A0A087X9J5_POEFO Loading...

Very-long-chain enoyl-CoA reductase

Involved in both the production of very long-chain fatty acids for sphingolipid synthesis and the degradation of the sphingosine moiety in sphingolipids through the sphingosine 1-phosphate metabolic pathway. Catalyzes the last of the four reactions of the long-chain fatty acids elongation cycle. This endoplasmic reticulum-bound enzymatic process, allows the addition of 2 carbons to the chain of long- and very long-chain fatty acids/VLCFAs per cycle. This enzyme reduces the trans-2,3-enoyl-CoA fatty acid intermediate to an acyl-CoA that can be further elongated by entering a new cycle of elongation. Thereby, it participates in the production of VLCFAs of different chain lengths that are involved in multiple biological processes as precursors of membrane lipids and lipid mediators. Catalyzes the saturation step of the sphingosine 1-phosphate metabolic pathway, the conversion of trans-2-hexadecenoyl-CoA to palmitoyl-CoA.

AlphaFold DB , UniProt , Accession A0A087X9J5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 342 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	34.5	Very low	221 Å²	221	163.7 Å²	163.7	100%	1.089	88%	0.883	S	S	*	*				0	40.3	0	-63.4	-89.2	-91.9	0	0	108.1
2	D	31.5	Very low	34.4	Very low	159 Å²	159	163.8 Å²	163.8	85%	0.85	88%	0.883	S	S	*	*				91.4	73.9	78.1	-71.4	3.9	0	0	0	110.8
3	I	33.1	Very low	34.1	Very low	168 Å²	168	157.2 Å²	157.2	86%	0.862	88%	0.877	S	S	*	*	S	Bend	trans	-105.6	90.5	158.8	-61.7	175.5	0	0	0	104.2
4	L	37.4	Very low	34.1	Very low	177 Å²	177	153.3 Å²	153.3	93%	0.927	87%	0.874	S	S	*	*			trans	-178.6	46.3	164.6	-102.3	171.9	0	0	0	112.1
5	A	34.5	Very low	34	Very low	91 Å²	91	156.8 Å²	156.8	75%	0.752	88%	0.88	S	S	*	*			trans	-158.3	86.4	168.1	0	0	0	0	0	110
6	L	31.6	Very low	34.3	Very low	180 Å²	180	152.8 Å²	152.8	94%	0.942	87%	0.873	S	S	*	*			trans	-177.7	49.4	152.6	-98.6	155.6	0	0	0	110.6
7	E	36.2	Very low	34.4	Very low	200 Å²	200	155.8 Å²	155.8	94%	0.935	88%	0.878	S	S	*	*			trans	-113.3	79.3	159.8	-93.6	-174.3	154.7	0	0	108
8	A	36.8	Very low	34.8	Very low	87 Å²	87	158.4 Å²	158.4	72%	0.719	88%	0.878	S	S	*	*	S	Bend	trans	177.8	80.1	158.7	0	0	0	0	0	109.7
9	K	33.8	Very low	35.3	Very low	212 Å²	212	160.3 Å²	160.3	92%	0.922	88%	0.876	S	S	*	*			trans	171	95.6	149.6	-100.5	168.4	-179.4	-179.5	0	109.7
10	S	32.6	Very low	35.5	Very low	122 Å²	122	158.8 Å²	158.8	85%	0.853	87%	0.874	S	S	*	*			trans	174.4	69.4	137.3	-171.2	0	0	0	0	108.6
11	Q	35.2	Very low	36.1	Very low	184 Å²	184	157.2 Å²	157.2	86%	0.86	87%	0.87	S	S	*	*			trans	-100.3	113.8	154.8	-86.3	-174.4	-23.7	0	0	106.2
12	N	33.3	Very low	36.5	Very low	165 Å²	165	152.6 Å²	152.6	88%	0.882	86%	0.856	S	S	*	*			trans	150	111.7	144.4	-76.6	-15.6	0	0	0	110.6
13	G	31.6	Very low	37.3	Very low	78 Å²	78	154.5 Å²	154.5	80%	0.804	86%	0.857	S	S	*	*			trans	177.9	80.9	174.1	0	0	0	0	0	113
14	A	33.5	Very low	38	Very low	102 Å²	102	152.5 Å²	152.5	84%	0.843	86%	0.855	S	S	*	*			trans	30.5	118.7	153.6	0	0	0	0	0	120.2	A16	A14-A16 PolarHBondContact O-N 2.98Å
15	E	31.9	Very low	38.6	Very low	206 Å²	206	153.3 Å²	153.3	96%	0.963	85%	0.851	S	S	*	*			trans	-64.6	123.1	163.9	-83.9	179	139.5	0	0	111.7
16	A	39	Very low	39.3	Very low	93 Å²	93	155 Å²	155	77%	0.769	85%	0.854	S	S	*	*			trans	-100	128	162.8	0	0	0	0	0	109.8	A14 K18	A14-A16 PolarHBondContact O-N 2.98Å; A16-K18 PolarHBondContact O-N 3.22Å
17	E	37	Very low	40.2	Very low	203 Å²	203	156.2 Å²	156.2	95%	0.949	85%	0.852	S	S	*	*			trans	-55.7	115.3	-178.3	-137.4	177	-176.8	0	0	112.4
18	K	40.5	Very low	40.8	Very low	203 Å²	203	150.7 Å²	150.7	88%	0.883	84%	0.841	S	S	*	*			trans	-84.6	112.2	174.5	-89.3	179.8	177.6	171.3	0	110.8	A16	A16-K18 PolarHBondContact O-N 3.22Å
19	K	44.3	Very low	41.4	Very low	195 Å²	195	152.3 Å²	152.3	85%	0.848	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-57.1	139.6	164.5	-82.8	179.9	176.1	175.7	0	111	T21	K19-T21 PolarHBondContact O-N 3.28Å
20	P	40.3	Very low	42.3	Very low	129 Å²	129	152.2 Å²	152.2	84%	0.838	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-69.2	129.8	179.8	26.2	-31	0	0	0	111.2
21	T	47.6	Very low	43.1	Very low	127 Å²	127	155.9 Å²	155.9	78%	0.779	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-69.9	138.6	172.3	26	0	0	0	0	110.5	K19 K23	K19-T21 PolarHBondContact O-N 3.28Å; T21-K23 PolarHBondContact O-N 2.82Å
22	P	44.8	Very low	43.8	Very low	124 Å²	124	151.6 Å²	151.6	81%	0.805	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-70.3	131.5	179.8	26.8	-31.4	0	0	0	110.7
23	K	48.5	Very low	44.8	Very low	199 Å²	199	153 Å²	153	87%	0.865	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-54	137.3	176.7	-74.6	178.8	177	176.4	0	110.9	T21 K25	T21-K23 PolarHBondContact O-N 2.82Å; K23-K25 PolarHBondContact O-N 2.76Å
24	P	48.3	Very low	46.2	Very low	126 Å²	126	160.9 Å²	160.9	82%	0.818	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-65.7	130.2	176.4	25.2	-30.2	0	0	0	110.2
25	K	50.4	Low	47.8	Very low	194 Å²	194	160.3 Å²	160.3	84%	0.843	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-57.9	143.7	174.9	-78.1	-178.7	177.3	177.7	0	110.4	K23 K27	K23-K25 PolarHBondContact O-N 2.76Å; K25-K27 PolarHBondContact O-N 2.93Å
26	P	47.3	Very low	50.1	Low	126 Å²	126	154.9 Å²	154.9	82%	0.818	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-58.6	130.2	174.6	-15.9	27.8	0	0	0	109.9	A28	P26-A28 PolarHBondContact O-N 2.87Å
27	K	51.5	Low	52.4	Low	205 Å²	205	155.5 Å²	155.5	89%	0.891	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-59.2	125.7	169.5	-77	178.4	177.6	173.3	0	108.1	K25	K25-K27 PolarHBondContact O-N 2.93Å
28	A	48.7	Very low	54.9	Low	85 Å²	85	147 Å²	147	70%	0.702	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-52.7	139	176	0	0	0	0	0	110.3	P26 K30	P26-A28 PolarHBondContact O-N 2.87Å; A28-K30 PolarHBondContact O-N 3.16Å
29	P	49.3	Very low	57.4	Low	121 Å²	121	140.7 Å²	140.7	79%	0.786	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-58.6	126.6	177.4	23	-30.7	0	0	0	108.8	K31	P29-K31 PolarHBondContact O-N 3.34Å
30	K	53.6	Low	59.8	Low	209 Å²	209	131.4 Å²	131.4	91%	0.909	68%	0.682	S	S	*	*			trans	-55.5	112.7	171.2	-72.5	-179	178.4	178.1	0	106.9	A28 A32	A28-K30 PolarHBondContact O-N 3.16Å; K30-A32 PolarHBondContact O-N 2.92Å; K30-A32 VanDerWaalsContact O-N 3.15Å
31	K	48.5	Very low	62.4	Low	200 Å²	200	127.1 Å²	127.1	87%	0.87	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-49.1	124	174.5	-75.5	-177.5	177.3	180	0	108.2	P29 K33	P29-K31 PolarHBondContact O-N 3.34Å; K31-K33 PolarHBondContact O-N 3.35Å; K31-K33 VanDerWaalsContact O-N 3.12Å
32	A	50	Low	64.7	Low	93 Å²	93	121.1 Å²	121.1	77%	0.769	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-54.2	120	172.4	0	0	0	0	0	108	K30 R34	K30-A32 PolarHBondContact O-N 2.92Å; K30-A32 VanDerWaalsContact O-N 3.15Å; A32-R34 PolarHBondContact O-N 3.22Å; A32-R34 VanDerWaalsContact O-N 3.09Å
33	K	55.2	Low	67.1	Low	194 Å²	194	116.1 Å²	116.1	84%	0.843	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-59.6	116.8	170.4	-78.4	-177.3	175.6	-177.7	0	106.3	K31 I35	K31-K33 PolarHBondContact O-N 3.35Å; K31-K33 VanDerWaalsContact O-N 3.12Å; K33-I35 VanDerWaalsContact C-N 3.34Å; K33-I35 PolarHBondContact O-N 3.43Å
34	R	60	Low	69.3	Low	245 Å²	245	108.2 Å²	108.2	93%	0.925	55%	0.548	S	S	*	.			trans	-63.4	99.2	168.4	-83.1	-177.5	173.8	177.6	-2.8	106.9	A32 V36	A32-R34 PolarHBondContact O-N 3.22Å; A32-R34 VanDerWaalsContact O-N 3.09Å; R34-V36 PolarHBondContact O-N 3.25Å
35	I	67.3	Low	71.3	Confident	89 Å²	89	104 Å²	104	46%	0.456	52%	0.519	S	S	.	.			trans	-78.1	113.9	172.8	-59.9	173	0	0	0	105.9	K33 Y37	K33-I35 VanDerWaalsContact C-N 3.34Å; K33-I35 PolarHBondContact O-N 3.43Å; I35-Y37 HydrophobicContact CB-CE2 4.44Å; I35-Y37 HydrophobicContact CG2-CD1 4.48Å; I35-Y37 HydrophobicContact CG2-CE1 4.15Å; I35-Y37 HydrophobicContact CG2-CE2 4.36Å
36	V	79.6	Confident	73.2	Confident	92 Å²	92	103.8 Å²	103.8	56%	0.558	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-78.3	121.3	169.8	-179.9	0	0	0	0	106.3	R34 P59	R34-V36 PolarHBondContact O-N 3.25Å; V36-P59 WeakPolarHBondContact O-CD 3.29Å; V36-P59 WeakPolarHBondContact O-CG 3.24Å
37	Y	87.4	Confident	75.3	Confident	106 Å²	106	101.5 Å²	101.5	42%	0.416	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-87.9	152.1	176.2	-67.5	-82.3	0	0	0	110.4	I35 K56 E58	I35-Y37 HydrophobicContact CB-CE2 4.44Å; I35-Y37 HydrophobicContact CG2-CD1 4.48Å; I35-Y37 HydrophobicContact CG2-CE1 4.15Å; I35-Y37 HydrophobicContact CG2-CE2 4.36Å; Y37-K56 HydrophobicContact CD1-CB 4.18Å; Y37-K56 HydrophobicContact CG-CB 4.35Å; Y37-E58 HydrophobicContact CE1-CG 4.08Å
38	F	90.9	Very high	77.2	Confident	24 Å²	24	98.6 Å²	98.6	11%	0.105	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	143.9	171.9	-77.6	-115.7	0	0	0	109.6	V57 P59 L99 Q100 V104 G105 T106	F38-V57 HydrophobicContact CB-CB 4.47Å; F38-V57 PolarHBondContact N-O 3.09Å; F38-V57 PolarHBondContact O-N 3.37Å; F38-P59 HydrophobicContact CD2-CB 4Å; F38-P59 HydrophobicContact CD2-CG 3.83Å; F38-P59 HydrophobicContact CE2-CB 3.59Å; F38-P59 HydrophobicContact CE2-CG 3.68Å; F38-L99 HydrophobicContact CB-CD2 3.51Å; F38-L99 HydrophobicContact CB-CG 4.42Å; F38-L99 HydrophobicContact CD1-CD2 3.91Å; F38-L99 HydrophobicContact CD1-CG 3.89Å; F38-L99 HydrophobicContact CD2-CD2 4.4Å; F38-L99 HydrophobicContact CE1-CG 4.35Å; F38-L99 HydrophobicContact CG-CD2 3.69Å; F38-L99 HydrophobicContact CG-CG 4.14Å; F38-Q100 HydrophobicContact CZ-CB 4.3Å; F38-V104 HydrophobicContact CE1-CG2 4.32Å; F38-G105 WeakPolarHBondContact CD1-O 3.48Å; F38-G105 WeakPolarHBondContact CE1-O 3.47Å; F38-T106 WeakPolarHBondContact CA-O 3.49Å
39	E	92.1	Very high	79.3	Confident	71 Å²	71	100.4 Å²	100.4	33%	0.332	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	121.7	166.5	-173	-178.9	178.4	0	0	108.3	L53 L54 T106 T107 A108	E39-L53 HydrophobicContact CG-CD1 3.78Å; E39-L53 HydrophobicContact CG-CG 4.31Å; E39-L53 WeakPolarHBondContact OE1-CD1 3.34Å; E39-L53 WeakPolarHBondContact OE1-CD2 3.35Å; E39-L54 WeakPolarHBondContact CA-O 3.11Å; E39-T106 PolarHBondContact N-O 3.17Å; E39-T107 HydrophobicContact CB-CG2 4.28Å; E39-T107 HydrophobicContact CG-CG2 4.38Å; E39-T107 CarbonylContact O-C 3.13Å; E39-T107 VanDerWaalsContact O-CA 3.29Å; E39-T107 WeakPolarHBondContact O-CA 3.48Å; E39-A108 PolarHBondContact O-N 3.39Å
40	V	94.4	Very high	81.4	Confident	0 Å²	0	99.8 Å²	99.8	0%	0	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118.1	-178.8	175.9	0	0	0	0	109.8	I42 L53 L54 V57 I66 L99 A108 F110	V40-I42 HydrophobicContact CG1-CG1 4.45Å; V40-L53 CarbonylContact O-C 3.55Å; V40-L54 HydrophobicContact CB-CB 4.15Å; V40-L54 HydrophobicContact CB-CD1 4.41Å; V40-L54 HydrophobicContact CG1-CD1 4.41Å; V40-L54 PolarHBondContact N-O 3.15Å; V40-L54 PolarHBondContact O-N 2.98Å; V40-V57 HydrophobicContact CB-CG2 4.02Å; V40-V57 HydrophobicContact CG2-CB 3.95Å; V40-V57 HydrophobicContact CG2-CG1 4.26Å; V40-V57 HydrophobicContact CG2-CG2 3.73Å; V40-I66 HydrophobicContact CG1-CG2 4.17Å; V40-L99 HydrophobicContact CG2-CD1 4.28Å; V40-L99 HydrophobicContact CG2-CD2 3.74Å; V40-A108 CarbonylContact C-O 3.56Å; V40-A108 WeakPolarHBondContact CA-O 3.18Å; V40-A108 HydrophobicContact CG2-CB 4.44Å; V40-F110 HydrophobicContact CG1-CD2 3.37Å; V40-F110 HydrophobicContact CG1-CE2 3.47Å; V40-F110 VanDerWaalsContact CG1-CE2 3.47Å; V40-F110 HydrophobicContact CG2-CE2 4.35Å
41	E	95.4	Very high	83.3	Confident	40 Å²	40	91.3 Å²	91.3	19%	0.187	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.2	175.5	-175.5	174.1	-127.7	0	0	110.3	L43 K50 L53 A108 S109 F110	E41-L43 HydrophobicContact CG-CD2 3.81Å; E41-L43 HydrophobicContact CG-CG 4.18Å; E41-K50 HydrophobicContact CG-CD 4.36Å; E41-K50 HydrophobicContact CG-CG 4.1Å; E41-K50 WeakPolarHBondContact OE1-CD 3.45Å; E41-K50 WeakPolarHBondContact OE1-CE 3.43Å; E41-K50 IonicContact OE1-NZ 2.76Å; E41-K50 PolarHBondContact OE1-NZ 2.77Å; E41-L53 HydrophobicContact CB-CD1 3.9Å; E41-L53 HydrophobicContact CG-CD1 4.33Å; E41-A108 PolarHBondContact N-O 3.39Å; E41-S109 CarbonylContact O-C 3.6Å; E41-S109 WeakPolarHBondContact O-CA 3.17Å; E41-S109 PolarHBondContact OE2-OG 2.95Å; E41-F110 PolarHBondContact O-N 2.87Å
42	I	95.5	Very high	85.5	Confident	0 Å²	0	83.2 Å²	83.2	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	117.4	176.2	-56.7	178.5	0	0	0	108.1	V40 L51 L52 L54 I66 F70 F110 F112	V40-I42 HydrophobicContact CG1-CG1 4.45Å; I42-L51 WeakPolarHBondContact O-CB 3.43Å; I42-L51 PolarHBondContact O-N 2.87Å; I42-L52 HydrophobicContact CB-CB 4.38Å; I42-L52 PolarHBondContact N-O 2.76Å; I42-L52 PolarHBondContact O-N 3.27Å; I42-L54 HydrophobicContact CD1-CD1 4.41Å; I42-I66 HydrophobicContact CD1-CG2 4.37Å; I42-F70 HydrophobicContact CD1-CB 3.74Å; I42-F70 HydrophobicContact CD1-CD1 4.42Å; I42-F70 HydrophobicContact CD1-CD2 3.68Å; I42-F70 HydrophobicContact CD1-CE2 4.37Å; I42-F70 HydrophobicContact CD1-CG 3.71Å; I42-F70 HydrophobicContact CG2-CD2 4.45Å; I42-F70 HydrophobicContact CG2-CE1 4.43Å; I42-F70 HydrophobicContact CG2-CE2 4.13Å; I42-F70 HydrophobicContact CG2-CZ 4.12Å; I42-F110 WeakPolarHBondContact CA-O 3.5Å; I42-F112 HydrophobicContact CG2-CB 3.72Å
43	L	95.1	Very high	87.6	Confident	19 Å²	19	81.4 Å²	81.4	10%	0.099	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	145.6	-179.6	-56.4	174	0	0	0	110.1	E41 E49 K50 F110 Y111 F112	E41-L43 HydrophobicContact CG-CD2 3.81Å; E41-L43 HydrophobicContact CG-CG 4.18Å; L43-E49 CarbonylContact C-O 3.53Å; L43-E49 VanDerWaalsContact CA-O 3.31Å; L43-E49 WeakPolarHBondContact CA-O 3.41Å; L43-K50 HydrophobicContact CD2-CB 3.97Å; L43-K50 HydrophobicContact CD2-CG 4.35Å; L43-F110 PolarHBondContact N-O 3.04Å; L43-Y111 HydrophobicContact CB-CD1 4.22Å; L43-Y111 HydrophobicContact CB-CE1 4.44Å; L43-Y111 HydrophobicContact CD1-CD1 4.44Å; L43-Y111 HydrophobicContact CD1-CE1 3.91Å; L43-Y111 CarbonylContact O-C 3.58Å; L43-Y111 WeakPolarHBondContact O-CA 3.36Å; L43-F112 PolarHBondContact O-N 3Å
44	D	93.8	Very high	89.3	Confident	33 Å²	33	73.3 Å²	73.3	18%	0.176	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	132.2	168.5	-174.3	-88.7	0	0	0	110.4	K46 T47 K48 E49 L51	D44-K46 VanDerWaalsContact C-N 3.25Å; D44-K46 PolarHBondContact O-N 2.79Å; D44-K46 WeakPolarHBondContact OD1-CA 3.38Å; D44-K46 WeakPolarHBondContact OD1-CB 3.36Å; D44-K46 PolarHBondContact OD1-N 2.84Å; D44-T47 WeakPolarHBondContact CB-OG1 3.44Å; D44-T47 PolarHBondContact OD1-N 2.9Å; D44-K48 WeakPolarHBondContact O-CA 3.31Å; D44-K48 PolarHBondContact O-N 2.81Å; D44-E49 PolarHBondContact N-O 2.83Å; D44-L51 HydrophobicContact CB-CD1 3.97Å; D44-L51 HydrophobicContact CB-CD2 4.32Å; D44-L51 HydrophobicContact CB-CG 4.17Å
45	L	91.6	Very high	90.6	Very high	39 Å²	39	66.5 Å²	66.5	20%	0.204	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-30.7	-177.8	179.9	67.8	0	0	0	113.1	P88 Y111 F112	L45-P88 HydrophobicContact CD1-CB 3.68Å; L45-P88 HydrophobicContact CD1-CG 4.3Å; L45-Y111 HydrophobicContact CD1-CD1 4.42Å; L45-Y111 HydrophobicContact CD1-CG 4.3Å; L45-F112 WeakPolarHBondContact CB-O 3.48Å; L45-F112 PolarHBondContact N-O 2.82Å
46	K	90.7	Very high	91.7	Very high	189 Å²	189	70.3 Å²	70.3	82%	0.822	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-51.9	-175.6	-62.1	-178.7	-179.5	179.6	0	111.8	D44	D44-K46 VanDerWaalsContact C-N 3.25Å; D44-K46 PolarHBondContact O-N 2.79Å; D44-K46 WeakPolarHBondContact OD1-CA 3.38Å; D44-K46 WeakPolarHBondContact OD1-CB 3.36Å; D44-K46 PolarHBondContact OD1-N 2.84Å
47	T	91.6	Very high	92.2	Very high	77 Å²	77	66.1 Å²	66.1	47%	0.472	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-18.1	-175.9	67.4	0	0	0	0	112.3	D44 E49	D44-T47 WeakPolarHBondContact CB-OG1 3.44Å; D44-T47 PolarHBondContact OD1-N 2.9Å; T47-E49 WeakPolarHBondContact CB-OE2 3.29Å; T47-E49 PolarHBondContact O-N 2.76Å; T47-E49 VanDerWaalsContact O-N 3.16Å; T47-E49 WeakPolarHBondContact OG1-CB 3.41Å; T47-E49 WeakPolarHBondContact OG1-CG 3.39Å; T47-E49 PolarHBondContact OG1-N 3.22Å; T47-E49 PolarHBondContact OG1-OE2 2.89Å
48	K	90.5	Very high	92.4	Very high	144 Å²	144	65.7 Å²	65.7	63%	0.626	31%	0.313	S	S	*	.			trans	59.3	12.7	-170.7	-54.5	-178.3	-179.5	-179.8	0	113.4	D44	D44-K48 WeakPolarHBondContact O-CA 3.31Å; D44-K48 PolarHBondContact O-N 2.81Å
49	E	92.9	Very high	92.3	Very high	124 Å²	124	65.5 Å²	65.5	58%	0.579	31%	0.314	S	S	*	.			trans	-70.5	143.2	176.5	-69.1	169.4	150.6	0	0	110	L43 D44 T47 L51	L43-E49 CarbonylContact C-O 3.53Å; L43-E49 VanDerWaalsContact CA-O 3.31Å; L43-E49 WeakPolarHBondContact CA-O 3.41Å; D44-E49 PolarHBondContact N-O 2.83Å; T47-E49 WeakPolarHBondContact CB-OE2 3.29Å; T47-E49 PolarHBondContact O-N 2.76Å; T47-E49 VanDerWaalsContact O-N 3.16Å; T47-E49 WeakPolarHBondContact OG1-CB 3.41Å; T47-E49 WeakPolarHBondContact OG1-CG 3.39Å; T47-E49 PolarHBondContact OG1-N 3.22Å; T47-E49 PolarHBondContact OG1-OE2 2.89Å; E49-L51 PolarHBondContact O-N 2.9Å
50	K	93.6	Very high	92.3	Very high	107 Å²	107	66.2 Å²	66.2	47%	0.465	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	114.6	175.4	-174.2	179	-173.3	137.6	0	109.8	E41 L43	E41-K50 HydrophobicContact CG-CD 4.36Å; E41-K50 HydrophobicContact CG-CG 4.1Å; E41-K50 WeakPolarHBondContact OE1-CD 3.45Å; E41-K50 WeakPolarHBondContact OE1-CE 3.43Å; E41-K50 IonicContact OE1-NZ 2.76Å; E41-K50 PolarHBondContact OE1-NZ 2.77Å; L43-K50 HydrophobicContact CD2-CB 3.97Å; L43-K50 HydrophobicContact CD2-CG 4.35Å
51	L	92.6	Very high	92.2	Very high	32 Å²	32	66.7 Å²	66.7	17%	0.168	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-45.6	178.8	-61.6	177.6	0	0	0	111.3	I42 D44 E49 F70 Y74 W77 F112	I42-L51 WeakPolarHBondContact O-CB 3.43Å; I42-L51 PolarHBondContact O-N 2.87Å; D44-L51 HydrophobicContact CB-CD1 3.97Å; D44-L51 HydrophobicContact CB-CD2 4.32Å; D44-L51 HydrophobicContact CB-CG 4.17Å; E49-L51 PolarHBondContact O-N 2.9Å; L51-F70 HydrophobicContact CB-CE2 4.23Å; L51-F70 HydrophobicContact CB-CZ 4.39Å; L51-F70 HydrophobicContact CD1-CZ 4.09Å; L51-Y74 PolarHBondContact O-OH 3.5Å; L51-W77 HydrophobicContact CD1-CH2 4.47Å; L51-W77 HydrophobicContact CD1-CZ3 4.39Å; L51-F112 HydrophobicContact CD1-CB 4.32Å; L51-F112 HydrophobicContact CD1-CD1 3.62Å; L51-F112 HydrophobicContact CD1-CE1 4.37Å; L51-F112 HydrophobicContact CD1-CG 4.31Å
52	L	94.2	Very high	92.1	Very high	30 Å²	30	66.4 Å²	66.4	16%	0.157	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	145.8	-178.4	-171.2	63.3	0	0	0	111.6	I42 L54 F70 Y74	I42-L52 HydrophobicContact CB-CB 4.38Å; I42-L52 PolarHBondContact N-O 2.76Å; I42-L52 PolarHBondContact O-N 3.27Å; L52-L54 HydrophobicContact CD2-CD2 3.7Å; L52-L54 HydrophobicContact CD2-CG 4.16Å; L52-L54 HydrophobicContact CG-CD2 4.13Å; L52-L54 HydrophobicContact CG-CG 4.35Å; L52-F70 HydrophobicContact CB-CD2 4.03Å; L52-F70 HydrophobicContact CB-CE2 4.08Å; L52-F70 HydrophobicContact CD2-CD2 3.7Å; L52-F70 HydrophobicContact CD2-CE2 4.49Å; L52-Y74 HydrophobicContact CB-CE2 4.4Å
