A0A077ZFW2_TRITR Loading...

Glucosidase 2 subunit beta

AlphaFold DB , UniProt , Accession A0A077ZFW2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 402 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	40.1	Very low	41.1	Very low	234 Å²	234	159.8 Å²	159.8	100%	1.153	81%	0.813	S	S	*	*				0	129.1	0	-72.5	169.5	71.4	0	0	106
2	I	46.1	Very low	40.5	Very low	172 Å²	172	156.6 Å²	156.6	88%	0.882	81%	0.813	S	S	*	*			trans	79.1	89.4	-152.4	-47.4	156.9	0	0	0	109.3
3	S	37.5	Very low	40.8	Very low	109 Å²	109	155.5 Å²	155.5	76%	0.762	81%	0.807	S	S	*	*			cis	58.4	125.3	49.7	-170.9	0	0	0	0	111.7
4	C	39.3	Very low	40.8	Very low	114 Å²	114	151 Å²	151	77%	0.77	80%	0.796	S	S	*	*			cis	-159.6	153	30.6	-157.7	0	0	0	0	110.8
5	S	39.6	Very low	40.5	Very low	93 Å²	93	146.5 Å²	146.5	65%	0.65	79%	0.789	S	S	*	*			trans	-63.4	143.8	177.7	-43.6	0	0	0	0	114.4
6	F	44.1	Very low	40.1	Very low	215 Å²	215	149.9 Å²	149.9	94%	0.943	80%	0.795	S	S	*	*			trans	-136.6	115.1	144.5	-102.9	-85.1	0	0	0	109.9
7	L	43.6	Very low	39.7	Very low	141 Å²	141	150.1 Å²	150.1	74%	0.738	79%	0.794	S	S	*	*			trans	-77.8	151	177.7	-84.2	150.3	0	0	0	111.3
8	L	36.3	Very low	39.2	Very low	138 Å²	138	147.8 Å²	147.8	72%	0.723	79%	0.79	S	S	*	*			trans	54.4	110.8	151	-84.2	91.5	0	0	0	119.2
9	R	41.5	Very low	38.7	Very low	229 Å²	229	146.7 Å²	146.7	86%	0.864	79%	0.794	S	S	*	*				-143.9	98.6	123.2	-76.3	-161.1	174.4	-169.6	-3.5	110.6
10	F	38.3	Very low	38.5	Very low	197 Å²	197	145.7 Å²	145.7	86%	0.864	79%	0.793	S	S	*	*			trans	-68.9	117	150.7	-92.1	-93.4	0	0	0	107.3
11	I	45.8	Very low	38.4	Very low	116 Å²	116	144.3 Å²	144.3	60%	0.595	78%	0.784	S	S	*	*			trans	-129.1	109	159.8	-62.6	179.4	0	0	0	106.2	I13	I11-I13 HydrophobicContact CG2-CG1 3.98Å; I11-I13 PolarHBondContact O-N 2.62Å
12	C	33.7	Very low	38.8	Very low	121 Å²	121	136 Å²	136	82%	0.818	75%	0.748	S	S	*	*			trans	-59.7	116.7	159.5	-67	0	0	0	0	108.5
13	I	44.2	Very low	39.2	Very low	143 Å²	143	129.9 Å²	129.9	73%	0.733	73%	0.727	S	S	*	*			trans	-114.5	106.4	152.3	-60.9	-178.6	0	0	0	106	I11	I11-I13 HydrophobicContact CG2-CG1 3.98Å; I11-I13 PolarHBondContact O-N 2.62Å
14	S	41.4	Very low	40.4	Very low	92 Å²	92	126.2 Å²	126.2	64%	0.643	70%	0.701	S	S	*	*			trans	-36.6	137.6	162.7	46.7	0	0	0	0	113.9	F16	S14-F16 PolarHBondContact O-N 3.27Å; S14-F16 VanDerWaalsContact O-N 3.14Å
15	A	35.8	Very low	41.9	Very low	84 Å²	84	122.5 Å²	122.5	69%	0.694	67%	0.673	S	S	*	*			trans	33.9	70.5	138.2	0	0	0	0	0	116.4
16	F	34.4	Very low	43.7	Very low	201 Å²	201	119 Å²	119	88%	0.882	65%	0.648	S	S	*	*			trans	-115.9	68.3	151	-104.4	-93	0	0	0	106.6	S14	S14-F16 PolarHBondContact O-N 3.27Å; S14-F16 VanDerWaalsContact O-N 3.14Å
17	I	34.2	Very low	45.4	Very low	153 Å²	153	111.7 Å²	111.7	79%	0.785	62%	0.619	S	S	*	*			trans	-86.4	107	172.5	-66.4	170.4	0	0	0	105.6
18	C	30.5	Very low	46.9	Very low	108 Å²	108	115.8 Å²	115.8	73%	0.73	62%	0.624	S	S	*	*			trans	60.4	60.8	150.6	-142.1	0	0	0	0	119
19	C	29.8	Very low	49	Very low	127 Å²	127	115.7 Å²	115.7	86%	0.858	62%	0.624	S	S	*	*			trans	-105.4	49.7	153.8	-80.1	0	0	0	0	110.6	L21	C19-L21 PolarHBondContact O-N 2.8Å
20	V	33.6	Very low	50.9	Low	126 Å²	126	111 Å²	111	76%	0.764	61%	0.606	S	S	*	*	S	Bend	trans	-80.7	97	163.6	177.9	0	0	0	0	105.7	C22	V20-C22 PolarHBondContact O-N 3.08Å
21	L	37.6	Very low	53	Low	118 Å²	118	108 Å²	108	62%	0.618	59%	0.593	S	S	*	*			trans	24.2	92.7	157	-72.3	151	0	0	0	113.5	C19 G23 E36	C19-L21 PolarHBondContact O-N 2.8Å; L21-G23 PolarHBondContact O-N 2.6Å; L21-E36 WeakPolarHBondContact CD2-OE1 3.4Å
22	C	47.2	Very low	54.9	Low	59 Å²	59	108.9 Å²	108.9	40%	0.399	59%	0.592	S	S	.	*			trans	-62.9	86.1	153.7	-147.9	0	0	0	0	105	V20 T24 W109	V20-C22 PolarHBondContact O-N 3.08Å; C22-T24 PolarHBondContact O-N 3.15Å; C22-W109 VanDerWaalsContact SG-CD2 3.51Å
23	G	54.3	Low	57.4	Low	43 Å²	43	106.5 Å²	106.5	44%	0.443	57%	0.571	S	S	.	*			trans	-55.7	134.2	-171.7	0	0	0	0	0	108.2	L21 N25	L21-G23 PolarHBondContact O-N 2.6Å; G23-N25 VanDerWaalsContact C-N 3.3Å; G23-N25 PolarHBondContact O-N 3.15Å
24	T	62.2	Low	59.5	Low	33 Å²	33	100.6 Å²	100.6	20%	0.202	54%	0.54	C	S	.	.			trans	-51.9	99.1	173.7	40.1	0	0	0	0	108.5	C22 V26 Y34 V54 P68	C22-T24 PolarHBondContact O-N 3.15Å; T24-V26 PolarHBondContact O-N 3.05Å; T24-Y34 HydrophobicContact CG2-CD1 3.87Å; T24-Y34 HydrophobicContact CG2-CG 4.15Å; T24-V54 HydrophobicContact CG2-CG1 4.09Å; T24-P68 HydrophobicContact CG2-CG 4.01Å
25	N	71.9	Confident	61.7	Low	36 Å²	36	101.6 Å²	101.6	19%	0.193	53%	0.533	C	S	.	.			trans	-78.8	80.4	178.1	-109.6	-7.4	0	0	0	105.6	G23 F78 H79 P81	G23-N25 VanDerWaalsContact C-N 3.3Å; G23-N25 PolarHBondContact O-N 3.15Å; N25-F78 HydrophobicContact CB-CD2 4.48Å; N25-F78 HydrophobicContact CB-CE1 4.47Å; N25-F78 HydrophobicContact CB-CE2 3.9Å; N25-F78 HydrophobicContact CB-CZ 3.9Å; N25-F78 WeakPolarHBondContact ND2-CZ 3.38Å; N25-H79 WeakPolarHBondContact CB-O 3.4Å; N25-H79 WeakPolarHBondContact O-CB 3.34Å; N25-H79 PolarHBondContact O-N 2.87Å; N25-P81 WeakPolarHBondContact OD1-CG 3.2Å
26	V	78.1	Confident	64.1	Low	19 Å²	19	104 Å²	104	12%	0.115	53%	0.529	C	S	.	.			trans	-118.8	148.7	178.5	-64.9	0	0	0	0	108.4	T24 R28 R30 K31 Y34 P68	T24-V26 PolarHBondContact O-N 3.05Å; V26-R28 PolarHBondContact O-N 3.2Å; V26-R30 HydrophobicContact CB-CB 4.4Å; V26-K31 HydrophobicContact CG2-CB 4.11Å; V26-Y34 HydrophobicContact CB-CD2 4.47Å; V26-Y34 HydrophobicContact CB-CE2 4.3Å; V26-Y34 HydrophobicContact CG1-CD2 4Å; V26-Y34 HydrophobicContact CG1-CE2 3.63Å; V26-Y34 HydrophobicContact CG2-CD2 4.04Å; V26-Y34 HydrophobicContact CG2-CE2 4.37Å; V26-P68 HydrophobicContact CG1-CB 3.41Å; V26-P68 VanDerWaalsContact CG1-CB 3.41Å; V26-P68 HydrophobicContact CG1-CG 3.84Å
27	N	78.9	Confident	66.5	Low	62 Å²	62	98.2 Å²	98.2	33%	0.332	53%	0.526	S	S	.	.			trans	-47.8	137.9	172.7	-175	-50	0	0	0	109.5	L29 R30 K31 H79	N27-L29 PolarHBondContact O-N 2.84Å; N27-L29 WeakPolarHBondContact OD1-CB 3.32Å; N27-L29 PolarHBondContact OD1-N 3.46Å; N27-R30 WeakPolarHBondContact O-CA 3.43Å; N27-R30 PolarHBondContact O-N 3.4Å; N27-K31 PolarHBondContact O-N 3Å; N27-K31 VanDerWaalsContact O-N 3.16Å; N27-H79 PolarHBondContact N-CD2 3.26Å
28	R	76.3	Confident	69.2	Low	226 Å²	226	97.3 Å²	97.3	85%	0.853	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-33.9	179.9	-170.5	178.5	-177	-173.1	1.6	112.9	V26 R30	V26-R28 PolarHBondContact O-N 3.2Å; R28-R30 VanDerWaalsContact C-N 3.31Å; R28-R30 PolarHBondContact O-N 3.03Å
29	L	78.3	Confident	72.1	Confident	137 Å²	137	97.8 Å²	97.8	72%	0.717	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-25.4	176	-66.4	175.4	0	0	0	113.7	N27 F32	N27-L29 PolarHBondContact O-N 2.84Å; N27-L29 WeakPolarHBondContact OD1-CB 3.32Å; N27-L29 PolarHBondContact OD1-N 3.46Å; L29-F32 WeakPolarHBondContact O-CD1 3.44Å; L29-F32 WeakPolarHBondContact O-CE1 3.48Å
30	R	81.7	Confident	75.2	Confident	129 Å²	129	92 Å²	92	49%	0.487	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-12.5	179.6	-68.6	-173.4	178.5	179.8	-1.1	113.8	V26 N27 R28 F32 L33	V26-R30 HydrophobicContact CB-CB 4.4Å; N27-R30 WeakPolarHBondContact O-CA 3.43Å; N27-R30 PolarHBondContact O-N 3.4Å; R28-R30 VanDerWaalsContact C-N 3.31Å; R28-R30 PolarHBondContact O-N 3.03Å; R30-F32 PolarHBondContact O-N 2.88Å; R30-L33 HydrophobicContact CB-CD1 4.16Å; R30-L33 HydrophobicContact CG-CD1 4.25Å; R30-L33 VanDerWaalsContact O-CB 3.29Å; R30-L33 WeakPolarHBondContact O-CB 3.33Å; R30-L33 PolarHBondContact O-N 3.22Å
31	K	82.5	Confident	78.1	Confident	136 Å²	136	89.3 Å²	89.3	59%	0.591	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-51.9	-30.8	-178.2	-171.9	167.3	-175.1	165.1	0	113.9	V26 N27 L33 Y34	V26-K31 HydrophobicContact CG2-CB 4.11Å; N27-K31 PolarHBondContact O-N 3Å; N27-K31 VanDerWaalsContact O-N 3.16Å; K31-L33 PolarHBondContact O-N 3.46Å; K31-Y34 PolarHBondContact O-N 3.07Å
32	F	85.5	Confident	80.8	Confident	133 Å²	133	83.9 Å²	83.9	58%	0.583	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-68.5	-14.9	178.5	74.8	-98.3	0	0	0	114.3	L29 R30 K35	L29-F32 WeakPolarHBondContact O-CD1 3.44Å; L29-F32 WeakPolarHBondContact O-CE1 3.48Å; R30-F32 PolarHBondContact O-N 2.88Å; F32-K35 WeakPolarHBondContact O-CE 3.32Å
33	L	86.8	Confident	82.9	Confident	71 Å²	71	84.1 Å²	84.1	37%	0.372	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-82.8	-25.3	-178.9	-61.8	165.1	0	0	0	112.1	R30 K31 K35 L43	R30-L33 HydrophobicContact CB-CD1 4.16Å; R30-L33 HydrophobicContact CG-CD1 4.25Å; R30-L33 VanDerWaalsContact O-CB 3.29Å; R30-L33 WeakPolarHBondContact O-CB 3.33Å; R30-L33 PolarHBondContact O-N 3.22Å; K31-L33 PolarHBondContact O-N 3.46Å; L33-K35 PolarHBondContact O-N 3.43Å; L33-L43 HydrophobicContact CB-CD2 4.33Å; L33-L43 HydrophobicContact CD1-CD2 3.61Å; L33-L43 HydrophobicContact CG-CD2 4.41Å
34	Y	89.1	Confident	84.8	Confident	20 Å²	20	86.3 Å²	86.3	8%	0.078	43%	0.426	C	S	.	.			trans	-99.4	86.2	-177.8	-63.9	-96.1	0	0	0	109.9	T24 V26 K31 F40 V54 S65 P68	T24-Y34 HydrophobicContact CG2-CD1 3.87Å; T24-Y34 HydrophobicContact CG2-CG 4.15Å; V26-Y34 HydrophobicContact CB-CD2 4.47Å; V26-Y34 HydrophobicContact CB-CE2 4.3Å; V26-Y34 HydrophobicContact CG1-CD2 4Å; V26-Y34 HydrophobicContact CG1-CE2 3.63Å; V26-Y34 HydrophobicContact CG2-CD2 4.04Å; V26-Y34 HydrophobicContact CG2-CE2 4.37Å; K31-Y34 PolarHBondContact O-N 3.07Å; Y34-F40 HydrophobicContact CD1-CD2 4.21Å; Y34-F40 AromaticContact CD1-CE2 3.71Å; Y34-F40 HydrophobicContact CD1-CE2 3.71Å; Y34-F40 HydrophobicContact CD1-CZ 4.25Å; Y34-F40 HydrophobicContact CE1-CD2 4.36Å; Y34-F40 AromaticContact CE1-CE2 3.5Å; Y34-F40 HydrophobicContact CE1-CE2 3.5Å; Y34-F40 VanDerWaalsContact CE1-CE2 3.5Å; Y34-F40 AromaticContact CE1-CZ 3.59Å; Y34-F40 HydrophobicContact CE1-CZ 3.59Å; Y34-F40 HydrophobicContact CE2-CE2 4.41Å; Y34-F40 HydrophobicContact CG-CE2 4.28Å; Y34-F40 AromaticContact CZ-CE2 3.89Å; Y34-F40 AromaticContact CZ-CZ 3.89Å; Y34-V54 HydrophobicContact CD1-CG1 3.89Å; Y34-V54 HydrophobicContact CE1-CG1 4.18Å; Y34-S65 VanDerWaalsContact CE1-O 3.23Å; Y34-S65 WeakPolarHBondContact CE1-O 3.29Å; Y34-S65 VanDerWaalsContact CZ-O 3.31Å; Y34-S65 PolarHBondContact OH-O 3.05Å; Y34-P68 HydrophobicContact CD1-CG 4.37Å; Y34-P68 HydrophobicContact CE1-CG 3.74Å
35	K	87.2	Confident	86.2	Confident	113 Å²	113	87.1 Å²	87.1	49%	0.491	44%	0.442	S	S	.	.			trans	-107.9	112.7	-178.2	-64.6	-176.1	-172.6	177.1	0	111.4	F32 L33 G37 K38 F51	F32-K35 WeakPolarHBondContact O-CE 3.32Å; L33-K35 PolarHBondContact O-N 3.43Å; K35-G37 PolarHBondContact O-N 3.18Å; K35-K38 PolarHBondContact O-N 3.32Å; K35-F51 VanDerWaalsContact C-CE2 3.43Å; K35-F51 VanDerWaalsContact O-CD2 3.24Å; K35-F51 WeakPolarHBondContact O-CD2 3.44Å; K35-F51 WeakPolarHBondContact O-CE2 3.25Å
36	E	86	Confident	87.3	Confident	134 Å²	134	88 Å²	88	63%	0.626	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	136.7	173.9	-73.6	170.7	-148.6	0	0	112.4	L21 F51	L21-E36 WeakPolarHBondContact CD2-OE1 3.4Å; E36-F51 HydrophobicContact CB-CD1 4.37Å; E36-F51 HydrophobicContact CB-CE1 4.09Å; E36-F51 HydrophobicContact CG-CD1 4.06Å; E36-F51 HydrophobicContact CG-CE1 3.38Å; E36-F51 HydrophobicContact CG-CZ 3.88Å
37	G	85.5	Confident	88	Confident	79 Å²	79	91.1 Å²	91.1	81%	0.814	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	11.7	177.5	0	0	0	0	0	115.4	K35	K35-G37 PolarHBondContact O-N 3.18Å
38	K	89.3	Confident	88.8	Confident	134 Å²	134	92.1 Å²	92.1	58%	0.583	48%	0.475	S	S	*	.	S	Bend	trans	-128.4	144.3	170.7	-64.4	-170.4	178.3	-164.7	0	110.2	K35 F40 F51	K35-K38 PolarHBondContact O-N 3.32Å; K38-F40 PolarHBondContact O-N 2.99Å; K38-F51 WeakPolarHBondContact O-CB 3.46Å
39	D	93	Very high	89.6	Confident	119 Å²	119	81.9 Å²	81.9	64%	0.636	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-49.9	135.2	171.6	-55.8	-7.4	0	0	0	110.6	T48 I49	D39-T48 HydrophobicContact CB-CG2 3.58Å; D39-I49 CarbonylContact C-O 3.54Å; D39-I49 WeakPolarHBondContact CA-O 3.43Å
40	F	94.1	Very high	90.4	Very high	6 Å²	6	77.3 Å²	77.3	3%	0.026	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.1	178.7	176.3	-104.9	0	0	0	108.9	Y34 K38 T48 I49 F51 V54 D66	Y34-F40 HydrophobicContact CD1-CD2 4.21Å; Y34-F40 AromaticContact CD1-CE2 3.71Å; Y34-F40 HydrophobicContact CD1-CE2 3.71Å; Y34-F40 HydrophobicContact CD1-CZ 4.25Å; Y34-F40 HydrophobicContact CE1-CD2 4.36Å; Y34-F40 AromaticContact CE1-CE2 3.5Å; Y34-F40 HydrophobicContact CE1-CE2 3.5Å; Y34-F40 VanDerWaalsContact CE1-CE2 3.5Å; Y34-F40 AromaticContact CE1-CZ 3.59Å; Y34-F40 HydrophobicContact CE1-CZ 3.59Å; Y34-F40 HydrophobicContact CE2-CE2 4.41Å; Y34-F40 HydrophobicContact CG-CE2 4.28Å; Y34-F40 AromaticContact CZ-CE2 3.89Å; Y34-F40 AromaticContact CZ-CZ 3.89Å; K38-F40 PolarHBondContact O-N 2.99Å; F40-T48 CarbonylContact O-C 3.52Å; F40-T48 VanDerWaalsContact O-CA 3.31Å; F40-T48 WeakPolarHBondContact O-CA 3.4Å; F40-I49 HydrophobicContact CB-CG1 4.21Å; F40-I49 HydrophobicContact CD1-CD1 4Å; F40-I49 HydrophobicContact CD1-CG1 3.97Å; F40-I49 PolarHBondContact N-O 3.45Å; F40-I49 PolarHBondContact O-N 2.89Å; F40-F51 HydrophobicContact CB-CD2 4.35Å; F40-V54 HydrophobicContact CB-CG2 3.82Å; F40-V54 HydrophobicContact CD1-CG2 3.85Å; F40-V54 HydrophobicContact CD2-CG2 4.37Å; F40-V54 HydrophobicContact CG-CG2 3.75Å; F40-D66 HydrophobicContact CE1-CB 4.32Å
41	T	94.6	Very high	91	Very high	69 Å²	69	72.6 Å²	72.6	42%	0.423	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.6	171.2	-58.3	0	0	0	0	107.9	L47 T48	T41-L47 WeakPolarHBondContact CA-O 3.39Å; T41-T48 PolarHBondContact OG1-OG1 2.93Å
42	C	94.4	Very high	91.4	Very high	3 Å²	3	72.4 Å²	72.4	2%	0.02	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-49.1	146.6	174.5	-53.8	0	0	0	0	110	D44 G45 L47 C61 S65	C42-D44 VanDerWaalsContact CB-OD1 3.3Å; C42-D44 WeakPolarHBondContact CB-OD1 3.22Å; C42-D44 PolarHBondContact O-N 3.48Å; C42-G45 WeakPolarHBondContact O-CA 3.41Å; C42-G45 PolarHBondContact O-N 3.42Å; C42-L47 PolarHBondContact N-O 3.08Å; C42-L47 PolarHBondContact SG-O 2.98Å; C42-L47 VanDerWaalsContact SG-O 3.41Å; C42-C61 VanDerWaalsContact CA-SG 3.58Å; C42-C61 HydrophobicContact CB-CB 3.76Å; C42-C61 WeakPolarHBondContact CB-SG 3.37Å; C42-C61 VanDerWaalsContact SG-CA 3.57Å; C42-C61 WeakPolarHBondContact SG-CB 3.5Å; C42-C61 CovalentContact SG-SG 2.03Å; C42-C61 PolarHBondContact SG-SG 3.47Å; C42-S65 WeakPolarHBondContact CA-OG 3.42Å
43	L	92	Very high	91.8	Very high	65 Å²	65	71.9 Å²	71.9	34%	0.34	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-24.1	-171.6	-62.2	177.6	0	0	0	113.2	L33 G45 D63 S65	L33-L43 HydrophobicContact CB-CD2 4.33Å; L33-L43 HydrophobicContact CD1-CD2 3.61Å; L33-L43 HydrophobicContact CG-CD2 4.41Å; L43-G45 VanDerWaalsContact C-N 3.31Å; L43-D63 WeakPolarHBondContact CA-OD2 3.36Å; L43-D63 VanDerWaalsContact CB-OD2 3.28Å; L43-D63 WeakPolarHBondContact CB-OD2 3.48Å; L43-D63 PolarHBondContact N-OD2 3.13Å; L43-S65 VanDerWaalsContact CG-CB 3.47Å; L43-S65 PolarHBondContact N-OG 3.28Å
44	D	92.5	Very high	92.2	Very high	88 Å²	88	69.2 Å²	69.2	47%	0.471	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-10	169.8	72.7	-11.2	0	0	0	114.3	C42 S46 D63	C42-D44 VanDerWaalsContact CB-OD1 3.3Å; C42-D44 WeakPolarHBondContact CB-OD1 3.22Å; C42-D44 PolarHBondContact O-N 3.48Å; D44-S46 VanDerWaalsContact OD1-CB 3.26Å; D44-S46 WeakPolarHBondContact OD1-CB 3.16Å; D44-S46 PolarHBondContact OD1-N 2.99Å; D44-S46 PolarHBondContact OD1-OG 2.86Å; D44-S46 WeakPolarHBondContact OD2-CB 3.49Å; D44-S46 PolarHBondContact OD2-OG 3.35Å; D44-D63 HydrophobicContact CB-CB 4Å; D44-D63 PolarHBondContact N-OD2 2.98Å
45	G	92.8	Very high	92.3	Very high	51 Å²	51	69.8 Å²	69.8	53%	0.526	39%	0.39	S	S	.	.	S	Bend	trans	79.4	12.5	-178	0	0	0	0	0	115.3	C42 L43	C42-G45 WeakPolarHBondContact O-CA 3.41Å; C42-G45 PolarHBondContact O-N 3.42Å; L43-G45 VanDerWaalsContact C-N 3.31Å
46	S	94.4	Very high	92.6	Very high	55 Å²	55	67.5 Å²	67.5	39%	0.385	38%	0.384	S	S	.	.	S	Bend	trans	-71	-40.9	-173.1	65.5	0	0	0	0	114	D44 P62	D44-S46 VanDerWaalsContact OD1-CB 3.26Å; D44-S46 WeakPolarHBondContact OD1-CB 3.16Å; D44-S46 PolarHBondContact OD1-N 2.99Å; D44-S46 PolarHBondContact OD1-OG 2.86Å; D44-S46 WeakPolarHBondContact OD2-CB 3.49Å; D44-S46 PolarHBondContact OD2-OG 3.35Å; S46-P62 VanDerWaalsContact OG-CD 3.24Å; S46-P62 WeakPolarHBondContact OG-CD 3.39Å
47	L	93.4	Very high	93	Very high	83 Å²	83	65.9 Å²	65.9	44%	0.435	38%	0.379	S	S	.	.			trans	-140.1	155.2	-177.2	-73.6	99.1	0	0	0	110.7	T41 C42 I49 P62	T41-L47 WeakPolarHBondContact CA-O 3.39Å; C42-L47 PolarHBondContact N-O 3.08Å; C42-L47 PolarHBondContact SG-O 2.98Å; C42-L47 VanDerWaalsContact SG-O 3.41Å; L47-I49 HydrophobicContact CB-CG2 4.44Å; L47-P62 HydrophobicContact CD1-CG 3.91Å
48	T	95.6	Very high	93.4	Very high	84 Å²	84	69 Å²	69	52%	0.515	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	120.4	167	-63	0	0	0	0	107.7	D39 F40 T41	D39-T48 HydrophobicContact CB-CG2 3.58Å; F40-T48 CarbonylContact O-C 3.52Å; F40-T48 VanDerWaalsContact O-CA 3.31Å; F40-T48 WeakPolarHBondContact O-CA 3.4Å; T41-T48 PolarHBondContact OG1-OG1 2.93Å
49	I	93.6	Very high	93.7	Very high	10 Å²	10	64.7 Å²	64.7	5%	0.051	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	164.7	-174.9	62.2	178.2	0	0	0	110.4	D39 F40 L47 W53 D60 D66	D39-I49 CarbonylContact C-O 3.54Å; D39-I49 WeakPolarHBondContact CA-O 3.43Å; F40-I49 HydrophobicContact CB-CG1 4.21Å; F40-I49 HydrophobicContact CD1-CD1 4Å; F40-I49 HydrophobicContact CD1-CG1 3.97Å; F40-I49 PolarHBondContact N-O 3.45Å; F40-I49 PolarHBondContact O-N 2.89Å; L47-I49 HydrophobicContact CB-CG2 4.44Å; I49-W53 HydrophobicContact CB-CB 4.45Å; I49-W53 HydrophobicContact CB-CD2 4.37Å; I49-W53 HydrophobicContact CB-CE3 3.79Å; I49-W53 HydrophobicContact CB-CZ3 4.49Å; I49-W53 HydrophobicContact CD1-CB 3.97Å; I49-W53 HydrophobicContact CG1-CB 4.44Å; I49-W53 HydrophobicContact CG2-CE3 3.83Å; I49-W53 HydrophobicContact CG2-CZ3 4.19Å; I49-D60 HydrophobicContact CD1-CB 4.14Å; I49-D60 HydrophobicContact CG2-CB 4.31Å; I49-D66 HydrophobicContact CD1-CB 3.74Å
50	S	94.2	Very high	93.8	Very high	41 Å²	41	60.8 Å²	60.8	29%	0.287	33%	0.333	S	S	.	.			trans	-63	146	170.3	-173.7	0	0	0	0	109.3	D52 W53	S50-D52 PolarHBondContact O-N 3.05Å; S50-D52 VanDerWaalsContact O-N 3.12Å; S50-D52 PolarHBondContact OG-N 3.07Å; S50-D52 PolarHBondContact OG-OD2 3.47Å; S50-W53 WeakPolarHBondContact O-CB 3.27Å; S50-W53 PolarHBondContact O-N 3.15Å
51	F	93.7	Very high	93.9	Very high	31 Å²	31	60.6 Å²	60.6	14%	0.136	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-59.6	-22.4	171.1	-160.8	-94.7	0	0	0	112.5	K35 E36 K38 F40 W53 V54	K35-F51 VanDerWaalsContact C-CE2 3.43Å; K35-F51 VanDerWaalsContact O-CD2 3.24Å; K35-F51 WeakPolarHBondContact O-CD2 3.44Å; K35-F51 WeakPolarHBondContact O-CE2 3.25Å; E36-F51 HydrophobicContact CB-CD1 4.37Å; E36-F51 HydrophobicContact CB-CE1 4.09Å; E36-F51 HydrophobicContact CG-CD1 4.06Å; E36-F51 HydrophobicContact CG-CE1 3.38Å; E36-F51 HydrophobicContact CG-CZ 3.88Å; K38-F51 WeakPolarHBondContact O-CB 3.46Å; F40-F51 HydrophobicContact CB-CD2 4.35Å; F51-W53 PolarHBondContact O-N 3.16Å; F51-V54 HydrophobicContact CD2-CG2 4.23Å; F51-V54 HydrophobicContact CE2-CG2 4.38Å; F51-V54 WeakPolarHBondContact O-CB 3.49Å; F51-V54 PolarHBondContact O-N 3.42Å; F51-V54 VanDerWaalsContact O-N 3.13Å
52	D	92.7	Very high	93.8	Very high	132 Å²	132	60.9 Å²	60.9	71%	0.706	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-66.3	-14.2	177.2	-55.9	-43.5	0	0	0	113	S50	S50-D52 PolarHBondContact O-N 3.05Å; S50-D52 VanDerWaalsContact O-N 3.12Å; S50-D52 PolarHBondContact OG-N 3.07Å; S50-D52 PolarHBondContact OG-OD2 3.47Å
53	W	93.8	Very high	93.7	Very high	121 Å²	121	62.9 Å²	62.9	46%	0.458	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-97.8	11.4	177.9	-58.5	3.6	0	0	0	111.6	I49 S50 F51 D60	I49-W53 HydrophobicContact CB-CB 4.45Å; I49-W53 HydrophobicContact CB-CD2 4.37Å; I49-W53 HydrophobicContact CB-CE3 3.79Å; I49-W53 HydrophobicContact CB-CZ3 4.49Å; I49-W53 HydrophobicContact CD1-CB 3.97Å; I49-W53 HydrophobicContact CG1-CB 4.44Å; I49-W53 HydrophobicContact CG2-CE3 3.83Å; I49-W53 HydrophobicContact CG2-CZ3 4.19Å; S50-W53 WeakPolarHBondContact O-CB 3.27Å; S50-W53 PolarHBondContact O-N 3.15Å; F51-W53 PolarHBondContact O-N 3.16Å; W53-D60 WeakPolarHBondContact CB-OD2 3.34Å; W53-D60 HydrophobicContact CE3-CB 4.42Å; W53-D60 VanDerWaalsContact CE3-OD2 3.28Å
54	V	93.6	Very high	93.8	Very high	15 Å²	15	60 Å²	60	9%	0.091	33%	0.332	C	S	.	.	S	Bend	trans	-95.4	125.1	174.4	174.1	0	0	0	0	108.3	T24 Y34 F40 F51 D56 D66	T24-V54 HydrophobicContact CG2-CG1 4.09Å; Y34-V54 HydrophobicContact CD1-CG1 3.89Å; Y34-V54 HydrophobicContact CE1-CG1 4.18Å; F40-V54 HydrophobicContact CB-CG2 3.82Å; F40-V54 HydrophobicContact CD1-CG2 3.85Å; F40-V54 HydrophobicContact CD2-CG2 4.37Å; F40-V54 HydrophobicContact CG-CG2 3.75Å; F51-V54 HydrophobicContact CD2-CG2 4.23Å; F51-V54 HydrophobicContact CE2-CG2 4.38Å; F51-V54 WeakPolarHBondContact O-CB 3.49Å; F51-V54 PolarHBondContact O-N 3.42Å; F51-V54 VanDerWaalsContact O-N 3.13Å; V54-D56 VanDerWaalsContact C-N 3.33Å; V54-D66 CarbonylContact C-O 3.55Å; V54-D66 VanDerWaalsContact CA-O 3.31Å; V54-D66 WeakPolarHBondContact CA-O 3.08Å; V54-D66 WeakPolarHBondContact CG1-O 2.98Å
55	N	92.6	Very high	93.8	Very high	33 Å²	33	56.2 Å²	56.2	18%	0.176	31%	0.312	C	S	.	.	S	Bend	trans	57.4	43.1	-172.5	-65.7	-27.9	0	0	0	112.6	D66 E67 P68 G69 T70	N55-D66 PolarHBondContact N-O 2.96Å; N55-E67 WeakPolarHBondContact CA-OE1 3.3Å; N55-E67 PolarHBondContact N-OE1 2.85Å; N55-P68 WeakPolarHBondContact OD1-CD 3.1Å; N55-P68 WeakPolarHBondContact OD1-CG 3.41Å; N55-G69 VanDerWaalsContact OD1-CA 3.32Å; N55-G69 WeakPolarHBondContact OD1-CA 3.21Å; N55-G69 PolarHBondContact OD1-N 3.41Å; N55-T70 HydrophobicContact CB-CG2 4.02Å
56	D	93.9	Very high	93.9	Very high	65 Å²	65	53.8 Å²	53.8	35%	0.348	29%	0.287	S	S	.	.	S	Bend	trans	-99.4	11.5	179.5	82.4	-17.3	0	0	0	113.5	V54 Y58 E67	V54-D56 VanDerWaalsContact C-N 3.33Å; D56-Y58 PolarHBondContact O-N 3.43Å; D56-Y58 WeakPolarHBondContact OD1-CA 3.41Å; D56-Y58 VanDerWaalsContact OD1-CB 3.28Å; D56-Y58 WeakPolarHBondContact OD1-CB 3.36Å; D56-Y58 PolarHBondContact OD1-N 3.29Å; D56-E67 PolarHBondContact N-OE1 2.92Å; D56-E67 PolarHBondContact N-OE2 3.42Å
57	D	92.5	Very high	93.9	Very high	99 Å²	99	51.2 Å²	51.2	53%	0.529	27%	0.269	S	S	.	.	S	Bend	trans	63.9	21.3	-174.7	-69.8	-41	0	0	0	113.4	E67 T70 A72	D57-E67 WeakPolarHBondContact CA-OE2 3.39Å; D57-E67 PolarHBondContact N-OE2 3.48Å; D57-T70 WeakPolarHBondContact OD1-CB 3.44Å; D57-T70 WeakPolarHBondContact OD1-CG2 3.25Å; D57-A72 WeakPolarHBondContact O-CB 2.97Å
58	Y	95.1	Very high	93.9	Very high	146 Å²	146	47.6 Å²	47.6	57%	0.573	25%	0.25	S	S	*	.	S	Bend	trans	-127.3	141	173.8	-167.7	-95.6	0	0	0	111.2	D56 D60 E67	D56-Y58 PolarHBondContact O-N 3.43Å; D56-Y58 WeakPolarHBondContact OD1-CA 3.41Å; D56-Y58 VanDerWaalsContact OD1-CB 3.28Å; D56-Y58 WeakPolarHBondContact OD1-CB 3.36Å; D56-Y58 PolarHBondContact OD1-N 3.29Å; Y58-D60 WeakPolarHBondContact CD1-OD1 3.27Å; Y58-D60 WeakPolarHBondContact CE1-OD1 3.45Å; Y58-D60 PolarHBondContact O-N 3.38Å; Y58-E67 WeakPolarHBondContact O-CG 3.41Å
59	C	95.8	Very high	93.8	Very high	42 Å²	42	43.7 Å²	43.7	28%	0.284	23%	0.226	S	C	.	.			trans	-96.9	90.1	-178	-162.5	0	0	0	0	110.5	C73	C59-C73 WeakPolarHBondContact CA-SG 3.29Å; C59-C73 HydrophobicContact CB-CB 4.11Å; C59-C73 WeakPolarHBondContact CB-SG 2.67Å; C59-C73 WeakPolarHBondContact SG-CA 3.31Å; C59-C73 WeakPolarHBondContact SG-CB 2.92Å; C59-C73 CovalentContact SG-SG 2.04Å; C59-C73 PolarHBondContact SG-SG 2.81Å
60	D	95.7	Very high	93.8	Very high	38 Å²	38	43.3 Å²	43.3	20%	0.203	23%	0.225	C	C	.	.			trans	-84.5	-38.8	175.7	-69	-54.7	0	0	0	112.9	I49 W53 Y58 P62 D66	I49-D60 HydrophobicContact CD1-CB 4.14Å; I49-D60 HydrophobicContact CG2-CB 4.31Å; W53-D60 WeakPolarHBondContact CB-OD2 3.34Å; W53-D60 HydrophobicContact CE3-CB 4.42Å; W53-D60 VanDerWaalsContact CE3-OD2 3.28Å; Y58-D60 WeakPolarHBondContact CD1-OD1 3.27Å; Y58-D60 WeakPolarHBondContact CE1-OD1 3.45Å; Y58-D60 PolarHBondContact O-N 3.38Å; D60-P62 WeakPolarHBondContact O-CD 3.48Å; D60-D66 VanDerWaalsContact CA-OD2 3.31Å; D60-D66 WeakPolarHBondContact CA-OD2 2.99Å; D60-D66 VanDerWaalsContact CB-OD2 3.3Å; D60-D66 WeakPolarHBondContact CB-OD2 3.29Å; D60-D66 PolarHBondContact N-OD2 3Å
61	C	94.4	Very high	93.8	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.007	23%	0.231	C	C	.	.	S	Bend	trans	-82.8	127.8	179.7	-71.6	0	0	0	0	111.3	C42 D63 G64 D66	C42-C61 VanDerWaalsContact CA-SG 3.58Å; C42-C61 HydrophobicContact CB-CB 3.76Å; C42-C61 WeakPolarHBondContact CB-SG 3.37Å; C42-C61 VanDerWaalsContact SG-CA 3.57Å; C42-C61 WeakPolarHBondContact SG-CB 3.5Å; C42-C61 CovalentContact SG-SG 2.03Å; C42-C61 PolarHBondContact SG-SG 3.47Å; C61-D63 WeakPolarHBondContact CB-OD1 2.9Å; C61-D63 PolarHBondContact O-N 2.85Å; C61-G64 WeakPolarHBondContact O-CA 3.32Å; C61-G64 PolarHBondContact O-N 3.05Å; C61-D66 HydrophobicContact CB-CB 4.13Å; C61-D66 WeakPolarHBondContact CB-OD1 3.39Å; C61-D66 PolarHBondContact N-OD1 3Å; C61-D66 PolarHBondContact N-OD2 2.8Å
62	P	93	Very high	93.8	Very high	76 Å²	76	44.2 Å²	44.2	49%	0.494	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.8	172.8	-25.9	33.5	0	0	0	114.3	S46 L47 D60 G64 Q75	S46-P62 VanDerWaalsContact OG-CD 3.24Å; S46-P62 WeakPolarHBondContact OG-CD 3.39Å; L47-P62 HydrophobicContact CD1-CG 3.91Å; D60-P62 WeakPolarHBondContact O-CD 3.48Å; P62-G64 VanDerWaalsContact C-N 3.34Å; P62-Q75 PolarHBondContact O-NE2 3.48Å
63	D	93	Very high	93.9	Very high	45 Å²	45	37.9 Å²	37.9	24%	0.241	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-5.3	174.7	72.8	-13.1	0	0	0	113.8	L43 D44 C61 S65	L43-D63 WeakPolarHBondContact CA-OD2 3.36Å; L43-D63 VanDerWaalsContact CB-OD2 3.28Å; L43-D63 WeakPolarHBondContact CB-OD2 3.48Å; L43-D63 PolarHBondContact N-OD2 3.13Å; D44-D63 HydrophobicContact CB-CB 4Å; D44-D63 PolarHBondContact N-OD2 2.98Å; C61-D63 WeakPolarHBondContact CB-OD1 2.9Å; C61-D63 PolarHBondContact O-N 2.85Å; D63-S65 VanDerWaalsContact C-N 3.27Å; D63-S65 PolarHBondContact O-N 2.85Å; D63-S65 WeakPolarHBondContact OD1-CB 3.32Å; D63-S65 PolarHBondContact OD1-N 2.78Å; D63-S65 PolarHBondContact OD1-OG 2.83Å; D63-S65 WeakPolarHBondContact OD2-CB 3.44Å; D63-S65 PolarHBondContact OD2-OG 3.32Å; D63-S65 VanDerWaalsContact OD2-OG 3.09Å
64	G	93	Very high	93.9	Very high	5 Å²	5	37.7 Å²	37.7	5%	0.052	22%	0.217	C	C	.	.			trans	67.1	21.5	-177.9	0	0	0	0	0	115.1	C61 P62 D66 E67 C73	C61-G64 WeakPolarHBondContact O-CA 3.32Å; C61-G64 PolarHBondContact O-N 3.05Å; P62-G64 VanDerWaalsContact C-N 3.34Å; G64-D66 VanDerWaalsContact C-N 3.33Å; G64-D66 VanDerWaalsContact C-OD1 3.27Å; G64-E67 PolarHBondContact O-N 3.39Å; G64-C73 WeakPolarHBondContact CA-SG 3.07Å
65	S	93.7	Very high	93.8	Very high	8 Å²	8	41.9 Å²	41.9	6%	0.056	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-14.9	-176	60.2	0	0	0	0	115.1	Y34 C42 L43 D63 E67	Y34-S65 VanDerWaalsContact CE1-O 3.23Å; Y34-S65 WeakPolarHBondContact CE1-O 3.29Å; Y34-S65 VanDerWaalsContact CZ-O 3.31Å; Y34-S65 PolarHBondContact OH-O 3.05Å; C42-S65 WeakPolarHBondContact CA-OG 3.42Å; L43-S65 VanDerWaalsContact CG-CB 3.47Å; L43-S65 PolarHBondContact N-OG 3.28Å; D63-S65 VanDerWaalsContact C-N 3.27Å; D63-S65 PolarHBondContact O-N 2.85Å; D63-S65 WeakPolarHBondContact OD1-CB 3.32Å; D63-S65 PolarHBondContact OD1-N 2.78Å; D63-S65 PolarHBondContact OD1-OG 2.83Å; D63-S65 WeakPolarHBondContact OD2-CB 3.44Å; D63-S65 PolarHBondContact OD2-OG 3.32Å; D63-S65 VanDerWaalsContact OD2-OG 3.09Å; S65-E67 VanDerWaalsContact C-N 3.3Å
