A0A077Z6L2_TRITR Loading...

COP9 signalosome complex subunit 5

AlphaFold DB , UniProt , Accession A0A077Z6L2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 347 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	36.5	Very low	245 Å²	245	143.9 Å²	143.9	100%	1.207	84%	0.842	S	S	*	*				0	88	0	-84.3	175.3	165.9	0	0	106.9
2	E	35.5	Very low	36.6	Very low	199 Å²	199	140.8 Å²	140.8	93%	0.93	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-66.1	129.5	-176.7	-71	175.8	147.7	0	0	109.9	G4	E2-G4 PolarHBondContact O-N 3.43Å
3	R	35.7	Very low	36.6	Very low	245 Å²	245	136.5 Å²	136.5	93%	0.925	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-75.4	117.7	173.2	-70.9	-176.3	-172	-153.4	1.4	107.8	G5	R3-G5 PolarHBondContact O-N 3.43Å
4	G	35.8	Very low	36.7	Very low	75 Å²	75	132.5 Å²	132.5	77%	0.773	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-57.4	128.8	173.4	0	0	0	0	0	111.2	E2	E2-G4 PolarHBondContact O-N 3.43Å
5	G	36.6	Very low	36.9	Very low	76 Å²	76	129.8 Å²	129.8	78%	0.784	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-68	136	173.3	0	0	0	0	0	111.2	R3	R3-G5 PolarHBondContact O-N 3.43Å
6	S	37	Very low	36.8	Very low	114 Å²	114	125.9 Å²	125.9	80%	0.797	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-62.6	142.7	167.4	-56.3	0	0	0	0	110.3	E8	S6-E8 PolarHBondContact O-N 3.46Å
7	P	39.5	Very low	37.5	Very low	126 Å²	126	121.9 Å²	121.9	82%	0.818	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-75.6	124.7	172.1	31	-29.5	0	0	0	109.1
8	E	35.7	Very low	38.2	Very low	185 Å²	185	117.9 Å²	117.9	86%	0.864	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-65.3	140.7	167.8	-75.3	-170.3	155.7	0	0	110.3	S6 S10	S6-E8 PolarHBondContact O-N 3.46Å; E8-S10 PolarHBondContact O-N 2.92Å
9	P	37.2	Very low	39	Very low	113 Å²	113	116.6 Å²	116.6	73%	0.734	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-76	119.5	175.1	30.1	-30.2	0	0	0	109.8	S11	P9-S11 PolarHBondContact O-N 3.37Å
10	S	34	Very low	40.1	Very low	108 Å²	108	118.7 Å²	118.7	76%	0.755	71%	0.707	S	S	*	*			trans	-64.1	89.4	172.6	56.1	0	0	0	0	111.3	E8	E8-S10 PolarHBondContact O-N 2.92Å
11	S	34.8	Very low	41.7	Very low	97 Å²	97	115.9 Å²	115.9	68%	0.678	69%	0.689	S	S	*	*			trans	-105.3	5.6	-177.1	60.5	0	0	0	0	114.9	P9	P9-S11 PolarHBondContact O-N 3.37Å
12	S	37.8	Very low	44	Very low	106 Å²	106	106.6 Å²	106.6	74%	0.741	64%	0.644	S	S	*	*	S	Bend	trans	-99.7	-8.9	-173.2	59.1	0	0	0	0	116.2
13	S	36.6	Very low	46.5	Very low	86 Å²	86	101.9 Å²	101.9	60%	0.601	62%	0.624	S	S	*	*	S	Bend	trans	-92.2	-29.7	-176.7	74.1	0	0	0	0	114.4
14	T	38.1	Very low	49.1	Very low	80 Å²	80	91.1 Å²	91.1	49%	0.491	59%	0.585	S	S	.	*	H	α-helix	trans	-73.5	-29.9	-173.8	-37.3	0	0	0	0	113.2	S17 N18	T14-S17 PolarHBondContact O-OG 2.92Å; T14-N18 PolarHBondContact O-N 3.39Å; T14-N18 PolarHBondContact O-ND2 3.36Å; T14-N18 PolarHBondContact O-OD1 3.32Å
15	T	39.8	Very low	51.7	Low	92 Å²	92	91.2 Å²	91.2	56%	0.564	56%	0.562	S	S	*	*	H	α-helix	trans	-71.1	-35.4	-178	2.6	0	0	0	0	112.4	V19	T15-V19 WeakPolarHBondContact O-CG2 3.43Å; T15-V19 PolarHBondContact O-N 3.18Å
16	A	35.7	Very low	54.1	Low	68 Å²	68	91.6 Å²	91.6	56%	0.562	55%	0.549	S	S	*	.	H	α-helix	trans	-75.6	-29.9	-178.7	0	0	0	0	0	113.3
17	S	47.8	Very low	56.1	Low	57 Å²	57	89.6 Å²	89.6	40%	0.399	53%	0.534	S	S	.	.	H	α-helix	trans	-69.6	-42.9	171.9	51.7	0	0	0	0	111.1	T14 V19 K20 D21	T14-S17 PolarHBondContact O-OG 2.92Å; S17-V19 PolarHBondContact O-N 3.49Å; S17-K20 PolarHBondContact O-N 2.88Å; S17-D21 PolarHBondContact O-N 3.36Å
18	N	50.4	Low	57.8	Low	51 Å²	51	87.7 Å²	87.7	27%	0.273	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-35.6	-175.6	-68.9	-3.4	0	0	0	113.1	T14 K20 D21 D22	T14-N18 PolarHBondContact O-N 3.39Å; T14-N18 PolarHBondContact O-ND2 3.36Å; T14-N18 PolarHBondContact O-OD1 3.32Å; N18-K20 VanDerWaalsContact C-N 3.34Å; N18-K20 PolarHBondContact O-N 3.45Å; N18-D21 PolarHBondContact O-N 3.37Å; N18-D22 PolarHBondContact O-N 3.5Å
19	V	53.9	Low	59.6	Low	93 Å²	93	88.8 Å²	88.8	56%	0.564	52%	0.516	S	S	*	.	H	α-helix	trans	-69.6	-30.6	177.2	176.3	0	0	0	0	112.2	T15 S17 D21 D22	T15-V19 WeakPolarHBondContact O-CG2 3.43Å; T15-V19 PolarHBondContact O-N 3.18Å; S17-V19 PolarHBondContact O-N 3.49Å; V19-D21 VanDerWaalsContact C-N 3.31Å; V19-D22 PolarHBondContact O-N 3.35Å
20	K	60.7	Low	61.4	Low	158 Å²	158	85.1 Å²	85.1	69%	0.687	50%	0.498	S	S	*	.	H	α-helix	trans	-67.2	-34.5	176.6	-81	-175.6	175.5	179.9	0	112.1	S17 N18	S17-K20 PolarHBondContact O-N 2.88Å; N18-K20 VanDerWaalsContact C-N 3.34Å; N18-K20 PolarHBondContact O-N 3.45Å
21	D	73.1	Confident	63.5	Low	60 Å²	60	83 Å²	83	32%	0.321	47%	0.474	S	S	.	.	H	α-helix	trans	-72.5	-33.3	-179.6	-69.6	-19.4	0	0	0	111.5	S17 N18 V19 I23 I24	S17-D21 PolarHBondContact O-N 3.36Å; N18-D21 PolarHBondContact O-N 3.37Å; V19-D21 VanDerWaalsContact C-N 3.31Å; D21-I23 VanDerWaalsContact C-N 3.28Å; D21-I23 PolarHBondContact O-N 3.4Å; D21-I24 WeakPolarHBondContact O-CB 3.43Å; D21-I24 WeakPolarHBondContact O-CG2 2.99Å; D21-I24 PolarHBondContact O-N 3.43Å
22	D	87.9	Confident	65.4	Low	49 Å²	49	80.2 Å²	80.2	26%	0.262	45%	0.452	S	S	.	.	H	α-helix	trans	-65.2	-30	178.4	-72.9	-17.3	0	0	0	113.4	N18 V19 I24 Y25 S227 S228	N18-D22 PolarHBondContact O-N 3.5Å; V19-D22 PolarHBondContact O-N 3.35Å; D22-I24 PolarHBondContact O-N 3.06Å; D22-Y25 WeakPolarHBondContact O-CB 2.99Å; D22-Y25 PolarHBondContact O-N 3.18Å; D22-S227 VanDerWaalsContact OD1-CA 3.22Å; D22-S227 WeakPolarHBondContact OD1-CA 3.47Å; D22-S227 WeakPolarHBondContact OD1-CB 3.49Å; D22-S228 PolarHBondContact OD1-N 2.89Å; D22-S228 PolarHBondContact OD1-OG 2.84Å; D22-S228 WeakPolarHBondContact OD2-CB 3.15Å; D22-S228 PolarHBondContact OD2-OG 3.37Å
23	I	88.7	Confident	67.4	Low	101 Å²	101	81.9 Å²	81.9	52%	0.518	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-61	-28.3	178.2	-65	168.6	0	0	0	111.3	D21 Y25 V26	D21-I23 VanDerWaalsContact C-N 3.28Å; D21-I23 PolarHBondContact O-N 3.4Å; I23-Y25 PolarHBondContact O-N 3.3Å; I23-V26 WeakPolarHBondContact O-CB 3.21Å; I23-V26 PolarHBondContact O-N 3.21Å
24	I	90.4	Very high	69.7	Low	19 Å²	19	81.5 Å²	81.5	10%	0.097	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-62.9	-25.8	178.8	-151	176	0	0	0	112	D21 D22 V26 K52 K80 I87 F225	D21-I24 WeakPolarHBondContact O-CB 3.43Å; D21-I24 WeakPolarHBondContact O-CG2 2.99Å; D21-I24 PolarHBondContact O-N 3.43Å; D22-I24 PolarHBondContact O-N 3.06Å; I24-V26 VanDerWaalsContact C-N 3.32Å; I24-K52 HydrophobicContact CD1-CD 4.08Å; I24-K80 VanDerWaalsContact O-CE 3.28Å; I24-K80 WeakPolarHBondContact O-CE 3.47Å; I24-K80 PolarHBondContact O-NZ 2.67Å; I24-I87 HydrophobicContact CD1-CD1 4.06Å; I24-I87 HydrophobicContact CD1-CG1 4.46Å; I24-I87 HydrophobicContact CD1-CG2 3.73Å; I24-I87 HydrophobicContact CG1-CD1 4.1Å; I24-I87 HydrophobicContact CG1-CG2 4.15Å; I24-F225 HydrophobicContact CD1-CD1 3.96Å; I24-F225 HydrophobicContact CD1-CD2 4.21Å; I24-F225 HydrophobicContact CD1-CE1 3.99Å; I24-F225 HydrophobicContact CD1-CE2 4.23Å; I24-F225 HydrophobicContact CD1-CG 4.06Å; I24-F225 HydrophobicContact CD1-CZ 4.13Å; I24-F225 HydrophobicContact CG2-CD2 3.42Å; I24-F225 VanDerWaalsContact CG2-CD2 3.42Å; I24-F225 HydrophobicContact CG2-CE2 3.41Å; I24-F225 VanDerWaalsContact CG2-CE2 3.41Å; I24-F225 HydrophobicContact CG2-CG 4.21Å; I24-F225 HydrophobicContact CG2-CZ 4.21Å
25	Y	89.5	Confident	71.9	Confident	76 Å²	76	78.6 Å²	78.6	30%	0.298	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-82.2	-10.8	178.8	-64.7	-88.3	0	0	0	113	D22 I23 P27 M89 F225 S227	D22-Y25 WeakPolarHBondContact O-CB 2.99Å; D22-Y25 PolarHBondContact O-N 3.18Å; I23-Y25 PolarHBondContact O-N 3.3Å; Y25-P27 VanDerWaalsContact O-CD 3.31Å; Y25-P27 WeakPolarHBondContact O-CD 3.22Å; Y25-M89 HydrophobicContact CD1-CE 3.3Å; Y25-M89 HydrophobicContact CE1-CE 3.78Å; Y25-M89 HydrophobicContact CG-CE 3.94Å; Y25-F225 AromaticContact CE1-CE2 3.91Å; Y25-F225 HydrophobicContact CE1-CE2 3.91Å; Y25-F225 AromaticContact CE2-CD2 3.85Å; Y25-F225 HydrophobicContact CE2-CD2 3.85Å; Y25-F225 AromaticContact CE2-CE2 3.89Å; Y25-F225 HydrophobicContact CE2-CE2 3.89Å; Y25-F225 AromaticContact CZ-CD2 3.74Å; Y25-F225 AromaticContact CZ-CE2 3.46Å; Y25-F225 VanDerWaalsContact CZ-CE2 3.46Å; Y25-F225 WeakPolarHBondContact OH-CD2 3.49Å; Y25-F225 WeakPolarHBondContact OH-CE2 3.43Å; Y25-S227 PolarHBondContact OH-N 3.19Å
26	V	86.8	Confident	74	Confident	84 Å²	84	78.2 Å²	78.2	51%	0.509	41%	0.409	S	S	.	.	S	Bend	trans	-75.1	125.3	179.4	-177.7	0	0	0	0	109.6	I23 I24 Q28 K80	I23-V26 WeakPolarHBondContact O-CB 3.21Å; I23-V26 PolarHBondContact O-N 3.21Å; I24-V26 VanDerWaalsContact C-N 3.32Å; V26-Q28 PolarHBondContact O-N 3.06Å; V26-K80 PolarHBondContact O-NZ 3.34Å
27	P	79.4	Confident	76.4	Confident	73 Å²	73	80.2 Å²	80.2	47%	0.474	42%	0.417	S	S	.	.			trans	-55.9	125	170	-31.9	40.7	0	0	0	112.6	Y25 I126	Y25-P27 VanDerWaalsContact O-CD 3.31Å; Y25-P27 WeakPolarHBondContact O-CD 3.22Å; P27-I126 HydrophobicContact CB-CD1 3.29Å; P27-I126 HydrophobicContact CG-CD1 3.43Å; P27-I126 VanDerWaalsContact CG-CD1 3.43Å
28	Q	76.5	Confident	78.4	Confident	85 Å²	85	84.5 Å²	84.5	40%	0.397	43%	0.428	S	S	.	.			trans	-100.8	87.1	170	-67.2	-162.3	8.2	0	0	109.9	V26 G30 Y31	V26-Q28 PolarHBondContact O-N 3.06Å; Q28-G30 PolarHBondContact O-N 2.57Å; Q28-Y31 PolarHBondContact O-N 2.79Å
29	K	72.3	Confident	80.4	Confident	209 Å²	209	87.3 Å²	87.3	91%	0.909	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	126.3	178.5	-77.4	-169.1	175.1	-173.5	0	111.1	Y31	K29-Y31 VanDerWaalsContact C-N 3.27Å; K29-Y31 PolarHBondContact O-N 3Å
30	G	75.1	Confident	82.2	Confident	35 Å²	35	84.7 Å²	84.7	36%	0.361	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	-13.2	176.2	0	0	0	0	0	116	Q28 N34	Q28-G30 PolarHBondContact O-N 2.57Å; G30-N34 WeakPolarHBondContact O-CB 3.31Å; G30-N34 PolarHBondContact O-N 3.47Å
31	Y	77.4	Confident	83.6	Confident	64 Å²	64	78 Å²	78	25%	0.251	39%	0.394	S	S	.	.	H	α-helix	trans	-67.9	-48.5	177.1	178.8	-94.6	0	0	0	111.1	Q28 K29 E33 N34 I35 V81 Q82 D83	Q28-Y31 PolarHBondContact O-N 2.79Å; K29-Y31 VanDerWaalsContact C-N 3.27Å; K29-Y31 PolarHBondContact O-N 3Å; Y31-E33 PolarHBondContact O-N 3.13Å; Y31-N34 PolarHBondContact O-N 2.69Å; Y31-I35 HydrophobicContact CD1-CD1 4.27Å; Y31-I35 HydrophobicContact CE1-CD1 3.41Å; Y31-I35 VanDerWaalsContact CE1-CD1 3.41Å; Y31-I35 HydrophobicContact CE1-CG1 4.23Å; Y31-I35 HydrophobicContact CE2-CD1 4.14Å; Y31-I35 PolarHBondContact O-N 2.93Å; Y31-I35 VanDerWaalsContact OH-CD1 3.23Å; Y31-I35 WeakPolarHBondContact OH-CD1 3.31Å; Y31-V81 WeakPolarHBondContact CE1-O 3.44Å; Y31-Q82 HydrophobicContact CE1-CB 4.35Å; Y31-Q82 HydrophobicContact CE1-CG 4.15Å; Y31-D83 PolarHBondContact OH-N 3.41Å; Y31-D83 PolarHBondContact OH-OD1 2.95Å
32	D	75.5	Confident	84.3	Confident	39 Å²	39	79.5 Å²	79.5	21%	0.209	41%	0.408	C	S	.	.	H	α-helix	trans	-62.5	-42.6	-179.9	-73.4	-32.8	0	0	0	111.9	N34 I35 R36 K80	D32-N34 PolarHBondContact O-N 3.17Å; D32-I35 PolarHBondContact O-N 3.43Å; D32-R36 VanDerWaalsContact O-CB 3.32Å; D32-R36 WeakPolarHBondContact O-CB 3.41Å; D32-R36 VanDerWaalsContact O-CG 3.29Å; D32-R36 WeakPolarHBondContact O-CG 3.45Å; D32-R36 PolarHBondContact O-N 3.35Å; D32-K80 WeakPolarHBondContact OD2-CB 3.25Å
33	E	80.3	Confident	84.4	Confident	141 Å²	141	86.3 Å²	86.3	66%	0.659	44%	0.436	S	S	*	.	H	α-helix	trans	-60.2	-45.9	174.3	-67.5	172.9	171.6	0	0	111.2	Y31 I35 R36 C37	Y31-E33 PolarHBondContact O-N 3.13Å; E33-I35 PolarHBondContact O-N 2.91Å; E33-R36 PolarHBondContact O-N 2.98Å; E33-C37 WeakPolarHBondContact O-CB 3.41Å; E33-C37 PolarHBondContact O-N 3.19Å; E33-C37 PolarHBondContact O-SG 3.17Å
34	N	84.8	Confident	84.5	Confident	78 Å²	78	85.3 Å²	85.3	42%	0.417	43%	0.431	S	S	.	.	H	α-helix	trans	-65.4	-41.8	-179.2	-164.9	-32.2	0	0	0	112	G30 Y31 D32 C37 K38	G30-N34 WeakPolarHBondContact O-CB 3.31Å; G30-N34 PolarHBondContact O-N 3.47Å; Y31-N34 PolarHBondContact O-N 2.69Å; D32-N34 PolarHBondContact O-N 3.17Å; N34-C37 PolarHBondContact O-N 3.22Å; N34-K38 WeakPolarHBondContact O-CB 3.23Å; N34-K38 WeakPolarHBondContact O-CG 3.19Å; N34-K38 PolarHBondContact O-N 3.3Å; N34-K38 VanDerWaalsContact OD1-CD 3.31Å; N34-K38 WeakPolarHBondContact OD1-CD 3.33Å; N34-K38 WeakPolarHBondContact OD1-CE 3.28Å; N34-K38 PolarHBondContact OD1-NZ 3.49Å
35	I	84.4	Confident	84.5	Confident	18 Å²	18	86.7 Å²	86.7	9%	0.092	44%	0.441	C	S	.	.	H	α-helix	trans	-63.9	-44.5	174.6	-92	-169	0	0	0	111.3	Y31 D32 E33 C37 K38 K39 W41 V81	Y31-I35 HydrophobicContact CD1-CD1 4.27Å; Y31-I35 HydrophobicContact CE1-CD1 3.41Å; Y31-I35 VanDerWaalsContact CE1-CD1 3.41Å; Y31-I35 HydrophobicContact CE1-CG1 4.23Å; Y31-I35 HydrophobicContact CE2-CD1 4.14Å; Y31-I35 PolarHBondContact O-N 2.93Å; Y31-I35 VanDerWaalsContact OH-CD1 3.23Å; Y31-I35 WeakPolarHBondContact OH-CD1 3.31Å; D32-I35 PolarHBondContact O-N 3.43Å; E33-I35 PolarHBondContact O-N 2.91Å; I35-C37 VanDerWaalsContact C-N 3.28Å; I35-C37 PolarHBondContact O-N 3.49Å; I35-K38 PolarHBondContact O-N 3.06Å; I35-K39 PolarHBondContact O-N 3.26Å; I35-W41 HydrophobicContact CG2-CH2 3.69Å; I35-W41 HydrophobicContact CG2-CZ3 3.45Å; I35-W41 VanDerWaalsContact CG2-CZ3 3.45Å; I35-V81 HydrophobicContact CG2-CG1 4.3Å
36	R	84	Confident	84.6	Confident	85 Å²	85	86.4 Å²	86.4	32%	0.321	44%	0.442	S	S	.	.	H	α-helix	trans	-63.5	-33.3	176.6	-77.3	177.9	163.7	-163.1	-6.2	112.4	D32 E33 K39 W41 H128	D32-R36 VanDerWaalsContact O-CB 3.32Å; D32-R36 WeakPolarHBondContact O-CB 3.41Å; D32-R36 VanDerWaalsContact O-CG 3.29Å; D32-R36 WeakPolarHBondContact O-CG 3.45Å; D32-R36 PolarHBondContact O-N 3.35Å; E33-R36 PolarHBondContact O-N 2.98Å; R36-K39 VanDerWaalsContact O-CE 3.3Å; R36-K39 WeakPolarHBondContact O-CE 3.45Å; R36-K39 WeakPolarHBondContact O-CG 3.42Å; R36-W41 HydrophobicContact CG-CH2 4.46Å; R36-H128 PolarHBondContact NH1-CD2 3.45Å
37	C	86	Confident	85	Confident	109 Å²	109	84.3 Å²	84.3	74%	0.736	43%	0.426	S	S	*	.	H	α-helix	trans	-70.1	-42.9	171.8	-71.8	0	0	0	0	112.3	E33 N34 I35	E33-C37 WeakPolarHBondContact O-CB 3.41Å; E33-C37 PolarHBondContact O-N 3.19Å; E33-C37 PolarHBondContact O-SG 3.17Å; N34-C37 PolarHBondContact O-N 3.22Å; I35-C37 VanDerWaalsContact C-N 3.28Å; I35-C37 PolarHBondContact O-N 3.49Å
38	K	90.5	Very high	85.8	Confident	147 Å²	147	81 Å²	81	64%	0.639	40%	0.404	S	S	*	.	H	α-helix	trans	-73.8	-28.6	-177.1	-77.7	173.2	175.9	155.5	0	114.2	N34 I35	N34-K38 WeakPolarHBondContact O-CB 3.23Å; N34-K38 WeakPolarHBondContact O-CG 3.19Å; N34-K38 PolarHBondContact O-N 3.3Å; N34-K38 VanDerWaalsContact OD1-CD 3.31Å; N34-K38 WeakPolarHBondContact OD1-CD 3.33Å; N34-K38 WeakPolarHBondContact OD1-CE 3.28Å; N34-K38 PolarHBondContact OD1-NZ 3.49Å; I35-K38 PolarHBondContact O-N 3.06Å
39	K	90.9	Very high	86.7	Confident	110 Å²	110	82.5 Å²	82.5	48%	0.478	41%	0.41	S	S	.	.			trans	44.3	58.1	-179.6	-56.1	-171.6	177.8	-175	0	113.6	I35 R36 W41 S42	I35-K39 PolarHBondContact O-N 3.26Å; R36-K39 VanDerWaalsContact O-CE 3.3Å; R36-K39 WeakPolarHBondContact O-CE 3.45Å; R36-K39 WeakPolarHBondContact O-CG 3.42Å; K39-W41 HydrophobicContact CB-CZ2 4.16Å; K39-W41 HydrophobicContact CG-CZ2 3.96Å; K39-W41 PolarHBondContact O-N 2.83Å; K39-S42 WeakPolarHBondContact O-CB 3.31Å; K39-S42 PolarHBondContact O-N 2.72Å; K39-S42 PolarHBondContact O-OG 3.34Å
40	P	91.7	Very high	87.9	Confident	38 Å²	38	75 Å²	75	25%	0.247	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-58.8	-30.8	-177.5	24.7	-34.3	0	0	0	113.1	S42 K43 F47	P40-S42 PolarHBondContact O-N 3.22Å; P40-K43 PolarHBondContact O-N 2.87Å; P40-K43 VanDerWaalsContact O-N 3.15Å; P40-F47 HydrophobicContact CB-CD2 4.45Å; P40-F47 HydrophobicContact CB-CE1 4.38Å; P40-F47 HydrophobicContact CB-CE2 3.82Å; P40-F47 HydrophobicContact CB-CZ 3.78Å; P40-F47 HydrophobicContact CG-CE1 3.94Å; P40-F47 HydrophobicContact CG-CE2 4.22Å; P40-F47 HydrophobicContact CG-CZ 3.64Å
41	W	90.8	Very high	89	Confident	19 Å²	19	73.4 Å²	73.4	7%	0.072	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-60.4	-23.6	174.1	50.1	84	0	0	0	114.2	I35 R36 K39 K43 N44 F47 F48 V81 E159 P160	I35-W41 HydrophobicContact CG2-CH2 3.69Å; I35-W41 HydrophobicContact CG2-CZ3 3.45Å; I35-W41 VanDerWaalsContact CG2-CZ3 3.45Å; R36-W41 HydrophobicContact CG-CH2 4.46Å; K39-W41 HydrophobicContact CB-CZ2 4.16Å; K39-W41 HydrophobicContact CG-CZ2 3.96Å; K39-W41 PolarHBondContact O-N 2.83Å; W41-K43 PolarHBondContact O-N 3.35Å; W41-K43 VanDerWaalsContact O-N 3.17Å; W41-N44 CarbonylContact O-C 3.56Å; W41-N44 PolarHBondContact O-N 3.3Å; W41-F47 HydrophobicContact CB-CB 3.96Å; W41-F47 HydrophobicContact CB-CD1 3.81Å; W41-F47 HydrophobicContact CB-CG 4.07Å; W41-F47 HydrophobicContact CE3-CD1 4.44Å; W41-F47 HydrophobicContact CE3-CE1 4.26Å; W41-F48 HydrophobicContact CB-CD2 4.48Å; W41-F48 HydrophobicContact CB-CE2 3.88Å; W41-F48 HydrophobicContact CB-CZ 4.43Å; W41-F48 HydrophobicContact CD2-CE2 4.15Å; W41-F48 HydrophobicContact CD2-CZ 4.13Å; W41-F48 HydrophobicContact CE3-CE1 4.47Å; W41-F48 AromaticContact CE3-CE2 3.96Å; W41-F48 HydrophobicContact CE3-CE2 3.96Å; W41-F48 AromaticContact CE3-CZ 3.47Å; W41-F48 HydrophobicContact CE3-CZ 3.47Å; W41-F48 VanDerWaalsContact CE3-CZ 3.47Å; W41-F48 HydrophobicContact CG-CE2 4.14Å; W41-F48 HydrophobicContact CZ3-CZ 4Å; W41-V81 HydrophobicContact CZ3-CG1 4.45Å; W41-E159 VanDerWaalsContact CD1-CG 3.45Å; W41-E159 HydrophobicContact CG-CG 4.32Å; W41-P160 HydrophobicContact CH2-CB 4.44Å; W41-P160 HydrophobicContact CH2-CG 3.95Å; W41-P160 HydrophobicContact CZ2-CG 4.3Å; W41-P160 HydrophobicContact CZ3-CB 4.49Å; W41-P160 HydrophobicContact CZ3-CG 4.25Å
42	S	88.5	Confident	90	Very high	90 Å²	90	73.8 Å²	73.8	63%	0.629	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-65.7	-18	176.2	-59.9	0	0	0	0	113.3	K39 P40	K39-S42 WeakPolarHBondContact O-CB 3.31Å; K39-S42 PolarHBondContact O-N 2.72Å; K39-S42 PolarHBondContact O-OG 3.34Å; P40-S42 PolarHBondContact O-N 3.22Å
43	K	89.6	Confident	91	Very high	192 Å²	192	71.9 Å²	71.9	84%	0.835	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-93.1	-20.9	179.5	-59.1	-176.6	-178.2	178.3	0	113.5	P40 W41	P40-K43 PolarHBondContact O-N 2.87Å; P40-K43 VanDerWaalsContact O-N 3.15Å; W41-K43 PolarHBondContact O-N 3.35Å; W41-K43 VanDerWaalsContact O-N 3.17Å
44	N	91	Very high	91.8	Very high	80 Å²	80	65.2 Å²	65.2	43%	0.428	32%	0.323	S	S	.	.			trans	-138.9	114.7	-177.9	176.7	6.2	0	0	0	109.6	W41 Q46 F47	W41-N44 CarbonylContact O-C 3.56Å; W41-N44 PolarHBondContact O-N 3.3Å; N44-Q46 PolarHBondContact O-N 2.92Å; N44-Q46 PolarHBondContact OD1-N 2.87Å; N44-F47 HydrophobicContact CB-CB 4.16Å; N44-F47 WeakPolarHBondContact O-CB 3.37Å; N44-F47 PolarHBondContact O-N 3.33Å
45	V	90.2	Very high	92.3	Very high	48 Å²	48	62.9 Å²	62.9	29%	0.291	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-34.4	-178.6	178.5	0	0	0	0	112.5	Y185 P186 Y189 Y218	V45-Y185 HydrophobicContact CG1-CD1 3.64Å; V45-Y185 HydrophobicContact CG1-CE1 4.28Å; V45-P186 VanDerWaalsContact CG1-CD 3.47Å; V45-P186 HydrophobicContact CG1-CG 4.21Å; V45-P186 HydrophobicContact CG2-CG 4.35Å; V45-Y189 HydrophobicContact CB-CD2 4.39Å; V45-Y189 HydrophobicContact CB-CE2 4.21Å; V45-Y189 HydrophobicContact CG1-CD1 4.2Å; V45-Y189 HydrophobicContact CG1-CD2 4.37Å; V45-Y189 HydrophobicContact CG1-CE1 4.29Å; V45-Y189 HydrophobicContact CG1-CE2 4.47Å; V45-Y189 HydrophobicContact CG1-CG 4.23Å; V45-Y189 HydrophobicContact CG2-CD2 3.84Å; V45-Y189 HydrophobicContact CG2-CE2 3.95Å; V45-Y189 HydrophobicContact CG2-CG 4.41Å; V45-Y218 PolarHBondContact O-OH 3.23Å
46	Q	91.6	Very high	92.8	Very high	70 Å²	70	66.5 Å²	66.5	33%	0.327	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	41.9	175.3	-66.8	-175.5	-27.1	0	0	111.1	N44 Y185 Y218	N44-Q46 PolarHBondContact O-N 2.92Å; N44-Q46 PolarHBondContact OD1-N 2.87Å; Q46-Y185 HydrophobicContact CG-CE1 3.95Å; Q46-Y185 PolarHBondContact NE2-OH 3.36Å; Q46-Y218 HydrophobicContact CG-CD1 4.31Å; Q46-Y218 HydrophobicContact CG-CE1 4.23Å
47	F	95.1	Very high	93.4	Very high	41 Å²	41	62.4 Å²	62.4	18%	0.18	32%	0.315	C	S	.	.			trans	-61.4	-48.8	176.4	176.6	-102.5	0	0	0	111.3	P40 W41 N44 D83 N84	P40-F47 HydrophobicContact CB-CD2 4.45Å; P40-F47 HydrophobicContact CB-CE1 4.38Å; P40-F47 HydrophobicContact CB-CE2 3.82Å; P40-F47 HydrophobicContact CB-CZ 3.78Å; P40-F47 HydrophobicContact CG-CE1 3.94Å; P40-F47 HydrophobicContact CG-CE2 4.22Å; P40-F47 HydrophobicContact CG-CZ 3.64Å; W41-F47 HydrophobicContact CB-CB 3.96Å; W41-F47 HydrophobicContact CB-CD1 3.81Å; W41-F47 HydrophobicContact CB-CG 4.07Å; W41-F47 HydrophobicContact CE3-CD1 4.44Å; W41-F47 HydrophobicContact CE3-CE1 4.26Å; N44-F47 HydrophobicContact CB-CB 4.16Å; N44-F47 WeakPolarHBondContact O-CB 3.37Å; N44-F47 PolarHBondContact O-N 3.33Å; F47-D83 WeakPolarHBondContact CE1-O 3.24Å; F47-D83 WeakPolarHBondContact CZ-O 3.39Å; F47-N84 VanDerWaalsContact O-CB 3.31Å; F47-N84 WeakPolarHBondContact O-CB 3.39Å
48	F	96.5	Very high	94	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.009	29%	0.286	C	S	.	.			trans	-78.6	132.3	177	-64.3	-63.7	0	0	0	110.8	W41 V81 I86 P160 Y218 L220	W41-F48 HydrophobicContact CB-CD2 4.48Å; W41-F48 HydrophobicContact CB-CE2 3.88Å; W41-F48 HydrophobicContact CB-CZ 4.43Å; W41-F48 HydrophobicContact CD2-CE2 4.15Å; W41-F48 HydrophobicContact CD2-CZ 4.13Å; W41-F48 HydrophobicContact CE3-CE1 4.47Å; W41-F48 AromaticContact CE3-CE2 3.96Å; W41-F48 HydrophobicContact CE3-CE2 3.96Å; W41-F48 AromaticContact CE3-CZ 3.47Å; W41-F48 HydrophobicContact CE3-CZ 3.47Å; W41-F48 VanDerWaalsContact CE3-CZ 3.47Å; W41-F48 HydrophobicContact CG-CE2 4.14Å; W41-F48 HydrophobicContact CZ3-CZ 4Å; F48-V81 HydrophobicContact CE1-CG1 3.5Å; F48-V81 VanDerWaalsContact CE1-CG1 3.5Å; F48-V81 HydrophobicContact CE1-CG2 4.39Å; F48-V81 HydrophobicContact CZ-CG1 3.9Å; F48-V81 HydrophobicContact CZ-CG2 4.4Å; F48-I86 HydrophobicContact CB-CD1 4.35Å; F48-I86 HydrophobicContact CD1-CD1 4.13Å; F48-I86 HydrophobicContact CD1-CG1 3.65Å; F48-I86 HydrophobicContact CD2-CD1 4.13Å; F48-I86 HydrophobicContact CE1-CG1 3.9Å; F48-I86 HydrophobicContact CE2-CD1 4.47Å; F48-I86 HydrophobicContact CG-CD1 3.94Å; F48-I86 HydrophobicContact CG-CG1 3.99Å; F48-I86 HydrophobicContact CZ-CG1 4.38Å; F48-P160 HydrophobicContact CE2-CB 3.79Å; F48-P160 HydrophobicContact CZ-CB 3.75Å; F48-Y218 WeakPolarHBondContact O-CE2 3.13Å; F48-L220 HydrophobicContact CB-CD2 3.88Å
49	K	95.1	Very high	94.2	Very high	118 Å²	118	55.5 Å²	55.5	51%	0.513	28%	0.275	S	S	.	.			trans	-127.3	-24	179.5	-64.2	-173.5	179.6	-175.6	0	113.4	N84 L220 E221	K49-N84 PolarHBondContact N-O 3.44Å; K49-L220 WeakPolarHBondContact O-CA 3.45Å; K49-E221 PolarHBondContact O-N 3.1Å
50	H	97.6	Very high	94.6	Very high	52 Å²	52	53.8 Å²	53.8	24%	0.241	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146.2	-174.2	-49.8	-81.1	0	0	0	110.8	I85 I86 E221	H50-I85 HydrophobicContact CB-CG1 4.19Å; H50-I85 HydrophobicContact CB-CG2 4.19Å; H50-I85 WeakPolarHBondContact O-CA 3.46Å; H50-I86 PolarHBondContact O-N 3.22Å; H50-E221 CarbonylContact C-O 3.58Å; H50-E221 VanDerWaalsContact CA-O 3.27Å; H50-E221 WeakPolarHBondContact CA-O 3.31Å; H50-E221 IonicContact CE1-OE2 3.26Å; H50-E221 PolarHBondContact CE1-OE2 2.95Å; H50-E221 IonicContact ND1-OE2 3.43Å; H50-E221 PolarHBondContact ND1-OE2 3.44Å
51	V	98.2	Very high	94.9	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.4	164.9	176.8	0	0	0	0	107.8	I86 V88 V162 I164 A181 L220 E221 I222 T223	V51-I86 CarbonylContact C-O 3.53Å; V51-I86 VanDerWaalsContact CA-O 3.27Å; V51-I86 WeakPolarHBondContact CA-O 3.3Å; V51-I86 HydrophobicContact CG2-CB 4.42Å; V51-V88 HydrophobicContact CG1-CG2 3.99Å; V51-V162 HydrophobicContact CG2-CG2 4.11Å; V51-I164 HydrophobicContact CG1-CD1 4.37Å; V51-A181 HydrophobicContact CB-CB 4.27Å; V51-A181 HydrophobicContact CG2-CB 3.7Å; V51-L220 HydrophobicContact CG2-CB 4Å; V51-L220 HydrophobicContact CG2-CD2 3.83Å; V51-E221 PolarHBondContact N-O 3.36Å; V51-I222 HydrophobicContact CB-CG1 4.42Å; V51-I222 CarbonylContact O-C 3.54Å; V51-I222 WeakPolarHBondContact O-CA 3.16Å; V51-T223 PolarHBondContact O-N 3.44Å; V51-T223 PolarHBondContact O-OG1 2.82Å
52	K	97.4	Very high	95.2	Very high	72 Å²	72	52.2 Å²	52.2	31%	0.313	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	121.2	167.7	-89.5	-175.5	178.2	-166.8	0	108.2	I24 I85 I86 I87 V88 T223 F225	I24-K52 HydrophobicContact CD1-CD 4.08Å; K52-I85 HydrophobicContact CB-CG2 4.07Å; K52-I85 HydrophobicContact CD-CG2 4.23Å; K52-I85 HydrophobicContact CG-CG2 3.95Å; K52-I86 PolarHBondContact N-O 2.88Å; K52-I87 HydrophobicContact CB-CG1 4.23Å; K52-I87 HydrophobicContact CB-CG2 4.4Å; K52-I87 CarbonylContact O-C 3.52Å; K52-I87 WeakPolarHBondContact O-CA 3.01Å; K52-V88 PolarHBondContact O-N 3.41Å; K52-T223 CarbonylContact C-O 3.56Å; K52-T223 WeakPolarHBondContact CA-O 3.29Å; K52-T223 WeakPolarHBondContact CG-OG1 3.17Å; K52-F225 HydrophobicContact CB-CD1 3.99Å; K52-F225 HydrophobicContact CB-CE1 4.1Å