53	L	94.3	Very high	92	Very high	54 Å²	54	66.4 Å²	66.4	28%	0.283	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	134.5	166.8	-166.3	61.6	0	0	0	109.4	E39 V40 E41 D55	E39-L53 HydrophobicContact CG-CD1 3.78Å; E39-L53 HydrophobicContact CG-CG 4.31Å; E39-L53 WeakPolarHBondContact OE1-CD1 3.34Å; E39-L53 WeakPolarHBondContact OE1-CD2 3.35Å; V40-L53 CarbonylContact O-C 3.55Å; E41-L53 HydrophobicContact CB-CD1 3.9Å; E41-L53 HydrophobicContact CG-CD1 4.33Å; L53-D55 VanDerWaalsContact CD2-OD1 3.24Å; L53-D55 WeakPolarHBondContact CD2-OD1 3.49Å; L53-D55 VanDerWaalsContact CG-OD1 3.29Å; L53-D55 WeakPolarHBondContact CG-OD1 3.47Å
54	L	92.1	Very high	91.9	Very high	25 Å²	25	69 Å²	69	13%	0.131	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	99.5	177	-60.1	172.4	0	0	0	108.4	E39 V40 I42 L52 K56 V57 I66 L69	E39-L54 WeakPolarHBondContact CA-O 3.11Å; V40-L54 HydrophobicContact CB-CB 4.15Å; V40-L54 HydrophobicContact CB-CD1 4.41Å; V40-L54 HydrophobicContact CG1-CD1 4.41Å; V40-L54 PolarHBondContact N-O 3.15Å; V40-L54 PolarHBondContact O-N 2.98Å; I42-L54 HydrophobicContact CD1-CD1 4.41Å; L52-L54 HydrophobicContact CD2-CD2 3.7Å; L52-L54 HydrophobicContact CD2-CG 4.16Å; L52-L54 HydrophobicContact CG-CD2 4.13Å; L52-L54 HydrophobicContact CG-CG 4.35Å; L54-K56 VanDerWaalsContact C-N 3.34Å; L54-K56 PolarHBondContact O-N 2.93Å; L54-V57 HydrophobicContact CB-CG2 3.57Å; L54-V57 HydrophobicContact CD1-CG2 4.2Å; L54-I66 HydrophobicContact CD1-CG2 4.33Å; L54-L69 HydrophobicContact CD1-CB 4.06Å; L54-L69 HydrophobicContact CD1-CD1 4.23Å; L54-L69 HydrophobicContact CD2-CB 4.29Å
55	D	87.7	Confident	92	Very high	102 Å²	102	70.9 Å²	70.9	55%	0.545	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-17.3	-169.4	-52	-35.2	0	0	0	114.5	L53	L53-D55 VanDerWaalsContact CD2-OD1 3.24Å; L53-D55 WeakPolarHBondContact CD2-OD1 3.49Å; L53-D55 VanDerWaalsContact CG-OD1 3.29Å; L53-D55 WeakPolarHBondContact CG-OD1 3.47Å
56	K	88.8	Confident	92.1	Very high	168 Å²	168	69 Å²	69	73%	0.73	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.8	63.2	-171	-64.4	-176.1	-175.6	175.5	0	112.3	Y37 L54	Y37-K56 HydrophobicContact CD1-CB 4.18Å; Y37-K56 HydrophobicContact CG-CB 4.35Å; L54-K56 VanDerWaalsContact C-N 3.34Å; L54-K56 PolarHBondContact O-N 2.93Å
57	V	90.5	Very high	92.3	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.024	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.9	175.1	-173.5	0	0	0	0	109.9	F38 V40 L54 A61 I66 L99	F38-V57 HydrophobicContact CB-CB 4.47Å; F38-V57 PolarHBondContact N-O 3.09Å; F38-V57 PolarHBondContact O-N 3.37Å; V40-V57 HydrophobicContact CB-CG2 4.02Å; V40-V57 HydrophobicContact CG2-CB 3.95Å; V40-V57 HydrophobicContact CG2-CG1 4.26Å; V40-V57 HydrophobicContact CG2-CG2 3.73Å; L54-V57 HydrophobicContact CB-CG2 3.57Å; L54-V57 HydrophobicContact CD1-CG2 4.2Å; V57-A61 HydrophobicContact CG1-CB 3.65Å; V57-I66 HydrophobicContact CG1-CG1 4.27Å; V57-L99 HydrophobicContact CB-CD2 4.16Å; V57-L99 HydrophobicContact CG1-CD2 3.68Å
58	E	91.2	Very high	92.5	Very high	98 Å²	98	59.1 Å²	59.1	46%	0.458	30%	0.298	S	S	.	.			trans	-67.2	142	176.7	-67.5	-172	171	0	0	111	Y37 T60 A61	Y37-E58 HydrophobicContact CE1-CG 4.08Å; E58-T60 PolarHBondContact O-N 3.41Å; E58-T60 VanDerWaalsContact O-N 3.14Å; E58-A61 WeakPolarHBondContact O-CB 3.38Å; E58-A61 PolarHBondContact O-N 3.28Å
59	P	89.4	Confident	92.7	Very high	20 Å²	20	55.1 Å²	55.1	13%	0.13	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-31.4	177.8	-25.3	33.1	0	0	0	114	V36 F38 A61 V98 Q100	V36-P59 WeakPolarHBondContact O-CD 3.29Å; V36-P59 WeakPolarHBondContact O-CG 3.24Å; F38-P59 HydrophobicContact CD2-CB 4Å; F38-P59 HydrophobicContact CD2-CG 3.83Å; F38-P59 HydrophobicContact CE2-CB 3.59Å; F38-P59 HydrophobicContact CE2-CG 3.68Å; P59-A61 VanDerWaalsContact C-N 3.3Å; P59-V98 WeakPolarHBondContact O-CG1 3.46Å; P59-Q100 HydrophobicContact CB-CB 4.04Å; P59-Q100 WeakPolarHBondContact O-CB 3.42Å; P59-Q100 WeakPolarHBondContact O-CG 3.5Å; P59-Q100 PolarHBondContact O-N 3.08Å
60	T	91.8	Very high	92.8	Very high	85 Å²	85	49.2 Å²	49.2	52%	0.521	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.9	179.6	47.2	0	0	0	0	113.4	E58	E58-T60 PolarHBondContact O-N 3.41Å; E58-T60 VanDerWaalsContact O-N 3.14Å
61	A	92.4	Very high	92.9	Very high	11 Å²	11	47 Å²	47	9%	0.091	25%	0.247	C	C	.	.			trans	-62.8	138.1	176.3	0	0	0	0	0	110.4	V57 E58 P59 D65 L99	V57-A61 HydrophobicContact CG1-CB 3.65Å; E58-A61 WeakPolarHBondContact O-CB 3.38Å; E58-A61 PolarHBondContact O-N 3.28Å; P59-A61 VanDerWaalsContact C-N 3.3Å; A61-D65 HydrophobicContact CB-CB 4.28Å; A61-L99 WeakPolarHBondContact O-CB 3.42Å; A61-L99 PolarHBondContact O-N 3.38Å
62	T	94.6	Very high	93	Very high	34 Å²	34	53.2 Å²	53.2	21%	0.209	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-85.7	163	175.2	64.9	0	0	0	0	111	L64 D65 I66 D95 E97 V98	T62-L64 PolarHBondContact O-N 3.43Å; T62-L64 PolarHBondContact OG1-N 2.93Å; T62-D65 WeakPolarHBondContact CB-OD2 3.38Å; T62-D65 PolarHBondContact N-OD2 3.14Å; T62-D65 WeakPolarHBondContact O-CB 3.08Å; T62-D65 PolarHBondContact O-N 3.21Å; T62-D65 PolarHBondContact OG1-N 2.86Å; T62-D65 PolarHBondContact OG1-OD2 3.47Å; T62-I66 PolarHBondContact O-N 2.84Å; T62-I66 VanDerWaalsContact O-N 3.08Å; T62-D95 WeakPolarHBondContact CB-O 3.33Å; T62-E97 CarbonylContact C-O 3.52Å; T62-E97 WeakPolarHBondContact CA-O 3.34Å; T62-V98 HydrophobicContact CG2-CG2 4.49Å
63	V	93.7	Very high	93	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-55.5	-35.5	170.1	171.2	0	0	0	0	111.2	D65 I66 K67 L84 L93 R94 E97	V63-D65 VanDerWaalsContact C-N 3.35Å; V63-D65 PolarHBondContact O-N 3.33Å; V63-I66 PolarHBondContact O-N 3.23Å; V63-K67 HydrophobicContact CG1-CD 4.35Å; V63-K67 HydrophobicContact CG1-CG 4.46Å; V63-K67 VanDerWaalsContact O-CG 3.29Å; V63-K67 WeakPolarHBondContact O-CG 3.04Å; V63-K67 PolarHBondContact O-N 3.23Å; V63-L84 HydrophobicContact CG1-CD1 4.3Å; V63-L93 HydrophobicContact CG1-CB 4.23Å; V63-L93 HydrophobicContact CG2-CB 3.98Å; V63-L93 HydrophobicContact CG2-CD1 4.2Å; V63-R94 WeakPolarHBondContact CB-O 3.36Å; V63-E97 HydrophobicContact CG2-CB 4.04Å; V63-E97 WeakPolarHBondContact CG2-O 3.02Å; V63-E97 PolarHBondContact N-O 3.28Å
64	L	93	Very high	92.9	Very high	73 Å²	73	56.3 Å²	56.3	38%	0.382	29%	0.289	S	S	.	.	H	α-helix	trans	-63.7	-38.5	174.6	-175.7	60.1	0	0	0	112.9	T62 K67 S68 P79 D95	T62-L64 PolarHBondContact O-N 3.43Å; T62-L64 PolarHBondContact OG1-N 2.93Å; L64-K67 PolarHBondContact O-N 2.88Å; L64-S68 WeakPolarHBondContact O-CB 3.11Å; L64-S68 PolarHBondContact O-N 2.62Å; L64-S68 PolarHBondContact O-OG 2.78Å; L64-P79 HydrophobicContact CD1-CB 4.12Å; L64-D95 HydrophobicContact CB-CB 4.1Å; L64-D95 PolarHBondContact N-O 3.39Å; L64-D95 VanDerWaalsContact N-O 3.08Å
65	D	94.1	Very high	92.9	Very high	73 Å²	73	59.7 Å²	59.7	39%	0.39	31%	0.312	S	S	.	.	H	α-helix	trans	-65.1	-43.6	176.5	-59.3	-46.5	0	0	0	110.3	A61 T62 V63 K67 S68 L69	A61-D65 HydrophobicContact CB-CB 4.28Å; T62-D65 WeakPolarHBondContact CB-OD2 3.38Å; T62-D65 PolarHBondContact N-OD2 3.14Å; T62-D65 WeakPolarHBondContact O-CB 3.08Å; T62-D65 PolarHBondContact O-N 3.21Å; T62-D65 PolarHBondContact OG1-N 2.86Å; T62-D65 PolarHBondContact OG1-OD2 3.47Å; V63-D65 VanDerWaalsContact C-N 3.35Å; V63-D65 PolarHBondContact O-N 3.33Å; D65-K67 PolarHBondContact O-N 2.86Å; D65-S68 WeakPolarHBondContact O-CB 3.33Å; D65-S68 PolarHBondContact O-N 3.37Å; D65-S68 VanDerWaalsContact O-N 3.14Å; D65-L69 WeakPolarHBondContact O-CG 3.45Å; D65-L69 PolarHBondContact O-N 3.01Å
66	I	94.8	Very high	93.2	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.3	-45.7	175.1	-64.9	160.9	0	0	0	110.6	V40 I42 L54 V57 T62 V63 S68 L69 F70 L84 L99 F110	V40-I66 HydrophobicContact CG1-CG2 4.17Å; I42-I66 HydrophobicContact CD1-CG2 4.37Å; L54-I66 HydrophobicContact CD1-CG2 4.33Å; V57-I66 HydrophobicContact CG1-CG1 4.27Å; T62-I66 PolarHBondContact O-N 2.84Å; T62-I66 VanDerWaalsContact O-N 3.08Å; V63-I66 PolarHBondContact O-N 3.23Å; I66-S68 VanDerWaalsContact C-N 3.27Å; I66-S68 PolarHBondContact O-N 2.73Å; I66-L69 WeakPolarHBondContact O-CB 3.45Å; I66-L69 PolarHBondContact O-N 2.8Å; I66-F70 PolarHBondContact O-N 3.31Å; I66-L84 HydrophobicContact CG2-CD1 4.04Å; I66-L99 HydrophobicContact CD1-CD1 4.18Å; I66-L99 HydrophobicContact CD1-CD2 4.46Å; I66-F110 HydrophobicContact CD1-CE2 3.8Å; I66-F110 HydrophobicContact CD1-CZ 4.24Å; I66-F110 HydrophobicContact CG2-CD2 4.43Å; I66-F110 HydrophobicContact CG2-CE2 4.46Å
67	K	95.1	Very high	93.4	Very high	13 Å²	13	56 Å²	56	6%	0.057	29%	0.29	C	S	.	.	H	α-helix	trans	-60.2	-38.8	175.3	-71.7	177.6	174.3	-174	0	112.3	V63 L64 D65 F70 H71 P79 Q82 L84 D95	V63-K67 HydrophobicContact CG1-CD 4.35Å; V63-K67 HydrophobicContact CG1-CG 4.46Å; V63-K67 VanDerWaalsContact O-CG 3.29Å; V63-K67 WeakPolarHBondContact O-CG 3.04Å; V63-K67 PolarHBondContact O-N 3.23Å; L64-K67 PolarHBondContact O-N 2.88Å; D65-K67 PolarHBondContact O-N 2.86Å; K67-F70 PolarHBondContact O-N 3.27Å; K67-H71 WeakPolarHBondContact O-CB 3.4Å; K67-H71 PolarHBondContact O-N 3.2Å; K67-P79 HydrophobicContact CB-CB 3.95Å; K67-Q82 HydrophobicContact CD-CB 4.29Å; K67-Q82 WeakPolarHBondContact CE-O 3.37Å; K67-Q82 HydrophobicContact CG-CB 4.2Å; K67-Q82 VanDerWaalsContact CG-OE1 3.24Å; K67-Q82 PolarHBondContact NZ-O 3.43Å; K67-Q82 PolarHBondContact O-NE2 2.65Å; K67-Q82 PolarHBondContact O-OE1 3.29Å; K67-L84 HydrophobicContact CG-CD1 3.74Å; K67-L84 HydrophobicContact CG-CG 4.28Å; K67-D95 WeakPolarHBondContact CE-OD1 3.37Å; K67-D95 IonicContact NZ-OD1 3.81Å; K67-D95 PolarHBondContact NZ-OD1 2.95Å
68	S	94.9	Very high	93.5	Very high	45 Å²	45	59.7 Å²	59.7	32%	0.315	30%	0.304	S	S	.	.	H	α-helix	trans	-68	-38.5	177.4	-58.8	0	0	0	0	111.7	L64 D65 I66 H71 K72	L64-S68 WeakPolarHBondContact O-CB 3.11Å; L64-S68 PolarHBondContact O-N 2.62Å; L64-S68 PolarHBondContact O-OG 2.78Å; D65-S68 WeakPolarHBondContact O-CB 3.33Å; D65-S68 PolarHBondContact O-N 3.37Å; D65-S68 VanDerWaalsContact O-N 3.14Å; I66-S68 VanDerWaalsContact C-N 3.27Å; I66-S68 PolarHBondContact O-N 2.73Å; S68-H71 PolarHBondContact O-N 3.12Å; S68-K72 WeakPolarHBondContact O-CG 3.42Å; S68-K72 PolarHBondContact O-N 2.9Å
69	L	94.6	Very high	93.6	Very high	59 Å²	59	56.3 Å²	56.3	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-64.2	-44.2	171.8	-68.9	173.3	0	0	0	111.5	L54 D65 I66 H71 K72	L54-L69 HydrophobicContact CD1-CB 4.06Å; L54-L69 HydrophobicContact CD1-CD1 4.23Å; L54-L69 HydrophobicContact CD2-CB 4.29Å; D65-L69 WeakPolarHBondContact O-CG 3.45Å; D65-L69 PolarHBondContact O-N 3.01Å; I66-L69 WeakPolarHBondContact O-CB 3.45Å; I66-L69 PolarHBondContact O-N 2.8Å; L69-H71 VanDerWaalsContact C-N 3.3Å; L69-H71 PolarHBondContact O-N 3.39Å; L69-K72 HydrophobicContact CD2-CD 4.48Å; L69-K72 WeakPolarHBondContact O-CB 3.44Å; L69-K72 PolarHBondContact O-N 3.38Å
70	F	95.1	Very high	93.6	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.4	-39.6	176.3	-174.3	-133.8	0	0	0	112.1	I42 L51 L52 I66 K67 K72 S73 Y74 W77 Q82 F112	I42-F70 HydrophobicContact CD1-CB 3.74Å; I42-F70 HydrophobicContact CD1-CD1 4.42Å; I42-F70 HydrophobicContact CD1-CD2 3.68Å; I42-F70 HydrophobicContact CD1-CE2 4.37Å; I42-F70 HydrophobicContact CD1-CG 3.71Å; I42-F70 HydrophobicContact CG2-CD2 4.45Å; I42-F70 HydrophobicContact CG2-CE1 4.43Å; I42-F70 HydrophobicContact CG2-CE2 4.13Å; I42-F70 HydrophobicContact CG2-CZ 4.12Å; L51-F70 HydrophobicContact CB-CE2 4.23Å; L51-F70 HydrophobicContact CB-CZ 4.39Å; L51-F70 HydrophobicContact CD1-CZ 4.09Å; L52-F70 HydrophobicContact CB-CD2 4.03Å; L52-F70 HydrophobicContact CB-CE2 4.08Å; L52-F70 HydrophobicContact CD2-CD2 3.7Å; L52-F70 HydrophobicContact CD2-CE2 4.49Å; I66-F70 PolarHBondContact O-N 3.31Å; K67-F70 PolarHBondContact O-N 3.27Å; F70-K72 VanDerWaalsContact C-N 3.29Å; F70-K72 PolarHBondContact O-N 3.08Å; F70-S73 PolarHBondContact O-N 3.35Å; F70-Y74 AromaticContact CD2-CD2 3.77Å; F70-Y74 HydrophobicContact CD2-CD2 3.77Å; F70-Y74 HydrophobicContact CD2-CE2 4.36Å; F70-Y74 AromaticContact CE2-CD2 3.32Å; F70-Y74 HydrophobicContact CE2-CD2 3.32Å; F70-Y74 AromaticContact CE2-CE2 3.71Å; F70-Y74 HydrophobicContact CE2-CE2 3.71Å; F70-Y74 HydrophobicContact CE2-CG 4.16Å; F70-Y74 HydrophobicContact CZ-CD2 4.03Å; F70-Y74 HydrophobicContact CZ-CG 4.46Å; F70-Y74 PolarHBondContact O-N 2.82Å; F70-W77 HydrophobicContact CE1-CD2 4.37Å; F70-W77 AromaticContact CE1-CE3 3.52Å; F70-W77 HydrophobicContact CE1-CE3 3.52Å; F70-W77 HydrophobicContact CE1-CZ3 4.08Å; F70-W77 HydrophobicContact CE2-CE3 4.25Å; F70-W77 HydrophobicContact CE2-CZ3 4.21Å; F70-W77 AromaticContact CZ-CE3 3.34Å; F70-W77 HydrophobicContact CZ-CE3 3.34Å; F70-W77 AromaticContact CZ-CZ3 3.43Å; F70-W77 HydrophobicContact CZ-CZ3 3.43Å; F70-W77 VanDerWaalsContact CZ-CZ3 3.43Å; F70-Q82 HydrophobicContact CD1-CG 4.27Å; F70-F112 HydrophobicContact CD1-CD2 4.38Å; F70-F112 HydrophobicContact CE1-CD1 4.25Å; F70-F112 AromaticContact CE1-CD2 3.66Å; F70-F112 HydrophobicContact CE1-CD2 3.66Å; F70-F112 HydrophobicContact CE1-CE1 4.32Å; F70-F112 AromaticContact CE1-CE2 3.76Å; F70-F112 HydrophobicContact CE1-CE2 3.76Å; F70-F112 AromaticContact CE1-CG 3.92Å; F70-F112 HydrophobicContact CE1-CG 3.92Å; F70-F112 HydrophobicContact CE1-CZ 4.09Å; F70-F112 HydrophobicContact CZ-CD1 4.38Å; F70-F112 HydrophobicContact CZ-CG 4.33Å
71	H	95.8	Very high	93.7	Very high	62 Å²	62	54.9 Å²	54.9	29%	0.287	28%	0.281	S	S	.	.	H	α-helix	trans	-62.7	-32.9	176.7	178.3	50	0	0	0	113.2	K67 S68 L69 S73 Y74 P75 W77 Y78 P79	K67-H71 WeakPolarHBondContact O-CB 3.4Å; K67-H71 PolarHBondContact O-N 3.2Å; S68-H71 PolarHBondContact O-N 3.12Å; L69-H71 VanDerWaalsContact C-N 3.3Å; L69-H71 PolarHBondContact O-N 3.39Å; H71-S73 VanDerWaalsContact C-N 3.3Å; H71-S73 PolarHBondContact O-N 2.68Å; H71-Y74 CarbonylContact O-C 3.56Å; H71-Y74 PolarHBondContact O-N 3.03Å; H71-P75 PolarHBondContact CE1-O 3.49Å; H71-P75 PolarHBondContact ND1-O 3.25Å; H71-P75 WeakPolarHBondContact O-CA 3.49Å; H71-W77 PolarHBondContact ND1-O 2.79Å; H71-Y78 WeakPolarHBondContact ND1-CA 3.12Å; H71-P79 HydrophobicContact CB-CG 4.36Å
72	K	94.8	Very high	93.8	Very high	161 Å²	161	54.4 Å²	54.4	70%	0.7	28%	0.277	S	S	*	.	H	α-helix	trans	-62.1	-38.5	176.3	-70.6	176	-178.3	179.6	0	111.8	S68 L69 F70	S68-K72 WeakPolarHBondContact O-CG 3.42Å; S68-K72 PolarHBondContact O-N 2.9Å; L69-K72 HydrophobicContact CD2-CD 4.48Å; L69-K72 WeakPolarHBondContact O-CB 3.44Å; L69-K72 PolarHBondContact O-N 3.38Å; F70-K72 VanDerWaalsContact C-N 3.29Å; F70-K72 PolarHBondContact O-N 3.08Å
73	S	94.1	Very high	93.7	Very high	64 Å²	64	53 Å²	53	45%	0.448	27%	0.268	S	S	.	.	H	α-helix	trans	-80.7	-32.9	176.6	-56	0	0	0	0	112.6	F70 H71	F70-S73 PolarHBondContact O-N 3.35Å; H71-S73 VanDerWaalsContact C-N 3.3Å; H71-S73 PolarHBondContact O-N 2.68Å
74	Y	93.4	Very high	93.7	Very high	85 Å²	85	53 Å²	53	33%	0.333	27%	0.268	S	S	.	.			trans	-125.6	82.7	179.8	-66.9	-87.4	0	0	0	111.9	L51 L52 F70 H71 K76 W77	L51-Y74 PolarHBondContact O-OH 3.5Å; L52-Y74 HydrophobicContact CB-CE2 4.4Å; F70-Y74 AromaticContact CD2-CD2 3.77Å; F70-Y74 HydrophobicContact CD2-CD2 3.77Å; F70-Y74 HydrophobicContact CD2-CE2 4.36Å; F70-Y74 AromaticContact CE2-CD2 3.32Å; F70-Y74 HydrophobicContact CE2-CD2 3.32Å; F70-Y74 AromaticContact CE2-CE2 3.71Å; F70-Y74 HydrophobicContact CE2-CE2 3.71Å; F70-Y74 HydrophobicContact CE2-CG 4.16Å; F70-Y74 HydrophobicContact CZ-CD2 4.03Å; F70-Y74 HydrophobicContact CZ-CG 4.46Å; F70-Y74 PolarHBondContact O-N 2.82Å; H71-Y74 CarbonylContact O-C 3.56Å; H71-Y74 PolarHBondContact O-N 3.03Å; Y74-K76 PolarHBondContact O-N 2.92Å; Y74-W77 AromaticContact CD1-CE3 3.95Å; Y74-W77 HydrophobicContact CD1-CE3 3.95Å; Y74-W77 HydrophobicContact CD1-CH2 4.16Å; Y74-W77 AromaticContact CD1-CZ3 3.48Å; Y74-W77 HydrophobicContact CD1-CZ3 3.48Å; Y74-W77 VanDerWaalsContact CD1-CZ3 3.48Å; Y74-W77 HydrophobicContact CD2-CE3 4.34Å; Y74-W77 HydrophobicContact CD2-CZ3 4.12Å; Y74-W77 HydrophobicContact CE1-CH2 4.49Å; Y74-W77 HydrophobicContact CE1-CZ3 4.01Å; Y74-W77 AromaticContact CG-CE3 3.65Å; Y74-W77 HydrophobicContact CG-CE3 3.65Å; Y74-W77 AromaticContact CG-CZ3 3.54Å; Y74-W77 HydrophobicContact CG-CZ3 3.54Å; Y74-W77 PolarHBondContact O-N 3.24Å
75	P	92.3	Very high	93.8	Very high	97 Å²	97	52.5 Å²	52.5	63%	0.63	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-25	-175.4	-28.1	35.9	0	0	0	114.8	H71 W77	H71-P75 PolarHBondContact CE1-O 3.49Å; H71-P75 PolarHBondContact ND1-O 3.25Å; H71-P75 WeakPolarHBondContact O-CA 3.49Å; P75-W77 PolarHBondContact O-N 3.08Å
76	K	92.9	Very high	93.7	Very high	151 Å²	151	51.1 Å²	51.1	66%	0.657	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-27	176.4	-178.9	178.2	176.3	-178.3	0	113.4	Y74 R81	Y74-K76 PolarHBondContact O-N 2.92Å; K76-R81 PolarHBondContact O-NH1 2.94Å
77	W	92.9	Very high	93.5	Very high	40 Å²	40	55 Å²	55	15%	0.152	27%	0.274	C	S	.	.	S	Bend	trans	-107.9	80.3	-176.3	-59.1	-41.7	0	0	0	109.7	L51 F70 H71 Y74 P75 Q82 F112	L51-W77 HydrophobicContact CD1-CH2 4.47Å; L51-W77 HydrophobicContact CD1-CZ3 4.39Å; F70-W77 HydrophobicContact CE1-CD2 4.37Å; F70-W77 AromaticContact CE1-CE3 3.52Å; F70-W77 HydrophobicContact CE1-CE3 3.52Å; F70-W77 HydrophobicContact CE1-CZ3 4.08Å; F70-W77 HydrophobicContact CE2-CE3 4.25Å; F70-W77 HydrophobicContact CE2-CZ3 4.21Å; F70-W77 AromaticContact CZ-CE3 3.34Å; F70-W77 HydrophobicContact CZ-CE3 3.34Å; F70-W77 AromaticContact CZ-CZ3 3.43Å; F70-W77 HydrophobicContact CZ-CZ3 3.43Å; F70-W77 VanDerWaalsContact CZ-CZ3 3.43Å; H71-W77 PolarHBondContact ND1-O 2.79Å; Y74-W77 AromaticContact CD1-CE3 3.95Å; Y74-W77 HydrophobicContact CD1-CE3 3.95Å; Y74-W77 HydrophobicContact CD1-CH2 4.16Å; Y74-W77 AromaticContact CD1-CZ3 3.48Å; Y74-W77 HydrophobicContact CD1-CZ3 3.48Å; Y74-W77 VanDerWaalsContact CD1-CZ3 3.48Å; Y74-W77 HydrophobicContact CD2-CE3 4.34Å; Y74-W77 HydrophobicContact CD2-CZ3 4.12Å; Y74-W77 HydrophobicContact CE1-CH2 4.49Å; Y74-W77 HydrophobicContact CE1-CZ3 4.01Å; Y74-W77 AromaticContact CG-CE3 3.65Å; Y74-W77 HydrophobicContact CG-CE3 3.65Å; Y74-W77 AromaticContact CG-CZ3 3.54Å; Y74-W77 HydrophobicContact CG-CZ3 3.54Å; Y74-W77 PolarHBondContact O-N 3.24Å; P75-W77 PolarHBondContact O-N 3.08Å; W77-Q82 HydrophobicContact CB-CG 4.23Å; W77-Q82 PolarHBondContact O-NE2 3.09Å; W77-F112 HydrophobicContact CB-CZ 4.36Å; W77-F112 AromaticContact CD2-CE1 4Å; W77-F112 HydrophobicContact CD2-CE1 4Å; W77-F112 AromaticContact CD2-CZ 3.7Å; W77-F112 HydrophobicContact CD2-CZ 3.7Å; W77-F112 AromaticContact CE2-CE1 3.94Å; W77-F112 AromaticContact CE2-CZ 3.93Å; W77-F112 HydrophobicContact CE3-CE1 4.13Å; W77-F112 HydrophobicContact CE3-CZ 4.08Å; W77-F112 AromaticContact CG-CZ 3.83Å; W77-F112 HydrophobicContact CG-CZ 3.83Å; W77-F112 HydrophobicContact CH2-CE1 4.21Å; W77-F112 HydrophobicContact CZ2-CE1 4.06Å; W77-F112 HydrophobicContact CZ3-CE1 4.24Å
78	Y	92.8	Very high	93.2	Very high	82 Å²	82	56.2 Å²	56.2	32%	0.322	28%	0.284	S	S	.	.			trans	-66.3	153.4	173.1	60.2	-92.9	0	0	0	111.4	H71 A80 R81 P117 Q118	H71-Y78 WeakPolarHBondContact ND1-CA 3.12Å; Y78-A80 VanDerWaalsContact C-N 3.33Å; Y78-A80 HydrophobicContact CD2-CB 3.99Å; Y78-A80 HydrophobicContact CE2-CB 3.88Å; Y78-A80 PolarHBondContact O-N 2.91Å; Y78-A80 VanDerWaalsContact O-N 3.09Å; Y78-R81 HydrophobicContact CD1-CB 4.35Å; Y78-R81 HydrophobicContact CD2-CB 4.13Å; Y78-R81 HydrophobicContact CE1-CB 4.14Å; Y78-R81 HydrophobicContact CE2-CB 3.89Å; Y78-R81 HydrophobicContact CG-CB 4.36Å; Y78-R81 WeakPolarHBondContact O-CB 3.4Å; Y78-R81 PolarHBondContact O-N 3.25Å; Y78-P117 WeakPolarHBondContact OH-CA 3.47Å; Y78-Q118 HydrophobicContact CE2-CB 4.47Å; Y78-Q118 PolarHBondContact OH-N 3.14Å
