A0A096NRX9_PAPAN Loading...

Potassium channel tetramerization domain containing 16

Auxiliary subunit of GABA-B receptors that determine the pharmacology and kinetics of the receptor response. Increases agonist potency and markedly alter the G-protein signaling of the receptors by accelerating onset and promoting desensitization.

AlphaFold DB , UniProt , Accession A0A096NRX9, Species PAPAN (Papio anubis, Olive baboon), Gene KCTD16, Length 318 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	36.2	Very low	35.9	Very low	244 Å²	244	152.4 Å²	152.4	100%	1.202	83%	0.832	S	S	*	*				0	109.7	0	-67.5	-172.5	-165.4	0	0	107.5
2	A	36.8	Very low	36.4	Very low	106 Å²	106	149.8 Å²	149.8	88%	0.876	83%	0.829	S	S	*	*			trans	-84.7	129.1	179.7	0	0	0	0	0	109.4	S4	A2-S4 PolarHBondContact O-N 2.72Å
3	L	37.8	Very low	36.3	Very low	179 Å²	179	156.8 Å²	156.8	94%	0.937	84%	0.835	S	S	*	*			trans	-83.4	110.3	176.2	-69.4	171.4	0	0	0	109.2
4	S	38.8	Very low	37.2	Very low	106 Å²	106	158.4 Å²	158.4	74%	0.741	84%	0.835	S	S	*	*			trans	-74.6	115.6	168.4	173.4	0	0	0	0	109.4	A2 N6	A2-S4 PolarHBondContact O-N 2.72Å; S4-N6 PolarHBondContact O-N 3.07Å
5	G	37.6	Very low	37.1	Very low	78 Å²	78	161 Å²	161	80%	0.804	84%	0.841	S	S	*	*			trans	-83.6	104	169	0	0	0	0	0	110.9
6	N	40.1	Very low	36.8	Very low	152 Å²	152	155.6 Å²	155.6	81%	0.813	84%	0.836	S	S	*	*			trans	-73.4	134	163.8	-82	11.3	0	0	0	109.8	S4	S4-N6 PolarHBondContact O-N 3.07Å
7	C	30.6	Very low	37.3	Very low	128 Å²	128	153.2 Å²	153.2	87%	0.865	84%	0.843	S	S	*	*			trans	-140.9	100.8	151	-165	0	0	0	0	111.3
8	S	32.9	Very low	37.5	Very low	88 Å²	88	149.8 Å²	149.8	62%	0.615	84%	0.839	S	S	*	*			trans	43.7	108.7	142.5	-138	0	0	0	0	121	Y10	S8-Y10 PolarHBondContact O-N 2.86Å
9	R	37.3	Very low	37.8	Very low	203 Å²	203	148.4 Å²	148.4	77%	0.766	83%	0.834	S	S	*	*			trans	-52.9	124.9	151.5	-87.8	172.1	166.1	174.6	-0	110.4	Y11	R9-Y11 HydrophobicContact CB-CD2 4.48Å; R9-Y11 HydrophobicContact CG-CE2 4.37Å
10	Y	33.1	Very low	38.2	Very low	213 Å²	213	146.7 Å²	146.7	84%	0.835	83%	0.829	S	S	*	*			trans	-97.2	108.8	157.1	-80.4	-88.1	0	0	0	108.5	S8	S8-Y10 PolarHBondContact O-N 2.86Å
11	Y	33.1	Very low	38.9	Very low	179 Å²	179	144.6 Å²	144.6	70%	0.702	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-101	122.4	156.7	-75.5	-71.7	0	0	0	107.8	R9	R9-Y11 HydrophobicContact CB-CD2 4.48Å; R9-Y11 HydrophobicContact CG-CE2 4.37Å
12	P	42.3	Very low	40.6	Very low	122 Å²	122	136 Å²	136	79%	0.792	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-79.1	143.3	160.8	-11.1	28.5	0	0	0	110.8
13	R	35.2	Very low	42.6	Very low	240 Å²	240	131.9 Å²	131.9	91%	0.906	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-73.7	137.8	-172.5	-165.8	176.6	-173.5	168.6	0.2	111.4
14	E	48.2	Very low	44.8	Very low	180 Å²	180	127.3 Å²	127.3	84%	0.841	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-72.2	138.3	177.5	-63.6	-156.7	155.3	0	0	113.4
15	Q	37	Very low	47.3	Very low	197 Å²	197	129.1 Å²	129.1	92%	0.921	72%	0.72	S	S	*	*			trans	-168.7	110.7	144.4	-104.3	147.8	21.2	0	0	111
16	G	31.1	Very low	49.9	Very low	74 Å²	74	129.3 Å²	129.3	76%	0.763	71%	0.705	S	S	*	*	S	Bend	trans	151.2	97.7	172.3	0	0	0	0	0	111.3	A18	G16-A18 PolarHBondContact O-N 3.13Å; G16-A18 VanDerWaalsContact O-N 3.15Å
17	A	46.5	Very low	52.5	Low	115 Å²	115	122.1 Å²	122.1	95%	0.95	67%	0.667	S	S	*	*			trans	-52.6	114.1	-176.9	0	0	0	0	0	112.9
18	A	39.7	Very low	55.6	Low	93 Å²	93	120.1 Å²	120.1	77%	0.769	65%	0.645	S	S	*	*			trans	-144.1	135.1	163.9	0	0	0	0	0	109.3	G16	G16-A18 PolarHBondContact O-N 3.13Å; G16-A18 VanDerWaalsContact O-N 3.15Å
19	V	44.5	Very low	58.6	Low	123 Å²	123	115.9 Å²	115.9	75%	0.745	62%	0.615	S	S	*	*			trans	-42.2	140.8	-177.6	-163.7	0	0	0	0	112	N21	V19-N21 PolarHBondContact O-N 3.3Å
20	P	46	Very low	61.4	Low	114 Å²	114	107 Å²	107	74%	0.74	58%	0.583	S	S	*	*			trans	-66.5	106.3	178.8	4.2	6.3	0	0	0	108.9	S22	P20-S22 PolarHBondContact O-N 3.15Å
21	N	51.6	Low	64.5	Low	103 Å²	103	96.8 Å²	96.8	55%	0.551	54%	0.543	S	S	*	.			trans	-62.4	121.8	166.9	-82.7	-17.1	0	0	0	107.6	V19 F23	V19-N21 PolarHBondContact O-N 3.3Å; N21-F23 PolarHBondContact O-N 3.33Å
22	S	73.1	Confident	67.3	Low	64 Å²	64	90.6 Å²	90.6	45%	0.448	53%	0.533	S	S	.	.	S	Bend	trans	-69.3	3.4	-175.1	55.6	0	0	0	0	114.8	P20	P20-S22 PolarHBondContact O-N 3.15Å
23	F	77.4	Confident	69.7	Low	18 Å²	18	87.4 Å²	87.4	8%	0.079	52%	0.522	C	S	.	.	S	Bend	trans	-127.5	144.7	-175.9	-67.9	-81.5	0	0	0	110.6	N21 H40 F55 A62 F73	N21-F23 PolarHBondContact O-N 3.33Å; F23-H40 WeakPolarHBondContact CB-CD2 3.38Å; F23-H40 AromaticContact CD2-CD2 3.86Å; F23-H40 AromaticContact CD2-NE2 3.5Å; F23-H40 AromaticContact CG-CD2 3.77Å; F23-H40 AromaticContact CG-NE2 3.92Å; F23-F55 AromaticContact CD1-CD1 3.88Å; F23-F55 HydrophobicContact CD1-CD1 3.88Å; F23-F55 HydrophobicContact CD1-CE1 4.36Å; F23-F55 AromaticContact CE1-CD1 3.73Å; F23-F55 HydrophobicContact CE1-CD1 3.73Å; F23-F55 HydrophobicContact CE1-CE1 4.17Å; F23-F55 WeakPolarHBondContact CE2-O 3.39Å; F23-F55 HydrophobicContact CG-CD1 4.4Å; F23-F55 HydrophobicContact CZ-CD1 4.15Å; F23-A62 HydrophobicContact CE1-CB 4.28Å; F23-A62 HydrophobicContact CE2-CB 4.41Å; F23-A62 HydrophobicContact CZ-CB 3.7Å; F23-F73 HydrophobicContact CD1-CZ 4.18Å; F23-F73 HydrophobicContact CE1-CE1 4.43Å; F23-F73 AromaticContact CE1-CZ 3.91Å; F23-F73 HydrophobicContact CE1-CZ 3.91Å
24	P	85.4	Confident	72.6	Confident	83 Å²	83	79.6 Å²	79.6	54%	0.539	50%	0.496	S	S	.	.			trans	-62.3	154.3	174.4	28	-34.6	0	0	0	111	V26 V27	P24-V26 VanDerWaalsContact C-N 3.25Å; P24-V26 WeakPolarHBondContact CG-O 3.42Å; P24-V26 PolarHBondContact O-N 2.63Å; P24-V27 HydrophobicContact CG-CG2 4.46Å
25	E	89.6	Confident	74.9	Confident	145 Å²	145	72.9 Å²	72.9	68%	0.678	47%	0.467	S	S	*	.	S	Bend	trans	-57.2	-41.5	179.2	-175	-176.9	174.2	0	0	111.8	R39 H40	E25-R39 CarbonylContact O-C 3.5Å; E25-R39 WeakPolarHBondContact O-CA 3.38Å; E25-H40 PolarHBondContact O-N 3.49Å
26	V	94.2	Very high	77.8	Confident	81 Å²	81	65.1 Å²	65.1	49%	0.491	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.6	173.9	-179	0	0	0	0	109	P24 F37 T38	P24-V26 VanDerWaalsContact C-N 3.25Å; P24-V26 WeakPolarHBondContact CG-O 3.42Å; P24-V26 PolarHBondContact O-N 2.63Å; V26-F37 HydrophobicContact CG1-CD1 4.47Å; V26-T38 WeakPolarHBondContact CA-O 3.22Å
27	V	93.9	Very high	80.9	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.006	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	134	-178.4	-179	0	0	0	0	109.5	P24 L29 T38 H40 L43 F55 F73	P24-V27 HydrophobicContact CG-CG2 4.46Å; V27-L29 HydrophobicContact CG1-CD2 3.87Å; V27-T38 PolarHBondContact N-O 3.24Å; V27-T38 PolarHBondContact O-N 2.9Å; V27-T38 VanDerWaalsContact O-N 3.13Å; V27-H40 HydrophobicContact CG2-CB 4.08Å; V27-L43 HydrophobicContact CB-CD1 3.98Å; V27-L43 HydrophobicContact CG1-CD1 3.91Å; V27-L43 HydrophobicContact CG2-CD1 4.28Å; V27-F55 HydrophobicContact CG1-CD1 4.4Å; V27-F55 HydrophobicContact CG1-CE1 3.67Å; V27-F55 HydrophobicContact CG1-CZ 4.13Å; V27-F73 HydrophobicContact CG1-CD2 3.72Å; V27-F73 HydrophobicContact CG1-CE2 3.94Å
28	E	95.1	Very high	83.2	Confident	86 Å²	86	62 Å²	62	40%	0.402	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.1	174.4	-57.4	-168.6	-159	0	0	111	F37 R72 F73	E28-F37 HydrophobicContact CB-CE1 4.48Å; E28-F37 HydrophobicContact CG-CD1 3.71Å; E28-F37 HydrophobicContact CG-CE1 3.45Å; E28-F37 VanDerWaalsContact CG-CE1 3.45Å; E28-F37 HydrophobicContact CG-CZ 4.29Å; E28-R72 HydrophobicContact CB-CB 4.26Å; E28-R72 HydrophobicContact CB-CG 3.9Å; E28-R72 VanDerWaalsContact OE2-CD 3.29Å; E28-R72 WeakPolarHBondContact OE2-CD 3.47Å; E28-R72 WeakPolarHBondContact OE2-CG 3.34Å; E28-F73 PolarHBondContact O-N 3.29Å
29	L	96.3	Very high	85.9	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.4	178.1	-53.9	179.7	0	0	0	110	V27 V31 V35 Y36 T38 L43 F55 F73 F82	V27-L29 HydrophobicContact CG1-CD2 3.87Å; L29-V31 HydrophobicContact CB-CG2 4.28Å; L29-V35 CarbonylContact O-C 3.52Å; L29-V35 VanDerWaalsContact O-CA 3.31Å; L29-V35 WeakPolarHBondContact O-CA 3.3Å; L29-Y36 PolarHBondContact N-O 3.21Å; L29-Y36 PolarHBondContact O-N 3.2Å; L29-T38 HydrophobicContact CD1-CG2 4.37Å; L29-L43 HydrophobicContact CD1-CD1 4.37Å; L29-L43 HydrophobicContact CD1-CD2 3.86Å; L29-L43 HydrophobicContact CD2-CD1 4.37Å; L29-F55 HydrophobicContact CD2-CE1 4.43Å; L29-F55 HydrophobicContact CD2-CE2 4.07Å; L29-F55 HydrophobicContact CD2-CZ 3.55Å; L29-F73 CarbonylContact C-O 3.54Å; L29-F73 WeakPolarHBondContact CA-O 3.49Å; L29-F73 HydrophobicContact CD2-CB 3.87Å; L29-F73 HydrophobicContact CD2-CD2 4.46Å; L29-F82 HydrophobicContact CD1-CE1 4.05Å; L29-F82 HydrophobicContact CD1-CZ 3.88Å
30	N	96.6	Very high	88.2	Confident	15 Å²	15	59.3 Å²	59.3	8%	0.08	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	107.5	167.4	179.3	-6.3	0	0	0	108.4	G33 D68 R72 F73 F74 I75	N30-G33 WeakPolarHBondContact OD1-CA 3.49Å; N30-G33 PolarHBondContact OD1-N 2.92Å; N30-D68 PolarHBondContact ND2-OD2 3.17Å; N30-R72 HydrophobicContact CB-CB 4.42Å; N30-F73 PolarHBondContact N-O 3.04Å; N30-F74 HydrophobicContact CB-CD2 4.16Å; N30-F74 CarbonylContact O-C 3.54Å; N30-F74 WeakPolarHBondContact O-CA 3.24Å; N30-F74 WeakPolarHBondContact O-CD2 3.36Å; N30-I75 PolarHBondContact O-N 2.9Å
31	V	97	Very high	90.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	102.3	-177.2	-170.4	0	0	0	0	108.9	L29 G33 Q34 Y36 I75 R77 G79 F82	L29-V31 HydrophobicContact CB-CG2 4.28Å; V31-G33 PolarHBondContact O-N 3.17Å; V31-G33 VanDerWaalsContact O-N 3.09Å; V31-Q34 PolarHBondContact N-O 2.71Å; V31-Q34 PolarHBondContact O-N 3.17Å; V31-Y36 HydrophobicContact CB-CD2 4.5Å; V31-Y36 HydrophobicContact CG2-CD2 4.18Å; V31-I75 CarbonylContact C-O 3.56Å; V31-I75 VanDerWaalsContact CA-O 3.3Å; V31-I75 WeakPolarHBondContact CA-O 3.37Å; V31-I75 HydrophobicContact CG1-CB 4.26Å; V31-I75 HydrophobicContact CG1-CG2 4.23Å; V31-I75 HydrophobicContact CG2-CB 4.2Å; V31-I75 HydrophobicContact CG2-CD1 4.24Å; V31-R77 CarbonylContact C-O 3.54Å; V31-R77 HydrophobicContact CG1-CB 3.98Å; V31-G79 VanDerWaalsContact O-CA 3.22Å; V31-G79 WeakPolarHBondContact O-CA 3.2Å; V31-F82 HydrophobicContact CB-CB 4.43Å; V31-F82 HydrophobicContact CB-CD1 4.46Å; V31-F82 HydrophobicContact CB-CG 4.31Å; V31-F82 HydrophobicContact CG1-CB 3.97Å; V31-F82 HydrophobicContact CG1-CD2 4.22Å; V31-F82 HydrophobicContact CG1-CG 4.04Å; V31-F82 HydrophobicContact CG2-CD1 3.79Å; V31-F82 HydrophobicContact CG2-CD2 4.26Å; V31-F82 HydrophobicContact CG2-CE1 3.95Å; V31-F82 HydrophobicContact CG2-CE2 4.41Å; V31-F82 HydrophobicContact CG2-CG 3.94Å; V31-F82 HydrophobicContact CG2-CZ 4.26Å
32	G	93.7	Very high	92.6	Very high	48 Å²	48	53.1 Å²	53.1	50%	0.495	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	27	-179.4	0	0	0	0	0	114.7	I75 R77	G32-I75 PolarHBondContact N-O 2.77Å; G32-R77 WeakPolarHBondContact CA-O 3.48Å; G32-R77 PolarHBondContact N-O 3.1Å
33	G	91.3	Very high	93.6	Very high	55 Å²	55	50.1 Å²	50.1	57%	0.567	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.6	-14.8	-175.7	0	0	0	0	0	114.8	N30 V31	N30-G33 WeakPolarHBondContact OD1-CA 3.49Å; N30-G33 PolarHBondContact OD1-N 2.92Å; V31-G33 PolarHBondContact O-N 3.17Å; V31-G33 VanDerWaalsContact O-N 3.09Å
34	Q	95.8	Very high	94.4	Very high	76 Å²	76	51.7 Å²	51.7	36%	0.355	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	127.3	175.9	-173.5	57.4	60.1	0	0	110.9	V31 Y36	V31-Q34 PolarHBondContact N-O 2.71Å; V31-Q34 PolarHBondContact O-N 3.17Å; Q34-Y36 HydrophobicContact CB-CE2 3.89Å; Q34-Y36 HydrophobicContact CG-CD2 4.1Å; Q34-Y36 HydrophobicContact CG-CE2 3.3Å
35	V	96.8	Very high	94.7	Very high	39 Å²	39	49.4 Å²	49.4	24%	0.236	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132.4	-176.5	-175.3	0	0	0	0	110.5	L29 F37 R72	L29-V35 CarbonylContact O-C 3.52Å; L29-V35 VanDerWaalsContact O-CA 3.31Å; L29-V35 WeakPolarHBondContact O-CA 3.3Å; V35-F37 HydrophobicContact CG1-CD2 4.48Å; V35-F37 HydrophobicContact CG1-CE2 3.83Å; V35-F37 HydrophobicContact CG1-CZ 4.27Å; V35-R72 VanDerWaalsContact CG2-NH1 3.28Å
36	Y	97.4	Very high	94.9	Very high	34 Å²	34	43.8 Å²	43.8	13%	0.133	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	143.9	176.9	-72.1	-85.1	0	0	0	111.3	L29 V31 Q34 G79 F82 R83 L86	L29-Y36 PolarHBondContact N-O 3.21Å; L29-Y36 PolarHBondContact O-N 3.2Å; V31-Y36 HydrophobicContact CB-CD2 4.5Å; V31-Y36 HydrophobicContact CG2-CD2 4.18Å; Q34-Y36 HydrophobicContact CB-CE2 3.89Å; Q34-Y36 HydrophobicContact CG-CD2 4.1Å; Q34-Y36 HydrophobicContact CG-CE2 3.3Å; Y36-G79 WeakPolarHBondContact CE2-O 3.26Å; Y36-G79 PolarHBondContact OH-O 3.49Å; Y36-F82 HydrophobicContact CD1-CD1 4.35Å; Y36-F82 AromaticContact CD2-CD1 3.57Å; Y36-F82 HydrophobicContact CD2-CD1 3.57Å; Y36-F82 HydrophobicContact CD2-CE1 4.11Å; Y36-F82 HydrophobicContact CE1-CD1 4.49Å; Y36-F82 HydrophobicContact CE2-CB 4.22Å; Y36-F82 AromaticContact CE2-CD1 3.71Å; Y36-F82 HydrophobicContact CE2-CD1 3.71Å; Y36-F82 HydrophobicContact CE2-CG 4.42Å; Y36-F82 AromaticContact CG-CD1 3.92Å; Y36-F82 HydrophobicContact CG-CD1 3.92Å; Y36-F82 HydrophobicContact CG-CE1 4.14Å; Y36-R83 HydrophobicContact CE1-CB 4.4Å; Y36-L86 HydrophobicContact CD1-CD2 3.81Å; Y36-L86 HydrophobicContact CG-CD2 4.36Å
37	F	96.4	Very high	94.7	Very high	116 Å²	116	43.7 Å²	43.7	51%	0.509	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.6	171.4	-64.2	-99	0	0	0	108.4	V26 E28 V35 R90	V26-F37 HydrophobicContact CG1-CD1 4.47Å; E28-F37 HydrophobicContact CB-CE1 4.48Å; E28-F37 HydrophobicContact CG-CD1 3.71Å; E28-F37 HydrophobicContact CG-CE1 3.45Å; E28-F37 VanDerWaalsContact CG-CE1 3.45Å; E28-F37 HydrophobicContact CG-CZ 4.29Å; V35-F37 HydrophobicContact CG1-CD2 4.48Å; V35-F37 HydrophobicContact CG1-CE2 3.83Å; V35-F37 HydrophobicContact CG1-CZ 4.27Å; F37-R90 PolarHBondContact O-NH2 2.81Å
38	T	96.3	Very high	94.4	Very high	8 Å²	8	50 Å²	50	5%	0.049	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	170.6	177.3	-164.3	0	0	0	0	111.3	V26 V27 L29 T42 L43 L86	V26-T38 WeakPolarHBondContact CA-O 3.22Å; V27-T38 PolarHBondContact N-O 3.24Å; V27-T38 PolarHBondContact O-N 2.9Å; V27-T38 VanDerWaalsContact O-N 3.13Å; L29-T38 HydrophobicContact CD1-CG2 4.37Å; T38-T42 WeakPolarHBondContact OG1-CB 3.33Å; T38-L43 HydrophobicContact CG2-CD1 3.91Å; T38-L43 HydrophobicContact CG2-CD2 3.72Å; T38-L43 HydrophobicContact CG2-CG 3.7Å; T38-L86 HydrophobicContact CG2-CD1 4.11Å
39	R	95.1	Very high	94.3	Very high	149 Å²	149	46 Å²	46	56%	0.562	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	146.5	176.3	-64.6	-179	179.9	179.1	-1.4	110.5	E25 S41 T42 L43	E25-R39 CarbonylContact O-C 3.5Å; E25-R39 WeakPolarHBondContact O-CA 3.38Å; R39-S41 WeakPolarHBondContact CB-OG 3.43Å; R39-S41 PolarHBondContact O-N 3.28Å; R39-T42 WeakPolarHBondContact O-CB 3.34Å; R39-T42 PolarHBondContact O-N 3.02Å; R39-L43 PolarHBondContact O-N 2.93Å
40	H	93.7	Very high	94	Very high	10 Å²	10	48.5 Å²	48.5	5%	0.046	27%	0.269	C	S	.	.	H	α-helix	trans	-53.1	-43.3	170.5	175.3	-102.3	0	0	0	111	F23 E25 V27 T42 L43 I44 F55	F23-H40 WeakPolarHBondContact CB-CD2 3.38Å; F23-H40 AromaticContact CD2-CD2 3.86Å; F23-H40 AromaticContact CD2-NE2 3.5Å; F23-H40 AromaticContact CG-CD2 3.77Å; F23-H40 AromaticContact CG-NE2 3.92Å; E25-H40 PolarHBondContact O-N 3.49Å; V27-H40 HydrophobicContact CG2-CB 4.08Å; H40-T42 PolarHBondContact O-N 2.98Å; H40-L43 PolarHBondContact O-N 3.36Å; H40-I44 WeakPolarHBondContact O-CG1 3.36Å; H40-I44 PolarHBondContact O-N 2.88Å; H40-F55 PolarHBondContact NE2-O 2.91Å
41	S	94.3	Very high	93.8	Very high	70 Å²	70	47.9 Å²	47.9	49%	0.49	27%	0.266	S	S	.	.	H	α-helix	trans	-56.3	-33.8	176.8	59.5	0	0	0	0	113.8	R39 S45	R39-S41 WeakPolarHBondContact CB-OG 3.43Å; R39-S41 PolarHBondContact O-N 3.28Å; S41-S45 WeakPolarHBondContact O-CA 3.46Å; S41-S45 WeakPolarHBondContact O-CB 3.37Å; S41-S45 PolarHBondContact O-N 2.84Å
42	T	95.4	Very high	93.6	Very high	18 Å²	18	51.6 Å²	51.6	11%	0.11	28%	0.28	C	S	.	.	H	α-helix	trans	-68.8	-40.3	176.4	-56.7	0	0	0	0	111.8	T38 R39 H40 I44 S45 L86 L89 R90	T38-T42 WeakPolarHBondContact OG1-CB 3.33Å; R39-T42 WeakPolarHBondContact O-CB 3.34Å; R39-T42 PolarHBondContact O-N 3.02Å; H40-T42 PolarHBondContact O-N 2.98Å; T42-I44 VanDerWaalsContact C-N 3.35Å; T42-S45 WeakPolarHBondContact O-CB 3.33Å; T42-S45 PolarHBondContact O-N 3.27Å; T42-S45 PolarHBondContact O-OG 3.43Å; T42-L86 HydrophobicContact CG2-CD1 4.16Å; T42-L89 HydrophobicContact CG2-CB 3.76Å; T42-R90 HydrophobicContact CG2-CG 3.76Å
43	L	94.1	Very high	93.3	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-70.1	-32.3	-178.3	-62.8	174.3	0	0	0	112.6	V27 L29 T38 R39 H40 S45 L51 W52 F55	V27-L43 HydrophobicContact CB-CD1 3.98Å; V27-L43 HydrophobicContact CG1-CD1 3.91Å; V27-L43 HydrophobicContact CG2-CD1 4.28Å; L29-L43 HydrophobicContact CD1-CD1 4.37Å; L29-L43 HydrophobicContact CD1-CD2 3.86Å; L29-L43 HydrophobicContact CD2-CD1 4.37Å; T38-L43 HydrophobicContact CG2-CD1 3.91Å; T38-L43 HydrophobicContact CG2-CD2 3.72Å; T38-L43 HydrophobicContact CG2-CG 3.7Å; R39-L43 PolarHBondContact O-N 2.93Å; H40-L43 PolarHBondContact O-N 3.36Å; L43-S45 VanDerWaalsContact C-N 3.34Å; L43-L51 HydrophobicContact CD2-CB 4.45Å; L43-L51 HydrophobicContact CD2-CD1 3.97Å; L43-L51 HydrophobicContact CD2-CD2 4.4Å; L43-L51 CarbonylContact O-C 3.59Å; L43-W52 PolarHBondContact O-N 3.01Å; L43-F55 HydrophobicContact CB-CB 4.23Å; L43-F55 HydrophobicContact CB-CD2 4.06Å; L43-F55 HydrophobicContact CB-CG 4.2Å; L43-F55 HydrophobicContact CD1-CD1 4.05Å; L43-F55 HydrophobicContact CD1-CD2 3.77Å; L43-F55 HydrophobicContact CD1-CE1 4.11Å; L43-F55 HydrophobicContact CD1-CE2 3.85Å; L43-F55 HydrophobicContact CD1-CG 3.89Å; L43-F55 HydrophobicContact CD1-CZ 4.02Å; L43-F55 HydrophobicContact CG-CD2 4.4Å
44	I	93	Very high	93.2	Very high	52 Å²	52	52.3 Å²	52.3	27%	0.267	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	6.9	176	65.7	164.6	0	0	0	113.1	H40 T42 I46 F55	H40-I44 WeakPolarHBondContact O-CG1 3.36Å; H40-I44 PolarHBondContact O-N 2.88Å; T42-I44 VanDerWaalsContact C-N 3.35Å; I44-I46 VanDerWaalsContact C-N 3.26Å; I44-I46 PolarHBondContact O-N 3.43Å; I44-F55 HydrophobicContact CG2-CB 4.02Å; I44-F55 WeakPolarHBondContact CG2-O 3.43Å
45	S	92.7	Very high	92.8	Very high	35 Å²	35	48.7 Å²	48.7	25%	0.245	24%	0.238	C	C	.	.	S	Bend	trans	-70.6	-24.3	-168.3	76.6	0	0	0	0	113	S41 T42 L43 L89 R92	S41-S45 WeakPolarHBondContact O-CA 3.46Å; S41-S45 WeakPolarHBondContact O-CB 3.37Å; S41-S45 PolarHBondContact O-N 2.84Å; T42-S45 WeakPolarHBondContact O-CB 3.33Å; T42-S45 PolarHBondContact O-N 3.27Å; T42-S45 PolarHBondContact O-OG 3.43Å; L43-S45 VanDerWaalsContact C-N 3.34Å; S45-L89 PolarHBondContact OG-O 2.91Å; S45-L89 VanDerWaalsContact OG-O 3.05Å; S45-R92 PolarHBondContact O-NH2 2.86Å; S45-R92 PolarHBondContact OG-NH1 2.83Å; S45-R92 PolarHBondContact OG-NH2 2.78Å
46	I	93	Very high	92.3	Very high	26 Å²	26	47.5 Å²	47.5	13%	0.133	23%	0.231	C	C	.	.	S	Bend	trans	-113.6	108	175.7	-60.9	-175.3	0	0	0	108.8	I44 S49 W52 Y88 L89 L115	I44-I46 VanDerWaalsContact C-N 3.26Å; I44-I46 PolarHBondContact O-N 3.43Å; I46-S49 WeakPolarHBondContact O-CB 2.89Å; I46-S49 PolarHBondContact O-N 3.3Å; I46-S49 PolarHBondContact O-OG 3.23Å; I46-W52 WeakPolarHBondContact O-CB 3.45Å; I46-Y88 HydrophobicContact CD1-CD1 3.95Å; I46-Y88 HydrophobicContact CD1-CE1 3.37Å; I46-L89 HydrophobicContact CB-CD2 4.34Å; I46-L89 HydrophobicContact CD1-CD2 3.76Å; I46-L89 HydrophobicContact CG1-CD2 3.96Å; I46-L115 HydrophobicContact CB-CD2 4.4Å; I46-L115 HydrophobicContact CD1-CD2 3.84Å; I46-L115 HydrophobicContact CG2-CD2 4.18Å
47	P	90.6	Very high	90.8	Very high	80 Å²	80	49.4 Å²	49.4	52%	0.519	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	147.6	178.5	-25.4	34.8	0	0	0	112.3	S49	P47-S49 PolarHBondContact O-N 2.96Å
48	H	87.4	Confident	89.4	Confident	132 Å²	132	51.9 Å²	51.9	61%	0.611	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	-1.8	177.3	-48.9	-68.1	0	0	0	116.8	K53 Q114	H48-K53 VanDerWaalsContact O-CE 3.24Å; H48-K53 WeakPolarHBondContact O-CE 3.35Å; H48-K53 PolarHBondContact O-NZ 2.94Å; H48-Q114 PolarHBondContact O-OE1 3.29Å
49	S	92.7	Very high	87.2	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.014	29%	0.294	C	S	.	.	S	Bend	trans	-64	162.9	168.8	68.1	0	0	0	0	111.6	I46 P47 L51 W52 K53	I46-S49 WeakPolarHBondContact O-CB 2.89Å; I46-S49 PolarHBondContact O-N 3.3Å; I46-S49 PolarHBondContact O-OG 3.23Å; P47-S49 PolarHBondContact O-N 2.96Å; S49-L51 PolarHBondContact O-N 2.85Å; S49-W52 PolarHBondContact O-N 2.69Å; S49-W52 VanDerWaalsContact OG-CB 3.25Å; S49-W52 WeakPolarHBondContact OG-CB 3.4Å; S49-W52 PolarHBondContact OG-N 2.81Å; S49-K53 WeakPolarHBondContact O-CG 3.36Å; S49-K53 PolarHBondContact O-N 3.14Å