53	M	97.4	Very high	95.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.9	-178.7	-175.9	179.1	-69.2	0	0	111	A57 L58 I61 V88 I164 I179 I222 T223 Y224 F225	M53-A57 HydrophobicContact CG-CB 3.88Å; M53-L58 HydrophobicContact CG-CB 4.4Å; M53-L58 HydrophobicContact SD-CB 3.85Å; M53-L58 HydrophobicContact SD-CD1 3.96Å; M53-I61 HydrophobicContact CE-CD1 3.88Å; M53-I61 HydrophobicContact SD-CD1 4.13Å; M53-V88 HydrophobicContact CB-CB 4.48Å; M53-V88 HydrophobicContact CG-CB 4.32Å; M53-V88 HydrophobicContact CG-CG1 4.43Å; M53-I164 HydrophobicContact CE-CD1 3.23Å; M53-I164 HydrophobicContact CE-CG2 4.21Å; M53-I179 HydrophobicContact CE-CD1 3.92Å; M53-I179 HydrophobicContact SD-CD1 4.09Å; M53-I222 HydrophobicContact CB-CG2 4.49Å; M53-T223 PolarHBondContact N-O 3.45Å; M53-Y224 HydrophobicContact CB-CD1 4.08Å; M53-Y224 HydrophobicContact CB-CE1 4.32Å; M53-Y224 VanDerWaalsContact O-CA 3.28Å; M53-Y224 WeakPolarHBondContact O-CA 3.31Å; M53-Y224 HydrophobicContact SD-CE1 4.42Å; M53-F225 WeakPolarHBondContact O-CD1 3.03Å; M53-F225 PolarHBondContact O-N 2.94Å; M53-F225 VanDerWaalsContact O-N 3.08Å
54	S	96.2	Very high	95.9	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.007	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	145	173.5	82.6	0	0	0	0	110	L56 A57 L58 V88 M89 F225	S54-L56 PolarHBondContact O-N 3.05Å; S54-A57 PolarHBondContact O-N 3.18Å; S54-A57 VanDerWaalsContact OG-CB 3.3Å; S54-A57 WeakPolarHBondContact OG-CB 3.41Å; S54-A57 PolarHBondContact OG-N 3.39Å; S54-L58 PolarHBondContact O-N 3.39Å; S54-V88 PolarHBondContact N-O 3.19Å; S54-M89 WeakPolarHBondContact CB-O 3.48Å; S54-M89 PolarHBondContact OG-O 3.15Å; S54-F225 WeakPolarHBondContact CA-O 3.34Å; S54-F225 VanDerWaalsContact CB-CZ 3.49Å
55	T	95.1	Very high	96.1	Very high	29 Å²	29	41.6 Å²	41.6	18%	0.178	20%	0.204	C	C	.	.	H	α-helix	trans	-58.7	-30.4	174.7	-47.7	0	0	0	0	111.9	M59 F225 C226 L234	T55-M59 HydrophobicContact CG2-CE 3.93Å; T55-M59 HydrophobicContact CG2-SD 4.38Å; T55-M59 VanDerWaalsContact O-CG 3.31Å; T55-M59 WeakPolarHBondContact O-CG 3.13Å; T55-M59 PolarHBondContact O-N 3.29Å; T55-F225 PolarHBondContact N-O 2.69Å; T55-F225 PolarHBondContact OG1-O 3.45Å; T55-F225 VanDerWaalsContact OG1-O 3.11Å; T55-C226 WeakPolarHBondContact OG1-CB 3.27Å; T55-L234 HydrophobicContact CG2-CD1 4.15Å
56	L	94.7	Very high	96.2	Very high	93 Å²	93	44 Å²	44	49%	0.487	21%	0.212	S	C	.	.	H	α-helix	trans	-63.7	-50.5	175.1	178.5	64	0	0	0	111.6	S54 L58 M59 K60	S54-L56 PolarHBondContact O-N 3.05Å; L56-L58 VanDerWaalsContact C-N 3.32Å; L56-L58 PolarHBondContact O-N 3.07Å; L56-M59 PolarHBondContact O-N 3.15Å; L56-K60 HydrophobicContact CG-CD 4.43Å; L56-K60 WeakPolarHBondContact O-CG 3.32Å; L56-K60 PolarHBondContact O-N 3.36Å
57	A	97.5	Very high	96.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57.5	-46.9	176.5	0	0	0	0	0	110.9	M53 S54 M59 K60 I61 V88 V91	M53-A57 HydrophobicContact CG-CB 3.88Å; S54-A57 PolarHBondContact O-N 3.18Å; S54-A57 VanDerWaalsContact OG-CB 3.3Å; S54-A57 WeakPolarHBondContact OG-CB 3.41Å; S54-A57 PolarHBondContact OG-N 3.39Å; A57-M59 PolarHBondContact O-N 3.17Å; A57-K60 PolarHBondContact O-N 2.96Å; A57-I61 WeakPolarHBondContact O-CG1 3.38Å; A57-I61 PolarHBondContact O-N 2.91Å; A57-V88 HydrophobicContact CB-CG1 3.87Å; A57-V91 HydrophobicContact CB-CG1 3.84Å
58	L	97.8	Very high	96.1	Very high	24 Å²	24	43.1 Å²	43.1	13%	0.126	22%	0.221	C	C	.	.	H	α-helix	trans	-56	-50	177.2	-179.3	64.8	0	0	0	111.9	M53 S54 L56 K60 I61 V62 V177 I179 Y224	M53-L58 HydrophobicContact CG-CB 4.4Å; M53-L58 HydrophobicContact SD-CB 3.85Å; M53-L58 HydrophobicContact SD-CD1 3.96Å; S54-L58 PolarHBondContact O-N 3.39Å; L56-L58 VanDerWaalsContact C-N 3.32Å; L56-L58 PolarHBondContact O-N 3.07Å; L58-K60 PolarHBondContact O-N 2.89Å; L58-I61 PolarHBondContact O-N 3Å; L58-V62 HydrophobicContact CD1-CG2 4.2Å; L58-V62 WeakPolarHBondContact O-CG2 3.29Å; L58-V62 PolarHBondContact O-N 3.06Å; L58-V177 HydrophobicContact CD1-CG1 4.07Å; L58-I179 HydrophobicContact CD1-CD1 3.94Å; L58-Y224 HydrophobicContact CD1-CE1 3.95Å; L58-Y224 HydrophobicContact CD2-CD1 3.94Å; L58-Y224 HydrophobicContact CD2-CE1 3.7Å; L58-Y224 HydrophobicContact CG-CE1 4.29Å
59	M	96.2	Very high	95.7	Very high	86 Å²	86	50.7 Å²	50.7	42%	0.424	25%	0.253	S	S	.	.	H	α-helix	trans	-62.7	-41.8	-179.9	-74.3	179.4	172.2	0	0	112.1	T55 L56 A57 N63 L234	T55-M59 HydrophobicContact CG2-CE 3.93Å; T55-M59 HydrophobicContact CG2-SD 4.38Å; T55-M59 VanDerWaalsContact O-CG 3.31Å; T55-M59 WeakPolarHBondContact O-CG 3.13Å; T55-M59 PolarHBondContact O-N 3.29Å; L56-M59 PolarHBondContact O-N 3.15Å; A57-M59 PolarHBondContact O-N 3.17Å; M59-N63 VanDerWaalsContact O-CB 3.28Å; M59-N63 WeakPolarHBondContact O-CB 3.46Å; M59-N63 PolarHBondContact O-N 3.24Å; M59-N63 PolarHBondContact O-ND2 3.17Å; M59-L234 HydrophobicContact CE-CD2 3.64Å
60	K	97.9	Very high	95.4	Very high	74 Å²	74	50.5 Å²	50.5	32%	0.322	26%	0.258	S	S	.	.	H	α-helix	trans	-62.5	-47.1	176.4	-75.9	-179.3	174.7	-175.2	0	111.8	L56 A57 L58 H64 D90 V91	L56-K60 HydrophobicContact CG-CD 4.43Å; L56-K60 WeakPolarHBondContact O-CG 3.32Å; L56-K60 PolarHBondContact O-N 3.36Å; A57-K60 PolarHBondContact O-N 2.96Å; L58-K60 PolarHBondContact O-N 2.89Å; K60-H64 VanDerWaalsContact O-CB 3.28Å; K60-H64 WeakPolarHBondContact O-CB 3.27Å; K60-H64 PolarHBondContact O-N 3.41Å; K60-D90 WeakPolarHBondContact CD-OD1 3.48Å; K60-D90 WeakPolarHBondContact CE-OD1 3.41Å; K60-D90 IonicContact NZ-OD1 3.2Å; K60-D90 PolarHBondContact NZ-OD1 3.15Å; K60-D90 IonicContact NZ-OD2 3.31Å; K60-D90 PolarHBondContact NZ-OD2 3.23Å; K60-V91 HydrophobicContact CB-CG2 3.41Å; K60-V91 VanDerWaalsContact CB-CG2 3.41Å; K60-V91 HydrophobicContact CD-CG2 3.85Å; K60-V91 HydrophobicContact CG-CG2 4.3Å; K60-V91 PolarHBondContact NZ-O 2.98Å
61	I	98.1	Very high	95	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.4	-51.7	177.2	-69.5	175.2	0	0	0	110.3	M53 A57 L58 N63 H64 A65 L77 V91 Y133 I164 V166	M53-I61 HydrophobicContact CE-CD1 3.88Å; M53-I61 HydrophobicContact SD-CD1 4.13Å; A57-I61 WeakPolarHBondContact O-CG1 3.38Å; A57-I61 PolarHBondContact O-N 2.91Å; L58-I61 PolarHBondContact O-N 3Å; I61-N63 PolarHBondContact O-N 3.18Å; I61-H64 PolarHBondContact O-N 2.93Å; I61-A65 WeakPolarHBondContact O-CB 3.34Å; I61-A65 PolarHBondContact O-N 2.91Å; I61-L77 HydrophobicContact CD1-CD2 4.09Å; I61-V91 HydrophobicContact CD1-CG1 4.01Å; I61-V91 HydrophobicContact CG1-CB 4.42Å; I61-V91 HydrophobicContact CG1-CG1 4Å; I61-V91 HydrophobicContact CG1-CG2 4Å; I61-Y133 HydrophobicContact CB-CD2 4.28Å; I61-Y133 HydrophobicContact CB-CE2 4.25Å; I61-Y133 HydrophobicContact CD1-CD1 4.27Å; I61-Y133 HydrophobicContact CD1-CD2 4.45Å; I61-Y133 HydrophobicContact CD1-CG 4.07Å; I61-Y133 HydrophobicContact CG1-CD1 4Å; I61-Y133 HydrophobicContact CG1-CD2 3.93Å; I61-Y133 HydrophobicContact CG1-CE1 4.08Å; I61-Y133 HydrophobicContact CG1-CE2 4.02Å; I61-Y133 HydrophobicContact CG1-CG 3.91Å; I61-Y133 HydrophobicContact CG2-CD2 3.72Å; I61-Y133 HydrophobicContact CG2-CE2 4.02Å; I61-Y133 HydrophobicContact CG2-CG 4.34Å; I61-I164 HydrophobicContact CD1-CG2 4.46Å; I61-V166 HydrophobicContact CG2-CB 4.02Å; I61-V166 HydrophobicContact CG2-CG1 3.68Å; I61-V166 HydrophobicContact CG2-CG2 4.36Å
62	V	97.2	Very high	94.6	Very high	25 Å²	25	53.1 Å²	53.1	15%	0.152	27%	0.273	C	S	.	.	H	α-helix	trans	-63.9	-44.6	-176.2	172.5	0	0	0	0	111.2	L58 H64 A65 Q66 V166 T171 V177	L58-V62 HydrophobicContact CD1-CG2 4.2Å; L58-V62 WeakPolarHBondContact O-CG2 3.29Å; L58-V62 PolarHBondContact O-N 3.06Å; V62-H64 PolarHBondContact O-N 2.97Å; V62-A65 PolarHBondContact O-N 3.31Å; V62-Q66 WeakPolarHBondContact O-CB 3.45Å; V62-Q66 PolarHBondContact O-N 2.86Å; V62-V166 HydrophobicContact CG2-CG2 4.38Å; V62-T171 HydrophobicContact CG1-CG2 4.41Å; V62-V177 HydrophobicContact CG2-CG1 3.79Å; V62-V177 HydrophobicContact CG2-CG2 4.4Å
63	N	96	Very high	94.4	Very high	104 Å²	104	50.2 Å²	50.2	56%	0.556	26%	0.261	S	S	*	.	H	α-helix	trans	-63	-42	177.3	-74.1	-13.7	0	0	0	111.8	M59 I61 Q66 S67	M59-N63 VanDerWaalsContact O-CB 3.28Å; M59-N63 WeakPolarHBondContact O-CB 3.46Å; M59-N63 PolarHBondContact O-N 3.24Å; M59-N63 PolarHBondContact O-ND2 3.17Å; I61-N63 PolarHBondContact O-N 3.18Å; N63-Q66 PolarHBondContact O-N 3.37Å; N63-S67 PolarHBondContact O-N 2.98Å
64	H	96.5	Very high	94.2	Very high	34 Å²	34	51.9 Å²	51.9	16%	0.157	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-47.9	177.5	-177.6	-144.9	0	0	0	111.5	K60 I61 V62 Q66 S67 G68 M74 A93 Y133	K60-H64 VanDerWaalsContact O-CB 3.28Å; K60-H64 WeakPolarHBondContact O-CB 3.27Å; K60-H64 PolarHBondContact O-N 3.41Å; I61-H64 PolarHBondContact O-N 2.93Å; V62-H64 PolarHBondContact O-N 2.97Å; H64-Q66 VanDerWaalsContact C-N 3.3Å; H64-Q66 PolarHBondContact O-N 2.82Å; H64-S67 WeakPolarHBondContact O-CB 3.35Å; H64-S67 PolarHBondContact O-N 2.84Å; H64-S67 PolarHBondContact O-OG 3.19Å; H64-G68 PolarHBondContact O-N 3.08Å; H64-M74 PolarHBondContact CE1-O 3.05Å; H64-A93 WeakPolarHBondContact CE1-CB 3.28Å; H64-Y133 AromaticContact ND1-CE2 3.73Å; H64-Y133 AromaticContact ND1-CZ 3.66Å; H64-Y133 PolarHBondContact ND1-OH 3.41Å
65	A	95.2	Very high	94.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.6	-41	176.5	0	0	0	0	0	112.2	I61 V62 S67 G68 V166 P168	I61-A65 WeakPolarHBondContact O-CB 3.34Å; I61-A65 PolarHBondContact O-N 2.91Å; V62-A65 PolarHBondContact O-N 3.31Å; A65-S67 VanDerWaalsContact C-N 3.3Å; A65-S67 PolarHBondContact O-N 3.4Å; A65-G68 PolarHBondContact O-N 3.25Å; A65-V166 HydrophobicContact CB-CG1 3.49Å; A65-V166 VanDerWaalsContact CB-CG1 3.49Å; A65-P168 HydrophobicContact CB-CB 3.99Å; A65-P168 HydrophobicContact CB-CG 4.07Å
66	Q	93.6	Very high	94.1	Very high	99 Å²	99	51.1 Å²	51.1	46%	0.463	26%	0.264	S	S	.	.	H	α-helix	trans	-65	-34.5	176.1	-168.1	175.5	24.8	0	0	112.2	V62 N63 H64 G68 K69	V62-Q66 WeakPolarHBondContact O-CB 3.45Å; V62-Q66 PolarHBondContact O-N 2.86Å; N63-Q66 PolarHBondContact O-N 3.37Å; H64-Q66 VanDerWaalsContact C-N 3.3Å; H64-Q66 PolarHBondContact O-N 2.82Å; Q66-G68 VanDerWaalsContact C-N 3.28Å; Q66-G68 PolarHBondContact O-N 2.84Å; Q66-K69 PolarHBondContact O-N 2.82Å
67	S	93.2	Very high	94.2	Very high	81 Å²	81	46.7 Å²	46.7	57%	0.566	24%	0.241	S	C	*	.	H	α-helix	trans	-66.5	-28.6	177.3	78.4	0	0	0	0	113.3	N63 H64 A65 K69	N63-S67 PolarHBondContact O-N 2.98Å; H64-S67 WeakPolarHBondContact O-CB 3.35Å; H64-S67 PolarHBondContact O-N 2.84Å; H64-S67 PolarHBondContact O-OG 3.19Å; A65-S67 VanDerWaalsContact C-N 3.3Å; A65-S67 PolarHBondContact O-N 3.4Å; S67-K69 PolarHBondContact O-N 2.82Å
68	G	90.9	Very high	94.1	Very high	12 Å²	12	46.9 Å²	46.9	12%	0.124	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-14	174.8	0	0	0	0	0	114.6	H64 A65 Q66 N70 L71	H64-G68 PolarHBondContact O-N 3.08Å; A65-G68 PolarHBondContact O-N 3.25Å; Q66-G68 VanDerWaalsContact C-N 3.28Å; Q66-G68 PolarHBondContact O-N 2.84Å; G68-N70 PolarHBondContact O-N 2.93Å; G68-N70 VanDerWaalsContact O-N 3.09Å; G68-L71 WeakPolarHBondContact O-CB 3.22Å; G68-L71 PolarHBondContact O-N 2.77Å
69	K	88.5	Confident	93.9	Very high	160 Å²	160	45.9 Å²	45.9	70%	0.696	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	-109.6	-176.3	-57.1	176.2	-179	175.8	0	111.7	Q66 S67	Q66-K69 PolarHBondContact O-N 2.82Å; S67-K69 PolarHBondContact O-N 2.82Å
70	N	88.4	Confident	93.8	Very high	115 Å²	115	42.6 Å²	42.6	62%	0.615	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	0.5	-179.9	-61.6	-24.1	0	0	0	112.4	G68 I169	G68-N70 PolarHBondContact O-N 2.93Å; G68-N70 VanDerWaalsContact O-N 3.09Å; N70-I169 WeakPolarHBondContact OD1-CD1 3.27Å
71	L	89	Confident	93.5	Very high	87 Å²	87	39.3 Å²	39.3	46%	0.455	21%	0.207	S	C	.	.	S	Bend	trans	-95.2	144.5	175.8	-58.3	176.8	0	0	0	109.6	G68	G68-L71 WeakPolarHBondContact O-CB 3.22Å; G68-L71 PolarHBondContact O-N 2.77Å
72	E	90.8	Very high	93.2	Very high	19 Å²	19	42.8 Å²	42.8	9%	0.089	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	138.1	170.7	-55	-176.7	139.2	0	0	108.9	G98 E100 S135 H136 Y139	E72-G98 VanDerWaalsContact O-CA 3.25Å; E72-G98 WeakPolarHBondContact O-CA 3.35Å; E72-G98 PolarHBondContact O-N 2.93Å; E72-E100 VanDerWaalsContact CD-CG 3.43Å; E72-E100 WeakPolarHBondContact OE1-CG 3.32Å; E72-E100 WeakPolarHBondContact OE2-CG 3.3Å; E72-E100 PolarHBondContact OE2-N 2.82Å; E72-E100 VanDerWaalsContact OE2-N 3.13Å; E72-S135 WeakPolarHBondContact CA-OG 3.34Å; E72-S135 WeakPolarHBondContact CB-O 3.43Å; E72-S135 VanDerWaalsContact CG-O 3.3Å; E72-S135 WeakPolarHBondContact CG-O 3.47Å; E72-H136 IonicContact OE1-CD2 2.69Å; E72-H136 PolarHBondContact OE1-CD2 3.04Å; E72-H136 VanDerWaalsContact OE1-CD2 3.31Å; E72-H136 IonicContact OE1-NE2 2.73Å; E72-Y139 WeakPolarHBondContact CG-OH 3.48Å; E72-Y139 PolarHBondContact OE1-OH 2.86Å
73	V	92.3	Very high	92.8	Very high	12 Å²	12	46 Å²	46	7%	0.073	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	156.1	170.8	-63.6	0	0	0	0	108.2	H134 S135	V73-H134 CarbonylContact O-C 3.52Å; V73-H134 WeakPolarHBondContact O-CA 3.36Å; V73-H134 WeakPolarHBondContact O-CB 3.22Å; V73-S135 PolarHBondContact N-OG 3.42Å; V73-S135 PolarHBondContact O-N 3.1Å
74	M	93.7	Very high	92.7	Very high	35 Å²	35	43.6 Å²	43.6	17%	0.172	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	162.8	178.7	60.5	160.6	41.7	0	0	113.4	H64 L94 V96 A105 W132 Y133 H134	H64-M74 PolarHBondContact CE1-O 3.05Å; M74-L94 HydrophobicContact CG-CD1 4.5Å; M74-L94 PolarHBondContact O-N 3.24Å; M74-L94 HydrophobicContact SD-CD1 4.23Å; M74-V96 HydrophobicContact CG-CG2 3.39Å; M74-V96 HydrophobicContact SD-CG2 3.79Å; M74-A105 HydrophobicContact SD-CB 4.26Å; M74-W132 HydrophobicContact CE-CE3 3.77Å; M74-W132 HydrophobicContact CE-CZ3 3.55Å; M74-Y133 CarbonylContact C-O 3.41Å; M74-Y133 WeakPolarHBondContact CA-O 3.42Å; M74-Y133 VanDerWaalsContact CB-O 3.29Å; M74-Y133 WeakPolarHBondContact CB-O 3.37Å; M74-H134 HydrophobicContact CB-CB 3.92Å
75	G	94.2	Very high	92.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	-179.2	176.3	0	0	0	0	0	112.4	Y92 W132 Y133	G75-Y92 CarbonylContact C-O 3.49Å; G75-Y92 WeakPolarHBondContact CA-O 3.18Å; G75-W132 CarbonylContact O-C 3.58Å; G75-W132 VanDerWaalsContact O-CA 3.31Å; G75-W132 WeakPolarHBondContact O-CA 3.46Å; G75-Y133 VanDerWaalsContact C-CE1 3.47Å; G75-Y133 PolarHBondContact N-O 3.28Å; G75-Y133 WeakPolarHBondContact O-CD1 3.37Å; G75-Y133 PolarHBondContact O-N 3.3Å
76	M	95	Very high	92.8	Very high	13 Å²	13	43.7 Å²	43.7	6%	0.064	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	150.1	-176.6	-57	-56.5	-66	0	0	111	V91 Y92 L94 M113 V129 W132 F161	M76-V91 VanDerWaalsContact O-CA 3.29Å; M76-V91 WeakPolarHBondContact O-CA 3.41Å; M76-V91 WeakPolarHBondContact O-CB 3.29Å; M76-Y92 HydrophobicContact CB-CD1 4.15Å; M76-Y92 HydrophobicContact CB-CD2 4.28Å; M76-Y92 HydrophobicContact CB-CE1 3.56Å; M76-Y92 HydrophobicContact CB-CE2 3.73Å; M76-Y92 HydrophobicContact CB-CG 4.49Å; M76-Y92 HydrophobicContact CG-CE1 4.38Å; M76-Y92 HydrophobicContact CG-CE2 3.71Å; M76-Y92 PolarHBondContact N-O 3.49Å; M76-Y92 PolarHBondContact O-N 3.28Å; M76-Y92 VanDerWaalsContact O-N 3.13Å; M76-L94 HydrophobicContact CG-CD1 4.01Å; M76-L94 HydrophobicContact CG-CD2 4.04Å; M76-L94 HydrophobicContact CG-CG 4.09Å; M76-L94 HydrophobicContact SD-CD1 3.93Å; M76-M113 HydrophobicContact CE-CE 3.49Å; M76-M113 VanDerWaalsContact CE-CE 3.49Å; M76-M113 HydrophobicContact CG-CE 4.07Å; M76-M113 HydrophobicContact CG-CG 4.29Å; M76-M113 HydrophobicContact CG-SD 4.28Å; M76-M113 HydrophobicContact SD-CE 3.86Å; M76-M113 HydrophobicContact SD-SD 4.19Å; M76-V129 HydrophobicContact CE-CG1 3.36Å; M76-W132 HydrophobicContact CE-CB 4.45Å; M76-W132 HydrophobicContact SD-CB 4.08Å; M76-F161 HydrophobicContact CE-CZ 3.8Å
77	L	96.9	Very high	92.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.6	179.4	-53.3	177	0	0	0	109.5	I61 V88 V91 V129 I130 G131 W132 Y133 V162 I164	I61-L77 HydrophobicContact CD1-CD2 4.09Å; L77-V88 HydrophobicContact CB-CG1 4.3Å; L77-V88 HydrophobicContact CD1-CG2 4.23Å; L77-V88 HydrophobicContact CD2-CG1 4.1Å; L77-V91 HydrophobicContact CD2-CB 4.35Å; L77-V91 HydrophobicContact CD2-CG1 3.36Å; L77-V129 CarbonylContact O-C 3.52Å; L77-V129 VanDerWaalsContact O-CA 3.3Å; L77-V129 WeakPolarHBondContact O-CA 3.08Å; L77-I130 HydrophobicContact CB-CG1 4.17Å; L77-I130 WeakPolarHBondContact O-CG1 3.43Å; L77-I130 PolarHBondContact O-N 2.66Å; L77-G131 PolarHBondContact N-O 3.5Å; L77-W132 WeakPolarHBondContact CD1-O 3.43Å; L77-Y133 HydrophobicContact CD2-CD1 3.7Å; L77-Y133 HydrophobicContact CD2-CG 4.33Å; L77-V162 HydrophobicContact CD1-CG1 3.76Å; L77-I164 HydrophobicContact CD1-CB 4.35Å; L77-I164 HydrophobicContact CD1-CD1 3.54Å; L77-I164 HydrophobicContact CD1-CG1 3.77Å; L77-I164 HydrophobicContact CD2-CD1 4.42Å
78	Q	94.5	Very high	93.1	Very high	5 Å²	5	35.2 Å²	35.2	2%	0.023	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	136.6	172.5	-72.4	172.2	-63	0	0	110.3	M89 D90 Y92 S120 E127 H128	Q78-M89 PolarHBondContact O-N 3.11Å; Q78-D90 PolarHBondContact N-O 2.98Å; Q78-D90 PolarHBondContact O-N 2.95Å; Q78-D90 VanDerWaalsContact O-N 3.09Å; Q78-D90 VanDerWaalsContact O-O 3.13Å; Q78-Y92 HydrophobicContact CG-CD1 4.27Å; Q78-Y92 HydrophobicContact CG-CE1 3.95Å; Q78-S120 PolarHBondContact NE2-OG 2.98Å; Q78-E127 HydrophobicContact CB-CB 4.3Å; Q78-H128 WeakPolarHBondContact CA-O 3.21Å
79	G	94.6	Very high	93.3	Very high	3 Å²	3	35.5 Å²	35.5	3%	0.031	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.8	-150.5	178.5	0	0	0	0	0	114.1	I87 H128 I130	G79-I87 VanDerWaalsContact CA-O 3.25Å; G79-I87 WeakPolarHBondContact CA-O 3.36Å; G79-H128 PolarHBondContact N-O 2.88Å; G79-I130 WeakPolarHBondContact O-CG2 3.24Å
80	K	92.8	Very high	93.6	Very high	16 Å²	16	28.8 Å²	28.8	7%	0.07	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	174.8	-174	62.8	-173.6	174.4	-163.8	0	112	I24 V26 D32 I87	I24-K80 VanDerWaalsContact O-CE 3.28Å; I24-K80 WeakPolarHBondContact O-CE 3.47Å; I24-K80 PolarHBondContact O-NZ 2.67Å; V26-K80 PolarHBondContact O-NZ 3.34Å; D32-K80 WeakPolarHBondContact OD2-CB 3.25Å; K80-I87 HydrophobicContact CG-CB 4.14Å; K80-I87 HydrophobicContact CG-CD1 4.37Å; K80-I87 PolarHBondContact N-O 2.91Å; K80-I87 PolarHBondContact O-N 3.39Å
81	V	92.6	Very high	94	Very high	6 Å²	6	23.4 Å²	23.4	4%	0.036	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	132	178.4	171.1	0	0	0	0	109.1	Y31 I35 W41 F48 I86 P160	Y31-V81 WeakPolarHBondContact CE1-O 3.44Å; I35-V81 HydrophobicContact CG2-CG1 4.3Å; W41-V81 HydrophobicContact CZ3-CG1 4.45Å; F48-V81 HydrophobicContact CE1-CG1 3.5Å; F48-V81 VanDerWaalsContact CE1-CG1 3.5Å; F48-V81 HydrophobicContact CE1-CG2 4.39Å; F48-V81 HydrophobicContact CZ-CG1 3.9Å; F48-V81 HydrophobicContact CZ-CG2 4.4Å; V81-I86 HydrophobicContact CG2-CG1 4.28Å; V81-P160 HydrophobicContact CB-CG 4.46Å; V81-P160 HydrophobicContact CG2-CB 4.07Å; V81-P160 HydrophobicContact CG2-CG 3.49Å; V81-P160 VanDerWaalsContact CG2-CG 3.49Å
82	Q	90.9	Very high	94.3	Very high	72 Å²	72	19.8 Å²	19.8	34%	0.336	10%	0.101	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	118.9	173.4	-169.2	-179.7	-28.3	0	0	109.4	Y31 N84 I85 I87	Y31-Q82 HydrophobicContact CE1-CB 4.35Å; Y31-Q82 HydrophobicContact CE1-CG 4.15Å; Q82-N84 PolarHBondContact O-N 3.32Å; Q82-N84 VanDerWaalsContact O-N 3.17Å; Q82-I85 PolarHBondContact N-O 2.9Å; Q82-I85 WeakPolarHBondContact O-CB 3.41Å; Q82-I85 PolarHBondContact O-N 3.26Å; Q82-I87 HydrophobicContact CB-CD1 3.73Å
83	D	90.2	Very high	94.4	Very high	94 Å²	94	20.6 Å²	20.6	50%	0.503	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	-117.7	-175.5	-54.7	-48.3	0	0	0	111.8	Y31 F47	Y31-D83 PolarHBondContact OH-N 3.41Å; Y31-D83 PolarHBondContact OH-OD1 2.95Å; F47-D83 WeakPolarHBondContact CE1-O 3.24Å; F47-D83 WeakPolarHBondContact CZ-O 3.39Å
84	N	93.6	Very high	94.4	Very high	52 Å²	52	20.4 Å²	20.4	28%	0.278	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	17.7	179	69	-33.4	0	0	0	113.9	F47 K49 Q82	F47-N84 VanDerWaalsContact O-CB 3.31Å; F47-N84 WeakPolarHBondContact O-CB 3.39Å; K49-N84 PolarHBondContact N-O 3.44Å; Q82-N84 PolarHBondContact O-N 3.32Å; Q82-N84 VanDerWaalsContact O-N 3.17Å
85	I	95.8	Very high	93.9	Very high	36 Å²	36	23 Å²	23	19%	0.185	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129.3	-173.5	-48.1	-177.1	0	0	0	109.8	H50 K52 Q82 I87	H50-I85 HydrophobicContact CB-CG1 4.19Å; H50-I85 HydrophobicContact CB-CG2 4.19Å; H50-I85 WeakPolarHBondContact O-CA 3.46Å; K52-I85 HydrophobicContact CB-CG2 4.07Å; K52-I85 HydrophobicContact CD-CG2 4.23Å; K52-I85 HydrophobicContact CG-CG2 3.95Å; Q82-I85 PolarHBondContact N-O 2.9Å; Q82-I85 WeakPolarHBondContact O-CB 3.41Å; Q82-I85 PolarHBondContact O-N 3.26Å; I85-I87 HydrophobicContact CG2-CG1 4.18Å
86	I	96.7	Very high	93	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.9	168.5	-60.9	176.3	0	0	0	107.7	F48 H50 V51 K52 V81 I130 V162	F48-I86 HydrophobicContact CB-CD1 4.35Å; F48-I86 HydrophobicContact CD1-CD1 4.13Å; F48-I86 HydrophobicContact CD1-CG1 3.65Å; F48-I86 HydrophobicContact CD2-CD1 4.13Å; F48-I86 HydrophobicContact CE1-CG1 3.9Å; F48-I86 HydrophobicContact CE2-CD1 4.47Å; F48-I86 HydrophobicContact CG-CD1 3.94Å; F48-I86 HydrophobicContact CG-CG1 3.99Å; F48-I86 HydrophobicContact CZ-CG1 4.38Å; H50-I86 PolarHBondContact O-N 3.22Å; V51-I86 CarbonylContact C-O 3.53Å; V51-I86 VanDerWaalsContact CA-O 3.27Å; V51-I86 WeakPolarHBondContact CA-O 3.3Å; V51-I86 HydrophobicContact CG2-CB 4.42Å; K52-I86 PolarHBondContact N-O 2.88Å; V81-I86 HydrophobicContact CG2-CG1 4.28Å; I86-I130 HydrophobicContact CG2-CD1 3.68Å; I86-V162 HydrophobicContact CD1-CB 3.87Å; I86-V162 HydrophobicContact CD1-CG1 4.42Å; I86-V162 HydrophobicContact CD1-CG2 4.47Å; I86-V162 HydrophobicContact CG2-CG1 4.02Å
87	I	96.3	Very high	91.8	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.015	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	109	-175.8	-56.1	171.4	0	0	0	108.6	I24 K52 G79 K80 Q82 I85 M89 I130 F225	I24-I87 HydrophobicContact CD1-CD1 4.06Å; I24-I87 HydrophobicContact CD1-CG1 4.46Å; I24-I87 HydrophobicContact CD1-CG2 3.73Å; I24-I87 HydrophobicContact CG1-CD1 4.1Å; I24-I87 HydrophobicContact CG1-CG2 4.15Å; K52-I87 HydrophobicContact CB-CG1 4.23Å; K52-I87 HydrophobicContact CB-CG2 4.4Å; K52-I87 CarbonylContact O-C 3.52Å; K52-I87 WeakPolarHBondContact O-CA 3.01Å; G79-I87 VanDerWaalsContact CA-O 3.25Å; G79-I87 WeakPolarHBondContact CA-O 3.36Å; K80-I87 HydrophobicContact CG-CB 4.14Å; K80-I87 HydrophobicContact CG-CD1 4.37Å; K80-I87 PolarHBondContact N-O 2.91Å; K80-I87 PolarHBondContact O-N 3.39Å; Q82-I87 HydrophobicContact CB-CD1 3.73Å; I85-I87 HydrophobicContact CG2-CG1 4.18Å; I87-M89 HydrophobicContact CG2-CG 4.37Å; I87-M89 HydrophobicContact CG2-SD 3.62Å; I87-I130 VanDerWaalsContact O-CD1 3.22Å; I87-I130 WeakPolarHBondContact O-CD1 3.41Å; I87-F225 HydrophobicContact CG2-CE1 3.82Å; I87-F225 HydrophobicContact CG2-CZ 3.9Å
88	V	97.3	Very high	90.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	110	174.3	-177.4	0	0	0	0	109	V51 K52 M53 S54 A57 L77 V91 I130 I164	V51-V88 HydrophobicContact CG1-CG2 3.99Å; K52-V88 PolarHBondContact O-N 3.41Å; M53-V88 HydrophobicContact CB-CB 4.48Å; M53-V88 HydrophobicContact CG-CB 4.32Å; M53-V88 HydrophobicContact CG-CG1 4.43Å; S54-V88 PolarHBondContact N-O 3.19Å; A57-V88 HydrophobicContact CB-CG1 3.87Å; L77-V88 HydrophobicContact CB-CG1 4.3Å; L77-V88 HydrophobicContact CD1-CG2 4.23Å; L77-V88 HydrophobicContact CD2-CG1 4.1Å; V88-V91 HydrophobicContact CG1-CG1 4.05Å; V88-I130 HydrophobicContact CG2-CD1 4.01Å; V88-I164 HydrophobicContact CG2-CD1 4.25Å
89	M	94.8	Very high	88.1	Confident	18 Å²	18	34.3 Å²	34.3	9%	0.089	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-46.2	-178.9	-63.6	-59.9	-66.9	0	0	110.9	Y25 S54 Q78 I87 E127 F225	Y25-M89 HydrophobicContact CD1-CE 3.3Å; Y25-M89 HydrophobicContact CE1-CE 3.78Å; Y25-M89 HydrophobicContact CG-CE 3.94Å; S54-M89 WeakPolarHBondContact CB-O 3.48Å; S54-M89 PolarHBondContact OG-O 3.15Å; Q78-M89 PolarHBondContact O-N 3.11Å; I87-M89 HydrophobicContact CG2-CG 4.37Å; I87-M89 HydrophobicContact CG2-SD 3.62Å; M89-E127 HydrophobicContact CB-CG 4.18Å; M89-E127 HydrophobicContact CG-CG 3.93Å; M89-F225 HydrophobicContact CE-CE2 4.43Å; M89-F225 HydrophobicContact SD-CE2 4.09Å; M89-F225 HydrophobicContact SD-CZ 3.63Å
90	D	95.4	Very high	86.3	Confident	18 Å²	18	37.2 Å²	37.2	10%	0.096	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	172.3	178.7	-155.9	8.5	0	0	0	112.2	K60 Q78	K60-D90 WeakPolarHBondContact CD-OD1 3.48Å; K60-D90 WeakPolarHBondContact CE-OD1 3.41Å; K60-D90 IonicContact NZ-OD1 3.2Å; K60-D90 PolarHBondContact NZ-OD1 3.15Å; K60-D90 IonicContact NZ-OD2 3.31Å; K60-D90 PolarHBondContact NZ-OD2 3.23Å; Q78-D90 PolarHBondContact N-O 2.98Å; Q78-D90 PolarHBondContact O-N 2.95Å; Q78-D90 VanDerWaalsContact O-N 3.09Å; Q78-D90 VanDerWaalsContact O-O 3.13Å
91	V	96.4	Very high	84.4	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.018	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	158.6	177.1	-52.7	0	0	0	0	111.5	A57 K60 I61 M76 L77 V88 Y133	A57-V91 HydrophobicContact CB-CG1 3.84Å; K60-V91 HydrophobicContact CB-CG2 3.41Å; K60-V91 VanDerWaalsContact CB-CG2 3.41Å; K60-V91 HydrophobicContact CD-CG2 3.85Å; K60-V91 HydrophobicContact CG-CG2 4.3Å; K60-V91 PolarHBondContact NZ-O 2.98Å; I61-V91 HydrophobicContact CD1-CG1 4.01Å; I61-V91 HydrophobicContact CG1-CB 4.42Å; I61-V91 HydrophobicContact CG1-CG1 4Å; I61-V91 HydrophobicContact CG1-CG2 4Å; M76-V91 VanDerWaalsContact O-CA 3.29Å; M76-V91 WeakPolarHBondContact O-CA 3.41Å; M76-V91 WeakPolarHBondContact O-CB 3.29Å; L77-V91 HydrophobicContact CD2-CB 4.35Å; L77-V91 HydrophobicContact CD2-CG1 3.36Å; V88-V91 HydrophobicContact CG1-CG1 4.05Å; V91-Y133 HydrophobicContact CB-CE1 4Å; V91-Y133 HydrophobicContact CG2-CE1 4.34Å