66	D	94.6	Very high	93.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-26.6	170.8	54.9	-29.6	0	0	0	113.2	F40 I49 V54 N55 D60 C61 G64 P68 C73	F40-D66 HydrophobicContact CE1-CB 4.32Å; I49-D66 HydrophobicContact CD1-CB 3.74Å; V54-D66 CarbonylContact C-O 3.55Å; V54-D66 VanDerWaalsContact CA-O 3.31Å; V54-D66 WeakPolarHBondContact CA-O 3.08Å; V54-D66 WeakPolarHBondContact CG1-O 2.98Å; N55-D66 PolarHBondContact N-O 2.96Å; D60-D66 VanDerWaalsContact CA-OD2 3.31Å; D60-D66 WeakPolarHBondContact CA-OD2 2.99Å; D60-D66 VanDerWaalsContact CB-OD2 3.3Å; D60-D66 WeakPolarHBondContact CB-OD2 3.29Å; D60-D66 PolarHBondContact N-OD2 3Å; C61-D66 HydrophobicContact CB-CB 4.13Å; C61-D66 WeakPolarHBondContact CB-OD1 3.39Å; C61-D66 PolarHBondContact N-OD1 3Å; C61-D66 PolarHBondContact N-OD2 2.8Å; G64-D66 VanDerWaalsContact C-N 3.33Å; G64-D66 VanDerWaalsContact C-OD1 3.27Å; D66-P68 WeakPolarHBondContact O-CD 3.46Å; D66-C73 PolarHBondContact OD1-SG 3.25Å
67	E	94.7	Very high	93.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.235	C	C	.	.			trans	-112	56.1	-174.9	-63.8	-60.1	103.5	0	0	114	N55 D56 D57 Y58 G64 S65 G69 T70 A72 C73	N55-E67 WeakPolarHBondContact CA-OE1 3.3Å; N55-E67 PolarHBondContact N-OE1 2.85Å; D56-E67 PolarHBondContact N-OE1 2.92Å; D56-E67 PolarHBondContact N-OE2 3.42Å; D57-E67 WeakPolarHBondContact CA-OE2 3.39Å; D57-E67 PolarHBondContact N-OE2 3.48Å; Y58-E67 WeakPolarHBondContact O-CG 3.41Å; G64-E67 PolarHBondContact O-N 3.39Å; S65-E67 VanDerWaalsContact C-N 3.3Å; E67-G69 PolarHBondContact O-N 3.47Å; E67-T70 WeakPolarHBondContact CB-OG1 3.39Å; E67-T70 WeakPolarHBondContact OE2-CB 3.41Å; E67-T70 VanDerWaalsContact OE2-CG2 3.23Å; E67-T70 WeakPolarHBondContact OE2-CG2 3.46Å; E67-T70 PolarHBondContact OE2-OG1 3.16Å; E67-A72 HydrophobicContact CB-CB 4.47Å; E67-A72 HydrophobicContact CG-CB 3.94Å; E67-C73 HydrophobicContact CB-CB 4.35Å
68	P	93.6	Very high	93.7	Very high	8 Å²	8	35.9 Å²	35.9	5%	0.052	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-15.4	178.4	31.4	-38.2	0	0	0	114.5	T24 V26 Y34 N55 D66 F78	T24-P68 HydrophobicContact CG2-CG 4.01Å; V26-P68 HydrophobicContact CG1-CB 3.41Å; V26-P68 VanDerWaalsContact CG1-CB 3.41Å; V26-P68 HydrophobicContact CG1-CG 3.84Å; Y34-P68 HydrophobicContact CD1-CG 4.37Å; Y34-P68 HydrophobicContact CE1-CG 3.74Å; N55-P68 WeakPolarHBondContact OD1-CD 3.1Å; N55-P68 WeakPolarHBondContact OD1-CG 3.41Å; D66-P68 WeakPolarHBondContact O-CD 3.46Å; P68-F78 VanDerWaalsContact O-CD2 3.26Å; P68-F78 WeakPolarHBondContact O-CD2 3.25Å
69	G	92.4	Very high	93.6	Very high	1 Å²	1	30 Å²	30	1%	0.01	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-1.9	-174.5	0	0	0	0	0	114.8	N55 E67 W109	N55-G69 VanDerWaalsContact OD1-CA 3.32Å; N55-G69 WeakPolarHBondContact OD1-CA 3.21Å; N55-G69 PolarHBondContact OD1-N 3.41Å; E67-G69 PolarHBondContact O-N 3.47Å; G69-W109 PolarHBondContact O-NE1 3.47Å
70	T	93.2	Very high	93.6	Very high	3 Å²	3	28 Å²	28	2%	0.018	17%	0.174	C	C	.	.	S	Bend	trans	-129	175.3	-175	81.5	0	0	0	0	111.5	N55 D57 E67 A72	N55-T70 HydrophobicContact CB-CG2 4.02Å; D57-T70 WeakPolarHBondContact OD1-CB 3.44Å; D57-T70 WeakPolarHBondContact OD1-CG2 3.25Å; E67-T70 WeakPolarHBondContact CB-OG1 3.39Å; E67-T70 WeakPolarHBondContact OE2-CB 3.41Å; E67-T70 VanDerWaalsContact OE2-CG2 3.23Å; E67-T70 WeakPolarHBondContact OE2-CG2 3.46Å; E67-T70 PolarHBondContact OE2-OG1 3.16Å; T70-A72 PolarHBondContact OG1-N 2.73Å
71	S	94.1	Very high	93.3	Very high	59 Å²	59	28.2 Å²	28.2	41%	0.413	18%	0.178	S	C	.	.	S	Bend	trans	-95.3	9.4	176.1	64.9	0	0	0	0	113.8	C73 S92	S71-C73 PolarHBondContact O-N 2.63Å; S71-S92 VanDerWaalsContact CA-O 3.31Å; S71-S92 WeakPolarHBondContact CA-O 3.28Å; S71-S92 WeakPolarHBondContact CB-O 3.24Å
72	A	95.2	Very high	93.3	Very high	31 Å²	31	28.3 Å²	28.3	26%	0.256	18%	0.179	S	C	.	.			trans	-71.5	-30.1	-166.2	0	0	0	0	0	114.3	D57 E67 T70	D57-A72 WeakPolarHBondContact O-CB 2.97Å; E67-A72 HydrophobicContact CB-CB 4.47Å; E67-A72 HydrophobicContact CG-CB 3.94Å; T70-A72 PolarHBondContact OG1-N 2.73Å
73	C	94.8	Very high	93.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.191	C	C	.	.			trans	-97.9	118.7	177.7	-68.6	0	0	0	0	112.2	C59 G64 D66 E67 S71 Q75 G76 S92	C59-C73 WeakPolarHBondContact CA-SG 3.29Å; C59-C73 HydrophobicContact CB-CB 4.11Å; C59-C73 WeakPolarHBondContact CB-SG 2.67Å; C59-C73 WeakPolarHBondContact SG-CA 3.31Å; C59-C73 WeakPolarHBondContact SG-CB 2.92Å; C59-C73 CovalentContact SG-SG 2.04Å; C59-C73 PolarHBondContact SG-SG 2.81Å; G64-C73 WeakPolarHBondContact CA-SG 3.07Å; D66-C73 PolarHBondContact OD1-SG 3.25Å; E67-C73 HydrophobicContact CB-CB 4.35Å; S71-C73 PolarHBondContact O-N 2.63Å; C73-Q75 VanDerWaalsContact C-N 3.26Å; C73-Q75 PolarHBondContact O-N 3.45Å; C73-G76 PolarHBondContact O-N 3.23Å; C73-S92 WeakPolarHBondContact O-CB 3.41Å; C73-S92 PolarHBondContact O-OG 2.67Å
74	P	92.7	Very high	93	Very high	116 Å²	116	32 Å²	32	75%	0.753	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-29.6	-178.2	-26.6	34.6	0	0	0	115.5
75	Q	91.4	Very high	93	Very high	104 Å²	104	33 Å²	33	49%	0.486	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	2.6	177.7	67.2	-79.9	14.2	0	0	113.1	P62 C73	P62-Q75 PolarHBondContact O-NE2 3.48Å; C73-Q75 VanDerWaalsContact C-N 3.26Å; C73-Q75 PolarHBondContact O-N 3.45Å
76	G	90.5	Very high	92.8	Very high	9 Å²	9	35.5 Å²	35.5	9%	0.093	24%	0.235	C	C	.	.			trans	-69.6	159.1	-178.3	0	0	0	0	0	113	C73 S92	C73-G76 PolarHBondContact O-N 3.23Å; G76-S92 WeakPolarHBondContact O-CB 3.22Å; G76-S92 PolarHBondContact O-N 3.4Å; G76-S92 PolarHBondContact O-OG 3.4Å
77	S	92.4	Very high	92.7	Very high	60 Å²	60	37.7 Å²	37.7	42%	0.42	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	129.5	173.4	72.9	0	0	0	0	110.1	I90	S77-I90 WeakPolarHBondContact CA-O 2.87Å
78	F	93.8	Very high	92.6	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.009	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.6	174.2	-177.7	-91.3	0	0	0	110	N25 P68 N89 I90 V95 S106 D107	N25-F78 HydrophobicContact CB-CD2 4.48Å; N25-F78 HydrophobicContact CB-CE1 4.47Å; N25-F78 HydrophobicContact CB-CE2 3.9Å; N25-F78 HydrophobicContact CB-CZ 3.9Å; N25-F78 WeakPolarHBondContact ND2-CZ 3.38Å; P68-F78 VanDerWaalsContact O-CD2 3.26Å; P68-F78 WeakPolarHBondContact O-CD2 3.25Å; F78-N89 CarbonylContact O-C 3.58Å; F78-N89 VanDerWaalsContact O-CA 3.28Å; F78-N89 WeakPolarHBondContact O-CA 3.33Å; F78-I90 HydrophobicContact CB-CD1 4.41Å; F78-I90 HydrophobicContact CB-CG1 3.83Å; F78-I90 HydrophobicContact CD1-CD1 3.93Å; F78-I90 HydrophobicContact CD1-CG1 4Å; F78-I90 HydrophobicContact CG-CG1 4.37Å; F78-I90 PolarHBondContact N-O 2.85Å; F78-I90 PolarHBondContact O-N 3.4Å; F78-V95 HydrophobicContact CB-CG2 3.49Å; F78-V95 VanDerWaalsContact CB-CG2 3.49Å; F78-V95 HydrophobicContact CD1-CG2 4.31Å; F78-V95 HydrophobicContact CD2-CG1 4.49Å; F78-V95 HydrophobicContact CD2-CG2 3.56Å; F78-V95 HydrophobicContact CE2-CG2 4.32Å; F78-V95 HydrophobicContact CG-CG2 3.54Å; F78-S106 VanDerWaalsContact CZ-O 3.29Å; F78-S106 WeakPolarHBondContact CZ-O 3.22Å; F78-D107 HydrophobicContact CE1-CB 4.23Å
79	H	94.6	Very high	92.6	Very high	22 Å²	22	46.3 Å²	46.3	10%	0.102	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	116.9	178.9	-176.8	64.8	0	0	0	110.8	N25 N27 P81 N89	N25-H79 WeakPolarHBondContact CB-O 3.4Å; N25-H79 WeakPolarHBondContact O-CB 3.34Å; N25-H79 PolarHBondContact O-N 2.87Å; N27-H79 PolarHBondContact N-CD2 3.26Å; H79-P81 VanDerWaalsContact O-CD 3.27Å; H79-P81 WeakPolarHBondContact O-CD 3.46Å; H79-N89 PolarHBondContact ND1-OD1 3.47Å
80	C	94.1	Very high	92.7	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	113.3	169.1	-49.1	0	0	0	0	109.4	N82 A87 M88 C102	C80-N82 VanDerWaalsContact C-N 3.3Å; C80-N82 WeakPolarHBondContact CB-OD1 3.28Å; C80-N82 PolarHBondContact O-N 3.04Å; C80-A87 WeakPolarHBondContact O-CA 2.94Å; C80-M88 HydrophobicContact CB-CG 3.99Å; C80-M88 PolarHBondContact N-O 2.98Å; C80-M88 PolarHBondContact O-N 2.6Å; C80-C102 HydrophobicContact CB-CB 3.67Å; C80-C102 WeakPolarHBondContact CB-SG 3.29Å; C80-C102 WeakPolarHBondContact SG-CB 3.12Å; C80-C102 CovalentContact SG-SG 2.03Å; C80-C102 PolarHBondContact SG-SG 2.66Å
81	P	91.1	Very high	92.8	Very high	43 Å²	43	49.4 Å²	49.4	28%	0.279	32%	0.317	S	S	.	.			trans	-64.9	-33.5	177.7	-22.3	34.9	0	0	0	113.2	N25 H79 L83 D104	N25-P81 WeakPolarHBondContact OD1-CG 3.2Å; H79-P81 VanDerWaalsContact O-CD 3.27Å; H79-P81 WeakPolarHBondContact O-CD 3.46Å; P81-L83 PolarHBondContact O-N 3.46Å; P81-D104 WeakPolarHBondContact CD-OD2 3.17Å
82	N	92.7	Very high	92.7	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.016	30%	0.298	C	S	.	.			trans	48.2	49.8	174.7	-69.3	-19.9	0	0	0	113.7	C80 G84 A85 A86 M88 C103 D104 C119	C80-N82 VanDerWaalsContact C-N 3.3Å; C80-N82 WeakPolarHBondContact CB-OD1 3.28Å; C80-N82 PolarHBondContact O-N 3.04Å; N82-G84 PolarHBondContact O-N 2.99Å; N82-A85 HydrophobicContact CB-CB 4.37Å; N82-A85 CarbonylContact O-C 3.43Å; N82-A85 WeakPolarHBondContact O-CA 3.32Å; N82-A85 PolarHBondContact O-N 3.29Å; N82-A86 VanDerWaalsContact CB-O 3.32Å; N82-A86 WeakPolarHBondContact CB-O 3.39Å; N82-A86 PolarHBondContact ND2-O 2.77Å; N82-M88 WeakPolarHBondContact ND2-CG 3.44Å; N82-C103 VanDerWaalsContact CB-SG 3.54Å; N82-C103 PolarHBondContact OD1-N 2.88Å; N82-C103 PolarHBondContact OD1-SG 3.29Å; N82-D104 WeakPolarHBondContact CA-OD2 3.19Å; N82-D104 PolarHBondContact N-OD2 2.97Å; N82-C119 VanDerWaalsContact CA-SG 3.56Å
83	L	90.9	Very high	92.7	Very high	143 Å²	143	49 Å²	49	75%	0.749	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	116.1	-179.2	-67.2	175.6	0	0	0	111	P81 C119	P81-L83 PolarHBondContact O-N 3.46Å; L83-C119 WeakPolarHBondContact O-CB 3.29Å
84	G	90.2	Very high	92.7	Very high	55 Å²	55	54 Å²	54	57%	0.567	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	105	-15.2	-175.8	0	0	0	0	0	114.6	N82 C119 G123	N82-G84 PolarHBondContact O-N 2.99Å; G84-C119 CarbonylContact C-O 3.48Å; G84-G123 WeakPolarHBondContact O-CA 3.3Å
85	A	92.4	Very high	92.8	Very high	27 Å²	27	48.6 Å²	48.6	22%	0.223	30%	0.295	C	S	.	.	S	Bend	trans	-126.2	-173.3	171.3	0	0	0	0	0	110.6	N82 C119	N82-A85 HydrophobicContact CB-CB 4.37Å; N82-A85 CarbonylContact O-C 3.43Å; N82-A85 WeakPolarHBondContact O-CA 3.32Å; N82-A85 PolarHBondContact O-N 3.29Å; A85-C119 HydrophobicContact CB-CB 4Å
86	A	89.3	Confident	93	Very high	59 Å²	59	45.4 Å²	45.4	49%	0.488	28%	0.282	S	S	.	.			trans	-73.5	134.9	173.6	0	0	0	0	0	110.4	N82	N82-A86 VanDerWaalsContact CB-O 3.32Å; N82-A86 WeakPolarHBondContact CB-O 3.39Å; N82-A86 PolarHBondContact ND2-O 2.77Å
87	A	92	Very high	93.2	Very high	46 Å²	46	47.9 Å²	47.9	38%	0.38	29%	0.293	S	S	.	.			trans	-67.7	148.3	172.3	0	0	0	0	0	109.9	C80	C80-A87 WeakPolarHBondContact O-CA 2.94Å
88	M	92.7	Very high	93.3	Very high	93 Å²	93	50.9 Å²	50.9	46%	0.458	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	165.6	178.7	65.9	176.7	41.9	0	0	111.8	C80 N82	C80-M88 HydrophobicContact CB-CG 3.99Å; C80-M88 PolarHBondContact N-O 2.98Å; C80-M88 PolarHBondContact O-N 2.6Å; N82-M88 WeakPolarHBondContact ND2-CG 3.44Å
89	N	93.5	Very high	93.4	Very high	96 Å²	96	55.7 Å²	55.7	51%	0.513	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.8	172.6	-60.3	-27.7	0	0	0	109.1	F78 H79	F78-N89 CarbonylContact O-C 3.58Å; F78-N89 VanDerWaalsContact O-CA 3.28Å; F78-N89 WeakPolarHBondContact O-CA 3.33Å; H79-N89 PolarHBondContact ND1-OD1 3.47Å
90	I	94.1	Very high	93.4	Very high	9 Å²	9	57.6 Å²	57.6	5%	0.046	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	154.4	171.8	64.1	178.1	0	0	0	109.2	S77 F78 R94 D101 D107	S77-I90 WeakPolarHBondContact CA-O 2.87Å; F78-I90 HydrophobicContact CB-CD1 4.41Å; F78-I90 HydrophobicContact CB-CG1 3.83Å; F78-I90 HydrophobicContact CD1-CD1 3.93Å; F78-I90 HydrophobicContact CD1-CG1 4Å; F78-I90 HydrophobicContact CG-CG1 4.37Å; F78-I90 PolarHBondContact N-O 2.85Å; F78-I90 PolarHBondContact O-N 3.4Å; I90-R94 HydrophobicContact CD1-CB 4.09Å; I90-D101 HydrophobicContact CD1-CB 3.99Å; I90-D101 HydrophobicContact CG2-CB 4.31Å; I90-D107 HydrophobicContact CD1-CB 3.79Å
91	P	95.4	Very high	93.5	Very high	61 Å²	61	59.6 Å²	59.6	40%	0.396	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	140.6	169.7	-21.7	33.5	0	0	0	110.6	S93 R94	P91-S93 PolarHBondContact O-N 2.63Å; P91-S93 VanDerWaalsContact O-N 3.08Å; P91-R94 PolarHBondContact O-N 3.49Å
92	S	93.9	Very high	93.7	Very high	3 Å²	3	57.8 Å²	57.8	2%	0.021	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-53.9	-28.6	176.5	55.6	0	0	0	0	113.1	S71 C73 G76 R94 V95	S71-S92 VanDerWaalsContact CA-O 3.31Å; S71-S92 WeakPolarHBondContact CA-O 3.28Å; S71-S92 WeakPolarHBondContact CB-O 3.24Å; C73-S92 WeakPolarHBondContact O-CB 3.41Å; C73-S92 PolarHBondContact O-OG 2.67Å; G76-S92 WeakPolarHBondContact O-CB 3.22Å; G76-S92 PolarHBondContact O-N 3.4Å; G76-S92 PolarHBondContact O-OG 3.4Å; S92-R94 PolarHBondContact O-N 3.1Å; S92-V95 WeakPolarHBondContact O-CB 3.36Å; S92-V95 PolarHBondContact O-N 3.36Å
93	S	94.5	Very high	93.8	Very high	78 Å²	78	58.5 Å²	58.5	55%	0.545	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-60.8	-12	176.1	69.6	0	0	0	0	114.8	P91	P91-S93 PolarHBondContact O-N 2.63Å; P91-S93 VanDerWaalsContact O-N 3.08Å
94	R	95.3	Very high	94	Very high	105 Å²	105	53 Å²	53	40%	0.396	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-101.9	8.1	177.6	-57.7	-161.4	-169.1	174.6	-0.7	113.4	I90 P91 S92 D101	I90-R94 HydrophobicContact CD1-CB 4.09Å; P91-R94 PolarHBondContact O-N 3.49Å; S92-R94 PolarHBondContact O-N 3.1Å; R94-D101 VanDerWaalsContact CD-OD1 3.26Å; R94-D101 WeakPolarHBondContact CD-OD1 3.4Å; R94-D101 VanDerWaalsContact CD-OD2 3.29Å; R94-D101 WeakPolarHBondContact CD-OD2 3.31Å; R94-D101 IonicContact CZ-OD1 3.67Å; R94-D101 IonicContact NE-OD1 3.87Å; R94-D101 IonicContact NH1-OD1 2.77Å; R94-D101 PolarHBondContact NH1-OD1 2.92Å
95	V	95	Very high	94.2	Very high	3 Å²	3	51 Å²	51	2%	0.018	30%	0.296	C	S	.	.	S	Bend	trans	-86.9	125.4	174.1	179	0	0	0	0	108.1	F78 S92 D97	F78-V95 HydrophobicContact CB-CG2 3.49Å; F78-V95 VanDerWaalsContact CB-CG2 3.49Å; F78-V95 HydrophobicContact CD1-CG2 4.31Å; F78-V95 HydrophobicContact CD2-CG1 4.49Å; F78-V95 HydrophobicContact CD2-CG2 3.56Å; F78-V95 HydrophobicContact CE2-CG2 4.32Å; F78-V95 HydrophobicContact CG-CG2 3.54Å; S92-V95 WeakPolarHBondContact O-CB 3.36Å; S92-V95 PolarHBondContact O-N 3.36Å; V95-D97 VanDerWaalsContact C-N 3.29Å; V95-D97 PolarHBondContact O-N 3.45Å
96	N	93.6	Very high	94.3	Very high	37 Å²	37	51 Å²	51	20%	0.198	29%	0.294	C	S	.	.	S	Bend	trans	55.1	37.2	-178.1	-60.2	-50	0	0	0	114.5	M98 D107 E108 W109 A110	N96-M98 VanDerWaalsContact C-N 3.33Å; N96-D107 PolarHBondContact N-O 2.8Å; N96-D107 PolarHBondContact OD1-O 2.9Å; N96-E108 VanDerWaalsContact C-OE1 3.26Å; N96-E108 WeakPolarHBondContact CA-OE1 3.4Å; N96-E108 PolarHBondContact N-OE1 3.41Å; N96-E108 VanDerWaalsContact N-OE1 3.1Å; N96-W109 WeakPolarHBondContact ND2-CZ2 2.86Å; N96-W109 PolarHBondContact ND2-NE1 2.89Å; N96-W109 PolarHBondContact OD1-N 3.09Å; N96-W109 VanDerWaalsContact OD1-N 3.16Å; N96-A110 HydrophobicContact CB-CB 4.14Å; N96-A110 VanDerWaalsContact CG-CB 3.46Å; N96-A110 WeakPolarHBondContact OD1-CB 3.44Å; N96-A110 PolarHBondContact OD1-N 3.5Å
97	D	95.3	Very high	94.5	Very high	60 Å²	60	48.1 Å²	48.1	32%	0.321	27%	0.271	S	S	.	.	S	Bend	trans	-93	7.4	175.7	80.2	-4.1	0	0	0	113.1	V95 I99 E108	V95-D97 VanDerWaalsContact C-N 3.29Å; V95-D97 PolarHBondContact O-N 3.45Å; D97-I99 VanDerWaalsContact C-N 3.26Å; D97-I99 PolarHBondContact O-N 2.97Å; D97-I99 WeakPolarHBondContact OD1-CA 3.19Å; D97-I99 VanDerWaalsContact OD1-CB 3.23Å; D97-I99 WeakPolarHBondContact OD1-CB 2.91Å; D97-I99 PolarHBondContact OD1-N 3.39Å; D97-E108 PolarHBondContact N-OE1 3.48Å
98	M	94.9	Very high	94.7	Very high	124 Å²	124	46.3 Å²	46.3	61%	0.611	25%	0.254	S	S	*	.	S	Bend	trans	71.6	11.4	-177.4	-47.9	-178.5	-179.5	0	0	114.5	N96 E108 H112	N96-M98 VanDerWaalsContact C-N 3.33Å; M98-E108 VanDerWaalsContact CA-OE2 3.28Å; M98-E108 WeakPolarHBondContact CA-OE2 3.34Å; M98-E108 PolarHBondContact N-OE1 2.86Å; M98-E108 VanDerWaalsContact N-OE1 3.15Å; M98-E108 PolarHBondContact N-OE2 3.12Å; M98-E108 VanDerWaalsContact N-OE2 3.1Å; M98-H112 HydrophobicContact CE-CB 4.22Å; M98-H112 HydrophobicContact CG-CB 4.36Å
99	I	96	Very high	94.6	Very high	102 Å²	102	47 Å²	47	52%	0.523	25%	0.252	S	S	.	.	S	Bend	trans	-113.8	131	175.4	-55.3	177	0	0	0	108.2	D97 D101	D97-I99 VanDerWaalsContact C-N 3.26Å; D97-I99 PolarHBondContact O-N 2.97Å; D97-I99 WeakPolarHBondContact OD1-CA 3.19Å; D97-I99 VanDerWaalsContact OD1-CB 3.23Å; D97-I99 WeakPolarHBondContact OD1-CB 2.91Å; D97-I99 PolarHBondContact OD1-N 3.39Å; I99-D101 PolarHBondContact O-N 3.22Å
100	C	95.1	Very high	94.5	Very high	62 Å²	62	44.3 Å²	44.3	42%	0.419	24%	0.243	S	C	.	.			trans	-81.7	97.5	177.6	-51.6	0	0	0	0	110.2	C115	C100-C115 HydrophobicContact CB-CB 3.85Å; C100-C115 WeakPolarHBondContact CB-SG 2.91Å; C100-C115 WeakPolarHBondContact SG-CA 3.24Å; C100-C115 WeakPolarHBondContact SG-CB 3.35Å; C100-C115 CovalentContact SG-SG 2.03Å; C100-C115 PolarHBondContact SG-SG 3.48Å
101	D	95.8	Very high	94.2	Very high	43 Å²	43	46.4 Å²	46.4	23%	0.23	27%	0.267	C	S	.	.			trans	-91.6	-35.6	177.1	-80.9	-82.1	0	0	0	113	I90 R94 I99 D107	I90-D101 HydrophobicContact CD1-CB 3.99Å; I90-D101 HydrophobicContact CG2-CB 4.31Å; R94-D101 VanDerWaalsContact CD-OD1 3.26Å; R94-D101 WeakPolarHBondContact CD-OD1 3.4Å; R94-D101 VanDerWaalsContact CD-OD2 3.29Å; R94-D101 WeakPolarHBondContact CD-OD2 3.31Å; R94-D101 IonicContact CZ-OD1 3.67Å; R94-D101 IonicContact NE-OD1 3.87Å; R94-D101 IonicContact NH1-OD1 2.77Å; R94-D101 PolarHBondContact NH1-OD1 2.92Å; I99-D101 PolarHBondContact O-N 3.22Å; D101-D107 WeakPolarHBondContact CA-OD2 3.39Å; D101-D107 WeakPolarHBondContact CB-OD2 3.46Å; D101-D107 PolarHBondContact N-OD2 2.89Å
102	C	95.2	Very high	94	Very high	4 Å²	4	49.9 Å²	49.9	3%	0.027	28%	0.278	C	S	.	.	S	Bend	trans	-83.4	138.2	172.3	-59.5	0	0	0	0	110.6	C80 D104 G105 D107	C80-C102 HydrophobicContact CB-CB 3.67Å; C80-C102 WeakPolarHBondContact CB-SG 3.29Å; C80-C102 WeakPolarHBondContact SG-CB 3.12Å; C80-C102 CovalentContact SG-SG 2.03Å; C80-C102 PolarHBondContact SG-SG 2.66Å; C102-D104 WeakPolarHBondContact CB-OD1 3.37Å; C102-D104 PolarHBondContact O-N 3.05Å; C102-G105 PolarHBondContact O-N 2.89Å; C102-D107 HydrophobicContact CB-CB 4.42Å; C102-D107 WeakPolarHBondContact CB-OD1 3.14Å; C102-D107 PolarHBondContact N-OD1 3.24Å; C102-D107 PolarHBondContact N-OD2 2.75Å
103	C	95.1	Very high	94	Very high	18 Å²	18	52 Å²	52	12%	0.122	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.3	177	65.9	0	0	0	0	112.9	N82 N117 L118 C119 L122	N82-C103 VanDerWaalsContact CB-SG 3.54Å; N82-C103 PolarHBondContact OD1-N 2.88Å; N82-C103 PolarHBondContact OD1-SG 3.29Å; C103-N117 CarbonylContact O-C 3.55Å; C103-N117 WeakPolarHBondContact O-CA 3.12Å; C103-L118 PolarHBondContact O-N 2.77Å; C103-C119 HydrophobicContact CB-CB 4.2Å; C103-C119 WeakPolarHBondContact CB-SG 3.03Å; C103-C119 PolarHBondContact O-SG 3.27Å; C103-C119 WeakPolarHBondContact SG-CA 3.36Å; C103-C119 WeakPolarHBondContact SG-CB 3.49Å; C103-C119 CovalentContact SG-SG 2.05Å; C103-C119 PolarHBondContact SG-SG 3Å; C103-L122 HydrophobicContact CB-CD2 3.99Å
104	D	94.5	Very high	94	Very high	29 Å²	29	57.7 Å²	57.7	16%	0.155	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-6.3	176.7	59.3	16.2	0	0	0	112.9	P81 N82 C102 S106 C119	P81-D104 WeakPolarHBondContact CD-OD2 3.17Å; N82-D104 WeakPolarHBondContact CA-OD2 3.19Å; N82-D104 PolarHBondContact N-OD2 2.97Å; C102-D104 WeakPolarHBondContact CB-OD1 3.37Å; C102-D104 PolarHBondContact O-N 3.05Å; D104-S106 PolarHBondContact O-N 2.51Å; D104-S106 WeakPolarHBondContact OD1-CB 3.48Å; D104-S106 PolarHBondContact OD1-N 2.98Å; D104-S106 PolarHBondContact OD1-OG 3.37Å; D104-C119 PolarHBondContact N-SG 3.21Å
105	G	94.4	Very high	93.9	Very high	13 Å²	13	54 Å²	54	13%	0.134	30%	0.295	C	S	.	.			trans	69.5	17.2	-177.8	0	0	0	0	0	114.4	C102 D107 E108 C115	C102-G105 PolarHBondContact O-N 2.89Å; G105-D107 WeakPolarHBondContact CA-OD1 3.23Å; G105-D107 PolarHBondContact O-N 3.27Å; G105-E108 PolarHBondContact O-N 3.44Å; G105-C115 VanDerWaalsContact CA-CB 3.49Å
106	S	93.9	Very high	93.8	Very high	25 Å²	25	57.8 Å²	57.8	18%	0.175	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-18	-175.8	57.8	0	0	0	0	114.6	F78 D104	F78-S106 VanDerWaalsContact CZ-O 3.29Å; F78-S106 WeakPolarHBondContact CZ-O 3.22Å; D104-S106 PolarHBondContact O-N 2.51Å; D104-S106 WeakPolarHBondContact OD1-CB 3.48Å; D104-S106 PolarHBondContact OD1-N 2.98Å; D104-S106 PolarHBondContact OD1-OG 3.37Å
107	D	94.8	Very high	93.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-30.2	173.9	52.3	-39.1	0	0	0	113.7	F78 I90 N96 D101 C102 G105 W109	F78-D107 HydrophobicContact CE1-CB 4.23Å; I90-D107 HydrophobicContact CD1-CB 3.79Å; N96-D107 PolarHBondContact N-O 2.8Å; N96-D107 PolarHBondContact OD1-O 2.9Å; D101-D107 WeakPolarHBondContact CA-OD2 3.39Å; D101-D107 WeakPolarHBondContact CB-OD2 3.46Å; D101-D107 PolarHBondContact N-OD2 2.89Å; C102-D107 HydrophobicContact CB-CB 4.42Å; C102-D107 WeakPolarHBondContact CB-OD1 3.14Å; C102-D107 PolarHBondContact N-OD1 3.24Å; C102-D107 PolarHBondContact N-OD2 2.75Å; G105-D107 WeakPolarHBondContact CA-OD1 3.23Å; G105-D107 PolarHBondContact O-N 3.27Å; D107-W109 PolarHBondContact O-N 3.37Å
108	E	94.9	Very high	93.9	Very high	7 Å²	7	62.1 Å²	62.1	3%	0.033	34%	0.343	C	S	.	.			trans	-102.9	44.6	-175.9	-67.9	-62	132.1	0	0	112.6	N96 D97 M98 G105 A110 G111 V113 C115	N96-E108 VanDerWaalsContact C-OE1 3.26Å; N96-E108 WeakPolarHBondContact CA-OE1 3.4Å; N96-E108 PolarHBondContact N-OE1 3.41Å; N96-E108 VanDerWaalsContact N-OE1 3.1Å; D97-E108 PolarHBondContact N-OE1 3.48Å; M98-E108 VanDerWaalsContact CA-OE2 3.28Å; M98-E108 WeakPolarHBondContact CA-OE2 3.34Å; M98-E108 PolarHBondContact N-OE1 2.86Å; M98-E108 VanDerWaalsContact N-OE1 3.15Å; M98-E108 PolarHBondContact N-OE2 3.12Å; M98-E108 VanDerWaalsContact N-OE2 3.1Å; G105-E108 PolarHBondContact O-N 3.44Å; E108-A110 VanDerWaalsContact C-N 3.28Å; E108-A110 PolarHBondContact O-N 3.16Å; E108-G111 PolarHBondContact O-N 2.77Å; E108-V113 HydrophobicContact CB-CG1 3.71Å; E108-V113 HydrophobicContact CG-CG1 3.57Å; E108-V113 WeakPolarHBondContact OE2-CG1 3.39Å; E108-C115 VanDerWaalsContact CG-SG 3.56Å
109	W	90.9	Very high	93.9	Very high	107 Å²	107	56.2 Å²	56.2	41%	0.405	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-20.1	-175	59.4	-100.1	0	0	0	114	C22 G69 N96 D107 G111	C22-W109 VanDerWaalsContact SG-CD2 3.51Å; G69-W109 PolarHBondContact O-NE1 3.47Å; N96-W109 WeakPolarHBondContact ND2-CZ2 2.86Å; N96-W109 PolarHBondContact ND2-NE1 2.89Å; N96-W109 PolarHBondContact OD1-N 3.09Å; N96-W109 VanDerWaalsContact OD1-N 3.16Å; D107-W109 PolarHBondContact O-N 3.37Å; W109-G111 PolarHBondContact O-N 2.77Å
110	A	91.4	Very high	93.8	Very high	40 Å²	40	57.1 Å²	57.1	33%	0.331	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-14.9	175.4	0	0	0	0	0	112.7	N96 E108 H112	N96-A110 HydrophobicContact CB-CB 4.14Å; N96-A110 VanDerWaalsContact CG-CB 3.46Å; N96-A110 WeakPolarHBondContact OD1-CB 3.44Å; N96-A110 PolarHBondContact OD1-N 3.5Å; E108-A110 VanDerWaalsContact C-N 3.28Å; E108-A110 PolarHBondContact O-N 3.16Å; A110-H112 VanDerWaalsContact C-N 3.33Å; A110-H112 PolarHBondContact O-N 2.71Å
111	G	88.5	Confident	93.8	Very high	53 Å²	53	61 Å²	61	55%	0.546	33%	0.327	S	S	.	.	S	Bend	trans	75.9	16	171.7	0	0	0	0	0	114.9	E108 W109 V113	E108-G111 PolarHBondContact O-N 2.77Å; W109-G111 PolarHBondContact O-N 2.77Å; G111-V113 VanDerWaalsContact C-N 3.31Å
112	H	90.9	Very high	93.7	Very high	135 Å²	135	61.5 Å²	61.5	63%	0.625	33%	0.33	S	S	*	.	S	Bend	trans	-67.2	-33.3	172.4	-65.4	-51.1	0	0	0	112.2	M98 A110	M98-H112 HydrophobicContact CE-CB 4.22Å; M98-H112 HydrophobicContact CG-CB 4.36Å; A110-H112 VanDerWaalsContact C-N 3.33Å; A110-H112 PolarHBondContact O-N 2.71Å
113	V	93.4	Very high	93.6	Very high	47 Å²	47	61.9 Å²	61.9	29%	0.285	34%	0.335	S	S	.	.	S	Bend	trans	-122.9	152	170.1	67.3	0	0	0	0	109.2	E108 G111	E108-V113 HydrophobicContact CB-CG1 3.71Å; E108-V113 HydrophobicContact CG-CG1 3.57Å; E108-V113 WeakPolarHBondContact OE2-CG1 3.39Å; G111-V113 VanDerWaalsContact C-N 3.31Å
114	K	94.1	Very high	93.6	Very high	197 Å²	197	69.1 Å²	69.1	86%	0.857	36%	0.36	S	S	*	.			trans	-101.7	99.3	174.3	-71.5	-175.8	-179.4	179.8	0	109.5	P116	K114-P116 WeakPolarHBondContact O-CD 3.44Å
115	C	94.1	Very high	93.6	Very high	28 Å²	28	74.7 Å²	74.7	19%	0.189	38%	0.379	C	S	.	.			trans	-81.8	119.8	174.5	-63.7	0	0	0	0	110.7	C100 G105 E108	C100-C115 HydrophobicContact CB-CB 3.85Å; C100-C115 WeakPolarHBondContact CB-SG 2.91Å; C100-C115 WeakPolarHBondContact SG-CA 3.24Å; C100-C115 WeakPolarHBondContact SG-CB 3.35Å; C100-C115 CovalentContact SG-SG 2.03Å; C100-C115 PolarHBondContact SG-SG 3.48Å; G105-C115 VanDerWaalsContact CA-CB 3.49Å; E108-C115 VanDerWaalsContact CG-SG 3.56Å
116	P	94	Very high	93.5	Very high	83 Å²	83	77.9 Å²	77.9	54%	0.539	39%	0.392	S	S	.	.			trans	-72.3	143.4	172.3	30.3	-32.7	0	0	0	110.2	K114 L118	K114-P116 WeakPolarHBondContact O-CD 3.44Å; P116-L118 HydrophobicContact CB-CD2 4.39Å; P116-L118 HydrophobicContact CG-CD1 4.46Å; P116-L118 HydrophobicContact CG-CD2 4.28Å; P116-L118 HydrophobicContact CG-CG 4.24Å; P116-L118 PolarHBondContact O-N 3.47Å
117	N	94.2	Very high	93.4	Very high	97 Å²	97	82.9 Å²	82.9	52%	0.519	41%	0.411	S	S	.	.			trans	-76.3	109.9	171.5	-173.5	-31.3	0	0	0	109.9	C103 C119	C103-N117 CarbonylContact O-C 3.55Å; C103-N117 WeakPolarHBondContact O-CA 3.12Å; N117-C119 WeakPolarHBondContact OD1-CB 3.35Å; N117-C119 PolarHBondContact OD1-N 3.18Å
118	L	95	Very high	93.4	Very high	91 Å²	91	84.8 Å²	84.8	48%	0.476	43%	0.426	S	S	.	.			trans	-105.3	4.1	-179.2	-60.1	177.3	0	0	0	112.8	C103 P116 E120 E121 L122	C103-L118 PolarHBondContact O-N 2.77Å; P116-L118 HydrophobicContact CB-CD2 4.39Å; P116-L118 HydrophobicContact CG-CD1 4.46Å; P116-L118 HydrophobicContact CG-CD2 4.28Å; P116-L118 HydrophobicContact CG-CG 4.24Å; P116-L118 PolarHBondContact O-N 3.47Å; L118-E120 PolarHBondContact O-N 3.08Å; L118-E121 PolarHBondContact O-N 2.75Å; L118-L122 WeakPolarHBondContact O-CB 3.33Å; L118-L122 PolarHBondContact O-N 2.83Å
119	C	96	Very high	93.3	Very high	0 Å²	0	88.9 Å²	88.9	0%	0	45%	0.445	C	S	.	.	H	α-helix	trans	-63.5	-37.7	-171.5	-64.4	0	0	0	0	113.4	N82 L83 G84 A85 C103 D104 N117 G123	N82-C119 VanDerWaalsContact CA-SG 3.56Å; L83-C119 WeakPolarHBondContact O-CB 3.29Å; G84-C119 CarbonylContact C-O 3.48Å; A85-C119 HydrophobicContact CB-CB 4Å; C103-C119 HydrophobicContact CB-CB 4.2Å; C103-C119 WeakPolarHBondContact CB-SG 3.03Å; C103-C119 PolarHBondContact O-SG 3.27Å; C103-C119 WeakPolarHBondContact SG-CA 3.36Å; C103-C119 WeakPolarHBondContact SG-CB 3.49Å; C103-C119 CovalentContact SG-SG 2.05Å; C103-C119 PolarHBondContact SG-SG 3Å; D104-C119 PolarHBondContact N-SG 3.21Å; N117-C119 WeakPolarHBondContact OD1-CB 3.35Å; N117-C119 PolarHBondContact OD1-N 3.18Å; C119-G123 PolarHBondContact O-N 3.44Å
120	E	94.2	Very high	93.3	Very high	120 Å²	120	91.6 Å²	91.6	56%	0.561	46%	0.455	S	S	*	.	H	α-helix	trans	-63.3	-44.2	177.2	-74.4	-162.9	-172.1	0	0	112.3	L118 R124	L118-E120 PolarHBondContact O-N 3.08Å; E120-R124 WeakPolarHBondContact O-CB 3.5Å; E120-R124 WeakPolarHBondContact O-CG 3.45Å; E120-R124 PolarHBondContact O-N 3.41Å; E120-R124 IonicContact OE2-CZ 3.8Å; E120-R124 IonicContact OE2-NH2 3.55Å; E120-R124 PolarHBondContact OE2-NH2 3.38Å
121	E	94.5	Very high	93.4	Very high	143 Å²	143	95 Å²	95	67%	0.668	47%	0.465	S	S	*	.	H	α-helix	trans	-67.7	-46.9	179.7	-175.7	178.8	171.3	0	0	110.6	L118 G123 R124 R125	L118-E121 PolarHBondContact O-N 2.75Å; E121-G123 PolarHBondContact O-N 2.84Å; E121-R124 PolarHBondContact O-N 2.97Å; E121-R125 PolarHBondContact O-N 3.47Å
122	L	93.1	Very high	93.6	Very high	54 Å²	54	99 Å²	99	28%	0.283	47%	0.469	S	S	.	.	H	α-helix	trans	-59.8	-46.7	177.3	-179	61.4	0	0	0	111.5	C103 L118 R125 L126	C103-L122 HydrophobicContact CB-CD2 3.99Å; L118-L122 WeakPolarHBondContact O-CB 3.33Å; L118-L122 PolarHBondContact O-N 2.83Å; L122-R125 PolarHBondContact O-N 3.01Å; L122-L126 HydrophobicContact CD1-CD1 4.12Å; L122-L126 HydrophobicContact CD1-CG 4.21Å; L122-L126 HydrophobicContact CG-CD1 4Å; L122-L126 HydrophobicContact CG-CG 4.47Å; L122-L126 WeakPolarHBondContact O-CG 3.39Å; L122-L126 PolarHBondContact O-N 3.28Å