50	F	91.6	Very high	85.2	Confident	53 Å²	53	62.9 Å²	62.9	23%	0.232	31%	0.306	C	S	.	.	H	α-helix	trans	-59.1	-46.8	179.2	-179.1	-100.2	0	0	0	112	W52 K53 M54 Y112 F113	F50-W52 VanDerWaalsContact C-N 3.34Å; F50-W52 PolarHBondContact O-N 2.88Å; F50-K53 WeakPolarHBondContact O-CB 3.33Å; F50-K53 PolarHBondContact O-N 2.82Å; F50-K53 VanDerWaalsContact O-N 3.14Å; F50-M54 HydrophobicContact CD1-CG 4.39Å; F50-M54 HydrophobicContact CD1-SD 3.71Å; F50-M54 HydrophobicContact CE1-CE 4.49Å; F50-M54 HydrophobicContact CE1-CG 4.09Å; F50-M54 HydrophobicContact CE1-SD 3.16Å; F50-M54 WeakPolarHBondContact CE1-SD 3.39Å; F50-M54 HydrophobicContact CZ-CG 4.31Å; F50-M54 HydrophobicContact CZ-SD 3.75Å; F50-M54 PolarHBondContact O-N 2.98Å; F50-Y112 HydrophobicContact CD1-CE1 4.22Å; F50-Y112 HydrophobicContact CE1-CE1 4.02Å; F50-Y112 HydrophobicContact CZ-CE1 4.39Å; F50-F113 HydrophobicContact CB-CD1 4.46Å; F50-F113 WeakPolarHBondContact CB-O 3.26Å; F50-F113 AromaticContact CD1-CD1 3.98Å; F50-F113 HydrophobicContact CD1-CD1 3.98Å; F50-F113 HydrophobicContact CD1-CE1 4.25Å; F50-F113 PolarHBondContact N-O 3.15Å
51	L	92.4	Very high	83.4	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-66.5	-36.6	178.2	-67.9	170.1	0	0	0	111.6	L43 S49 K53 M54 F55 I75 F82 L89 F113	L43-L51 HydrophobicContact CD2-CB 4.45Å; L43-L51 HydrophobicContact CD2-CD1 3.97Å; L43-L51 HydrophobicContact CD2-CD2 4.4Å; L43-L51 CarbonylContact O-C 3.59Å; S49-L51 PolarHBondContact O-N 2.85Å; L51-K53 VanDerWaalsContact C-N 3.31Å; L51-K53 PolarHBondContact O-N 2.72Å; L51-M54 HydrophobicContact CD2-SD 4.3Å; L51-M54 PolarHBondContact O-N 3.3Å; L51-F55 HydrophobicContact CD2-CD2 4.44Å; L51-F55 HydrophobicContact CD2-CE2 4.1Å; L51-F55 WeakPolarHBondContact O-CB 3.4Å; L51-F55 VanDerWaalsContact O-CD2 3.32Å; L51-F55 WeakPolarHBondContact O-CD2 3.31Å; L51-F55 PolarHBondContact O-N 2.85Å; L51-I75 HydrophobicContact CD2-CD1 3.78Å; L51-F82 HydrophobicContact CD1-CE2 4.1Å; L51-F82 HydrophobicContact CD1-CZ 4.18Å; L51-L89 HydrophobicContact CD1-CD1 3.56Å; L51-F113 HydrophobicContact CD1-CD1 4.11Å; L51-F113 HydrophobicContact CD1-CE1 4.4Å; L51-F113 HydrophobicContact CD2-CD1 4.39Å; L51-F113 HydrophobicContact CD2-CE1 4.24Å; L51-F113 HydrophobicContact CG-CD1 3.94Å; L51-F113 HydrophobicContact CG-CE1 4.26Å
52	W	91.1	Very high	81.5	Confident	78 Å²	78	63 Å²	63	30%	0.295	31%	0.307	S	S	.	.	H	α-helix	trans	-60.2	-42.2	171.9	175.8	94.1	0	0	0	111.4	L43 I46 S49 F50 M54 F55 S56	L43-W52 PolarHBondContact O-N 3.01Å; I46-W52 WeakPolarHBondContact O-CB 3.45Å; S49-W52 PolarHBondContact O-N 2.69Å; S49-W52 VanDerWaalsContact OG-CB 3.25Å; S49-W52 WeakPolarHBondContact OG-CB 3.4Å; S49-W52 PolarHBondContact OG-N 2.81Å; F50-W52 VanDerWaalsContact C-N 3.34Å; F50-W52 PolarHBondContact O-N 2.88Å; W52-M54 PolarHBondContact O-N 3.43Å; W52-F55 PolarHBondContact O-N 3.45Å; W52-S56 VanDerWaalsContact CD2-OG 3.3Å; W52-S56 WeakPolarHBondContact O-CA 3.45Å; W52-S56 WeakPolarHBondContact O-CB 2.99Å; W52-S56 PolarHBondContact O-N 2.89Å; W52-S56 PolarHBondContact O-OG 3.14Å
53	K	89.4	Confident	79.6	Confident	98 Å²	98	69.3 Å²	69.3	43%	0.426	34%	0.34	S	S	.	.	H	α-helix	trans	-63.5	-41.8	177.8	-69.4	171.4	-178.5	165.2	0	111.7	H48 S49 F50 L51	H48-K53 VanDerWaalsContact O-CE 3.24Å; H48-K53 WeakPolarHBondContact O-CE 3.35Å; H48-K53 PolarHBondContact O-NZ 2.94Å; S49-K53 WeakPolarHBondContact O-CG 3.36Å; S49-K53 PolarHBondContact O-N 3.14Å; F50-K53 WeakPolarHBondContact O-CB 3.33Å; F50-K53 PolarHBondContact O-N 2.82Å; F50-K53 VanDerWaalsContact O-N 3.14Å; L51-K53 VanDerWaalsContact C-N 3.31Å; L51-K53 PolarHBondContact O-N 2.72Å
54	M	87.9	Confident	78.3	Confident	20 Å²	20	76.1 Å²	76.1	10%	0.099	38%	0.376	C	S	.	.	H	α-helix	trans	-66.4	-43.6	178	-70.2	179.5	80	0	0	112.7	F50 L51 W52 L65	F50-M54 HydrophobicContact CD1-CG 4.39Å; F50-M54 HydrophobicContact CD1-SD 3.71Å; F50-M54 HydrophobicContact CE1-CE 4.49Å; F50-M54 HydrophobicContact CE1-CG 4.09Å; F50-M54 HydrophobicContact CE1-SD 3.16Å; F50-M54 WeakPolarHBondContact CE1-SD 3.39Å; F50-M54 HydrophobicContact CZ-CG 4.31Å; F50-M54 HydrophobicContact CZ-SD 3.75Å; F50-M54 PolarHBondContact O-N 2.98Å; L51-M54 HydrophobicContact CD2-SD 4.3Å; L51-M54 PolarHBondContact O-N 3.3Å; W52-M54 PolarHBondContact O-N 3.43Å; M54-L65 HydrophobicContact CB-CD1 4.28Å; M54-L65 HydrophobicContact CB-CD2 4.18Å; M54-L65 HydrophobicContact CE-CD1 4.31Å; M54-L65 HydrophobicContact CE-CD2 3.75Å; M54-L65 HydrophobicContact CE-CG 4.45Å; M54-L65 HydrophobicContact CG-CD2 4.11Å
55	F	88.5	Confident	77.7	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-102	10	-171.4	-67.4	-80.6	0	0	0	113.5	F23 V27 L29 H40 L43 I44 L51 W52 F73	F23-F55 AromaticContact CD1-CD1 3.88Å; F23-F55 HydrophobicContact CD1-CD1 3.88Å; F23-F55 HydrophobicContact CD1-CE1 4.36Å; F23-F55 AromaticContact CE1-CD1 3.73Å; F23-F55 HydrophobicContact CE1-CD1 3.73Å; F23-F55 HydrophobicContact CE1-CE1 4.17Å; F23-F55 WeakPolarHBondContact CE2-O 3.39Å; F23-F55 HydrophobicContact CG-CD1 4.4Å; F23-F55 HydrophobicContact CZ-CD1 4.15Å; V27-F55 HydrophobicContact CG1-CD1 4.4Å; V27-F55 HydrophobicContact CG1-CE1 3.67Å; V27-F55 HydrophobicContact CG1-CZ 4.13Å; L29-F55 HydrophobicContact CD2-CE1 4.43Å; L29-F55 HydrophobicContact CD2-CE2 4.07Å; L29-F55 HydrophobicContact CD2-CZ 3.55Å; H40-F55 PolarHBondContact NE2-O 2.91Å; L43-F55 HydrophobicContact CB-CB 4.23Å; L43-F55 HydrophobicContact CB-CD2 4.06Å; L43-F55 HydrophobicContact CB-CG 4.2Å; L43-F55 HydrophobicContact CD1-CD1 4.05Å; L43-F55 HydrophobicContact CD1-CD2 3.77Å; L43-F55 HydrophobicContact CD1-CE1 4.11Å; L43-F55 HydrophobicContact CD1-CE2 3.85Å; L43-F55 HydrophobicContact CD1-CG 3.89Å; L43-F55 HydrophobicContact CD1-CZ 4.02Å; L43-F55 HydrophobicContact CG-CD2 4.4Å; I44-F55 HydrophobicContact CG2-CB 4.02Å; I44-F55 WeakPolarHBondContact CG2-O 3.43Å; L51-F55 HydrophobicContact CD2-CD2 4.44Å; L51-F55 HydrophobicContact CD2-CE2 4.1Å; L51-F55 WeakPolarHBondContact O-CB 3.4Å; L51-F55 VanDerWaalsContact O-CD2 3.32Å; L51-F55 WeakPolarHBondContact O-CD2 3.31Å; L51-F55 PolarHBondContact O-N 2.85Å; W52-F55 PolarHBondContact O-N 3.45Å; F55-F73 HydrophobicContact CE1-CD1 4.31Å; F55-F73 AromaticContact CE1-CD2 3.71Å; F55-F73 HydrophobicContact CE1-CD2 3.71Å; F55-F73 HydrophobicContact CE1-CE1 4.39Å; F55-F73 AromaticContact CE1-CE2 3.8Å; F55-F73 HydrophobicContact CE1-CE2 3.8Å; F55-F73 AromaticContact CE1-CG 3.97Å; F55-F73 HydrophobicContact CE1-CG 3.97Å; F55-F73 HydrophobicContact CE1-CZ 4.14Å; F55-F73 HydrophobicContact CZ-CB 4.08Å; F55-F73 HydrophobicContact CZ-CD1 4.35Å; F55-F73 AromaticContact CZ-CD2 3.96Å; F55-F73 HydrophobicContact CZ-CD2 3.96Å; F55-F73 HydrophobicContact CZ-CE2 4.5Å; F55-F73 AromaticContact CZ-CG 3.87Å; F55-F73 HydrophobicContact CZ-CG 3.87Å
56	S	84.5	Confident	77.5	Confident	13 Å²	13	75.9 Å²	75.9	9%	0.091	38%	0.381	C	S	.	.	S	Bend	trans	-72.6	145	173.3	-82.3	0	0	0	0	111.3	W52 K58	W52-S56 VanDerWaalsContact CD2-OG 3.3Å; W52-S56 WeakPolarHBondContact O-CA 3.45Å; W52-S56 WeakPolarHBondContact O-CB 2.99Å; W52-S56 PolarHBondContact O-N 2.89Å; W52-S56 PolarHBondContact O-OG 3.14Å; S56-K58 PolarHBondContact O-N 2.95Å
57	P	67.7	Low	77.4	Confident	74 Å²	74	80.3 Å²	80.3	48%	0.481	40%	0.399	S	S	.	.	S	Bend	trans	-71.9	19.8	-174.9	26.2	-32.4	0	0	0	115.5	R59	P57-R59 PolarHBondContact O-N 2.98Å; P57-R59 VanDerWaalsContact O-N 3.16Å
58	K	65.4	Low	77.5	Confident	168 Å²	168	77.8 Å²	77.8	73%	0.73	38%	0.381	S	S	*	.			trans	-72.9	108.5	169.7	-86.6	-171.3	174.1	-175.8	0	108.6	S56 E60 T61	S56-K58 PolarHBondContact O-N 2.95Å; K58-E60 PolarHBondContact O-N 3.12Å; K58-T61 PolarHBondContact O-N 2.73Å
59	R	51.5	Low	77.7	Confident	216 Å²	216	77.6 Å²	77.6	82%	0.815	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-19.2	-169.7	-74.3	-178.3	171.5	-176.9	-3.3	116.3	P57	P57-R59 PolarHBondContact O-N 2.98Å; P57-R59 VanDerWaalsContact O-N 3.16Å
60	E	52.6	Low	77.6	Confident	173 Å²	173	85.1 Å²	85.1	81%	0.808	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-28.1	-175.2	-67.5	175.1	177	0	0	113.5	K58	K58-E60 PolarHBondContact O-N 3.12Å
61	T	54.9	Low	77.5	Confident	62 Å²	62	84.7 Å²	84.7	38%	0.38	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-20.9	-172.8	-42.5	0	0	0	0	113.6	K58 N63 D64 L65	K58-T61 PolarHBondContact O-N 2.73Å; T61-N63 VanDerWaalsContact C-N 3.33Å; T61-N63 PolarHBondContact O-N 2.7Å; T61-D64 PolarHBondContact O-N 3.24Å; T61-L65 HydrophobicContact CG2-CD2 4.44Å; T61-L65 WeakPolarHBondContact O-CG 3.14Å
62	A	55.6	Low	77.5	Confident	20 Å²	20	86.5 Å²	86.5	17%	0.165	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-25.1	-173.8	0	0	0	0	0	114.1	F23	F23-A62 HydrophobicContact CE1-CB 4.28Å; F23-A62 HydrophobicContact CE2-CB 4.41Å; F23-A62 HydrophobicContact CZ-CB 3.7Å
63	N	55.9	Low	77.6	Confident	150 Å²	150	83.8 Å²	83.8	80%	0.802	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-17	179.7	-74.5	-23.4	0	0	0	113.5	T61	T61-N63 VanDerWaalsContact C-N 3.33Å; T61-N63 PolarHBondContact O-N 2.7Å
64	D	66.7	Low	77.8	Confident	143 Å²	143	82.5 Å²	82.5	77%	0.765	43%	0.429	S	S	*	.	S	Bend	trans	-97.3	2.3	-177.7	-76	-15.5	0	0	0	113.5	T61 A66	T61-D64 PolarHBondContact O-N 3.24Å; D64-A66 PolarHBondContact O-N 3.16Å
65	L	80.5	Confident	78.2	Confident	23 Å²	23	81.8 Å²	81.8	12%	0.12	43%	0.426	C	S	.	.	S	Bend	trans	-74.6	124.4	179.4	-56.9	-175.9	0	0	0	110.4	M54 T61 K67 F73	M54-L65 HydrophobicContact CB-CD1 4.28Å; M54-L65 HydrophobicContact CB-CD2 4.18Å; M54-L65 HydrophobicContact CE-CD1 4.31Å; M54-L65 HydrophobicContact CE-CD2 3.75Å; M54-L65 HydrophobicContact CE-CG 4.45Å; M54-L65 HydrophobicContact CG-CD2 4.11Å; T61-L65 HydrophobicContact CG2-CD2 4.44Å; T61-L65 WeakPolarHBondContact O-CG 3.14Å; L65-K67 PolarHBondContact O-N 3.11Å; L65-F73 HydrophobicContact CB-CD1 3.72Å; L65-F73 HydrophobicContact CB-CE1 3.93Å; L65-F73 HydrophobicContact CD1-CD1 3.74Å; L65-F73 HydrophobicContact CD1-CE1 3.63Å; L65-F73 HydrophobicContact CG-CD1 4.4Å; L65-F73 HydrophobicContact CG-CE1 4.37Å
66	A	87.9	Confident	78.5	Confident	59 Å²	59	87.9 Å²	87.9	49%	0.488	46%	0.458	S	S	.	.			trans	-54	136	175	0	0	0	0	0	110.7	D64 F74	D64-A66 PolarHBondContact O-N 3.16Å; A66-F74 HydrophobicContact CB-CB 4.38Å; A66-F74 PolarHBondContact O-N 2.88Å
67	K	91.8	Very high	79.1	Confident	119 Å²	119	90.7 Å²	90.7	52%	0.517	47%	0.467	S	S	.	.	B	Isolated β-bridge	trans	-127.4	147.1	176.6	-70	175.3	-177.9	178.2	0	110.2	L65 R72 F73	L65-K67 PolarHBondContact O-N 3.11Å; K67-R72 CarbonylContact C-O 3.46Å; K67-R72 WeakPolarHBondContact CA-O 3.13Å; K67-F73 HydrophobicContact CG-CD1 4.36Å
68	D	91.8	Very high	80.4	Confident	27 Å²	27	88.7 Å²	88.7	14%	0.144	45%	0.452	C	S	.	.			trans	-77	178.5	172.1	72	9.9	0	0	0	112.1	N30 K70 G71 R72	N30-D68 PolarHBondContact ND2-OD2 3.17Å; D68-K70 PolarHBondContact O-N 3.07Å; D68-K70 WeakPolarHBondContact OD1-CA 3.44Å; D68-K70 WeakPolarHBondContact OD1-CB 2.93Å; D68-K70 PolarHBondContact OD1-N 2.77Å; D68-G71 PolarHBondContact O-N 3.39Å; D68-G71 PolarHBondContact OD1-N 2.87Å; D68-G71 VanDerWaalsContact OD1-N 3.14Å; D68-R72 PolarHBondContact N-O 3.22Å; D68-R72 PolarHBondContact OD1-N 2.85Å; D68-R72 IonicContact OD1-NE 3.51Å; D68-R72 IonicContact OD2-CZ 2.66Å; D68-R72 IonicContact OD2-NE 2.64Å; D68-R72 PolarHBondContact OD2-NE 3.47Å; D68-R72 IonicContact OD2-NH2 3.65Å; D68-R72 PolarHBondContact OD2-NH2 3.45Å
69	S	90.8	Very high	81.7	Confident	129 Å²	129	81 Å²	81	90%	0.902	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-12.3	179.5	57.8	0	0	0	0	114.5
70	K	91.5	Very high	83.8	Confident	160 Å²	160	77.8 Å²	77.8	70%	0.696	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	5.7	176.3	-62.1	-173.7	177.9	-176	0	112.4	D68 R72	D68-K70 PolarHBondContact O-N 3.07Å; D68-K70 WeakPolarHBondContact OD1-CA 3.44Å; D68-K70 WeakPolarHBondContact OD1-CB 2.93Å; D68-K70 PolarHBondContact OD1-N 2.77Å; K70-R72 VanDerWaalsContact C-N 3.33Å; K70-R72 HydrophobicContact CB-CG 4.42Å
71	G	89.1	Confident	85.8	Confident	44 Å²	44	69.6 Å²	69.6	45%	0.454	37%	0.374	S	S	.	.	S	Bend	trans	78.9	11.2	178.4	0	0	0	0	0	114.7	D68	D68-G71 PolarHBondContact O-N 3.39Å; D68-G71 PolarHBondContact OD1-N 2.87Å; D68-G71 VanDerWaalsContact OD1-N 3.14Å
72	R	92.9	Very high	87.8	Confident	41 Å²	41	66.6 Å²	66.6	16%	0.155	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-83.6	144.2	178.5	-56.4	176.2	-64.9	-161.1	8.1	109.9	E28 N30 V35 K67 D68 K70 F74	E28-R72 HydrophobicContact CB-CB 4.26Å; E28-R72 HydrophobicContact CB-CG 3.9Å; E28-R72 VanDerWaalsContact OE2-CD 3.29Å; E28-R72 WeakPolarHBondContact OE2-CD 3.47Å; E28-R72 WeakPolarHBondContact OE2-CG 3.34Å; N30-R72 HydrophobicContact CB-CB 4.42Å; V35-R72 VanDerWaalsContact CG2-NH1 3.28Å; K67-R72 CarbonylContact C-O 3.46Å; K67-R72 WeakPolarHBondContact CA-O 3.13Å; D68-R72 PolarHBondContact N-O 3.22Å; D68-R72 PolarHBondContact OD1-N 2.85Å; D68-R72 IonicContact OD1-NE 3.51Å; D68-R72 IonicContact OD2-CZ 2.66Å; D68-R72 IonicContact OD2-NE 2.64Å; D68-R72 PolarHBondContact OD2-NE 3.47Å; D68-R72 IonicContact OD2-NH2 3.65Å; D68-R72 PolarHBondContact OD2-NH2 3.45Å; K70-R72 VanDerWaalsContact C-N 3.33Å; K70-R72 HydrophobicContact CB-CG 4.42Å; R72-F74 PolarHBondContact O-N 3.11Å
73	F	92.8	Very high	89.8	Confident	21 Å²	21	71.4 Å²	71.4	9%	0.092	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	124.4	179.3	-64.6	-78	0	0	0	110.2	F23 V27 E28 L29 N30 F55 L65 K67	F23-F73 HydrophobicContact CD1-CZ 4.18Å; F23-F73 HydrophobicContact CE1-CE1 4.43Å; F23-F73 AromaticContact CE1-CZ 3.91Å; F23-F73 HydrophobicContact CE1-CZ 3.91Å; V27-F73 HydrophobicContact CG1-CD2 3.72Å; V27-F73 HydrophobicContact CG1-CE2 3.94Å; E28-F73 PolarHBondContact O-N 3.29Å; L29-F73 CarbonylContact C-O 3.54Å; L29-F73 WeakPolarHBondContact CA-O 3.49Å; L29-F73 HydrophobicContact CD2-CB 3.87Å; L29-F73 HydrophobicContact CD2-CD2 4.46Å; N30-F73 PolarHBondContact N-O 3.04Å; F55-F73 HydrophobicContact CE1-CD1 4.31Å; F55-F73 AromaticContact CE1-CD2 3.71Å; F55-F73 HydrophobicContact CE1-CD2 3.71Å; F55-F73 HydrophobicContact CE1-CE1 4.39Å; F55-F73 AromaticContact CE1-CE2 3.8Å; F55-F73 HydrophobicContact CE1-CE2 3.8Å; F55-F73 AromaticContact CE1-CG 3.97Å; F55-F73 HydrophobicContact CE1-CG 3.97Å; F55-F73 HydrophobicContact CE1-CZ 4.14Å; F55-F73 HydrophobicContact CZ-CB 4.08Å; F55-F73 HydrophobicContact CZ-CD1 4.35Å; F55-F73 AromaticContact CZ-CD2 3.96Å; F55-F73 HydrophobicContact CZ-CD2 3.96Å; F55-F73 HydrophobicContact CZ-CE2 4.5Å; F55-F73 AromaticContact CZ-CG 3.87Å; F55-F73 HydrophobicContact CZ-CG 3.87Å; L65-F73 HydrophobicContact CB-CD1 3.72Å; L65-F73 HydrophobicContact CB-CE1 3.93Å; L65-F73 HydrophobicContact CD1-CD1 3.74Å; L65-F73 HydrophobicContact CD1-CE1 3.63Å; L65-F73 HydrophobicContact CG-CD1 4.4Å; L65-F73 HydrophobicContact CG-CE1 4.37Å; K67-F73 HydrophobicContact CG-CD1 4.36Å
74	F	94.8	Very high	91.7	Very high	70 Å²	70	65.2 Å²	65.2	31%	0.307	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	133.5	-174.4	-178.3	-107.8	0	0	0	111.3	N30 A66 R72 D76	N30-F74 HydrophobicContact CB-CD2 4.16Å; N30-F74 CarbonylContact O-C 3.54Å; N30-F74 WeakPolarHBondContact O-CA 3.24Å; N30-F74 WeakPolarHBondContact O-CD2 3.36Å; A66-F74 HydrophobicContact CB-CB 4.38Å; A66-F74 PolarHBondContact O-N 2.88Å; R72-F74 PolarHBondContact O-N 3.11Å; F74-D76 HydrophobicContact CE1-CB 3.83Å; F74-D76 HydrophobicContact CZ-CB 4.2Å
75	I	94.9	Very high	93.1	Very high	6 Å²	6	58.4 Å²	58.4	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	119.3	176.2	-58	177.4	0	0	0	107.2	N30 V31 G32 L51 R77 F113	N30-I75 PolarHBondContact O-N 2.9Å; V31-I75 CarbonylContact C-O 3.56Å; V31-I75 VanDerWaalsContact CA-O 3.3Å; V31-I75 WeakPolarHBondContact CA-O 3.37Å; V31-I75 HydrophobicContact CG1-CB 4.26Å; V31-I75 HydrophobicContact CG1-CG2 4.23Å; V31-I75 HydrophobicContact CG2-CB 4.2Å; V31-I75 HydrophobicContact CG2-CD1 4.24Å; G32-I75 PolarHBondContact N-O 2.77Å; L51-I75 HydrophobicContact CD2-CD1 3.78Å; I75-R77 HydrophobicContact CG2-CB 3.93Å; I75-R77 HydrophobicContact CG2-CG 3.62Å; I75-R77 PolarHBondContact O-N 3Å; I75-F113 HydrophobicContact CD1-CE1 4.39Å; I75-F113 HydrophobicContact CG2-CE1 4.2Å; I75-F113 HydrophobicContact CG2-CZ 4.09Å
76	D	95.4	Very high	93.9	Very high	127 Å²	127	57.4 Å²	57.4	68%	0.679	29%	0.294	S	S	*	.			trans	-82.9	64.5	-178.6	-170.3	24.8	0	0	0	111.6	F74	F74-D76 HydrophobicContact CE1-CB 3.83Å; F74-D76 HydrophobicContact CZ-CB 4.2Å
77	R	96.4	Very high	94.3	Very high	72 Å²	72	56.9 Å²	56.9	27%	0.272	28%	0.282	S	S	.	.	S	Bend	trans	-137.3	174.4	-177.6	-63.3	-56.4	-61.7	-179.8	0.2	111.9	V31 G32 I75 G79 E109 Y112 F113	V31-R77 CarbonylContact C-O 3.54Å; V31-R77 HydrophobicContact CG1-CB 3.98Å; G32-R77 WeakPolarHBondContact CA-O 3.48Å; G32-R77 PolarHBondContact N-O 3.1Å; I75-R77 HydrophobicContact CG2-CB 3.93Å; I75-R77 HydrophobicContact CG2-CG 3.62Å; I75-R77 PolarHBondContact O-N 3Å; R77-G79 PolarHBondContact O-N 2.63Å; R77-G79 VanDerWaalsContact O-N 3.13Å; R77-E109 IonicContact CZ-OE1 3.18Å; R77-E109 IonicContact CZ-OE2 2.72Å; R77-E109 IonicContact NE-OE1 3.15Å; R77-E109 IonicContact NE-OE2 2.76Å; R77-E109 PolarHBondContact NE-OE2 2.76Å; R77-E109 VanDerWaalsContact NH2-CD 3.27Å; R77-E109 IonicContact NH2-OE1 2.81Å; R77-E109 PolarHBondContact NH2-OE1 2.79Å; R77-E109 IonicContact NH2-OE2 3.61Å; R77-E109 PolarHBondContact NH2-OE2 2.84Å; R77-Y112 HydrophobicContact CG-CD1 3.72Å; R77-Y112 HydrophobicContact CG-CE1 3.37Å; R77-Y112 HydrophobicContact CG-CE2 4.39Å; R77-Y112 HydrophobicContact CG-CG 4.38Å; R77-F113 HydrophobicContact CB-CZ 4.31Å; R77-F113 HydrophobicContact CG-CZ 4.15Å
78	D	94.6	Very high	94.5	Very high	33 Å²	33	51.8 Å²	51.8	18%	0.176	26%	0.26	C	S	.	.			trans	-68.5	108	179.2	-167.8	-49.3	0	0	0	111.7	F80 L81 F82 R105	D78-F80 PolarHBondContact O-N 3.39Å; D78-F80 PolarHBondContact OD1-N 3.35Å; D78-L81 HydrophobicContact CB-CB 4.23Å; D78-L81 HydrophobicContact CB-CD1 4.17Å; D78-L81 HydrophobicContact CB-CG 4.35Å; D78-L81 PolarHBondContact OD1-N 3.19Å; D78-L81 VanDerWaalsContact OD1-N 3.09Å; D78-F82 WeakPolarHBondContact O-CB 3.42Å; D78-F82 PolarHBondContact O-N 3.4Å; D78-F82 VanDerWaalsContact O-N 3.1Å; D78-R105 IonicContact OD2-CZ 3.84Å; D78-R105 IonicContact OD2-NH2 3.93Å; D78-R105 PolarHBondContact OD2-NH2 2.61Å
79	G	94.6	Very high	94.7	Very high	5 Å²	5	50.7 Å²	50.7	5%	0.052	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-37.9	179.5	0	0	0	0	0	114	V31 Y36 R77 F82	V31-G79 VanDerWaalsContact O-CA 3.22Å; V31-G79 WeakPolarHBondContact O-CA 3.2Å; Y36-G79 WeakPolarHBondContact CE2-O 3.26Å; Y36-G79 PolarHBondContact OH-O 3.49Å; R77-G79 PolarHBondContact O-N 2.63Å; R77-G79 VanDerWaalsContact O-N 3.13Å; G79-F82 WeakPolarHBondContact O-CB 3.46Å; G79-F82 PolarHBondContact O-N 2.95Å
80	F	94.3	Very high	94.9	Very high	150 Å²	150	50 Å²	50	66%	0.658	23%	0.232	S	C	*	.	H	α-helix	trans	-70.4	-41.4	-176.7	-68.9	-76.2	0	0	0	111.9	D78 F82 R83	D78-F80 PolarHBondContact O-N 3.39Å; D78-F80 PolarHBondContact OD1-N 3.35Å; F80-F82 VanDerWaalsContact C-N 3.31Å; F80-R83 WeakPolarHBondContact O-CB 3.25Å; F80-R83 PolarHBondContact O-N 3.33Å
81	L	94.9	Very high	94.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-71.7	-27.8	177.1	-63.6	177.6	0	0	0	112.2	D78 R83 Y84 F100 E102 R105 L106 E109	D78-L81 HydrophobicContact CB-CB 4.23Å; D78-L81 HydrophobicContact CB-CD1 4.17Å; D78-L81 HydrophobicContact CB-CG 4.35Å; D78-L81 PolarHBondContact OD1-N 3.19Å; D78-L81 VanDerWaalsContact OD1-N 3.09Å; L81-R83 PolarHBondContact O-N 3.26Å; L81-R83 VanDerWaalsContact O-N 3.13Å; L81-Y84 HydrophobicContact CD2-CE2 4.48Å; L81-Y84 PolarHBondContact O-N 3.39Å; L81-Y84 VanDerWaalsContact O-N 3.08Å; L81-F100 HydrophobicContact CD2-CZ 3.79Å; L81-E102 HydrophobicContact CD2-CB 3.94Å; L81-R105 HydrophobicContact CD1-CB 3.47Å; L81-R105 VanDerWaalsContact CD1-CB 3.47Å; L81-L106 HydrophobicContact CB-CD1 4.37Å; L81-L106 HydrophobicContact CD2-CB 4.43Å; L81-E109 HydrophobicContact CB-CG 3.97Å; L81-E109 HydrophobicContact CD1-CG 3.99Å
82	F	97.4	Very high	94.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.9	-25.8	176.5	-172.2	-102.4	0	0	0	113.3	L29 V31 Y36 L51 D78 G79 F80 Y84 I85 L86 F113	L29-F82 HydrophobicContact CD1-CE1 4.05Å; L29-F82 HydrophobicContact CD1-CZ 3.88Å; V31-F82 HydrophobicContact CB-CB 4.43Å; V31-F82 HydrophobicContact CB-CD1 4.46Å; V31-F82 HydrophobicContact CB-CG 4.31Å; V31-F82 HydrophobicContact CG1-CB 3.97Å; V31-F82 HydrophobicContact CG1-CD2 4.22Å; V31-F82 HydrophobicContact CG1-CG 4.04Å; V31-F82 HydrophobicContact CG2-CD1 3.79Å; V31-F82 HydrophobicContact CG2-CD2 4.26Å; V31-F82 HydrophobicContact CG2-CE1 3.95Å; V31-F82 HydrophobicContact CG2-CE2 4.41Å; V31-F82 HydrophobicContact CG2-CG 3.94Å; V31-F82 HydrophobicContact CG2-CZ 4.26Å; Y36-F82 HydrophobicContact CD1-CD1 4.35Å; Y36-F82 AromaticContact CD2-CD1 3.57Å; Y36-F82 HydrophobicContact CD2-CD1 3.57Å; Y36-F82 HydrophobicContact CD2-CE1 4.11Å; Y36-F82 HydrophobicContact CE1-CD1 4.49Å; Y36-F82 HydrophobicContact CE2-CB 4.22Å; Y36-F82 AromaticContact CE2-CD1 3.71Å; Y36-F82 HydrophobicContact CE2-CD1 3.71Å; Y36-F82 HydrophobicContact CE2-CG 4.42Å; Y36-F82 AromaticContact CG-CD1 3.92Å; Y36-F82 HydrophobicContact CG-CD1 3.92Å; Y36-F82 HydrophobicContact CG-CE1 4.14Å; L51-F82 HydrophobicContact CD1-CE2 4.1Å; L51-F82 HydrophobicContact CD1-CZ 4.18Å; D78-F82 WeakPolarHBondContact O-CB 3.42Å; D78-F82 PolarHBondContact O-N 3.4Å; D78-F82 VanDerWaalsContact O-N 3.1Å; G79-F82 WeakPolarHBondContact O-CB 3.46Å; G79-F82 PolarHBondContact O-N 2.95Å; F80-F82 VanDerWaalsContact C-N 3.31Å; F82-Y84 VanDerWaalsContact C-N 3.28Å; F82-Y84 PolarHBondContact O-N 3.34Å; F82-I85 HydrophobicContact CD2-CB 4.17Å; F82-I85 HydrophobicContact CD2-CG2 4.32Å; F82-I85 HydrophobicContact CE2-CG2 4.22Å; F82-I85 WeakPolarHBondContact O-CB 3.17Å; F82-I85 PolarHBondContact O-N 3.07Å; F82-L86 HydrophobicContact CD1-CB 4.49Å; F82-L86 HydrophobicContact CE1-CB 4.25Å; F82-L86 HydrophobicContact CE1-CD1 4.42Å; F82-L86 HydrophobicContact CE1-CD2 4.36Å; F82-L86 WeakPolarHBondContact O-CB 3.07Å; F82-L86 PolarHBondContact O-N 3.05Å; F82-F113 HydrophobicContact CD2-CE1 4.24Å; F82-F113 AromaticContact CD2-CE2 3.71Å; F82-F113 HydrophobicContact CD2-CE2 3.71Å; F82-F113 AromaticContact CD2-CZ 3.5Å; F82-F113 HydrophobicContact CD2-CZ 3.5Å; F82-F113 AromaticContact CE2-CE1 3.84Å; F82-F113 HydrophobicContact CE2-CE1 3.84Å; F82-F113 HydrophobicContact CE2-CE2 4.09Å; F82-F113 AromaticContact CE2-CZ 3.59Å; F82-F113 HydrophobicContact CE2-CZ 3.59Å