79	P	92.7	Very high	92.8	Very high	28 Å²	28	63.6 Å²	63.6	18%	0.182	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-50.8	-43	-166.8	-32.6	37.5	0	0	0	115.9	L64 K67 H71 R81 Q82	L64-P79 HydrophobicContact CD1-CB 4.12Å; K67-P79 HydrophobicContact CB-CB 3.95Å; H71-P79 HydrophobicContact CB-CG 4.36Å; P79-R81 PolarHBondContact O-N 2.91Å; P79-Q82 WeakPolarHBondContact O-CB 3.34Å; P79-Q82 PolarHBondContact O-N 3.04Å
80	A	90.6	Very high	92.6	Very high	34 Å²	34	62.6 Å²	62.6	28%	0.281	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-64.8	-25.2	-179.7	0	0	0	0	0	114	Y78 Q82 Q118 T189	Y78-A80 VanDerWaalsContact C-N 3.33Å; Y78-A80 HydrophobicContact CD2-CB 3.99Å; Y78-A80 HydrophobicContact CE2-CB 3.88Å; Y78-A80 PolarHBondContact O-N 2.91Å; Y78-A80 VanDerWaalsContact O-N 3.09Å; A80-Q82 VanDerWaalsContact C-N 3.29Å; A80-Q118 HydrophobicContact CB-CB 4.41Å; A80-Q118 WeakPolarHBondContact O-CG 3.35Å; A80-T189 HydrophobicContact CB-CG2 3.8Å
81	R	93.4	Very high	92.2	Very high	40 Å²	40	71.9 Å²	71.9	15%	0.151	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-77.8	-16.5	176	-179.5	167.8	-172.7	-161.4	3.2	112.5	K76 Y78 P79 D114 L115 G116	K76-R81 PolarHBondContact O-NH1 2.94Å; Y78-R81 HydrophobicContact CD1-CB 4.35Å; Y78-R81 HydrophobicContact CD2-CB 4.13Å; Y78-R81 HydrophobicContact CE1-CB 4.14Å; Y78-R81 HydrophobicContact CE2-CB 3.89Å; Y78-R81 HydrophobicContact CG-CB 4.36Å; Y78-R81 WeakPolarHBondContact O-CB 3.4Å; Y78-R81 PolarHBondContact O-N 3.25Å; P79-R81 PolarHBondContact O-N 2.91Å; R81-D114 WeakPolarHBondContact CD-OD1 3.35Å; R81-D114 WeakPolarHBondContact CG-OD1 3.35Å; R81-D114 IonicContact CZ-OD1 2.86Å; R81-D114 IonicContact CZ-OD2 2.68Å; R81-D114 VanDerWaalsContact NE-CG 3.32Å; R81-D114 IonicContact NE-OD1 2.75Å; R81-D114 PolarHBondContact NE-OD1 2.95Å; R81-D114 IonicContact NE-OD2 3.69Å; R81-D114 PolarHBondContact NE-OD2 2.68Å; R81-D114 IonicContact NH2-OD1 3.64Å; R81-D114 PolarHBondContact NH2-OD1 3.06Å; R81-D114 IonicContact NH2-OD2 2.61Å; R81-D114 PolarHBondContact NH2-OD2 2.91Å; R81-L115 WeakPolarHBondContact O-CB 3.04Å; R81-L115 PolarHBondContact O-N 3.37Å; R81-G116 WeakPolarHBondContact CG-O 3.43Å
82	Q	93.8	Very high	91.9	Very high	1 Å²	1	71.9 Å²	71.9	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	126.6	-175.3	-51.2	173.4	20.7	0	0	111.3	K67 F70 W77 P79 A80 F112	K67-Q82 HydrophobicContact CD-CB 4.29Å; K67-Q82 WeakPolarHBondContact CE-O 3.37Å; K67-Q82 HydrophobicContact CG-CB 4.2Å; K67-Q82 VanDerWaalsContact CG-OE1 3.24Å; K67-Q82 PolarHBondContact NZ-O 3.43Å; K67-Q82 PolarHBondContact O-NE2 2.65Å; K67-Q82 PolarHBondContact O-OE1 3.29Å; F70-Q82 HydrophobicContact CD1-CG 4.27Å; W77-Q82 HydrophobicContact CB-CG 4.23Å; W77-Q82 PolarHBondContact O-NE2 3.09Å; P79-Q82 WeakPolarHBondContact O-CB 3.34Å; P79-Q82 PolarHBondContact O-N 3.04Å; A80-Q82 VanDerWaalsContact C-N 3.29Å; Q82-F112 HydrophobicContact CB-CD2 4.21Å; Q82-F112 HydrophobicContact CB-CE2 3.89Å; Q82-F112 HydrophobicContact CG-CE2 3.9Å
83	S	93.4	Very high	91.8	Very high	4 Å²	4	65.1 Å²	65.1	3%	0.028	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.5	165.3	165	0	0	0	0	109.2	C92 F112 S113	S83-C92 PolarHBondContact OG-SG 2.91Å; S83-F112 CarbonylContact O-C 3.53Å; S83-F112 WeakPolarHBondContact O-CA 3.23Å; S83-S113 VanDerWaalsContact CB-OG 3.27Å; S83-S113 WeakPolarHBondContact CB-OG 3.46Å; S83-S113 PolarHBondContact N-O 3.28Å; S83-S113 PolarHBondContact O-N 3.05Å; S83-S113 PolarHBondContact OG-OG 2.68Å
84	L	94.3	Very high	91.5	Very high	2 Å²	2	69.8 Å²	69.8	1%	0.01	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.8	176.3	-60.1	-178.9	0	0	0	109.9	V63 I66 K67 L93 F110 Y111 F112	V63-L84 HydrophobicContact CG1-CD1 4.3Å; I66-L84 HydrophobicContact CG2-CD1 4.04Å; K67-L84 HydrophobicContact CG-CD1 3.74Å; K67-L84 HydrophobicContact CG-CG 4.28Å; L84-L93 PolarHBondContact O-N 2.93Å; L84-F110 HydrophobicContact CB-CB 4.47Å; L84-F110 HydrophobicContact CD2-CB 4.36Å; L84-Y111 WeakPolarHBondContact CA-O 3.42Å; L84-F112 HydrophobicContact CD2-CB 4.08Å; L84-F112 HydrophobicContact CD2-CD2 4.26Å
85	R	94.6	Very high	91.3	Very high	62 Å²	62	67.4 Å²	67.4	23%	0.234	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	149.1	179	-54.9	176.5	-174.5	-170	1.9	110.1	D87 P88 A90 F110 Y111	R85-D87 WeakPolarHBondContact CB-O 3.44Å; R85-P88 PolarHBondContact NH1-O 3.23Å; R85-A90 WeakPolarHBondContact CD-O 3.21Å; R85-F110 CarbonylContact O-C 3.5Å; R85-F110 WeakPolarHBondContact O-CA 3.45Å; R85-Y111 PolarHBondContact N-O 2.85Å; R85-Y111 PolarHBondContact O-N 3.45Å
86	L	92.4	Very high	91	Very high	43 Å²	43	66.7 Å²	66.7	23%	0.225	32%	0.317	C	S	.	.	S	Bend	trans	-77.5	-29.6	172.6	-70.9	171.1	0	0	0	112.8	L93 L102 P103 V104 F110 Y111	L86-L93 HydrophobicContact CD1-CD2 4.04Å; L86-L93 HydrophobicContact CD2-CD1 4.45Å; L86-L93 HydrophobicContact CG-CD1 4.14Å; L86-L93 HydrophobicContact CG-CD2 4.05Å; L86-L93 HydrophobicContact CG-CG 4.49Å; L86-L102 HydrophobicContact CD1-CB 4.37Å; L86-L102 HydrophobicContact CD1-CD2 4.38Å; L86-L102 HydrophobicContact CD2-CD1 4.46Å; L86-P103 HydrophobicContact CD1-CG 3.91Å; L86-V104 HydrophobicContact CD2-CG1 3.45Å; L86-V104 VanDerWaalsContact CD2-CG1 3.45Å; L86-F110 HydrophobicContact CD2-CD1 3.88Å; L86-F110 HydrophobicContact CD2-CE1 3.46Å; L86-F110 VanDerWaalsContact CD2-CE1 3.46Å; L86-F110 HydrophobicContact CD2-CZ 4.47Å; L86-F110 HydrophobicContact CG-CE1 4.32Å; L86-Y111 WeakPolarHBondContact O-CE2 3.34Å
87	D	89.5	Confident	90.9	Very high	81 Å²	81	61.3 Å²	61.3	43%	0.433	30%	0.295	S	S	.	.	S	Bend	trans	-136.5	147.5	177.7	179.4	-75.3	0	0	0	108.5	R85 K89 A90	R85-D87 WeakPolarHBondContact CB-O 3.44Å; D87-K89 PolarHBondContact O-N 3.14Å; D87-K89 VanDerWaalsContact O-N 3.11Å; D87-K89 WeakPolarHBondContact OD1-CB 3.29Å; D87-K89 PolarHBondContact OD1-N 3.14Å; D87-A90 HydrophobicContact CB-CB 3.8Å; D87-A90 WeakPolarHBondContact O-CB 3.47Å; D87-A90 PolarHBondContact O-N 2.95Å
88	P	88.3	Confident	90.8	Very high	40 Å²	40	61.2 Å²	61.2	26%	0.26	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-33.7	179.3	-28.8	37.3	0	0	0	114.5	L45 R85 Y111	L45-P88 HydrophobicContact CD1-CB 3.68Å; L45-P88 HydrophobicContact CD1-CG 4.3Å; R85-P88 PolarHBondContact NH1-O 3.23Å; P88-Y111 HydrophobicContact CG-CD1 3.94Å; P88-Y111 HydrophobicContact CG-CD2 4.22Å; P88-Y111 HydrophobicContact CG-CE1 3.8Å; P88-Y111 HydrophobicContact CG-CE2 4.11Å; P88-Y111 HydrophobicContact CG-CG 4.13Å
89	K	88.1	Confident	90.7	Very high	200 Å²	200	57.3 Å²	57.3	87%	0.87	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-9.8	179.4	-61.9	-177.3	-179	177.8	0	113.5	D87	D87-K89 PolarHBondContact O-N 3.14Å; D87-K89 VanDerWaalsContact O-N 3.11Å; D87-K89 WeakPolarHBondContact OD1-CB 3.29Å; D87-K89 PolarHBondContact OD1-N 3.14Å
90	A	89.3	Confident	90.6	Very high	38 Å²	38	61.1 Å²	61.1	31%	0.314	30%	0.299	S	S	.	.	S	Bend	trans	-71.7	163.8	178.9	0	0	0	0	0	112.5	R85 D87	R85-A90 WeakPolarHBondContact CD-O 3.21Å; D87-A90 HydrophobicContact CB-CB 3.8Å; D87-A90 WeakPolarHBondContact O-CB 3.47Å; D87-A90 PolarHBondContact O-N 2.95Å
91	K	87.8	Confident	90.6	Very high	195 Å²	195	64 Å²	64	85%	0.848	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-67	152.2	171.1	-69.7	-179	-179.5	173.7	0	110.4
92	C	89.6	Confident	90.4	Very high	62 Å²	62	62.8 Å²	62.8	42%	0.419	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-60.8	136.5	171.6	-56.7	0	0	0	0	110.6	S83	S83-C92 PolarHBondContact OG-SG 2.91Å
93	L	91.3	Very high	90.2	Very high	18 Å²	18	68.4 Å²	68.4	9%	0.094	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-68.2	142.6	173.4	-62.8	170.9	0	0	0	110.3	V63 L84 L86 E97 L102 F110	V63-L93 HydrophobicContact CG1-CB 4.23Å; V63-L93 HydrophobicContact CG2-CB 3.98Å; V63-L93 HydrophobicContact CG2-CD1 4.2Å; L84-L93 PolarHBondContact O-N 2.93Å; L86-L93 HydrophobicContact CD1-CD2 4.04Å; L86-L93 HydrophobicContact CD2-CD1 4.45Å; L86-L93 HydrophobicContact CG-CD1 4.14Å; L86-L93 HydrophobicContact CG-CD2 4.05Å; L86-L93 HydrophobicContact CG-CG 4.49Å; L93-E97 WeakPolarHBondContact CD2-OE2 3.42Å; L93-L102 HydrophobicContact CD1-CD1 4.1Å; L93-L102 HydrophobicContact CD2-CD1 4.42Å; L93-L102 HydrophobicContact CD2-CD2 3.86Å; L93-F110 HydrophobicContact CD1-CD1 3.59Å; L93-F110 HydrophobicContact CD1-CE1 3.28Å; L93-F110 HydrophobicContact CD1-CZ 4.27Å
94	R	88.1	Confident	89.8	Confident	162 Å²	162	70 Å²	70	61%	0.611	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-80.2	148.6	173.5	-59.1	172.3	-69	168.1	3.1	110.1	V63 E96 E97	V63-R94 WeakPolarHBondContact CB-O 3.36Å; R94-E96 WeakPolarHBondContact CB-OE2 3.42Å; R94-E96 PolarHBondContact O-N 2.98Å; R94-E96 VanDerWaalsContact O-N 3.08Å; R94-E97 HydrophobicContact CB-CG 4.16Å; R94-E97 VanDerWaalsContact CB-OE1 3.29Å; R94-E97 WeakPolarHBondContact CB-OE1 3.27Å; R94-E97 WeakPolarHBondContact CG-OE1 3.45Å; R94-E97 IonicContact CZ-OE1 3.95Å; R94-E97 PolarHBondContact N-OE1 3.49Å; R94-E97 IonicContact NE-OE1 3.33Å; R94-E97 PolarHBondContact NE-OE1 2.94Å; R94-E97 IonicContact NH2-OE1 2.77Å; R94-E97 WeakPolarHBondContact O-CB 3.45Å; R94-E97 PolarHBondContact O-N 2.86Å
95	D	89.2	Confident	89.4	Confident	36 Å²	36	72.3 Å²	72.3	19%	0.193	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.7	-177.2	-74.9	-6.1	0	0	0	113.4	T62 L64 K67	T62-D95 WeakPolarHBondContact CB-O 3.33Å; L64-D95 HydrophobicContact CB-CB 4.1Å; L64-D95 PolarHBondContact N-O 3.39Å; L64-D95 VanDerWaalsContact N-O 3.08Å; K67-D95 WeakPolarHBondContact CE-OD1 3.37Å; K67-D95 IonicContact NZ-OD1 3.81Å; K67-D95 PolarHBondContact NZ-OD1 2.95Å
96	E	87.1	Confident	89	Confident	81 Å²	81	73.6 Å²	73.6	38%	0.379	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-9.6	-178.8	-49.6	79.4	-165.8	0	0	114.3	R94 V98 K258	R94-E96 WeakPolarHBondContact CB-OE2 3.42Å; R94-E96 PolarHBondContact O-N 2.98Å; R94-E96 VanDerWaalsContact O-N 3.08Å; E96-V98 PolarHBondContact O-N 2.77Å; E96-K258 HydrophobicContact CG-CD 3.98Å; E96-K258 IonicContact OE1-NZ 3.16Å; E96-K258 PolarHBondContact OE1-NZ 2.71Å
97	E	89.1	Confident	88.8	Confident	38 Å²	38	74.9 Å²	74.9	18%	0.178	40%	0.404	C	S	.	.			trans	-64.4	132.5	179.1	-73.6	173	-130.7	0	0	109.3	T62 V63 L93 R94 L102	T62-E97 CarbonylContact C-O 3.52Å; T62-E97 WeakPolarHBondContact CA-O 3.34Å; V63-E97 HydrophobicContact CG2-CB 4.04Å; V63-E97 WeakPolarHBondContact CG2-O 3.02Å; V63-E97 PolarHBondContact N-O 3.28Å; L93-E97 WeakPolarHBondContact CD2-OE2 3.42Å; R94-E97 HydrophobicContact CB-CG 4.16Å; R94-E97 VanDerWaalsContact CB-OE1 3.29Å; R94-E97 WeakPolarHBondContact CB-OE1 3.27Å; R94-E97 WeakPolarHBondContact CG-OE1 3.45Å; R94-E97 IonicContact CZ-OE1 3.95Å; R94-E97 PolarHBondContact N-OE1 3.49Å; R94-E97 IonicContact NE-OE1 3.33Å; R94-E97 PolarHBondContact NE-OE1 2.94Å; R94-E97 IonicContact NH2-OE1 2.77Å; R94-E97 WeakPolarHBondContact O-CB 3.45Å; R94-E97 PolarHBondContact O-N 2.86Å; E97-L102 HydrophobicContact CB-CD2 4.11Å; E97-L102 WeakPolarHBondContact OE2-CD2 3.34Å
98	V	91.9	Very high	88.9	Confident	38 Å²	38	71.1 Å²	71.1	23%	0.23	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-93.9	135	-176.4	-177.1	0	0	0	0	108.2	P59 T62 E96 Q100 T101	P59-V98 WeakPolarHBondContact O-CG1 3.46Å; T62-V98 HydrophobicContact CG2-CG2 4.49Å; E96-V98 PolarHBondContact O-N 2.77Å; V98-Q100 VanDerWaalsContact C-N 3.32Å; V98-Q100 HydrophobicContact CG1-CG 3.96Å; V98-Q100 PolarHBondContact O-N 2.78Å; V98-T101 HydrophobicContact CB-CG2 4.14Å; V98-T101 PolarHBondContact O-N 3.23Å; V98-T101 PolarHBondContact O-OG1 3.01Å
99	L	90.8	Very high	89.2	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-51.4	-47.9	-173.5	-176.7	59	0	0	0	112.8	F38 V40 V57 A61 I66 T101 L102 V104 A108 F110	F38-L99 HydrophobicContact CB-CD2 3.51Å; F38-L99 HydrophobicContact CB-CG 4.42Å; F38-L99 HydrophobicContact CD1-CD2 3.91Å; F38-L99 HydrophobicContact CD1-CG 3.89Å; F38-L99 HydrophobicContact CD2-CD2 4.4Å; F38-L99 HydrophobicContact CE1-CG 4.35Å; F38-L99 HydrophobicContact CG-CD2 3.69Å; F38-L99 HydrophobicContact CG-CG 4.14Å; V40-L99 HydrophobicContact CG2-CD1 4.28Å; V40-L99 HydrophobicContact CG2-CD2 3.74Å; V57-L99 HydrophobicContact CB-CD2 4.16Å; V57-L99 HydrophobicContact CG1-CD2 3.68Å; A61-L99 WeakPolarHBondContact O-CB 3.42Å; A61-L99 PolarHBondContact O-N 3.38Å; I66-L99 HydrophobicContact CD1-CD1 4.18Å; I66-L99 HydrophobicContact CD1-CD2 4.46Å; L99-T101 PolarHBondContact O-N 3.07Å; L99-T101 VanDerWaalsContact O-N 3.14Å; L99-L102 HydrophobicContact CD1-CD1 4.45Å; L99-L102 WeakPolarHBondContact O-CB 3.47Å; L99-L102 PolarHBondContact O-N 2.99Å; L99-L102 VanDerWaalsContact O-N 3.14Å; L99-V104 HydrophobicContact CD1-CG2 4.31Å; L99-A108 HydrophobicContact CD1-CB 4.05Å; L99-F110 HydrophobicContact CD1-CE2 4.07Å; L99-F110 HydrophobicContact CD1-CZ 3.75Å
100	Q	90.7	Very high	89.5	Confident	109 Å²	109	61.8 Å²	61.8	51%	0.509	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-65.2	-16.2	179.7	73.7	-173.9	5.9	0	0	115.1	F38 P59 V98	F38-Q100 HydrophobicContact CZ-CB 4.3Å; P59-Q100 HydrophobicContact CB-CB 4.04Å; P59-Q100 WeakPolarHBondContact O-CB 3.42Å; P59-Q100 WeakPolarHBondContact O-CG 3.5Å; P59-Q100 PolarHBondContact O-N 3.08Å; V98-Q100 VanDerWaalsContact C-N 3.32Å; V98-Q100 HydrophobicContact CG1-CG 3.96Å; V98-Q100 PolarHBondContact O-N 2.78Å
101	T	90.1	Very high	89.8	Confident	95 Å²	95	62.2 Å²	62.2	58%	0.583	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-91.3	-10.3	179.3	65.3	0	0	0	0	112.7	V98 L99	V98-T101 HydrophobicContact CB-CG2 4.14Å; V98-T101 PolarHBondContact O-N 3.23Å; V98-T101 PolarHBondContact O-OG1 3.01Å; L99-T101 PolarHBondContact O-N 3.07Å; L99-T101 VanDerWaalsContact O-N 3.14Å
102	L	90.1	Very high	90.2	Very high	13 Å²	13	53 Å²	53	7%	0.068	30%	0.299	C	S	.	.	S	Bend	trans	-77.5	152.3	176.3	-60.8	178.4	0	0	0	109.8	L86 L93 E97 L99 V104 F110	L86-L102 HydrophobicContact CD1-CB 4.37Å; L86-L102 HydrophobicContact CD1-CD2 4.38Å; L86-L102 HydrophobicContact CD2-CD1 4.46Å; L93-L102 HydrophobicContact CD1-CD1 4.1Å; L93-L102 HydrophobicContact CD2-CD1 4.42Å; L93-L102 HydrophobicContact CD2-CD2 3.86Å; E97-L102 HydrophobicContact CB-CD2 4.11Å; E97-L102 WeakPolarHBondContact OE2-CD2 3.34Å; L99-L102 HydrophobicContact CD1-CD1 4.45Å; L99-L102 WeakPolarHBondContact O-CB 3.47Å; L99-L102 PolarHBondContact O-N 2.99Å; L99-L102 VanDerWaalsContact O-N 3.14Å; L102-V104 HydrophobicContact CB-CG1 4.27Å; L102-V104 HydrophobicContact CB-CG2 4Å; L102-V104 PolarHBondContact O-N 3.11Å; L102-F110 HydrophobicContact CD1-CE1 3.93Å; L102-F110 HydrophobicContact CD1-CZ 3.92Å
103	P	88.6	Confident	90.4	Very high	120 Å²	120	51 Å²	51	78%	0.779	29%	0.285	S	S	*	.	S	Bend	trans	-74.4	61.7	176.8	33.3	-37.2	0	0	0	111	L86	L86-P103 HydrophobicContact CD1-CG 3.91Å
104	V	85.9	Confident	90.4	Very high	38 Å²	38	53.4 Å²	53.4	23%	0.23	30%	0.298	C	S	.	.			trans	-128.3	150.3	-178.3	-61.7	0	0	0	0	110.3	F38 L86 L99 L102 A108	F38-V104 HydrophobicContact CE1-CG2 4.32Å; L86-V104 HydrophobicContact CD2-CG1 3.45Å; L86-V104 VanDerWaalsContact CD2-CG1 3.45Å; L99-V104 HydrophobicContact CD1-CG2 4.31Å; L102-V104 HydrophobicContact CB-CG1 4.27Å; L102-V104 HydrophobicContact CB-CG2 4Å; L102-V104 PolarHBondContact O-N 3.11Å; V104-A108 HydrophobicContact CB-CB 3.88Å; V104-A108 HydrophobicContact CG1-CB 4.01Å; V104-A108 HydrophobicContact CG2-CB 3.91Å
105	G	85.3	Confident	90.6	Very high	49 Å²	49	49.7 Å²	49.7	51%	0.505	29%	0.29	S	S	.	.			trans	-78.8	-158	172.8	0	0	0	0	0	111.8	F38 T107	F38-G105 WeakPolarHBondContact CD1-O 3.48Å; F38-G105 WeakPolarHBondContact CE1-O 3.47Å; G105-T107 PolarHBondContact O-N 3.43Å
106	T	85.8	Confident	90.7	Very high	90 Å²	90	48.6 Å²	48.6	55%	0.552	29%	0.288	S	S	*	.	S	Bend	trans	-65.2	-17.4	171.5	49.3	0	0	0	0	113.1	F38 E39	F38-T106 WeakPolarHBondContact CA-O 3.49Å; E39-T106 PolarHBondContact N-O 3.17Å
107	T	88.3	Confident	90.9	Very high	70 Å²	70	48.2 Å²	48.2	43%	0.429	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.1	172.8	-49.1	0	0	0	0	108.7	E39 G105	E39-T107 HydrophobicContact CB-CG2 4.28Å; E39-T107 HydrophobicContact CG-CG2 4.38Å; E39-T107 CarbonylContact O-C 3.13Å; E39-T107 VanDerWaalsContact O-CA 3.29Å; E39-T107 WeakPolarHBondContact O-CA 3.48Å; G105-T107 PolarHBondContact O-N 3.43Å
108	A	91.6	Very high	91	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.008	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	122.2	-179.6	0	0	0	0	0	110.4	E39 V40 E41 L99 V104 F110	E39-A108 PolarHBondContact O-N 3.39Å; V40-A108 CarbonylContact C-O 3.56Å; V40-A108 WeakPolarHBondContact CA-O 3.18Å; V40-A108 HydrophobicContact CG2-CB 4.44Å; E41-A108 PolarHBondContact N-O 3.39Å; L99-A108 HydrophobicContact CD1-CB 4.05Å; V104-A108 HydrophobicContact CB-CB 3.88Å; V104-A108 HydrophobicContact CG1-CB 4.01Å; V104-A108 HydrophobicContact CG2-CB 3.91Å; A108-F110 HydrophobicContact CB-CE2 4.32Å; A108-F110 HydrophobicContact CB-CZ 4.33Å
109	S	93.6	Very high	90.9	Very high	44 Å²	44	47.5 Å²	47.5	31%	0.308	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.8	173.8	-54.5	0	0	0	0	110.2	E41	E41-S109 CarbonylContact O-C 3.6Å; E41-S109 WeakPolarHBondContact O-CA 3.17Å; E41-S109 PolarHBondContact OE2-OG 2.95Å
110	F	95.3	Very high	90.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	135	174.5	-65.3	-58.8	0	0	0	111.3	V40 E41 I42 L43 I66 L84 R85 L86 L93 L99 L102 A108	V40-F110 HydrophobicContact CG1-CD2 3.37Å; V40-F110 HydrophobicContact CG1-CE2 3.47Å; V40-F110 VanDerWaalsContact CG1-CE2 3.47Å; V40-F110 HydrophobicContact CG2-CE2 4.35Å; E41-F110 PolarHBondContact O-N 2.87Å; I42-F110 WeakPolarHBondContact CA-O 3.5Å; L43-F110 PolarHBondContact N-O 3.04Å; I66-F110 HydrophobicContact CD1-CE2 3.8Å; I66-F110 HydrophobicContact CD1-CZ 4.24Å; I66-F110 HydrophobicContact CG2-CD2 4.43Å; I66-F110 HydrophobicContact CG2-CE2 4.46Å; L84-F110 HydrophobicContact CB-CB 4.47Å; L84-F110 HydrophobicContact CD2-CB 4.36Å; R85-F110 CarbonylContact O-C 3.5Å; R85-F110 WeakPolarHBondContact O-CA 3.45Å; L86-F110 HydrophobicContact CD2-CD1 3.88Å; L86-F110 HydrophobicContact CD2-CE1 3.46Å; L86-F110 VanDerWaalsContact CD2-CE1 3.46Å; L86-F110 HydrophobicContact CD2-CZ 4.47Å; L86-F110 HydrophobicContact CG-CE1 4.32Å; L93-F110 HydrophobicContact CD1-CD1 3.59Å; L93-F110 HydrophobicContact CD1-CE1 3.28Å; L93-F110 HydrophobicContact CD1-CZ 4.27Å; L99-F110 HydrophobicContact CD1-CE2 4.07Å; L99-F110 HydrophobicContact CD1-CZ 3.75Å; L102-F110 HydrophobicContact CD1-CE1 3.93Å; L102-F110 HydrophobicContact CD1-CZ 3.92Å; A108-F110 HydrophobicContact CB-CE2 4.32Å; A108-F110 HydrophobicContact CB-CZ 4.33Å
