.48Å; H239-T251 VanDerWaalsContact ND1-CG2 3.33Å; H239-T251 WeakPolarHBondContact ND1-CG2 3.01Å; H239-I270 VanDerWaalsContact CE1-CD1 3.47Å; H239-I270 WeakPolarHBondContact CE1-CD1 3.18Å; H239-M327 VanDerWaalsContact CA-O 3.3Å; H239-M327 WeakPolarHBondContact CA-O 3.4Å; H239-M327 HydrophobicContact CB-CB 4.09Å; H239-M327 WeakPolarHBondContact CB-O 3.49Å; H239-M327 HydrophobicContact CB-SD 4.34Å
240	F	90.8	Very high	86.9	Confident	29 Å²	29	47.1 Å²	47.1	13%	0.127	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.5	177.7	-173.2	-111.1	0	0	0	111	E242 W247 M327 A328 K329	F240-E242 HydrophobicContact CD1-CB 4.37Å; F240-E242 HydrophobicContact CE1-CB 4.15Å; F240-E242 HydrophobicContact CE1-CG 4.27Å; F240-W247 HydrophobicContact CB-CD2 4.16Å; F240-W247 HydrophobicContact CB-CE3 4.14Å; F240-W247 HydrophobicContact CB-CH2 3.71Å; F240-W247 HydrophobicContact CB-CZ2 3.78Å; F240-W247 HydrophobicContact CB-CZ3 3.94Å; F240-W247 AromaticContact CD2-CD1 3.89Å; F240-W247 HydrophobicContact CD2-CD2 4.1Å; F240-W247 AromaticContact CD2-CE2 3.64Å; F240-W247 HydrophobicContact CD2-CG 4.21Å; F240-W247 HydrophobicContact CD2-CZ2 4.01Å; F240-W247 AromaticContact CD2-NE1 3.53Å; F240-W247 HydrophobicContact CG-CZ2 4.15Å; F240-M327 PolarHBondContact N-O 2.74Å; F240-A328 HydrophobicContact CB-CB 3.97Å; F240-A328 HydrophobicContact CD1-CB 4.18Å; F240-A328 CarbonylContact O-C 3.4Å; F240-A328 VanDerWaalsContact O-CA 3.23Å; F240-A328 WeakPolarHBondContact O-CA 3.06Å; F240-K329 PolarHBondContact O-N 3.36Å
241	D	88.9	Confident	87.5	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.032	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	114.3	168.1	-176.3	-52.6	0	0	0	107.6	D243 D244 Q245 K246 Y248	D241-D243 VanDerWaalsContact C-N 3.33Å; D241-D243 PolarHBondContact OD1-N 3.32Å; D241-D243 VanDerWaalsContact OD1-N 3.11Å; D241-D244 HydrophobicContact CB-CB 4.42Å; D241-D244 PolarHBondContact OD1-N 3.08Å; D241-Q245 WeakPolarHBondContact O-CA 3.49Å; D241-Q245 PolarHBondContact O-N 3.09Å; D241-K246 PolarHBondContact N-O 2.97Å; D241-K246 PolarHBondContact O-N 3.32Å; D241-K246 VanDerWaalsContact O-N 3.14Å; D241-Y248 HydrophobicContact CB-CD2 3.63Å; D241-Y248 HydrophobicContact CB-CE2 3.82Å
242	E	86.4	Confident	87.6	Confident	31 Å²	31	47.6 Å²	47.6	15%	0.145	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-20.1	-174.2	-169.1	170.1	-105.4	0	0	112.6	F240 Q245 W289 R307 K329 K330	F240-E242 HydrophobicContact CD1-CB 4.37Å; F240-E242 HydrophobicContact CE1-CB 4.15Å; F240-E242 HydrophobicContact CE1-CG 4.27Å; E242-Q245 PolarHBondContact O-NE2 3.03Å; E242-W289 WeakPolarHBondContact OE1-CZ2 3Å; E242-W289 WeakPolarHBondContact OE2-CZ2 3.25Å; E242-R307 IonicContact OE1-CZ 3.37Å; E242-R307 IonicContact OE1-NH1 3.44Å; E242-R307 IonicContact OE1-NH2 2.67Å; E242-R307 PolarHBondContact OE1-NH2 3.36Å; E242-K329 WeakPolarHBondContact CB-O 3.45Å; E242-K329 PolarHBondContact N-O 2.99Å; E242-K330 HydrophobicContact CB-CB 4.38Å; E242-K330 WeakPolarHBondContact OE2-CD 3.06Å; E242-K330 IonicContact OE2-NZ 2.58Å; E242-K330 PolarHBondContact OE2-NZ 3.03Å
243	D	81.5	Confident	87.6	Confident	85 Å²	85	47.3 Å²	47.3	46%	0.455	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-38.7	179.4	-56.4	-63.2	0	0	0	111.2	D241 Q245 V331	D241-D243 VanDerWaalsContact C-N 3.33Å; D241-D243 PolarHBondContact OD1-N 3.32Å; D241-D243 VanDerWaalsContact OD1-N 3.11Å; D243-Q245 VanDerWaalsContact C-N 3.34Å; D243-V331 WeakPolarHBondContact OD2-CA 3.2Å; D243-V331 WeakPolarHBondContact OD2-CB 3.28Å; D243-V331 PolarHBondContact OD2-N 3.31Å
244	D	86.2	Confident	87.4	Confident	57 Å²	57	47.4 Å²	47.4	31%	0.305	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-9.7	171.8	-83.3	-18.1	0	0	0	113.7	D241 K246 Y248 K275	D241-D244 HydrophobicContact CB-CB 4.42Å; D241-D244 PolarHBondContact OD1-N 3.08Å; D244-K246 HydrophobicContact CB-CB 4.27Å; D244-K246 HydrophobicContact CB-CD 4.4Å; D244-K246 WeakPolarHBondContact O-CG 3.4Å; D244-K246 PolarHBondContact O-N 3.09Å; D244-Y248 HydrophobicContact CB-CE2 3.92Å; D244-Y248 WeakPolarHBondContact OD2-CE2 3.3Å; D244-Y248 PolarHBondContact OD2-OH 2.82Å; D244-K275 IonicContact OD1-NZ 3.96Å; D244-K275 IonicContact OD2-NZ 2.97Å; D244-K275 PolarHBondContact OD2-NZ 2.88Å
245	Q	88.8	Confident	87.2	Confident	126 Å²	126	49.1 Å²	49.1	59%	0.589	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	37.9	-171.9	-69.1	-73.2	-56	0	0	113.1	D241 E242 D243	D241-Q245 WeakPolarHBondContact O-CA 3.49Å; D241-Q245 PolarHBondContact O-N 3.09Å; E242-Q245 PolarHBondContact O-NE2 3.03Å; D243-Q245 VanDerWaalsContact C-N 3.34Å
246	K	92.1	Very high	86.7	Confident	87 Å²	87	48.3 Å²	48.3	38%	0.378	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	152.5	-170.5	-78.9	164.5	-168.3	154.4	0	112.9	D241 D244 Y248	D241-K246 PolarHBondContact N-O 2.97Å; D241-K246 PolarHBondContact O-N 3.32Å; D241-K246 VanDerWaalsContact O-N 3.14Å; D244-K246 HydrophobicContact CB-CB 4.27Å; D244-K246 HydrophobicContact CB-CD 4.4Å; D244-K246 WeakPolarHBondContact O-CG 3.4Å; D244-K246 PolarHBondContact O-N 3.09Å; K246-Y248 HydrophobicContact CB-CE2 3.95Å
247	W	92.2	Very high	86	Confident	36 Å²	36	49.8 Å²	49.8	14%	0.136	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	126.3	172.7	-73	89.8	0	0	0	109.9	H239 F240 Q277 C278 K280 C282 W286	H239-W247 VanDerWaalsContact C-CE3 3.44Å; H239-W247 CarbonylContact O-C 3.59Å; H239-W247 WeakPolarHBondContact O-CA 3.3Å; F240-W247 HydrophobicContact CB-CD2 4.16Å; F240-W247 HydrophobicContact CB-CE3 4.14Å; F240-W247 HydrophobicContact CB-CH2 3.71Å; F240-W247 HydrophobicContact CB-CZ2 3.78Å; F240-W247 HydrophobicContact CB-CZ3 3.94Å; F240-W247 AromaticContact CD2-CD1 3.89Å; F240-W247 HydrophobicContact CD2-CD2 4.1Å; F240-W247 AromaticContact CD2-CE2 3.64Å; F240-W247 HydrophobicContact CD2-CG 4.21Å; F240-W247 HydrophobicContact CD2-CZ2 4.01Å; F240-W247 AromaticContact CD2-NE1 3.53Å; F240-W247 HydrophobicContact CG-CZ2 4.15Å; W247-Q277 CarbonylContact O-C 3.52Å; W247-Q277 WeakPolarHBondContact O-CA 3.03Å; W247-C278 WeakPolarHBondContact CB-O 3.07Å; W247-C278 PolarHBondContact O-N 2.89Å; W247-K280 HydrophobicContact CZ2-CB 4.49Å; W247-K280 HydrophobicContact CZ2-CG 3.89Å; W247-C282 HydrophobicContact CH2-CB 4.27Å; W247-C282 WeakPolarHBondContact CH2-SG 3.4Å; W247-C282 WeakPolarHBondContact CZ3-SG 3.07Å; W247-W286 HydrophobicContact CH2-CH2 4.05Å; W247-W286 AromaticContact CH2-CZ2 3.88Å; W247-W286 HydrophobicContact CH2-CZ2 3.88Å; W247-W286 HydrophobicContact CZ2-CZ2 4.34Å
248	Y	92.8	Very high	85.1	Confident	14 Å²	14	50.4 Å²	50.4	6%	0.055	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.7	178.6	-72.1	-61.7	0	0	0	112.4	C238 H239 D241 D244 K246 Y250 I270 K275 R276 Q277 C278	C238-Y248 WeakPolarHBondContact CA-O 3.39Å; H239-Y248 PolarHBondContact N-O 3.14Å; H239-Y248 PolarHBondContact ND1-O 1.83Å; H239-Y248 PolarHBondContact O-N 3.41Å; D241-Y248 HydrophobicContact CB-CD2 3.63Å; D241-Y248 HydrophobicContact CB-CE2 3.82Å; D244-Y248 HydrophobicContact CB-CE2 3.92Å; D244-Y248 WeakPolarHBondContact OD2-CE2 3.3Å; D244-Y248 PolarHBondContact OD2-OH 2.82Å; K246-Y248 HydrophobicContact CB-CE2 3.95Å; Y248-Y250 VanDerWaalsContact C-N 3.26Å; Y248-Y250 PolarHBondContact O-N 3.04Å; Y248-I270 HydrophobicContact CD2-CD1 3.51Å; Y248-I270 HydrophobicContact CE2-CD1 4.37Å; Y248-I270 HydrophobicContact CG-CD1 3.69Å; Y248-K275 HydrophobicContact CD1-CB 4.06Å; Y248-K275 HydrophobicContact CD1-CG 4.46Å; Y248-K275 HydrophobicContact CE1-CB 3.66Å; Y248-K275 HydrophobicContact CE1-CD 4.34Å; Y248-K275 HydrophobicContact CE1-CG 4.15Å; Y248-K275 HydrophobicContact CE2-CD 4.32Å; Y248-R276 WeakPolarHBondContact CA-O 3.29Å; Y248-Q277 HydrophobicContact CD1-CG 4.36Å; Y248-Q277 HydrophobicContact CE1-CG 3.98Å; Y248-C278 PolarHBondContact O-SG 3.44Å
249	K	91.2	Very high	84	Confident	73 Å²	73	54.4 Å²	54.4	32%	0.317	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	-20.3	-173.4	-176.8	168.4	175.4	175.2	0	114.1	E236 H237 R276 C278	E236-K249 HydrophobicContact CG-CG 4.37Å; E236-K249 WeakPolarHBondContact OE1-CE 3Å; E236-K249 IonicContact OE1-NZ 2.7Å; E236-K249 PolarHBondContact OE1-NZ 3.28Å; E236-K249 IonicContact OE2-NZ 3.47Å; H237-K249 CarbonylContact C-O 3.49Å; H237-K249 VanDerWaalsContact C-O 3.3Å; H237-K249 PolarHBondContact N-O 3.34Å; H237-K249 CarbonylContact O-C 3.3Å; K249-R276 HydrophobicContact CB-CB 4.46Å; K249-R276 WeakPolarHBondContact CB-O 3.08Å; K249-R276 PolarHBondContact N-O 3.3Å; K249-C278 HydrophobicContact CB-CB 4.07Å; K249-C278 PolarHBondContact N-SG 2.53Å; K249-C278 VanDerWaalsContact N-SG 3.41Å
250	Y	89.3	Confident	82.3	Confident	18 Å²	18	57.6 Å²	57.6	7%	0.071	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	131.6	-171	-61.3	-76.4	0	0	0	112.3	M234 V235 E236 H239 Y248 R276	M234-Y250 HydrophobicContact CE-CD1 3.91Å; M234-Y250 HydrophobicContact CE-CE1 3.86Å; M234-Y250 HydrophobicContact CG-CD1 3.66Å; M234-Y250 HydrophobicContact CG-CG 3.95Å; M234-Y250 HydrophobicContact SD-CD1 3.68Å; M234-Y250 HydrophobicContact SD-CD2 4.43Å; M234-Y250 HydrophobicContact SD-CE1 4.16Å; M234-Y250 HydrophobicContact SD-CG 3.84Å; V235-Y250 CarbonylContact O-C 3.51Å; V235-Y250 VanDerWaalsContact O-CA 3.29Å; V235-Y250 WeakPolarHBondContact O-CA 3.27Å; E236-Y250 HydrophobicContact CB-CD1 4.09Å; E236-Y250 HydrophobicContact CB-CE1 3.81Å; E236-Y250 HydrophobicContact CG-CD1 4.38Å; E236-Y250 HydrophobicContact CG-CE1 3.85Å; E236-Y250 VanDerWaalsContact OE2-CE1 3.26Å; E236-Y250 WeakPolarHBondContact OE2-CE1 3.47Å; E236-Y250 PolarHBondContact OE2-OH 3.09Å; E236-Y250 VanDerWaalsContact OE2-OH 3.07Å; H239-Y250 PolarHBondContact CE1-O 3.4Å; Y248-Y250 VanDerWaalsContact C-N 3.26Å; Y248-Y250 PolarHBondContact O-N 3.04Å; Y250-R276 HydrophobicContact CD2-CB 4.25Å; Y250-R276 HydrophobicContact CE2-CB 4.22Å; Y250-R276 HydrophobicContact CE2-CG 4.49Å
251	T	83.9	Confident	80.4	Confident	9 Å²	9	60.4 Å²	60.4	6%	0.055	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	166.2	171.5	57.5	0	0	0	0	111.3	V235 H239 M327	V235-T251 PolarHBondContact N-O 2.62Å; V235-T251 PolarHBondContact O-N 3.01Å; H239-T251 HydrophobicContact CB-CG2 4.01Å; H239-T251 VanDerWaalsContact CG-CG2 3.48Å; H239-T251 VanDerWaalsContact ND1-CG2 3.33Å; H239-T251 WeakPolarHBondContact ND1-CG2 3.01Å; T251-M327 HydrophobicContact CG2-CE 3.81Å; T251-M327 HydrophobicContact CG2-SD 4.42Å
252	V	82.2	Confident	79	Confident	35 Å²	35	62.8 Å²	62.8	21%	0.212	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.4	169	-177	0	0	0	0	108.7	Y232 P267 W274	Y232-V252 HydrophobicContact CD2-CG1 3.73Å; Y232-V252 HydrophobicContact CG-CG1 4.04Å; V252-P267 HydrophobicContact CG1-CG 4.03Å; V252-P267 HydrophobicContact CG2-CG 4.47Å; V252-W274 HydrophobicContact CG2-CE3 4.25Å; V252-W274 HydrophobicContact CG2-CZ3 4Å
253	S	82.7	Confident	77.7	Confident	38 Å²	38	61.6 Å²	61.6	27%	0.266	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	117	169.9	167.7	0	0	0	0	109.1	Y232 K233	Y232-S253 CarbonylContact C-O 3.41Å; Y232-S253 WeakPolarHBondContact CA-O 3.36Å; Y232-S253 WeakPolarHBondContact CB-O 3.29Å; K233-S253 PolarHBondContact N-O 2.96Å; K233-S253 PolarHBondContact O-N 3.35Å
254	I	80.7	Confident	76.9	Confident	90 Å²	90	60.1 Å²	60.1	46%	0.462	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	130.5	173.9	-60.6	169.4	0	0	0	108.3	E257 C266	I254-E257 HydrophobicContact CG2-CG 4.44Å; I254-C266 HydrophobicContact CD1-CB 3.82Å; I254-C266 HydrophobicContact CG1-CB 4.16Å
255	L	82.6	Confident	75.9	Confident	88 Å²	88	61.6 Å²	61.6	46%	0.461	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-33.6	178.1	-59.2	179.3	0	0	0	111.7	N231 K233	N231-L255 HydrophobicContact CB-CB 4.2Å; N231-L255 WeakPolarHBondContact O-CA 3.25Å; N231-L255 WeakPolarHBondContact O-CB 3.25Å; N231-L255 PolarHBondContact O-N 2.94Å; K233-L255 HydrophobicContact CB-CD1 4.19Å; K233-L255 HydrophobicContact CD-CD1 4.21Å; K233-L255 HydrophobicContact CD-CD2 3.96Å; K233-L255 HydrophobicContact CD-CG 4.45Å; K233-L255 HydrophobicContact CG-CD1 4.19Å; K233-L255 HydrophobicContact CG-CD2 4.16Å; K233-L255 HydrophobicContact CG-CG 4.27Å
256	S	78.1	Confident	74.9	Confident	32 Å²	32	56.9 Å²	56.9	22%	0.224	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	146	168.2	67.9	0	0	0	0	110.3	C230 N231	C230-S256 CarbonylContact C-O 3.39Å; C230-S256 VanDerWaalsContact CA-O 3.31Å; C230-S256 WeakPolarHBondContact CA-O 3.18Å; N231-S256 VanDerWaalsContact CB-OG 3.32Å; N231-S256 WeakPolarHBondContact CB-OG 3.34Å; N231-S256 PolarHBondContact N-O 3.12Å; N231-S256 PolarHBondContact O-N 3.46Å
257	E	72.8	Confident	74.1	Confident	150 Å²	150	54.4 Å²	54.4	70%	0.701	30%	0.296	S	S	*	.			trans	-76.9	166.3	176.8	-64.2	-176.7	175.4	0	0	113.3	I254	I254-E257 HydrophobicContact CG2-CG 4.44Å
258	A	65.9	Low	72.9	Confident	32 Å²	32	55.2 Å²	55.2	26%	0.264	31%	0.305	S	S	.	.			trans	-81.9	146.7	178.6	0	0	0	0	0	112.1	R228 C230 S260 I264	R228-A258 CarbonylContact O-C 3.55Å; R228-A258 WeakPolarHBondContact O-CA 3.02Å; C230-A258 HydrophobicContact CB-CB 4.36Å; A258-S260 PolarHBondContact O-N 2.72Å; A258-I264 VanDerWaalsContact CB-O 3.23Å; A258-I264 WeakPolarHBondContact CB-O 3.37Å
259	R	65.5	Low	72	Confident	105 Å²	105	55.5 Å²	55.5	40%	0.396	31%	0.312	S	S	.	.			trans	-81.7	107.6	173.7	-171.3	174.8	-171.5	-172.7	1.5	110.5	Y71 Y227 R228 Y262 G263	Y71-R259 VanDerWaalsContact CD2-NH2 3.27Å; Y71-R259 VanDerWaalsContact CE2-NH2 3.3Å; Y71-R259 VanDerWaalsContact CG-NH2 3.31Å; Y227-R259 HydrophobicContact CD1-CG 4.49Å; R228-R259 HydrophobicContact CB-CB 4.05Å; R228-R259 PolarHBondContact O-N 2.9Å; R259-Y262 PolarHBondContact O-N 3.29Å; R259-G263 PolarHBondContact O-N 2.61Å
260	S	54	Low	71.6	Confident	69 Å²	69	52.7 Å²	52.7	48%	0.483	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	145.6	172.7	-168	0	0	0	0	112.1	A258	A258-S260 PolarHBondContact O-N 2.72Å
261	P	51.3	Low	71.5	Confident	87 Å²	87	52.8 Å²	52.8	57%	0.565	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	cis	-94.6	1.4	-4.5	36.7	-34.7	0	0	0	114.5
262	Y	57.9	Low	71.5	Confident	56 Å²	56	61.4 Å²	61.4	22%	0.22	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-12.5	-167.6	-56.3	-76	0	0	0	116.1	P28 T69 F70 Y227 R259	P28-Y262 HydrophobicContact CG-CD1 4.35Å; P28-Y262 HydrophobicContact CG-CG 4.4Å; T69-Y262 WeakPolarHBondContact CG2-OH 3.43Å; T69-Y262 VanDerWaalsContact O-CE2 3.27Å; T69-Y262 WeakPolarHBondContact O-CE2 3.46Å; T69-Y262 PolarHBondContact O-OH 2.99Å; F70-Y262 HydrophobicContact CD1-CD2 4.46Å; F70-Y262 AromaticContact CD1-CE2 3.94Å; F70-Y262 HydrophobicContact CD1-CE2 3.94Å; F70-Y262 HydrophobicContact CE1-CE1 4.17Å; F70-Y262 HydrophobicContact CE1-CE2 4.32Å; F70-Y262 AromaticContact CE1-CZ 3.98Å; Y227-Y262 HydrophobicContact CD1-CD2 4.2Å; Y227-Y262 HydrophobicContact CD2-CD2 4.36Å; Y227-Y262 HydrophobicContact CD2-CG 4.33Å; Y227-Y262 AromaticContact CE1-CD2 3.55Å; Y227-Y262 HydrophobicContact CE1-CD2 3.55Å; Y227-Y262 HydrophobicContact CE1-CE2 4.43Å; Y227-Y262 HydrophobicContact CE1-CG 4.32Å; Y227-Y262 AromaticContact CE2-CD2 3.71Å; Y227-Y262 HydrophobicContact CE2-CD2 3.71Å; Y227-Y262 HydrophobicContact CE2-CG 4Å; Y227-Y262 AromaticContact CZ-CD2 3.27Å; Y227-Y262 AromaticContact CZ-CE2 3.95Å; Y227-Y262 VanDerWaalsContact OH-CD2 3.31Å; Y227-Y262 WeakPolarHBondContact OH-CD2 3.32Å; Y227-Y262 WeakPolarHBondContact OH-CE2 3.22Å; R259-Y262 PolarHBondContact O-N 3.29Å
263	G	60.3	Low	71.7	Confident	7 Å²	7	66.6 Å²	66.6	7%	0.072	36%	0.362	C	S	.	.	S	Bend	trans	-66.4	141.9	174	0	0	0	0	0	111.2	R228 R259 P265	R228-G263 WeakPolarHBondContact O-CA 3.43Å; R259-G263 PolarHBondContact O-N 2.61Å; G263-P265 WeakPolarHBondContact O-CD 3.02Å; G263-P265 VanDerWaalsContact O-N 3.17Å
264	I	64.4	Low	72	Confident	53 Å²	53	65.9 Å²	65.9	27%	0.272	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-61.9	118.6	177.1	-61.2	168.5	0	0	0	108.9	A31 M33 N229 C230 A258	A31-I264 HydrophobicContact CB-CD1 3.73Å; A31-I264 HydrophobicContact CB-CG1 3.58Å; M33-I264 HydrophobicContact CE-CG1 4.28Å; N229-I264 HydrophobicContact CB-CB 4.18Å; N229-I264 WeakPolarHBondContact OD1-CB 3.29Å; N229-I264 VanDerWaalsContact OD1-CG1 3.31Å; N229-I264 WeakPolarHBondContact OD1-CG1 3.37Å; N229-I264 PolarHBondContact OD1-N 2.66Å; C230-I264 WeakPolarHBondContact CB-O 3.29Å; C230-I264 PolarHBondContact N-O 3.1Å; A258-I264 VanDerWaalsContact CB-O 3.23Å; A258-I264 WeakPolarHBondContact CB-O 3.37Å
265	P	65	Low	72.5	Confident	88 Å²	88	65.1 Å²	65.1	57%	0.571	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-67.5	161.3	-177.1	28.3	-35.5	0	0	0	112	G263	G263-P265 WeakPolarHBondContact O-CD 3.02Å; G263-P265 VanDerWaalsContact O-N 3.17Å
266	C	68.6	Low	73	Confident	27 Å²	27	68.3 Å²	68.3	18%	0.182	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-65.5	144.9	177.3	-62.5	0	0	0	0	111.3	C230 I254 T268	C230-C266 VanDerWaalsContact CB-CA 3.49Å; C230-C266 HydrophobicContact CB-CB 3.81Å; C230-C266 WeakPolarHBondContact CB-SG 3.48Å; C230-C266 WeakPolarHBondContact SG-CA 2.96Å; C230-C266 WeakPolarHBondContact SG-CB 3.38Å; C230-C266 CovalentContact SG-SG 2.03Å; C230-C266 PolarHBondContact SG-SG 3.05Å; I254-C266 HydrophobicContact CD1-CB 3.82Å; I254-C266 HydrophobicContact CG1-CB 4.16Å; C266-T268 PolarHBondContact O-N 3.22Å
267	P	75.1	Confident	73.7	Confident	36 Å²	36	73.3 Å²	73.3	23%	0.234	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-67.9	123.7	174	30.3	-35.2	0	0	0	109.4	Y232 V252 G269	Y232-P267 HydrophobicContact CD1-CG 4.1Å; Y232-P267 HydrophobicContact CD2-CG 3.89Å; Y232-P267 HydrophobicContact CE1-CG 3.97Å; Y232-P267 HydrophobicContact CE2-CG 3.74Å; Y232-P267 HydrophobicContact CG-CG 4.06Å; V252-P267 HydrophobicContact CG1-CG 4.03Å; V252-P267 HydrophobicContact CG2-CG 4.47Å; P267-G269 VanDerWaalsContact C-N 3.25Å; P267-G269 PolarHBondContact O-N 2.97Å
268	T	67.8	Low	74.6	Confident	53 Å²	53	67.8 Å²	67.8	33%	0.325	35%	0.35	S	S	.	.	S	Bend	trans	-73.7	-17.6	-175.9	55.6	0	0	0	0	113.3	C266 T302 K329	C266-T268 PolarHBondContact O-N 3.22Å; T268-T302 HydrophobicContact CG2-CG2 4.45Å; T268-K329 PolarHBondContact O-NZ 2.03Å
269	G	73.4	Confident	75.8	Confident	20 Å²	20	74.4 Å²	74.4	21%	0.206	38%	0.376	C	S	.	.	S	Bend	trans	-141.8	-177.5	174	0	0	0	0	0	112.4	P267 P271	P267-G269 VanDerWaalsContact C-N 3.25Å; P267-G269 PolarHBondContact O-N 2.97Å; G269-P271 WeakPolarHBondContact O-CD 3.41Å
270	I	83.4	Confident	76.7	Confident	13 Å²	13	76.7 Å²	76.7	7%	0.067	39%	0.388	C	S	.	.			trans	-63.4	123.9	178.3	-48.5	167.9	0	0	0	109.4	H239 Y248 K272 W274 K275	H239-I270 VanDerWaalsContact CE1-CD1 3.47Å; H239-I270 WeakPolarHBondContact CE1-CD1 3.18Å; Y248-I270 HydrophobicContact CD2-CD1 3.51Å; Y248-I270 HydrophobicContact CE2-CD1 4.37Å; Y248-I270 HydrophobicContact CG-CD1 3.69Å; I270-K272 PolarHBondContact O-N 3.21Å; I270-W274 HydrophobicContact CG2-CB 3.74Å; I270-K275 HydrophobicContact CB-CG 4.07Å; I270-K275 HydrophobicContact CG2-CG 3.85Å
271	P	85.3	Confident	78.1	Confident	20 Å²	20	76.4 Å²	76.4	13%	0.13	38%	0.384	C	S	.	.			trans	-54.7	138.4	172	-25.2	34.5	0	0	0	111	G269 Q273 W274	G269-P271 WeakPolarHBondContact O-CD 3.41Å; P271-Q273 PolarHBondContact O-N 2.04Å; P271-W274 HydrophobicContact CB-CD2 4.3Å; P271-W274 HydrophobicContact CB-CG 4.34Å; P271-W274 HydrophobicContact CG-CD2 3.98Å; P271-W274 HydrophobicContact CG-CE3 3.9Å; P271-W274 HydrophobicContact CG-CG 4.49Å; P271-W274 HydrophobicContact CG-CZ3 4.24Å; P271-W274 PolarHBondContact O-N 3.44Å
272	K	85.2	Confident	79.8	Confident	191 Å²	191	72.5 Å²	72.5	83%	0.83	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-51.3	-38.5	-172.7	-68.9	-173.2	177.4	-174.9	0	113.2	I270 W274 K275	I270-K272 PolarHBondContact O-N 3.21Å; K272-W274 VanDerWaalsContact C-N 3.26Å; K272-W274 PolarHBondContact O-N 2.9Å; K272-K275 PolarHBondContact O-N 3.1Å
273	Q	86.6	Confident	81.2	Confident	143 Å²	143	79.6 Å²	79.6	67%	0.668	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-69.3	-12.8	178.1	66.3	-84	15.7	0	0	115.3	P271	P271-Q273 PolarHBondContact O-N 2.04Å
274	W	89.3	Confident	82.4	Confident	23 Å²	23	80 Å²	80	9%	0.087	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-100.6	-9	176.9	-62.1	-4.4	0	0	0	113	V19 Y232 M234 V252 I270 P271 K272 R276	V19-W274 HydrophobicContact CB-CH2 4.44Å; V19-W274 HydrophobicContact CB-CZ2 3.92Å; V19-W274 HydrophobicContact CG1-CZ2 4.04Å; V19-W274 HydrophobicContact CG2-CZ2 3.87Å; Y232-W274 AromaticContact CD2-CH2 3.82Å; Y232-W274 HydrophobicContact CD2-CH2 3.82Å; Y232-W274 HydrophobicContact CD2-CZ3 4.2Å; Y232-W274 AromaticContact CE2-CH2 3.55Å; Y232-W274 HydrophobicContact CE2-CH2 3.55Å; Y232-W274 HydrophobicContact CE2-CZ2 4.28Å; Y232-W274 HydrophobicContact CE2-CZ3 4.12Å; M234-W274 HydrophobicContact CB-CD2 4.36Å; M234-W274 HydrophobicContact CB-CE3 4.01Å; M234-W274 HydrophobicContact CB-CH2 3.8Å; M234-W274 HydrophobicContact CB-CZ2 4.16Å; M234-W274 HydrophobicContact CB-CZ3 3.71Å; M234-W274 HydrophobicContact CG-CD2 4.13Å; M234-W274 HydrophobicContact CG-CE3 3.9Å; M234-W274 HydrophobicContact CG-CZ3 4.13Å; M234-W274 HydrophobicContact SD-CD2 4.06Å; M234-W274 HydrophobicContact SD-CE3 4.44Å; M234-W274 HydrophobicContact SD-CG 4.13Å; V252-W274 HydrophobicContact CG2-CE3 4.25Å; V252-W274 HydrophobicContact CG2-CZ3 4Å; I270-W274 HydrophobicContact CG2-CB 3.74Å; P271-W274 HydrophobicContact CB-CD2 4.3Å; P271-W274 HydrophobicContact CB-CG 4.34Å; P271-W274 HydrophobicContact CG-CD2 3.98Å; P271-W274 HydrophobicContact CG-CE3 3.9Å; P271-W274 HydrophobicContact CG-CG 4.49Å; P271-W274 HydrophobicContact CG-CZ3 4.24Å; P271-W274 PolarHBondContact O-N 3.44Å; K272-W274 VanDerWaalsContact C-N 3.26Å; K272-W274 PolarHBondContact O-N 2.9Å; W274-R276 VanDerWaalsContact C-N 3.33Å; W274-R276 PolarHBondContact O-N 3.1Å