83	R	96.1	Very high	94.4	Very high	120 Å²	120	55.4 Å²	55.4	45%	0.453	25%	0.249	S	C	.	.	H	α-helix	trans	-50.6	-49.4	172.1	-177.8	175.6	70.2	158.4	2.2	111.9	Y36 F80 L81 I85 L86 D87	Y36-R83 HydrophobicContact CE1-CB 4.4Å; F80-R83 WeakPolarHBondContact O-CB 3.25Å; F80-R83 PolarHBondContact O-N 3.33Å; L81-R83 PolarHBondContact O-N 3.26Å; L81-R83 VanDerWaalsContact O-N 3.13Å; R83-I85 PolarHBondContact O-N 3.06Å; R83-L86 WeakPolarHBondContact O-CB 3.41Å; R83-L86 PolarHBondContact O-N 2.87Å; R83-D87 VanDerWaalsContact O-CG 3.24Å; R83-D87 PolarHBondContact O-N 3.07Å
84	Y	96.1	Very high	94.1	Very high	21 Å²	21	55.8 Å²	55.8	8%	0.082	25%	0.253	C	S	.	.	H	α-helix	trans	-71.4	-31.8	-177.5	-56.3	-72.7	0	0	0	112.5	L81 F82 L86 Y88 V94 L96 F100 L106	L81-Y84 HydrophobicContact CD2-CE2 4.48Å; L81-Y84 PolarHBondContact O-N 3.39Å; L81-Y84 VanDerWaalsContact O-N 3.08Å; F82-Y84 VanDerWaalsContact C-N 3.28Å; F82-Y84 PolarHBondContact O-N 3.34Å; Y84-L86 VanDerWaalsContact C-N 3.32Å; Y84-Y88 WeakPolarHBondContact O-CB 3.17Å; Y84-Y88 PolarHBondContact O-N 2.96Å; Y84-V94 HydrophobicContact CD1-CG2 4.32Å; Y84-L96 HydrophobicContact CD1-CD2 3.7Å; Y84-L96 HydrophobicContact CE1-CD2 4.04Å; Y84-L96 HydrophobicContact CG-CD2 4.11Å; Y84-F100 HydrophobicContact CD2-CE2 4.34Å; Y84-F100 AromaticContact CD2-CZ 3.92Å; Y84-F100 HydrophobicContact CD2-CZ 3.92Å; Y84-F100 HydrophobicContact CE1-CE2 4.49Å; Y84-F100 AromaticContact CE2-CE2 3.45Å; Y84-F100 HydrophobicContact CE2-CE2 3.45Å; Y84-F100 VanDerWaalsContact CE2-CE2 3.45Å; Y84-F100 AromaticContact CE2-CZ 3.45Å; Y84-F100 HydrophobicContact CE2-CZ 3.45Å; Y84-F100 VanDerWaalsContact CE2-CZ 3.45Å; Y84-F100 AromaticContact CZ-CE2 3.53Å; Y84-F100 AromaticContact CZ-CZ 3.95Å; Y84-F100 WeakPolarHBondContact OH-CE2 3.28Å; Y84-L106 HydrophobicContact CD2-CD1 4.28Å; Y84-L106 HydrophobicContact CD2-CD2 4.21Å; Y84-L106 HydrophobicContact CG-CD1 4.44Å; Y84-L106 HydrophobicContact CG-CD2 4.07Å
85	I	97.4	Very high	93.6	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.7	-45.3	170.8	-57.7	-59.8	0	0	0	109.8	F82 R83 Y88 L89 L106 E109 A110 F113 L115 L118	F82-I85 HydrophobicContact CD2-CB 4.17Å; F82-I85 HydrophobicContact CD2-CG2 4.32Å; F82-I85 HydrophobicContact CE2-CG2 4.22Å; F82-I85 WeakPolarHBondContact O-CB 3.17Å; F82-I85 PolarHBondContact O-N 3.07Å; R83-I85 PolarHBondContact O-N 3.06Å; I85-Y88 PolarHBondContact O-N 3.14Å; I85-L89 HydrophobicContact CG2-CD1 4.28Å; I85-L89 WeakPolarHBondContact O-CG 3.47Å; I85-L89 PolarHBondContact O-N 2.8Å; I85-L106 HydrophobicContact CD1-CD1 3.87Å; I85-L106 HydrophobicContact CG1-CD1 4.23Å; I85-E109 HydrophobicContact CD1-CB 4.15Å; I85-E109 HydrophobicContact CG1-CB 4.3Å; I85-A110 HydrophobicContact CD1-CB 4.16Å; I85-F113 HydrophobicContact CB-CD2 4.5Å; I85-F113 HydrophobicContact CD1-CD2 4.31Å; I85-F113 HydrophobicContact CG1-CD2 3.98Å; I85-F113 HydrophobicContact CG1-CE2 4.28Å; I85-F113 HydrophobicContact CG2-CB 4.4Å; I85-F113 HydrophobicContact CG2-CD2 3.9Å; I85-F113 HydrophobicContact CG2-CE2 4.47Å; I85-F113 HydrophobicContact CG2-CG 4.14Å; I85-L115 HydrophobicContact CD1-CD1 4.39Å; I85-L115 HydrophobicContact CG2-CD1 3.74Å; I85-L118 HydrophobicContact CD1-CD2 3.72Å
86	L	96.8	Very high	93.1	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-68.1	-38.7	-179.1	-168.2	60.8	0	0	0	112.4	Y36 T38 T42 F82 R83 Y84 L89 R90	Y36-L86 HydrophobicContact CD1-CD2 3.81Å; Y36-L86 HydrophobicContact CG-CD2 4.36Å; T38-L86 HydrophobicContact CG2-CD1 4.11Å; T42-L86 HydrophobicContact CG2-CD1 4.16Å; F82-L86 HydrophobicContact CD1-CB 4.49Å; F82-L86 HydrophobicContact CE1-CB 4.25Å; F82-L86 HydrophobicContact CE1-CD1 4.42Å; F82-L86 HydrophobicContact CE1-CD2 4.36Å; F82-L86 WeakPolarHBondContact O-CB 3.07Å; F82-L86 PolarHBondContact O-N 3.05Å; R83-L86 WeakPolarHBondContact O-CB 3.41Å; R83-L86 PolarHBondContact O-N 2.87Å; Y84-L86 VanDerWaalsContact C-N 3.32Å; L86-L89 PolarHBondContact O-N 3.02Å; L86-R90 WeakPolarHBondContact O-CG 3.3Å; L86-R90 PolarHBondContact O-N 3.21Å; L86-R90 VanDerWaalsContact O-N 3.12Å
87	D	95.7	Very high	92.3	Very high	47 Å²	47	57.5 Å²	57.5	25%	0.251	27%	0.273	S	S	.	.	H	α-helix	trans	-62.8	-43.6	174.5	-65.4	-20.9	0	0	0	110.8	R83 L89 R90 D91	R83-D87 VanDerWaalsContact O-CG 3.24Å; R83-D87 PolarHBondContact O-N 3.07Å; D87-L89 VanDerWaalsContact C-N 3.32Å; D87-L89 PolarHBondContact O-N 2.87Å; D87-R90 WeakPolarHBondContact O-CB 3.35Å; D87-R90 PolarHBondContact O-N 3.47Å; D87-R90 IonicContact OD1-NH1 2.9Å; D87-D91 PolarHBondContact O-N 2.72Å
88	Y	96.6	Very high	90.9	Very high	13 Å²	13	61.3 Å²	61.3	5%	0.051	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-38.9	173.4	179.6	-102.1	0	0	0	113.1	I46 Y84 I85 R90 R92 Q93 L115 D117 L118 L121	I46-Y88 HydrophobicContact CD1-CD1 3.95Å; I46-Y88 HydrophobicContact CD1-CE1 3.37Å; Y84-Y88 WeakPolarHBondContact O-CB 3.17Å; Y84-Y88 PolarHBondContact O-N 2.96Å; I85-Y88 PolarHBondContact O-N 3.14Å; Y88-R90 PolarHBondContact O-N 2.67Å; Y88-R92 WeakPolarHBondContact CE2-O 3.43Å; Y88-R92 VanDerWaalsContact O-CA 3.26Å; Y88-R92 WeakPolarHBondContact O-CA 3.23Å; Y88-R92 PolarHBondContact O-N 2.83Å; Y88-R92 PolarHBondContact O-NH1 3.5Å; Y88-Q93 WeakPolarHBondContact CA-O 3.23Å; Y88-L115 HydrophobicContact CD1-CD1 4.15Å; Y88-L115 HydrophobicContact CE1-CD2 4.43Å; Y88-D117 WeakPolarHBondContact OH-CB 3.36Å; Y88-L118 HydrophobicContact CD1-CB 3.97Å; Y88-L118 HydrophobicContact CD1-CD2 3.93Å; Y88-L118 HydrophobicContact CD1-CG 4.39Å; Y88-L118 HydrophobicContact CD2-CB 4.27Å; Y88-L118 HydrophobicContact CD2-CD1 3.85Å; Y88-L118 HydrophobicContact CD2-CG 4.44Å; Y88-L118 HydrophobicContact CE1-CB 3.78Å; Y88-L118 HydrophobicContact CE2-CB 4.11Å; Y88-L118 HydrophobicContact CE2-CD1 4.31Å; Y88-L118 HydrophobicContact CG-CB 4.2Å; Y88-L118 HydrophobicContact CG-CD1 4.03Å; Y88-L118 HydrophobicContact CG-CD2 3.91Å; Y88-L118 HydrophobicContact CG-CG 4.27Å; Y88-L121 HydrophobicContact CE2-CD1 4.07Å
89	L	95.4	Very high	89.6	Confident	3 Å²	3	64.1 Å²	64.1	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-67.6	-22.2	175.6	-69.3	170.1	0	0	0	113.3	T42 S45 I46 L51 I85 L86 D87 R92 L115	T42-L89 HydrophobicContact CG2-CB 3.76Å; S45-L89 PolarHBondContact OG-O 2.91Å; S45-L89 VanDerWaalsContact OG-O 3.05Å; I46-L89 HydrophobicContact CB-CD2 4.34Å; I46-L89 HydrophobicContact CD1-CD2 3.76Å; I46-L89 HydrophobicContact CG1-CD2 3.96Å; L51-L89 HydrophobicContact CD1-CD1 3.56Å; I85-L89 HydrophobicContact CG2-CD1 4.28Å; I85-L89 WeakPolarHBondContact O-CG 3.47Å; I85-L89 PolarHBondContact O-N 2.8Å; L86-L89 PolarHBondContact O-N 3.02Å; D87-L89 VanDerWaalsContact C-N 3.32Å; D87-L89 PolarHBondContact O-N 2.87Å; L89-R92 VanDerWaalsContact C-NH1 3.27Å; L89-R92 PolarHBondContact O-NH1 2.84Å; L89-L115 HydrophobicContact CD2-CD2 4.23Å
90	R	94.8	Very high	89.1	Confident	114 Å²	114	65 Å²	65	43%	0.43	31%	0.313	S	S	.	.	H	α-helix	trans	-86	-51.9	176.4	-69.8	167.1	177.2	163.1	-4.1	111.6	F37 T42 L86 D87 Y88	F37-R90 PolarHBondContact O-NH2 2.81Å; T42-R90 HydrophobicContact CG2-CG 3.76Å; L86-R90 WeakPolarHBondContact O-CG 3.3Å; L86-R90 PolarHBondContact O-N 3.21Å; L86-R90 VanDerWaalsContact O-N 3.12Å; D87-R90 WeakPolarHBondContact O-CB 3.35Å; D87-R90 PolarHBondContact O-N 3.47Å; D87-R90 IonicContact OD1-NH1 2.9Å; Y88-R90 PolarHBondContact O-N 2.67Å
91	D	91.1	Very high	88.2	Confident	117 Å²	117	63.2 Å²	63.2	63%	0.626	32%	0.317	S	S	*	.	H	α-helix	trans	-107	-6.6	-163.8	-57.8	-34.2	0	0	0	113.4	D87 Q93	D87-D91 PolarHBondContact O-N 2.72Å; D91-Q93 PolarHBondContact O-N 2.91Å; D91-Q93 VanDerWaalsContact O-N 3.1Å
92	R	88.9	Confident	87.7	Confident	101 Å²	101	66.2 Å²	66.2	38%	0.381	33%	0.331	S	S	.	.	S	Bend	trans	60.6	11.1	-172.3	-60.5	-73.1	174.7	-86.5	-2.2	114.2	S45 Y88 L89	S45-R92 PolarHBondContact O-NH2 2.86Å; S45-R92 PolarHBondContact OG-NH1 2.83Å; S45-R92 PolarHBondContact OG-NH2 2.78Å; Y88-R92 WeakPolarHBondContact CE2-O 3.43Å; Y88-R92 VanDerWaalsContact O-CA 3.26Å; Y88-R92 WeakPolarHBondContact O-CA 3.23Å; Y88-R92 PolarHBondContact O-N 2.83Å; Y88-R92 PolarHBondContact O-NH1 3.5Å; L89-R92 VanDerWaalsContact C-NH1 3.27Å; L89-R92 PolarHBondContact O-NH1 2.84Å
93	Q	84.2	Confident	87.3	Confident	141 Å²	141	70.1 Å²	70.1	66%	0.659	35%	0.348	S	S	*	.	S	Bend	trans	-137	157.4	174.5	-62.3	-169.2	11.1	0	0	108.6	Y88 D91	Y88-Q93 WeakPolarHBondContact CA-O 3.23Å; D91-Q93 PolarHBondContact O-N 2.91Å; D91-Q93 VanDerWaalsContact O-N 3.1Å
94	V	86.3	Confident	87	Confident	29 Å²	29	66.9 Å²	66.9	18%	0.176	35%	0.352	C	S	.	.			trans	-124.7	120.9	174.3	67	0	0	0	0	108.2	Y84 L96 L118	Y84-V94 HydrophobicContact CD1-CG2 4.32Å; V94-L96 HydrophobicContact CG1-CG 4.42Å; V94-L96 HydrophobicContact CG2-CD2 3.64Å; V94-L96 HydrophobicContact CG2-CG 4.18Å; V94-L118 HydrophobicContact CB-CD1 4.15Å; V94-L118 HydrophobicContact CG1-CD1 3.62Å
95	V	83.9	Confident	86.9	Confident	128 Å²	128	70.9 Å²	70.9	78%	0.776	37%	0.367	S	S	*	.			trans	-95.2	109.2	171.6	-178.5	0	0	0	0	106.9
96	L	84.6	Confident	86.8	Confident	41 Å²	41	70.9 Å²	70.9	22%	0.215	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-93	141.9	175.5	-60	178.8	0	0	0	108.9	Y84 V94 F100 K103 L106 L122	Y84-L96 HydrophobicContact CD1-CD2 3.7Å; Y84-L96 HydrophobicContact CE1-CD2 4.04Å; Y84-L96 HydrophobicContact CG-CD2 4.11Å; V94-L96 HydrophobicContact CG1-CG 4.42Å; V94-L96 HydrophobicContact CG2-CD2 3.64Å; V94-L96 HydrophobicContact CG2-CG 4.18Å; L96-F100 HydrophobicContact CB-CB 4.05Å; L96-F100 HydrophobicContact CB-CG 4.35Å; L96-F100 HydrophobicContact CD1-CB 4.46Å; L96-F100 HydrophobicContact CD1-CD1 3.97Å; L96-F100 HydrophobicContact CD1-CG 4.45Å; L96-F100 HydrophobicContact CD2-CD1 4.07Å; L96-F100 HydrophobicContact CD2-CE1 4.27Å; L96-F100 HydrophobicContact CD2-CG 4.34Å; L96-F100 HydrophobicContact CG-CD1 4.46Å; L96-K103 HydrophobicContact CD1-CG 4.5Å; L96-L106 HydrophobicContact CD1-CD2 4.41Å; L96-L106 HydrophobicContact CD2-CD2 3.63Å; L96-L122 HydrophobicContact CD1-CD2 3.75Å
97	P	77.4	Confident	86.7	Confident	70 Å²	70	73.8 Å²	73.8	46%	0.455	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-54.1	148.3	167.4	-23.2	33.2	0	0	0	110.9	H99 F100	P97-H99 PolarHBondContact O-N 2.94Å; P97-F100 PolarHBondContact O-N 2.79Å; P97-F100 VanDerWaalsContact O-N 3.13Å
98	D	66.9	Low	86.7	Confident	152 Å²	152	78.7 Å²	78.7	81%	0.813	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	128.7	173.3	-65.1	-30.6	0	0	0	109.4
99	H	68.7	Low	86.8	Confident	93 Å²	93	78.8 Å²	78.8	43%	0.431	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	43.3	-179.1	-48.8	-72.7	0	0	0	115.3	P97 P101 F279	P97-H99 PolarHBondContact O-N 2.94Å; H99-P101 WeakPolarHBondContact O-CD 3.38Å; H99-F279 HydrophobicContact CB-CD1 3.67Å; H99-F279 HydrophobicContact CB-CE1 3.42Å; H99-F279 VanDerWaalsContact CB-CE1 3.42Å; H99-F279 AromaticContact CD2-CD1 3.05Å; H99-F279 WeakPolarHBondContact CD2-CD1 3.09Å; H99-F279 AromaticContact CD2-CE1 2.93Å; H99-F279 WeakPolarHBondContact CD2-CE1 3.42Å; H99-F279 AromaticContact CD2-CG 3.76Å; H99-F279 AromaticContact CD2-CZ 3.61Å; H99-F279 AromaticContact CE1-CD1 3.28Å; H99-F279 WeakPolarHBondContact CE1-CD1 3.46Å; H99-F279 AromaticContact CE1-CG 3.53Å; H99-F279 AromaticContact CG-CD1 2.99Å; H99-F279 AromaticContact CG-CE1 3.09Å; H99-F279 AromaticContact CG-CG 4Å; H99-F279 AromaticContact ND1-CD1 3.17Å; H99-F279 WeakPolarHBondContact ND1-CD1 3.16Å; H99-F279 AromaticContact ND1-CE1 3.81Å; H99-F279 AromaticContact ND1-CG 3.88Å; H99-F279 AromaticContact NE2-CD1 3.2Å; H99-F279 WeakPolarHBondContact NE2-CD1 3.32Å; H99-F279 AromaticContact NE2-CD2 3.99Å; H99-F279 AromaticContact NE2-CE1 3.56Å; H99-F279 AromaticContact NE2-CG 3.42Å; H99-F279 WeakPolarHBondContact NE2-CG 3.15Å
100	F	83.5	Confident	86.8	Confident	22 Å²	22	78.6 Å²	78.6	10%	0.096	39%	0.394	C	S	.	.			trans	-52.5	103.3	173.9	-174.9	-117	0	0	0	112.5	L81 Y84 L96 P97 E102 K103 L106	L81-F100 HydrophobicContact CD2-CZ 3.79Å; Y84-F100 HydrophobicContact CD2-CE2 4.34Å; Y84-F100 AromaticContact CD2-CZ 3.92Å; Y84-F100 HydrophobicContact CD2-CZ 3.92Å; Y84-F100 HydrophobicContact CE1-CE2 4.49Å; Y84-F100 AromaticContact CE2-CE2 3.45Å; Y84-F100 HydrophobicContact CE2-CE2 3.45Å; Y84-F100 VanDerWaalsContact CE2-CE2 3.45Å; Y84-F100 AromaticContact CE2-CZ 3.45Å; Y84-F100 HydrophobicContact CE2-CZ 3.45Å; Y84-F100 VanDerWaalsContact CE2-CZ 3.45Å; Y84-F100 AromaticContact CZ-CE2 3.53Å; Y84-F100 AromaticContact CZ-CZ 3.95Å; Y84-F100 WeakPolarHBondContact OH-CE2 3.28Å; L96-F100 HydrophobicContact CB-CB 4.05Å; L96-F100 HydrophobicContact CB-CG 4.35Å; L96-F100 HydrophobicContact CD1-CB 4.46Å; L96-F100 HydrophobicContact CD1-CD1 3.97Å; L96-F100 HydrophobicContact CD1-CG 4.45Å; L96-F100 HydrophobicContact CD2-CD1 4.07Å; L96-F100 HydrophobicContact CD2-CE1 4.27Å; L96-F100 HydrophobicContact CD2-CG 4.34Å; L96-F100 HydrophobicContact CG-CD1 4.46Å; P97-F100 PolarHBondContact O-N 2.79Å; P97-F100 VanDerWaalsContact O-N 3.13Å; F100-E102 VanDerWaalsContact CE1-C 3.42Å; F100-E102 HydrophobicContact CE1-CB 4.06Å; F100-E102 HydrophobicContact CE2-CB 4.27Å; F100-E102 HydrophobicContact CZ-CB 3.8Å; F100-E102 PolarHBondContact O-N 2.93Å; F100-K103 HydrophobicContact CD1-CB 3.93Å; F100-K103 VanDerWaalsContact CD1-N 3.34Å; F100-K103 PolarHBondContact O-N 3Å; F100-L106 HydrophobicContact CD1-CD2 4.4Å; F100-L106 HydrophobicContact CE1-CB 3.75Å; F100-L106 HydrophobicContact CE1-CD2 3.64Å; F100-L106 HydrophobicContact CE1-CG 4.34Å; F100-L106 HydrophobicContact CZ-CB 4.38Å; F100-L106 HydrophobicContact CZ-CD2 4.24Å
101	P	74.8	Confident	86.9	Confident	113 Å²	113	77.8 Å²	77.8	73%	0.734	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-19	-168.1	28.2	-33	0	0	0	112.4	H99	H99-P101 WeakPolarHBondContact O-CD 3.38Å
102	E	86.2	Confident	87.1	Confident	63 Å²	63	76 Å²	76	29%	0.294	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	16.7	-177.3	-58.6	-170.5	103.1	0	0	112.7	L81 F100 G104 R105 L106	L81-E102 HydrophobicContact CD2-CB 3.94Å; F100-E102 VanDerWaalsContact CE1-C 3.42Å; F100-E102 HydrophobicContact CE1-CB 4.06Å; F100-E102 HydrophobicContact CE2-CB 4.27Å; F100-E102 HydrophobicContact CZ-CB 3.8Å; F100-E102 PolarHBondContact O-N 2.93Å; E102-G104 VanDerWaalsContact C-N 3.26Å; E102-G104 PolarHBondContact O-N 2.89Å; E102-R105 HydrophobicContact CB-CB 4.32Å; E102-R105 CarbonylContact O-C 3.57Å; E102-R105 WeakPolarHBondContact O-CA 3.43Å; E102-R105 WeakPolarHBondContact O-CB 3.31Å; E102-R105 PolarHBondContact O-N 2.9Å; E102-R105 WeakPolarHBondContact OE1-CD 3.28Å; E102-R105 IonicContact OE1-CZ 3.52Å; E102-R105 IonicContact OE1-NE 3.42Å; E102-R105 IonicContact OE1-NH1 3.58Å; E102-R105 PolarHBondContact OE1-NH1 2.74Å; E102-L106 PolarHBondContact O-N 3.18Å
103	K	88.4	Confident	87.5	Confident	82 Å²	82	71.2 Å²	71.2	36%	0.357	36%	0.363	S	S	.	.	H	α-helix	trans	-52	-43.1	-179.1	-165.5	179.3	-176.3	-173.4	0	112.6	L96 F100 R105 L106 K107 L122	L96-K103 HydrophobicContact CD1-CG 4.5Å; F100-K103 HydrophobicContact CD1-CB 3.93Å; F100-K103 VanDerWaalsContact CD1-N 3.34Å; F100-K103 PolarHBondContact O-N 3Å; K103-R105 PolarHBondContact O-N 2.82Å; K103-L106 PolarHBondContact O-N 2.84Å; K103-K107 PolarHBondContact O-N 2.91Å; K103-L122 WeakPolarHBondContact CE-O 3.46Å; K103-L122 HydrophobicContact CG-CD2 4.07Å
104	G	88.9	Confident	88.1	Confident	52 Å²	52	68.4 Å²	68.4	54%	0.536	35%	0.349	S	S	.	.	H	α-helix	trans	-67.4	-31.1	175.9	0	0	0	0	0	114.2	E102 R108	E102-G104 VanDerWaalsContact C-N 3.26Å; E102-G104 PolarHBondContact O-N 2.89Å; G104-R108 PolarHBondContact O-N 3.09Å
105	R	93.6	Very high	88.5	Confident	105 Å²	105	67.2 Å²	67.2	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-72.4	-44.5	172.5	-61.6	-179.8	61.9	175.4	3.7	110.7	D78 L81 E102 K103 K107 R108 E109	D78-R105 IonicContact OD2-CZ 3.84Å; D78-R105 IonicContact OD2-NH2 3.93Å; D78-R105 PolarHBondContact OD2-NH2 2.61Å; L81-R105 HydrophobicContact CD1-CB 3.47Å; L81-R105 VanDerWaalsContact CD1-CB 3.47Å; E102-R105 HydrophobicContact CB-CB 4.32Å; E102-R105 CarbonylContact O-C 3.57Å; E102-R105 WeakPolarHBondContact O-CA 3.43Å; E102-R105 WeakPolarHBondContact O-CB 3.31Å; E102-R105 PolarHBondContact O-N 2.9Å; E102-R105 WeakPolarHBondContact OE1-CD 3.28Å; E102-R105 IonicContact OE1-CZ 3.52Å; E102-R105 IonicContact OE1-NE 3.42Å; E102-R105 IonicContact OE1-NH1 3.58Å; E102-R105 PolarHBondContact OE1-NH1 2.74Å; K103-R105 PolarHBondContact O-N 2.82Å; R105-K107 VanDerWaalsContact C-N 3.27Å; R105-K107 PolarHBondContact O-N 3.21Å; R105-R108 WeakPolarHBondContact O-CB 3.04Å; R105-R108 PolarHBondContact O-N 3.2Å; R105-R108 VanDerWaalsContact O-N 3.08Å; R105-E109 PolarHBondContact O-N 2.59Å; R105-E109 VanDerWaalsContact O-N 3.07Å
106	L	95.7	Very high	88.9	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-37.4	176.8	179.6	60.8	0	0	0	111.8	L81 Y84 I85 L96 F100 E102 K103 R108 E109 A110 L122	L81-L106 HydrophobicContact CB-CD1 4.37Å; L81-L106 HydrophobicContact CD2-CB 4.43Å; Y84-L106 HydrophobicContact CD2-CD1 4.28Å; Y84-L106 HydrophobicContact CD2-CD2 4.21Å; Y84-L106 HydrophobicContact CG-CD1 4.44Å; Y84-L106 HydrophobicContact CG-CD2 4.07Å; I85-L106 HydrophobicContact CD1-CD1 3.87Å; I85-L106 HydrophobicContact CG1-CD1 4.23Å; L96-L106 HydrophobicContact CD1-CD2 4.41Å; L96-L106 HydrophobicContact CD2-CD2 3.63Å; F100-L106 HydrophobicContact CD1-CD2 4.4Å; F100-L106 HydrophobicContact CE1-CB 3.75Å; F100-L106 HydrophobicContact CE1-CD2 3.64Å; F100-L106 HydrophobicContact CE1-CG 4.34Å; F100-L106 HydrophobicContact CZ-CB 4.38Å; F100-L106 HydrophobicContact CZ-CD2 4.24Å; E102-L106 PolarHBondContact O-N 3.18Å; K103-L106 PolarHBondContact O-N 2.84Å; L106-R108 VanDerWaalsContact C-N 3.34Å; L106-R108 PolarHBondContact O-N 3.25Å; L106-E109 PolarHBondContact O-N 3.27Å; L106-A110 PolarHBondContact O-N 3.13Å; L106-L122 HydrophobicContact CB-CD1 4.49Å; L106-L122 HydrophobicContact CD2-CD1 4.21Å; L106-L122 HydrophobicContact CD2-CD2 4.08Å; L106-L122 HydrophobicContact CG-CD1 3.86Å
107	K	95.4	Very high	89.3	Confident	64 Å²	64	66.8 Å²	66.8	28%	0.278	34%	0.34	S	S	.	.	H	α-helix	trans	-57.1	-46.1	172.4	-173.9	-172.4	172.3	-169.4	0	111.6	K103 R105 E109 A110 E111 V119 L122 T123	K103-K107 PolarHBondContact O-N 2.91Å; R105-K107 VanDerWaalsContact C-N 3.27Å; R105-K107 PolarHBondContact O-N 3.21Å; K107-E109 VanDerWaalsContact C-N 3.32Å; K107-E109 PolarHBondContact O-N 3Å; K107-A110 WeakPolarHBondContact O-CB 3.22Å; K107-A110 PolarHBondContact O-N 3Å; K107-A110 VanDerWaalsContact O-N 3.14Å; K107-E111 VanDerWaalsContact CE-OE1 3.22Å; K107-E111 WeakPolarHBondContact CE-OE1 2.93Å; K107-E111 IonicContact NZ-OE1 3.16Å; K107-E111 WeakPolarHBondContact O-CG 3.18Å; K107-E111 PolarHBondContact O-N 2.89Å; K107-V119 HydrophobicContact CG-CG1 4.19Å; K107-L122 HydrophobicContact CB-CB 4.23Å; K107-L122 HydrophobicContact CB-CD1 4.36Å; K107-L122 HydrophobicContact CG-CB 4.37Å; K107-T123 HydrophobicContact CD-CG2 4.24Å; K107-T123 VanDerWaalsContact NZ-CG2 3.34Å
108	R	95.9	Very high	90	Very high	150 Å²	150	63.4 Å²	63.4	57%	0.566	32%	0.318	S	S	*	.	H	α-helix	trans	-63.4	-35.5	176.3	-71.2	-173.6	-69.8	161.8	-1.7	112.7	G104 R105 L106 E111 Y112	G104-R108 PolarHBondContact O-N 3.09Å; R105-R108 WeakPolarHBondContact O-CB 3.04Å; R105-R108 PolarHBondContact O-N 3.2Å; R105-R108 VanDerWaalsContact O-N 3.08Å; L106-R108 VanDerWaalsContact C-N 3.34Å; L106-R108 PolarHBondContact O-N 3.25Å; R108-E111 PolarHBondContact O-N 3.2Å; R108-Y112 PolarHBondContact O-N 3.3Å