123	G	93.8	Very high	93.5	Very high	13 Å²	13	98.4 Å²	98.4	13%	0.134	47%	0.465	C	S	.	.	H	α-helix	trans	-63	-41.5	178	0	0	0	0	0	112.9	G84 C119 E121 K127	G84-G123 WeakPolarHBondContact O-CA 3.3Å; C119-G123 PolarHBondContact O-N 3.44Å; E121-G123 PolarHBondContact O-N 2.84Å; G123-K127 WeakPolarHBondContact O-CB 3.33Å; G123-K127 PolarHBondContact O-N 3.3Å
124	R	95.3	Very high	93.4	Very high	170 Å²	170	98.2 Å²	98.2	64%	0.642	46%	0.464	S	S	*	.	H	α-helix	trans	-61.2	-43.7	173.1	-73.8	176.3	-149.1	-179.4	7.9	111.5	E120 E121 A128	E120-R124 WeakPolarHBondContact O-CB 3.5Å; E120-R124 WeakPolarHBondContact O-CG 3.45Å; E120-R124 PolarHBondContact O-N 3.41Å; E120-R124 IonicContact OE2-CZ 3.8Å; E120-R124 IonicContact OE2-NH2 3.55Å; E120-R124 PolarHBondContact OE2-NH2 3.38Å; E121-R124 PolarHBondContact O-N 2.97Å; R124-A128 WeakPolarHBondContact O-CB 3.17Å; R124-A128 PolarHBondContact O-N 2.87Å
125	R	94.8	Very high	93.4	Very high	146 Å²	146	91.4 Å²	91.4	55%	0.551	44%	0.444	S	S	*	.	H	α-helix	trans	-63.3	-52.1	178.5	-174	-179.4	69.5	-179.9	0.3	111.6	E121 L122 K127 A128 E129	E121-R125 PolarHBondContact O-N 3.47Å; L122-R125 PolarHBondContact O-N 3.01Å; R125-K127 VanDerWaalsContact C-N 3.29Å; R125-K127 PolarHBondContact O-N 3.45Å; R125-A128 PolarHBondContact O-N 2.89Å; R125-A128 VanDerWaalsContact O-N 3.17Å; R125-E129 HydrophobicContact CG-CG 4.47Å; R125-E129 WeakPolarHBondContact CG-OE1 3.24Å; R125-E129 IonicContact NE-OE1 2.78Å; R125-E129 WeakPolarHBondContact O-CG 3.25Å; R125-E129 PolarHBondContact O-N 2.76Å
126	L	91.2	Very high	93.3	Very high	79 Å²	79	93.1 Å²	93.1	41%	0.414	45%	0.451	S	S	.	.	H	α-helix	trans	-61.5	-38.4	179.5	-69.1	174.3	0	0	0	112	L122 R130	L122-L126 HydrophobicContact CD1-CD1 4.12Å; L122-L126 HydrophobicContact CD1-CG 4.21Å; L122-L126 HydrophobicContact CG-CD1 4Å; L122-L126 HydrophobicContact CG-CG 4.47Å; L122-L126 WeakPolarHBondContact O-CG 3.39Å; L122-L126 PolarHBondContact O-N 3.28Å; L126-R130 VanDerWaalsContact O-CB 3.32Å; L126-R130 WeakPolarHBondContact O-CB 3.49Å; L126-R130 PolarHBondContact O-N 3.48Å
127	K	92	Very high	93.2	Very high	131 Å²	131	90 Å²	90	57%	0.57	43%	0.429	S	S	*	.	H	α-helix	trans	-64.1	-46.8	174.2	-178.5	175.1	173	178.9	0	111.5	G123 R125 R130 E131	G123-K127 WeakPolarHBondContact O-CB 3.33Å; G123-K127 PolarHBondContact O-N 3.3Å; R125-K127 VanDerWaalsContact C-N 3.29Å; R125-K127 PolarHBondContact O-N 3.45Å; K127-R130 PolarHBondContact O-N 2.95Å; K127-E131 WeakPolarHBondContact CE-OE1 3.39Å; K127-E131 HydrophobicContact CG-CG 4.44Å; K127-E131 IonicContact NZ-OE1 3.88Å; K127-E131 WeakPolarHBondContact O-CB 3.34Å; K127-E131 VanDerWaalsContact O-CG 3.31Å; K127-E131 WeakPolarHBondContact O-CG 3.4Å; K127-E131 PolarHBondContact O-N 2.92Å
128	A	95.4	Very high	93.2	Very high	39 Å²	39	93 Å²	93	32%	0.322	43%	0.433	S	S	.	.	H	α-helix	trans	-62.1	-43	177.4	0	0	0	0	0	111.9	R124 R125 E131 Q132	R124-A128 WeakPolarHBondContact O-CB 3.17Å; R124-A128 PolarHBondContact O-N 2.87Å; R125-A128 PolarHBondContact O-N 2.89Å; R125-A128 VanDerWaalsContact O-N 3.17Å; A128-E131 PolarHBondContact O-N 3.17Å; A128-Q132 WeakPolarHBondContact O-CB 3.4Å; A128-Q132 VanDerWaalsContact O-CG 3.27Å; A128-Q132 WeakPolarHBondContact O-CG 3.38Å; A128-Q132 PolarHBondContact O-N 3.45Å
129	E	93.1	Very high	93.2	Very high	94 Å²	94	94 Å²	94	44%	0.439	44%	0.435	S	S	.	.	H	α-helix	trans	-61.8	-43.3	174.9	-73.1	171	-176.9	0	0	111.7	R125 Q132 K133	R125-E129 HydrophobicContact CG-CG 4.47Å; R125-E129 WeakPolarHBondContact CG-OE1 3.24Å; R125-E129 IonicContact NE-OE1 2.78Å; R125-E129 WeakPolarHBondContact O-CG 3.25Å; R125-E129 PolarHBondContact O-N 2.76Å; E129-Q132 PolarHBondContact O-N 3.08Å; E129-K133 WeakPolarHBondContact O-CB 2.61Å; E129-K133 PolarHBondContact O-N 3.49Å
130	R	90.8	Very high	93.2	Very high	163 Å²	163	94 Å²	94	62%	0.615	44%	0.435	S	S	*	.	H	α-helix	trans	-63.9	-44.5	175.5	-175.4	176.4	-178.4	171.3	2.3	111.8	L126 K127 Q132 K133 V134	L126-R130 VanDerWaalsContact O-CB 3.32Å; L126-R130 WeakPolarHBondContact O-CB 3.49Å; L126-R130 PolarHBondContact O-N 3.48Å; K127-R130 PolarHBondContact O-N 2.95Å; R130-Q132 VanDerWaalsContact C-N 3.33Å; R130-Q132 PolarHBondContact O-N 3.25Å; R130-K133 PolarHBondContact O-N 3.33Å; R130-V134 HydrophobicContact CG-CG2 4.48Å; R130-V134 WeakPolarHBondContact O-CB 3.47Å; R130-V134 VanDerWaalsContact O-CG2 3.27Å; R130-V134 WeakPolarHBondContact O-CG2 3.48Å; R130-V134 PolarHBondContact O-N 3.01Å
131	E	92.7	Very high	93.3	Very high	112 Å²	112	90.8 Å²	90.8	52%	0.523	42%	0.419	S	S	.	.	H	α-helix	trans	-62.1	-40.7	176.8	-75.6	174.3	178.8	0	0	111.4	K127 A128 V134 A135	K127-E131 WeakPolarHBondContact CE-OE1 3.39Å; K127-E131 HydrophobicContact CG-CG 4.44Å; K127-E131 IonicContact NZ-OE1 3.88Å; K127-E131 WeakPolarHBondContact O-CB 3.34Å; K127-E131 VanDerWaalsContact O-CG 3.31Å; K127-E131 WeakPolarHBondContact O-CG 3.4Å; K127-E131 PolarHBondContact O-N 2.92Å; A128-E131 PolarHBondContact O-N 3.17Å; E131-V134 PolarHBondContact O-N 2.98Å; E131-A135 VanDerWaalsContact O-CB 3.29Å; E131-A135 WeakPolarHBondContact O-CB 3.41Å; E131-A135 PolarHBondContact O-N 3.23Å
132	Q	92.7	Very high	93.3	Very high	138 Å²	138	86.3 Å²	86.3	65%	0.645	41%	0.406	S	S	*	.	H	α-helix	trans	-63.4	-47.6	173.4	-74	175.8	6.9	0	0	112.1	A128 E129 R130 V134 A135 L136	A128-Q132 WeakPolarHBondContact O-CB 3.4Å; A128-Q132 VanDerWaalsContact O-CG 3.27Å; A128-Q132 WeakPolarHBondContact O-CG 3.38Å; A128-Q132 PolarHBondContact O-N 3.45Å; E129-Q132 PolarHBondContact O-N 3.08Å; R130-Q132 VanDerWaalsContact C-N 3.33Å; R130-Q132 PolarHBondContact O-N 3.25Å; Q132-V134 VanDerWaalsContact C-N 3.32Å; Q132-V134 PolarHBondContact O-N 2.69Å; Q132-A135 PolarHBondContact O-N 2.82Å; Q132-L136 WeakPolarHBondContact O-CB 3.28Å; Q132-L136 PolarHBondContact O-N 3.3Å
133	K	89.8	Confident	93.5	Very high	121 Å²	121	86 Å²	86	53%	0.526	41%	0.407	S	S	.	.	H	α-helix	trans	-59.2	-43	176.8	-170.8	-179.3	179.9	-174	0	111.1	E129 R130 H137 E399	E129-K133 WeakPolarHBondContact O-CB 2.61Å; E129-K133 PolarHBondContact O-N 3.49Å; R130-K133 PolarHBondContact O-N 3.33Å; K133-H137 VanDerWaalsContact O-CB 3.32Å; K133-H137 WeakPolarHBondContact O-CB 3.43Å; K133-H137 PolarHBondContact O-N 2.86Å; K133-E399 IonicContact NZ-OE2 2.61Å; K133-E399 PolarHBondContact NZ-OE2 3.3Å
134	V	91.7	Very high	93.5	Very high	44 Å²	44	86.1 Å²	86.1	27%	0.267	40%	0.403	S	S	.	.	H	α-helix	trans	-67.4	-41.6	177.3	170.7	0	0	0	0	111.7	R130 E131 Q132 H137 R138	R130-V134 HydrophobicContact CG-CG2 4.48Å; R130-V134 WeakPolarHBondContact O-CB 3.47Å; R130-V134 VanDerWaalsContact O-CG2 3.27Å; R130-V134 WeakPolarHBondContact O-CG2 3.48Å; R130-V134 PolarHBondContact O-N 3.01Å; E131-V134 PolarHBondContact O-N 2.98Å; Q132-V134 VanDerWaalsContact C-N 3.32Å; Q132-V134 PolarHBondContact O-N 2.69Å; V134-H137 PolarHBondContact O-N 3.26Å; V134-R138 HydrophobicContact CG1-CG 4.47Å; V134-R138 WeakPolarHBondContact O-CB 3.29Å; V134-R138 VanDerWaalsContact O-CG 3.3Å; V134-R138 WeakPolarHBondContact O-CG 3.35Å; V134-R138 PolarHBondContact O-N 2.96Å
135	A	93.1	Very high	93.5	Very high	54 Å²	54	82.1 Å²	82.1	45%	0.446	39%	0.394	S	S	.	.	H	α-helix	trans	-62.8	-48.7	177	0	0	0	0	0	111.4	E131 Q132 H137 R138 E139	E131-A135 VanDerWaalsContact O-CB 3.29Å; E131-A135 WeakPolarHBondContact O-CB 3.41Å; E131-A135 PolarHBondContact O-N 3.23Å; Q132-A135 PolarHBondContact O-N 2.82Å; A135-H137 VanDerWaalsContact C-N 3.32Å; A135-H137 PolarHBondContact O-N 2.99Å; A135-R138 PolarHBondContact O-N 3.19Å; A135-E139 WeakPolarHBondContact O-CB 3.37Å; A135-E139 PolarHBondContact O-N 3.33Å
136	L	92.1	Very high	93.5	Very high	63 Å²	63	81.9 Å²	81.9	33%	0.33	40%	0.397	S	S	.	.	H	α-helix	trans	-57.4	-45.3	175.8	-178.7	69.9	0	0	0	111.4	Q132 E139 G140 S365	Q132-L136 WeakPolarHBondContact O-CB 3.28Å; Q132-L136 PolarHBondContact O-N 3.3Å; L136-E139 PolarHBondContact O-N 3.03Å; L136-G140 PolarHBondContact O-N 3.32Å; L136-S365 WeakPolarHBondContact CD1-OG 3.32Å
137	H	92.3	Very high	93.7	Very high	19 Å²	19	79.1 Å²	79.1	9%	0.088	38%	0.382	C	S	.	.	H	α-helix	trans	-65.1	-40.6	179.2	-172.5	-90.1	0	0	0	112.5	K133 V134 A135 Y141 C363 E391 L396	K133-H137 VanDerWaalsContact O-CB 3.32Å; K133-H137 WeakPolarHBondContact O-CB 3.43Å; K133-H137 PolarHBondContact O-N 2.86Å; V134-H137 PolarHBondContact O-N 3.26Å; A135-H137 VanDerWaalsContact C-N 3.32Å; A135-H137 PolarHBondContact O-N 2.99Å; H137-Y141 VanDerWaalsContact O-CB 3.28Å; H137-Y141 WeakPolarHBondContact O-CB 3.23Å; H137-Y141 PolarHBondContact O-N 3.48Å; H137-C363 PolarHBondContact CD2-SG 2.6Å; H137-E391 PolarHBondContact CE1-O 3.09Å; H137-L396 HydrophobicContact CB-CD1 4.14Å; H137-L396 WeakPolarHBondContact ND1-CD1 3.29Å
138	R	94.1	Very high	93.8	Very high	159 Å²	159	73.1 Å²	73.1	60%	0.6	36%	0.357	S	S	*	.	H	α-helix	trans	-64.1	-42.5	175.7	-76	175.5	178.8	177	1.1	111.9	V134 A135 A142 P393	V134-R138 HydrophobicContact CG1-CG 4.47Å; V134-R138 WeakPolarHBondContact O-CB 3.29Å; V134-R138 VanDerWaalsContact O-CG 3.3Å; V134-R138 WeakPolarHBondContact O-CG 3.35Å; V134-R138 PolarHBondContact O-N 2.96Å; A135-R138 PolarHBondContact O-N 3.19Å; R138-A142 WeakPolarHBondContact O-CB 3.4Å; R138-A142 PolarHBondContact O-N 3.32Å; R138-P393 HydrophobicContact CG-CG 4.26Å
139	E	95.5	Very high	93.7	Very high	111 Å²	111	78.1 Å²	78.1	52%	0.519	37%	0.374	S	S	.	.	H	α-helix	trans	-63.2	-50.8	176	-175.9	-179.5	178.5	0	0	111.2	A135 L136 Y141 A142 T143	A135-E139 WeakPolarHBondContact O-CB 3.37Å; A135-E139 PolarHBondContact O-N 3.33Å; L136-E139 PolarHBondContact O-N 3.03Å; E139-Y141 VanDerWaalsContact C-N 3.33Å; E139-Y141 PolarHBondContact O-N 3.14Å; E139-A142 WeakPolarHBondContact O-CB 3.19Å; E139-A142 PolarHBondContact O-N 3.13Å; E139-A142 VanDerWaalsContact O-N 3.14Å; E139-T143 PolarHBondContact O-N 3.18Å; E139-T143 PolarHBondContact O-OG1 2.79Å
140	G	95.6	Very high	93.6	Very high	0 Å²	0	79.8 Å²	79.8	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-58.2	-42.6	176.2	0	0	0	0	0	112.7	L136 A142 T143 R144 G364 P387	L136-G140 PolarHBondContact O-N 3.32Å; G140-A142 PolarHBondContact O-N 3.08Å; G140-T143 PolarHBondContact O-N 3.33Å; G140-R144 PolarHBondContact O-N 3.39Å; G140-G364 VanDerWaalsContact CA-O 3.26Å; G140-G364 WeakPolarHBondContact CA-O 3.41Å; G140-P387 WeakPolarHBondContact O-CB 3.28Å
141	Y	95.4	Very high	93.7	Very high	53 Å²	53	72 Å²	72	21%	0.208	35%	0.352	C	S	.	.	H	α-helix	trans	-64.2	-39.9	175.1	-176.2	-108.8	0	0	0	112.8	H137 E139 T143 R144 L145 E391 P392 P393	H137-Y141 VanDerWaalsContact O-CB 3.28Å; H137-Y141 WeakPolarHBondContact O-CB 3.23Å; H137-Y141 PolarHBondContact O-N 3.48Å; E139-Y141 VanDerWaalsContact C-N 3.33Å; E139-Y141 PolarHBondContact O-N 3.14Å; Y141-T143 VanDerWaalsContact C-N 3.32Å; Y141-T143 PolarHBondContact O-N 3.38Å; Y141-R144 WeakPolarHBondContact O-CB 3.44Å; Y141-R144 PolarHBondContact O-N 3.38Å; Y141-L145 HydrophobicContact CD1-CD1 4.27Å; Y141-L145 HydrophobicContact CE1-CD1 3.81Å; Y141-L145 HydrophobicContact CE1-CD2 4.43Å; Y141-L145 HydrophobicContact CE1-CG 4.19Å; Y141-L145 HydrophobicContact CE2-CD2 4.46Å; Y141-L145 WeakPolarHBondContact O-CG 3.16Å; Y141-L145 PolarHBondContact O-N 3.26Å; Y141-L145 VanDerWaalsContact O-N 3.1Å; Y141-E391 VanDerWaalsContact CD2-C 3.46Å; Y141-E391 WeakPolarHBondContact CD2-O 3.25Å; Y141-P392 HydrophobicContact CE2-CB 4.08Å; Y141-P392 HydrophobicContact CE2-CG 3.85Å; Y141-P393 HydrophobicContact CD1-CG 4.3Å
142	A	95.9	Very high	93.6	Very high	50 Å²	50	70.8 Å²	70.8	41%	0.413	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-39.9	175.4	0	0	0	0	0	111.9	R138 E139 G140 L145	R138-A142 WeakPolarHBondContact O-CB 3.4Å; R138-A142 PolarHBondContact O-N 3.32Å; E139-A142 WeakPolarHBondContact O-CB 3.19Å; E139-A142 PolarHBondContact O-N 3.13Å; E139-A142 VanDerWaalsContact O-N 3.14Å; G140-A142 PolarHBondContact O-N 3.08Å; A142-L145 PolarHBondContact O-N 2.94Å
143	T	95.8	Very high	93.5	Very high	47 Å²	47	70.6 Å²	70.6	29%	0.288	34%	0.342	S	S	.	.	H	α-helix	trans	-67.5	-40.3	174.2	-60.8	0	0	0	0	111.6	E139 G140 Y141 L145 K146 M147 P387	E139-T143 PolarHBondContact O-N 3.18Å; E139-T143 PolarHBondContact O-OG1 2.79Å; G140-T143 PolarHBondContact O-N 3.33Å; Y141-T143 VanDerWaalsContact C-N 3.32Å; Y141-T143 PolarHBondContact O-N 3.38Å; T143-L145 VanDerWaalsContact C-N 3.28Å; T143-L145 PolarHBondContact O-N 3.15Å; T143-K146 PolarHBondContact O-N 2.81Å; T143-K146 VanDerWaalsContact O-N 3.16Å; T143-M147 HydrophobicContact CG2-CG 4.41Å; T143-M147 HydrophobicContact CG2-SD 4.18Å; T143-M147 WeakPolarHBondContact O-CG 3.44Å; T143-M147 PolarHBondContact O-N 3.45Å; T143-P387 HydrophobicContact CG2-CB 3.78Å; T143-P387 HydrophobicContact CG2-CG 3.68Å
144	R	95.1	Very high	93.4	Very high	16 Å²	16	68 Å²	68	6%	0.06	33%	0.332	C	S	.	.	H	α-helix	trans	-54.5	-43.4	174.2	-175.5	-178.3	156.8	-137.3	-14	112.4	G140 Y141 K146 M147 A148 D298 A300 P387 C390	G140-R144 PolarHBondContact O-N 3.39Å; Y141-R144 WeakPolarHBondContact O-CB 3.44Å; Y141-R144 PolarHBondContact O-N 3.38Å; R144-K146 VanDerWaalsContact C-N 3.32Å; R144-K146 PolarHBondContact O-N 3.4Å; R144-M147 PolarHBondContact O-N 3.4Å; R144-A148 VanDerWaalsContact O-CB 3.29Å; R144-A148 WeakPolarHBondContact O-CB 3.38Å; R144-A148 PolarHBondContact O-N 3.39Å; R144-D298 IonicContact NH2-OD2 3.89Å; R144-D298 PolarHBondContact NH2-OD2 3.37Å; R144-A300 HydrophobicContact CG-CB 4.09Å; R144-P387 VanDerWaalsContact CB-O 3.3Å; R144-P387 WeakPolarHBondContact CB-O 3.18Å; R144-C390 WeakPolarHBondContact CD-O 3.38Å; R144-C390 PolarHBondContact NH1-O 2.92Å
145	L	94.9	Very high	93.1	Very high	86 Å²	86	68.2 Å²	68.2	45%	0.45	33%	0.329	S	S	.	.	H	α-helix	trans	-61.6	-41.3	-179.3	-70.1	176	0	0	0	111.7	Y141 A142 T143 A148 E149	Y141-L145 HydrophobicContact CD1-CD1 4.27Å; Y141-L145 HydrophobicContact CE1-CD1 3.81Å; Y141-L145 HydrophobicContact CE1-CD2 4.43Å; Y141-L145 HydrophobicContact CE1-CG 4.19Å; Y141-L145 HydrophobicContact CE2-CD2 4.46Å; Y141-L145 WeakPolarHBondContact O-CG 3.16Å; Y141-L145 PolarHBondContact O-N 3.26Å; Y141-L145 VanDerWaalsContact O-N 3.1Å; A142-L145 PolarHBondContact O-N 2.94Å; T143-L145 VanDerWaalsContact C-N 3.28Å; T143-L145 PolarHBondContact O-N 3.15Å; L145-A148 PolarHBondContact O-N 2.92Å; L145-E149 PolarHBondContact O-N 2.85Å
146	K	95.1	Very high	92.8	Very high	140 Å²	140	71.3 Å²	71.3	61%	0.609	33%	0.334	S	S	*	.	H	α-helix	trans	-64.5	-48.1	175.2	-63.2	178.6	-179.4	177.9	0	111.5	T143 R144 A148 E149 E150	T143-K146 PolarHBondContact O-N 2.81Å; T143-K146 VanDerWaalsContact O-N 3.16Å; R144-K146 VanDerWaalsContact C-N 3.32Å; R144-K146 PolarHBondContact O-N 3.4Å; K146-A148 VanDerWaalsContact C-N 3.27Å; K146-A148 PolarHBondContact O-N 3.35Å; K146-E149 PolarHBondContact O-N 2.97Å; K146-E149 VanDerWaalsContact O-N 3.16Å; K146-E150 WeakPolarHBondContact O-CG 3.5Å; K146-E150 PolarHBondContact O-N 2.92Å
147	M	94.1	Very high	92.4	Very high	21 Å²	21	72.2 Å²	72.2	10%	0.103	34%	0.34	C	S	.	.	H	α-helix	trans	-56.5	-42.3	176	-71.2	176.7	74	0	0	111.9	T143 R144 A151 P303 L304 P387 A388	T143-M147 HydrophobicContact CG2-CG 4.41Å; T143-M147 HydrophobicContact CG2-SD 4.18Å; T143-M147 WeakPolarHBondContact O-CG 3.44Å; T143-M147 PolarHBondContact O-N 3.45Å; R144-M147 PolarHBondContact O-N 3.4Å; M147-A151 WeakPolarHBondContact O-CB 3.3Å; M147-A151 PolarHBondContact O-N 3.16Å; M147-P303 HydrophobicContact CB-CG 4.13Å; M147-P303 HydrophobicContact CE-CB 4.06Å; M147-P303 HydrophobicContact CE-CG 4.24Å; M147-L304 HydrophobicContact CE-CD1 4.29Å; M147-L304 HydrophobicContact CE-CD2 4.27Å; M147-L304 HydrophobicContact CE-CG 4.03Å; M147-P387 HydrophobicContact SD-CB 3.87Å; M147-P387 HydrophobicContact SD-CG 4.3Å; M147-A388 HydrophobicContact CE-CB 4.3Å
148	A	94	Very high	91.9	Very high	6 Å²	6	74 Å²	74	5%	0.05	35%	0.347	C	S	.	.	H	α-helix	trans	-67.4	-37.4	178.7	0	0	0	0	0	112.7	R144 L145 K146 K152 D298	R144-A148 VanDerWaalsContact O-CB 3.29Å; R144-A148 WeakPolarHBondContact O-CB 3.38Å; R144-A148 PolarHBondContact O-N 3.39Å; L145-A148 PolarHBondContact O-N 2.92Å; K146-A148 VanDerWaalsContact C-N 3.27Å; K146-A148 PolarHBondContact O-N 3.35Å; A148-K152 WeakPolarHBondContact O-CB 3.48Å; A148-K152 VanDerWaalsContact O-CG 3.22Å; A148-K152 WeakPolarHBondContact O-CG 3.36Å; A148-K152 PolarHBondContact O-N 3.29Å; A148-D298 HydrophobicContact CB-CB 3.82Å
149	E	93.8	Very high	91.2	Very high	144 Å²	144	70.1 Å²	70.1	67%	0.673	34%	0.336	S	S	*	.	H	α-helix	trans	-65.6	-48.7	175	-174.4	176.2	-176	0	0	111.5	L145 K146 A151 K152 K153	L145-E149 PolarHBondContact O-N 2.85Å; K146-E149 PolarHBondContact O-N 2.97Å; K146-E149 VanDerWaalsContact O-N 3.16Å; E149-A151 PolarHBondContact O-N 3.06Å; E149-K152 PolarHBondContact O-N 3.21Å; E149-K153 PolarHBondContact O-N 3.46Å; E149-K153 VanDerWaalsContact O-N 3.14Å
150	E	92.1	Very high	90.6	Very high	128 Å²	128	67.2 Å²	67.2	60%	0.598	33%	0.326	S	S	*	.	H	α-helix	trans	-60.2	-44.9	176.1	-70.3	174.3	179.2	0	0	111.5	K146 K152 K153 E154	K146-E150 WeakPolarHBondContact O-CG 3.5Å; K146-E150 PolarHBondContact O-N 2.92Å; E150-K152 PolarHBondContact O-N 3.36Å; E150-K153 WeakPolarHBondContact O-CB 3.29Å; E150-K153 PolarHBondContact O-N 3.48Å; E150-E154 PolarHBondContact O-N 3.07Å
151	A	92.1	Very high	89.5	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.8	-41.4	177	0	0	0	0	0	112.9	M147 E149 K153 E154 K155 F299 L302 P303	M147-A151 WeakPolarHBondContact O-CB 3.3Å; M147-A151 PolarHBondContact O-N 3.16Å; E149-A151 PolarHBondContact O-N 3.06Å; A151-K153 VanDerWaalsContact C-N 3.34Å; A151-K153 PolarHBondContact O-N 3.39Å; A151-E154 PolarHBondContact O-N 2.75Å; A151-K155 WeakPolarHBondContact O-CB 3.46Å; A151-K155 PolarHBondContact O-N 3.49Å; A151-F299 HydrophobicContact CB-CB 4.01Å; A151-F299 VanDerWaalsContact CB-O 3.32Å; A151-F299 WeakPolarHBondContact CB-O 3.45Å; A151-L302 HydrophobicContact CB-CB 3.95Å; A151-L302 HydrophobicContact CB-CD2 4.03Å; A151-L302 HydrophobicContact CB-CG 4.4Å; A151-L302 WeakPolarHBondContact O-CD2 3.08Å; A151-P303 HydrophobicContact CB-CG 4.08Å
152	K	91.2	Very high	88.7	Confident	86 Å²	86	69.1 Å²	69.1	37%	0.374	34%	0.343	S	S	.	.	H	α-helix	trans	-61.2	-44.2	176.2	-78.9	170.3	-176	176.2	0	111	A148 E149 E150 K155 Q156 D298 F299	A148-K152 WeakPolarHBondContact O-CB 3.48Å; A148-K152 VanDerWaalsContact O-CG 3.22Å; A148-K152 WeakPolarHBondContact O-CG 3.36Å; A148-K152 PolarHBondContact O-N 3.29Å; E149-K152 PolarHBondContact O-N 3.21Å; E150-K152 PolarHBondContact O-N 3.36Å; K152-K155 PolarHBondContact O-N 3.5Å; K152-Q156 WeakPolarHBondContact O-CG 3.46Å; K152-Q156 PolarHBondContact O-N 2.83Å; K152-Q156 VanDerWaalsContact O-N 3.07Å; K152-D298 WeakPolarHBondContact CE-OD1 3.44Å; K152-D298 IonicContact NZ-OD1 2.87Å; K152-D298 PolarHBondContact NZ-OD1 3.4Å; K152-F299 HydrophobicContact CG-CD2 4.25Å
153	K	90.6	Very high	87.8	Confident	135 Å²	135	71.8 Å²	71.8	59%	0.587	35%	0.346	S	S	*	.	H	α-helix	trans	-63.3	-49.3	175.9	-174.5	-176.6	175.9	-174.7	0	111.4	E149 E150 A151 K155 Q156 D157	E149-K153 PolarHBondContact O-N 3.46Å; E149-K153 VanDerWaalsContact O-N 3.14Å; E150-K153 WeakPolarHBondContact O-CB 3.29Å; E150-K153 PolarHBondContact O-N 3.48Å; A151-K153 VanDerWaalsContact C-N 3.34Å; A151-K153 PolarHBondContact O-N 3.39Å; K153-K155 VanDerWaalsContact C-N 3.28Å; K153-K155 PolarHBondContact O-N 2.84Å; K153-Q156 WeakPolarHBondContact O-CB 3.37Å; K153-Q156 PolarHBondContact O-N 3.04Å; K153-Q156 VanDerWaalsContact O-N 3.07Å; K153-D157 PolarHBondContact O-N 3.27Å
154	E	87.5	Confident	86.7	Confident	67 Å²	67	70.2 Å²	70.2	31%	0.313	34%	0.335	S	S	.	.	H	α-helix	trans	-59.2	-40.5	179.3	-171.2	-173.2	161.2	0	0	111.9	E150 A151 D157 K158 L302	E150-E154 PolarHBondContact O-N 3.07Å; A151-E154 PolarHBondContact O-N 2.75Å; E154-D157 PolarHBondContact O-N 3.49Å; E154-K158 HydrophobicContact CG-CD 4.31Å; E154-K158 WeakPolarHBondContact O-CB 3.48Å; E154-K158 WeakPolarHBondContact O-CG 3.37Å; E154-K158 PolarHBondContact O-N 2.87Å; E154-K158 VanDerWaalsContact OE1-CE 3.24Å; E154-K158 WeakPolarHBondContact OE1-CE 3.41Å; E154-K158 IonicContact OE1-NZ 3.78Å; E154-K158 PolarHBondContact OE1-NZ 2.84Å; E154-L302 HydrophobicContact CB-CD2 4.45Å
155	K	85	Confident	85.5	Confident	47 Å²	47	71.6 Å²	71.6	20%	0.204	34%	0.342	C	S	.	.	H	α-helix	trans	-62.7	-44.6	175.1	-174.6	175.2	-176.8	172.6	0	111.7	A151 K152 K153 K158 Q159 L291 F299 L302	A151-K155 WeakPolarHBondContact O-CB 3.46Å; A151-K155 PolarHBondContact O-N 3.49Å; K152-K155 PolarHBondContact O-N 3.5Å; K153-K155 VanDerWaalsContact C-N 3.28Å; K153-K155 PolarHBondContact O-N 2.84Å; K155-K158 PolarHBondContact O-N 2.99Å; K155-Q159 WeakPolarHBondContact O-CB 3.48Å; K155-Q159 VanDerWaalsContact O-CG 3.26Å; K155-Q159 WeakPolarHBondContact O-CG 3.5Å; K155-Q159 PolarHBondContact O-N 3.32Å; K155-L291 HydrophobicContact CG-CD2 3.98Å; K155-F299 HydrophobicContact CD-CD1 4.04Å; K155-F299 HydrophobicContact CD-CD2 3.89Å; K155-F299 HydrophobicContact CD-CE1 3.87Å; K155-F299 HydrophobicContact CD-CE2 3.68Å; K155-F299 HydrophobicContact CD-CG 4.1Å; K155-F299 HydrophobicContact CD-CZ 3.71Å; K155-L302 HydrophobicContact CB-CD2 4.32Å
156	Q	86.2	Confident	84.4	Confident	119 Å²	119	72.3 Å²	72.3	56%	0.556	34%	0.341	S	S	*	.	H	α-helix	trans	-61.7	-46.8	176.5	-73.3	173.6	-7.6	0	0	110.9	K152 K153 K158 Q159 V160	K152-Q156 WeakPolarHBondContact O-CG 3.46Å; K152-Q156 PolarHBondContact O-N 2.83Å; K152-Q156 VanDerWaalsContact O-N 3.07Å; K153-Q156 WeakPolarHBondContact O-CB 3.37Å; K153-Q156 PolarHBondContact O-N 3.04Å; K153-Q156 VanDerWaalsContact O-N 3.07Å; Q156-K158 PolarHBondContact O-N 2.84Å; Q156-Q159 WeakPolarHBondContact O-CB 3.43Å; Q156-Q159 PolarHBondContact O-N 2.64Å; Q156-Q159 VanDerWaalsContact O-N 3.16Å; Q156-V160 WeakPolarHBondContact O-CG2 3.45Å; Q156-V160 PolarHBondContact O-N 3.09Å
157	D	85.1	Confident	83.1	Confident	83 Å²	83	65.6 Å²	65.6	44%	0.444	31%	0.312	S	S	.	.	H	α-helix	trans	-60.6	-42.6	178.6	-69.3	-16.3	0	0	0	111.6	K153 E154 V160 S161	K153-D157 PolarHBondContact O-N 3.27Å; E154-D157 PolarHBondContact O-N 3.49Å; D157-V160 PolarHBondContact O-N 3.27Å; D157-S161 VanDerWaalsContact O-CB 3.29Å; D157-S161 WeakPolarHBondContact O-CB 3.49Å; D157-S161 PolarHBondContact O-N 3.08Å; D157-S161 PolarHBondContact O-OG 2.89Å
158	K	80.5	Confident	81.8	Confident	55 Å²	55	66.1 Å²	66.1	24%	0.239	31%	0.314	C	S	.	.	H	α-helix	trans	-68.2	-36.7	175.5	-74.5	-178.6	175	169.6	0	112.6	E154 K155 Q156 S161 M162 L290	E154-K158 HydrophobicContact CG-CD 4.31Å; E154-K158 WeakPolarHBondContact O-CB 3.48Å; E154-K158 WeakPolarHBondContact O-CG 3.37Å; E154-K158 PolarHBondContact O-N 2.87Å; E154-K158 VanDerWaalsContact OE1-CE 3.24Å; E154-K158 WeakPolarHBondContact OE1-CE 3.41Å; E154-K158 IonicContact OE1-NZ 3.78Å; E154-K158 PolarHBondContact OE1-NZ 2.84Å; K155-K158 PolarHBondContact O-N 2.99Å; Q156-K158 PolarHBondContact O-N 2.84Å; K158-S161 PolarHBondContact O-N 2.88Å; K158-M162 WeakPolarHBondContact O-CB 3.4Å; K158-M162 PolarHBondContact O-N 2.7Å; K158-L290 HydrophobicContact CD-CD2 3.31Å
159	Q	80.4	Confident	80.4	Confident	79 Å²	79	70.2 Å²	70.2	37%	0.369	34%	0.335	S	S	.	.	H	α-helix	trans	-66	-44.8	174.4	-77.8	179.1	-23.6	0	0	111.8	K155 Q156 M162 K163 L291	K155-Q159 WeakPolarHBondContact O-CB 3.48Å; K155-Q159 VanDerWaalsContact O-CG 3.26Å; K155-Q159 WeakPolarHBondContact O-CG 3.5Å; K155-Q159 PolarHBondContact O-N 3.32Å; Q156-Q159 WeakPolarHBondContact O-CB 3.43Å; Q156-Q159 PolarHBondContact O-N 2.64Å; Q156-Q159 VanDerWaalsContact O-N 3.16Å; Q159-M162 PolarHBondContact O-N 2.94Å; Q159-K163 WeakPolarHBondContact O-CG 3.41Å; Q159-K163 PolarHBondContact O-N 3.44Å; Q159-L291 HydrophobicContact CG-CD1 4.07Å; Q159-L291 HydrophobicContact CG-CD2 3.99Å
160	V	82	Confident	79	Confident	50 Å²	50	66 Å²	66	30%	0.303	32%	0.317	S	S	.	.	H	α-helix	trans	-60.5	-48.8	173.7	170	0	0	0	0	109.8	Q156 D157 M162 K163 I164 E186	Q156-V160 WeakPolarHBondContact O-CG2 3.45Å; Q156-V160 PolarHBondContact O-N 3.09Å; D157-V160 PolarHBondContact O-N 3.27Å; V160-M162 VanDerWaalsContact C-N 3.28Å; V160-M162 PolarHBondContact O-N 3.1Å; V160-K163 WeakPolarHBondContact O-CA 3.41Å; V160-K163 PolarHBondContact O-N 3.3Å; V160-I164 HydrophobicContact CG1-CD1 3.69Å; V160-I164 HydrophobicContact CG1-CG1 4.16Å; V160-I164 WeakPolarHBondContact O-CG1 3.37Å; V160-I164 PolarHBondContact O-N 2.8Å; V160-E186 HydrophobicContact CG1-CB 4.45Å
161	S	73.9	Confident	77.1	Confident	60 Å²	60	62.4 Å²	62.4	42%	0.42	31%	0.305	S	S	.	.	H	α-helix	trans	-55.9	-41.8	176.5	-61.6	0	0	0	0	112.2	D157 K158 K163 I164 F165	D157-S161 VanDerWaalsContact O-CB 3.29Å; D157-S161 WeakPolarHBondContact O-CB 3.49Å; D157-S161 PolarHBondContact O-N 3.08Å; D157-S161 PolarHBondContact O-OG 2.89Å; K158-S161 PolarHBondContact O-N 2.88Å; S161-K163 PolarHBondContact O-N 2.81Å; S161-I164 PolarHBondContact O-N 2.89Å; S161-F165 WeakPolarHBondContact O-CB 3.45Å; S161-F165 PolarHBondContact O-N 3.34Å
162	M	76.8	Confident	75.5	Confident	32 Å²	32	69.9 Å²	69.9	16%	0.158	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-37.6	175.9	-176.2	178.5	53.6	0	0	112.5	K158 Q159 V160 K166 I287 K288 L291	K158-M162 WeakPolarHBondContact O-CB 3.4Å; K158-M162 PolarHBondContact O-N 2.7Å; Q159-M162 PolarHBondContact O-N 2.94Å; V160-M162 VanDerWaalsContact C-N 3.28Å; V160-M162 PolarHBondContact O-N 3.1Å; M162-K166 WeakPolarHBondContact O-CG 3.49Å; M162-K166 PolarHBondContact O-N 3.31Å; M162-K166 VanDerWaalsContact O-N 3.1Å; M162-I287 HydrophobicContact CB-CG2 4.2Å; M162-K288 HydrophobicContact SD-CG 3.98Å; M162-L291 HydrophobicContact CE-CD1 3.59Å; M162-L291 HydrophobicContact SD-CD1 4.1Å
163	K	78.6	Confident	73.9	Confident	106 Å²	106	68 Å²	68	46%	0.461	34%	0.336	S	S	.	.	H	α-helix	trans	-69	-49.2	175.8	-65.8	-177.5	-169.1	175.4	0	110.8	Q159 V160 S161 F165 K166 T167 E186	Q159-K163 WeakPolarHBondContact O-CG 3.41Å; Q159-K163 PolarHBondContact O-N 3.44Å; V160-K163 WeakPolarHBondContact O-CA 3.41Å; V160-K163 PolarHBondContact O-N 3.3Å; S161-K163 PolarHBondContact O-N 2.81Å; K163-F165 VanDerWaalsContact C-N 3.28Å; K163-F165 PolarHBondContact O-N 3.02Å; K163-K166 WeakPolarHBondContact O-CB 3.24Å; K163-K166 PolarHBondContact O-N 3.13Å; K163-K166 VanDerWaalsContact O-N 3.09Å; K163-T167 PolarHBondContact O-N 3.23Å; K163-T167 PolarHBondContact O-OG1 3.46Å; K163-E186 WeakPolarHBondContact CB-OE1 3.22Å; K163-E186 VanDerWaalsContact CB-OE2 3.23Å; K163-E186 WeakPolarHBondContact CB-OE2 3.49Å; K163-E186 WeakPolarHBondContact CD-OE2 3.33Å
164	I	72.1	Confident	72.2	Confident	14 Å²	14	71.9 Å²	71.9	7%	0.072	35%	0.348	C	S	.	.	H	α-helix	trans	-52.1	-48.9	174.4	-66.7	176.6	0	0	0	110.4	V160 S161 K166 T167 Q168 F187 K203	V160-I164 HydrophobicContact CG1-CD1 3.69Å; V160-I164 HydrophobicContact CG1-CG1 4.16Å; V160-I164 WeakPolarHBondContact O-CG1 3.37Å; V160-I164 PolarHBondContact O-N 2.8Å; S161-I164 PolarHBondContact O-N 2.89Å; I164-K166 PolarHBondContact O-N 3.01Å; I164-T167 CarbonylContact O-C 3.08Å; I164-T167 WeakPolarHBondContact O-CA 3.25Å; I164-T167 VanDerWaalsContact O-CB 3.3Å; I164-T167 WeakPolarHBondContact O-CB 3.24Å; I164-T167 PolarHBondContact O-N 3.46Å; I164-T167 VanDerWaalsContact O-N 3.08Å; I164-Q168 HydrophobicContact CG2-CG 4.47Å; I164-Q168 WeakPolarHBondContact O-CG 3.4Å; I164-Q168 PolarHBondContact O-N 2.87Å; I164-F187 HydrophobicContact CB-CE1 4.34Å; I164-F187 HydrophobicContact CD1-CE1 4.43Å; I164-F187 HydrophobicContact CG1-CD1 4.35Å; I164-F187 HydrophobicContact CG1-CE1 3.76Å; I164-F187 HydrophobicContact CG2-CE1 4.19Å; I164-K203 HydrophobicContact CD1-CD 4.22Å