111	Y	95.5	Very high	90.6	Very high	48 Å²	48	49.7 Å²	49.7	19%	0.188	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	117.1	171.7	-62.2	-89.9	0	0	0	110	L43 L45 L84 R85 L86 P88	L43-Y111 HydrophobicContact CB-CD1 4.22Å; L43-Y111 HydrophobicContact CB-CE1 4.44Å; L43-Y111 HydrophobicContact CD1-CD1 4.44Å; L43-Y111 HydrophobicContact CD1-CE1 3.91Å; L43-Y111 CarbonylContact O-C 3.58Å; L43-Y111 WeakPolarHBondContact O-CA 3.36Å; L45-Y111 HydrophobicContact CD1-CD1 4.42Å; L45-Y111 HydrophobicContact CD1-CG 4.3Å; L84-Y111 WeakPolarHBondContact CA-O 3.42Å; R85-Y111 PolarHBondContact N-O 2.85Å; R85-Y111 PolarHBondContact O-N 3.45Å; L86-Y111 WeakPolarHBondContact O-CE2 3.34Å; P88-Y111 HydrophobicContact CG-CD1 3.94Å; P88-Y111 HydrophobicContact CG-CD2 4.22Å; P88-Y111 HydrophobicContact CG-CE1 3.8Å; P88-Y111 HydrophobicContact CG-CE2 4.11Å; P88-Y111 HydrophobicContact CG-CG 4.13Å
112	F	95.8	Very high	90.5	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.009	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	134.5	178.9	165.8	-104.1	0	0	0	111.5	I42 L43 L45 L51 F70 W77 Q82 S83 L84 D114	I42-F112 HydrophobicContact CG2-CB 3.72Å; L43-F112 PolarHBondContact O-N 3Å; L45-F112 WeakPolarHBondContact CB-O 3.48Å; L45-F112 PolarHBondContact N-O 2.82Å; L51-F112 HydrophobicContact CD1-CB 4.32Å; L51-F112 HydrophobicContact CD1-CD1 3.62Å; L51-F112 HydrophobicContact CD1-CE1 4.37Å; L51-F112 HydrophobicContact CD1-CG 4.31Å; F70-F112 HydrophobicContact CD1-CD2 4.38Å; F70-F112 HydrophobicContact CE1-CD1 4.25Å; F70-F112 AromaticContact CE1-CD2 3.66Å; F70-F112 HydrophobicContact CE1-CD2 3.66Å; F70-F112 HydrophobicContact CE1-CE1 4.32Å; F70-F112 AromaticContact CE1-CE2 3.76Å; F70-F112 HydrophobicContact CE1-CE2 3.76Å; F70-F112 AromaticContact CE1-CG 3.92Å; F70-F112 HydrophobicContact CE1-CG 3.92Å; F70-F112 HydrophobicContact CE1-CZ 4.09Å; F70-F112 HydrophobicContact CZ-CD1 4.38Å; F70-F112 HydrophobicContact CZ-CG 4.33Å; W77-F112 HydrophobicContact CB-CZ 4.36Å; W77-F112 AromaticContact CD2-CE1 4Å; W77-F112 HydrophobicContact CD2-CE1 4Å; W77-F112 AromaticContact CD2-CZ 3.7Å; W77-F112 HydrophobicContact CD2-CZ 3.7Å; W77-F112 AromaticContact CE2-CE1 3.94Å; W77-F112 AromaticContact CE2-CZ 3.93Å; W77-F112 HydrophobicContact CE3-CE1 4.13Å; W77-F112 HydrophobicContact CE3-CZ 4.08Å; W77-F112 AromaticContact CG-CZ 3.83Å; W77-F112 HydrophobicContact CG-CZ 3.83Å; W77-F112 HydrophobicContact CH2-CE1 4.21Å; W77-F112 HydrophobicContact CZ2-CE1 4.06Å; W77-F112 HydrophobicContact CZ3-CE1 4.24Å; Q82-F112 HydrophobicContact CB-CD2 4.21Å; Q82-F112 HydrophobicContact CB-CE2 3.89Å; Q82-F112 HydrophobicContact CG-CE2 3.9Å; S83-F112 CarbonylContact O-C 3.53Å; S83-F112 WeakPolarHBondContact O-CA 3.23Å; L84-F112 HydrophobicContact CD2-CB 4.08Å; L84-F112 HydrophobicContact CD2-CD2 4.26Å; F112-D114 HydrophobicContact CE1-CB 4.31Å; F112-D114 HydrophobicContact CZ-CB 3.97Å
113	S	93.4	Very high	90.4	Very high	20 Å²	20	48.6 Å²	48.6	14%	0.14	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	138.8	165.1	55.7	0	0	0	0	111.3	S83	S83-S113 VanDerWaalsContact CB-OG 3.27Å; S83-S113 WeakPolarHBondContact CB-OG 3.46Å; S83-S113 PolarHBondContact N-O 3.28Å; S83-S113 PolarHBondContact O-N 3.05Å; S83-S113 PolarHBondContact OG-OG 2.68Å
114	D	93.3	Very high	90.5	Very high	68 Å²	68	42.9 Å²	42.9	36%	0.364	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	115.2	176.8	-179.4	3	0	0	0	110.7	R81 F112 G116	R81-D114 WeakPolarHBondContact CD-OD1 3.35Å; R81-D114 WeakPolarHBondContact CG-OD1 3.35Å; R81-D114 IonicContact CZ-OD1 2.86Å; R81-D114 IonicContact CZ-OD2 2.68Å; R81-D114 VanDerWaalsContact NE-CG 3.32Å; R81-D114 IonicContact NE-OD1 2.75Å; R81-D114 PolarHBondContact NE-OD1 2.95Å; R81-D114 IonicContact NE-OD2 3.69Å; R81-D114 PolarHBondContact NE-OD2 2.68Å; R81-D114 IonicContact NH2-OD1 3.64Å; R81-D114 PolarHBondContact NH2-OD1 3.06Å; R81-D114 IonicContact NH2-OD2 2.61Å; R81-D114 PolarHBondContact NH2-OD2 2.91Å; F112-D114 HydrophobicContact CE1-CB 4.31Å; F112-D114 HydrophobicContact CZ-CB 3.97Å; D114-G116 VanDerWaalsContact C-N 3.28Å; D114-G116 PolarHBondContact O-N 3.02Å; D114-G116 WeakPolarHBondContact OD1-CA 3.48Å; D114-G116 PolarHBondContact OD1-N 3.08Å
115	L	90.8	Very high	90.7	Very high	83 Å²	83	44 Å²	44	44%	0.435	26%	0.261	S	S	.	.			trans	-79.3	-8.5	177.6	-60.3	177.5	0	0	0	113.7	R81 Q118	R81-L115 WeakPolarHBondContact O-CB 3.04Å; R81-L115 PolarHBondContact O-N 3.37Å; L115-Q118 HydrophobicContact CB-CG 4.48Å; L115-Q118 PolarHBondContact O-NE2 2.91Å
116	G	92	Very high	91.1	Very high	14 Å²	14	43.8 Å²	43.8	14%	0.144	25%	0.248	C	C	.	.			trans	75.4	-173.9	-170	0	0	0	0	0	113.2	R81 D114 Q118	R81-G116 WeakPolarHBondContact CG-O 3.43Å; D114-G116 VanDerWaalsContact C-N 3.28Å; D114-G116 PolarHBondContact O-N 3.02Å; D114-G116 WeakPolarHBondContact OD1-CA 3.48Å; D114-G116 PolarHBondContact OD1-N 3.08Å; G116-Q118 WeakPolarHBondContact O-CG 3.38Å; G116-Q118 PolarHBondContact O-N 3.14Å; G116-Q118 PolarHBondContact O-NE2 3.1Å
117	P	91.3	Very high	91.4	Very high	73 Å²	73	40.8 Å²	40.8	47%	0.474	23%	0.232	S	C	.	.	S	Bend	trans	-56.2	126.9	179.5	-24.8	34.4	0	0	0	112.5	Y78 L192	Y78-P117 WeakPolarHBondContact OH-CA 3.47Å; P117-L192 HydrophobicContact CB-CB 4.04Å; P117-L192 HydrophobicContact CB-CD2 4Å; P117-L192 WeakPolarHBondContact O-CB 3.44Å; P117-L192 PolarHBondContact O-N 3.4Å
118	Q	91.6	Very high	91.6	Very high	20 Å²	20	38 Å²	38	9%	0.093	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	146.1	-179.1	-61.4	-53.2	-63.2	0	0	111.1	Y78 A80 L115 G116 T189 M190 P191	Y78-Q118 HydrophobicContact CE2-CB 4.47Å; Y78-Q118 PolarHBondContact OH-N 3.14Å; A80-Q118 HydrophobicContact CB-CB 4.41Å; A80-Q118 WeakPolarHBondContact O-CG 3.35Å; L115-Q118 HydrophobicContact CB-CG 4.48Å; L115-Q118 PolarHBondContact O-NE2 2.91Å; G116-Q118 WeakPolarHBondContact O-CG 3.38Å; G116-Q118 PolarHBondContact O-N 3.14Å; G116-Q118 PolarHBondContact O-NE2 3.1Å; Q118-T189 HydrophobicContact CB-CG2 4.4Å; Q118-M190 WeakPolarHBondContact CA-O 3.42Å; Q118-M190 PolarHBondContact OE1-O 2.9Å; Q118-P191 VanDerWaalsContact OE1-N 3.15Å
119	L	88.8	Confident	91.7	Very high	40 Å²	40	37.9 Å²	37.9	21%	0.209	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	146.8	170.1	-68.9	-179.3	0	0	0	110.5	V124 T189 M190 L192 I195	L119-V124 HydrophobicContact CB-CG2 4.04Å; L119-T189 CarbonylContact O-C 3.56Å; L119-T189 WeakPolarHBondContact O-CA 3.34Å; L119-T189 VanDerWaalsContact O-CB 3.23Å; L119-T189 WeakPolarHBondContact O-CB 3.4Å; L119-M190 PolarHBondContact N-O 3.41Å; L119-M190 PolarHBondContact O-N 2.99Å; L119-L192 HydrophobicContact CD1-CD1 3.41Å; L119-L192 VanDerWaalsContact CD1-CD1 3.41Å; L119-L192 HydrophobicContact CD2-CD1 4.2Å; L119-L192 HydrophobicContact CG-CD1 3.75Å; L119-I195 HydrophobicContact CD1-CB 4.21Å; L119-I195 HydrophobicContact CD1-CD1 3.42Å; L119-I195 VanDerWaalsContact CD1-CD1 3.42Å; L119-I195 HydrophobicContact CD1-CG1 4.37Å; L119-I195 HydrophobicContact CD1-CG2 4.42Å
120	T	88.4	Confident	91.8	Very high	76 Å²	76	38.9 Å²	38.9	47%	0.466	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	147.2	172.3	66.8	0	0	0	0	109.9	G122 T123 V124	T120-G122 PolarHBondContact O-N 3.46Å; T120-T123 PolarHBondContact O-N 3.11Å; T120-T123 VanDerWaalsContact O-N 3.11Å; T120-T123 PolarHBondContact OG1-N 3.39Å; T120-T123 PolarHBondContact OG1-OG1 3.14Å; T120-T123 VanDerWaalsContact OG1-OG1 3.1Å; T120-V124 WeakPolarHBondContact O-CG2 3.43Å; T120-V124 PolarHBondContact O-N 2.98Å; T120-V124 VanDerWaalsContact O-N 3.14Å
121	W	86.4	Confident	91.8	Very high	79 Å²	79	39.1 Å²	39.1	30%	0.299	22%	0.221	S	C	.	.	H	α-helix	trans	-57.3	-30.7	176.3	-78.3	111.2	0	0	0	113.1	V124 F125 I185 M190	W121-V124 HydrophobicContact CE3-CB 4.42Å; W121-V124 HydrophobicContact CE3-CG1 4.35Å; W121-V124 HydrophobicContact CZ3-CG1 4.4Å; W121-V124 PolarHBondContact O-N 3.18Å; W121-F125 HydrophobicContact CB-CE2 4.23Å; W121-F125 HydrophobicContact CE3-CE1 4.01Å; W121-F125 AromaticContact CE3-CZ 3.97Å; W121-F125 HydrophobicContact CE3-CZ 3.97Å; W121-F125 HydrophobicContact CZ3-CE1 4.45Å; W121-F125 VanDerWaalsContact O-CD2 3.28Å; W121-F125 WeakPolarHBondContact O-CD2 3.32Å; W121-F125 VanDerWaalsContact O-CG 3.31Å; W121-F125 WeakPolarHBondContact O-CG 3.47Å; W121-F125 PolarHBondContact O-N 2.88Å; W121-I185 HydrophobicContact CB-CG2 3.48Å; W121-I185 VanDerWaalsContact CB-CG2 3.48Å; W121-M190 HydrophobicContact CH2-CB 4.17Å; W121-M190 HydrophobicContact CH2-CG 4.22Å; W121-M190 HydrophobicContact CH2-SD 3.74Å; W121-M190 HydrophobicContact CZ2-CB 4.1Å; W121-M190 HydrophobicContact CZ2-CG 4.49Å; W121-M190 HydrophobicContact CZ3-CB 4.48Å; W121-M190 HydrophobicContact CZ3-SD 3.86Å
122	G	87.9	Confident	91.8	Very high	16 Å²	16	36.9 Å²	36.9	17%	0.165	21%	0.212	C	C	.	.	H	α-helix	trans	-59.7	-50.9	173.4	0	0	0	0	0	112.5	T120 V124 F125 L126 I185	T120-G122 PolarHBondContact O-N 3.46Å; G122-V124 VanDerWaalsContact C-N 3.28Å; G122-V124 PolarHBondContact O-N 2.97Å; G122-F125 PolarHBondContact O-N 3.31Å; G122-L126 VanDerWaalsContact O-CG 3.29Å; G122-L126 WeakPolarHBondContact O-CG 3.22Å; G122-L126 PolarHBondContact O-N 3.1Å; G122-I185 VanDerWaalsContact CA-CD1 3.48Å
123	T	89.4	Confident	91.9	Very high	69 Å²	69	38 Å²	38	42%	0.423	22%	0.218	S	C	.	.	H	α-helix	trans	-60.2	-39.7	176.7	-56.4	0	0	0	0	111.9	T120 L126 A127	T120-T123 PolarHBondContact O-N 3.11Å; T120-T123 VanDerWaalsContact O-N 3.11Å; T120-T123 PolarHBondContact OG1-N 3.39Å; T120-T123 PolarHBondContact OG1-OG1 3.14Å; T120-T123 VanDerWaalsContact OG1-OG1 3.1Å; T123-L126 PolarHBondContact O-N 2.61Å; T123-A127 WeakPolarHBondContact O-CB 3.33Å; T123-A127 PolarHBondContact O-N 2.79Å
124	V	90.3	Very high	92.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-51.3	178.2	176.5	0	0	0	0	110.8	L119 T120 W121 G122 L126 A127 E128 M190	L119-V124 HydrophobicContact CB-CG2 4.04Å; T120-V124 WeakPolarHBondContact O-CG2 3.43Å; T120-V124 PolarHBondContact O-N 2.98Å; T120-V124 VanDerWaalsContact O-N 3.14Å; W121-V124 HydrophobicContact CE3-CB 4.42Å; W121-V124 HydrophobicContact CE3-CG1 4.35Å; W121-V124 HydrophobicContact CZ3-CG1 4.4Å; W121-V124 PolarHBondContact O-N 3.18Å; G122-V124 VanDerWaalsContact C-N 3.28Å; G122-V124 PolarHBondContact O-N 2.97Å; V124-L126 VanDerWaalsContact C-N 3.3Å; V124-L126 PolarHBondContact O-N 2.84Å; V124-A127 PolarHBondContact O-N 3.33Å; V124-E128 HydrophobicContact CG1-CG 4.44Å; V124-E128 WeakPolarHBondContact CG1-OE1 3.35Å; V124-E128 WeakPolarHBondContact O-CB 3.41Å; V124-E128 WeakPolarHBondContact O-CG 3.2Å; V124-E128 PolarHBondContact O-N 2.86Å; V124-M190 HydrophobicContact CB-CE 4.28Å; V124-M190 HydrophobicContact CG1-CE 3.58Å; V124-M190 HydrophobicContact CG1-SD 4.46Å; V124-M190 HydrophobicContact CG2-CB 4.4Å; V124-M190 HydrophobicContact CG2-CE 3.62Å
125	F	89.9	Confident	92.3	Very high	61 Å²	61	39.3 Å²	39.3	27%	0.268	23%	0.225	S	C	.	.	H	α-helix	trans	-63.4	-35.6	179.3	-65.2	-31.3	0	0	0	112.8	W121 G122 E128 C129 T179 I185	W121-F125 HydrophobicContact CB-CE2 4.23Å; W121-F125 HydrophobicContact CE3-CE1 4.01Å; W121-F125 AromaticContact CE3-CZ 3.97Å; W121-F125 HydrophobicContact CE3-CZ 3.97Å; W121-F125 HydrophobicContact CZ3-CE1 4.45Å; W121-F125 VanDerWaalsContact O-CD2 3.28Å; W121-F125 WeakPolarHBondContact O-CD2 3.32Å; W121-F125 VanDerWaalsContact O-CG 3.31Å; W121-F125 WeakPolarHBondContact O-CG 3.47Å; W121-F125 PolarHBondContact O-N 2.88Å; G122-F125 PolarHBondContact O-N 3.31Å; F125-E128 PolarHBondContact O-N 2.85Å; F125-C129 PolarHBondContact O-N 3.05Å; F125-C129 VanDerWaalsContact O-N 3.14Å; F125-C129 PolarHBondContact O-SG 3.46Å; F125-T179 HydrophobicContact CB-CG2 3.74Å; F125-I185 HydrophobicContact CD2-CD1 3.94Å; F125-I185 HydrophobicContact CE2-CD1 4.42Å; F125-I185 HydrophobicContact CE2-CG2 4.44Å
126	L	93.2	Very high	92.6	Very high	46 Å²	46	35.3 Å²	35.3	24%	0.241	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-47.6	173.9	-69.6	172.2	0	0	0	111.5	G122 T123 V124 E128 C129 V130 V176 T179 L180	G122-L126 VanDerWaalsContact O-CG 3.29Å; G122-L126 WeakPolarHBondContact O-CG 3.22Å; G122-L126 PolarHBondContact O-N 3.1Å; T123-L126 PolarHBondContact O-N 2.61Å; V124-L126 VanDerWaalsContact C-N 3.3Å; V124-L126 PolarHBondContact O-N 2.84Å; L126-E128 VanDerWaalsContact C-N 3.31Å; L126-E128 PolarHBondContact O-N 3.23Å; L126-C129 PolarHBondContact O-N 3.35Å; L126-C129 VanDerWaalsContact O-N 3.08Å; L126-V130 WeakPolarHBondContact O-CB 3.32Å; L126-V130 WeakPolarHBondContact O-CG2 3.42Å; L126-V130 PolarHBondContact O-N 3.43Å; L126-V176 HydrophobicContact CD2-CG1 4.04Å; L126-T179 HydrophobicContact CD2-CG2 3.91Å; L126-T179 HydrophobicContact CG-CG2 3.98Å; L126-L180 HydrophobicContact CD1-CD2 3.75Å; L126-L180 HydrophobicContact CD2-CD2 3.82Å; L126-L180 HydrophobicContact CD2-CG 3.89Å; L126-L180 HydrophobicContact CG-CD2 4.37Å
127	A	92.9	Very high	92.9	Very high	26 Å²	26	37.1 Å²	37.1	22%	0.215	21%	0.211	C	C	.	.	H	α-helix	trans	-62.7	-38.6	177.8	0	0	0	0	0	112.3	T123 V124 C129 G131 I195 W203	T123-A127 WeakPolarHBondContact O-CB 3.33Å; T123-A127 PolarHBondContact O-N 2.79Å; V124-A127 PolarHBondContact O-N 3.33Å; A127-C129 PolarHBondContact O-N 3.45Å; A127-G131 PolarHBondContact O-N 3.16Å; A127-I195 HydrophobicContact CB-CD1 3.97Å; A127-W203 PolarHBondContact O-NE1 3.4Å
128	E	91.9	Very high	93.2	Very high	11 Å²	11	37.1 Å²	37.1	5%	0.051	21%	0.205	C	C	.	.	H	α-helix	trans	-62.6	-26.9	174.4	-74.1	174.7	-175.3	0	0	112.8	V124 F125 L126 P132 N198 Y202	V124-E128 HydrophobicContact CG1-CG 4.44Å; V124-E128 WeakPolarHBondContact CG1-OE1 3.35Å; V124-E128 WeakPolarHBondContact O-CB 3.41Å; V124-E128 WeakPolarHBondContact O-CG 3.2Å; V124-E128 PolarHBondContact O-N 2.86Å; F125-E128 PolarHBondContact O-N 2.85Å; L126-E128 VanDerWaalsContact C-N 3.31Å; L126-E128 PolarHBondContact O-N 3.23Å; E128-P132 WeakPolarHBondContact O-CD 3.5Å; E128-P132 VanDerWaalsContact O-CG 3.24Å; E128-P132 WeakPolarHBondContact O-CG 3.29Å; E128-N198 HydrophobicContact CG-CB 4.38Å; E128-N198 VanDerWaalsContact OE1-CB 3.3Å; E128-N198 WeakPolarHBondContact OE1-CB 3.31Å; E128-N198 PolarHBondContact OE1-ND2 3.36Å; E128-Y202 HydrophobicContact CB-CD2 4.25Å; E128-Y202 HydrophobicContact CG-CD2 4.06Å; E128-Y202 HydrophobicContact CG-CE2 4.28Å
129	C	93.4	Very high	93.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-98.5	-40.3	-178.3	-61.8	0	0	0	0	113.9	F125 L126 A127 L133 Y172 R175 V176	F125-C129 PolarHBondContact O-N 3.05Å; F125-C129 VanDerWaalsContact O-N 3.14Å; F125-C129 PolarHBondContact O-SG 3.46Å; L126-C129 PolarHBondContact O-N 3.35Å; L126-C129 VanDerWaalsContact O-N 3.08Å; A127-C129 PolarHBondContact O-N 3.45Å; C129-L133 PolarHBondContact O-N 3.36Å; C129-Y172 HydrophobicContact CB-CD1 4.03Å; C129-Y172 VanDerWaalsContact O-CD1 3.25Å; C129-Y172 WeakPolarHBondContact O-CD1 3.39Å; C129-R175 HydrophobicContact CB-CB 4.45Å; C129-V176 HydrophobicContact CB-CG2 3.66Å
130	V	95.8	Very high	93.9	Very high	64 Å²	64	38.1 Å²	38.1	39%	0.388	21%	0.207	S	C	.	.	H	α-helix	trans	-68.4	-39.4	-177.6	171.5	0	0	0	0	111.1	L126 L133 V134 V176	L126-V130 WeakPolarHBondContact O-CB 3.32Å; L126-V130 WeakPolarHBondContact O-CG2 3.42Å; L126-V130 PolarHBondContact O-N 3.43Å; V130-L133 WeakPolarHBondContact O-CB 3.33Å; V130-L133 PolarHBondContact O-N 3.29Å; V130-V134 HydrophobicContact CG1-CG2 4.11Å; V130-V134 WeakPolarHBondContact O-CG2 3.31Å; V130-V134 PolarHBondContact O-N 3.42Å; V130-V176 HydrophobicContact CG2-CG2 3.82Å
131	G	95.7	Very high	94.3	Very high	6 Å²	6	39.8 Å²	39.8	6%	0.062	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-54.1	-179.2	0	0	0	0	0	114.1	A127 L133 V134 L135 W203	A127-G131 PolarHBondContact O-N 3.16Å; G131-L133 VanDerWaalsContact C-N 3.26Å; G131-L133 PolarHBondContact O-N 3.01Å; G131-V134 PolarHBondContact O-N 2.92Å; G131-L135 WeakPolarHBondContact O-CB 3.28Å; G131-L135 WeakPolarHBondContact O-CG 3.29Å; G131-L135 PolarHBondContact O-N 3.31Å; G131-W203 VanDerWaalsContact CA-CE2 3.45Å
132	P	96.3	Very high	94.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-54.4	-40.6	174.6	-32.2	40.8	0	0	0	113.4	E128 Y136 H168 Y172 A206	E128-P132 WeakPolarHBondContact O-CD 3.5Å; E128-P132 VanDerWaalsContact O-CG 3.24Å; E128-P132 WeakPolarHBondContact O-CG 3.29Å; P132-Y136 VanDerWaalsContact O-CB 3.24Å; P132-Y136 WeakPolarHBondContact O-CB 3.49Å; P132-Y136 PolarHBondContact O-N 3.22Å; P132-H168 PolarHBondContact O-CE1 3.34Å; P132-Y172 HydrophobicContact CB-CD1 4.05Å; P132-Y172 HydrophobicContact CB-CD2 4.17Å; P132-Y172 HydrophobicContact CB-CE1 3.54Å; P132-Y172 HydrophobicContact CB-CE2 3.71Å; P132-Y172 HydrophobicContact CB-CG 4.33Å; P132-Y172 HydrophobicContact CG-CD1 4.44Å; P132-Y172 HydrophobicContact CG-CE1 3.72Å; P132-A206 HydrophobicContact CB-CB 3.61Å; P132-A206 HydrophobicContact CG-CB 4.26Å
133	L	97.2	Very high	95.2	Very high	26 Å²	26	38.5 Å²	38.5	14%	0.136	20%	0.202	C	C	.	.	H	α-helix	trans	-60.2	-53.6	177	176.3	63.2	0	0	0	111.5	C129 V130 G131 Y136 L137 I173	C129-L133 PolarHBondContact O-N 3.36Å; V130-L133 WeakPolarHBondContact O-CB 3.33Å; V130-L133 PolarHBondContact O-N 3.29Å; G131-L133 VanDerWaalsContact C-N 3.26Å; G131-L133 PolarHBondContact O-N 3.01Å; L133-Y136 PolarHBondContact O-N 2.98Å; L133-L137 HydrophobicContact CD1-CD1 4.12Å; L133-L137 HydrophobicContact CD1-CG 4.49Å; L133-L137 HydrophobicContact CG-CD1 4.28Å; L133-L137 WeakPolarHBondContact O-CG 3.35Å; L133-L137 PolarHBondContact O-N 3.35Å; L133-L137 VanDerWaalsContact O-N 3.1Å; L133-I173 HydrophobicContact CD1-CG1 4.26Å; L133-I173 HydrophobicContact CD2-CG1 3.73Å
134	V	97.6	Very high	95.4	Very high	75 Å²	75	37.4 Å²	37.4	46%	0.455	20%	0.196	S	C	.	.	H	α-helix	trans	-62.5	-48.7	-179	172.8	0	0	0	0	110.5	V130 G131 Y136 L137 M138	V130-V134 HydrophobicContact CG1-CG2 4.11Å; V130-V134 WeakPolarHBondContact O-CG2 3.31Å; V130-V134 PolarHBondContact O-N 3.42Å; G131-V134 PolarHBondContact O-N 2.92Å; V134-Y136 PolarHBondContact O-N 3.08Å; V134-L137 PolarHBondContact O-N 3.47Å; V134-M138 HydrophobicContact CG1-SD 4.22Å; V134-M138 WeakPolarHBondContact O-CG 3.34Å; V134-M138 PolarHBondContact O-N 2.95Å
135	L	96.9	Very high	95.5	Very high	40 Å²	40	47.5 Å²	47.5	21%	0.209	24%	0.24	C	C	.	.	H	α-helix	trans	-58.9	-48.6	179.8	-73.4	172.3	0	0	0	111.2	G131 L137 M138 F139 W203	G131-L135 WeakPolarHBondContact O-CB 3.28Å; G131-L135 WeakPolarHBondContact O-CG 3.29Å; G131-L135 PolarHBondContact O-N 3.31Å; L135-L137 VanDerWaalsContact C-N 3.29Å; L135-L137 PolarHBondContact O-N 3.07Å; L135-M138 HydrophobicContact CD2-SD 4.14Å; L135-M138 WeakPolarHBondContact O-CB 3.46Å; L135-M138 PolarHBondContact O-N 3.35Å; L135-M138 VanDerWaalsContact O-N 3.09Å; L135-F139 WeakPolarHBondContact O-CD2 3.19Å; L135-F139 PolarHBondContact O-N 3.21Å; L135-W203 HydrophobicContact CD1-CB 3.56Å; L135-W203 HydrophobicContact CD1-CD2 4.15Å; L135-W203 HydrophobicContact CD1-CE3 4.01Å; L135-W203 HydrophobicContact CD1-CG 4Å