109	E	97.3	Very high	91.3	Very high	14 Å²	14	57.4 Å²	57.4	7%	0.065	29%	0.287	C	S	.	.	H	α-helix	trans	-65.5	-43.3	171.5	-61.1	-49.3	129.5	0	0	111.3	R77 L81 I85 R105 L106 K107 E111 Y112 F113	R77-E109 IonicContact CZ-OE1 3.18Å; R77-E109 IonicContact CZ-OE2 2.72Å; R77-E109 IonicContact NE-OE1 3.15Å; R77-E109 IonicContact NE-OE2 2.76Å; R77-E109 PolarHBondContact NE-OE2 2.76Å; R77-E109 VanDerWaalsContact NH2-CD 3.27Å; R77-E109 IonicContact NH2-OE1 2.81Å; R77-E109 PolarHBondContact NH2-OE1 2.79Å; R77-E109 IonicContact NH2-OE2 3.61Å; R77-E109 PolarHBondContact NH2-OE2 2.84Å; L81-E109 HydrophobicContact CB-CG 3.97Å; L81-E109 HydrophobicContact CD1-CG 3.99Å; I85-E109 HydrophobicContact CD1-CB 4.15Å; I85-E109 HydrophobicContact CG1-CB 4.3Å; R105-E109 PolarHBondContact O-N 2.59Å; R105-E109 VanDerWaalsContact O-N 3.07Å; L106-E109 PolarHBondContact O-N 3.27Å; K107-E109 VanDerWaalsContact C-N 3.32Å; K107-E109 PolarHBondContact O-N 3Å; E109-E111 VanDerWaalsContact C-N 3.3Å; E109-E111 PolarHBondContact O-N 2.97Å; E109-Y112 WeakPolarHBondContact O-CB 3.05Å; E109-Y112 PolarHBondContact O-N 3.07Å; E109-Y112 VanDerWaalsContact O-N 3.16Å; E109-F113 HydrophobicContact CB-CD2 4.45Å; E109-F113 HydrophobicContact CB-CE2 4.49Å; E109-F113 WeakPolarHBondContact O-CD2 3.42Å; E109-F113 PolarHBondContact O-N 2.81Å
110	A	96.6	Very high	92.4	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-37.4	176.8	0	0	0	0	0	112.5	I85 L106 K107 Q114 L115 L118 V119 L122	I85-A110 HydrophobicContact CD1-CB 4.16Å; L106-A110 PolarHBondContact O-N 3.13Å; K107-A110 WeakPolarHBondContact O-CB 3.22Å; K107-A110 PolarHBondContact O-N 3Å; K107-A110 VanDerWaalsContact O-N 3.14Å; A110-Q114 PolarHBondContact O-N 3.25Å; A110-L115 PolarHBondContact O-N 3.29Å; A110-L118 HydrophobicContact CB-CB 4.26Å; A110-L118 HydrophobicContact CB-CD2 3.74Å; A110-L118 HydrophobicContact CB-CG 3.84Å; A110-V119 HydrophobicContact CB-CG2 3.72Å; A110-L122 HydrophobicContact CB-CD1 4.14Å
111	E	96.4	Very high	92.6	Very high	96 Å²	96	63.1 Å²	63.1	45%	0.449	31%	0.314	S	S	.	.	H	α-helix	trans	-63.1	-47.4	171.7	-71.4	166.6	-177.4	0	0	111.4	K107 R108 E109 F113 Q114 V119	K107-E111 VanDerWaalsContact CE-OE1 3.22Å; K107-E111 WeakPolarHBondContact CE-OE1 2.93Å; K107-E111 IonicContact NZ-OE1 3.16Å; K107-E111 WeakPolarHBondContact O-CG 3.18Å; K107-E111 PolarHBondContact O-N 2.89Å; R108-E111 PolarHBondContact O-N 3.2Å; E109-E111 VanDerWaalsContact C-N 3.3Å; E109-E111 PolarHBondContact O-N 2.97Å; E111-F113 PolarHBondContact O-N 3.22Å; E111-Q114 PolarHBondContact O-N 3.02Å; E111-V119 HydrophobicContact CB-CG2 4.5Å; E111-V119 HydrophobicContact CG-CG1 4.28Å; E111-V119 HydrophobicContact CG-CG2 3.7Å
112	Y	96.6	Very high	93.3	Very high	80 Å²	80	58 Å²	58	31%	0.314	28%	0.281	S	S	.	.	H	α-helix	trans	-58.4	-46.4	177.4	175.7	-90.7	0	0	0	112.2	F50 R77 R108 E109 Q114	F50-Y112 HydrophobicContact CD1-CE1 4.22Å; F50-Y112 HydrophobicContact CE1-CE1 4.02Å; F50-Y112 HydrophobicContact CZ-CE1 4.39Å; R77-Y112 HydrophobicContact CG-CD1 3.72Å; R77-Y112 HydrophobicContact CG-CE1 3.37Å; R77-Y112 HydrophobicContact CG-CE2 4.39Å; R77-Y112 HydrophobicContact CG-CG 4.38Å; R108-Y112 PolarHBondContact O-N 3.3Å; E109-Y112 WeakPolarHBondContact O-CB 3.05Å; E109-Y112 PolarHBondContact O-N 3.07Å; E109-Y112 VanDerWaalsContact O-N 3.16Å; Y112-Q114 PolarHBondContact O-N 2.75Å
113	F	96.1	Very high	93.2	Very high	1 Å²	1	57.1 Å²	57.1	0%	0.004	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	0.4	178.3	-70.4	-68.9	0	0	0	113.7	F50 L51 I75 R77 F82 I85 E109 E111 L115	F50-F113 HydrophobicContact CB-CD1 4.46Å; F50-F113 WeakPolarHBondContact CB-O 3.26Å; F50-F113 AromaticContact CD1-CD1 3.98Å; F50-F113 HydrophobicContact CD1-CD1 3.98Å; F50-F113 HydrophobicContact CD1-CE1 4.25Å; F50-F113 PolarHBondContact N-O 3.15Å; L51-F113 HydrophobicContact CD1-CD1 4.11Å; L51-F113 HydrophobicContact CD1-CE1 4.4Å; L51-F113 HydrophobicContact CD2-CD1 4.39Å; L51-F113 HydrophobicContact CD2-CE1 4.24Å; L51-F113 HydrophobicContact CG-CD1 3.94Å; L51-F113 HydrophobicContact CG-CE1 4.26Å; I75-F113 HydrophobicContact CD1-CE1 4.39Å; I75-F113 HydrophobicContact CG2-CE1 4.2Å; I75-F113 HydrophobicContact CG2-CZ 4.09Å; R77-F113 HydrophobicContact CB-CZ 4.31Å; R77-F113 HydrophobicContact CG-CZ 4.15Å; F82-F113 HydrophobicContact CD2-CE1 4.24Å; F82-F113 AromaticContact CD2-CE2 3.71Å; F82-F113 HydrophobicContact CD2-CE2 3.71Å; F82-F113 AromaticContact CD2-CZ 3.5Å; F82-F113 HydrophobicContact CD2-CZ 3.5Å; F82-F113 AromaticContact CE2-CE1 3.84Å; F82-F113 HydrophobicContact CE2-CE1 3.84Å; F82-F113 HydrophobicContact CE2-CE2 4.09Å; F82-F113 AromaticContact CE2-CZ 3.59Å; F82-F113 HydrophobicContact CE2-CZ 3.59Å; I85-F113 HydrophobicContact CB-CD2 4.5Å; I85-F113 HydrophobicContact CD1-CD2 4.31Å; I85-F113 HydrophobicContact CG1-CD2 3.98Å; I85-F113 HydrophobicContact CG1-CE2 4.28Å; I85-F113 HydrophobicContact CG2-CB 4.4Å; I85-F113 HydrophobicContact CG2-CD2 3.9Å; I85-F113 HydrophobicContact CG2-CE2 4.47Å; I85-F113 HydrophobicContact CG2-CG 4.14Å; E109-F113 HydrophobicContact CB-CD2 4.45Å; E109-F113 HydrophobicContact CB-CE2 4.49Å; E109-F113 WeakPolarHBondContact O-CD2 3.42Å; E109-F113 PolarHBondContact O-N 2.81Å; E111-F113 PolarHBondContact O-N 3.22Å; F113-L115 HydrophobicContact CB-CD1 4Å; F113-L115 HydrophobicContact CB-CG 4.07Å
114	Q	96.1	Very high	92.1	Very high	82 Å²	82	58.3 Å²	58.3	38%	0.383	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	52.8	178.7	-57.5	175	6.4	0	0	112	H48 A110 E111 Y112 P116	H48-Q114 PolarHBondContact O-OE1 3.29Å; A110-Q114 PolarHBondContact O-N 3.25Å; E111-Q114 PolarHBondContact O-N 3.02Å; Y112-Q114 PolarHBondContact O-N 2.75Å; Q114-P116 WeakPolarHBondContact O-CD 3.44Å
115	L	95.9	Very high	90.5	Very high	4 Å²	4	63.2 Å²	63.2	2%	0.021	31%	0.31	C	S	.	.			trans	-112.4	75.8	-179.2	-61.9	176.4	0	0	0	110.7	I46 I85 Y88 L89 A110 F113 D117 L118 V119	I46-L115 HydrophobicContact CB-CD2 4.4Å; I46-L115 HydrophobicContact CD1-CD2 3.84Å; I46-L115 HydrophobicContact CG2-CD2 4.18Å; I85-L115 HydrophobicContact CD1-CD1 4.39Å; I85-L115 HydrophobicContact CG2-CD1 3.74Å; Y88-L115 HydrophobicContact CD1-CD1 4.15Å; Y88-L115 HydrophobicContact CE1-CD2 4.43Å; L89-L115 HydrophobicContact CD2-CD2 4.23Å; A110-L115 PolarHBondContact O-N 3.29Å; F113-L115 HydrophobicContact CB-CD1 4Å; F113-L115 HydrophobicContact CB-CG 4.07Å; L115-D117 VanDerWaalsContact C-N 3.33Å; L115-D117 PolarHBondContact O-N 3.33Å; L115-L118 HydrophobicContact CB-CB 3.95Å; L115-L118 HydrophobicContact CB-CD2 4.48Å; L115-L118 HydrophobicContact CD1-CD2 4.03Å; L115-L118 PolarHBondContact O-N 3.19Å; L115-L118 VanDerWaalsContact O-N 3.16Å; L115-V119 WeakPolarHBondContact O-CG2 3.32Å; L115-V119 PolarHBondContact O-N 3.13Å
116	P	92.4	Very high	88.2	Confident	77 Å²	77	66.9 Å²	66.9	50%	0.5	33%	0.332	S	S	.	.	H	α-helix	trans	-62.2	-36.2	-169.5	24.8	-35.1	0	0	0	113.4	Q114 V119 K120	Q114-P116 WeakPolarHBondContact O-CD 3.44Å; P116-V119 WeakPolarHBondContact O-CB 3.29Å; P116-V119 PolarHBondContact O-N 3.43Å; P116-K120 WeakPolarHBondContact O-CG 3.28Å; P116-K120 PolarHBondContact O-N 3.49Å
117	D	92.1	Very high	85.7	Confident	82 Å²	82	74.3 Å²	74.3	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	-72.9	-32.9	179.9	-59.9	-38.3	0	0	0	112	Y88 L115 K120 L121	Y88-D117 WeakPolarHBondContact OH-CB 3.36Å; L115-D117 VanDerWaalsContact C-N 3.33Å; L115-D117 PolarHBondContact O-N 3.33Å; D117-K120 PolarHBondContact O-N 2.89Å; D117-K120 IonicContact OD1-NZ 3.66Å; D117-K120 PolarHBondContact OD1-NZ 2.96Å; D117-L121 WeakPolarHBondContact O-CG 3.27Å; D117-L121 PolarHBondContact O-N 3.35Å
118	L	92.8	Very high	82.9	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-66.5	-39.5	169.6	-179.3	58.3	0	0	0	111.1	I85 Y88 V94 A110 L115 K120 L121 L122	I85-L118 HydrophobicContact CD1-CD2 3.72Å; Y88-L118 HydrophobicContact CD1-CB 3.97Å; Y88-L118 HydrophobicContact CD1-CD2 3.93Å; Y88-L118 HydrophobicContact CD1-CG 4.39Å; Y88-L118 HydrophobicContact CD2-CB 4.27Å; Y88-L118 HydrophobicContact CD2-CD1 3.85Å; Y88-L118 HydrophobicContact CD2-CG 4.44Å; Y88-L118 HydrophobicContact CE1-CB 3.78Å; Y88-L118 HydrophobicContact CE2-CB 4.11Å; Y88-L118 HydrophobicContact CE2-CD1 4.31Å; Y88-L118 HydrophobicContact CG-CB 4.2Å; Y88-L118 HydrophobicContact CG-CD1 4.03Å; Y88-L118 HydrophobicContact CG-CD2 3.91Å; Y88-L118 HydrophobicContact CG-CG 4.27Å; V94-L118 HydrophobicContact CB-CD1 4.15Å; V94-L118 HydrophobicContact CG1-CD1 3.62Å; A110-L118 HydrophobicContact CB-CB 4.26Å; A110-L118 HydrophobicContact CB-CD2 3.74Å; A110-L118 HydrophobicContact CB-CG 3.84Å; L115-L118 HydrophobicContact CB-CB 3.95Å; L115-L118 HydrophobicContact CB-CD2 4.48Å; L115-L118 HydrophobicContact CD1-CD2 4.03Å; L115-L118 PolarHBondContact O-N 3.19Å; L115-L118 VanDerWaalsContact O-N 3.16Å; L118-K120 VanDerWaalsContact C-N 3.3Å; L118-K120 PolarHBondContact O-N 3.32Å; L118-L121 PolarHBondContact O-N 3.11Å; L118-L122 HydrophobicContact CD1-CD1 4.03Å; L118-L122 HydrophobicContact CD1-CG 4.15Å; L118-L122 HydrophobicContact CG-CD1 3.89Å; L118-L122 HydrophobicContact CG-CG 4.42Å; L118-L122 WeakPolarHBondContact O-CB 3.46Å; L118-L122 WeakPolarHBondContact O-CG 3.18Å; L118-L122 PolarHBondContact O-N 2.87Å
119	V	94.1	Very high	79.9	Confident	26 Å²	26	82.5 Å²	82.5	16%	0.158	41%	0.412	C	S	.	.	H	α-helix	trans	-59.5	-43	174.2	175.4	0	0	0	0	110.8	K107 A110 E111 L115 P116 L122 T123	K107-V119 HydrophobicContact CG-CG1 4.19Å; A110-V119 HydrophobicContact CB-CG2 3.72Å; E111-V119 HydrophobicContact CB-CG2 4.5Å; E111-V119 HydrophobicContact CG-CG1 4.28Å; E111-V119 HydrophobicContact CG-CG2 3.7Å; L115-V119 WeakPolarHBondContact O-CG2 3.32Å; L115-V119 PolarHBondContact O-N 3.13Å; P116-V119 WeakPolarHBondContact O-CB 3.29Å; P116-V119 PolarHBondContact O-N 3.43Å; V119-L122 CarbonylContact O-C 3.55Å; V119-L122 PolarHBondContact O-N 3Å; V119-L122 VanDerWaalsContact O-N 3.13Å; V119-T123 PolarHBondContact O-N 3.19Å; V119-T123 PolarHBondContact O-OG1 3.37Å
120	K	91.2	Very high	76.7	Confident	131 Å²	131	87 Å²	87	57%	0.57	45%	0.446	S	S	*	.	H	α-helix	trans	-60.9	-44.3	175.3	-69.5	172.1	-165.9	157.7	0	112.4	P116 D117 L118 L122 T123	P116-K120 WeakPolarHBondContact O-CG 3.28Å; P116-K120 PolarHBondContact O-N 3.49Å; D117-K120 PolarHBondContact O-N 2.89Å; D117-K120 IonicContact OD1-NZ 3.66Å; D117-K120 PolarHBondContact OD1-NZ 2.96Å; L118-K120 VanDerWaalsContact C-N 3.3Å; L118-K120 PolarHBondContact O-N 3.32Å; K120-L122 PolarHBondContact O-N 2.88Å; K120-T123 VanDerWaalsContact CA-OG1 3.27Å; K120-T123 WeakPolarHBondContact CA-OG1 3.48Å; K120-T123 PolarHBondContact O-N 2.94Å; K120-T123 PolarHBondContact O-OG1 3.1Å
121	L	88.3	Confident	74.5	Confident	103 Å²	103	92.5 Å²	92.5	54%	0.539	48%	0.481	S	S	.	.	H	α-helix	trans	-62.8	-28	175.4	-68.8	171.7	0	0	0	112.6	Y88 D117 L118	Y88-L121 HydrophobicContact CE2-CD1 4.07Å; D117-L121 WeakPolarHBondContact O-CG 3.27Å; D117-L121 PolarHBondContact O-N 3.35Å; L118-L121 PolarHBondContact O-N 3.11Å
122	L	88.5	Confident	71.6	Confident	7 Å²	7	95.2 Å²	95.2	4%	0.037	50%	0.498	C	S	.	.	H	α-helix	trans	-91.2	-17.7	-179.8	-64.6	172.9	0	0	0	113.2	L96 K103 L106 K107 A110 L118 V119 K120	L96-L122 HydrophobicContact CD1-CD2 3.75Å; K103-L122 WeakPolarHBondContact CE-O 3.46Å; K103-L122 HydrophobicContact CG-CD2 4.07Å; L106-L122 HydrophobicContact CB-CD1 4.49Å; L106-L122 HydrophobicContact CD2-CD1 4.21Å; L106-L122 HydrophobicContact CD2-CD2 4.08Å; L106-L122 HydrophobicContact CG-CD1 3.86Å; K107-L122 HydrophobicContact CB-CB 4.23Å; K107-L122 HydrophobicContact CB-CD1 4.36Å; K107-L122 HydrophobicContact CG-CB 4.37Å; A110-L122 HydrophobicContact CB-CD1 4.14Å; L118-L122 HydrophobicContact CD1-CD1 4.03Å; L118-L122 HydrophobicContact CD1-CG 4.15Å; L118-L122 HydrophobicContact CG-CD1 3.89Å; L118-L122 HydrophobicContact CG-CG 4.42Å; L118-L122 WeakPolarHBondContact O-CB 3.46Å; L118-L122 WeakPolarHBondContact O-CG 3.18Å; L118-L122 PolarHBondContact O-N 2.87Å; V119-L122 CarbonylContact O-C 3.55Å; V119-L122 PolarHBondContact O-N 3Å; V119-L122 VanDerWaalsContact O-N 3.13Å; K120-L122 PolarHBondContact O-N 2.88Å
123	T	84.6	Confident	68.7	Low	44 Å²	44	99.9 Å²	99.9	27%	0.27	52%	0.523	S	S	.	.	S	Bend	trans	-74.9	137.8	168.8	36.8	0	0	0	0	110.5	K107 V119 K120 D125	K107-T123 HydrophobicContact CD-CG2 4.24Å; K107-T123 VanDerWaalsContact NZ-CG2 3.34Å; V119-T123 PolarHBondContact O-N 3.19Å; V119-T123 PolarHBondContact O-OG1 3.37Å; K120-T123 VanDerWaalsContact CA-OG1 3.27Å; K120-T123 WeakPolarHBondContact CA-OG1 3.48Å; K120-T123 PolarHBondContact O-N 2.94Å; K120-T123 PolarHBondContact O-OG1 3.1Å; T123-D125 PolarHBondContact O-N 2.82Å
124	P	66.4	Low	65.8	Low	107 Å²	107	108 Å²	108	70%	0.695	56%	0.559	S	S	*	*			trans	-59.5	134	164.9	-14.3	28.3	0	0	0	108.9	E126	P124-E126 PolarHBondContact O-N 2.8Å; P124-E126 VanDerWaalsContact O-N 3.1Å
125	D	54.9	Low	63.3	Low	154 Å²	154	109.4 Å²	109.4	82%	0.824	58%	0.577	S	S	*	*			trans	-65.3	109.5	166.8	-91.2	-33.1	0	0	0	107.7	T123 I127	T123-D125 PolarHBondContact O-N 2.82Å; D125-I127 VanDerWaalsContact C-N 3.34Å; D125-I127 PolarHBondContact O-N 3.48Å
126	E	44.7	Very low	60.5	Low	183 Å²	183	116.8 Å²	116.8	86%	0.855	61%	0.611	S	S	*	*			trans	-65.4	100.7	161.6	-68.9	-174.3	166.5	0	0	106.9	P124 K128	P124-E126 PolarHBondContact O-N 2.8Å; P124-E126 VanDerWaalsContact O-N 3.1Å; E126-K128 PolarHBondContact O-N 2.9Å
127	I	43.3	Very low	58.1	Low	155 Å²	155	117.4 Å²	117.4	80%	0.795	62%	0.617	S	S	*	*			trans	-57.4	107.5	164.9	-63.5	172.3	0	0	0	106.2	D125 Q129	D125-I127 VanDerWaalsContact C-N 3.34Å; D125-I127 PolarHBondContact O-N 3.48Å; I127-Q129 PolarHBondContact O-N 2.83Å
128	K	36.9	Very low	55.3	Low	201 Å²	201	120.6 Å²	120.6	87%	0.874	63%	0.634	S	S	*	*			trans	-45.9	99.6	176.2	-68.3	172.2	177.6	175.7	0	110.8	E126	E126-K128 PolarHBondContact O-N 2.9Å
129	Q	33.5	Very low	52.7	Low	186 Å²	186	129.3 Å²	129.3	87%	0.869	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-93.8	128.4	149.8	-70.7	-177.3	0.4	0	0	106.6	I127	I127-Q129 PolarHBondContact O-N 2.83Å
130	S	29.9	Very low	50.3	Low	109 Å²	109	135.2 Å²	135.2	76%	0.762	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-58.1	157.2	-169.5	46.8	0	0	0	0	114.3
131	P	48.8	Very low	47.7	Very low	115 Å²	115	135.9 Å²	135.9	75%	0.747	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-84.4	130.2	-177.6	33.7	-28.4	0	0	0	110.5
132	D	35.8	Very low	45.1	Very low	152 Å²	152	134.9 Å²	134.9	81%	0.813	71%	0.714	S	S	*	*			trans	-149.2	111.4	149.3	-86.1	-34.9	0	0	0	109
133	E	37.4	Very low	42.8	Very low	179 Å²	179	139.2 Å²	139.2	84%	0.836	75%	0.745	S	S	*	*			trans	40.8	113.3	146.7	-57.1	-172.8	137.4	0	0	119.7
134	F	33.3	Very low	40.5	Very low	170 Å²	170	146.3 Å²	146.3	75%	0.746	78%	0.775	S	S	*	*				161.3	125.6	83.5	-159.2	-125.6	0	0	0	110.4	H136	F134-H136 AromaticContact CD1-CD2 3.48Å; F134-H136 VanDerWaalsContact CD1-CD2 3.48Å; F134-H136 WeakPolarHBondContact CD1-CD2 3.31Å; F134-H136 AromaticContact CD1-NE2 3.78Å; F134-H136 AromaticContact CE1-CD2 3.13Å; F134-H136 WeakPolarHBondContact CE1-CD2 3.26Å; F134-H136 AromaticContact CE1-NE2 2.93Å; F134-H136 WeakPolarHBondContact CE1-NE2 3.31Å; F134-H136 AromaticContact CZ-NE2 3.44Å; F134-H136 WeakPolarHBondContact CZ-NE2 3.32Å
135	C	45.5	Very low	38.7	Very low	113 Å²	113	145 Å²	145	76%	0.764	78%	0.781	S	S	*	*			trans	-68.4	139.5	170	-56.9	0	0	0	0	110
136	H	36.6	Very low	37.8	Very low	158 Å²	158	142.8 Å²	142.8	73%	0.731	78%	0.778	S	S	*	*			trans	-153.6	120.3	139.5	-89.3	-58.3	0	0	0	110.6	F134	F134-H136 AromaticContact CD1-CD2 3.48Å; F134-H136 VanDerWaalsContact CD1-CD2 3.48Å; F134-H136 WeakPolarHBondContact CD1-CD2 3.31Å; F134-H136 AromaticContact CD1-NE2 3.78Å; F134-H136 AromaticContact CE1-CD2 3.13Å; F134-H136 WeakPolarHBondContact CE1-CD2 3.26Å; F134-H136 AromaticContact CE1-NE2 2.93Å; F134-H136 WeakPolarHBondContact CE1-NE2 3.31Å; F134-H136 AromaticContact CZ-NE2 3.44Å; F134-H136 WeakPolarHBondContact CZ-NE2 3.32Å
137	S	42.7	Very low	37.3	Very low	91 Å²	91	140.6 Å²	140.6	64%	0.636	77%	0.772	S	S	*	*			trans	-77.1	167.5	164.6	51.8	0	0	0	0	111.1
138	D	32	Very low	36.7	Very low	148 Å²	148	139.8 Å²	139.8	79%	0.791	77%	0.774	S	S	*	*			trans	96.5	120.3	163	-49.3	-23.4	0	0	0	113.9
139	F	37.8	Very low	36.9	Very low	184 Å²	184	141.4 Å²	141.4	81%	0.807	78%	0.775	S	S	*	*				110.3	121.6	51.5	-161.4	-100.9	0	0	0	107.8
140	E	45.3	Very low	36.7	Very low	150 Å²	150	140.1 Å²	140.1	70%	0.701	77%	0.773	S	S	*	*			trans	62	128.9	169.3	-63	-86.7	114	0	0	119.2
141	D	34.7	Very low	36.9	Very low	145 Å²	145	140.7 Å²	140.7	78%	0.775	78%	0.775	S	S	*	*				173.7	158.4	85.6	-167.7	17.6	0	0	0	110
142	A	33.9	Very low	36.1	Very low	81 Å²	81	140.1 Å²	140.1	67%	0.669	77%	0.772	S	S	*	*			trans	-68.3	170.3	-173.3	0	0	0	0	0	115.8
143	S	40.4	Very low	36.1	Very low	98 Å²	98	137.6 Å²	137.6	69%	0.685	76%	0.763	S	S	*	*			trans	119.8	114.2	131.9	-158.8	0	0	0	0	117.6
144	Q	35.9	Very low	36.3	Very low	193 Å²	193	135.3 Å²	135.3	90%	0.902	77%	0.767	S	S	*	*			trans	65	134.3	136.2	-68.9	-167.4	47	0	0	123
145	G	29.5	Very low	36.7	Very low	80 Å²	80	131.6 Å²	131.6	83%	0.825	76%	0.762	S	S	*	*			trans	137.4	125.6	136	0	0	0	0	0	115.8
146	S	35.1	Very low	36.4	Very low	107 Å²	107	133.7 Å²	133.7	75%	0.748	77%	0.765	S	S	*	*			trans	-66.3	158.8	-171.2	-130.1	0	0	0	0	117.5
147	D	35.6	Very low	36.6	Very low	137 Å²	137	133.3 Å²	133.3	73%	0.733	77%	0.768	S	S	*	*			trans	51.5	114.2	145.5	-73.7	-59	0	0	0	120.6
148	T	30.4	Very low	36.6	Very low	138 Å²	138	134.2 Å²	134.2	85%	0.847	77%	0.771	S	S	*	*				179.8	152.7	101.4	31.4	0	0	0	0	111.2
149	R	40.9	Very low	37.4	Very low	235 Å²	235	134.1 Å²	134.1	89%	0.887	78%	0.776	S	S	*	*			trans	-40.9	135.6	-178.5	-53.9	171.9	-162.1	147.6	4.7	114.1
150	I	30.3	Very low	38	Very low	160 Å²	160	130.6 Å²	130.6	82%	0.821	77%	0.766	S	S	*	*				-178.7	127.3	128.1	-84.7	144.8	0	0	0	105.7	P152	I150-P152 WeakPolarHBondContact O-CD 3.35Å
151	C	32.8	Very low	38.7	Very low	120 Å²	120	128.8 Å²	128.8	81%	0.811	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-58.3	122.8	171.4	-55.5	0	0	0	0	109.2
152	P	33	Very low	40.8	Very low	104 Å²	104	129 Å²	129	68%	0.675	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-77.2	145.6	171.7	29.5	-27.4	0	0	0	109.5	I150	I150-P152 WeakPolarHBondContact O-CD 3.35Å
153	P	34.6	Very low	43.4	Very low	98 Å²	98	129.2 Å²	129.2	64%	0.636	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-60.2	144.6	175.3	26.1	-32	0	0	0	109.7	S155	P153-S155 PolarHBondContact O-N 3.28Å
154	S	42	Very low	46	Very low	131 Å²	131	124.7 Å²	124.7	92%	0.916	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	30.4	-171	-48.8	0	0	0	0	116.1
155	S	42.8	Very low	48.9	Very low	92 Å²	92	120.1 Å²	120.1	64%	0.643	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.3	4.3	-171.5	58.5	0	0	0	0	115.4	P153	P153-S155 PolarHBondContact O-N 3.28Å
156	L	38.6	Very low	52.1	Low	157 Å²	157	116.3 Å²	116.3	82%	0.822	64%	0.637	S	S	*	*	S	Bend	trans	-122.6	10.8	179.2	-68.5	176.8	0	0	0	115.2
157	L	41.1	Very low	55.2	Low	151 Å²	151	112.6 Å²	112.6	79%	0.791	61%	0.61	S	S	*	*	S	Bend	trans	-81.8	142.3	163	-74.7	172.3	0	0	0	108.8	T159	L157-T159 PolarHBondContact O-N 3.26Å
158	P	42.9	Very low	58.1	Low	109 Å²	109	106.1 Å²	106.1	71%	0.708	58%	0.575	S	S	*	*			trans	-47.4	132.6	173.2	-24.1	31.6	0	0	0	109.4	D160	P158-D160 PolarHBondContact O-N 3.16Å
159	T	48.4	Very low	61.2	Low	147 Å²	147	99.6 Å²	99.6	90%	0.902	54%	0.535	S	S	*	.	S	Bend	trans	-56.8	3.2	179.4	-25.6	0	0	0	0	113.6	L157 R161	L157-T159 PolarHBondContact O-N 3.26Å; T159-R161 PolarHBondContact O-N 3Å; T159-R161 VanDerWaalsContact O-N 3.14Å
160	D	50.1	Low	63.7	Low	109 Å²	109	89.3 Å²	89.3	58%	0.583	50%	0.497	S	S	*	.			trans	-84	102.3	-168.7	-151.1	29.4	0	0	0	110.7	P158	P158-D160 PolarHBondContact O-N 3.16Å
161	R	60.5	Low	66.4	Low	112 Å²	112	88.2 Å²	88.2	42%	0.423	48%	0.482	S	S	.	.			trans	87.6	62.7	156.8	-50.3	156.3	-172.3	-116.5	-3.1	116.7	T159 W163 R197	T159-R161 PolarHBondContact O-N 3Å; T159-R161 VanDerWaalsContact O-N 3.14Å; R161-W163 HydrophobicContact CG-CZ2 4.31Å; R161-W163 PolarHBondContact O-N 3.18Å; R161-R197 PolarHBondContact O-NH1 3.38Å; R161-R197 PolarHBondContact O-NH2 3.37Å
162	K	78.3	Confident	68.6	Low	149 Å²	149	83.3 Å²	83.3	65%	0.648	45%	0.452	S	S	*	.	S	Bend	trans	-59.8	-12.2	160.1	-68.4	-173.5	178.2	-178.6	0	113.4	R278	K162-R278 PolarHBondContact O-NE 2.96Å; K162-R278 PolarHBondContact O-NH2 2.88Å
163	W	88.8	Confident	70.2	Confident	86 Å²	86	83.3 Å²	83.3	33%	0.326	45%	0.454	S	S	.	.			trans	-96.1	159.4	177.8	62	-83.8	0	0	0	112.5	R161 R197 Y277 R278 L280	R161-W163 HydrophobicContact CG-CZ2 4.31Å; R161-W163 PolarHBondContact O-N 3.18Å; W163-R197 PolarHBondContact O-NH1 3.45Å; W163-Y277 AromaticContact CE3-CE2 3.99Å; W163-Y277 HydrophobicContact CE3-CE2 3.99Å; W163-Y277 VanDerWaalsContact CE3-OH 3.31Å; W163-R278 WeakPolarHBondContact CA-O 3.35Å; W163-R278 WeakPolarHBondContact CB-O 3.46Å; W163-L280 HydrophobicContact CB-CG 4.12Å; W163-L280 HydrophobicContact CG-CD1 4.08Å; W163-L280 HydrophobicContact CG-CG 3.94Å
164	G	93.7	Very high	71.6	Confident	3 Å²	3	81.6 Å²	81.6	3%	0.031	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.3	177.1	177.1	0	0	0	0	0	113.1	F245 Y277 R278	G164-F245 VanDerWaalsContact O-CE1 3.3Å; G164-F245 WeakPolarHBondContact O-CE1 3.41Å; G164-Y277 VanDerWaalsContact C-CD2 3.42Å; G164-Y277 WeakPolarHBondContact O-CD2 3.29Å; G164-R278 PolarHBondContact N-O 2.94Å; G164-R278 PolarHBondContact O-N 3.26Å; G164-R278 VanDerWaalsContact O-N 3.11Å