165	F	69.1	Low	70.8	Confident	46 Å²	46	77.8 Å²	77.8	20%	0.202	37%	0.368	C	S	.	.	H	α-helix	trans	-62	-41.9	-180	-175.5	-92.9	0	0	0	113	S161 K163 T167 Q168 L169 K280 C284	S161-F165 WeakPolarHBondContact O-CB 3.45Å; S161-F165 PolarHBondContact O-N 3.34Å; K163-F165 VanDerWaalsContact C-N 3.28Å; K163-F165 PolarHBondContact O-N 3.02Å; F165-T167 VanDerWaalsContact C-N 3.31Å; F165-T167 PolarHBondContact O-N 3.15Å; F165-Q168 WeakPolarHBondContact O-CB 3.4Å; F165-Q168 PolarHBondContact O-N 3.08Å; F165-L169 PolarHBondContact O-N 2.84Å; F165-K280 HydrophobicContact CE1-CB 4.49Å; F165-K280 HydrophobicContact CE2-CB 4.19Å; F165-K280 HydrophobicContact CE2-CG 3.8Å; F165-K280 HydrophobicContact CZ-CB 3.5Å; F165-K280 HydrophobicContact CZ-CD 4.33Å; F165-K280 HydrophobicContact CZ-CG 3.6Å; F165-K280 WeakPolarHBondContact CZ-O 3.41Å; F165-C284 HydrophobicContact CD1-CB 4.3Å; F165-C284 WeakPolarHBondContact CD1-SG 3.44Å; F165-C284 HydrophobicContact CE1-CB 3.8Å; F165-C284 WeakPolarHBondContact CE1-SG 3.12Å; F165-C284 HydrophobicContact CZ-CB 4.43Å
166	K	72.1	Confident	69.8	Low	100 Å²	100	76.6 Å²	76.6	44%	0.435	36%	0.363	S	S	.	.	H	α-helix	trans	-62.7	-39.8	172.5	-74.8	175.3	-178.2	178	0	111.3	M162 K163 I164 L169 L170	M162-K166 WeakPolarHBondContact O-CG 3.49Å; M162-K166 PolarHBondContact O-N 3.31Å; M162-K166 VanDerWaalsContact O-N 3.1Å; K163-K166 WeakPolarHBondContact O-CB 3.24Å; K163-K166 PolarHBondContact O-N 3.13Å; K163-K166 VanDerWaalsContact O-N 3.09Å; I164-K166 PolarHBondContact O-N 3.01Å; K166-L169 WeakPolarHBondContact O-CB 3.42Å; K166-L169 PolarHBondContact O-N 3.22Å; K166-L170 WeakPolarHBondContact O-CG 3.49Å; K166-L170 PolarHBondContact O-N 2.91Å
167	T	68.5	Low	69	Low	0 Å²	0	74.9 Å²	74.9	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-63.8	-42.6	176	-44.3	0	0	0	0	111.8	K163 I164 F165 L169 L170 C171 I176 L181 R184 E186 F187	K163-T167 PolarHBondContact O-N 3.23Å; K163-T167 PolarHBondContact O-OG1 3.46Å; I164-T167 CarbonylContact O-C 3.08Å; I164-T167 WeakPolarHBondContact O-CA 3.25Å; I164-T167 VanDerWaalsContact O-CB 3.3Å; I164-T167 WeakPolarHBondContact O-CB 3.24Å; I164-T167 PolarHBondContact O-N 3.46Å; I164-T167 VanDerWaalsContact O-N 3.08Å; F165-T167 VanDerWaalsContact C-N 3.31Å; F165-T167 PolarHBondContact O-N 3.15Å; T167-L169 VanDerWaalsContact C-N 3.28Å; T167-L169 PolarHBondContact O-N 2.87Å; T167-L170 PolarHBondContact O-N 3.3Å; T167-L170 VanDerWaalsContact O-N 3.16Å; T167-C171 WeakPolarHBondContact O-CB 3.41Å; T167-C171 PolarHBondContact O-N 3.36Å; T167-I176 HydrophobicContact CG2-CD1 3.67Å; T167-L181 HydrophobicContact CG2-CD1 3.93Å; T167-R184 PolarHBondContact OG1-NH1 2.89Å; T167-E186 PolarHBondContact OG1-OE1 3.04Å; T167-F187 HydrophobicContact CG2-CE2 3.86Å; T167-F187 HydrophobicContact CG2-CZ 3.75Å
168	Q	65.4	Low	68.4	Low	31 Å²	31	75 Å²	75	15%	0.145	37%	0.365	C	S	.	.	H	α-helix	trans	-58.3	-42	173.9	-76	177.8	-36.1	0	0	111.7	I164 F165 L170 C171 F172 L204 S207	I164-Q168 HydrophobicContact CG2-CG 4.47Å; I164-Q168 WeakPolarHBondContact O-CG 3.4Å; I164-Q168 PolarHBondContact O-N 2.87Å; F165-Q168 WeakPolarHBondContact O-CB 3.4Å; F165-Q168 PolarHBondContact O-N 3.08Å; Q168-L170 VanDerWaalsContact C-N 3.34Å; Q168-L170 PolarHBondContact O-N 3.03Å; Q168-C171 PolarHBondContact O-N 2.61Å; Q168-F172 WeakPolarHBondContact O-CB 3.26Å; Q168-F172 PolarHBondContact O-N 3.43Å; Q168-L204 HydrophobicContact CB-CD2 4.36Å; Q168-L204 HydrophobicContact CG-CD2 3.3Å; Q168-L204 PolarHBondContact NE2-O 2.83Å; Q168-S207 VanDerWaalsContact CD-OG 3.31Å; Q168-S207 PolarHBondContact NE2-OG 3.21Å; Q168-S207 PolarHBondContact OE1-OG 2.92Å
169	L	65.7	Low	68.2	Low	92 Å²	92	78.4 Å²	78.4	48%	0.482	39%	0.385	S	S	.	.	H	α-helix	trans	-63.9	-39.4	177	-154	107.2	0	0	0	111.9	F165 K166 T167 S173	F165-L169 PolarHBondContact O-N 2.84Å; K166-L169 WeakPolarHBondContact O-CB 3.42Å; K166-L169 PolarHBondContact O-N 3.22Å; T167-L169 VanDerWaalsContact C-N 3.28Å; T167-L169 PolarHBondContact O-N 2.87Å; L169-S173 WeakPolarHBondContact O-CB 3.33Å; L169-S173 PolarHBondContact O-N 3.41Å; L169-S173 PolarHBondContact O-OG 3.16Å
170	L	64.6	Low	68.1	Low	55 Å²	55	78.6 Å²	78.6	29%	0.288	39%	0.387	S	S	.	.	H	α-helix	trans	-68.4	-41.3	174.6	-68.9	170.1	0	0	0	111.9	K166 T167 Q168 S173 Y174 R175 I176	K166-L170 WeakPolarHBondContact O-CG 3.49Å; K166-L170 PolarHBondContact O-N 2.91Å; T167-L170 PolarHBondContact O-N 3.3Å; T167-L170 VanDerWaalsContact O-N 3.16Å; Q168-L170 VanDerWaalsContact C-N 3.34Å; Q168-L170 PolarHBondContact O-N 3.03Å; L170-S173 WeakPolarHBondContact CA-OG 3.44Å; L170-S173 PolarHBondContact O-N 2.91Å; L170-S173 PolarHBondContact O-OG 3.46Å; L170-Y174 PolarHBondContact O-N 3.41Å; L170-R175 HydrophobicContact CD2-CB 4.08Å; L170-R175 PolarHBondContact O-N 3.49Å; L170-I176 HydrophobicContact CB-CB 4.15Å; L170-I176 HydrophobicContact CB-CG2 4.25Å
171	C	52.8	Low	67.6	Low	54 Å²	54	76.9 Å²	76.9	37%	0.365	38%	0.376	S	S	.	.	H	α-helix	trans	-63.8	-46.5	177.1	-169.8	0	0	0	0	111.8	T167 Q168 S173 Y174 I176	T167-C171 WeakPolarHBondContact O-CB 3.41Å; T167-C171 PolarHBondContact O-N 3.36Å; Q168-C171 PolarHBondContact O-N 2.61Å; C171-S173 PolarHBondContact O-N 3.41Å; C171-Y174 PolarHBondContact O-N 3.48Å; C171-I176 VanDerWaalsContact CA-CG2 3.5Å; C171-I176 HydrophobicContact CB-CG2 3.83Å
172	F	57.9	Low	67.9	Low	156 Å²	156	77.3 Å²	77.3	68%	0.684	37%	0.371	S	S	*	.	H	α-helix	trans	-64.4	-29	177.4	-172.5	-101.9	0	0	0	113.1	Q168 Y174	Q168-F172 WeakPolarHBondContact O-CB 3.26Å; Q168-F172 PolarHBondContact O-N 3.43Å; F172-Y174 VanDerWaalsContact C-N 3.28Å
173	S	58.2	Low	68.2	Low	47 Å²	47	80 Å²	80	33%	0.329	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	6.3	174.8	56.2	0	0	0	0	113.9	L169 L170 C171 R175	L169-S173 WeakPolarHBondContact O-CB 3.33Å; L169-S173 PolarHBondContact O-N 3.41Å; L169-S173 PolarHBondContact O-OG 3.16Å; L170-S173 WeakPolarHBondContact CA-OG 3.44Å; L170-S173 PolarHBondContact O-N 2.91Å; L170-S173 PolarHBondContact O-OG 3.46Å; C171-S173 PolarHBondContact O-N 3.41Å; S173-R175 PolarHBondContact O-N 2.92Å; S173-R175 WeakPolarHBondContact OG-CD 3.49Å; S173-R175 WeakPolarHBondContact OG-CG 3.33Å
174	Y	53.3	Low	68.3	Low	217 Å²	217	77.5 Å²	77.5	85%	0.851	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	32	-175	-57.2	-89.9	0	0	0	113.2	L170 C171 F172	L170-Y174 PolarHBondContact O-N 3.41Å; C171-Y174 PolarHBondContact O-N 3.48Å; F172-Y174 VanDerWaalsContact C-N 3.28Å
175	R	58.7	Low	69	Low	191 Å²	191	82.5 Å²	82.5	72%	0.721	41%	0.406	S	S	*	.			trans	-99.4	-3.7	-175.9	-69.5	-174.9	-176.6	-174.1	1.2	114.9	L170 S173	L170-R175 HydrophobicContact CD2-CB 4.08Å; L170-R175 PolarHBondContact O-N 3.49Å; S173-R175 PolarHBondContact O-N 2.92Å; S173-R175 WeakPolarHBondContact OG-CD 3.49Å; S173-R175 WeakPolarHBondContact OG-CG 3.33Å
176	I	65	Low	69.5	Low	21 Å²	21	82 Å²	82	11%	0.108	41%	0.405	C	S	.	.	S	Bend	trans	-124.4	137.6	-179.7	-167.4	170.2	0	0	0	109.4	T167 L170 C171 E180 L181	T167-I176 HydrophobicContact CG2-CD1 3.67Å; L170-I176 HydrophobicContact CB-CB 4.15Å; L170-I176 HydrophobicContact CB-CG2 4.25Å; C171-I176 VanDerWaalsContact CA-CG2 3.5Å; C171-I176 HydrophobicContact CB-CG2 3.83Å; I176-E180 HydrophobicContact CD1-CB 4.43Å; I176-E180 HydrophobicContact CD1-CG 4.16Å; I176-E180 HydrophobicContact CG1-CB 3.72Å; I176-E180 HydrophobicContact CG1-CG 3.76Å; I176-E180 WeakPolarHBondContact CG1-OE2 3.23Å; I176-L181 HydrophobicContact CD1-CD1 4.46Å
177	T	69.5	Low	70	Confident	84 Å²	84	77.2 Å²	77.2	52%	0.515	38%	0.384	S	S	.	.			trans	-87.2	166.3	176.2	66.4	0	0	0	0	111.4	D179 E180 L181	T177-D179 VanDerWaalsContact C-N 3.33Å; T177-E180 PolarHBondContact O-N 3.32Å; T177-E180 WeakPolarHBondContact OG1-CB 2.93Å; T177-E180 PolarHBondContact OG1-N 2.91Å; T177-E180 VanDerWaalsContact OG1-N 3.15Å; T177-L181 PolarHBondContact O-N 3.05Å
178	V	70.9	Confident	70.8	Confident	85 Å²	85	78.3 Å²	78.3	52%	0.515	39%	0.39	S	S	.	.	H	α-helix	trans	-62.3	-42.2	174.2	179.2	0	0	0	0	110.7	E180 L181 Q182 V197	V178-E180 VanDerWaalsContact C-N 3.31Å; V178-E180 PolarHBondContact O-N 2.85Å; V178-L181 WeakPolarHBondContact O-CA 3.42Å; V178-L181 VanDerWaalsContact O-CB 3.24Å; V178-L181 WeakPolarHBondContact O-CB 3.12Å; V178-L181 PolarHBondContact O-N 3Å; V178-L181 VanDerWaalsContact O-N 3.09Å; V178-Q182 HydrophobicContact CG1-CG 4.41Å; V178-Q182 WeakPolarHBondContact O-CG 3.09Å; V178-Q182 PolarHBondContact O-N 2.86Å; V178-V197 HydrophobicContact CG1-CG2 4.19Å
179	D	76.1	Confident	71.5	Confident	126 Å²	126	80.7 Å²	80.7	67%	0.674	40%	0.404	S	S	*	.	H	α-helix	trans	-60.4	-41.4	176.4	-57.8	-37.1	0	0	0	111.8	T177 L181 Q182 S183	T177-D179 VanDerWaalsContact C-N 3.33Å; D179-L181 VanDerWaalsContact C-N 3.3Å; D179-L181 PolarHBondContact O-N 3.28Å; D179-Q182 PolarHBondContact O-N 3.07Å; D179-S183 PolarHBondContact O-N 2.05Å; D179-S183 VanDerWaalsContact O-N 3.08Å
180	E	78.2	Confident	72.5	Confident	84 Å²	84	80.3 Å²	80.3	39%	0.393	40%	0.402	S	S	.	.	H	α-helix	trans	-68.3	-32.3	177.1	-166.3	-179.1	176.4	0	0	111.4	I176 T177 V178 S183	I176-E180 HydrophobicContact CD1-CB 4.43Å; I176-E180 HydrophobicContact CD1-CG 4.16Å; I176-E180 HydrophobicContact CG1-CB 3.72Å; I176-E180 HydrophobicContact CG1-CG 3.76Å; I176-E180 WeakPolarHBondContact CG1-OE2 3.23Å; T177-E180 PolarHBondContact O-N 3.32Å; T177-E180 WeakPolarHBondContact OG1-CB 2.93Å; T177-E180 PolarHBondContact OG1-N 2.91Å; T177-E180 VanDerWaalsContact OG1-N 3.15Å; V178-E180 VanDerWaalsContact C-N 3.31Å; V178-E180 PolarHBondContact O-N 2.85Å; E180-S183 PolarHBondContact O-OG 3.08Å
181	L	72.7	Confident	73.6	Confident	14 Å²	14	82.7 Å²	82.7	7%	0.073	42%	0.423	C	S	.	.	H	α-helix	trans	-65	-47.9	172.9	-166.2	87.7	0	0	0	111.8	T167 I176 T177 V178 D179 S183 R184 F187 A200 L204	T167-L181 HydrophobicContact CG2-CD1 3.93Å; I176-L181 HydrophobicContact CD1-CD1 4.46Å; T177-L181 PolarHBondContact O-N 3.05Å; V178-L181 WeakPolarHBondContact O-CA 3.42Å; V178-L181 VanDerWaalsContact O-CB 3.24Å; V178-L181 WeakPolarHBondContact O-CB 3.12Å; V178-L181 PolarHBondContact O-N 3Å; V178-L181 VanDerWaalsContact O-N 3.09Å; D179-L181 VanDerWaalsContact C-N 3.3Å; D179-L181 PolarHBondContact O-N 3.28Å; L181-S183 PolarHBondContact O-N 3.27Å; L181-R184 WeakPolarHBondContact O-CB 3.22Å; L181-R184 PolarHBondContact O-N 3.14Å; L181-F187 HydrophobicContact CD1-CE2 3.94Å; L181-F187 HydrophobicContact CD1-CZ 4.47Å; L181-F187 HydrophobicContact CG-CE2 4.26Å; L181-A200 HydrophobicContact CD2-CB 3.28Å; L181-A200 HydrophobicContact CG-CB 3.8Å; L181-L204 HydrophobicContact CD1-CD1 3.83Å; L181-L204 HydrophobicContact CD2-CD1 4.35Å
182	Q	79.5	Confident	75.4	Confident	69 Å²	69	84.7 Å²	84.7	32%	0.322	43%	0.43	S	S	.	.	H	α-helix	trans	-70.5	-17.2	-179.5	-65.8	-175.9	-76	0	0	113	V178 D179 R184 V195	V178-Q182 HydrophobicContact CG1-CG 4.41Å; V178-Q182 WeakPolarHBondContact O-CG 3.09Å; V178-Q182 PolarHBondContact O-N 2.86Å; D179-Q182 PolarHBondContact O-N 3.07Å; Q182-R184 PolarHBondContact O-N 3.07Å; Q182-V195 WeakPolarHBondContact CG-O 3.48Å; Q182-V195 PolarHBondContact NE2-O 3.33Å; Q182-V195 VanDerWaalsContact NE2-O 3.08Å; Q182-V195 WeakPolarHBondContact O-CB 3.44Å
183	S	83.3	Confident	77	Confident	87 Å²	87	79.5 Å²	79.5	61%	0.608	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-7.4	172.4	77.3	0	0	0	0	114.2	D179 E180 L181	D179-S183 PolarHBondContact O-N 2.05Å; D179-S183 VanDerWaalsContact O-N 3.08Å; E180-S183 PolarHBondContact O-OG 3.08Å; L181-S183 PolarHBondContact O-N 3.27Å
184	R	81.7	Confident	78.5	Confident	54 Å²	54	81.7 Å²	81.7	20%	0.204	43%	0.432	C	S	.	.			trans	-98.8	97.2	-173.9	-60.8	-167.2	178	-148.4	11.1	112.8	T167 L181 Q182 E186 F187 V195	T167-R184 PolarHBondContact OG1-NH1 2.89Å; L181-R184 WeakPolarHBondContact O-CB 3.22Å; L181-R184 PolarHBondContact O-N 3.14Å; Q182-R184 PolarHBondContact O-N 3.07Å; R184-E186 HydrophobicContact CB-CG 4.06Å; R184-E186 WeakPolarHBondContact CD-OE1 3.07Å; R184-E186 IonicContact NH1-OE1 3.97Å; R184-E186 PolarHBondContact NH1-OE1 3.17Å; R184-E186 PolarHBondContact O-N 2.82Å; R184-F187 HydrophobicContact CB-CD2 3.76Å; R184-F187 HydrophobicContact CB-CE2 3.97Å; R184-F187 HydrophobicContact CG-CE2 4.5Å; R184-F187 PolarHBondContact O-N 2.97Å; R184-V195 WeakPolarHBondContact O-CG2 3.23Å
185	L	85.1	Confident	80	Confident	119 Å²	119	71.6 Å²	71.6	62%	0.623	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-54.5	-13.7	176.5	-64.8	171.3	0	0	0	115.4	F187 D188	L185-F187 PolarHBondContact O-N 2.84Å; L185-D188 WeakPolarHBondContact O-CB 3.19Å; L185-D188 PolarHBondContact O-N 3.21Å; L185-D188 VanDerWaalsContact O-N 3.13Å
186	E	80.6	Confident	81.3	Confident	36 Å²	36	64.8 Å²	64.8	17%	0.168	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-67.9	-12.1	172.2	66.8	-152.7	-160.2	0	0	114.1	V160 K163 T167 R184	V160-E186 HydrophobicContact CG1-CB 4.45Å; K163-E186 WeakPolarHBondContact CB-OE1 3.22Å; K163-E186 VanDerWaalsContact CB-OE2 3.23Å; K163-E186 WeakPolarHBondContact CB-OE2 3.49Å; K163-E186 WeakPolarHBondContact CD-OE2 3.33Å; T167-E186 PolarHBondContact OG1-OE1 3.04Å; R184-E186 HydrophobicContact CB-CG 4.06Å; R184-E186 WeakPolarHBondContact CD-OE1 3.07Å; R184-E186 IonicContact NH1-OE1 3.97Å; R184-E186 PolarHBondContact NH1-OE1 3.17Å; R184-E186 PolarHBondContact O-N 2.82Å
187	F	82	Confident	81.8	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-101.8	3	172.7	-59.6	-51.9	0	0	0	113.3	I164 T167 L181 R184 L185 D189 V195 E199 A200 K203 L204	I164-F187 HydrophobicContact CB-CE1 4.34Å; I164-F187 HydrophobicContact CD1-CE1 4.43Å; I164-F187 HydrophobicContact CG1-CD1 4.35Å; I164-F187 HydrophobicContact CG1-CE1 3.76Å; I164-F187 HydrophobicContact CG2-CE1 4.19Å; T167-F187 HydrophobicContact CG2-CE2 3.86Å; T167-F187 HydrophobicContact CG2-CZ 3.75Å; L181-F187 HydrophobicContact CD1-CE2 3.94Å; L181-F187 HydrophobicContact CD1-CZ 4.47Å; L181-F187 HydrophobicContact CG-CE2 4.26Å; R184-F187 HydrophobicContact CB-CD2 3.76Å; R184-F187 HydrophobicContact CB-CE2 3.97Å; R184-F187 HydrophobicContact CG-CE2 4.5Å; R184-F187 PolarHBondContact O-N 2.97Å; L185-F187 PolarHBondContact O-N 2.84Å; F187-D189 PolarHBondContact O-N 3.42Å; F187-D189 VanDerWaalsContact O-N 3.14Å; F187-V195 HydrophobicContact CB-CG1 3.62Å; F187-V195 HydrophobicContact CB-CG2 4.36Å; F187-E199 WeakPolarHBondContact O-CB 3.32Å; F187-A200 HydrophobicContact CB-CB 4.2Å; F187-A200 HydrophobicContact CD2-CB 4.22Å; F187-A200 HydrophobicContact CG-CB 4.24Å; F187-K203 HydrophobicContact CD1-CB 3.46Å; F187-K203 VanDerWaalsContact CD1-CB 3.46Å; F187-K203 HydrophobicContact CD1-CG 4.01Å; F187-K203 HydrophobicContact CE1-CB 3.95Å; F187-L204 HydrophobicContact CE1-CD2 4.1Å; F187-L204 HydrophobicContact CE1-CG 4.29Å; F187-L204 HydrophobicContact CZ-CD2 3.91Å; F187-L204 HydrophobicContact CZ-CG 4.31Å
188	D	85.2	Confident	82.2	Confident	22 Å²	22	69 Å²	69	12%	0.118	39%	0.39	C	S	.	.			trans	-81.1	88.1	176.4	179.2	2	0	0	0	109.3	L185 N190 S191 D192 G193 V195	L185-D188 WeakPolarHBondContact O-CB 3.19Å; L185-D188 PolarHBondContact O-N 3.21Å; L185-D188 VanDerWaalsContact O-N 3.13Å; D188-N190 VanDerWaalsContact C-N 3.3Å; D188-N190 PolarHBondContact O-N 2.86Å; D188-N190 PolarHBondContact OD1-N 3.42Å; D188-N190 PolarHBondContact OD1-OD1 3.05Å; D188-S191 VanDerWaalsContact OD1-CA 3.28Å; D188-S191 WeakPolarHBondContact OD1-CA 3.34Å; D188-S191 PolarHBondContact OD1-N 3.47Å; D188-S191 WeakPolarHBondContact OD2-CA 3.37Å; D188-D192 PolarHBondContact OD1-N 2.89Å; D188-D192 PolarHBondContact OD2-N 3.09Å; D188-G193 VanDerWaalsContact OD2-CA 3.23Å; D188-G193 WeakPolarHBondContact OD2-CA 3.31Å; D188-G193 PolarHBondContact OD2-N 3Å; D188-V195 HydrophobicContact CB-CG2 3.96Å
189	D	81.5	Confident	82.6	Confident	82 Å²	82	66 Å²	66	44%	0.439	37%	0.37	S	S	.	.	S	Bend	trans	-70.5	-28.3	-174	-77.2	17.7	0	0	0	112.9	F187 E199 K203	F187-D189 PolarHBondContact O-N 3.42Å; F187-D189 VanDerWaalsContact O-N 3.14Å; D189-E199 HydrophobicContact CB-CG 4.43Å; D189-K203 WeakPolarHBondContact OD1-CE 3.35Å; D189-K203 VanDerWaalsContact OD1-CG 3.25Å; D189-K203 WeakPolarHBondContact OD1-CG 3.45Å; D189-K203 IonicContact OD1-NZ 2.6Å; D189-K203 WeakPolarHBondContact OD2-CE 3.45Å; D189-K203 IonicContact OD2-NZ 2.85Å
190	N	86.9	Confident	82.4	Confident	84 Å²	84	60 Å²	60	45%	0.449	34%	0.338	S	S	.	.	S	Bend	trans	-99.5	-6.7	-174.4	72.4	25.9	0	0	0	112.5	D188 D192 E199	D188-N190 VanDerWaalsContact C-N 3.3Å; D188-N190 PolarHBondContact O-N 2.86Å; D188-N190 PolarHBondContact OD1-N 3.42Å; D188-N190 PolarHBondContact OD1-OD1 3.05Å; N190-D192 VanDerWaalsContact C-N 3.31Å; N190-D192 PolarHBondContact ND2-OD2 3.16Å; N190-D192 PolarHBondContact O-N 3.05Å; N190-D192 WeakPolarHBondContact OD1-CB 3.23Å; N190-D192 PolarHBondContact OD1-N 3.43Å; N190-D192 PolarHBondContact OD1-OD1 3.42Å; N190-D192 PolarHBondContact OD1-OD2 3.31Å; N190-E199 VanDerWaalsContact CG-OE1 3.25Å; N190-E199 PolarHBondContact ND2-OE1 3.45Å
191	S	85.7	Confident	81.9	Confident	104 Å²	104	61.8 Å²	61.8	73%	0.727	35%	0.348	S	S	*	.			trans	60.2	32	-179.2	-55.3	0	0	0	0	114.3	D188 G193	D188-S191 VanDerWaalsContact OD1-CA 3.28Å; D188-S191 WeakPolarHBondContact OD1-CA 3.34Å; D188-S191 PolarHBondContact OD1-N 3.47Å; D188-S191 WeakPolarHBondContact OD2-CA 3.37Å; S191-G193 VanDerWaalsContact C-N 3.34Å
192	D	92	Very high	81.8	Confident	96 Å²	96	63.5 Å²	63.5	51%	0.513	36%	0.364	S	S	.	.	S	Bend	trans	-86	-6.9	177.3	73.4	13.5	0	0	0	113.5	D188 N190 V194	D188-D192 PolarHBondContact OD1-N 2.89Å; D188-D192 PolarHBondContact OD2-N 3.09Å; N190-D192 VanDerWaalsContact C-N 3.31Å; N190-D192 PolarHBondContact ND2-OD2 3.16Å; N190-D192 PolarHBondContact O-N 3.05Å; N190-D192 WeakPolarHBondContact OD1-CB 3.23Å; N190-D192 PolarHBondContact OD1-N 3.43Å; N190-D192 PolarHBondContact OD1-OD1 3.42Å; N190-D192 PolarHBondContact OD1-OD2 3.31Å; D192-V194 WeakPolarHBondContact OD1-CA 3.37Å; D192-V194 WeakPolarHBondContact OD1-CB 3.22Å; D192-V194 PolarHBondContact OD1-N 3.36Å; D192-V194 VanDerWaalsContact OD1-O 3.07Å
193	G	90.3	Very high	81.5	Confident	48 Å²	48	63.7 Å²	63.7	50%	0.495	36%	0.364	S	S	.	.	S	Bend	trans	87.6	3.5	-179.3	0	0	0	0	0	114.5	D188 S191	D188-G193 VanDerWaalsContact OD2-CA 3.23Å; D188-G193 WeakPolarHBondContact OD2-CA 3.31Å; D188-G193 PolarHBondContact OD2-N 3Å; S191-G193 VanDerWaalsContact C-N 3.34Å
194	V	90.1	Very high	80.7	Confident	92 Å²	92	60.5 Å²	60.5	56%	0.558	34%	0.34	S	S	*	.			trans	-128.4	118.4	-177	-177.1	0	0	0	0	110.3	D192 T196	D192-V194 WeakPolarHBondContact OD1-CA 3.37Å; D192-V194 WeakPolarHBondContact OD1-CB 3.22Å; D192-V194 PolarHBondContact OD1-N 3.36Å; D192-V194 VanDerWaalsContact OD1-O 3.07Å; V194-T196 PolarHBondContact O-N 2.89Å
195	V	85.9	Confident	79.7	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.03	35%	0.348	C	S	.	.			trans	-89.5	111.8	176.9	-178.2	0	0	0	0	110.6	Q182 R184 F187 D188 A200	Q182-V195 WeakPolarHBondContact CG-O 3.48Å; Q182-V195 PolarHBondContact NE2-O 3.33Å; Q182-V195 VanDerWaalsContact NE2-O 3.08Å; Q182-V195 WeakPolarHBondContact O-CB 3.44Å; R184-V195 WeakPolarHBondContact O-CG2 3.23Å; F187-V195 HydrophobicContact CB-CG1 3.62Å; F187-V195 HydrophobicContact CB-CG2 4.36Å; D188-V195 HydrophobicContact CB-CG2 3.96Å; V195-A200 HydrophobicContact CG1-CB 3.85Å
196	T	86.2	Confident	78.1	Confident	48 Å²	48	62.5 Å²	62.5	29%	0.294	35%	0.354	S	S	.	.			trans	-74	159.1	170.8	63.8	0	0	0	0	111.5	V194 E198 E199 A200	V194-T196 PolarHBondContact O-N 2.89Å; T196-E198 PolarHBondContact O-N 3.47Å; T196-E199 WeakPolarHBondContact CB-OE2 3.48Å; T196-E199 WeakPolarHBondContact CG2-OE2 3.46Å; T196-E199 PolarHBondContact N-OE2 3.01Å; T196-E199 PolarHBondContact O-N 3.5Å; T196-E199 WeakPolarHBondContact OG1-CB 3.44Å; T196-E199 WeakPolarHBondContact OG1-CG 3.34Å; T196-E199 PolarHBondContact OG1-N 3.26Å; T196-E199 VanDerWaalsContact OG1-N 3.09Å; T196-E199 PolarHBondContact OG1-OE2 3.47Å; T196-A200 PolarHBondContact O-N 3.33Å; T196-A200 VanDerWaalsContact O-N 3.12Å
197	V	74.7	Confident	76.8	Confident	54 Å²	54	63.3 Å²	63.3	33%	0.327	36%	0.364	S	S	.	.	H	α-helix	trans	-62.4	-37.6	174.8	178	0	0	0	0	109.6	V178 M201	V178-V197 HydrophobicContact CG1-CG2 4.19Å; V197-M201 HydrophobicContact CG1-CG 4.15Å; V197-M201 HydrophobicContact CG1-SD 3.89Å; V197-M201 VanDerWaalsContact O-CB 3.23Å; V197-M201 WeakPolarHBondContact O-CB 3.29Å; V197-M201 WeakPolarHBondContact O-CG 3.13Å; V197-M201 PolarHBondContact O-N 3.42Å
198	E	78	Confident	75.2	Confident	140 Å²	140	66.3 Å²	66.3	65%	0.654	38%	0.379	S	S	*	.	H	α-helix	trans	-60.5	-46.6	176.9	-67.7	75.9	-167.4	0	0	112.2	T196 M201 A202	T196-E198 PolarHBondContact O-N 3.47Å; E198-M201 PolarHBondContact O-N 2.85Å; E198-A202 WeakPolarHBondContact O-CB 3.22Å; E198-A202 PolarHBondContact O-N 3.03Å
199	E	78.8	Confident	73.4	Confident	23 Å²	23	70.4 Å²	70.4	11%	0.107	40%	0.396	C	S	.	.	H	α-helix	trans	-65.7	-46.9	178.7	-73.2	160.1	150.5	0	0	111.9	F187 D189 N190 T196 M201 A202 K203	F187-E199 WeakPolarHBondContact O-CB 3.32Å; D189-E199 HydrophobicContact CB-CG 4.43Å; N190-E199 VanDerWaalsContact CG-OE1 3.25Å; N190-E199 PolarHBondContact ND2-OE1 3.45Å; T196-E199 WeakPolarHBondContact CB-OE2 3.48Å; T196-E199 WeakPolarHBondContact CG2-OE2 3.46Å; T196-E199 PolarHBondContact N-OE2 3.01Å; T196-E199 PolarHBondContact O-N 3.5Å; T196-E199 WeakPolarHBondContact OG1-CB 3.44Å; T196-E199 WeakPolarHBondContact OG1-CG 3.34Å; T196-E199 PolarHBondContact OG1-N 3.26Å; T196-E199 VanDerWaalsContact OG1-N 3.09Å; T196-E199 PolarHBondContact OG1-OE2 3.47Å; E199-M201 VanDerWaalsContact C-N 3.33Å; E199-M201 PolarHBondContact O-N 3.16Å; E199-A202 PolarHBondContact O-N 3.1Å; E199-A202 VanDerWaalsContact O-N 3.16Å; E199-K203 PolarHBondContact O-N 2.96Å
200	A	72	Confident	72	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-62.6	-42.5	178.1	0	0	0	0	0	111.5	L181 F187 V195 T196 L204	L181-A200 HydrophobicContact CD2-CB 3.28Å; L181-A200 HydrophobicContact CG-CB 3.8Å; F187-A200 HydrophobicContact CB-CB 4.2Å; F187-A200 HydrophobicContact CD2-CB 4.22Å; F187-A200 HydrophobicContact CG-CB 4.24Å; V195-A200 HydrophobicContact CG1-CB 3.85Å; T196-A200 PolarHBondContact O-N 3.33Å; T196-A200 VanDerWaalsContact O-N 3.12Å; A200-L204 WeakPolarHBondContact O-CB 3.24Å; A200-L204 WeakPolarHBondContact O-CG 3.42Å; A200-L204 PolarHBondContact O-N 2.79Å
201	M	68.1	Low	70.1	Confident	120 Å²	120	71.3 Å²	71.3	59%	0.591	40%	0.401	S	S	*	.	H	α-helix	trans	-65.6	-39.9	173.9	-74.5	-170.7	69.9	0	0	112.1	V197 E198 E199 L204 A205	V197-M201 HydrophobicContact CG1-CG 4.15Å; V197-M201 HydrophobicContact CG1-SD 3.89Å; V197-M201 VanDerWaalsContact O-CB 3.23Å; V197-M201 WeakPolarHBondContact O-CB 3.29Å; V197-M201 WeakPolarHBondContact O-CG 3.13Å; V197-M201 PolarHBondContact O-N 3.42Å; E198-M201 PolarHBondContact O-N 2.85Å; E199-M201 VanDerWaalsContact C-N 3.33Å; E199-M201 PolarHBondContact O-N 3.16Å; M201-L204 PolarHBondContact O-N 3.45Å; M201-A205 WeakPolarHBondContact O-CA 3.37Å; M201-A205 WeakPolarHBondContact O-CB 3.26Å; M201-A205 PolarHBondContact O-N 3Å
202	A	71.3	Confident	68.2	Low	50 Å²	50	72 Å²	72	41%	0.413	39%	0.388	S	S	.	.	H	α-helix	trans	-62.7	-45	178.3	0	0	0	0	0	111.4	E198 E199 A205 F206	E198-A202 WeakPolarHBondContact O-CB 3.22Å; E198-A202 PolarHBondContact O-N 3.03Å; E199-A202 PolarHBondContact O-N 3.1Å; E199-A202 VanDerWaalsContact O-N 3.16Å; A202-A205 PolarHBondContact O-N 3.01Å; A202-F206 VanDerWaalsContact O-CB 3.29Å; A202-F206 WeakPolarHBondContact O-CB 3.39Å; A202-F206 PolarHBondContact O-N 3.05Å
203	K	71.6	Confident	66.2	Low	73 Å²	73	75.1 Å²	75.1	32%	0.317	39%	0.394	S	S	.	.	H	α-helix	trans	-66.1	-42	176.4	-80.4	-73.1	-179.3	-176.3	0	113.3	I164 F187 D189 E199 A205	I164-K203 HydrophobicContact CD1-CD 4.22Å; F187-K203 HydrophobicContact CD1-CB 3.46Å; F187-K203 VanDerWaalsContact CD1-CB 3.46Å; F187-K203 HydrophobicContact CD1-CG 4.01Å; F187-K203 HydrophobicContact CE1-CB 3.95Å; D189-K203 WeakPolarHBondContact OD1-CE 3.35Å; D189-K203 VanDerWaalsContact OD1-CG 3.25Å; D189-K203 WeakPolarHBondContact OD1-CG 3.45Å; D189-K203 IonicContact OD1-NZ 2.6Å; D189-K203 WeakPolarHBondContact OD2-CE 3.45Å; D189-K203 IonicContact OD2-NZ 2.85Å; E199-K203 PolarHBondContact O-N 2.96Å; K203-A205 VanDerWaalsContact C-N 3.31Å
204	L	66.8	Low	64.3	Low	20 Å²	20	76.7 Å²	76.7	11%	0.105	39%	0.387	C	S	.	.	H	α-helix	trans	-65.4	-36.9	173.2	-66.8	174	0	0	0	111.1	Q168 L181 F187 A200 M201 L208	Q168-L204 HydrophobicContact CB-CD2 4.36Å; Q168-L204 HydrophobicContact CG-CD2 3.3Å; Q168-L204 PolarHBondContact NE2-O 2.83Å; L181-L204 HydrophobicContact CD1-CD1 3.83Å; L181-L204 HydrophobicContact CD2-CD1 4.35Å; F187-L204 HydrophobicContact CE1-CD2 4.1Å; F187-L204 HydrophobicContact CE1-CG 4.29Å; F187-L204 HydrophobicContact CZ-CD2 3.91Å; F187-L204 HydrophobicContact CZ-CG 4.31Å; A200-L204 WeakPolarHBondContact O-CB 3.24Å; A200-L204 WeakPolarHBondContact O-CG 3.42Å; A200-L204 PolarHBondContact O-N 2.79Å; M201-L204 PolarHBondContact O-N 3.45Å; L204-L208 WeakPolarHBondContact O-CB 3.46Å; L204-L208 VanDerWaalsContact O-CD1 3.31Å; L204-L208 WeakPolarHBondContact O-CD1 3.36Å; L204-L208 WeakPolarHBondContact O-CG 3.23Å; L204-L208 PolarHBondContact O-N 3.27Å
205	A	60.7	Low	62.3	Low	47 Å²	47	76.2 Å²	76.2	39%	0.388	38%	0.38	S	S	.	.	H	α-helix	trans	-76.6	-31.8	-178.8	0	0	0	0	0	113.4	M201 A202 K203 L208 F209	M201-A205 WeakPolarHBondContact O-CA 3.37Å; M201-A205 WeakPolarHBondContact O-CB 3.26Å; M201-A205 PolarHBondContact O-N 3Å; A202-A205 PolarHBondContact O-N 3.01Å; K203-A205 VanDerWaalsContact C-N 3.31Å; A205-L208 CarbonylContact O-C 3.59Å; A205-L208 VanDerWaalsContact O-C 3.24Å; A205-L208 WeakPolarHBondContact O-CA 3.42Å; A205-L208 WeakPolarHBondContact O-CB 3.42Å; A205-L208 PolarHBondContact O-N 3.47Å; A205-F209 PolarHBondContact O-N 2.79Å
206	F	52.8	Low	60.6	Low	168 Å²	168	77.8 Å²	77.8	74%	0.737	39%	0.388	S	S	*	.	H	α-helix	trans	-73.5	-38.3	-177.4	-168	-95.7	0	0	0	112.3	A202 L208 F209	A202-F206 VanDerWaalsContact O-CB 3.29Å; A202-F206 WeakPolarHBondContact O-CB 3.39Å; A202-F206 PolarHBondContact O-N 3.05Å; F206-L208 VanDerWaalsContact C-N 3.3Å; F206-F209 VanDerWaalsContact O-CB 3.24Å; F206-F209 WeakPolarHBondContact O-CB 3.39Å; F206-F209 PolarHBondContact O-N 2.89Å
207	S	52.4	Low	58.7	Low	53 Å²	53	82.2 Å²	82.2	37%	0.371	40%	0.404	S	S	.	.	H	α-helix	trans	-80	-18.5	169.2	80.3	0	0	0	0	112.4	Q168	Q168-S207 VanDerWaalsContact CD-OG 3.31Å; Q168-S207 PolarHBondContact NE2-OG 3.21Å; Q168-S207 PolarHBondContact OE1-OG 2.92Å
208	L	49	Very low	57.5	Low	63 Å²	63	83.5 Å²	83.5	33%	0.33	41%	0.405	S	S	.	.	H	α-helix	trans	-70.7	-13.1	159.3	-73.5	168.1	0	0	0	111.5	L204 A205 F206 D210 L211 Y212 M215	L204-L208 WeakPolarHBondContact O-CB 3.46Å; L204-L208 VanDerWaalsContact O-CD1 3.31Å; L204-L208 WeakPolarHBondContact O-CD1 3.36Å; L204-L208 WeakPolarHBondContact O-CG 3.23Å; L204-L208 PolarHBondContact O-N 3.27Å; A205-L208 CarbonylContact O-C 3.59Å; A205-L208 VanDerWaalsContact O-C 3.24Å; A205-L208 WeakPolarHBondContact O-CA 3.42Å; A205-L208 WeakPolarHBondContact O-CB 3.42Å; A205-L208 PolarHBondContact O-N 3.47Å; F206-L208 VanDerWaalsContact C-N 3.3Å; L208-D210 PolarHBondContact O-N 3.22Å; L208-L211 HydrophobicContact CB-CB 4.42Å; L208-L211 HydrophobicContact CD2-CB 3.8Å; L208-L211 HydrophobicContact CD2-CD2 3.48Å; L208-L211 VanDerWaalsContact CD2-CD2 3.48Å; L208-L211 HydrophobicContact CD2-CG 4.25Å; L208-L211 CarbonylContact O-C 3.38Å; L208-L211 VanDerWaalsContact O-CA 3.24Å; L208-L211 WeakPolarHBondContact O-CA 3.46Å; L208-L211 WeakPolarHBondContact O-CB 3.41Å; L208-L211 PolarHBondContact O-N 2.88Å; L208-Y212 WeakPolarHBondContact O-CA 3.45Å; L208-Y212 WeakPolarHBondContact O-CB 3.41Å; L208-Y212 PolarHBondContact O-N 3.12Å; L208-M215 HydrophobicContact CD2-SD 4.48Å
209	F	46.6	Very low	56.2	Low	109 Å²	109	78.8 Å²	78.8	48%	0.478	39%	0.387	S	S	.	.	H	α-helix	trans	-67.8	-34.7	-173.6	-132	-99.2	0	0	0	112.9	A205 F206 Y212 Y213	A205-F209 PolarHBondContact O-N 2.79Å; F206-F209 VanDerWaalsContact O-CB 3.24Å; F206-F209 WeakPolarHBondContact O-CB 3.39Å; F206-F209 PolarHBondContact O-N 2.89Å; F209-Y212 HydrophobicContact CD2-CD1 4.34Å; F209-Y212 HydrophobicContact CE2-CD1 4.24Å; F209-Y212 HydrophobicContact CE2-CE1 4.44Å; F209-Y212 HydrophobicContact CZ-CD1 4.49Å; F209-Y212 PolarHBondContact O-N 3.4Å; F209-Y213 HydrophobicContact CD1-CD2 4.25Å; F209-Y213 HydrophobicContact CD1-CE2 4.33Å; F209-Y213 HydrophobicContact CE1-CD2 4.35Å; F209-Y213 HydrophobicContact CE1-CE2 4.01Å; F209-Y213 PolarHBondContact O-N 3.07Å