136	Y	97.8	Very high	95.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-57.8	-43.7	178.8	-168.4	-72.2	0	0	0	111.8	P132 L133 V134 M138 F139 Y140 A164 C165 H168 A210 I213	P132-Y136 VanDerWaalsContact O-CB 3.24Å; P132-Y136 WeakPolarHBondContact O-CB 3.49Å; P132-Y136 PolarHBondContact O-N 3.22Å; L133-Y136 PolarHBondContact O-N 2.98Å; V134-Y136 PolarHBondContact O-N 3.08Å; Y136-M138 VanDerWaalsContact C-N 3.3Å; Y136-M138 PolarHBondContact O-N 2.79Å; Y136-F139 PolarHBondContact O-N 2.85Å; Y136-Y140 PolarHBondContact O-N 3.22Å; Y136-A164 WeakPolarHBondContact OH-CB 3.17Å; Y136-C165 HydrophobicContact CE1-CB 3.81Å; Y136-H168 WeakPolarHBondContact CB-CE1 3.3Å; Y136-H168 HydrophobicContact CD2-CB 4.14Å; Y136-H168 AromaticContact CD2-CD2 3.45Å; Y136-H168 VanDerWaalsContact CD2-CD2 3.45Å; Y136-H168 WeakPolarHBondContact CD2-CD2 3.35Å; Y136-H168 AromaticContact CD2-CE1 3.57Å; Y136-H168 AromaticContact CD2-CG 3.47Å; Y136-H168 VanDerWaalsContact CD2-CG 3.47Å; Y136-H168 AromaticContact CD2-ND1 3.54Å; Y136-H168 AromaticContact CD2-NE2 3.52Å; Y136-H168 HydrophobicContact CE1-CB 4.43Å; Y136-H168 HydrophobicContact CE2-CB 4.03Å; Y136-H168 AromaticContact CE2-CD2 3.79Å; Y136-H168 AromaticContact CE2-CG 3.8Å; Y136-H168 HydrophobicContact CG-CB 4.39Å; Y136-H168 AromaticContact CG-CE1 3.65Å; Y136-H168 AromaticContact CG-CG 3.78Å; Y136-H168 AromaticContact CG-ND1 3.44Å; Y136-A210 HydrophobicContact CD2-CB 3.47Å; Y136-A210 VanDerWaalsContact CD2-CB 3.47Å; Y136-A210 HydrophobicContact CE2-CB 3.88Å; Y136-A210 HydrophobicContact CG-CB 3.88Å; Y136-I213 HydrophobicContact CE2-CD1 4.32Å; Y136-I213 WeakPolarHBondContact OH-CG2 3.25Å
137	L	97.9	Very high	95.8	Very high	52 Å²	52	45.2 Å²	45.2	27%	0.272	23%	0.229	S	C	.	.	H	α-helix	trans	-62.5	-36.5	177.7	-70.4	172.6	0	0	0	112.2	L133 V134 L135 F139 Y140 F141	L133-L137 HydrophobicContact CD1-CD1 4.12Å; L133-L137 HydrophobicContact CD1-CG 4.49Å; L133-L137 HydrophobicContact CG-CD1 4.28Å; L133-L137 WeakPolarHBondContact O-CG 3.35Å; L133-L137 PolarHBondContact O-N 3.35Å; L133-L137 VanDerWaalsContact O-N 3.1Å; V134-L137 PolarHBondContact O-N 3.47Å; L135-L137 VanDerWaalsContact C-N 3.29Å; L135-L137 PolarHBondContact O-N 3.07Å; L137-F139 VanDerWaalsContact C-N 3.34Å; L137-F139 PolarHBondContact O-N 2.81Å; L137-Y140 PolarHBondContact O-N 3.37Å; L137-F141 HydrophobicContact CB-CD2 4.35Å; L137-F141 HydrophobicContact CB-CE2 4.32Å; L137-F141 HydrophobicContact CD2-CE2 4.22Å; L137-F141 WeakPolarHBondContact O-CD2 3.48Å; L137-F141 PolarHBondContact O-N 3.42Å
138	M	97.4	Very high	95.8	Very high	73 Å²	73	46.9 Å²	46.9	36%	0.36	24%	0.239	S	C	.	.	H	α-helix	trans	-59.8	-43	174.3	-65.2	170.8	63.4	0	0	112.1	V134 L135 Y136 R142 L143 I146	V134-M138 HydrophobicContact CG1-SD 4.22Å; V134-M138 WeakPolarHBondContact O-CG 3.34Å; V134-M138 PolarHBondContact O-N 2.95Å; L135-M138 HydrophobicContact CD2-SD 4.14Å; L135-M138 WeakPolarHBondContact O-CB 3.46Å; L135-M138 PolarHBondContact O-N 3.35Å; L135-M138 VanDerWaalsContact O-N 3.09Å; Y136-M138 VanDerWaalsContact C-N 3.3Å; Y136-M138 PolarHBondContact O-N 2.79Å; M138-R142 PolarHBondContact O-N 3.12Å; M138-L143 HydrophobicContact CB-CD1 3.84Å; M138-L143 HydrophobicContact CB-CG 4.3Å; M138-L143 HydrophobicContact CE-CD1 4.13Å; M138-L143 HydrophobicContact CG-CD1 3.69Å; M138-L143 PolarHBondContact O-N 3.42Å; M138-I146 HydrophobicContact CB-CD1 4.24Å; M138-I146 WeakPolarHBondContact O-CD1 3.39Å
139	F	97.6	Very high	95.9	Very high	30 Å²	30	51.2 Å²	51.2	13%	0.132	27%	0.268	C	S	.	.	H	α-helix	trans	-69.5	-40.1	175.2	-71.7	-84.4	0	0	0	112.2	L135 Y136 L137 R142 I146 A207 A210 Y211 N214	L135-F139 WeakPolarHBondContact O-CD2 3.19Å; L135-F139 PolarHBondContact O-N 3.21Å; Y136-F139 PolarHBondContact O-N 2.85Å; L137-F139 VanDerWaalsContact C-N 3.34Å; L137-F139 PolarHBondContact O-N 2.81Å; F139-R142 PolarHBondContact O-N 2.97Å; F139-R142 VanDerWaalsContact O-N 3.07Å; F139-I146 HydrophobicContact CD1-CD1 4.34Å; F139-I146 HydrophobicContact CD1-CG2 3.39Å; F139-I146 HydrophobicContact CE1-CG2 3.53Å; F139-I146 HydrophobicContact CG-CG2 4.42Å; F139-A207 HydrophobicContact CE2-CB 3.63Å; F139-A207 HydrophobicContact CZ-CB 3.94Å; F139-A210 HydrophobicContact CB-CB 3.71Å; F139-A210 HydrophobicContact CD2-CB 3.66Å; F139-A210 HydrophobicContact CG-CB 3.8Å; F139-Y211 HydrophobicContact CD1-CD2 4.27Å; F139-Y211 AromaticContact CE1-CD2 3.92Å; F139-Y211 HydrophobicContact CE1-CD2 3.92Å; F139-Y211 HydrophobicContact CE1-CG 4.39Å; F139-N214 HydrophobicContact CB-CB 4.43Å
140	Y	97.8	Very high	96	Very high	50 Å²	50	58.2 Å²	58.2	20%	0.196	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-45.6	178	172.5	-101.7	0	0	0	112.4	Y136 L137 R142 H162 C165 N214	Y136-Y140 PolarHBondContact O-N 3.22Å; L137-Y140 PolarHBondContact O-N 3.37Å; Y140-R142 PolarHBondContact O-N 2.9Å; Y140-H162 AromaticContact CE2-ND1 3.53Å; Y140-H162 AromaticContact CZ-ND1 3.63Å; Y140-H162 PolarHBondContact OH-ND1 3.46Å; Y140-C165 HydrophobicContact CD2-CB 3.51Å; Y140-C165 HydrophobicContact CE2-CB 3.7Å; Y140-C165 HydrophobicContact CG-CB 4.01Å; Y140-C165 VanDerWaalsContact CG-SG 3.5Å; Y140-N214 WeakPolarHBondContact CD2-OD1 3.35Å
141	F	97.2	Very high	95.9	Very high	112 Å²	112	58.2 Å²	58.2	49%	0.491	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-1.4	175.5	-69.7	-61.6	0	0	0	113.5	L137 L143 F153	L137-F141 HydrophobicContact CB-CD2 4.35Å; L137-F141 HydrophobicContact CB-CE2 4.32Å; L137-F141 HydrophobicContact CD2-CE2 4.22Å; L137-F141 WeakPolarHBondContact O-CD2 3.48Å; L137-F141 PolarHBondContact O-N 3.42Å; F141-L143 VanDerWaalsContact C-N 3.34Å; F141-L143 HydrophobicContact CB-CD2 4.28Å; F141-L143 PolarHBondContact O-N 3.36Å; F141-F153 WeakPolarHBondContact O-CA 3.39Å
142	R	96.1	Very high	95.9	Very high	13 Å²	13	60.2 Å²	60.2	5%	0.049	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	55.7	-178.6	-55.3	-167	177.1	144.6	0.9	111.7	M138 F139 Y140 Y147 Y151 F153 T154 S155 N214	M138-R142 PolarHBondContact O-N 3.12Å; F139-R142 PolarHBondContact O-N 2.97Å; F139-R142 VanDerWaalsContact O-N 3.07Å; Y140-R142 PolarHBondContact O-N 2.9Å; R142-Y147 HydrophobicContact CB-CD2 4.01Å; R142-Y147 HydrophobicContact CB-CE2 4.32Å; R142-Y147 HydrophobicContact CG-CD2 3.87Å; R142-Y147 HydrophobicContact CG-CE2 3.83Å; R142-Y151 WeakPolarHBondContact CD-O 3.14Å; R142-F153 PolarHBondContact O-N 2.8Å; R142-T154 VanDerWaalsContact CD-O 3.26Å; R142-T154 WeakPolarHBondContact CD-O 3.38Å; R142-T154 PolarHBondContact NH1-O 3.18Å; R142-T154 PolarHBondContact NH1-OG1 3.1Å; R142-S155 PolarHBondContact NH1-O 3.19Å; R142-N214 PolarHBondContact NE-O 3.25Å; R142-N214 VanDerWaalsContact NE-O 3.08Å; R142-N214 PolarHBondContact NH2-O 3.04Å
143	L	96.4	Very high	95.8	Very high	55 Å²	55	66.9 Å²	66.9	29%	0.288	33%	0.331	S	S	.	.			trans	-56.4	151.8	176	-62.7	-172.6	0	0	0	110.6	M138 F141 I146 F153	M138-L143 HydrophobicContact CB-CD1 3.84Å; M138-L143 HydrophobicContact CB-CG 4.3Å; M138-L143 HydrophobicContact CE-CD1 4.13Å; M138-L143 HydrophobicContact CG-CD1 3.69Å; M138-L143 PolarHBondContact O-N 3.42Å; F141-L143 VanDerWaalsContact C-N 3.34Å; F141-L143 HydrophobicContact CB-CD2 4.28Å; F141-L143 PolarHBondContact O-N 3.36Å; L143-I146 HydrophobicContact CB-CD1 3.96Å; L143-I146 WeakPolarHBondContact O-CB 3.33Å; L143-I146 WeakPolarHBondContact O-CG1 3.45Å; L143-I146 PolarHBondContact O-N 3.44Å; L143-F153 HydrophobicContact CD2-CD1 4.27Å; L143-F153 HydrophobicContact CD2-CE1 3.47Å; L143-F153 VanDerWaalsContact CD2-CE1 3.47Å; L143-F153 HydrophobicContact CD2-CZ 4.15Å
144	P	94.8	Very high	95.6	Very high	46 Å²	46	68 Å²	68	30%	0.299	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	152.5	177.7	-28.1	35.3	0	0	0	112.4	I146 F153	P144-I146 PolarHBondContact O-N 2.98Å; P144-F153 VanDerWaalsContact CD-CZ 3.46Å; P144-F153 HydrophobicContact CG-CE2 3.66Å; P144-F153 HydrophobicContact CG-CZ 3.93Å
145	F	92.1	Very high	95.4	Very high	212 Å²	212	68.1 Å²	68.1	93%	0.93	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	-3.8	-178.3	-42.7	-72.7	0	0	0	116.2
146	I	94.1	Very high	95.3	Very high	40 Å²	40	67 Å²	67	21%	0.205	34%	0.338	C	S	.	.	S	Bend	trans	-85.4	-49.2	176.3	-62	179.3	0	0	0	111.7	M138 F139 L143 P144	M138-I146 HydrophobicContact CB-CD1 4.24Å; M138-I146 WeakPolarHBondContact O-CD1 3.39Å; F139-I146 HydrophobicContact CD1-CD1 4.34Å; F139-I146 HydrophobicContact CD1-CG2 3.39Å; F139-I146 HydrophobicContact CE1-CG2 3.53Å; F139-I146 HydrophobicContact CG-CG2 4.42Å; L143-I146 HydrophobicContact CB-CD1 3.96Å; L143-I146 WeakPolarHBondContact O-CB 3.33Å; L143-I146 WeakPolarHBondContact O-CG1 3.45Å; L143-I146 PolarHBondContact O-N 3.44Å; P144-I146 PolarHBondContact O-N 2.98Å
147	Y	94.3	Very high	95.1	Very high	19 Å²	19	76.9 Å²	76.9	8%	0.075	38%	0.381	C	S	.	.	S	Bend	trans	-119.7	-176.7	178.4	-56.9	-65.8	0	0	0	109.9	R142 Y211 H215 P216	R142-Y147 HydrophobicContact CB-CD2 4.01Å; R142-Y147 HydrophobicContact CB-CE2 4.32Å; R142-Y147 HydrophobicContact CG-CD2 3.87Å; R142-Y147 HydrophobicContact CG-CE2 3.83Å; Y147-Y211 HydrophobicContact CD1-CD2 4.4Å; Y147-Y211 AromaticContact CD1-CE2 3.9Å; Y147-Y211 HydrophobicContact CD1-CE2 3.9Å; Y147-Y211 AromaticContact CE1-CD2 3.61Å; Y147-Y211 HydrophobicContact CE1-CD2 3.61Å; Y147-Y211 AromaticContact CE1-CE2 3.5Å; Y147-Y211 HydrophobicContact CE1-CE2 3.5Å; Y147-Y211 HydrophobicContact CE1-CG 4.39Å; Y147-Y211 WeakPolarHBondContact OH-CA 3.37Å; Y147-Y211 PolarHBondContact OH-O 3.26Å; Y147-H215 AromaticContact CD1-CD2 3.69Å; Y147-H215 HydrophobicContact CE1-CB 4.22Å; Y147-H215 AromaticContact CE1-CD2 3.44Å; Y147-H215 VanDerWaalsContact CE1-CD2 3.44Å; Y147-H215 WeakPolarHBondContact CE1-CD2 3.41Å; Y147-H215 PolarHBondContact OH-N 2.6Å; Y147-P216 HydrophobicContact CG-CG 4.22Å
148	S	93.9	Very high	95.1	Very high	61 Å²	61	77.8 Å²	77.8	43%	0.427	38%	0.384	S	S	.	.			trans	-59.5	137.9	173.7	180	0	0	0	0	110.5	K150 Y151	S148-K150 PolarHBondContact O-N 3.21Å; S148-Y151 PolarHBondContact O-N 2.91Å
149	P	94.6	Very high	95	Very high	101 Å²	101	81.3 Å²	81.3	66%	0.656	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-52.4	-26.6	-173.5	-30.7	35.5	0	0	0	115.6	Y151 D152	P149-Y151 PolarHBondContact O-N 3.33Å; P149-Y151 VanDerWaalsContact O-N 3.1Å; P149-D152 WeakPolarHBondContact O-CB 3.34Å; P149-D152 VanDerWaalsContact O-CG 3.3Å; P149-D152 PolarHBondContact O-N 2.7Å
150	K	95.2	Very high	94.9	Very high	147 Å²	147	80.1 Å²	80.1	64%	0.639	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-63.5	-12.4	175	70.1	-175.3	-178.9	176.5	0	114.5	S148	S148-K150 PolarHBondContact O-N 3.21Å
151	Y	93.3	Very high	94.9	Very high	65 Å²	65	77.8 Å²	77.8	26%	0.255	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-109.6	3	179.6	-59.8	-63.5	0	0	0	113.3	R142 S148 P149 F153 T154 P216	R142-Y151 WeakPolarHBondContact CD-O 3.14Å; S148-Y151 PolarHBondContact O-N 2.91Å; P149-Y151 PolarHBondContact O-N 3.33Å; P149-Y151 VanDerWaalsContact O-N 3.1Å; Y151-F153 PolarHBondContact O-N 2.87Å; Y151-T154 WeakPolarHBondContact CA-OG1 3.36Å; Y151-T154 WeakPolarHBondContact O-CB 3.24Å; Y151-T154 PolarHBondContact O-N 3.44Å; Y151-T154 VanDerWaalsContact O-N 3.09Å; Y151-T154 PolarHBondContact O-OG1 3.37Å; Y151-P216 HydrophobicContact CD1-CB 3.66Å; Y151-P216 HydrophobicContact CD1-CG 3.84Å; Y151-P216 HydrophobicContact CD2-CB 3.81Å; Y151-P216 HydrophobicContact CD2-CG 3.47Å; Y151-P216 VanDerWaalsContact CD2-CG 3.47Å; Y151-P216 HydrophobicContact CE1-CB 3.62Å; Y151-P216 HydrophobicContact CE1-CG 4.25Å; Y151-P216 HydrophobicContact CE2-CB 3.74Å; Y151-P216 HydrophobicContact CE2-CG 3.89Å; Y151-P216 HydrophobicContact CG-CB 3.76Å; Y151-P216 HydrophobicContact CG-CG 3.41Å; Y151-P216 VanDerWaalsContact CG-CG 3.41Å
152	D	94.9	Very high	95	Very high	48 Å²	48	74 Å²	74	26%	0.257	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	128.1	179.8	-69.1	-6.4	0	0	0	110.2	P149 T154	P149-D152 WeakPolarHBondContact O-CB 3.34Å; P149-D152 VanDerWaalsContact O-CG 3.3Å; P149-D152 PolarHBondContact O-N 2.7Å; D152-T154 PolarHBondContact O-N 3.36Å
153	F	94.5	Very high	95.1	Very high	140 Å²	140	74 Å²	74	61%	0.614	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	12.6	-178.1	-54.4	-75.1	0	0	0	116.1	F141 R142 L143 P144 Y151	F141-F153 WeakPolarHBondContact O-CA 3.39Å; R142-F153 PolarHBondContact O-N 2.8Å; L143-F153 HydrophobicContact CD2-CD1 4.27Å; L143-F153 HydrophobicContact CD2-CE1 3.47Å; L143-F153 VanDerWaalsContact CD2-CE1 3.47Å; L143-F153 HydrophobicContact CD2-CZ 4.15Å; P144-F153 VanDerWaalsContact CD-CZ 3.46Å; P144-F153 HydrophobicContact CG-CE2 3.66Å; P144-F153 HydrophobicContact CG-CZ 3.93Å; Y151-F153 PolarHBondContact O-N 2.87Å
154	T	94.3	Very high	95.2	Very high	49 Å²	49	71.4 Å²	71.4	30%	0.301	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-77.5	143	175	62.9	0	0	0	0	110.9	R142 Y151 D152	R142-T154 VanDerWaalsContact CD-O 3.26Å; R142-T154 WeakPolarHBondContact CD-O 3.38Å; R142-T154 PolarHBondContact NH1-O 3.18Å; R142-T154 PolarHBondContact NH1-OG1 3.1Å; Y151-T154 WeakPolarHBondContact CA-OG1 3.36Å; Y151-T154 WeakPolarHBondContact O-CB 3.24Å; Y151-T154 PolarHBondContact O-N 3.44Å; Y151-T154 VanDerWaalsContact O-N 3.09Å; Y151-T154 PolarHBondContact O-OG1 3.37Å; D152-T154 PolarHBondContact O-N 3.36Å
155	S	93.3	Very high	95.3	Very high	78 Å²	78	69.6 Å²	69.6	55%	0.545	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-87.4	154.9	174.5	-149.3	0	0	0	0	111.9	R142 H162	R142-S155 PolarHBondContact NH1-O 3.19Å; S155-H162 PolarHBondContact OG-CE1 3.25Å
156	S	94.4	Very high	95.6	Very high	17 Å²	17	65.1 Å²	65.1	12%	0.119	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-72.3	149	168.8	-172.1	0	0	0	0	110.2	H158 H162	S156-H158 VanDerWaalsContact C-N 3.34Å; S156-H158 PolarHBondContact OG-N 3.23Å; S156-H162 PolarHBondContact O-NE2 3.24Å; S156-H162 VanDerWaalsContact O-NE2 3.16Å
157	K	94.2	Very high	95.9	Very high	206 Å²	206	63.5 Å²	63.5	90%	0.896	32%	0.315	S	S	*	.	S	Bend	trans	-85	-14	171.7	-60.7	-179.9	-178.3	179.6	0	112.2
158	H	96.1	Very high	96.1	Very high	71 Å²	71	62.7 Å²	62.7	33%	0.329	31%	0.311	S	S	.	.			trans	-92.9	119.3	-171.5	-61.4	-58.2	0	0	0	111.3	S156 V160 V161 Y218 T220	S156-H158 VanDerWaalsContact C-N 3.34Å; S156-H158 PolarHBondContact OG-N 3.23Å; H158-V160 HydrophobicContact CB-CG1 4.19Å; H158-V160 PolarHBondContact O-N 3.2Å; H158-V161 HydrophobicContact CB-CG2 4.14Å; H158-V161 WeakPolarHBondContact O-CB 3.13Å; H158-V161 PolarHBondContact O-N 3.09Å; H158-Y218 PolarHBondContact NE2-O 3.41Å; H158-T220 HydrophobicContact CB-CG2 4.01Å; H158-T220 VanDerWaalsContact ND1-CG2 3.34Å; H158-T220 WeakPolarHBondContact ND1-CG2 3.47Å
159	W	95.4	Very high	96.3	Very high	147 Å²	147	60.5 Å²	60.5	56%	0.557	30%	0.296	S	S	*	.	H	α-helix	trans	-55.2	-37.1	-178.9	-177.4	-122.2	0	0	0	114.1	V161 H162 L163	W159-V161 PolarHBondContact O-N 3.33Å; W159-H162 HydrophobicContact CE3-CB 4.03Å; W159-H162 AromaticContact CE3-CD2 3.91Å; W159-H162 HydrophobicContact CZ3-CB 4Å; W159-H162 PolarHBondContact O-N 2.92Å; W159-H162 VanDerWaalsContact O-N 3.08Å; W159-L163 HydrophobicContact CD2-CG 4.4Å; W159-L163 HydrophobicContact CG-CG 4.47Å; W159-L163 HydrophobicContact CZ2-CD2 3.81Å; W159-L163 HydrophobicContact CZ2-CG 4.21Å; W159-L163 PolarHBondContact O-N 2.98Å
160	V	97.1	Very high	96.4	Very high	6 Å²	6	60.3 Å²	60.3	4%	0.036	29%	0.285	C	S	.	.	H	α-helix	trans	-58.2	-29.8	177.7	64.6	0	0	0	0	113.2	H158 L163 A164 Y218 T220 P221 V228 M295	H158-V160 HydrophobicContact CB-CG1 4.19Å; H158-V160 PolarHBondContact O-N 3.2Å; V160-L163 PolarHBondContact O-N 3.1Å; V160-A164 VanDerWaalsContact O-CB 3.26Å; V160-A164 WeakPolarHBondContact O-CB 3.25Å; V160-A164 PolarHBondContact O-N 3.01Å; V160-Y218 HydrophobicContact CG1-CE1 3.53Å; V160-T220 HydrophobicContact CG1-CG2 4.29Å; V160-P221 HydrophobicContact CG2-CG 4.28Å; V160-V228 HydrophobicContact CB-CG1 4.38Å; V160-V228 HydrophobicContact CB-CG2 4.23Å; V160-V228 HydrophobicContact CG2-CG1 4.13Å; V160-V228 HydrophobicContact CG2-CG2 3.92Å; V160-M295 HydrophobicContact CG2-CG 4.34Å; V160-M295 VanDerWaalsContact CG2-O 3.31Å; V160-M295 WeakPolarHBondContact CG2-O 3.24Å
161	V	97.8	Very high	96.6	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-69.8	-40.6	177.3	178.2	0	0	0	0	110.6	H158 W159 A164 C165 I213 N214 Y218	H158-V161 HydrophobicContact CB-CG2 4.14Å; H158-V161 WeakPolarHBondContact O-CB 3.13Å; H158-V161 PolarHBondContact O-N 3.09Å; W159-V161 PolarHBondContact O-N 3.33Å; V161-A164 PolarHBondContact O-N 3.44Å; V161-C165 PolarHBondContact O-N 3.47Å; V161-I213 HydrophobicContact CG1-CG2 4.46Å; V161-I213 WeakPolarHBondContact CG2-O 3.39Å; V161-N214 VanDerWaalsContact CG1-OD1 3.26Å; V161-N214 WeakPolarHBondContact CG1-OD1 3.48Å; V161-Y218 HydrophobicContact CG2-CD1 3.6Å; V161-Y218 HydrophobicContact CG2-CE1 3.85Å; V161-Y218 HydrophobicContact CG2-CG 4.18Å
162	H	97.9	Very high	96.8	Very high	31 Å²	31	50.3 Å²	50.3	14%	0.144	24%	0.243	C	C	.	.	H	α-helix	trans	-66.7	-43.7	174.7	-56.6	-62	0	0	0	111.4	Y140 S155 S156 W159 A164 C165 M166	Y140-H162 AromaticContact CE2-ND1 3.53Å; Y140-H162 AromaticContact CZ-ND1 3.63Å; Y140-H162 PolarHBondContact OH-ND1 3.46Å; S155-H162 PolarHBondContact OG-CE1 3.25Å; S156-H162 PolarHBondContact O-NE2 3.24Å; S156-H162 VanDerWaalsContact O-NE2 3.16Å; W159-H162 HydrophobicContact CE3-CB 4.03Å; W159-H162 AromaticContact CE3-CD2 3.91Å; W159-H162 HydrophobicContact CZ3-CB 4Å; W159-H162 PolarHBondContact O-N 2.92Å; W159-H162 VanDerWaalsContact O-N 3.08Å; H162-A164 VanDerWaalsContact C-N 3.31Å; H162-A164 PolarHBondContact O-N 2.88Å; H162-C165 WeakPolarHBondContact O-CB 3.18Å; H162-C165 PolarHBondContact O-N 3.22Å; H162-M166 VanDerWaalsContact O-CG 3.3Å; H162-M166 WeakPolarHBondContact O-CG 3.26Å; H162-M166 PolarHBondContact O-N 3.13Å
163	L	98.1	Very high	96.9	Very high	14 Å²	14	52.2 Å²	52.2	7%	0.073	25%	0.252	C	S	.	.	H	α-helix	trans	-59.4	-42.7	173.4	-71.6	179.1	0	0	0	111.7	W159 V160 C165 M166 C167 V228 L232 M295	W159-L163 HydrophobicContact CD2-CG 4.4Å; W159-L163 HydrophobicContact CG-CG 4.47Å; W159-L163 HydrophobicContact CZ2-CD2 3.81Å; W159-L163 HydrophobicContact CZ2-CG 4.21Å; W159-L163 PolarHBondContact O-N 2.98Å; V160-L163 PolarHBondContact O-N 3.1Å; L163-C165 VanDerWaalsContact C-N 3.35Å; L163-C165 PolarHBondContact O-N 3.31Å; L163-M166 PolarHBondContact O-N 3.14Å; L163-C167 WeakPolarHBondContact O-CB 3.2Å; L163-C167 PolarHBondContact O-N 3.28Å; L163-C167 PolarHBondContact O-SG 3.4Å; L163-C167 VanDerWaalsContact O-SG 3.41Å; L163-V228 HydrophobicContact CD1-CG1 3.73Å; L163-L232 HydrophobicContact CD1-CD2 4.44Å; L163-L232 HydrophobicContact CD2-CD2 4.35Å; L163-M295 HydrophobicContact CB-SD 4.31Å
164	A	98.2	Very high	97.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.3	-43.9	177	0	0	0	0	0	111.7	Y136 V160 V161 H162 C167 H168 I213 F292 M295 T296	Y136-A164 WeakPolarHBondContact OH-CB 3.17Å; V160-A164 VanDerWaalsContact O-CB 3.26Å; V160-A164 WeakPolarHBondContact O-CB 3.25Å; V160-A164 PolarHBondContact O-N 3.01Å; V161-A164 PolarHBondContact O-N 3.44Å; H162-A164 VanDerWaalsContact C-N 3.31Å; H162-A164 PolarHBondContact O-N 2.88Å; A164-C167 PolarHBondContact O-N 2.92Å; A164-H168 VanDerWaalsContact O-CB 3.24Å; A164-H168 WeakPolarHBondContact O-CB 3.22Å; A164-H168 PolarHBondContact O-N 3.29Å; A164-I213 HydrophobicContact CB-CG2 3.78Å; A164-F292 HydrophobicContact CB-CE2 4.02Å; A164-F292 HydrophobicContact CB-CZ 3.95Å; A164-F292 WeakPolarHBondContact O-CE2 3.33Å; A164-M295 HydrophobicContact CB-CE 4.24Å; A164-T296 HydrophobicContact CB-CG2 3.82Å