165	F	97.3	Very high	72.2	Confident	98 Å²	98	81 Å²	81	43%	0.43	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.5	178.9	-68.2	-88.2	0	0	0	111.6	V248 V275 F276 Y277	F165-V248 HydrophobicContact CE1-CG2 4.25Å; F165-V275 HydrophobicContact CD1-CG1 3.77Å; F165-V275 HydrophobicContact CE1-CG1 4.29Å; F165-F276 CarbonylContact C-O 3.52Å; F165-F276 VanDerWaalsContact CA-O 3.26Å; F165-F276 WeakPolarHBondContact CA-O 3.46Å; F165-Y277 AromaticContact CD1-CD2 3.69Å; F165-Y277 HydrophobicContact CD1-CD2 3.69Å; F165-Y277 HydrophobicContact CD1-CG 4.08Å; F165-Y277 AromaticContact CD2-CD2 3.62Å; F165-Y277 HydrophobicContact CD2-CD2 3.62Å; F165-Y277 AromaticContact CD2-CE2 3.88Å; F165-Y277 HydrophobicContact CD2-CE2 3.88Å; F165-Y277 AromaticContact CE1-CD2 3.6Å; F165-Y277 HydrophobicContact CE1-CD2 3.6Å; F165-Y277 HydrophobicContact CE1-CE2 4.46Å; F165-Y277 AromaticContact CE1-CG 3.75Å; F165-Y277 HydrophobicContact CE1-CG 3.75Å; F165-Y277 AromaticContact CE2-CD2 3.51Å; F165-Y277 HydrophobicContact CE2-CD2 3.51Å; F165-Y277 AromaticContact CE2-CE2 3.6Å; F165-Y277 HydrophobicContact CE2-CE2 3.6Å; F165-Y277 HydrophobicContact CE2-CG 4.35Å; F165-Y277 AromaticContact CG-CD2 3.7Å; F165-Y277 HydrophobicContact CG-CD2 3.7Å; F165-Y277 HydrophobicContact CG-CE2 4.42Å; F165-Y277 AromaticContact CZ-CD2 3.5Å; F165-Y277 HydrophobicContact CZ-CD2 3.5Å; F165-Y277 AromaticContact CZ-CE2 3.92Å; F165-Y277 HydrophobicContact CZ-CE2 3.92Å; F165-Y277 AromaticContact CZ-CG 3.89Å; F165-Y277 HydrophobicContact CZ-CG 3.89Å
166	I	98	Very high	72.8	Confident	0 Å²	0	84.3 Å²	84.3	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.2	162	-67.8	177.2	0	0	0	107	V168 V194 C195 L200 V204 F205 L240 F245 F276	I166-V168 HydrophobicContact CG2-CG1 4.2Å; I166-V194 HydrophobicContact CG2-CG1 4.14Å; I166-C195 WeakPolarHBondContact CA-O 3.27Å; I166-L200 HydrophobicContact CD1-CB 4Å; I166-L200 HydrophobicContact CG1-CB 4.27Å; I166-V204 HydrophobicContact CD1-CB 4.39Å; I166-V204 HydrophobicContact CD1-CG2 3.84Å; I166-F205 HydrophobicContact CG2-CE2 4.21Å; I166-L240 HydrophobicContact CB-CD2 4.07Å; I166-L240 HydrophobicContact CD1-CD2 3.76Å; I166-L240 HydrophobicContact CG1-CD2 4.49Å; I166-L240 HydrophobicContact CG2-CD2 3.98Å; I166-F245 HydrophobicContact CB-CD1 4.5Å; I166-F245 HydrophobicContact CB-CE1 4.17Å; I166-F245 HydrophobicContact CD1-CD1 4.48Å; I166-F245 HydrophobicContact CD1-CE1 3.77Å; I166-F245 HydrophobicContact CD1-CE2 4.08Å; I166-F245 HydrophobicContact CD1-CZ 3.55Å; I166-F245 HydrophobicContact CG1-CE1 3.74Å; I166-F245 HydrophobicContact CG1-CZ 3.98Å; I166-F276 PolarHBondContact N-O 3.02Å; I166-F276 WeakPolarHBondContact O-CA 3.35Å; I166-F276 WeakPolarHBondContact O-CB 3.4Å; I166-F276 PolarHBondContact O-N 3.27Å
167	T	98.5	Very high	73.1	Confident	29 Å²	29	79.5 Å²	79.5	18%	0.178	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.1	172.4	-56	0	0	0	0	108.7	C195 E273 Y274 V275	T167-C195 PolarHBondContact N-O 3.35Å; T167-C195 PolarHBondContact O-N 3.12Å; T167-E273 HydrophobicContact CG2-CB 4.03Å; T167-Y274 CarbonylContact C-O 3.53Å; T167-Y274 VanDerWaalsContact CA-O 3.32Å; T167-Y274 WeakPolarHBondContact CA-O 3.16Å; T167-V275 HydrophobicContact CG2-CG2 4.35Å
168	V	97.9	Very high	73.3	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138.5	171.7	-60.9	0	0	0	0	109.5	I166 I192 L193 V194 F205 F237 L240 E273 Y274 F276	I166-V168 HydrophobicContact CG2-CG1 4.2Å; V168-I192 HydrophobicContact CB-CG2 4.2Å; V168-L193 VanDerWaalsContact CA-O 3.29Å; V168-L193 WeakPolarHBondContact CA-O 3.47Å; V168-V194 HydrophobicContact CG1-CG2 4.39Å; V168-F205 HydrophobicContact CG1-CZ 4.13Å; V168-F237 HydrophobicContact CG2-CD1 4.18Å; V168-F237 HydrophobicContact CG2-CE1 3.67Å; V168-L240 HydrophobicContact CG1-CD1 3.95Å; V168-L240 HydrophobicContact CG2-CD1 4.5Å; V168-E273 CarbonylContact O-C 3.51Å; V168-E273 WeakPolarHBondContact O-CA 3.45Å; V168-Y274 HydrophobicContact CG2-CD2 4.35Å; V168-Y274 PolarHBondContact N-O 2.86Å; V168-Y274 PolarHBondContact O-N 2.8Å; V168-F276 HydrophobicContact CG2-CD2 4.17Å; V168-F276 HydrophobicContact CG2-CE2 3.72Å
169	G	95.3	Very high	73.6	Confident	1 Å²	1	88.5 Å²	88.5	1%	0.01	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	167.6	-178.4	0	0	0	0	0	112.7	I192 L193 T272	G169-I192 CarbonylContact O-C 3.45Å; G169-I192 WeakPolarHBondContact O-CA 3.35Å; G169-L193 PolarHBondContact N-O 2.85Å; G169-L193 PolarHBondContact O-N 3.07Å; G169-T272 CarbonylContact C-O 3.6Å; G169-T272 WeakPolarHBondContact CA-O 3.46Å
170	Y	93.1	Very high	73.6	Confident	20 Å²	20	85 Å²	85	8%	0.078	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	155.9	171	73.8	-79.6	0	0	0	110.3	R187 V189 R191 L233 T272	Y170-R187 VanDerWaalsContact CZ-NE 3.3Å; Y170-R187 VanDerWaalsContact OH-CZ 3.26Å; Y170-R187 PolarHBondContact OH-NE 3.05Å; Y170-R187 PolarHBondContact OH-NH2 2.92Å; Y170-V189 HydrophobicContact CD1-CG1 4.38Å; Y170-V189 HydrophobicContact CD1-CG2 4.41Å; Y170-V189 HydrophobicContact CD2-CG1 4.28Å; Y170-V189 HydrophobicContact CD2-CG2 4.33Å; Y170-V189 HydrophobicContact CE2-CG2 4.49Å; Y170-V189 HydrophobicContact CG-CG1 3.86Å; Y170-V189 HydrophobicContact CG-CG2 4.32Å; Y170-R191 VanDerWaalsContact CB-O 3.28Å; Y170-R191 WeakPolarHBondContact CB-O 3.43Å; Y170-L233 HydrophobicContact CD1-CD1 3.76Å; Y170-L233 HydrophobicContact CD1-CD2 4.36Å; Y170-L233 HydrophobicContact CE1-CD1 3.74Å; Y170-T272 HydrophobicContact CE1-CG2 4.31Å; Y170-T272 PolarHBondContact N-O 2.72Å; Y170-T272 PolarHBondContact O-N 3.24Å
171	R	86.4	Confident	73.1	Confident	137 Å²	137	87.1 Å²	87.1	52%	0.517	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	120.8	174.5	-166.6	179.3	-176.7	130	-4.1	109.5	P190 S269 S270 Y271	R171-P190 WeakPolarHBondContact O-CD 3.49Å; R171-P190 WeakPolarHBondContact O-CG 3.29Å; R171-S269 PolarHBondContact NE-OG 3.08Å; R171-S269 PolarHBondContact NH2-OG 2.88Å; R171-S270 CarbonylContact C-O 3.55Å; R171-S270 VanDerWaalsContact CA-O 3.29Å; R171-S270 WeakPolarHBondContact CA-O 3.34Å; R171-S270 WeakPolarHBondContact CG-O 3.14Å; R171-Y271 HydrophobicContact CB-CD2 4.44Å
172	G	78.8	Confident	72.4	Confident	17 Å²	17	87.3 Å²	87.3	18%	0.175	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	150.5	164.4	0	0	0	0	0	110.9	S269 S270	G172-S269 WeakPolarHBondContact O-CA 3.06Å; G172-S270 PolarHBondContact N-O 3.15Å; G172-S270 PolarHBondContact O-N 2.66Å; G172-S270 VanDerWaalsContact O-O 3.08Å
173	S	67.5	Low	70.6	Confident	103 Å²	103	83.9 Å²	83.9	72%	0.72	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.3	170.7	54.8	0	0	0	0	109
174	C	63.1	Low	68.7	Low	63 Å²	63	84 Å²	84	43%	0.426	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	117.8	168.1	49	0	0	0	0	109	W268	C174-W268 PolarHBondContact N-O 3.43Å; C174-W268 PolarHBondContact O-N 3.14Å; C174-W268 WeakPolarHBondContact SG-CB 3.3Å
175	T	55.9	Low	66.6	Low	118 Å²	118	91.6 Å²	91.6	72%	0.724	52%	0.516	S	S	*	.			trans	-93.6	109.2	167	52.8	0	0	0	0	106.5	G177	T175-G177 PolarHBondContact O-N 2.92Å
176	L	54.3	Low	64.5	Low	161 Å²	161	96.3 Å²	96.3	84%	0.843	54%	0.537	S	S	*	.			trans	-73.1	80.6	172.5	-171.4	69.9	0	0	0	108.1
177	G	46.3	Very low	62.6	Low	57 Å²	57	101.9 Å²	101.9	59%	0.588	56%	0.558	S	S	*	*			trans	-84.1	141.7	169.9	0	0	0	0	0	110	T175 E179	T175-G177 PolarHBondContact O-N 2.92Å; G177-E179 PolarHBondContact O-N 3.43Å
178	R	45.4	Very low	61.2	Low	249 Å²	249	111.3 Å²	111.3	94%	0.94	59%	0.59	S	S	*	*	S	Bend	trans	-47	127.3	178.7	-71	179.9	-166.8	-148.6	0.9	111.4
179	E	47.3	Very low	59.9	Low	199 Å²	199	112 Å²	112	93%	0.93	59%	0.594	S	S	*	*	S	Bend	trans	40.5	123.1	152.9	-144	175.5	-157.4	0	0	119.1	G177	G177-E179 PolarHBondContact O-N 3.43Å
180	G	49.6	Very low	59	Low	73 Å²	73	115.1 Å²	115.1	75%	0.753	61%	0.614	S	S	*	*			trans	104.8	48.6	149	0	0	0	0	0	118.1
181	Q	40.3	Very low	58.9	Low	155 Å²	155	118.6 Å²	118.6	72%	0.724	63%	0.628	S	S	*	*			trans	-168.3	104.5	141.2	-119.4	-163.3	-2.5	0	0	109.6	D183	Q181-D183 HydrophobicContact CB-CB 4.26Å; Q181-D183 PolarHBondContact O-N 2.78Å
182	A	44.7	Very low	59.3	Low	116 Å²	116	112.1 Å²	112.1	96%	0.959	60%	0.603	S	S	*	*			trans	-70.7	66.4	159.8	0	0	0	0	0	107.8	A184	A182-A184 PolarHBondContact O-N 2.84Å
183	D	40.2	Very low	60.2	Low	77 Å²	77	112.9 Å²	112.9	41%	0.412	60%	0.603	S	S	.	*			trans	-74.1	128.8	-178.2	-164.1	18.9	0	0	0	107.5	Q181 K185	Q181-D183 HydrophobicContact CB-CB 4.26Å; Q181-D183 PolarHBondContact O-N 2.78Å; D183-K185 HydrophobicContact CB-CD 4.3Å; D183-K185 HydrophobicContact CB-CG 4.15Å; D183-K185 PolarHBondContact O-N 2.75Å; D183-K185 VanDerWaalsContact OD2-CE 3.28Å; D183-K185 WeakPolarHBondContact OD2-CE 3.32Å
184	A	49.7	Very low	61.7	Low	88 Å²	88	108 Å²	108	73%	0.727	57%	0.569	S	S	*	*			trans	-64.4	71.3	-179.1	0	0	0	0	0	110	A182 F186	A182-A184 PolarHBondContact O-N 2.84Å; A184-F186 PolarHBondContact O-N 3.24Å
185	K	48.7	Very low	63.3	Low	163 Å²	163	106.2 Å²	106.2	71%	0.709	56%	0.557	S	S	*	*			trans	-85.6	100.6	-173.3	-76.6	174.3	177.5	163.9	0	108	D183	D183-K185 HydrophobicContact CB-CD 4.3Å; D183-K185 HydrophobicContact CB-CG 4.15Å; D183-K185 PolarHBondContact O-N 2.75Å; D183-K185 VanDerWaalsContact OD2-CE 3.28Å; D183-K185 WeakPolarHBondContact OD2-CE 3.32Å
186	F	52.7	Low	65.3	Low	197 Å²	197	101 Å²	101	86%	0.864	53%	0.527	S	S	*	.			trans	-37.4	140.8	160.9	-70.5	-87.3	0	0	0	110.6	A184 R188	A184-F186 PolarHBondContact O-N 3.24Å; F186-R188 PolarHBondContact O-N 3.35Å
187	R	59.8	Low	67.2	Low	116 Å²	116	94.2 Å²	94.2	44%	0.438	49%	0.49	S	S	.	.			trans	-57.5	92.7	179.9	-168.5	-175.6	-162.4	170.4	12.5	110.5	Y170 V189 Y274	Y170-R187 VanDerWaalsContact CZ-NE 3.3Å; Y170-R187 VanDerWaalsContact OH-CZ 3.26Å; Y170-R187 PolarHBondContact OH-NE 3.05Å; Y170-R187 PolarHBondContact OH-NH2 2.92Å; R187-V189 HydrophobicContact CG-CG2 4.05Å; R187-V189 PolarHBondContact O-N 3.41Å; R187-V189 VanDerWaalsContact O-N 3.07Å; R187-Y274 VanDerWaalsContact CZ-OH 3.24Å; R187-Y274 PolarHBondContact NH1-OH 3.16Å; R187-Y274 PolarHBondContact NH2-OH 2.82Å
188	R	68.6	Low	69.6	Low	227 Å²	227	91.6 Å²	91.6	86%	0.857	46%	0.462	S	S	*	.			trans	-77.1	96.2	176.5	-172	178.2	-179	-171.8	1	108.7	F186 P190	F186-R188 PolarHBondContact O-N 3.35Å; R188-P190 VanDerWaalsContact O-CD 3.22Å; R188-P190 WeakPolarHBondContact O-CD 3.44Å
189	V	70.3	Confident	71.9	Confident	14 Å²	14	81.6 Å²	81.6	9%	0.085	43%	0.431	C	S	.	.			trans	-82.9	106.7	174.4	179.3	0	0	0	0	108.3	Y170 R187 I192 K231 L233	Y170-V189 HydrophobicContact CD1-CG1 4.38Å; Y170-V189 HydrophobicContact CD1-CG2 4.41Å; Y170-V189 HydrophobicContact CD2-CG1 4.28Å; Y170-V189 HydrophobicContact CD2-CG2 4.33Å; Y170-V189 HydrophobicContact CE2-CG2 4.49Å; Y170-V189 HydrophobicContact CG-CG1 3.86Å; Y170-V189 HydrophobicContact CG-CG2 4.32Å; R187-V189 HydrophobicContact CG-CG2 4.05Å; R187-V189 PolarHBondContact O-N 3.41Å; R187-V189 VanDerWaalsContact O-N 3.07Å; V189-I192 HydrophobicContact CG1-CD1 4.46Å; V189-I192 HydrophobicContact CG1-CG1 3.63Å; V189-K231 WeakPolarHBondContact CB-O 3.34Å; V189-L233 HydrophobicContact CG1-CG 4.24Å; V189-L233 HydrophobicContact CG2-CD1 3.62Å; V189-L233 HydrophobicContact CG2-CG 3.95Å
190	P	76.3	Confident	74.2	Confident	67 Å²	67	72.1 Å²	72.1	44%	0.435	39%	0.386	S	S	.	.			trans	-73.3	-35.1	-173.7	28.1	-32.7	0	0	0	112	R171 R188 K231	R171-P190 WeakPolarHBondContact O-CD 3.49Å; R171-P190 WeakPolarHBondContact O-CG 3.29Å; R188-P190 VanDerWaalsContact O-CD 3.22Å; R188-P190 WeakPolarHBondContact O-CD 3.44Å; P190-K231 WeakPolarHBondContact O-CE 3.22Å
191	R	90.6	Very high	76.4	Confident	94 Å²	94	68.7 Å²	68.7	36%	0.355	35%	0.351	S	S	.	.			trans	-162.9	131.6	-177.3	-173	175.4	-61.9	-161.6	3.5	109.1	Y170 R213 Y227	Y170-R191 VanDerWaalsContact CB-O 3.28Å; Y170-R191 WeakPolarHBondContact CB-O 3.43Å; R191-R213 VanDerWaalsContact NH1-CZ 3.33Å; R191-Y227 HydrophobicContact CG-CD2 3.84Å; R191-Y227 HydrophobicContact CG-CG 4.02Å
192	I	96.1	Very high	79.1	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.333	C	S	.	.			trans	-91.7	116.5	173.7	-56.4	168.4	0	0	0	107.3	V168 G169 V189 Y227 L228 F230 H232 L233 A236	V168-I192 HydrophobicContact CB-CG2 4.2Å; G169-I192 CarbonylContact O-C 3.45Å; G169-I192 WeakPolarHBondContact O-CA 3.35Å; V189-I192 HydrophobicContact CG1-CD1 4.46Å; V189-I192 HydrophobicContact CG1-CG1 3.63Å; I192-Y227 CarbonylContact O-C 3.56Å; I192-Y227 WeakPolarHBondContact O-CA 3.49Å; I192-Y227 VanDerWaalsContact O-CB 3.23Å; I192-Y227 WeakPolarHBondContact O-CB 3.46Å; I192-L228 HydrophobicContact CB-CB 4.26Å; I192-L228 HydrophobicContact CB-CD1 4.03Å; I192-L228 HydrophobicContact CB-CG 4.27Å; I192-L228 HydrophobicContact CD1-CD1 4.22Å; I192-L228 HydrophobicContact CG2-CD1 3.75Å; I192-L228 HydrophobicContact CG2-CG 4.26Å; I192-L228 PolarHBondContact O-N 2.72Å; I192-F230 HydrophobicContact CD1-CD2 4.31Å; I192-F230 HydrophobicContact CD1-CE2 4.25Å; I192-H232 WeakPolarHBondContact CD1-O 3.13Å; I192-L233 HydrophobicContact CD1-CD2 3.95Å; I192-L233 HydrophobicContact CD1-CG 4.25Å; I192-L233 HydrophobicContact CG1-CD2 3.84Å; I192-L233 HydrophobicContact CG1-CG 4.37Å; I192-L233 HydrophobicContact CG2-CD2 4.11Å; I192-A236 HydrophobicContact CD1-CB 4.45Å
193	L	97.3	Very high	81.5	Confident	33 Å²	33	64.4 Å²	64.4	17%	0.173	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	144.3	174.1	-64.1	160.4	0	0	0	109.1	V168 G169 F226 Y271	V168-L193 VanDerWaalsContact CA-O 3.29Å; V168-L193 WeakPolarHBondContact CA-O 3.47Å; G169-L193 PolarHBondContact N-O 2.85Å; G169-L193 PolarHBondContact O-N 3.07Å; L193-F226 WeakPolarHBondContact CA-O 3.49Å; L193-Y271 HydrophobicContact CD1-CE2 3.76Å
194	V	98.1	Very high	84.2	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125	178.1	-176.9	0	0	0	0	108.6	I166 V168 A201 F205 L209 F226 L228	I166-V194 HydrophobicContact CG2-CG1 4.14Å; V168-V194 HydrophobicContact CG1-CG2 4.39Å; V194-A201 HydrophobicContact CG1-CB 4.14Å; V194-F205 HydrophobicContact CG1-CD2 4.07Å; V194-F205 HydrophobicContact CG1-CE2 3.73Å; V194-F205 HydrophobicContact CG2-CD2 4.39Å; V194-F205 HydrophobicContact CG2-CE2 4.13Å; V194-L209 HydrophobicContact CB-CD1 4.16Å; V194-L209 HydrophobicContact CG1-CD1 4.35Å; V194-L209 HydrophobicContact CG2-CD1 4.08Å; V194-F226 HydrophobicContact CB-CB 4.19Å; V194-F226 PolarHBondContact N-O 3.02Å; V194-L228 HydrophobicContact CG2-CD1 4.29Å; V194-L228 HydrophobicContact CG2-CD2 3.75Å; V194-L228 HydrophobicContact CG2-CG 3.73Å
195	C	98	Very high	86.4	Confident	25 Å²	25	57.1 Å²	57.1	17%	0.169	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	141.7	177.7	-53.9	0	0	0	0	109.3	I166 T167 T223 S224	I166-C195 WeakPolarHBondContact CA-O 3.27Å; T167-C195 PolarHBondContact N-O 3.35Å; T167-C195 PolarHBondContact O-N 3.12Å; C195-T223 CarbonylContact C-O 3.52Å; C195-T223 VanDerWaalsContact CA-O 3.27Å; C195-T223 WeakPolarHBondContact CA-O 3.1Å; C195-S224 VanDerWaalsContact SG-CA 3.57Å
196	G	96.8	Very high	88.6	Confident	10 Å²	10	51.2 Å²	51.2	10%	0.103	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.9	-168.2	179.1	0	0	0	0	0	112.7	Y222 T223	G196-Y222 CarbonylContact O-C 3.27Å; G196-Y222 VanDerWaalsContact O-CA 3.32Å; G196-Y222 WeakPolarHBondContact O-CA 3.19Å; G196-T223 PolarHBondContact N-O 3.25Å; G196-T223 PolarHBondContact O-N 2.74Å
197	R	95.6	Very high	90.7	Very high	18 Å²	18	50.4 Å²	50.4	7%	0.068	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	134.7	175	-159.4	177.2	68.7	-145.8	1.1	110.1	R161 W163 S199 L200 A201 Y222	R161-R197 PolarHBondContact O-NH1 3.38Å; R161-R197 PolarHBondContact O-NH2 3.37Å; W163-R197 PolarHBondContact O-NH1 3.45Å; R197-S199 PolarHBondContact NE-OG 2.92Å; R197-S199 PolarHBondContact NH2-OG 3.19Å; R197-S199 PolarHBondContact O-N 3.03Å; R197-L200 HydrophobicContact CB-CD1 4.2Å; R197-L200 HydrophobicContact CB-CG 4.35Å; R197-L200 VanDerWaalsContact NH2-CD2 3.28Å; R197-L200 VanDerWaalsContact NH2-CG 3.26Å; R197-L200 PolarHBondContact O-N 3.38Å; R197-A201 PolarHBondContact O-N 3.08Å; R197-Y222 HydrophobicContact CB-CD1 4.17Å; R197-Y222 HydrophobicContact CB-CE1 3.89Å; R197-Y222 HydrophobicContact CB-CE2 4.27Å; R197-Y222 HydrophobicContact CB-CG 4.49Å; R197-Y222 HydrophobicContact CG-CD2 4.3Å; R197-Y222 HydrophobicContact CG-CE2 4.04Å
198	I	95.3	Very high	92.5	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-43.5	-170.9	-69.6	172.4	0	0	0	111.3	L200 A201 K202 R217 R221 T223 F226	I198-L200 VanDerWaalsContact C-N 3.31Å; I198-L200 PolarHBondContact O-N 2.88Å; I198-A201 PolarHBondContact O-N 3.13Å; I198-K202 HydrophobicContact CG2-CD 4.03Å; I198-K202 HydrophobicContact CG2-CG 4.32Å; I198-K202 WeakPolarHBondContact O-CG 3.45Å; I198-K202 PolarHBondContact O-N 3.47Å; I198-R217 HydrophobicContact CD1-CB 3.6Å; I198-R217 HydrophobicContact CD1-CG 3.57Å; I198-R221 HydrophobicContact CD1-CB 4.25Å; I198-R221 VanDerWaalsContact CG1-O 3.31Å; I198-R221 WeakPolarHBondContact CG1-O 3.2Å; I198-R221 PolarHBondContact N-O 3.05Å; I198-T223 HydrophobicContact CD1-CG2 4.47Å; I198-T223 HydrophobicContact CG1-CG2 3.79Å; I198-F226 HydrophobicContact CG1-CE2 4.24Å; I198-F226 HydrophobicContact CG1-CZ 4.39Å; I198-F226 HydrophobicContact CG2-CE2 4.25Å; I198-F226 HydrophobicContact CG2-CZ 4.42Å
199	S	94.6	Very high	93.8	Very high	39 Å²	39	35.7 Å²	35.7	27%	0.273	19%	0.191	S	C	.	.	H	α-helix	trans	-57.8	-41.3	177.9	55.8	0	0	0	0	112.8	R197 E203 P219	R197-S199 PolarHBondContact NE-OG 2.92Å; R197-S199 PolarHBondContact NH2-OG 3.19Å; R197-S199 PolarHBondContact O-N 3.03Å; S199-E203 VanDerWaalsContact O-CB 3.31Å; S199-E203 WeakPolarHBondContact O-CB 3.22Å; S199-E203 PolarHBondContact O-N 3.38Å; S199-P219 VanDerWaalsContact CB-O 3.32Å; S199-P219 WeakPolarHBondContact CB-O 3.44Å; S199-P219 PolarHBondContact N-O 3.49Å; S199-P219 PolarHBondContact OG-O 3.49Å
200	L	95.6	Very high	95.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-70.7	-42.7	177.8	-62.7	176	0	0	0	112	I166 R197 I198 K202 E203 V204 F245 R278	I166-L200 HydrophobicContact CD1-CB 4Å; I166-L200 HydrophobicContact CG1-CB 4.27Å; R197-L200 HydrophobicContact CB-CD1 4.2Å; R197-L200 HydrophobicContact CB-CG 4.35Å; R197-L200 VanDerWaalsContact NH2-CD2 3.28Å; R197-L200 VanDerWaalsContact NH2-CG 3.26Å; R197-L200 PolarHBondContact O-N 3.38Å; I198-L200 VanDerWaalsContact C-N 3.31Å; I198-L200 PolarHBondContact O-N 2.88Å; L200-K202 VanDerWaalsContact C-N 3.31Å; L200-K202 PolarHBondContact O-N 3.17Å; L200-E203 PolarHBondContact O-N 3.32Å; L200-V204 WeakPolarHBondContact O-CG2 3.26Å; L200-V204 PolarHBondContact O-N 3.1Å; L200-F245 HydrophobicContact CB-CZ 4.37Å; L200-F245 HydrophobicContact CD1-CZ 4.35Å; L200-F245 HydrophobicContact CD2-CZ 4.43Å; L200-R278 VanDerWaalsContact CD2-NH2 3.34Å
201	A	96.3	Very high	96.1	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-62.7	-40.2	178.5	0	0	0	0	0	111.5	V194 R197 I198 F205 L209 F226	V194-A201 HydrophobicContact CG1-CB 4.14Å; R197-A201 PolarHBondContact O-N 3.08Å; I198-A201 PolarHBondContact O-N 3.13Å; A201-F205 WeakPolarHBondContact O-CB 3.48Å; A201-F205 WeakPolarHBondContact O-CD2 3.37Å; A201-F205 PolarHBondContact O-N 3.09Å; A201-L209 HydrophobicContact CB-CD2 4.07Å; A201-F226 HydrophobicContact CB-CD2 4.39Å
202	K	95.4	Very high	96.3	Very high	79 Å²	79	35.6 Å²	35.6	34%	0.343	20%	0.198	S	C	.	.	H	α-helix	trans	-68.4	-40.1	175.3	-71.2	-172.6	179.2	-156.3	0	112.4	I198 L200 G206 L209 E211	I198-K202 HydrophobicContact CG2-CD 4.03Å; I198-K202 HydrophobicContact CG2-CG 4.32Å; I198-K202 WeakPolarHBondContact O-CG 3.45Å; I198-K202 PolarHBondContact O-N 3.47Å; L200-K202 VanDerWaalsContact C-N 3.31Å; L200-K202 PolarHBondContact O-N 3.17Å; K202-G206 VanDerWaalsContact O-CA 3.26Å; K202-G206 WeakPolarHBondContact O-CA 3.38Å; K202-G206 PolarHBondContact O-N 3.09Å; K202-L209 HydrophobicContact CG-CD2 4.12Å; K202-E211 WeakPolarHBondContact CE-OE1 3.43Å; K202-E211 WeakPolarHBondContact CE-OE2 3.44Å; K202-E211 VanDerWaalsContact NZ-CD 3.31Å; K202-E211 IonicContact NZ-OE1 2.73Å; K202-E211 PolarHBondContact NZ-OE1 2.91Å; K202-E211 VanDerWaalsContact NZ-OE1 3.16Å; K202-E211 IonicContact NZ-OE2 3.55Å; K202-E211 PolarHBondContact NZ-OE2 2.64Å
203	E	95	Very high	96.1	Very high	102 Å²	102	41.2 Å²	41.2	48%	0.477	22%	0.219	S	C	.	.	H	α-helix	trans	-58.7	-47.6	175	-174.8	-167.8	150.5	0	0	111.6	S199 L200 R278	S199-E203 VanDerWaalsContact O-CB 3.31Å; S199-E203 WeakPolarHBondContact O-CB 3.22Å; S199-E203 PolarHBondContact O-N 3.38Å; L200-E203 PolarHBondContact O-N 3.32Å; E203-R278 IonicContact OE1-CZ 3.23Å; E203-R278 VanDerWaalsContact OE1-CZ 3.23Å; E203-R278 IonicContact OE1-NH1 2.72Å; E203-R278 PolarHBondContact OE1-NH1 3.14Å; E203-R278 IonicContact OE1-NH2 2.88Å; E203-R278 PolarHBondContact OE1-NH2 2.92Å; E203-R278 IonicContact OE2-CZ 3.85Å; E203-R278 IonicContact OE2-NH1 3.99Å; E203-R278 IonicContact OE2-NH2 2.82Å; E203-R278 PolarHBondContact OE2-NH2 2.94Å