275	K	89.4	Confident	83.6	Confident	75 Å²	75	84.6 Å²	84.6	33%	0.326	41%	0.414	S	S	.	.			trans	-68.2	84.6	178.4	-70.3	-162	173.4	-160.3	0	111.5	D244 Y248 I270 K272	D244-K275 IonicContact OD1-NZ 3.96Å; D244-K275 IonicContact OD2-NZ 2.97Å; D244-K275 PolarHBondContact OD2-NZ 2.88Å; Y248-K275 HydrophobicContact CD1-CB 4.06Å; Y248-K275 HydrophobicContact CD1-CG 4.46Å; Y248-K275 HydrophobicContact CE1-CB 3.66Å; Y248-K275 HydrophobicContact CE1-CD 4.34Å; Y248-K275 HydrophobicContact CE1-CG 4.15Å; Y248-K275 HydrophobicContact CE2-CD 4.32Å; I270-K275 HydrophobicContact CB-CG 4.07Å; I270-K275 HydrophobicContact CG2-CG 3.85Å; K272-K275 PolarHBondContact O-N 3.1Å
276	R	93.2	Very high	84.9	Confident	154 Å²	154	84.7 Å²	84.7	58%	0.581	40%	0.403	S	S	*	.			trans	-113.5	123.8	173.8	-72.9	172.7	165.7	-165.1	-5.4	109.3	Y248 K249 Y250 W274	Y248-R276 WeakPolarHBondContact CA-O 3.29Å; K249-R276 HydrophobicContact CB-CB 4.46Å; K249-R276 WeakPolarHBondContact CB-O 3.08Å; K249-R276 PolarHBondContact N-O 3.3Å; Y250-R276 HydrophobicContact CD2-CB 4.25Å; Y250-R276 HydrophobicContact CE2-CB 4.22Å; Y250-R276 HydrophobicContact CE2-CG 4.49Å; W274-R276 VanDerWaalsContact C-N 3.33Å; W274-R276 PolarHBondContact O-N 3.1Å
277	Q	93.1	Very high	85.9	Confident	138 Å²	138	85.2 Å²	85.2	65%	0.645	41%	0.413	S	S	*	.	B	Isolated β-bridge	trans	-71.1	152.5	-176.4	-69.5	-179.9	79.7	0	0	112	W247 Y248	W247-Q277 CarbonylContact O-C 3.52Å; W247-Q277 WeakPolarHBondContact O-CA 3.03Å; Y248-Q277 HydrophobicContact CD1-CG 4.36Å; Y248-Q277 HydrophobicContact CE1-CG 3.98Å
278	C	92.6	Very high	86.8	Confident	34 Å²	34	93.2 Å²	93.2	23%	0.23	44%	0.444	C	S	.	.			trans	-132.9	168.9	170.9	52.2	0	0	0	0	110.2	C238 W247 Y248 K249	C238-C278 VanDerWaalsContact CA-SG 3.55Å; C238-C278 HydrophobicContact CB-CB 3.95Å; C238-C278 WeakPolarHBondContact CB-SG 3.07Å; C238-C278 WeakPolarHBondContact SG-CB 3.17Å; C238-C278 CovalentContact SG-SG 2.04Å; C238-C278 PolarHBondContact SG-SG 3.08Å; W247-C278 WeakPolarHBondContact CB-O 3.07Å; W247-C278 PolarHBondContact O-N 2.89Å; Y248-C278 PolarHBondContact O-SG 3.44Å; K249-C278 HydrophobicContact CB-CB 4.07Å; K249-C278 PolarHBondContact N-SG 2.53Å; K249-C278 VanDerWaalsContact N-SG 3.41Å
279	E	89.7	Confident	87.8	Confident	171 Å²	171	93.6 Å²	93.6	80%	0.799	44%	0.44	S	S	*	.			trans	-78.9	158.1	175.7	-65.1	-177.6	178.7	0	0	111.9	C238 T281	C238-E279 PolarHBondContact SG-O 3.06Å; E279-T281 PolarHBondContact O-N 2.81Å; E279-T281 VanDerWaalsContact O-N 3.11Å
280	K	86.3	Confident	88.5	Confident	153 Å²	153	95 Å²	95	67%	0.665	45%	0.446	S	S	*	.			trans	-64.9	110.7	177.7	178.2	-176.9	174.3	-175.1	0	110.6	W247 C282	W247-K280 HydrophobicContact CZ2-CB 4.49Å; W247-K280 HydrophobicContact CZ2-CG 3.89Å; K280-C282 VanDerWaalsContact CE-O 3.22Å; K280-C282 WeakPolarHBondContact CE-O 3Å
281	T	83.1	Confident	88.5	Confident	62 Å²	62	98.7 Å²	98.7	38%	0.38	48%	0.479	S	S	.	.			trans	-86.1	-15.8	-178.1	43.3	0	0	0	0	114.9	C238 E279 C326	C238-T281 HydrophobicContact CB-CG2 3.92Å; E279-T281 PolarHBondContact O-N 2.81Å; E279-T281 VanDerWaalsContact O-N 3.11Å; T281-C326 PolarHBondContact OG1-SG 3.05Å; T281-C326 VanDerWaalsContact OG1-SG 3.32Å
282	C	86.6	Confident	88	Confident	6 Å²	6	100.4 Å²	100.4	4%	0.041	49%	0.485	C	S	.	.			trans	-109.3	126.3	-161	-31.6	0	0	0	0	113.1	W247 K280 W286 A309 C326	W247-C282 HydrophobicContact CH2-CB 4.27Å; W247-C282 WeakPolarHBondContact CH2-SG 3.4Å; W247-C282 WeakPolarHBondContact CZ3-SG 3.07Å; K280-C282 VanDerWaalsContact CE-O 3.22Å; K280-C282 WeakPolarHBondContact CE-O 3Å; C282-W286 HydrophobicContact CB-CZ2 4.47Å; C282-A309 HydrophobicContact CB-CB 4.43Å; C282-C326 HydrophobicContact CB-CB 3.86Å; C282-C326 WeakPolarHBondContact CB-SG 3.48Å; C282-C326 WeakPolarHBondContact SG-CB 3.39Å; C282-C326 CovalentContact SG-SG 2Å; C282-C326 PolarHBondContact SG-SG 3.17Å
283	R	87.2	Confident	87.1	Confident	205 Å²	205	93.5 Å²	93.5	77%	0.774	46%	0.46	S	S	*	.			trans	-117.6	-16.4	179.6	-56	179.5	-177.7	-174.1	0.3	113	A311	R283-A311 WeakPolarHBondContact CB-O 3.13Å; R283-A311 PolarHBondContact N-O 3.34Å
284	G	85.6	Confident	85.8	Confident	14 Å²	14	92.3 Å²	92.3	14%	0.144	47%	0.467	C	S	.	.	S	Bend	trans	-79.5	169.9	174.4	0	0	0	0	0	113.7	P310 E312	G284-P310 PolarHBondContact N-O 3.49Å; G284-E312 PolarHBondContact N-O 3.25Å
285	N	90.1	Very high	84.4	Confident	151 Å²	151	94.8 Å²	94.8	81%	0.807	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-73.5	142.5	177.9	-72.2	-28.2	0	0	0	112	P310	N285-P310 WeakPolarHBondContact O-CD 3.34Å
286	W	91	Very high	82.7	Confident	89 Å²	89	98 Å²	98	34%	0.337	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-74.4	132.5	174	-69.3	101.7	0	0	0	111.9	W247 C282 R307 A309 C326 A328	W247-W286 HydrophobicContact CH2-CH2 4.05Å; W247-W286 AromaticContact CH2-CZ2 3.88Å; W247-W286 HydrophobicContact CH2-CZ2 3.88Å; W247-W286 HydrophobicContact CZ2-CZ2 4.34Å; C282-W286 HydrophobicContact CB-CZ2 4.47Å; W286-R307 HydrophobicContact CD2-CG 4.46Å; W286-R307 HydrophobicContact CE3-CG 3.74Å; W286-R307 HydrophobicContact CZ3-CG 4.25Å; W286-A309 HydrophobicContact CD2-CB 3.51Å; W286-A309 HydrophobicContact CE3-CB 3.39Å; W286-A309 HydrophobicContact CG-CB 4.06Å; W286-A309 HydrophobicContact CH2-CB 4.08Å; W286-A309 HydrophobicContact CZ2-CB 4.2Å; W286-A309 HydrophobicContact CZ3-CB 3.68Å; W286-C326 HydrophobicContact CH2-CB 4.04Å; W286-C326 HydrophobicContact CZ3-CB 4.39Å; W286-A328 HydrophobicContact CE3-CB 4.22Å; W286-A328 HydrophobicContact CH2-CB 3.65Å; W286-A328 HydrophobicContact CZ2-CB 4.26Å; W286-A328 HydrophobicContact CZ3-CB 3.63Å
287	G	90.8	Very high	80.7	Confident	39 Å²	39	93.3 Å²	93.3	40%	0.402	48%	0.48	S	S	.	.			trans	-70.5	176.9	167.9	0	0	0	0	0	113.1	F308	G287-F308 PolarHBondContact N-O 2.81Å
288	K	92.7	Very high	78.9	Confident	204 Å²	204	90.2 Å²	90.2	89%	0.887	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-63.1	148.9	173.1	-65.3	-177.8	-179.6	179.3	0	110.5
289	W	89.9	Confident	77.3	Confident	61 Å²	61	92 Å²	92	23%	0.231	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-61.9	147.1	166.4	-72.1	107.5	0	0	0	111.4	E242 R305 E306 R307 A328 K330	E242-W289 WeakPolarHBondContact OE1-CZ2 3Å; E242-W289 WeakPolarHBondContact OE2-CZ2 3.25Å; W289-R305 HydrophobicContact CE3-CB 3.76Å; W289-R305 HydrophobicContact CZ3-CB 4.2Å; W289-R305 WeakPolarHBondContact CZ3-O 3.44Å; W289-E306 CarbonylContact C-O 3.56Å; W289-R307 HydrophobicContact CD2-CB 3.98Å; W289-R307 HydrophobicContact CD2-CG 3.95Å; W289-R307 HydrophobicContact CE3-CB 3.82Å; W289-R307 HydrophobicContact CE3-CG 3.82Å; W289-R307 HydrophobicContact CG-CB 4.42Å; W289-R307 HydrophobicContact CH2-CG 3.89Å; W289-R307 HydrophobicContact CZ2-CG 4.02Å; W289-R307 HydrophobicContact CZ3-CB 4.23Å; W289-R307 HydrophobicContact CZ3-CG 3.78Å; W289-A328 HydrophobicContact CH2-CB 4.27Å; W289-A328 WeakPolarHBondContact CZ3-O 3.5Å; W289-K330 HydrophobicContact CH2-CB 3.76Å; W289-K330 HydrophobicContact CZ2-CB 4.39Å; W289-K330 HydrophobicContact CZ3-CB 3.95Å
290	S	88.2	Confident	75.9	Confident	49 Å²	49	85 Å²	85	34%	0.343	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-50.5	149.3	163.7	64.9	0	0	0	0	110.6	E292 R305 E306	S290-E292 PolarHBondContact O-N 3.01Å; S290-R305 PolarHBondContact O-NE 2.73Å; S290-R305 VanDerWaalsContact O-NE 3.1Å; S290-R305 PolarHBondContact O-NH2 2.84Å; S290-R305 WeakPolarHBondContact OG-CA 3.18Å; S290-E306 PolarHBondContact N-O 3.4Å; S290-E306 PolarHBondContact OG-N 3.33Å
291	A	82.4	Confident	74.5	Confident	90 Å²	90	82.1 Å²	82.1	74%	0.744	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-56.4	139.5	173.1	0	0	0	0	0	109.6
292	E	74.5	Confident	73.7	Confident	57 Å²	57	80.2 Å²	80.2	27%	0.266	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-69	151.8	159.4	-74.6	177.5	-164.5	0	0	108.3	S290 S294 R299 R305	S290-E292 PolarHBondContact O-N 3.01Å; E292-S294 PolarHBondContact O-N 2.88Å; E292-S294 VanDerWaalsContact O-N 3.11Å; E292-R299 IonicContact OE2-NH2 2.94Å; E292-R305 VanDerWaalsContact CG-CD 3.5Å; E292-R305 HydrophobicContact CG-CG 4.15Å; E292-R305 WeakPolarHBondContact OE1-CD 3.17Å; E292-R305 IonicContact OE1-CZ 2.74Å; E292-R305 IonicContact OE1-NE 3.59Å; E292-R305 IonicContact OE1-NH1 3.85Å; E292-R305 PolarHBondContact OE1-NH1 2.03Å
293	P	66.9	Low	72.9	Confident	46 Å²	46	80.5 Å²	80.5	30%	0.299	42%	0.42	S	S	.	.			trans	-45	121.8	158.5	-25.2	33.7	0	0	0	109.2	E295 L298 I303	P293-E295 PolarHBondContact O-N 2.81Å; P293-E295 VanDerWaalsContact O-N 3.08Å; P293-L298 HydrophobicContact CB-CB 3.62Å; P293-L298 HydrophobicContact CB-CD1 3.67Å; P293-L298 HydrophobicContact CB-CG 4.26Å; P293-L298 HydrophobicContact CG-CB 4.34Å; P293-I303 HydrophobicContact CG-CD1 4.01Å; P293-I303 HydrophobicContact CG-CG1 4.45Å; P293-I303 HydrophobicContact CG-CG2 4.44Å
294	S	59.4	Low	72.3	Confident	117 Å²	117	73 Å²	73	82%	0.818	40%	0.398	S	S	*	.	S	Bend	trans	-64	-16.8	-173.4	46.7	0	0	0	0	113.2	E292	E292-S294 PolarHBondContact O-N 2.88Å; E292-S294 VanDerWaalsContact O-N 3.11Å
295	E	59.5	Low	72.2	Confident	76 Å²	76	74.9 Å²	74.9	36%	0.355	40%	0.4	S	S	.	.	S	Bend	trans	-105.6	124.6	-170.6	-48.9	-171.5	106.1	0	0	111	P293 H297 L298	P293-E295 PolarHBondContact O-N 2.81Å; P293-E295 VanDerWaalsContact O-N 3.08Å; E295-H297 WeakPolarHBondContact CB-NE2 3.33Å; E295-H297 VanDerWaalsContact CG-NE2 3.27Å; E295-H297 WeakPolarHBondContact CG-NE2 3.39Å; E295-H297 PolarHBondContact O-N 2.83Å; E295-H297 IonicContact OE1-CE1 3.79Å; E295-H297 PolarHBondContact OE1-CE1 2.83Å; E295-H297 IonicContact OE1-NE2 3.03Å; E295-H297 PolarHBondContact OE1-NE2 3.24Å; E295-H297 IonicContact OE2-CD2 3.69Å; E295-H297 IonicContact OE2-CE1 2.74Å; E295-H297 IonicContact OE2-NE2 3.87Å; E295-H297 PolarHBondContact OE2-NE2 3.31Å; E295-L298 HydrophobicContact CB-CD1 4.17Å; E295-L298 HydrophobicContact CB-CG 4.42Å; E295-L298 HydrophobicContact CG-CD1 4.44Å; E295-L298 PolarHBondContact O-N 2.97Å
296	E	53.7	Low	72.2	Confident	142 Å²	142	70.8 Å²	70.8	66%	0.664	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-54.7	-26.8	-179.8	-176.3	175.6	-161.1	0	0	112.9	R299	E296-R299 WeakPolarHBondContact O-CB 3.44Å; E296-R299 VanDerWaalsContact O-CG 3.27Å; E296-R299 WeakPolarHBondContact O-CG 3.3Å; E296-R299 PolarHBondContact O-N 3.49Å
297	H	51.3	Low	72.3	Confident	56 Å²	56	68.7 Å²	68.7	26%	0.259	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-78	-17.9	179.5	56.4	-124.7	0	0	0	115.4	E295 R299 C300 F341 T346	E295-H297 WeakPolarHBondContact CB-NE2 3.33Å; E295-H297 VanDerWaalsContact CG-NE2 3.27Å; E295-H297 WeakPolarHBondContact CG-NE2 3.39Å; E295-H297 PolarHBondContact O-N 2.83Å; E295-H297 IonicContact OE1-CE1 3.79Å; E295-H297 PolarHBondContact OE1-CE1 2.83Å; E295-H297 IonicContact OE1-NE2 3.03Å; E295-H297 PolarHBondContact OE1-NE2 3.24Å; E295-H297 IonicContact OE2-CD2 3.69Å; E295-H297 IonicContact OE2-CE1 2.74Å; E295-H297 IonicContact OE2-NE2 3.87Å; E295-H297 PolarHBondContact OE2-NE2 3.31Å; H297-R299 PolarHBondContact O-N 2.84Å; H297-C300 PolarHBondContact O-SG 3.18Å; H297-F341 HydrophobicContact CB-CD1 3.85Å; H297-F341 HydrophobicContact CB-CE1 3.1Å; H297-F341 HydrophobicContact CB-CZ 3.72Å; H297-T346 VanDerWaalsContact CB-O 3.24Å; H297-T346 WeakPolarHBondContact CB-O 3.32Å; H297-T346 VanDerWaalsContact CD2-CA 3.5Å; H297-T346 WeakPolarHBondContact CD2-CA 3.41Å; H297-T346 WeakPolarHBondContact CD2-CB 3.22Å; H297-T346 WeakPolarHBondContact CD2-CG2 3.43Å; H297-T346 WeakPolarHBondContact NE2-CB 3.47Å; H297-T346 WeakPolarHBondContact NE2-CG2 3.5Å
298	L	55	Low	72.4	Confident	72 Å²	72	68.3 Å²	68.3	38%	0.377	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-75.9	-6.4	170.2	-71.9	166.6	0	0	0	111.8	P293 E295 C300 T346	P293-L298 HydrophobicContact CB-CB 3.62Å; P293-L298 HydrophobicContact CB-CD1 3.67Å; P293-L298 HydrophobicContact CB-CG 4.26Å; P293-L298 HydrophobicContact CG-CB 4.34Å; E295-L298 HydrophobicContact CB-CD1 4.17Å; E295-L298 HydrophobicContact CB-CG 4.42Å; E295-L298 HydrophobicContact CG-CD1 4.44Å; E295-L298 PolarHBondContact O-N 2.97Å; L298-C300 PolarHBondContact O-N 3.43Å; L298-C300 VanDerWaalsContact O-N 3.15Å; L298-T346 HydrophobicContact CD2-CG2 3.66Å; L298-T346 HydrophobicContact CG-CG2 4.06Å
299	R	60.5	Low	72.4	Confident	72 Å²	72	58.6 Å²	58.6	27%	0.272	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-79.6	23.4	173.1	-51.3	175.5	173.6	165.2	-6.2	113	E292 E296 H297 D301 I303 Y334	E292-R299 IonicContact OE2-NH2 2.94Å; E296-R299 WeakPolarHBondContact O-CB 3.44Å; E296-R299 VanDerWaalsContact O-CG 3.27Å; E296-R299 WeakPolarHBondContact O-CG 3.3Å; E296-R299 PolarHBondContact O-N 3.49Å; H297-R299 PolarHBondContact O-N 2.84Å; R299-D301 VanDerWaalsContact C-N 3.33Å; R299-I303 HydrophobicContact CB-CD1 4.24Å; R299-I303 HydrophobicContact CG-CD1 3.72Å; R299-Y334 HydrophobicContact CB-CD1 4.2Å; R299-Y334 HydrophobicContact CB-CD2 3.86Å; R299-Y334 HydrophobicContact CB-CE2 4.27Å; R299-Y334 HydrophobicContact CB-CG 3.81Å; R299-Y334 HydrophobicContact CG-CD2 4.3Å; R299-Y334 HydrophobicContact CG-CE2 4.21Å; R299-Y334 WeakPolarHBondContact O-CB 3.06Å
300	C	59.1	Low	72.4	Confident	24 Å²	24	56.1 Å²	56.1	16%	0.162	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-82.6	-15.7	171.9	-66	0	0	0	0	113.1	H297 L298 C338 F341	H297-C300 PolarHBondContact O-SG 3.18Å; L298-C300 PolarHBondContact O-N 3.43Å; L298-C300 VanDerWaalsContact O-N 3.15Å; C300-C338 HydrophobicContact CB-CB 3.97Å; C300-C338 WeakPolarHBondContact O-CB 3.27Å; C300-C338 PolarHBondContact O-SG 2.04Å; C300-F341 VanDerWaalsContact SG-CB 3.59Å; C300-F341 WeakPolarHBondContact SG-CD2 3.01Å; C300-F341 WeakPolarHBondContact SG-CG 3.44Å
301	D	57.9	Low	72.4	Confident	93 Å²	93	54.8 Å²	54.8	50%	0.497	30%	0.297	S	S	.	.	S	Bend	trans	-120.9	-177.9	-178.8	-161	-0.6	0	0	0	110.6	R299 I303	R299-D301 VanDerWaalsContact C-N 3.33Å; D301-I303 PolarHBondContact O-N 2.95Å
302	T	65.5	Low	72.6	Confident	21 Å²	21	57.2 Å²	57.2	13%	0.129	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	98.6	-177.8	-43.2	0	0	0	0	109.8	T268 T304 V331 K333	T268-T302 HydrophobicContact CG2-CG2 4.45Å; T302-T304 PolarHBondContact O-N 3.08Å; T302-V331 HydrophobicContact CG2-CG1 3.26Å; T302-K333 HydrophobicContact CG2-CB 4.23Å; T302-K333 HydrophobicContact CG2-CG 4.41Å
303	I	70.7	Confident	73.2	Confident	12 Å²	12	59.2 Å²	59.2	6%	0.062	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	119	-178.2	-64	-176.5	0	0	0	109.8	P293 R299 D301 R305 T332 Y334	P293-I303 HydrophobicContact CG-CD1 4.01Å; P293-I303 HydrophobicContact CG-CG1 4.45Å; P293-I303 HydrophobicContact CG-CG2 4.44Å; R299-I303 HydrophobicContact CB-CD1 4.24Å; R299-I303 HydrophobicContact CG-CD1 3.72Å; D301-I303 PolarHBondContact O-N 2.95Å; I303-R305 HydrophobicContact CG2-CG 4.24Å; I303-T332 PolarHBondContact N-O 3.4Å; I303-T332 PolarHBondContact O-N 3.47Å; I303-Y334 HydrophobicContact CB-CE2 4.23Å; I303-Y334 HydrophobicContact CD1-CD2 4.12Å; I303-Y334 HydrophobicContact CD1-CE2 3.78Å; I303-Y334 HydrophobicContact CG1-CD2 4.23Å; I303-Y334 HydrophobicContact CG1-CE2 4.15Å
304	T	73	Confident	74	Confident	48 Å²	48	60.9 Å²	60.9	29%	0.294	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	125.3	167.5	-76.2	0	0	0	0	109.6	T302 E306 K329 K330	T302-T304 PolarHBondContact O-N 3.08Å; T304-E306 HydrophobicContact CG2-CG 3.9Å; T304-K329 HydrophobicContact CG2-CD 4.3Å; T304-K329 HydrophobicContact CG2-CG 4.11Å; T304-K329 WeakPolarHBondContact OG1-CE 2.98Å; T304-K329 PolarHBondContact OG1-NZ 2.81Å; T304-K330 CarbonylContact C-O 3.5Å; T304-K330 WeakPolarHBondContact CA-O 3.5Å
305	R	84.9	Confident	75.4	Confident	54 Å²	54	57.6 Å²	57.6	20%	0.204	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	147.1	162.5	-55.9	-175.2	73.3	173.3	-2	109.9	W289 S290 E292 I303 K329 K330	W289-R305 HydrophobicContact CE3-CB 3.76Å; W289-R305 HydrophobicContact CZ3-CB 4.2Å; W289-R305 WeakPolarHBondContact CZ3-O 3.44Å; S290-R305 PolarHBondContact O-NE 2.73Å; S290-R305 VanDerWaalsContact O-NE 3.1Å; S290-R305 PolarHBondContact O-NH2 2.84Å; S290-R305 WeakPolarHBondContact OG-CA 3.18Å; E292-R305 VanDerWaalsContact CG-CD 3.5Å; E292-R305 HydrophobicContact CG-CG 4.15Å; E292-R305 WeakPolarHBondContact OE1-CD 3.17Å; E292-R305 IonicContact OE1-CZ 2.74Å; E292-R305 IonicContact OE1-NE 3.59Å; E292-R305 IonicContact OE1-NH1 3.85Å; E292-R305 PolarHBondContact OE1-NH1 2.03Å; I303-R305 HydrophobicContact CG2-CG 4.24Å; R305-K329 WeakPolarHBondContact O-CA 3.08Å; R305-K330 HydrophobicContact CB-CB 4.41Å; R305-K330 PolarHBondContact N-O 2.99Å; R305-K330 PolarHBondContact O-N 3.2Å
306	E	89.1	Confident	76.7	Confident	64 Å²	64	57.8 Å²	57.8	30%	0.299	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	144.9	180	-62.7	-174.7	171.4	0	0	110.9	W289 S290 T304 F308 M327 A328 K329	W289-E306 CarbonylContact C-O 3.56Å; S290-E306 PolarHBondContact N-O 3.4Å; S290-E306 PolarHBondContact OG-N 3.33Å; T304-E306 HydrophobicContact CG2-CG 3.9Å; E306-F308 HydrophobicContact CB-CE2 4.48Å; E306-F308 HydrophobicContact CB-CZ 4.15Å; E306-M327 HydrophobicContact CG-SD 4.45Å; E306-A328 WeakPolarHBondContact CA-O 3.11Å; E306-K329 HydrophobicContact CG-CG 4.46Å
307	R	92.5	Very high	78.2	Confident	45 Å²	45	57.1 Å²	57.1	17%	0.17	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	158.5	167.7	64.1	174.7	179.1	-147.9	-20.1	109.5	E242 W286 W289 M327 A328	E242-R307 IonicContact OE1-CZ 3.37Å; E242-R307 IonicContact OE1-NH1 3.44Å; E242-R307 IonicContact OE1-NH2 2.67Å; E242-R307 PolarHBondContact OE1-NH2 3.36Å; W286-R307 HydrophobicContact CD2-CG 4.46Å; W286-R307 HydrophobicContact CE3-CG 3.74Å; W286-R307 HydrophobicContact CZ3-CG 4.25Å; W289-R307 HydrophobicContact CD2-CB 3.98Å; W289-R307 HydrophobicContact CD2-CG 3.95Å; W289-R307 HydrophobicContact CE3-CB 3.82Å; W289-R307 HydrophobicContact CE3-CG 3.82Å; W289-R307 HydrophobicContact CG-CB 4.42Å; W289-R307 HydrophobicContact CH2-CG 3.89Å; W289-R307 HydrophobicContact CZ2-CG 4.02Å; W289-R307 HydrophobicContact CZ3-CB 4.23Å; W289-R307 HydrophobicContact CZ3-CG 3.78Å; R307-M327 CarbonylContact O-C 3.59Å; R307-M327 WeakPolarHBondContact O-CA 3.46Å; R307-A328 HydrophobicContact CG-CB 3.83Å; R307-A328 PolarHBondContact N-O 3.4Å; R307-A328 PolarHBondContact O-N 2.98Å
308	F	93.2	Very high	79.9	Confident	32 Å²	32	55.7 Å²	55.7	14%	0.14	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	150.6	-175.1	-53.5	-80.5	0	0	0	112.2	G287 E306 C318 N319 K320 S321 C326 M327	G287-F308 PolarHBondContact N-O 2.81Å; E306-F308 HydrophobicContact CB-CE2 4.48Å; E306-F308 HydrophobicContact CB-CZ 4.15Å; F308-C318 HydrophobicContact CB-CB 4.48Å; F308-N319 WeakPolarHBondContact CE2-O 3.22Å; F308-K320 VanDerWaalsContact CD1-C 3.45Å; F308-K320 VanDerWaalsContact CE1-C 3.49Å; F308-S321 VanDerWaalsContact CE1-N 3.26Å; F308-C326 CarbonylContact C-O 3.54Å; F308-C326 WeakPolarHBondContact CA-O 2.99Å; F308-C326 WeakPolarHBondContact CB-O 2.96Å; F308-M327 HydrophobicContact CD1-CB 4.04Å; F308-M327 HydrophobicContact CD1-CG 4.25Å; F308-M327 HydrophobicContact CE1-CB 3.95Å; F308-M327 HydrophobicContact CE1-CG 3.78Å
309	A	92.6	Very high	81.4	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	143.1	174.2	0	0	0	0	0	110.7	C282 W286 C318 C326	C282-A309 HydrophobicContact CB-CB 4.43Å; W286-A309 HydrophobicContact CD2-CB 3.51Å; W286-A309 HydrophobicContact CE3-CB 3.39Å; W286-A309 HydrophobicContact CG-CB 4.06Å; W286-A309 HydrophobicContact CH2-CB 4.08Å; W286-A309 HydrophobicContact CZ2-CB 4.2Å; W286-A309 HydrophobicContact CZ3-CB 3.68Å; A309-C318 PolarHBondContact N-SG 2.97Å; A309-C318 PolarHBondContact O-SG 2.7Å; A309-C326 HydrophobicContact CB-CB 4.49Å; A309-C326 PolarHBondContact N-O 3.49Å; A309-C326 WeakPolarHBondContact O-CB 3.27Å; A309-C326 PolarHBondContact O-N 3.4Å
310	P	91.1	Very high	82.5	Confident	8 Å²	8	62.2 Å²	62.2	5%	0.052	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	142.8	172	-17.9	30.6	0	0	0	111.4	G284 N285 E312 A315 A316	G284-P310 PolarHBondContact N-O 3.49Å; N285-P310 WeakPolarHBondContact O-CD 3.34Å; P310-E312 VanDerWaalsContact C-N 3.32Å; P310-A315 HydrophobicContact CB-CB 3.81Å; P310-A316 WeakPolarHBondContact CG-O 3.38Å
311	A	87.7	Confident	83.4	Confident	21 Å²	21	63.8 Å²	63.8	17%	0.174	38%	0.382	C	S	.	.	S	Bend	trans	-62.1	-42	175.5	0	0	0	0	0	111.2	R283 T324	R283-A311 WeakPolarHBondContact CB-O 3.13Å; R283-A311 PolarHBondContact N-O 3.34Å; A311-T324 WeakPolarHBondContact CB-O 3.41Å; A311-T324 PolarHBondContact N-O 2.85Å
312	E	87.4	Confident	84.4	Confident	142 Å²	142	60.6 Å²	60.6	66%	0.664	37%	0.371	S	S	*	.	S	Bend	trans	-98.7	155.8	-179.1	-64.1	-177.1	175.6	0	0	113	G284 P310 A315	G284-E312 PolarHBondContact N-O 3.25Å; P310-E312 VanDerWaalsContact C-N 3.32Å; E312-A315 HydrophobicContact CB-CB 4.26Å
313	S	86.6	Confident	85	Confident	99 Å²	99	67.8 Å²	67.8	69%	0.692	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	133.5	173.7	-172.1	0	0	0	0	109.8	A315	S313-A315 VanDerWaalsContact C-N 3.3Å; S313-A315 PolarHBondContact O-N 3.15Å
314	G	84.1	Confident	85.7	Confident	81 Å²	81	72 Å²	72	84%	0.835	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	-6.1	-178.4	0	0	0	0	0	115.7
315	A	87.5	Confident	86.4	Confident	47 Å²	47	70.8 Å²	70.8	39%	0.388	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-70.1	155.4	174.5	0	0	0	0	0	112.6	P310 E312 S313	P310-A315 HydrophobicContact CB-CB 3.81Å; E312-A315 HydrophobicContact CB-CB 4.26Å; S313-A315 VanDerWaalsContact C-N 3.3Å; S313-A315 PolarHBondContact O-N 3.15Å
316	A	87	Confident	86.6	Confident	80 Å²	80	68.3 Å²	68.3	66%	0.661	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-60.4	145.5	-175.7	0	0	0	0	0	113	P310	P310-A316 WeakPolarHBondContact CG-O 3.38Å