92	Y	94.9	Very high	82.5	Confident	10 Å²	10	50 Å²	50	4%	0.039	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	146	168	60.8	-88.1	0	0	0	111.4	G75 M76 Q78 L94 Y112 M113 Y116	G75-Y92 CarbonylContact C-O 3.49Å; G75-Y92 WeakPolarHBondContact CA-O 3.18Å; M76-Y92 HydrophobicContact CB-CD1 4.15Å; M76-Y92 HydrophobicContact CB-CD2 4.28Å; M76-Y92 HydrophobicContact CB-CE1 3.56Å; M76-Y92 HydrophobicContact CB-CE2 3.73Å; M76-Y92 HydrophobicContact CB-CG 4.49Å; M76-Y92 HydrophobicContact CG-CE1 4.38Å; M76-Y92 HydrophobicContact CG-CE2 3.71Å; M76-Y92 PolarHBondContact N-O 3.49Å; M76-Y92 PolarHBondContact O-N 3.28Å; M76-Y92 VanDerWaalsContact O-N 3.13Å; Q78-Y92 HydrophobicContact CG-CD1 4.27Å; Q78-Y92 HydrophobicContact CG-CE1 3.95Å; Y92-L94 HydrophobicContact CD2-CD2 4.3Å; Y92-L94 HydrophobicContact CE2-CD2 3.88Å; Y92-Y112 HydrophobicContact CD2-CE1 4.11Å; Y92-Y112 HydrophobicContact CE2-CE1 4.42Å; Y92-M113 HydrophobicContact CE2-CG 4.42Å; Y92-Y116 VanDerWaalsContact CB-CZ 3.42Å; Y92-Y116 AromaticContact CD1-CD1 3.49Å; Y92-Y116 HydrophobicContact CD1-CD1 3.49Å; Y92-Y116 VanDerWaalsContact CD1-CD1 3.49Å; Y92-Y116 AromaticContact CD1-CE1 3.19Å; Y92-Y116 HydrophobicContact CD1-CE1 3.19Å; Y92-Y116 HydrophobicContact CD1-CG 4.32Å; Y92-Y116 AromaticContact CD1-CZ 3.83Å; Y92-Y116 AromaticContact CD2-CD1 3.94Å; Y92-Y116 HydrophobicContact CD2-CD1 3.94Å; Y92-Y116 HydrophobicContact CD2-CD2 4.19Å; Y92-Y116 HydrophobicContact CD2-CE1 4.19Å; Y92-Y116 HydrophobicContact CD2-CE2 4.41Å; Y92-Y116 AromaticContact CD2-CG 3.96Å; Y92-Y116 HydrophobicContact CD2-CG 3.96Å; Y92-Y116 AromaticContact CE1-CD1 3.52Å; Y92-Y116 HydrophobicContact CE1-CD1 3.52Å; Y92-Y116 AromaticContact CE1-CE1 3.68Å; Y92-Y116 HydrophobicContact CE1-CE1 3.68Å; Y92-Y116 HydrophobicContact CE1-CG 4.4Å; Y92-Y116 AromaticContact CE2-CD1 3.96Å; Y92-Y116 HydrophobicContact CE2-CD1 3.96Å; Y92-Y116 HydrophobicContact CE2-CG 4.03Å; Y92-Y116 AromaticContact CG-CD1 3.69Å; Y92-Y116 HydrophobicContact CG-CD1 3.69Å; Y92-Y116 HydrophobicContact CG-CD2 4.23Å; Y92-Y116 AromaticContact CG-CE1 3.47Å; Y92-Y116 HydrophobicContact CG-CE1 3.47Å; Y92-Y116 VanDerWaalsContact CG-CE1 3.47Å; Y92-Y116 HydrophobicContact CG-CE2 4.04Å; Y92-Y116 HydrophobicContact CG-CG 4.08Å; Y92-Y116 AromaticContact CG-CZ 3.67Å; Y92-Y116 AromaticContact CZ-CD1 3.74Å
93	A	93.8	Very high	80.4	Confident	37 Å²	37	49.4 Å²	49.4	31%	0.306	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	142.1	176.2	0	0	0	0	0	110	H64	H64-A93 WeakPolarHBondContact CE1-CB 3.28Å
94	L	91.1	Very high	78.7	Confident	8 Å²	8	49.5 Å²	49.5	4%	0.042	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	143.2	167.2	-67.8	178.1	0	0	0	109.2	M74 M76 Y92 V96 Y112 M113	M74-L94 HydrophobicContact CG-CD1 4.5Å; M74-L94 PolarHBondContact O-N 3.24Å; M74-L94 HydrophobicContact SD-CD1 4.23Å; M76-L94 HydrophobicContact CG-CD1 4.01Å; M76-L94 HydrophobicContact CG-CD2 4.04Å; M76-L94 HydrophobicContact CG-CG 4.09Å; M76-L94 HydrophobicContact SD-CD1 3.93Å; Y92-L94 HydrophobicContact CD2-CD2 4.3Å; Y92-L94 HydrophobicContact CE2-CD2 3.88Å; L94-V96 HydrophobicContact CB-CG2 3.8Å; L94-V96 PolarHBondContact O-N 3.16Å; L94-Y112 HydrophobicContact CD2-CD1 3.96Å; L94-M113 HydrophobicContact CD1-SD 4.17Å; L94-M113 HydrophobicContact CD2-CG 3.5Å; L94-M113 VanDerWaalsContact CD2-CG 3.5Å; L94-M113 HydrophobicContact CD2-SD 4.18Å
95	P	84.8	Confident	76.8	Confident	89 Å²	89	48 Å²	48	58%	0.578	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	51.2	177.7	34.6	-37	0	0	0	111.1	Y112	P95-Y112 HydrophobicContact CG-CD1 4.49Å; P95-Y112 HydrophobicContact CG-CD2 3.98Å; P95-Y112 HydrophobicContact CG-CE2 4.49Å; P95-Y112 HydrophobicContact CG-CG 3.99Å
96	V	75.5	Confident	74.9	Confident	23 Å²	23	51.3 Å²	51.3	14%	0.139	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.9	178.5	-63.3	0	0	0	0	109.8	M74 L94 G98 A105 A109	M74-V96 HydrophobicContact CG-CG2 3.39Å; M74-V96 HydrophobicContact SD-CG2 3.79Å; L94-V96 HydrophobicContact CB-CG2 3.8Å; L94-V96 PolarHBondContact O-N 3.16Å; V96-G98 PolarHBondContact O-N 2.89Å; V96-A105 HydrophobicContact CG1-CB 4.02Å; V96-A105 HydrophobicContact CG2-CB 4.23Å; V96-A109 HydrophobicContact CG1-CB 3.79Å
97	E	68.7	Low	73.3	Confident	154 Å²	154	54.8 Å²	54.8	72%	0.72	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	113.4	164.1	-67.1	-177.1	174.7	0	0	107.2	T99	E97-T99 PolarHBondContact O-N 2.9Å
98	G	60.5	Low	72.1	Confident	14 Å²	14	60.5 Å²	60.5	14%	0.144	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	127	172.4	0	0	0	0	0	108.7	E72 V96	E72-G98 VanDerWaalsContact O-CA 3.25Å; E72-G98 WeakPolarHBondContact O-CA 3.35Å; E72-G98 PolarHBondContact O-N 2.93Å; V96-G98 PolarHBondContact O-N 2.89Å
99	T	53.6	Low	71.3	Confident	64 Å²	64	60.5 Å²	60.5	39%	0.393	33%	0.331	S	S	.	.			trans	-120	135.4	159.6	49.9	0	0	0	0	105.6	E97 T101 R102	E97-T99 PolarHBondContact O-N 2.9Å; T99-T101 PolarHBondContact O-N 3Å; T99-R102 PolarHBondContact O-N 3.27Å
100	E	56.4	Low	70.6	Confident	65 Å²	65	65.4 Å²	65.4	30%	0.304	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-11.4	175.9	-69.3	179	136.6	0	0	113.7	E72 I146 K206	E72-E100 VanDerWaalsContact CD-CG 3.43Å; E72-E100 WeakPolarHBondContact OE1-CG 3.32Å; E72-E100 WeakPolarHBondContact OE2-CG 3.3Å; E72-E100 PolarHBondContact OE2-N 2.82Å; E72-E100 VanDerWaalsContact OE2-N 3.13Å; E100-I146 WeakPolarHBondContact O-CD1 3.49Å; E100-K206 WeakPolarHBondContact OE1-CE 3.3Å; E100-K206 IonicContact OE1-NZ 3.94Å; E100-K206 PolarHBondContact OE1-NZ 3.23Å; E100-K206 IonicContact OE2-NZ 2.75Å; E100-K206 PolarHBondContact OE2-NZ 2.84Å
101	T	53.3	Low	70.1	Confident	114 Å²	114	70.7 Å²	70.7	70%	0.699	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-5.6	178.4	64.4	0	0	0	0	114.5	T99	T99-T101 PolarHBondContact O-N 3Å
102	R	53.3	Low	69.9	Low	175 Å²	175	74.9 Å²	74.9	66%	0.66	39%	0.39	S	S	*	.			trans	-133.2	109.3	-175.1	-65.1	-168.4	-179.7	-153.8	1.5	112.2	T99	T99-R102 PolarHBondContact O-N 3.27Å
103	V	46.5	Very low	69.6	Low	61 Å²	61	76.1 Å²	76.1	37%	0.37	40%	0.396	S	S	.	.			trans	-83.6	-18.2	-170.9	-169.5	0	0	0	0	113.6	I146 T150	V103-I146 HydrophobicContact CB-CG2 4.1Å; V103-I146 HydrophobicContact CG1-CG2 4.07Å; V103-I146 HydrophobicContact CG2-CB 4.12Å; V103-I146 HydrophobicContact CG2-CD1 4.1Å; V103-I146 HydrophobicContact CG2-CG1 3.78Å; V103-I146 HydrophobicContact CG2-CG2 3.42Å; V103-I146 VanDerWaalsContact CG2-CG2 3.42Å; V103-T150 WeakPolarHBondContact CG1-OG1 3.44Å
104	N	53.1	Low	69.4	Low	96 Å²	96	77.1 Å²	77.1	51%	0.513	41%	0.405	S	S	.	.	S	Bend	trans	-120	106.6	-173.9	-139	0.3	0	0	0	108.3	Q106 Y110	N104-Q106 PolarHBondContact O-N 3.45Å; N104-Q106 VanDerWaalsContact O-N 3.13Å; N104-Y110 WeakPolarHBondContact OD1-CE2 3.29Å; N104-Y110 PolarHBondContact OD1-OH 3.05Å
105	A	54	Low	69.4	Low	20 Å²	20	81.3 Å²	81.3	17%	0.165	43%	0.427	C	S	.	.			trans	-44.9	123.7	162.7	0	0	0	0	0	106.7	M74 V96 A109	M74-A105 HydrophobicContact SD-CB 4.26Å; V96-A105 HydrophobicContact CG1-CB 4.02Å; V96-A105 HydrophobicContact CG2-CB 4.23Å; A105-A109 HydrophobicContact CB-CB 3.3Å
106	Q	57.3	Low	69.7	Low	105 Å²	105	79.8 Å²	79.8	49%	0.491	41%	0.41	S	S	.	.			trans	-57	170.5	-166.6	-58.8	-172.7	22.5	0	0	111	N104 E108 A109	N104-Q106 PolarHBondContact O-N 3.45Å; N104-Q106 VanDerWaalsContact O-N 3.13Å; Q106-E108 PolarHBondContact O-N 3.45Å; Q106-A109 WeakPolarHBondContact O-CB 3.46Å; Q106-A109 PolarHBondContact O-N 2.82Å
107	A	63.2	Low	70.3	Confident	73 Å²	73	81.1 Å²	81.1	60%	0.603	42%	0.415	S	S	*	.	H	α-helix	trans	-46.7	-34.8	178.2	0	0	0	0	0	113.1	A109 Y110 E111	A107-A109 VanDerWaalsContact C-N 3.31Å; A107-A109 PolarHBondContact O-N 2.76Å; A107-Y110 PolarHBondContact O-N 2.73Å; A107-Y110 VanDerWaalsContact O-N 3.15Å; A107-E111 PolarHBondContact O-N 3.19Å
108	E	70.8	Confident	71.3	Confident	123 Å²	123	79.8 Å²	79.8	58%	0.575	41%	0.409	S	S	*	.	H	α-helix	trans	-56.6	-36.6	174.3	-62.9	152.6	173.4	0	0	113.8	Q106 Y112	Q106-E108 PolarHBondContact O-N 3.45Å; E108-Y112 WeakPolarHBondContact O-CB 3.34Å; E108-Y112 PolarHBondContact O-N 2.89Å
109	A	79	Confident	72.8	Confident	1 Å²	1	84.3 Å²	84.3	1%	0.008	43%	0.429	C	S	.	.	H	α-helix	trans	-72.9	-37	177.4	0	0	0	0	0	111.9	V96 A105 Q106 A107 Y112 M113	V96-A109 HydrophobicContact CG1-CB 3.79Å; A105-A109 HydrophobicContact CB-CB 3.3Å; Q106-A109 WeakPolarHBondContact O-CB 3.46Å; Q106-A109 PolarHBondContact O-N 2.82Å; A107-A109 VanDerWaalsContact C-N 3.31Å; A107-A109 PolarHBondContact O-N 2.76Å; A109-Y112 PolarHBondContact O-N 2.84Å; A109-M113 WeakPolarHBondContact O-CB 3.49Å; A109-M113 WeakPolarHBondContact O-CG 3.42Å; A109-M113 PolarHBondContact O-N 3.37Å
110	Y	80.9	Confident	74.6	Confident	120 Å²	120	81.7 Å²	81.7	47%	0.471	41%	0.414	S	S	.	.	H	α-helix	trans	-66.2	-40.1	174.4	-75.5	-74.6	0	0	0	111.6	N104 A107 M113 A114	N104-Y110 WeakPolarHBondContact OD1-CE2 3.29Å; N104-Y110 PolarHBondContact OD1-OH 3.05Å; A107-Y110 PolarHBondContact O-N 2.73Å; A107-Y110 VanDerWaalsContact O-N 3.15Å; Y110-M113 PolarHBondContact O-N 2.89Å; Y110-A114 PolarHBondContact O-N 3.47Å
111	E	86	Confident	76	Confident	129 Å²	129	83.9 Å²	83.9	60%	0.603	42%	0.424	S	S	*	.	H	α-helix	trans	-60.2	-50.4	172.4	-71.2	177.7	-177	0	0	110.6	A107 M113 A114 D115	A107-E111 PolarHBondContact O-N 3.19Å; E111-M113 VanDerWaalsContact C-N 3.29Å; E111-M113 PolarHBondContact O-N 3Å; E111-A114 PolarHBondContact O-N 3.01Å; E111-A114 VanDerWaalsContact O-N 3.15Å; E111-D115 PolarHBondContact O-N 3.09Å
112	Y	90.6	Very high	77.8	Confident	92 Å²	92	84.6 Å²	84.6	36%	0.361	42%	0.423	S	S	.	.	H	α-helix	trans	-57.7	-40.8	176.5	-174.4	-86.9	0	0	0	112.7	Y92 L94 P95 E108 A109 Y116	Y92-Y112 HydrophobicContact CD2-CE1 4.11Å; Y92-Y112 HydrophobicContact CE2-CE1 4.42Å; L94-Y112 HydrophobicContact CD2-CD1 3.96Å; P95-Y112 HydrophobicContact CG-CD1 4.49Å; P95-Y112 HydrophobicContact CG-CD2 3.98Å; P95-Y112 HydrophobicContact CG-CE2 4.49Å; P95-Y112 HydrophobicContact CG-CG 3.99Å; E108-Y112 WeakPolarHBondContact O-CB 3.34Å; E108-Y112 PolarHBondContact O-N 2.89Å; A109-Y112 PolarHBondContact O-N 2.84Å; Y112-Y116 HydrophobicContact CE1-CD2 4.06Å; Y112-Y116 HydrophobicContact CE1-CG 4.44Å; Y112-Y116 WeakPolarHBondContact O-CB 3.29Å; Y112-Y116 PolarHBondContact O-N 3.17Å
113	M	89.6	Confident	79.5	Confident	36 Å²	36	83.5 Å²	83.5	18%	0.177	43%	0.428	C	S	.	.	H	α-helix	trans	-64.4	-40.6	178.3	-75.9	171.1	64.4	0	0	112.3	M76 Y92 L94 A109 Y110 E111 M117	M76-M113 HydrophobicContact CE-CE 3.49Å; M76-M113 VanDerWaalsContact CE-CE 3.49Å; M76-M113 HydrophobicContact CG-CE 4.07Å; M76-M113 HydrophobicContact CG-CG 4.29Å; M76-M113 HydrophobicContact CG-SD 4.28Å; M76-M113 HydrophobicContact SD-CE 3.86Å; M76-M113 HydrophobicContact SD-SD 4.19Å; Y92-M113 HydrophobicContact CE2-CG 4.42Å; L94-M113 HydrophobicContact CD1-SD 4.17Å; L94-M113 HydrophobicContact CD2-CG 3.5Å; L94-M113 VanDerWaalsContact CD2-CG 3.5Å; L94-M113 HydrophobicContact CD2-SD 4.18Å; A109-M113 WeakPolarHBondContact O-CB 3.49Å; A109-M113 WeakPolarHBondContact O-CG 3.42Å; A109-M113 PolarHBondContact O-N 3.37Å; Y110-M113 PolarHBondContact O-N 2.89Å; E111-M113 VanDerWaalsContact C-N 3.29Å; E111-M113 PolarHBondContact O-N 3Å; M113-M117 WeakPolarHBondContact O-CB 3.35Å; M113-M117 PolarHBondContact O-N 3.2Å; M113-M117 VanDerWaalsContact O-N 3.12Å
114	A	88.5	Confident	81.3	Confident	58 Å²	58	83.3 Å²	83.3	48%	0.479	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-50.4	177.2	0	0	0	0	0	110.7	Y110 E111 Y116 M117 E118	Y110-A114 PolarHBondContact O-N 3.47Å; E111-A114 PolarHBondContact O-N 3.01Å; E111-A114 VanDerWaalsContact O-N 3.15Å; A114-Y116 PolarHBondContact O-N 3.42Å; A114-M117 PolarHBondContact O-N 3.46Å; A114-E118 PolarHBondContact O-N 3.28Å
115	D	91.3	Very high	82.8	Confident	96 Å²	96	83.4 Å²	83.4	51%	0.513	43%	0.434	S	S	.	.	H	α-helix	trans	-61.2	-43	179.3	-69.6	-5.3	0	0	0	111.6	E111 M117 E118 L119	E111-D115 PolarHBondContact O-N 3.09Å; D115-M117 VanDerWaalsContact C-N 3.3Å; D115-M117 PolarHBondContact O-N 2.98Å; D115-E118 PolarHBondContact O-N 3.02Å; D115-L119 WeakPolarHBondContact O-CB 3.29Å; D115-L119 VanDerWaalsContact O-CG 3.31Å; D115-L119 WeakPolarHBondContact O-CG 3.43Å; D115-L119 PolarHBondContact O-N 3.45Å
116	Y	92.2	Very high	84.2	Confident	57 Å²	57	86.7 Å²	86.7	22%	0.224	45%	0.448	C	S	.	.	H	α-helix	trans	-63.3	-38.7	178.3	-169.9	-83.4	0	0	0	111.7	Y92 Y112 A114 S120	Y92-Y116 VanDerWaalsContact CB-CZ 3.42Å; Y92-Y116 AromaticContact CD1-CD1 3.49Å; Y92-Y116 HydrophobicContact CD1-CD1 3.49Å; Y92-Y116 VanDerWaalsContact CD1-CD1 3.49Å; Y92-Y116 AromaticContact CD1-CE1 3.19Å; Y92-Y116 HydrophobicContact CD1-CE1 3.19Å; Y92-Y116 HydrophobicContact CD1-CG 4.32Å; Y92-Y116 AromaticContact CD1-CZ 3.83Å; Y92-Y116 AromaticContact CD2-CD1 3.94Å; Y92-Y116 HydrophobicContact CD2-CD1 3.94Å; Y92-Y116 HydrophobicContact CD2-CD2 4.19Å; Y92-Y116 HydrophobicContact CD2-CE1 4.19Å; Y92-Y116 HydrophobicContact CD2-CE2 4.41Å; Y92-Y116 AromaticContact CD2-CG 3.96Å; Y92-Y116 HydrophobicContact CD2-CG 3.96Å; Y92-Y116 AromaticContact CE1-CD1 3.52Å; Y92-Y116 HydrophobicContact CE1-CD1 3.52Å; Y92-Y116 AromaticContact CE1-CE1 3.68Å; Y92-Y116 HydrophobicContact CE1-CE1 3.68Å; Y92-Y116 HydrophobicContact CE1-CG 4.4Å; Y92-Y116 AromaticContact CE2-CD1 3.96Å; Y92-Y116 HydrophobicContact CE2-CD1 3.96Å; Y92-Y116 HydrophobicContact CE2-CG 4.03Å; Y92-Y116 AromaticContact CG-CD1 3.69Å; Y92-Y116 HydrophobicContact CG-CD1 3.69Å; Y92-Y116 HydrophobicContact CG-CD2 4.23Å; Y92-Y116 AromaticContact CG-CE1 3.47Å; Y92-Y116 HydrophobicContact CG-CE1 3.47Å; Y92-Y116 VanDerWaalsContact CG-CE1 3.47Å; Y92-Y116 HydrophobicContact CG-CE2 4.04Å; Y92-Y116 HydrophobicContact CG-CG 4.08Å; Y92-Y116 AromaticContact CG-CZ 3.67Å; Y92-Y116 AromaticContact CZ-CD1 3.74Å; Y112-Y116 HydrophobicContact CE1-CD2 4.06Å; Y112-Y116 HydrophobicContact CE1-CG 4.44Å; Y112-Y116 WeakPolarHBondContact O-CB 3.29Å; Y112-Y116 PolarHBondContact O-N 3.17Å; A114-Y116 PolarHBondContact O-N 3.42Å; Y116-S120 WeakPolarHBondContact CD1-OG 3.31Å; Y116-S120 WeakPolarHBondContact CE1-OG 3.46Å; Y116-S120 VanDerWaalsContact O-CB 3.29Å; Y116-S120 WeakPolarHBondContact O-CB 3.33Å; Y116-S120 PolarHBondContact O-N 2.76Å; Y116-S120 PolarHBondContact O-OG 3.21Å
117	M	87.6	Confident	85.6	Confident	51 Å²	51	83.1 Å²	83.1	25%	0.251	43%	0.431	S	S	.	.	H	α-helix	trans	-69.7	-42.1	-179.9	-167.6	155.3	-177.2	0	0	111.3	M113 A114 D115 S120 E121 H128 V129	M113-M117 WeakPolarHBondContact O-CB 3.35Å; M113-M117 PolarHBondContact O-N 3.2Å; M113-M117 VanDerWaalsContact O-N 3.12Å; A114-M117 PolarHBondContact O-N 3.46Å; D115-M117 VanDerWaalsContact C-N 3.3Å; D115-M117 PolarHBondContact O-N 2.98Å; M117-S120 WeakPolarHBondContact O-CB 3.35Å; M117-S120 PolarHBondContact O-N 2.7Å; M117-E121 WeakPolarHBondContact O-CG 3.45Å; M117-E121 PolarHBondContact O-N 3.25Å; M117-H128 HydrophobicContact CE-CB 4.17Å; M117-H128 VanDerWaalsContact CE-ND1 3.29Å; M117-H128 WeakPolarHBondContact CE-ND1 3.46Å; M117-V129 HydrophobicContact SD-CG2 4.25Å
118	E	90	Very high	86.7	Confident	125 Å²	125	83 Å²	83	58%	0.584	42%	0.418	S	S	*	.	H	α-helix	trans	-60.8	-48	174.3	-172.6	172.5	-167.1	0	0	111.4	A114 D115 S120 E121 D122	A114-E118 PolarHBondContact O-N 3.28Å; D115-E118 PolarHBondContact O-N 3.02Å; E118-S120 VanDerWaalsContact C-N 3.3Å; E118-S120 PolarHBondContact O-N 3.5Å; E118-E121 PolarHBondContact O-N 3.28Å; E118-D122 PolarHBondContact O-N 3.35Å
119	L	92.5	Very high	87.7	Confident	109 Å²	109	78.2 Å²	78.2	57%	0.571	40%	0.397	S	S	*	.	H	α-helix	trans	-63.3	-35.1	176.6	-72.1	169.5	0	0	0	113	D115 M123	D115-L119 WeakPolarHBondContact O-CB 3.29Å; D115-L119 VanDerWaalsContact O-CG 3.31Å; D115-L119 WeakPolarHBondContact O-CG 3.43Å; D115-L119 PolarHBondContact O-N 3.45Å; L119-M123 WeakPolarHBondContact O-CB 3.29Å; L119-M123 WeakPolarHBondContact O-CG 3.33Å; L119-M123 PolarHBondContact O-N 3Å; L119-M123 VanDerWaalsContact O-N 3.11Å
120	S	89.8	Confident	88.5	Confident	9 Å²	9	78.3 Å²	78.3	6%	0.063	40%	0.397	C	S	.	.	H	α-helix	trans	-63.3	-45.8	175.8	-66.7	0	0	0	0	110.7	Q78 Y116 M117 E118 M123 G124 F125	Q78-S120 PolarHBondContact NE2-OG 2.98Å; Y116-S120 WeakPolarHBondContact CD1-OG 3.31Å; Y116-S120 WeakPolarHBondContact CE1-OG 3.46Å; Y116-S120 VanDerWaalsContact O-CB 3.29Å; Y116-S120 WeakPolarHBondContact O-CB 3.33Å; Y116-S120 PolarHBondContact O-N 2.76Å; Y116-S120 PolarHBondContact O-OG 3.21Å; M117-S120 WeakPolarHBondContact O-CB 3.35Å; M117-S120 PolarHBondContact O-N 2.7Å; E118-S120 VanDerWaalsContact C-N 3.3Å; E118-S120 PolarHBondContact O-N 3.5Å; S120-M123 PolarHBondContact O-N 3.04Å; S120-G124 PolarHBondContact O-N 3.22Å; S120-F125 WeakPolarHBondContact O-CB 3.4Å; S120-F125 PolarHBondContact O-N 3.04Å
121	E	87.3	Confident	89.3	Confident	111 Å²	111	72.6 Å²	72.6	52%	0.519	38%	0.375	S	S	.	.	H	α-helix	trans	-63.4	-42.8	178.4	-71.6	-179.8	-173.1	0	0	111.6	M117 E118 M123 G124	M117-E121 WeakPolarHBondContact O-CG 3.45Å; M117-E121 PolarHBondContact O-N 3.25Å; E118-E121 PolarHBondContact O-N 3.28Å; E121-M123 VanDerWaalsContact C-N 3.26Å; E121-M123 PolarHBondContact O-N 2.9Å; E121-G124 WeakPolarHBondContact O-CA 3.45Å; E121-G124 PolarHBondContact O-N 3.39Å
122	D	90	Very high	89.8	Confident	129 Å²	129	66.8 Å²	66.8	69%	0.69	35%	0.348	S	S	*	.	H	α-helix	trans	-60.6	-34.7	175.7	-81.7	-10.9	0	0	0	112.9	E118 G124	E118-D122 PolarHBondContact O-N 3.35Å; D122-G124 PolarHBondContact O-N 3.11Å
123	M	89.7	Confident	90.1	Very high	153 Å²	153	62.6 Å²	62.6	75%	0.754	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-1.3	176.3	-67.8	-70.9	-77.8	0	0	113.1	L119 S120 E121 F125	L119-M123 WeakPolarHBondContact O-CB 3.29Å; L119-M123 WeakPolarHBondContact O-CG 3.33Å; L119-M123 PolarHBondContact O-N 3Å; L119-M123 VanDerWaalsContact O-N 3.11Å; S120-M123 PolarHBondContact O-N 3.04Å; E121-M123 VanDerWaalsContact C-N 3.26Å; E121-M123 PolarHBondContact O-N 2.9Å; M123-F125 HydrophobicContact CB-CD2 4.01Å; M123-F125 HydrophobicContact CB-CE2 4.28Å
124	G	84.7	Confident	90.4	Very high	56 Å²	56	61.1 Å²	61.1	58%	0.577	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	12.9	178.8	0	0	0	0	0	114.6	S120 E121 D122	S120-G124 PolarHBondContact O-N 3.22Å; E121-G124 WeakPolarHBondContact O-CA 3.45Å; E121-G124 PolarHBondContact O-N 3.39Å; D122-G124 PolarHBondContact O-N 3.11Å
125	F	84.3	Confident	90.7	Very high	98 Å²	98	58.3 Å²	58.3	43%	0.43	30%	0.301	S	S	.	.			trans	-73.8	124	165.7	-69.6	-82.6	0	0	0	108.8	S120 M123	S120-F125 WeakPolarHBondContact O-CB 3.4Å; S120-F125 PolarHBondContact O-N 3.04Å; M123-F125 HydrophobicContact CB-CD2 4.01Å; M123-F125 HydrophobicContact CB-CE2 4.28Å
126	I	83.1	Confident	90.8	Very high	90 Å²	90	53.8 Å²	53.8	46%	0.462	28%	0.276	S	S	.	.			trans	-103.1	-13.9	-173.4	58.7	169.2	0	0	0	112.3	P27 H128	P27-I126 HydrophobicContact CB-CD1 3.29Å; P27-I126 HydrophobicContact CG-CD1 3.43Å; P27-I126 VanDerWaalsContact CG-CD1 3.43Å; I126-H128 PolarHBondContact O-N 3.21Å
127	E	86.1	Confident	90.9	Very high	30 Å²	30	51.7 Å²	51.7	14%	0.14	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-74.7	124.7	-174.5	-74.1	78.9	-174.1	0	0	111.6	Q78 M89	Q78-E127 HydrophobicContact CB-CB 4.3Å; M89-E127 HydrophobicContact CB-CG 4.18Å; M89-E127 HydrophobicContact CG-CG 3.93Å
128	H	86.7	Confident	91.1	Very high	70 Å²	70	49.8 Å²	49.8	32%	0.324	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	166.2	175.8	-60.1	-63.3	0	0	0	111.9	R36 Q78 G79 M117 I126 I130	R36-H128 PolarHBondContact NH1-CD2 3.45Å; Q78-H128 WeakPolarHBondContact CA-O 3.21Å; G79-H128 PolarHBondContact N-O 2.88Å; M117-H128 HydrophobicContact CE-CB 4.17Å; M117-H128 VanDerWaalsContact CE-ND1 3.29Å; M117-H128 WeakPolarHBondContact CE-ND1 3.46Å; I126-H128 PolarHBondContact O-N 3.21Å; H128-I130 PolarHBondContact O-N 3.12Å
129	V	92.7	Very high	91.1	Very high	23 Å²	23	45 Å²	45	14%	0.139	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	129.3	167.8	-178.3	0	0	0	0	109.9	M76 L77 M117 F161	M76-V129 HydrophobicContact CE-CG1 3.36Å; L77-V129 CarbonylContact O-C 3.52Å; L77-V129 VanDerWaalsContact O-CA 3.3Å; L77-V129 WeakPolarHBondContact O-CA 3.08Å; M117-V129 HydrophobicContact SD-CG2 4.25Å; V129-F161 HydrophobicContact CG1-CE2 3.72Å; V129-F161 HydrophobicContact CG1-CZ 4.04Å
130	I	95.2	Very high	91.2	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	4.4	-179.3	55.4	160.8	0	0	0	112.9	L77 G79 I86 I87 V88 H128 F161 V162	L77-I130 HydrophobicContact CB-CG1 4.17Å; L77-I130 WeakPolarHBondContact O-CG1 3.43Å; L77-I130 PolarHBondContact O-N 2.66Å; G79-I130 WeakPolarHBondContact O-CG2 3.24Å; I86-I130 HydrophobicContact CG2-CD1 3.68Å; I87-I130 VanDerWaalsContact O-CD1 3.22Å; I87-I130 WeakPolarHBondContact O-CD1 3.41Å; V88-I130 HydrophobicContact CG2-CD1 4.01Å; H128-I130 PolarHBondContact O-N 3.12Å; I130-F161 CarbonylContact O-C 3.53Å; I130-F161 VanDerWaalsContact O-CA 3.29Å; I130-F161 WeakPolarHBondContact O-CA 3.31Å; I130-V162 PolarHBondContact O-N 3.39Å
131	G	96.7	Very high	91.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.1	-173.6	-177	0	0	0	0	0	113	L77 V162	L77-G131 PolarHBondContact N-O 3.5Å; G131-V162 CarbonylContact C-O 3.51Å; G131-V162 WeakPolarHBondContact CA-O 3.42Å
132	W	96.3	Very high	91.8	Very high	8 Å²	8	34.3 Å²	34.3	3%	0.03	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	159.1	177.8	67.1	-59.7	0	0	0	109.5	M74 G75 M76 L77 H134 D147 T150 F161 V162 A163 I164	M74-W132 HydrophobicContact CE-CE3 3.77Å; M74-W132 HydrophobicContact CE-CZ3 3.55Å; G75-W132 CarbonylContact O-C 3.58Å; G75-W132 VanDerWaalsContact O-CA 3.31Å; G75-W132 WeakPolarHBondContact O-CA 3.46Å; M76-W132 HydrophobicContact CE-CB 4.45Å; M76-W132 HydrophobicContact SD-CB 4.08Å; L77-W132 WeakPolarHBondContact CD1-O 3.43Å; W132-H134 HydrophobicContact CE3-CB 4.31Å; W132-H134 AromaticContact CE3-ND1 3.93Å; W132-H134 AromaticContact CH2-CE1 3.56Å; W132-H134 AromaticContact CH2-ND1 3.51Å; W132-H134 HydrophobicContact CZ3-CB 3.9Å; W132-H134 AromaticContact CZ3-CE1 3.83Å; W132-H134 AromaticContact CZ3-CG 3.66Å; W132-H134 AromaticContact CZ3-ND1 3.31Å; W132-H134 VanDerWaalsContact CZ3-ND1 3.31Å; W132-H134 WeakPolarHBondContact CZ3-ND1 3.2Å; W132-D147 HydrophobicContact CH2-CB 4.23Å; W132-D147 HydrophobicContact CZ2-CB 4.45Å; W132-T150 HydrophobicContact CH2-CG2 4.22Å; W132-T150 HydrophobicContact CZ2-CG2 3.97Å; W132-F161 HydrophobicContact CB-CE1 4.15Å; W132-F161 AromaticContact CD1-CD1 3.8Å; W132-F161 AromaticContact CD1-CE1 3.4Å; W132-F161 HydrophobicContact CG-CE1 4.05Å; W132-V162 PolarHBondContact N-O 2.95Å; W132-A163 HydrophobicContact CZ2-CB 4.16Å; W132-A163 CarbonylContact O-C 3.5Å; W132-A163 WeakPolarHBondContact O-CA 3.14Å; W132-I164 PolarHBondContact O-N 3.4Å
133	Y	97.3	Very high	92	Very high	3 Å²	3	28.2 Å²	28.2	1%	0.012	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	153.3	169.9	74.1	-83.4	0	0	0	111	I61 H64 M74 G75 L77 V91 I164	I61-Y133 HydrophobicContact CB-CD2 4.28Å; I61-Y133 HydrophobicContact CB-CE2 4.25Å; I61-Y133 HydrophobicContact CD1-CD1 4.27Å; I61-Y133 HydrophobicContact CD1-CD2 4.45Å; I61-Y133 HydrophobicContact CD1-CG 4.07Å; I61-Y133 HydrophobicContact CG1-CD1 4Å; I61-Y133 HydrophobicContact CG1-CD2 3.93Å; I61-Y133 HydrophobicContact CG1-CE1 4.08Å; I61-Y133 HydrophobicContact CG1-CE2 4.02Å; I61-Y133 HydrophobicContact CG1-CG 3.91Å; I61-Y133 HydrophobicContact CG2-CD2 3.72Å; I61-Y133 HydrophobicContact CG2-CE2 4.02Å; I61-Y133 HydrophobicContact CG2-CG 4.34Å; H64-Y133 AromaticContact ND1-CE2 3.73Å; H64-Y133 AromaticContact ND1-CZ 3.66Å; H64-Y133 PolarHBondContact ND1-OH 3.41Å; M74-Y133 CarbonylContact C-O 3.41Å; M74-Y133 WeakPolarHBondContact CA-O 3.42Å; M74-Y133 VanDerWaalsContact CB-O 3.29Å; M74-Y133 WeakPolarHBondContact CB-O 3.37Å; G75-Y133 VanDerWaalsContact C-CE1 3.47Å; G75-Y133 PolarHBondContact N-O 3.28Å; G75-Y133 WeakPolarHBondContact O-CD1 3.37Å; G75-Y133 PolarHBondContact O-N 3.3Å; L77-Y133 HydrophobicContact CD2-CD1 3.7Å; L77-Y133 HydrophobicContact CD2-CG 4.33Å; V91-Y133 HydrophobicContact CB-CE1 4Å; V91-Y133 HydrophobicContact CG2-CE1 4.34Å; Y133-I164 CarbonylContact C-O 3.55Å; Y133-I164 WeakPolarHBondContact CA-O 3.25Å; Y133-I164 WeakPolarHBondContact CB-O 3.34Å
134	H	95.4	Very high	92.1	Very high	5 Å²	5	21.3 Å²	21.3	2%	0.023	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	163.9	170	68.3	-68.6	0	0	0	112	V73 M74 W132 H136 D147 I164 V165 V166	V73-H134 CarbonylContact O-C 3.52Å; V73-H134 WeakPolarHBondContact O-CA 3.36Å; V73-H134 WeakPolarHBondContact O-CB 3.22Å; M74-H134 HydrophobicContact CB-CB 3.92Å; W132-H134 HydrophobicContact CE3-CB 4.31Å; W132-H134 AromaticContact CE3-ND1 3.93Å; W132-H134 AromaticContact CH2-CE1 3.56Å; W132-H134 AromaticContact CH2-ND1 3.51Å; W132-H134 HydrophobicContact CZ3-CB 3.9Å; W132-H134 AromaticContact CZ3-CE1 3.83Å; W132-H134 AromaticContact CZ3-CG 3.66Å; W132-H134 AromaticContact CZ3-ND1 3.31Å; W132-H134 VanDerWaalsContact CZ3-ND1 3.31Å; W132-H134 WeakPolarHBondContact CZ3-ND1 3.2Å; H134-H136 AromaticContact CD2-CD2 3.47Å; H134-H136 PolarHBondContact CD2-CD2 3.2Å; H134-H136 VanDerWaalsContact CD2-CD2 3.47Å; H134-H136 AromaticContact CD2-NE2 3.41Å; H134-H136 PolarHBondContact CD2-NE2 2.75Å; H134-H136 AromaticContact NE2-CD2 3.48Å; H134-H136 PolarHBondContact NE2-CD2 2.78Å; H134-H136 AromaticContact NE2-CE1 3.74Å; H134-H136 AromaticContact NE2-NE2 2.95Å; H134-H136 PolarHBondContact NE2-NE2 3.43Å; H134-D147 IonicContact CD2-OD1 2.68Å; H134-D147 IonicContact CE1-OD1 2.62Å; H134-D147 IonicContact CE1-OD2 3.22Å; H134-D147 VanDerWaalsContact NE2-CG 3.29Å; H134-D147 IonicContact NE2-OD1 2.73Å; H134-D147 PolarHBondContact NE2-OD1 3.09Å; H134-D147 IonicContact NE2-OD2 3.61Å; H134-D147 PolarHBondContact NE2-OD2 2.94Å; H134-I164 PolarHBondContact N-O 2.94Å; H134-V165 WeakPolarHBondContact O-CA 3.21Å; H134-V166 PolarHBondContact O-N 2.73Å