165	C	98.5	Very high	97.2	Very high	9 Å²	9	46.8 Å²	46.8	6%	0.061	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-45.7	173.8	-176.8	0	0	0	0	112.3	Y136 Y140 V161 H162 L163 S169	Y136-C165 HydrophobicContact CE1-CB 3.81Å; Y140-C165 HydrophobicContact CD2-CB 3.51Å; Y140-C165 HydrophobicContact CE2-CB 3.7Å; Y140-C165 HydrophobicContact CG-CB 4.01Å; Y140-C165 VanDerWaalsContact CG-SG 3.5Å; V161-C165 PolarHBondContact O-N 3.47Å; H162-C165 WeakPolarHBondContact O-CB 3.18Å; H162-C165 PolarHBondContact O-N 3.22Å; L163-C165 VanDerWaalsContact C-N 3.35Å; L163-C165 PolarHBondContact O-N 3.31Å; C165-S169 WeakPolarHBondContact O-CB 3.27Å; C165-S169 PolarHBondContact O-N 3.47Å; C165-S169 PolarHBondContact O-OG 2.91Å
166	M	98.6	Very high	97.3	Very high	118 Å²	118	44.3 Å²	44.3	58%	0.581	20%	0.204	S	C	*	.	H	α-helix	trans	-61.8	-47.7	177.9	-71.5	175.8	69.2	0	0	111.5	H162 L163 S169 F170	H162-M166 VanDerWaalsContact O-CG 3.3Å; H162-M166 WeakPolarHBondContact O-CG 3.26Å; H162-M166 PolarHBondContact O-N 3.13Å; L163-M166 PolarHBondContact O-N 3.14Å; M166-S169 PolarHBondContact O-N 2.87Å; M166-F170 WeakPolarHBondContact O-CB 3.36Å; M166-F170 PolarHBondContact O-N 3.49Å
167	C	98.6	Very high	97.4	Very high	6 Å²	6	46.8 Å²	46.8	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-50	178	-77	0	0	0	0	111.8	L163 A164 S169 F170 H171 L232 F235 F292 M295	L163-C167 WeakPolarHBondContact O-CB 3.2Å; L163-C167 PolarHBondContact O-N 3.28Å; L163-C167 PolarHBondContact O-SG 3.4Å; L163-C167 VanDerWaalsContact O-SG 3.41Å; A164-C167 PolarHBondContact O-N 2.92Å; C167-S169 VanDerWaalsContact C-N 3.34Å; C167-S169 PolarHBondContact O-N 3.42Å; C167-F170 PolarHBondContact O-N 2.75Å; C167-H171 WeakPolarHBondContact O-CB 3.02Å; C167-H171 PolarHBondContact O-N 2.86Å; C167-L232 WeakPolarHBondContact SG-CD1 3.3Å; C167-F235 HydrophobicContact CB-CD1 4.02Å; C167-F235 HydrophobicContact CB-CE1 3.58Å; C167-F235 HydrophobicContact CB-CE2 4.2Å; C167-F235 HydrophobicContact CB-CG 4.49Å; C167-F235 HydrophobicContact CB-CZ 3.69Å; C167-F235 VanDerWaalsContact O-CZ 3.23Å; C167-F235 WeakPolarHBondContact O-CZ 3.32Å; C167-F292 HydrophobicContact CB-CD2 3.97Å; C167-F292 HydrophobicContact CB-CE2 3.81Å; C167-M295 HydrophobicContact CB-CE 4.13Å
168	H	98.3	Very high	97.5	Very high	1 Å²	1	37 Å²	37	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-60.5	-46	178.9	-175.5	-81	0	0	0	111	P132 Y136 A164 H171 Y172 F292	P132-H168 PolarHBondContact O-CE1 3.34Å; Y136-H168 WeakPolarHBondContact CB-CE1 3.3Å; Y136-H168 HydrophobicContact CD2-CB 4.14Å; Y136-H168 AromaticContact CD2-CD2 3.45Å; Y136-H168 VanDerWaalsContact CD2-CD2 3.45Å; Y136-H168 WeakPolarHBondContact CD2-CD2 3.35Å; Y136-H168 AromaticContact CD2-CE1 3.57Å; Y136-H168 AromaticContact CD2-CG 3.47Å; Y136-H168 VanDerWaalsContact CD2-CG 3.47Å; Y136-H168 AromaticContact CD2-ND1 3.54Å; Y136-H168 AromaticContact CD2-NE2 3.52Å; Y136-H168 HydrophobicContact CE1-CB 4.43Å; Y136-H168 HydrophobicContact CE2-CB 4.03Å; Y136-H168 AromaticContact CE2-CD2 3.79Å; Y136-H168 AromaticContact CE2-CG 3.8Å; Y136-H168 HydrophobicContact CG-CB 4.39Å; Y136-H168 AromaticContact CG-CE1 3.65Å; Y136-H168 AromaticContact CG-CG 3.78Å; Y136-H168 AromaticContact CG-ND1 3.44Å; A164-H168 VanDerWaalsContact O-CB 3.24Å; A164-H168 WeakPolarHBondContact O-CB 3.22Å; A164-H168 PolarHBondContact O-N 3.29Å; H168-H171 PolarHBondContact O-N 2.79Å; H168-Y172 AromaticContact CD2-CE2 3.88Å; H168-Y172 AromaticContact CE1-CD2 3.34Å; H168-Y172 WeakPolarHBondContact CE1-CD2 3.48Å; H168-Y172 AromaticContact CE1-CE2 3.34Å; H168-Y172 WeakPolarHBondContact CE1-CE2 3.34Å; H168-Y172 AromaticContact ND1-CD2 3.66Å; H168-Y172 AromaticContact NE2-CD2 3.7Å; H168-Y172 AromaticContact NE2-CE2 3.23Å; H168-Y172 WeakPolarHBondContact NE2-CE2 3.35Å; H168-Y172 WeakPolarHBondContact O-CD2 3.16Å; H168-Y172 PolarHBondContact O-N 2.79Å; H168-Y172 VanDerWaalsContact O-N 3.13Å; H168-F292 HydrophobicContact CB-CE2 4.41Å; H168-F292 HydrophobicContact CB-CZ 4.15Å
169	S	98.3	Very high	97.3	Very high	15 Å²	15	34.2 Å²	34.2	11%	0.105	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-46.8	177.9	-58.4	0	0	0	0	111.5	C165 M166 C167 H171 Y172 I173	C165-S169 WeakPolarHBondContact O-CB 3.27Å; C165-S169 PolarHBondContact O-N 3.47Å; C165-S169 PolarHBondContact O-OG 2.91Å; M166-S169 PolarHBondContact O-N 2.87Å; C167-S169 VanDerWaalsContact C-N 3.34Å; C167-S169 PolarHBondContact O-N 3.42Å; S169-H171 VanDerWaalsContact C-N 3.32Å; S169-H171 PolarHBondContact O-N 3.35Å; S169-Y172 PolarHBondContact O-N 3.45Å; S169-I173 VanDerWaalsContact O-CB 3.27Å; S169-I173 WeakPolarHBondContact O-CB 3.44Å; S169-I173 WeakPolarHBondContact O-CG1 3.45Å; S169-I173 PolarHBondContact O-N 3.42Å
170	F	98.5	Very high	97.2	Very high	97 Å²	97	31.7 Å²	31.7	43%	0.425	16%	0.161	S	C	.	.	H	α-helix	trans	-57.3	-45.2	176.8	173.7	-106	0	0	0	111.9	M166 C167 K174 F235 Q239	M166-F170 WeakPolarHBondContact O-CB 3.36Å; M166-F170 PolarHBondContact O-N 3.49Å; C167-F170 PolarHBondContact O-N 2.75Å; F170-K174 WeakPolarHBondContact O-CB 3.39Å; F170-K174 PolarHBondContact O-N 2.86Å; F170-F235 HydrophobicContact CD1-CE1 4.19Å; F170-Q239 HydrophobicContact CD1-CG 4.18Å; F170-Q239 HydrophobicContact CE1-CB 3.72Å; F170-Q239 HydrophobicContact CE1-CG 3.89Å
171	H	98.2	Very high	97	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-53.5	176.9	174.8	68	0	0	0	112.2	C167 H168 S169 K174 R175 F235 Q239 E285 W289	C167-H171 WeakPolarHBondContact O-CB 3.02Å; C167-H171 PolarHBondContact O-N 2.86Å; H168-H171 PolarHBondContact O-N 2.79Å; S169-H171 VanDerWaalsContact C-N 3.32Å; S169-H171 PolarHBondContact O-N 3.35Å; H171-K174 PolarHBondContact O-N 3.03Å; H171-R175 VanDerWaalsContact CE1-CD 3.44Å; H171-R175 WeakPolarHBondContact CE1-CD 3.15Å; H171-R175 WeakPolarHBondContact NE2-CD 3.17Å; H171-R175 WeakPolarHBondContact O-CG 3.19Å; H171-R175 PolarHBondContact O-N 3.34Å; H171-F235 HydrophobicContact CB-CZ 4.02Å; H171-Q239 PolarHBondContact ND1-NE2 3.07Å; H171-Q239 PolarHBondContact ND1-OE1 3.33Å; H171-E285 IonicContact CE1-OE1 3.43Å; H171-E285 PolarHBondContact CE1-OE1 3.1Å; H171-E285 IonicContact CE1-OE2 2.62Å; H171-E285 PolarHBondContact CE1-OE2 2.92Å; H171-E285 IonicContact NE2-OE1 3.29Å; H171-E285 PolarHBondContact NE2-OE1 3.27Å; H171-W289 AromaticContact CD2-CZ2 3.65Å; H171-W289 AromaticContact NE2-CZ2 3.66Å
172	Y	97.6	Very high	96.7	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-73	-36.6	-176.3	-79.5	-75.1	0	0	0	113	C129 P132 H168 S169 R175 V176 W289	C129-Y172 HydrophobicContact CB-CD1 4.03Å; C129-Y172 VanDerWaalsContact O-CD1 3.25Å; C129-Y172 WeakPolarHBondContact O-CD1 3.39Å; P132-Y172 HydrophobicContact CB-CD1 4.05Å; P132-Y172 HydrophobicContact CB-CD2 4.17Å; P132-Y172 HydrophobicContact CB-CE1 3.54Å; P132-Y172 HydrophobicContact CB-CE2 3.71Å; P132-Y172 HydrophobicContact CB-CG 4.33Å; P132-Y172 HydrophobicContact CG-CD1 4.44Å; P132-Y172 HydrophobicContact CG-CE1 3.72Å; H168-Y172 AromaticContact CD2-CE2 3.88Å; H168-Y172 AromaticContact CE1-CD2 3.34Å; H168-Y172 WeakPolarHBondContact CE1-CD2 3.48Å; H168-Y172 AromaticContact CE1-CE2 3.34Å; H168-Y172 WeakPolarHBondContact CE1-CE2 3.34Å; H168-Y172 AromaticContact ND1-CD2 3.66Å; H168-Y172 AromaticContact NE2-CD2 3.7Å; H168-Y172 AromaticContact NE2-CE2 3.23Å; H168-Y172 WeakPolarHBondContact NE2-CE2 3.35Å; H168-Y172 WeakPolarHBondContact O-CD2 3.16Å; H168-Y172 PolarHBondContact O-N 2.79Å; H168-Y172 VanDerWaalsContact O-N 3.13Å; S169-Y172 PolarHBondContact O-N 3.45Å; Y172-R175 PolarHBondContact O-N 3.46Å; Y172-V176 WeakPolarHBondContact O-CG2 3.32Å; Y172-V176 PolarHBondContact O-N 3.09Å; Y172-W289 HydrophobicContact CE2-CH2 4.17Å; Y172-W289 HydrophobicContact CE2-CZ2 4.42Å
173	I	98	Very high	96.3	Very high	89 Å²	89	40.4 Å²	40.4	46%	0.456	20%	0.2	S	C	.	.	H	α-helix	trans	-61.2	-48.1	173.1	-69.6	167.8	0	0	0	110	L133 S169 R175 V176 V177	L133-I173 HydrophobicContact CD1-CG1 4.26Å; L133-I173 HydrophobicContact CD2-CG1 3.73Å; S169-I173 VanDerWaalsContact O-CB 3.27Å; S169-I173 WeakPolarHBondContact O-CB 3.44Å; S169-I173 WeakPolarHBondContact O-CG1 3.45Å; S169-I173 PolarHBondContact O-N 3.42Å; I173-R175 VanDerWaalsContact C-N 3.3Å; I173-R175 PolarHBondContact O-N 2.97Å; I173-V176 PolarHBondContact O-N 3.3Å; I173-V177 HydrophobicContact CG2-CG2 4.42Å; I173-V177 WeakPolarHBondContact O-CG2 3.18Å; I173-V177 PolarHBondContact O-N 3.37Å
174	K	97.6	Very high	95.6	Very high	19 Å²	19	43.5 Å²	43.5	8%	0.083	21%	0.211	C	C	.	.	H	α-helix	trans	-54.6	-48.2	174	175.6	-161.7	146.2	-170.9	0	110.4	F170 H171 V176 V177 E178 Q239 N242	F170-K174 WeakPolarHBondContact O-CB 3.39Å; F170-K174 PolarHBondContact O-N 2.86Å; H171-K174 PolarHBondContact O-N 3.03Å; K174-V176 VanDerWaalsContact C-N 3.34Å; K174-V176 PolarHBondContact O-N 2.98Å; K174-V177 PolarHBondContact O-N 3.28Å; K174-E178 WeakPolarHBondContact CE-OE1 3.4Å; K174-E178 HydrophobicContact CG-CG 4.23Å; K174-E178 IonicContact NZ-OE1 2.92Å; K174-E178 WeakPolarHBondContact O-CB 3.39Å; K174-E178 VanDerWaalsContact O-CG 3.3Å; K174-E178 WeakPolarHBondContact O-CG 3.3Å; K174-E178 PolarHBondContact O-N 2.92Å; K174-Q239 PolarHBondContact NZ-O 3.23Å; K174-Q239 VanDerWaalsContact NZ-OE1 3.08Å; K174-N242 PolarHBondContact NZ-OD1 3.26Å
175	R	95.8	Very high	94.6	Very high	55 Å²	55	46 Å²	46	21%	0.208	22%	0.224	C	C	.	.	H	α-helix	trans	-62.3	-38.8	179.3	-75.5	-171.3	64.3	168.8	-2.7	113.1	C129 H171 Y172 I173 T179 E285	C129-R175 HydrophobicContact CB-CB 4.45Å; H171-R175 VanDerWaalsContact CE1-CD 3.44Å; H171-R175 WeakPolarHBondContact CE1-CD 3.15Å; H171-R175 WeakPolarHBondContact NE2-CD 3.17Å; H171-R175 WeakPolarHBondContact O-CG 3.19Å; H171-R175 PolarHBondContact O-N 3.34Å; Y172-R175 PolarHBondContact O-N 3.46Å; I173-R175 VanDerWaalsContact C-N 3.3Å; I173-R175 PolarHBondContact O-N 2.97Å; R175-T179 WeakPolarHBondContact O-CB 3.46Å; R175-T179 PolarHBondContact O-N 3.13Å; R175-T179 PolarHBondContact O-OG1 3.19Å; R175-E285 IonicContact NH1-OE1 3.37Å
176	V	96.2	Very high	93.1	Very high	26 Å²	26	49.7 Å²	49.7	16%	0.158	25%	0.25	C	C	.	.	H	α-helix	trans	-61.8	-50.7	174.1	169	0	0	0	0	110.2	L126 C129 V130 Y172 I173 K174 E178 T179 L180	L126-V176 HydrophobicContact CD2-CG1 4.04Å; C129-V176 HydrophobicContact CB-CG2 3.66Å; V130-V176 HydrophobicContact CG2-CG2 3.82Å; Y172-V176 WeakPolarHBondContact O-CG2 3.32Å; Y172-V176 PolarHBondContact O-N 3.09Å; I173-V176 PolarHBondContact O-N 3.3Å; K174-V176 VanDerWaalsContact C-N 3.34Å; K174-V176 PolarHBondContact O-N 2.98Å; V176-E178 PolarHBondContact O-N 2.74Å; V176-T179 WeakPolarHBondContact O-CB 3.43Å; V176-T179 PolarHBondContact O-N 3.39Å; V176-L180 HydrophobicContact CG1-CD1 4.09Å; V176-L180 WeakPolarHBondContact O-CG 3.26Å; V176-L180 PolarHBondContact O-N 2.88Å
177	V	96.8	Very high	91.5	Very high	69 Å²	69	50.8 Å²	50.8	42%	0.418	25%	0.253	S	S	.	.	H	α-helix	trans	-60.3	-45.2	178.3	171.3	0	0	0	0	111.2	I173 K174 T179 L180 F181	I173-V177 HydrophobicContact CG2-CG2 4.42Å; I173-V177 WeakPolarHBondContact O-CG2 3.18Å; I173-V177 PolarHBondContact O-N 3.37Å; K174-V177 PolarHBondContact O-N 3.28Å; V177-T179 VanDerWaalsContact C-N 3.33Å; V177-T179 PolarHBondContact O-N 3.45Å; V177-L180 PolarHBondContact O-N 3.43Å; V177-F181 HydrophobicContact CG1-CD2 3.88Å; V177-F181 HydrophobicContact CG1-CE2 4.5Å; V177-F181 VanDerWaalsContact O-CD2 3.25Å; V177-F181 WeakPolarHBondContact O-CD2 3.45Å; V177-F181 PolarHBondContact O-N 3.23Å
178	E	95.4	Very high	90.4	Very high	2 Å²	2	52 Å²	52	1%	0.009	27%	0.267	C	S	.	.	I	π-helix	trans	-61.8	-41.5	176.7	-75.3	-179.1	154	0	0	112.2	K174 V176 L180 V182 H183 F243 H246	K174-E178 WeakPolarHBondContact CE-OE1 3.4Å; K174-E178 HydrophobicContact CG-CG 4.23Å; K174-E178 IonicContact NZ-OE1 2.92Å; K174-E178 WeakPolarHBondContact O-CB 3.39Å; K174-E178 VanDerWaalsContact O-CG 3.3Å; K174-E178 WeakPolarHBondContact O-CG 3.3Å; K174-E178 PolarHBondContact O-N 2.92Å; V176-E178 PolarHBondContact O-N 2.74Å; E178-L180 VanDerWaalsContact C-N 3.29Å; E178-L180 PolarHBondContact O-N 3.37Å; E178-V182 HydrophobicContact CB-CB 4.19Å; E178-V182 HydrophobicContact CB-CG2 4.4Å; E178-V182 HydrophobicContact CG-CB 4.39Å; E178-V182 HydrophobicContact CG-CG2 4.23Å; E178-V182 CarbonylContact O-C 3.53Å; E178-V182 WeakPolarHBondContact O-CA 3.49Å; E178-V182 WeakPolarHBondContact O-CB 3.45Å; E178-V182 PolarHBondContact O-N 2.98Å; E178-H183 PolarHBondContact O-N 2.9Å; E178-H183 IonicContact OE2-NE2 3.81Å; E178-F243 HydrophobicContact CG-CD2 4.04Å; E178-F243 HydrophobicContact CG-CE2 4.31Å; E178-F243 WeakPolarHBondContact OE1-CA 3.43Å; E178-F243 WeakPolarHBondContact OE1-CD2 3.3Å; E178-H246 IonicContact OE1-CG 3.44Å; E178-H246 IonicContact OE1-ND1 2.65Å; E178-H246 PolarHBondContact OE1-ND1 2.86Å; E178-H246 IonicContact OE2-CE1 3.88Å; E178-H246 PolarHBondContact OE2-CE1 3.32Å; E178-H246 IonicContact OE2-CG 3.27Å; E178-H246 IonicContact OE2-ND1 3.78Å; E178-H246 PolarHBondContact OE2-ND1 2.83Å
179	T	93.2	Very high	89.7	Confident	11 Å²	11	54 Å²	54	7%	0.067	28%	0.279	C	S	.	.	I	π-helix	trans	-61.3	-40.4	177.3	-58.9	0	0	0	0	111.1	F125 L126 R175 V176 V177 I185	F125-T179 HydrophobicContact CB-CG2 3.74Å; L126-T179 HydrophobicContact CD2-CG2 3.91Å; L126-T179 HydrophobicContact CG-CG2 3.98Å; R175-T179 WeakPolarHBondContact O-CB 3.46Å; R175-T179 PolarHBondContact O-N 3.13Å; R175-T179 PolarHBondContact O-OG1 3.19Å; V176-T179 WeakPolarHBondContact O-CB 3.43Å; V176-T179 PolarHBondContact O-N 3.39Å; V177-T179 VanDerWaalsContact C-N 3.33Å; V177-T179 PolarHBondContact O-N 3.45Å; T179-I185 HydrophobicContact CG2-CD1 4.09Å
180	L	92.1	Very high	89.2	Confident	95 Å²	95	53.7 Å²	53.7	50%	0.497	28%	0.276	S	S	.	.	I	π-helix	trans	-74.9	-41.5	-179.6	-67	174.2	0	0	0	113.4	L126 V176 V177 E178	L126-L180 HydrophobicContact CD1-CD2 3.75Å; L126-L180 HydrophobicContact CD2-CD2 3.82Å; L126-L180 HydrophobicContact CD2-CG 3.89Å; L126-L180 HydrophobicContact CG-CD2 4.37Å; V176-L180 HydrophobicContact CG1-CD1 4.09Å; V176-L180 WeakPolarHBondContact O-CG 3.26Å; V176-L180 PolarHBondContact O-N 2.88Å; V177-L180 PolarHBondContact O-N 3.43Å; E178-L180 VanDerWaalsContact C-N 3.29Å; E178-L180 PolarHBondContact O-N 3.37Å
181	F	93.3	Very high	88.7	Confident	143 Å²	143	51.7 Å²	51.7	63%	0.627	27%	0.272	S	S	*	.	I	π-helix	trans	-118.9	-24.1	-164.6	-57.6	-68.8	0	0	0	114.8	V177	V177-F181 HydrophobicContact CG1-CD2 3.88Å; V177-F181 HydrophobicContact CG1-CE2 4.5Å; V177-F181 VanDerWaalsContact O-CD2 3.25Å; V177-F181 WeakPolarHBondContact O-CD2 3.45Å; V177-F181 PolarHBondContact O-N 3.23Å
182	V	92	Very high	88.2	Confident	14 Å²	14	54.9 Å²	54.9	9%	0.085	29%	0.289	C	S	.	.	I	π-helix	trans	-102.3	-48.5	-174.5	179	0	0	0	0	111.1	E178 R184 F243 H246 I247 R250	E178-V182 HydrophobicContact CB-CB 4.19Å; E178-V182 HydrophobicContact CB-CG2 4.4Å; E178-V182 HydrophobicContact CG-CB 4.39Å; E178-V182 HydrophobicContact CG-CG2 4.23Å; E178-V182 CarbonylContact O-C 3.53Å; E178-V182 WeakPolarHBondContact O-CA 3.49Å; E178-V182 WeakPolarHBondContact O-CB 3.45Å; E178-V182 PolarHBondContact O-N 2.98Å; V182-R184 PolarHBondContact O-N 3.48Å; V182-F243 HydrophobicContact CG2-CE2 4.32Å; V182-H246 HydrophobicContact CG1-CB 4.14Å; V182-I247 HydrophobicContact CG1-CD1 3.84Å; V182-I247 HydrophobicContact CG1-CG1 4.48Å; V182-I247 HydrophobicContact CG2-CD1 3.95Å; V182-R250 HydrophobicContact CG1-CB 4.23Å; V182-R250 WeakPolarHBondContact O-CB 3.38Å; V182-R250 WeakPolarHBondContact O-CD 3.34Å; V182-R250 WeakPolarHBondContact O-CG 3.23Å
183	H	89.5	Confident	87.7	Confident	63 Å²	63	65.3 Å²	65.3	29%	0.292	33%	0.328	S	S	.	.			trans	-72.7	126	-171.4	-70.8	-173	0	0	0	111.6	E178 I185 H246	E178-H183 PolarHBondContact O-N 2.9Å; E178-H183 IonicContact OE2-NE2 3.81Å; H183-I185 HydrophobicContact CB-CG1 3.98Å; H183-I185 PolarHBondContact O-N 3.33Å; H183-H246 AromaticContact NE2-CE1 3.85Å; H183-H246 AromaticContact NE2-CG 3.67Å; H183-H246 AromaticContact NE2-ND1 3.55Å
184	R	83.5	Confident	87.2	Confident	79 Å²	79	64.7 Å²	64.7	30%	0.298	33%	0.326	S	S	.	.			trans	-92.8	84.7	168.4	-65.9	-179.8	-177.3	-163.1	-4.4	108.8	V182 R250 K253 Q255	V182-R184 PolarHBondContact O-N 3.48Å; R184-R250 HydrophobicContact CG-CG 4.4Å; R184-K253 HydrophobicContact CB-CD 3.97Å; R184-K253 PolarHBondContact NH1-O 3.03Å; R184-K253 PolarHBondContact O-NZ 2.77Å; R184-Q255 VanDerWaalsContact NH1-CA 3.26Å
185	I	77.1	Confident	86.8	Confident	54 Å²	54	64.8 Å²	64.8	28%	0.277	33%	0.327	S	S	.	.			trans	-71.7	140.6	-177	-54.3	176.4	0	0	0	109.3	W121 G122 F125 T179 H183	W121-I185 HydrophobicContact CB-CG2 3.48Å; W121-I185 VanDerWaalsContact CB-CG2 3.48Å; G122-I185 VanDerWaalsContact CA-CD1 3.48Å; F125-I185 HydrophobicContact CD2-CD1 3.94Å; F125-I185 HydrophobicContact CE2-CD1 4.42Å; F125-I185 HydrophobicContact CE2-CG2 4.44Å; T179-I185 HydrophobicContact CG2-CD1 4.09Å; H183-I185 HydrophobicContact CB-CG1 3.98Å; H183-I185 PolarHBondContact O-N 3.33Å
186	S	66.9	Low	86.3	Confident	86 Å²	86	69.5 Å²	69.5	60%	0.601	35%	0.35	S	S	*	.			trans	-70.1	153.3	175.9	48.4	0	0	0	0	111.1	G188	S186-G188 PolarHBondContact O-N 3.4Å
187	H	64.9	Low	85.8	Confident	141 Å²	141	76.4 Å²	76.4	65%	0.653	38%	0.377	S	S	*	.	S	Bend	trans	-67.6	11.5	178.9	-64.5	-82.7	0	0	0	114.8
188	G	75.3	Confident	85.1	Confident	32 Å²	32	75.4 Å²	75.4	33%	0.33	37%	0.37	S	S	.	.			trans	-71	164	176.6	0	0	0	0	0	112	S186	S186-G188 PolarHBondContact O-N 3.4Å
189	T	84.5	Confident	84.8	Confident	41 Å²	41	75.8 Å²	75.8	25%	0.252	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	166.3	175.2	57.9	0	0	0	0	111	A80 Q118 L119	A80-T189 HydrophobicContact CB-CG2 3.8Å; Q118-T189 HydrophobicContact CB-CG2 4.4Å; L119-T189 CarbonylContact O-C 3.56Å; L119-T189 WeakPolarHBondContact O-CA 3.34Å; L119-T189 VanDerWaalsContact O-CB 3.23Å; L119-T189 WeakPolarHBondContact O-CB 3.4Å
190	M	86.6	Confident	84.6	Confident	10 Å²	10	76.7 Å²	76.7	5%	0.049	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	141.8	176.6	-173.6	176.4	75	0	0	109.8	Q118 L119 W121 V124 L192 N194 I195	Q118-M190 WeakPolarHBondContact CA-O 3.42Å; Q118-M190 PolarHBondContact OE1-O 2.9Å; L119-M190 PolarHBondContact N-O 3.41Å; L119-M190 PolarHBondContact O-N 2.99Å; W121-M190 HydrophobicContact CH2-CB 4.17Å; W121-M190 HydrophobicContact CH2-CG 4.22Å; W121-M190 HydrophobicContact CH2-SD 3.74Å; W121-M190 HydrophobicContact CZ2-CB 4.1Å; W121-M190 HydrophobicContact CZ2-CG 4.49Å; W121-M190 HydrophobicContact CZ3-CB 4.48Å; W121-M190 HydrophobicContact CZ3-SD 3.86Å; V124-M190 HydrophobicContact CB-CE 4.28Å; V124-M190 HydrophobicContact CG1-CE 3.58Å; V124-M190 HydrophobicContact CG1-SD 4.46Å; V124-M190 HydrophobicContact CG2-CB 4.4Å; V124-M190 HydrophobicContact CG2-CE 3.62Å; M190-L192 PolarHBondContact O-N 3.18Å; M190-N194 HydrophobicContact CE-CB 3.86Å; M190-N194 HydrophobicContact CG-CB 3.94Å; M190-N194 HydrophobicContact SD-CB 3.76Å; M190-I195 HydrophobicContact CE-CB 4.3Å