317	P	86.6	Confident	86.7	Confident	129 Å²	129	65.8 Å²	65.8	84%	0.838	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-56.5	146.7	177	-24.5	34.1	0	0	0	112.9
318	C	86.1	Confident	86.6	Confident	25 Å²	25	63.6 Å²	63.6	17%	0.169	40%	0.399	C	S	.	.			trans	-122.1	154	-177.4	52.4	0	0	0	0	112.6	F308 A309 C325	F308-C318 HydrophobicContact CB-CB 4.48Å; A309-C318 PolarHBondContact N-SG 2.97Å; A309-C318 PolarHBondContact O-SG 2.7Å; C318-C325 HydrophobicContact CB-CB 3.63Å; C318-C325 WeakPolarHBondContact CB-SG 3.04Å
319	N	86.6	Confident	86.3	Confident	135 Å²	135	63.3 Å²	63.3	72%	0.722	40%	0.397	S	S	*	.	S	Bend	trans	-130.2	8.9	-175.6	64.7	-8.1	0	0	0	113.5	F308	F308-N319 WeakPolarHBondContact CE2-O 3.22Å
320	K	83.9	Confident	85.9	Confident	147 Å²	147	66.5 Å²	66.5	64%	0.639	41%	0.411	S	S	*	.	S	Bend	trans	-155.1	153.8	179.1	63.9	-175.9	179.6	-177.5	0	110.2	F308 C325	F308-K320 VanDerWaalsContact CD1-C 3.45Å; F308-K320 VanDerWaalsContact CE1-C 3.49Å; K320-C325 WeakPolarHBondContact O-CB 3.3Å
321	S	77.9	Confident	85.4	Confident	56 Å²	56	67.4 Å²	67.4	39%	0.392	42%	0.417	S	S	.	.			trans	-68.6	140.9	174	57.9	0	0	0	0	112	F308	F308-S321 VanDerWaalsContact CE1-N 3.26Å
322	G	78.7	Confident	84.8	Confident	26 Å²	26	68.1 Å²	68.1	27%	0.268	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-176.3	177.5	176.4	0	0	0	0	0	112.5	H237 T324 C325	H237-G322 PolarHBondContact CE1-O 2.74Å; H237-G322 PolarHBondContact ND1-O 3.48Å; G322-T324 PolarHBondContact O-N 3.49Å; G322-T324 VanDerWaalsContact O-N 3.15Å; G322-C325 PolarHBondContact N-O 3.23Å; G322-C325 CarbonylContact O-C 3.52Å; G322-C325 PolarHBondContact O-N 2.77Å
323	L	77.8	Confident	84	Confident	172 Å²	172	67.9 Å²	67.9	90%	0.901	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-30.8	-177.5	-68.9	171	0	0	0	113.6
324	T	84.9	Confident	83.2	Confident	102 Å²	102	66.3 Å²	66.3	63%	0.626	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-7	176.7	50.9	0	0	0	0	114	A311 G322	A311-T324 WeakPolarHBondContact CB-O 3.41Å; A311-T324 PolarHBondContact N-O 2.85Å; G322-T324 PolarHBondContact O-N 3.49Å; G322-T324 VanDerWaalsContact O-N 3.15Å
325	C	88	Confident	82.1	Confident	22 Å²	22	66.9 Å²	66.9	15%	0.149	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	102.5	-164	-56.9	0	0	0	0	110.4	H237 C318 K320 G322	H237-C325 PolarHBondContact CE1-O 3.02Å; H237-C325 PolarHBondContact NE2-O 3.22Å; C318-C325 HydrophobicContact CB-CB 3.63Å; C318-C325 WeakPolarHBondContact CB-SG 3.04Å; K320-C325 WeakPolarHBondContact O-CB 3.3Å; G322-C325 PolarHBondContact N-O 3.23Å; G322-C325 CarbonylContact O-C 3.52Å; G322-C325 PolarHBondContact O-N 2.77Å
326	C	89.2	Confident	80.8	Confident	2 Å²	2	71.9 Å²	71.9	1%	0.014	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	152.9	175.5	-63	0	0	0	0	112.9	T281 C282 W286 F308 A309	T281-C326 PolarHBondContact OG1-SG 3.05Å; T281-C326 VanDerWaalsContact OG1-SG 3.32Å; C282-C326 HydrophobicContact CB-CB 3.86Å; C282-C326 WeakPolarHBondContact CB-SG 3.48Å; C282-C326 WeakPolarHBondContact SG-CB 3.39Å; C282-C326 CovalentContact SG-SG 2Å; C282-C326 PolarHBondContact SG-SG 3.17Å; W286-C326 HydrophobicContact CH2-CB 4.04Å; W286-C326 HydrophobicContact CZ3-CB 4.39Å; F308-C326 CarbonylContact C-O 3.54Å; F308-C326 WeakPolarHBondContact CA-O 2.99Å; F308-C326 WeakPolarHBondContact CB-O 2.96Å; A309-C326 HydrophobicContact CB-CB 4.49Å; A309-C326 PolarHBondContact N-O 3.49Å; A309-C326 WeakPolarHBondContact O-CB 3.27Å; A309-C326 PolarHBondContact O-N 3.4Å
327	M	90.4	Very high	79.7	Confident	10 Å²	10	70.2 Å²	70.2	5%	0.049	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	146.4	167.4	-176.3	-141.4	-64.2	0	0	110.3	H239 F240 T251 E306 R307 F308 K329	H239-M327 VanDerWaalsContact CA-O 3.3Å; H239-M327 WeakPolarHBondContact CA-O 3.4Å; H239-M327 HydrophobicContact CB-CB 4.09Å; H239-M327 WeakPolarHBondContact CB-O 3.49Å; H239-M327 HydrophobicContact CB-SD 4.34Å; F240-M327 PolarHBondContact N-O 2.74Å; T251-M327 HydrophobicContact CG2-CE 3.81Å; T251-M327 HydrophobicContact CG2-SD 4.42Å; E306-M327 HydrophobicContact CG-SD 4.45Å; R307-M327 CarbonylContact O-C 3.59Å; R307-M327 WeakPolarHBondContact O-CA 3.46Å; F308-M327 HydrophobicContact CD1-CB 4.04Å; F308-M327 HydrophobicContact CD1-CG 4.25Å; F308-M327 HydrophobicContact CE1-CB 3.95Å; F308-M327 HydrophobicContact CE1-CG 3.78Å; M327-K329 HydrophobicContact SD-CB 4.29Å
328	A	90.9	Very high	78.8	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.9	156.4	0	0	0	0	0	109.2	F240 W286 W289 E306 R307	F240-A328 HydrophobicContact CB-CB 3.97Å; F240-A328 HydrophobicContact CD1-CB 4.18Å; F240-A328 CarbonylContact O-C 3.4Å; F240-A328 VanDerWaalsContact O-CA 3.23Å; F240-A328 WeakPolarHBondContact O-CA 3.06Å; W286-A328 HydrophobicContact CE3-CB 4.22Å; W286-A328 HydrophobicContact CH2-CB 3.65Å; W286-A328 HydrophobicContact CZ2-CB 4.26Å; W286-A328 HydrophobicContact CZ3-CB 3.63Å; W289-A328 HydrophobicContact CH2-CB 4.27Å; W289-A328 WeakPolarHBondContact CZ3-O 3.5Å; E306-A328 WeakPolarHBondContact CA-O 3.11Å; R307-A328 HydrophobicContact CG-CB 3.83Å; R307-A328 PolarHBondContact N-O 3.4Å; R307-A328 PolarHBondContact O-N 2.98Å
329	K	86.7	Confident	78.2	Confident	26 Å²	26	66.2 Å²	66.2	11%	0.113	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.8	-179	-161.3	-173.7	-169.3	-165	0	110.1	F240 E242 T268 T304 R305 E306 M327 V331	F240-K329 PolarHBondContact O-N 3.36Å; E242-K329 WeakPolarHBondContact CB-O 3.45Å; E242-K329 PolarHBondContact N-O 2.99Å; T268-K329 PolarHBondContact O-NZ 2.03Å; T304-K329 HydrophobicContact CG2-CD 4.3Å; T304-K329 HydrophobicContact CG2-CG 4.11Å; T304-K329 WeakPolarHBondContact OG1-CE 2.98Å; T304-K329 PolarHBondContact OG1-NZ 2.81Å; R305-K329 WeakPolarHBondContact O-CA 3.08Å; E306-K329 HydrophobicContact CG-CG 4.46Å; M327-K329 HydrophobicContact SD-CB 4.29Å; K329-V331 HydrophobicContact CD-CG2 3.77Å; K329-V331 HydrophobicContact CG-CG2 4.01Å
330	K	85.7	Confident	77.9	Confident	67 Å²	67	61 Å²	61	29%	0.291	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.2	169	-169.9	-170.2	-161.3	111	0	109	E242 W289 T304 R305	E242-K330 HydrophobicContact CB-CB 4.38Å; E242-K330 WeakPolarHBondContact OE2-CD 3.06Å; E242-K330 IonicContact OE2-NZ 2.58Å; E242-K330 PolarHBondContact OE2-NZ 3.03Å; W289-K330 HydrophobicContact CH2-CB 3.76Å; W289-K330 HydrophobicContact CZ2-CB 4.39Å; W289-K330 HydrophobicContact CZ3-CB 3.95Å; T304-K330 CarbonylContact C-O 3.5Å; T304-K330 WeakPolarHBondContact CA-O 3.5Å; R305-K330 HydrophobicContact CB-CB 4.41Å; R305-K330 PolarHBondContact N-O 2.99Å; R305-K330 PolarHBondContact O-N 3.2Å
331	V	78.9	Confident	77.6	Confident	27 Å²	27	54.6 Å²	54.6	16%	0.164	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	75.5	-170.1	-176	0	0	0	0	108.6	D243 T302 K329 K333	D243-V331 WeakPolarHBondContact OD2-CA 3.2Å; D243-V331 WeakPolarHBondContact OD2-CB 3.28Å; D243-V331 PolarHBondContact OD2-N 3.31Å; T302-V331 HydrophobicContact CG2-CG1 3.26Å; K329-V331 HydrophobicContact CD-CG2 3.77Å; K329-V331 HydrophobicContact CG-CG2 4.01Å; V331-K333 PolarHBondContact O-N 3.47Å; V331-K333 VanDerWaalsContact O-N 3.11Å
332	T	75.9	Confident	77.5	Confident	35 Å²	35	52.3 Å²	52.3	22%	0.215	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	105	-177.9	-49.8	0	0	0	0	110.1	I303 Y334	I303-T332 PolarHBondContact N-O 3.4Å; I303-T332 PolarHBondContact O-N 3.47Å; T332-Y334 HydrophobicContact CG2-CD2 3.99Å; T332-Y334 HydrophobicContact CG2-CE1 4.15Å; T332-Y334 HydrophobicContact CG2-CE2 3.42Å; T332-Y334 VanDerWaalsContact CG2-CE2 3.42Å; T332-Y334 PolarHBondContact O-N 3.11Å
333	K	71.8	Confident	77.1	Confident	137 Å²	137	53.4 Å²	53.4	60%	0.596	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	103.8	172.7	-161.1	-169.2	-170.4	-146	0	110.9	T302 V331 N335	T302-K333 HydrophobicContact CG2-CB 4.23Å; T302-K333 HydrophobicContact CG2-CG 4.41Å; V331-K333 PolarHBondContact O-N 3.47Å; V331-K333 VanDerWaalsContact O-N 3.11Å; K333-N335 VanDerWaalsContact CE-OD1 3.29Å; K333-N335 WeakPolarHBondContact CE-OD1 3.41Å; K333-N335 PolarHBondContact NZ-OD1 2.99Å
334	Y	68	Low	76.3	Confident	66 Å²	66	50.9 Å²	50.9	26%	0.259	28%	0.275	S	S	.	.			trans	-80.3	130.3	166.2	-63.7	-85	0	0	0	108.8	R299 I303 T332 C338	R299-Y334 HydrophobicContact CB-CD1 4.2Å; R299-Y334 HydrophobicContact CB-CD2 3.86Å; R299-Y334 HydrophobicContact CB-CE2 4.27Å; R299-Y334 HydrophobicContact CB-CG 3.81Å; R299-Y334 HydrophobicContact CG-CD2 4.3Å; R299-Y334 HydrophobicContact CG-CE2 4.21Å; R299-Y334 WeakPolarHBondContact O-CB 3.06Å; I303-Y334 HydrophobicContact CB-CE2 4.23Å; I303-Y334 HydrophobicContact CD1-CD2 4.12Å; I303-Y334 HydrophobicContact CD1-CE2 3.78Å; I303-Y334 HydrophobicContact CG1-CD2 4.23Å; I303-Y334 HydrophobicContact CG1-CE2 4.15Å; T332-Y334 HydrophobicContact CG2-CD2 3.99Å; T332-Y334 HydrophobicContact CG2-CE1 4.15Å; T332-Y334 HydrophobicContact CG2-CE2 3.42Å; T332-Y334 VanDerWaalsContact CG2-CE2 3.42Å; T332-Y334 PolarHBondContact O-N 3.11Å; Y334-C338 PolarHBondContact O-SG 3.46Å; Y334-C338 VanDerWaalsContact O-SG 3.33Å
335	N	61.8	Low	75.2	Confident	93 Å²	93	47.5 Å²	47.5	50%	0.497	25%	0.254	S	S	.	.			trans	-128.5	-19.2	-167.5	-138.4	49.3	0	0	0	112.7	K333	K333-N335 VanDerWaalsContact CE-OD1 3.29Å; K333-N335 WeakPolarHBondContact CE-OD1 3.41Å; K333-N335 PolarHBondContact NZ-OD1 2.99Å
336	D	59.7	Low	74.1	Confident	152 Å²	152	49 Å²	49	81%	0.813	26%	0.263	S	S	*	.	S	Bend	trans	-104.7	-14.9	-158.7	-54.9	-34.9	0	0	0	114.4
337	S	63.7	Low	73.2	Confident	45 Å²	45	50.2 Å²	50.2	32%	0.315	27%	0.269	S	S	.	.	S	Bend	trans	-113.3	-15.9	178.4	62.9	0	0	0	0	114.2	T339 D340 F341	S337-T339 PolarHBondContact O-N 3.18Å; S337-D340 WeakPolarHBondContact O-CB 3.22Å; S337-D340 PolarHBondContact O-N 3.4Å; S337-F341 VanDerWaalsContact O-CD2 3.29Å; S337-F341 WeakPolarHBondContact O-CD2 3.37Å
338	C	67.6	Low	72.7	Confident	12 Å²	12	51 Å²	51	8%	0.081	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-58.4	-30.1	-170.6	-33.3	0	0	0	0	113.1	C300 Y334 D340 F341 H367	C300-C338 HydrophobicContact CB-CB 3.97Å; C300-C338 WeakPolarHBondContact O-CB 3.27Å; C300-C338 PolarHBondContact O-SG 2.04Å; Y334-C338 PolarHBondContact O-SG 3.46Å; Y334-C338 VanDerWaalsContact O-SG 3.33Å; C338-D340 PolarHBondContact O-N 3.13Å; C338-F341 PolarHBondContact O-N 3.08Å; C338-H367 PolarHBondContact O-CE1 2.83Å; C338-H367 PolarHBondContact O-ND1 2.88Å
339	T	75	Confident	72.3	Confident	58 Å²	58	51 Å²	51	36%	0.356	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-69.3	-8.1	179.3	69	0	0	0	0	113.9	S337 R362 G366 L368	S337-T339 PolarHBondContact O-N 3.18Å; T339-R362 PolarHBondContact O-NH1 2.94Å; T339-G366 WeakPolarHBondContact CB-O 3.19Å; T339-L368 WeakPolarHBondContact O-CG 3.42Å; T339-L368 PolarHBondContact O-N 2.79Å
340	D	80	Confident	72.3	Confident	27 Å²	27	56 Å²	56	14%	0.144	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-92.7	-5.4	176.5	-64.8	-24.5	0	0	0	113.1	S337 C338 L349 K350	S337-D340 WeakPolarHBondContact O-CB 3.22Å; S337-D340 PolarHBondContact O-N 3.4Å; C338-D340 PolarHBondContact O-N 3.13Å; D340-L349 PolarHBondContact O-N 3.27Å; D340-L349 VanDerWaalsContact O-N 3.08Å; D340-K350 HydrophobicContact CB-CB 3.88Å; D340-K350 HydrophobicContact CB-CD 3.79Å; D340-K350 PolarHBondContact O-N 3.35Å; D340-K350 WeakPolarHBondContact OD1-CD 3.41Å; D340-K350 IonicContact OD1-NZ 2.96Å; D340-K350 PolarHBondContact OD1-NZ 3.25Å; D340-K350 WeakPolarHBondContact OD2-CD 3.24Å; D340-K350 IonicContact OD2-NZ 2.65Å; D340-K350 PolarHBondContact OD2-NZ 3.23Å
341	F	76.7	Confident	72.2	Confident	11 Å²	11	61.6 Å²	61.6	5%	0.048	32%	0.32	C	S	.	.	S	Bend	trans	-109.6	161.2	-177.3	-63.6	-94.9	0	0	0	111.7	H297 C300 S337 C338 I347 N348 H367 L368	H297-F341 HydrophobicContact CB-CD1 3.85Å; H297-F341 HydrophobicContact CB-CE1 3.1Å; H297-F341 HydrophobicContact CB-CZ 3.72Å; C300-F341 VanDerWaalsContact SG-CB 3.59Å; C300-F341 WeakPolarHBondContact SG-CD2 3.01Å; C300-F341 WeakPolarHBondContact SG-CG 3.44Å; S337-F341 VanDerWaalsContact O-CD2 3.29Å; S337-F341 WeakPolarHBondContact O-CD2 3.37Å; C338-F341 PolarHBondContact O-N 3.08Å; F341-I347 VanDerWaalsContact CA-O 3.24Å; F341-I347 WeakPolarHBondContact CA-O 3.39Å; F341-N348 VanDerWaalsContact CD1-CA 3.43Å; F341-N348 HydrophobicContact CD1-CB 3.71Å; F341-N348 HydrophobicContact CE1-CB 3.34Å; F341-N348 VanDerWaalsContact CE1-ND2 3.28Å; F341-N348 WeakPolarHBondContact CE1-ND2 3.03Å; F341-N348 VanDerWaalsContact CE2-ND2 3.31Å; F341-N348 WeakPolarHBondContact CE2-ND2 3.22Å; F341-N348 HydrophobicContact CZ-CB 4.01Å; F341-N348 WeakPolarHBondContact CZ-ND2 3.32Å; F341-H367 VanDerWaalsContact O-CB 3.31Å; F341-H367 WeakPolarHBondContact O-CB 3.43Å; F341-L368 PolarHBondContact O-N 2.62Å
342	A	75.6	Confident	72.5	Confident	8 Å²	8	65.1 Å²	65.1	7%	0.066	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-74.6	139.4	166.1	0	0	0	0	0	111.6	N344 T345 I347 L349 L368 I379	A342-N344 PolarHBondContact O-N 2.86Å; A342-T345 HydrophobicContact CB-CG2 4.02Å; A342-T345 WeakPolarHBondContact CB-OG1 3.35Å; A342-T345 WeakPolarHBondContact O-CB 3.48Å; A342-T345 PolarHBondContact O-N 3.36Å; A342-T345 PolarHBondContact O-OG1 2.82Å; A342-I347 PolarHBondContact N-O 2.03Å; A342-L349 HydrophobicContact CB-CD1 3.88Å; A342-L349 HydrophobicContact CB-CG 4.26Å; A342-L368 VanDerWaalsContact CA-O 3.31Å; A342-L368 WeakPolarHBondContact CA-O 3.44Å; A342-I379 HydrophobicContact CB-CG2 3.55Å
343	S	70.9	Confident	73.2	Confident	50 Å²	50	64.3 Å²	64.3	35%	0.35	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	124.9	-172.6	171.8	0	0	0	0	112.6	T345 D363	S343-T345 VanDerWaalsContact C-N 3.3Å; S343-T345 PolarHBondContact O-N 3.22Å; S343-D363 WeakPolarHBondContact CB-OD2 3.41Å
344	N	60.8	Low	74	Confident	119 Å²	119	59 Å²	59	64%	0.636	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	37.4	-177.4	-163.7	31.4	0	0	0	113.6	A342	A342-N344 PolarHBondContact O-N 2.86Å
345	T	61.1	Low	75.2	Confident	30 Å²	30	59.2 Å²	59.2	18%	0.184	32%	0.318	C	S	.	.	S	Bend	trans	-135.4	167.2	176.8	79.1	0	0	0	0	111.8	A342 S343 I347 I379	A342-T345 HydrophobicContact CB-CG2 4.02Å; A342-T345 WeakPolarHBondContact CB-OG1 3.35Å; A342-T345 WeakPolarHBondContact O-CB 3.48Å; A342-T345 PolarHBondContact O-N 3.36Å; A342-T345 PolarHBondContact O-OG1 2.82Å; S343-T345 VanDerWaalsContact C-N 3.3Å; S343-T345 PolarHBondContact O-N 3.22Å; T345-I347 VanDerWaalsContact C-N 3.32Å; T345-I347 PolarHBondContact OG1-N 3.07Å; T345-I347 VanDerWaalsContact OG1-N 3.14Å; T345-I379 HydrophobicContact CG2-CD1 3.94Å
346	T	66.7	Low	76.5	Confident	55 Å²	55	58 Å²	58	34%	0.337	31%	0.312	S	S	.	.	S	Bend	trans	-82.8	-4.1	171.2	49.7	0	0	0	0	113.9	H297 L298 N348	H297-T346 VanDerWaalsContact CB-O 3.24Å; H297-T346 WeakPolarHBondContact CB-O 3.32Å; H297-T346 VanDerWaalsContact CD2-CA 3.5Å; H297-T346 WeakPolarHBondContact CD2-CA 3.41Å; H297-T346 WeakPolarHBondContact CD2-CB 3.22Å; H297-T346 WeakPolarHBondContact CD2-CG2 3.43Å; H297-T346 WeakPolarHBondContact NE2-CB 3.47Å; H297-T346 WeakPolarHBondContact NE2-CG2 3.5Å; L298-T346 HydrophobicContact CD2-CG2 3.66Å; L298-T346 HydrophobicContact CG-CG2 4.06Å; T346-N348 PolarHBondContact O-N 3.33Å
347	I	69	Low	77.9	Confident	26 Å²	26	58 Å²	58	13%	0.133	31%	0.312	C	S	.	.			trans	-90.4	109	-162.9	-64.7	174.2	0	0	0	110.6	F341 A342 T345 L349 I379 Q380	F341-I347 VanDerWaalsContact CA-O 3.24Å; F341-I347 WeakPolarHBondContact CA-O 3.39Å; A342-I347 PolarHBondContact N-O 2.03Å; T345-I347 VanDerWaalsContact C-N 3.32Å; T345-I347 PolarHBondContact OG1-N 3.07Å; T345-I347 VanDerWaalsContact OG1-N 3.14Å; I347-L349 HydrophobicContact CG2-CD2 3.67Å; I347-L349 HydrophobicContact CG2-CG 4.15Å; I347-L349 PolarHBondContact O-N 3.02Å; I347-L349 VanDerWaalsContact O-N 3.11Å; I347-I379 HydrophobicContact CB-CG2 4.31Å; I347-I379 HydrophobicContact CD1-CB 3.9Å; I347-I379 HydrophobicContact CD1-CD1 3.91Å; I347-I379 HydrophobicContact CD1-CG2 3.72Å; I347-I379 HydrophobicContact CG2-CG2 4.24Å; I347-Q380 HydrophobicContact CD1-CG 4.45Å; I347-Q380 VanDerWaalsContact CG2-CD 3.47Å; I347-Q380 HydrophobicContact CG2-CG 3.63Å
348	N	80.2	Confident	79	Confident	27 Å²	27	56.5 Å²	56.5	14%	0.144	30%	0.304	C	S	.	.			trans	-79	89.5	175.1	-165.4	-69.7	0	0	0	110.7	F341 T346 K350 K351 Q352	F341-N348 VanDerWaalsContact CD1-CA 3.43Å; F341-N348 HydrophobicContact CD1-CB 3.71Å; F341-N348 HydrophobicContact CE1-CB 3.34Å; F341-N348 VanDerWaalsContact CE1-ND2 3.28Å; F341-N348 WeakPolarHBondContact CE1-ND2 3.03Å; F341-N348 VanDerWaalsContact CE2-ND2 3.31Å; F341-N348 WeakPolarHBondContact CE2-ND2 3.22Å; F341-N348 HydrophobicContact CZ-CB 4.01Å; F341-N348 WeakPolarHBondContact CZ-ND2 3.32Å; T346-N348 PolarHBondContact O-N 3.33Å; N348-K350 PolarHBondContact O-N 3.07Å; N348-K350 WeakPolarHBondContact OD1-CB 3.47Å; N348-K350 PolarHBondContact OD1-N 2.99Å; N348-K351 HydrophobicContact CB-CB 4.14Å; N348-K351 PolarHBondContact O-N 3.07Å; N348-K351 VanDerWaalsContact OD1-CB 3.24Å; N348-K351 WeakPolarHBondContact OD1-CB 3.21Å; N348-K351 PolarHBondContact OD1-N 3.26Å; N348-Q352 WeakPolarHBondContact O-CB 3.49Å; N348-Q352 WeakPolarHBondContact O-CG 3.03Å; N348-Q352 PolarHBondContact O-N 3.19Å
349	L	83.5	Confident	80.1	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65	-21.1	-179.6	-69.5	-176.7	0	0	0	113.9	D340 A342 I347 G353 I360 L368 K369 C370 Q380	D340-L349 PolarHBondContact O-N 3.27Å; D340-L349 VanDerWaalsContact O-N 3.08Å; A342-L349 HydrophobicContact CB-CD1 3.88Å; A342-L349 HydrophobicContact CB-CG 4.26Å; I347-L349 HydrophobicContact CG2-CD2 3.67Å; I347-L349 HydrophobicContact CG2-CG 4.15Å; I347-L349 PolarHBondContact O-N 3.02Å; I347-L349 VanDerWaalsContact O-N 3.11Å; L349-G353 WeakPolarHBondContact CD2-O 3.26Å; L349-G353 WeakPolarHBondContact O-CA 3.47Å; L349-G353 PolarHBondContact O-N 3.44Å; L349-I360 WeakPolarHBondContact O-CD1 3.25Å; L349-L368 HydrophobicContact CB-CB 3.77Å; L349-L368 HydrophobicContact CB-CD1 3.81Å; L349-L368 HydrophobicContact CB-CG 4.44Å; L349-L368 HydrophobicContact CD1-CB 3.9Å; L349-L368 HydrophobicContact CG-CB 4.4Å; L349-K369 VanDerWaalsContact CD1-CA 3.47Å; L349-C370 WeakPolarHBondContact CD2-SG 3.4Å; L349-Q380 HydrophobicContact CD2-CG 3.81Å
350	K	85	Confident	80.8	Confident	132 Å²	132	61.5 Å²	61.5	57%	0.574	33%	0.33	S	S	*	.	H	α-helix	trans	-73.6	-33.2	174.7	-178.8	176.4	176	179.6	0	113.1	D340 N348 L368	D340-K350 HydrophobicContact CB-CB 3.88Å; D340-K350 HydrophobicContact CB-CD 3.79Å; D340-K350 PolarHBondContact O-N 3.35Å; D340-K350 WeakPolarHBondContact OD1-CD 3.41Å; D340-K350 IonicContact OD1-NZ 2.96Å; D340-K350 PolarHBondContact OD1-NZ 3.25Å; D340-K350 WeakPolarHBondContact OD2-CD 3.24Å; D340-K350 IonicContact OD2-NZ 2.65Å; D340-K350 PolarHBondContact OD2-NZ 3.23Å; N348-K350 PolarHBondContact O-N 3.07Å; N348-K350 WeakPolarHBondContact OD1-CB 3.47Å; N348-K350 PolarHBondContact OD1-N 2.99Å; K350-L368 HydrophobicContact CB-CD1 3.87Å
351	K	85	Confident	81.1	Confident	184 Å²	184	62.6 Å²	62.6	80%	0.8	34%	0.34	S	S	*	.	H	α-helix	trans	-90.2	-43.9	180	-178.5	-179.2	178.4	-178.1	0	111.9	N348	N348-K351 HydrophobicContact CB-CB 4.14Å; N348-K351 PolarHBondContact O-N 3.07Å; N348-K351 VanDerWaalsContact OD1-CB 3.24Å; N348-K351 WeakPolarHBondContact OD1-CB 3.21Å; N348-K351 PolarHBondContact OD1-N 3.26Å
352	Q	85.5	Confident	81.3	Confident	100 Å²	100	67.8 Å²	67.8	47%	0.467	36%	0.359	S	S	.	.	H	α-helix	trans	-88.4	-25.3	-175.7	-59.2	178.7	5.3	0	0	112.3	N348	N348-Q352 WeakPolarHBondContact O-CB 3.49Å; N348-Q352 WeakPolarHBondContact O-CG 3.03Å; N348-Q352 PolarHBondContact O-N 3.19Å
353	G	89.1	Confident	81	Confident	19 Å²	19	69.3 Å²	69.3	20%	0.196	37%	0.366	C	S	.	.			trans	71.4	-162.7	-175.1	0	0	0	0	0	113.3	L349 Q380	L349-G353 WeakPolarHBondContact CD2-O 3.26Å; L349-G353 WeakPolarHBondContact O-CA 3.47Å; L349-G353 PolarHBondContact O-N 3.44Å; G353-Q380 PolarHBondContact O-NE2 3.44Å
354	C	90.1	Very high	80.5	Confident	25 Å²	25	72 Å²	72	17%	0.169	39%	0.385	C	S	.	.			trans	-114.1	138.6	171.6	-52	0	0	0	0	108.5	G358 C370 Q380	C354-G358 WeakPolarHBondContact CB-O 3.19Å; C354-C370 VanDerWaalsContact CA-SG 3.55Å; C354-C370 HydrophobicContact CB-CB 3.85Å; C354-C370 WeakPolarHBondContact CB-SG 3.36Å; C354-C370 VanDerWaalsContact SG-CA 3.52Å; C354-C370 WeakPolarHBondContact SG-CB 3.36Å; C354-C370 CovalentContact SG-SG 2.03Å; C354-C370 PolarHBondContact SG-SG 2.81Å; C354-Q380 CarbonylContact C-O 3.59Å; C354-Q380 WeakPolarHBondContact CA-O 3.37Å
355	N	91.5	Very high	80.4	Confident	70 Å²	70	73.3 Å²	73.3	37%	0.374	38%	0.382	S	S	.	.	S	Bend	trans	-74.7	170.2	173.2	-61.2	-35.9	0	0	0	111.1	N357 G358 Q380	N355-N357 VanDerWaalsContact C-N 3.3Å; N355-N357 PolarHBondContact O-N 3.12Å; N355-N357 VanDerWaalsContact O-N 3.09Å; N355-G358 PolarHBondContact O-N 2.71Å; N355-Q380 WeakPolarHBondContact CB-O 3.36Å; N355-Q380 PolarHBondContact N-O 3.29Å
356	N	90.7	Very high	80.7	Confident	67 Å²	67	72.9 Å²	72.9	36%	0.358	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	44.4	165.6	-61.2	-43	0	0	0	114.9	G358 P373 Y376 C381	N356-G358 PolarHBondContact O-N 2.82Å; N356-P373 VanDerWaalsContact O-CG 3.31Å; N356-P373 WeakPolarHBondContact O-CG 3.44Å; N356-Y376 HydrophobicContact CB-CD1 3.64Å; N356-Y376 HydrophobicContact CB-CD2 3.54Å; N356-Y376 HydrophobicContact CB-CE1 3.77Å; N356-Y376 HydrophobicContact CB-CE2 3.68Å; N356-Y376 HydrophobicContact CB-CG 3.52Å; N356-Y376 VanDerWaalsContact CG-CE1 3.44Å; N356-Y376 VanDerWaalsContact ND2-CD1 3.29Å; N356-Y376 WeakPolarHBondContact ND2-CD1 3.27Å; N356-Y376 WeakPolarHBondContact ND2-CE1 3.37Å; N356-C381 WeakPolarHBondContact CB-O 3.41Å; N356-C381 PolarHBondContact ND2-O 2.87Å
357	N	89.4	Confident	81	Confident	152 Å²	152	71.8 Å²	71.8	81%	0.813	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	23.3	-176.7	-66.2	9.4	0	0	0	115.6	N355 P373	N355-N357 VanDerWaalsContact C-N 3.3Å; N355-N357 PolarHBondContact O-N 3.12Å; N355-N357 VanDerWaalsContact O-N 3.09Å; N357-P373 HydrophobicContact CB-CG 4.34Å