210	D	52	Low	54.8	Low	139 Å²	139	86.3 Å²	86.3	74%	0.743	41%	0.414	S	S	*	.	H	α-helix	trans	-69.6	-41.1	166.3	-76.6	-36.4	0	0	0	111.2	L208 Y212 F214	L208-D210 PolarHBondContact O-N 3.22Å; D210-Y212 PolarHBondContact O-N 3.12Å; D210-F214 WeakPolarHBondContact O-CB 3.46Å; D210-F214 PolarHBondContact O-N 3.11Å
211	L	48.1	Very low	53.9	Low	46 Å²	46	90.5 Å²	90.5	24%	0.241	44%	0.435	C	S	.	.	H	α-helix	trans	-68.1	-14.9	172.2	-133	90.4	0	0	0	112.8	L208 M215	L208-L211 HydrophobicContact CB-CB 4.42Å; L208-L211 HydrophobicContact CD2-CB 3.8Å; L208-L211 HydrophobicContact CD2-CD2 3.48Å; L208-L211 VanDerWaalsContact CD2-CD2 3.48Å; L208-L211 HydrophobicContact CD2-CG 4.25Å; L208-L211 CarbonylContact O-C 3.38Å; L208-L211 VanDerWaalsContact O-CA 3.24Å; L208-L211 WeakPolarHBondContact O-CA 3.46Å; L208-L211 WeakPolarHBondContact O-CB 3.41Å; L208-L211 PolarHBondContact O-N 2.88Å; L211-M215 HydrophobicContact CD2-SD 3.97Å; L211-M215 HydrophobicContact CG-SD 4.46Å; L211-M215 VanDerWaalsContact O-CA 3.28Å; L211-M215 WeakPolarHBondContact O-CA 3.5Å; L211-M215 WeakPolarHBondContact O-CB 3.43Å; L211-M215 WeakPolarHBondContact O-CG 3.2Å; L211-M215 PolarHBondContact O-N 2.64Å
212	Y	44.5	Very low	53.2	Low	117 Å²	117	86 Å²	86	46%	0.459	42%	0.416	S	S	.	.	H	α-helix	trans	-108.5	-25.2	-167.8	176.7	-102.9	0	0	0	108.8	L208 F209 D210 I216	L208-Y212 WeakPolarHBondContact O-CA 3.45Å; L208-Y212 WeakPolarHBondContact O-CB 3.41Å; L208-Y212 PolarHBondContact O-N 3.12Å; F209-Y212 HydrophobicContact CD2-CD1 4.34Å; F209-Y212 HydrophobicContact CE2-CD1 4.24Å; F209-Y212 HydrophobicContact CE2-CE1 4.44Å; F209-Y212 HydrophobicContact CZ-CD1 4.49Å; F209-Y212 PolarHBondContact O-N 3.4Å; D210-Y212 PolarHBondContact O-N 3.12Å; Y212-I216 HydrophobicContact CD1-CD1 3.48Å; Y212-I216 VanDerWaalsContact CD1-CD1 3.48Å; Y212-I216 HydrophobicContact CD1-CG1 4.2Å; Y212-I216 HydrophobicContact CD2-CD1 4.3Å; Y212-I216 HydrophobicContact CD2-CG1 4.28Å; Y212-I216 HydrophobicContact CE1-CD1 3.1Å; Y212-I216 HydrophobicContact CE1-CG1 4.08Å; Y212-I216 HydrophobicContact CE2-CD1 3.99Å; Y212-I216 HydrophobicContact CE2-CG1 4.14Å; Y212-I216 HydrophobicContact CG-CD1 4.06Å; Y212-I216 HydrophobicContact CG-CG1 4.3Å; Y212-I216 VanDerWaalsContact O-CA 3.29Å; Y212-I216 WeakPolarHBondContact O-CA 3.5Å; Y212-I216 WeakPolarHBondContact O-CB 3.35Å; Y212-I216 WeakPolarHBondContact O-CD1 3.41Å; Y212-I216 WeakPolarHBondContact O-CG1 3.3Å; Y212-I216 PolarHBondContact O-N 3.47Å
213	Y	51.2	Low	52.4	Low	163 Å²	163	88.5 Å²	88.5	64%	0.639	42%	0.421	S	S	*	.	H	α-helix	trans	-73.5	-38.8	156.4	-98.3	-87.3	0	0	0	111.1	F209 I216 F217	F209-Y213 HydrophobicContact CD1-CD2 4.25Å; F209-Y213 HydrophobicContact CD1-CE2 4.33Å; F209-Y213 HydrophobicContact CE1-CD2 4.35Å; F209-Y213 HydrophobicContact CE1-CE2 4.01Å; F209-Y213 PolarHBondContact O-N 3.07Å; Y213-I216 PolarHBondContact O-N 2.9Å; Y213-F217 VanDerWaalsContact O-CB 3.25Å; Y213-F217 WeakPolarHBondContact O-CB 3.32Å; Y213-F217 PolarHBondContact O-N 2.86Å
214	F	49.5	Very low	51.7	Low	80 Å²	80	87.3 Å²	87.3	35%	0.351	43%	0.426	S	S	.	.	H	α-helix	trans	-66.4	-45.4	172.2	-160.7	-96	0	0	0	111.3	D210 F217 F218	D210-F214 WeakPolarHBondContact O-CB 3.46Å; D210-F214 PolarHBondContact O-N 3.11Å; F214-F217 PolarHBondContact O-N 3.37Å; F214-F218 HydrophobicContact CD1-CD2 4.18Å; F214-F218 AromaticContact CE1-CD2 3.99Å; F214-F218 HydrophobicContact CE1-CD2 3.99Å; F214-F218 AromaticContact CE1-CE2 3.99Å; F214-F218 HydrophobicContact CE1-CE2 3.99Å; F214-F218 HydrophobicContact CE2-CE2 4.08Å; F214-F218 HydrophobicContact CZ-CD2 4.2Å; F214-F218 AromaticContact CZ-CE2 3.74Å; F214-F218 HydrophobicContact CZ-CE2 3.74Å; F214-F218 WeakPolarHBondContact O-CD2 3.29Å; F214-F218 PolarHBondContact O-N 3.02Å
215	M	48.8	Very low	51.2	Low	83 Å²	83	89.2 Å²	89.2	41%	0.409	44%	0.435	S	S	.	.	H	α-helix	trans	-70.7	-33	171.6	-75.2	165.4	64.8	0	0	111.1	L208 L211 F217 C219	L208-M215 HydrophobicContact CD2-SD 4.48Å; L211-M215 HydrophobicContact CD2-SD 3.97Å; L211-M215 HydrophobicContact CG-SD 4.46Å; L211-M215 VanDerWaalsContact O-CA 3.28Å; L211-M215 WeakPolarHBondContact O-CA 3.5Å; L211-M215 WeakPolarHBondContact O-CB 3.43Å; L211-M215 WeakPolarHBondContact O-CG 3.2Å; L211-M215 PolarHBondContact O-N 2.64Å; M215-F217 VanDerWaalsContact C-N 3.31Å; M215-F217 PolarHBondContact O-N 2.92Å; M215-C219 HydrophobicContact CB-CB 4.47Å; M215-C219 WeakPolarHBondContact O-CA 3.26Å; M215-C219 WeakPolarHBondContact O-CB 3.45Å; M215-C219 PolarHBondContact O-N 3.49Å
216	I	49.3	Very low	51.1	Low	38 Å²	38	91.3 Å²	91.3	20%	0.195	44%	0.439	C	S	.	.	H	α-helix	trans	-69.1	-35.9	174.2	-81.5	171.4	0	0	0	109.6	Y212 Y213 R220	Y212-I216 HydrophobicContact CD1-CD1 3.48Å; Y212-I216 VanDerWaalsContact CD1-CD1 3.48Å; Y212-I216 HydrophobicContact CD1-CG1 4.2Å; Y212-I216 HydrophobicContact CD2-CD1 4.3Å; Y212-I216 HydrophobicContact CD2-CG1 4.28Å; Y212-I216 HydrophobicContact CE1-CD1 3.1Å; Y212-I216 HydrophobicContact CE1-CG1 4.08Å; Y212-I216 HydrophobicContact CE2-CD1 3.99Å; Y212-I216 HydrophobicContact CE2-CG1 4.14Å; Y212-I216 HydrophobicContact CG-CD1 4.06Å; Y212-I216 HydrophobicContact CG-CG1 4.3Å; Y212-I216 VanDerWaalsContact O-CA 3.29Å; Y212-I216 WeakPolarHBondContact O-CA 3.5Å; Y212-I216 WeakPolarHBondContact O-CB 3.35Å; Y212-I216 WeakPolarHBondContact O-CD1 3.41Å; Y212-I216 WeakPolarHBondContact O-CG1 3.3Å; Y212-I216 PolarHBondContact O-N 3.47Å; Y213-I216 PolarHBondContact O-N 2.9Å; I216-R220 VanDerWaalsContact CG2-CD 3.5Å; I216-R220 HydrophobicContact CG2-CG 3.8Å; I216-R220 WeakPolarHBondContact O-CA 3.46Å; I216-R220 WeakPolarHBondContact O-CB 3.28Å; I216-R220 WeakPolarHBondContact O-CG 3.36Å; I216-R220 PolarHBondContact O-N 2.86Å
217	F	46.4	Very low	51.4	Low	141 Å²	141	85.7 Å²	85.7	62%	0.618	42%	0.423	S	S	*	.	H	α-helix	trans	-65.3	-46.9	177.5	-170.3	-99.6	0	0	0	111.4	Y213 F214 M215	Y213-F217 VanDerWaalsContact O-CB 3.25Å; Y213-F217 WeakPolarHBondContact O-CB 3.32Å; Y213-F217 PolarHBondContact O-N 2.86Å; F214-F217 PolarHBondContact O-N 3.37Å; M215-F217 VanDerWaalsContact C-N 3.31Å; M215-F217 PolarHBondContact O-N 2.92Å
218	F	50.1	Low	51.7	Low	81 Å²	81	90 Å²	90	36%	0.355	44%	0.435	S	S	.	.	H	α-helix	trans	-83.6	-38	179.4	-80.8	-81.9	0	0	0	114	F214 I221 C222	F214-F218 HydrophobicContact CD1-CD2 4.18Å; F214-F218 AromaticContact CE1-CD2 3.99Å; F214-F218 HydrophobicContact CE1-CD2 3.99Å; F214-F218 AromaticContact CE1-CE2 3.99Å; F214-F218 HydrophobicContact CE1-CE2 3.99Å; F214-F218 HydrophobicContact CE2-CE2 4.08Å; F214-F218 HydrophobicContact CZ-CD2 4.2Å; F214-F218 AromaticContact CZ-CE2 3.74Å; F214-F218 HydrophobicContact CZ-CE2 3.74Å; F214-F218 WeakPolarHBondContact O-CD2 3.29Å; F214-F218 PolarHBondContact O-N 3.02Å; F218-I221 WeakPolarHBondContact O-CB 3.11Å; F218-I221 PolarHBondContact O-N 3.29Å; F218-C222 PolarHBondContact O-N 3Å; F218-C222 PolarHBondContact O-SG 3.24Å
219	C	50.7	Low	52	Low	40 Å²	40	88.2 Å²	88.2	27%	0.27	43%	0.426	S	S	.	.	H	α-helix	trans	-81.1	-16.3	177.2	-145.3	0	0	0	0	112	M215 I221 L223	M215-C219 HydrophobicContact CB-CB 4.47Å; M215-C219 WeakPolarHBondContact O-CA 3.26Å; M215-C219 WeakPolarHBondContact O-CB 3.45Å; M215-C219 PolarHBondContact O-N 3.49Å; C219-I221 VanDerWaalsContact C-N 3.29Å; C219-L223 HydrophobicContact CB-CD1 4.03Å; C219-L223 HydrophobicContact CB-CG 4.43Å; C219-L223 VanDerWaalsContact O-CA 3.29Å; C219-L223 WeakPolarHBondContact O-CA 3.42Å; C219-L223 WeakPolarHBondContact O-CB 3.21Å; C219-L223 WeakPolarHBondContact O-CG 3.41Å; C219-L223 PolarHBondContact O-N 3.31Å; C219-L223 WeakPolarHBondContact SG-CD1 3.48Å; C219-L223 WeakPolarHBondContact SG-CG 3.25Å
220	R	49	Very low	52.6	Low	181 Å²	181	86.8 Å²	86.8	68%	0.683	43%	0.427	S	S	*	.	H	α-helix	trans	-67.9	-33.9	162.1	-83	179.3	169.2	177.3	-0	111.1	I216 A224	I216-R220 VanDerWaalsContact CG2-CD 3.5Å; I216-R220 HydrophobicContact CG2-CG 3.8Å; I216-R220 WeakPolarHBondContact O-CA 3.46Å; I216-R220 WeakPolarHBondContact O-CB 3.28Å; I216-R220 WeakPolarHBondContact O-CG 3.36Å; I216-R220 PolarHBondContact O-N 2.86Å; R220-A224 WeakPolarHBondContact O-CB 3.27Å; R220-A224 PolarHBondContact O-N 3.21Å
221	I	53.4	Low	52.9	Low	88 Å²	88	86.9 Å²	86.9	45%	0.451	42%	0.422	S	S	.	.	H	α-helix	trans	-70.5	-48.6	174.4	-61	169.9	0	0	0	109.1	F218 C219 M225	F218-I221 WeakPolarHBondContact O-CB 3.11Å; F218-I221 PolarHBondContact O-N 3.29Å; C219-I221 VanDerWaalsContact C-N 3.29Å; I221-M225 HydrophobicContact CG2-CE 4.22Å; I221-M225 WeakPolarHBondContact O-CG 3.32Å; I221-M225 PolarHBondContact O-N 3.46Å; I221-M225 VanDerWaalsContact O-N 3.16Å
222	C	52.6	Low	53.2	Low	26 Å²	26	85.6 Å²	85.6	18%	0.176	42%	0.415	C	S	.	.	H	α-helix	trans	-75.3	-39.9	-178.6	-63.6	0	0	0	0	114.9	F218 M225 L226	F218-C222 PolarHBondContact O-N 3Å; F218-C222 PolarHBondContact O-SG 3.24Å; C222-M225 PolarHBondContact O-N 2.95Å; C222-L226 VanDerWaalsContact O-CB 3.31Å; C222-L226 WeakPolarHBondContact O-CB 3.48Å; C222-L226 WeakPolarHBondContact O-CG 2.92Å; C222-L226 PolarHBondContact O-N 3.14Å
223	L	55.6	Low	53.7	Low	102 Å²	102	83.7 Å²	83.7	53%	0.534	41%	0.41	S	S	.	.	H	α-helix	trans	-74.3	-31.6	173.5	-70.3	158.6	0	0	0	111.9	C219 M225 L226 A227	C219-L223 HydrophobicContact CB-CD1 4.03Å; C219-L223 HydrophobicContact CB-CG 4.43Å; C219-L223 VanDerWaalsContact O-CA 3.29Å; C219-L223 WeakPolarHBondContact O-CA 3.42Å; C219-L223 WeakPolarHBondContact O-CB 3.21Å; C219-L223 WeakPolarHBondContact O-CG 3.41Å; C219-L223 PolarHBondContact O-N 3.31Å; C219-L223 WeakPolarHBondContact SG-CD1 3.48Å; C219-L223 WeakPolarHBondContact SG-CG 3.25Å; L223-M225 VanDerWaalsContact C-N 3.26Å; L223-M225 PolarHBondContact O-N 3.24Å; L223-L226 PolarHBondContact O-N 3.39Å; L223-A227 WeakPolarHBondContact O-CA 3.05Å; L223-A227 WeakPolarHBondContact O-CB 3.49Å; L223-A227 PolarHBondContact O-N 2.99Å
224	A	55.8	Low	53.8	Low	49 Å²	49	81.8 Å²	81.8	41%	0.405	41%	0.41	S	S	.	.	H	α-helix	trans	-65.8	-35.3	170.9	0	0	0	0	0	110.8	R220 K228	R220-A224 WeakPolarHBondContact O-CB 3.27Å; R220-A224 PolarHBondContact O-N 3.21Å; A224-K228 VanDerWaalsContact O-CB 3.27Å; A224-K228 WeakPolarHBondContact O-CB 3.31Å; A224-K228 VanDerWaalsContact O-CG 3.25Å; A224-K228 WeakPolarHBondContact O-CG 3.41Å; A224-K228 PolarHBondContact O-N 3.47Å; A224-K228 VanDerWaalsContact O-N 3.15Å
225	M	57.2	Low	53.8	Low	60 Å²	60	79.4 Å²	79.4	30%	0.296	40%	0.403	S	S	.	.	H	α-helix	trans	-70.1	-47	172.2	-74.5	-152.8	-85.8	0	0	112.3	I221 C222 L223 K228 L229 I265	I221-M225 HydrophobicContact CG2-CE 4.22Å; I221-M225 WeakPolarHBondContact O-CG 3.32Å; I221-M225 PolarHBondContact O-N 3.46Å; I221-M225 VanDerWaalsContact O-N 3.16Å; C222-M225 PolarHBondContact O-N 2.95Å; L223-M225 VanDerWaalsContact C-N 3.26Å; L223-M225 PolarHBondContact O-N 3.24Å; M225-K228 PolarHBondContact O-N 2.77Å; M225-L229 WeakPolarHBondContact O-CB 3.44Å; M225-L229 VanDerWaalsContact O-CD1 3.32Å; M225-L229 WeakPolarHBondContact O-CD1 3.39Å; M225-L229 WeakPolarHBondContact O-CG 3.37Å; M225-L229 PolarHBondContact O-N 2.65Å; M225-I265 HydrophobicContact CE-CG1 4.2Å; M225-I265 HydrophobicContact SD-CD1 4.09Å; M225-I265 HydrophobicContact SD-CG1 4.25Å
226	L	57.8	Low	53.9	Low	90 Å²	90	79.3 Å²	79.3	47%	0.471	40%	0.403	S	S	.	.	H	α-helix	trans	-70	-35.4	179.8	-78.9	164.1	0	0	0	113.6	C222 L223 L229 T230	C222-L226 VanDerWaalsContact O-CB 3.31Å; C222-L226 WeakPolarHBondContact O-CB 3.48Å; C222-L226 WeakPolarHBondContact O-CG 2.92Å; C222-L226 PolarHBondContact O-N 3.14Å; L223-L226 PolarHBondContact O-N 3.39Å; L226-L229 WeakPolarHBondContact O-CB 3.3Å; L226-L229 PolarHBondContact O-N 2.84Å; L226-T230 WeakPolarHBondContact O-CB 3.35Å; L226-T230 PolarHBondContact O-N 3.42Å; L226-T230 PolarHBondContact O-OG1 3.43Å
227	A	59.7	Low	54	Low	50 Å²	50	85.8 Å²	85.8	41%	0.413	43%	0.429	S	S	.	.	H	α-helix	trans	-70.2	-41.9	174.4	0	0	0	0	0	110.9	L223 L229 T230 Q231	L223-A227 WeakPolarHBondContact O-CA 3.05Å; L223-A227 WeakPolarHBondContact O-CB 3.49Å; L223-A227 PolarHBondContact O-N 2.99Å; A227-L229 VanDerWaalsContact C-N 3.29Å; A227-L229 PolarHBondContact O-N 2.96Å; A227-T230 WeakPolarHBondContact CA-OG1 3.1Å; A227-T230 PolarHBondContact O-N 2.95Å; A227-T230 PolarHBondContact O-OG1 2.87Å; A227-Q231 WeakPolarHBondContact O-CB 3.43Å; A227-Q231 PolarHBondContact O-N 3.08Å
228	K	57.9	Low	53.7	Low	144 Å²	144	82.8 Å²	82.8	63%	0.626	43%	0.425	S	S	*	.	H	α-helix	trans	-60.6	-40.2	170.8	-81	177.1	176.9	178.8	0	111.5	A224 M225 M232	A224-K228 VanDerWaalsContact O-CB 3.27Å; A224-K228 WeakPolarHBondContact O-CB 3.31Å; A224-K228 VanDerWaalsContact O-CG 3.25Å; A224-K228 WeakPolarHBondContact O-CG 3.41Å; A224-K228 PolarHBondContact O-N 3.47Å; A224-K228 VanDerWaalsContact O-N 3.15Å; M225-K228 PolarHBondContact O-N 2.77Å; K228-M232 VanDerWaalsContact O-CB 3.3Å; K228-M232 WeakPolarHBondContact O-CB 3.3Å; K228-M232 WeakPolarHBondContact O-CG 3.45Å; K228-M232 PolarHBondContact O-N 2.87Å
229	L	56.6	Low	53.4	Low	26 Å²	26	82.8 Å²	82.8	14%	0.136	45%	0.448	C	S	.	.	H	α-helix	trans	-65.8	-48.1	176.2	-88.7	155.9	0	0	0	113.9	M225 L226 A227 M232 F233 Y255 I258	M225-L229 WeakPolarHBondContact O-CB 3.44Å; M225-L229 VanDerWaalsContact O-CD1 3.32Å; M225-L229 WeakPolarHBondContact O-CD1 3.39Å; M225-L229 WeakPolarHBondContact O-CG 3.37Å; M225-L229 PolarHBondContact O-N 2.65Å; L226-L229 WeakPolarHBondContact O-CB 3.3Å; L226-L229 PolarHBondContact O-N 2.84Å; A227-L229 VanDerWaalsContact C-N 3.29Å; A227-L229 PolarHBondContact O-N 2.96Å; L229-M232 PolarHBondContact O-N 2.82Å; L229-F233 WeakPolarHBondContact O-CB 3.44Å; L229-F233 PolarHBondContact O-N 2.86Å; L229-Y255 HydrophobicContact CD2-CD2 4.5Å; L229-I258 HydrophobicContact CD1-CB 4.49Å; L229-I258 HydrophobicContact CD1-CD1 4.31Å; L229-I258 HydrophobicContact CD1-CG1 4.3Å; L229-I258 HydrophobicContact CD1-CG2 3.58Å; L229-I258 HydrophobicContact CD2-CB 3.83Å; L229-I258 HydrophobicContact CD2-CD1 3.47Å; L229-I258 VanDerWaalsContact CD2-CD1 3.47Å; L229-I258 HydrophobicContact CD2-CG1 3.97Å; L229-I258 HydrophobicContact CD2-CG2 3.47Å; L229-I258 VanDerWaalsContact CD2-CG2 3.47Å; L229-I258 HydrophobicContact CG-CB 4.38Å; L229-I258 HydrophobicContact CG-CD1 3.57Å; L229-I258 HydrophobicContact CG-CG1 4.07Å; L229-I258 HydrophobicContact CG-CG2 3.91Å
230	T	57.8	Low	53.2	Low	79 Å²	79	88.4 Å²	88.4	49%	0.485	47%	0.468	S	S	.	.	H	α-helix	trans	-69.8	-37.9	179.4	34.9	0	0	0	0	111.3	L226 A227 F233 L234	L226-T230 WeakPolarHBondContact O-CB 3.35Å; L226-T230 PolarHBondContact O-N 3.42Å; L226-T230 PolarHBondContact O-OG1 3.43Å; A227-T230 WeakPolarHBondContact CA-OG1 3.1Å; A227-T230 PolarHBondContact O-N 2.95Å; A227-T230 PolarHBondContact O-OG1 2.87Å; T230-F233 PolarHBondContact O-N 2.62Å; T230-L234 VanDerWaalsContact O-CB 3.27Å; T230-L234 WeakPolarHBondContact O-CB 2.88Å; T230-L234 WeakPolarHBondContact O-CD1 3.31Å; T230-L234 WeakPolarHBondContact O-CG 3.36Å; T230-L234 PolarHBondContact O-N 2.87Å
231	Q	58.3	Low	52.9	Low	140 Å²	140	89.1 Å²	89.1	65%	0.654	48%	0.479	S	S	*	.	H	α-helix	trans	-63.9	-41.8	173.6	-165.8	175.3	9	0	0	111.2	A227 S235	A227-Q231 WeakPolarHBondContact O-CB 3.43Å; A227-Q231 PolarHBondContact O-N 3.08Å; Q231-S235 WeakPolarHBondContact O-CB 3.46Å; Q231-S235 PolarHBondContact O-N 3.02Å; Q231-S235 PolarHBondContact O-OG 3.2Å; Q231-S235 VanDerWaalsContact O-OG 3.08Å
232	M	54.4	Low	52.7	Low	19 Å²	19	87.4 Å²	87.4	9%	0.094	47%	0.47	C	S	.	.	H	α-helix	trans	-64.4	-39.8	171.6	-90.5	164.9	47.8	0	0	113.4	K228 L229 S235 M236 A251 K254 Y255 I258	K228-M232 VanDerWaalsContact O-CB 3.3Å; K228-M232 WeakPolarHBondContact O-CB 3.3Å; K228-M232 WeakPolarHBondContact O-CG 3.45Å; K228-M232 PolarHBondContact O-N 2.87Å; L229-M232 PolarHBondContact O-N 2.82Å; M232-S235 WeakPolarHBondContact CA-OG 3.45Å; M232-S235 PolarHBondContact O-OG 2.89Å; M232-M236 WeakPolarHBondContact O-CB 3.29Å; M232-M236 VanDerWaalsContact O-CG 3.32Å; M232-M236 WeakPolarHBondContact O-CG 3.29Å; M232-M236 PolarHBondContact O-N 2.84Å; M232-A251 WeakPolarHBondContact CE-O 3.31Å; M232-K254 VanDerWaalsContact CE-C 3.45Å; M232-K254 HydrophobicContact CE-CB 3.51Å; M232-K254 HydrophobicContact SD-CB 3.51Å; M232-K254 VanDerWaalsContact SD-CB 3.51Å; M232-K254 HydrophobicContact SD-CD 4.03Å; M232-K254 HydrophobicContact SD-CG 4.42Å; M232-Y255 HydrophobicContact CE-CD2 4.4Å; M232-Y255 HydrophobicContact CE-CG 4.5Å; M232-I258 HydrophobicContact CE-CD1 4.01Å
233	F	54.7	Low	52.5	Low	78 Å²	78	89.9 Å²	89.9	34%	0.342	49%	0.488	S	S	.	.	H	α-helix	trans	-70	-39.7	178.6	-117.8	-72.1	0	0	0	112.4	L229 T230 M236 K237 Y255	L229-F233 WeakPolarHBondContact O-CB 3.44Å; L229-F233 PolarHBondContact O-N 2.86Å; T230-F233 PolarHBondContact O-N 2.62Å; F233-M236 HydrophobicContact CD1-CE 4.36Å; F233-M236 HydrophobicContact CG-CE 4.37Å; F233-M236 PolarHBondContact O-N 3.37Å; F233-K237 HydrophobicContact CD1-CD 4.47Å; F233-K237 WeakPolarHBondContact O-CB 3.3Å; F233-K237 PolarHBondContact O-N 2.9Å; F233-Y255 HydrophobicContact CD2-CD2 4.42Å; F233-Y255 AromaticContact CD2-CE2 3.8Å; F233-Y255 HydrophobicContact CD2-CE2 3.8Å; F233-Y255 HydrophobicContact CE2-CD2 4.22Å; F233-Y255 AromaticContact CE2-CE2 3.22Å; F233-Y255 HydrophobicContact CE2-CE2 3.22Å; F233-Y255 AromaticContact CE2-CZ 3.64Å; F233-Y255 WeakPolarHBondContact CE2-OH 3.28Å; F233-Y255 AromaticContact CZ-CE2 3.86Å; F233-Y255 HydrophobicContact CZ-CE2 3.86Å; F233-Y255 AromaticContact CZ-CZ 3.79Å; F233-Y255 VanDerWaalsContact CZ-OH 3.29Å; F233-Y255 WeakPolarHBondContact CZ-OH 3.21Å
234	L	54.3	Low	52.2	Low	123 Å²	123	90.6 Å²	90.6	64%	0.644	50%	0.501	S	S	*	.	H	α-helix	trans	-67.3	-39.4	176	-80.8	157.7	0	0	0	111	T230 K237 C238	T230-L234 VanDerWaalsContact O-CB 3.27Å; T230-L234 WeakPolarHBondContact O-CB 2.88Å; T230-L234 WeakPolarHBondContact O-CD1 3.31Å; T230-L234 WeakPolarHBondContact O-CG 3.36Å; T230-L234 PolarHBondContact O-N 2.87Å; L234-K237 PolarHBondContact O-N 3.21Å; L234-C238 WeakPolarHBondContact O-CB 3.46Å; L234-C238 PolarHBondContact O-N 3.45Å; L234-C238 VanDerWaalsContact O-N 3.13Å
235	S	50	Low	52.3	Low	30 Å²	30	94.5 Å²	94.5	21%	0.21	52%	0.515	C	S	.	.	H	α-helix	trans	-69.6	-34.3	175.1	64.3	0	0	0	0	112.8	Q231 M232 L242	Q231-S235 WeakPolarHBondContact O-CB 3.46Å; Q231-S235 PolarHBondContact O-N 3.02Å; Q231-S235 PolarHBondContact O-OG 3.2Å; Q231-S235 VanDerWaalsContact O-OG 3.08Å; M232-S235 WeakPolarHBondContact CA-OG 3.45Å; M232-S235 PolarHBondContact O-OG 2.89Å; S235-L242 VanDerWaalsContact CB-CD1 3.44Å; S235-L242 WeakPolarHBondContact OG-CD1 3.39Å
236	M	49.9	Very low	52.5	Low	81 Å²	81	94.5 Å²	94.5	40%	0.399	52%	0.516	S	S	.	.	H	α-helix	trans	-71.6	-33.8	174.1	-76.4	-169.4	-49.1	0	0	113.6	M232 F233 Y255	M232-M236 WeakPolarHBondContact O-CB 3.29Å; M232-M236 VanDerWaalsContact O-CG 3.32Å; M232-M236 WeakPolarHBondContact O-CG 3.29Å; M232-M236 PolarHBondContact O-N 2.84Å; F233-M236 HydrophobicContact CD1-CE 4.36Å; F233-M236 HydrophobicContact CG-CE 4.37Å; F233-M236 PolarHBondContact O-N 3.37Å; M236-Y255 HydrophobicContact CE-CD1 4.32Å; M236-Y255 HydrophobicContact CE-CD2 4.11Å; M236-Y255 HydrophobicContact CE-CE2 4.45Å; M236-Y255 HydrophobicContact CE-CG 4.05Å
237	K	51.8	Low	53.1	Low	174 Å²	174	93.7 Å²	93.7	76%	0.757	52%	0.515	S	S	*	.	H	α-helix	trans	-85.5	-17.8	-178.8	-79.6	-171.4	175	-178.6	0	114.6	F233 L234	F233-K237 HydrophobicContact CD1-CD 4.47Å; F233-K237 WeakPolarHBondContact O-CB 3.3Å; F233-K237 PolarHBondContact O-N 2.9Å; L234-K237 PolarHBondContact O-N 3.21Å
238	C	39.1	Very low	53.5	Low	77 Å²	77	94.5 Å²	94.5	52%	0.52	52%	0.521	S	S	.	.	H	α-helix	trans	-103	-5.1	-171.3	-147.6	0	0	0	0	114.9	L234 K240	L234-C238 WeakPolarHBondContact O-CB 3.46Å; L234-C238 PolarHBondContact O-N 3.45Å; L234-C238 VanDerWaalsContact O-N 3.13Å; C238-K240 PolarHBondContact O-N 2.9Å
239	G	45.7	Very low	54.3	Low	81 Å²	81	92 Å²	92	84%	0.835	52%	0.515	S	S	*	.			trans	54.3	15.8	179	0	0	0	0	0	114.3
240	K	44.8	Very low	55.1	Low	159 Å²	159	95 Å²	95	69%	0.691	53%	0.528	S	S	*	.			trans	-96.3	132	178.9	-78.2	-177	178.6	-178.8	0	107.3	C238 L242	C238-K240 PolarHBondContact O-N 2.9Å; K240-L242 PolarHBondContact O-N 3.34Å
241	E	43.9	Very low	55.2	Low	196 Å²	196	91.5 Å²	91.5	92%	0.916	51%	0.507	S	S	*	.			trans	-35.4	109.2	-179.9	-75.1	173.8	147.9	0	0	111	S243	E241-S243 PolarHBondContact O-N 2.97Å
242	L	47.8	Very low	55.8	Low	52 Å²	52	91.6 Å²	91.6	27%	0.272	50%	0.502	S	S	.	.			trans	-52.9	130.7	160.2	-162.8	63.7	0	0	0	105.4	S235 K240 S244 I246 A251	S235-L242 VanDerWaalsContact CB-CD1 3.44Å; S235-L242 WeakPolarHBondContact OG-CD1 3.39Å; K240-L242 PolarHBondContact O-N 3.34Å; L242-S244 PolarHBondContact O-N 3.26Å; L242-I246 HydrophobicContact CD2-CB 3.73Å; L242-I246 HydrophobicContact CD2-CG2 3.68Å; L242-I246 WeakPolarHBondContact CD2-O 3.23Å; L242-I246 HydrophobicContact CG-CB 4.06Å; L242-I246 HydrophobicContact CG-CG2 4.48Å; L242-A251 HydrophobicContact CD2-CB 3.89Å
243	S	48.5	Very low	56.8	Low	77 Å²	77	96 Å²	96	54%	0.538	53%	0.526	S	S	.	.			trans	-38.3	133.8	175.6	55.3	0	0	0	0	109.4	E241 D245 I246	E241-S243 PolarHBondContact O-N 2.97Å; S243-D245 PolarHBondContact O-N 3.41Å; S243-I246 PolarHBondContact O-N 3.48Å
244	S	49.7	Very low	57.6	Low	117 Å²	117	96.7 Å²	96.7	82%	0.818	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-4.9	-167.2	52.7	0	0	0	0	117.9	L242	L242-S244 PolarHBondContact O-N 3.26Å
245	D	58	Low	58.2	Low	132 Å²	132	93.6 Å²	93.6	71%	0.706	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	5.4	-167.6	-53.2	-15.2	0	0	0	113	S243	S243-D245 PolarHBondContact O-N 3.41Å
246	I	62	Low	59.4	Low	59 Å²	59	96.7 Å²	96.7	30%	0.303	52%	0.52	S	S	.	.			trans	-130.1	124	173.7	-54.2	176.7	0	0	0	109.5	L242 S243 E250 A251	L242-I246 HydrophobicContact CD2-CB 3.73Å; L242-I246 HydrophobicContact CD2-CG2 3.68Å; L242-I246 WeakPolarHBondContact CD2-O 3.23Å; L242-I246 HydrophobicContact CG-CB 4.06Å; L242-I246 HydrophobicContact CG-CG2 4.48Å; S243-I246 PolarHBondContact O-N 3.48Å; I246-E250 WeakPolarHBondContact CA-OE2 3.42Å; I246-E250 HydrophobicContact CG2-CB 3.71Å; I246-A251 HydrophobicContact CG2-CB 4.44Å
247	T	70.6	Confident	60.6	Low	73 Å²	73	98.3 Å²	98.3	45%	0.448	53%	0.526	S	S	.	.			trans	-74.4	153.2	174.5	61.2	0	0	0	0	111.1	D249 E250 A251	T247-D249 PolarHBondContact O-N 3.44Å; T247-D249 VanDerWaalsContact O-N 3.15Å; T247-E250 PolarHBondContact N-OE2 3.48Å; T247-E250 PolarHBondContact O-N 2.85Å; T247-E250 WeakPolarHBondContact OG1-CB 3.37Å; T247-E250 WeakPolarHBondContact OG1-CG 3.2Å; T247-E250 PolarHBondContact OG1-N 2.04Å; T247-E250 VanDerWaalsContact OG1-N 3.15Å; T247-E250 PolarHBondContact OG1-OE2 2.91Å; T247-E250 VanDerWaalsContact OG1-OE2 3.08Å; T247-A251 PolarHBondContact O-N 3.32Å
248	A	67.9	Low	61.1	Low	67 Å²	67	91.8 Å²	91.8	55%	0.554	50%	0.499	S	S	*	.	H	α-helix	trans	-59.7	-23.8	174.4	0	0	0	0	0	113	R252	A248-R252 PolarHBondContact O-N 2.9Å; A248-R252 PolarHBondContact O-NE 2.97Å
249	D	74.3	Confident	62.8	Low	91 Å²	91	91.4 Å²	91.4	49%	0.487	49%	0.492	S	S	.	.	H	α-helix	trans	-73.9	-44.1	172.6	-69.1	-41.3	0	0	0	111.5	T247 A251 R252 N253	T247-D249 PolarHBondContact O-N 3.44Å; T247-D249 VanDerWaalsContact O-N 3.15Å; D249-A251 VanDerWaalsContact C-N 3.34Å; D249-A251 PolarHBondContact O-N 3.41Å; D249-R252 PolarHBondContact O-N 2.76Å; D249-R252 IonicContact OD1-CZ 3.47Å; D249-R252 VanDerWaalsContact OD1-CZ 3.26Å; D249-R252 IonicContact OD1-NE 3.96Å; D249-R252 IonicContact OD1-NH1 3.93Å; D249-R252 IonicContact OD1-NH2 2.77Å; D249-R252 PolarHBondContact OD1-NH2 3.39Å; D249-N253 WeakPolarHBondContact O-CB 3.37Å; D249-N253 VanDerWaalsContact O-CG 3.24Å; D249-N253 PolarHBondContact O-N 3.12Å; D249-N253 PolarHBondContact O-ND2 2.87Å
250	E	73.1	Confident	64.3	Low	91 Å²	91	92.7 Å²	92.7	43%	0.425	48%	0.479	S	S	.	.	H	α-helix	trans	-62.5	-38.5	175.3	-77.1	167	151.6	0	0	112.9	I246 T247 N253 K254	I246-E250 WeakPolarHBondContact CA-OE2 3.42Å; I246-E250 HydrophobicContact CG2-CB 3.71Å; T247-E250 PolarHBondContact N-OE2 3.48Å; T247-E250 PolarHBondContact O-N 2.85Å; T247-E250 WeakPolarHBondContact OG1-CB 3.37Å; T247-E250 WeakPolarHBondContact OG1-CG 3.2Å; T247-E250 PolarHBondContact OG1-N 2.04Å; T247-E250 VanDerWaalsContact OG1-N 3.15Å; T247-E250 PolarHBondContact OG1-OE2 2.91Å; T247-E250 VanDerWaalsContact OG1-OE2 3.08Å; E250-N253 PolarHBondContact O-N 3.49Å; E250-K254 WeakPolarHBondContact O-CG 3.5Å; E250-K254 PolarHBondContact O-N 2.87Å
251	A	59.6	Low	65.7	Low	5 Å²	5	88.6 Å²	88.6	4%	0.041	47%	0.465	C	S	.	.	H	α-helix	trans	-64	-41.9	174.5	0	0	0	0	0	111.9	M232 L242 I246 T247 D249 Y255	M232-A251 WeakPolarHBondContact CE-O 3.31Å; L242-A251 HydrophobicContact CD2-CB 3.89Å; I246-A251 HydrophobicContact CG2-CB 4.44Å; T247-A251 PolarHBondContact O-N 3.32Å; D249-A251 VanDerWaalsContact C-N 3.34Å; D249-A251 PolarHBondContact O-N 3.41Å; A251-Y255 WeakPolarHBondContact O-CB 3.42Å; A251-Y255 PolarHBondContact O-N 2.98Å
252	R	72	Confident	67.1	Low	141 Å²	141	84.4 Å²	84.4	53%	0.532	44%	0.444	S	S	.	.	H	α-helix	trans	-65.7	-42.6	175.7	-84.5	-177.4	-77.4	159.6	-6.1	112.1	A248 D249 Y255 Q256	A248-R252 PolarHBondContact O-N 2.9Å; A248-R252 PolarHBondContact O-NE 2.97Å; D249-R252 PolarHBondContact O-N 2.76Å; D249-R252 IonicContact OD1-CZ 3.47Å; D249-R252 VanDerWaalsContact OD1-CZ 3.26Å; D249-R252 IonicContact OD1-NE 3.96Å; D249-R252 IonicContact OD1-NH1 3.93Å; D249-R252 IonicContact OD1-NH2 2.77Å; D249-R252 PolarHBondContact OD1-NH2 3.39Å; R252-Y255 PolarHBondContact O-N 2.82Å; R252-Y255 VanDerWaalsContact O-N 3.16Å; R252-Q256 WeakPolarHBondContact O-CB 2.76Å; R252-Q256 PolarHBondContact O-N 3.31Å
253	N	75	Confident	68.2	Low	112 Å²	112	85.8 Å²	85.8	60%	0.599	46%	0.458	S	S	*	.	H	α-helix	trans	-62.3	-44.4	178.5	-71.3	-16	0	0	0	111.6	D249 E250 Y255 Q256 E257	D249-N253 WeakPolarHBondContact O-CB 3.37Å; D249-N253 VanDerWaalsContact O-CG 3.24Å; D249-N253 PolarHBondContact O-N 3.12Å; D249-N253 PolarHBondContact O-ND2 2.87Å; E250-N253 PolarHBondContact O-N 3.49Å; N253-Y255 VanDerWaalsContact C-N 3.3Å; N253-Y255 PolarHBondContact O-N 2.58Å; N253-Q256 PolarHBondContact O-N 2.9Å; N253-E257 WeakPolarHBondContact O-CB 3.19Å; N253-E257 PolarHBondContact O-N 3.09Å
254	K	71.6	Confident	69.2	Low	93 Å²	93	85.4 Å²	85.4	40%	0.404	45%	0.453	S	S	.	.	H	α-helix	trans	-62.6	-37.7	173.8	-74.2	176.2	178.9	169	0	112.2	M232 E250 Q256 E257 I258	M232-K254 VanDerWaalsContact CE-C 3.45Å; M232-K254 HydrophobicContact CE-CB 3.51Å; M232-K254 HydrophobicContact SD-CB 3.51Å; M232-K254 VanDerWaalsContact SD-CB 3.51Å; M232-K254 HydrophobicContact SD-CD 4.03Å; M232-K254 HydrophobicContact SD-CG 4.42Å; E250-K254 WeakPolarHBondContact O-CG 3.5Å; E250-K254 PolarHBondContact O-N 2.87Å; K254-Q256 VanDerWaalsContact C-N 3.35Å; K254-E257 PolarHBondContact O-N 2.83Å; K254-I258 WeakPolarHBondContact O-CD1 3.27Å; K254-I258 WeakPolarHBondContact O-CG1 3.32Å; K254-I258 PolarHBondContact O-N 3.34Å
255	Y	66.7	Low	69.6	Low	58 Å²	58	81.2 Å²	81.2	23%	0.227	42%	0.42	C	S	.	.	H	α-helix	trans	-67.2	-42.5	-179.8	-179.1	-112.7	0	0	0	110.7	L229 M232 F233 M236 A251 R252 N253 I258 L259	L229-Y255 HydrophobicContact CD2-CD2 4.5Å; M232-Y255 HydrophobicContact CE-CD2 4.4Å; M232-Y255 HydrophobicContact CE-CG 4.5Å; F233-Y255 HydrophobicContact CD2-CD2 4.42Å; F233-Y255 AromaticContact CD2-CE2 3.8Å; F233-Y255 HydrophobicContact CD2-CE2 3.8Å; F233-Y255 HydrophobicContact CE2-CD2 4.22Å; F233-Y255 AromaticContact CE2-CE2 3.22Å; F233-Y255 HydrophobicContact CE2-CE2 3.22Å; F233-Y255 AromaticContact CE2-CZ 3.64Å; F233-Y255 WeakPolarHBondContact CE2-OH 3.28Å; F233-Y255 AromaticContact CZ-CE2 3.86Å; F233-Y255 HydrophobicContact CZ-CE2 3.86Å; F233-Y255 AromaticContact CZ-CZ 3.79Å; F233-Y255 VanDerWaalsContact CZ-OH 3.29Å; F233-Y255 WeakPolarHBondContact CZ-OH 3.21Å; M236-Y255 HydrophobicContact CE-CD1 4.32Å; M236-Y255 HydrophobicContact CE-CD2 4.11Å; M236-Y255 HydrophobicContact CE-CE2 4.45Å; M236-Y255 HydrophobicContact CE-CG 4.05Å; A251-Y255 WeakPolarHBondContact O-CB 3.42Å; A251-Y255 PolarHBondContact O-N 2.98Å; R252-Y255 PolarHBondContact O-N 2.82Å; R252-Y255 VanDerWaalsContact O-N 3.16Å; N253-Y255 VanDerWaalsContact C-N 3.3Å; N253-Y255 PolarHBondContact O-N 2.58Å; Y255-I258 PolarHBondContact O-N 2.85Å; Y255-L259 HydrophobicContact CD1-CD1 3.92Å; Y255-L259 HydrophobicContact CD1-CG 4.5Å; Y255-L259 HydrophobicContact CE1-CD1 3.39Å; Y255-L259 HydrophobicContact CE1-CG 4.08Å; Y255-L259 HydrophobicContact CE2-CG 4.38Å; Y255-L259 WeakPolarHBondContact O-CG 3.47Å; Y255-L259 PolarHBondContact O-N 3.13Å