204	V	96.6	Very high	95.8	Very high	10 Å²	10	41 Å²	41	6%	0.061	22%	0.218	C	C	.	.	H	α-helix	trans	-75.5	-48.4	-176.4	175.2	0	0	0	0	112.1	I166 L200 M239 L240 C243 F245	I166-V204 HydrophobicContact CD1-CB 4.39Å; I166-V204 HydrophobicContact CD1-CG2 3.84Å; L200-V204 WeakPolarHBondContact O-CG2 3.26Å; L200-V204 PolarHBondContact O-N 3.1Å; V204-M239 HydrophobicContact CG1-CB 4.31Å; V204-M239 WeakPolarHBondContact O-CE 3.43Å; V204-L240 HydrophobicContact CG1-CD2 3.83Å; V204-L240 HydrophobicContact CG1-CG 4.01Å; V204-L240 HydrophobicContact CG2-CD2 4.27Å; V204-C243 HydrophobicContact CG2-CB 3.87Å; V204-F245 HydrophobicContact CG2-CD2 4.08Å; V204-F245 HydrophobicContact CG2-CE2 3.57Å; V204-F245 HydrophobicContact CG2-CZ 4.32Å
205	F	97.3	Very high	95.5	Very high	3 Å²	3	44.4 Å²	44.4	1%	0.013	24%	0.241	C	C	.	.	H	α-helix	trans	-99.7	-17.7	-167.5	-61.8	-66.5	0	0	0	114.1	I166 V168 V194 A201 E207 T208 L209 L228 A236 M239 L240	I166-F205 HydrophobicContact CG2-CE2 4.21Å; V168-F205 HydrophobicContact CG1-CZ 4.13Å; V194-F205 HydrophobicContact CG1-CD2 4.07Å; V194-F205 HydrophobicContact CG1-CE2 3.73Å; V194-F205 HydrophobicContact CG2-CD2 4.39Å; V194-F205 HydrophobicContact CG2-CE2 4.13Å; A201-F205 WeakPolarHBondContact O-CB 3.48Å; A201-F205 WeakPolarHBondContact O-CD2 3.37Å; A201-F205 PolarHBondContact O-N 3.09Å; F205-E207 PolarHBondContact O-N 3.46Å; F205-T208 WeakPolarHBondContact O-CA 3.38Å; F205-T208 WeakPolarHBondContact O-CB 3.34Å; F205-T208 PolarHBondContact O-N 2.9Å; F205-T208 PolarHBondContact O-OG1 2.88Å; F205-L209 HydrophobicContact CB-CB 3.94Å; F205-L209 HydrophobicContact CB-CD1 4.11Å; F205-L209 HydrophobicContact CB-CG 4.47Å; F205-L209 HydrophobicContact CD2-CD1 4.24Å; F205-L209 HydrophobicContact CG-CD1 4.45Å; F205-L228 HydrophobicContact CB-CD2 3.91Å; F205-L228 HydrophobicContact CD1-CD1 4.17Å; F205-L228 HydrophobicContact CD1-CD2 3.53Å; F205-L228 HydrophobicContact CD2-CD2 4.16Å; F205-L228 HydrophobicContact CE1-CD1 3.95Å; F205-L228 HydrophobicContact CE1-CD2 4.06Å; F205-L228 HydrophobicContact CG-CD2 3.59Å; F205-L228 HydrophobicContact CZ-CD1 4.5Å; F205-A236 HydrophobicContact CE1-CB 4.18Å; F205-M239 HydrophobicContact CD1-CE 3.89Å; F205-M239 HydrophobicContact CD1-SD 4.23Å; F205-M239 HydrophobicContact CE1-CB 4.39Å; F205-L240 HydrophobicContact CE1-CG 4.41Å; F205-L240 HydrophobicContact CE2-CD2 4.44Å; F205-L240 HydrophobicContact CZ-CD1 3.95Å; F205-L240 HydrophobicContact CZ-CD2 4.11Å; F205-L240 HydrophobicContact CZ-CG 3.81Å
206	G	95	Very high	94.9	Very high	39 Å²	39	51.1 Å²	51.1	40%	0.402	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	44.2	-127.6	177.8	0	0	0	0	0	112.9	K202 T208 L209	K202-G206 VanDerWaalsContact O-CA 3.26Å; K202-G206 WeakPolarHBondContact O-CA 3.38Å; K202-G206 PolarHBondContact O-N 3.09Å; G206-T208 PolarHBondContact O-N 2.98Å; G206-T208 VanDerWaalsContact O-N 3.17Å; G206-L209 VanDerWaalsContact O-CB 3.3Å; G206-L209 WeakPolarHBondContact O-CB 3.48Å; G206-L209 PolarHBondContact O-N 2.86Å; G206-L209 VanDerWaalsContact O-N 3.17Å
207	E	95.8	Very high	94.5	Very high	179 Å²	179	54.9 Å²	54.9	84%	0.836	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-66.8	-15.4	-178.8	-58.6	-173.3	166	0	0	114.4	F205 L209 K229	F205-E207 PolarHBondContact O-N 3.46Å; E207-L209 VanDerWaalsContact C-N 3.25Å; E207-K229 WeakPolarHBondContact O-CD 3.42Å; E207-K229 WeakPolarHBondContact O-CE 3.49Å; E207-K229 PolarHBondContact O-NZ 3.29Å
208	T	97.4	Very high	94	Very high	28 Å²	28	55.9 Å²	55.9	17%	0.172	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-78.3	-14.3	177.6	75	0	0	0	0	112.6	F205 G206 K229 F230 M239	F205-T208 WeakPolarHBondContact O-CA 3.38Å; F205-T208 WeakPolarHBondContact O-CB 3.34Å; F205-T208 PolarHBondContact O-N 2.9Å; F205-T208 PolarHBondContact O-OG1 2.88Å; G206-T208 PolarHBondContact O-N 2.98Å; G206-T208 VanDerWaalsContact O-N 3.17Å; T208-K229 WeakPolarHBondContact O-CG 3.4Å; T208-K229 PolarHBondContact O-N 3.12Å; T208-F230 HydrophobicContact CG2-CD1 4.36Å; T208-F230 HydrophobicContact CG2-CE1 4.11Å; T208-M239 HydrophobicContact CG2-CE 4.31Å
209	L	97.6	Very high	93.7	Very high	7 Å²	7	59.4 Å²	59.4	4%	0.037	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	139.8	174.4	-161.1	62.9	0	0	0	110.3	V194 A201 K202 F205 G206 E207 F226 L228 K229	V194-L209 HydrophobicContact CB-CD1 4.16Å; V194-L209 HydrophobicContact CG1-CD1 4.35Å; V194-L209 HydrophobicContact CG2-CD1 4.08Å; A201-L209 HydrophobicContact CB-CD2 4.07Å; K202-L209 HydrophobicContact CG-CD2 4.12Å; F205-L209 HydrophobicContact CB-CB 3.94Å; F205-L209 HydrophobicContact CB-CD1 4.11Å; F205-L209 HydrophobicContact CB-CG 4.47Å; F205-L209 HydrophobicContact CD2-CD1 4.24Å; F205-L209 HydrophobicContact CG-CD1 4.45Å; G206-L209 VanDerWaalsContact O-CB 3.3Å; G206-L209 WeakPolarHBondContact O-CB 3.48Å; G206-L209 PolarHBondContact O-N 2.86Å; G206-L209 VanDerWaalsContact O-N 3.17Å; E207-L209 VanDerWaalsContact C-N 3.25Å; L209-F226 HydrophobicContact CD1-CB 3.88Å; L209-F226 HydrophobicContact CD1-CD2 4.1Å; L209-F226 HydrophobicContact CD1-CG 4.35Å; L209-F226 HydrophobicContact CD2-CD2 3.56Å; L209-F226 HydrophobicContact CD2-CE2 3.81Å; L209-F226 HydrophobicContact CD2-CG 4.4Å; L209-F226 HydrophobicContact CG-CB 4.34Å; L209-F226 HydrophobicContact CG-CD2 3.95Å; L209-F226 HydrophobicContact CG-CG 4.33Å; L209-L228 HydrophobicContact CD1-CD2 3.99Å; L209-K229 WeakPolarHBondContact O-CE 3.44Å
210	N	97.1	Very high	93.3	Very high	36 Å²	36	63.1 Å²	63.1	19%	0.193	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	116.8	173.2	-168.8	-48.5	0	0	0	109.9	S212 Y227 K229	N210-S212 WeakPolarHBondContact OD1-CB 3.45Å; N210-S212 PolarHBondContact OD1-N 3.14Å; N210-S212 PolarHBondContact OD1-OG 3.16Å; N210-S212 VanDerWaalsContact OD1-OG 3.07Å; N210-Y227 WeakPolarHBondContact CA-O 3.33Å; N210-Y227 HydrophobicContact CB-CD1 4.21Å; N210-Y227 HydrophobicContact CB-CD2 3.93Å; N210-Y227 HydrophobicContact CB-CE1 3.92Å; N210-Y227 HydrophobicContact CB-CE2 3.67Å; N210-Y227 HydrophobicContact CB-CG 4.21Å; N210-Y227 VanDerWaalsContact CB-O 3.23Å; N210-Y227 WeakPolarHBondContact CB-O 3.42Å; N210-Y227 PolarHBondContact N-O 3.2Å; N210-Y227 PolarHBondContact ND2-OH 2.92Å; N210-Y227 VanDerWaalsContact ND2-OH 3.12Å; N210-Y227 PolarHBondContact O-N 3.26Å; N210-Y227 WeakPolarHBondContact OD1-CE1 3.43Å; N210-Y227 VanDerWaalsContact OD1-CZ 3.29Å; N210-Y227 PolarHBondContact OD1-OH 3.03Å; N210-Y227 VanDerWaalsContact OD1-OH 3.07Å; N210-K229 HydrophobicContact CB-CG 4.21Å
211	E	96.4	Very high	93.2	Very high	58 Å²	58	70.3 Å²	70.3	27%	0.271	36%	0.361	S	S	.	.			trans	-98.1	2.3	-175.1	-55.5	-176.4	-135.7	0	0	112.9	K202 R213 D214 F226	K202-E211 WeakPolarHBondContact CE-OE1 3.43Å; K202-E211 WeakPolarHBondContact CE-OE2 3.44Å; K202-E211 VanDerWaalsContact NZ-CD 3.31Å; K202-E211 IonicContact NZ-OE1 2.73Å; K202-E211 PolarHBondContact NZ-OE1 2.91Å; K202-E211 VanDerWaalsContact NZ-OE1 3.16Å; K202-E211 IonicContact NZ-OE2 3.55Å; K202-E211 PolarHBondContact NZ-OE2 2.64Å; E211-R213 PolarHBondContact O-N 3.04Å; E211-D214 CarbonylContact O-C 3.59Å; E211-D214 VanDerWaalsContact O-C 3.27Å; E211-D214 PolarHBondContact O-N 3.38Å; E211-F226 HydrophobicContact CB-CD1 4.29Å; E211-F226 HydrophobicContact CB-CE1 3.74Å; E211-F226 HydrophobicContact CB-CZ 4.14Å; E211-F226 HydrophobicContact CG-CD1 4.3Å; E211-F226 HydrophobicContact CG-CE1 3.78Å; E211-F226 HydrophobicContact CG-CE2 4.22Å; E211-F226 HydrophobicContact CG-CZ 3.72Å
212	S	94.6	Very high	93.1	Very high	79 Å²	79	76.6 Å²	76.6	55%	0.552	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-15.5	-168	80.2	0	0	0	0	115.1	N210 Y227	N210-S212 WeakPolarHBondContact OD1-CB 3.45Å; N210-S212 PolarHBondContact OD1-N 3.14Å; N210-S212 PolarHBondContact OD1-OG 3.16Å; N210-S212 VanDerWaalsContact OD1-OG 3.07Å; S212-Y227 PolarHBondContact OG-OH 3.18Å; S212-Y227 VanDerWaalsContact OG-OH 3.05Å
213	R	92.3	Very high	93.2	Very high	118 Å²	118	73.2 Å²	73.2	45%	0.445	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-10.9	179.5	-74.9	-177.8	167.1	-167.7	-5.7	113.6	R191 E211 R225 Y227	R191-R213 VanDerWaalsContact NH1-CZ 3.33Å; E211-R213 PolarHBondContact O-N 3.04Å; R213-R225 HydrophobicContact CB-CB 4.31Å; R213-R225 PolarHBondContact O-NE 3.18Å; R213-R225 PolarHBondContact O-NH2 3.21Å; R213-Y227 HydrophobicContact CG-CE1 4.06Å
214	D	91.6	Very high	93.2	Very high	27 Å²	27	72.3 Å²	72.3	14%	0.144	38%	0.376	C	S	.	.	S	Bend	trans	-156.5	58	-177.1	-163.1	32.9	0	0	0	110.5	E211 R217 T223 R225 F226	E211-D214 CarbonylContact O-C 3.59Å; E211-D214 VanDerWaalsContact O-C 3.27Å; E211-D214 PolarHBondContact O-N 3.38Å; D214-R217 VanDerWaalsContact OD2-CD 3.26Å; D214-R217 WeakPolarHBondContact OD2-CD 3.44Å; D214-R217 IonicContact OD2-NE 2.7Å; D214-T223 VanDerWaalsContact OD2-CB 3.31Å; D214-T223 WeakPolarHBondContact OD2-CB 3.36Å; D214-T223 PolarHBondContact OD2-OG1 3.04Å; D214-R225 HydrophobicContact CB-CB 3.81Å; D214-F226 HydrophobicContact CB-CD1 4.39Å; D214-F226 HydrophobicContact CB-CE1 4.09Å
215	P	90.6	Very high	93.2	Very high	74 Å²	74	78.2 Å²	78.2	48%	0.481	40%	0.398	S	S	.	.			trans	-70.5	165.8	-178.4	32.2	-36.5	0	0	0	112.2	R217	P215-R217 VanDerWaalsContact C-N 3.28Å; P215-R217 PolarHBondContact O-N 3.45Å
216	D	86.4	Confident	93.2	Very high	166 Å²	166	78.1 Å²	78.1	89%	0.888	40%	0.397	S	S	*	.	S	Bend	trans	61	28.4	167.7	-50.2	-44.5	0	0	0	115.9
217	R	87.8	Confident	93.3	Very high	88 Å²	88	77.7 Å²	77.7	33%	0.332	38%	0.383	S	S	.	.			trans	-98.7	134.2	-177.9	-157.2	162.2	-169.3	-92.1	14.5	111.4	I198 D214 P215 R221 Y222	I198-R217 HydrophobicContact CD1-CB 3.6Å; I198-R217 HydrophobicContact CD1-CG 3.57Å; D214-R217 VanDerWaalsContact OD2-CD 3.26Å; D214-R217 WeakPolarHBondContact OD2-CD 3.44Å; D214-R217 IonicContact OD2-NE 2.7Å; P215-R217 VanDerWaalsContact C-N 3.28Å; P215-R217 PolarHBondContact O-N 3.45Å; R217-R221 HydrophobicContact CG-CB 4.35Å; R217-Y222 VanDerWaalsContact CZ-O 3.26Å; R217-Y222 PolarHBondContact NH1-O 3.45Å; R217-Y222 PolarHBondContact NH2-O 3.47Å
218	A	86.4	Confident	93.4	Very high	39 Å²	39	69.4 Å²	69.4	32%	0.322	35%	0.345	S	S	.	.			trans	-61	139.4	-173.1	0	0	0	0	0	112.6	E220 R221	A218-E220 VanDerWaalsContact C-N 3.25Å; A218-E220 WeakPolarHBondContact CB-OE1 3.42Å; A218-E220 WeakPolarHBondContact CB-OE2 3.43Å; A218-E220 PolarHBondContact O-N 2.73Å; A218-E220 VanDerWaalsContact O-N 3.14Å; A218-R221 HydrophobicContact CB-CG 4.16Å; A218-R221 WeakPolarHBondContact O-CB 3.42Å; A218-R221 PolarHBondContact O-N 3Å
219	P	88.6	Confident	93.4	Very high	75 Å²	75	74.5 Å²	74.5	49%	0.487	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-28.4	-169.6	-25.7	34.8	0	0	0	115.6	S199 R221	S199-P219 VanDerWaalsContact CB-O 3.32Å; S199-P219 WeakPolarHBondContact CB-O 3.44Å; S199-P219 PolarHBondContact N-O 3.49Å; S199-P219 PolarHBondContact OG-O 3.49Å; P219-R221 VanDerWaalsContact C-N 3.3Å
220	E	86.2	Confident	93.2	Very high	117 Å²	117	75 Å²	75	55%	0.547	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-13.2	179.6	73.1	-66.9	159.1	0	0	113.6	A218	A218-E220 VanDerWaalsContact C-N 3.25Å; A218-E220 WeakPolarHBondContact CB-OE1 3.42Å; A218-E220 WeakPolarHBondContact CB-OE2 3.43Å; A218-E220 PolarHBondContact O-N 2.73Å; A218-E220 VanDerWaalsContact O-N 3.14Å
221	R	92.6	Very high	93.1	Very high	151 Å²	151	79.4 Å²	79.4	57%	0.57	38%	0.384	S	S	*	.	S	Bend	trans	-81.4	166.8	179.6	-62.1	-66.9	-160.5	133.7	3	112.6	I198 R217 A218 P219	I198-R221 HydrophobicContact CD1-CB 4.25Å; I198-R221 VanDerWaalsContact CG1-O 3.31Å; I198-R221 WeakPolarHBondContact CG1-O 3.2Å; I198-R221 PolarHBondContact N-O 3.05Å; R217-R221 HydrophobicContact CG-CB 4.35Å; A218-R221 HydrophobicContact CB-CG 4.16Å; A218-R221 WeakPolarHBondContact O-CB 3.42Å; A218-R221 PolarHBondContact O-N 3Å; P219-R221 VanDerWaalsContact C-N 3.3Å
222	Y	95.5	Very high	92.8	Very high	134 Å²	134	82.8 Å²	82.8	53%	0.525	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128	-178.8	-77.7	-102.7	0	0	0	113.1	G196 R197 R217	G196-Y222 CarbonylContact O-C 3.27Å; G196-Y222 VanDerWaalsContact O-CA 3.32Å; G196-Y222 WeakPolarHBondContact O-CA 3.19Å; R197-Y222 HydrophobicContact CB-CD1 4.17Å; R197-Y222 HydrophobicContact CB-CE1 3.89Å; R197-Y222 HydrophobicContact CB-CE2 4.27Å; R197-Y222 HydrophobicContact CB-CG 4.49Å; R197-Y222 HydrophobicContact CG-CD2 4.3Å; R197-Y222 HydrophobicContact CG-CE2 4.04Å; R217-Y222 VanDerWaalsContact CZ-O 3.26Å; R217-Y222 PolarHBondContact NH1-O 3.45Å; R217-Y222 PolarHBondContact NH2-O 3.47Å
223	T	95.9	Very high	92.8	Very high	8 Å²	8	79.1 Å²	79.1	5%	0.049	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	158.4	177.5	-173.1	0	0	0	0	111.8	C195 G196 I198 D214 R225 F226	C195-T223 CarbonylContact C-O 3.52Å; C195-T223 VanDerWaalsContact CA-O 3.27Å; C195-T223 WeakPolarHBondContact CA-O 3.1Å; G196-T223 PolarHBondContact N-O 3.25Å; G196-T223 PolarHBondContact O-N 2.74Å; I198-T223 HydrophobicContact CD1-CG2 4.47Å; I198-T223 HydrophobicContact CG1-CG2 3.79Å; D214-T223 VanDerWaalsContact OD2-CB 3.31Å; D214-T223 WeakPolarHBondContact OD2-CB 3.36Å; D214-T223 PolarHBondContact OD2-OG1 3.04Å; T223-R225 PolarHBondContact OG1-N 3.41Å; T223-F226 HydrophobicContact CG2-CB 4.46Å; T223-F226 HydrophobicContact CG2-CD1 4.08Å; T223-F226 HydrophobicContact CG2-CD2 3.48Å; T223-F226 VanDerWaalsContact CG2-CD2 3.48Å; T223-F226 HydrophobicContact CG2-CE1 4.2Å; T223-F226 HydrophobicContact CG2-CE2 3.64Å; T223-F226 HydrophobicContact CG2-CG 3.73Å; T223-F226 HydrophobicContact CG2-CZ 4.01Å
224	S	96.4	Very high	92.8	Very high	82 Å²	82	78.6 Å²	78.6	57%	0.573	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	16.8	171.3	67.3	0	0	0	0	112.3	C195	C195-S224 VanDerWaalsContact SG-CA 3.57Å
225	R	95.4	Very high	93	Very high	135 Å²	135	83.1 Å²	83.1	51%	0.509	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	-6.7	-166.1	-62	-172	70.6	177.6	0	114	R213 D214 T223	R213-R225 HydrophobicContact CB-CB 4.31Å; R213-R225 PolarHBondContact O-NE 3.18Å; R213-R225 PolarHBondContact O-NH2 3.21Å; D214-R225 HydrophobicContact CB-CB 3.81Å; T223-R225 PolarHBondContact OG1-N 3.41Å
226	F	97.8	Very high	93.3	Very high	0 Å²	0	79.6 Å²	79.6	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	158	175.9	-69.6	-9.6	0	0	0	111.7	L193 V194 I198 A201 L209 E211 D214 T223	L193-F226 WeakPolarHBondContact CA-O 3.49Å; V194-F226 HydrophobicContact CB-CB 4.19Å; V194-F226 PolarHBondContact N-O 3.02Å; I198-F226 HydrophobicContact CG1-CE2 4.24Å; I198-F226 HydrophobicContact CG1-CZ 4.39Å; I198-F226 HydrophobicContact CG2-CE2 4.25Å; I198-F226 HydrophobicContact CG2-CZ 4.42Å; A201-F226 HydrophobicContact CB-CD2 4.39Å; L209-F226 HydrophobicContact CD1-CB 3.88Å; L209-F226 HydrophobicContact CD1-CD2 4.1Å; L209-F226 HydrophobicContact CD1-CG 4.35Å; L209-F226 HydrophobicContact CD2-CD2 3.56Å; L209-F226 HydrophobicContact CD2-CE2 3.81Å; L209-F226 HydrophobicContact CD2-CG 4.4Å; L209-F226 HydrophobicContact CG-CB 4.34Å; L209-F226 HydrophobicContact CG-CD2 3.95Å; L209-F226 HydrophobicContact CG-CG 4.33Å; E211-F226 HydrophobicContact CB-CD1 4.29Å; E211-F226 HydrophobicContact CB-CE1 3.74Å; E211-F226 HydrophobicContact CB-CZ 4.14Å; E211-F226 HydrophobicContact CG-CD1 4.3Å; E211-F226 HydrophobicContact CG-CE1 3.78Å; E211-F226 HydrophobicContact CG-CE2 4.22Å; E211-F226 HydrophobicContact CG-CZ 3.72Å; D214-F226 HydrophobicContact CB-CD1 4.39Å; D214-F226 HydrophobicContact CB-CE1 4.09Å; T223-F226 HydrophobicContact CG2-CB 4.46Å; T223-F226 HydrophobicContact CG2-CD1 4.08Å; T223-F226 HydrophobicContact CG2-CD2 3.48Å; T223-F226 VanDerWaalsContact CG2-CD2 3.48Å; T223-F226 HydrophobicContact CG2-CE1 4.2Å; T223-F226 HydrophobicContact CG2-CE2 3.64Å; T223-F226 HydrophobicContact CG2-CG 3.73Å; T223-F226 HydrophobicContact CG2-CZ 4.01Å
227	Y	97.6	Very high	93.8	Very high	30 Å²	30	73.5 Å²	73.5	12%	0.118	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	155.7	174.9	61.1	-79.7	0	0	0	111.3	R191 I192 N210 S212 R213	R191-Y227 HydrophobicContact CG-CD2 3.84Å; R191-Y227 HydrophobicContact CG-CG 4.02Å; I192-Y227 CarbonylContact O-C 3.56Å; I192-Y227 WeakPolarHBondContact O-CA 3.49Å; I192-Y227 VanDerWaalsContact O-CB 3.23Å; I192-Y227 WeakPolarHBondContact O-CB 3.46Å; N210-Y227 WeakPolarHBondContact CA-O 3.33Å; N210-Y227 HydrophobicContact CB-CD1 4.21Å; N210-Y227 HydrophobicContact CB-CD2 3.93Å; N210-Y227 HydrophobicContact CB-CE1 3.92Å; N210-Y227 HydrophobicContact CB-CE2 3.67Å; N210-Y227 HydrophobicContact CB-CG 4.21Å; N210-Y227 VanDerWaalsContact CB-O 3.23Å; N210-Y227 WeakPolarHBondContact CB-O 3.42Å; N210-Y227 PolarHBondContact N-O 3.2Å; N210-Y227 PolarHBondContact ND2-OH 2.92Å; N210-Y227 VanDerWaalsContact ND2-OH 3.12Å; N210-Y227 PolarHBondContact O-N 3.26Å; N210-Y227 WeakPolarHBondContact OD1-CE1 3.43Å; N210-Y227 VanDerWaalsContact OD1-CZ 3.29Å; N210-Y227 PolarHBondContact OD1-OH 3.03Å; N210-Y227 VanDerWaalsContact OD1-OH 3.07Å; S212-Y227 PolarHBondContact OG-OH 3.18Å; S212-Y227 VanDerWaalsContact OG-OH 3.05Å; R213-Y227 HydrophobicContact CG-CE1 4.06Å
228	L	97.9	Very high	94.1	Very high	5 Å²	5	73.8 Å²	73.8	3%	0.026	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	146.4	179.8	-57.1	177	0	0	0	111.3	I192 V194 F205 L209 F230 A236	I192-L228 HydrophobicContact CB-CB 4.26Å; I192-L228 HydrophobicContact CB-CD1 4.03Å; I192-L228 HydrophobicContact CB-CG 4.27Å; I192-L228 HydrophobicContact CD1-CD1 4.22Å; I192-L228 HydrophobicContact CG2-CD1 3.75Å; I192-L228 HydrophobicContact CG2-CG 4.26Å; I192-L228 PolarHBondContact O-N 2.72Å; V194-L228 HydrophobicContact CG2-CD1 4.29Å; V194-L228 HydrophobicContact CG2-CD2 3.75Å; V194-L228 HydrophobicContact CG2-CG 3.73Å; F205-L228 HydrophobicContact CB-CD2 3.91Å; F205-L228 HydrophobicContact CD1-CD1 4.17Å; F205-L228 HydrophobicContact CD1-CD2 3.53Å; F205-L228 HydrophobicContact CD2-CD2 4.16Å; F205-L228 HydrophobicContact CE1-CD1 3.95Å; F205-L228 HydrophobicContact CE1-CD2 4.06Å; F205-L228 HydrophobicContact CG-CD2 3.59Å; F205-L228 HydrophobicContact CZ-CD1 4.5Å; L209-L228 HydrophobicContact CD1-CD2 3.99Å; L228-F230 HydrophobicContact CB-CD1 4.38Å; L228-F230 HydrophobicContact CB-CE1 4.28Å; L228-F230 HydrophobicContact CB-CZ 4.37Å; L228-F230 HydrophobicContact CD1-CE1 4.21Å; L228-F230 HydrophobicContact CD1-CE2 3.81Å; L228-F230 HydrophobicContact CD1-CZ 3.58Å; L228-F230 HydrophobicContact CG-CZ 4.41Å; L228-F230 PolarHBondContact O-N 3.31Å; L228-A236 HydrophobicContact CD1-CB 3.56Å
229	K	96.1	Very high	94.6	Very high	135 Å²	135	73.5 Å²	73.5	59%	0.587	34%	0.335	S	S	*	.	S	Bend	trans	-70.9	-19.7	175.4	-66.9	176.2	-175	170.9	0	112.5	E207 T208 L209 N210	E207-K229 WeakPolarHBondContact O-CD 3.42Å; E207-K229 WeakPolarHBondContact O-CE 3.49Å; E207-K229 PolarHBondContact O-NZ 3.29Å; T208-K229 WeakPolarHBondContact O-CG 3.4Å; T208-K229 PolarHBondContact O-N 3.12Å; L209-K229 WeakPolarHBondContact O-CE 3.44Å; N210-K229 HydrophobicContact CB-CG 4.21Å
230	F	95.1	Very high	95	Very high	19 Å²	19	70 Å²	70	8%	0.083	31%	0.312	C	S	.	.	S	Bend	trans	-106.3	171.4	174.8	63.1	-97.8	0	0	0	112.1	I192 T208 L228 H232 R235 A236 M239	I192-F230 HydrophobicContact CD1-CD2 4.31Å; I192-F230 HydrophobicContact CD1-CE2 4.25Å; T208-F230 HydrophobicContact CG2-CD1 4.36Å; T208-F230 HydrophobicContact CG2-CE1 4.11Å; L228-F230 HydrophobicContact CB-CD1 4.38Å; L228-F230 HydrophobicContact CB-CE1 4.28Å; L228-F230 HydrophobicContact CB-CZ 4.37Å; L228-F230 HydrophobicContact CD1-CE1 4.21Å; L228-F230 HydrophobicContact CD1-CE2 3.81Å; L228-F230 HydrophobicContact CD1-CZ 3.58Å; L228-F230 HydrophobicContact CG-CZ 4.41Å; L228-F230 PolarHBondContact O-N 3.31Å; F230-H232 WeakPolarHBondContact CE2-O 3.45Å; F230-R235 HydrophobicContact CD2-CB 4.29Å; F230-R235 HydrophobicContact CD2-CG 4.28Å; F230-R235 HydrophobicContact CE1-CG 4.47Å; F230-R235 HydrophobicContact CE2-CB 3.82Å; F230-R235 HydrophobicContact CE2-CG 3.77Å; F230-R235 HydrophobicContact CZ-CB 4.38Å; F230-R235 HydrophobicContact CZ-CG 3.87Å; F230-A236 HydrophobicContact CE2-CB 3.99Å; F230-A236 HydrophobicContact CZ-CB 4.17Å; F230-M239 HydrophobicContact CE1-SD 3.83Å; F230-M239 HydrophobicContact CZ-SD 3.67Å
231	K	93.1	Very high	95.3	Very high	128 Å²	128	68 Å²	68	56%	0.557	31%	0.311	S	S	*	.			trans	-122.2	-7.2	-170.4	-63.8	179	-175.7	173.3	0	115.6	V189 P190	V189-K231 WeakPolarHBondContact CB-O 3.34Å; P190-K231 WeakPolarHBondContact O-CE 3.22Å
232	H	91.9	Very high	95.3	Very high	129 Å²	129	68.7 Å²	68.7	60%	0.597	32%	0.321	S	S	*	.			trans	-79.9	120.1	177.6	-54.5	104.9	0	0	0	109.6	I192 F230 R235	I192-H232 WeakPolarHBondContact CD1-O 3.13Å; F230-H232 WeakPolarHBondContact CE2-O 3.45Å; H232-R235 HydrophobicContact CB-CB 4.13Å