358	G	86.3	Confident	81.6	Confident	15 Å²	15	71 Å²	71	16%	0.155	37%	0.371	C	S	.	.			trans	-60.6	148.3	166.5	0	0	0	0	0	112.4	C354 N355 N356 V371	C354-G358 WeakPolarHBondContact CB-O 3.19Å; N355-G358 PolarHBondContact O-N 2.71Å; N356-G358 PolarHBondContact O-N 2.82Å; G358-V371 WeakPolarHBondContact CA-O 3.41Å
359	T	89.3	Confident	81.7	Confident	87 Å²	87	74.1 Å²	74.1	53%	0.534	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	141.6	179.7	55	0	0	0	0	111.7	C370 V371	T359-C370 CarbonylContact O-C 3.04Å; T359-V371 PolarHBondContact N-O 2.65Å; T359-V371 PolarHBondContact O-N 3.12Å; T359-V371 PolarHBondContact OG1-O 3.07Å
360	I	90	Very high	81.8	Confident	87 Å²	87	75 Å²	75	45%	0.446	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	131	179.5	-65.3	177.5	0	0	0	110.3	L349 L368	L349-I360 WeakPolarHBondContact O-CD1 3.25Å; I360-L368 HydrophobicContact CG2-CB 4.45Å; I360-L368 HydrophobicContact CG2-CD1 3.76Å; I360-L368 HydrophobicContact CG2-CD2 3.58Å; I360-L368 HydrophobicContact CG2-CG 4.11Å
361	S	87.8	Confident	81.7	Confident	50 Å²	50	72 Å²	72	35%	0.35	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	-173.5	173.4	-167	0	0	0	0	110.2	L368 K369	S361-L368 CarbonylContact O-C 3.6Å; S361-L368 WeakPolarHBondContact O-CA 3.36Å; S361-K369 PolarHBondContact N-O 2.95Å; S361-K369 PolarHBondContact O-N 2.82Å
362	R	80.2	Confident	81.5	Confident	120 Å²	120	64.4 Å²	64.4	45%	0.453	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	153.3	172.3	-69.2	-174.7	-176.4	-73.4	-4.8	112	T339 G366 H367 L368 K369	T339-R362 PolarHBondContact O-NH1 2.94Å; R362-G366 PolarHBondContact NH1-O 3.17Å; R362-H367 CarbonylContact C-O 3.56Å; R362-H367 WeakPolarHBondContact CA-O 3.38Å; R362-L368 HydrophobicContact CG-CD2 3.98Å; R362-K369 WeakPolarHBondContact O-CE 3.38Å; R362-K369 PolarHBondContact O-NZ 3.45Å
363	D	68.8	Low	81.3	Confident	41 Å²	41	62 Å²	62	22%	0.219	34%	0.344	C	S	.	.			trans	-88.7	-175.1	170.1	78.6	-1.6	0	0	0	112.3	S343 Y365 G366 H367 K369	S343-D363 WeakPolarHBondContact CB-OD2 3.41Å; D363-Y365 PolarHBondContact O-N 2.78Å; D363-Y365 WeakPolarHBondContact OD1-CA 3.31Å; D363-Y365 PolarHBondContact OD1-N 2.79Å; D363-G366 PolarHBondContact O-N 3.01Å; D363-G366 PolarHBondContact OD1-N 2.03Å; D363-H367 PolarHBondContact N-O 3.34Å; D363-H367 PolarHBondContact OD1-N 3.23Å; D363-H367 IonicContact OD2-CD2 2.78Å; D363-K369 HydrophobicContact CB-CD 4.26Å
364	S	60.9	Low	80.7	Confident	107 Å²	107	63 Å²	63	75%	0.748	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-13.8	178.6	48.3	0	0	0	0	114.7
365	Y	57.7	Low	80.2	Confident	146 Å²	146	67.4 Å²	67.4	57%	0.573	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-11.1	-178.6	-56.9	-70.7	0	0	0	112.2	D363	D363-Y365 PolarHBondContact O-N 2.78Å; D363-Y365 WeakPolarHBondContact OD1-CA 3.31Å; D363-Y365 PolarHBondContact OD1-N 2.79Å
366	G	68.8	Low	79.7	Confident	21 Å²	21	66.3 Å²	66.3	22%	0.216	35%	0.349	C	S	.	.	S	Bend	trans	100.7	-2	177.1	0	0	0	0	0	114.2	T339 R362 D363	T339-G366 WeakPolarHBondContact CB-O 3.19Å; R362-G366 PolarHBondContact NH1-O 3.17Å; D363-G366 PolarHBondContact O-N 3.01Å; D363-G366 PolarHBondContact OD1-N 2.03Å
367	H	72	Confident	78.9	Confident	32 Å²	32	63.4 Å²	63.4	15%	0.148	33%	0.334	C	S	.	.			trans	-64.7	153.4	172.7	-70.1	-73.6	0	0	0	110.8	C338 F341 R362 D363	C338-H367 PolarHBondContact O-CE1 2.83Å; C338-H367 PolarHBondContact O-ND1 2.88Å; F341-H367 VanDerWaalsContact O-CB 3.31Å; F341-H367 WeakPolarHBondContact O-CB 3.43Å; R362-H367 CarbonylContact C-O 3.56Å; R362-H367 WeakPolarHBondContact CA-O 3.38Å; D363-H367 PolarHBondContact N-O 3.34Å; D363-H367 PolarHBondContact OD1-N 3.23Å; D363-H367 IonicContact OD2-CD2 2.78Å
368	L	81.2	Confident	77.8	Confident	10 Å²	10	57.8 Å²	57.8	5%	0.052	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	153.6	168.9	-71.3	-168	0	0	0	109.8	T339 F341 A342 L349 K350 I360 S361 R362	T339-L368 WeakPolarHBondContact O-CG 3.42Å; T339-L368 PolarHBondContact O-N 2.79Å; F341-L368 PolarHBondContact O-N 2.62Å; A342-L368 VanDerWaalsContact CA-O 3.31Å; A342-L368 WeakPolarHBondContact CA-O 3.44Å; L349-L368 HydrophobicContact CB-CB 3.77Å; L349-L368 HydrophobicContact CB-CD1 3.81Å; L349-L368 HydrophobicContact CB-CG 4.44Å; L349-L368 HydrophobicContact CD1-CB 3.9Å; L349-L368 HydrophobicContact CG-CB 4.4Å; K350-L368 HydrophobicContact CB-CD1 3.87Å; I360-L368 HydrophobicContact CG2-CB 4.45Å; I360-L368 HydrophobicContact CG2-CD1 3.76Å; I360-L368 HydrophobicContact CG2-CD2 3.58Å; I360-L368 HydrophobicContact CG2-CG 4.11Å; S361-L368 CarbonylContact O-C 3.6Å; S361-L368 WeakPolarHBondContact O-CA 3.36Å; R362-L368 HydrophobicContact CG-CD2 3.98Å
369	K	83.6	Confident	77.2	Confident	91 Å²	91	60.5 Å²	60.5	40%	0.396	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	148.6	166.2	69.2	-175.9	-172.9	-171	0	109.4	L349 S361 R362 D363	L349-K369 VanDerWaalsContact CD1-CA 3.47Å; S361-K369 PolarHBondContact N-O 2.95Å; S361-K369 PolarHBondContact O-N 2.82Å; R362-K369 WeakPolarHBondContact O-CE 3.38Å; R362-K369 PolarHBondContact O-NZ 3.45Å; D363-K369 HydrophobicContact CB-CD 4.26Å
370	C	84.5	Confident	76.9	Confident	20 Å²	20	57.7 Å²	57.7	14%	0.135	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	144	166.9	-67.5	0	0	0	0	110.9	L349 C354 T359 I379 C381	L349-C370 WeakPolarHBondContact CD2-SG 3.4Å; C354-C370 VanDerWaalsContact CA-SG 3.55Å; C354-C370 HydrophobicContact CB-CB 3.85Å; C354-C370 WeakPolarHBondContact CB-SG 3.36Å; C354-C370 VanDerWaalsContact SG-CA 3.52Å; C354-C370 WeakPolarHBondContact SG-CB 3.36Å; C354-C370 CovalentContact SG-SG 2.03Å; C354-C370 PolarHBondContact SG-SG 2.81Å; T359-C370 CarbonylContact O-C 3.04Å; C370-I379 WeakPolarHBondContact CB-O 3.46Å; C370-I379 PolarHBondContact SG-O 2.95Å; C370-C381 VanDerWaalsContact CB-SG 3.55Å
371	V	84.1	Confident	76.6	Confident	68 Å²	68	53.6 Å²	53.6	41%	0.412	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	102.6	168.6	178.4	0	0	0	0	106	G358 T359	G358-V371 WeakPolarHBondContact CA-O 3.41Å; T359-V371 PolarHBondContact N-O 2.65Å; T359-V371 PolarHBondContact O-N 3.12Å; T359-V371 PolarHBondContact OG1-O 3.07Å
372	C	80	Confident	76.6	Confident	25 Å²	25	54.9 Å²	54.9	17%	0.169	28%	0.282	C	S	.	.			trans	-82.3	148.8	-171.6	-52.6	0	0	0	0	112.5	Y376 C381 A604	C372-Y376 WeakPolarHBondContact CB-O 3.11Å; C372-C381 WeakPolarHBondContact CA-SG 3.02Å; C372-C381 HydrophobicContact CB-CB 3.61Å; C372-C381 WeakPolarHBondContact CB-SG 3.49Å; C372-C381 WeakPolarHBondContact SG-CA 3.31Å; C372-C381 WeakPolarHBondContact SG-CB 3.42Å; C372-C381 CovalentContact SG-SG 2.03Å; C372-C381 PolarHBondContact SG-SG 2.95Å; C372-A604 HydrophobicContact CB-CB 4.4Å
373	P	80.7	Confident	76.4	Confident	48 Å²	48	52.7 Å²	52.7	31%	0.312	28%	0.277	S	S	.	.			trans	-65.7	161.4	167	-19.9	35.4	0	0	0	111.2	N356 N357 R375 Y376	N356-P373 VanDerWaalsContact O-CG 3.31Å; N356-P373 WeakPolarHBondContact O-CG 3.44Å; N357-P373 HydrophobicContact CB-CG 4.34Å; P373-R375 PolarHBondContact O-N 3.32Å; P373-Y376 HydrophobicContact CB-CD2 4.46Å; P373-Y376 PolarHBondContact O-N 3.03Å
374	D	76.4	Confident	77.1	Confident	41 Å²	41	52.2 Å²	52.2	22%	0.219	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-8.9	-171.5	-65.3	-46.2	0	0	0	115.5	G401 S601 K603	D374-G401 VanDerWaalsContact O-CA 3.26Å; D374-G401 WeakPolarHBondContact O-CA 3.11Å; D374-G401 PolarHBondContact O-N 2.72Å; D374-S601 WeakPolarHBondContact OD2-CB 3.29Å; D374-S601 PolarHBondContact OD2-OG 2.93Å; D374-K603 PolarHBondContact OD1-N 2.74Å; D374-K603 VanDerWaalsContact OD1-O 3.08Å
375	R	81	Confident	78	Confident	117 Å²	117	47.4 Å²	47.4	44%	0.442	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-11.2	175.7	-176.5	170.5	176.2	-179.5	-4.8	114.7	P373 D384 V385 P398	P373-R375 PolarHBondContact O-N 3.32Å; R375-D384 VanDerWaalsContact CG-OD1 3.27Å; R375-D384 WeakPolarHBondContact CG-OD1 3.44Å; R375-D384 IonicContact CZ-OD2 3.1Å; R375-D384 VanDerWaalsContact NE-CG 3.31Å; R375-D384 IonicContact NE-OD1 3.11Å; R375-D384 PolarHBondContact NE-OD1 2.74Å; R375-D384 VanDerWaalsContact NE-OD1 3.11Å; R375-D384 IonicContact NE-OD2 2.8Å; R375-D384 PolarHBondContact NE-OD2 2.78Å; R375-D384 IonicContact NH2-OD2 2.66Å; R375-D384 PolarHBondContact NH2-OD2 2.87Å; R375-V385 WeakPolarHBondContact O-CG1 3.44Å; R375-V385 WeakPolarHBondContact O-CG2 3.13Å; R375-V385 PolarHBondContact O-N 2.78Å; R375-P398 HydrophobicContact CB-CB 3.74Å; R375-P398 HydrophobicContact CB-CG 3.84Å; R375-P398 HydrophobicContact CG-CB 3.97Å; R375-P398 HydrophobicContact CG-CG 4.02Å
376	Y	81.2	Confident	79.2	Confident	48 Å²	48	41.4 Å²	41.4	19%	0.188	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	141.4	-168.3	-60.3	-77.7	0	0	0	113.6	N356 C372 P373 E383 D384 A604	N356-Y376 HydrophobicContact CB-CD1 3.64Å; N356-Y376 HydrophobicContact CB-CD2 3.54Å; N356-Y376 HydrophobicContact CB-CE1 3.77Å; N356-Y376 HydrophobicContact CB-CE2 3.68Å; N356-Y376 HydrophobicContact CB-CG 3.52Å; N356-Y376 VanDerWaalsContact CG-CE1 3.44Å; N356-Y376 VanDerWaalsContact ND2-CD1 3.29Å; N356-Y376 WeakPolarHBondContact ND2-CD1 3.27Å; N356-Y376 WeakPolarHBondContact ND2-CE1 3.37Å; C372-Y376 WeakPolarHBondContact CB-O 3.11Å; P373-Y376 HydrophobicContact CB-CD2 4.46Å; P373-Y376 PolarHBondContact O-N 3.03Å; Y376-E383 CarbonylContact C-O 3.59Å; Y376-E383 VanDerWaalsContact CA-O 3.24Å; Y376-E383 WeakPolarHBondContact CA-O 3.39Å; Y376-D384 HydrophobicContact CD1-CB 4.12Å; Y376-D384 HydrophobicContact CE1-CB 3.84Å; Y376-A604 WeakPolarHBondContact O-CB 3.23Å
377	I	73.2	Confident	80	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.026	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	177.3	-178.7	59.6	178.2	0	0	0	110.7	C381 E382 E383 V385 A604 V605 V607	I377-C381 CarbonylContact O-C 3.3Å; I377-C381 VanDerWaalsContact O-C 3.25Å; I377-C381 WeakPolarHBondContact O-CA 3.15Å; I377-E382 PolarHBondContact O-N 3.11Å; I377-E383 HydrophobicContact CD1-CB 4.19Å; I377-E383 VanDerWaalsContact CD1-OE2 3.28Å; I377-E383 WeakPolarHBondContact CD1-OE2 2.95Å; I377-E383 HydrophobicContact CG1-CB 3.45Å; I377-E383 VanDerWaalsContact CG1-CB 3.45Å; I377-E383 HydrophobicContact CG1-CG 4.47Å; I377-E383 WeakPolarHBondContact CG1-OE2 2.95Å; I377-E383 PolarHBondContact N-O 3.45Å; I377-E383 PolarHBondContact O-N 2.98Å; I377-E383 VanDerWaalsContact O-N 3.07Å; I377-V385 HydrophobicContact CB-CG1 4.11Å; I377-V385 HydrophobicContact CD1-CG1 3.83Å; I377-V385 HydrophobicContact CG1-CG1 3.72Å; I377-V385 HydrophobicContact CG2-CG1 3.45Å; I377-V385 VanDerWaalsContact CG2-CG1 3.45Å; I377-A604 HydrophobicContact CG2-CB 3.57Å; I377-V605 VanDerWaalsContact CB-O 3.31Å; I377-V605 WeakPolarHBondContact CB-O 3.33Å; I377-V605 HydrophobicContact CG2-CB 3.76Å; I377-V605 HydrophobicContact CG2-CG1 4.21Å; I377-V605 WeakPolarHBondContact CG2-O 2.8Å; I377-V607 HydrophobicContact CD1-CB 4.07Å; I377-V607 HydrophobicContact CD1-CG2 3.75Å
378	G	65.1	Low	80.3	Confident	34 Å²	34	49.3 Å²	49.3	35%	0.351	27%	0.269	S	S	.	.	S	Bend	trans	101.7	-178.2	-175.9	0	0	0	0	0	113.3	Q380 E382	G378-Q380 VanDerWaalsContact C-N 3.34Å; G378-E382 WeakPolarHBondContact CA-OE2 3.3Å
379	I	74.8	Confident	80.4	Confident	72 Å²	72	51.1 Å²	51.1	37%	0.369	28%	0.281	S	S	.	.	S	Bend	trans	-77.3	-27.4	-175.9	-66.4	158.2	0	0	0	111	A342 T345 I347 C370 E382	A342-I379 HydrophobicContact CB-CG2 3.55Å; T345-I379 HydrophobicContact CG2-CD1 3.94Å; I347-I379 HydrophobicContact CB-CG2 4.31Å; I347-I379 HydrophobicContact CD1-CB 3.9Å; I347-I379 HydrophobicContact CD1-CD1 3.91Å; I347-I379 HydrophobicContact CD1-CG2 3.72Å; I347-I379 HydrophobicContact CG2-CG2 4.24Å; C370-I379 WeakPolarHBondContact CB-O 3.46Å; C370-I379 PolarHBondContact SG-O 2.95Å; I379-E382 PolarHBondContact N-OE1 2.91Å; I379-E382 VanDerWaalsContact N-OE1 3.12Å; I379-E382 PolarHBondContact N-OE2 2.84Å
380	Q	83.4	Confident	80.5	Confident	29 Å²	29	47.9 Å²	47.9	14%	0.136	27%	0.269	C	S	.	.	S	Bend	trans	-114.7	5.6	179.4	-54.2	-167.8	-100.8	0	0	113.2	I347 L349 G353 C354 N355 G378 E382	I347-Q380 HydrophobicContact CD1-CG 4.45Å; I347-Q380 VanDerWaalsContact CG2-CD 3.47Å; I347-Q380 HydrophobicContact CG2-CG 3.63Å; L349-Q380 HydrophobicContact CD2-CG 3.81Å; G353-Q380 PolarHBondContact O-NE2 3.44Å; C354-Q380 CarbonylContact C-O 3.59Å; C354-Q380 WeakPolarHBondContact CA-O 3.37Å; N355-Q380 WeakPolarHBondContact CB-O 3.36Å; N355-Q380 PolarHBondContact N-O 3.29Å; G378-Q380 VanDerWaalsContact C-N 3.34Å; Q380-E382 WeakPolarHBondContact CA-OE2 3.3Å; Q380-E382 WeakPolarHBondContact CB-OE2 3.44Å; Q380-E382 PolarHBondContact N-OE2 2.96Å
381	C	84.3	Confident	80.7	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.282	C	S	.	.	S	Bend	trans	67.4	34.8	-172.4	-40.5	0	0	0	0	113.4	N356 C370 C372 I377	N356-C381 WeakPolarHBondContact CB-O 3.41Å; N356-C381 PolarHBondContact ND2-O 2.87Å; C370-C381 VanDerWaalsContact CB-SG 3.55Å; C372-C381 WeakPolarHBondContact CA-SG 3.02Å; C372-C381 HydrophobicContact CB-CB 3.61Å; C372-C381 WeakPolarHBondContact CB-SG 3.49Å; C372-C381 WeakPolarHBondContact SG-CA 3.31Å; C372-C381 WeakPolarHBondContact SG-CB 3.42Å; C372-C381 CovalentContact SG-SG 2.03Å; C372-C381 PolarHBondContact SG-SG 2.95Å; I377-C381 CarbonylContact O-C 3.3Å; I377-C381 VanDerWaalsContact O-C 3.25Å; I377-C381 WeakPolarHBondContact O-CA 3.15Å
382	E	86.4	Confident	80.8	Confident	77 Å²	77	50.9 Å²	50.9	36%	0.36	28%	0.281	S	S	.	.			trans	-80.2	-29.9	-173.8	62.2	-84.1	-154.7	0	0	114.5	I377 G378 I379 Q380	I377-E382 PolarHBondContact O-N 3.11Å; G378-E382 WeakPolarHBondContact CA-OE2 3.3Å; I379-E382 PolarHBondContact N-OE1 2.91Å; I379-E382 VanDerWaalsContact N-OE1 3.12Å; I379-E382 PolarHBondContact N-OE2 2.84Å; Q380-E382 WeakPolarHBondContact CA-OE2 3.3Å; Q380-E382 WeakPolarHBondContact CB-OE2 3.44Å; Q380-E382 PolarHBondContact N-OE2 2.96Å
383	E	77.2	Confident	80.9	Confident	75 Å²	75	52 Å²	52	35%	0.35	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	126	-174.5	-80.8	170.4	-154.7	0	0	111	Y376 I377	Y376-E383 CarbonylContact C-O 3.59Å; Y376-E383 VanDerWaalsContact CA-O 3.24Å; Y376-E383 WeakPolarHBondContact CA-O 3.39Å; I377-E383 HydrophobicContact CD1-CB 4.19Å; I377-E383 VanDerWaalsContact CD1-OE2 3.28Å; I377-E383 WeakPolarHBondContact CD1-OE2 2.95Å; I377-E383 HydrophobicContact CG1-CB 3.45Å; I377-E383 VanDerWaalsContact CG1-CB 3.45Å; I377-E383 HydrophobicContact CG1-CG 4.47Å; I377-E383 WeakPolarHBondContact CG1-OE2 2.95Å; I377-E383 PolarHBondContact N-O 3.45Å; I377-E383 PolarHBondContact O-N 2.98Å; I377-E383 VanDerWaalsContact O-N 3.07Å
384	D	83.6	Confident	81	Confident	30 Å²	30	50.2 Å²	50.2	16%	0.16	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	123.3	171.3	-174.6	-17.2	0	0	0	110.6	R375 Y376 C386 E387	R375-D384 VanDerWaalsContact CG-OD1 3.27Å; R375-D384 WeakPolarHBondContact CG-OD1 3.44Å; R375-D384 IonicContact CZ-OD2 3.1Å; R375-D384 VanDerWaalsContact NE-CG 3.31Å; R375-D384 IonicContact NE-OD1 3.11Å; R375-D384 PolarHBondContact NE-OD1 2.74Å; R375-D384 VanDerWaalsContact NE-OD1 3.11Å; R375-D384 IonicContact NE-OD2 2.8Å; R375-D384 PolarHBondContact NE-OD2 2.78Å; R375-D384 IonicContact NH2-OD2 2.66Å; R375-D384 PolarHBondContact NH2-OD2 2.87Å; Y376-D384 HydrophobicContact CD1-CB 4.12Å; Y376-D384 HydrophobicContact CE1-CB 3.84Å; D384-C386 VanDerWaalsContact C-N 3.26Å; D384-C386 PolarHBondContact O-N 2.89Å; D384-C386 PolarHBondContact OD1-N 3.26Å; D384-E387 HydrophobicContact CB-CB 4.01Å; D384-E387 PolarHBondContact O-N 2.81Å
385	V	78.7	Confident	81.4	Confident	7 Å²	7	51.4 Å²	51.4	4%	0.042	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-18.8	-173.1	-51.6	0	0	0	0	113.1	R375 I377 T389 P398 G401 P403	R375-V385 WeakPolarHBondContact O-CG1 3.44Å; R375-V385 WeakPolarHBondContact O-CG2 3.13Å; R375-V385 PolarHBondContact O-N 2.78Å; I377-V385 HydrophobicContact CB-CG1 4.11Å; I377-V385 HydrophobicContact CD1-CG1 3.83Å; I377-V385 HydrophobicContact CG1-CG1 3.72Å; I377-V385 HydrophobicContact CG2-CG1 3.45Å; I377-V385 VanDerWaalsContact CG2-CG1 3.45Å; V385-T389 PolarHBondContact O-OG1 3.3Å; V385-P398 HydrophobicContact CG2-CB 3.76Å; V385-G401 WeakPolarHBondContact CB-O 3.36Å; V385-G401 WeakPolarHBondContact CG1-O 3.43Å; V385-P403 VanDerWaalsContact O-CB 3.3Å; V385-P403 WeakPolarHBondContact O-CB 3.02Å; V385-P403 VanDerWaalsContact O-CG 3.3Å; V385-P403 WeakPolarHBondContact O-CG 3.17Å
386	C	83	Confident	81.5	Confident	20 Å²	20	47.3 Å²	47.3	14%	0.135	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-12	177.7	-83.8	0	0	0	0	113.5	D384 G388 C396 P398	D384-C386 VanDerWaalsContact C-N 3.26Å; D384-C386 PolarHBondContact O-N 2.89Å; D384-C386 PolarHBondContact OD1-N 3.26Å; C386-G388 PolarHBondContact O-N 3.1Å; C386-C396 WeakPolarHBondContact CA-SG 3.03Å; C386-C396 HydrophobicContact CB-CB 3.55Å; C386-C396 WeakPolarHBondContact CB-SG 3.39Å; C386-C396 WeakPolarHBondContact SG-CB 3.41Å; C386-C396 CovalentContact SG-SG 2.03Å; C386-C396 PolarHBondContact SG-SG 2.82Å; C386-P398 VanDerWaalsContact SG-CD 3.59Å
387	E	86.1	Confident	81.5	Confident	152 Å²	152	47.9 Å²	47.9	71%	0.71	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	123.4	178	-171.9	165.3	-160.5	0	0	110.2	D384 T389	D384-E387 HydrophobicContact CB-CB 4.01Å; D384-E387 PolarHBondContact O-N 2.81Å; E387-T389 PolarHBondContact O-N 2.87Å
388	G	78.7	Confident	81.3	Confident	67 Å²	67	49.7 Å²	49.7	69%	0.691	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	-1.3	178.3	0	0	0	0	0	117.4	C386	C386-G388 PolarHBondContact O-N 3.1Å
389	T	82.7	Confident	80.8	Confident	48 Å²	48	49.3 Å²	49.3	29%	0.294	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-46.3	-172.5	-62.4	0	0	0	0	113.8	V385 E387 P403 N415	V385-T389 PolarHBondContact O-OG1 3.3Å; E387-T389 PolarHBondContact O-N 2.87Å; T389-P403 HydrophobicContact CG2-CB 3.75Å; T389-P403 HydrophobicContact CG2-CG 3.42Å; T389-P403 VanDerWaalsContact CG2-CG 3.42Å; T389-N415 WeakPolarHBondContact O-CB 3.03Å
390	C	86.3	Confident	80.1	Confident	22 Å²	22	46.1 Å²	46.1	15%	0.149	28%	0.282	C	S	.	.	S	Bend	trans	-90.7	112.6	-177.7	-54.6	0	0	0	0	110.3	G394 C396 C405	C390-G394 VanDerWaalsContact CB-O 3.27Å; C390-G394 WeakPolarHBondContact CB-O 3.44Å; C390-C396 HydrophobicContact CB-CB 4.21Å; C390-C396 WeakPolarHBondContact SG-CA 3.31Å; C390-C396 WeakPolarHBondContact SG-CB 3.4Å; C390-C405 WeakPolarHBondContact CA-SG 3.28Å; C390-C405 HydrophobicContact CB-CB 3.75Å; C390-C405 WeakPolarHBondContact CB-SG 3.2Å; C390-C405 WeakPolarHBondContact SG-CA 3.22Å; C390-C405 WeakPolarHBondContact SG-CB 3.47Å; C390-C405 CovalentContact SG-SG 2.03Å; C390-C405 PolarHBondContact SG-SG 3.25Å
391	L	88.8	Confident	79	Confident	76 Å²	76	44.7 Å²	44.7	40%	0.398	28%	0.276	S	S	.	.			trans	-86.8	174.3	-176.9	-56.3	-172.5	0	0	0	111.6	G393 G394 N415 C416	L391-G393 PolarHBondContact O-N 2.88Å; L391-G393 VanDerWaalsContact O-N 3.08Å; L391-G394 PolarHBondContact O-N 2.86Å; L391-N415 PolarHBondContact N-O 2.84Å; L391-C416 WeakPolarHBondContact O-CB 3.24Å
392	N	85.6	Confident	77.9	Confident	76 Å²	76	48 Å²	48	41%	0.406	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	34.4	172.7	-60.3	-38.9	0	0	0	114.3	G394 F411 C416	N392-G394 VanDerWaalsContact C-N 3.26Å; N392-G394 PolarHBondContact O-N 2.85Å; N392-F411 HydrophobicContact CB-CB 4.47Å; N392-F411 HydrophobicContact CB-CD1 3.61Å; N392-F411 HydrophobicContact CB-CD2 3.78Å; N392-F411 HydrophobicContact CB-CE1 3.66Å; N392-F411 HydrophobicContact CB-CE2 3.82Å; N392-F411 HydrophobicContact CB-CG 3.67Å; N392-F411 HydrophobicContact CB-CZ 3.76Å; N392-F411 VanDerWaalsContact CG-CE1 3.41Å; N392-F411 VanDerWaalsContact ND2-CD1 3.29Å; N392-F411 WeakPolarHBondContact ND2-CD1 3.36Å; N392-F411 WeakPolarHBondContact ND2-CE1 3.17Å; N392-C416 PolarHBondContact ND2-O 3.35Å
393	G	81.7	Confident	77.4	Confident	47 Å²	47	46.4 Å²	46.4	49%	0.485	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	14.5	179.9	0	0	0	0	0	114.8	L391 R408	L391-G393 PolarHBondContact O-N 2.88Å; L391-G393 VanDerWaalsContact O-N 3.08Å; G393-R408 WeakPolarHBondContact O-CD 3.49Å; G393-R408 WeakPolarHBondContact O-CG 3.27Å; G393-R408 PolarHBondContact O-NE 2.81Å
394	G	83.5	Confident	77.4	Confident	11 Å²	11	47.8 Å²	47.8	11%	0.113	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-66.3	142.5	174.3	0	0	0	0	0	112.7	C390 L391 N392 F406	C390-G394 VanDerWaalsContact CB-O 3.27Å; C390-G394 WeakPolarHBondContact CB-O 3.44Å; L391-G394 PolarHBondContact O-N 2.86Å; N392-G394 VanDerWaalsContact C-N 3.26Å; N392-G394 PolarHBondContact O-N 2.85Å; G394-F406 CarbonylContact C-O 3.57Å; G394-F406 VanDerWaalsContact CA-O 3.23Å; G394-F406 WeakPolarHBondContact CA-O 3.4Å
395	T	83.4	Confident	77.4	Confident	66 Å²	66	47 Å²	47	41%	0.405	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	121.5	-176.3	-57.9	0	0	0	0	110.4	F406	T395-F406 PolarHBondContact N-O 3.46Å; T395-F406 PolarHBondContact O-N 3.3Å
396	C	83.6	Confident	77.5	Confident	32 Å²	32	50 Å²	50	22%	0.216	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	125.3	174.3	-170	0	0	0	0	112	C386 C390 P403	C386-C396 WeakPolarHBondContact CA-SG 3.03Å; C386-C396 HydrophobicContact CB-CB 3.55Å; C386-C396 WeakPolarHBondContact CB-SG 3.39Å; C386-C396 WeakPolarHBondContact SG-CB 3.41Å; C386-C396 CovalentContact SG-SG 2.03Å; C386-C396 PolarHBondContact SG-SG 2.82Å; C390-C396 HydrophobicContact CB-CB 4.21Å; C390-C396 WeakPolarHBondContact SG-CA 3.31Å; C390-C396 WeakPolarHBondContact SG-CB 3.4Å; C396-P403 WeakPolarHBondContact SG-CB 3.4Å