135	S	95.6	Very high	92.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.3	176.7	58	0	0	0	0	112.3	E72 V73 V166	E72-S135 WeakPolarHBondContact CA-OG 3.34Å; E72-S135 WeakPolarHBondContact CB-O 3.43Å; E72-S135 VanDerWaalsContact CG-O 3.3Å; E72-S135 WeakPolarHBondContact CG-O 3.47Å; V73-S135 PolarHBondContact N-OG 3.42Å; V73-S135 PolarHBondContact O-N 3.1Å; S135-V166 CarbonylContact C-O 3.45Å; S135-V166 WeakPolarHBondContact CA-O 3.42Å
136	H	94.3	Very high	92.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.092	C	C	.	.			trans	-117.9	89.7	167.6	-81.8	-169.9	0	0	0	109.4	E72 H134 G138 Y139 G140 W142 D147 V165 V166 D167	E72-H136 IonicContact OE1-CD2 2.69Å; E72-H136 PolarHBondContact OE1-CD2 3.04Å; E72-H136 VanDerWaalsContact OE1-CD2 3.31Å; E72-H136 IonicContact OE1-NE2 2.73Å; H134-H136 AromaticContact CD2-CD2 3.47Å; H134-H136 PolarHBondContact CD2-CD2 3.2Å; H134-H136 VanDerWaalsContact CD2-CD2 3.47Å; H134-H136 AromaticContact CD2-NE2 3.41Å; H134-H136 PolarHBondContact CD2-NE2 2.75Å; H134-H136 AromaticContact NE2-CD2 3.48Å; H134-H136 PolarHBondContact NE2-CD2 2.78Å; H134-H136 AromaticContact NE2-CE1 3.74Å; H134-H136 AromaticContact NE2-NE2 2.95Å; H134-H136 PolarHBondContact NE2-NE2 3.43Å; H136-G138 PolarHBondContact O-N 3.08Å; H136-G138 VanDerWaalsContact O-N 3.08Å; H136-Y139 VanDerWaalsContact CA-CZ 3.5Å; H136-Y139 WeakPolarHBondContact CA-OH 3.41Å; H136-Y139 HydrophobicContact CB-CD2 3.85Å; H136-Y139 HydrophobicContact CB-CE1 4.19Å; H136-Y139 HydrophobicContact CB-CE2 3.37Å; H136-Y139 HydrophobicContact CB-CG 4.45Å; H136-Y139 AromaticContact CD2-CE2 3.59Å; H136-Y139 AromaticContact CD2-CZ 3.82Å; H136-Y139 PolarHBondContact CD2-OH 3.26Å; H136-Y139 AromaticContact CE1-CE2 3.84Å; H136-Y139 AromaticContact CG-CD2 3.92Å; H136-Y139 AromaticContact CG-CE2 3.17Å; H136-Y139 AromaticContact CG-CZ 3.64Å; H136-Y139 AromaticContact ND1-CD2 3.82Å; H136-Y139 AromaticContact ND1-CE2 3.34Å; H136-Y139 VanDerWaalsContact ND1-CE2 3.34Å; H136-Y139 WeakPolarHBondContact ND1-CE2 3.48Å; H136-G140 WeakPolarHBondContact CB-O 3.3Å; H136-G140 PolarHBondContact ND1-O 2.69Å; H136-W142 PolarHBondContact CE1-O 3.07Å; H136-W142 PolarHBondContact ND1-O 2.79Å; H136-D147 IonicContact CE1-OD2 2.7Å; H136-D147 PolarHBondContact CE1-OD2 3.36Å; H136-D147 IonicContact NE2-OD2 2.76Å; H136-D147 PolarHBondContact NE2-OD2 3.27Å; H136-V165 HydrophobicContact CB-CG1 3.8Å; H136-V166 PolarHBondContact N-O 2.99Å; H136-D167 WeakPolarHBondContact O-CA 3.34Å; H136-D167 WeakPolarHBondContact O-CB 3.25Å
137	P	93.3	Very high	93.2	Very high	14 Å²	14	13.4 Å²	13.4	9%	0.091	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	103.9	-172.4	-18.9	33.1	0	0	0	113.2	Y139 P168 I169	P137-Y139 VanDerWaalsContact O-CD1 3.23Å; P137-Y139 WeakPolarHBondContact O-CD1 3.39Å; P137-Y139 WeakPolarHBondContact O-CE1 3.33Å; P137-P168 HydrophobicContact CB-CG 4.38Å; P137-P168 HydrophobicContact CG-CG 4.45Å; P137-I169 HydrophobicContact CB-CD1 3.63Å; P137-I169 HydrophobicContact CB-CG1 3.98Å
138	G	91.2	Very high	93.6	Very high	11 Å²	11	12.5 Å²	12.5	11%	0.113	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.2	-10.3	168.9	0	0	0	0	0	116.2	H136 D167 R170	H136-G138 PolarHBondContact O-N 3.08Å; H136-G138 VanDerWaalsContact O-N 3.08Å; G138-D167 VanDerWaalsContact C-OD2 3.24Å; G138-D167 VanDerWaalsContact CA-OD2 3.23Å; G138-D167 WeakPolarHBondContact CA-OD2 3.46Å; G138-D167 PolarHBondContact N-OD1 2.6Å; G138-D167 PolarHBondContact N-OD2 2.89Å; G138-R170 PolarHBondContact O-NE 2.87Å; G138-R170 PolarHBondContact O-NH2 2.95Å
139	Y	91.6	Very high	93.9	Very high	24 Å²	24	13.9 Å²	13.9	9%	0.094	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	14.4	-177.3	50.9	-81.6	0	0	0	114.2	E72 H136 P137 W142 D167 K206	E72-Y139 WeakPolarHBondContact CG-OH 3.48Å; E72-Y139 PolarHBondContact OE1-OH 2.86Å; H136-Y139 VanDerWaalsContact CA-CZ 3.5Å; H136-Y139 WeakPolarHBondContact CA-OH 3.41Å; H136-Y139 HydrophobicContact CB-CD2 3.85Å; H136-Y139 HydrophobicContact CB-CE1 4.19Å; H136-Y139 HydrophobicContact CB-CE2 3.37Å; H136-Y139 HydrophobicContact CB-CG 4.45Å; H136-Y139 AromaticContact CD2-CE2 3.59Å; H136-Y139 AromaticContact CD2-CZ 3.82Å; H136-Y139 PolarHBondContact CD2-OH 3.26Å; H136-Y139 AromaticContact CE1-CE2 3.84Å; H136-Y139 AromaticContact CG-CD2 3.92Å; H136-Y139 AromaticContact CG-CE2 3.17Å; H136-Y139 AromaticContact CG-CZ 3.64Å; H136-Y139 AromaticContact ND1-CD2 3.82Å; H136-Y139 AromaticContact ND1-CE2 3.34Å; H136-Y139 VanDerWaalsContact ND1-CE2 3.34Å; H136-Y139 WeakPolarHBondContact ND1-CE2 3.48Å; P137-Y139 VanDerWaalsContact O-CD1 3.23Å; P137-Y139 WeakPolarHBondContact O-CD1 3.39Å; P137-Y139 WeakPolarHBondContact O-CE1 3.33Å; Y139-W142 AromaticContact CD2-CZ2 3.92Å; Y139-W142 HydrophobicContact CD2-CZ2 3.92Å; Y139-W142 AromaticContact CD2-NE1 3.71Å; Y139-W142 HydrophobicContact CE2-CZ2 4.43Å; Y139-W142 PolarHBondContact O-NE1 3.23Å; Y139-D167 PolarHBondContact N-OD2 2.9Å; Y139-K206 HydrophobicContact CD2-CG 4.43Å; Y139-K206 HydrophobicContact CG-CG 4.46Å
140	G	93.1	Very high	93.9	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.077	C	C	.	.			trans	84	-178.2	171	0	0	0	0	0	114.1	H136 D167 R170 Q200	H136-G140 WeakPolarHBondContact CB-O 3.3Å; H136-G140 PolarHBondContact ND1-O 2.69Å; G140-D167 PolarHBondContact N-OD2 3.03Å; G140-R170 VanDerWaalsContact N-CZ 3.34Å; G140-Q200 VanDerWaalsContact CA-NE2 3.26Å
141	C	95.3	Very high	93.9	Very high	3 Å²	3	13.6 Å²	13.6	2%	0.02	8%	0.077	C	C	.	.	S	Bend	trans	-109.1	101.1	-171.1	-61.5	0	0	0	0	109.7	V165 D178 F182 Q200	C141-V165 HydrophobicContact CB-CB 4.05Å; C141-V165 HydrophobicContact CB-CG1 4.16Å; C141-V165 PolarHBondContact SG-O 2.97Å; C141-D178 PolarHBondContact SG-O 3.04Å; C141-D178 PolarHBondContact SG-OD1 2.95Å; C141-F182 HydrophobicContact CB-CE2 4.4Å; C141-F182 HydrophobicContact CB-CZ 4.35Å; C141-F182 WeakPolarHBondContact O-CZ 3.31Å; C141-Q200 PolarHBondContact O-OE1 3.32Å
142	W	94.9	Very high	93.7	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.008	8%	0.083	C	C	.	.			trans	-156.1	169.9	179.8	57.5	-81.2	0	0	0	108.5	H136 Y139 I202 K206 D209 F210 Y217	H136-W142 PolarHBondContact CE1-O 3.07Å; H136-W142 PolarHBondContact ND1-O 2.79Å; Y139-W142 AromaticContact CD2-CZ2 3.92Å; Y139-W142 HydrophobicContact CD2-CZ2 3.92Å; Y139-W142 AromaticContact CD2-NE1 3.71Å; Y139-W142 HydrophobicContact CE2-CZ2 4.43Å; Y139-W142 PolarHBondContact O-NE1 3.23Å; W142-I202 HydrophobicContact CG-CD1 4.32Å; W142-K206 HydrophobicContact CH2-CB 4.17Å; W142-K206 HydrophobicContact CH2-CD 4.45Å; W142-K206 HydrophobicContact CZ2-CB 3.74Å; W142-K206 HydrophobicContact CZ2-CD 4.25Å; W142-K206 HydrophobicContact CZ2-CG 4.18Å; W142-D209 HydrophobicContact CH2-CB 4.26Å; W142-D209 HydrophobicContact CZ3-CB 4.41Å; W142-D209 WeakPolarHBondContact CZ3-OD2 3.41Å; W142-F210 HydrophobicContact CB-CD2 3.84Å; W142-F210 HydrophobicContact CB-CE2 3.86Å; W142-F210 HydrophobicContact CD2-CB 4.3Å; W142-F210 AromaticContact CD2-CD2 3.68Å; W142-F210 HydrophobicContact CD2-CD2 3.68Å; W142-F210 HydrophobicContact CD2-CG 4.45Å; W142-F210 HydrophobicContact CE3-CB 3.91Å; W142-F210 AromaticContact CE3-CD2 3.65Å; W142-F210 HydrophobicContact CE3-CD2 3.65Å; W142-F210 HydrophobicContact CE3-CG 4.29Å; W142-F210 AromaticContact CG-CD2 3.76Å; W142-F210 HydrophobicContact CG-CD2 3.76Å; W142-F210 HydrophobicContact CG-CE2 4.21Å; W142-F210 HydrophobicContact CH2-CB 4.23Å; W142-F210 HydrophobicContact CZ3-CB 3.84Å; W142-F210 HydrophobicContact CZ3-CD2 4.44Å; W142-Y217 WeakPolarHBondContact CB-OH 3.42Å
143	L	94	Very high	93.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.104	C	C	.	.			trans	-103.8	124.1	177.6	-58.2	-176.5	0	0	0	110.5	D147 V148 A163 V165 F182 T184 Y217	L143-D147 HydrophobicContact CB-CB 3.82Å; L143-D147 HydrophobicContact CD2-CB 3.91Å; L143-D147 HydrophobicContact CG-CB 4.38Å; L143-V148 HydrophobicContact CB-CG2 3.84Å; L143-V148 HydrophobicContact CD1-CG2 4.44Å; L143-A163 HydrophobicContact CD1-CB 4.5Å; L143-A163 HydrophobicContact CD2-CB 4.03Å; L143-V165 HydrophobicContact CD2-CG2 3.73Å; L143-F182 HydrophobicContact CD1-CB 3.65Å; L143-F182 HydrophobicContact CD1-CG 4.33Å; L143-F182 HydrophobicContact CD2-CB 4.21Å; L143-F182 HydrophobicContact CD2-CD2 4.01Å; L143-F182 HydrophobicContact CD2-CG 4.29Å; L143-F182 HydrophobicContact CG-CB 3.9Å; L143-F182 HydrophobicContact CG-CD2 4.21Å; L143-F182 HydrophobicContact CG-CG 4.03Å; L143-T184 HydrophobicContact CD1-CG2 4.17Å; L143-Y217 HydrophobicContact CB-CD1 3.81Å; L143-Y217 HydrophobicContact CB-CE1 3.72Å; L143-Y217 HydrophobicContact CB-CG 4.39Å; L143-Y217 HydrophobicContact CD1-CD1 4.1Å; L143-Y217 HydrophobicContact CD1-CG 4Å; L143-Y217 HydrophobicContact CG-CD1 4.25Å; L143-Y217 HydrophobicContact CG-CE1 4.43Å; L143-Y217 HydrophobicContact CG-CG 4.32Å; L143-Y217 WeakPolarHBondContact O-CE1 3.5Å
144	S	92.8	Very high	93.4	Very high	9 Å²	9	20.2 Å²	20.2	6%	0.063	11%	0.111	C	C	.	.			trans	-66.6	170.8	168.4	68.4	0	0	0	0	111.8	I146 D147 V148 D209	S144-I146 PolarHBondContact O-N 2.78Å; S144-D147 WeakPolarHBondContact CB-OD2 3.06Å; S144-D147 PolarHBondContact N-OD2 3.27Å; S144-D147 PolarHBondContact O-N 2.75Å; S144-D147 VanDerWaalsContact O-N 3.16Å; S144-D147 PolarHBondContact OG-N 3.34Å; S144-D147 VanDerWaalsContact OG-N 3.15Å; S144-D147 PolarHBondContact OG-OD2 2.84Å; S144-V148 WeakPolarHBondContact O-CG2 3.49Å; S144-V148 PolarHBondContact O-N 2.83Å; S144-D209 VanDerWaalsContact CA-OD2 3.23Å; S144-D209 WeakPolarHBondContact CA-OD2 3.49Å; S144-D209 WeakPolarHBondContact CB-OD2 3.42Å
145	G	92	Very high	93.3	Very high	10 Å²	10	21 Å²	21	10%	0.103	12%	0.115	C	C	.	.	H	α-helix	trans	-56	-38.6	174	0	0	0	0	0	113	V148 D149 D209 H213	G145-V148 PolarHBondContact O-N 2.91Å; G145-D149 PolarHBondContact O-N 2.95Å; G145-D209 PolarHBondContact N-OD2 3.23Å; G145-H213 WeakPolarHBondContact CA-CD2 3.3Å; G145-H213 VanDerWaalsContact CA-NE2 3.3Å; G145-H213 WeakPolarHBondContact CA-NE2 3.31Å; G145-H213 PolarHBondContact N-CD2 3.42Å; G145-H213 VanDerWaalsContact N-CD2 3.29Å
146	I	90.3	Very high	93.1	Very high	57 Å²	57	24.9 Å²	24.9	29%	0.292	14%	0.142	S	C	.	.	H	α-helix	trans	-67.7	-42	177.2	-80.4	168.8	0	0	0	111.6	E100 V103 S144 V148 D149 T150	E100-I146 WeakPolarHBondContact O-CD1 3.49Å; V103-I146 HydrophobicContact CB-CG2 4.1Å; V103-I146 HydrophobicContact CG1-CG2 4.07Å; V103-I146 HydrophobicContact CG2-CB 4.12Å; V103-I146 HydrophobicContact CG2-CD1 4.1Å; V103-I146 HydrophobicContact CG2-CG1 3.78Å; V103-I146 HydrophobicContact CG2-CG2 3.42Å; V103-I146 VanDerWaalsContact CG2-CG2 3.42Å; S144-I146 PolarHBondContact O-N 2.78Å; I146-V148 VanDerWaalsContact C-N 3.32Å; I146-V148 PolarHBondContact O-N 2.88Å; I146-D149 PolarHBondContact O-N 3.02Å; I146-T150 WeakPolarHBondContact O-CB 3.33Å; I146-T150 PolarHBondContact O-N 3.26Å; I146-T150 PolarHBondContact O-OG1 3.47Å
147	D	93.4	Very high	92.9	Very high	10 Å²	10	32.9 Å²	32.9	5%	0.053	18%	0.177	C	C	.	.	H	α-helix	trans	-66.3	-38.4	176.8	-58.4	-37.3	0	0	0	111.4	W132 H134 H136 L143 S144 T150 Q151	W132-D147 HydrophobicContact CH2-CB 4.23Å; W132-D147 HydrophobicContact CZ2-CB 4.45Å; H134-D147 IonicContact CD2-OD1 2.68Å; H134-D147 IonicContact CE1-OD1 2.62Å; H134-D147 IonicContact CE1-OD2 3.22Å; H134-D147 VanDerWaalsContact NE2-CG 3.29Å; H134-D147 IonicContact NE2-OD1 2.73Å; H134-D147 PolarHBondContact NE2-OD1 3.09Å; H134-D147 IonicContact NE2-OD2 3.61Å; H134-D147 PolarHBondContact NE2-OD2 2.94Å; H136-D147 IonicContact CE1-OD2 2.7Å; H136-D147 PolarHBondContact CE1-OD2 3.36Å; H136-D147 IonicContact NE2-OD2 2.76Å; H136-D147 PolarHBondContact NE2-OD2 3.27Å; L143-D147 HydrophobicContact CB-CB 3.82Å; L143-D147 HydrophobicContact CD2-CB 3.91Å; L143-D147 HydrophobicContact CG-CB 4.38Å; S144-D147 WeakPolarHBondContact CB-OD2 3.06Å; S144-D147 PolarHBondContact N-OD2 3.27Å; S144-D147 PolarHBondContact O-N 2.75Å; S144-D147 VanDerWaalsContact O-N 3.16Å; S144-D147 PolarHBondContact OG-N 3.34Å; S144-D147 VanDerWaalsContact OG-N 3.15Å; S144-D147 PolarHBondContact OG-OD2 2.84Å; D147-T150 PolarHBondContact O-N 3.43Å; D147-Q151 WeakPolarHBondContact O-CB 3.48Å; D147-Q151 PolarHBondContact O-N 3.38Å
148	V	94.3	Very high	92.8	Very high	12 Å²	12	36.6 Å²	36.6	7%	0.073	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-47.1	175.8	168.2	0	0	0	0	110.5	L143 S144 G145 I146 Q151 L152 T184 H213 C216 Y217	L143-V148 HydrophobicContact CB-CG2 3.84Å; L143-V148 HydrophobicContact CD1-CG2 4.44Å; S144-V148 WeakPolarHBondContact O-CG2 3.49Å; S144-V148 PolarHBondContact O-N 2.83Å; G145-V148 PolarHBondContact O-N 2.91Å; I146-V148 VanDerWaalsContact C-N 3.32Å; I146-V148 PolarHBondContact O-N 2.88Å; V148-Q151 PolarHBondContact O-N 3.1Å; V148-L152 WeakPolarHBondContact O-CB 3.32Å; V148-L152 PolarHBondContact O-N 3.05Å; V148-T184 HydrophobicContact CB-CG2 4.33Å; V148-T184 HydrophobicContact CG1-CG2 4.02Å; V148-T184 HydrophobicContact CG2-CG2 4.33Å; V148-H213 HydrophobicContact CG2-CB 4.3Å; V148-C216 HydrophobicContact CG1-CB 3.87Å; V148-C216 HydrophobicContact CG2-CB 4.23Å; V148-Y217 HydrophobicContact CG2-CD1 3.78Å; V148-Y217 HydrophobicContact CG2-CE1 4.24Å
149	D	92.9	Very high	92.8	Very high	98 Å²	98	38.3 Å²	38.3	52%	0.524	20%	0.201	S	C	.	.	H	α-helix	trans	-64.4	-42.9	177.8	-81.2	-22.7	0	0	0	112	G145 I146 L152 M153	G145-D149 PolarHBondContact O-N 2.95Å; I146-D149 PolarHBondContact O-N 3.02Å; D149-L152 PolarHBondContact O-N 2.92Å; D149-M153 WeakPolarHBondContact O-CB 3.43Å; D149-M153 PolarHBondContact O-N 3.42Å
150	T	92	Very high	92.9	Very high	19 Å²	19	37.3 Å²	37.3	12%	0.117	20%	0.197	C	C	.	.	H	α-helix	trans	-58.7	-51.9	174.6	-54.3	0	0	0	0	111.2	V103 W132 I146 D147 L152 M153 N154	V103-T150 WeakPolarHBondContact CG1-OG1 3.44Å; W132-T150 HydrophobicContact CH2-CG2 4.22Å; W132-T150 HydrophobicContact CZ2-CG2 3.97Å; I146-T150 WeakPolarHBondContact O-CB 3.33Å; I146-T150 PolarHBondContact O-N 3.26Å; I146-T150 PolarHBondContact O-OG1 3.47Å; D147-T150 PolarHBondContact O-N 3.43Å; T150-L152 VanDerWaalsContact C-N 3.31Å; T150-L152 PolarHBondContact O-N 3.27Å; T150-M153 WeakPolarHBondContact O-CB 3.3Å; T150-M153 PolarHBondContact O-N 3.19Å; T150-N154 PolarHBondContact O-N 3.03Å; T150-N154 PolarHBondContact O-ND2 2.97Å
151	Q	95	Very high	93	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.5	-37.3	-178	178.4	58.4	12.4	0	0	111.5	D147 V148 N154 Q155 F161 A163 T184	D147-Q151 WeakPolarHBondContact O-CB 3.48Å; D147-Q151 PolarHBondContact O-N 3.38Å; V148-Q151 PolarHBondContact O-N 3.1Å; Q151-N154 PolarHBondContact O-N 3.42Å; Q151-Q155 WeakPolarHBondContact O-CB 3.4Å; Q151-Q155 WeakPolarHBondContact O-CG 3.28Å; Q151-Q155 PolarHBondContact O-N 2.9Å; Q151-F161 PolarHBondContact NE2-O 3.45Å; Q151-A163 HydrophobicContact CB-CB 4.48Å; Q151-A163 HydrophobicContact CG-CB 4.15Å; Q151-T184 HydrophobicContact CB-CG2 3.88Å; Q151-T184 HydrophobicContact CG-CG2 3.73Å
152	L	93.7	Very high	93.1	Very high	23 Å²	23	37.2 Å²	37.2	12%	0.12	20%	0.196	C	C	.	.	H	α-helix	trans	-66.4	-40.2	175.4	-176.1	68.9	0	0	0	112	V148 D149 T150 S156 K187	V148-L152 WeakPolarHBondContact O-CB 3.32Å; V148-L152 PolarHBondContact O-N 3.05Å; D149-L152 PolarHBondContact O-N 2.92Å; T150-L152 VanDerWaalsContact C-N 3.31Å; T150-L152 PolarHBondContact O-N 3.27Å; L152-S156 WeakPolarHBondContact O-CB 3.34Å; L152-S156 PolarHBondContact O-N 3.13Å; L152-S156 PolarHBondContact O-OG 3.12Å; L152-K187 HydrophobicContact CD2-CD 4.06Å; L152-K187 HydrophobicContact CD2-CG 3.57Å
153	M	93.8	Very high	93.3	Very high	97 Å²	97	37.1 Å²	37.1	48%	0.478	20%	0.196	S	C	.	.	H	α-helix	trans	-60.3	-50.5	172.8	-174.1	-174.5	-60.2	0	0	110.3	D149 T150 Q155 S156 F157	D149-M153 WeakPolarHBondContact O-CB 3.43Å; D149-M153 PolarHBondContact O-N 3.42Å; T150-M153 WeakPolarHBondContact O-CB 3.3Å; T150-M153 PolarHBondContact O-N 3.19Å; M153-Q155 PolarHBondContact O-N 3.48Å; M153-S156 WeakPolarHBondContact O-CA 3.2Å; M153-S156 WeakPolarHBondContact O-CB 3.39Å; M153-S156 PolarHBondContact O-N 3.07Å; M153-F157 HydrophobicContact CG-CD2 3.99Å; M153-F157 HydrophobicContact CG-CE2 3.99Å; M153-F157 VanDerWaalsContact O-CD2 3.25Å; M153-F157 WeakPolarHBondContact O-CD2 3.31Å; M153-F157 PolarHBondContact O-N 3.29Å
154	N	93.2	Very high	93.5	Very high	30 Å²	30	37.1 Å²	37.1	16%	0.16	20%	0.196	C	C	.	.	H	α-helix	trans	-62.9	-42.7	179.9	-69	-26.4	0	0	0	112.4	T150 Q151 S156 F157 L158 F161	T150-N154 PolarHBondContact O-N 3.03Å; T150-N154 PolarHBondContact O-ND2 2.97Å; Q151-N154 PolarHBondContact O-N 3.42Å; N154-S156 PolarHBondContact O-N 2.91Å; N154-F157 PolarHBondContact O-N 3.42Å; N154-L158 WeakPolarHBondContact O-CA 3.29Å; N154-L158 WeakPolarHBondContact O-CB 3.36Å; N154-L158 PolarHBondContact O-N 3.37Å; N154-F161 HydrophobicContact CB-CB 4.47Å; N154-F161 HydrophobicContact CB-CD1 3.36Å; N154-F161 HydrophobicContact CB-CE1 3.53Å; N154-F161 HydrophobicContact CB-CG 3.89Å; N154-F161 HydrophobicContact CB-CZ 4.22Å; N154-F161 WeakPolarHBondContact ND2-CE1 3.23Å
155	Q	93.7	Very high	93.7	Very high	21 Å²	21	36.7 Å²	36.7	10%	0.098	19%	0.193	C	C	.	.	H	α-helix	trans	-63.6	-21.9	172.8	-78.8	-178.2	-146.1	0	0	113	Q151 M153 E159 F161 R183 T184	Q151-Q155 WeakPolarHBondContact O-CB 3.4Å; Q151-Q155 WeakPolarHBondContact O-CG 3.28Å; Q151-Q155 PolarHBondContact O-N 2.9Å; M153-Q155 PolarHBondContact O-N 3.48Å; Q155-E159 WeakPolarHBondContact CB-OE2 3.44Å; Q155-E159 WeakPolarHBondContact O-CB 3.28Å; Q155-F161 HydrophobicContact CG-CB 4.2Å; Q155-R183 VanDerWaalsContact NE2-NH2 3.17Å; Q155-T184 PolarHBondContact NE2-O 3.17Å; Q155-T184 PolarHBondContact OE1-OG1 3.27Å
156	S	91.5	Very high	94	Very high	82 Å²	82	36.2 Å²	36.2	57%	0.573	19%	0.188	S	C	*	.	H	α-helix	trans	-79.3	-33	177.4	-59.3	0	0	0	0	112.6	L152 M153 N154	L152-S156 WeakPolarHBondContact O-CB 3.34Å; L152-S156 PolarHBondContact O-N 3.13Å; L152-S156 PolarHBondContact O-OG 3.12Å; M153-S156 WeakPolarHBondContact O-CA 3.2Å; M153-S156 WeakPolarHBondContact O-CB 3.39Å; M153-S156 PolarHBondContact O-N 3.07Å; N154-S156 PolarHBondContact O-N 2.91Å
157	F	89.9	Confident	94.2	Very high	168 Å²	168	33.5 Å²	33.5	74%	0.737	17%	0.174	S	C	*	.	H	α-helix	trans	-109.9	-30.2	-173.5	-63.7	-71	0	0	0	114.6	M153 N154	M153-F157 HydrophobicContact CG-CD2 3.99Å; M153-F157 HydrophobicContact CG-CE2 3.99Å; M153-F157 VanDerWaalsContact O-CD2 3.25Å; M153-F157 WeakPolarHBondContact O-CD2 3.31Å; M153-F157 PolarHBondContact O-N 3.29Å; N154-F157 PolarHBondContact O-N 3.42Å
158	L	89.9	Confident	94.3	Very high	92 Å²	92	33.3 Å²	33.3	48%	0.482	17%	0.174	S	C	.	.	S	Bend	trans	-122.1	27.8	-170	-58.6	177.5	0	0	0	113	N154 P160 F161	N154-L158 WeakPolarHBondContact O-CA 3.29Å; N154-L158 WeakPolarHBondContact O-CB 3.36Å; N154-L158 PolarHBondContact O-N 3.37Å; L158-P160 CarbonylContact O-C 3.53Å; L158-F161 HydrophobicContact CB-CD2 3.69Å; L158-F161 HydrophobicContact CB-CE2 3.88Å; L158-F161 HydrophobicContact CD1-CD2 4.5Å; L158-F161 HydrophobicContact CD1-CE2 3.86Å; L158-F161 HydrophobicContact CD1-CZ 4.3Å; L158-F161 WeakPolarHBondContact O-CD2 3.49Å
159	E	91.8	Very high	94.3	Very high	48 Å²	48	34.6 Å²	34.6	22%	0.224	18%	0.18	C	C	.	.	S	Bend	trans	-63.3	128.8	-179.1	-168.2	69.3	-124.5	0	0	111.9	W41 Q155 R183	W41-E159 VanDerWaalsContact CD1-CG 3.45Å; W41-E159 HydrophobicContact CG-CG 4.32Å; Q155-E159 WeakPolarHBondContact CB-OE2 3.44Å; Q155-E159 WeakPolarHBondContact O-CB 3.28Å; E159-R183 IonicContact OE1-CZ 3Å; E159-R183 IonicContact OE1-NH1 3.74Å; E159-R183 PolarHBondContact OE1-NH1 2.95Å; E159-R183 IonicContact OE1-NH2 2.69Å; E159-R183 PolarHBondContact OE1-NH2 3.07Å; E159-R183 IonicContact OE2-CZ 3.78Å; E159-R183 IonicContact OE2-NH1 3.2Å; E159-R183 IonicContact OE2-NH2 3.06Å; E159-R183 PolarHBondContact OE2-NH2 3.37Å
160	P	93.6	Very high	94.2	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.013	16%	0.157	C	C	.	.	S	Bend	cis	-86.2	134.3	10.1	32.4	-32.3	0	0	0	116	W41 F48 V81 L158	W41-P160 HydrophobicContact CH2-CB 4.44Å; W41-P160 HydrophobicContact CH2-CG 3.95Å; W41-P160 HydrophobicContact CZ2-CG 4.3Å; W41-P160 HydrophobicContact CZ3-CB 4.49Å; W41-P160 HydrophobicContact CZ3-CG 4.25Å; F48-P160 HydrophobicContact CE2-CB 3.79Å; F48-P160 HydrophobicContact CZ-CB 3.75Å; V81-P160 HydrophobicContact CB-CG 4.46Å; V81-P160 HydrophobicContact CG2-CB 4.07Å; V81-P160 HydrophobicContact CG2-CG 3.49Å; V81-P160 VanDerWaalsContact CG2-CG 3.49Å; L158-P160 CarbonylContact O-C 3.53Å
161	F	95.7	Very high	94.3	Very high	1 Å²	1	30.3 Å²	30.3	0%	0.004	16%	0.156	C	C	.	.			trans	-133.6	138.3	-177.5	-137.7	-104.1	0	0	0	113.4	M76 V129 I130 W132 Q151 N154 Q155 L158 R183	M76-F161 HydrophobicContact CE-CZ 3.8Å; V129-F161 HydrophobicContact CG1-CE2 3.72Å; V129-F161 HydrophobicContact CG1-CZ 4.04Å; I130-F161 CarbonylContact O-C 3.53Å; I130-F161 VanDerWaalsContact O-CA 3.29Å; I130-F161 WeakPolarHBondContact O-CA 3.31Å; W132-F161 HydrophobicContact CB-CE1 4.15Å; W132-F161 AromaticContact CD1-CD1 3.8Å; W132-F161 AromaticContact CD1-CE1 3.4Å; W132-F161 HydrophobicContact CG-CE1 4.05Å; Q151-F161 PolarHBondContact NE2-O 3.45Å; N154-F161 HydrophobicContact CB-CB 4.47Å; N154-F161 HydrophobicContact CB-CD1 3.36Å; N154-F161 HydrophobicContact CB-CE1 3.53Å; N154-F161 HydrophobicContact CB-CG 3.89Å; N154-F161 HydrophobicContact CB-CZ 4.22Å; N154-F161 WeakPolarHBondContact ND2-CE1 3.23Å; Q155-F161 HydrophobicContact CG-CB 4.2Å; L158-F161 HydrophobicContact CB-CD2 3.69Å; L158-F161 HydrophobicContact CB-CE2 3.88Å; L158-F161 HydrophobicContact CD1-CD2 4.5Å; L158-F161 HydrophobicContact CD1-CE2 3.86Å; L158-F161 HydrophobicContact CD1-CZ 4.3Å; L158-F161 WeakPolarHBondContact O-CD2 3.49Å; F161-R183 PolarHBondContact O-NH1 3.33Å
162	V	97.8	Very high	94	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	144.7	175.9	68.2	0	0	0	0	111.4	V51 L77 I86 I130 G131 W132 I164 A181 F182 R183	V51-V162 HydrophobicContact CG2-CG2 4.11Å; L77-V162 HydrophobicContact CD1-CG1 3.76Å; I86-V162 HydrophobicContact CD1-CB 3.87Å; I86-V162 HydrophobicContact CD1-CG1 4.42Å; I86-V162 HydrophobicContact CD1-CG2 4.47Å; I86-V162 HydrophobicContact CG2-CG1 4.02Å; I130-V162 PolarHBondContact O-N 3.39Å; G131-V162 CarbonylContact C-O 3.51Å; G131-V162 WeakPolarHBondContact CA-O 3.42Å; W132-V162 PolarHBondContact N-O 2.95Å; V162-I164 HydrophobicContact CG1-CG1 4.48Å; V162-A181 HydrophobicContact CG2-CB 4.28Å; V162-F182 WeakPolarHBondContact CG2-O 3.44Å; V162-R183 HydrophobicContact CG2-CG 4.3Å
163	A	97.8	Very high	93.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	131.7	169.8	0	0	0	0	0	109.4	W132 L143 Q151 A181 F182	W132-A163 HydrophobicContact CZ2-CB 4.16Å; W132-A163 CarbonylContact O-C 3.5Å; W132-A163 WeakPolarHBondContact O-CA 3.14Å; L143-A163 HydrophobicContact CD1-CB 4.5Å; L143-A163 HydrophobicContact CD2-CB 4.03Å; Q151-A163 HydrophobicContact CB-CB 4.48Å; Q151-A163 HydrophobicContact CG-CB 4.15Å; A163-A181 CarbonylContact O-C 3.52Å; A163-A181 WeakPolarHBondContact O-CA 3.18Å; A163-F182 PolarHBondContact N-O 3.45Å; A163-F182 PolarHBondContact O-N 3.1Å
164	I	98.3	Very high	93.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.1	175.1	-64	-172.4	0	0	0	109.4	V51 M53 I61 L77 V88 W132 Y133 H134 V162 I179 G180 A181	V51-I164 HydrophobicContact CG1-CD1 4.37Å; M53-I164 HydrophobicContact CE-CD1 3.23Å; M53-I164 HydrophobicContact CE-CG2 4.21Å; I61-I164 HydrophobicContact CD1-CG2 4.46Å; L77-I164 HydrophobicContact CD1-CB 4.35Å; L77-I164 HydrophobicContact CD1-CD1 3.54Å; L77-I164 HydrophobicContact CD1-CG1 3.77Å; L77-I164 HydrophobicContact CD2-CD1 4.42Å; V88-I164 HydrophobicContact CG2-CD1 4.25Å; W132-I164 PolarHBondContact O-N 3.4Å; Y133-I164 CarbonylContact C-O 3.55Å; Y133-I164 WeakPolarHBondContact CA-O 3.25Å; Y133-I164 WeakPolarHBondContact CB-O 3.34Å; H134-I164 PolarHBondContact N-O 2.94Å; V162-I164 HydrophobicContact CG1-CG1 4.48Å; I164-I179 HydrophobicContact CG2-CD1 3.78Å; I164-I179 HydrophobicContact CG2-CG1 3.77Å; I164-G180 CarbonylContact C-O 3.54Å; I164-G180 VanDerWaalsContact CA-O 3.3Å; I164-G180 WeakPolarHBondContact CA-O 3.47Å; I164-A181 HydrophobicContact CG1-CB 4.17Å
165	V	97.5	Very high	92.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	135	177.3	-170	0	0	0	0	108.6	H134 H136 C141 L143 I179 G180 F182	H134-V165 WeakPolarHBondContact O-CA 3.21Å; H136-V165 HydrophobicContact CB-CG1 3.8Å; C141-V165 HydrophobicContact CB-CB 4.05Å; C141-V165 HydrophobicContact CB-CG1 4.16Å; C141-V165 PolarHBondContact SG-O 2.97Å; L143-V165 HydrophobicContact CD2-CG2 3.73Å; V165-I179 CarbonylContact O-C 3.48Å; V165-I179 VanDerWaalsContact O-CA 3.28Å; V165-I179 WeakPolarHBondContact O-CA 3.37Å; V165-G180 PolarHBondContact N-O 3.1Å; V165-G180 PolarHBondContact O-N 3.23Å; V165-F182 HydrophobicContact CB-CE2 3.97Å; V165-F182 HydrophobicContact CG2-CD2 3.8Å; V165-F182 HydrophobicContact CG2-CE2 3.68Å