256	Q	74.9	Confident	69.9	Low	94 Å²	94	79.6 Å²	79.6	44%	0.439	41%	0.409	S	S	.	.	H	α-helix	trans	-63.9	-42.6	174.4	-165	58.9	43	0	0	111.3	R252 N253 K254 I258 L259 D260	R252-Q256 WeakPolarHBondContact O-CB 2.76Å; R252-Q256 PolarHBondContact O-N 3.31Å; N253-Q256 PolarHBondContact O-N 2.9Å; K254-Q256 VanDerWaalsContact C-N 3.35Å; Q256-I258 VanDerWaalsContact C-N 3.27Å; Q256-I258 PolarHBondContact O-N 2.99Å; Q256-L259 CarbonylContact O-C 3.59Å; Q256-L259 WeakPolarHBondContact O-CB 3.1Å; Q256-L259 PolarHBondContact O-N 3.44Å; Q256-D260 PolarHBondContact NE2-OD1 2.93Å; Q256-D260 WeakPolarHBondContact O-CB 3.14Å; Q256-D260 PolarHBondContact O-N 2.85Å
257	E	74.9	Confident	69.8	Low	116 Å²	116	82.7 Å²	82.7	54%	0.542	42%	0.422	S	S	.	.	H	α-helix	trans	-56.7	-39.5	174.9	-175.9	-176.3	-177.7	0	0	112.3	N253 K254 N261	N253-E257 WeakPolarHBondContact O-CB 3.19Å; N253-E257 PolarHBondContact O-N 3.09Å; K254-E257 PolarHBondContact O-N 2.83Å; E257-N261 WeakPolarHBondContact O-CB 3.29Å; E257-N261 PolarHBondContact O-N 2.83Å; E257-N261 PolarHBondContact O-ND2 2.88Å
258	I	63.1	Low	69.2	Low	36 Å²	36	83.9 Å²	83.9	19%	0.185	42%	0.422	C	S	.	.	H	α-helix	trans	-71.1	-41.1	175.2	-68	139.2	0	0	0	111.6	L229 M232 K254 Y255 Q256 D260 N261 K262 I265	L229-I258 HydrophobicContact CD1-CB 4.49Å; L229-I258 HydrophobicContact CD1-CD1 4.31Å; L229-I258 HydrophobicContact CD1-CG1 4.3Å; L229-I258 HydrophobicContact CD1-CG2 3.58Å; L229-I258 HydrophobicContact CD2-CB 3.83Å; L229-I258 HydrophobicContact CD2-CD1 3.47Å; L229-I258 VanDerWaalsContact CD2-CD1 3.47Å; L229-I258 HydrophobicContact CD2-CG1 3.97Å; L229-I258 HydrophobicContact CD2-CG2 3.47Å; L229-I258 VanDerWaalsContact CD2-CG2 3.47Å; L229-I258 HydrophobicContact CG-CB 4.38Å; L229-I258 HydrophobicContact CG-CD1 3.57Å; L229-I258 HydrophobicContact CG-CG1 4.07Å; L229-I258 HydrophobicContact CG-CG2 3.91Å; M232-I258 HydrophobicContact CE-CD1 4.01Å; K254-I258 WeakPolarHBondContact O-CD1 3.27Å; K254-I258 WeakPolarHBondContact O-CG1 3.32Å; K254-I258 PolarHBondContact O-N 3.34Å; Y255-I258 PolarHBondContact O-N 2.85Å; Q256-I258 VanDerWaalsContact C-N 3.27Å; Q256-I258 PolarHBondContact O-N 2.99Å; I258-D260 VanDerWaalsContact C-N 3.29Å; I258-D260 PolarHBondContact O-N 2.8Å; I258-N261 CarbonylContact O-C 3.56Å; I258-N261 PolarHBondContact O-N 2.84Å; I258-K262 WeakPolarHBondContact O-CA 3.39Å; I258-K262 PolarHBondContact O-N 3.41Å; I258-I265 HydrophobicContact CG2-CD1 4.06Å
259	L	74	Confident	68.5	Low	70 Å²	70	83.8 Å²	83.8	37%	0.366	41%	0.412	S	S	.	.	H	α-helix	trans	-62.4	-40.4	176.2	-74.5	178.4	0	0	0	111.6	Y255 Q256 N261 K262	Y255-L259 HydrophobicContact CD1-CD1 3.92Å; Y255-L259 HydrophobicContact CD1-CG 4.5Å; Y255-L259 HydrophobicContact CE1-CD1 3.39Å; Y255-L259 HydrophobicContact CE1-CG 4.08Å; Y255-L259 HydrophobicContact CE2-CG 4.38Å; Y255-L259 WeakPolarHBondContact O-CG 3.47Å; Y255-L259 PolarHBondContact O-N 3.13Å; Q256-L259 CarbonylContact O-C 3.59Å; Q256-L259 WeakPolarHBondContact O-CB 3.1Å; Q256-L259 PolarHBondContact O-N 3.44Å; L259-N261 VanDerWaalsContact C-N 3.27Å; L259-N261 PolarHBondContact O-N 2.98Å; L259-K262 WeakPolarHBondContact O-CB 3.25Å; L259-K262 PolarHBondContact O-N 2.85Å
260	D	78.6	Confident	67.5	Low	107 Å²	107	88.1 Å²	88.1	57%	0.572	42%	0.421	S	S	*	.	H	α-helix	trans	-65.8	-33.3	177.5	-64.2	-13.4	0	0	0	110.8	Q256 I258	Q256-D260 PolarHBondContact NE2-OD1 2.93Å; Q256-D260 WeakPolarHBondContact O-CB 3.14Å; Q256-D260 PolarHBondContact O-N 2.85Å; I258-D260 VanDerWaalsContact C-N 3.29Å; I258-D260 PolarHBondContact O-N 2.8Å
261	N	74.2	Confident	66.2	Low	73 Å²	73	91.2 Å²	91.2	39%	0.39	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	6.3	176.3	-69.8	-45.3	0	0	0	114.6	E257 I258 L259 S263 T264 I265	E257-N261 WeakPolarHBondContact O-CB 3.29Å; E257-N261 PolarHBondContact O-N 2.83Å; E257-N261 PolarHBondContact O-ND2 2.88Å; I258-N261 CarbonylContact O-C 3.56Å; I258-N261 PolarHBondContact O-N 2.84Å; L259-N261 VanDerWaalsContact C-N 3.27Å; L259-N261 PolarHBondContact O-N 2.98Å; N261-S263 VanDerWaalsContact C-N 3.32Å; N261-S263 PolarHBondContact O-N 3.23Å; N261-T264 WeakPolarHBondContact O-CB 3.35Å; N261-T264 PolarHBondContact O-N 2.96Å; N261-T264 VanDerWaalsContact O-N 3.1Å; N261-I265 HydrophobicContact CB-CD1 4.29Å; N261-I265 WeakPolarHBondContact O-CG1 3.4Å; N261-I265 PolarHBondContact O-N 3.49Å
262	K	72.4	Confident	65.6	Low	108 Å²	108	92.3 Å²	92.3	47%	0.47	44%	0.437	S	S	.	.	H	α-helix	trans	-55.9	-44.9	-172.4	177	-178.6	171.1	-176.6	0	112.4	I258 L259 T264 I265 E266	I258-K262 WeakPolarHBondContact O-CA 3.39Å; I258-K262 PolarHBondContact O-N 3.41Å; L259-K262 WeakPolarHBondContact O-CB 3.25Å; L259-K262 PolarHBondContact O-N 2.85Å; K262-T264 VanDerWaalsContact C-N 3.35Å; K262-T264 PolarHBondContact O-N 2.87Å; K262-I265 PolarHBondContact O-N 3.3Å; K262-E266 WeakPolarHBondContact CE-OE1 3.29Å; K262-E266 HydrophobicContact CG-CG 4.4Å; K262-E266 IonicContact NZ-OE1 3.26Å; K262-E266 WeakPolarHBondContact O-CB 3.26Å; K262-E266 VanDerWaalsContact O-CG 3.32Å; K262-E266 WeakPolarHBondContact O-CG 3.39Å; K262-E266 PolarHBondContact O-N 2.87Å
263	S	70.8	Confident	64.6	Low	81 Å²	81	89 Å²	89	57%	0.566	43%	0.433	S	S	*	.	H	α-helix	trans	-64.6	-38.7	-179.6	55.6	0	0	0	0	112.2	N261 H267	N261-S263 VanDerWaalsContact C-N 3.32Å; N261-S263 PolarHBondContact O-N 3.23Å; S263-H267 WeakPolarHBondContact O-CB 3.35Å; S263-H267 PolarHBondContact O-N 3.25Å
264	T	69	Low	62.8	Low	70 Å²	70	87.5 Å²	87.5	43%	0.429	43%	0.43	S	S	.	.	H	α-helix	trans	-65.3	-47.2	176	-51.1	0	0	0	0	110.8	N261 K262 E266 H267 E268	N261-T264 WeakPolarHBondContact O-CB 3.35Å; N261-T264 PolarHBondContact O-N 2.96Å; N261-T264 VanDerWaalsContact O-N 3.1Å; K262-T264 VanDerWaalsContact C-N 3.35Å; K262-T264 PolarHBondContact O-N 2.87Å; T264-E266 PolarHBondContact O-N 3.17Å; T264-H267 PolarHBondContact O-N 3.36Å; T264-E268 WeakPolarHBondContact O-CG 3.16Å; T264-E268 PolarHBondContact O-N 2.85Å
265	I	59	Low	61.3	Low	28 Å²	28	84.7 Å²	84.7	14%	0.144	42%	0.421	C	S	.	.	H	α-helix	trans	-61.8	-44.5	177.1	-64.6	167	0	0	0	110.6	M225 I258 N261 K262 H267 E268 I269	M225-I265 HydrophobicContact CE-CG1 4.2Å; M225-I265 HydrophobicContact SD-CD1 4.09Å; M225-I265 HydrophobicContact SD-CG1 4.25Å; I258-I265 HydrophobicContact CG2-CD1 4.06Å; N261-I265 HydrophobicContact CB-CD1 4.29Å; N261-I265 WeakPolarHBondContact O-CG1 3.4Å; N261-I265 PolarHBondContact O-N 3.49Å; K262-I265 PolarHBondContact O-N 3.3Å; I265-H267 VanDerWaalsContact C-N 3.33Å; I265-H267 PolarHBondContact O-N 2.91Å; I265-E268 PolarHBondContact O-N 2.93Å; I265-I269 HydrophobicContact CG2-CD1 3.85Å; I265-I269 HydrophobicContact CG2-CG1 4.5Å; I265-I269 VanDerWaalsContact O-CG1 3.28Å; I265-I269 WeakPolarHBondContact O-CG1 3.36Å; I265-I269 PolarHBondContact O-N 3.38Å
266	E	64	Low	60.4	Low	99 Å²	99	83 Å²	83	46%	0.463	42%	0.417	S	S	.	.	H	α-helix	trans	-62.4	-38.8	176.2	-77	178.9	171.9	0	0	112.2	K262 T264 R270	K262-E266 WeakPolarHBondContact CE-OE1 3.29Å; K262-E266 HydrophobicContact CG-CG 4.4Å; K262-E266 IonicContact NZ-OE1 3.26Å; K262-E266 WeakPolarHBondContact O-CB 3.26Å; K262-E266 VanDerWaalsContact O-CG 3.32Å; K262-E266 WeakPolarHBondContact O-CG 3.39Å; K262-E266 PolarHBondContact O-N 2.87Å; T264-E266 PolarHBondContact O-N 3.17Å; E266-R270 VanDerWaalsContact O-CB 3.3Å; E266-R270 WeakPolarHBondContact O-CB 3.36Å; E266-R270 PolarHBondContact O-N 3.21Å
267	H	61.1	Low	59.4	Low	124 Å²	124	82 Å²	82	57%	0.574	42%	0.415	S	S	*	.	H	α-helix	trans	-66.6	-44.3	175.5	-179.9	-88.2	0	0	0	112	S263 T264 I265 R270 Y271	S263-H267 WeakPolarHBondContact O-CB 3.35Å; S263-H267 PolarHBondContact O-N 3.25Å; T264-H267 PolarHBondContact O-N 3.36Å; I265-H267 VanDerWaalsContact C-N 3.33Å; I265-H267 PolarHBondContact O-N 2.91Å; H267-R270 PolarHBondContact O-N 2.78Å; H267-Y271 WeakPolarHBondContact O-CB 3.44Å; H267-Y271 PolarHBondContact O-N 2.94Å
268	E	57.3	Low	58.4	Low	97 Å²	97	81.7 Å²	81.7	45%	0.453	42%	0.417	S	S	.	.	H	α-helix	trans	-63	-43.2	177	-74.7	-178	173.4	0	0	112.2	T264 I265 Y271 S272	T264-E268 WeakPolarHBondContact O-CG 3.16Å; T264-E268 PolarHBondContact O-N 2.85Å; I265-E268 PolarHBondContact O-N 2.93Å; E268-Y271 PolarHBondContact O-N 3.16Å; E268-S272 VanDerWaalsContact O-CB 3.29Å; E268-S272 WeakPolarHBondContact O-CB 3.47Å; E268-S272 PolarHBondContact O-N 3.41Å
269	I	52.1	Low	57.8	Low	66 Å²	66	86.3 Å²	86.3	34%	0.338	44%	0.436	S	S	.	.	H	α-helix	trans	-60.3	-47.8	173.5	-68.8	167.6	0	0	0	109.9	I265 Y271 S272 T273	I265-I269 HydrophobicContact CG2-CD1 3.85Å; I265-I269 HydrophobicContact CG2-CG1 4.5Å; I265-I269 VanDerWaalsContact O-CG1 3.28Å; I265-I269 WeakPolarHBondContact O-CG1 3.36Å; I265-I269 PolarHBondContact O-N 3.38Å; I269-Y271 PolarHBondContact O-N 3.19Å; I269-S272 PolarHBondContact O-N 2.89Å; I269-T273 WeakPolarHBondContact O-CG2 3.42Å; I269-T273 PolarHBondContact O-N 2.81Å; I269-T273 PolarHBondContact O-OG1 3.01Å; I269-T273 VanDerWaalsContact O-OG1 3.08Å
270	R	53.6	Low	57	Low	181 Å²	181	84.8 Å²	84.8	68%	0.683	43%	0.426	S	S	*	.	H	α-helix	trans	-61.4	-45.4	-179.9	-173.6	-179.5	-63.3	-164.9	0.9	111.9	E266 H267 T273 C274	E266-R270 VanDerWaalsContact O-CB 3.3Å; E266-R270 WeakPolarHBondContact O-CB 3.36Å; E266-R270 PolarHBondContact O-N 3.21Å; H267-R270 PolarHBondContact O-N 2.78Å; R270-T273 WeakPolarHBondContact CA-OG1 3.05Å; R270-T273 PolarHBondContact O-N 2.93Å; R270-T273 PolarHBondContact O-OG1 3.43Å; R270-C274 WeakPolarHBondContact O-CB 3.12Å; R270-C274 PolarHBondContact O-N 3.38Å
271	Y	47.2	Very low	56.1	Low	156 Å²	156	86.2 Å²	86.2	61%	0.612	43%	0.429	S	S	*	.	H	α-helix	trans	-61.2	-47.3	176.3	-177.1	-98.4	0	0	0	110.9	H267 E268 I269 T273 C274 V275	H267-Y271 WeakPolarHBondContact O-CB 3.44Å; H267-Y271 PolarHBondContact O-N 2.94Å; E268-Y271 PolarHBondContact O-N 3.16Å; I269-Y271 PolarHBondContact O-N 3.19Å; Y271-T273 PolarHBondContact O-N 2.98Å; Y271-C274 WeakPolarHBondContact O-CB 3.49Å; Y271-C274 PolarHBondContact O-N 3.19Å; Y271-C274 VanDerWaalsContact O-N 3.17Å; Y271-V275 HydrophobicContact CD1-CG2 4.11Å; Y271-V275 HydrophobicContact CE1-CG2 3.74Å; Y271-V275 HydrophobicContact CE2-CG2 4.37Å; Y271-V275 WeakPolarHBondContact O-CG2 3.32Å; Y271-V275 PolarHBondContact O-N 3.46Å
272	S	45.1	Very low	55.4	Low	28 Å²	28	85.5 Å²	85.5	20%	0.196	43%	0.427	C	S	.	.	H	α-helix	trans	-59.8	-44	176.8	-174.6	0	0	0	0	112.4	E268 I269 C274 V275 C276	E268-S272 VanDerWaalsContact O-CB 3.29Å; E268-S272 WeakPolarHBondContact O-CB 3.47Å; E268-S272 PolarHBondContact O-N 3.41Å; I269-S272 PolarHBondContact O-N 2.89Å; S272-C274 PolarHBondContact O-N 3.06Å; S272-V275 PolarHBondContact O-N 1.99Å; S272-C276 PolarHBondContact O-N 3.48Å; S272-C276 PolarHBondContact O-SG 3.39Å
273	T	51.4	Low	54.7	Low	72 Å²	72	82.3 Å²	82.3	44%	0.442	42%	0.421	S	S	.	.	H	α-helix	trans	-62.1	-41.4	174.5	48.5	0	0	0	0	112.3	I269 R270 Y271 C276 D277	I269-T273 WeakPolarHBondContact O-CG2 3.42Å; I269-T273 PolarHBondContact O-N 2.81Å; I269-T273 PolarHBondContact O-OG1 3.01Å; I269-T273 VanDerWaalsContact O-OG1 3.08Å; R270-T273 WeakPolarHBondContact CA-OG1 3.05Å; R270-T273 PolarHBondContact O-N 2.93Å; R270-T273 PolarHBondContact O-OG1 3.43Å; Y271-T273 PolarHBondContact O-N 2.98Å; T273-C276 PolarHBondContact O-N 3.32Å; T273-D277 PolarHBondContact O-N 3.47Å
274	C	36.9	Very low	54.2	Low	80 Å²	80	79.3 Å²	79.3	54%	0.541	40%	0.4	S	S	.	.	H	α-helix	trans	-65.1	-41.1	178.5	-176.6	0	0	0	0	112	R270 Y271 S272 D277 L278	R270-C274 WeakPolarHBondContact O-CB 3.12Å; R270-C274 PolarHBondContact O-N 3.38Å; Y271-C274 WeakPolarHBondContact O-CB 3.49Å; Y271-C274 PolarHBondContact O-N 3.19Å; Y271-C274 VanDerWaalsContact O-N 3.17Å; S272-C274 PolarHBondContact O-N 3.06Å; C274-D277 PolarHBondContact O-N 3.08Å; C274-L278 VanDerWaalsContact O-CB 3.29Å; C274-L278 WeakPolarHBondContact O-CB 3.48Å; C274-L278 PolarHBondContact O-N 3.26Å
275	V	41.3	Very low	54	Low	34 Å²	34	85.5 Å²	85.5	21%	0.206	42%	0.415	C	S	.	.	H	α-helix	trans	-63.5	-46.1	175.7	172.9	0	0	0	0	110.5	Y271 S272 D277 L278 F279	Y271-V275 HydrophobicContact CD1-CG2 4.11Å; Y271-V275 HydrophobicContact CE1-CG2 3.74Å; Y271-V275 HydrophobicContact CE2-CG2 4.37Å; Y271-V275 WeakPolarHBondContact O-CG2 3.32Å; Y271-V275 PolarHBondContact O-N 3.46Å; S272-V275 PolarHBondContact O-N 1.99Å; V275-D277 PolarHBondContact O-N 2.91Å; V275-L278 WeakPolarHBondContact O-CB 3.44Å; V275-L278 PolarHBondContact O-N 2.94Å; V275-F279 HydrophobicContact CG1-CD2 3.62Å; V275-F279 HydrophobicContact CG1-CE2 3.6Å; V275-F279 VanDerWaalsContact O-CD2 3.29Å; V275-F279 WeakPolarHBondContact O-CD2 3.5Å; V275-F279 PolarHBondContact O-N 3Å
276	C	47.8	Very low	54.4	Low	23 Å²	23	90 Å²	90	16%	0.155	44%	0.436	C	S	.	.	H	α-helix	trans	-59.2	-44.8	175.3	-75.5	0	0	0	0	112.4	S272 T273 L278 K280	S272-C276 PolarHBondContact O-N 3.48Å; S272-C276 PolarHBondContact O-SG 3.39Å; T273-C276 PolarHBondContact O-N 3.32Å; C276-L278 VanDerWaalsContact C-N 3.33Å; C276-K280 VanDerWaalsContact O-CB 3.25Å; C276-K280 WeakPolarHBondContact O-CB 3.04Å; C276-K280 WeakPolarHBondContact O-CG 3.39Å; C276-K280 PolarHBondContact O-N 3.15Å
277	D	54.4	Low	54.5	Low	74 Å²	74	87.3 Å²	87.3	40%	0.396	42%	0.424	S	S	.	.	H	α-helix	trans	-65.3	-37.7	176.7	-72	-21	0	0	0	111.5	T273 C274 V275 K280 H281	T273-D277 PolarHBondContact O-N 3.47Å; C274-D277 PolarHBondContact O-N 3.08Å; V275-D277 PolarHBondContact O-N 2.91Å; D277-K280 WeakPolarHBondContact O-CB 3.38Å; D277-K280 PolarHBondContact O-N 3.1Å; D277-H281 WeakPolarHBondContact O-CB 3.29Å; D277-H281 PolarHBondContact O-CD2 2.92Å; D277-H281 PolarHBondContact O-N 3.39Å
278	L	53.3	Low	54.9	Low	109 Å²	109	86.9 Å²	86.9	57%	0.571	42%	0.421	S	S	*	.	H	α-helix	trans	-63.8	-49.4	176.2	-174.1	64.6	0	0	0	111.7	C274 V275 C276 K280 H281 T282	C274-L278 VanDerWaalsContact O-CB 3.29Å; C274-L278 WeakPolarHBondContact O-CB 3.48Å; C274-L278 PolarHBondContact O-N 3.26Å; V275-L278 WeakPolarHBondContact O-CB 3.44Å; V275-L278 PolarHBondContact O-N 2.94Å; C276-L278 VanDerWaalsContact C-N 3.33Å; L278-K280 VanDerWaalsContact C-N 3.28Å; L278-K280 PolarHBondContact O-N 3.16Å; L278-H281 PolarHBondContact O-N 2.73Å; L278-H281 VanDerWaalsContact O-N 3.15Å; L278-T282 WeakPolarHBondContact O-CG2 3.26Å; L278-T282 PolarHBondContact O-N 3.35Å; L278-T282 PolarHBondContact O-OG1 3.04Å
279	F	50.8	Low	55.6	Low	133 Å²	133	84.3 Å²	84.3	58%	0.583	42%	0.416	S	S	*	.	H	α-helix	trans	-59.9	-39.9	175.6	-88.8	-76.3	0	0	0	112.2	V275 T282 A283	V275-F279 HydrophobicContact CG1-CD2 3.62Å; V275-F279 HydrophobicContact CG1-CE2 3.6Å; V275-F279 VanDerWaalsContact O-CD2 3.29Å; V275-F279 WeakPolarHBondContact O-CD2 3.5Å; V275-F279 PolarHBondContact O-N 3Å; F279-T282 WeakPolarHBondContact CA-OG1 3.19Å; F279-T282 PolarHBondContact O-N 2.79Å; F279-T282 PolarHBondContact O-OG1 2.05Å; F279-A283 WeakPolarHBondContact O-CB 3.4Å; F279-A283 PolarHBondContact O-N 2.82Å
280	K	56.8	Low	56.8	Low	38 Å²	38	81.5 Å²	81.5	17%	0.165	40%	0.402	C	S	.	.	H	α-helix	trans	-60.7	-47.4	173.7	-82.1	178.8	-173.8	175.8	0	111.4	F165 C276 D277 L278 C284	F165-K280 HydrophobicContact CE1-CB 4.49Å; F165-K280 HydrophobicContact CE2-CB 4.19Å; F165-K280 HydrophobicContact CE2-CG 3.8Å; F165-K280 HydrophobicContact CZ-CB 3.5Å; F165-K280 HydrophobicContact CZ-CD 4.33Å; F165-K280 HydrophobicContact CZ-CG 3.6Å; F165-K280 WeakPolarHBondContact CZ-O 3.41Å; C276-K280 VanDerWaalsContact O-CB 3.25Å; C276-K280 WeakPolarHBondContact O-CB 3.04Å; C276-K280 WeakPolarHBondContact O-CG 3.39Å; C276-K280 PolarHBondContact O-N 3.15Å; D277-K280 WeakPolarHBondContact O-CB 3.38Å; D277-K280 PolarHBondContact O-N 3.1Å; L278-K280 VanDerWaalsContact C-N 3.28Å; L278-K280 PolarHBondContact O-N 3.16Å; K280-C284 VanDerWaalsContact O-CB 3.24Å; K280-C284 WeakPolarHBondContact O-CB 3.36Å; K280-C284 PolarHBondContact O-N 3.01Å; K280-C284 VanDerWaalsContact O-N 3.13Å
281	H	59.4	Low	57.9	Low	137 Å²	137	75 Å²	75	63%	0.634	38%	0.38	S	S	*	.	H	α-helix	trans	-65.3	-39.5	178.8	-86.1	-68.6	0	0	0	112.5	D277 L278 R285	D277-H281 WeakPolarHBondContact O-CB 3.29Å; D277-H281 PolarHBondContact O-CD2 2.92Å; D277-H281 PolarHBondContact O-N 3.39Å; L278-H281 PolarHBondContact O-N 2.73Å; L278-H281 VanDerWaalsContact O-N 3.15Å; H281-R285 VanDerWaalsContact O-CB 3.25Å; H281-R285 WeakPolarHBondContact O-CB 3.44Å; H281-R285 PolarHBondContact O-N 3.26Å
282	T	59.4	Low	59.3	Low	57 Å²	57	72 Å²	72	35%	0.35	38%	0.382	S	S	.	.	H	α-helix	trans	-68	-51.7	178.7	52.8	0	0	0	0	111.6	L278 F279 C284 R285 E286	L278-T282 WeakPolarHBondContact O-CG2 3.26Å; L278-T282 PolarHBondContact O-N 3.35Å; L278-T282 PolarHBondContact O-OG1 3.04Å; F279-T282 WeakPolarHBondContact CA-OG1 3.19Å; F279-T282 PolarHBondContact O-N 2.79Å; F279-T282 PolarHBondContact O-OG1 2.05Å; T282-C284 VanDerWaalsContact C-N 3.3Å; T282-C284 PolarHBondContact O-N 3.25Å; T282-R285 WeakPolarHBondContact O-CA 3.34Å; T282-R285 WeakPolarHBondContact O-CB 3.47Å; T282-R285 PolarHBondContact O-N 3.25Å; T282-E286 WeakPolarHBondContact O-CG 3.29Å; T282-E286 PolarHBondContact O-N 3.5Å
283	A	58.9	Low	61	Low	41 Å²	41	72.7 Å²	72.7	34%	0.339	38%	0.383	S	S	.	.	H	α-helix	trans	-59.4	-41.5	179.4	0	0	0	0	0	112.1	F279 R285 E286 I287	F279-A283 WeakPolarHBondContact O-CB 3.4Å; F279-A283 PolarHBondContact O-N 2.82Å; A283-R285 VanDerWaalsContact C-N 3.33Å; A283-R285 PolarHBondContact O-N 3.12Å; A283-E286 PolarHBondContact O-N 3.23Å; A283-I287 WeakPolarHBondContact O-CG1 3.23Å; A283-I287 PolarHBondContact O-N 2.82Å
284	C	59.2	Low	62.6	Low	18 Å²	18	73.1 Å²	73.1	12%	0.122	38%	0.383	C	S	.	.	H	α-helix	trans	-67.2	-34.8	177.1	-139	0	0	0	0	112.1	F165 K280 T282 K288	F165-C284 HydrophobicContact CD1-CB 4.3Å; F165-C284 WeakPolarHBondContact CD1-SG 3.44Å; F165-C284 HydrophobicContact CE1-CB 3.8Å; F165-C284 WeakPolarHBondContact CE1-SG 3.12Å; F165-C284 HydrophobicContact CZ-CB 4.43Å; K280-C284 VanDerWaalsContact O-CB 3.24Å; K280-C284 WeakPolarHBondContact O-CB 3.36Å; K280-C284 PolarHBondContact O-N 3.01Å; K280-C284 VanDerWaalsContact O-N 3.13Å; T282-C284 VanDerWaalsContact C-N 3.3Å; T282-C284 PolarHBondContact O-N 3.25Å; C284-K288 WeakPolarHBondContact O-CB 3.16Å; C284-K288 WeakPolarHBondContact O-CG 3.44Å; C284-K288 PolarHBondContact O-N 3.36Å; C284-K288 VanDerWaalsContact O-N 3.09Å
285	R	65.4	Low	64.9	Low	200 Å²	200	69.6 Å²	69.6	76%	0.755	36%	0.358	S	S	*	.	H	α-helix	trans	-68.2	-41.6	175.2	-176.3	-179.8	179.8	180	-1	111.1	H281 T282 A283 K288 A289	H281-R285 VanDerWaalsContact O-CB 3.25Å; H281-R285 WeakPolarHBondContact O-CB 3.44Å; H281-R285 PolarHBondContact O-N 3.26Å; T282-R285 WeakPolarHBondContact O-CA 3.34Å; T282-R285 WeakPolarHBondContact O-CB 3.47Å; T282-R285 PolarHBondContact O-N 3.25Å; A283-R285 VanDerWaalsContact C-N 3.33Å; A283-R285 PolarHBondContact O-N 3.12Å; R285-K288 PolarHBondContact O-N 3.02Å; R285-A289 WeakPolarHBondContact O-CB 3.22Å; R285-A289 PolarHBondContact O-N 3.28Å
286	E	66.4	Low	66.9	Low	123 Å²	123	68.4 Å²	68.4	58%	0.575	35%	0.353	S	S	*	.	H	α-helix	trans	-64.1	-47.5	177.3	-72.6	174.3	-179	0	0	112	T282 A283 K288 A289 L290	T282-E286 WeakPolarHBondContact O-CG 3.29Å; T282-E286 PolarHBondContact O-N 3.5Å; A283-E286 PolarHBondContact O-N 3.23Å; E286-K288 VanDerWaalsContact C-N 3.33Å; E286-K288 PolarHBondContact O-N 3.26Å; E286-A289 PolarHBondContact O-N 2.03Å; E286-L290 WeakPolarHBondContact O-CB 3.29Å; E286-L290 PolarHBondContact O-N 3.03Å
287	I	67.2	Low	68.6	Low	43 Å²	43	70 Å²	70	22%	0.221	36%	0.363	C	S	.	.	H	α-helix	trans	-62.2	-41.7	176.6	-66.2	168.7	0	0	0	110.9	M162 A283 L290 L291	M162-I287 HydrophobicContact CB-CG2 4.2Å; A283-I287 WeakPolarHBondContact O-CG1 3.23Å; A283-I287 PolarHBondContact O-N 2.82Å; I287-L290 PolarHBondContact O-N 3.18Å; I287-L291 HydrophobicContact CG2-CD1 3.78Å; I287-L291 HydrophobicContact CG2-CG 4.21Å; I287-L291 WeakPolarHBondContact O-CB 3.07Å; I287-L291 VanDerWaalsContact O-CG 3.23Å; I287-L291 WeakPolarHBondContact O-CG 3.28Å; I287-L291 PolarHBondContact O-N 2.61Å
288	K	69.3	Low	70.1	Confident	114 Å²	114	69.8 Å²	69.8	50%	0.496	36%	0.362	S	S	.	.	H	α-helix	trans	-63	-42.2	175.4	-77.5	176.1	-176.4	179.6	0	112.2	M162 C284 R285 E286 L291 S292	M162-K288 HydrophobicContact SD-CG 3.98Å; C284-K288 WeakPolarHBondContact O-CB 3.16Å; C284-K288 WeakPolarHBondContact O-CG 3.44Å; C284-K288 PolarHBondContact O-N 3.36Å; C284-K288 VanDerWaalsContact O-N 3.09Å; R285-K288 PolarHBondContact O-N 3.02Å; E286-K288 VanDerWaalsContact C-N 3.33Å; E286-K288 PolarHBondContact O-N 3.26Å; K288-L291 PolarHBondContact O-N 2.99Å; K288-S292 WeakPolarHBondContact O-CB 3.32Å; K288-S292 PolarHBondContact O-N 3.19Å; K288-S292 VanDerWaalsContact O-N 3.11Å; K288-S292 PolarHBondContact O-OG 3.49Å
289	A	72.4	Confident	71.7	Confident	43 Å²	43	67.3 Å²	67.3	36%	0.355	35%	0.347	S	S	.	.	H	α-helix	trans	-62.3	-48.4	176.7	0	0	0	0	0	110.4	R285 E286 L291 S292 I293	R285-A289 WeakPolarHBondContact O-CB 3.22Å; R285-A289 PolarHBondContact O-N 3.28Å; E286-A289 PolarHBondContact O-N 2.03Å; A289-L291 PolarHBondContact O-N 3.45Å; A289-S292 WeakPolarHBondContact O-CB 3.27Å; A289-S292 PolarHBondContact O-N 3.42Å; A289-S292 PolarHBondContact O-OG 2.86Å; A289-I293 WeakPolarHBondContact O-CG1 3.2Å; A289-I293 PolarHBondContact O-N 2.91Å
290	L	75.9	Confident	73.6	Confident	8 Å²	8	61 Å²	61	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-56.6	-50.5	175.5	-177	82.3	0	0	0	112	K158 E286 I287 S292 I293 F295 L302 Y305	K158-L290 HydrophobicContact CD-CD2 3.31Å; E286-L290 WeakPolarHBondContact O-CB 3.29Å; E286-L290 PolarHBondContact O-N 3.03Å; I287-L290 PolarHBondContact O-N 3.18Å; L290-S292 PolarHBondContact O-N 3.19Å; L290-S292 VanDerWaalsContact O-N 3.12Å; L290-I293 PolarHBondContact O-N 2.77Å; L290-I293 VanDerWaalsContact O-N 3.12Å; L290-F295 HydrophobicContact CD1-CE2 4.16Å; L290-F295 HydrophobicContact CD1-CZ 3.66Å; L290-F295 HydrophobicContact CG-CE2 4.35Å; L290-F295 HydrophobicContact CG-CZ 4.33Å; L290-F295 WeakPolarHBondContact O-CE2 3.46Å; L290-L302 HydrophobicContact CD1-CD1 3.96Å; L290-L302 HydrophobicContact CD2-CD1 4.33Å; L290-L302 HydrophobicContact CG-CD1 4.31Å; L290-Y305 HydrophobicContact CD1-CD1 3.28Å; L290-Y305 HydrophobicContact CD1-CD2 3.61Å; L290-Y305 HydrophobicContact CD1-CE1 3.31Å; L290-Y305 HydrophobicContact CD1-CE2 3.68Å; L290-Y305 HydrophobicContact CD1-CG 3.41Å; L290-Y305 VanDerWaalsContact CD1-CG 3.41Å
291	L	76.8	Confident	75.2	Confident	44 Å²	44	59.4 Å²	59.4	23%	0.23	31%	0.312	C	S	.	.	H	α-helix	trans	-66.2	-13.3	-179.5	-68.9	176	0	0	0	113.4	K155 Q159 M162 I287 K288 A289	K155-L291 HydrophobicContact CG-CD2 3.98Å; Q159-L291 HydrophobicContact CG-CD1 4.07Å; Q159-L291 HydrophobicContact CG-CD2 3.99Å; M162-L291 HydrophobicContact CE-CD1 3.59Å; M162-L291 HydrophobicContact SD-CD1 4.1Å; I287-L291 HydrophobicContact CG2-CD1 3.78Å; I287-L291 HydrophobicContact CG2-CG 4.21Å; I287-L291 WeakPolarHBondContact O-CB 3.07Å; I287-L291 VanDerWaalsContact O-CG 3.23Å; I287-L291 WeakPolarHBondContact O-CG 3.28Å; I287-L291 PolarHBondContact O-N 2.61Å; K288-L291 PolarHBondContact O-N 2.99Å; A289-L291 PolarHBondContact O-N 3.45Å
292	S	77.3	Confident	76.7	Confident	94 Å²	94	53.2 Å²	53.2	66%	0.657	28%	0.283	S	S	*	.	H	α-helix	trans	-91.1	-11.3	176	73.1	0	0	0	0	114.3	K288 A289 L290	K288-S292 WeakPolarHBondContact O-CB 3.32Å; K288-S292 PolarHBondContact O-N 3.19Å; K288-S292 VanDerWaalsContact O-N 3.11Å; K288-S292 PolarHBondContact O-OG 3.49Å; A289-S292 WeakPolarHBondContact O-CB 3.27Å; A289-S292 PolarHBondContact O-N 3.42Å; A289-S292 PolarHBondContact O-OG 2.86Å; L290-S292 PolarHBondContact O-N 3.19Å; L290-S292 VanDerWaalsContact O-N 3.12Å
293	I	81	Confident	78.2	Confident	42 Å²	42	52.3 Å²	52.3	22%	0.215	28%	0.279	C	S	.	.	S	Bend	trans	-80.6	138.1	179.5	-65.7	167.3	0	0	0	110	A289 L290 F295 Y305 F323	A289-I293 WeakPolarHBondContact O-CG1 3.2Å; A289-I293 PolarHBondContact O-N 2.91Å; L290-I293 PolarHBondContact O-N 2.77Å; L290-I293 VanDerWaalsContact O-N 3.12Å; I293-F295 HydrophobicContact CB-CD2 4.41Å; I293-F295 HydrophobicContact CB-CE1 4.42Å; I293-F295 HydrophobicContact CB-CE2 3.77Å; I293-F295 HydrophobicContact CB-CZ 3.78Å; I293-F295 HydrophobicContact CD1-CZ 4.28Å; I293-F295 HydrophobicContact CG2-CD1 4.15Å; I293-F295 HydrophobicContact CG2-CD2 4.28Å; I293-F295 HydrophobicContact CG2-CE1 3.78Å; I293-F295 HydrophobicContact CG2-CE2 3.92Å; I293-F295 HydrophobicContact CG2-CG 4.39Å; I293-F295 HydrophobicContact CG2-CZ 3.65Å; I293-F295 WeakPolarHBondContact O-CD2 3.47Å; I293-F295 PolarHBondContact O-N 2.7Å; I293-Y305 HydrophobicContact CD1-CD2 4.22Å; I293-Y305 HydrophobicContact CD1-CE2 3.51Å; I293-F323 HydrophobicContact CD1-CB 4.48Å; I293-F323 HydrophobicContact CG2-CD1 3.44Å; I293-F323 VanDerWaalsContact CG2-CD1 3.44Å; I293-F323 HydrophobicContact CG2-CE1 3.64Å; I293-F323 HydrophobicContact CG2-CG 4.31Å
294	D	84.1	Confident	79.8	Confident	80 Å²	80	51 Å²	51	43%	0.428	27%	0.266	S	S	.	.			trans	-82.7	108.8	169.3	-174.5	7.7	0	0	0	110.3	G296	D294-G296 VanDerWaalsContact C-N 3.28Å; D294-G296 WeakPolarHBondContact OD1-CA 2.88Å; D294-G296 PolarHBondContact OD1-N 3.28Å
295	F	86.6	Confident	81.2	Confident	7 Å²	7	52.6 Å²	52.6	3%	0.031	27%	0.27	C	S	.	.			trans	-91.3	13.5	175.9	-65.8	-73.5	0	0	0	112.9	L290 I293 F299 L301 L302 Y305 F323	L290-F295 HydrophobicContact CD1-CE2 4.16Å; L290-F295 HydrophobicContact CD1-CZ 3.66Å; L290-F295 HydrophobicContact CG-CE2 4.35Å; L290-F295 HydrophobicContact CG-CZ 4.33Å; L290-F295 WeakPolarHBondContact O-CE2 3.46Å; I293-F295 HydrophobicContact CB-CD2 4.41Å; I293-F295 HydrophobicContact CB-CE1 4.42Å; I293-F295 HydrophobicContact CB-CE2 3.77Å; I293-F295 HydrophobicContact CB-CZ 3.78Å; I293-F295 HydrophobicContact CD1-CZ 4.28Å; I293-F295 HydrophobicContact CG2-CD1 4.15Å; I293-F295 HydrophobicContact CG2-CD2 4.28Å; I293-F295 HydrophobicContact CG2-CE1 3.78Å; I293-F295 HydrophobicContact CG2-CE2 3.92Å; I293-F295 HydrophobicContact CG2-CG 4.39Å; I293-F295 HydrophobicContact CG2-CZ 3.65Å; I293-F295 WeakPolarHBondContact O-CD2 3.47Å; I293-F295 PolarHBondContact O-N 2.7Å; F295-F299 HydrophobicContact CB-CB 4.22Å; F295-F299 HydrophobicContact CB-CD1 4.34Å; F295-L301 HydrophobicContact CB-CB 4.23Å; F295-L301 HydrophobicContact CD1-CB 4.26Å; F295-L301 WeakPolarHBondContact O-CB 3.07Å; F295-L301 PolarHBondContact O-N 2.9Å; F295-L302 HydrophobicContact CB-CB 4.21Å; F295-L302 VanDerWaalsContact CD1-CA 3.47Å; F295-L302 HydrophobicContact CD1-CB 4.07Å; F295-L302 HydrophobicContact CD1-CD1 4.4Å; F295-L302 HydrophobicContact CD2-CB 4.11Å; F295-L302 HydrophobicContact CD2-CD1 3.96Å; F295-L302 HydrophobicContact CE1-CB 4.49Å; F295-L302 HydrophobicContact CE1-CD1 4.03Å; F295-L302 HydrophobicContact CE2-CD1 3.55Å; F295-L302 HydrophobicContact CG-CB 3.86Å; F295-L302 HydrophobicContact CG-CD1 4.37Å; F295-L302 HydrophobicContact CZ-CD1 3.59Å; F295-Y305 AromaticContact CE1-CD2 3.77Å; F295-Y305 HydrophobicContact CE1-CD2 3.77Å; F295-Y305 HydrophobicContact CE1-CG 4.25Å; F295-Y305 AromaticContact CZ-CD2 3.72Å; F295-Y305 HydrophobicContact CZ-CD2 3.72Å; F295-Y305 HydrophobicContact CZ-CE2 4.41Å; F295-Y305 HydrophobicContact CZ-CG 4.2Å; F295-F323 HydrophobicContact CD1-CD1 4.46Å; F295-F323 HydrophobicContact CD1-CD2 4.23Å; F295-F323 AromaticContact CD1-CE1 3.96Å; F295-F323 HydrophobicContact CD1-CE1 3.96Å; F295-F323 AromaticContact CD1-CE2 3.71Å; F295-F323 HydrophobicContact CD1-CE2 3.71Å; F295-F323 AromaticContact CD1-CZ 3.53Å; F295-F323 HydrophobicContact CD1-CZ 3.53Å; F295-F323 HydrophobicContact CE1-CD1 4.16Å; F295-F323 AromaticContact CE1-CD2 3.86Å; F295-F323 HydrophobicContact CE1-CD2 3.86Å; F295-F323 HydrophobicContact CE1-CE1 4.11Å; F295-F323 AromaticContact CE1-CE2 3.83Å; F295-F323 HydrophobicContact CE1-CE2 3.83Å; F295-F323 HydrophobicContact CE1-CG 4.01Å; F295-F323 AromaticContact CE1-CZ 3.93Å; F295-F323 HydrophobicContact CE1-CZ 3.93Å