397	V	81.2	Confident	77.3	Confident	60 Å²	60	50.1 Å²	50.1	36%	0.364	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	115.6	166	175.6	0	0	0	0	108.7	A399 H404 F406	V397-A399 PolarHBondContact O-N 2.76Å; V397-H404 PolarHBondContact N-O 3.04Å; V397-H404 PolarHBondContact O-N 2.89Å; V397-F406 HydrophobicContact CB-CD2 4.49Å; V397-F406 HydrophobicContact CB-CE2 4.04Å; V397-F406 HydrophobicContact CG2-CD2 3.83Å; V397-F406 HydrophobicContact CG2-CE2 3.57Å
398	P	68.2	Low	76.8	Confident	42 Å²	42	47.9 Å²	47.9	27%	0.273	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	100.9	177.3	27.2	-30	0	0	0	109.6	R375 V385 C386	R375-P398 HydrophobicContact CB-CB 3.74Å; R375-P398 HydrophobicContact CB-CG 3.84Å; R375-P398 HydrophobicContact CG-CB 3.97Å; R375-P398 HydrophobicContact CG-CG 4.02Å; V385-P398 HydrophobicContact CG2-CB 3.76Å; C386-P398 VanDerWaalsContact SG-CD 3.59Å
399	A	56.4	Low	76.5	Confident	27 Å²	27	48.1 Å²	48.1	22%	0.223	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	94.5	179.8	0	0	0	0	0	109.4	V397 K402	V397-A399 PolarHBondContact O-N 2.76Å; A399-K402 CarbonylContact C-O 3.58Å; A399-K402 WeakPolarHBondContact CA-O 3.37Å; A399-K402 PolarHBondContact N-O 2.03Å; A399-K402 WeakPolarHBondContact O-CB 3.24Å; A399-K402 PolarHBondContact O-N 3.47Å
400	R	59.1	Low	76	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.015	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	45.4	175.1	-55.2	-162.6	155.8	-176.7	-17.6	114	R53 V54 E56 K402 S602 K603 A604 V605	R53-R400 PolarHBondContact O-NH2 3.43Å; V54-R400 HydrophobicContact CG2-CG 4.29Å; E56-R400 VanDerWaalsContact CD-CD 3.48Å; E56-R400 WeakPolarHBondContact OE1-CD 3.5Å; E56-R400 IonicContact OE1-NE 3.78Å; E56-R400 WeakPolarHBondContact OE2-CD 3.28Å; E56-R400 IonicContact OE2-CZ 1.83Å; E56-R400 IonicContact OE2-NE 2.53Å; E56-R400 PolarHBondContact OE2-NE 3.21Å; E56-R400 IonicContact OE2-NH1 3.52Å; E56-R400 PolarHBondContact OE2-NH1 3.33Å; E56-R400 IonicContact OE2-NH2 2.82Å; R400-K402 PolarHBondContact O-N 3.23Å; R400-K402 VanDerWaalsContact O-N 3.1Å; R400-S602 WeakPolarHBondContact CD-O 3.34Å; R400-S602 WeakPolarHBondContact CG-O 3.32Å; R400-S602 PolarHBondContact NE-O 2.81Å; R400-K603 CarbonylContact C-O 3.53Å; R400-K603 WeakPolarHBondContact CA-O 3.43Å; R400-K603 HydrophobicContact CB-CB 4.07Å; R400-K603 VanDerWaalsContact NH1-NZ 3.12Å; R400-K603 CarbonylContact O-C 3.56Å; R400-A604 WeakPolarHBondContact O-CA 3.26Å; R400-V605 WeakPolarHBondContact O-CG2 3.36Å
401	G	60.7	Low	75.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	-3.2	-171.7	0	0	0	0	0	114.9	D374 V385 K603 V605	D374-G401 VanDerWaalsContact O-CA 3.26Å; D374-G401 WeakPolarHBondContact O-CA 3.11Å; D374-G401 PolarHBondContact O-N 2.72Å; V385-G401 WeakPolarHBondContact CB-O 3.36Å; V385-G401 WeakPolarHBondContact CG1-O 3.43Å; G401-K603 PolarHBondContact N-O 3.39Å; G401-V605 VanDerWaalsContact O-CB 3.25Å; G401-V605 WeakPolarHBondContact O-CB 3.48Å; G401-V605 WeakPolarHBondContact O-CG1 3.31Å
402	K	61.1	Low	75.3	Confident	69 Å²	69	45.4 Å²	45.4	30%	0.3	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	124.5	167.3	-97.4	144.9	-172	-104.3	0	107	K64 E67 A399 R400 V605	K64-K402 HydrophobicContact CB-CD 4.47Å; K64-K402 HydrophobicContact CD-CD 4.17Å; E67-K402 IonicContact OE2-NZ 3.35Å; E67-K402 PolarHBondContact OE2-NZ 2.7Å; A399-K402 CarbonylContact C-O 3.58Å; A399-K402 WeakPolarHBondContact CA-O 3.37Å; A399-K402 PolarHBondContact N-O 2.03Å; A399-K402 WeakPolarHBondContact O-CB 3.24Å; A399-K402 PolarHBondContact O-N 3.47Å; R400-K402 PolarHBondContact O-N 3.23Å; R400-K402 VanDerWaalsContact O-N 3.1Å; K402-V605 HydrophobicContact CB-CG2 4.26Å; K402-V605 HydrophobicContact CD-CG2 3.76Å; K402-V605 HydrophobicContact CG-CG1 4.07Å; K402-V605 HydrophobicContact CG-CG2 3.73Å
403	P	75.1	Confident	74.7	Confident	44 Å²	44	42.8 Å²	42.8	29%	0.286	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	141.7	168	26.3	-30.3	0	0	0	109.6	V385 T389 C396	V385-P403 VanDerWaalsContact O-CB 3.3Å; V385-P403 WeakPolarHBondContact O-CB 3.02Å; V385-P403 VanDerWaalsContact O-CG 3.3Å; V385-P403 WeakPolarHBondContact O-CG 3.17Å; T389-P403 HydrophobicContact CG2-CB 3.75Å; T389-P403 HydrophobicContact CG2-CG 3.42Å; T389-P403 VanDerWaalsContact CG2-CG 3.42Å; C396-P403 WeakPolarHBondContact SG-CB 3.4Å
404	H	78.3	Confident	74.6	Confident	104 Å²	104	46 Å²	46	48%	0.481	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.2	165.3	-174.1	64.5	0	0	0	108.5	V397 F406	V397-H404 PolarHBondContact N-O 3.04Å; V397-H404 PolarHBondContact O-N 2.89Å; H404-F406 AromaticContact CD2-CE2 3.66Å; H404-F406 AromaticContact CD2-CZ 3.71Å
405	C	83.1	Confident	74.7	Confident	12 Å²	12	47.8 Å²	47.8	8%	0.081	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.2	-173.2	-59.5	0	0	0	0	111.7	C390 C416	C390-C405 WeakPolarHBondContact CA-SG 3.28Å; C390-C405 HydrophobicContact CB-CB 3.75Å; C390-C405 WeakPolarHBondContact CB-SG 3.2Å; C390-C405 WeakPolarHBondContact SG-CA 3.22Å; C390-C405 WeakPolarHBondContact SG-CB 3.47Å; C390-C405 CovalentContact SG-SG 2.03Å; C390-C405 PolarHBondContact SG-SG 3.25Å; C405-C416 VanDerWaalsContact CB-SG 3.54Å
406	F	80.6	Confident	74.8	Confident	71 Å²	71	44.6 Å²	44.6	31%	0.311	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	106.4	166.9	-67.7	-85.9	0	0	0	108.8	G394 T395 V397 H404 Y483	G394-F406 CarbonylContact C-O 3.57Å; G394-F406 VanDerWaalsContact CA-O 3.23Å; G394-F406 WeakPolarHBondContact CA-O 3.4Å; T395-F406 PolarHBondContact N-O 3.46Å; T395-F406 PolarHBondContact O-N 3.3Å; V397-F406 HydrophobicContact CB-CD2 4.49Å; V397-F406 HydrophobicContact CB-CE2 4.04Å; V397-F406 HydrophobicContact CG2-CD2 3.83Å; V397-F406 HydrophobicContact CG2-CE2 3.57Å; H404-F406 AromaticContact CD2-CE2 3.66Å; H404-F406 AromaticContact CD2-CZ 3.71Å; F406-Y483 HydrophobicContact CB-CD1 4.45Å
407	C	79.4	Confident	75	Confident	23 Å²	23	45.8 Å²	45.8	16%	0.155	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-74.6	140.3	-174.9	-52.1	0	0	0	0	112	F411 C416	C407-F411 HydrophobicContact CB-CB 4.23Å; C407-F411 WeakPolarHBondContact CB-O 3.42Å; C407-C416 WeakPolarHBondContact CA-SG 3.44Å; C407-C416 HydrophobicContact CB-CB 3.71Å; C407-C416 WeakPolarHBondContact CB-SG 3.49Å; C407-C416 PolarHBondContact N-SG 3.43Å; C407-C416 VanDerWaalsContact N-SG 3.44Å; C407-C416 WeakPolarHBondContact SG-CA 3.3Å; C407-C416 WeakPolarHBondContact SG-CB 3.37Å; C407-C416 CovalentContact SG-SG 2.04Å; C407-C416 PolarHBondContact SG-SG 3.22Å
408	R	76.1	Confident	75	Confident	104 Å²	104	48.2 Å²	48.2	39%	0.392	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-63.1	158.7	167.6	-80	-177.6	179.1	-100.4	7.3	110.8	G393 G410 F411 E482 Y483	G393-R408 WeakPolarHBondContact O-CD 3.49Å; G393-R408 WeakPolarHBondContact O-CG 3.27Å; G393-R408 PolarHBondContact O-NE 2.81Å; R408-G410 PolarHBondContact O-N 2.64Å; R408-F411 HydrophobicContact CB-CD2 4.49Å; R408-F411 PolarHBondContact O-N 2.98Å; R408-E482 IonicContact CZ-OE1 2.71Å; R408-E482 IonicContact NH1-OE1 3.37Å; R408-E482 PolarHBondContact NH1-OE1 3.33Å; R408-E482 IonicContact NH1-OE2 3.56Å; R408-E482 PolarHBondContact NH1-OE2 2.8Å; R408-Y483 HydrophobicContact CG-CE1 4.44Å; R408-Y483 WeakPolarHBondContact CG-OH 3.42Å
409	R	70.9	Confident	75.5	Confident	73 Å²	73	47.1 Å²	47.1	28%	0.275	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	131.3	173.6	-75.7	-174.8	167.4	118.2	6.1	110.9	V447 A481	R409-V447 HydrophobicContact CB-CG1 4.08Å; R409-A481 PolarHBondContact NH2-O 3.19Å
410	G	73.7	Confident	76.4	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.01	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	90	-4.4	-177.5	0	0	0	0	0	115.4	R408 L420 V445	R408-G410 PolarHBondContact O-N 2.64Å; G410-L420 WeakPolarHBondContact O-CB 3.38Å; G410-L420 PolarHBondContact O-N 3.07Å; G410-V445 WeakPolarHBondContact O-CG1 3.44Å
411	F	81.4	Confident	77	Confident	29 Å²	29	55.3 Å²	55.3	13%	0.127	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	151.9	177.3	-63.1	-79.1	0	0	0	113.2	N392 C407 R408 C416 E418 I440	N392-F411 HydrophobicContact CB-CB 4.47Å; N392-F411 HydrophobicContact CB-CD1 3.61Å; N392-F411 HydrophobicContact CB-CD2 3.78Å; N392-F411 HydrophobicContact CB-CE1 3.66Å; N392-F411 HydrophobicContact CB-CE2 3.82Å; N392-F411 HydrophobicContact CB-CG 3.67Å; N392-F411 HydrophobicContact CB-CZ 3.76Å; N392-F411 VanDerWaalsContact CG-CE1 3.41Å; N392-F411 VanDerWaalsContact ND2-CD1 3.29Å; N392-F411 WeakPolarHBondContact ND2-CD1 3.36Å; N392-F411 WeakPolarHBondContact ND2-CE1 3.17Å; C407-F411 HydrophobicContact CB-CB 4.23Å; C407-F411 WeakPolarHBondContact CB-O 3.42Å; R408-F411 HydrophobicContact CB-CD2 4.49Å; R408-F411 PolarHBondContact O-N 2.98Å; F411-C416 HydrophobicContact CB-CB 4.44Å; F411-E418 CarbonylContact C-O 3.52Å; F411-E418 VanDerWaalsContact CA-O 3.29Å; F411-E418 WeakPolarHBondContact CA-O 3.36Å; F411-I440 HydrophobicContact CE2-CD1 4.13Å; F411-I440 HydrophobicContact CZ-CD1 3.84Å
412	T	77.4	Confident	77.5	Confident	58 Å²	58	58.1 Å²	58.1	36%	0.356	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	-176.8	-177.8	-167.2	0	0	0	0	111.1	C416 S417 E418	T412-C416 CarbonylContact O-C 3.54Å; T412-C416 VanDerWaalsContact O-C 3.31Å; T412-C416 WeakPolarHBondContact O-CA 3.46Å; T412-S417 PolarHBondContact O-N 2.93Å; T412-E418 HydrophobicContact CG2-CB 3.71Å; T412-E418 PolarHBondContact N-O 3.15Å; T412-E418 WeakPolarHBondContact O-CB 3.38Å; T412-E418 PolarHBondContact O-N 2.91Å; T412-E418 VanDerWaalsContact O-N 3.07Å
413	G	74.6	Confident	77.9	Confident	21 Å²	21	54.9 Å²	54.9	22%	0.216	29%	0.293	C	S	.	.	S	Bend	trans	86.7	161.8	-172.2	0	0	0	0	0	112.6	N415 C416	G413-N415 PolarHBondContact O-N 2.79Å; G413-N415 VanDerWaalsContact O-N 3.12Å; G413-C416 PolarHBondContact O-N 3.05Å; G413-C416 VanDerWaalsContact O-N 3.1Å
414	S	79	Confident	77.4	Confident	115 Å²	115	54.1 Å²	54.1	80%	0.804	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-18.4	-171	57.4	0	0	0	0	115.1
415	N	85.1	Confident	76.5	Confident	48 Å²	48	59.3 Å²	59.3	26%	0.257	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	10.6	178.3	66.7	-18.5	0	0	0	112.5	T389 L391 G413 S417	T389-N415 WeakPolarHBondContact O-CB 3.03Å; L391-N415 PolarHBondContact N-O 2.84Å; G413-N415 PolarHBondContact O-N 2.79Å; G413-N415 VanDerWaalsContact O-N 3.12Å; N415-S417 VanDerWaalsContact C-N 3.26Å; N415-S417 PolarHBondContact O-N 2.7Å; N415-S417 WeakPolarHBondContact OD1-CB 3.4Å; N415-S417 PolarHBondContact OD1-N 2.88Å; N415-S417 VanDerWaalsContact OD1-N 3.17Å; N415-S417 PolarHBondContact OD1-OG 3.06Å
416	C	86.4	Confident	75.5	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.343	C	S	.	.	S	Bend	trans	62.1	21.4	-176.6	-48.3	0	0	0	0	115.9	L391 N392 C405 C407 F411 T412 G413	L391-C416 WeakPolarHBondContact O-CB 3.24Å; N392-C416 PolarHBondContact ND2-O 3.35Å; C405-C416 VanDerWaalsContact CB-SG 3.54Å; C407-C416 WeakPolarHBondContact CA-SG 3.44Å; C407-C416 HydrophobicContact CB-CB 3.71Å; C407-C416 WeakPolarHBondContact CB-SG 3.49Å; C407-C416 PolarHBondContact N-SG 3.43Å; C407-C416 VanDerWaalsContact N-SG 3.44Å; C407-C416 WeakPolarHBondContact SG-CA 3.3Å; C407-C416 WeakPolarHBondContact SG-CB 3.37Å; C407-C416 CovalentContact SG-SG 2.04Å; C407-C416 PolarHBondContact SG-SG 3.22Å; F411-C416 HydrophobicContact CB-CB 4.44Å; T412-C416 CarbonylContact O-C 3.54Å; T412-C416 VanDerWaalsContact O-C 3.31Å; T412-C416 WeakPolarHBondContact O-CA 3.46Å; G413-C416 PolarHBondContact O-N 3.05Å; G413-C416 VanDerWaalsContact O-N 3.1Å
417	S	87.2	Confident	74.8	Confident	57 Å²	57	61.4 Å²	61.4	40%	0.399	35%	0.347	S	S	.	.			trans	-75.5	-19.3	-179.9	64.5	0	0	0	0	114.8	T412 N415	T412-S417 PolarHBondContact O-N 2.93Å; N415-S417 VanDerWaalsContact C-N 3.26Å; N415-S417 PolarHBondContact O-N 2.7Å; N415-S417 WeakPolarHBondContact OD1-CB 3.4Å; N415-S417 PolarHBondContact OD1-N 2.88Å; N415-S417 VanDerWaalsContact OD1-N 3.17Å; N415-S417 PolarHBondContact OD1-OG 3.06Å
418	E	81.3	Confident	74.5	Confident	110 Å²	110	64.4 Å²	64.4	51%	0.514	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	131.5	-171.4	-62.4	170	-142.5	0	0	111	F411 T412	F411-E418 CarbonylContact C-O 3.52Å; F411-E418 VanDerWaalsContact CA-O 3.29Å; F411-E418 WeakPolarHBondContact CA-O 3.36Å; T412-E418 HydrophobicContact CG2-CB 3.71Å; T412-E418 PolarHBondContact N-O 3.15Å; T412-E418 WeakPolarHBondContact O-CB 3.38Å; T412-E418 PolarHBondContact O-N 2.91Å; T412-E418 VanDerWaalsContact O-N 3.07Å
419	A	79.2	Confident	74.7	Confident	19 Å²	19	60 Å²	60	16%	0.157	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	140.1	168.9	0	0	0	0	0	111.3	K421 V445	A419-K421 PolarHBondContact O-N 3.14Å; A419-V445 HydrophobicContact CB-CG1 4.41Å; A419-V445 HydrophobicContact CB-CG2 4.06Å
420	L	74.4	Confident	75.3	Confident	20 Å²	20	61.3 Å²	61.3	11%	0.105	36%	0.359	C	S	.	.			trans	-73.4	115.9	179	-172.8	72.1	0	0	0	110.7	G410 S422 K446 V457	G410-L420 WeakPolarHBondContact O-CB 3.38Å; G410-L420 PolarHBondContact O-N 3.07Å; L420-S422 WeakPolarHBondContact CD1-O 3.39Å; L420-S422 WeakPolarHBondContact CG-O 3.44Å; L420-K446 WeakPolarHBondContact CD2-O 3.36Å; L420-K446 PolarHBondContact O-N 2.77Å; L420-V457 HydrophobicContact CD1-CG1 4.37Å; L420-V457 HydrophobicContact CD2-CG1 3.84Å
421	K	72.8	Confident	75.9	Confident	183 Å²	183	64.8 Å²	64.8	80%	0.796	38%	0.377	S	S	*	.			trans	-89.4	-20.3	-174.9	-61.2	-177	-179.2	178.9	0	114.6	A419 K446	A419-K421 PolarHBondContact O-N 3.14Å; K421-K446 WeakPolarHBondContact O-CG 3.08Å
422	S	70.6	Confident	75.9	Confident	59 Å²	59	66.4 Å²	66.4	41%	0.413	40%	0.402	S	S	.	.	S	Bend	trans	-148.4	154	175.6	71.8	0	0	0	0	111.2	L420 G424	L420-S422 WeakPolarHBondContact CD1-O 3.39Å; L420-S422 WeakPolarHBondContact CG-O 3.44Å; S422-G424 PolarHBondContact O-N 3.19Å; S422-G424 PolarHBondContact OG-O 3Å; S422-G424 VanDerWaalsContact OG-O 3.08Å
423	C	69.8	Low	76.3	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.014	39%	0.391	C	S	.	.	S	Bend	trans	-79	35.2	176.2	-67.7	0	0	0	0	113.3	T428 C435 C448	C423-T428 CarbonylContact O-C 3.54Å; C423-T428 VanDerWaalsContact O-C 3.3Å; C423-C435 HydrophobicContact CB-CB 3.67Å; C423-C435 WeakPolarHBondContact CB-SG 3.36Å; C423-C435 VanDerWaalsContact SG-CA 3.59Å; C423-C435 WeakPolarHBondContact SG-CB 3.38Å; C423-C435 CovalentContact SG-SG 2.03Å; C423-C435 PolarHBondContact SG-SG 3.5Å; C423-C448 VanDerWaalsContact SG-SG 3.65Å
424	G	63.1	Low	76.8	Confident	27 Å²	27	67.2 Å²	67.2	28%	0.278	41%	0.405	S	S	.	.	S	Bend	trans	107.7	177.8	-171	0	0	0	0	0	113.6	S422 S426 G427	S422-G424 PolarHBondContact O-N 3.19Å; S422-G424 PolarHBondContact OG-O 3Å; S422-G424 VanDerWaalsContact OG-O 3.08Å; G424-S426 VanDerWaalsContact C-N 3.34Å; G424-S426 PolarHBondContact O-N 2.85Å; G424-G427 PolarHBondContact O-N 2.84Å; G424-G427 VanDerWaalsContact O-N 3.16Å
425	E	61.1	Low	77.1	Confident	213 Å²	213	64 Å²	64	100%	0.995	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-36	-177.2	-67.4	-176.4	162.6	0	0	113	G427	E425-G427 VanDerWaalsContact C-N 3.32Å
426	S	61.2	Low	77.1	Confident	91 Å²	91	65 Å²	65	64%	0.636	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-1.4	176.6	53.4	0	0	0	0	114	G424 T428	G424-S426 VanDerWaalsContact C-N 3.34Å; G424-S426 PolarHBondContact O-N 2.85Å; S426-T428 PolarHBondContact O-N 2.8Å; S426-T428 PolarHBondContact OG-OG1 2.9Å
427	G	66.4	Low	76.8	Confident	37 Å²	37	68 Å²	68	38%	0.381	40%	0.404	S	S	.	.	S	Bend	trans	68.4	6.5	-171.8	0	0	0	0	0	114.9	G424 E425	G424-G427 PolarHBondContact O-N 2.84Å; G424-G427 VanDerWaalsContact O-N 3.16Å; E425-G427 VanDerWaalsContact C-N 3.32Å
428	T	72.6	Confident	76.3	Confident	86 Å²	86	69 Å²	69	53%	0.528	40%	0.404	S	S	.	.			trans	-116.7	131.3	-177.7	49.5	0	0	0	0	111.9	C423 S426	C423-T428 CarbonylContact O-C 3.54Å; C423-T428 VanDerWaalsContact O-C 3.3Å; S426-T428 PolarHBondContact O-N 2.8Å; S426-T428 PolarHBondContact OG-OG1 2.9Å
429	C	81	Confident	76	Confident	10 Å²	10	70.8 Å²	70.8	7%	0.068	41%	0.411	C	S	.	.			trans	-65.8	145.5	172.9	-52.6	0	0	0	0	110.7	C435 C448	C429-C435 VanDerWaalsContact SG-CA 3.59Å; C429-C448 HydrophobicContact CB-CB 3.72Å; C429-C448 WeakPolarHBondContact CB-SG 3.4Å; C429-C448 WeakPolarHBondContact SG-CA 3.45Å; C429-C448 WeakPolarHBondContact SG-CB 3.36Å; C429-C448 CovalentContact SG-SG 2.03Å; C429-C448 PolarHBondContact SG-SG 3.11Å
430	Q	83.6	Confident	75.3	Confident	102 Å²	102	74 Å²	74	48%	0.477	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-71.7	166.4	-179.5	-57.6	-169.1	10.9	0	0	111.7	G432 G433 T458 C459	Q430-G432 PolarHBondContact O-N 3.16Å; Q430-G433 PolarHBondContact O-N 3.44Å; Q430-T458 WeakPolarHBondContact CB-O 3.47Å; Q430-T458 PolarHBondContact N-O 2.83Å; Q430-C459 WeakPolarHBondContact O-CB 3.31Å
431	N	85.4	Confident	74.9	Confident	73 Å²	73	76.9 Å²	76.9	39%	0.39	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	53.2	28.6	173.9	-59.7	-49.1	0	0	0	115.3	Y454 C459	N431-Y454 HydrophobicContact CB-CD1 3.41Å; N431-Y454 VanDerWaalsContact CB-CD1 3.41Å; N431-Y454 HydrophobicContact CB-CD2 3.95Å; N431-Y454 HydrophobicContact CB-CE1 3.55Å; N431-Y454 HydrophobicContact CB-CE2 4.06Å; N431-Y454 HydrophobicContact CB-CG 3.61Å; N431-Y454 VanDerWaalsContact CG-CD1 3.46Å; N431-Y454 WeakPolarHBondContact ND2-CD1 3.38Å; N431-C459 PolarHBondContact ND2-O 2.9Å
432	G	82.4	Confident	74.8	Confident	63 Å²	63	73.1 Å²	73.1	65%	0.649	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	77.2	19.9	-179.9	0	0	0	0	0	114.5	Q430	Q430-G432 PolarHBondContact O-N 3.16Å
433	G	84.4	Confident	74.4	Confident	14 Å²	14	76.5 Å²	76.5	14%	0.144	47%	0.471	C	S	.	.			trans	-65	155.6	169.4	0	0	0	0	0	112.7	Q430 K449	Q430-G433 PolarHBondContact O-N 3.44Å; G433-K449 CarbonylContact C-O 3.56Å; G433-K449 WeakPolarHBondContact CA-O 3.5Å
434	T	85.1	Confident	74.6	Confident	82 Å²	82	81.4 Å²	81.4	50%	0.503	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.1	175.9	-56.5	0	0	0	0	110.1	E436 K449	T434-E436 HydrophobicContact CG2-CG 4.39Å; T434-E436 PolarHBondContact O-N 3.08Å; T434-K449 PolarHBondContact N-O 2.9Å; T434-K449 PolarHBondContact O-N 2.9Å
435	C	85.8	Confident	75.1	Confident	49 Å²	49	80.1 Å²	80.1	33%	0.331	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	110.1	174.4	-174.2	0	0	0	0	109.8	C423 C429	C423-C435 HydrophobicContact CB-CB 3.67Å; C423-C435 WeakPolarHBondContact CB-SG 3.36Å; C423-C435 VanDerWaalsContact SG-CA 3.59Å; C423-C435 WeakPolarHBondContact SG-CB 3.38Å; C423-C435 CovalentContact SG-SG 2.03Å; C423-C435 PolarHBondContact SG-SG 3.5Å; C429-C435 VanDerWaalsContact SG-CA 3.59Å
436	E	84.8	Confident	76.1	Confident	69 Å²	69	72 Å²	72	32%	0.322	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	150.9	175.4	-66.6	-179.1	172.6	0	0	109.8	T434 V447 K449	T434-E436 HydrophobicContact CG2-CG 4.39Å; T434-E436 PolarHBondContact O-N 3.08Å; E436-V447 PolarHBondContact N-O 2.79Å; E436-V447 PolarHBondContact O-N 3.4Å; E436-K449 WeakPolarHBondContact OE1-CD 3.02Å; E436-K449 IonicContact OE1-NZ 3.31Å; E436-K449 PolarHBondContact OE1-NZ 2.73Å
437	T	81.6	Confident	77	Confident	62 Å²	62	68.5 Å²	68.5	38%	0.38	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	121.5	176.6	-56.9	0	0	0	0	108.3	E444 K446	T437-E444 HydrophobicContact CG2-CG 3.46Å; T437-E444 VanDerWaalsContact CG2-CG 3.46Å; T437-E444 VanDerWaalsContact CG2-OE1 3.24Å; T437-E444 WeakPolarHBondContact CG2-OE1 3.37Å; T437-K446 HydrophobicContact CG2-CD 4.14Å; T437-K446 WeakPolarHBondContact OG1-CD 3.26Å; T437-K446 PolarHBondContact OG1-NZ 3.07Å
438	L	76.1	Confident	77.8	Confident	78 Å²	78	66.8 Å²	66.8	41%	0.408	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	157.3	178.1	-57.5	-176.1	0	0	0	109.8	V445 V447	L438-V445 PolarHBondContact N-O 3.28Å; L438-V445 PolarHBondContact O-N 2.92Å; L438-V447 HydrophobicContact CD1-CB 4.19Å; L438-V447 HydrophobicContact CD1-CG2 3.71Å; L438-V447 HydrophobicContact CG-CB 4.49Å; L438-V447 HydrophobicContact CG-CG2 4.22Å
439	F	74	Confident	78.4	Confident	148 Å²	148	68.2 Å²	68.2	65%	0.649	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.8	172	-67.1	-84.2	0	0	0	108.9	E443 E444	F439-E443 WeakPolarHBondContact CA-O 3.32Å; F439-E444 HydrophobicContact CD1-CB 4.31Å; F439-E444 HydrophobicContact CE1-CB 3.97Å; F439-E444 HydrophobicContact CE1-CG 4.03Å; F439-E444 HydrophobicContact CZ-CG 4.36Å
440	I	65.8	Low	78.4	Confident	87 Å²	87	68.9 Å²	68.9	45%	0.446	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	98.4	174.4	-57.5	-174.7	0	0	0	106.7	F411 A442 E443 V445	F411-I440 HydrophobicContact CE2-CD1 4.13Å; F411-I440 HydrophobicContact CZ-CD1 3.84Å; I440-A442 PolarHBondContact O-N 3.32Å; I440-E443 PolarHBondContact N-O 3.02Å; I440-E443 PolarHBondContact O-N 2.75Å; I440-V445 HydrophobicContact CB-CG2 4.11Å; I440-V445 HydrophobicContact CD1-CB 4.42Å; I440-V445 HydrophobicContact CD1-CG2 4.01Å; I440-V445 HydrophobicContact CG1-CB 4.48Å; I440-V445 HydrophobicContact CG1-CG2 3.94Å
441	G	65.9	Low	78.4	Confident	79 Å²	79	70.5 Å²	70.5	81%	0.814	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	-120	-167.8	0	0	0	0	0	110.8
442	A	70.3	Confident	78.2	Confident	105 Å²	105	74.5 Å²	74.5	87%	0.868	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-4.4	176.9	0	0	0	0	0	113.7	I440	I440-A442 PolarHBondContact O-N 3.32Å
443	E	63	Low	78	Confident	129 Å²	129	73.1 Å²	73.1	60%	0.603	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.4	-179.4	-65.6	-163.5	150.6	0	0	111.9	F439 I440	F439-E443 WeakPolarHBondContact CA-O 3.32Å; I440-E443 PolarHBondContact N-O 3.02Å; I440-E443 PolarHBondContact O-N 2.75Å
444	E	73.7	Confident	77.8	Confident	105 Å²	105	76 Å²	76	49%	0.491	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	123.2	170.8	-171.1	-172.8	161.8	0	0	109.7	T437 F439 K446	T437-E444 HydrophobicContact CG2-CG 3.46Å; T437-E444 VanDerWaalsContact CG2-CG 3.46Å; T437-E444 VanDerWaalsContact CG2-OE1 3.24Å; T437-E444 WeakPolarHBondContact CG2-OE1 3.37Å; F439-E444 HydrophobicContact CD1-CB 4.31Å; F439-E444 HydrophobicContact CE1-CB 3.97Å; F439-E444 HydrophobicContact CE1-CG 4.03Å; F439-E444 HydrophobicContact CZ-CG 4.36Å; E444-K446 WeakPolarHBondContact OE1-CE 3.47Å; E444-K446 IonicContact OE1-NZ 3.64Å; E444-K446 PolarHBondContact OE1-NZ 2.79Å