166	V	97.4	Very high	92.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.9	174.5	64.3	0	0	0	0	110.3	I61 V62 A65 H134 S135 H136 P168 D178	I61-V166 HydrophobicContact CG2-CB 4.02Å; I61-V166 HydrophobicContact CG2-CG1 3.68Å; I61-V166 HydrophobicContact CG2-CG2 4.36Å; V62-V166 HydrophobicContact CG2-CG2 4.38Å; A65-V166 HydrophobicContact CB-CG1 3.49Å; A65-V166 VanDerWaalsContact CB-CG1 3.49Å; H134-V166 PolarHBondContact O-N 2.73Å; S135-V166 CarbonylContact C-O 3.45Å; S135-V166 WeakPolarHBondContact CA-O 3.42Å; H136-V166 PolarHBondContact N-O 2.99Å; V166-P168 WeakPolarHBondContact O-CD 3.44Å; V166-D178 WeakPolarHBondContact CA-O 3.48Å; V166-D178 WeakPolarHBondContact CG2-O 3.14Å
167	D	96	Very high	92.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	101.4	172.3	-172.7	-29.7	0	0	0	109.3	H136 G138 Y139 G140 I169 R170 T171 D178	H136-D167 WeakPolarHBondContact O-CA 3.34Å; H136-D167 WeakPolarHBondContact O-CB 3.25Å; G138-D167 VanDerWaalsContact C-OD2 3.24Å; G138-D167 VanDerWaalsContact CA-OD2 3.23Å; G138-D167 WeakPolarHBondContact CA-OD2 3.46Å; G138-D167 PolarHBondContact N-OD1 2.6Å; G138-D167 PolarHBondContact N-OD2 2.89Å; Y139-D167 PolarHBondContact N-OD2 2.9Å; G140-D167 PolarHBondContact N-OD2 3.03Å; D167-I169 VanDerWaalsContact C-N 3.3Å; D167-I169 PolarHBondContact O-N 3.42Å; D167-I169 PolarHBondContact OD1-N 3.22Å; D167-R170 HydrophobicContact CB-CB 4.02Å; D167-R170 HydrophobicContact CB-CG 4.35Å; D167-R170 PolarHBondContact OD1-N 3.49Å; D167-R170 WeakPolarHBondContact OD2-CD 3.13Å; D167-R170 WeakPolarHBondContact OD2-CG 3.46Å; D167-R170 IonicContact OD2-NE 3.13Å; D167-R170 PolarHBondContact OD2-NE 3.43Å; D167-R170 VanDerWaalsContact OD2-NE 3.14Å; D167-T171 VanDerWaalsContact O-CB 3.22Å; D167-T171 WeakPolarHBondContact O-CB 3.39Å; D167-T171 PolarHBondContact O-N 2.93Å; D167-T171 PolarHBondContact O-OG1 2.96Å; D167-D178 HydrophobicContact CB-CB 4.16Å; D167-D178 PolarHBondContact N-O 3.18Å
168	P	95	Very high	92.9	Very high	7 Å²	7	30.4 Å²	30.4	5%	0.045	17%	0.174	C	C	.	.	H	α-helix	trans	-68.7	-29.7	-178	27.4	-34.6	0	0	0	112.7	A65 P137 V166 T172	A65-P168 HydrophobicContact CB-CB 3.99Å; A65-P168 HydrophobicContact CB-CG 4.07Å; P137-P168 HydrophobicContact CB-CG 4.38Å; P137-P168 HydrophobicContact CG-CG 4.45Å; V166-P168 WeakPolarHBondContact O-CD 3.44Å; P168-T172 WeakPolarHBondContact O-CB 3.32Å; P168-T172 PolarHBondContact O-N 3.4Å; P168-T172 VanDerWaalsContact O-N 3.08Å; P168-T172 PolarHBondContact O-OG1 3.38Å
169	I	93.2	Very high	93.3	Very high	38 Å²	38	26.5 Å²	26.5	20%	0.195	15%	0.153	C	C	.	.	H	α-helix	trans	-72.8	-49.3	-179.2	-60.8	-176.3	0	0	0	109.3	N70 P137 D167 T171 T172 A173 Y257	N70-I169 WeakPolarHBondContact OD1-CD1 3.27Å; P137-I169 HydrophobicContact CB-CD1 3.63Å; P137-I169 HydrophobicContact CB-CG1 3.98Å; D167-I169 VanDerWaalsContact C-N 3.3Å; D167-I169 PolarHBondContact O-N 3.42Å; D167-I169 PolarHBondContact OD1-N 3.22Å; I169-T171 VanDerWaalsContact C-N 3.3Å; I169-T171 PolarHBondContact O-N 3.37Å; I169-T172 PolarHBondContact O-N 2.85Å; I169-A173 VanDerWaalsContact O-CB 3.3Å; I169-A173 WeakPolarHBondContact O-CB 3.47Å; I169-A173 PolarHBondContact O-N 3.1Å; I169-Y257 HydrophobicContact CG2-CD2 3.4Å; I169-Y257 HydrophobicContact CG2-CE2 4.21Å; I169-Y257 HydrophobicContact CG2-CG 3.8Å
170	R	92.1	Very high	93.6	Very high	11 Å²	11	24.2 Å²	24.2	4%	0.042	14%	0.142	C	C	.	.	H	α-helix	trans	-64.3	-36.3	174.7	-71.7	-179.2	-169	-152.3	-2.9	112.2	G138 G140 D167 T172 A173 N174 D178 Q200 S201 Y257	G138-R170 PolarHBondContact O-NE 2.87Å; G138-R170 PolarHBondContact O-NH2 2.95Å; G140-R170 VanDerWaalsContact N-CZ 3.34Å; D167-R170 HydrophobicContact CB-CB 4.02Å; D167-R170 HydrophobicContact CB-CG 4.35Å; D167-R170 PolarHBondContact OD1-N 3.49Å; D167-R170 WeakPolarHBondContact OD2-CD 3.13Å; D167-R170 WeakPolarHBondContact OD2-CG 3.46Å; D167-R170 IonicContact OD2-NE 3.13Å; D167-R170 PolarHBondContact OD2-NE 3.43Å; D167-R170 VanDerWaalsContact OD2-NE 3.14Å; R170-T172 VanDerWaalsContact C-N 3.32Å; R170-T172 PolarHBondContact O-N 3.41Å; R170-A173 PolarHBondContact O-N 3.28Å; R170-N174 VanDerWaalsContact O-CB 3.31Å; R170-N174 WeakPolarHBondContact O-CB 3.15Å; R170-N174 PolarHBondContact O-N 3.39Å; R170-D178 HydrophobicContact CB-CB 3.95Å; R170-D178 WeakPolarHBondContact CD-OD2 3.41Å; R170-Q200 VanDerWaalsContact NH1-CG 3.3Å; R170-S201 PolarHBondContact NH1-O 3.49Å; R170-S201 PolarHBondContact NH2-O 3.36Å; R170-Y257 HydrophobicContact CG-CE2 4.01Å
171	T	92.8	Very high	93.8	Very high	16 Å²	16	24.1 Å²	24.1	10%	0.098	14%	0.142	C	C	.	.	H	α-helix	trans	-57.6	-48.5	175.5	-66.8	0	0	0	0	111.4	V62 D167 I169 G175 K176 V177 D178	V62-T171 HydrophobicContact CG1-CG2 4.41Å; D167-T171 VanDerWaalsContact O-CB 3.22Å; D167-T171 WeakPolarHBondContact O-CB 3.39Å; D167-T171 PolarHBondContact O-N 2.93Å; D167-T171 PolarHBondContact O-OG1 2.96Å; I169-T171 VanDerWaalsContact C-N 3.3Å; I169-T171 PolarHBondContact O-N 3.37Å; T171-G175 WeakPolarHBondContact O-CA 3.32Å; T171-G175 PolarHBondContact O-N 3.37Å; T171-K176 WeakPolarHBondContact CA-O 3.48Å; T171-K176 PolarHBondContact O-N 3.38Å; T171-V177 HydrophobicContact CG2-CB 4.35Å; T171-V177 HydrophobicContact CG2-CG2 4.17Å; T171-D178 PolarHBondContact OG1-N 3.38Å
172	T	89	Confident	93.9	Very high	44 Å²	44	24.3 Å²	24.3	27%	0.27	14%	0.142	S	C	.	.	H	α-helix	trans	-70.4	-44.1	-179.4	-54.8	0	0	0	0	111.4	P168 I169 R170 D250	P168-T172 WeakPolarHBondContact O-CB 3.32Å; P168-T172 PolarHBondContact O-N 3.4Å; P168-T172 VanDerWaalsContact O-N 3.08Å; P168-T172 PolarHBondContact O-OG1 3.38Å; I169-T172 PolarHBondContact O-N 2.85Å; R170-T172 VanDerWaalsContact C-N 3.32Å; R170-T172 PolarHBondContact O-N 3.41Å; T172-D250 HydrophobicContact CG2-CB 4.47Å; T172-D250 WeakPolarHBondContact CG2-OD2 3.39Å
173	A	85.3	Confident	93.8	Very high	2 Å²	2	24.8 Å²	24.8	2%	0.017	14%	0.144	C	C	.	.	H	α-helix	trans	-63.1	-45.7	178.6	0	0	0	0	0	111.6	I169 R170 R254 Y257	I169-A173 VanDerWaalsContact O-CB 3.3Å; I169-A173 WeakPolarHBondContact O-CB 3.47Å; I169-A173 PolarHBondContact O-N 3.1Å; R170-A173 PolarHBondContact O-N 3.28Å; A173-R254 PolarHBondContact O-NE 3.15Å; A173-R254 PolarHBondContact O-NH1 2.91Å; A173-R254 PolarHBondContact O-NH2 3.49Å; A173-Y257 HydrophobicContact CB-CD1 3.4Å; A173-Y257 HydrophobicContact CB-CE1 3.79Å; A173-Y257 HydrophobicContact CB-CG 4.05Å
174	N	83.4	Confident	93.7	Very high	60 Å²	60	24.9 Å²	24.9	32%	0.321	15%	0.145	S	C	.	.	H	α-helix	trans	-92.3	-7.9	-172.7	-68.9	-18.5	0	0	0	114	R170 K176 E311	R170-N174 VanDerWaalsContact O-CB 3.31Å; R170-N174 WeakPolarHBondContact O-CB 3.15Å; R170-N174 PolarHBondContact O-N 3.39Å; N174-K176 PolarHBondContact O-N 3.39Å; N174-E311 PolarHBondContact ND2-OE1 2.92Å; N174-E311 VanDerWaalsContact OD1-CG 3.3Å; N174-E311 WeakPolarHBondContact OD1-CG 3.47Å; N174-E311 PolarHBondContact OD1-OE1 3.42Å
175	G	84.1	Confident	93.6	Very high	73 Å²	73	26 Å²	26	75%	0.753	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.8	19.3	-176.2	0	0	0	0	0	113.1	T171	T171-G175 WeakPolarHBondContact O-CA 3.32Å; T171-G175 PolarHBondContact O-N 3.37Å
176	K	90.1	Very high	93.3	Very high	163 Å²	163	29 Å²	29	71%	0.709	17%	0.169	S	C	*	.	S	Bend	trans	-138	130	179.8	176.6	-177	176.5	-170.9	0	107.6	T171 N174 D178	T171-K176 WeakPolarHBondContact CA-O 3.48Å; T171-K176 PolarHBondContact O-N 3.38Å; N174-K176 PolarHBondContact O-N 3.39Å; K176-D178 PolarHBondContact O-N 3.5Å; K176-D178 VanDerWaalsContact O-N 3.09Å
177	V	95.3	Very high	92.8	Very high	49 Å²	49	37 Å²	37	30%	0.297	20%	0.203	S	C	.	.			trans	-59.3	115.7	178.3	-172.7	0	0	0	0	110.2	L58 V62 T171 I179	L58-V177 HydrophobicContact CD1-CG1 4.07Å; V62-V177 HydrophobicContact CG2-CG1 3.79Å; V62-V177 HydrophobicContact CG2-CG2 4.4Å; T171-V177 HydrophobicContact CG2-CB 4.35Å; T171-V177 HydrophobicContact CG2-CG2 4.17Å; V177-I179 HydrophobicContact CG1-CB 4.06Å; V177-I179 HydrophobicContact CG1-CG2 3.96Å
178	D	95.6	Very high	92.2	Very high	33 Å²	33	45.8 Å²	45.8	18%	0.176	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	105.7	171.7	-164.4	-4.7	0	0	0	107.9	C141 V166 D167 R170 T171 K176 Q200	C141-D178 PolarHBondContact SG-O 3.04Å; C141-D178 PolarHBondContact SG-OD1 2.95Å; V166-D178 WeakPolarHBondContact CA-O 3.48Å; V166-D178 WeakPolarHBondContact CG2-O 3.14Å; D167-D178 HydrophobicContact CB-CB 4.16Å; D167-D178 PolarHBondContact N-O 3.18Å; R170-D178 HydrophobicContact CB-CB 3.95Å; R170-D178 WeakPolarHBondContact CD-OD2 3.41Å; T171-D178 PolarHBondContact OG1-N 3.38Å; K176-D178 PolarHBondContact O-N 3.5Å; K176-D178 VanDerWaalsContact O-N 3.09Å; D178-Q200 PolarHBondContact OD2-NE2 3.37Å
179	I	97.7	Very high	91.8	Very high	9 Å²	9	49.8 Å²	49.8	5%	0.046	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	140.7	-173.7	-172.3	171.5	0	0	0	109.2	M53 L58 I164 V165 V177 R219 I222 Y224	M53-I179 HydrophobicContact CE-CD1 3.92Å; M53-I179 HydrophobicContact SD-CD1 4.09Å; L58-I179 HydrophobicContact CD1-CD1 3.94Å; I164-I179 HydrophobicContact CG2-CD1 3.78Å; I164-I179 HydrophobicContact CG2-CG1 3.77Å; V165-I179 CarbonylContact O-C 3.48Å; V165-I179 VanDerWaalsContact O-CA 3.28Å; V165-I179 WeakPolarHBondContact O-CA 3.37Å; V177-I179 HydrophobicContact CG1-CB 4.06Å; V177-I179 HydrophobicContact CG1-CG2 3.96Å; I179-R219 PolarHBondContact O-NH2 3.26Å; I179-I222 HydrophobicContact CB-CD1 4.49Å; I179-I222 HydrophobicContact CD1-CD1 4.42Å; I179-I222 HydrophobicContact CG1-CD1 3.96Å; I179-I222 HydrophobicContact CG2-CD1 4.06Å; I179-Y224 WeakPolarHBondContact CG2-OH 3.18Å
180	G	97.4	Very high	91.4	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	146	175.7	0	0	0	0	0	111.5	I164 V165 F182	I164-G180 CarbonylContact C-O 3.54Å; I164-G180 VanDerWaalsContact CA-O 3.3Å; I164-G180 WeakPolarHBondContact CA-O 3.47Å; V165-G180 PolarHBondContact N-O 3.1Å; V165-G180 PolarHBondContact O-N 3.23Å; G180-F182 WeakPolarHBondContact O-CE2 3.25Å
181	A	98.1	Very high	90.9	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.8	173.7	0	0	0	0	0	108.9	V51 V162 A163 I164 R219 L220 I222	V51-A181 HydrophobicContact CB-CB 4.27Å; V51-A181 HydrophobicContact CG2-CB 3.7Å; V162-A181 HydrophobicContact CG2-CB 4.28Å; A163-A181 CarbonylContact O-C 3.52Å; A163-A181 WeakPolarHBondContact O-CA 3.18Å; I164-A181 HydrophobicContact CG1-CB 4.17Å; A181-R219 CarbonylContact O-C 3.55Å; A181-R219 WeakPolarHBondContact O-CA 3.48Å; A181-L220 HydrophobicContact CB-CB 4.18Å; A181-L220 PolarHBondContact O-N 3.09Å; A181-I222 HydrophobicContact CB-CD1 3.85Å; A181-I222 HydrophobicContact CB-CG1 3.74Å
182	F	97.5	Very high	90.2	Very high	5 Å²	5	63 Å²	63	2%	0.022	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	150.7	-169.2	-54.1	-81.4	0	0	0	111.8	C141 L143 V162 A163 V165 G180 Y217 Y218 R219	C141-F182 HydrophobicContact CB-CE2 4.4Å; C141-F182 HydrophobicContact CB-CZ 4.35Å; C141-F182 WeakPolarHBondContact O-CZ 3.31Å; L143-F182 HydrophobicContact CD1-CB 3.65Å; L143-F182 HydrophobicContact CD1-CG 4.33Å; L143-F182 HydrophobicContact CD2-CB 4.21Å; L143-F182 HydrophobicContact CD2-CD2 4.01Å; L143-F182 HydrophobicContact CD2-CG 4.29Å; L143-F182 HydrophobicContact CG-CB 3.9Å; L143-F182 HydrophobicContact CG-CD2 4.21Å; L143-F182 HydrophobicContact CG-CG 4.03Å; V162-F182 WeakPolarHBondContact CG2-O 3.44Å; A163-F182 PolarHBondContact N-O 3.45Å; A163-F182 PolarHBondContact O-N 3.1Å; V165-F182 HydrophobicContact CB-CE2 3.97Å; V165-F182 HydrophobicContact CG2-CD2 3.8Å; V165-F182 HydrophobicContact CG2-CE2 3.68Å; G180-F182 WeakPolarHBondContact O-CE2 3.25Å; F182-Y217 AromaticContact CD1-CD2 3.69Å; F182-Y217 HydrophobicContact CD1-CD2 3.69Å; F182-Y217 AromaticContact CD1-CE2 3.91Å; F182-Y217 HydrophobicContact CD1-CE2 3.91Å; F182-Y217 HydrophobicContact CE1-CD2 4.36Å; F182-Y217 HydrophobicContact CE1-CE2 4.13Å; F182-Y217 HydrophobicContact CG-CD2 4.4Å; F182-Y218 WeakPolarHBondContact CA-O 3.33Å; F182-R219 HydrophobicContact CD1-CB 4.14Å; F182-R219 HydrophobicContact CD1-CG 4.32Å; F182-R219 HydrophobicContact CE1-CB 4Å; F182-R219 HydrophobicContact CE1-CG 3.89Å
183	R	96.7	Very high	88.8	Confident	10 Å²	10	68.2 Å²	68.2	4%	0.038	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.8	168	-74.6	-173.3	56.9	104	8.5	110.1	Q155 E159 F161 V162 Y217 Y218 L220	Q155-R183 VanDerWaalsContact NE2-NH2 3.17Å; E159-R183 IonicContact OE1-CZ 3Å; E159-R183 IonicContact OE1-NH1 3.74Å; E159-R183 PolarHBondContact OE1-NH1 2.95Å; E159-R183 IonicContact OE1-NH2 2.69Å; E159-R183 PolarHBondContact OE1-NH2 3.07Å; E159-R183 IonicContact OE2-CZ 3.78Å; E159-R183 IonicContact OE2-NH1 3.2Å; E159-R183 IonicContact OE2-NH2 3.06Å; E159-R183 PolarHBondContact OE2-NH2 3.37Å; F161-R183 PolarHBondContact O-NH1 3.33Å; V162-R183 HydrophobicContact CG2-CG 4.3Å; R183-Y217 CarbonylContact O-C 3.6Å; R183-Y217 WeakPolarHBondContact O-CA 3.37Å; R183-Y217 WeakPolarHBondContact O-CB 3.05Å; R183-Y218 HydrophobicContact CB-CD1 4.41Å; R183-Y218 HydrophobicContact CB-CE1 3.75Å; R183-Y218 HydrophobicContact CB-CE2 4.18Å; R183-Y218 PolarHBondContact N-O 3.18Å; R183-Y218 VanDerWaalsContact N-O 3.08Å; R183-Y218 PolarHBondContact NE-OH 3.46Å; R183-Y218 WeakPolarHBondContact O-CD1 3.06Å; R183-Y218 PolarHBondContact O-N 3.41Å; R183-L220 HydrophobicContact CB-CD1 4Å; R183-L220 HydrophobicContact CG-CD1 3.78Å
184	T	95.8	Very high	87.4	Confident	3 Å²	3	72.8 Å²	72.8	2%	0.018	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	147.7	-179.8	52.9	0	0	0	0	111.3	L143 V148 Q151 Q155 C216	L143-T184 HydrophobicContact CD1-CG2 4.17Å; V148-T184 HydrophobicContact CB-CG2 4.33Å; V148-T184 HydrophobicContact CG1-CG2 4.02Å; V148-T184 HydrophobicContact CG2-CG2 4.33Å; Q151-T184 HydrophobicContact CB-CG2 3.88Å; Q151-T184 HydrophobicContact CG-CG2 3.73Å; Q155-T184 PolarHBondContact NE2-O 3.17Å; Q155-T184 PolarHBondContact OE1-OG1 3.27Å; T184-C216 WeakPolarHBondContact CA-O 3.22Å
185	Y	94.7	Very high	85.9	Confident	24 Å²	24	77.9 Å²	77.9	9%	0.094	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-75.1	149	167.4	-64.6	-66.5	0	0	0	110.4	V45 Q46 Y189 P191 D215 C216 Y217 Y218	V45-Y185 HydrophobicContact CG1-CD1 3.64Å; V45-Y185 HydrophobicContact CG1-CE1 4.28Å; Q46-Y185 HydrophobicContact CG-CE1 3.95Å; Q46-Y185 PolarHBondContact NE2-OH 3.36Å; Y185-Y189 AromaticContact CD1-CD1 3.34Å; Y185-Y189 HydrophobicContact CD1-CD1 3.34Å; Y185-Y189 AromaticContact CD1-CE1 3.5Å; Y185-Y189 HydrophobicContact CD1-CE1 3.5Å; Y185-Y189 VanDerWaalsContact CD1-CE1 3.5Å; Y185-Y189 HydrophobicContact CD1-CG 4.37Å; Y185-Y189 AromaticContact CE1-CD1 3.93Å; Y185-Y189 HydrophobicContact CE1-CD1 3.93Å; Y185-Y189 AromaticContact CE1-CE1 3.59Å; Y185-Y189 HydrophobicContact CE1-CE1 3.59Å; Y185-Y189 AromaticContact CG-CD1 3.74Å; Y185-Y189 HydrophobicContact CG-CD1 3.74Å; Y185-Y189 HydrophobicContact CG-CE1 4.26Å; Y185-P191 HydrophobicContact CD2-CB 4.39Å; Y185-P191 HydrophobicContact CD2-CG 4.26Å; Y185-P191 HydrophobicContact CE1-CB 4.44Å; Y185-P191 HydrophobicContact CE2-CB 3.77Å; Y185-P191 HydrophobicContact CE2-CG 3.93Å; Y185-D215 WeakPolarHBondContact CD2-O 3.1Å; Y185-C216 PolarHBondContact N-O 3.26Å; Y185-Y217 WeakPolarHBondContact CE2-O 3.28Å; Y185-Y218 HydrophobicContact CD1-CD1 4.11Å; Y185-Y218 HydrophobicContact CD1-CE1 4.46Å; Y185-Y218 AromaticContact CE1-CD1 3.63Å; Y185-Y218 HydrophobicContact CE1-CD1 3.63Å; Y185-Y218 HydrophobicContact CE1-CE1 4.23Å; Y185-Y218 HydrophobicContact CE1-CG 4.44Å; Y185-Y218 HydrophobicContact CE2-CD1 4.35Å; Y185-Y218 AromaticContact CZ-CD1 3.77Å
186	P	92.1	Very high	84.4	Confident	62 Å²	62	79 Å²	79	40%	0.403	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-58.3	148.4	169.8	-22.2	32.2	0	0	0	111.6	V45 H188 Y189	V45-P186 VanDerWaalsContact CG1-CD 3.47Å; V45-P186 HydrophobicContact CG1-CG 4.21Å; V45-P186 HydrophobicContact CG2-CG 4.35Å; P186-H188 PolarHBondContact O-N 2.71Å; P186-Y189 WeakPolarHBondContact O-CB 3.36Å; P186-Y189 PolarHBondContact O-N 2.89Å
187	K	86.5	Confident	83.1	Confident	167 Å²	167	76 Å²	76	73%	0.726	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	-26.7	-174.3	-65.5	-167.1	176	-173.3	0	116.1	L152	L152-K187 HydrophobicContact CD2-CD 4.06Å; L152-K187 HydrophobicContact CD2-CG 3.57Å
188	H	84	Confident	81.9	Confident	185 Å²	185	81.6 Å²	81.6	86%	0.856	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	5.1	-176.1	-55.7	-54.9	0	0	0	113.8	P186	P186-H188 PolarHBondContact O-N 2.71Å
189	Y	87.2	Confident	81	Confident	92 Å²	92	84.2 Å²	84.2	36%	0.361	42%	0.419	S	S	.	.			trans	-91.4	124.7	179.2	-174.4	-93.6	0	0	0	110.2	V45 Y185 P186 P191	V45-Y189 HydrophobicContact CB-CD2 4.39Å; V45-Y189 HydrophobicContact CB-CE2 4.21Å; V45-Y189 HydrophobicContact CG1-CD1 4.2Å; V45-Y189 HydrophobicContact CG1-CD2 4.37Å; V45-Y189 HydrophobicContact CG1-CE1 4.29Å; V45-Y189 HydrophobicContact CG1-CE2 4.47Å; V45-Y189 HydrophobicContact CG1-CG 4.23Å; V45-Y189 HydrophobicContact CG2-CD2 3.84Å; V45-Y189 HydrophobicContact CG2-CE2 3.95Å; V45-Y189 HydrophobicContact CG2-CG 4.41Å; Y185-Y189 AromaticContact CD1-CD1 3.34Å; Y185-Y189 HydrophobicContact CD1-CD1 3.34Å; Y185-Y189 AromaticContact CD1-CE1 3.5Å; Y185-Y189 HydrophobicContact CD1-CE1 3.5Å; Y185-Y189 VanDerWaalsContact CD1-CE1 3.5Å; Y185-Y189 HydrophobicContact CD1-CG 4.37Å; Y185-Y189 AromaticContact CE1-CD1 3.93Å; Y185-Y189 HydrophobicContact CE1-CD1 3.93Å; Y185-Y189 AromaticContact CE1-CE1 3.59Å; Y185-Y189 HydrophobicContact CE1-CE1 3.59Å; Y185-Y189 AromaticContact CG-CD1 3.74Å; Y185-Y189 HydrophobicContact CG-CD1 3.74Å; Y185-Y189 HydrophobicContact CG-CE1 4.26Å; P186-Y189 WeakPolarHBondContact O-CB 3.36Å; P186-Y189 PolarHBondContact O-N 2.89Å; Y189-P191 HydrophobicContact CE1-CB 4.3Å
190	K	83.6	Confident	80.1	Confident	189 Å²	189	85.8 Å²	85.8	82%	0.822	43%	0.426	S	S	*	.			trans	-99.7	115.7	170.5	-71.6	-170.3	177.8	-173.1	0	108.9
191	P	83	Confident	79.5	Confident	32 Å²	32	86.4 Å²	86.4	21%	0.208	43%	0.431	C	S	.	.			trans	-63.8	143.5	176	27.2	-33.3	0	0	0	110.2	Y185 Y189 Q193 D215	Y185-P191 HydrophobicContact CD2-CB 4.39Å; Y185-P191 HydrophobicContact CD2-CG 4.26Å; Y185-P191 HydrophobicContact CE1-CB 4.44Å; Y185-P191 HydrophobicContact CE2-CB 3.77Å; Y185-P191 HydrophobicContact CE2-CG 3.93Å; Y189-P191 HydrophobicContact CE1-CB 4.3Å; P191-Q193 PolarHBondContact O-N 3.14Å; P191-D215 WeakPolarHBondContact CG-O 3.31Å
192	V	77	Confident	79.1	Confident	120 Å²	120	86.7 Å²	86.7	73%	0.727	43%	0.432	S	S	*	.			trans	-67.3	119.2	164.5	-176.5	0	0	0	0	105.8	T194	V192-T194 VanDerWaalsContact C-N 3.32Å; V192-T194 PolarHBondContact O-N 2.89Å; V192-T194 PolarHBondContact O-OG1 2.86Å
193	Q	60.6	Low	78.7	Confident	155 Å²	155	87.5 Å²	87.5	72%	0.724	44%	0.438	S	S	*	.			trans	-60.4	94.6	179.8	-76.6	-176.7	-4.3	0	0	109.9	P191	P191-Q193 PolarHBondContact O-N 3.14Å
194	T	54.6	Low	78.2	Confident	98 Å²	98	89.3 Å²	89.3	60%	0.601	45%	0.448	S	S	*	.			trans	-91.4	118.6	165.4	19	0	0	0	0	107.4	V192 S196	V192-T194 VanDerWaalsContact C-N 3.32Å; V192-T194 PolarHBondContact O-N 2.89Å; V192-T194 PolarHBondContact O-OG1 2.86Å; T194-S196 PolarHBondContact O-N 3.38Å
195	N	52.3	Low	77.9	Confident	167 Å²	167	98 Å²	98	89%	0.893	49%	0.488	S	S	*	.	S	Bend	trans	-59.6	16.5	179.2	-77.2	-15.5	0	0	0	115.2
196	S	53.4	Low	77.6	Confident	97 Å²	97	98.8 Å²	98.8	68%	0.678	49%	0.492	S	S	*	.			trans	-101.7	14.6	-168.1	46.8	0	0	0	0	114.1	T194 E198	T194-S196 PolarHBondContact O-N 3.38Å; S196-E198 PolarHBondContact O-N 3.28Å
197	Q	62.4	Low	77.4	Confident	98 Å²	98	99.2 Å²	99.2	46%	0.458	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-70.5	117.6	165.2	-74	-168.4	-8.9	0	0	108.8	Y199 S214	Q197-Y199 PolarHBondContact O-N 2.9Å; Q197-S214 PolarHBondContact NE2-O 2.9Å
198	E	69.1	Low	77.4	Confident	168 Å²	168	99 Å²	99	79%	0.785	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-60.5	128.7	178.3	-163.9	171.6	-167	0	0	109.3	S196 Q200	S196-E198 PolarHBondContact O-N 3.28Å; E198-Q200 PolarHBondContact O-N 3.05Å
199	Y	76.6	Confident	77.6	Confident	88 Å²	88	92.9 Å²	92.9	35%	0.345	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-66.9	128.4	179.8	178.2	-93.1	0	0	0	109.7	Q197 N300 K303 D304	Q197-Y199 PolarHBondContact O-N 2.9Å; Y199-N300 HydrophobicContact CE2-CB 4.21Å; Y199-N300 PolarHBondContact OH-O 3.22Å; Y199-K303 HydrophobicContact CD1-CB 4.11Å; Y199-K303 HydrophobicContact CD1-CD 3.84Å; Y199-K303 HydrophobicContact CD2-CD 4.11Å; Y199-K303 HydrophobicContact CE1-CB 3.63Å; Y199-K303 HydrophobicContact CE1-CD 3.99Å; Y199-K303 HydrophobicContact CE1-CG 4.49Å; Y199-K303 HydrophobicContact CE2-CD 4.23Å; Y199-K303 HydrophobicContact CG-CD 3.91Å; Y199-D304 VanDerWaalsContact CE1-OD1 3.27Å; Y199-D304 WeakPolarHBondContact CE1-OD1 3.45Å; Y199-D304 VanDerWaalsContact CZ-OD1 3.31Å; Y199-D304 VanDerWaalsContact OH-CG 3.27Å; Y199-D304 PolarHBondContact OH-OD1 2.73Å; Y199-D304 PolarHBondContact OH-OD2 2.9Å
200	Q	80.6	Confident	77.6	Confident	42 Å²	42	90.8 Å²	90.8	20%	0.196	46%	0.459	C	S	.	.			trans	-121	138.7	170.5	-170.2	167.8	38.5	0	0	108.8	G140 C141 R170 D178 E198 I202	G140-Q200 VanDerWaalsContact CA-NE2 3.26Å; C141-Q200 PolarHBondContact O-OE1 3.32Å; R170-Q200 VanDerWaalsContact NH1-CG 3.3Å; D178-Q200 PolarHBondContact OD2-NE2 3.37Å; E198-Q200 PolarHBondContact O-N 3.05Å; Q200-I202 HydrophobicContact CB-CD1 4.25Å; Q200-I202 HydrophobicContact CG-CD1 4.21Å; Q200-I202 PolarHBondContact O-N 3.41Å; Q200-I202 VanDerWaalsContact O-N 3.16Å
201	S	83.9	Confident	77.7	Confident	13 Å²	13	84.1 Å²	84.1	9%	0.091	44%	0.443	C	S	.	.			trans	-64.9	114.3	170	173.8	0	0	0	0	108.3	R170 D304	R170-S201 PolarHBondContact NH1-O 3.49Å; R170-S201 PolarHBondContact NH2-O 3.36Å; S201-D304 WeakPolarHBondContact CB-OD1 3.41Å; S201-D304 PolarHBondContact OG-OD1 2.9Å
202	I	89.4	Confident	78	Confident	6 Å²	6	87.4 Å²	87.4	3%	0.031	46%	0.463	C	S	.	.			trans	-108.6	130.3	175.1	-55.3	-55.7	0	0	0	107.7	W142 Q200 K206 F210 K268	W142-I202 HydrophobicContact CG-CD1 4.32Å; Q200-I202 HydrophobicContact CB-CD1 4.25Å; Q200-I202 HydrophobicContact CG-CD1 4.21Å; Q200-I202 PolarHBondContact O-N 3.41Å; Q200-I202 VanDerWaalsContact O-N 3.16Å; I202-K206 HydrophobicContact CG2-CB 3.73Å; I202-F210 HydrophobicContact CD1-CD2 4.45Å; I202-F210 HydrophobicContact CG1-CD1 4.13Å; I202-F210 HydrophobicContact CG1-CD2 4.31Å; I202-F210 HydrophobicContact CG1-CE1 4.39Å; I202-F210 HydrophobicContact CG1-CG 4.08Å; I202-F210 HydrophobicContact CG2-CB 4.22Å; I202-K268 WeakPolarHBondContact O-CE 3.43Å; I202-K268 PolarHBondContact O-NZ 3.43Å
203	P	89	Confident	78.5	Confident	22 Å²	22	84 Å²	84	14%	0.143	44%	0.439	C	S	.	.			trans	-58.1	149.7	175.5	-27.1	37.7	0	0	0	112.5	E205 K206 I207 D264	P203-E205 PolarHBondContact O-N 3.41Å; P203-K206 PolarHBondContact O-N 2.82Å; P203-I207 PolarHBondContact O-N 3.45Å; P203-I207 VanDerWaalsContact O-N 3.11Å; P203-D264 VanDerWaalsContact CA-OD1 3.32Å; P203-D264 WeakPolarHBondContact CA-OD1 3.4Å
204	L	87	Confident	79.8	Confident	47 Å²	47	77.3 Å²	77.3	25%	0.246	41%	0.409	C	S	.	.	H	α-helix	trans	-51.8	-41.1	179.9	-108.2	163.4	0	0	0	112.9	K206 I207 D264 A267 K268	L204-K206 PolarHBondContact O-N 2.97Å; L204-K206 VanDerWaalsContact O-N 3.12Å; L204-I207 VanDerWaalsContact O-CG2 3.27Å; L204-I207 WeakPolarHBondContact O-CG2 3.41Å; L204-I207 PolarHBondContact O-N 3.42Å; L204-D264 PolarHBondContact N-OD1 3.49Å; L204-A267 HydrophobicContact CD1-CB 3.49Å; L204-A267 VanDerWaalsContact CD1-CB 3.49Å; L204-K268 HydrophobicContact CD1-CB 4.08Å; L204-K268 HydrophobicContact CD1-CG 3.47Å; L204-K268 VanDerWaalsContact CD1-CG 3.47Å; L204-K268 HydrophobicContact CD2-CG 4.48Å; L204-K268 HydrophobicContact CG-CG 3.54Å
205	E	89.1	Confident	81.5	Confident	185 Å²	185	76.5 Å²	76.5	86%	0.864	40%	0.401	S	S	*	.	H	α-helix	trans	-63.2	-19	-179.1	-61.2	179.5	-179.5	0	0	113.2	P203	P203-E205 PolarHBondContact O-N 3.41Å
206	K	88.7	Confident	83.4	Confident	42 Å²	42	70.8 Å²	70.8	18%	0.183	37%	0.373	C	S	.	.	H	α-helix	trans	-112.9	-9.5	-176.4	-61.9	-62.2	174.9	-176	0	113.9	E100 Y139 W142 I202 P203 L204 E208 D209 F210	E100-K206 WeakPolarHBondContact OE1-CE 3.3Å; E100-K206 IonicContact OE1-NZ 3.94Å; E100-K206 PolarHBondContact OE1-NZ 3.23Å; E100-K206 IonicContact OE2-NZ 2.75Å; E100-K206 PolarHBondContact OE2-NZ 2.84Å; Y139-K206 HydrophobicContact CD2-CG 4.43Å; Y139-K206 HydrophobicContact CG-CG 4.46Å; W142-K206 HydrophobicContact CH2-CB 4.17Å; W142-K206 HydrophobicContact CH2-CD 4.45Å; W142-K206 HydrophobicContact CZ2-CB 3.74Å; W142-K206 HydrophobicContact CZ2-CD 4.25Å; W142-K206 HydrophobicContact CZ2-CG 4.18Å; I202-K206 HydrophobicContact CG2-CB 3.73Å; P203-K206 PolarHBondContact O-N 2.82Å; L204-K206 PolarHBondContact O-N 2.97Å; L204-K206 VanDerWaalsContact O-N 3.12Å; K206-E208 VanDerWaalsContact C-N 3.27Å; K206-E208 PolarHBondContact O-N 3.22Å; K206-D209 PolarHBondContact O-N 2.91Å; K206-F210 WeakPolarHBondContact O-CB 3.3Å; K206-F210 PolarHBondContact O-N 2.91Å
207	I	86.8	Confident	85.3	Confident	70 Å²	70	66.6 Å²	66.6	36%	0.359	34%	0.343	S	S	.	.	H	α-helix	trans	-66.5	-30.7	-170	-156.3	169.6	0	0	0	112.7	P203 L204 G211	P203-I207 PolarHBondContact O-N 3.45Å; P203-I207 VanDerWaalsContact O-N 3.11Å; L204-I207 VanDerWaalsContact O-CG2 3.27Å; L204-I207 WeakPolarHBondContact O-CG2 3.41Å; L204-I207 PolarHBondContact O-N 3.42Å; I207-G211 PolarHBondContact O-N 2.9Å