191	P	88.6	Confident	84.3	Confident	54 Å²	54	76 Å²	76	35%	0.351	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	134.1	173.5	-26	34.7	0	0	0	111.8	Q118 R193 N194	Q118-P191 VanDerWaalsContact OE1-N 3.15Å; P191-R193 PolarHBondContact O-N 2.86Å; P191-R193 VanDerWaalsContact O-N 3.14Å; P191-N194 WeakPolarHBondContact O-CB 3.23Å; P191-N194 PolarHBondContact O-N 3.45Å
192	L	87.7	Confident	84	Confident	68 Å²	68	70.8 Å²	70.8	36%	0.356	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-41	-175.8	176.1	62.7	0	0	0	112.6	P117 L119 M190 N194 I195	P117-L192 HydrophobicContact CB-CB 4.04Å; P117-L192 HydrophobicContact CB-CD2 4Å; P117-L192 WeakPolarHBondContact O-CB 3.44Å; P117-L192 PolarHBondContact O-N 3.4Å; L119-L192 HydrophobicContact CD1-CD1 3.41Å; L119-L192 VanDerWaalsContact CD1-CD1 3.41Å; L119-L192 HydrophobicContact CD2-CD1 4.2Å; L119-L192 HydrophobicContact CG-CD1 3.75Å; M190-L192 PolarHBondContact O-N 3.18Å; L192-N194 PolarHBondContact O-N 2.85Å; L192-N194 VanDerWaalsContact O-N 3.1Å; L192-I195 HydrophobicContact CD1-CG2 4.17Å; L192-I195 WeakPolarHBondContact O-CB 3.38Å; L192-I195 WeakPolarHBondContact O-CG2 3.33Å; L192-I195 PolarHBondContact O-N 2.66Å
193	R	86.9	Confident	84.2	Confident	220 Å²	220	74.9 Å²	74.9	83%	0.83	37%	0.366	S	S	*	.	H	α-helix	trans	-58.2	-28.7	-178.7	-64	-178.1	-179.6	-175.2	-0.9	113.4	P191 I195	P191-R193 PolarHBondContact O-N 2.86Å; P191-R193 VanDerWaalsContact O-N 3.14Å; R193-I195 VanDerWaalsContact C-N 3.26Å; R193-I195 PolarHBondContact O-N 3.31Å
194	N	87.4	Confident	84.4	Confident	76 Å²	76	76 Å²	76	41%	0.406	38%	0.38	S	S	.	.	H	α-helix	trans	-73.2	-19.6	-179.2	-67	-4	0	0	0	112.5	M190 P191 L192 F196 K197 N198	M190-N194 HydrophobicContact CE-CB 3.86Å; M190-N194 HydrophobicContact CG-CB 3.94Å; M190-N194 HydrophobicContact SD-CB 3.76Å; P191-N194 WeakPolarHBondContact O-CB 3.23Å; P191-N194 PolarHBondContact O-N 3.45Å; L192-N194 PolarHBondContact O-N 2.85Å; L192-N194 VanDerWaalsContact O-N 3.1Å; N194-F196 VanDerWaalsContact C-N 3.26Å; N194-F196 PolarHBondContact O-N 3.12Å; N194-K197 PolarHBondContact O-N 3.15Å; N194-N198 PolarHBondContact O-N 3.31Å
195	I	88.3	Confident	84.8	Confident	21 Å²	21	73.1 Å²	73.1	11%	0.108	37%	0.372	C	S	.	.	H	α-helix	trans	-62.3	-36.9	179.3	-160.1	166.7	0	0	0	111.5	L119 A127 M190 L192 R193 K197 N198 C199	L119-I195 HydrophobicContact CD1-CB 4.21Å; L119-I195 HydrophobicContact CD1-CD1 3.42Å; L119-I195 VanDerWaalsContact CD1-CD1 3.42Å; L119-I195 HydrophobicContact CD1-CG1 4.37Å; L119-I195 HydrophobicContact CD1-CG2 4.42Å; A127-I195 HydrophobicContact CB-CD1 3.97Å; M190-I195 HydrophobicContact CE-CB 4.3Å; L192-I195 HydrophobicContact CD1-CG2 4.17Å; L192-I195 WeakPolarHBondContact O-CB 3.38Å; L192-I195 WeakPolarHBondContact O-CG2 3.33Å; L192-I195 PolarHBondContact O-N 2.66Å; R193-I195 VanDerWaalsContact C-N 3.26Å; R193-I195 PolarHBondContact O-N 3.31Å; I195-K197 VanDerWaalsContact C-N 3.33Å; I195-K197 PolarHBondContact O-N 3.07Å; I195-N198 PolarHBondContact O-N 2.84Å; I195-C199 VanDerWaalsContact O-CB 3.22Å; I195-C199 WeakPolarHBondContact O-CB 3.47Å; I195-C199 PolarHBondContact O-N 2.91Å; I195-C199 PolarHBondContact O-SG 3.27Å
196	F	87	Confident	85.7	Confident	154 Å²	154	70.6 Å²	70.6	68%	0.675	36%	0.359	S	S	*	.	H	α-helix	trans	-65.4	-38.2	179.5	-63.8	-69.9	0	0	0	111.7	N194 G200	N194-F196 VanDerWaalsContact C-N 3.26Å; N194-F196 PolarHBondContact O-N 3.12Å; F196-G200 WeakPolarHBondContact O-CA 3.44Å; F196-G200 PolarHBondContact O-N 2.73Å
197	K	84.4	Confident	87.1	Confident	171 Å²	171	67.5 Å²	67.5	74%	0.743	34%	0.339	S	S	*	.	H	α-helix	trans	-67.2	-47.1	175.3	-175.1	179.1	177.4	179.1	0	111.2	N194 I195 Y201	N194-K197 PolarHBondContact O-N 3.15Å; I195-K197 VanDerWaalsContact C-N 3.33Å; I195-K197 PolarHBondContact O-N 3.07Å; K197-Y201 PolarHBondContact O-N 3.37Å
198	N	83.4	Confident	88.6	Confident	49 Å²	49	66 Å²	66	26%	0.262	33%	0.327	S	S	.	.	H	α-helix	trans	-64.2	-54.4	179.9	-79.3	17.3	0	0	0	111.7	E128 N194 I195 Y201 Y202	E128-N198 HydrophobicContact CG-CB 4.38Å; E128-N198 VanDerWaalsContact OE1-CB 3.3Å; E128-N198 WeakPolarHBondContact OE1-CB 3.31Å; E128-N198 PolarHBondContact OE1-ND2 3.36Å; N194-N198 PolarHBondContact O-N 3.31Å; I195-N198 PolarHBondContact O-N 2.84Å; N198-Y201 PolarHBondContact O-N 2.88Å; N198-Y202 WeakPolarHBondContact O-CD2 3.41Å
199	C	88.9	Confident	89.7	Confident	10 Å²	10	64.5 Å²	64.5	7%	0.068	31%	0.312	C	S	.	.	H	α-helix	trans	-64.8	-43.5	-179.3	-69.4	0	0	0	0	111.1	I195 Y201 Y202 W203	I195-C199 VanDerWaalsContact O-CB 3.22Å; I195-C199 WeakPolarHBondContact O-CB 3.47Å; I195-C199 PolarHBondContact O-N 2.91Å; I195-C199 PolarHBondContact O-SG 3.27Å; C199-Y201 VanDerWaalsContact C-N 3.27Å; C199-Y201 PolarHBondContact O-N 2.85Å; C199-Y202 PolarHBondContact O-N 3.45Å; C199-Y202 VanDerWaalsContact O-N 3.12Å; C199-W203 HydrophobicContact CB-CD2 4.33Å; C199-W203 HydrophobicContact CB-CG 4.36Å; C199-W203 HydrophobicContact CB-CZ2 4.39Å; C199-W203 WeakPolarHBondContact O-CB 3.38Å; C199-W203 PolarHBondContact O-N 3.01Å
200	G	88.4	Confident	90.3	Very high	30 Å²	30	62.5 Å²	62.5	31%	0.309	30%	0.3	S	S	.	.	H	α-helix	trans	-53.3	-43.3	179.7	0	0	0	0	0	112.8	F196 C204	F196-G200 WeakPolarHBondContact O-CA 3.44Å; F196-G200 PolarHBondContact O-N 2.73Å; G200-C204 WeakPolarHBondContact O-CB 3.1Å; G200-C204 PolarHBondContact O-N 3.43Å; G200-C204 PolarHBondContact O-SG 3.39Å
201	Y	85.5	Confident	90.8	Very high	80 Å²	80	66 Å²	66	31%	0.314	31%	0.313	S	S	.	.	H	α-helix	trans	-60	-52.8	176.1	170.8	-101.3	0	0	0	112.8	K197 N198 C199 S205 F304 V307	K197-Y201 PolarHBondContact O-N 3.37Å; N198-Y201 PolarHBondContact O-N 2.88Å; C199-Y201 VanDerWaalsContact C-N 3.27Å; C199-Y201 PolarHBondContact O-N 2.85Å; Y201-S205 VanDerWaalsContact O-CB 3.22Å; Y201-S205 WeakPolarHBondContact O-CB 3.32Å; Y201-S205 PolarHBondContact O-N 2.83Å; Y201-S205 VanDerWaalsContact O-N 3.1Å; Y201-S205 PolarHBondContact O-OG 3.5Å; Y201-F304 HydrophobicContact CE1-CE2 4.29Å; Y201-V307 HydrophobicContact CE2-CG1 3.99Å; Y201-V307 WeakPolarHBondContact OH-CG1 3.19Å
202	Y	87.7	Confident	91.2	Very high	33 Å²	33	68.9 Å²	68.9	13%	0.129	32%	0.318	C	S	.	.	H	α-helix	trans	-68	-41.5	-177.7	-71	-68.1	0	0	0	112.2	E128 N198 C199 A206	E128-Y202 HydrophobicContact CB-CD2 4.25Å; E128-Y202 HydrophobicContact CG-CD2 4.06Å; E128-Y202 HydrophobicContact CG-CE2 4.28Å; N198-Y202 WeakPolarHBondContact O-CD2 3.41Å; C199-Y202 PolarHBondContact O-N 3.45Å; C199-Y202 VanDerWaalsContact O-N 3.12Å; Y202-A206 VanDerWaalsContact O-CB 3.26Å; Y202-A206 WeakPolarHBondContact O-CB 3.37Å; Y202-A206 PolarHBondContact O-N 2.88Å
203	W	95	Very high	91.7	Very high	100 Å²	100	65.7 Å²	65.7	38%	0.379	30%	0.301	S	S	.	.	H	α-helix	trans	-69.1	-46.9	-176.7	-69.8	31.5	0	0	0	110.9	A127 G131 L135 C199 S205 A206 A207	A127-W203 PolarHBondContact O-NE1 3.4Å; G131-W203 VanDerWaalsContact CA-CE2 3.45Å; L135-W203 HydrophobicContact CD1-CB 3.56Å; L135-W203 HydrophobicContact CD1-CD2 4.15Å; L135-W203 HydrophobicContact CD1-CE3 4.01Å; L135-W203 HydrophobicContact CD1-CG 4Å; C199-W203 HydrophobicContact CB-CD2 4.33Å; C199-W203 HydrophobicContact CB-CG 4.36Å; C199-W203 HydrophobicContact CB-CZ2 4.39Å; C199-W203 WeakPolarHBondContact O-CB 3.38Å; C199-W203 PolarHBondContact O-N 3.01Å; W203-S205 VanDerWaalsContact C-N 3.34Å; W203-S205 PolarHBondContact O-N 3.48Å; W203-A206 PolarHBondContact O-N 3.42Å; W203-A207 WeakPolarHBondContact O-CB 3.41Å; W203-A207 PolarHBondContact O-N 3.4Å
204	C	94.4	Very high	92.2	Very high	88 Å²	88	55.3 Å²	55.3	60%	0.595	26%	0.262	S	S	*	.	H	α-helix	trans	-65.9	-38.6	177.2	-68.3	0	0	0	0	111.7	G200 A207 W208	G200-C204 WeakPolarHBondContact O-CB 3.1Å; G200-C204 PolarHBondContact O-N 3.43Å; G200-C204 PolarHBondContact O-SG 3.39Å; C204-A207 PolarHBondContact O-N 3.34Å; C204-W208 VanDerWaalsContact O-CB 3.32Å; C204-W208 WeakPolarHBondContact O-CB 3.2Å; C204-W208 PolarHBondContact O-N 3.01Å
205	S	92.3	Very high	92.6	Very high	18 Å²	18	53.7 Å²	53.7	13%	0.126	25%	0.252	C	S	.	.	H	α-helix	trans	-65.3	-42	176.5	-64.8	0	0	0	0	111.7	Y201 W203 W208 M209	Y201-S205 VanDerWaalsContact O-CB 3.22Å; Y201-S205 WeakPolarHBondContact O-CB 3.32Å; Y201-S205 PolarHBondContact O-N 2.83Å; Y201-S205 VanDerWaalsContact O-N 3.1Å; Y201-S205 PolarHBondContact O-OG 3.5Å; W203-S205 VanDerWaalsContact C-N 3.34Å; W203-S205 PolarHBondContact O-N 3.48Å; S205-W208 PolarHBondContact O-N 3.41Å; S205-M209 WeakPolarHBondContact O-CE 3.26Å; S205-M209 WeakPolarHBondContact O-CG 3.3Å; S205-M209 PolarHBondContact O-N 2.79Å
206	A	95.5	Very high	93	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-45.1	174.5	0	0	0	0	0	111.9	P132 Y202 W203 W208 M209 A210	P132-A206 HydrophobicContact CB-CB 3.61Å; P132-A206 HydrophobicContact CG-CB 4.26Å; Y202-A206 VanDerWaalsContact O-CB 3.26Å; Y202-A206 WeakPolarHBondContact O-CB 3.37Å; Y202-A206 PolarHBondContact O-N 2.88Å; W203-A206 PolarHBondContact O-N 3.42Å; A206-W208 VanDerWaalsContact C-N 3.35Å; A206-W208 PolarHBondContact O-N 3.5Å; A206-M209 WeakPolarHBondContact O-CG 3.36Å; A206-A210 WeakPolarHBondContact O-CB 3.32Å; A206-A210 PolarHBondContact O-N 3.28Å
207	A	96.8	Very high	93.3	Very high	22 Å²	22	52.9 Å²	52.9	18%	0.182	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-44	175.1	0	0	0	0	0	111.7	F139 W203 C204 A210 Y211	F139-A207 HydrophobicContact CE2-CB 3.63Å; F139-A207 HydrophobicContact CZ-CB 3.94Å; W203-A207 WeakPolarHBondContact O-CB 3.41Å; W203-A207 PolarHBondContact O-N 3.4Å; C204-A207 PolarHBondContact O-N 3.34Å; A207-A210 PolarHBondContact O-N 3.15Å; A207-Y211 VanDerWaalsContact O-CB 3.32Å; A207-Y211 WeakPolarHBondContact O-CB 3.19Å; A207-Y211 PolarHBondContact O-N 3.43Å
208	W	96.9	Very high	93.9	Very high	109 Å²	109	45.9 Å²	45.9	41%	0.413	23%	0.225	S	C	.	.	H	α-helix	trans	-63.5	-48	180	-173.5	30.6	0	0	0	111.9	C204 S205 A206 Y212 P300 F303	C204-W208 VanDerWaalsContact O-CB 3.32Å; C204-W208 WeakPolarHBondContact O-CB 3.2Å; C204-W208 PolarHBondContact O-N 3.01Å; S205-W208 PolarHBondContact O-N 3.41Å; A206-W208 VanDerWaalsContact C-N 3.35Å; A206-W208 PolarHBondContact O-N 3.5Å; W208-Y212 AromaticContact CD1-CD2 3.82Å; W208-Y212 AromaticContact CD1-CE2 3.53Å; W208-Y212 AromaticContact NE1-CD2 3.89Å; W208-Y212 AromaticContact NE1-CE2 3.3Å; W208-Y212 VanDerWaalsContact NE1-CE2 3.3Å; W208-Y212 WeakPolarHBondContact O-CD2 3.47Å; W208-P300 HydrophobicContact CD2-CB 3.86Å; W208-P300 HydrophobicContact CD2-CG 4.21Å; W208-P300 HydrophobicContact CE3-CB 4.19Å; W208-P300 HydrophobicContact CG-CB 4.18Å; W208-P300 HydrophobicContact CG-CG 4.45Å; W208-P300 HydrophobicContact CZ2-CB 4.39Å; W208-P300 HydrophobicContact CZ2-CG 4.17Å; W208-F303 HydrophobicContact CH2-CD1 4.17Å; W208-F303 HydrophobicContact CH2-CG 4.28Å; W208-F303 HydrophobicContact CZ3-CB 4.38Å; W208-F303 AromaticContact CZ3-CD1 3.52Å; W208-F303 HydrophobicContact CZ3-CD1 3.52Å; W208-F303 AromaticContact CZ3-CE1 3.98Å; W208-F303 HydrophobicContact CZ3-CE1 3.98Å; W208-F303 HydrophobicContact CZ3-CG 4.05Å
209	M	96.6	Very high	94.4	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-41.3	175.7	68	-178.9	74.7	0	0	112.4	S205 A206 Y211 Y212 I213 W289 P300 V301 F304	S205-M209 WeakPolarHBondContact O-CE 3.26Å; S205-M209 WeakPolarHBondContact O-CG 3.3Å; S205-M209 PolarHBondContact O-N 2.79Å; A206-M209 WeakPolarHBondContact O-CG 3.36Å; M209-Y211 VanDerWaalsContact C-N 3.32Å; M209-Y211 PolarHBondContact O-N 2.82Å; M209-Y212 PolarHBondContact O-N 3.42Å; M209-I213 HydrophobicContact CB-CD1 4.4Å; M209-I213 WeakPolarHBondContact O-CD1 3.2Å; M209-I213 VanDerWaalsContact O-CG1 3.29Å; M209-I213 WeakPolarHBondContact O-CG1 3.45Å; M209-I213 PolarHBondContact O-N 3.37Å; M209-W289 HydrophobicContact CE-CZ3 4.42Å; M209-W289 HydrophobicContact SD-CZ3 4.18Å; M209-P300 HydrophobicContact CB-CB 4.31Å; M209-V301 HydrophobicContact CB-CG2 3.88Å; M209-F304 HydrophobicContact CE-CB 4.01Å; M209-F304 HydrophobicContact CE-CD1 3.81Å; M209-F304 HydrophobicContact CE-CD2 4.12Å; M209-F304 HydrophobicContact CE-CE1 4.33Å; M209-F304 HydrophobicContact CE-CG 3.69Å
210	A	97.5	Very high	94.7	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.9	-37.6	-178.3	0	0	0	0	0	111.5	Y136 F139 A206 A207 Y212 N214	Y136-A210 HydrophobicContact CD2-CB 3.47Å; Y136-A210 VanDerWaalsContact CD2-CB 3.47Å; Y136-A210 HydrophobicContact CE2-CB 3.88Å; Y136-A210 HydrophobicContact CG-CB 3.88Å; F139-A210 HydrophobicContact CB-CB 3.71Å; F139-A210 HydrophobicContact CD2-CB 3.66Å; F139-A210 HydrophobicContact CG-CB 3.8Å; A206-A210 WeakPolarHBondContact O-CB 3.32Å; A206-A210 PolarHBondContact O-N 3.28Å; A207-A210 PolarHBondContact O-N 3.15Å; A210-Y212 VanDerWaalsContact C-N 3.35Å; A210-Y212 PolarHBondContact O-N 3.18Å; A210-N214 VanDerWaalsContact O-CB 3.31Å; A210-N214 WeakPolarHBondContact O-CB 3.36Å; A210-N214 PolarHBondContact O-N 2.97Å; A210-N214 PolarHBondContact O-ND2 3.05Å
211	Y	97.4	Very high	95.1	Very high	82 Å²	82	50.9 Å²	50.9	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-55.8	-49.1	175.9	177.2	-95.3	0	0	0	111.6	F139 Y147 A207 M209 H215	F139-Y211 HydrophobicContact CD1-CD2 4.27Å; F139-Y211 AromaticContact CE1-CD2 3.92Å; F139-Y211 HydrophobicContact CE1-CD2 3.92Å; F139-Y211 HydrophobicContact CE1-CG 4.39Å; Y147-Y211 HydrophobicContact CD1-CD2 4.4Å; Y147-Y211 AromaticContact CD1-CE2 3.9Å; Y147-Y211 HydrophobicContact CD1-CE2 3.9Å; Y147-Y211 AromaticContact CE1-CD2 3.61Å; Y147-Y211 HydrophobicContact CE1-CD2 3.61Å; Y147-Y211 AromaticContact CE1-CE2 3.5Å; Y147-Y211 HydrophobicContact CE1-CE2 3.5Å; Y147-Y211 HydrophobicContact CE1-CG 4.39Å; Y147-Y211 WeakPolarHBondContact OH-CA 3.37Å; Y147-Y211 PolarHBondContact OH-O 3.26Å; A207-Y211 VanDerWaalsContact O-CB 3.32Å; A207-Y211 WeakPolarHBondContact O-CB 3.19Å; A207-Y211 PolarHBondContact O-N 3.43Å; M209-Y211 VanDerWaalsContact C-N 3.32Å; M209-Y211 PolarHBondContact O-N 2.82Å; Y211-H215 AromaticContact CE1-CD2 3.94Å; Y211-H215 AromaticContact CZ-CD2 3.73Å; Y211-H215 WeakPolarHBondContact O-CB 3.34Å; Y211-H215 PolarHBondContact O-N 3.24Å; Y211-H215 VanDerWaalsContact O-N 3.15Å
212	Y	97.1	Very high	95.6	Very high	116 Å²	116	54 Å²	54	46%	0.455	27%	0.268	S	S	.	.	H	α-helix	trans	-75.3	-41.6	-177.5	-78.8	-86.3	0	0	0	113	W208 M209 A210 N214 H215 Y218 P300	W208-Y212 AromaticContact CD1-CD2 3.82Å; W208-Y212 AromaticContact CD1-CE2 3.53Å; W208-Y212 AromaticContact NE1-CD2 3.89Å; W208-Y212 AromaticContact NE1-CE2 3.3Å; W208-Y212 VanDerWaalsContact NE1-CE2 3.3Å; W208-Y212 WeakPolarHBondContact O-CD2 3.47Å; M209-Y212 PolarHBondContact O-N 3.42Å; A210-Y212 VanDerWaalsContact C-N 3.35Å; A210-Y212 PolarHBondContact O-N 3.18Å; Y212-N214 VanDerWaalsContact C-N 3.34Å; Y212-N214 PolarHBondContact O-N 3.14Å; Y212-H215 PolarHBondContact O-N 3.49Å; Y212-Y218 WeakPolarHBondContact O-CD2 3.19Å; Y212-P300 HydrophobicContact CD2-CG 3.58Å; Y212-P300 HydrophobicContact CE2-CG 4.12Å; Y212-P300 HydrophobicContact CG-CG 4.01Å
213	I	97.6	Very high	96	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.6	-40.2	-179.7	-66.1	165	0	0	0	111.2	Y136 V161 A164 M209 Y218 F292 T296 C298 V301	Y136-I213 HydrophobicContact CE2-CD1 4.32Å; Y136-I213 WeakPolarHBondContact OH-CG2 3.25Å; V161-I213 HydrophobicContact CG1-CG2 4.46Å; V161-I213 WeakPolarHBondContact CG2-O 3.39Å; A164-I213 HydrophobicContact CB-CG2 3.78Å; M209-I213 HydrophobicContact CB-CD1 4.4Å; M209-I213 WeakPolarHBondContact O-CD1 3.2Å; M209-I213 VanDerWaalsContact O-CG1 3.29Å; M209-I213 WeakPolarHBondContact O-CG1 3.45Å; M209-I213 PolarHBondContact O-N 3.37Å; I213-Y218 WeakPolarHBondContact O-CD2 3.47Å; I213-F292 HydrophobicContact CD1-CE1 3.96Å; I213-F292 HydrophobicContact CD1-CZ 4.18Å; I213-T296 HydrophobicContact CD1-CG2 4.04Å; I213-T296 HydrophobicContact CG1-CG2 4.39Å; I213-C298 HydrophobicContact CG1-CB 4.21Å; I213-V301 HydrophobicContact CD1-CG2 3.8Å; I213-V301 HydrophobicContact CG1-CG2 4.49Å
214	N	97.8	Very high	96	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.011	29%	0.293	C	S	.	.	H	α-helix	trans	-93.2	-2	-175.2	-59.9	-72.8	0	0	0	113.4	F139 Y140 R142 V161 A210 Y212	F139-N214 HydrophobicContact CB-CB 4.43Å; Y140-N214 WeakPolarHBondContact CD2-OD1 3.35Å; R142-N214 PolarHBondContact NE-O 3.25Å; R142-N214 VanDerWaalsContact NE-O 3.08Å; R142-N214 PolarHBondContact NH2-O 3.04Å; V161-N214 VanDerWaalsContact CG1-OD1 3.26Å; V161-N214 WeakPolarHBondContact CG1-OD1 3.48Å; A210-N214 VanDerWaalsContact O-CB 3.31Å; A210-N214 WeakPolarHBondContact O-CB 3.36Å; A210-N214 PolarHBondContact O-N 2.97Å; A210-N214 PolarHBondContact O-ND2 3.05Å; Y212-N214 VanDerWaalsContact C-N 3.34Å; Y212-N214 PolarHBondContact O-N 3.14Å
215	H	96.8	Very high	96.1	Very high	43 Å²	43	58 Å²	58	20%	0.199	29%	0.286	C	S	.	.			trans	-55.4	139.9	-177.6	-163.6	-90.4	0	0	0	111	Y147 Y211 Y212 L217 Y218	Y147-H215 AromaticContact CD1-CD2 3.69Å; Y147-H215 HydrophobicContact CE1-CB 4.22Å; Y147-H215 AromaticContact CE1-CD2 3.44Å; Y147-H215 VanDerWaalsContact CE1-CD2 3.44Å; Y147-H215 WeakPolarHBondContact CE1-CD2 3.41Å; Y147-H215 PolarHBondContact OH-N 2.6Å; Y211-H215 AromaticContact CE1-CD2 3.94Å; Y211-H215 AromaticContact CZ-CD2 3.73Å; Y211-H215 WeakPolarHBondContact O-CB 3.34Å; Y211-H215 PolarHBondContact O-N 3.24Å; Y211-H215 VanDerWaalsContact O-N 3.15Å; Y212-H215 PolarHBondContact O-N 3.49Å; H215-L217 WeakPolarHBondContact ND1-CB 3.36Å; H215-L217 PolarHBondContact ND1-N 3.02Å; H215-L217 PolarHBondContact O-N 3.04Å; H215-Y218 VanDerWaalsContact O-CB 3.22Å; H215-Y218 WeakPolarHBondContact O-CB 3.25Å; H215-Y218 PolarHBondContact O-N 3.5Å
216	P	95.3	Very high	96.3	Very high	31 Å²	31	65 Å²	65	20%	0.201	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.2	177.1	-27.2	35.1	0	0	0	115.2	Y147 Y151	Y147-P216 HydrophobicContact CG-CG 4.22Å; Y151-P216 HydrophobicContact CD1-CB 3.66Å; Y151-P216 HydrophobicContact CD1-CG 3.84Å; Y151-P216 HydrophobicContact CD2-CB 3.81Å; Y151-P216 HydrophobicContact CD2-CG 3.47Å; Y151-P216 VanDerWaalsContact CD2-CG 3.47Å; Y151-P216 HydrophobicContact CE1-CB 3.62Å; Y151-P216 HydrophobicContact CE1-CG 4.25Å; Y151-P216 HydrophobicContact CE2-CB 3.74Å; Y151-P216 HydrophobicContact CE2-CG 3.89Å; Y151-P216 HydrophobicContact CG-CB 3.76Å; Y151-P216 HydrophobicContact CG-CG 3.41Å; Y151-P216 VanDerWaalsContact CG-CG 3.41Å
217	L	94.8	Very high	96.4	Very high	126 Å²	126	66.2 Å²	66.2	66%	0.66	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	16.4	177.4	-52	178.4	0	0	0	113.1	H215 T219	H215-L217 WeakPolarHBondContact ND1-CB 3.36Å; H215-L217 PolarHBondContact ND1-N 3.02Å; H215-L217 PolarHBondContact O-N 3.04Å; L217-T219 PolarHBondContact O-N 3.09Å
218	Y	95.6	Very high	96.4	Very high	25 Å²	25	65.3 Å²	65.3	10%	0.098	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-60	130.2	177.5	175.9	-94.9	0	0	0	110.8	H158 V160 V161 Y212 I213 H215 T296	H158-Y218 PolarHBondContact NE2-O 3.41Å; V160-Y218 HydrophobicContact CG1-CE1 3.53Å; V161-Y218 HydrophobicContact CG2-CD1 3.6Å; V161-Y218 HydrophobicContact CG2-CE1 3.85Å; V161-Y218 HydrophobicContact CG2-CG 4.18Å; Y212-Y218 WeakPolarHBondContact O-CD2 3.19Å; I213-Y218 WeakPolarHBondContact O-CD2 3.47Å; H215-Y218 VanDerWaalsContact O-CB 3.22Å; H215-Y218 WeakPolarHBondContact O-CB 3.25Å; H215-Y218 PolarHBondContact O-N 3.5Å; Y218-T296 PolarHBondContact OH-O 2.98Å