445	V	73.9	Confident	77.3	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.006	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.8	-176.9	-171.5	0	0	0	0	109.2	G410 A419 L438 I440	G410-V445 WeakPolarHBondContact O-CG1 3.44Å; A419-V445 HydrophobicContact CB-CG1 4.41Å; A419-V445 HydrophobicContact CB-CG2 4.06Å; L438-V445 PolarHBondContact N-O 3.28Å; L438-V445 PolarHBondContact O-N 2.92Å; I440-V445 HydrophobicContact CB-CG2 4.11Å; I440-V445 HydrophobicContact CD1-CB 4.42Å; I440-V445 HydrophobicContact CD1-CG2 4.01Å; I440-V445 HydrophobicContact CG1-CB 4.48Å; I440-V445 HydrophobicContact CG1-CG2 3.94Å
446	K	80.5	Confident	76.5	Confident	43 Å²	43	70.1 Å²	70.1	19%	0.187	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	139.7	174	-58.8	-51.8	-164.4	-169.5	0	110.3	L420 K421 T437 E444	L420-K446 WeakPolarHBondContact CD2-O 3.36Å; L420-K446 PolarHBondContact O-N 2.77Å; K421-K446 WeakPolarHBondContact O-CG 3.08Å; T437-K446 HydrophobicContact CG2-CD 4.14Å; T437-K446 WeakPolarHBondContact OG1-CD 3.26Å; T437-K446 PolarHBondContact OG1-NZ 3.07Å; E444-K446 WeakPolarHBondContact OE1-CE 3.47Å; E444-K446 IonicContact OE1-NZ 3.64Å; E444-K446 PolarHBondContact OE1-NZ 2.79Å
447	V	80.8	Confident	76	Confident	16 Å²	16	68.5 Å²	68.5	10%	0.097	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	132.8	178.4	172.9	0	0	0	0	110.3	R409 E436 L438	R409-V447 HydrophobicContact CB-CG1 4.08Å; E436-V447 PolarHBondContact N-O 2.79Å; E436-V447 PolarHBondContact O-N 3.4Å; L438-V447 HydrophobicContact CD1-CB 4.19Å; L438-V447 HydrophobicContact CD1-CG2 3.71Å; L438-V447 HydrophobicContact CG-CB 4.49Å; L438-V447 HydrophobicContact CG-CG2 4.22Å
448	C	83	Confident	75.8	Confident	1 Å²	1	67 Å²	67	1%	0.007	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	118.9	171.8	-76.1	0	0	0	0	111.8	C423 C429 V457	C423-C448 VanDerWaalsContact SG-SG 3.65Å; C429-C448 HydrophobicContact CB-CB 3.72Å; C429-C448 WeakPolarHBondContact CB-SG 3.4Å; C429-C448 WeakPolarHBondContact SG-CA 3.45Å; C429-C448 WeakPolarHBondContact SG-CB 3.36Å; C429-C448 CovalentContact SG-SG 2.03Å; C429-C448 PolarHBondContact SG-SG 3.11Å; C448-V457 WeakPolarHBondContact CB-O 3.42Å
449	K	84.3	Confident	76	Confident	117 Å²	117	63.3 Å²	63.3	51%	0.509	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	105.7	170.2	-177.8	172.7	-178.3	175.8	0	109.3	G433 T434 E436	G433-K449 CarbonylContact C-O 3.56Å; G433-K449 WeakPolarHBondContact CA-O 3.5Å; T434-K449 PolarHBondContact N-O 2.9Å; T434-K449 PolarHBondContact O-N 2.9Å; E436-K449 WeakPolarHBondContact OE1-CD 3.02Å; E436-K449 IonicContact OE1-NZ 3.31Å; E436-K449 PolarHBondContact OE1-NZ 2.73Å
450	C	81.9	Confident	76.2	Confident	23 Å²	23	59.2 Å²	59.2	16%	0.155	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-78	149	-174.6	-51.6	0	0	0	0	112	Y454 C459	C450-Y454 WeakPolarHBondContact CB-O 3.42Å; C450-C459 WeakPolarHBondContact CA-SG 3.43Å; C450-C459 HydrophobicContact CB-CB 3.75Å; C450-C459 WeakPolarHBondContact CB-SG 3.28Å; C450-C459 PolarHBondContact N-SG 2.8Å; C450-C459 VanDerWaalsContact N-SG 3.43Å; C450-C459 WeakPolarHBondContact SG-CA 3.2Å; C450-C459 WeakPolarHBondContact SG-CB 3.42Å; C450-C459 CovalentContact SG-SG 2.04Å; C450-C459 PolarHBondContact SG-SG 2.98Å
451	K	84.2	Confident	76.7	Confident	137 Å²	137	60.7 Å²	60.7	60%	0.596	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-74.4	152.6	169.3	-168.9	174.8	-179.3	-178.3	0	109.6	G453 Y454	K451-G453 PolarHBondContact O-N 2.98Å; K451-Y454 HydrophobicContact CB-CD2 4.48Å; K451-Y454 PolarHBondContact O-N 3.31Å
452	D	80.6	Confident	77.4	Confident	157 Å²	157	64.1 Å²	64.1	84%	0.84	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	134	178.2	-57.3	-30.7	0	0	0	111.8
453	G	78.1	Confident	77.5	Confident	33 Å²	33	59.7 Å²	59.7	34%	0.34	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	-3	-172.7	0	0	0	0	0	115.4	K451 E462 V463	K451-G453 PolarHBondContact O-N 2.98Å; G453-E462 CarbonylContact O-C 3.31Å; G453-E462 WeakPolarHBondContact O-CA 3.26Å; G453-V463 PolarHBondContact O-N 3.33Å
454	Y	81.4	Confident	77.9	Confident	76 Å²	76	58.8 Å²	58.8	30%	0.298	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	148.5	177.4	-60.9	-84.2	0	0	0	114	N431 C450 K451 R461 V463	N431-Y454 HydrophobicContact CB-CD1 3.41Å; N431-Y454 VanDerWaalsContact CB-CD1 3.41Å; N431-Y454 HydrophobicContact CB-CD2 3.95Å; N431-Y454 HydrophobicContact CB-CE1 3.55Å; N431-Y454 HydrophobicContact CB-CE2 4.06Å; N431-Y454 HydrophobicContact CB-CG 3.61Å; N431-Y454 VanDerWaalsContact CG-CD1 3.46Å; N431-Y454 WeakPolarHBondContact ND2-CD1 3.38Å; C450-Y454 WeakPolarHBondContact CB-O 3.42Å; K451-Y454 HydrophobicContact CB-CD2 4.48Å; K451-Y454 PolarHBondContact O-N 3.31Å; Y454-R461 CarbonylContact C-O 3.57Å; Y454-R461 VanDerWaalsContact CA-O 3.24Å; Y454-R461 WeakPolarHBondContact CA-O 3.32Å; Y454-V463 VanDerWaalsContact C-CG2 3.4Å
455	G	74.3	Confident	78.2	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	-174.1	-176.9	0	0	0	0	0	112.4	C459 E460 R461	G455-C459 CarbonylContact O-C 3.52Å; G455-C459 VanDerWaalsContact O-C 3.23Å; G455-C459 VanDerWaalsContact O-CA 3.26Å; G455-C459 WeakPolarHBondContact O-CA 2.99Å; G455-E460 PolarHBondContact O-N 3.36Å; G455-R461 PolarHBondContact N-O 3.24Å; G455-R461 WeakPolarHBondContact O-CB 3.38Å; G455-R461 PolarHBondContact O-N 2.84Å
456	G	67.7	Low	78.5	Confident	6 Å²	6	62.7 Å²	62.7	6%	0.062	31%	0.307	C	S	.	.	S	Bend	trans	92.4	172.9	-169	0	0	0	0	0	113	T458 C459 E460	G456-T458 VanDerWaalsContact C-N 3.33Å; G456-T458 PolarHBondContact O-N 2.82Å; G456-C459 PolarHBondContact O-N 3.28Å; G456-E460 VanDerWaalsContact C-OE2 3.3Å; G456-E460 WeakPolarHBondContact CA-OE2 3.23Å
457	V	74.3	Confident	78.6	Confident	36 Å²	36	67.1 Å²	67.1	22%	0.218	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-30.7	-171	178.2	0	0	0	0	111.8	L420 C448 E460	L420-V457 HydrophobicContact CD1-CG1 4.37Å; L420-V457 HydrophobicContact CD2-CG1 3.84Å; C448-V457 WeakPolarHBondContact CB-O 3.42Å; V457-E460 PolarHBondContact N-OE2 3.17Å; V457-E460 VanDerWaalsContact N-OE2 3.1Å
458	T	77.3	Confident	78.4	Confident	30 Å²	30	73.3 Å²	73.3	18%	0.184	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	18.8	176.1	55.4	0	0	0	0	112.4	Q430 G456 E460	Q430-T458 WeakPolarHBondContact CB-O 3.47Å; Q430-T458 PolarHBondContact N-O 2.83Å; G456-T458 VanDerWaalsContact C-N 3.33Å; G456-T458 PolarHBondContact O-N 2.82Å; T458-E460 PolarHBondContact N-OE2 2.83Å; T458-E460 PolarHBondContact O-N 3.01Å; T458-E460 PolarHBondContact OG1-OE2 3.45Å
459	C	82	Confident	78.3	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	38%	0.382	C	S	.	.	S	Bend	trans	62	28.4	-174.1	-50.6	0	0	0	0	113.9	Q430 N431 C450 G455 G456 R461	Q430-C459 WeakPolarHBondContact O-CB 3.31Å; N431-C459 PolarHBondContact ND2-O 2.9Å; C450-C459 WeakPolarHBondContact CA-SG 3.43Å; C450-C459 HydrophobicContact CB-CB 3.75Å; C450-C459 WeakPolarHBondContact CB-SG 3.28Å; C450-C459 PolarHBondContact N-SG 2.8Å; C450-C459 VanDerWaalsContact N-SG 3.43Å; C450-C459 WeakPolarHBondContact SG-CA 3.2Å; C450-C459 WeakPolarHBondContact SG-CB 3.42Å; C450-C459 CovalentContact SG-SG 2.04Å; C450-C459 PolarHBondContact SG-SG 2.98Å; G455-C459 CarbonylContact O-C 3.52Å; G455-C459 VanDerWaalsContact O-C 3.23Å; G455-C459 VanDerWaalsContact O-CA 3.26Å; G455-C459 WeakPolarHBondContact O-CA 2.99Å; G456-C459 PolarHBondContact O-N 3.28Å; C459-R461 VanDerWaalsContact C-N 3.32Å; C459-R461 PolarHBondContact O-N 3.07Å
460	E	78.1	Confident	78.2	Confident	62 Å²	62	72.5 Å²	72.5	29%	0.29	36%	0.364	S	S	.	.			trans	-78.2	-10.3	-173.9	76.7	-68.6	168.5	0	0	114.5	G455 G456 V457 T458	G455-E460 PolarHBondContact O-N 3.36Å; G456-E460 VanDerWaalsContact C-OE2 3.3Å; G456-E460 WeakPolarHBondContact CA-OE2 3.23Å; V457-E460 PolarHBondContact N-OE2 3.17Å; V457-E460 VanDerWaalsContact N-OE2 3.1Å; T458-E460 PolarHBondContact N-OE2 2.83Å; T458-E460 PolarHBondContact O-N 3.01Å; T458-E460 PolarHBondContact OG1-OE2 3.45Å
461	R	76.1	Confident	78.3	Confident	118 Å²	118	71.5 Å²	71.5	45%	0.445	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	145.9	-175.1	-49.5	-178.6	-170.8	-163.2	-6	111.2	Y454 G455 C459	Y454-R461 CarbonylContact C-O 3.57Å; Y454-R461 VanDerWaalsContact CA-O 3.24Å; Y454-R461 WeakPolarHBondContact CA-O 3.32Å; G455-R461 PolarHBondContact N-O 3.24Å; G455-R461 WeakPolarHBondContact O-CB 3.38Å; G455-R461 PolarHBondContact O-N 2.84Å; C459-R461 VanDerWaalsContact C-N 3.32Å; C459-R461 PolarHBondContact O-N 3.07Å
462	E	79.3	Confident	78.2	Confident	151 Å²	151	68.6 Å²	68.6	71%	0.706	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	134.4	165	-165.9	171.6	-170.6	0	0	108.8	G453	G453-E462 CarbonylContact O-C 3.31Å; G453-E462 WeakPolarHBondContact O-CA 3.26Å
463	V	72.9	Confident	78.4	Confident	13 Å²	13	68.8 Å²	68.8	8%	0.079	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-73.9	126.4	-179.5	-178	0	0	0	0	108.7	G453 Y454 K465	G453-V463 PolarHBondContact O-N 3.33Å; Y454-V463 VanDerWaalsContact C-CG2 3.4Å; V463-K465 PolarHBondContact O-N 3.05Å
464	Q	71.4	Confident	78.8	Confident	110 Å²	110	68.9 Å²	68.9	51%	0.514	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-63.2	127.6	170.8	-69.9	-176.7	-40.2	0	0	110.3	G484 I486	Q464-G484 PolarHBondContact N-O 3.03Å; Q464-I486 HydrophobicContact CB-CG2 4.14Å; Q464-I486 WeakPolarHBondContact O-CG2 3.31Å
465	K	80.4	Confident	79	Confident	142 Å²	142	65.8 Å²	65.8	62%	0.617	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-83.6	156.1	176.2	-66.4	-177.2	179.9	177	0	110.9	V463 E467 E479	V463-K465 PolarHBondContact O-N 3.05Å; K465-E467 PolarHBondContact O-N 3.13Å; K465-E479 VanDerWaalsContact CA-OE1 3.22Å; K465-E479 WeakPolarHBondContact CA-OE1 3.3Å; K465-E479 WeakPolarHBondContact CB-OE1 3.41Å
466	C	80.8	Confident	79.7	Confident	46 Å²	46	68.8 Å²	68.8	31%	0.311	34%	0.34	S	S	.	.			trans	-75.7	114.7	170.9	-75.4	0	0	0	0	111.1	C477 R478 E479	C466-C477 VanDerWaalsContact CA-SG 3.51Å; C466-C477 HydrophobicContact CB-CB 3.7Å; C466-C477 WeakPolarHBondContact CB-SG 3.33Å; C466-C477 WeakPolarHBondContact SG-CB 3.4Å; C466-C477 CovalentContact SG-SG 2.04Å; C466-C477 PolarHBondContact SG-SG 2.81Å; C466-R478 VanDerWaalsContact SG-C 3.52Å; C466-R478 PolarHBondContact SG-N 2.83Å; C466-R478 VanDerWaalsContact SG-N 3.35Å; C466-E479 HydrophobicContact CB-CG 4.32Å; C466-E479 PolarHBondContact N-OE1 2.79Å; C466-E479 VanDerWaalsContact N-OE1 3.08Å
467	E	81.4	Confident	80.7	Confident	136 Å²	136	70 Å²	70	64%	0.636	35%	0.347	S	S	*	.			trans	-99	157.8	165.2	-62.4	-176.9	-170.3	0	0	109.3	K465 D469 S470	K465-E467 PolarHBondContact O-N 3.13Å; E467-D469 PolarHBondContact O-N 2.86Å; E467-D469 VanDerWaalsContact O-N 3.13Å; E467-S470 PolarHBondContact N-OG 3.1Å; E467-S470 WeakPolarHBondContact O-CB 3.34Å; E467-S470 PolarHBondContact O-N 2.8Å; E467-S470 PolarHBondContact O-OG 2.79Å; E467-S470 VanDerWaalsContact O-OG 3.07Å
468	D	76.9	Confident	81.2	Confident	146 Å²	146	76 Å²	76	78%	0.781	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.8	-171.9	-65.8	-36.4	0	0	0	113.4	Y473	D468-Y473 HydrophobicContact CB-CD1 4.45Å; D468-Y473 HydrophobicContact CB-CE1 3.77Å; D468-Y473 VanDerWaalsContact O-CD1 3.23Å; D468-Y473 WeakPolarHBondContact O-CD1 3.42Å; D468-Y473 WeakPolarHBondContact O-CE1 3.47Å
469	D	80.8	Confident	81.3	Confident	81 Å²	81	79.9 Å²	79.9	43%	0.433	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-3.5	178.3	71.1	-21.9	0	0	0	113.9	E467 C471 N472 Y473	E467-D469 PolarHBondContact O-N 2.86Å; E467-D469 VanDerWaalsContact O-N 3.13Å; D469-C471 PolarHBondContact O-N 2.87Å; D469-C471 VanDerWaalsContact O-N 3.07Å; D469-N472 WeakPolarHBondContact O-CA 3.36Å; D469-N472 PolarHBondContact O-N 2.91Å; D469-Y473 HydrophobicContact CB-CD2 4.34Å; D469-Y473 HydrophobicContact CB-CE1 4.24Å; D469-Y473 HydrophobicContact CB-CE2 3.58Å
470	S	82.1	Confident	80.8	Confident	19 Å²	19	81.5 Å²	81.5	13%	0.133	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-31.9	-174.2	-77.2	0	0	0	0	113.6	E467 Y498	E467-S470 PolarHBondContact N-OG 3.1Å; E467-S470 WeakPolarHBondContact O-CB 3.34Å; E467-S470 PolarHBondContact O-N 2.8Å; E467-S470 PolarHBondContact O-OG 2.79Å; E467-S470 VanDerWaalsContact O-OG 3.07Å; S470-Y498 WeakPolarHBondContact O-CD1 3.39Å
471	C	84.5	Confident	80.2	Confident	2 Å²	2	81 Å²	81	1%	0.014	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	32.8	173.5	-55.6	0	0	0	0	112.5	D469 Y473 N474 C477 C488 Y498	D469-C471 PolarHBondContact O-N 2.87Å; D469-C471 VanDerWaalsContact O-N 3.07Å; C471-Y473 PolarHBondContact O-N 3.46Å; C471-N474 PolarHBondContact O-N 3.01Å; C471-C477 WeakPolarHBondContact SG-CA 3.37Å; C471-C477 WeakPolarHBondContact SG-CB 3.23Å; C471-C488 WeakPolarHBondContact CA-SG 3.31Å; C471-C488 HydrophobicContact CB-CB 3.74Å; C471-C488 WeakPolarHBondContact CB-SG 3.44Å; C471-C488 VanDerWaalsContact SG-CA 3.51Å; C471-C488 WeakPolarHBondContact SG-CB 3.44Å; C471-C488 CovalentContact SG-SG 2.03Å; C471-C488 PolarHBondContact SG-SG 3.08Å; C471-Y498 CarbonylContact C-O 3.51Å; C471-Y498 WeakPolarHBondContact CA-O 3.17Å
472	N	81.5	Confident	79.5	Confident	77 Å²	77	78.1 Å²	78.1	41%	0.412	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	30.7	-175	-70.5	-84.2	0	0	0	113.8	D469 N474 Y498	D469-N472 WeakPolarHBondContact O-CA 3.36Å; D469-N472 PolarHBondContact O-N 2.91Å; N472-N474 VanDerWaalsContact O-CG 3.28Å; N472-N474 PolarHBondContact O-N 2.98Å; N472-N474 PolarHBondContact O-ND2 3.21Å; N472-Y498 PolarHBondContact N-O 3.42Å; N472-Y498 PolarHBondContact ND2-O 3.07Å
473	Y	84.9	Confident	78.6	Confident	160 Å²	160	72.4 Å²	72.4	63%	0.627	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	9.9	-170.3	-49	-84.1	0	0	0	115.5	D468 D469 C471	D468-Y473 HydrophobicContact CB-CD1 4.45Å; D468-Y473 HydrophobicContact CB-CE1 3.77Å; D468-Y473 VanDerWaalsContact O-CD1 3.23Å; D468-Y473 WeakPolarHBondContact O-CD1 3.42Å; D468-Y473 WeakPolarHBondContact O-CE1 3.47Å; D469-Y473 HydrophobicContact CB-CD2 4.34Å; D469-Y473 HydrophobicContact CB-CE1 4.24Å; D469-Y473 HydrophobicContact CB-CE2 3.58Å; C471-Y473 PolarHBondContact O-N 3.46Å
474	N	86.3	Confident	78.2	Confident	35 Å²	35	72.2 Å²	72.2	19%	0.187	36%	0.362	C	S	.	.	S	Bend	trans	-108.7	16	-175.1	-61.4	-46.4	0	0	0	112.8	C471 N472 Y491 Y494 C499	C471-N474 PolarHBondContact O-N 3.01Å; N472-N474 VanDerWaalsContact O-CG 3.28Å; N472-N474 PolarHBondContact O-N 2.98Å; N472-N474 PolarHBondContact O-ND2 3.21Å; N474-Y491 WeakPolarHBondContact O-CD2 3.47Å; N474-Y491 PolarHBondContact O-N 3.47Å; N474-Y494 HydrophobicContact CB-CD1 3.67Å; N474-Y494 HydrophobicContact CB-CD2 4Å; N474-Y494 HydrophobicContact CB-CE1 4Å; N474-Y494 HydrophobicContact CB-CE2 4.32Å; N474-Y494 HydrophobicContact CB-CG 3.67Å; N474-Y494 VanDerWaalsContact ND2-CE1 3.33Å; N474-Y494 WeakPolarHBondContact ND2-CE1 3.15Å; N474-Y494 WeakPolarHBondContact OD1-CE1 3.22Å; N474-Y494 VanDerWaalsContact OD1-CZ 3.26Å; N474-Y494 PolarHBondContact OD1-OH 2.97Å; N474-C499 HydrophobicContact CB-CB 3.71Å; N474-C499 WeakPolarHBondContact CB-O 3.01Å; N474-C499 PolarHBondContact ND2-O 2.96Å; N474-C499 VanDerWaalsContact ND2-O 3.12Å
475	G	86.2	Confident	78.1	Confident	11 Å²	11	70.1 Å²	70.1	11%	0.113	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	174.6	178.5	0	0	0	0	0	113.1	T489	G475-T489 CarbonylContact C-O 3.58Å; G475-T489 WeakPolarHBondContact CA-O 3.29Å
476	V	89.3	Confident	78.1	Confident	64 Å²	64	63.9 Å²	63.9	39%	0.388	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	120.1	176.7	-178.5	0	0	0	0	109.5	C488 T489 Y491	V476-C488 WeakPolarHBondContact O-CA 3.31Å; V476-T489 PolarHBondContact N-O 3Å; V476-T489 PolarHBondContact O-N 2.78Å; V476-Y491 HydrophobicContact CG2-CE1 3.92Å
477	C	87.6	Confident	78.2	Confident	31 Å²	31	66.7 Å²	66.7	21%	0.209	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	142.7	174.6	-172	0	0	0	0	111.8	C466 C471 E487	C466-C477 VanDerWaalsContact CA-SG 3.51Å; C466-C477 HydrophobicContact CB-CB 3.7Å; C466-C477 WeakPolarHBondContact CB-SG 3.33Å; C466-C477 WeakPolarHBondContact SG-CB 3.4Å; C466-C477 CovalentContact SG-SG 2.04Å; C466-C477 PolarHBondContact SG-SG 2.81Å; C471-C477 WeakPolarHBondContact SG-CA 3.37Å; C471-C477 WeakPolarHBondContact SG-CB 3.23Å; C477-E487 CarbonylContact C-O 3.47Å
478	R	86.4	Confident	78.4	Confident	163 Å²	163	61.3 Å²	61.3	62%	0.615	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.3	141.4	168.7	-67.1	-178.3	172.1	174.9	-2.6	110.3	C466 I486 E487	C466-R478 VanDerWaalsContact SG-C 3.52Å; C466-R478 PolarHBondContact SG-N 2.83Å; C466-R478 VanDerWaalsContact SG-N 3.35Å; R478-I486 CarbonylContact O-C 3.55Å; R478-I486 WeakPolarHBondContact O-CA 3.46Å; R478-E487 PolarHBondContact N-O 3.45Å; R478-E487 PolarHBondContact O-N 2.84Å
479	E	79.1	Confident	79	Confident	110 Å²	110	58 Å²	58	51%	0.514	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	125.4	177.4	-60.2	-179.4	175.5	0	0	110.1	K465 C466	K465-E479 VanDerWaalsContact CA-OE1 3.22Å; K465-E479 WeakPolarHBondContact CA-OE1 3.3Å; K465-E479 WeakPolarHBondContact CB-OE1 3.41Å; C466-E479 HydrophobicContact CB-CG 4.32Å; C466-E479 PolarHBondContact N-OE1 2.79Å; C466-E479 VanDerWaalsContact N-OE1 3.08Å
480	N	69.9	Low	79.2	Confident	35 Å²	35	56 Å²	56	19%	0.187	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	90.5	179.2	-167.7	-38.2	0	0	0	111	E482 Y483 G484 M485 E487	N480-E482 PolarHBondContact O-N 3.34Å; N480-E482 WeakPolarHBondContact OD1-CB 3.46Å; N480-E482 PolarHBondContact OD1-N 2.85Å; N480-Y483 PolarHBondContact O-N 2.91Å; N480-Y483 WeakPolarHBondContact OD1-CD2 3.08Å; N480-G484 PolarHBondContact O-N 3.47Å; N480-M485 CarbonylContact C-O 3.59Å; N480-M485 VanDerWaalsContact CA-O 3.3Å; N480-M485 WeakPolarHBondContact CA-O 2.94Å; N480-M485 HydrophobicContact CB-CG 4.41Å; N480-M485 VanDerWaalsContact CB-O 3.29Å; N480-M485 WeakPolarHBondContact CB-O 3.39Å; N480-M485 PolarHBondContact N-O 3.24Å; N480-M485 PolarHBondContact O-N 3.29Å; N480-E487 PolarHBondContact ND2-OE2 3.45Å
481	A	66.7	Low	79.5	Confident	52 Å²	52	61.1 Å²	61.1	43%	0.43	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-8.5	177.9	0	0	0	0	0	114.5	R409	R409-A481 PolarHBondContact NH2-O 3.19Å
482	E	60.3	Low	79.2	Confident	56 Å²	56	69.9 Å²	69.9	26%	0.262	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-42.4	175.1	-165.7	177.8	-171.2	0	0	111.1	R408 N480	R408-E482 IonicContact CZ-OE1 2.71Å; R408-E482 IonicContact NH1-OE1 3.37Å; R408-E482 PolarHBondContact NH1-OE1 3.33Å; R408-E482 IonicContact NH1-OE2 3.56Å; R408-E482 PolarHBondContact NH1-OE2 2.8Å; N480-E482 PolarHBondContact O-N 3.34Å; N480-E482 WeakPolarHBondContact OD1-CB 3.46Å; N480-E482 PolarHBondContact OD1-N 2.85Å
483	Y	61.9	Low	78.9	Confident	31 Å²	31	68.6 Å²	68.6	12%	0.122	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-15.1	-177.8	-52.2	-82.1	0	0	0	113.8	F406 R408 N480 M485	F406-Y483 HydrophobicContact CB-CD1 4.45Å; R408-Y483 HydrophobicContact CG-CE1 4.44Å; R408-Y483 WeakPolarHBondContact CG-OH 3.42Å; N480-Y483 PolarHBondContact O-N 2.91Å; N480-Y483 WeakPolarHBondContact OD1-CD2 3.08Å; Y483-M485 HydrophobicContact CG-SD 4.49Å
484	G	64.9	Low	78.7	Confident	9 Å²	9	64.2 Å²	64.2	9%	0.093	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	29.5	-177.1	0	0	0	0	0	114.1	Q464 N480	Q464-G484 PolarHBondContact N-O 3.03Å; N480-G484 PolarHBondContact O-N 3.47Å
485	M	68.4	Low	78.4	Confident	66 Å²	66	67 Å²	67	33%	0.325	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	170.5	-174.9	67.8	-169.8	-73.2	0	0	111	N480 Y483	N480-M485 CarbonylContact C-O 3.59Å; N480-M485 VanDerWaalsContact CA-O 3.3Å; N480-M485 WeakPolarHBondContact CA-O 2.94Å; N480-M485 HydrophobicContact CB-CG 4.41Å; N480-M485 VanDerWaalsContact CB-O 3.29Å; N480-M485 WeakPolarHBondContact CB-O 3.39Å; N480-M485 PolarHBondContact N-O 3.24Å; N480-M485 PolarHBondContact O-N 3.29Å; Y483-M485 HydrophobicContact CG-SD 4.49Å
486	I	79.4	Confident	77.8	Confident	12 Å²	12	67.9 Å²	67.9	6%	0.062	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	159	168.9	55.1	166.3	0	0	0	111.7	Q464 R478 Y498	Q464-I486 HydrophobicContact CB-CG2 4.14Å; Q464-I486 WeakPolarHBondContact O-CG2 3.31Å; R478-I486 CarbonylContact O-C 3.55Å; R478-I486 WeakPolarHBondContact O-CA 3.46Å; I486-Y498 HydrophobicContact CD1-CD1 4.08Å; I486-Y498 HydrophobicContact CD1-CE1 3.85Å; I486-Y498 HydrophobicContact CG1-CE1 4.03Å
487	E	82.8	Confident	77.4	Confident	105 Å²	105	70.3 Å²	70.3	49%	0.491	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	122.5	177.5	-176.9	178	173.3	0	0	109.6	C477 R478 N480	C477-E487 CarbonylContact C-O 3.47Å; R478-E487 PolarHBondContact N-O 3.45Å; R478-E487 PolarHBondContact O-N 2.84Å; N480-E487 PolarHBondContact ND2-OE2 3.45Å
488	C	86.4	Confident	77.3	Confident	22 Å²	22	72.6 Å²	72.6	15%	0.149	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.8	-177.5	-68.3	0	0	0	0	112.9	C471 V476 E497	C471-C488 WeakPolarHBondContact CA-SG 3.31Å; C471-C488 HydrophobicContact CB-CB 3.74Å; C471-C488 WeakPolarHBondContact CB-SG 3.44Å; C471-C488 VanDerWaalsContact SG-CA 3.51Å; C471-C488 WeakPolarHBondContact SG-CB 3.44Å; C471-C488 CovalentContact SG-SG 2.03Å; C471-C488 PolarHBondContact SG-SG 3.08Å; V476-C488 WeakPolarHBondContact O-CA 3.31Å; C488-E497 VanDerWaalsContact CB-O 3.28Å; C488-E497 WeakPolarHBondContact CB-O 3.33Å
489	T	89.6	Confident	77.3	Confident	76 Å²	76	64.8 Å²	64.8	47%	0.466	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	101.9	170	-53.5	0	0	0	0	110	G475 V476	G475-T489 CarbonylContact C-O 3.58Å; G475-T489 WeakPolarHBondContact CA-O 3.29Å; V476-T489 PolarHBondContact N-O 3Å; V476-T489 PolarHBondContact O-N 2.78Å