208	E	87.5	Confident	86.8	Confident	162 Å²	162	62.8 Å²	62.8	76%	0.757	32%	0.324	S	S	*	.	H	α-helix	trans	-68.8	-51.3	177.8	-65.7	-171.5	169.5	0	0	111	K206 F210 G211 V212	K206-E208 VanDerWaalsContact C-N 3.27Å; K206-E208 PolarHBondContact O-N 3.22Å; E208-F210 PolarHBondContact O-N 3.31Å; E208-G211 PolarHBondContact O-N 3.2Å; E208-G211 VanDerWaalsContact O-N 3.1Å; E208-V212 WeakPolarHBondContact O-CG2 3.45Å; E208-V212 PolarHBondContact O-N 3.38Å
209	D	88.2	Confident	88.1	Confident	57 Å²	57	60 Å²	60	31%	0.305	31%	0.307	S	S	.	.	H	α-helix	trans	-61.3	-44.7	179.3	-169.8	54.2	0	0	0	111.3	W142 S144 G145 K206 G211 V212 H213	W142-D209 HydrophobicContact CH2-CB 4.26Å; W142-D209 HydrophobicContact CZ3-CB 4.41Å; W142-D209 WeakPolarHBondContact CZ3-OD2 3.41Å; S144-D209 VanDerWaalsContact CA-OD2 3.23Å; S144-D209 WeakPolarHBondContact CA-OD2 3.49Å; S144-D209 WeakPolarHBondContact CB-OD2 3.42Å; G145-D209 PolarHBondContact N-OD2 3.23Å; K206-D209 PolarHBondContact O-N 2.91Å; D209-G211 VanDerWaalsContact C-N 3.33Å; D209-G211 PolarHBondContact O-N 2.96Å; D209-V212 PolarHBondContact O-N 2.94Å; D209-H213 PolarHBondContact O-CD2 3.38Å; D209-H213 PolarHBondContact O-N 2.87Å; D209-H213 VanDerWaalsContact O-N 3.14Å; D209-H213 IonicContact OD1-CD2 3.94Å; D209-H213 PolarHBondContact OD1-CD2 3.48Å; D209-H213 IonicContact OD1-NE2 2.97Å
210	F	87.5	Confident	89	Confident	49 Å²	49	56 Å²	56	22%	0.215	29%	0.291	C	S	.	.	H	α-helix	trans	-57.6	-46.1	172.2	176	-99.7	0	0	0	111.9	W142 I202 K206 E208 V212 H213 S214	W142-F210 HydrophobicContact CB-CD2 3.84Å; W142-F210 HydrophobicContact CB-CE2 3.86Å; W142-F210 HydrophobicContact CD2-CB 4.3Å; W142-F210 AromaticContact CD2-CD2 3.68Å; W142-F210 HydrophobicContact CD2-CD2 3.68Å; W142-F210 HydrophobicContact CD2-CG 4.45Å; W142-F210 HydrophobicContact CE3-CB 3.91Å; W142-F210 AromaticContact CE3-CD2 3.65Å; W142-F210 HydrophobicContact CE3-CD2 3.65Å; W142-F210 HydrophobicContact CE3-CG 4.29Å; W142-F210 AromaticContact CG-CD2 3.76Å; W142-F210 HydrophobicContact CG-CD2 3.76Å; W142-F210 HydrophobicContact CG-CE2 4.21Å; W142-F210 HydrophobicContact CH2-CB 4.23Å; W142-F210 HydrophobicContact CZ3-CB 3.84Å; W142-F210 HydrophobicContact CZ3-CD2 4.44Å; I202-F210 HydrophobicContact CD1-CD2 4.45Å; I202-F210 HydrophobicContact CG1-CD1 4.13Å; I202-F210 HydrophobicContact CG1-CD2 4.31Å; I202-F210 HydrophobicContact CG1-CE1 4.39Å; I202-F210 HydrophobicContact CG1-CG 4.08Å; I202-F210 HydrophobicContact CG2-CB 4.22Å; K206-F210 WeakPolarHBondContact O-CB 3.3Å; K206-F210 PolarHBondContact O-N 2.91Å; E208-F210 PolarHBondContact O-N 3.31Å; F210-V212 VanDerWaalsContact C-N 3.3Å; F210-V212 PolarHBondContact O-N 3.37Å; F210-H213 PolarHBondContact O-N 3.31Å; F210-S214 WeakPolarHBondContact O-CB 3.45Å; F210-S214 PolarHBondContact O-N 3.43Å; F210-S214 PolarHBondContact O-OG 3.22Å
211	G	85.7	Confident	89.8	Confident	48 Å²	48	59.4 Å²	59.4	50%	0.495	31%	0.307	S	S	.	.	H	α-helix	trans	-61.6	-36.2	-179	0	0	0	0	0	113.4	I207 E208 D209	I207-G211 PolarHBondContact O-N 2.9Å; E208-G211 PolarHBondContact O-N 3.2Å; E208-G211 VanDerWaalsContact O-N 3.1Å; D209-G211 VanDerWaalsContact C-N 3.33Å; D209-G211 PolarHBondContact O-N 2.96Å
212	V	88	Confident	90.4	Very high	102 Å²	102	60.2 Å²	60.2	62%	0.618	31%	0.31	S	S	*	.	H	α-helix	trans	-74.8	-35.9	179.3	177	0	0	0	0	111.9	E208 D209 F210	E208-V212 WeakPolarHBondContact O-CG2 3.45Å; E208-V212 PolarHBondContact O-N 3.38Å; D209-V212 PolarHBondContact O-N 2.94Å; F210-V212 VanDerWaalsContact C-N 3.3Å; F210-V212 PolarHBondContact O-N 3.37Å
213	H	89	Confident	90.8	Very high	48 Å²	48	62.2 Å²	62.2	22%	0.222	32%	0.323	C	S	.	.	H	α-helix	trans	-107.7	-8.7	-169	-63.8	-51	0	0	0	115.5	G145 V148 D209 F210 D215 C216 Y217	G145-H213 WeakPolarHBondContact CA-CD2 3.3Å; G145-H213 VanDerWaalsContact CA-NE2 3.3Å; G145-H213 WeakPolarHBondContact CA-NE2 3.31Å; G145-H213 PolarHBondContact N-CD2 3.42Å; G145-H213 VanDerWaalsContact N-CD2 3.29Å; V148-H213 HydrophobicContact CG2-CB 4.3Å; D209-H213 PolarHBondContact O-CD2 3.38Å; D209-H213 PolarHBondContact O-N 2.87Å; D209-H213 VanDerWaalsContact O-N 3.14Å; D209-H213 IonicContact OD1-CD2 3.94Å; D209-H213 PolarHBondContact OD1-CD2 3.48Å; D209-H213 IonicContact OD1-NE2 2.97Å; F210-H213 PolarHBondContact O-N 3.31Å; H213-D215 PolarHBondContact O-N 3.34Å; H213-D215 VanDerWaalsContact O-N 3.14Å; H213-C216 VanDerWaalsContact O-CB 3.25Å; H213-C216 WeakPolarHBondContact O-CB 3.43Å; H213-C216 PolarHBondContact O-N 3.49Å; H213-Y217 WeakPolarHBondContact O-CD1 3.35Å; H213-Y217 WeakPolarHBondContact O-CE1 3.19Å
214	S	86.9	Confident	91.1	Very high	15 Å²	15	66.3 Å²	66.3	11%	0.105	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-55.4	-30.5	180	52.4	0	0	0	0	114.8	Q197 F210 C216	Q197-S214 PolarHBondContact NE2-O 2.9Å; F210-S214 WeakPolarHBondContact O-CB 3.45Å; F210-S214 PolarHBondContact O-N 3.43Å; F210-S214 PolarHBondContact O-OG 3.22Å; S214-C216 VanDerWaalsContact C-N 3.34Å
215	D	89.7	Confident	91.5	Very high	81 Å²	81	64.4 Å²	64.4	43%	0.433	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-83.2	-6.4	176.9	-75.9	-25.5	0	0	0	113.4	Y185 P191 H213	Y185-D215 WeakPolarHBondContact CD2-O 3.1Å; P191-D215 WeakPolarHBondContact CG-O 3.31Å; H213-D215 PolarHBondContact O-N 3.34Å; H213-D215 VanDerWaalsContact O-N 3.14Å
216	C	92.3	Very high	91.7	Very high	46 Å²	46	56.5 Å²	56.5	31%	0.311	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-84.7	-9.1	-177	-61.7	0	0	0	0	113.7	V148 T184 Y185 H213 S214	V148-C216 HydrophobicContact CG1-CB 3.87Å; V148-C216 HydrophobicContact CG2-CB 4.23Å; T184-C216 WeakPolarHBondContact CA-O 3.22Å; Y185-C216 PolarHBondContact N-O 3.26Å; H213-C216 VanDerWaalsContact O-CB 3.25Å; H213-C216 WeakPolarHBondContact O-CB 3.43Å; H213-C216 PolarHBondContact O-N 3.49Å; S214-C216 VanDerWaalsContact C-N 3.34Å
217	Y	94.4	Very high	91.8	Very high	9 Å²	9	55.3 Å²	55.3	4%	0.035	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	168.2	-178.2	56.4	-94.6	0	0	0	112.7	W142 L143 V148 F182 R183 Y185 H213	W142-Y217 WeakPolarHBondContact CB-OH 3.42Å; L143-Y217 HydrophobicContact CB-CD1 3.81Å; L143-Y217 HydrophobicContact CB-CE1 3.72Å; L143-Y217 HydrophobicContact CB-CG 4.39Å; L143-Y217 HydrophobicContact CD1-CD1 4.1Å; L143-Y217 HydrophobicContact CD1-CG 4Å; L143-Y217 HydrophobicContact CG-CD1 4.25Å; L143-Y217 HydrophobicContact CG-CE1 4.43Å; L143-Y217 HydrophobicContact CG-CG 4.32Å; L143-Y217 WeakPolarHBondContact O-CE1 3.5Å; V148-Y217 HydrophobicContact CG2-CD1 3.78Å; V148-Y217 HydrophobicContact CG2-CE1 4.24Å; F182-Y217 AromaticContact CD1-CD2 3.69Å; F182-Y217 HydrophobicContact CD1-CD2 3.69Å; F182-Y217 AromaticContact CD1-CE2 3.91Å; F182-Y217 HydrophobicContact CD1-CE2 3.91Å; F182-Y217 HydrophobicContact CE1-CD2 4.36Å; F182-Y217 HydrophobicContact CE1-CE2 4.13Å; F182-Y217 HydrophobicContact CG-CD2 4.4Å; R183-Y217 CarbonylContact O-C 3.6Å; R183-Y217 WeakPolarHBondContact O-CA 3.37Å; R183-Y217 WeakPolarHBondContact O-CB 3.05Å; Y185-Y217 WeakPolarHBondContact CE2-O 3.28Å; H213-Y217 WeakPolarHBondContact O-CD1 3.35Å; H213-Y217 WeakPolarHBondContact O-CE1 3.19Å
218	Y	94.3	Very high	92.1	Very high	18 Å²	18	54.2 Å²	54.2	7%	0.071	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	150.5	170.1	63.5	-84.4	0	0	0	110.7	V45 Q46 F48 F182 R183 Y185 L220	V45-Y218 PolarHBondContact O-OH 3.23Å; Q46-Y218 HydrophobicContact CG-CD1 4.31Å; Q46-Y218 HydrophobicContact CG-CE1 4.23Å; F48-Y218 WeakPolarHBondContact O-CE2 3.13Å; F182-Y218 WeakPolarHBondContact CA-O 3.33Å; R183-Y218 HydrophobicContact CB-CD1 4.41Å; R183-Y218 HydrophobicContact CB-CE1 3.75Å; R183-Y218 HydrophobicContact CB-CE2 4.18Å; R183-Y218 PolarHBondContact N-O 3.18Å; R183-Y218 VanDerWaalsContact N-O 3.08Å; R183-Y218 PolarHBondContact NE-OH 3.46Å; R183-Y218 WeakPolarHBondContact O-CD1 3.06Å; R183-Y218 PolarHBondContact O-N 3.41Å; Y185-Y218 HydrophobicContact CD1-CD1 4.11Å; Y185-Y218 HydrophobicContact CD1-CE1 4.46Å; Y185-Y218 AromaticContact CE1-CD1 3.63Å; Y185-Y218 HydrophobicContact CE1-CD1 3.63Å; Y185-Y218 HydrophobicContact CE1-CE1 4.23Å; Y185-Y218 HydrophobicContact CE1-CG 4.44Å; Y185-Y218 HydrophobicContact CE2-CD1 4.35Å; Y185-Y218 AromaticContact CZ-CD1 3.77Å; Y218-L220 HydrophobicContact CD2-CD1 3.95Å; Y218-L220 HydrophobicContact CD2-CG 4.46Å; Y218-L220 HydrophobicContact CE2-CD1 3.68Å; Y218-L220 HydrophobicContact CE2-CG 4.07Å
219	R	94.7	Very high	92.3	Very high	110 Å²	110	53.7 Å²	53.7	42%	0.415	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	138.5	178	-169.6	174.4	176.4	103.9	1.6	110.2	I179 A181 F182	I179-R219 PolarHBondContact O-NH2 3.26Å; A181-R219 CarbonylContact O-C 3.55Å; A181-R219 WeakPolarHBondContact O-CA 3.48Å; F182-R219 HydrophobicContact CD1-CB 4.14Å; F182-R219 HydrophobicContact CD1-CG 4.32Å; F182-R219 HydrophobicContact CE1-CB 4Å; F182-R219 HydrophobicContact CE1-CG 3.89Å
220	L	96.3	Very high	92.5	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.021	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	147.1	173.4	-69.7	80	0	0	0	109.3	F48 K49 V51 A181 R183 Y218 I222	F48-L220 HydrophobicContact CB-CD2 3.88Å; K49-L220 WeakPolarHBondContact O-CA 3.45Å; V51-L220 HydrophobicContact CG2-CB 4Å; V51-L220 HydrophobicContact CG2-CD2 3.83Å; A181-L220 HydrophobicContact CB-CB 4.18Å; A181-L220 PolarHBondContact O-N 3.09Å; R183-L220 HydrophobicContact CB-CD1 4Å; R183-L220 HydrophobicContact CG-CD1 3.78Å; Y218-L220 HydrophobicContact CD2-CD1 3.95Å; Y218-L220 HydrophobicContact CD2-CG 4.46Å; Y218-L220 HydrophobicContact CE2-CD1 3.68Å; Y218-L220 HydrophobicContact CE2-CG 4.07Å; L220-I222 PolarHBondContact O-N 3.19Å
221	E	96.8	Very high	92.7	Very high	114 Å²	114	52.7 Å²	52.7	53%	0.533	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	123	174.6	-175.9	-176.3	-176.8	0	0	110	K49 H50 V51	K49-E221 PolarHBondContact O-N 3.1Å; H50-E221 CarbonylContact C-O 3.58Å; H50-E221 VanDerWaalsContact CA-O 3.27Å; H50-E221 WeakPolarHBondContact CA-O 3.31Å; H50-E221 IonicContact CE1-OE2 3.26Å; H50-E221 PolarHBondContact CE1-OE2 2.95Å; H50-E221 IonicContact ND1-OE2 3.43Å; H50-E221 PolarHBondContact ND1-OE2 3.44Å; V51-E221 PolarHBondContact N-O 3.36Å
222	I	97.6	Very high	93	Very high	30 Å²	30	56.8 Å²	56.8	15%	0.154	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	128	177.2	-57.2	172.3	0	0	0	109.2	V51 M53 I179 A181 L220 Y224	V51-I222 HydrophobicContact CB-CG1 4.42Å; V51-I222 CarbonylContact O-C 3.54Å; V51-I222 WeakPolarHBondContact O-CA 3.16Å; M53-I222 HydrophobicContact CB-CG2 4.49Å; I179-I222 HydrophobicContact CB-CD1 4.49Å; I179-I222 HydrophobicContact CD1-CD1 4.42Å; I179-I222 HydrophobicContact CG1-CD1 3.96Å; I179-I222 HydrophobicContact CG2-CD1 4.06Å; A181-I222 HydrophobicContact CB-CD1 3.85Å; A181-I222 HydrophobicContact CB-CG1 3.74Å; L220-I222 PolarHBondContact O-N 3.19Å; I222-Y224 HydrophobicContact CG2-CD1 4.34Å; I222-Y224 HydrophobicContact CG2-CE1 3.65Å
223	T	97.4	Very high	93.3	Very high	47 Å²	47	54.6 Å²	54.6	29%	0.288	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	156.5	168.9	54.3	0	0	0	0	109.4	V51 K52 M53	V51-T223 PolarHBondContact O-N 3.44Å; V51-T223 PolarHBondContact O-OG1 2.82Å; K52-T223 CarbonylContact C-O 3.56Å; K52-T223 WeakPolarHBondContact CA-O 3.29Å; K52-T223 WeakPolarHBondContact CG-OG1 3.17Å; M53-T223 PolarHBondContact N-O 3.45Å
224	Y	95.6	Very high	93.4	Very high	109 Å²	109	55.2 Å²	55.2	43%	0.427	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	149.8	-176.8	-53.8	-71.2	0	0	0	111.1	M53 L58 I179 I222	M53-Y224 HydrophobicContact CB-CD1 4.08Å; M53-Y224 HydrophobicContact CB-CE1 4.32Å; M53-Y224 VanDerWaalsContact O-CA 3.28Å; M53-Y224 WeakPolarHBondContact O-CA 3.31Å; M53-Y224 HydrophobicContact SD-CE1 4.42Å; L58-Y224 HydrophobicContact CD1-CE1 3.95Å; L58-Y224 HydrophobicContact CD2-CD1 3.94Å; L58-Y224 HydrophobicContact CD2-CE1 3.7Å; L58-Y224 HydrophobicContact CG-CE1 4.29Å; I179-Y224 WeakPolarHBondContact CG2-OH 3.18Å; I222-Y224 HydrophobicContact CG2-CD1 4.34Å; I222-Y224 HydrophobicContact CG2-CE1 3.65Å
225	F	94.9	Very high	93.7	Very high	7 Å²	7	59 Å²	59	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	152	170.3	66.2	-85.8	0	0	0	110.2	I24 Y25 K52 M53 S54 T55 I87 M89	I24-F225 HydrophobicContact CD1-CD1 3.96Å; I24-F225 HydrophobicContact CD1-CD2 4.21Å; I24-F225 HydrophobicContact CD1-CE1 3.99Å; I24-F225 HydrophobicContact CD1-CE2 4.23Å; I24-F225 HydrophobicContact CD1-CG 4.06Å; I24-F225 HydrophobicContact CD1-CZ 4.13Å; I24-F225 HydrophobicContact CG2-CD2 3.42Å; I24-F225 VanDerWaalsContact CG2-CD2 3.42Å; I24-F225 HydrophobicContact CG2-CE2 3.41Å; I24-F225 VanDerWaalsContact CG2-CE2 3.41Å; I24-F225 HydrophobicContact CG2-CG 4.21Å; I24-F225 HydrophobicContact CG2-CZ 4.21Å; Y25-F225 AromaticContact CE1-CE2 3.91Å; Y25-F225 HydrophobicContact CE1-CE2 3.91Å; Y25-F225 AromaticContact CE2-CD2 3.85Å; Y25-F225 HydrophobicContact CE2-CD2 3.85Å; Y25-F225 AromaticContact CE2-CE2 3.89Å; Y25-F225 HydrophobicContact CE2-CE2 3.89Å; Y25-F225 AromaticContact CZ-CD2 3.74Å; Y25-F225 AromaticContact CZ-CE2 3.46Å; Y25-F225 VanDerWaalsContact CZ-CE2 3.46Å; Y25-F225 WeakPolarHBondContact OH-CD2 3.49Å; Y25-F225 WeakPolarHBondContact OH-CE2 3.43Å; K52-F225 HydrophobicContact CB-CD1 3.99Å; K52-F225 HydrophobicContact CB-CE1 4.1Å; M53-F225 WeakPolarHBondContact O-CD1 3.03Å; M53-F225 PolarHBondContact O-N 2.94Å; M53-F225 VanDerWaalsContact O-N 3.08Å; S54-F225 WeakPolarHBondContact CA-O 3.34Å; S54-F225 VanDerWaalsContact CB-CZ 3.49Å; T55-F225 PolarHBondContact N-O 2.69Å; T55-F225 PolarHBondContact OG1-O 3.45Å; T55-F225 VanDerWaalsContact OG1-O 3.11Å; I87-F225 HydrophobicContact CG2-CE1 3.82Å; I87-F225 HydrophobicContact CG2-CZ 3.9Å; M89-F225 HydrophobicContact CE-CE2 4.43Å; M89-F225 HydrophobicContact SD-CE2 4.09Å; M89-F225 HydrophobicContact SD-CZ 3.63Å
226	C	92.6	Very high	93.9	Very high	18 Å²	18	58.9 Å²	58.9	12%	0.122	29%	0.292	C	S	.	.			trans	-138.9	140.5	-179.5	-157.7	0	0	0	0	108.3	T55 S230	T55-C226 WeakPolarHBondContact OG1-CB 3.27Å; C226-S230 WeakPolarHBondContact SG-CB 3.37Å
227	S	92.6	Very high	93.9	Very high	18 Å²	18	60.4 Å²	60.4	13%	0.126	30%	0.296	C	S	.	.			trans	-65.3	156.1	171.8	75.6	0	0	0	0	110.7	D22 Y25 F229 S230 S231	D22-S227 VanDerWaalsContact OD1-CA 3.22Å; D22-S227 WeakPolarHBondContact OD1-CA 3.47Å; D22-S227 WeakPolarHBondContact OD1-CB 3.49Å; Y25-S227 PolarHBondContact OH-N 3.19Å; S227-F229 PolarHBondContact O-N 2.9Å; S227-S230 PolarHBondContact O-N 3.03Å; S227-S230 VanDerWaalsContact OG-CB 3.24Å; S227-S230 WeakPolarHBondContact OG-CB 3.34Å; S227-S230 PolarHBondContact OG-N 2.92Å; S227-S230 PolarHBondContact OG-OG 2.88Å; S227-S231 WeakPolarHBondContact O-CB 3Å; S227-S231 PolarHBondContact O-N 2.93Å; S227-S231 PolarHBondContact O-OG 2.86Å
228	S	92.4	Very high	93.8	Very high	47 Å²	47	67 Å²	67	33%	0.329	32%	0.321	S	S	.	.	H	α-helix	trans	-57.8	-38.7	174.3	63.7	0	0	0	0	111.6	D22 R232	D22-S228 PolarHBondContact OD1-N 2.89Å; D22-S228 PolarHBondContact OD1-OG 2.84Å; D22-S228 WeakPolarHBondContact OD2-CB 3.15Å; D22-S228 PolarHBondContact OD2-OG 3.37Å; S228-R232 PolarHBondContact O-N 3.34Å; S228-R232 VanDerWaalsContact O-N 3.13Å
229	F	92.2	Very high	93.7	Very high	151 Å²	151	70.9 Å²	70.9	66%	0.662	34%	0.343	S	S	*	.	H	α-helix	trans	-66.1	-51.5	175.8	178.2	-103.8	0	0	0	112	S227 S231 R232 V233	S227-F229 PolarHBondContact O-N 2.9Å; F229-S231 VanDerWaalsContact C-N 3.27Å; F229-S231 PolarHBondContact O-N 3.04Å; F229-R232 WeakPolarHBondContact O-CB 3.37Å; F229-R232 PolarHBondContact O-N 2.8Å; F229-R232 VanDerWaalsContact O-N 3.07Å; F229-V233 HydrophobicContact CD1-CG2 4.27Å; F229-V233 HydrophobicContact CE1-CG2 3.81Å; F229-V233 HydrophobicContact CE2-CG2 4.2Å; F229-V233 HydrophobicContact CZ-CG2 3.77Å; F229-V233 WeakPolarHBondContact O-CG2 3.13Å; F229-V233 PolarHBondContact O-N 2.86Å
230	S	91.4	Very high	93.6	Very high	44 Å²	44	72.4 Å²	72.4	31%	0.308	36%	0.355	S	S	.	.	H	α-helix	trans	-59.2	-40.7	178.4	-62.7	0	0	0	0	111.3	C226 S227 R232 V233 L234	C226-S230 WeakPolarHBondContact SG-CB 3.37Å; S227-S230 PolarHBondContact O-N 3.03Å; S227-S230 VanDerWaalsContact OG-CB 3.24Å; S227-S230 WeakPolarHBondContact OG-CB 3.34Å; S227-S230 PolarHBondContact OG-N 2.92Å; S227-S230 PolarHBondContact OG-OG 2.88Å; S230-R232 VanDerWaalsContact C-N 3.3Å; S230-R232 PolarHBondContact O-N 3.31Å; S230-V233 PolarHBondContact O-N 3.43Å; S230-L234 VanDerWaalsContact O-CG 3.31Å; S230-L234 WeakPolarHBondContact O-CG 3.4Å; S230-L234 PolarHBondContact O-N 3.01Å
231	S	91.5	Very high	93.3	Very high	40 Å²	40	75.4 Å²	75.4	28%	0.28	37%	0.371	S	S	.	.	H	α-helix	trans	-58.5	-43.3	175.2	-60.2	0	0	0	0	111.5	S227 F229 L234 E235	S227-S231 WeakPolarHBondContact O-CB 3Å; S227-S231 PolarHBondContact O-N 2.93Å; S227-S231 PolarHBondContact O-OG 2.86Å; F229-S231 VanDerWaalsContact C-N 3.27Å; F229-S231 PolarHBondContact O-N 3.04Å; S231-L234 PolarHBondContact O-N 3.02Å; S231-E235 PolarHBondContact O-N 2.99Å
232	R	92.7	Very high	92.9	Very high	135 Å²	135	76.5 Å²	76.5	51%	0.509	37%	0.37	S	S	.	.	H	α-helix	trans	-66.1	-39.1	176.8	-175.1	57	177.1	172.3	2.7	112.5	S228 F229 S230 E235 I236	S228-R232 PolarHBondContact O-N 3.34Å; S228-R232 VanDerWaalsContact O-N 3.13Å; F229-R232 WeakPolarHBondContact O-CB 3.37Å; F229-R232 PolarHBondContact O-N 2.8Å; F229-R232 VanDerWaalsContact O-N 3.07Å; S230-R232 VanDerWaalsContact C-N 3.3Å; S230-R232 PolarHBondContact O-N 3.31Å; R232-E235 IonicContact CZ-OE2 3.14Å; R232-E235 IonicContact NH1-OE1 2.75Å; R232-E235 PolarHBondContact NH1-OE1 2.85Å; R232-E235 IonicContact NH1-OE2 3.65Å; R232-E235 PolarHBondContact NH1-OE2 2.99Å; R232-E235 PolarHBondContact O-N 2.9Å; R232-I236 HydrophobicContact CG-CD1 4.42Å; R232-I236 WeakPolarHBondContact O-CG1 3.19Å; R232-I236 PolarHBondContact O-N 3.08Å; R232-I236 VanDerWaalsContact O-N 3.15Å
233	V	93.2	Very high	92.5	Very high	55 Å²	55	77.2 Å²	77.2	33%	0.333	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-44.6	175.3	173.3	0	0	0	0	110.8	F229 S230 E235 I236 L237	F229-V233 HydrophobicContact CD1-CG2 4.27Å; F229-V233 HydrophobicContact CE1-CG2 3.81Å; F229-V233 HydrophobicContact CE2-CG2 4.2Å; F229-V233 HydrophobicContact CZ-CG2 3.77Å; F229-V233 WeakPolarHBondContact O-CG2 3.13Å; F229-V233 PolarHBondContact O-N 2.86Å; S230-V233 PolarHBondContact O-N 3.43Å; V233-E235 VanDerWaalsContact C-N 3.3Å; V233-E235 PolarHBondContact O-N 3.15Å; V233-I236 PolarHBondContact O-N 3.31Å; V233-L237 HydrophobicContact CG1-CD1 4.01Å; V233-L237 HydrophobicContact CG1-CG 4.38Å; V233-L237 WeakPolarHBondContact O-CG 3.31Å; V233-L237 PolarHBondContact O-N 3.5Å
234	L	91.6	Very high	92	Very high	62 Å²	62	79.4 Å²	79.4	33%	0.325	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-37.6	177.7	-69.3	173.4	0	0	0	112.2	T55 M59 S230 S231 L237 W238	T55-L234 HydrophobicContact CG2-CD1 4.15Å; M59-L234 HydrophobicContact CE-CD2 3.64Å; S230-L234 VanDerWaalsContact O-CG 3.31Å; S230-L234 WeakPolarHBondContact O-CG 3.4Å; S230-L234 PolarHBondContact O-N 3.01Å; S231-L234 PolarHBondContact O-N 3.02Å; L234-L237 HydrophobicContact CD2-CD1 4.46Å; L234-L237 PolarHBondContact O-N 2.82Å; L234-W238 WeakPolarHBondContact O-CB 3.4Å; L234-W238 PolarHBondContact O-N 2.75Å
235	E	92.8	Very high	91.4	Very high	94 Å²	94	77.7 Å²	77.7	44%	0.439	39%	0.392	S	S	.	.	H	α-helix	trans	-63.2	-43.5	174.6	-168.4	-169	161.3	0	0	111.9	S231 R232 V233 W238 N239	S231-E235 PolarHBondContact O-N 2.99Å; R232-E235 IonicContact CZ-OE2 3.14Å; R232-E235 IonicContact NH1-OE1 2.75Å; R232-E235 PolarHBondContact NH1-OE1 2.85Å; R232-E235 IonicContact NH1-OE2 3.65Å; R232-E235 PolarHBondContact NH1-OE2 2.99Å; R232-E235 PolarHBondContact O-N 2.9Å; V233-E235 VanDerWaalsContact C-N 3.3Å; V233-E235 PolarHBondContact O-N 3.15Å; E235-W238 PolarHBondContact O-N 3.04Å; E235-N239 VanDerWaalsContact O-CG 3.26Å; E235-N239 PolarHBondContact O-N 3.29Å; E235-N239 VanDerWaalsContact O-N 3.1Å; E235-N239 PolarHBondContact O-ND2 3.36Å
236	I	94.7	Very high	90.9	Very high	79 Å²	79	80.1 Å²	80.1	41%	0.405	41%	0.405	S	S	.	.	H	α-helix	trans	-64.5	-44.1	176.4	-65.8	166.2	0	0	0	110.5	R232 V233 W238 N239 Q240	R232-I236 HydrophobicContact CG-CD1 4.42Å; R232-I236 WeakPolarHBondContact O-CG1 3.19Å; R232-I236 PolarHBondContact O-N 3.08Å; R232-I236 VanDerWaalsContact O-N 3.15Å; V233-I236 PolarHBondContact O-N 3.31Å; I236-W238 VanDerWaalsContact C-N 3.31Å; I236-W238 PolarHBondContact O-N 3.46Å; I236-N239 PolarHBondContact O-N 3.48Å; I236-Q240 PolarHBondContact O-N 2.87Å
237	L	93	Very high	90.4	Very high	78 Å²	78	83 Å²	83	41%	0.408	43%	0.425	S	S	.	.	H	α-helix	trans	-61.3	-40.9	177.1	-74.2	172.1	0	0	0	111.5	V233 L234 N239 Q240 N241	V233-L237 HydrophobicContact CG1-CD1 4.01Å; V233-L237 HydrophobicContact CG1-CG 4.38Å; V233-L237 WeakPolarHBondContact O-CG 3.31Å; V233-L237 PolarHBondContact O-N 3.5Å; L234-L237 HydrophobicContact CD2-CD1 4.46Å; L234-L237 PolarHBondContact O-N 2.82Å; L237-N239 VanDerWaalsContact C-N 3.35Å; L237-N239 PolarHBondContact O-N 3.06Å; L237-Q240 PolarHBondContact O-N 2.65Å; L237-N241 VanDerWaalsContact O-CB 3.29Å; L237-N241 WeakPolarHBondContact O-CB 3.36Å; L237-N241 PolarHBondContact O-N 2.89Å; L237-N241 PolarHBondContact O-ND2 3.38Å
238	W	91.8	Very high	89.6	Confident	147 Å²	147	85.5 Å²	85.5	56%	0.557	44%	0.442	S	S	*	.	H	α-helix	trans	-60.1	-45.3	175.7	178.9	-103.3	0	0	0	111.8	L234 E235 I236 Q240 N241 W242 T245	L234-W238 WeakPolarHBondContact O-CB 3.4Å; L234-W238 PolarHBondContact O-N 2.75Å; E235-W238 PolarHBondContact O-N 3.04Å; I236-W238 VanDerWaalsContact C-N 3.31Å; I236-W238 PolarHBondContact O-N 3.46Å; W238-Q240 PolarHBondContact O-N 3.08Å; W238-Q240 VanDerWaalsContact O-N 3.15Å; W238-N241 PolarHBondContact O-N 2.92Å; W238-N241 VanDerWaalsContact O-N 3.16Å; W238-W242 HydrophobicContact CZ2-CB 4.41Å; W238-W242 PolarHBondContact O-N 3.34Å; W238-T245 HydrophobicContact CH2-CG2 4.41Å
239	N	92.1	Very high	88.5	Confident	99 Å²	99	87.3 Å²	87.3	53%	0.529	46%	0.455	S	S	.	.	H	α-helix	trans	-61.5	-25.2	179.3	-68.3	-26.4	0	0	0	113.3	E235 I236 L237	E235-N239 VanDerWaalsContact O-CG 3.26Å; E235-N239 PolarHBondContact O-N 3.29Å; E235-N239 VanDerWaalsContact O-N 3.1Å; E235-N239 PolarHBondContact O-ND2 3.36Å; I236-N239 PolarHBondContact O-N 3.48Å; L237-N239 VanDerWaalsContact C-N 3.35Å; L237-N239 PolarHBondContact O-N 3.06Å
240	Q	91.6	Very high	87.4	Confident	142 Å²	142	84.2 Å²	84.2	66%	0.664	45%	0.445	S	S	*	.	H	α-helix	trans	-92.1	-31	176	-66	-175.8	-15	0	0	113.2	I236 L237 W238	I236-Q240 PolarHBondContact O-N 2.87Å; L237-Q240 PolarHBondContact O-N 2.65Å; W238-Q240 PolarHBondContact O-N 3.08Å; W238-Q240 VanDerWaalsContact O-N 3.15Å
241	N	90	Very high	86.5	Confident	67 Å²	67	84.2 Å²	84.2	36%	0.358	45%	0.452	S	S	.	.	H	α-helix	trans	-109.2	2.2	-168.9	-67.3	-70.1	0	0	0	114.9	L237 W238 A243 N244	L237-N241 VanDerWaalsContact O-CB 3.29Å; L237-N241 WeakPolarHBondContact O-CB 3.36Å; L237-N241 PolarHBondContact O-N 2.89Å; L237-N241 PolarHBondContact O-ND2 3.38Å; W238-N241 PolarHBondContact O-N 2.92Å; W238-N241 VanDerWaalsContact O-N 3.16Å; N241-A243 PolarHBondContact O-N 3.46Å; N241-N244 VanDerWaalsContact O-CB 3.31Å; N241-N244 WeakPolarHBondContact O-CB 3.36Å; N241-N244 PolarHBondContact O-N 3.3Å; N241-N244 PolarHBondContact OD1-ND2 3.02Å
242	W	90.3	Very high	85.9	Confident	137 Å²	137	85.4 Å²	85.4	52%	0.519	47%	0.465	S	S	.	.	H	α-helix	trans	-52.4	-32.7	-179.8	69.7	-90.3	0	0	0	113.3	W238 N244 T245 L246	W238-W242 HydrophobicContact CZ2-CB 4.41Å; W238-W242 PolarHBondContact O-N 3.34Å; W242-N244 VanDerWaalsContact C-N 3.28Å; W242-N244 PolarHBondContact O-N 3.48Å; W242-T245 WeakPolarHBondContact O-CB 3.32Å; W242-T245 PolarHBondContact O-N 3.05Å; W242-L246 HydrophobicContact CE3-CD1 3.76Å; W242-L246 HydrophobicContact CZ3-CD1 3.46Å; W242-L246 VanDerWaalsContact CZ3-CD1 3.46Å
243	A	89.1	Confident	85	Confident	45 Å²	45	80.9 Å²	80.9	37%	0.372	45%	0.454	S	S	.	.	H	α-helix	trans	-63.7	-33.2	178	0	0	0	0	0	112.3	N241 T245 L246 S247	N241-A243 PolarHBondContact O-N 3.46Å; A243-T245 VanDerWaalsContact C-N 3.28Å; A243-T245 PolarHBondContact O-N 2.94Å; A243-L246 PolarHBondContact O-N 3.29Å; A243-L246 VanDerWaalsContact O-N 3.1Å; A243-S247 PolarHBondContact O-N 3.04Å; A243-S247 PolarHBondContact O-OG 3.49Å
244	N	86.7	Confident	84.5	Confident	93 Å²	93	80.7 Å²	80.7	50%	0.497	45%	0.447	S	S	.	.	H	α-helix	trans	-63.7	-34.8	177.1	-66.9	-22.5	0	0	0	111.5	N241 W242 L246 S247 S248	N241-N244 VanDerWaalsContact O-CB 3.31Å; N241-N244 WeakPolarHBondContact O-CB 3.36Å; N241-N244 PolarHBondContact O-N 3.3Å; N241-N244 PolarHBondContact OD1-ND2 3.02Å; W242-N244 VanDerWaalsContact C-N 3.28Å; W242-N244 PolarHBondContact O-N 3.48Å; N244-L246 VanDerWaalsContact C-N 3.27Å; N244-L246 PolarHBondContact O-N 3.41Å; N244-S247 WeakPolarHBondContact CA-OG 3.45Å; N244-S247 PolarHBondContact O-N 3.2Å; N244-S247 PolarHBondContact O-OG 3.31Å; N244-S248 WeakPolarHBondContact O-CB 3.17Å; N244-S248 PolarHBondContact O-N 3.19Å; N244-S248 PolarHBondContact O-OG 3.14Å
245	T	83.3	Confident	84.2	Confident	74 Å²	74	83.7 Å²	83.7	45%	0.454	46%	0.46	S	S	.	.	H	α-helix	trans	-61.7	-38.1	174.6	-53	0	0	0	0	111.3	W238 W242 A243 S248	W238-T245 HydrophobicContact CH2-CG2 4.41Å; W242-T245 WeakPolarHBondContact O-CB 3.32Å; W242-T245 PolarHBondContact O-N 3.05Å; A243-T245 VanDerWaalsContact C-N 3.28Å; A243-T245 PolarHBondContact O-N 2.94Å; T245-S248 PolarHBondContact O-OG 3.32Å