296	G	82.5	Confident	82.3	Confident	9 Å²	9	47.6 Å²	47.6	9%	0.093	25%	0.254	C	S	.	.			trans	74.1	-172	-176.9	0	0	0	0	0	113.6	D294 D298 F299	D294-G296 VanDerWaalsContact C-N 3.28Å; D294-G296 WeakPolarHBondContact OD1-CA 2.88Å; D294-G296 PolarHBondContact OD1-N 3.28Å; G296-D298 PolarHBondContact O-N 3.34Å; G296-F299 PolarHBondContact O-N 3.37Å; G296-F299 VanDerWaalsContact O-N 3.12Å
297	P	84.6	Confident	83.6	Confident	56 Å²	56	46.7 Å²	46.7	36%	0.364	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-53.4	133.7	179.7	-26	34.3	0	0	0	112.2	F299 A300	P297-F299 PolarHBondContact O-N 3.26Å; P297-F299 VanDerWaalsContact O-N 3.08Å; P297-A300 PolarHBondContact O-N 2.03Å
298	D	85	Confident	84.9	Confident	69 Å²	69	47.3 Å²	47.3	37%	0.369	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	58.1	15.6	-179.6	-57.3	-66.4	0	0	0	115.6	R144 A148 K152 G296 A300	R144-D298 IonicContact NH2-OD2 3.89Å; R144-D298 PolarHBondContact NH2-OD2 3.37Å; A148-D298 HydrophobicContact CB-CB 3.82Å; K152-D298 WeakPolarHBondContact CE-OD1 3.44Å; K152-D298 IonicContact NZ-OD1 2.87Å; K152-D298 PolarHBondContact NZ-OD1 3.4Å; G296-D298 PolarHBondContact O-N 3.34Å; D298-A300 PolarHBondContact O-N 2.8Å
299	F	87.6	Confident	86.1	Confident	58 Å²	58	43.6 Å²	43.6	25%	0.254	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	59	27.4	-173.4	-45.6	-69.8	0	0	0	113.4	A151 K152 K155 F295 G296 P297 L301 L302	A151-F299 HydrophobicContact CB-CB 4.01Å; A151-F299 VanDerWaalsContact CB-O 3.32Å; A151-F299 WeakPolarHBondContact CB-O 3.45Å; K152-F299 HydrophobicContact CG-CD2 4.25Å; K155-F299 HydrophobicContact CD-CD1 4.04Å; K155-F299 HydrophobicContact CD-CD2 3.89Å; K155-F299 HydrophobicContact CD-CE1 3.87Å; K155-F299 HydrophobicContact CD-CE2 3.68Å; K155-F299 HydrophobicContact CD-CG 4.1Å; K155-F299 HydrophobicContact CD-CZ 3.71Å; F295-F299 HydrophobicContact CB-CB 4.22Å; F295-F299 HydrophobicContact CB-CD1 4.34Å; G296-F299 PolarHBondContact O-N 3.37Å; G296-F299 VanDerWaalsContact O-N 3.12Å; P297-F299 PolarHBondContact O-N 3.26Å; P297-F299 VanDerWaalsContact O-N 3.08Å; F299-L301 PolarHBondContact O-N 3.49Å; F299-L302 HydrophobicContact CB-CB 4.15Å; F299-L302 VanDerWaalsContact O-CB 3.23Å; F299-L302 WeakPolarHBondContact O-CB 3.28Å; F299-L302 PolarHBondContact O-N 2.82Å
300	A	89.2	Confident	87.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.2	-173.4	0	0	0	0	0	114.3	R144 P297 D298 P303 A388	R144-A300 HydrophobicContact CG-CB 4.09Å; P297-A300 PolarHBondContact O-N 2.03Å; D298-A300 PolarHBondContact O-N 2.8Å; A300-P303 WeakPolarHBondContact O-CD 3.17Å; A300-A388 HydrophobicContact CB-CB 4.22Å; A300-A388 VanDerWaalsContact O-CB 3.32Å; A300-A388 WeakPolarHBondContact O-CB 3.5Å
301	L	91	Very high	88	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.026	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-9.3	176.1	-67.4	167	0	0	0	114.3	F295 F299 P303 L304 F323 M361 A388	F295-L301 HydrophobicContact CB-CB 4.23Å; F295-L301 HydrophobicContact CD1-CB 4.26Å; F295-L301 WeakPolarHBondContact O-CB 3.07Å; F295-L301 PolarHBondContact O-N 2.9Å; F299-L301 PolarHBondContact O-N 3.49Å; L301-P303 VanDerWaalsContact C-CD 3.43Å; L301-L304 HydrophobicContact CD2-CD1 4.18Å; L301-L304 PolarHBondContact O-N 3.34Å; L301-F323 HydrophobicContact CB-CE2 3.83Å; L301-F323 HydrophobicContact CB-CZ 3.7Å; L301-F323 HydrophobicContact CD1-CZ 4.03Å; L301-F323 HydrophobicContact CG-CZ 4.44Å; L301-M361 HydrophobicContact CD1-CE 4.12Å; L301-M361 HydrophobicContact CD1-SD 3.9Å; L301-M361 HydrophobicContact CD2-CE 3.89Å; L301-M361 HydrophobicContact CD2-SD 3.76Å; L301-A388 HydrophobicContact CD2-CB 3.52Å; L301-A388 HydrophobicContact CG-CB 4.1Å
302	L	90.5	Very high	88.6	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.031	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-57	-40	179.9	175.7	63.2	0	0	0	113.2	A151 E154 K155 L290 F295 F299 L304 Y305	A151-L302 HydrophobicContact CB-CB 3.95Å; A151-L302 HydrophobicContact CB-CD2 4.03Å; A151-L302 HydrophobicContact CB-CG 4.4Å; A151-L302 WeakPolarHBondContact O-CD2 3.08Å; E154-L302 HydrophobicContact CB-CD2 4.45Å; K155-L302 HydrophobicContact CB-CD2 4.32Å; L290-L302 HydrophobicContact CD1-CD1 3.96Å; L290-L302 HydrophobicContact CD2-CD1 4.33Å; L290-L302 HydrophobicContact CG-CD1 4.31Å; F295-L302 HydrophobicContact CB-CB 4.21Å; F295-L302 VanDerWaalsContact CD1-CA 3.47Å; F295-L302 HydrophobicContact CD1-CB 4.07Å; F295-L302 HydrophobicContact CD1-CD1 4.4Å; F295-L302 HydrophobicContact CD2-CB 4.11Å; F295-L302 HydrophobicContact CD2-CD1 3.96Å; F295-L302 HydrophobicContact CE1-CB 4.49Å; F295-L302 HydrophobicContact CE1-CD1 4.03Å; F295-L302 HydrophobicContact CE2-CD1 3.55Å; F295-L302 HydrophobicContact CG-CB 3.86Å; F295-L302 HydrophobicContact CG-CD1 4.37Å; F295-L302 HydrophobicContact CZ-CD1 3.59Å; F299-L302 HydrophobicContact CB-CB 4.15Å; F299-L302 VanDerWaalsContact O-CB 3.23Å; F299-L302 WeakPolarHBondContact O-CB 3.28Å; F299-L302 PolarHBondContact O-N 2.82Å; L302-L304 PolarHBondContact O-N 2.95Å; L302-Y305 WeakPolarHBondContact O-CB 3.44Å; L302-Y305 PolarHBondContact O-N 2.98Å
303	P	92	Very high	88.8	Confident	39 Å²	39	54.8 Å²	54.8	25%	0.253	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-63.8	-13.9	178.3	-24.3	37.4	0	0	0	114	M147 A151 A300 L301	M147-P303 HydrophobicContact CB-CG 4.13Å; M147-P303 HydrophobicContact CE-CB 4.06Å; M147-P303 HydrophobicContact CE-CG 4.24Å; A151-P303 HydrophobicContact CB-CG 4.08Å; A300-P303 WeakPolarHBondContact O-CD 3.17Å; L301-P303 VanDerWaalsContact C-CD 3.43Å
304	L	92.6	Very high	88.6	Confident	12 Å²	12	58 Å²	58	6%	0.063	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-99.3	6.7	177.6	-56.7	176	0	0	0	112.4	M147 L301 L302 K306 E307 F309 L322 F384 T386 A388	M147-L304 HydrophobicContact CE-CD1 4.29Å; M147-L304 HydrophobicContact CE-CD2 4.27Å; M147-L304 HydrophobicContact CE-CG 4.03Å; L301-L304 HydrophobicContact CD2-CD1 4.18Å; L301-L304 PolarHBondContact O-N 3.34Å; L302-L304 PolarHBondContact O-N 2.95Å; L304-K306 PolarHBondContact O-N 3.16Å; L304-E307 WeakPolarHBondContact O-CB 3.44Å; L304-E307 PolarHBondContact O-N 3.47Å; L304-E307 VanDerWaalsContact O-N 3.08Å; L304-F309 HydrophobicContact CD2-CZ 4.14Å; L304-L322 HydrophobicContact CB-CD1 3.64Å; L304-L322 HydrophobicContact CD1-CD1 3.9Å; L304-L322 HydrophobicContact CG-CD1 4.36Å; L304-L322 WeakPolarHBondContact O-CB 3.39Å; L304-F384 HydrophobicContact CD1-CE1 4.06Å; L304-F384 HydrophobicContact CD1-CZ 4.4Å; L304-T386 WeakPolarHBondContact CD1-OG1 3.42Å; L304-A388 HydrophobicContact CD1-CB 4.44Å
305	Y	88.7	Confident	88.4	Confident	53 Å²	53	61.6 Å²	61.6	21%	0.208	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	118.4	179.6	179.3	-105.4	0	0	0	111.2	L290 I293 F295 L302 E307 F323	L290-Y305 HydrophobicContact CD1-CD1 3.28Å; L290-Y305 HydrophobicContact CD1-CD2 3.61Å; L290-Y305 HydrophobicContact CD1-CE1 3.31Å; L290-Y305 HydrophobicContact CD1-CE2 3.68Å; L290-Y305 HydrophobicContact CD1-CG 3.41Å; L290-Y305 VanDerWaalsContact CD1-CG 3.41Å; I293-Y305 HydrophobicContact CD1-CD2 4.22Å; I293-Y305 HydrophobicContact CD1-CE2 3.51Å; F295-Y305 AromaticContact CE1-CD2 3.77Å; F295-Y305 HydrophobicContact CE1-CD2 3.77Å; F295-Y305 HydrophobicContact CE1-CG 4.25Å; F295-Y305 AromaticContact CZ-CD2 3.72Å; F295-Y305 HydrophobicContact CZ-CD2 3.72Å; F295-Y305 HydrophobicContact CZ-CE2 4.41Å; F295-Y305 HydrophobicContact CZ-CG 4.2Å; L302-Y305 WeakPolarHBondContact O-CB 3.44Å; L302-Y305 PolarHBondContact O-N 2.98Å; Y305-E307 PolarHBondContact O-N 3.41Å; Y305-F323 HydrophobicContact CD2-CB 3.54Å; Y305-F323 HydrophobicContact CD2-CD2 4.35Å; Y305-F323 HydrophobicContact CD2-CG 4.17Å; Y305-F323 HydrophobicContact CE2-CB 3.77Å
306	K	87.9	Confident	88.3	Confident	95 Å²	95	68.1 Å²	68.1	41%	0.413	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	10.6	-174.8	-60.2	-174.1	170.9	-161	0	115.6	L304 L322 D324	L304-K306 PolarHBondContact O-N 3.16Å; K306-L322 WeakPolarHBondContact CA-O 3.19Å; K306-L322 PolarHBondContact N-O 2.73Å; K306-D324 VanDerWaalsContact CE-OD1 3.22Å; K306-D324 WeakPolarHBondContact CE-OD1 3.26Å; K306-D324 HydrophobicContact CG-CB 4.21Å; K306-D324 IonicContact NZ-OD1 3.81Å
307	E	93.5	Very high	88.7	Confident	104 Å²	104	71.4 Å²	71.4	49%	0.486	35%	0.353	S	S	.	.			trans	-72.9	138	170.4	-69.9	-60.5	139.5	0	0	110.1	L304 Y305 F309 C321 L322	L304-E307 WeakPolarHBondContact O-CB 3.44Å; L304-E307 PolarHBondContact O-N 3.47Å; L304-E307 VanDerWaalsContact O-N 3.08Å; Y305-E307 PolarHBondContact O-N 3.41Å; E307-F309 HydrophobicContact CB-CE2 3.84Å; E307-F309 HydrophobicContact CB-CZ 4.14Å; E307-C321 WeakPolarHBondContact O-CA 3.18Å; E307-L322 PolarHBondContact O-N 3.1Å
308	C	94.2	Very high	88.9	Confident	55 Å²	55	70.5 Å²	70.5	37%	0.372	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.2	-173.9	-59.5	0	0	0	0	112.3	L320 C321	C308-L320 CarbonylContact C-O 3.52Å; C308-L320 WeakPolarHBondContact CA-O 3.29Å; C308-C321 HydrophobicContact CB-CB 4.16Å; C308-C321 WeakPolarHBondContact CB-SG 3Å; C308-C321 WeakPolarHBondContact SG-CB 3.21Å; C308-C321 CovalentContact SG-SG 2.05Å; C308-C321 PolarHBondContact SG-SG 3.15Å
309	F	95.2	Very high	89.3	Confident	36 Å²	36	73.3 Å²	73.3	16%	0.158	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	143.8	-178.7	-57.1	-89.8	0	0	0	110.2	L304 E307 K319 L320 L322 S367 L369 F384	L304-F309 HydrophobicContact CD2-CZ 4.14Å; E307-F309 HydrophobicContact CB-CE2 3.84Å; E307-F309 HydrophobicContact CB-CZ 4.14Å; F309-K319 CarbonylContact O-C 3.54Å; F309-K319 WeakPolarHBondContact O-CA 3.18Å; F309-L320 PolarHBondContact N-O 3.16Å; F309-L320 PolarHBondContact O-N 3.46Å; F309-L322 HydrophobicContact CE2-CD1 4.22Å; F309-S367 WeakPolarHBondContact CD1-O 3.38Å; F309-S367 WeakPolarHBondContact CE1-O 3.15Å; F309-L369 HydrophobicContact CB-CB 3.85Å; F309-F384 HydrophobicContact CB-CE2 4.09Å; F309-F384 HydrophobicContact CD1-CE2 4.02Å; F309-F384 HydrophobicContact CD2-CD2 4.46Å; F309-F384 AromaticContact CD2-CE2 3.4Å; F309-F384 HydrophobicContact CD2-CE2 3.4Å; F309-F384 AromaticContact CD2-CZ 3.72Å; F309-F384 HydrophobicContact CD2-CZ 3.72Å; F309-F384 HydrophobicContact CE1-CE2 4.33Å; F309-F384 HydrophobicContact CE1-CZ 4.39Å; F309-F384 AromaticContact CE2-CE2 3.77Å; F309-F384 HydrophobicContact CE2-CE2 3.77Å; F309-F384 AromaticContact CE2-CZ 3.57Å; F309-F384 HydrophobicContact CE2-CZ 3.57Å; F309-F384 AromaticContact CG-CE2 3.55Å; F309-F384 HydrophobicContact CG-CE2 3.55Å; F309-F384 HydrophobicContact CG-CZ 4.21Å; F309-F384 HydrophobicContact CZ-CE2 4.22Å; F309-F384 AromaticContact CZ-CZ 3.94Å; F309-F384 HydrophobicContact CZ-CZ 3.94Å
310	E	94.3	Very high	89.6	Confident	110 Å²	110	70.9 Å²	70.9	51%	0.514	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142.2	-175.8	-66	-177.3	-175.8	0	0	111.4	T317 Y318 K319	E310-T317 HydrophobicContact CB-CG2 4.38Å; E310-Y318 CarbonylContact C-O 3.24Å; E310-Y318 VanDerWaalsContact CA-O 3.24Å; E310-Y318 WeakPolarHBondContact CA-O 3.23Å; E310-K319 HydrophobicContact CG-CB 3.97Å; E310-K319 HydrophobicContact CG-CD 4.32Å; E310-K319 HydrophobicContact CG-CG 3.83Å; E310-K319 WeakPolarHBondContact OE1-CD 3.31Å; E310-K319 IonicContact OE1-NZ 3.98Å
311	V	93.3	Very high	89.7	Confident	27 Å²	27	72.3 Å²	72.3	16%	0.164	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	140.9	168.9	71.2	0	0	0	0	108.9	Y318 L369 A372	V311-Y318 HydrophobicContact CG1-CD2 4.44Å; V311-Y318 PolarHBondContact N-O 2.89Å; V311-Y318 PolarHBondContact O-N 3.17Å; V311-L369 HydrophobicContact CB-CB 4.29Å; V311-L369 HydrophobicContact CB-CD2 4.03Å; V311-L369 HydrophobicContact CB-CG 3.9Å; V311-L369 HydrophobicContact CG1-CD2 3.59Å; V311-L369 HydrophobicContact CG1-CG 3.67Å; V311-A372 HydrophobicContact CG1-CB 3.82Å
312	R	90.4	Very high	89.7	Confident	206 Å²	206	72 Å²	72	78%	0.777	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	122.6	175.2	-65.4	-174	-179.1	169.2	2.9	108.8	T317	R312-T317 HydrophobicContact CG-CG2 4.16Å
313	D	81.7	Confident	89.5	Confident	81 Å²	81	72 Å²	72	43%	0.433	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	152.6	163.3	-174.8	21.3	0	0	0	108.4	Q315 Y316 Y318	D313-Q315 CarbonylContact O-C 3.55Å; D313-Q315 PolarHBondContact O-N 3.1Å; D313-Y316 PolarHBondContact N-O 3.38Å; D313-Y316 PolarHBondContact O-N 2.82Å; D313-Y318 HydrophobicContact CB-CE2 4.05Å
314	S	74.8	Confident	89	Confident	110 Å²	110	73.3 Å²	73.3	77%	0.769	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-18.2	-38.2	-173.1	57.3	0	0	0	0	119.1
315	Q	81.4	Confident	87.8	Confident	156 Å²	156	81.1 Å²	81.1	73%	0.729	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	-12.5	178.9	-60.9	-176.8	-6.2	0	0	115.7	D313	D313-Q315 CarbonylContact O-C 3.55Å; D313-Q315 PolarHBondContact O-N 3.1Å
316	Y	84.2	Confident	85.7	Confident	143 Å²	143	79.4 Å²	79.4	56%	0.561	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.5	145	-170.4	-61.3	-77.7	0	0	0	112	D313	D313-Y316 PolarHBondContact N-O 3.38Å; D313-Y316 PolarHBondContact O-N 2.82Å
317	T	89.8	Confident	83.3	Confident	78 Å²	78	82.8 Å²	82.8	48%	0.479	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.8	167.2	-57	0	0	0	0	107.9	E310 R312	E310-T317 HydrophobicContact CB-CG2 4.38Å; R312-T317 HydrophobicContact CG-CG2 4.16Å
318	Y	90.5	Very high	80.3	Confident	38 Å²	38	84.2 Å²	84.2	15%	0.149	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	131	174.6	-63.2	-93.5	0	0	0	108.5	E310 V311 D313 A372 Y380 L382	E310-Y318 CarbonylContact C-O 3.24Å; E310-Y318 VanDerWaalsContact CA-O 3.24Å; E310-Y318 WeakPolarHBondContact CA-O 3.23Å; V311-Y318 HydrophobicContact CG1-CD2 4.44Å; V311-Y318 PolarHBondContact N-O 2.89Å; V311-Y318 PolarHBondContact O-N 3.17Å; D313-Y318 HydrophobicContact CB-CE2 4.05Å; Y318-A372 HydrophobicContact CD1-CB 3.8Å; Y318-A372 HydrophobicContact CD2-CB 3.36Å; Y318-A372 HydrophobicContact CE1-CB 4.15Å; Y318-A372 HydrophobicContact CE2-CB 3.75Å; Y318-A372 HydrophobicContact CG-CB 3.38Å; Y318-Y380 AromaticContact CE1-CD1 3.81Å; Y318-Y380 HydrophobicContact CE1-CD1 3.81Å; Y318-Y380 AromaticContact CE1-CE1 4Å; Y318-Y380 HydrophobicContact CE1-CE1 4Å; Y318-L382 HydrophobicContact CD1-CD2 4.43Å
319	K	93.4	Very high	78	Confident	127 Å²	127	83.8 Å²	83.8	55%	0.552	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	120.8	177.8	-177.1	175.4	-174.7	168	0	109.2	F309 E310	F309-K319 CarbonylContact O-C 3.54Å; F309-K319 WeakPolarHBondContact O-CA 3.18Å; E310-K319 HydrophobicContact CG-CB 3.97Å; E310-K319 HydrophobicContact CG-CD 4.32Å; E310-K319 HydrophobicContact CG-CG 3.83Å; E310-K319 WeakPolarHBondContact OE1-CD 3.31Å; E310-K319 IonicContact OE1-NZ 3.98Å
320	L	92.3	Very high	75.4	Confident	7 Å²	7	84.9 Å²	84.9	4%	0.037	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.2	176.4	171.8	61.1	0	0	0	108.9	C308 F309 L322 Y343 V359 L369 L382 F384	C308-L320 CarbonylContact C-O 3.52Å; C308-L320 WeakPolarHBondContact CA-O 3.29Å; F309-L320 PolarHBondContact N-O 3.16Å; F309-L320 PolarHBondContact O-N 3.46Å; L320-L322 HydrophobicContact CD1-CD2 4.33Å; L320-L322 HydrophobicContact CD2-CD2 4.06Å; L320-L322 HydrophobicContact CG-CD2 4.23Å; L320-L322 HydrophobicContact CG-CG 4.5Å; L320-Y343 HydrophobicContact CD1-CE2 4.23Å; L320-V359 HydrophobicContact CD1-CG2 3.67Å; L320-V359 HydrophobicContact CD2-CG1 3.77Å; L320-V359 HydrophobicContact CD2-CG2 4.07Å; L320-L369 HydrophobicContact CB-CD1 4.42Å; L320-L369 HydrophobicContact CB-CD2 3.98Å; L320-L369 HydrophobicContact CD2-CD1 4.04Å; L320-L382 HydrophobicContact CB-CD1 4.17Å; L320-L382 HydrophobicContact CD1-CD1 4.28Å; L320-L382 HydrophobicContact CD2-CD1 4.47Å; L320-F384 HydrophobicContact CD2-CB 4.16Å; L320-F384 HydrophobicContact CD2-CD2 3.92Å; L320-F384 HydrophobicContact CD2-CG 4.11Å
321	C	92.6	Very high	73.2	Confident	30 Å²	30	81.4 Å²	81.4	20%	0.203	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	114.6	168.3	-59.6	0	0	0	0	108.7	E307 C308 F323 D324	E307-C321 WeakPolarHBondContact O-CA 3.18Å; C308-C321 HydrophobicContact CB-CB 4.16Å; C308-C321 WeakPolarHBondContact CB-SG 3Å; C308-C321 WeakPolarHBondContact SG-CB 3.21Å; C308-C321 CovalentContact SG-SG 2.05Å; C308-C321 PolarHBondContact SG-SG 3.15Å; C321-F323 PolarHBondContact O-N 3.27Å; C321-D324 HydrophobicContact CB-CB 4.12Å
322	L	91.1	Very high	70.8	Confident	0 Å²	0	82 Å²	82	0%	0	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	132.1	-172.6	-71.5	171.6	0	0	0	111	L304 K306 E307 F309 L320 D324 M361 F384	L304-L322 HydrophobicContact CB-CD1 3.64Å; L304-L322 HydrophobicContact CD1-CD1 3.9Å; L304-L322 HydrophobicContact CG-CD1 4.36Å; L304-L322 WeakPolarHBondContact O-CB 3.39Å; K306-L322 WeakPolarHBondContact CA-O 3.19Å; K306-L322 PolarHBondContact N-O 2.73Å; E307-L322 PolarHBondContact O-N 3.1Å; F309-L322 HydrophobicContact CE2-CD1 4.22Å; L320-L322 HydrophobicContact CD1-CD2 4.33Å; L320-L322 HydrophobicContact CD2-CD2 4.06Å; L320-L322 HydrophobicContact CG-CD2 4.23Å; L320-L322 HydrophobicContact CG-CG 4.5Å; L322-D324 PolarHBondContact O-N 3.04Å; L322-M361 HydrophobicContact CD2-CE 3.97Å; L322-F384 HydrophobicContact CD1-CD1 4.31Å; L322-F384 HydrophobicContact CD1-CE1 3.59Å; L322-F384 HydrophobicContact CD1-CZ 3.74Å
323	F	86.3	Confident	68.5	Low	6 Å²	6	78.1 Å²	78.1	3%	0.026	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	17	177.5	-50.5	-85.6	0	0	0	117.1	I293 F295 L301 Y305 C321 I329 Y343	I293-F323 HydrophobicContact CD1-CB 4.48Å; I293-F323 HydrophobicContact CG2-CD1 3.44Å; I293-F323 VanDerWaalsContact CG2-CD1 3.44Å; I293-F323 HydrophobicContact CG2-CE1 3.64Å; I293-F323 HydrophobicContact CG2-CG 4.31Å; F295-F323 HydrophobicContact CD1-CD1 4.46Å; F295-F323 HydrophobicContact CD1-CD2 4.23Å; F295-F323 AromaticContact CD1-CE1 3.96Å; F295-F323 HydrophobicContact CD1-CE1 3.96Å; F295-F323 AromaticContact CD1-CE2 3.71Å; F295-F323 HydrophobicContact CD1-CE2 3.71Å; F295-F323 AromaticContact CD1-CZ 3.53Å; F295-F323 HydrophobicContact CD1-CZ 3.53Å; F295-F323 HydrophobicContact CE1-CD1 4.16Å; F295-F323 AromaticContact CE1-CD2 3.86Å; F295-F323 HydrophobicContact CE1-CD2 3.86Å; F295-F323 HydrophobicContact CE1-CE1 4.11Å; F295-F323 AromaticContact CE1-CE2 3.83Å; F295-F323 HydrophobicContact CE1-CE2 3.83Å; F295-F323 HydrophobicContact CE1-CG 4.01Å; F295-F323 AromaticContact CE1-CZ 3.93Å; F295-F323 HydrophobicContact CE1-CZ 3.93Å; L301-F323 HydrophobicContact CB-CE2 3.83Å; L301-F323 HydrophobicContact CB-CZ 3.7Å; L301-F323 HydrophobicContact CD1-CZ 4.03Å; L301-F323 HydrophobicContact CG-CZ 4.44Å; Y305-F323 HydrophobicContact CD2-CB 3.54Å; Y305-F323 HydrophobicContact CD2-CD2 4.35Å; Y305-F323 HydrophobicContact CD2-CG 4.17Å; Y305-F323 HydrophobicContact CE2-CB 3.77Å; C321-F323 PolarHBondContact O-N 3.27Å; F323-I329 HydrophobicContact CB-CD1 4.13Å; F323-I329 HydrophobicContact CD1-CD1 3.8Å; F323-I329 HydrophobicContact CG-CD1 4.37Å; F323-Y343 PolarHBondContact N-OH 2.96Å
324	D	80.4	Confident	66.6	Low	66 Å²	66	78.6 Å²	78.6	35%	0.353	40%	0.397	S	S	.	.	S	Bend	trans	-94.1	-111.4	177.6	-157.4	30.9	0	0	0	110.7	K306 C321 L322 A326	K306-D324 VanDerWaalsContact CE-OD1 3.22Å; K306-D324 WeakPolarHBondContact CE-OD1 3.26Å; K306-D324 HydrophobicContact CG-CB 4.21Å; K306-D324 IonicContact NZ-OD1 3.81Å; C321-D324 HydrophobicContact CB-CB 4.12Å; L322-D324 PolarHBondContact O-N 3.04Å; D324-A326 PolarHBondContact O-N 3.03Å
325	E	66.9	Low	64.9	Low	176 Å²	176	81.2 Å²	81.2	82%	0.822	40%	0.397	S	S	*	.	S	Bend	trans	-82.9	87.4	-175.3	-65	-173.2	166.3	0	0	113.1
326	A	45.1	Very low	63.3	Low	16 Å²	16	80.2 Å²	80.2	13%	0.132	40%	0.401	C	S	.	.			trans	-147.5	126.8	142.3	0	0	0	0	0	110.6	D324 Q328 Y343	D324-A326 PolarHBondContact O-N 3.03Å; A326-Q328 PolarHBondContact O-N 2.99Å; A326-Y343 HydrophobicContact CB-CD1 3.36Å; A326-Y343 HydrophobicContact CB-CE1 4.26Å; A326-Y343 HydrophobicContact CB-CG 3.83Å
327	F	37.1	Very low	61.7	Low	167 Å²	167	77.8 Å²	77.8	73%	0.732	41%	0.405	S	S	*	.	S	Bend	trans	-70.5	101.8	176.5	-65.9	-91.2	0	0	0	108.1	N345	F327-N345 PolarHBondContact O-ND2 3.31Å; F327-N345 VanDerWaalsContact O-ND2 3.13Å
328	Q	31	Very low	60.5	Low	134 Å²	134	76.6 Å²	76.6	63%	0.626	40%	0.398	S	S	*	.			trans	87.4	87.1	-178.7	-158.4	172.7	10.1	0	0	114.5	A326 T330	A326-Q328 PolarHBondContact O-N 2.99Å; Q328-T330 HydrophobicContact CG-CG2 4.35Å; Q328-T330 PolarHBondContact O-N 3.08Å
329	I	46.6	Very low	59.9	Low	45 Å²	45	75.8 Å²	75.8	23%	0.231	39%	0.394	C	S	.	.			trans	-78.5	101.4	163.2	-55.5	168.4	0	0	0	106.6	F323 V331 Q341	F323-I329 HydrophobicContact CB-CD1 4.13Å; F323-I329 HydrophobicContact CD1-CD1 3.8Å; F323-I329 HydrophobicContact CG-CD1 4.37Å; I329-V331 HydrophobicContact CG2-CG2 3.86Å; I329-V331 PolarHBondContact O-N 3.04Å; I329-Q341 HydrophobicContact CG2-CG 4.39Å
330	T	39.3	Very low	59.6	Low	60 Å²	60	72.8 Å²	72.8	37%	0.368	38%	0.382	S	S	.	.			trans	-82.9	108	157.8	45.5	0	0	0	0	107	Q328 A332	Q328-T330 HydrophobicContact CG-CG2 4.35Å; Q328-T330 PolarHBondContact O-N 3.08Å; T330-A332 PolarHBondContact O-N 2.97Å
331	V	49.7	Very low	59.3	Low	36 Å²	36	72.6 Å²	72.6	22%	0.218	38%	0.38	C	S	.	.			trans	-74.5	88.1	164.3	-173.4	0	0	0	0	105.7	I329 F333	I329-V331 HydrophobicContact CG2-CG2 3.86Å; I329-V331 PolarHBondContact O-N 3.04Å; V331-F333 HydrophobicContact CG1-CD2 4.46Å; V331-F333 HydrophobicContact CG1-CE2 4.03Å; V331-F333 HydrophobicContact CG1-CZ 4.41Å; V331-F333 PolarHBondContact O-N 3.38Å
332	A	41.2	Very low	59.2	Low	39 Å²	39	73.3 Å²	73.3	32%	0.322	38%	0.382	S	S	.	.			trans	-82.3	110.9	175.9	0	0	0	0	0	108.3	T330 I334	T330-A332 PolarHBondContact O-N 2.97Å; A332-I334 VanDerWaalsContact C-N 3.35Å; A332-I334 HydrophobicContact CB-CD1 3.98Å; A332-I334 HydrophobicContact CB-CG1 3.88Å; A332-I334 PolarHBondContact O-N 2.88Å; A332-I334 VanDerWaalsContact O-N 3.08Å
333	F	43.9	Very low	59.1	Low	125 Å²	125	74.5 Å²	74.5	55%	0.548	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-73.5	91.8	165.4	-70.3	-92.3	0	0	0	107.7	V331	V331-F333 HydrophobicContact CG1-CD2 4.46Å; V331-F333 HydrophobicContact CG1-CE2 4.03Å; V331-F333 HydrophobicContact CG1-CZ 4.41Å; V331-F333 PolarHBondContact O-N 3.38Å
334	I	40.1	Very low	59.2	Low	92 Å²	92	77.5 Å²	77.5	47%	0.472	40%	0.401	S	S	.	.			trans	-108.7	110.3	175.3	-56	176.7	0	0	0	106.8	A332	A332-I334 VanDerWaalsContact C-N 3.35Å; A332-I334 HydrophobicContact CB-CD1 3.98Å; A332-I334 HydrophobicContact CB-CG1 3.88Å; A332-I334 PolarHBondContact O-N 2.88Å; A332-I334 VanDerWaalsContact O-N 3.08Å
335	E	39.2	Very low	59.5	Low	164 Å²	164	79 Å²	79	77%	0.766	41%	0.409	S	S	*	.	S	Bend	trans	66.3	136.2	-175.2	-64.5	172.4	161.1	0	0	113.6	S337 V338	E335-S337 PolarHBondContact O-N 3.35Å; E335-V338 PolarHBondContact O-N 2.75Å
336	T	47.7	Very low	60.4	Low	135 Å²	135	72.1 Å²	72.1	83%	0.828	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	9.8	-162.9	43	0	0	0	0	116.3
337	S	52.4	Low	62.4	Low	92 Å²	92	78.5 Å²	78.5	64%	0.643	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.5	-9.7	-169.5	-36.1	0	0	0	0	114	E335	E335-S337 PolarHBondContact O-N 3.35Å
338	V	63.7	Low	65	Low	53 Å²	53	75.1 Å²	75.1	32%	0.321	41%	0.409	S	S	.	.			trans	-130.8	115.5	-173	-172.4	0	0	0	0	111.4	E335 K340 V360	E335-V338 PolarHBondContact O-N 2.75Å; V338-K340 HydrophobicContact CG1-CG 4.2Å; V338-V360 HydrophobicContact CG1-CG1 3.6Å
339	R	77.3	Confident	67.7	Low	21 Å²	21	69.9 Å²	69.9	8%	0.079	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	130.4	173.5	-65.9	-173.7	-172.5	163.7	10.6	110.1	M361 A388	R339-M361 HydrophobicContact CB-CB 4.15Å; R339-M361 HydrophobicContact CB-SD 4.21Å; R339-M361 WeakPolarHBondContact O-CB 3.02Å; R339-M361 PolarHBondContact O-N 2.73Å; R339-A388 PolarHBondContact NH1-O 2.85Å
340	K	87	Confident	69.7	Low	65 Å²	65	78.4 Å²	78.4	28%	0.283	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	143.8	178.9	-61.8	-179.9	-175.9	173	0	110.7	V338 T358 V359 V360	V338-K340 HydrophobicContact CG1-CG 4.2Å; K340-T358 HydrophobicContact CD-CG2 4.31Å; K340-V359 CarbonylContact C-O 3.6Å; K340-V359 VanDerWaalsContact CA-O 3.23Å; K340-V359 WeakPolarHBondContact CA-O 3.45Å; K340-V360 HydrophobicContact CG-CG2 4.31Å
341	Q	87.7	Confident	72	Confident	3 Å²	3	82.3 Å²	82.3	1%	0.014	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.3	164.8	-70.5	-177.1	-4.3	0	0	109.2	I329 Y343 V359 M361	I329-Q341 HydrophobicContact CG2-CG 4.39Å; Q341-Y343 HydrophobicContact CB-CD2 4.35Å; Q341-Y343 HydrophobicContact CB-CE2 3.63Å; Q341-Y343 PolarHBondContact OE1-OH 2.73Å; Q341-V359 HydrophobicContact CB-CB 4.26Å; Q341-V359 PolarHBondContact N-O 3.14Å; Q341-V359 PolarHBondContact O-N 3.32Å; Q341-M361 HydrophobicContact CG-CE 3.79Å
342	L	89.1	Confident	73.7	Confident	45 Å²	45	81.9 Å²	81.9	24%	0.236	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128.4	177.1	-172	65.8	0	0	0	109.8	E344	L342-E344 HydrophobicContact CD1-CG 4.34Å; L342-E344 VanDerWaalsContact CD2-CD 3.45Å; L342-E344 HydrophobicContact CD2-CG 3.68Å; L342-E344 HydrophobicContact CG-CG 3.61Å
343	Y	89.2	Confident	76.1	Confident	25 Å²	25	83.9 Å²	83.9	10%	0.098	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	107.6	176.2	-66.4	-106.3	0	0	0	107.8	L320 F323 A326 Q341 T356 T357 V359	L320-Y343 HydrophobicContact CD1-CE2 4.23Å; F323-Y343 PolarHBondContact N-OH 2.96Å; A326-Y343 HydrophobicContact CB-CD1 3.36Å; A326-Y343 HydrophobicContact CB-CE1 4.26Å; A326-Y343 HydrophobicContact CB-CG 3.83Å; Q341-Y343 HydrophobicContact CB-CD2 4.35Å; Q341-Y343 HydrophobicContact CB-CE2 3.63Å; Q341-Y343 PolarHBondContact OE1-OH 2.73Å; Y343-T356 CarbonylContact O-C 3.55Å; Y343-T356 WeakPolarHBondContact O-CA 3.47Å; Y343-T357 PolarHBondContact N-O 3.34Å; Y343-T357 PolarHBondContact O-N 2.52Å; Y343-V359 HydrophobicContact CD2-CG2 3.8Å; Y343-V359 HydrophobicContact CE2-CB 4.26Å; Y343-V359 HydrophobicContact CE2-CG2 3.48Å; Y343-V359 VanDerWaalsContact CE2-CG2 3.48Å
344	E	88.1	Confident	78.3	Confident	69 Å²	69	81.1 Å²	81.1	32%	0.322	44%	0.441	S	S	.	.			trans	-112	175.6	-178	-53.7	-169.7	110.2	0	0	111.5	L342 G346	L342-E344 HydrophobicContact CD1-CG 4.34Å; L342-E344 VanDerWaalsContact CD2-CD 3.45Å; L342-E344 HydrophobicContact CD2-CG 3.68Å; L342-E344 HydrophobicContact CG-CG 3.61Å; E344-G346 VanDerWaalsContact C-N 3.27Å; E344-G346 PolarHBondContact O-N 2.85Å
345	N	86.5	Confident	80.8	Confident	98 Å²	98	81.5 Å²	81.5	52%	0.524	44%	0.437	S	S	.	.	S	Bend	trans	61.6	32.7	176.2	-53.8	-59.9	0	0	0	113.8	F327	F327-N345 PolarHBondContact O-ND2 3.31Å; F327-N345 VanDerWaalsContact O-ND2 3.13Å
346	G	86.4	Confident	83.3	Confident	31 Å²	31	75.4 Å²	75.4	32%	0.32	41%	0.411	S	S	.	.			trans	-68.9	177.1	173.7	0	0	0	0	0	112.9	E344 R355	E344-G346 VanDerWaalsContact C-N 3.27Å; E344-G346 PolarHBondContact O-N 2.85Å; G346-R355 VanDerWaalsContact CA-O 3.31Å; G346-R355 WeakPolarHBondContact CA-O 3.14Å; G346-R355 PolarHBondContact N-O 3.23Å
347	Q	88	Confident	85.4	Confident	150 Å²	150	70.4 Å²	70.4	70%	0.701	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-52.6	142.1	177.8	-175.2	177.9	-9.7	0	0	111.8	C349 R355	Q347-C349 PolarHBondContact O-N 3.43Å; Q347-R355 VanDerWaalsContact O-CG 3.3Å; Q347-R355 WeakPolarHBondContact O-CG 3.49Å; Q347-R355 PolarHBondContact O-N 2.98Å; Q347-R355 VanDerWaalsContact O-N 3.09Å
348	S	89.9	Confident	87.3	Confident	95 Å²	95	67.5 Å²	67.5	66%	0.664	36%	0.358	S	S	*	.	B	Isolated β-bridge	trans	-57.1	133.8	174.2	-56.4	0	0	0	0	111.2
349	C	88.7	Confident	88.8	Confident	25 Å²	25	65 Å²	65	17%	0.169	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-99	145	179.1	-157.8	0	0	0	0	110.7	Q347 N351 G352 P353 R355 C378	Q347-C349 PolarHBondContact O-N 3.43Å; C349-N351 PolarHBondContact O-N 2.87Å; C349-G352 PolarHBondContact O-N 3.34Å; C349-P353 WeakPolarHBondContact CB-O 3.45Å; C349-P353 PolarHBondContact N-O 3.26Å; C349-R355 HydrophobicContact CB-CG 4.26Å; C349-C378 HydrophobicContact CB-CB 3.47Å; C349-C378 VanDerWaalsContact CB-CB 3.47Å; C349-C378 WeakPolarHBondContact CB-SG 3.36Å; C349-C378 WeakPolarHBondContact SG-CB 3.31Å; C349-C378 CovalentContact SG-SG 1.99Å; C349-C378 PolarHBondContact SG-SG 2.93Å