490	C	85.8	Confident	77.5	Confident	39 Å²	39	63.8 Å²	63.8	26%	0.264	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	145.3	-172.7	-52.9	0	0	0	0	114.6	Y494 G496 C499	C490-Y494 WeakPolarHBondContact CB-O 3.16Å; C490-G496 PolarHBondContact SG-O 2.83Å; C490-G496 VanDerWaalsContact SG-O 3.34Å; C490-C499 WeakPolarHBondContact CA-SG 3.01Å; C490-C499 HydrophobicContact CB-CB 3.79Å; C490-C499 WeakPolarHBondContact CB-SG 3.3Å; C490-C499 WeakPolarHBondContact SG-CA 3.33Å; C490-C499 WeakPolarHBondContact SG-CB 3Å; C490-C499 CovalentContact SG-SG 2.04Å; C490-C499 PolarHBondContact SG-SG 2.58Å
491	Y	87.5	Confident	77.7	Confident	127 Å²	127	67.3 Å²	67.3	50%	0.498	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-71	160.8	171.8	-60.9	-43.4	0	0	0	111.7	N474 V476 S493 Y494	N474-Y491 WeakPolarHBondContact O-CD2 3.47Å; N474-Y491 PolarHBondContact O-N 3.47Å; V476-Y491 HydrophobicContact CG2-CE1 3.92Å; Y491-S493 PolarHBondContact O-N 3.42Å; Y491-Y494 PolarHBondContact O-N 3.49Å
492	Q	78.2	Confident	77.9	Confident	186 Å²	186	71.7 Å²	71.7	87%	0.869	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	136.8	177.4	-71.6	-176	-4.9	0	0	111.5
493	S	75.3	Confident	78	Confident	51 Å²	51	71.6 Å²	71.6	36%	0.357	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	8.7	-170.6	-31.4	0	0	0	0	115.9	Y491 K502 D503	Y491-S493 PolarHBondContact O-N 3.42Å; S493-K502 CarbonylContact O-C 3.57Å; S493-K502 VanDerWaalsContact O-CA 3.26Å; S493-K502 WeakPolarHBondContact O-CA 3.14Å; S493-K502 VanDerWaalsContact O-CG 3.26Å; S493-K502 WeakPolarHBondContact O-CG 3.07Å; S493-D503 PolarHBondContact O-N 2.84Å
494	Y	81.7	Confident	77.7	Confident	68 Å²	68	72.2 Å²	72.2	27%	0.267	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.6	172.4	-66.6	-91.8	0	0	0	112.6	N474 C490 Y491 K501 K502	N474-Y494 HydrophobicContact CB-CD1 3.67Å; N474-Y494 HydrophobicContact CB-CD2 4Å; N474-Y494 HydrophobicContact CB-CE1 4Å; N474-Y494 HydrophobicContact CB-CE2 4.32Å; N474-Y494 HydrophobicContact CB-CG 3.67Å; N474-Y494 VanDerWaalsContact ND2-CE1 3.33Å; N474-Y494 WeakPolarHBondContact ND2-CE1 3.15Å; N474-Y494 WeakPolarHBondContact OD1-CE1 3.22Å; N474-Y494 VanDerWaalsContact OD1-CZ 3.26Å; N474-Y494 PolarHBondContact OD1-OH 2.97Å; C490-Y494 WeakPolarHBondContact CB-O 3.16Å; Y491-Y494 PolarHBondContact O-N 3.49Å; Y494-K501 CarbonylContact C-O 3.45Å; Y494-K501 WeakPolarHBondContact CA-O 3.32Å; Y494-K501 WeakPolarHBondContact CD1-O 3.21Å; Y494-K502 HydrophobicContact CD1-CB 4.33Å; Y494-K502 HydrophobicContact CD1-CG 4.47Å; Y494-K502 HydrophobicContact CE1-CB 4.19Å; Y494-K502 HydrophobicContact CE1-CD 4.38Å; Y494-K502 HydrophobicContact CE1-CG 4.16Å
495	E	79.1	Confident	77.3	Confident	93 Å²	93	77.5 Å²	77.5	44%	0.435	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	170.3	179.6	70.2	179.3	-175.4	0	0	110.8	C499 D500 K501	E495-C499 CarbonylContact O-C 3.59Å; E495-C499 WeakPolarHBondContact O-CA 3.36Å; E495-D500 PolarHBondContact O-N 3.14Å; E495-K501 HydrophobicContact CG-CB 3.63Å; E495-K501 HydrophobicContact CG-CD 4.41Å; E495-K501 PolarHBondContact N-O 2.84Å; E495-K501 WeakPolarHBondContact O-CB 3.31Å; E495-K501 PolarHBondContact O-N 3.46Å; E495-K501 VanDerWaalsContact O-N 3.1Å
496	G	72.7	Confident	76.5	Confident	30 Å²	30	80.1 Å²	80.1	31%	0.309	40%	0.404	S	S	.	.	S	Bend	trans	100.4	158.2	-176.1	0	0	0	0	0	113.2	C490 Y498 C499	C490-G496 PolarHBondContact SG-O 2.83Å; C490-G496 VanDerWaalsContact SG-O 3.34Å; G496-Y498 PolarHBondContact O-N 3.09Å; G496-C499 PolarHBondContact O-N 3.15Å; G496-C499 VanDerWaalsContact O-N 3.1Å
497	E	82.6	Confident	75.2	Confident	114 Å²	114	84.9 Å²	84.9	53%	0.533	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.4	-175.8	-172.5	-175.5	150.1	0	0	113.2	C488	C488-E497 VanDerWaalsContact CB-O 3.28Å; C488-E497 WeakPolarHBondContact CB-O 3.33Å
498	Y	85.5	Confident	73.8	Confident	79 Å²	79	86.5 Å²	86.5	31%	0.31	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	18.1	177.8	-54.8	-86.9	0	0	0	111.9	S470 C471 N472 I486 G496 D500	S470-Y498 WeakPolarHBondContact O-CD1 3.39Å; C471-Y498 CarbonylContact C-O 3.51Å; C471-Y498 WeakPolarHBondContact CA-O 3.17Å; N472-Y498 PolarHBondContact N-O 3.42Å; N472-Y498 PolarHBondContact ND2-O 3.07Å; I486-Y498 HydrophobicContact CD1-CD1 4.08Å; I486-Y498 HydrophobicContact CD1-CE1 3.85Å; I486-Y498 HydrophobicContact CG1-CE1 4.03Å; G496-Y498 PolarHBondContact O-N 3.09Å; Y498-D500 PolarHBondContact O-N 3Å
499	C	84.7	Confident	72.2	Confident	0 Å²	0	95.3 Å²	95.3	0%	0	47%	0.466	C	S	.	.	S	Bend	trans	55.3	36.5	-178.3	-45	0	0	0	0	114	N474 C490 E495 G496	N474-C499 HydrophobicContact CB-CB 3.71Å; N474-C499 WeakPolarHBondContact CB-O 3.01Å; N474-C499 PolarHBondContact ND2-O 2.96Å; N474-C499 VanDerWaalsContact ND2-O 3.12Å; C490-C499 WeakPolarHBondContact CA-SG 3.01Å; C490-C499 HydrophobicContact CB-CB 3.79Å; C490-C499 WeakPolarHBondContact CB-SG 3.3Å; C490-C499 WeakPolarHBondContact SG-CA 3.33Å; C490-C499 WeakPolarHBondContact SG-CB 3Å; C490-C499 CovalentContact SG-SG 2.04Å; C490-C499 PolarHBondContact SG-SG 2.58Å; E495-C499 CarbonylContact O-C 3.59Å; E495-C499 WeakPolarHBondContact O-CA 3.36Å; G496-C499 PolarHBondContact O-N 3.15Å; G496-C499 VanDerWaalsContact O-N 3.1Å
500	D	83.5	Confident	70.5	Confident	88 Å²	88	98.6 Å²	98.6	47%	0.471	48%	0.48	S	S	.	.			trans	-80.8	-19.1	-176.3	64	-56.8	0	0	0	113.5	E495 Y498	E495-D500 PolarHBondContact O-N 3.14Å; Y498-D500 PolarHBondContact O-N 3Å
501	K	75.6	Confident	69.2	Low	110 Å²	110	102.6 Å²	102.6	48%	0.478	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	142.1	-175.8	-65.4	158.6	-166.3	164.8	0	110.6	Y494 E495	Y494-K501 CarbonylContact C-O 3.45Å; Y494-K501 WeakPolarHBondContact CA-O 3.32Å; Y494-K501 WeakPolarHBondContact CD1-O 3.21Å; E495-K501 HydrophobicContact CG-CB 3.63Å; E495-K501 HydrophobicContact CG-CD 4.41Å; E495-K501 PolarHBondContact N-O 2.84Å; E495-K501 WeakPolarHBondContact O-CB 3.31Å; E495-K501 PolarHBondContact O-N 3.46Å; E495-K501 VanDerWaalsContact O-N 3.1Å
502	K	70.5	Confident	67.6	Low	143 Å²	143	102.6 Å²	102.6	62%	0.622	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.6	175	-163.5	169.9	-173.4	150.5	0	109.5	S493 Y494 G504	S493-K502 CarbonylContact O-C 3.57Å; S493-K502 VanDerWaalsContact O-CA 3.26Å; S493-K502 WeakPolarHBondContact O-CA 3.14Å; S493-K502 VanDerWaalsContact O-CG 3.26Å; S493-K502 WeakPolarHBondContact O-CG 3.07Å; Y494-K502 HydrophobicContact CD1-CB 4.33Å; Y494-K502 HydrophobicContact CD1-CG 4.47Å; Y494-K502 HydrophobicContact CE1-CB 4.19Å; Y494-K502 HydrophobicContact CE1-CD 4.38Å; Y494-K502 HydrophobicContact CE1-CG 4.16Å; K502-G504 PolarHBondContact O-N 2.86Å; K502-G504 VanDerWaalsContact O-N 3.15Å
503	D	62.1	Low	66.5	Low	55 Å²	55	98.1 Å²	98.1	29%	0.294	49%	0.493	S	S	.	.			trans	-60.2	115.2	-177.1	-179.2	6.1	0	0	0	110.9	S493 K505	S493-D503 PolarHBondContact O-N 2.84Å; D503-K505 VanDerWaalsContact C-N 3.27Å; D503-K505 PolarHBondContact O-N 2.96Å; D503-K505 VanDerWaalsContact OD1-CB 3.26Å; D503-K505 WeakPolarHBondContact OD1-CB 3.43Å; D503-K505 WeakPolarHBondContact OD1-CD 3.31Å; D503-K505 VanDerWaalsContact OD1-CG 3.23Å; D503-K505 WeakPolarHBondContact OD1-CG 2.99Å; D503-K505 PolarHBondContact OD1-N 3.21Å
504	G	55	Low	65.9	Low	44 Å²	44	99.5 Å²	99.5	45%	0.454	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-13	-179.1	0	0	0	0	0	114.6	K502 L506 I507	K502-G504 PolarHBondContact O-N 2.86Å; K502-G504 VanDerWaalsContact O-N 3.15Å; G504-L506 PolarHBondContact O-N 2.85Å; G504-L506 VanDerWaalsContact O-N 3.08Å; G504-I507 PolarHBondContact O-N 3.14Å
505	K	56.1	Low	65	Low	120 Å²	120	101 Å²	101	52%	0.522	52%	0.52	S	S	.	.	H	α-helix	trans	-62.7	-19.2	-173.4	-71.7	167	-175	155.3	0	114.3	D503 I507 R509	D503-K505 VanDerWaalsContact C-N 3.27Å; D503-K505 PolarHBondContact O-N 2.96Å; D503-K505 VanDerWaalsContact OD1-CB 3.26Å; D503-K505 WeakPolarHBondContact OD1-CB 3.43Å; D503-K505 WeakPolarHBondContact OD1-CD 3.31Å; D503-K505 VanDerWaalsContact OD1-CG 3.23Å; D503-K505 WeakPolarHBondContact OD1-CG 2.99Å; D503-K505 PolarHBondContact OD1-N 3.21Å; K505-I507 VanDerWaalsContact C-N 3.29Å; K505-I507 PolarHBondContact O-N 3.31Å; K505-R509 PolarHBondContact O-N 3.04Å
506	L	52.3	Low	64.5	Low	120 Å²	120	99.9 Å²	99.9	63%	0.628	52%	0.522	S	S	*	.	H	α-helix	trans	-68.5	-28.7	172.8	-149.9	77.4	0	0	0	112.3	G504 L510	G504-L506 PolarHBondContact O-N 2.85Å; G504-L506 VanDerWaalsContact O-N 3.08Å; L506-L510 WeakPolarHBondContact O-CD1 3.47Å
507	I	53.3	Low	64.3	Low	113 Å²	113	102.9 Å²	102.9	58%	0.579	53%	0.531	S	S	*	.	H	α-helix	trans	-84.3	-37.3	-179.4	-57.8	178.3	0	0	0	111.2	G504 K505 R509 L510 I511	G504-I507 PolarHBondContact O-N 3.14Å; K505-I507 VanDerWaalsContact C-N 3.29Å; K505-I507 PolarHBondContact O-N 3.31Å; I507-R509 VanDerWaalsContact C-N 3.33Å; I507-R509 PolarHBondContact O-N 2.84Å; I507-L510 WeakPolarHBondContact O-CB 3.48Å; I507-L510 PolarHBondContact O-N 3.14Å; I507-L510 VanDerWaalsContact O-N 3.1Å; I507-I511 HydrophobicContact CG2-CD1 3.87Å
508	E	51.5	Low	63.9	Low	138 Å²	138	101 Å²	101	65%	0.645	53%	0.527	S	S	*	.	H	α-helix	trans	-62	-39	176	-82.5	-172.1	142.6	0	0	112.7	L510 I511 N512	E508-L510 PolarHBondContact O-N 2.82Å; E508-L510 VanDerWaalsContact O-N 3.16Å; E508-I511 PolarHBondContact O-N 3.06Å; E508-I511 VanDerWaalsContact O-N 3.13Å; E508-N512 PolarHBondContact O-N 3.39Å
509	R	54.3	Low	63.5	Low	207 Å²	207	101.3 Å²	101.3	78%	0.781	54%	0.537	S	S	*	.	H	α-helix	trans	-62	-21.7	175.6	-70.6	-176.5	-175.1	-175.3	3.4	113.7	K505 I507	K505-R509 PolarHBondContact O-N 3.04Å; I507-R509 VanDerWaalsContact C-N 3.33Å; I507-R509 PolarHBondContact O-N 2.84Å
510	L	52.9	Low	63.2	Low	145 Å²	145	106 Å²	106	76%	0.759	56%	0.562	S	S	*	*	H	α-helix	trans	-88.4	-13.2	178.7	-73.7	163.4	0	0	0	113.8	L506 I507 E508	L506-L510 WeakPolarHBondContact O-CD1 3.47Å; I507-L510 WeakPolarHBondContact O-CB 3.48Å; I507-L510 PolarHBondContact O-N 3.14Å; I507-L510 VanDerWaalsContact O-N 3.1Å; E508-L510 PolarHBondContact O-N 2.82Å; E508-L510 VanDerWaalsContact O-N 3.16Å
511	I	58.9	Low	63.1	Low	124 Å²	124	105.9 Å²	105.9	64%	0.636	57%	0.565	S	S	*	*	H	α-helix	trans	-111.2	-14.1	-172.4	-60.9	174.9	0	0	0	112.6	I507 E508 P513	I507-I511 HydrophobicContact CG2-CD1 3.87Å; E508-I511 PolarHBondContact O-N 3.06Å; E508-I511 VanDerWaalsContact O-N 3.13Å; I511-P513 WeakPolarHBondContact O-CD 3.46Å; I511-P513 VanDerWaalsContact O-N 3.13Å
512	N	53.8	Low	63.5	Low	126 Å²	126	104.7 Å²	104.7	67%	0.674	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-53.6	118.3	178.3	-93.4	-18.9	0	0	0	112.1	E508 T514	E508-N512 PolarHBondContact O-N 3.39Å; N512-T514 PolarHBondContact O-N 3.26Å
513	P	54.5	Low	64.3	Low	92 Å²	92	101.3 Å²	101.3	60%	0.597	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-71.5	116.4	-176.4	28.1	-33.8	0	0	0	110.1	I511 V518	I511-P513 WeakPolarHBondContact O-CD 3.46Å; I511-P513 VanDerWaalsContact O-N 3.13Å; P513-V518 HydrophobicContact CB-CG2 3.94Å
514	T	62.4	Low	65.4	Low	81 Å²	81	100.8 Å²	100.8	50%	0.497	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-63.9	147.1	166.5	55.9	0	0	0	0	109.7	N512 S516 N517 V518	N512-T514 PolarHBondContact O-N 3.26Å; T514-S516 PolarHBondContact O-N 2.98Å; T514-S516 VanDerWaalsContact O-N 3.13Å; T514-N517 WeakPolarHBondContact O-CB 3.45Å; T514-N517 PolarHBondContact O-N 3.41Å; T514-N517 PolarHBondContact OG1-ND2 3.24Å; T514-V518 PolarHBondContact O-N 2.88Å
515	S	63.2	Low	67	Low	100 Å²	100	106 Å²	106	70%	0.699	58%	0.576	S	S	*	*	H	α-helix	trans	-53.8	-35.8	-178.1	49.9	0	0	0	0	113.1	N517 V518 V519	S515-N517 PolarHBondContact O-N 3.28Å; S515-V518 PolarHBondContact O-N 2.84Å; S515-V519 WeakPolarHBondContact O-CG2 3.24Å; S515-V519 PolarHBondContact O-N 2.03Å; S515-V519 VanDerWaalsContact O-N 3.1Å
516	S	69.6	Low	68.6	Low	68 Å²	68	104.1 Å²	104.1	48%	0.476	57%	0.574	S	S	.	*	H	α-helix	trans	-61.4	-40.3	175.5	-170.2	0	0	0	0	113.1	T514 V518 V519 N520	T514-S516 PolarHBondContact O-N 2.98Å; T514-S516 VanDerWaalsContact O-N 3.13Å; S516-V518 PolarHBondContact O-N 3.49Å; S516-V519 PolarHBondContact O-N 3.04Å; S516-N520 VanDerWaalsContact O-CG 3.3Å; S516-N520 PolarHBondContact O-N 2.77Å; S516-N520 PolarHBondContact O-ND2 2.86Å
517	N	68.8	Low	70.4	Confident	94 Å²	94	103.2 Å²	103.2	50%	0.503	57%	0.569	S	S	.	*	H	α-helix	trans	-66.1	-39.4	178.5	-71.4	-6.9	0	0	0	111.7	T514 S515 N520 V521	T514-N517 WeakPolarHBondContact O-CB 3.45Å; T514-N517 PolarHBondContact O-N 3.41Å; T514-N517 PolarHBondContact OG1-ND2 3.24Å; S515-N517 PolarHBondContact O-N 3.28Å; N517-N520 PolarHBondContact O-N 2.76Å; N517-V521 WeakPolarHBondContact O-CG2 2.91Å; N517-V521 PolarHBondContact O-N 2.87Å; N517-V521 VanDerWaalsContact O-N 3.12Å
518	V	72.7	Confident	72.1	Confident	74 Å²	74	99.5 Å²	99.5	45%	0.448	56%	0.558	S	S	.	*	H	α-helix	trans	-64.9	-45.9	176.8	-175.4	0	0	0	0	110.9	P513 T514 S515 S516 N520 V521 V522	P513-V518 HydrophobicContact CB-CG2 3.94Å; T514-V518 PolarHBondContact O-N 2.88Å; S515-V518 PolarHBondContact O-N 2.84Å; S516-V518 PolarHBondContact O-N 3.49Å; V518-N520 PolarHBondContact O-N 2.83Å; V518-V521 PolarHBondContact O-N 3.24Å; V518-V522 HydrophobicContact CG1-CG2 4.49Å; V518-V522 WeakPolarHBondContact O-CG2 3.48Å; V518-V522 PolarHBondContact O-N 3.31Å
519	V	77.7	Confident	73.8	Confident	85 Å²	85	99 Å²	99	52%	0.515	55%	0.554	S	S	.	*	H	α-helix	trans	-59.5	-47.2	177.5	172.5	0	0	0	0	111.1	S515 S516 V521 V522 V523	S515-V519 WeakPolarHBondContact O-CG2 3.24Å; S515-V519 PolarHBondContact O-N 2.03Å; S515-V519 VanDerWaalsContact O-N 3.1Å; S516-V519 PolarHBondContact O-N 3.04Å; V519-V521 VanDerWaalsContact C-N 3.33Å; V519-V521 PolarHBondContact O-N 2.85Å; V519-V522 PolarHBondContact O-N 2.03Å; V519-V523 HydrophobicContact CG1-CG2 4.15Å; V519-V523 WeakPolarHBondContact O-CB 3.44Å; V519-V523 VanDerWaalsContact O-CG2 3.31Å; V519-V523 WeakPolarHBondContact O-CG2 3.37Å; V519-V523 PolarHBondContact O-N 2.88Å
520	N	79.4	Confident	75.3	Confident	99 Å²	99	93.8 Å²	93.8	53%	0.529	54%	0.541	S	S	.	.	H	α-helix	trans	-61.8	-38.7	179.8	-71.3	-23.9	0	0	0	112.8	S516 N517 V518 G524	S516-N520 VanDerWaalsContact O-CG 3.3Å; S516-N520 PolarHBondContact O-N 2.77Å; S516-N520 PolarHBondContact O-ND2 2.86Å; N517-N520 PolarHBondContact O-N 2.76Å; V518-N520 PolarHBondContact O-N 2.83Å; N520-G524 PolarHBondContact O-N 3.46Å
521	V	80	Confident	76.9	Confident	86 Å²	86	92.8 Å²	92.8	52%	0.521	53%	0.534	S	S	.	.	H	α-helix	trans	-65.7	-45.5	174.9	170.6	0	0	0	0	111.3	N517 V518 V519 G524 F525	N517-V521 WeakPolarHBondContact O-CG2 2.91Å; N517-V521 PolarHBondContact O-N 2.87Å; N517-V521 VanDerWaalsContact O-N 3.12Å; V518-V521 PolarHBondContact O-N 3.24Å; V519-V521 VanDerWaalsContact C-N 3.33Å; V519-V521 PolarHBondContact O-N 2.85Å; V521-G524 PolarHBondContact O-N 3.19Å; V521-F525 HydrophobicContact CG1-CD2 3.8Å; V521-F525 HydrophobicContact CG1-CE2 3.75Å; V521-F525 VanDerWaalsContact O-CD2 3.3Å; V521-F525 WeakPolarHBondContact O-CD2 3.25Å; V521-F525 PolarHBondContact O-N 3.43Å
522	V	84.3	Confident	78.1	Confident	85 Å²	85	91.4 Å²	91.4	52%	0.515	53%	0.528	S	S	.	.	H	α-helix	trans	-63.5	-45.5	178.1	172.8	0	0	0	0	111.3	V518 V519 G524 F525 V526	V518-V522 HydrophobicContact CG1-CG2 4.49Å; V518-V522 WeakPolarHBondContact O-CG2 3.48Å; V518-V522 PolarHBondContact O-N 3.31Å; V519-V522 PolarHBondContact O-N 2.03Å; V522-G524 VanDerWaalsContact C-N 3.32Å; V522-G524 PolarHBondContact O-N 2.88Å; V522-F525 PolarHBondContact O-N 3.44Å; V522-V526 HydrophobicContact CG1-CG2 4.45Å; V522-V526 WeakPolarHBondContact O-CG2 3.17Å; V522-V526 PolarHBondContact O-N 2.8Å
523	V	86.7	Confident	79.4	Confident	71 Å²	71	90.9 Å²	90.9	43%	0.43	52%	0.522	S	S	.	.	H	α-helix	trans	-59.4	-43.6	175.4	170.3	0	0	0	0	110.9	V519 F525 V526 L527	V519-V523 HydrophobicContact CG1-CG2 4.15Å; V519-V523 WeakPolarHBondContact O-CB 3.44Å; V519-V523 VanDerWaalsContact O-CG2 3.31Å; V519-V523 WeakPolarHBondContact O-CG2 3.37Å; V519-V523 PolarHBondContact O-N 2.88Å; V523-F525 PolarHBondContact O-N 3.28Å; V523-V526 PolarHBondContact O-N 3.27Å; V523-L527 HydrophobicContact CG1-CD1 3.76Å; V523-L527 HydrophobicContact CG1-CG 4.27Å; V523-L527 WeakPolarHBondContact O-CB 3.48Å; V523-L527 WeakPolarHBondContact O-CG 3.4Å; V523-L527 PolarHBondContact O-N 2.82Å
524	G	86	Confident	80.7	Confident	44 Å²	44	92.6 Å²	92.6	45%	0.454	53%	0.526	S	S	.	.	H	α-helix	trans	-59.4	-43.7	175.1	0	0	0	0	0	113.3	N520 V521 V522 G528	N520-G524 PolarHBondContact O-N 3.46Å; V521-G524 PolarHBondContact O-N 3.19Å; V522-G524 VanDerWaalsContact C-N 3.32Å; V522-G524 PolarHBondContact O-N 2.88Å; G524-G528 PolarHBondContact O-N 3.42Å
525	F	88.7	Confident	81.6	Confident	155 Å²	155	92.9 Å²	92.9	68%	0.68	53%	0.531	S	S	*	.	H	α-helix	trans	-65.2	-42.8	175.3	-86.7	-68.9	0	0	0	112.7	V521 V522 V523 G528 F529	V521-F525 HydrophobicContact CG1-CD2 3.8Å; V521-F525 HydrophobicContact CG1-CE2 3.75Å; V521-F525 VanDerWaalsContact O-CD2 3.3Å; V521-F525 WeakPolarHBondContact O-CD2 3.25Å; V521-F525 PolarHBondContact O-N 3.43Å; V522-F525 PolarHBondContact O-N 3.44Å; V523-F525 PolarHBondContact O-N 3.28Å; F525-G528 PolarHBondContact O-N 3.5Å; F525-F529 WeakPolarHBondContact O-CB 3.17Å; F525-F529 PolarHBondContact O-N 3.44Å
526	V	89	Confident	82.1	Confident	79 Å²	79	95 Å²	95	48%	0.479	53%	0.527	S	S	.	.	H	α-helix	trans	-64.5	-46.5	178.8	172.3	0	0	0	0	111.3	V522 V523 G528 F529 L530	V522-V526 HydrophobicContact CG1-CG2 4.45Å; V522-V526 WeakPolarHBondContact O-CG2 3.17Å; V522-V526 PolarHBondContact O-N 2.8Å; V523-V526 PolarHBondContact O-N 3.27Å; V526-G528 PolarHBondContact O-N 2.67Å; V526-F529 PolarHBondContact O-N 2.84Å; V526-L530 HydrophobicContact CG1-CD1 4.05Å; V526-L530 WeakPolarHBondContact O-CG 3.08Å; V526-L530 PolarHBondContact O-N 2.86Å
527	L	91	Very high	81.9	Confident	102 Å²	102	93.5 Å²	93.5	53%	0.534	52%	0.522	S	S	.	.	H	α-helix	trans	-63	-42.2	176.7	-69.7	173.7	0	0	0	111.8	V523 F529 L530 M531	V523-L527 HydrophobicContact CG1-CD1 3.76Å; V523-L527 HydrophobicContact CG1-CG 4.27Å; V523-L527 WeakPolarHBondContact O-CB 3.48Å; V523-L527 WeakPolarHBondContact O-CG 3.4Å; V523-L527 PolarHBondContact O-N 2.82Å; L527-F529 VanDerWaalsContact C-N 3.34Å; L527-F529 PolarHBondContact O-N 3.26Å; L527-L530 PolarHBondContact O-N 2.64Å; L527-M531 WeakPolarHBondContact O-CB 3.41Å; L527-M531 WeakPolarHBondContact O-CG 3.32Å; L527-M531 PolarHBondContact O-N 3.34Å
528	G	88.6	Confident	81.6	Confident	34 Å²	34	91.3 Å²	91.3	35%	0.351	52%	0.522	S	S	.	.	H	α-helix	trans	-60.7	-41	174.6	0	0	0	0	0	112.8	G524 F525 V526 M531 L532	G524-G528 PolarHBondContact O-N 3.42Å; F525-G528 PolarHBondContact O-N 3.5Å; V526-G528 PolarHBondContact O-N 2.67Å; G528-M531 PolarHBondContact O-N 3.31Å; G528-L532 WeakPolarHBondContact O-CG 3.08Å; G528-L532 PolarHBondContact O-N 2.82Å
529	F	87.4	Confident	81	Confident	129 Å²	129	90.6 Å²	90.6	57%	0.566	52%	0.524	S	S	*	.	H	α-helix	trans	-69.9	-39.4	178.6	-155.8	-96.1	0	0	0	112.4	F525 V526 L527 L532 M533	F525-F529 WeakPolarHBondContact O-CB 3.17Å; F525-F529 PolarHBondContact O-N 3.44Å; V526-F529 PolarHBondContact O-N 2.84Å; L527-F529 VanDerWaalsContact C-N 3.34Å; L527-F529 PolarHBondContact O-N 3.26Å; F529-L532 PolarHBondContact O-N 3.07Å; F529-M533 HydrophobicContact CD1-CE 4.33Å; F529-M533 HydrophobicContact CD1-CG 4.24Å; F529-M533 HydrophobicContact CE1-CE 3.44Å; F529-M533 VanDerWaalsContact CE1-CE 3.44Å; F529-M533 HydrophobicContact CE1-CG 4.23Å; F529-M533 HydrophobicContact CZ-CE 3.74Å; F529-M533 WeakPolarHBondContact O-CG 3.47Å; F529-M533 PolarHBondContact O-N 3.03Å
530	L	86.5	Confident	80.1	Confident	97 Å²	97	89.6 Å²	89.6	51%	0.508	53%	0.525	S	S	.	.	H	α-helix	trans	-63.4	-43.9	173.6	-72.5	169.9	0	0	0	111.9	V526 L527 L532 M533 L534	V526-L530 HydrophobicContact CG1-CD1 4.05Å; V526-L530 WeakPolarHBondContact O-CG 3.08Å; V526-L530 PolarHBondContact O-N 2.86Å; L527-L530 PolarHBondContact O-N 2.64Å; L530-L532 PolarHBondContact O-N 3.11Å; L530-M533 PolarHBondContact O-N 2.81Å; L530-L534 WeakPolarHBondContact O-CG 3.36Å; L530-L534 PolarHBondContact O-N 3.28Å
531	M	86.3	Confident	79.3	Confident	123 Å²	123	89.9 Å²	89.9	61%	0.606	53%	0.53	S	S	*	.	H	α-helix	trans	-61.7	-41.4	175.4	-75.2	-69.2	-77.1	0	0	112.2	L527 G528 L534 C535	L527-M531 WeakPolarHBondContact O-CB 3.41Å; L527-M531 WeakPolarHBondContact O-CG 3.32Å; L527-M531 PolarHBondContact O-N 3.34Å; G528-M531 PolarHBondContact O-N 3.31Å; M531-L534 PolarHBondContact O-N 2.84Å; M531-C535 WeakPolarHBondContact O-CB 3.33Å; M531-C535 PolarHBondContact O-N 2.04Å; M531-C535 PolarHBondContact O-SG 3.03Å
532	L	83.3	Confident	78.2	Confident	96 Å²	96	91.9 Å²	91.9	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-62.3	-44.9	174.1	-77.2	163	0	0	0	111.8	G528 F529 L530 L534 C535 F536	G528-L532 WeakPolarHBondContact O-CG 3.08Å; G528-L532 PolarHBondContact O-N 2.82Å; F529-L532 PolarHBondContact O-N 3.07Å; L530-L532 PolarHBondContact O-N 3.11Å; L532-L534 PolarHBondContact O-N 3.41Å; L532-C535 PolarHBondContact O-N 2.87Å; L532-F536 HydrophobicContact CD2-CD2 4.34Å; L532-F536 HydrophobicContact CD2-CE2 3.79Å; L532-F536 VanDerWaalsContact O-CD2 3.28Å; L532-F536 WeakPolarHBondContact O-CD2 3.29Å; L532-F536 PolarHBondContact O-N 2.82Å
533	M	81.7	Confident	77	Confident	114 Å²	114	93.3 Å²	93.3	56%	0.562	53%	0.534	S	S	*	.	H	α-helix	trans	-62.8	-39	177.9	-75.5	-65.1	180	0	0	112.7	F529 L530 G537	F529-M533 HydrophobicContact CD1-CE 4.33Å; F529-M533 HydrophobicContact CD1-CG 4.24Å; F529-M533 HydrophobicContact CE1-CE 3.44Å; F529-M533 VanDerWaalsContact CE1-CE 3.44Å; F529-M533 HydrophobicContact CE1-CG 4.23Å; F529-M533 HydrophobicContact CZ-CE 3.74Å; F529-M533 WeakPolarHBondContact O-CG 3.47Å; F529-M533 PolarHBondContact O-N 3.03Å; L530-M533 PolarHBondContact O-N 2.81Å; M533-G537 WeakPolarHBondContact O-CA 3.03Å; M533-G537 PolarHBondContact O-N 3.16Å