246	L	82.6	Confident	83.9	Confident	57 Å²	57	85.5 Å²	85.5	30%	0.298	47%	0.468	S	S	.	.	H	α-helix	trans	-80	-29.8	179.1	-63.3	176.8	0	0	0	113.4	W242 A243 N244 K322 F326	W242-L246 HydrophobicContact CE3-CD1 3.76Å; W242-L246 HydrophobicContact CZ3-CD1 3.46Å; W242-L246 VanDerWaalsContact CZ3-CD1 3.46Å; A243-L246 PolarHBondContact O-N 3.29Å; A243-L246 VanDerWaalsContact O-N 3.1Å; N244-L246 VanDerWaalsContact C-N 3.27Å; N244-L246 PolarHBondContact O-N 3.41Å; L246-K322 WeakPolarHBondContact O-CD 3.29Å; L246-K322 VanDerWaalsContact O-CE 3.25Å; L246-K322 WeakPolarHBondContact O-CE 3.37Å; L246-F326 HydrophobicContact CB-CE2 4.23Å; L246-F326 HydrophobicContact CB-CZ 4.09Å; L246-F326 HydrophobicContact CD1-CZ 3.92Å
247	S	82.2	Confident	83.5	Confident	79 Å²	79	82.3 Å²	82.3	55%	0.552	45%	0.451	S	S	*	.	H	α-helix	trans	-88.2	-16.1	178.9	66.1	0	0	0	0	113.9	A243 N244 S249	A243-S247 PolarHBondContact O-N 3.04Å; A243-S247 PolarHBondContact O-OG 3.49Å; N244-S247 WeakPolarHBondContact CA-OG 3.45Å; N244-S247 PolarHBondContact O-N 3.2Å; N244-S247 PolarHBondContact O-OG 3.31Å; S247-S249 PolarHBondContact O-N 3.47Å; S247-S249 VanDerWaalsContact O-N 3.08Å
248	S	76.1	Confident	83.3	Confident	70 Å²	70	80.9 Å²	80.9	49%	0.49	44%	0.443	S	S	.	.			trans	-61.7	111.8	-178.9	61.5	0	0	0	0	111.6	N244 T245 K322	N244-S248 WeakPolarHBondContact O-CB 3.17Å; N244-S248 PolarHBondContact O-N 3.19Å; N244-S248 PolarHBondContact O-OG 3.14Å; T245-S248 PolarHBondContact O-OG 3.32Å; S248-K322 PolarHBondContact O-NZ 3.36Å
249	S	68.9	Low	83.3	Confident	86 Å²	86	77.2 Å²	77.2	60%	0.601	44%	0.437	S	S	*	.			trans	-125.1	84.9	171	63.1	0	0	0	0	108.3	S247 G251	S247-S249 PolarHBondContact O-N 3.47Å; S247-S249 VanDerWaalsContact O-N 3.08Å; S249-G251 PolarHBondContact O-N 2.94Å
250	D	69.4	Low	83.2	Confident	85 Å²	85	75.9 Å²	75.9	46%	0.455	44%	0.435	S	S	.	.			trans	-82.2	52.7	176.8	-153	14.5	0	0	0	111.1	T172 A252 S253 R254	T172-D250 HydrophobicContact CG2-CB 4.47Å; T172-D250 WeakPolarHBondContact CG2-OD2 3.39Å; D250-A252 VanDerWaalsContact C-N 3.29Å; D250-A252 PolarHBondContact O-N 3.2Å; D250-S253 PolarHBondContact O-OG 3.2Å; D250-S253 PolarHBondContact OD1-OG 3.48Å; D250-S253 PolarHBondContact OD2-OG 3.38Å; D250-R254 VanDerWaalsContact O-CB 3.24Å; D250-R254 WeakPolarHBondContact O-CB 3.35Å; D250-R254 PolarHBondContact O-N 3.42Å
251	G	73.5	Confident	83.1	Confident	44 Å²	44	69.9 Å²	69.9	45%	0.454	41%	0.407	S	S	.	.	H	α-helix	trans	-63.6	-35.4	-169.6	0	0	0	0	0	112.6	S249 Q255	S249-G251 PolarHBondContact O-N 2.94Å; G251-Q255 WeakPolarHBondContact O-CB 3.27Å; G251-Q255 PolarHBondContact O-N 2.57Å
252	A	77.2	Confident	83.2	Confident	65 Å²	65	72.5 Å²	72.5	54%	0.537	42%	0.418	S	S	.	.	H	α-helix	trans	-69.5	-54.5	-177.5	0	0	0	0	0	112.1	D250 R254 Q255 E256	D250-A252 VanDerWaalsContact C-N 3.29Å; D250-A252 PolarHBondContact O-N 3.2Å; A252-R254 VanDerWaalsContact C-N 3.26Å; A252-R254 PolarHBondContact O-N 2.87Å; A252-Q255 PolarHBondContact O-N 2.87Å; A252-E256 PolarHBondContact O-N 3.45Å
253	S	75.7	Confident	83.4	Confident	40 Å²	40	70.9 Å²	70.9	28%	0.28	42%	0.42	S	S	.	.	H	α-helix	trans	-60.3	-40.3	179.2	68.8	0	0	0	0	111.1	D250 E256 Y257	D250-S253 PolarHBondContact O-OG 3.2Å; D250-S253 PolarHBondContact OD1-OG 3.48Å; D250-S253 PolarHBondContact OD2-OG 3.38Å; S253-E256 PolarHBondContact O-N 3.04Å; S253-Y257 PolarHBondContact O-N 3.42Å
254	R	81	Confident	83.6	Confident	51 Å²	51	69.7 Å²	69.7	19%	0.192	41%	0.407	C	S	.	.	H	α-helix	trans	-68.2	-38.3	178.5	-165.4	162.8	-163.3	169.3	-5.8	112.6	A173 D250 A252 Y257 M258 E311 I315	A173-R254 PolarHBondContact O-NE 3.15Å; A173-R254 PolarHBondContact O-NH1 2.91Å; A173-R254 PolarHBondContact O-NH2 3.49Å; D250-R254 VanDerWaalsContact O-CB 3.24Å; D250-R254 WeakPolarHBondContact O-CB 3.35Å; D250-R254 PolarHBondContact O-N 3.42Å; A252-R254 VanDerWaalsContact C-N 3.26Å; A252-R254 PolarHBondContact O-N 2.87Å; R254-Y257 PolarHBondContact O-N 3.3Å; R254-M258 WeakPolarHBondContact O-CB 3.49Å; R254-M258 WeakPolarHBondContact O-CG 3.36Å; R254-M258 PolarHBondContact O-N 2.88Å; R254-E311 PolarHBondContact NH2-O 3.49Å; R254-I315 HydrophobicContact CG-CD1 3.92Å
255	Q	85.2	Confident	83.8	Confident	126 Å²	126	66 Å²	66	59%	0.589	39%	0.388	S	S	*	.	H	α-helix	trans	-65.7	-42.2	176.2	-179.6	178.6	-16.7	0	0	111.5	G251 A252 M258 T259	G251-Q255 WeakPolarHBondContact O-CB 3.27Å; G251-Q255 PolarHBondContact O-N 2.57Å; A252-Q255 PolarHBondContact O-N 2.87Å; Q255-M258 PolarHBondContact O-N 3.46Å; Q255-T259 WeakPolarHBondContact O-CB 3.23Å; Q255-T259 PolarHBondContact O-N 2.75Å; Q255-T259 PolarHBondContact O-OG1 2.86Å
256	E	87.1	Confident	84.3	Confident	132 Å²	132	64.5 Å²	64.5	62%	0.617	38%	0.383	S	S	*	.	H	α-helix	trans	-60.3	-48.7	175.3	-72.9	178.1	-172	0	0	111	A252 S253 M258 T259 S260	A252-E256 PolarHBondContact O-N 3.45Å; S253-E256 PolarHBondContact O-N 3.04Å; E256-M258 PolarHBondContact O-N 2.89Å; E256-T259 PolarHBondContact O-N 3.47Å; E256-S260 PolarHBondContact O-N 2.73Å
257	Y	87.3	Confident	84.9	Confident	12 Å²	12	63.1 Å²	63.1	5%	0.047	38%	0.379	C	S	.	.	H	α-helix	trans	-59.5	-48	176.6	175.7	-109.9	0	0	0	112.6	I169 R170 A173 S253 R254 T259 S260 Q261	I169-Y257 HydrophobicContact CG2-CD2 3.4Å; I169-Y257 HydrophobicContact CG2-CE2 4.21Å; I169-Y257 HydrophobicContact CG2-CG 3.8Å; R170-Y257 HydrophobicContact CG-CE2 4.01Å; A173-Y257 HydrophobicContact CB-CD1 3.4Å; A173-Y257 HydrophobicContact CB-CE1 3.79Å; A173-Y257 HydrophobicContact CB-CG 4.05Å; S253-Y257 PolarHBondContact O-N 3.42Å; R254-Y257 PolarHBondContact O-N 3.3Å; Y257-T259 VanDerWaalsContact C-N 3.32Å; Y257-T259 PolarHBondContact O-N 3.16Å; Y257-S260 WeakPolarHBondContact O-CB 3.32Å; Y257-S260 PolarHBondContact O-N 3.07Å; Y257-Q261 HydrophobicContact CD1-CG 4.34Å; Y257-Q261 HydrophobicContact CD2-CG 4.23Å; Y257-Q261 HydrophobicContact CE1-CG 3.84Å; Y257-Q261 HydrophobicContact CE2-CG 3.72Å; Y257-Q261 WeakPolarHBondContact O-CG 3.02Å; Y257-Q261 PolarHBondContact O-N 3.27Å
258	M	87.3	Confident	85.3	Confident	48 Å²	48	60 Å²	60	24%	0.236	36%	0.356	C	S	.	.	H	α-helix	trans	-62.2	-39.9	178.8	-76.9	-160.9	-61	0	0	112.3	R254 Q255 E256 S260 Q261 M262 F308 T312 I315	R254-M258 WeakPolarHBondContact O-CB 3.49Å; R254-M258 WeakPolarHBondContact O-CG 3.36Å; R254-M258 PolarHBondContact O-N 2.88Å; Q255-M258 PolarHBondContact O-N 3.46Å; E256-M258 PolarHBondContact O-N 2.89Å; M258-S260 VanDerWaalsContact C-N 3.31Å; M258-S260 PolarHBondContact O-N 2.96Å; M258-Q261 PolarHBondContact O-N 2.89Å; M258-M262 WeakPolarHBondContact O-CB 3.46Å; M258-M262 PolarHBondContact O-N 2.87Å; M258-F308 HydrophobicContact CB-CE2 4.18Å; M258-F308 HydrophobicContact CG-CE2 4.31Å; M258-T312 HydrophobicContact SD-CG2 4.42Å; M258-I315 HydrophobicContact CE-CD1 3.7Å; M258-I315 HydrophobicContact CG-CD1 4.31Å; M258-I315 HydrophobicContact SD-CD1 3.23Å; M258-I315 WeakPolarHBondContact SD-CD1 3.48Å
259	T	91.8	Very high	86	Confident	70 Å²	70	60.2 Å²	60.2	43%	0.429	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-41.2	177.2	-55.1	0	0	0	0	110.4	Q255 E256 Y257 M262 N263	Q255-T259 WeakPolarHBondContact O-CB 3.23Å; Q255-T259 PolarHBondContact O-N 2.75Å; Q255-T259 PolarHBondContact O-OG1 2.86Å; E256-T259 PolarHBondContact O-N 3.47Å; Y257-T259 VanDerWaalsContact C-N 3.32Å; Y257-T259 PolarHBondContact O-N 3.16Å; T259-M262 PolarHBondContact O-N 2.77Å; T259-N263 WeakPolarHBondContact O-CB 3.42Å; T259-N263 VanDerWaalsContact O-CG 3.24Å; T259-N263 PolarHBondContact O-N 2.92Å; T259-N263 PolarHBondContact O-ND2 3.37Å
260	S	90	Very high	87.1	Confident	71 Å²	71	63.3 Å²	63.3	50%	0.497	35%	0.348	S	S	.	.	H	α-helix	trans	-61.1	-49.6	174.4	-175.6	0	0	0	0	112.1	E256 Y257 M258 M262 N263 D264	E256-S260 PolarHBondContact O-N 2.73Å; Y257-S260 WeakPolarHBondContact O-CB 3.32Å; Y257-S260 PolarHBondContact O-N 3.07Å; M258-S260 VanDerWaalsContact C-N 3.31Å; M258-S260 PolarHBondContact O-N 2.96Å; S260-M262 VanDerWaalsContact C-N 3.32Å; S260-M262 PolarHBondContact O-N 3.43Å; S260-N263 PolarHBondContact O-N 2.98Å; S260-D264 PolarHBondContact O-N 3.27Å
261	Q	90	Very high	88	Confident	16 Å²	16	62.1 Å²	62.1	8%	0.075	34%	0.342	C	S	.	.	H	α-helix	trans	-60	-40.1	176.3	-70.3	-64.1	-53.5	0	0	112.4	Y257 M258 D264 L265 F308	Y257-Q261 HydrophobicContact CD1-CG 4.34Å; Y257-Q261 HydrophobicContact CD2-CG 4.23Å; Y257-Q261 HydrophobicContact CE1-CG 3.84Å; Y257-Q261 HydrophobicContact CE2-CG 3.72Å; Y257-Q261 WeakPolarHBondContact O-CG 3.02Å; Y257-Q261 PolarHBondContact O-N 3.27Å; M258-Q261 PolarHBondContact O-N 2.89Å; Q261-D264 PolarHBondContact O-N 3.16Å; Q261-L265 WeakPolarHBondContact O-CB 3.17Å; Q261-L265 PolarHBondContact O-N 3.15Å; Q261-F308 HydrophobicContact CB-CD2 3.89Å; Q261-F308 HydrophobicContact CB-CE2 4.11Å
262	M	92.4	Very high	88.6	Confident	121 Å²	121	60.9 Å²	60.9	60%	0.596	33%	0.325	S	S	*	.	H	α-helix	trans	-66.2	-40.6	177.7	-172.9	172.1	-179	0	0	111.9	M258 T259 S260 L265 A266 F308	M258-M262 WeakPolarHBondContact O-CB 3.46Å; M258-M262 PolarHBondContact O-N 2.87Å; T259-M262 PolarHBondContact O-N 2.77Å; S260-M262 VanDerWaalsContact C-N 3.32Å; S260-M262 PolarHBondContact O-N 3.43Å; M262-L265 PolarHBondContact O-N 2.79Å; M262-A266 WeakPolarHBondContact O-CB 3.34Å; M262-A266 PolarHBondContact O-N 3.06Å; M262-F308 HydrophobicContact CB-CZ 4.25Å
263	N	94.2	Very high	89.1	Confident	103 Å²	103	63.1 Å²	63.1	55%	0.551	33%	0.327	S	S	*	.	H	α-helix	trans	-64.9	-42	175	-73.2	-27.8	0	0	0	111.7	T259 S260 A266 A267	T259-N263 WeakPolarHBondContact O-CB 3.42Å; T259-N263 VanDerWaalsContact O-CG 3.24Å; T259-N263 PolarHBondContact O-N 2.92Å; T259-N263 PolarHBondContact O-ND2 3.37Å; S260-N263 PolarHBondContact O-N 2.98Å; N263-A266 PolarHBondContact O-N 3.28Å; N263-A267 WeakPolarHBondContact O-CB 3.34Å; N263-A267 PolarHBondContact O-N 2.91Å
264	D	92.8	Very high	89.5	Confident	20 Å²	20	66.3 Å²	66.3	11%	0.107	34%	0.341	C	S	.	.	H	α-helix	trans	-62.2	-46.7	175.6	-179.5	65.8	0	0	0	111.6	P203 L204 S260 Q261 A266 A267 K268	P203-D264 VanDerWaalsContact CA-OD1 3.32Å; P203-D264 WeakPolarHBondContact CA-OD1 3.4Å; L204-D264 PolarHBondContact N-OD1 3.49Å; S260-D264 PolarHBondContact O-N 3.27Å; Q261-D264 PolarHBondContact O-N 3.16Å; D264-A266 VanDerWaalsContact C-N 3.32Å; D264-A266 PolarHBondContact O-N 3.14Å; D264-A267 WeakPolarHBondContact O-CB 3.18Å; D264-A267 PolarHBondContact O-N 3.22Å; D264-A267 VanDerWaalsContact O-N 3.1Å; D264-K268 WeakPolarHBondContact O-CG 3.23Å; D264-K268 PolarHBondContact O-N 2.95Å; D264-K268 WeakPolarHBondContact OD2-CE 3.3Å; D264-K268 IonicContact OD2-NZ 4Å; D264-K268 PolarHBondContact OD2-NZ 3.45Å
265	L	92.5	Very high	89.4	Confident	17 Å²	17	66 Å²	66	9%	0.089	35%	0.345	C	S	.	.	H	α-helix	trans	-60.5	-42.4	176.1	-171.7	68.4	0	0	0	111.7	Q261 M262 A267 K268 M269 I301 D304 L305	Q261-L265 WeakPolarHBondContact O-CB 3.17Å; Q261-L265 PolarHBondContact O-N 3.15Å; M262-L265 PolarHBondContact O-N 2.79Å; L265-A267 VanDerWaalsContact C-N 3.3Å; L265-A267 PolarHBondContact O-N 2.98Å; L265-K268 PolarHBondContact O-N 3.49Å; L265-M269 HydrophobicContact CD1-CE 4.3Å; L265-M269 HydrophobicContact CD2-CE 4.13Å; L265-M269 HydrophobicContact CG-CE 3.99Å; L265-M269 WeakPolarHBondContact O-CG 3.47Å; L265-M269 PolarHBondContact O-N 3.31Å; L265-I301 HydrophobicContact CD1-CG2 3.99Å; L265-D304 HydrophobicContact CD1-CB 3.95Å; L265-L305 HydrophobicContact CD2-CB 4.22Å; L265-L305 HydrophobicContact CD2-CD1 3.7Å
266	A	94	Very high	89	Confident	42 Å²	42	63.4 Å²	63.4	35%	0.347	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-32.9	175.8	0	0	0	0	0	112.6	M262 N263 D264 R270	M262-A266 WeakPolarHBondContact O-CB 3.34Å; M262-A266 PolarHBondContact O-N 3.06Å; N263-A266 PolarHBondContact O-N 3.28Å; D264-A266 VanDerWaalsContact C-N 3.32Å; D264-A266 PolarHBondContact O-N 3.14Å; A266-R270 WeakPolarHBondContact O-CG 3.23Å; A266-R270 PolarHBondContact O-N 3.47Å; A266-R270 PolarHBondContact O-NE 3.47Å
267	A	93.5	Very high	88.4	Confident	27 Å²	27	58.7 Å²	58.7	22%	0.223	32%	0.322	C	S	.	.	H	α-helix	trans	-69.2	-43.8	171.8	0	0	0	0	0	111.5	L204 N263 D264 L265 M269 R270 D271	L204-A267 HydrophobicContact CD1-CB 3.49Å; L204-A267 VanDerWaalsContact CD1-CB 3.49Å; N263-A267 WeakPolarHBondContact O-CB 3.34Å; N263-A267 PolarHBondContact O-N 2.91Å; D264-A267 WeakPolarHBondContact O-CB 3.18Å; D264-A267 PolarHBondContact O-N 3.22Å; D264-A267 VanDerWaalsContact O-N 3.1Å; L265-A267 VanDerWaalsContact C-N 3.3Å; L265-A267 PolarHBondContact O-N 2.98Å; A267-M269 VanDerWaalsContact C-N 3.33Å; A267-M269 PolarHBondContact O-N 3.48Å; A267-R270 PolarHBondContact O-N 3.2Å; A267-R270 VanDerWaalsContact O-N 3.16Å; A267-D271 PolarHBondContact O-N 3.26Å
268	K	91.7	Very high	87.4	Confident	13 Å²	13	63.8 Å²	63.8	6%	0.057	35%	0.346	C	S	.	.	H	α-helix	trans	-59.7	-42.5	176.3	-74	171.4	175.9	164.1	0	112.1	I202 L204 D264 L265 D271 L272 I301 D304	I202-K268 WeakPolarHBondContact O-CE 3.43Å; I202-K268 PolarHBondContact O-NZ 3.43Å; L204-K268 HydrophobicContact CD1-CB 4.08Å; L204-K268 HydrophobicContact CD1-CG 3.47Å; L204-K268 VanDerWaalsContact CD1-CG 3.47Å; L204-K268 HydrophobicContact CD2-CG 4.48Å; L204-K268 HydrophobicContact CG-CG 3.54Å; D264-K268 WeakPolarHBondContact O-CG 3.23Å; D264-K268 PolarHBondContact O-N 2.95Å; D264-K268 WeakPolarHBondContact OD2-CE 3.3Å; D264-K268 IonicContact OD2-NZ 4Å; D264-K268 PolarHBondContact OD2-NZ 3.45Å; L265-K268 PolarHBondContact O-N 3.49Å; K268-D271 PolarHBondContact O-N 3.41Å; K268-L272 PolarHBondContact O-N 2.78Å; K268-I301 HydrophobicContact CB-CD1 4.09Å; K268-I301 HydrophobicContact CB-CG1 3.94Å; K268-I301 WeakPolarHBondContact O-CD1 3.39Å; K268-D304 WeakPolarHBondContact CD-OD2 2.88Å; K268-D304 IonicContact NZ-OD2 3.93Å; K268-D304 PolarHBondContact NZ-OD2 3.39Å
269	M	91.1	Very high	86.1	Confident	75 Å²	75	63 Å²	63	37%	0.369	35%	0.347	S	S	.	.	H	α-helix	trans	-64.8	-40.3	176	-72.5	-178.2	179.3	0	0	112.3	L265 A267 L272 I273 I301	L265-M269 HydrophobicContact CD1-CE 4.3Å; L265-M269 HydrophobicContact CD2-CE 4.13Å; L265-M269 HydrophobicContact CG-CE 3.99Å; L265-M269 WeakPolarHBondContact O-CG 3.47Å; L265-M269 PolarHBondContact O-N 3.31Å; A267-M269 VanDerWaalsContact C-N 3.33Å; A267-M269 PolarHBondContact O-N 3.48Å; M269-L272 PolarHBondContact O-N 2.88Å; M269-I273 VanDerWaalsContact O-CG1 3.29Å; M269-I273 WeakPolarHBondContact O-CG1 3.45Å; M269-I273 PolarHBondContact O-N 2.92Å; M269-I301 HydrophobicContact CE-CG2 3.77Å; M269-I301 HydrophobicContact CG-CG2 3.95Å
270	R	91.7	Very high	84.5	Confident	151 Å²	151	65 Å²	65	57%	0.57	36%	0.355	S	S	*	.	H	α-helix	trans	-63.7	-46.6	175.4	-79.4	-179.8	-72.8	161.4	-1.8	111.8	A266 A267 L272 I273 D274	A266-R270 WeakPolarHBondContact O-CG 3.23Å; A266-R270 PolarHBondContact O-N 3.47Å; A266-R270 PolarHBondContact O-NE 3.47Å; A267-R270 PolarHBondContact O-N 3.2Å; A267-R270 VanDerWaalsContact O-N 3.16Å; R270-L272 VanDerWaalsContact C-N 3.3Å; R270-L272 PolarHBondContact O-N 3Å; R270-I273 PolarHBondContact O-N 3Å; R270-I273 VanDerWaalsContact O-N 3.08Å; R270-D274 PolarHBondContact O-N 2.92Å
271	D	87.9	Confident	83	Confident	60 Å²	60	70.1 Å²	70.1	32%	0.321	37%	0.368	S	S	.	.	H	α-helix	trans	-57	-42.4	175.9	178.8	63.4	0	0	0	111.9	A267 K268 I273 D274 V275 K297	A267-D271 PolarHBondContact O-N 3.26Å; K268-D271 PolarHBondContact O-N 3.41Å; D271-I273 PolarHBondContact O-N 3.08Å; D271-D274 PolarHBondContact O-N 2.96Å; D271-V275 VanDerWaalsContact O-CG2 3.29Å; D271-V275 WeakPolarHBondContact O-CG2 3.24Å; D271-V275 PolarHBondContact O-N 3.49Å; D271-K297 IonicContact OD1-NZ 2.71Å; D271-K297 IonicContact OD2-NZ 2.56Å; D271-K297 PolarHBondContact OD2-NZ 3.2Å
272	L	87	Confident	81.3	Confident	18 Å²	18	76.2 Å²	76.2	9%	0.094	40%	0.395	C	S	.	.	H	α-helix	trans	-63.3	-41.6	174.9	-178.4	67.1	0	0	0	112.7	K268 M269 R270 D274 N276 K297 L298 I301	K268-L272 PolarHBondContact O-N 2.78Å; M269-L272 PolarHBondContact O-N 2.88Å; R270-L272 VanDerWaalsContact C-N 3.3Å; R270-L272 PolarHBondContact O-N 3Å; L272-D274 VanDerWaalsContact C-N 3.35Å; L272-N276 WeakPolarHBondContact O-CB 3.3Å; L272-N276 PolarHBondContact O-N 3.33Å; L272-K297 HydrophobicContact CD1-CB 3.88Å; L272-L298 HydrophobicContact CD2-CB 4.03Å; L272-L298 HydrophobicContact CD2-CD1 3.75Å; L272-L298 HydrophobicContact CD2-CG 4.47Å; L272-I301 HydrophobicContact CB-CD1 3.98Å; L272-I301 HydrophobicContact CD2-CD1 3.91Å
273	I	86.9	Confident	79.2	Confident	113 Å²	113	76.3 Å²	76.3	58%	0.579	39%	0.394	S	S	*	.	H	α-helix	trans	-64.1	-42.5	178.3	-69.9	163.8	0	0	0	110.4	M269 R270 D271 N276 G277	M269-I273 VanDerWaalsContact O-CG1 3.29Å; M269-I273 WeakPolarHBondContact O-CG1 3.45Å; M269-I273 PolarHBondContact O-N 2.92Å; R270-I273 PolarHBondContact O-N 3Å; R270-I273 VanDerWaalsContact O-N 3.08Å; D271-I273 PolarHBondContact O-N 3.08Å; I273-N276 PolarHBondContact O-N 3.17Å; I273-G277 PolarHBondContact O-N 3.43Å
274	D	85.1	Confident	77	Confident	106 Å²	106	79.8 Å²	79.8	57%	0.567	41%	0.409	S	S	*	.	H	α-helix	trans	-64.5	-45.2	179.6	-71.7	-22.6	0	0	0	111.1	R270 D271 L272 N276 G277 E278	R270-D274 PolarHBondContact O-N 2.92Å; D271-D274 PolarHBondContact O-N 2.96Å; L272-D274 VanDerWaalsContact C-N 3.35Å; D274-N276 PolarHBondContact O-N 3.27Å; D274-G277 PolarHBondContact O-N 3.39Å; D274-E278 WeakPolarHBondContact O-CG 3.32Å; D274-E278 PolarHBondContact O-N 3.41Å
275	V	77.9	Confident	74.9	Confident	46 Å²	46	87.3 Å²	87.3	28%	0.279	44%	0.443	S	S	.	.	H	α-helix	trans	-58.1	-47.1	174.6	172.5	0	0	0	0	111.5	D271 G277 E278 A279	D271-V275 VanDerWaalsContact O-CG2 3.29Å; D271-V275 WeakPolarHBondContact O-CG2 3.24Å; D271-V275 PolarHBondContact O-N 3.49Å; V275-G277 PolarHBondContact O-N 2.81Å; V275-E278 PolarHBondContact O-N 2.94Å; V275-A279 WeakPolarHBondContact O-CB 3.37Å; V275-A279 PolarHBondContact O-N 3.05Å
276	N	75.9	Confident	72.3	Confident	70 Å²	70	97 Å²	97	37%	0.374	48%	0.479	S	S	.	.	H	α-helix	trans	-68.1	-33.5	177.8	-82	8.1	0	0	0	112.7	L272 I273 D274 A279 N280	L272-N276 WeakPolarHBondContact O-CB 3.3Å; L272-N276 PolarHBondContact O-N 3.33Å; I273-N276 PolarHBondContact O-N 3.17Å; D274-N276 PolarHBondContact O-N 3.27Å; N276-A279 PolarHBondContact O-N 3.15Å; N276-N280 WeakPolarHBondContact O-CB 3.43Å; N276-N280 PolarHBondContact O-N 3.35Å; N276-N280 PolarHBondContact O-ND2 3.25Å
277	G	74.8	Confident	69.6	Low	34 Å²	34	100 Å²	100	35%	0.351	50%	0.497	S	S	.	.	H	α-helix	trans	-66.9	-40.7	176.8	0	0	0	0	0	112.3	I273 D274 V275 K281	I273-G277 PolarHBondContact O-N 3.43Å; D274-G277 PolarHBondContact O-N 3.39Å; V275-G277 PolarHBondContact O-N 2.81Å; G277-K281 PolarHBondContact O-N 2.65Å
278	E	66.6	Low	66.9	Low	119 Å²	119	104.5 Å²	104.5	56%	0.556	53%	0.527	S	S	*	.	H	α-helix	trans	-69.7	-39.4	172.8	-69.6	-163	164.9	0	0	112.7	D274 V275 K281 K282	D274-E278 WeakPolarHBondContact O-CG 3.32Å; D274-E278 PolarHBondContact O-N 3.41Å; V275-E278 PolarHBondContact O-N 2.94Å; E278-K281 PolarHBondContact O-N 3.27Å; E278-K282 PolarHBondContact O-N 3.41Å
279	A	59.3	Low	64.6	Low	31 Å²	31	107.2 Å²	107.2	26%	0.256	56%	0.558	S	S	.	*	H	α-helix	trans	-60.5	-44.2	175.1	0	0	0	0	0	111.3	V275 N276 K281 K282 Q283	V275-A279 WeakPolarHBondContact O-CB 3.37Å; V275-A279 PolarHBondContact O-N 3.05Å; N276-A279 PolarHBondContact O-N 3.15Å; A279-K281 VanDerWaalsContact C-N 3.31Å; A279-K281 PolarHBondContact O-N 3.34Å; A279-K282 CarbonylContact O-C 3.56Å; A279-K282 PolarHBondContact O-N 2.9Å; A279-K282 VanDerWaalsContact O-N 3.09Å; A279-Q283 VanDerWaalsContact O-CB 3.31Å; A279-Q283 WeakPolarHBondContact O-CB 3.44Å; A279-Q283 PolarHBondContact O-N 3.26Å
280	N	58.1	Low	62.6	Low	113 Å²	113	112.7 Å²	112.7	60%	0.604	58%	0.581	S	S	*	*	H	α-helix	trans	-62.6	-34	175.9	-84.7	-37.2	0	0	0	113.1	N276	N276-N280 WeakPolarHBondContact O-CB 3.43Å; N276-N280 PolarHBondContact O-N 3.35Å; N276-N280 PolarHBondContact O-ND2 3.25Å
281	K	59.9	Low	61.3	Low	177 Å²	177	108.6 Å²	108.6	77%	0.77	57%	0.57	S	S	*	*	H	α-helix	trans	-68.7	-36.1	172.8	-74.5	176.9	-179	171.7	0	112.3	G277 E278 A279	G277-K281 PolarHBondContact O-N 2.65Å; E278-K281 PolarHBondContact O-N 3.27Å; A279-K281 VanDerWaalsContact C-N 3.31Å; A279-K281 PolarHBondContact O-N 3.34Å
282	K	53.2	Low	60.5	Low	144 Å²	144	113.5 Å²	113.5	63%	0.626	59%	0.588	S	S	*	*	H	α-helix	trans	-81.7	-28	179.2	-73.1	174.7	179.9	163.2	0	113.4	E278 A279 M284 Q285	E278-K282 PolarHBondContact O-N 3.41Å; A279-K282 CarbonylContact O-C 3.56Å; A279-K282 PolarHBondContact O-N 2.9Å; A279-K282 VanDerWaalsContact O-N 3.09Å; K282-M284 PolarHBondContact O-N 3.04Å; K282-Q285 PolarHBondContact O-N 3.21Å
283	Q	49.5	Very low	59.8	Low	123 Å²	123	118.2 Å²	118.2	58%	0.575	61%	0.614	S	S	*	*	H	α-helix	trans	-69.9	-16.2	-179.6	-164.9	171.5	3.9	0	0	112.9	A279 Q285	A279-Q283 VanDerWaalsContact O-CB 3.31Å; A279-Q283 WeakPolarHBondContact O-CB 3.44Å; A279-Q283 PolarHBondContact O-N 3.26Å; Q283-Q285 PolarHBondContact O-N 3.37Å
284	M	47.7	Very low	59.4	Low	177 Å²	177	113.1 Å²	113.1	87%	0.872	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-8.4	167	-158.2	153.1	84.8	0	0	113.2	K282	K282-M284 PolarHBondContact O-N 3.04Å
285	Q	48.3	Very low	59.2	Low	178 Å²	178	112.4 Å²	112.4	83%	0.832	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	-21.5	176.8	-79.3	-174.1	-13.5	0	0	115.9	K282 Q283	K282-Q285 PolarHBondContact O-N 3.21Å; Q283-Q285 PolarHBondContact O-N 3.37Å
286	R	37.6	Very low	59.6	Low	220 Å²	220	116.8 Å²	116.8	83%	0.83	60%	0.597	S	S	*	*			trans	-150.2	120.1	175.5	-80.4	-174	139.1	160	-8.6	112.7
287	S	37.1	Very low	60	Low	104 Å²	104	117 Å²	117	73%	0.727	60%	0.595	S	S	*	*			trans	-71.1	145.8	166.9	44.9	0	0	0	0	112.1
288	S	38.4	Very low	60.6	Low	123 Å²	123	120.1 Å²	120.1	86%	0.86	60%	0.603	S	S	*	*			trans	88.7	49.5	157.2	86	0	0	0	0	120.7
289	G	43.8	Very low	61.7	Low	69 Å²	69	119.9 Å²	119.9	71%	0.711	60%	0.6	S	S	*	*			trans	-126.3	109	150.4	0	0	0	0	0	109.2	D291	G289-D291 PolarHBondContact O-N 2.63Å
290	F	48.2	Very low	63.1	Low	191 Å²	191	120.5 Å²	120.5	84%	0.838	60%	0.599	S	S	*	*			trans	-58.4	123.6	169.9	-108	-99.4	0	0	0	108.3	K292	F290-K292 PolarHBondContact O-N 2.83Å
291	D	64.2	Low	64.7	Low	64 Å²	64	115.7 Å²	115.7	34%	0.342	57%	0.574	S	S	.	*			trans	-72.4	78.3	-176.9	-164.7	-12.6	0	0	0	110.6	G289 D293 G294 E295	G289-D291 PolarHBondContact O-N 2.63Å; D291-D293 PolarHBondContact O-N 3.46Å; D291-D293 PolarHBondContact OD1-N 3.08Å; D291-G294 PolarHBondContact O-N 3.05Å; D291-G294 PolarHBondContact OD1-N 2.89Å; D291-E295 PolarHBondContact O-N 2.93Å; D291-E295 VanDerWaalsContact O-N 3.08Å
292	K	70.4	Confident	66.2	Low	163 Å²	163	111.9 Å²	111.9	71%	0.709	56%	0.561	S	S	*	*	H	α-helix	trans	-59.6	-29.1	180	-72.3	-174.3	177.8	-179.4	0	112	F290 K296	F290-K292 PolarHBondContact O-N 2.83Å; K292-K296 WeakPolarHBondContact O-CB 3.38Å; K292-K296 PolarHBondContact O-N 2.94Å
293	D	73.2	Confident	68	Low	117 Å²	117	109.8 Å²	109.8	63%	0.626	55%	0.553	S	S	*	*	H	α-helix	trans	-74.7	-44	-179.9	-70.2	-25.1	0	0	0	110.7	D291 E295 K296 K297	D291-D293 PolarHBondContact O-N 3.46Å; D291-D293 PolarHBondContact OD1-N 3.08Å; D293-E295 PolarHBondContact O-N 3.41Å; D293-K296 PolarHBondContact O-N 3.31Å; D293-K297 WeakPolarHBondContact O-CB 3.48Å; D293-K297 WeakPolarHBondContact O-CG 3.41Å; D293-K297 PolarHBondContact O-N 3.31Å
294	G	77.6	Confident	69.9	Low	6 Å²	6	104.4 Å²	104.4	6%	0.062	53%	0.527	C	S	.	.	H	α-helix	trans	-57.5	-44.9	170.8	0	0	0	0	0	112.7	D291 K296 K297 L298	D291-G294 PolarHBondContact O-N 3.05Å; D291-G294 PolarHBondContact OD1-N 2.89Å; G294-K296 PolarHBondContact O-N 3Å; G294-K297 PolarHBondContact O-N 3.26Å; G294-L298 WeakPolarHBondContact O-CB 3.5Å; G294-L298 PolarHBondContact O-N 3.5Å
295	E	82.6	Confident	72	Confident	92 Å²	92	99.4 Å²	99.4	43%	0.43	50%	0.504	S	S	.	.	H	α-helix	trans	-65.1	-39.1	178.2	-160.7	-169.6	151.4	0	0	112.3	D291 D293 K299	D291-E295 PolarHBondContact O-N 2.93Å; D291-E295 VanDerWaalsContact O-N 3.08Å; D293-E295 PolarHBondContact O-N 3.41Å; E295-K299 WeakPolarHBondContact O-CG 3.27Å; E295-K299 PolarHBondContact O-N 3.41Å; E295-K299 VanDerWaalsContact OE1-CE 3.31Å; E295-K299 WeakPolarHBondContact OE1-CE 3.3Å; E295-K299 IonicContact OE1-NZ 2.98Å; E295-K299 PolarHBondContact OE1-NZ 3.03Å
296	K	84.6	Confident	74.1	Confident	137 Å²	137	94.8 Å²	94.8	60%	0.596	49%	0.49	S	S	*	.	H	α-helix	trans	-67	-44.8	176.4	-172.5	-178.6	178.3	-172.7	0	111.5	K292 D293 G294 L298 K299 N300	K292-K296 WeakPolarHBondContact O-CB 3.38Å; K292-K296 PolarHBondContact O-N 2.94Å; D293-K296 PolarHBondContact O-N 3.31Å; G294-K296 PolarHBondContact O-N 3Å; K296-L298 VanDerWaalsContact C-N 3.34Å; K296-L298 PolarHBondContact O-N 3.37Å; K296-K299 PolarHBondContact O-N 3.1Å; K296-N300 PolarHBondContact O-N 3.39Å
297	K	84.7	Confident	76.4	Confident	76 Å²	76	87 Å²	87	33%	0.33	47%	0.47	S	S	.	.	H	α-helix	trans	-59.5	-44.8	175.2	-77.3	-172.2	177.7	-167.7	0	111.1	D271 L272 D293 G294 K299 N300 I301	D271-K297 IonicContact OD1-NZ 2.71Å; D271-K297 IonicContact OD2-NZ 2.56Å; D271-K297 PolarHBondContact OD2-NZ 3.2Å; L272-K297 HydrophobicContact CD1-CB 3.88Å; D293-K297 WeakPolarHBondContact O-CB 3.48Å; D293-K297 WeakPolarHBondContact O-CG 3.41Å; D293-K297 PolarHBondContact O-N 3.31Å; G294-K297 PolarHBondContact O-N 3.26Å; K297-K299 PolarHBondContact O-N 3.45Å; K297-N300 PolarHBondContact O-N 3.37Å; K297-I301 WeakPolarHBondContact O-CG1 3.38Å; K297-I301 PolarHBondContact O-N 3.29Å