233	L	92.7	Very high	95.2	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-70.3	-39.2	-176.9	-83.8	168.7	0	0	0	111.4	Y170 V189 I192 R235 A236 F237 Y274	Y170-L233 HydrophobicContact CD1-CD1 3.76Å; Y170-L233 HydrophobicContact CD1-CD2 4.36Å; Y170-L233 HydrophobicContact CE1-CD1 3.74Å; V189-L233 HydrophobicContact CG1-CG 4.24Å; V189-L233 HydrophobicContact CG2-CD1 3.62Å; V189-L233 HydrophobicContact CG2-CG 3.95Å; I192-L233 HydrophobicContact CD1-CD2 3.95Å; I192-L233 HydrophobicContact CD1-CG 4.25Å; I192-L233 HydrophobicContact CG1-CD2 3.84Å; I192-L233 HydrophobicContact CG1-CG 4.37Å; I192-L233 HydrophobicContact CG2-CD2 4.11Å; L233-R235 VanDerWaalsContact C-N 3.28Å; L233-R235 PolarHBondContact O-N 3.13Å; L233-A236 WeakPolarHBondContact O-CA 3.48Å; L233-A236 WeakPolarHBondContact O-CB 3.15Å; L233-A236 PolarHBondContact O-N 3.45Å; L233-F237 HydrophobicContact CB-CE2 4.2Å; L233-F237 HydrophobicContact CB-CZ 4.05Å; L233-F237 HydrophobicContact CD2-CE1 4.42Å; L233-F237 HydrophobicContact CD2-CZ 4.37Å; L233-F237 WeakPolarHBondContact O-CD1 3.36Å; L233-F237 WeakPolarHBondContact O-CG 3.22Å; L233-F237 PolarHBondContact O-N 3.19Å; L233-Y274 HydrophobicContact CD1-CE2 4.3Å
234	E	92.8	Very high	95	Very high	108 Å²	108	65.3 Å²	65.3	51%	0.505	32%	0.322	S	S	.	.	H	α-helix	trans	-57.9	-44.1	-179.3	-60.1	74.7	-164.9	0	0	109.9	A236 F237 D238	E234-A236 VanDerWaalsContact C-N 3.28Å; E234-A236 PolarHBondContact O-N 2.94Å; E234-F237 CarbonylContact O-C 3.52Å; E234-F237 WeakPolarHBondContact O-CA 3.47Å; E234-F237 WeakPolarHBondContact O-CB 3.33Å; E234-F237 PolarHBondContact O-N 3.25Å; E234-D238 VanDerWaalsContact O-CG 3.24Å; E234-D238 PolarHBondContact O-N 2.94Å
235	R	95.5	Very high	94.9	Very high	122 Å²	122	61.5 Å²	61.5	46%	0.46	30%	0.295	S	S	.	.	H	α-helix	trans	-57.6	-39.3	172.9	-179.2	178.9	176.2	-178	1.1	112.8	F230 H232 L233 F237 M239	F230-R235 HydrophobicContact CD2-CB 4.29Å; F230-R235 HydrophobicContact CD2-CG 4.28Å; F230-R235 HydrophobicContact CE1-CG 4.47Å; F230-R235 HydrophobicContact CE2-CB 3.82Å; F230-R235 HydrophobicContact CE2-CG 3.77Å; F230-R235 HydrophobicContact CZ-CB 4.38Å; F230-R235 HydrophobicContact CZ-CG 3.87Å; H232-R235 HydrophobicContact CB-CB 4.13Å; L233-R235 VanDerWaalsContact C-N 3.28Å; L233-R235 PolarHBondContact O-N 3.13Å; R235-F237 VanDerWaalsContact C-N 3.34Å; R235-M239 HydrophobicContact CG-SD 4.34Å; R235-M239 VanDerWaalsContact O-CG 3.24Å; R235-M239 WeakPolarHBondContact O-CG 3.47Å; R235-M239 PolarHBondContact O-N 3.45Å; R235-M239 VanDerWaalsContact O-N 3.15Å
236	A	97	Very high	94.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-69.5	-35.6	177.2	0	0	0	0	0	111.4	I192 F205 L228 F230 L233 E234 L240	I192-A236 HydrophobicContact CD1-CB 4.45Å; F205-A236 HydrophobicContact CE1-CB 4.18Å; L228-A236 HydrophobicContact CD1-CB 3.56Å; F230-A236 HydrophobicContact CE2-CB 3.99Å; F230-A236 HydrophobicContact CZ-CB 4.17Å; L233-A236 WeakPolarHBondContact O-CA 3.48Å; L233-A236 WeakPolarHBondContact O-CB 3.15Å; L233-A236 PolarHBondContact O-N 3.45Å; E234-A236 VanDerWaalsContact C-N 3.28Å; E234-A236 PolarHBondContact O-N 2.94Å; A236-L240 WeakPolarHBondContact O-CD1 3.46Å; A236-L240 WeakPolarHBondContact O-CG 3.48Å; A236-L240 PolarHBondContact O-N 3.18Å; A236-L240 VanDerWaalsContact O-N 3.14Å
237	F	97.4	Very high	94.8	Very high	37 Å²	37	64.5 Å²	64.5	16%	0.162	32%	0.315	C	S	.	.	H	α-helix	trans	-66.9	-42	175.5	-56.5	-21.5	0	0	0	111.7	V168 L233 E234 R235 L240 S241 M247 Y274 F276	V168-F237 HydrophobicContact CG2-CD1 4.18Å; V168-F237 HydrophobicContact CG2-CE1 3.67Å; L233-F237 HydrophobicContact CB-CE2 4.2Å; L233-F237 HydrophobicContact CB-CZ 4.05Å; L233-F237 HydrophobicContact CD2-CE1 4.42Å; L233-F237 HydrophobicContact CD2-CZ 4.37Å; L233-F237 WeakPolarHBondContact O-CD1 3.36Å; L233-F237 WeakPolarHBondContact O-CG 3.22Å; L233-F237 PolarHBondContact O-N 3.19Å; E234-F237 CarbonylContact O-C 3.52Å; E234-F237 WeakPolarHBondContact O-CA 3.47Å; E234-F237 WeakPolarHBondContact O-CB 3.33Å; E234-F237 PolarHBondContact O-N 3.25Å; R235-F237 VanDerWaalsContact C-N 3.34Å; F237-L240 PolarHBondContact O-N 3.47Å; F237-S241 WeakPolarHBondContact O-CB 3.25Å; F237-S241 PolarHBondContact O-N 2.81Å; F237-M247 HydrophobicContact CD1-CE 4.44Å; F237-M247 HydrophobicContact CD2-CE 4.31Å; F237-M247 HydrophobicContact CE1-CE 4.26Å; F237-M247 HydrophobicContact CE2-CE 4.14Å; F237-M247 HydrophobicContact CG-CE 4.45Å; F237-M247 HydrophobicContact CZ-CE 4.11Å; F237-Y274 AromaticContact CE1-CD2 3.97Å; F237-Y274 HydrophobicContact CE1-CD2 3.97Å; F237-Y274 AromaticContact CE1-CG 3.96Å; F237-Y274 HydrophobicContact CE1-CG 3.96Å; F237-Y274 HydrophobicContact CZ-CD1 4.02Å; F237-Y274 AromaticContact CZ-CD2 3.73Å; F237-Y274 HydrophobicContact CZ-CD2 3.73Å; F237-Y274 HydrophobicContact CZ-CE1 4.15Å; F237-Y274 AromaticContact CZ-CE2 3.88Å; F237-Y274 HydrophobicContact CZ-CE2 3.88Å; F237-Y274 AromaticContact CZ-CG 3.81Å; F237-Y274 HydrophobicContact CZ-CG 3.81Å; F237-F276 HydrophobicContact CB-CZ 4.2Å; F237-F276 HydrophobicContact CD1-CE1 4.46Å; F237-F276 AromaticContact CD1-CE2 3.73Å; F237-F276 HydrophobicContact CD1-CE2 3.73Å; F237-F276 AromaticContact CD1-CZ 3.35Å; F237-F276 HydrophobicContact CD1-CZ 3.35Å; F237-F276 AromaticContact CE1-CE2 3.87Å; F237-F276 HydrophobicContact CE1-CE2 3.87Å; F237-F276 AromaticContact CE1-CZ 3.87Å; F237-F276 HydrophobicContact CE1-CZ 3.87Å; F237-F276 AromaticContact CG-CZ 3.92Å; F237-F276 HydrophobicContact CG-CZ 3.92Å
238	D	94.9	Very high	94.7	Very high	95 Å²	95	66.6 Å²	66.6	51%	0.508	33%	0.331	S	S	.	.	H	α-helix	trans	-60.2	-49.1	176.5	-63.8	-26.8	0	0	0	110.6	E234 L240 S241 E242	E234-D238 VanDerWaalsContact O-CG 3.24Å; E234-D238 PolarHBondContact O-N 2.94Å; D238-L240 VanDerWaalsContact C-N 3.3Å; D238-L240 PolarHBondContact O-N 2.77Å; D238-S241 WeakPolarHBondContact O-CB 3.36Å; D238-S241 PolarHBondContact O-N 2.97Å; D238-S241 VanDerWaalsContact O-N 3.13Å; D238-E242 WeakPolarHBondContact O-CB 3.4Å; D238-E242 WeakPolarHBondContact O-CG 3.19Å; D238-E242 PolarHBondContact O-N 3.41Å
239	M	97.3	Very high	94.5	Very high	33 Å²	33	68.8 Å²	68.8	16%	0.163	35%	0.35	C	S	.	.	H	α-helix	trans	-58.7	-39.4	177.1	-68.6	174.7	71	0	0	112.8	V204 F205 T208 F230 R235 C243	V204-M239 HydrophobicContact CG1-CB 4.31Å; V204-M239 WeakPolarHBondContact O-CE 3.43Å; F205-M239 HydrophobicContact CD1-CE 3.89Å; F205-M239 HydrophobicContact CD1-SD 4.23Å; F205-M239 HydrophobicContact CE1-CB 4.39Å; T208-M239 HydrophobicContact CG2-CE 4.31Å; F230-M239 HydrophobicContact CE1-SD 3.83Å; F230-M239 HydrophobicContact CZ-SD 3.67Å; R235-M239 HydrophobicContact CG-SD 4.34Å; R235-M239 VanDerWaalsContact O-CG 3.24Å; R235-M239 WeakPolarHBondContact O-CG 3.47Å; R235-M239 PolarHBondContact O-N 3.45Å; R235-M239 VanDerWaalsContact O-N 3.15Å; M239-C243 PolarHBondContact O-N 2.87Å; M239-C243 PolarHBondContact O-SG 3.45Å
240	L	96.7	Very high	94.4	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66.5	-45.8	175.4	-80.3	162.3	0	0	0	111.5	I166 V168 V204 F205 A236 F237 D238 C243 G244 F245 F276	I166-L240 HydrophobicContact CB-CD2 4.07Å; I166-L240 HydrophobicContact CD1-CD2 3.76Å; I166-L240 HydrophobicContact CG1-CD2 4.49Å; I166-L240 HydrophobicContact CG2-CD2 3.98Å; V168-L240 HydrophobicContact CG1-CD1 3.95Å; V168-L240 HydrophobicContact CG2-CD1 4.5Å; V204-L240 HydrophobicContact CG1-CD2 3.83Å; V204-L240 HydrophobicContact CG1-CG 4.01Å; V204-L240 HydrophobicContact CG2-CD2 4.27Å; F205-L240 HydrophobicContact CE1-CG 4.41Å; F205-L240 HydrophobicContact CE2-CD2 4.44Å; F205-L240 HydrophobicContact CZ-CD1 3.95Å; F205-L240 HydrophobicContact CZ-CD2 4.11Å; F205-L240 HydrophobicContact CZ-CG 3.81Å; A236-L240 WeakPolarHBondContact O-CD1 3.46Å; A236-L240 WeakPolarHBondContact O-CG 3.48Å; A236-L240 PolarHBondContact O-N 3.18Å; A236-L240 VanDerWaalsContact O-N 3.14Å; F237-L240 PolarHBondContact O-N 3.47Å; D238-L240 VanDerWaalsContact C-N 3.3Å; D238-L240 PolarHBondContact O-N 2.77Å; L240-C243 CarbonylContact O-C 3.51Å; L240-C243 PolarHBondContact O-N 2.81Å; L240-C243 VanDerWaalsContact O-N 3.15Å; L240-G244 PolarHBondContact O-N 3.29Å; L240-F245 HydrophobicContact CB-CB 4.06Å; L240-F245 HydrophobicContact CD2-CB 4.11Å; L240-F245 HydrophobicContact CD2-CD1 4.22Å; L240-F245 HydrophobicContact CD2-CD2 4.03Å; L240-F245 HydrophobicContact CD2-CG 3.86Å; L240-F245 WeakPolarHBondContact O-CB 3.22Å; L240-F245 PolarHBondContact O-N 3.2Å; L240-F276 HydrophobicContact CB-CD1 4.07Å; L240-F276 HydrophobicContact CB-CE1 4.23Å; L240-F276 HydrophobicContact CD1-CB 4.42Å; L240-F276 HydrophobicContact CD1-CD1 4.03Å; L240-F276 HydrophobicContact CD1-CD2 3.69Å; L240-F276 HydrophobicContact CD1-CE1 4.16Å; L240-F276 HydrophobicContact CD1-CE2 3.83Å; L240-F276 HydrophobicContact CD1-CG 3.79Å; L240-F276 HydrophobicContact CD1-CZ 4.07Å; L240-F276 HydrophobicContact CD2-CB 4.47Å
241	S	92.5	Very high	94.2	Very high	77 Å²	77	68.6 Å²	68.6	54%	0.538	36%	0.361	S	S	.	.	H	α-helix	trans	-61.9	-44.6	179.3	-175.4	0	0	0	0	112.1	F237 D238 C243 G244	F237-S241 WeakPolarHBondContact O-CB 3.25Å; F237-S241 PolarHBondContact O-N 2.81Å; D238-S241 WeakPolarHBondContact O-CB 3.36Å; D238-S241 PolarHBondContact O-N 2.97Å; D238-S241 VanDerWaalsContact O-N 3.13Å; S241-C243 PolarHBondContact O-N 3.23Å; S241-G244 PolarHBondContact O-N 3.26Å
242	E	92.1	Very high	94	Very high	164 Å²	164	65.6 Å²	65.6	77%	0.766	36%	0.357	S	S	*	.	H	α-helix	trans	-58.9	-31.6	174.6	-73.8	173.9	-178.3	0	0	112.2	D238 G244	D238-E242 WeakPolarHBondContact O-CB 3.4Å; D238-E242 WeakPolarHBondContact O-CG 3.19Å; D238-E242 PolarHBondContact O-N 3.41Å; E242-G244 VanDerWaalsContact C-N 3.29Å; E242-G244 PolarHBondContact O-N 3.45Å
243	C	92.2	Very high	93.7	Very high	38 Å²	38	62 Å²	62	26%	0.257	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	4.3	175.5	-64.9	0	0	0	0	113.5	V204 M239 L240 S241 F245 R278	V204-C243 HydrophobicContact CG2-CB 3.87Å; M239-C243 PolarHBondContact O-N 2.87Å; M239-C243 PolarHBondContact O-SG 3.45Å; L240-C243 CarbonylContact O-C 3.51Å; L240-C243 PolarHBondContact O-N 2.81Å; L240-C243 VanDerWaalsContact O-N 3.15Å; S241-C243 PolarHBondContact O-N 3.23Å; C243-F245 HydrophobicContact CB-CD2 4.08Å; C243-F245 HydrophobicContact CB-CE2 4.37Å; C243-R278 WeakPolarHBondContact O-CD 3.37Å; C243-R278 PolarHBondContact O-NH1 3.13Å
244	G	92.3	Very high	93.4	Very high	33 Å²	33	66 Å²	66	34%	0.34	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	17.4	178	0	0	0	0	0	115.2	L240 S241 E242 R278	L240-G244 PolarHBondContact O-N 3.29Å; S241-G244 PolarHBondContact O-N 3.26Å; E242-G244 VanDerWaalsContact C-N 3.29Å; E242-G244 PolarHBondContact O-N 3.45Å; G244-R278 WeakPolarHBondContact O-CG 3.47Å
245	F	95.6	Very high	92.8	Very high	3 Å²	3	64.7 Å²	64.7	1%	0.013	37%	0.37	C	S	.	.			trans	-86.4	138.5	172.5	-74.5	-101.4	0	0	0	111.3	G164 I166 L200 V204 L240 C243 F276 R278	G164-F245 VanDerWaalsContact O-CE1 3.3Å; G164-F245 WeakPolarHBondContact O-CE1 3.41Å; I166-F245 HydrophobicContact CB-CD1 4.5Å; I166-F245 HydrophobicContact CB-CE1 4.17Å; I166-F245 HydrophobicContact CD1-CD1 4.48Å; I166-F245 HydrophobicContact CD1-CE1 3.77Å; I166-F245 HydrophobicContact CD1-CE2 4.08Å; I166-F245 HydrophobicContact CD1-CZ 3.55Å; I166-F245 HydrophobicContact CG1-CE1 3.74Å; I166-F245 HydrophobicContact CG1-CZ 3.98Å; L200-F245 HydrophobicContact CB-CZ 4.37Å; L200-F245 HydrophobicContact CD1-CZ 4.35Å; L200-F245 HydrophobicContact CD2-CZ 4.43Å; V204-F245 HydrophobicContact CG2-CD2 4.08Å; V204-F245 HydrophobicContact CG2-CE2 3.57Å; V204-F245 HydrophobicContact CG2-CZ 4.32Å; L240-F245 HydrophobicContact CB-CB 4.06Å; L240-F245 HydrophobicContact CD2-CB 4.11Å; L240-F245 HydrophobicContact CD2-CD1 4.22Å; L240-F245 HydrophobicContact CD2-CD2 4.03Å; L240-F245 HydrophobicContact CD2-CG 3.86Å; L240-F245 WeakPolarHBondContact O-CB 3.22Å; L240-F245 PolarHBondContact O-N 3.2Å; C243-F245 HydrophobicContact CB-CD2 4.08Å; C243-F245 HydrophobicContact CB-CE2 4.37Å; F245-F276 HydrophobicContact CB-CB 4.1Å; F245-F276 HydrophobicContact CB-CD1 4.23Å; F245-F276 HydrophobicContact CD1-CB 4.06Å; F245-F276 HydrophobicContact CG-CB 4.5Å; F245-R278 HydrophobicContact CB-CB 4.5Å; F245-R278 HydrophobicContact CD1-CB 3.66Å; F245-R278 HydrophobicContact CD2-CB 3.84Å; F245-R278 HydrophobicContact CD2-CG 4.46Å; F245-R278 HydrophobicContact CE1-CB 3.68Å; F245-R278 HydrophobicContact CE2-CB 3.85Å; F245-R278 HydrophobicContact CE2-CG 4.45Å; F245-R278 HydrophobicContact CG-CB 3.73Å; F245-R278 HydrophobicContact CZ-CB 3.76Å
246	H	94.9	Very high	92	Very high	109 Å²	109	61.2 Å²	61.2	51%	0.505	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	138.6	173.9	-59.1	-78.5	0	0	0	110.4	V248 F276 Y277	H246-V248 PolarHBondContact O-N 2.84Å; H246-F276 CarbonylContact O-C 3.59Å; H246-F276 VanDerWaalsContact O-CA 3.25Å; H246-F276 WeakPolarHBondContact O-CA 3.42Å; H246-Y277 PolarHBondContact N-O 2.88Å; H246-Y277 PolarHBondContact O-N 2.82Å
247	M	94.9	Very high	90.9	Very high	88 Å²	88	63.8 Å²	63.8	43%	0.433	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	122.5	172	-171	-175.3	-65.1	0	0	109.2	F237 Y274 V275 F276	F237-M247 HydrophobicContact CD1-CE 4.44Å; F237-M247 HydrophobicContact CD2-CE 4.31Å; F237-M247 HydrophobicContact CE1-CE 4.26Å; F237-M247 HydrophobicContact CE2-CE 4.14Å; F237-M247 HydrophobicContact CG-CE 4.45Å; F237-M247 HydrophobicContact CZ-CE 4.11Å; M247-Y274 HydrophobicContact CE-CD1 3.8Å; M247-Y274 HydrophobicContact CE-CE1 4.49Å; M247-Y274 HydrophobicContact CE-CG 4.4Å; M247-Y274 HydrophobicContact SD-CD1 3.92Å; M247-V275 WeakPolarHBondContact CA-O 3.43Å; M247-F276 HydrophobicContact CB-CD1 4.09Å; M247-F276 HydrophobicContact CB-CE1 3.75Å; M247-F276 HydrophobicContact CB-CZ 4.04Å; M247-F276 HydrophobicContact CE-CE1 4.19Å; M247-F276 HydrophobicContact CE-CE2 4.02Å; M247-F276 HydrophobicContact CE-CZ 3.44Å; M247-F276 VanDerWaalsContact CE-CZ 3.44Å; M247-F276 HydrophobicContact CG-CE1 4.43Å; M247-F276 HydrophobicContact CG-CE2 4.46Å; M247-F276 HydrophobicContact CG-CZ 4.24Å
248	V	96.4	Very high	89.7	Confident	75 Å²	75	68.6 Å²	68.6	46%	0.455	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-23.1	-176	-64.8	0	0	0	0	113.4	F165 H246 V275	F165-V248 HydrophobicContact CE1-CG2 4.25Å; H246-V248 PolarHBondContact O-N 2.84Å; V248-V275 HydrophobicContact CG2-CB 4.03Å; V248-V275 HydrophobicContact CG2-CG1 3.79Å; V248-V275 WeakPolarHBondContact CG2-O 3.18Å; V248-V275 PolarHBondContact N-O 2.91Å
249	A	93.8	Very high	88.4	Confident	50 Å²	50	68.1 Å²	68.1	41%	0.413	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	156.4	177.5	0	0	0	0	0	111.6	V275	A249-V275 HydrophobicContact CB-CB 4.15Å; A249-V275 HydrophobicContact CB-CG2 4.18Å; A249-V275 PolarHBondContact N-O 3.09Å; A249-V275 PolarHBondContact O-N 3.46Å
250	C	94.3	Very high	87	Confident	73 Å²	73	71.2 Å²	71.2	49%	0.493	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	136.5	171.4	174.5	0	0	0	0	108.8	E273 Y274	C250-E273 WeakPolarHBondContact CA-O 3.24Å; C250-Y274 HydrophobicContact CB-CD1 3.93Å; C250-Y274 HydrophobicContact CB-CE1 4.13Å; C250-Y274 WeakPolarHBondContact SG-CE1 3.22Å
251	N	89.8	Confident	85.4	Confident	77 Å²	77	79.9 Å²	79.9	41%	0.412	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	151.2	176.5	177.1	46.1	0	0	0	110.6	S253 T272 E273	N251-S253 PolarHBondContact ND2-OG 2.98Å; N251-T272 WeakPolarHBondContact O-CA 3.46Å; N251-E273 HydrophobicContact CB-CG 4Å; N251-E273 PolarHBondContact N-O 2.78Å; N251-E273 PolarHBondContact ND2-OE1 2.84Å; N251-E273 VanDerWaalsContact ND2-OE1 3.11Å; N251-E273 PolarHBondContact O-N 2.81Å
252	S	89.7	Confident	83.8	Confident	66 Å²	66	86.3 Å²	86.3	46%	0.462	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	120.8	174.7	-169.8	0	0	0	0	110.3	Y271 T272	S252-Y271 CarbonylContact C-O 3.6Å; S252-Y271 WeakPolarHBondContact CA-O 3.14Å; S252-T272 PolarHBondContact OG-OG1 2.76Å; S252-T272 VanDerWaalsContact OG-OG1 3.09Å
253	S	86	Confident	82.3	Confident	52 Å²	52	81.2 Å²	81.2	36%	0.364	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	151.7	-179	-60.8	0	0	0	0	110.3	N251 S270 Y271	N251-S253 PolarHBondContact ND2-OG 2.98Å; S253-S270 CarbonylContact O-C 3.55Å; S253-S270 WeakPolarHBondContact O-CA 3.46Å; S253-Y271 PolarHBondContact N-O 2.91Å; S253-Y271 PolarHBondContact O-N 3.31Å
254	V	84.4	Confident	81	Confident	86 Å²	86	85.4 Å²	85.4	52%	0.521	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131	175.4	-178.5	0	0	0	0	109	W268 S269	V254-W268 HydrophobicContact CG1-CE3 3.77Å; V254-W268 HydrophobicContact CG1-CZ3 4.45Å; V254-S269 CarbonylContact C-O 3.53Å; V254-S269 WeakPolarHBondContact CA-O 3.36Å
255	T	81.2	Confident	80	Confident	81 Å²	81	88.3 Å²	88.3	50%	0.497	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138.8	177.7	57.6	0	0	0	0	110.5	W268 S269	T255-W268 WeakPolarHBondContact O-CA 3.45Å; T255-S269 PolarHBondContact N-O 2.87Å; T255-S269 PolarHBondContact O-N 2.94Å
256	A	79.1	Confident	78.7	Confident	49 Å²	49	92.1 Å²	92.1	41%	0.405	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	136.6	173.5	0	0	0	0	0	109.9	I267 W268	A256-I267 WeakPolarHBondContact CA-O 3.32Å; A256-W268 HydrophobicContact CB-CD2 3.96Å; A256-W268 HydrophobicContact CB-CE3 3.74Å; A256-W268 HydrophobicContact CB-CH2 4.01Å; A256-W268 HydrophobicContact CB-CZ2 4.19Å; A256-W268 HydrophobicContact CB-CZ3 3.78Å
257	S	73.9	Confident	77.7	Confident	54 Å²	54	89.8 Å²	89.8	38%	0.378	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135.6	171.4	54.3	0	0	0	0	109.9	I267	S257-I267 PolarHBondContact N-O 3.02Å; S257-I267 PolarHBondContact O-N 2.61Å; S257-I267 PolarHBondContact OG-O 3.42Å
258	F	71.9	Confident	76.8	Confident	138 Å²	138	90.4 Å²	90.4	61%	0.605	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	135	175	-65.8	-83.8	0	0	0	110.4	K266	F258-K266 HydrophobicContact CD1-CG 4.09Å; F258-K266 HydrophobicContact CE1-CD 4.28Å; F258-K266 HydrophobicContact CE1-CG 4.08Å
259	I	67	Low	76	Confident	85 Å²	85	87.2 Å²	87.2	44%	0.436	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-39.3	179.2	-56.4	179.1	0	0	0	111	D265 I267	I259-D265 HydrophobicContact CB-CB 4.48Å; I259-D265 HydrophobicContact CD1-CB 3.8Å; I259-D265 HydrophobicContact CG1-CB 4.31Å; I259-D265 WeakPolarHBondContact CG1-O 3.31Å; I259-D265 PolarHBondContact N-O 2.91Å; I259-D265 VanDerWaalsContact N-O 3.09Å; I259-I267 HydrophobicContact CD1-CD1 3.72Å; I259-I267 HydrophobicContact CD1-CG1 3.47Å; I259-I267 VanDerWaalsContact CD1-CG1 3.47Å; I259-I267 HydrophobicContact CG1-CB 4.37Å; I259-I267 HydrophobicContact CG1-CD1 3.52Å; I259-I267 HydrophobicContact CG1-CG1 3.47Å; I259-I267 VanDerWaalsContact CG1-CG1 3.47Å
260	N	67.4	Low	75.6	Confident	97 Å²	97	86 Å²	86	52%	0.519	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.4	-177.3	-94.1	-36.4	0	0	0	110.2	Y262	N260-Y262 PolarHBondContact O-N 2.89Å
261	Q	64.2	Low	75.3	Confident	183 Å²	183	85.8 Å²	85.8	86%	0.855	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.7	173.5	-78.6	177.6	-1.1	0	0	113.2
262	Y	58.5	Low	75.4	Confident	211 Å²	211	82.5 Å²	82.5	83%	0.827	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-4.1	-171.5	-62.7	-78.6	0	0	0	114.7	N260	N260-Y262 PolarHBondContact O-N 2.89Å
263	T	60.7	Low	75.6	Confident	58 Å²	58	82 Å²	82	36%	0.356	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.8	176.4	69.8	0	0	0	0	110.6	D265	T263-D265 WeakPolarHBondContact CB-OD2 3.48Å; T263-D265 PolarHBondContact O-N 3.46Å; T263-D265 VanDerWaalsContact O-N 3.12Å; T263-D265 PolarHBondContact OG1-OD2 3.5Å
264	D	65.6	Low	76.2	Confident	125 Å²	125	80.7 Å²	80.7	67%	0.668	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	22.8	177.8	-161.5	17.2	0	0	0	112.4	K266	D264-K266 PolarHBondContact O-N 3.29Å; D264-K266 WeakPolarHBondContact OD1-CE 3.46Å; D264-K266 IonicContact OD1-NZ 3.36Å
265	D	70	Confident	76.8	Confident	95 Å²	95	78.1 Å²	78.1	51%	0.508	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	119.4	177.9	-59	-49.3	0	0	0	109.7	I259 T263	I259-D265 HydrophobicContact CB-CB 4.48Å; I259-D265 HydrophobicContact CD1-CB 3.8Å; I259-D265 HydrophobicContact CG1-CB 4.31Å; I259-D265 WeakPolarHBondContact CG1-O 3.31Å; I259-D265 PolarHBondContact N-O 2.91Å; I259-D265 VanDerWaalsContact N-O 3.09Å; T263-D265 WeakPolarHBondContact CB-OD2 3.48Å; T263-D265 PolarHBondContact O-N 3.46Å; T263-D265 VanDerWaalsContact O-N 3.12Å; T263-D265 PolarHBondContact OG1-OD2 3.5Å
266	K	68.4	Low	77.6	Confident	83 Å²	83	74.6 Å²	74.6	36%	0.361	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.1	179.3	-67.6	171.6	-173.2	162.6	0	110.3	F258 D264 W268	F258-K266 HydrophobicContact CD1-CG 4.09Å; F258-K266 HydrophobicContact CE1-CD 4.28Å; F258-K266 HydrophobicContact CE1-CG 4.08Å; D264-K266 PolarHBondContact O-N 3.29Å; D264-K266 WeakPolarHBondContact OD1-CE 3.46Å; D264-K266 IonicContact OD1-NZ 3.36Å; K266-W268 HydrophobicContact CD-CZ2 4.46Å
267	I	74.9	Confident	78.4	Confident	60 Å²	60	73.5 Å²	73.5	31%	0.308	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	126.2	164.2	-71	166	0	0	0	107.9	A256 S257 I259	A256-I267 WeakPolarHBondContact CA-O 3.32Å; S257-I267 PolarHBondContact N-O 3.02Å; S257-I267 PolarHBondContact O-N 2.61Å; S257-I267 PolarHBondContact OG-O 3.42Å; I259-I267 HydrophobicContact CD1-CD1 3.72Å; I259-I267 HydrophobicContact CD1-CG1 3.47Å; I259-I267 VanDerWaalsContact CD1-CG1 3.47Å; I259-I267 HydrophobicContact CG1-CB 4.37Å; I259-I267 HydrophobicContact CG1-CD1 3.52Å; I259-I267 HydrophobicContact CG1-CG1 3.47Å; I259-I267 VanDerWaalsContact CG1-CG1 3.47Å