350	W	88.1	Confident	89.5	Confident	223 Å²	223	65.1 Å²	65.1	85%	0.845	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	119.1	-179.3	-178.1	-91.7	0	0	0	110.7	G352	W350-G352 PolarHBondContact O-N 2.6Å; W350-G352 VanDerWaalsContact O-N 3.16Å
351	N	88.5	Confident	89.8	Confident	142 Å²	142	62.4 Å²	62.4	76%	0.759	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	23.3	-174.4	-66.4	-23	0	0	0	114.9	C349	C349-N351 PolarHBondContact O-N 2.87Å
352	G	85.8	Confident	90.1	Very high	28 Å²	28	65.5 Å²	65.5	29%	0.289	35%	0.349	S	S	.	.	S	Bend	trans	-130.3	176.1	-178.5	0	0	0	0	0	112.6	C349 W350	C349-G352 PolarHBondContact O-N 3.34Å; W350-G352 PolarHBondContact O-N 2.6Å; W350-G352 VanDerWaalsContact O-N 3.16Å
353	P	90.8	Very high	90.3	Very high	81 Å²	81	65.1 Å²	65.1	53%	0.526	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-64	172.4	169.7	29.9	-34.4	0	0	0	111.1	C349 R355 C378	C349-P353 WeakPolarHBondContact CB-O 3.45Å; C349-P353 PolarHBondContact N-O 3.26Å; P353-R355 PolarHBondContact O-N 3.27Å; P353-C378 HydrophobicContact CG-CB 4.46Å
354	T	90.9	Very high	90.5	Very high	67 Å²	67	63.9 Å²	63.9	41%	0.411	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-56.8	136.6	162.3	46.8	0	0	0	0	109.4	T356	T354-T356 PolarHBondContact O-N 3.23Å
355	R	91.7	Very high	90.8	Very high	100 Å²	100	62.2 Å²	62.2	38%	0.377	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-57.3	137.2	-178.8	-73.5	172.9	175	-165.7	-3.6	111.3	G346 Q347 C349 P353 C378 Y380	G346-R355 VanDerWaalsContact CA-O 3.31Å; G346-R355 WeakPolarHBondContact CA-O 3.14Å; G346-R355 PolarHBondContact N-O 3.23Å; Q347-R355 VanDerWaalsContact O-CG 3.3Å; Q347-R355 WeakPolarHBondContact O-CG 3.49Å; Q347-R355 PolarHBondContact O-N 2.98Å; Q347-R355 VanDerWaalsContact O-N 3.09Å; C349-R355 HydrophobicContact CB-CG 4.26Å; P353-R355 PolarHBondContact O-N 3.27Å; R355-C378 VanDerWaalsContact CA-O 3.29Å; R355-C378 WeakPolarHBondContact CA-O 3.31Å; R355-C378 HydrophobicContact CG-CB 4.01Å; R355-Y380 HydrophobicContact CB-CE2 4.39Å; R355-Y380 HydrophobicContact CG-CE2 4.11Å
356	T	92.5	Very high	91.2	Very high	35 Å²	35	61 Å²	61	22%	0.215	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	154.7	174.7	58.1	0	0	0	0	110	Y343 T354 C378 Y380	Y343-T356 CarbonylContact O-C 3.55Å; Y343-T356 WeakPolarHBondContact O-CA 3.47Å; T354-T356 PolarHBondContact O-N 3.23Å; T356-C378 PolarHBondContact N-O 2.82Å; T356-Y380 WeakPolarHBondContact O-CD2 3.42Å; T356-Y380 PolarHBondContact O-N 3.45Å
357	T	91.5	Very high	91.7	Very high	30 Å²	30	60.9 Å²	60.9	18%	0.184	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	130	178.3	-57.6	0	0	0	0	110.7	Y343 V359 Y380 L382	Y343-T357 PolarHBondContact N-O 3.34Å; Y343-T357 PolarHBondContact O-N 2.52Å; T357-V359 HydrophobicContact CG2-CG2 4.42Å; T357-Y380 CarbonylContact C-O 3.54Å; T357-Y380 VanDerWaalsContact CA-O 3.29Å; T357-Y380 WeakPolarHBondContact CA-O 3.32Å; T357-L382 HydrophobicContact CG2-CD1 3.65Å; T357-L382 HydrophobicContact CG2-CG 3.68Å
358	T	92.9	Very high	92.1	Very high	31 Å²	31	56 Å²	56	19%	0.19	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.9	170	-61.3	0	0	0	0	109	K340 V360 Y380 L381 L382	K340-T358 HydrophobicContact CD-CG2 4.31Å; T358-V360 HydrophobicContact CG2-CG2 4.34Å; T358-Y380 PolarHBondContact N-O 2.94Å; T358-L381 HydrophobicContact CG2-CD1 4.19Å; T358-L381 WeakPolarHBondContact O-CA 3.05Å; T358-L382 PolarHBondContact O-N 2.99Å
359	V	93.4	Very high	92.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	115.5	172.3	-178	0	0	0	0	108.4	L320 K340 Q341 Y343 T357 L382 F384	L320-V359 HydrophobicContact CD1-CG2 3.67Å; L320-V359 HydrophobicContact CD2-CG1 3.77Å; L320-V359 HydrophobicContact CD2-CG2 4.07Å; K340-V359 CarbonylContact C-O 3.6Å; K340-V359 VanDerWaalsContact CA-O 3.23Å; K340-V359 WeakPolarHBondContact CA-O 3.45Å; Q341-V359 HydrophobicContact CB-CB 4.26Å; Q341-V359 PolarHBondContact N-O 3.14Å; Q341-V359 PolarHBondContact O-N 3.32Å; Y343-V359 HydrophobicContact CD2-CG2 3.8Å; Y343-V359 HydrophobicContact CE2-CB 4.26Å; Y343-V359 HydrophobicContact CE2-CG2 3.48Å; Y343-V359 VanDerWaalsContact CE2-CG2 3.48Å; T357-V359 HydrophobicContact CG2-CG2 4.42Å; V359-L382 CarbonylContact C-O 3.59Å; V359-L382 WeakPolarHBondContact CA-O 3.03Å; V359-L382 HydrophobicContact CG2-CB 4.19Å; V359-L382 HydrophobicContact CG2-CD1 4.17Å; V359-F384 HydrophobicContact CG1-CB 3.72Å
360	V	93.6	Very high	92.6	Very high	24 Å²	24	58.3 Å²	58.3	15%	0.145	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.9	172.7	175.1	0	0	0	0	108.5	V338 K340 T358 L381 L382 F384	V338-V360 HydrophobicContact CG1-CG1 3.6Å; K340-V360 HydrophobicContact CG-CG2 4.31Å; T358-V360 HydrophobicContact CG2-CG2 4.34Å; V360-L381 HydrophobicContact CG2-CD1 3.65Å; V360-L382 PolarHBondContact N-O 3.44Å; V360-F384 PolarHBondContact O-N 2.6Å
361	M	92.3	Very high	92.9	Very high	8 Å²	8	49.7 Å²	49.7	4%	0.039	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122	178.7	-59.3	-178.1	165.9	0	0	110.9	L301 L322 R339 Q341 F384 A389	L301-M361 HydrophobicContact CD1-CE 4.12Å; L301-M361 HydrophobicContact CD1-SD 3.9Å; L301-M361 HydrophobicContact CD2-CE 3.89Å; L301-M361 HydrophobicContact CD2-SD 3.76Å; L322-M361 HydrophobicContact CD2-CE 3.97Å; R339-M361 HydrophobicContact CB-CB 4.15Å; R339-M361 HydrophobicContact CB-SD 4.21Å; R339-M361 WeakPolarHBondContact O-CB 3.02Å; R339-M361 PolarHBondContact O-N 2.73Å; Q341-M361 HydrophobicContact CG-CE 3.79Å; M361-F384 CarbonylContact C-O 3.48Å; M361-F384 VanDerWaalsContact CA-O 3.25Å; M361-F384 WeakPolarHBondContact CA-O 3.05Å; M361-F384 HydrophobicContact CG-CD1 4.49Å; M361-A389 HydrophobicContact CB-CB 3.98Å
362	E	93.6	Very high	93.2	Very high	69 Å²	69	43.3 Å²	43.3	32%	0.322	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	146.8	175.6	-66.6	-177.5	165.7	0	0	110.5	R370 T383 F384 Q385 T386	E362-R370 IonicContact OE1-NH1 3.34Å; E362-R370 IonicContact OE2-CZ 3.95Å; E362-R370 IonicContact OE2-NH1 3.64Å; E362-R370 PolarHBondContact OE2-NH1 2.98Å; E362-T383 HydrophobicContact CG-CG2 3.77Å; E362-T383 WeakPolarHBondContact OE1-CG2 3.4Å; E362-T383 VanDerWaalsContact OE2-CG2 3.29Å; E362-T383 WeakPolarHBondContact OE2-CG2 3.41Å; E362-F384 PolarHBondContact N-O 3.17Å; E362-Q385 CarbonylContact O-C 3.57Å; E362-Q385 WeakPolarHBondContact O-CA 3.36Å; E362-T386 PolarHBondContact O-N 3.34Å
363	C	93.8	Very high	93.5	Very high	36 Å²	36	45.2 Å²	45.2	24%	0.243	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	136.2	173.1	171.2	0	0	0	0	111.1	H137 C390	H137-C363 PolarHBondContact CD2-SG 2.6Å; C363-C390 WeakPolarHBondContact CA-SG 3.24Å; C363-C390 HydrophobicContact CB-CB 3.93Å; C363-C390 WeakPolarHBondContact CB-SG 3.47Å; C363-C390 VanDerWaalsContact SG-CA 3.54Å; C363-C390 WeakPolarHBondContact SG-CB 3.23Å; C363-C390 CovalentContact SG-SG 2.04Å; C363-C390 PolarHBondContact SG-SG 3.5Å
364	G	94	Very high	93.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.242	C	C	.	.			trans	-160.5	177	169.3	0	0	0	0	0	112.1	G140 T386 P387 C390	G140-G364 VanDerWaalsContact CA-O 3.26Å; G140-G364 WeakPolarHBondContact CA-O 3.41Å; G364-T386 PolarHBondContact N-O 3.21Å; G364-P387 WeakPolarHBondContact O-CA 3.28Å; G364-P387 WeakPolarHBondContact O-CG 3.47Å; G364-C390 PolarHBondContact N-SG 3.49Å
365	S	93.8	Very high	93.6	Very high	34 Å²	34	46.3 Å²	46.3	24%	0.238	25%	0.248	C	C	.	.	S	Bend	trans	-80.4	-18.7	-179.5	50.1	0	0	0	0	113.6	L136 P387	L136-S365 WeakPolarHBondContact CD1-OG 3.32Å; S365-P387 VanDerWaalsContact O-CG 3.31Å; S365-P387 WeakPolarHBondContact O-CG 3.24Å
366	D	95.4	Very high	93.6	Very high	73 Å²	73	44.3 Å²	44.3	39%	0.39	25%	0.25	S	C	.	.	S	Bend	trans	-136.5	160.7	-176.9	65.6	-27.2	0	0	0	112	T368 Q385 T386 P387	D366-T368 VanDerWaalsContact OD2-CG2 3.26Å; D366-T368 WeakPolarHBondContact OD2-CG2 3.09Å; D366-Q385 CarbonylContact O-C 3.55Å; D366-Q385 PolarHBondContact OD1-NE2 3.12Å; D366-T386 WeakPolarHBondContact O-CA 3.42Å; D366-P387 WeakPolarHBondContact O-CD 3.48Å
367	S	96.7	Very high	93.5	Very high	27 Å²	27	48.4 Å²	48.4	19%	0.189	27%	0.268	C	S	.	.			trans	-94.6	110.4	177.2	-70.3	0	0	0	0	110.7	F309 Q385 T386	F309-S367 WeakPolarHBondContact CD1-O 3.38Å; F309-S367 WeakPolarHBondContact CE1-O 3.15Å; S367-Q385 CarbonylContact C-O 3.56Å; S367-Q385 VanDerWaalsContact CA-O 3.23Å; S367-Q385 WeakPolarHBondContact CA-O 3.26Å; S367-T386 WeakPolarHBondContact OG-CB 3.35Å; S367-T386 PolarHBondContact OG-OG1 2.03Å
368	T	96.5	Very high	93.5	Very high	49 Å²	49	47 Å²	47	30%	0.301	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	147.7	-177.6	55.8	0	0	0	0	112.3	D366 R370 F384 Q385	D366-T368 VanDerWaalsContact OD2-CG2 3.26Å; D366-T368 WeakPolarHBondContact OD2-CG2 3.09Å; T368-R370 PolarHBondContact O-N 3.46Å; T368-F384 WeakPolarHBondContact O-CD2 3.3Å; T368-Q385 PolarHBondContact N-O 3.35Å; T368-Q385 PolarHBondContact O-N 3.13Å
369	L	95.1	Very high	93.5	Very high	13 Å²	13	49.3 Å²	49.3	7%	0.068	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	107.9	170.5	-173.5	57.5	0	0	0	108.9	F309 V311 L320 L382 F384	F309-L369 HydrophobicContact CB-CB 3.85Å; V311-L369 HydrophobicContact CB-CB 4.29Å; V311-L369 HydrophobicContact CB-CD2 4.03Å; V311-L369 HydrophobicContact CB-CG 3.9Å; V311-L369 HydrophobicContact CG1-CD2 3.59Å; V311-L369 HydrophobicContact CG1-CG 3.67Å; L320-L369 HydrophobicContact CB-CD1 4.42Å; L320-L369 HydrophobicContact CB-CD2 3.98Å; L320-L369 HydrophobicContact CD2-CD1 4.04Å; L369-L382 HydrophobicContact CD1-CB 4.06Å; L369-L382 HydrophobicContact CD1-CD1 4.48Å; L369-F384 HydrophobicContact CB-CD2 4.46Å; L369-F384 HydrophobicContact CD1-CD2 4.47Å
370	R	95	Very high	93.4	Very high	154 Å²	154	50.5 Å²	50.5	58%	0.581	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	-42.3	-169.8	-174.1	-178.6	177.4	-150.6	-2.3	112.6	E362 T368 T383	E362-R370 IonicContact OE1-NH1 3.34Å; E362-R370 IonicContact OE2-CZ 3.95Å; E362-R370 IonicContact OE2-NH1 3.64Å; E362-R370 PolarHBondContact OE2-NH1 2.98Å; T368-R370 PolarHBondContact O-N 3.46Å; R370-T383 HydrophobicContact CB-CG2 4.44Å; R370-T383 WeakPolarHBondContact CB-O 3.34Å; R370-T383 PolarHBondContact N-O 3.45Å
371	S	94.3	Very high	93.4	Very high	43 Å²	43	52.3 Å²	52.3	30%	0.301	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	158.4	-179.8	61.6	0	0	0	0	111.9	L382 T383	S371-L382 WeakPolarHBondContact O-CA 3.21Å; S371-T383 PolarHBondContact N-O 3.47Å; S371-T383 PolarHBondContact O-N 2.87Å; S371-T383 VanDerWaalsContact OG-CB 3.3Å; S371-T383 WeakPolarHBondContact OG-CB 2.98Å; S371-T383 PolarHBondContact OG-OG1 3.42Å
372	A	93	Very high	93.5	Very high	8 Å²	8	52.4 Å²	52.4	7%	0.066	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	128.6	172.5	0	0	0	0	0	108.6	V311 Y318 L382	V311-A372 HydrophobicContact CG1-CB 3.82Å; Y318-A372 HydrophobicContact CD1-CB 3.8Å; Y318-A372 HydrophobicContact CD2-CB 3.36Å; Y318-A372 HydrophobicContact CE1-CB 4.15Å; Y318-A372 HydrophobicContact CE2-CB 3.75Å; Y318-A372 HydrophobicContact CG-CB 3.38Å; A372-L382 HydrophobicContact CB-CD2 3.26Å
373	T	93	Very high	93.6	Very high	68 Å²	68	50 Å²	50	42%	0.417	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	153.9	177	60.1	0	0	0	0	110.2	P375 Y380 L381	T373-P375 VanDerWaalsContact C-CD 3.49Å; T373-P375 VanDerWaalsContact O-CD 3.29Å; T373-P375 WeakPolarHBondContact O-CD 3.12Å; T373-Y380 CarbonylContact O-C 3.54Å; T373-Y380 WeakPolarHBondContact O-CA 3.48Å; T373-L381 PolarHBondContact N-O 2.96Å; T373-L381 PolarHBondContact O-N 3.19Å; T373-L381 PolarHBondContact OG1-O 3.5Å
374	E	91	Very high	93.7	Very high	88 Å²	88	48.3 Å²	48.3	41%	0.411	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	80.9	175	-173.7	171.5	-179.3	0	0	108.5	S376 C378 E379 Y380	E374-S376 VanDerWaalsContact C-N 3.27Å; E374-S376 WeakPolarHBondContact CG-O 3.46Å; E374-S376 PolarHBondContact O-N 2.04Å; E374-C378 PolarHBondContact OE1-N 2.79Å; E374-E379 WeakPolarHBondContact CA-O 3.07Å; E374-Y380 HydrophobicContact CB-CD1 3.92Å; E374-Y380 HydrophobicContact CB-CE1 3.95Å; E374-Y380 VanDerWaalsContact CD-CE1 3.48Å; E374-Y380 HydrophobicContact CG-CD1 4.03Å; E374-Y380 HydrophobicContact CG-CE1 3.8Å; E374-Y380 VanDerWaalsContact OE2-CE1 3.31Å; E374-Y380 WeakPolarHBondContact OE2-CE1 3.21Å
375	P	92	Very high	93.7	Very high	82 Å²	82	49.9 Å²	49.9	53%	0.532	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	-30.9	-176.9	24.4	-36.2	0	0	0	113.6	T373 E379 L381	T373-P375 VanDerWaalsContact C-CD 3.49Å; T373-P375 VanDerWaalsContact O-CD 3.29Å; T373-P375 WeakPolarHBondContact O-CD 3.12Å; P375-E379 VanDerWaalsContact CD-O 3.25Å; P375-E379 WeakPolarHBondContact CD-O 3.3Å; P375-L381 HydrophobicContact CG-CB 4.14Å
376	S	92.6	Very high	93.8	Very high	59 Å²	59	48.3 Å²	48.3	41%	0.413	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	158.1	175.6	-42.6	0	0	0	0	109.6	E374 C378 E379	E374-S376 VanDerWaalsContact C-N 3.27Å; E374-S376 WeakPolarHBondContact CG-O 3.46Å; E374-S376 PolarHBondContact O-N 2.04Å; S376-C378 PolarHBondContact O-N 3Å; S376-E379 VanDerWaalsContact CB-OE2 3.26Å; S376-E379 WeakPolarHBondContact CB-OE2 3.36Å; S376-E379 PolarHBondContact O-N 2.65Å; S376-E379 VanDerWaalsContact O-O 3.14Å; S376-E379 PolarHBondContact OG-OE2 2.98Å
377	M	90.6	Very high	93.9	Very high	121 Å²	121	44.9 Å²	44.9	60%	0.596	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.3	117	176	175	179.8	-62	0	0	111.2	E379	M377-E379 PolarHBondContact O-N 3.49Å
378	C	90.2	Very high	93.7	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.007	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	14.4	177.3	-33.7	0	0	0	0	115.1	C349 P353 R355 T356 E374 S376	C349-C378 HydrophobicContact CB-CB 3.47Å; C349-C378 VanDerWaalsContact CB-CB 3.47Å; C349-C378 WeakPolarHBondContact CB-SG 3.36Å; C349-C378 WeakPolarHBondContact SG-CB 3.31Å; C349-C378 CovalentContact SG-SG 1.99Å; C349-C378 PolarHBondContact SG-SG 2.93Å; P353-C378 HydrophobicContact CG-CB 4.46Å; R355-C378 VanDerWaalsContact CA-O 3.29Å; R355-C378 WeakPolarHBondContact CA-O 3.31Å; R355-C378 HydrophobicContact CG-CB 4.01Å; T356-C378 PolarHBondContact N-O 2.82Å; E374-C378 PolarHBondContact OE1-N 2.79Å; S376-C378 PolarHBondContact O-N 3Å
379	E	93.2	Very high	93.6	Very high	78 Å²	78	41.9 Å²	41.9	36%	0.364	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	117.4	173.6	-176.3	-177.2	-175.6	0	0	108.1	E374 P375 S376 M377	E374-E379 WeakPolarHBondContact CA-O 3.07Å; P375-E379 VanDerWaalsContact CD-O 3.25Å; P375-E379 WeakPolarHBondContact CD-O 3.3Å; S376-E379 VanDerWaalsContact CB-OE2 3.26Å; S376-E379 WeakPolarHBondContact CB-OE2 3.36Å; S376-E379 PolarHBondContact O-N 2.65Å; S376-E379 VanDerWaalsContact O-O 3.14Å; S376-E379 PolarHBondContact OG-OE2 2.98Å; M377-E379 PolarHBondContact O-N 3.49Å
380	Y	91.8	Very high	93.4	Very high	26 Å²	26	41.3 Å²	41.3	10%	0.102	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	142.5	-178.1	-56.8	-81.2	0	0	0	111.2	Y318 R355 T356 T357 T358 T373 E374	Y318-Y380 AromaticContact CE1-CD1 3.81Å; Y318-Y380 HydrophobicContact CE1-CD1 3.81Å; Y318-Y380 AromaticContact CE1-CE1 4Å; Y318-Y380 HydrophobicContact CE1-CE1 4Å; R355-Y380 HydrophobicContact CB-CE2 4.39Å; R355-Y380 HydrophobicContact CG-CE2 4.11Å; T356-Y380 WeakPolarHBondContact O-CD2 3.42Å; T356-Y380 PolarHBondContact O-N 3.45Å; T357-Y380 CarbonylContact C-O 3.54Å; T357-Y380 VanDerWaalsContact CA-O 3.29Å; T357-Y380 WeakPolarHBondContact CA-O 3.32Å; T358-Y380 PolarHBondContact N-O 2.94Å; T373-Y380 CarbonylContact O-C 3.54Å; T373-Y380 WeakPolarHBondContact O-CA 3.48Å; E374-Y380 HydrophobicContact CB-CD1 3.92Å; E374-Y380 HydrophobicContact CB-CE1 3.95Å; E374-Y380 VanDerWaalsContact CD-CE1 3.48Å; E374-Y380 HydrophobicContact CG-CD1 4.03Å; E374-Y380 HydrophobicContact CG-CE1 3.8Å; E374-Y380 VanDerWaalsContact OE2-CE1 3.31Å; E374-Y380 WeakPolarHBondContact OE2-CE1 3.21Å
381	L	93.6	Very high	93.2	Very high	61 Å²	61	37 Å²	37	32%	0.319	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.3	171.2	178.6	66	0	0	0	108.7	T358 V360 T373 P375	T358-L381 HydrophobicContact CG2-CD1 4.19Å; T358-L381 WeakPolarHBondContact O-CA 3.05Å; V360-L381 HydrophobicContact CG2-CD1 3.65Å; T373-L381 PolarHBondContact N-O 2.96Å; T373-L381 PolarHBondContact O-N 3.19Å; T373-L381 PolarHBondContact OG1-O 3.5Å; P375-L381 HydrophobicContact CG-CB 4.14Å
382	L	94.2	Very high	92.9	Very high	10 Å²	10	37.4 Å²	37.4	5%	0.052	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	132.5	177.8	-60.3	-175.6	0	0	0	109.4	Y318 L320 T357 T358 V359 V360 L369 S371 A372	Y318-L382 HydrophobicContact CD1-CD2 4.43Å; L320-L382 HydrophobicContact CB-CD1 4.17Å; L320-L382 HydrophobicContact CD1-CD1 4.28Å; L320-L382 HydrophobicContact CD2-CD1 4.47Å; T357-L382 HydrophobicContact CG2-CD1 3.65Å; T357-L382 HydrophobicContact CG2-CG 3.68Å; T358-L382 PolarHBondContact O-N 2.99Å; V359-L382 CarbonylContact C-O 3.59Å; V359-L382 WeakPolarHBondContact CA-O 3.03Å; V359-L382 HydrophobicContact CG2-CB 4.19Å; V359-L382 HydrophobicContact CG2-CD1 4.17Å; V360-L382 PolarHBondContact N-O 3.44Å; L369-L382 HydrophobicContact CD1-CB 4.06Å; L369-L382 HydrophobicContact CD1-CD1 4.48Å; S371-L382 WeakPolarHBondContact O-CA 3.21Å; A372-L382 HydrophobicContact CB-CD2 3.26Å
383	T	95.3	Very high	92.2	Very high	19 Å²	19	38.9 Å²	38.9	12%	0.117	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	114.9	170.7	-58.3	0	0	0	0	109	E362 R370 S371	E362-T383 HydrophobicContact CG-CG2 3.77Å; E362-T383 WeakPolarHBondContact OE1-CG2 3.4Å; E362-T383 VanDerWaalsContact OE2-CG2 3.29Å; E362-T383 WeakPolarHBondContact OE2-CG2 3.41Å; R370-T383 HydrophobicContact CB-CG2 4.44Å; R370-T383 WeakPolarHBondContact CB-O 3.34Å; R370-T383 PolarHBondContact N-O 3.45Å; S371-T383 PolarHBondContact N-O 3.47Å; S371-T383 PolarHBondContact O-N 2.87Å; S371-T383 VanDerWaalsContact OG-CB 3.3Å; S371-T383 WeakPolarHBondContact OG-CB 2.98Å; S371-T383 PolarHBondContact OG-OG1 3.42Å
384	F	95.6	Very high	91.4	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	117.8	-179	-176.2	-108.3	0	0	0	110.1	L304 F309 L320 L322 V359 V360 M361 E362 T368 L369 T386	L304-F384 HydrophobicContact CD1-CE1 4.06Å; L304-F384 HydrophobicContact CD1-CZ 4.4Å; F309-F384 HydrophobicContact CB-CE2 4.09Å; F309-F384 HydrophobicContact CD1-CE2 4.02Å; F309-F384 HydrophobicContact CD2-CD2 4.46Å; F309-F384 AromaticContact CD2-CE2 3.4Å; F309-F384 HydrophobicContact CD2-CE2 3.4Å; F309-F384 AromaticContact CD2-CZ 3.72Å; F309-F384 HydrophobicContact CD2-CZ 3.72Å; F309-F384 HydrophobicContact CE1-CE2 4.33Å; F309-F384 HydrophobicContact CE1-CZ 4.39Å; F309-F384 AromaticContact CE2-CE2 3.77Å; F309-F384 HydrophobicContact CE2-CE2 3.77Å; F309-F384 AromaticContact CE2-CZ 3.57Å; F309-F384 HydrophobicContact CE2-CZ 3.57Å; F309-F384 AromaticContact CG-CE2 3.55Å; F309-F384 HydrophobicContact CG-CE2 3.55Å; F309-F384 HydrophobicContact CG-CZ 4.21Å; F309-F384 HydrophobicContact CZ-CE2 4.22Å; F309-F384 AromaticContact CZ-CZ 3.94Å; F309-F384 HydrophobicContact CZ-CZ 3.94Å; L320-F384 HydrophobicContact CD2-CB 4.16Å; L320-F384 HydrophobicContact CD2-CD2 3.92Å; L320-F384 HydrophobicContact CD2-CG 4.11Å; L322-F384 HydrophobicContact CD1-CD1 4.31Å; L322-F384 HydrophobicContact CD1-CE1 3.59Å; L322-F384 HydrophobicContact CD1-CZ 3.74Å; V359-F384 HydrophobicContact CG1-CB 3.72Å; V360-F384 PolarHBondContact O-N 2.6Å; M361-F384 CarbonylContact C-O 3.48Å; M361-F384 VanDerWaalsContact CA-O 3.25Å; M361-F384 WeakPolarHBondContact CA-O 3.05Å; M361-F384 HydrophobicContact CG-CD1 4.49Å; E362-F384 PolarHBondContact N-O 3.17Å; T368-F384 WeakPolarHBondContact O-CD2 3.3Å; L369-F384 HydrophobicContact CB-CD2 4.46Å; L369-F384 HydrophobicContact CD1-CD2 4.47Å; F384-T386 HydrophobicContact CD1-CG2 3.82Å; F384-T386 HydrophobicContact CE1-CG2 3.72Å
385	Q	95.6	Very high	90.3	Very high	34 Å²	34	40.2 Å²	40.2	16%	0.159	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	133.6	175.5	-178.4	173.4	-53.5	0	0	108.9	E362 D366 S367 T368	E362-Q385 CarbonylContact O-C 3.57Å; E362-Q385 WeakPolarHBondContact O-CA 3.36Å; D366-Q385 CarbonylContact O-C 3.55Å; D366-Q385 PolarHBondContact OD1-NE2 3.12Å; S367-Q385 CarbonylContact C-O 3.56Å; S367-Q385 VanDerWaalsContact CA-O 3.23Å; S367-Q385 WeakPolarHBondContact CA-O 3.26Å; T368-Q385 PolarHBondContact N-O 3.35Å; T368-Q385 PolarHBondContact O-N 3.13Å
386	T	95.8	Very high	88.9	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	144.3	175.5	179.4	0	0	0	0	113.2	L304 E362 G364 D366 S367 F384 A388 A389	L304-T386 WeakPolarHBondContact CD1-OG1 3.42Å; E362-T386 PolarHBondContact O-N 3.34Å; G364-T386 PolarHBondContact N-O 3.21Å; D366-T386 WeakPolarHBondContact O-CA 3.42Å; S367-T386 WeakPolarHBondContact OG-CB 3.35Å; S367-T386 PolarHBondContact OG-OG1 2.03Å; F384-T386 HydrophobicContact CD1-CG2 3.82Å; F384-T386 HydrophobicContact CE1-CG2 3.72Å; T386-A388 HydrophobicContact CG2-CB 4.12Å; T386-A388 PolarHBondContact O-N 3.02Å; T386-A388 PolarHBondContact OG1-N 3Å; T386-A389 HydrophobicContact CG2-CB 3.9Å; T386-A389 PolarHBondContact O-N 3.09Å
387	P	96	Very high	87	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.013	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-53.8	-34.7	168.3	-28.7	36.5	0	0	0	112.8	G140 T143 R144 M147 G364 S365 D366 A389 C390	G140-P387 WeakPolarHBondContact O-CB 3.28Å; T143-P387 HydrophobicContact CG2-CB 3.78Å; T143-P387 HydrophobicContact CG2-CG 3.68Å; R144-P387 VanDerWaalsContact CB-O 3.3Å; R144-P387 WeakPolarHBondContact CB-O 3.18Å; M147-P387 HydrophobicContact SD-CB 3.87Å; M147-P387 HydrophobicContact SD-CG 4.3Å; G364-P387 WeakPolarHBondContact O-CA 3.28Å; G364-P387 WeakPolarHBondContact O-CG 3.47Å; S365-P387 VanDerWaalsContact O-CG 3.31Å; S365-P387 WeakPolarHBondContact O-CG 3.24Å; D366-P387 WeakPolarHBondContact O-CD 3.48Å; P387-A389 PolarHBondContact O-N 2.92Å; P387-C390 WeakPolarHBondContact O-CB 3.47Å; P387-C390 PolarHBondContact O-N 2.94Å
388	A	93.9	Very high	85	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-59.3	-22	-177.2	0	0	0	0	0	113.6	M147 A300 L301 L304 R339 T386	M147-A388 HydrophobicContact CE-CB 4.3Å; A300-A388 HydrophobicContact CB-CB 4.22Å; A300-A388 VanDerWaalsContact O-CB 3.32Å; A300-A388 WeakPolarHBondContact O-CB 3.5Å; L301-A388 HydrophobicContact CD2-CB 3.52Å; L301-A388 HydrophobicContact CG-CB 4.1Å; L304-A388 HydrophobicContact CD1-CB 4.44Å; R339-A388 PolarHBondContact NH1-O 2.85Å; T386-A388 HydrophobicContact CG2-CB 4.12Å; T386-A388 PolarHBondContact O-N 3.02Å; T386-A388 PolarHBondContact OG1-N 3Å
389	A	92.8	Very high	82.8	Confident	13 Å²	13	52.1 Å²	52.1	11%	0.107	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-89	-9.5	177.5	0	0	0	0	0	114	M361 T386 P387	M361-A389 HydrophobicContact CB-CB 3.98Å; T386-A389 HydrophobicContact CG2-CB 3.9Å; T386-A389 PolarHBondContact O-N 3.09Å; P387-A389 PolarHBondContact O-N 2.92Å
390	C	92.8	Very high	80.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-72.7	133	-178.6	-60.9	0	0	0	0	112.5	R144 C363 G364 P387	R144-C390 WeakPolarHBondContact CD-O 3.38Å; R144-C390 PolarHBondContact NH1-O 2.92Å; C363-C390 WeakPolarHBondContact CA-SG 3.24Å; C363-C390 HydrophobicContact CB-CB 3.93Å; C363-C390 WeakPolarHBondContact CB-SG 3.47Å; C363-C390 VanDerWaalsContact SG-CA 3.54Å; C363-C390 WeakPolarHBondContact SG-CB 3.23Å; C363-C390 CovalentContact SG-SG 2.04Å; C363-C390 PolarHBondContact SG-SG 3.5Å; G364-C390 PolarHBondContact N-SG 3.49Å; P387-C390 WeakPolarHBondContact O-CB 3.47Å; P387-C390 PolarHBondContact O-N 2.94Å
391	E	89.1	Confident	77.1	Confident	63 Å²	63	62.3 Å²	62.3	29%	0.294	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-93.9	166.7	178.8	-63	-159.4	155.6	0	0	111.3	H137 Y141 S395	H137-E391 PolarHBondContact CE1-O 3.09Å; Y141-E391 VanDerWaalsContact CD2-C 3.46Å; Y141-E391 WeakPolarHBondContact CD2-O 3.25Å; E391-S395 VanDerWaalsContact CB-OG 3.28Å; E391-S395 WeakPolarHBondContact CB-OG 3.46Å
392	P	88.4	Confident	74.2	Confident	53 Å²	53	68.2 Å²	68.2	34%	0.344	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-57.3	136.1	172.7	-22.2	33.7	0	0	0	110.3	Y141 D394 S395	Y141-P392 HydrophobicContact CE2-CB 4.08Å; Y141-P392 HydrophobicContact CE2-CG 3.85Å; P392-D394 PolarHBondContact O-N 2.85Å; P392-S395 WeakPolarHBondContact O-CB 3.36Å; P392-S395 PolarHBondContact O-N 2.89Å; P392-S395 PolarHBondContact O-OG 3.23Å
393	P	79.3	Confident	73.2	Confident	39 Å²	39	71.1 Å²	71.1	25%	0.253	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-53.1	-27.8	-175.3	-28.9	34.2	0	0	0	115.3	R138 Y141 S395 L396	R138-P393 HydrophobicContact CG-CG 4.26Å; Y141-P393 HydrophobicContact CD1-CG 4.3Å; P393-S395 PolarHBondContact O-N 3.35Å; P393-L396 WeakPolarHBondContact O-CB 3.31Å; P393-L396 PolarHBondContact O-N 3.04Å; P393-L396 VanDerWaalsContact O-N 3.16Å
394	D	76	Confident	72	Confident	134 Å²	134	73.8 Å²	73.8	72%	0.717	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-64.5	-18.6	177.6	-57.6	-27.2	0	0	0	113.1	P392 L396 H397	P392-D394 PolarHBondContact O-N 2.85Å; D394-L396 VanDerWaalsContact C-N 3.35Å; D394-H397 PolarHBondContact O-CD2 2.94Å
395	S	68.1	Low	70.7	Confident	49 Å²	49	77.9 Å²	77.9	34%	0.343	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-77.3	-16.7	175.9	62.8	0	0	0	0	113.9	E391 P392 P393 H397	E391-S395 VanDerWaalsContact CB-OG 3.28Å; E391-S395 WeakPolarHBondContact CB-OG 3.46Å; P392-S395 WeakPolarHBondContact O-CB 3.36Å; P392-S395 PolarHBondContact O-N 2.89Å; P392-S395 PolarHBondContact O-OG 3.23Å; P393-S395 PolarHBondContact O-N 3.35Å; S395-H397 PolarHBondContact O-N 3.41Å; S395-H397 VanDerWaalsContact O-N 3.1Å
396	L	62.1	Low	69.2	Low	72 Å²	72	80.5 Å²	80.5	38%	0.377	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-73.3	0.7	-177.3	-70.8	173.2	0	0	0	114.3	H137 P393 D394 H398	H137-L396 HydrophobicContact CB-CD1 4.14Å; H137-L396 WeakPolarHBondContact ND1-CD1 3.29Å; P393-L396 WeakPolarHBondContact O-CB 3.31Å; P393-L396 PolarHBondContact O-N 3.04Å; P393-L396 VanDerWaalsContact O-N 3.16Å; D394-L396 VanDerWaalsContact C-N 3.35Å; L396-H398 PolarHBondContact O-N 3.49Å; L396-H398 VanDerWaalsContact O-N 3.15Å
397	H	53.5	Low	67.6	Low	124 Å²	124	85.6 Å²	85.6	57%	0.574	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-77.6	9.6	-172.1	-81.8	-73.7	0	0	0	115.5	D394 S395	D394-H397 PolarHBondContact O-CD2 2.94Å; S395-H397 PolarHBondContact O-N 3.41Å; S395-H397 VanDerWaalsContact O-N 3.1Å
398	H	48.3	Very low	65.7	Low	175 Å²	175	91.1 Å²	91.1	81%	0.81	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-110.9	-0.7	-175.7	-73.1	-55.3	0	0	0	116.9	L396 H400	L396-H398 PolarHBondContact O-N 3.49Å; L396-H398 VanDerWaalsContact O-N 3.15Å; H398-H400 PolarHBondContact O-N 3.03Å
399	E	43.4	Very low	63.7	Low	143 Å²	143	97.6 Å²	97.6	67%	0.668	50%	0.495	S	S	*	.	S	Bend	trans	-90.9	80.7	168.6	-71.7	-176.9	165.2	0	0	110.3	K133	K133-E399 IonicContact NZ-OE2 2.61Å; K133-E399 PolarHBondContact NZ-OE2 3.3Å
400	H	37.3	Very low	61.4	Low	150 Å²	150	104.2 Å²	104.2	69%	0.694	53%	0.525	S	S	*	.			trans	50.4	83.8	164	-70.7	-116.6	0	0	0	116.8	H398 L402	H398-H400 PolarHBondContact O-N 3.03Å; H400-L402 VanDerWaalsContact C-N 3.34Å; H400-L402 VanDerWaalsContact ND1-CD1 3.29Å; H400-L402 WeakPolarHBondContact ND1-CD1 3.22Å; H400-L402 PolarHBondContact O-N 2.81Å
401	E	28.8	Very low	58.8	Low	167 Å²	167	112.8 Å²	112.8	78%	0.78	57%	0.569	S	S	*	*			trans	-68	98.9	136.7	-78.7	-178	165.6	0	0	107.5
402	L	31.4	Very low	56	Low	185 Å²	185	117.4 Å²	117.4	97%	0.969	59%	0.594	S	S	*	*			trans	-135.7	0	166.3	-108.5	151.9	0	0	0	109	H400	H400-L402 VanDerWaalsContact C-N 3.34Å; H400-L402 VanDerWaalsContact ND1-CD1 3.29Å; H400-L402 WeakPolarHBondContact ND1-CD1 3.22Å; H400-L402 PolarHBondContact O-N 2.81Å

Retrieved 402 of 402 residues in 181.1 ms (Link to these results)

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