298	L	88.2	Confident	78.9	Confident	99 Å²	99	83.9 Å²	83.9	52%	0.518	44%	0.443	S	S	.	.	H	α-helix	trans	-60.7	-44.2	177	-177.4	63.7	0	0	0	112.2	L272 G294 K296 N300 I301 D302	L272-L298 HydrophobicContact CD2-CB 4.03Å; L272-L298 HydrophobicContact CD2-CD1 3.75Å; L272-L298 HydrophobicContact CD2-CG 4.47Å; G294-L298 WeakPolarHBondContact O-CB 3.5Å; G294-L298 PolarHBondContact O-N 3.5Å; K296-L298 VanDerWaalsContact C-N 3.34Å; K296-L298 PolarHBondContact O-N 3.37Å; L298-N300 VanDerWaalsContact C-N 3.3Å; L298-N300 PolarHBondContact O-N 2.93Å; L298-I301 PolarHBondContact O-N 3.32Å; L298-D302 PolarHBondContact O-N 3.11Å
299	K	89.9	Confident	81.3	Confident	114 Å²	114	80.2 Å²	80.2	50%	0.496	42%	0.42	S	S	.	.	H	α-helix	trans	-62.5	-35.4	175.9	-75.6	175.6	-174.5	165.2	0	112.9	E295 K296 K297 K303	E295-K299 WeakPolarHBondContact O-CG 3.27Å; E295-K299 PolarHBondContact O-N 3.41Å; E295-K299 VanDerWaalsContact OE1-CE 3.31Å; E295-K299 WeakPolarHBondContact OE1-CE 3.3Å; E295-K299 IonicContact OE1-NZ 2.98Å; E295-K299 PolarHBondContact OE1-NZ 3.03Å; K296-K299 PolarHBondContact O-N 3.1Å; K297-K299 PolarHBondContact O-N 3.45Å; K299-K303 WeakPolarHBondContact O-CG 3.32Å; K299-K303 PolarHBondContact O-N 3.12Å
300	N	88.8	Confident	83.5	Confident	43 Å²	43	78.5 Å²	78.5	23%	0.23	40%	0.402	C	S	.	.	H	α-helix	trans	-70.1	-42.5	175.9	-70.8	-6.9	0	0	0	111.3	Y199 K296 K297 L298 D302 K303 D304	Y199-N300 HydrophobicContact CE2-CB 4.21Å; Y199-N300 PolarHBondContact OH-O 3.22Å; K296-N300 PolarHBondContact O-N 3.39Å; K297-N300 PolarHBondContact O-N 3.37Å; L298-N300 VanDerWaalsContact C-N 3.3Å; L298-N300 PolarHBondContact O-N 2.93Å; N300-D302 VanDerWaalsContact C-N 3.32Å; N300-D302 PolarHBondContact O-N 2.73Å; N300-K303 WeakPolarHBondContact O-CB 3.06Å; N300-K303 PolarHBondContact O-N 3.19Å; N300-D304 PolarHBondContact O-N 3.29Å
301	I	90.5	Very high	85.2	Confident	13 Å²	13	70.8 Å²	70.8	7%	0.067	37%	0.369	C	S	.	.	H	α-helix	trans	-60.6	-41.7	174.8	-69.7	167.8	0	0	0	111.2	L265 K268 M269 L272 K297 L298 K303 D304 L305	L265-I301 HydrophobicContact CD1-CG2 3.99Å; K268-I301 HydrophobicContact CB-CD1 4.09Å; K268-I301 HydrophobicContact CB-CG1 3.94Å; K268-I301 WeakPolarHBondContact O-CD1 3.39Å; M269-I301 HydrophobicContact CE-CG2 3.77Å; M269-I301 HydrophobicContact CG-CG2 3.95Å; L272-I301 HydrophobicContact CB-CD1 3.98Å; L272-I301 HydrophobicContact CD2-CD1 3.91Å; K297-I301 WeakPolarHBondContact O-CG1 3.38Å; K297-I301 PolarHBondContact O-N 3.29Å; L298-I301 PolarHBondContact O-N 3.32Å; I301-K303 VanDerWaalsContact C-N 3.33Å; I301-K303 PolarHBondContact O-N 3.25Å; I301-D304 PolarHBondContact O-N 2.9Å; I301-L305 WeakPolarHBondContact O-CB 3.13Å; I301-L305 PolarHBondContact O-N 3.5Å
302	D	91.9	Very high	86.1	Confident	96 Å²	96	69.3 Å²	69.3	51%	0.513	36%	0.363	S	S	.	.	H	α-helix	trans	-61.1	-41.6	176.5	-173.9	53.7	0	0	0	112	L298 N300 L305 C306	L298-D302 PolarHBondContact O-N 3.11Å; N300-D302 VanDerWaalsContact C-N 3.32Å; N300-D302 PolarHBondContact O-N 2.73Å; D302-L305 PolarHBondContact O-N 2.81Å; D302-C306 WeakPolarHBondContact O-CB 3.48Å; D302-C306 PolarHBondContact O-N 2.79Å; D302-C306 PolarHBondContact O-SG 2.95Å; D302-C306 VanDerWaalsContact O-SG 3.38Å
303	K	90.7	Very high	87	Confident	101 Å²	101	65.3 Å²	65.3	44%	0.439	35%	0.352	S	S	.	.	H	α-helix	trans	-63.9	-45.6	173.6	-72.6	176.5	-178.5	179.2	0	112.4	Y199 K299 N300 I301 L305 C306 S307	Y199-K303 HydrophobicContact CD1-CB 4.11Å; Y199-K303 HydrophobicContact CD1-CD 3.84Å; Y199-K303 HydrophobicContact CD2-CD 4.11Å; Y199-K303 HydrophobicContact CE1-CB 3.63Å; Y199-K303 HydrophobicContact CE1-CD 3.99Å; Y199-K303 HydrophobicContact CE1-CG 4.49Å; Y199-K303 HydrophobicContact CE2-CD 4.23Å; Y199-K303 HydrophobicContact CG-CD 3.91Å; K299-K303 WeakPolarHBondContact O-CG 3.32Å; K299-K303 PolarHBondContact O-N 3.12Å; N300-K303 WeakPolarHBondContact O-CB 3.06Å; N300-K303 PolarHBondContact O-N 3.19Å; I301-K303 VanDerWaalsContact C-N 3.33Å; I301-K303 PolarHBondContact O-N 3.25Å; K303-L305 VanDerWaalsContact C-N 3.33Å; K303-L305 PolarHBondContact O-N 2.76Å; K303-C306 PolarHBondContact O-N 3.37Å; K303-S307 WeakPolarHBondContact O-CB 3.34Å; K303-S307 PolarHBondContact O-N 2.54Å
304	D	89.8	Confident	87.5	Confident	9 Å²	9	64.6 Å²	64.6	5%	0.048	35%	0.348	C	S	.	.	H	α-helix	trans	-62.1	-43	178.6	-70.3	-7.1	0	0	0	110.7	Y199 S201 L265 K268 N300 I301 S307 F308	Y199-D304 VanDerWaalsContact CE1-OD1 3.27Å; Y199-D304 WeakPolarHBondContact CE1-OD1 3.45Å; Y199-D304 VanDerWaalsContact CZ-OD1 3.31Å; Y199-D304 VanDerWaalsContact OH-CG 3.27Å; Y199-D304 PolarHBondContact OH-OD1 2.73Å; Y199-D304 PolarHBondContact OH-OD2 2.9Å; S201-D304 WeakPolarHBondContact CB-OD1 3.41Å; S201-D304 PolarHBondContact OG-OD1 2.9Å; L265-D304 HydrophobicContact CD1-CB 3.95Å; K268-D304 WeakPolarHBondContact CD-OD2 2.88Å; K268-D304 IonicContact NZ-OD2 3.93Å; K268-D304 PolarHBondContact NZ-OD2 3.39Å; N300-D304 PolarHBondContact O-N 3.29Å; I301-D304 PolarHBondContact O-N 2.9Å; D304-S307 PolarHBondContact O-N 2.62Å; D304-F308 VanDerWaalsContact O-CB 3.32Å; D304-F308 WeakPolarHBondContact O-CB 3.18Å; D304-F308 PolarHBondContact O-N 3.4Å
305	L	91.6	Very high	87.7	Confident	73 Å²	73	65.7 Å²	65.7	38%	0.382	35%	0.352	S	S	.	.	H	α-helix	trans	-62.8	-44.3	176.4	179	65.7	0	0	0	111.7	L265 I301 D302 K303 F308 A309	L265-L305 HydrophobicContact CD2-CB 4.22Å; L265-L305 HydrophobicContact CD2-CD1 3.7Å; I301-L305 WeakPolarHBondContact O-CB 3.13Å; I301-L305 PolarHBondContact O-N 3.5Å; D302-L305 PolarHBondContact O-N 2.81Å; K303-L305 VanDerWaalsContact C-N 3.33Å; K303-L305 PolarHBondContact O-N 2.76Å; L305-F308 PolarHBondContact O-N 2.92Å; L305-A309 VanDerWaalsContact O-CB 3.27Å; L305-A309 WeakPolarHBondContact O-CB 3.35Å; L305-A309 PolarHBondContact O-N 3.22Å
306	C	91.5	Very high	87.8	Confident	80 Å²	80	65.6 Å²	65.6	54%	0.541	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-41.3	177.2	-80	0	0	0	0	112.1	D302 K303 G310	D302-C306 WeakPolarHBondContact O-CB 3.48Å; D302-C306 PolarHBondContact O-N 2.79Å; D302-C306 PolarHBondContact O-SG 2.95Å; D302-C306 VanDerWaalsContact O-SG 3.38Å; K303-C306 PolarHBondContact O-N 3.37Å; C306-G310 PolarHBondContact O-N 3.31Å
307	S	86.9	Confident	88	Confident	57 Å²	57	63.3 Å²	63.3	40%	0.399	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-51.2	174.7	-163.7	0	0	0	0	110.8	K303 D304 A309 G310 E311	K303-S307 WeakPolarHBondContact O-CB 3.34Å; K303-S307 PolarHBondContact O-N 2.54Å; D304-S307 PolarHBondContact O-N 2.62Å; S307-A309 VanDerWaalsContact C-N 3.34Å; S307-A309 PolarHBondContact O-N 3.13Å; S307-G310 PolarHBondContact O-N 2.92Å; S307-E311 WeakPolarHBondContact O-CG 3.48Å; S307-E311 PolarHBondContact O-N 3.39Å
308	F	88.5	Confident	88	Confident	38 Å²	38	61.9 Å²	61.9	17%	0.167	35%	0.349	C	S	.	.	H	α-helix	trans	-58.5	-43.7	178.5	176.8	-101.9	0	0	0	112.5	M258 Q261 M262 D304 L305 E311 T312	M258-F308 HydrophobicContact CB-CE2 4.18Å; M258-F308 HydrophobicContact CG-CE2 4.31Å; Q261-F308 HydrophobicContact CB-CD2 3.89Å; Q261-F308 HydrophobicContact CB-CE2 4.11Å; M262-F308 HydrophobicContact CB-CZ 4.25Å; D304-F308 VanDerWaalsContact O-CB 3.32Å; D304-F308 WeakPolarHBondContact O-CB 3.18Å; D304-F308 PolarHBondContact O-N 3.4Å; L305-F308 PolarHBondContact O-N 2.92Å; F308-E311 PolarHBondContact O-N 2.91Å; F308-T312 WeakPolarHBondContact O-CB 3.23Å; F308-T312 PolarHBondContact O-N 3.5Å; F308-T312 PolarHBondContact O-OG1 3.19Å
309	A	90.8	Very high	87.8	Confident	46 Å²	46	61.2 Å²	61.2	38%	0.38	34%	0.344	S	S	.	.	H	α-helix	trans	-64.1	-44.6	177.2	0	0	0	0	0	111.5	L305 S307 T312 V313	L305-A309 VanDerWaalsContact O-CB 3.27Å; L305-A309 WeakPolarHBondContact O-CB 3.35Å; L305-A309 PolarHBondContact O-N 3.22Å; S307-A309 VanDerWaalsContact C-N 3.34Å; S307-A309 PolarHBondContact O-N 3.13Å; A309-T312 PolarHBondContact O-N 2.96Å; A309-V313 VanDerWaalsContact O-CG2 3.31Å; A309-V313 WeakPolarHBondContact O-CG2 3.18Å; A309-V313 PolarHBondContact O-N 3.4Å
310	G	88.3	Confident	87.7	Confident	33 Å²	33	60.9 Å²	60.9	34%	0.34	35%	0.345	S	S	.	.	H	α-helix	trans	-60.9	-44.8	177.4	0	0	0	0	0	112.7	C306 S307 V313 N314	C306-G310 PolarHBondContact O-N 3.31Å; S307-G310 PolarHBondContact O-N 2.92Å; G310-V313 PolarHBondContact O-N 3.05Å; G310-N314 PolarHBondContact O-N 2.9Å; G310-N314 VanDerWaalsContact O-N 3.09Å; G310-N314 PolarHBondContact O-ND2 3.09Å
311	E	83.7	Confident	87.6	Confident	29 Å²	29	62.7 Å²	62.7	14%	0.136	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-44.8	175.3	-70.7	176.4	-177.4	0	0	111.7	N174 R254 S307 F308 V313 N314 I315	N174-E311 PolarHBondContact ND2-OE1 2.92Å; N174-E311 VanDerWaalsContact OD1-CG 3.3Å; N174-E311 WeakPolarHBondContact OD1-CG 3.47Å; N174-E311 PolarHBondContact OD1-OE1 3.42Å; R254-E311 PolarHBondContact NH2-O 3.49Å; S307-E311 WeakPolarHBondContact O-CG 3.48Å; S307-E311 PolarHBondContact O-N 3.39Å; F308-E311 PolarHBondContact O-N 2.91Å; E311-V313 PolarHBondContact O-N 3.01Å; E311-N314 PolarHBondContact O-N 2.92Å; E311-I315 WeakPolarHBondContact O-CG1 3.41Å; E311-I315 PolarHBondContact O-N 3.45Å
312	T	84.7	Confident	87.4	Confident	34 Å²	34	63.8 Å²	63.8	21%	0.209	36%	0.362	C	S	.	.	H	α-helix	trans	-63.1	-42	178.5	-56.8	0	0	0	0	111.8	M258 F308 A309 N314 I315 I316	M258-T312 HydrophobicContact SD-CG2 4.42Å; F308-T312 WeakPolarHBondContact O-CB 3.23Å; F308-T312 PolarHBondContact O-N 3.5Å; F308-T312 PolarHBondContact O-OG1 3.19Å; A309-T312 PolarHBondContact O-N 2.96Å; T312-N314 VanDerWaalsContact C-N 3.33Å; T312-N314 PolarHBondContact O-N 3.13Å; T312-I315 VanDerWaalsContact O-CB 3.3Å; T312-I315 WeakPolarHBondContact O-CB 3.4Å; T312-I315 PolarHBondContact O-N 2.94Å; T312-I316 HydrophobicContact CG2-CD1 4.06Å; T312-I316 WeakPolarHBondContact O-CG1 3.19Å; T312-I316 PolarHBondContact O-N 2.78Å
313	V	88.8	Confident	87.1	Confident	79 Å²	79	67.6 Å²	67.6	48%	0.479	37%	0.369	S	S	.	.	H	α-helix	trans	-62	-42.2	176.4	168.2	0	0	0	0	111.1	A309 G310 E311 I315 I316 L317	A309-V313 VanDerWaalsContact O-CG2 3.31Å; A309-V313 WeakPolarHBondContact O-CG2 3.18Å; A309-V313 PolarHBondContact O-N 3.4Å; G310-V313 PolarHBondContact O-N 3.05Å; E311-V313 PolarHBondContact O-N 3.01Å; V313-I315 VanDerWaalsContact C-N 3.28Å; V313-I315 PolarHBondContact O-N 3.43Å; V313-I316 PolarHBondContact O-N 2.72Å; V313-L317 HydrophobicContact CG1-CD1 3.7Å; V313-L317 HydrophobicContact CG1-CG 4.15Å; V313-L317 WeakPolarHBondContact O-CB 3.32Å; V313-L317 VanDerWaalsContact O-CG 3.3Å; V313-L317 WeakPolarHBondContact O-CG 3.43Å; V313-L317 PolarHBondContact O-N 3.19Å
314	N	84.5	Confident	87	Confident	102 Å²	102	70 Å²	70	55%	0.545	38%	0.38	S	S	.	.	H	α-helix	trans	-61	-35.6	177.2	-73.6	-27.3	0	0	0	112.5	G310 E311 T312 A318	G310-N314 PolarHBondContact O-N 2.9Å; G310-N314 VanDerWaalsContact O-N 3.09Å; G310-N314 PolarHBondContact O-ND2 3.09Å; E311-N314 PolarHBondContact O-N 2.92Å; T312-N314 VanDerWaalsContact C-N 3.33Å; T312-N314 PolarHBondContact O-N 3.13Å; N314-A318 WeakPolarHBondContact O-CB 3.43Å; N314-A318 PolarHBondContact O-N 3.04Å
315	I	80.6	Confident	86.8	Confident	28 Å²	28	73.7 Å²	73.7	14%	0.144	40%	0.399	C	S	.	.	H	α-helix	trans	-58.4	-57.5	172.2	-61.1	170	0	0	0	110.5	R254 M258 E311 T312 V313 L317 A318 E319	R254-I315 HydrophobicContact CG-CD1 3.92Å; M258-I315 HydrophobicContact CE-CD1 3.7Å; M258-I315 HydrophobicContact CG-CD1 4.31Å; M258-I315 HydrophobicContact SD-CD1 3.23Å; M258-I315 WeakPolarHBondContact SD-CD1 3.48Å; E311-I315 WeakPolarHBondContact O-CG1 3.41Å; E311-I315 PolarHBondContact O-N 3.45Å; T312-I315 VanDerWaalsContact O-CB 3.3Å; T312-I315 WeakPolarHBondContact O-CB 3.4Å; T312-I315 PolarHBondContact O-N 2.94Å; V313-I315 VanDerWaalsContact C-N 3.28Å; V313-I315 PolarHBondContact O-N 3.43Å; I315-L317 PolarHBondContact O-N 3.08Å; I315-A318 WeakPolarHBondContact O-CB 3.4Å; I315-A318 PolarHBondContact O-N 3.35Å; I315-A318 VanDerWaalsContact O-N 3.1Å; I315-E319 PolarHBondContact O-N 2.78Å
316	I	85.7	Confident	86.5	Confident	91 Å²	91	76 Å²	76	47%	0.467	41%	0.406	S	S	.	.	H	α-helix	trans	-62.6	-41.6	-170.9	-66	168.7	0	0	0	108.6	T312 V313 E319 M320	T312-I316 HydrophobicContact CG2-CD1 4.06Å; T312-I316 WeakPolarHBondContact O-CG1 3.19Å; T312-I316 PolarHBondContact O-N 2.78Å; V313-I316 PolarHBondContact O-N 2.72Å; I316-E319 PolarHBondContact O-N 3.43Å; I316-M320 HydrophobicContact CG2-CG 4.22Å; I316-M320 HydrophobicContact CG2-SD 3.81Å; I316-M320 WeakPolarHBondContact O-CB 3.25Å; I316-M320 WeakPolarHBondContact O-CG 3.38Å; I316-M320 PolarHBondContact O-N 3.27Å
317	L	88.3	Confident	86	Confident	89 Å²	89	75.4 Å²	75.4	47%	0.466	40%	0.4	S	S	.	.	H	α-helix	trans	-60	-46.3	174.9	-74	173.2	0	0	0	112.3	V313 I315 E319 M320 V321	V313-L317 HydrophobicContact CG1-CD1 3.7Å; V313-L317 HydrophobicContact CG1-CG 4.15Å; V313-L317 WeakPolarHBondContact O-CB 3.32Å; V313-L317 VanDerWaalsContact O-CG 3.3Å; V313-L317 WeakPolarHBondContact O-CG 3.43Å; V313-L317 PolarHBondContact O-N 3.19Å; I315-L317 PolarHBondContact O-N 3.08Å; L317-E319 VanDerWaalsContact C-N 3.35Å; L317-E319 PolarHBondContact O-N 3.05Å; L317-M320 PolarHBondContact O-N 3.49Å; L317-V321 VanDerWaalsContact O-CG2 3.29Å; L317-V321 WeakPolarHBondContact O-CG2 3.41Å; L317-V321 PolarHBondContact O-N 3.47Å
318	A	83.9	Confident	85.3	Confident	45 Å²	45	75 Å²	75	37%	0.372	40%	0.397	S	S	.	.	H	α-helix	trans	-59.7	-45.2	178.2	0	0	0	0	0	111.7	N314 I315 V321 K322	N314-A318 WeakPolarHBondContact O-CB 3.43Å; N314-A318 PolarHBondContact O-N 3.04Å; I315-A318 WeakPolarHBondContact O-CB 3.4Å; I315-A318 PolarHBondContact O-N 3.35Å; I315-A318 VanDerWaalsContact O-N 3.1Å; A318-V321 PolarHBondContact O-N 2.94Å; A318-K322 WeakPolarHBondContact O-CG 3.1Å; A318-K322 PolarHBondContact O-N 3.42Å; A318-K322 VanDerWaalsContact O-N 3.07Å
319	E	84	Confident	84.1	Confident	86 Å²	86	79 Å²	79	40%	0.402	42%	0.419	S	S	.	.	H	α-helix	trans	-67.2	-38.8	177.1	-69.6	-54.7	127.8	0	0	112.6	I315 I316 L317 V321 K322 R323	I315-E319 PolarHBondContact O-N 2.78Å; I316-E319 PolarHBondContact O-N 3.43Å; L317-E319 VanDerWaalsContact C-N 3.35Å; L317-E319 PolarHBondContact O-N 3.05Å; E319-V321 VanDerWaalsContact C-N 3.35Å; E319-V321 PolarHBondContact O-N 3.18Å; E319-K322 PolarHBondContact O-N 2.68Å; E319-K322 IonicContact OE1-NZ 3.62Å; E319-K322 PolarHBondContact OE1-NZ 3.16Å; E319-R323 WeakPolarHBondContact O-CB 3.49Å; E319-R323 PolarHBondContact O-N 3.2Å
320	M	88.1	Confident	82.7	Confident	106 Å²	106	78.6 Å²	78.6	52%	0.522	42%	0.42	S	S	.	.	H	α-helix	trans	-63.4	-40.1	174.6	-75.6	178.5	72.4	0	0	112.1	I316 L317 R323 K324	I316-M320 HydrophobicContact CG2-CG 4.22Å; I316-M320 HydrophobicContact CG2-SD 3.81Å; I316-M320 WeakPolarHBondContact O-CB 3.25Å; I316-M320 WeakPolarHBondContact O-CG 3.38Å; I316-M320 PolarHBondContact O-N 3.27Å; L317-M320 PolarHBondContact O-N 3.49Å; M320-R323 PolarHBondContact O-N 2.93Å; M320-K324 PolarHBondContact O-N 3.41Å
321	V	88	Confident	81.4	Confident	82 Å²	82	82.7 Å²	82.7	50%	0.497	43%	0.43	S	S	.	.	H	α-helix	trans	-62.8	-48.4	175.9	168.3	0	0	0	0	110.2	L317 A318 E319 R323 K324 L325	L317-V321 VanDerWaalsContact O-CG2 3.29Å; L317-V321 WeakPolarHBondContact O-CG2 3.41Å; L317-V321 PolarHBondContact O-N 3.47Å; A318-V321 PolarHBondContact O-N 2.94Å; E319-V321 VanDerWaalsContact C-N 3.35Å; E319-V321 PolarHBondContact O-N 3.18Å; V321-R323 PolarHBondContact O-N 3.39Å; V321-K324 PolarHBondContact O-N 2.86Å; V321-L325 HydrophobicContact CG1-CD1 3.74Å; V321-L325 HydrophobicContact CG1-CG 4.36Å; V321-L325 WeakPolarHBondContact O-CB 3.37Å; V321-L325 WeakPolarHBondContact O-CG 3.44Å; V321-L325 PolarHBondContact O-N 2.96Å
322	K	85.9	Confident	80.2	Confident	35 Å²	35	88 Å²	88	15%	0.152	45%	0.453	C	S	.	.	H	α-helix	trans	-57.3	-47.9	175.3	-68.3	172.6	-169.6	170.8	0	111.4	L246 S248 A318 E319 K324 L325 F326	L246-K322 WeakPolarHBondContact O-CD 3.29Å; L246-K322 VanDerWaalsContact O-CE 3.25Å; L246-K322 WeakPolarHBondContact O-CE 3.37Å; S248-K322 PolarHBondContact O-NZ 3.36Å; A318-K322 WeakPolarHBondContact O-CG 3.1Å; A318-K322 PolarHBondContact O-N 3.42Å; A318-K322 VanDerWaalsContact O-N 3.07Å; E319-K322 PolarHBondContact O-N 2.68Å; E319-K322 IonicContact OE1-NZ 3.62Å; E319-K322 PolarHBondContact OE1-NZ 3.16Å; K322-K324 PolarHBondContact O-N 3.1Å; K322-L325 PolarHBondContact O-N 2.56Å; K322-F326 HydrophobicContact CB-CD2 4.34Å; K322-F326 WeakPolarHBondContact O-CD2 3.49Å; K322-F326 PolarHBondContact O-N 2.97Å
323	R	85.8	Confident	78.8	Confident	177 Å²	177	93.2 Å²	93.2	67%	0.668	47%	0.473	S	S	*	.	H	α-helix	trans	-61.2	-42.5	179.6	-168.4	173	179.9	-179.9	-0.2	111.9	E319 M320 V321 V327 S328	E319-R323 WeakPolarHBondContact O-CB 3.49Å; E319-R323 PolarHBondContact O-N 3.2Å; M320-R323 PolarHBondContact O-N 2.93Å; V321-R323 PolarHBondContact O-N 3.39Å; R323-V327 HydrophobicContact CG-CB 4Å; R323-V327 HydrophobicContact CG-CG2 3.92Å; R323-V327 WeakPolarHBondContact O-CA 3.29Å; R323-V327 VanDerWaalsContact O-CB 3.23Å; R323-V327 WeakPolarHBondContact O-CB 3.4Å; R323-V327 PolarHBondContact O-N 3.26Å; R323-S328 PolarHBondContact O-N 3.45Å
324	K	87.8	Confident	77.2	Confident	152 Å²	152	94.4 Å²	94.4	66%	0.661	48%	0.48	S	S	*	.	H	α-helix	trans	-64.4	-44.7	174.7	-82.8	-159	175.5	-174.8	0	112.2	M320 V321 K322 F326 S328	M320-K324 PolarHBondContact O-N 3.41Å; V321-K324 PolarHBondContact O-N 2.86Å; K322-K324 PolarHBondContact O-N 3.1Å; K324-F326 PolarHBondContact O-N 2.92Å; K324-S328 WeakPolarHBondContact O-CB 3.5Å; K324-S328 PolarHBondContact O-OG 2.88Å
325	L	85.7	Confident	75.8	Confident	85 Å²	85	96.1 Å²	96.1	45%	0.445	48%	0.484	S	S	.	.	H	α-helix	trans	-63	-42.4	-179	-75.2	170.4	0	0	0	112.3	V321 K322 L329	V321-L325 HydrophobicContact CG1-CD1 3.74Å; V321-L325 HydrophobicContact CG1-CG 4.36Å; V321-L325 WeakPolarHBondContact O-CB 3.37Å; V321-L325 WeakPolarHBondContact O-CG 3.44Å; V321-L325 PolarHBondContact O-N 2.96Å; K322-L325 PolarHBondContact O-N 2.56Å; L325-L329 WeakPolarHBondContact O-CD1 3.46Å
326	F	84.7	Confident	74.6	Confident	122 Å²	122	100 Å²	100	54%	0.535	50%	0.504	S	S	.	.	H	α-helix	trans	-106.2	-34.4	-169.1	-57.5	-63.9	0	0	0	114.9	L246 K322 K324	L246-F326 HydrophobicContact CB-CE2 4.23Å; L246-F326 HydrophobicContact CB-CZ 4.09Å; L246-F326 HydrophobicContact CD1-CZ 3.92Å; K322-F326 HydrophobicContact CB-CD2 4.34Å; K322-F326 WeakPolarHBondContact O-CD2 3.49Å; K322-F326 PolarHBondContact O-N 2.97Å; K324-F326 PolarHBondContact O-N 2.92Å
327	V	81.6	Confident	73.1	Confident	68 Å²	68	100.5 Å²	100.5	41%	0.412	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-42.5	-175.4	-177	0	0	0	0	111.6	R323 L329 G330 E331	R323-V327 HydrophobicContact CG-CB 4Å; R323-V327 HydrophobicContact CG-CG2 3.92Å; R323-V327 WeakPolarHBondContact O-CA 3.29Å; R323-V327 VanDerWaalsContact O-CB 3.23Å; R323-V327 WeakPolarHBondContact O-CB 3.4Å; R323-V327 PolarHBondContact O-N 3.26Å; V327-L329 PolarHBondContact O-N 3.23Å; V327-G330 PolarHBondContact O-N 2.75Å; V327-E331 PolarHBondContact O-N 2.77Å
328	S	73.1	Confident	71.5	Confident	48 Å²	48	98.1 Å²	98.1	34%	0.336	50%	0.504	S	S	.	.	H	α-helix	trans	-66.7	-21.3	-175.8	80.9	0	0	0	0	113.9	R323 K324 G330 K332	R323-S328 PolarHBondContact O-N 3.45Å; K324-S328 WeakPolarHBondContact O-CB 3.5Å; K324-S328 PolarHBondContact O-OG 2.88Å; S328-G330 VanDerWaalsContact C-N 3.35Å; S328-K332 PolarHBondContact O-N 3.09Å
329	L	62.8	Low	70.1	Confident	122 Å²	122	99.6 Å²	99.6	64%	0.639	51%	0.512	S	S	*	.	H	α-helix	trans	-69.4	-32.4	171.5	-73	173.1	0	0	0	112.4	L325 V327 K333	L325-L329 WeakPolarHBondContact O-CD1 3.46Å; V327-L329 PolarHBondContact O-N 3.23Å; L329-K333 PolarHBondContact O-N 3.19Å
330	G	60.2	Low	68.7	Low	38 Å²	38	100.4 Å²	100.4	39%	0.392	52%	0.519	S	S	.	.	H	α-helix	trans	-70.3	-42.9	176.3	0	0	0	0	0	112.1	V327 S328 K332 K333 V334	V327-G330 PolarHBondContact O-N 2.75Å; S328-G330 VanDerWaalsContact C-N 3.35Å; G330-K332 PolarHBondContact O-N 3.36Å; G330-K333 PolarHBondContact O-N 3.32Å; G330-V334 WeakPolarHBondContact O-CG2 3.35Å; G330-V334 PolarHBondContact O-N 3.47Å
331	E	61.9	Low	67.1	Low	118 Å²	118	100.6 Å²	100.6	55%	0.551	52%	0.522	S	S	*	.	H	α-helix	trans	-63.1	-44.3	-179	-68	174.3	166.5	0	0	111.9	V327 K333 V334 E335	V327-E331 PolarHBondContact O-N 2.77Å; E331-K333 VanDerWaalsContact C-N 3.31Å; E331-K333 PolarHBondContact O-N 2.96Å; E331-V334 PolarHBondContact O-N 2.95Å; E331-E335 PolarHBondContact O-N 2.8Å; E331-E335 VanDerWaalsContact O-N 3.1Å
332	K	58.5	Low	65.4	Low	141 Å²	141	106.2 Å²	106.2	61%	0.613	53%	0.534	S	S	*	.	H	α-helix	trans	-63.9	-33.2	174.5	-78.8	-174.2	175.5	-177.1	0	113.4	S328 G330 I336	S328-K332 PolarHBondContact O-N 3.09Å; G330-K332 PolarHBondContact O-N 3.36Å; K332-I336 WeakPolarHBondContact O-CD1 3.38Å; K332-I336 VanDerWaalsContact O-CG1 3.24Å; K332-I336 WeakPolarHBondContact O-CG1 3.45Å; K332-I336 PolarHBondContact O-N 3.48Å; K332-I336 VanDerWaalsContact O-N 3.12Å
333	K	53.9	Low	63.9	Low	144 Å²	144	107.7 Å²	107.7	63%	0.626	55%	0.553	S	S	*	*	H	α-helix	trans	-72.9	-34.7	179.7	-160.4	176.4	-178.1	-176.7	0	111.6	L329 G330 E331 L337	L329-K333 PolarHBondContact O-N 3.19Å; G330-K333 PolarHBondContact O-N 3.32Å; E331-K333 VanDerWaalsContact C-N 3.31Å; E331-K333 PolarHBondContact O-N 2.96Å; K333-L337 HydrophobicContact CG-CD1 4.39Å; K333-L337 WeakPolarHBondContact O-CG 3.49Å; K333-L337 PolarHBondContact O-N 3.03Å; K333-L337 VanDerWaalsContact O-N 3.1Å
334	V	56.8	Low	62.3	Low	104 Å²	104	107.1 Å²	107.1	63%	0.63	56%	0.558	S	S	*	*	H	α-helix	trans	-68.5	-39.8	173.6	174.6	0	0	0	0	111.2	G330 E331 L337 G338	G330-V334 WeakPolarHBondContact O-CG2 3.35Å; G330-V334 PolarHBondContact O-N 3.47Å; E331-V334 PolarHBondContact O-N 2.95Å; V334-L337 PolarHBondContact O-N 2.93Å; V334-G338 PolarHBondContact O-N 3.44Å
335	E	53.9	Low	60.7	Low	137 Å²	137	109.7 Å²	109.7	64%	0.64	57%	0.565	S	S	*	*	H	α-helix	trans	-63	-41.3	174	-77.5	-177.4	155.5	0	0	112.8	E331 S339	E331-E335 PolarHBondContact O-N 2.8Å; E331-E335 VanDerWaalsContact O-N 3.1Å; E335-S339 WeakPolarHBondContact O-CB 3.31Å; E335-S339 PolarHBondContact O-N 3.19Å; E335-S339 VanDerWaalsContact O-N 3.1Å; E335-S339 PolarHBondContact O-OG 3.03Å
336	I	56.2	Low	59.1	Low	109 Å²	109	112.7 Å²	112.7	56%	0.559	58%	0.581	S	S	*	*	H	α-helix	trans	-67.7	-40.2	178.8	-67.5	165.5	0	0	0	111.3	K332 S339 N340	K332-I336 WeakPolarHBondContact O-CD1 3.38Å; K332-I336 VanDerWaalsContact O-CG1 3.24Å; K332-I336 WeakPolarHBondContact O-CG1 3.45Å; K332-I336 PolarHBondContact O-N 3.48Å; K332-I336 VanDerWaalsContact O-N 3.12Å; I336-S339 PolarHBondContact O-N 3.37Å; I336-N340 PolarHBondContact O-N 2.95Å
337	L	53.1	Low	57	Low	103 Å²	103	118.7 Å²	118.7	54%	0.539	61%	0.611	S	S	.	*	H	α-helix	trans	-69.5	-42.1	177.5	-71.8	166.7	0	0	0	112.1	K333 V334 S339 N340 D341	K333-L337 HydrophobicContact CG-CD1 4.39Å; K333-L337 WeakPolarHBondContact O-CG 3.49Å; K333-L337 PolarHBondContact O-N 3.03Å; K333-L337 VanDerWaalsContact O-N 3.1Å; V334-L337 PolarHBondContact O-N 2.93Å; L337-S339 PolarHBondContact O-N 2.92Å; L337-N340 PolarHBondContact O-N 3.26Å; L337-D341 PolarHBondContact O-N 3.44Å
338	G	54.7	Low	55.8	Low	38 Å²	38	121.3 Å²	121.3	39%	0.392	62%	0.621	S	S	.	*	H	α-helix	trans	-68.4	-17.5	175.9	0	0	0	0	0	114.5	V334	V334-G338 PolarHBondContact O-N 3.44Å
339	S	56	Low	54.9	Low	76 Å²	76	125.1 Å²	125.1	53%	0.531	64%	0.636	S	S	.	*	H	α-helix	trans	-82.1	-35.1	174.5	-56.8	0	0	0	0	112.3	E335 I336 L337 R342	E335-S339 WeakPolarHBondContact O-CB 3.31Å; E335-S339 PolarHBondContact O-N 3.19Å; E335-S339 VanDerWaalsContact O-N 3.1Å; E335-S339 PolarHBondContact O-OG 3.03Å; I336-S339 PolarHBondContact O-N 3.37Å; L337-S339 PolarHBondContact O-N 2.92Å; S339-R342 PolarHBondContact O-N 3.38Å
340	N	54.4	Low	54.5	Low	104 Å²	104	125.3 Å²	125.3	56%	0.556	64%	0.636	S	S	*	*	H	α-helix	trans	-72.7	-37.5	177.2	-83.1	-3	0	0	0	112.4	I336 L337 R342 A343	I336-N340 PolarHBondContact O-N 2.95Å; L337-N340 PolarHBondContact O-N 3.26Å; N340-R342 PolarHBondContact O-N 3.04Å; N340-A343 PolarHBondContact O-N 3.28Å
341	D	54	Low	54.1	Low	109 Å²	109	130.4 Å²	130.4	58%	0.583	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-20.2	176.5	-74.1	-16.2	0	0	0	113.1	L337	L337-D341 PolarHBondContact O-N 3.44Å
342	R	53.1	Low	53.6	Low	201 Å²	201	131.2 Å²	131.2	76%	0.758	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-15.6	173.8	-79.1	-177.1	174.8	167.8	0.6	113.9	S339 N340	S339-R342 PolarHBondContact O-N 3.38Å; N340-R342 PolarHBondContact O-N 3.04Å
343	A	54.1	Low	53.3	Low	66 Å²	66	130.5 Å²	130.5	55%	0.545	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.5	-31.2	177.5	0	0	0	0	0	112	N340 Y345	N340-A343 PolarHBondContact O-N 3.28Å; A343-Y345 VanDerWaalsContact C-N 3.31Å; A343-Y345 PolarHBondContact O-N 3.22Å
344	E	51.5	Low	53.3	Low	165 Å²	165	129.6 Å²	129.6	77%	0.771	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-7.4	179.1	-73.7	-172.1	167.3	0	0	114.6
345	Y	53.8	Low	53	Low	205 Å²	205	131.5 Å²	131.5	80%	0.804	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	8.8	177.9	-93.4	-82.2	0	0	0	114.6	A343	A343-Y345 VanDerWaalsContact C-N 3.31Å; A343-Y345 PolarHBondContact O-N 3.22Å
346	N	52.8	Low	52.9	Low	148 Å²	148	131.1 Å²	131.1	79%	0.791	67%	0.666	S	S	*	*			trans	-122.1	17.2	-179.2	-80.9	-43.4	0	0	0	114.7
347	E	41.2	Very low	52.6	Low	249 Å²	249	133.1 Å²	133.1	100%	1.164	68%	0.676	S	S	*	*			trans	-109	0	160.4	-75	-172.2	164.1	0	0	109.7

Retrieved 347 of 347 residues in 370.8 ms (Link to these results)

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