534	L	81.8	Confident	75.6	Confident	129 Å²	129	100.5 Å²	100.5	68%	0.675	55%	0.553	S	S	*	*	H	α-helix	trans	-65.1	-45.4	174.3	-71.5	168.6	0	0	0	111.8	L530 M531 L532 G538	L530-L534 WeakPolarHBondContact O-CG 3.36Å; L530-L534 PolarHBondContact O-N 3.28Å; M531-L534 PolarHBondContact O-N 2.84Å; L532-L534 PolarHBondContact O-N 3.41Å; L534-G538 PolarHBondContact O-N 3.46Å
535	C	80.7	Confident	74.2	Confident	87 Å²	87	108.9 Å²	108.9	59%	0.588	57%	0.571	S	S	*	*	H	α-helix	trans	-63.6	-44.8	179.6	-67.7	0	0	0	0	112.7	M531 L532	M531-C535 WeakPolarHBondContact O-CB 3.33Å; M531-C535 PolarHBondContact O-N 2.04Å; M531-C535 PolarHBondContact O-SG 3.03Å; L532-C535 PolarHBondContact O-N 2.87Å
536	F	74.5	Confident	72.6	Confident	144 Å²	144	111.2 Å²	111.2	63%	0.632	58%	0.576	S	S	*	*	H	α-helix	trans	-80.3	-30.1	-179.8	-72.8	-66.3	0	0	0	113.4	L532 A539 A540	L532-F536 HydrophobicContact CD2-CD2 4.34Å; L532-F536 HydrophobicContact CD2-CE2 3.79Å; L532-F536 VanDerWaalsContact O-CD2 3.28Å; L532-F536 WeakPolarHBondContact O-CD2 3.29Å; L532-F536 PolarHBondContact O-N 2.82Å; F536-A539 PolarHBondContact O-N 2.85Å; F536-A540 PolarHBondContact O-N 2.94Å; F536-A540 VanDerWaalsContact O-N 3.08Å
537	G	64.4	Low	71	Confident	36 Å²	36	117.3 Å²	117.3	37%	0.371	59%	0.59	S	S	.	*	H	α-helix	trans	-60.3	-45.5	173.6	0	0	0	0	0	112.6	M533 A539 A540 V541	M533-G537 WeakPolarHBondContact O-CA 3.03Å; M533-G537 PolarHBondContact O-N 3.16Å; G537-A539 PolarHBondContact O-N 2.97Å; G537-A540 PolarHBondContact O-N 3.01Å; G537-V541 WeakPolarHBondContact O-CG2 2.79Å; G537-V541 PolarHBondContact O-N 2.93Å; G537-V541 VanDerWaalsContact O-N 3.14Å
538	G	62.2	Low	69.4	Low	48 Å²	48	123.6 Å²	123.6	50%	0.495	61%	0.607	S	S	.	*	H	α-helix	trans	-59.7	-43.4	176.3	0	0	0	0	0	113.2	L534 A540 V541 H542	L534-G538 PolarHBondContact O-N 3.46Å; G538-A540 PolarHBondContact O-N 3.32Å; G538-V541 PolarHBondContact O-N 3.11Å; G538-H542 PolarHBondContact O-N 3.2Å; G538-H542 VanDerWaalsContact O-N 3.12Å
539	A	60.5	Low	67.7	Low	60 Å²	60	133.2 Å²	133.2	50%	0.496	63%	0.632	S	S	.	*	H	α-helix	trans	-63.5	-41.4	177.5	0	0	0	0	0	112.5	F536 G537 H542 H543	F536-A539 PolarHBondContact O-N 2.85Å; G537-A539 PolarHBondContact O-N 2.97Å; A539-H542 PolarHBondContact O-N 3.34Å; A539-H543 PolarHBondContact O-N 3.03Å
540	A	59.2	Low	65.7	Low	64 Å²	64	131.1 Å²	131.1	53%	0.529	65%	0.647	S	S	.	*	H	α-helix	trans	-64.3	-39.6	178.2	0	0	0	0	0	112.7	F536 G537 G538 R544	F536-A540 PolarHBondContact O-N 2.94Å; F536-A540 VanDerWaalsContact O-N 3.08Å; G537-A540 PolarHBondContact O-N 3.01Å; G538-A540 PolarHBondContact O-N 3.32Å; A540-R544 PolarHBondContact O-N 2.93Å
541	V	62	Low	63.5	Low	104 Å²	104	130 Å²	130	63%	0.63	66%	0.659	S	S	*	*	H	α-helix	trans	-68.5	-43	177.5	176.8	0	0	0	0	111.3	G537 G538 H543 R544	G537-V541 WeakPolarHBondContact O-CG2 2.79Å; G537-V541 PolarHBondContact O-N 2.93Å; G537-V541 VanDerWaalsContact O-N 3.14Å; G538-V541 PolarHBondContact O-N 3.11Å; V541-H543 PolarHBondContact O-N 3.1Å; V541-R544 PolarHBondContact O-N 3.04Å
542	H	58.2	Low	61.5	Low	128 Å²	128	133.1 Å²	133.1	59%	0.593	67%	0.672	S	S	*	*	H	α-helix	trans	-65.5	-40.3	179.2	-165.8	-98.5	0	0	0	112.2	G538 A539 R544 R545	G538-H542 PolarHBondContact O-N 3.2Å; G538-H542 VanDerWaalsContact O-N 3.12Å; A539-H542 PolarHBondContact O-N 3.34Å; H542-R544 VanDerWaalsContact C-N 3.29Å; H542-R544 PolarHBondContact O-N 3.34Å; H542-R545 PolarHBondContact O-N 2Å
543	H	57.9	Low	59.6	Low	116 Å²	116	133 Å²	133	54%	0.537	68%	0.679	S	S	.	*	H	α-helix	trans	-68.8	-25.2	179.9	-156.9	-65.1	0	0	0	113.4	A539 V541	A539-H543 PolarHBondContact O-N 3.03Å; V541-H543 PolarHBondContact O-N 3.1Å
544	R	57.9	Low	57.7	Low	221 Å²	221	136.9 Å²	136.9	83%	0.834	69%	0.689	S	S	*	*	H	α-helix	trans	-73.3	-25.3	175.4	-116.5	177.1	-179.2	168.4	0.7	113.5	A540 V541 H542	A540-R544 PolarHBondContact O-N 2.93Å; V541-R544 PolarHBondContact O-N 3.04Å; H542-R544 VanDerWaalsContact C-N 3.29Å; H542-R544 PolarHBondContact O-N 3.34Å
545	R	56.7	Low	55.8	Low	220 Å²	220	138 Å²	138	83%	0.83	69%	0.691	S	S	*	*	H	α-helix	trans	-77.3	-27.2	178.5	-96.3	-176.9	172.7	174.8	-1.4	114.5	H542	H542-R545 PolarHBondContact O-N 2Å
546	R	55	Low	54	Low	204 Å²	204	138.5 Å²	138.5	77%	0.77	70%	0.695	S	S	*	*	H	α-helix	trans	-76.7	-20.2	-178.9	-97.4	-174.6	175.9	174.8	-0.1	115.5	R548	R546-R548 VanDerWaalsContact C-N 3.26Å; R546-R548 PolarHBondContact O-N 3.46Å
547	R	55.2	Low	52.4	Low	207 Å²	207	136.4 Å²	136.4	78%	0.781	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	11.2	-176.3	-74.1	-170.2	175.3	170.6	0.7	116
548	R	57	Low	51.2	Low	234 Å²	234	145.7 Å²	145.7	88%	0.883	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	9.6	-177.3	-78.5	-169.4	176.7	177.2	-1	115.8	R546	R546-R548 VanDerWaalsContact C-N 3.26Å; R546-R548 PolarHBondContact O-N 3.46Å
549	R	53.6	Low	50.1	Low	237 Å²	237	148.4 Å²	148.4	89%	0.894	74%	0.742	S	S	*	*	S	Bend	trans	-123.3	123.3	168	-71.7	-179.6	175	149.1	-1.9	107.9
550	G	44.2	Very low	49.1	Very low	85 Å²	85	150.6 Å²	150.6	88%	0.876	75%	0.753	S	S	*	*			trans	-90.5	-171.4	-169.5	0	0	0	0	0	113.6
551	G	40.3	Very low	48.4	Very low	74 Å²	74	152.4 Å²	152.4	76%	0.763	76%	0.758	S	S	*	*			trans	126.6	118.4	174	0	0	0	0	0	113.3
552	H	46.1	Very low	47.5	Very low	188 Å²	188	155.6 Å²	155.6	87%	0.87	76%	0.763	S	S	*	*			trans	-25.8	159	153.6	-74.4	-109.8	0	0	0	116.3
553	S	41.7	Very low	46.9	Very low	93 Å²	93	154.7 Å²	154.7	65%	0.65	77%	0.772	S	S	*	*			cis	-175.8	179.6	-11	50.3	0	0	0	0	108.2
554	Y	42.1	Very low	46.3	Very low	195 Å²	195	153.7 Å²	153.7	77%	0.765	77%	0.774	S	S	*	*			trans	78.3	94.4	163.1	-113.5	-105.4	0	0	0	118.8
555	E	42.2	Very low	45.6	Very low	154 Å²	154	145.2 Å²	145.2	72%	0.72	75%	0.751	S	S	*	*				79.2	145.5	116.7	-147.9	170.2	-114.8	0	0	122.9
556	S	42.3	Very low	45.2	Very low	96 Å²	96	140.7 Å²	140.7	67%	0.671	74%	0.742	S	S	*	*			trans	79.9	92.5	158	-138.5	0	0	0	0	121.3
557	S	41	Very low	44.8	Very low	101 Å²	101	135.1 Å²	135.1	71%	0.706	73%	0.734	S	S	*	*				60	68.4	115.3	-48.3	0	0	0	0	120.8
558	Y	40.2	Very low	44.4	Very low	231 Å²	231	128.2 Å²	128.2	91%	0.906	72%	0.717	S	S	*	*			trans	-154.5	58.1	145.2	-103.5	-71.1	0	0	0	111.5
559	A	37.9	Very low	43.9	Very low	105 Å²	105	126.4 Å²	126.4	87%	0.868	71%	0.711	S	S	*	*			trans	-137	54.5	-174.1	0	0	0	0	0	113.6
560	S	40.4	Very low	43.6	Very low	105 Å²	105	118.1 Å²	118.1	73%	0.734	69%	0.693	S	S	*	*	S	Bend	trans	-131.7	-7.1	178	56.4	0	0	0	0	115.5
561	T	43.2	Very low	43.8	Very low	102 Å²	102	117 Å²	117	63%	0.626	67%	0.672	S	S	*	*	S	Bend	trans	-108.4	-7.2	-170.9	12	0	0	0	0	116.3	T564	T561-T564 PolarHBondContact O-OG1 2.94Å
562	F	44.3	Very low	44.3	Very low	171 Å²	171	117.5 Å²	117.5	75%	0.75	66%	0.66	S	S	*	*	S	Bend	trans	-93.9	-24.9	-174.5	-140	-99.5	0	0	0	114.7	A565	F562-A565 PolarHBondContact O-N 3.32Å
563	S	45.6	Very low	44.2	Very low	110 Å²	110	115.4 Å²	115.4	77%	0.769	65%	0.649	S	S	*	*	S	Bend	trans	-75.1	-23.1	179.6	-57.8	0	0	0	0	113.7
564	T	44.3	Very low	44.5	Very low	95 Å²	95	114.8 Å²	114.8	58%	0.583	64%	0.644	S	S	*	*	H	α-helix	trans	-78.1	-23.2	175.5	28.6	0	0	0	0	113.3	T561 I566 S568	T561-T564 PolarHBondContact O-OG1 2.94Å; T564-I566 PolarHBondContact O-N 3.38Å; T564-S568 PolarHBondContact O-N 2.86Å; T564-S568 PolarHBondContact O-OG 2.9Å
565	A	44.7	Very low	44.9	Very low	42 Å²	42	108 Å²	108	35%	0.347	62%	0.623	S	S	.	*	H	α-helix	trans	-73.5	-23.1	-178.4	0	0	0	0	0	114.5	F562 S568	F562-A565 PolarHBondContact O-N 3.32Å; A565-S568 PolarHBondContact O-OG 3.47Å; A565-S568 VanDerWaalsContact O-OG 3.06Å
566	I	48.1	Very low	45.2	Very low	125 Å²	125	103.1 Å²	103.1	64%	0.641	61%	0.609	S	S	*	*	H	α-helix	trans	-89.1	-35.8	178.1	-64.1	178.2	0	0	0	110.9	T564 S568 R569 A570	T564-I566 PolarHBondContact O-N 3.38Å; I566-S568 VanDerWaalsContact C-N 3.35Å; I566-S568 PolarHBondContact O-N 2.79Å; I566-R569 PolarHBondContact O-N 3.34Å; I566-A570 PolarHBondContact O-N 2.95Å
567	S	46.1	Very low	45.5	Very low	87 Å²	87	102.9 Å²	102.9	61%	0.608	60%	0.599	S	S	*	*	H	α-helix	trans	-62	-40.8	172.3	-174.4	0	0	0	0	112.1	R569 S571	S567-R569 VanDerWaalsContact C-N 3.28Å; S567-R569 PolarHBondContact O-N 3.16Å; S567-S571 PolarHBondContact O-N 2.93Å
568	S	46	Very low	45.9	Very low	62 Å²	62	102 Å²	102	43%	0.434	59%	0.593	S	S	.	*	H	α-helix	trans	-66.5	-24.1	177.7	58.9	0	0	0	0	114.3	T564 A565 I566 S571	T564-S568 PolarHBondContact O-N 2.86Å; T564-S568 PolarHBondContact O-OG 2.9Å; A565-S568 PolarHBondContact O-OG 3.47Å; A565-S568 VanDerWaalsContact O-OG 3.06Å; I566-S568 VanDerWaalsContact C-N 3.35Å; I566-S568 PolarHBondContact O-N 2.79Å; S568-S571 PolarHBondContact O-OG 2.94Å
569	R	48.3	Very low	46.4	Very low	197 Å²	197	98.2 Å²	98.2	74%	0.743	58%	0.577	S	S	*	*	H	α-helix	trans	-91.5	-29.8	-179.3	-76.7	-175.4	167.8	-169.1	-3.3	113.7	I566 S567 S571 T572 F573	I566-R569 PolarHBondContact O-N 3.34Å; S567-R569 VanDerWaalsContact C-N 3.28Å; S567-R569 PolarHBondContact O-N 3.16Å; R569-S571 VanDerWaalsContact C-N 3.33Å; R569-T572 WeakPolarHBondContact CA-OG1 3.45Å; R569-T572 PolarHBondContact O-N 2.71Å; R569-T572 PolarHBondContact O-OG1 2.77Å; R569-F573 PolarHBondContact O-N 3.15Å
570	A	45.7	Very low	46.8	Very low	63 Å²	63	97.1 Å²	97.1	52%	0.521	57%	0.568	S	S	.	*	H	α-helix	trans	-60.7	-43.4	168.1	0	0	0	0	0	111.4	I566 T572 F573 S574	I566-A570 PolarHBondContact O-N 2.95Å; A570-T572 VanDerWaalsContact C-N 3.3Å; A570-T572 PolarHBondContact O-N 3.18Å; A570-F573 PolarHBondContact O-N 2.93Å; A570-F573 VanDerWaalsContact O-N 3.17Å; A570-S574 PolarHBondContact O-N 3.18Å
571	S	50.1	Low	47.2	Very low	61 Å²	61	101.1 Å²	101.1	43%	0.427	57%	0.572	S	S	.	*	H	α-helix	trans	-62.2	-35.1	176.5	74	0	0	0	0	112.6	S567 S568 R569 F573 T575	S567-S571 PolarHBondContact O-N 2.93Å; S568-S571 PolarHBondContact O-OG 2.94Å; R569-S571 VanDerWaalsContact C-N 3.33Å; S571-F573 PolarHBondContact O-N 2.87Å; S571-T575 VanDerWaalsContact O-CB 3.23Å; S571-T575 WeakPolarHBondContact O-CB 3.15Å; S571-T575 PolarHBondContact O-N 3.25Å; S571-T575 PolarHBondContact O-OG1 3.38Å
572	T	48.9	Very low	46.9	Very low	84 Å²	84	97.9 Å²	97.9	52%	0.515	56%	0.559	S	S	.	*	H	α-helix	trans	-68	-28.3	176.1	50.2	0	0	0	0	114.2	R569 A570 A576	R569-T572 WeakPolarHBondContact CA-OG1 3.45Å; R569-T572 PolarHBondContact O-N 2.71Å; R569-T572 PolarHBondContact O-OG1 2.77Å; A570-T572 VanDerWaalsContact C-N 3.3Å; A570-T572 PolarHBondContact O-N 3.18Å; T572-A576 VanDerWaalsContact O-CB 3.28Å; T572-A576 WeakPolarHBondContact O-CB 3.34Å; T572-A576 PolarHBondContact O-N 3.18Å
573	F	45	Very low	46.7	Very low	145 Å²	145	101.6 Å²	101.6	64%	0.636	57%	0.569	S	S	*	*	H	α-helix	trans	-76	-44.3	178.6	-159.9	-98.3	0	0	0	111.5	R569 A570 S571 T575 A576 I577	R569-F573 PolarHBondContact O-N 3.15Å; A570-F573 PolarHBondContact O-N 2.93Å; A570-F573 VanDerWaalsContact O-N 3.17Å; S571-F573 PolarHBondContact O-N 2.87Å; F573-T575 VanDerWaalsContact C-N 3.31Å; F573-T575 PolarHBondContact O-N 2.92Å; F573-A576 WeakPolarHBondContact O-CB 3.26Å; F573-A576 PolarHBondContact O-N 3.35Å; F573-A576 VanDerWaalsContact O-N 3.12Å; F573-I577 HydrophobicContact CD1-CD1 4.08Å; F573-I577 HydrophobicContact CE1-CD1 3.86Å; F573-I577 PolarHBondContact O-N 2.95Å; F573-I577 VanDerWaalsContact O-N 3.08Å
574	S	49	Very low	46.3	Very low	79 Å²	79	103 Å²	103	55%	0.552	56%	0.561	S	S	*	*	H	α-helix	trans	-59.5	-42.8	169.2	-57	0	0	0	0	111.3	A570 A576 I577 S578	A570-S574 PolarHBondContact O-N 3.18Å; S574-A576 VanDerWaalsContact C-N 3.28Å; S574-A576 PolarHBondContact O-N 3.46Å; S574-I577 PolarHBondContact O-N 2.79Å; S574-S578 WeakPolarHBondContact O-CB 3.43Å; S574-S578 PolarHBondContact O-N 3.19Å; S574-S578 PolarHBondContact O-OG 2.88Å; S574-S578 VanDerWaalsContact O-OG 3.1Å
575	T	49.5	Very low	45.9	Very low	53 Å²	53	106.8 Å²	106.8	33%	0.325	57%	0.572	S	S	.	*	H	α-helix	trans	-67.2	-26.5	176.4	-53.8	0	0	0	0	112.6	S571 F573 R579	S571-T575 VanDerWaalsContact O-CB 3.23Å; S571-T575 WeakPolarHBondContact O-CB 3.15Å; S571-T575 PolarHBondContact O-N 3.25Å; S571-T575 PolarHBondContact O-OG1 3.38Å; F573-T575 VanDerWaalsContact C-N 3.31Å; F573-T575 PolarHBondContact O-N 2.92Å; T575-R579 HydrophobicContact CG2-CG 4.43Å; T575-R579 VanDerWaalsContact O-CB 3.26Å; T575-R579 WeakPolarHBondContact O-CB 3.49Å; T575-R579 WeakPolarHBondContact O-CD 3.14Å; T575-R579 WeakPolarHBondContact O-CG 3.21Å; T575-R579 PolarHBondContact O-N 2.97Å
576	A	48.4	Very low	45.5	Very low	52 Å²	52	111.4 Å²	111.4	43%	0.43	60%	0.596	S	S	.	*	H	α-helix	trans	-72.4	-44	174.8	0	0	0	0	0	111.3	T572 F573 S574 R579 A580	T572-A576 VanDerWaalsContact O-CB 3.28Å; T572-A576 WeakPolarHBondContact O-CB 3.34Å; T572-A576 PolarHBondContact O-N 3.18Å; F573-A576 WeakPolarHBondContact O-CB 3.26Å; F573-A576 PolarHBondContact O-N 3.35Å; F573-A576 VanDerWaalsContact O-N 3.12Å; S574-A576 VanDerWaalsContact C-N 3.28Å; S574-A576 PolarHBondContact O-N 3.46Å; A576-R579 CarbonylContact O-C 3.54Å; A576-R579 PolarHBondContact O-N 2.57Å; A576-A580 WeakPolarHBondContact O-CB 3.15Å; A576-A580 PolarHBondContact O-N 3.01Å
577	I	49.5	Very low	45	Very low	91 Å²	91	111.4 Å²	111.4	47%	0.467	60%	0.601	S	S	.	*	H	α-helix	trans	-63.9	-44.5	174	-64.3	173.1	0	0	0	110.2	F573 S574 R579 A580 F581	F573-I577 HydrophobicContact CD1-CD1 4.08Å; F573-I577 HydrophobicContact CE1-CD1 3.86Å; F573-I577 PolarHBondContact O-N 2.95Å; F573-I577 VanDerWaalsContact O-N 3.08Å; S574-I577 PolarHBondContact O-N 2.79Å; I577-R579 PolarHBondContact O-N 3.15Å; I577-A580 PolarHBondContact O-N 2.61Å; I577-F581 HydrophobicContact CG2-CD2 4.21Å; I577-F581 PolarHBondContact O-N 2.75Å
578	S	49.6	Very low	44.5	Very low	83 Å²	83	116.9 Å²	116.9	58%	0.58	61%	0.614	S	S	*	*	H	α-helix	trans	-66.1	-12.2	172.5	-56.6	0	0	0	0	114.5	S574 G582	S574-S578 WeakPolarHBondContact O-CB 3.43Å; S574-S578 PolarHBondContact O-N 3.19Å; S574-S578 PolarHBondContact O-OG 2.88Å; S574-S578 VanDerWaalsContact O-OG 3.1Å; S578-G582 WeakPolarHBondContact O-CA 3.29Å; S578-G582 PolarHBondContact O-N 3.07Å
579	R	50.2	Low	43.8	Very low	151 Å²	151	119 Å²	119	57%	0.57	64%	0.635	S	S	*	*	H	α-helix	trans	-99.6	-22.4	172.1	-78.1	170.7	178.7	173.4	4.7	113.4	T575 A576 I577	T575-R579 HydrophobicContact CG2-CG 4.43Å; T575-R579 VanDerWaalsContact O-CB 3.26Å; T575-R579 WeakPolarHBondContact O-CB 3.49Å; T575-R579 WeakPolarHBondContact O-CD 3.14Å; T575-R579 WeakPolarHBondContact O-CG 3.21Å; T575-R579 PolarHBondContact O-N 2.97Å; A576-R579 CarbonylContact O-C 3.54Å; A576-R579 PolarHBondContact O-N 2.57Å; I577-R579 PolarHBondContact O-N 3.15Å
580	A	46.2	Very low	43	Very low	81 Å²	81	119.5 Å²	119.5	67%	0.669	64%	0.643	S	S	*	*	H	α-helix	trans	-75.6	-38.8	171.5	0	0	0	0	0	111.1	A576 I577	A576-A580 WeakPolarHBondContact O-CB 3.15Å; A576-A580 PolarHBondContact O-N 3.01Å; I577-A580 PolarHBondContact O-N 2.61Å
581	F	49.4	Very low	42.1	Very low	189 Å²	189	126.4 Å²	126.4	83%	0.829	66%	0.661	S	S	*	*	S	Bend	trans	-101.1	-10.3	175.7	-69.3	-81.7	0	0	0	114.3	I577	I577-F581 HydrophobicContact CG2-CD2 4.21Å; I577-F581 PolarHBondContact O-N 2.75Å
582	G	35.8	Very low	41.2	Very low	34 Å²	34	127.5 Å²	127.5	35%	0.351	67%	0.674	S	S	.	*	S	Bend	trans	-117.5	95.4	174.3	0	0	0	0	0	111.5	S578 K584	S578-G582 WeakPolarHBondContact O-CA 3.29Å; S578-G582 PolarHBondContact O-N 3.07Å; G582-K584 PolarHBondContact O-N 2.71Å
583	R	39.6	Very low	40.2	Very low	250 Å²	250	130.4 Å²	130.4	94%	0.943	69%	0.687	S	S	*	*			trans	-76	110.8	-179.9	-144	172.5	-169.8	169.3	2.1	110.2
584	K	37.5	Very low	39.4	Very low	139 Å²	139	129.7 Å²	129.7	60%	0.604	69%	0.694	S	S	*	*			trans	-33.5	148.3	163	-65.4	173.5	176.3	175.1	0	112.1	G582	G582-K584 PolarHBondContact O-N 2.71Å
585	Q	37.3	Very low	38.4	Very low	175 Å²	175	134.9 Å²	134.9	82%	0.818	70%	0.702	S	S	*	*				-139.8	128.1	72.1	-76.5	-180	-14.8	0	0	115.3	V587	Q585-V587 HydrophobicContact CB-CG2 4.48Å
586	T	35.6	Very low	37.4	Very low	139 Å²	139	137.5 Å²	137.5	85%	0.853	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-92.1	119.5	148.8	37.2	0	0	0	0	108.8
587	V	36.7	Very low	36.5	Very low	124 Å²	124	142.3 Å²	142.3	75%	0.752	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-103.1	142.7	167.4	177.3	0	0	0	0	108.6	Q585	Q585-V587 HydrophobicContact CB-CG2 4.48Å
588	K	36.1	Very low	35.5	Very low	202 Å²	202	142 Å²	142	88%	0.878	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-70	153.9	-174.5	-70.5	176.7	175.9	177.8	0	112.1
589	A	30.5	Very low	34.5	Very low	106 Å²	106	142.1 Å²	142.1	88%	0.876	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-59.5	137.1	-178.2	0	0	0	0	0	114.3
590	K	32.6	Very low	33.5	Very low	209 Å²	209	137 Å²	137	91%	0.909	74%	0.735	S	S	*	*			trans	-139.6	144.4	149.2	-134	177.6	-177.2	-175.8	0	107.5
591	K	26.9	Very low	32.8	Very low	207 Å²	207	135.3 Å²	135.3	90%	0.9	72%	0.719	S	S	*	*			trans	-63.2	162.2	179.4	-99	177	170.6	179.7	0	111.6
592	A	30	Very low	32.1	Very low	84 Å²	84	128.2 Å²	128.2	69%	0.694	69%	0.692	S	S	*	*			trans	96	114.4	167.8	0	0	0	0	0	117
593	D	28	Very low	31.9	Very low	146 Å²	146	128.1 Å²	128.1	78%	0.781	68%	0.682	S	S	*	*			trans	70.7	139.8	132.6	-56.3	-33.8	0	0	0	124.6
594	T	30.1	Very low	31.5	Very low	130 Å²	130	117.9 Å²	117.9	80%	0.798	65%	0.651	S	S	*	*			trans	70.3	100.7	149.6	43.6	0	0	0	0	121.5
595	R	26.7	Very low	31.4	Very low	188 Å²	188	113 Å²	113	71%	0.709	63%	0.633	S	S	*	*				37.2	112.1	123.7	-83.6	-179.1	165.2	168.7	-5	119.4	E211	E211-R595 IonicContact OE1-CZ 2.62Å; E211-R595 IonicContact OE1-NH2 2.65Å; E211-R595 PolarHBondContact OE1-NH2 3.46Å
596	S	29.8	Very low	31.4	Very low	108 Å²	108	107.2 Å²	107.2	76%	0.755	62%	0.62	S	S	*	*				-130.2	133.6	125.5	69.3	0	0	0	0	107
597	L	27.7	Very low	31.3	Very low	153 Å²	153	105.4 Å²	105.4	80%	0.801	61%	0.609	S	S	*	*				53.8	126	61.5	-64.1	168.7	0	0	0	111.4
598	A	28.7	Very low	31.2	Very low	85 Å²	85	104 Å²	104	70%	0.702	61%	0.605	S	S	*	*			cis	-160	169.8	-3.8	0	0	0	0	0	113.2
599	K	28.6	Very low	30.9	Very low	84 Å²	84	103.5 Å²	103.5	37%	0.365	60%	0.603	S	S	.	*			trans	-14.3	140.5	149.4	-50.9	165.3	174.9	-178.6	0	119	T214	T214-K599 HydrophobicContact CG2-CG 3.92Å
600	G	30.6	Very low	31.2	Very low	43 Å²	43	105.5 Å²	105.5	44%	0.443	60%	0.604	S	S	.	*			trans	149.2	125.4	158.3	0	0	0	0	0	118.9	R53	R53-G600 VanDerWaalsContact CA-N 3.35Å; R53-G600 VanDerWaalsContact CB-C 3.42Å; R53-G600 VanDerWaalsContact CB-CA 3.5Å; R53-G600 WeakPolarHBondContact CD-O 3.4Å
601	S	30.5	Very low	31.1	Very low	47 Å²	47	102.7 Å²	102.7	33%	0.329	63%	0.633	S	S	.	*			cis	-120.3	175.2	-16.7	-164.8	0	0	0	0	114.4	R53 V54 D374	R53-S601 WeakPolarHBondContact CB-O 3.32Å; R53-S601 WeakPolarHBondContact CD-O 3.28Å; V54-S601 WeakPolarHBondContact CG1-OG 3.46Å; D374-S601 WeakPolarHBondContact OD2-CB 3.29Å; D374-S601 PolarHBondContact OD2-OG 2.93Å
602	S	34.6	Very low	31.4	Very low	39 Å²	39	97.5 Å²	97.5	27%	0.273	62%	0.62	S	S	.	*			trans	-175.6	157.3	170.7	28.5	0	0	0	0	107.1	V54 R400	V54-S602 VanDerWaalsContact CG2-O 3.3Å; V54-S602 WeakPolarHBondContact CG2-O 3.48Å; R400-S602 WeakPolarHBondContact CD-O 3.34Å; R400-S602 WeakPolarHBondContact CG-O 3.32Å; R400-S602 PolarHBondContact NE-O 2.81Å
603	K	32.3	Very low	31.4	Very low	32 Å²	32	98.2 Å²	98.2	14%	0.139	62%	0.616	C	S	.	*			cis	-141.9	-167.9	30.8	-46.1	156	176.1	150.4	0	109.9	F61 K64 L65 D374 R400 G401	F61-K603 PolarHBondContact O-NZ 2.97Å; K64-K603 PolarHBondContact O-NZ 3.45Å; L65-K603 VanDerWaalsContact N-NZ 3.11Å; D374-K603 PolarHBondContact OD1-N 2.74Å; D374-K603 VanDerWaalsContact OD1-O 3.08Å; R400-K603 CarbonylContact C-O 3.53Å; R400-K603 WeakPolarHBondContact CA-O 3.43Å; R400-K603 HydrophobicContact CB-CB 4.07Å; R400-K603 VanDerWaalsContact NH1-NZ 3.12Å; R400-K603 CarbonylContact O-C 3.56Å; G401-K603 PolarHBondContact N-O 3.39Å
604	A	31.6	Very low	31.6	Very low	36 Å²	36	95.5 Å²	95.5	30%	0.298	61%	0.607	S	S	.	*			trans	-165.2	113.3	157.5	0	0	0	0	0	108.7	C372 Y376 I377 R400	C372-A604 HydrophobicContact CB-CB 4.4Å; Y376-A604 WeakPolarHBondContact O-CB 3.23Å; I377-A604 HydrophobicContact CG2-CB 3.57Å; R400-A604 WeakPolarHBondContact O-CA 3.26Å
605	V	35.1	Very low	31.7	Very low	35 Å²	35	93.5 Å²	93.5	21%	0.212	60%	0.596	C	S	.	*				69.5	162.1	73.2	-179.4	0	0	0	0	114.6	I377 R400 G401 K402	I377-V605 VanDerWaalsContact CB-O 3.31Å; I377-V605 WeakPolarHBondContact CB-O 3.33Å; I377-V605 HydrophobicContact CG2-CB 3.76Å; I377-V605 HydrophobicContact CG2-CG1 4.21Å; I377-V605 WeakPolarHBondContact CG2-O 2.8Å; R400-V605 WeakPolarHBondContact O-CG2 3.36Å; G401-V605 VanDerWaalsContact O-CB 3.25Å; G401-V605 WeakPolarHBondContact O-CB 3.48Å; G401-V605 WeakPolarHBondContact O-CG1 3.31Å; K402-V605 HydrophobicContact CB-CG2 4.26Å; K402-V605 HydrophobicContact CD-CG2 3.76Å; K402-V605 HydrophobicContact CG-CG1 4.07Å; K402-V605 HydrophobicContact CG-CG2 3.73Å
606	G	35.9	Very low	32	Very low	54 Å²	54	87.6 Å²	87.6	56%	0.557	59%	0.589	S	S	*	*			trans	-160.7	162	-176.3	0	0	0	0	0	113.6
607	V	33.8	Very low	32.2	Very low	101 Å²	101	86.2 Å²	86.2	61%	0.612	58%	0.578	S	S	*	*			trans	-142.9	-168.6	178.9	170.4	0	0	0	0	106.7	I377	I377-V607 HydrophobicContact CD1-CB 4.07Å; I377-V607 HydrophobicContact CD1-CG2 3.75Å
608	S	34.3	Very low	32.5	Very low	96 Å²	96	81.4 Å²	81.4	67%	0.671	56%	0.562	S	S	*	*				-100.7	163.7	-67.6	-112.6	0	0	0	0	109.5
609	K	31.2	Very low	32.8	Very low	191 Å²	191	81.2 Å²	81.2	83%	0.83	55%	0.551	S	S	*	*				78.4	135.1	53.5	-150.6	-172.4	-176	-176.7	0	115.7
610	V	35.3	Very low	33.1	Very low	148 Å²	148	80.9 Å²	80.9	90%	0.897	57%	0.566	S	S	*	*			trans	109.3	124.9	161.7	-172.4	0	0	0	0	115.6
611	G	32.3	Very low	33.4	Very low	149 Å²	149	84.4 Å²	84.4	100%	1.536	58%	0.578	S	S	*	*			trans	148.2	0	-166.8	0	0	0	0	0	108.1

Retrieved 611 of 611 residues in 878 ms (Link to these results)

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