268	W	75.1	Confident	79.4	Confident	100 Å²	100	72 Å²	72	38%	0.379	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	125.2	174.6	-62.3	84.6	0	0	0	109.2	C174 V254 T255 A256 K266	C174-W268 PolarHBondContact N-O 3.43Å; C174-W268 PolarHBondContact O-N 3.14Å; C174-W268 WeakPolarHBondContact SG-CB 3.3Å; V254-W268 HydrophobicContact CG1-CE3 3.77Å; V254-W268 HydrophobicContact CG1-CZ3 4.45Å; T255-W268 WeakPolarHBondContact O-CA 3.45Å; A256-W268 HydrophobicContact CB-CD2 3.96Å; A256-W268 HydrophobicContact CB-CE3 3.74Å; A256-W268 HydrophobicContact CB-CH2 4.01Å; A256-W268 HydrophobicContact CB-CZ2 4.19Å; A256-W268 HydrophobicContact CB-CZ3 3.78Å; K266-W268 HydrophobicContact CD-CZ2 4.46Å
269	S	80	Confident	79.9	Confident	9 Å²	9	68.4 Å²	68.4	6%	0.063	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	122.3	176	-70.1	0	0	0	0	109.4	R171 G172 V254 T255	R171-S269 PolarHBondContact NE-OG 3.08Å; R171-S269 PolarHBondContact NH2-OG 2.88Å; G172-S269 WeakPolarHBondContact O-CA 3.06Å; V254-S269 CarbonylContact C-O 3.53Å; V254-S269 WeakPolarHBondContact CA-O 3.36Å; T255-S269 PolarHBondContact N-O 2.87Å; T255-S269 PolarHBondContact O-N 2.94Å
270	S	85	Confident	80.1	Confident	25 Å²	25	69.4 Å²	69.4	18%	0.175	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	141.4	169.3	170.6	0	0	0	0	109.4	R171 G172 S253	R171-S270 CarbonylContact C-O 3.55Å; R171-S270 VanDerWaalsContact CA-O 3.29Å; R171-S270 WeakPolarHBondContact CA-O 3.34Å; R171-S270 WeakPolarHBondContact CG-O 3.14Å; G172-S270 PolarHBondContact N-O 3.15Å; G172-S270 PolarHBondContact O-N 2.66Å; G172-S270 VanDerWaalsContact O-O 3.08Å; S253-S270 CarbonylContact O-C 3.55Å; S253-S270 WeakPolarHBondContact O-CA 3.46Å
271	Y	88.2	Confident	79.1	Confident	67 Å²	67	72.1 Å²	72.1	26%	0.263	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	119.4	171.1	-173.3	-101	0	0	0	108.5	R171 L193 S252 S253 E273	R171-Y271 HydrophobicContact CB-CD2 4.44Å; L193-Y271 HydrophobicContact CD1-CE2 3.76Å; S252-Y271 CarbonylContact C-O 3.6Å; S252-Y271 WeakPolarHBondContact CA-O 3.14Å; S253-Y271 PolarHBondContact N-O 2.91Å; S253-Y271 PolarHBondContact O-N 3.31Å; Y271-E273 HydrophobicContact CD1-CB 4.43Å; Y271-E273 HydrophobicContact CE1-CB 3.85Å; Y271-E273 HydrophobicContact CE1-CG 4.48Å
272	T	91.3	Very high	78.3	Confident	8 Å²	8	70.7 Å²	70.7	5%	0.049	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132	176	-50.6	0	0	0	0	109.1	G169 Y170 N251 S252 Y274	G169-T272 CarbonylContact C-O 3.6Å; G169-T272 WeakPolarHBondContact CA-O 3.46Å; Y170-T272 HydrophobicContact CE1-CG2 4.31Å; Y170-T272 PolarHBondContact N-O 2.72Å; Y170-T272 PolarHBondContact O-N 3.24Å; N251-T272 WeakPolarHBondContact O-CA 3.46Å; S252-T272 PolarHBondContact OG-OG1 2.76Å; S252-T272 VanDerWaalsContact OG-OG1 3.09Å; T272-Y274 HydrophobicContact CG2-CE2 3.87Å
273	E	94.9	Very high	77.5	Confident	56 Å²	56	65.8 Å²	65.8	26%	0.262	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145.3	-177.8	65.3	-167.2	168.9	0	0	111.7	T167 V168 C250 N251 Y271	T167-E273 HydrophobicContact CG2-CB 4.03Å; V168-E273 CarbonylContact O-C 3.51Å; V168-E273 WeakPolarHBondContact O-CA 3.45Å; C250-E273 WeakPolarHBondContact CA-O 3.24Å; N251-E273 HydrophobicContact CB-CG 4Å; N251-E273 PolarHBondContact N-O 2.78Å; N251-E273 PolarHBondContact ND2-OE1 2.84Å; N251-E273 VanDerWaalsContact ND2-OE1 3.11Å; N251-E273 PolarHBondContact O-N 2.81Å; Y271-E273 HydrophobicContact CD1-CB 4.43Å; Y271-E273 HydrophobicContact CE1-CB 3.85Å; Y271-E273 HydrophobicContact CE1-CG 4.48Å
274	Y	97.7	Very high	76.6	Confident	24 Å²	24	71.7 Å²	71.7	9%	0.094	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119.8	-179.5	-59.8	-83.3	0	0	0	108.3	T167 V168 R187 L233 F237 M247 C250 T272	T167-Y274 CarbonylContact C-O 3.53Å; T167-Y274 VanDerWaalsContact CA-O 3.32Å; T167-Y274 WeakPolarHBondContact CA-O 3.16Å; V168-Y274 HydrophobicContact CG2-CD2 4.35Å; V168-Y274 PolarHBondContact N-O 2.86Å; V168-Y274 PolarHBondContact O-N 2.8Å; R187-Y274 VanDerWaalsContact CZ-OH 3.24Å; R187-Y274 PolarHBondContact NH1-OH 3.16Å; R187-Y274 PolarHBondContact NH2-OH 2.82Å; L233-Y274 HydrophobicContact CD1-CE2 4.3Å; F237-Y274 AromaticContact CE1-CD2 3.97Å; F237-Y274 HydrophobicContact CE1-CD2 3.97Å; F237-Y274 AromaticContact CE1-CG 3.96Å; F237-Y274 HydrophobicContact CE1-CG 3.96Å; F237-Y274 HydrophobicContact CZ-CD1 4.02Å; F237-Y274 AromaticContact CZ-CD2 3.73Å; F237-Y274 HydrophobicContact CZ-CD2 3.73Å; F237-Y274 HydrophobicContact CZ-CE1 4.15Å; F237-Y274 AromaticContact CZ-CE2 3.88Å; F237-Y274 HydrophobicContact CZ-CE2 3.88Å; F237-Y274 AromaticContact CZ-CG 3.81Å; F237-Y274 HydrophobicContact CZ-CG 3.81Å; M247-Y274 HydrophobicContact CE-CD1 3.8Å; M247-Y274 HydrophobicContact CE-CE1 4.49Å; M247-Y274 HydrophobicContact CE-CG 4.4Å; M247-Y274 HydrophobicContact SD-CD1 3.92Å; C250-Y274 HydrophobicContact CB-CD1 3.93Å; C250-Y274 HydrophobicContact CB-CE1 4.13Å; C250-Y274 WeakPolarHBondContact SG-CE1 3.22Å; T272-Y274 HydrophobicContact CG2-CE2 3.87Å
275	V	97.8	Very high	75.4	Confident	32 Å²	32	69.9 Å²	69.9	19%	0.194	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125.2	-177.4	-171.2	0	0	0	0	108.5	F165 T167 M247 V248 A249	F165-V275 HydrophobicContact CD1-CG1 3.77Å; F165-V275 HydrophobicContact CE1-CG1 4.29Å; T167-V275 HydrophobicContact CG2-CG2 4.35Å; M247-V275 WeakPolarHBondContact CA-O 3.43Å; V248-V275 HydrophobicContact CG2-CB 4.03Å; V248-V275 HydrophobicContact CG2-CG1 3.79Å; V248-V275 WeakPolarHBondContact CG2-O 3.18Å; V248-V275 PolarHBondContact N-O 2.91Å; A249-V275 HydrophobicContact CB-CB 4.15Å; A249-V275 HydrophobicContact CB-CG2 4.18Å; A249-V275 PolarHBondContact N-O 3.09Å; A249-V275 PolarHBondContact O-N 3.46Å
276	F	98.1	Very high	73.9	Confident	7 Å²	7	68.5 Å²	68.5	3%	0.031	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142.8	177.6	-72.8	-99.4	0	0	0	110.2	F165 I166 V168 F237 L240 F245 H246 M247	F165-F276 CarbonylContact C-O 3.52Å; F165-F276 VanDerWaalsContact CA-O 3.26Å; F165-F276 WeakPolarHBondContact CA-O 3.46Å; I166-F276 PolarHBondContact N-O 3.02Å; I166-F276 WeakPolarHBondContact O-CA 3.35Å; I166-F276 WeakPolarHBondContact O-CB 3.4Å; I166-F276 PolarHBondContact O-N 3.27Å; V168-F276 HydrophobicContact CG2-CD2 4.17Å; V168-F276 HydrophobicContact CG2-CE2 3.72Å; F237-F276 HydrophobicContact CB-CZ 4.2Å; F237-F276 HydrophobicContact CD1-CE1 4.46Å; F237-F276 AromaticContact CD1-CE2 3.73Å; F237-F276 HydrophobicContact CD1-CE2 3.73Å; F237-F276 AromaticContact CD1-CZ 3.35Å; F237-F276 HydrophobicContact CD1-CZ 3.35Å; F237-F276 AromaticContact CE1-CE2 3.87Å; F237-F276 HydrophobicContact CE1-CE2 3.87Å; F237-F276 AromaticContact CE1-CZ 3.87Å; F237-F276 HydrophobicContact CE1-CZ 3.87Å; F237-F276 AromaticContact CG-CZ 3.92Å; F237-F276 HydrophobicContact CG-CZ 3.92Å; L240-F276 HydrophobicContact CB-CD1 4.07Å; L240-F276 HydrophobicContact CB-CE1 4.23Å; L240-F276 HydrophobicContact CD1-CB 4.42Å; L240-F276 HydrophobicContact CD1-CD1 4.03Å; L240-F276 HydrophobicContact CD1-CD2 3.69Å; L240-F276 HydrophobicContact CD1-CE1 4.16Å; L240-F276 HydrophobicContact CD1-CE2 3.83Å; L240-F276 HydrophobicContact CD1-CG 3.79Å; L240-F276 HydrophobicContact CD1-CZ 4.07Å; L240-F276 HydrophobicContact CD2-CB 4.47Å; F245-F276 HydrophobicContact CB-CB 4.1Å; F245-F276 HydrophobicContact CB-CD1 4.23Å; F245-F276 HydrophobicContact CD1-CB 4.06Å; F245-F276 HydrophobicContact CG-CB 4.5Å; H246-F276 CarbonylContact O-C 3.59Å; H246-F276 VanDerWaalsContact O-CA 3.25Å; H246-F276 WeakPolarHBondContact O-CA 3.42Å; M247-F276 HydrophobicContact CB-CD1 4.09Å; M247-F276 HydrophobicContact CB-CE1 3.75Å; M247-F276 HydrophobicContact CB-CZ 4.04Å; M247-F276 HydrophobicContact CE-CE1 4.19Å; M247-F276 HydrophobicContact CE-CE2 4.02Å; M247-F276 HydrophobicContact CE-CZ 3.44Å; M247-F276 VanDerWaalsContact CE-CZ 3.44Å; M247-F276 HydrophobicContact CG-CE1 4.43Å; M247-F276 HydrophobicContact CG-CE2 4.46Å; M247-F276 HydrophobicContact CG-CZ 4.24Å
277	Y	96.3	Very high	72.6	Confident	26 Å²	26	73.2 Å²	73.2	10%	0.102	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	135.6	176.5	-173.8	-120.9	0	0	0	110.9	W163 G164 F165 H246 F279	W163-Y277 AromaticContact CE3-CE2 3.99Å; W163-Y277 HydrophobicContact CE3-CE2 3.99Å; W163-Y277 VanDerWaalsContact CE3-OH 3.31Å; G164-Y277 VanDerWaalsContact C-CD2 3.42Å; G164-Y277 WeakPolarHBondContact O-CD2 3.29Å; F165-Y277 AromaticContact CD1-CD2 3.69Å; F165-Y277 HydrophobicContact CD1-CD2 3.69Å; F165-Y277 HydrophobicContact CD1-CG 4.08Å; F165-Y277 AromaticContact CD2-CD2 3.62Å; F165-Y277 HydrophobicContact CD2-CD2 3.62Å; F165-Y277 AromaticContact CD2-CE2 3.88Å; F165-Y277 HydrophobicContact CD2-CE2 3.88Å; F165-Y277 AromaticContact CE1-CD2 3.6Å; F165-Y277 HydrophobicContact CE1-CD2 3.6Å; F165-Y277 HydrophobicContact CE1-CE2 4.46Å; F165-Y277 AromaticContact CE1-CG 3.75Å; F165-Y277 HydrophobicContact CE1-CG 3.75Å; F165-Y277 AromaticContact CE2-CD2 3.51Å; F165-Y277 HydrophobicContact CE2-CD2 3.51Å; F165-Y277 AromaticContact CE2-CE2 3.6Å; F165-Y277 HydrophobicContact CE2-CE2 3.6Å; F165-Y277 HydrophobicContact CE2-CG 4.35Å; F165-Y277 AromaticContact CG-CD2 3.7Å; F165-Y277 HydrophobicContact CG-CD2 3.7Å; F165-Y277 HydrophobicContact CG-CE2 4.42Å; F165-Y277 AromaticContact CZ-CD2 3.5Å; F165-Y277 HydrophobicContact CZ-CD2 3.5Å; F165-Y277 AromaticContact CZ-CE2 3.92Å; F165-Y277 HydrophobicContact CZ-CE2 3.92Å; F165-Y277 AromaticContact CZ-CG 3.89Å; F165-Y277 HydrophobicContact CZ-CG 3.89Å; H246-Y277 PolarHBondContact N-O 2.88Å; H246-Y277 PolarHBondContact O-N 2.82Å; Y277-F279 AromaticContact CD1-CD1 3.41Å; Y277-F279 HydrophobicContact CD1-CD1 3.41Å; Y277-F279 VanDerWaalsContact CD1-CD1 3.41Å; Y277-F279 HydrophobicContact CD1-CD2 4.44Å; Y277-F279 AromaticContact CD1-CE1 3.15Å; Y277-F279 HydrophobicContact CD1-CE1 3.15Å; Y277-F279 HydrophobicContact CD1-CE2 4.21Å; Y277-F279 HydrophobicContact CD1-CG 4.1Å; Y277-F279 AromaticContact CD1-CZ 3.61Å; Y277-F279 HydrophobicContact CD1-CZ 3.61Å; Y277-F279 AromaticContact CE1-CD1 3.07Å; Y277-F279 HydrophobicContact CE1-CD1 3.07Å; Y277-F279 AromaticContact CE1-CE1 3.12Å; Y277-F279 HydrophobicContact CE1-CE1 3.12Å; Y277-F279 HydrophobicContact CE1-CG 4.01Å; Y277-F279 HydrophobicContact CE1-CZ 4.06Å
278	R	94.3	Very high	70.8	Confident	22 Å²	22	77.5 Å²	77.5	8%	0.083	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.4	171.6	180	161.6	73.4	177.6	4.6	109.5	K162 W163 G164 L200 E203 C243 G244 F245	K162-R278 PolarHBondContact O-NE 2.96Å; K162-R278 PolarHBondContact O-NH2 2.88Å; W163-R278 WeakPolarHBondContact CA-O 3.35Å; W163-R278 WeakPolarHBondContact CB-O 3.46Å; G164-R278 PolarHBondContact N-O 2.94Å; G164-R278 PolarHBondContact O-N 3.26Å; G164-R278 VanDerWaalsContact O-N 3.11Å; L200-R278 VanDerWaalsContact CD2-NH2 3.34Å; E203-R278 IonicContact OE1-CZ 3.23Å; E203-R278 VanDerWaalsContact OE1-CZ 3.23Å; E203-R278 IonicContact OE1-NH1 2.72Å; E203-R278 PolarHBondContact OE1-NH1 3.14Å; E203-R278 IonicContact OE1-NH2 2.88Å; E203-R278 PolarHBondContact OE1-NH2 2.92Å; E203-R278 IonicContact OE2-CZ 3.85Å; E203-R278 IonicContact OE2-NH1 3.99Å; E203-R278 IonicContact OE2-NH2 2.82Å; E203-R278 PolarHBondContact OE2-NH2 2.94Å; C243-R278 WeakPolarHBondContact O-CD 3.37Å; C243-R278 PolarHBondContact O-NH1 3.13Å; G244-R278 WeakPolarHBondContact O-CG 3.47Å; F245-R278 HydrophobicContact CB-CB 4.5Å; F245-R278 HydrophobicContact CD1-CB 3.66Å; F245-R278 HydrophobicContact CD2-CB 3.84Å; F245-R278 HydrophobicContact CD2-CG 4.46Å; F245-R278 HydrophobicContact CE1-CB 3.68Å; F245-R278 HydrophobicContact CE2-CB 3.85Å; F245-R278 HydrophobicContact CE2-CG 4.45Å; F245-R278 HydrophobicContact CG-CB 3.73Å; F245-R278 HydrophobicContact CZ-CB 3.76Å
279	F	81.8	Confident	69.1	Low	63 Å²	63	77.7 Å²	77.7	28%	0.276	40%	0.397	S	S	.	.			trans	-85.2	159.7	178.2	-58.5	-72.5	0	0	0	111.7	H99 Y277 W281	H99-F279 HydrophobicContact CB-CD1 3.67Å; H99-F279 HydrophobicContact CB-CE1 3.42Å; H99-F279 VanDerWaalsContact CB-CE1 3.42Å; H99-F279 AromaticContact CD2-CD1 3.05Å; H99-F279 WeakPolarHBondContact CD2-CD1 3.09Å; H99-F279 AromaticContact CD2-CE1 2.93Å; H99-F279 WeakPolarHBondContact CD2-CE1 3.42Å; H99-F279 AromaticContact CD2-CG 3.76Å; H99-F279 AromaticContact CD2-CZ 3.61Å; H99-F279 AromaticContact CE1-CD1 3.28Å; H99-F279 WeakPolarHBondContact CE1-CD1 3.46Å; H99-F279 AromaticContact CE1-CG 3.53Å; H99-F279 AromaticContact CG-CD1 2.99Å; H99-F279 AromaticContact CG-CE1 3.09Å; H99-F279 AromaticContact CG-CG 4Å; H99-F279 AromaticContact ND1-CD1 3.17Å; H99-F279 WeakPolarHBondContact ND1-CD1 3.16Å; H99-F279 AromaticContact ND1-CE1 3.81Å; H99-F279 AromaticContact ND1-CG 3.88Å; H99-F279 AromaticContact NE2-CD1 3.2Å; H99-F279 WeakPolarHBondContact NE2-CD1 3.32Å; H99-F279 AromaticContact NE2-CD2 3.99Å; H99-F279 AromaticContact NE2-CE1 3.56Å; H99-F279 AromaticContact NE2-CG 3.42Å; H99-F279 WeakPolarHBondContact NE2-CG 3.15Å; Y277-F279 AromaticContact CD1-CD1 3.41Å; Y277-F279 HydrophobicContact CD1-CD1 3.41Å; Y277-F279 VanDerWaalsContact CD1-CD1 3.41Å; Y277-F279 HydrophobicContact CD1-CD2 4.44Å; Y277-F279 AromaticContact CD1-CE1 3.15Å; Y277-F279 HydrophobicContact CD1-CE1 3.15Å; Y277-F279 HydrophobicContact CD1-CE2 4.21Å; Y277-F279 HydrophobicContact CD1-CG 4.1Å; Y277-F279 AromaticContact CD1-CZ 3.61Å; Y277-F279 HydrophobicContact CD1-CZ 3.61Å; Y277-F279 AromaticContact CE1-CD1 3.07Å; Y277-F279 HydrophobicContact CE1-CD1 3.07Å; Y277-F279 AromaticContact CE1-CE1 3.12Å; Y277-F279 HydrophobicContact CE1-CE1 3.12Å; Y277-F279 HydrophobicContact CE1-CG 4.01Å; Y277-F279 HydrophobicContact CE1-CZ 4.06Å; F279-W281 PolarHBondContact O-N 3.01Å
280	L	72.2	Confident	66.8	Low	107 Å²	107	87.4 Å²	87.4	56%	0.56	44%	0.438	S	S	*	.			trans	-78.2	110.1	160.6	-81.8	162.6	0	0	0	107.5	W163 E282	W163-L280 HydrophobicContact CB-CG 4.12Å; W163-L280 HydrophobicContact CG-CD1 4.08Å; W163-L280 HydrophobicContact CG-CG 3.94Å; L280-E282 PolarHBondContact O-N 2.92Å
281	W	47	Very low	64.3	Low	153 Å²	153	91.4 Å²	91.4	58%	0.58	47%	0.466	S	S	*	.			trans	-86.8	99.8	168.3	-170	-85.2	0	0	0	108.4	F279 C285 A286 L289	F279-W281 PolarHBondContact O-N 3.01Å; W281-C285 HydrophobicContact CZ2-CB 4.43Å; W281-A286 HydrophobicContact CZ2-CB 4.43Å; W281-L289 HydrophobicContact CH2-CD1 3.69Å; W281-L289 HydrophobicContact CZ3-CD1 4.21Å
282	E	47.4	Very low	61.9	Low	153 Å²	153	94 Å²	94	72%	0.715	48%	0.483	S	S	*	.			trans	-73.6	132.4	162.4	-83.8	-178.5	167.3	0	0	108.9	L280 E284	L280-E282 PolarHBondContact O-N 2.92Å; E282-E284 PolarHBondContact O-N 3.26Å
283	P	40.6	Very low	59.1	Low	109 Å²	109	98 Å²	98	71%	0.708	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-68.2	-1.8	-169.4	23.3	-31.3	0	0	0	115.8
284	E	41.3	Very low	56.2	Low	181 Å²	181	104.2 Å²	104.2	85%	0.846	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-79.4	-14.8	-179.3	-68.5	-169.6	157	0	0	114.5	E282 A286	E282-E284 PolarHBondContact O-N 3.26Å; E284-A286 PolarHBondContact O-N 3.38Å
285	C	40.3	Very low	52.8	Low	87 Å²	87	111.5 Å²	111.5	59%	0.588	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-86.4	-1	179.7	-70	0	0	0	0	114.9	W281 Q287	W281-C285 HydrophobicContact CZ2-CB 4.43Å; C285-Q287 PolarHBondContact O-N 3.4Å
286	A	39.7	Very low	49.9	Very low	66 Å²	66	116.1 Å²	116.1	55%	0.545	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.2	-3.4	-170.3	0	0	0	0	0	115.9	W281 E284	W281-A286 HydrophobicContact CZ2-CB 4.43Å; E284-A286 PolarHBondContact O-N 3.38Å
287	Q	40.8	Very low	46.9	Very low	182 Å²	182	118.7 Å²	118.7	85%	0.85	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-16.6	-177.9	-65.9	-171.1	-0	0	0	114.9	C285	C285-Q287 PolarHBondContact O-N 3.4Å
288	N	36.2	Very low	44.1	Very low	151 Å²	151	125.6 Å²	125.6	81%	0.807	67%	0.674	S	S	*	*	S	Bend	trans	-108.9	3.5	-172	-76	-35.3	0	0	0	116.2
289	L	40.3	Very low	41.2	Very low	104 Å²	104	134.3 Å²	134.3	55%	0.545	71%	0.713	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.3	23	-172.2	-106.8	152.4	0	0	0	115.9	W281 S291	W281-L289 HydrophobicContact CH2-CD1 3.69Å; W281-L289 HydrophobicContact CZ3-CD1 4.21Å; L289-S291 VanDerWaalsContact C-N 3.32Å
290	K	30.8	Very low	38.7	Very low	212 Å²	212	138.1 Å²	138.1	92%	0.922	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-3.6	167.7	-73	-173	179.4	178.5	0	114.3
291	S	34.4	Very low	36.8	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	74%	0.741	S	S	*	*	S	Bend	trans	-101.1	-2.7	-172.6	-167.2	0	0	0	0	116	L289	L289-S291 VanDerWaalsContact C-N 3.32Å
292	I	37.8	Very low	35.9	Very low	122 Å²	122	139.3 Å²	139.3	63%	0.626	76%	0.757	S	S	*	*			trans	-110.8	66.7	175.4	-48.5	179.1	0	0	0	108.5	F294	I292-F294 HydrophobicContact CG2-CD2 4.31Å; I292-F294 HydrophobicContact CG2-CE2 4.38Å; I292-F294 PolarHBondContact O-N 3.42Å
293	A	32.3	Very low	35.1	Very low	91 Å²	91	137.5 Å²	137.5	75%	0.752	76%	0.757	S	S	*	*			trans	-65.6	110	158.3	0	0	0	0	0	107.4	H295	A293-H295 PolarHBondContact O-N 3.38Å
294	F	33.8	Very low	34.7	Very low	188 Å²	188	138.4 Å²	138.4	83%	0.825	76%	0.763	S	S	*	*			trans	-60.4	117.2	168.2	-100.6	-100.3	0	0	0	108.9	I292	I292-F294 HydrophobicContact CG2-CD2 4.31Å; I292-F294 HydrophobicContact CG2-CE2 4.38Å; I292-F294 PolarHBondContact O-N 3.42Å
295	H	26.3	Very low	34.1	Very low	176 Å²	176	138.8 Å²	138.8	82%	0.815	76%	0.764	S	S	*	*			trans	-62.9	123.9	165.3	-123.4	-80.6	0	0	0	108.3	A293 G297	A293-H295 PolarHBondContact O-N 3.38Å; H295-G297 PolarHBondContact O-N 3.46Å; H295-G297 VanDerWaalsContact O-N 3.11Å
296	P	35.3	Very low	33.7	Very low	129 Å²	129	142.4 Å²	142.4	84%	0.838	77%	0.772	S	S	*	*	S	Bend	trans	-79.8	97.2	176.5	31.3	-28.9	0	0	0	107.5
297	G	35.8	Very low	33.3	Very low	62 Å²	62	144.8 Å²	144.8	64%	0.639	79%	0.785	S	S	*	*			trans	176.3	49.3	-176.8	0	0	0	0	0	117.1	H295	H295-G297 PolarHBondContact O-N 3.46Å; H295-G297 VanDerWaalsContact O-N 3.11Å
298	I	38.1	Very low	32.9	Very low	170 Å²	170	144.6 Å²	144.6	87%	0.872	78%	0.781	S	S	*	*			trans	-138.6	75.8	155.1	-52.5	-177	0	0	0	108.9
299	F	32.8	Very low	32.7	Very low	205 Å²	205	145.9 Å²	145.9	90%	0.899	79%	0.787	S	S	*	*			trans	-116.7	103.2	149.1	-105.1	-87.1	0	0	0	105.9
300	N	29.2	Very low	32.3	Very low	143 Å²	143	149.5 Å²	149.5	77%	0.765	80%	0.802	S	S	*	*			trans	-158.7	97.5	155.3	-96.9	-23.6	0	0	0	107.2
301	V	32.2	Very low	32.3	Very low	111 Å²	111	143.1 Å²	143.1	67%	0.673	80%	0.795	S	S	*	*				63.3	98.8	103.6	-177.8	0	0	0	0	111.8	T303	V301-T303 HydrophobicContact CG1-CG2 4.23Å
302	L	28.6	Very low	32.1	Very low	175 Å²	175	143.6 Å²	143.6	92%	0.916	80%	0.799	S	S	*	*			trans	-118.8	97.9	152.2	-78.7	172.6	0	0	0	107.9
303	T	30.8	Very low	32.1	Very low	114 Å²	114	142.7 Å²	142.7	70%	0.699	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-77	142.1	160.2	43	0	0	0	0	109.6	V301	V301-T303 HydrophobicContact CG1-CG2 4.23Å
304	P	32.3	Very low	32.1	Very low	128 Å²	128	147.8 Å²	147.8	83%	0.831	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-78.9	127.8	171.6	7.5	8.6	0	0	0	110.1
305	H	28.3	Very low	32.2	Very low	189 Å²	189	148.4 Å²	148.4	88%	0.875	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-81	121.3	174.3	-158.9	-76	0	0	0	109.6
306	E	31.4	Very low	33.1	Very low	163 Å²	163	145.5 Å²	145.5	76%	0.762	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-60.9	130.6	167.7	-69.3	-179.9	141.6	0	0	110
307	S	31.6	Very low	33.1	Very low	116 Å²	116	143.4 Å²	143.4	81%	0.811	81%	0.81	S	S	*	*			trans	-100.5	103.6	165.3	56.2	0	0	0	0	109.1	L309	S307-L309 PolarHBondContact O-N 3.44Å
308	K	32.3	Very low	33.5	Very low	179 Å²	179	154 Å²	154	78%	0.778	84%	0.839	S	S	*	*			trans	-63.8	123.4	168.2	-78.2	174.6	176	174.4	0	110
309	L	32.7	Very low	33.3	Very low	178 Å²	178	153.2 Å²	153.2	93%	0.932	84%	0.838	S	S	*	*			trans	-68.4	119.3	158.7	-86.9	149.8	0	0	0	108.5	S307	S307-L309 PolarHBondContact O-N 3.44Å
310	Q	31.6	Very low	33.3	Very low	180 Å²	180	150.5 Å²	150.5	84%	0.841	84%	0.835	S	S	*	*			trans	-135	116.1	162.1	-160.5	134.1	10.1	0	0	108.5
311	G	30	Very low	33.5	Very low	77 Å²	77	150.9 Å²	150.9	79%	0.794	84%	0.839	S	S	*	*			trans	-72.8	154.1	179.5	0	0	0	0	0	112.5
312	S	31.7	Very low	33.6	Very low	120 Å²	120	153.2 Å²	153.2	84%	0.839	85%	0.848	S	S	*	*			trans	-140.9	116	157	57.3	0	0	0	0	108.4
313	A	36	Very low	33.9	Very low	102 Å²	102	151.9 Å²	151.9	84%	0.843	84%	0.844	S	S	*	*			trans	-61.9	136.6	172.7	0	0	0	0	0	111.1
314	Q	32.9	Very low	34.1	Very low	199 Å²	199	154.4 Å²	154.4	93%	0.93	85%	0.854	S	S	*	*			trans	-141.5	114.5	154.2	-102.1	176.7	-9.4	0	0	108.9
315	K	35.7	Very low	34.3	Very low	200 Å²	200	156.3 Å²	156.3	87%	0.87	86%	0.855	S	S	*	*			trans	-128.2	165.5	160.3	-105.4	-167.2	179.2	-176	0	105
316	P	45.8	Very low	34.7	Very low	115 Å²	115	153.8 Å²	153.8	75%	0.747	85%	0.854	S	S	*	*			cis	-132.2	178.2	-45.7	34.3	-16.7	0	0	0	110.3
317	A	34.6	Very low	35	Very low	85 Å²	85	153 Å²	153	70%	0.702	86%	0.861	S	S	*	*			trans	-159.3	117.3	151	0	0	0	0	0	111.3
318	F	45.1	Very low	35.3	Very low	285 Å²	285	156.4 Å²	156.4	100%	1.25	87%	0.866	S	S	*	*			trans	61.9	0	167	-56.9	-74.4	0	0	0	119.2

Retrieved 318 of 318 residues in 93.8 ms (Link to these results)

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