219	T	94.8	Very high	96.5	Very high	115 Å²	115	63 Å²	63	71%	0.706	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-100.7	136.7	174.4	54.7	0	0	0	0	110.1	L217	L217-T219 PolarHBondContact O-N 3.09Å
220	T	94.8	Very high	96.6	Very high	73 Å²	73	65.2 Å²	65.2	45%	0.448	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-62.6	155.1	177.8	51.3	0	0	0	0	112.4	H158 V160	H158-T220 HydrophobicContact CB-CG2 4.01Å; H158-T220 VanDerWaalsContact ND1-CG2 3.34Å; H158-T220 WeakPolarHBondContact ND1-CG2 3.47Å; V160-T220 HydrophobicContact CG1-CG2 4.29Å
221	P	96.3	Very high	96.6	Very high	6 Å²	6	65.2 Å²	65.2	4%	0.039	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-53.1	145.4	175.5	-27	35.3	0	0	0	113.5	V160 Y223 G224 Q227 V228 M295 Q297	V160-P221 HydrophobicContact CG2-CG 4.28Å; P221-Y223 PolarHBondContact O-N 3.3Å; P221-G224 PolarHBondContact O-N 3.4Å; P221-Q227 HydrophobicContact CB-CG 4.4Å; P221-V228 HydrophobicContact CB-CG2 4.45Å; P221-V228 HydrophobicContact CG-CG2 3.87Å; P221-M295 WeakPolarHBondContact CG-O 3.5Å; P221-Q297 HydrophobicContact CB-CB 3.98Å; P221-Q297 HydrophobicContact CG-CB 4.24Å
222	H	95.8	Very high	96.7	Very high	144 Å²	144	62.9 Å²	62.9	67%	0.667	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-38.2	-169.8	-179.7	75.6	0	0	0	112.8	G224	H222-G224 PolarHBondContact O-N 3.21Å
223	Y	95.9	Very high	96.7	Very high	178 Å²	178	65.1 Å²	65.1	70%	0.698	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	15.2	179.9	-53.9	-79.5	0	0	0	113	P221 Q227	P221-Y223 PolarHBondContact O-N 3.3Å; Y223-Q227 VanDerWaalsContact CB-OE1 3.28Å; Y223-Q227 VanDerWaalsContact CD2-OE1 3.3Å
224	G	95.4	Very high	96.8	Very high	32 Å²	32	68.5 Å²	68.5	33%	0.33	35%	0.347	S	S	.	.	H	α-helix	trans	63.6	-150.6	170.4	0	0	0	0	0	114.9	P221 H222 Q226 Q227 V228	P221-G224 PolarHBondContact O-N 3.4Å; H222-G224 PolarHBondContact O-N 3.21Å; G224-Q226 VanDerWaalsContact C-N 3.3Å; G224-Q226 PolarHBondContact O-N 2.91Å; G224-Q227 PolarHBondContact O-N 3.26Å; G224-V228 PolarHBondContact O-N 3.01Å
225	Q	96.3	Very high	96.8	Very high	96 Å²	96	68.5 Å²	68.5	45%	0.449	35%	0.347	S	S	.	.	H	α-helix	trans	-66	-29.1	-168.6	-167.4	60.6	47.4	0	0	113.7	V228 N229	Q225-V228 PolarHBondContact O-N 3.3Å; Q225-N229 PolarHBondContact NE2-OD1 3.02Å; Q225-N229 WeakPolarHBondContact O-CB 3.5Å; Q225-N229 VanDerWaalsContact O-CG 3.22Å; Q225-N229 PolarHBondContact O-N 3.04Å
226	Q	96.8	Very high	96.9	Very high	166 Å²	166	69.9 Å²	69.9	78%	0.776	36%	0.356	S	S	*	.	H	α-helix	trans	-64	-44	178.5	-68.4	-175.9	-2.9	0	0	111.3	G224 N229 A230	G224-Q226 VanDerWaalsContact C-N 3.3Å; G224-Q226 PolarHBondContact O-N 2.91Å; Q226-N229 PolarHBondContact O-N 2.9Å; Q226-A230 WeakPolarHBondContact O-CB 3.14Å; Q226-A230 PolarHBondContact O-N 3.45Å
227	Q	97.8	Very high	97.1	Very high	24 Å²	24	74 Å²	74	11%	0.112	37%	0.371	C	S	.	.	H	α-helix	trans	-62.4	-44.1	174.2	171.1	-175.1	-2	0	0	111.9	P221 Y223 G224 N229 A230 G231 V294	P221-Q227 HydrophobicContact CB-CG 4.4Å; Y223-Q227 VanDerWaalsContact CB-OE1 3.28Å; Y223-Q227 VanDerWaalsContact CD2-OE1 3.3Å; G224-Q227 PolarHBondContact O-N 3.26Å; Q227-N229 PolarHBondContact O-N 3.07Å; Q227-A230 PolarHBondContact O-N 3.44Å; Q227-G231 PolarHBondContact O-N 3.26Å; Q227-V294 HydrophobicContact CG-CG1 3.87Å; Q227-V294 WeakPolarHBondContact CG-O 3.46Å; Q227-V294 PolarHBondContact NE2-O 2.84Å
228	V	98.1	Very high	97.3	Very high	4 Å²	4	68.6 Å²	68.6	2%	0.024	34%	0.343	C	S	.	.	H	α-helix	trans	-59.2	-48.6	177.4	175.1	0	0	0	0	110.6	V160 L163 P221 G224 Q225 G231 L232 M295	V160-V228 HydrophobicContact CB-CG1 4.38Å; V160-V228 HydrophobicContact CB-CG2 4.23Å; V160-V228 HydrophobicContact CG2-CG1 4.13Å; V160-V228 HydrophobicContact CG2-CG2 3.92Å; L163-V228 HydrophobicContact CD1-CG1 3.73Å; P221-V228 HydrophobicContact CB-CG2 4.45Å; P221-V228 HydrophobicContact CG-CG2 3.87Å; G224-V228 PolarHBondContact O-N 3.01Å; Q225-V228 PolarHBondContact O-N 3.3Å; V228-G231 PolarHBondContact O-N 3.47Å; V228-L232 WeakPolarHBondContact O-CB 3.14Å; V228-L232 PolarHBondContact O-N 3.24Å; V228-M295 HydrophobicContact CG1-CG 4Å
229	N	98	Very high	97.4	Very high	61 Å²	61	67.5 Å²	67.5	33%	0.326	34%	0.339	S	S	.	.	H	α-helix	trans	-64.9	-44.1	179.9	-70.9	-8.2	0	0	0	111.8	Q225 Q226 Q227 G231 L232 Y233	Q225-N229 PolarHBondContact NE2-OD1 3.02Å; Q225-N229 WeakPolarHBondContact O-CB 3.5Å; Q225-N229 VanDerWaalsContact O-CG 3.22Å; Q225-N229 PolarHBondContact O-N 3.04Å; Q226-N229 PolarHBondContact O-N 2.9Å; Q227-N229 PolarHBondContact O-N 3.07Å; N229-G231 PolarHBondContact O-N 3.28Å; N229-L232 PolarHBondContact O-N 2.83Å; N229-Y233 HydrophobicContact CB-CE2 4.19Å; N229-Y233 WeakPolarHBondContact O-CD2 3.26Å; N229-Y233 PolarHBondContact O-N 2.87Å
230	A	98.3	Very high	97.6	Very high	45 Å²	45	65.4 Å²	65.4	37%	0.372	33%	0.326	S	S	.	.	H	α-helix	trans	-60	-46.8	176.9	0	0	0	0	0	111.6	Q226 Q227 L232 Y233 I234	Q226-A230 WeakPolarHBondContact O-CB 3.14Å; Q226-A230 PolarHBondContact O-N 3.45Å; Q227-A230 PolarHBondContact O-N 3.44Å; A230-L232 VanDerWaalsContact C-N 3.34Å; A230-L232 PolarHBondContact O-N 3.47Å; A230-Y233 PolarHBondContact O-N 2.91Å; A230-I234 VanDerWaalsContact O-CG1 3.3Å; A230-I234 WeakPolarHBondContact O-CG1 3.37Å; A230-I234 PolarHBondContact O-N 3.37Å
231	G	98.5	Very high	97.7	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.7	-40.9	175.7	0	0	0	0	0	112.8	Q227 V228 N229 I234 F235 G291	Q227-G231 PolarHBondContact O-N 3.26Å; V228-G231 PolarHBondContact O-N 3.47Å; N229-G231 PolarHBondContact O-N 3.28Å; G231-I234 PolarHBondContact O-N 3.38Å; G231-F235 VanDerWaalsContact O-CB 3.31Å; G231-F235 WeakPolarHBondContact O-CB 3.46Å; G231-F235 PolarHBondContact O-N 2.87Å; G231-G291 CarbonylContact C-O 3.55Å; G231-G291 VanDerWaalsContact CA-O 3.29Å; G231-G291 WeakPolarHBondContact CA-O 3.2Å; G231-G291 CarbonylContact O-C 3.59Å; G231-G291 WeakPolarHBondContact O-CA 2.88Å
232	L	98.6	Very high	97.8	Very high	33 Å²	33	61.7 Å²	61.7	17%	0.173	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-45.8	175.1	178.8	62.3	0	0	0	112.3	L163 C167 V228 N229 A230 F235 L236 M295	L163-L232 HydrophobicContact CD1-CD2 4.44Å; L163-L232 HydrophobicContact CD2-CD2 4.35Å; C167-L232 WeakPolarHBondContact SG-CD1 3.3Å; V228-L232 WeakPolarHBondContact O-CB 3.14Å; V228-L232 PolarHBondContact O-N 3.24Å; N229-L232 PolarHBondContact O-N 2.83Å; A230-L232 VanDerWaalsContact C-N 3.34Å; A230-L232 PolarHBondContact O-N 3.47Å; L232-F235 WeakPolarHBondContact O-CB 3.38Å; L232-F235 PolarHBondContact O-N 3.26Å; L232-L236 HydrophobicContact CD1-CD1 3.95Å; L232-L236 HydrophobicContact CD1-CG 4.02Å; L232-L236 HydrophobicContact CG-CD1 4.01Å; L232-L236 HydrophobicContact CG-CG 4.44Å; L232-L236 WeakPolarHBondContact O-CG 3.48Å; L232-L236 PolarHBondContact O-N 2.86Å; L232-M295 HydrophobicContact CB-SD 4.05Å; L232-M295 HydrophobicContact CD1-SD 4.32Å
233	Y	98.6	Very high	97.9	Very high	163 Å²	163	59 Å²	59	64%	0.639	29%	0.29	S	S	*	.	H	α-helix	trans	-62.5	-44.7	178.2	-72.9	-56.1	0	0	0	112	N229 A230 F235 L236 F237	N229-Y233 HydrophobicContact CB-CE2 4.19Å; N229-Y233 WeakPolarHBondContact O-CD2 3.26Å; N229-Y233 PolarHBondContact O-N 2.87Å; A230-Y233 PolarHBondContact O-N 2.91Å; Y233-F235 VanDerWaalsContact C-N 3.32Å; Y233-F235 PolarHBondContact O-N 3.49Å; Y233-L236 PolarHBondContact O-N 3.02Å; Y233-F237 VanDerWaalsContact O-CB 3.27Å; Y233-F237 WeakPolarHBondContact O-CB 3.41Å; Y233-F237 PolarHBondContact O-N 3.4Å
234	I	98.7	Very high	98	Very high	72 Å²	72	51 Å²	51	37%	0.369	26%	0.26	S	S	.	.	H	α-helix	trans	-58.5	-48.2	174.7	-67.5	166	0	0	0	109.7	A230 G231 L236 C238 G287	A230-I234 VanDerWaalsContact O-CG1 3.3Å; A230-I234 WeakPolarHBondContact O-CG1 3.37Å; A230-I234 PolarHBondContact O-N 3.37Å; G231-I234 PolarHBondContact O-N 3.38Å; I234-L236 PolarHBondContact O-N 3.38Å; I234-C238 VanDerWaalsContact O-CB 3.27Å; I234-C238 WeakPolarHBondContact O-CB 3.23Å; I234-C238 PolarHBondContact O-N 2.81Å; I234-C238 PolarHBondContact O-SG 3.35Å; I234-G287 WeakPolarHBondContact CG2-O 3.35Å
235	F	98.8	Very high	98.1	Very high	1 Å²	1	49.5 Å²	49.5	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-56.8	-52.6	179.1	179.5	-87.8	0	0	0	111.9	C167 F170 H171 G231 L232 Y233 C238 Q239 S288 F292	C167-F235 HydrophobicContact CB-CD1 4.02Å; C167-F235 HydrophobicContact CB-CE1 3.58Å; C167-F235 HydrophobicContact CB-CE2 4.2Å; C167-F235 HydrophobicContact CB-CG 4.49Å; C167-F235 HydrophobicContact CB-CZ 3.69Å; C167-F235 VanDerWaalsContact O-CZ 3.23Å; C167-F235 WeakPolarHBondContact O-CZ 3.32Å; F170-F235 HydrophobicContact CD1-CE1 4.19Å; H171-F235 HydrophobicContact CB-CZ 4.02Å; G231-F235 VanDerWaalsContact O-CB 3.31Å; G231-F235 WeakPolarHBondContact O-CB 3.46Å; G231-F235 PolarHBondContact O-N 2.87Å; L232-F235 WeakPolarHBondContact O-CB 3.38Å; L232-F235 PolarHBondContact O-N 3.26Å; Y233-F235 VanDerWaalsContact C-N 3.32Å; Y233-F235 PolarHBondContact O-N 3.49Å; F235-C238 PolarHBondContact O-N 3.46Å; F235-Q239 HydrophobicContact CD1-CG 3.99Å; F235-Q239 HydrophobicContact CE1-CG 3.58Å; F235-Q239 HydrophobicContact CE2-CG 4.44Å; F235-Q239 HydrophobicContact CZ-CG 3.83Å; F235-Q239 WeakPolarHBondContact O-CG 3.29Å; F235-Q239 PolarHBondContact O-N 3.43Å; F235-S288 VanDerWaalsContact CD2-O 3.28Å; F235-S288 WeakPolarHBondContact CD2-O 3.24Å; F235-F292 HydrophobicContact CD2-CB 4.02Å; F235-F292 HydrophobicContact CD2-CD2 4.27Å; F235-F292 HydrophobicContact CE2-CB 4.36Å; F235-F292 HydrophobicContact CE2-CD2 4.21Å
236	L	98.6	Very high	98.1	Very high	73 Å²	73	46 Å²	46	38%	0.382	23%	0.228	S	C	.	.	H	α-helix	trans	-65.5	-45.2	-177	-68.5	175.1	0	0	0	112.2	L232 Y233 I234 C238 Q239 V240	L232-L236 HydrophobicContact CD1-CD1 3.95Å; L232-L236 HydrophobicContact CD1-CG 4.02Å; L232-L236 HydrophobicContact CG-CD1 4.01Å; L232-L236 HydrophobicContact CG-CG 4.44Å; L232-L236 WeakPolarHBondContact O-CG 3.48Å; L232-L236 PolarHBondContact O-N 2.86Å; Y233-L236 PolarHBondContact O-N 3.02Å; I234-L236 PolarHBondContact O-N 3.38Å; L236-C238 VanDerWaalsContact C-N 3.26Å; L236-C238 PolarHBondContact O-N 2.83Å; L236-Q239 PolarHBondContact O-N 2.79Å; L236-V240 WeakPolarHBondContact O-CG2 3.5Å; L236-V240 PolarHBondContact O-N 2.96Å
237	F	98.6	Very high	98.1	Very high	118 Å²	118	40.5 Å²	40.5	52%	0.518	20%	0.203	S	C	.	.	H	α-helix	trans	-54.9	-46	175.4	175.9	-95.8	0	0	0	111	Y233 V240 G241 F270 Y284	Y233-F237 VanDerWaalsContact O-CB 3.27Å; Y233-F237 WeakPolarHBondContact O-CB 3.41Å; Y233-F237 PolarHBondContact O-N 3.4Å; F237-V240 PolarHBondContact O-N 3.25Å; F237-G241 PolarHBondContact O-N 3.2Å; F237-F270 AromaticContact CD2-CE1 3.66Å; F237-F270 HydrophobicContact CD2-CE1 3.66Å; F237-F270 HydrophobicContact CD2-CZ 4.05Å; F237-F270 HydrophobicContact CE1-CE1 4.38Å; F237-F270 HydrophobicContact CE2-CD1 4.33Å; F237-F270 AromaticContact CE2-CE1 3.4Å; F237-F270 HydrophobicContact CE2-CE1 3.4Å; F237-F270 AromaticContact CE2-CZ 3.92Å; F237-F270 HydrophobicContact CE2-CZ 3.92Å; F237-F270 HydrophobicContact CG-CE1 4.26Å; F237-F270 HydrophobicContact CZ-CD1 4.34Å; F237-F270 AromaticContact CZ-CE1 3.8Å; F237-F270 HydrophobicContact CZ-CE1 3.8Å; F237-Y284 HydrophobicContact CD1-CE1 4.47Å; F237-Y284 AromaticContact CE1-CE1 3.94Å; F237-Y284 HydrophobicContact CE1-CE1 3.94Å
238	C	98.6	Very high	97.9	Very high	12 Å²	12	39.8 Å²	39.8	8%	0.081	20%	0.202	C	C	.	.	H	α-helix	trans	-69.8	-35.6	179.1	-72.6	0	0	0	0	113.1	I234 F235 L236 G241 N242 Y284 G287 S288	I234-C238 VanDerWaalsContact O-CB 3.27Å; I234-C238 WeakPolarHBondContact O-CB 3.23Å; I234-C238 PolarHBondContact O-N 2.81Å; I234-C238 PolarHBondContact O-SG 3.35Å; F235-C238 PolarHBondContact O-N 3.46Å; L236-C238 VanDerWaalsContact C-N 3.26Å; L236-C238 PolarHBondContact O-N 2.83Å; C238-G241 PolarHBondContact O-N 3.03Å; C238-N242 VanDerWaalsContact O-CB 3.29Å; C238-N242 WeakPolarHBondContact O-CB 3.29Å; C238-N242 PolarHBondContact O-N 3.38Å; C238-Y284 HydrophobicContact CB-CD1 4.29Å; C238-Y284 VanDerWaalsContact CB-O 3.3Å; C238-Y284 WeakPolarHBondContact CB-O 3.46Å; C238-Y284 WeakPolarHBondContact O-CB 3.49Å; C238-G287 VanDerWaalsContact SG-C 3.59Å; C238-S288 WeakPolarHBondContact CB-OG 3.46Å
239	Q	98.5	Very high	97.7	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-63.8	-42.2	174.6	-72.7	-57.2	-27.3	0	0	112.3	F170 H171 K174 F235 L236 F243 S288	F170-Q239 HydrophobicContact CD1-CG 4.18Å; F170-Q239 HydrophobicContact CE1-CB 3.72Å; F170-Q239 HydrophobicContact CE1-CG 3.89Å; H171-Q239 PolarHBondContact ND1-NE2 3.07Å; H171-Q239 PolarHBondContact ND1-OE1 3.33Å; K174-Q239 PolarHBondContact NZ-O 3.23Å; K174-Q239 VanDerWaalsContact NZ-OE1 3.08Å; F235-Q239 HydrophobicContact CD1-CG 3.99Å; F235-Q239 HydrophobicContact CE1-CG 3.58Å; F235-Q239 HydrophobicContact CE2-CG 4.44Å; F235-Q239 HydrophobicContact CZ-CG 3.83Å; F235-Q239 WeakPolarHBondContact O-CG 3.29Å; F235-Q239 PolarHBondContact O-N 3.43Å; L236-Q239 PolarHBondContact O-N 2.79Å; Q239-F243 WeakPolarHBondContact O-CB 3.5Å; Q239-F243 PolarHBondContact O-N 2.97Å; Q239-S288 VanDerWaalsContact NE2-CB 3.3Å; Q239-S288 PolarHBondContact NE2-OG 3.03Å
240	V	98.4	Very high	97.3	Very high	71 Å²	71	42.9 Å²	42.9	43%	0.43	21%	0.211	S	C	.	.	H	α-helix	trans	-65.3	-41.9	175.5	176.4	0	0	0	0	110.7	L236 F237 F243 S244 F270	L236-V240 WeakPolarHBondContact O-CG2 3.5Å; L236-V240 PolarHBondContact O-N 2.96Å; F237-V240 PolarHBondContact O-N 3.25Å; V240-F243 PolarHBondContact O-N 3.47Å; V240-S244 WeakPolarHBondContact O-CB 3.38Å; V240-S244 PolarHBondContact O-N 3.47Å; V240-S244 PolarHBondContact O-OG 2.85Å; V240-F270 HydrophobicContact CB-CE1 4.47Å; V240-F270 HydrophobicContact CB-CZ 4.25Å; V240-F270 HydrophobicContact CG1-CD2 4.11Å; V240-F270 HydrophobicContact CG1-CE1 4.31Å; V240-F270 HydrophobicContact CG1-CE2 3.65Å; V240-F270 HydrophobicContact CG1-CZ 3.76Å
241	G	98.3	Very high	96.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-51.1	175.1	0	0	0	0	0	112.6	F237 C238 F243 S244 I245	F237-G241 PolarHBondContact O-N 3.2Å; C238-G241 PolarHBondContact O-N 3.03Å; G241-F243 VanDerWaalsContact C-N 3.35Å; G241-F243 PolarHBondContact O-N 2.89Å; G241-S244 WeakPolarHBondContact O-CB 3.4Å; G241-S244 PolarHBondContact O-N 2.96Å; G241-S244 VanDerWaalsContact O-N 3.15Å; G241-I245 WeakPolarHBondContact O-CG1 3.22Å; G241-I245 PolarHBondContact O-N 3.21Å
242	N	98.3	Very high	96.3	Very high	2 Å²	2	48 Å²	48	1%	0.011	23%	0.232	C	C	.	.	H	α-helix	trans	-57.6	-45.3	177.8	175.9	-82.8	0	0	0	111.8	K174 C238 S244 I245 H246 N281 E285	K174-N242 PolarHBondContact NZ-OD1 3.26Å; C238-N242 VanDerWaalsContact O-CB 3.29Å; C238-N242 WeakPolarHBondContact O-CB 3.29Å; C238-N242 PolarHBondContact O-N 3.38Å; N242-S244 PolarHBondContact O-N 3.03Å; N242-I245 PolarHBondContact O-N 3.08Å; N242-H246 PolarHBondContact O-N 2.92Å; N242-H246 PolarHBondContact OD1-CE1 3.04Å; N242-H246 PolarHBondContact OD1-ND1 3.06Å; N242-N281 PolarHBondContact ND2-O 3.35Å; N242-E285 PolarHBondContact ND2-OE2 2.96Å
243	F	98	Very high	95.3	Very high	87 Å²	87	51 Å²	51	38%	0.382	24%	0.244	S	C	.	.	H	α-helix	trans	-60.1	-45.7	175.6	177.8	-103	0	0	0	111.8	E178 V182 Q239 V240 G241 I245 H246 I247	E178-F243 HydrophobicContact CG-CD2 4.04Å; E178-F243 HydrophobicContact CG-CE2 4.31Å; E178-F243 WeakPolarHBondContact OE1-CA 3.43Å; E178-F243 WeakPolarHBondContact OE1-CD2 3.3Å; V182-F243 HydrophobicContact CG2-CE2 4.32Å; Q239-F243 WeakPolarHBondContact O-CB 3.5Å; Q239-F243 PolarHBondContact O-N 2.97Å; V240-F243 PolarHBondContact O-N 3.47Å; G241-F243 VanDerWaalsContact C-N 3.35Å; G241-F243 PolarHBondContact O-N 2.89Å; F243-I245 VanDerWaalsContact C-N 3.27Å; F243-I245 PolarHBondContact O-N 3.4Å; F243-H246 PolarHBondContact O-N 3.44Å; F243-I247 HydrophobicContact CD1-CG1 4.17Å; F243-I247 HydrophobicContact CE1-CD1 4.24Å; F243-I247 HydrophobicContact CE1-CG1 3.7Å; F243-I247 HydrophobicContact CE2-CD1 4.12Å; F243-I247 HydrophobicContact CE2-CG1 4.08Å; F243-I247 HydrophobicContact CZ-CD1 3.71Å; F243-I247 HydrophobicContact CZ-CG1 3.64Å; F243-I247 WeakPolarHBondContact O-CG1 3.45Å; F243-I247 PolarHBondContact O-N 2.94Å
244	S	97.8	Very high	93.8	Very high	11 Å²	11	45.8 Å²	45.8	8%	0.077	23%	0.234	C	C	.	.	H	α-helix	trans	-58.2	-40.6	178.2	-63.5	0	0	0	0	111.9	V240 G241 N242 A248 N268	V240-S244 WeakPolarHBondContact O-CB 3.38Å; V240-S244 PolarHBondContact O-N 3.47Å; V240-S244 PolarHBondContact O-OG 2.85Å; G241-S244 WeakPolarHBondContact O-CB 3.4Å; G241-S244 PolarHBondContact O-N 2.96Å; G241-S244 VanDerWaalsContact O-N 3.15Å; N242-S244 PolarHBondContact O-N 3.03Å; S244-A248 PolarHBondContact O-N 3.35Å; S244-N268 VanDerWaalsContact CB-ND2 3.31Å; S244-N268 WeakPolarHBondContact CB-ND2 3.43Å; S244-N268 PolarHBondContact OG-ND2 2.78Å
245	I	97.4	Very high	92	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.8	-44.9	173.9	-60.9	-51.8	0	0	0	111.2	G241 N242 F243 I247 A248 L249 F270 T271 I273 F274 P280 N281 Y284	G241-I245 WeakPolarHBondContact O-CG1 3.22Å; G241-I245 PolarHBondContact O-N 3.21Å; N242-I245 PolarHBondContact O-N 3.08Å; F243-I245 VanDerWaalsContact C-N 3.27Å; F243-I245 PolarHBondContact O-N 3.4Å; I245-I247 VanDerWaalsContact C-N 3.32Å; I245-I247 PolarHBondContact O-N 3.47Å; I245-A248 PolarHBondContact O-N 2.86Å; I245-L249 HydrophobicContact CG2-CD1 3.86Å; I245-L249 HydrophobicContact CG2-CG 4.08Å; I245-L249 WeakPolarHBondContact O-CB 3.42Å; I245-L249 VanDerWaalsContact O-CG 3.3Å; I245-L249 WeakPolarHBondContact O-CG 3.49Å; I245-L249 PolarHBondContact O-N 3.15Å; I245-F270 WeakPolarHBondContact CD1-O 3.22Å; I245-T271 HydrophobicContact CD1-CG2 4.22Å; I245-I273 HydrophobicContact CD1-CG2 4.2Å; I245-F274 HydrophobicContact CD1-CD2 4.11Å; I245-F274 HydrophobicContact CD1-CE2 3.69Å; I245-F274 HydrophobicContact CD1-CZ 4.2Å; I245-F274 HydrophobicContact CG2-CE2 4.15Å; I245-F274 HydrophobicContact CG2-CZ 3.68Å; I245-P280 HydrophobicContact CD1-CB 3.92Å; I245-P280 HydrophobicContact CD1-CG 3.66Å; I245-P280 HydrophobicContact CG1-CB 4Å; I245-P280 HydrophobicContact CG1-CG 3.95Å; I245-P280 HydrophobicContact CG2-CG 3.92Å; I245-N281 HydrophobicContact CB-CB 4.11Å; I245-N281 HydrophobicContact CG2-CB 3.64Å; I245-Y284 HydrophobicContact CD1-CE2 4.26Å; I245-Y284 HydrophobicContact CG1-CD2 3.83Å; I245-Y284 HydrophobicContact CG1-CE2 3.92Å
246	H	96.2	Very high	90.2	Very high	23 Å²	23	54.8 Å²	54.8	11%	0.106	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-40.4	178.8	-69.7	162.5	0	0	0	112.5	E178 V182 H183 N242 F243 L249 R250	E178-H246 IonicContact OE1-CG 3.44Å; E178-H246 IonicContact OE1-ND1 2.65Å; E178-H246 PolarHBondContact OE1-ND1 2.86Å; E178-H246 IonicContact OE2-CE1 3.88Å; E178-H246 PolarHBondContact OE2-CE1 3.32Å; E178-H246 IonicContact OE2-CG 3.27Å; E178-H246 IonicContact OE2-ND1 3.78Å; E178-H246 PolarHBondContact OE2-ND1 2.83Å; V182-H246 HydrophobicContact CG1-CB 4.14Å; H183-H246 AromaticContact NE2-CE1 3.85Å; H183-H246 AromaticContact NE2-CG 3.67Å; H183-H246 AromaticContact NE2-ND1 3.55Å; N242-H246 PolarHBondContact O-N 2.92Å; N242-H246 PolarHBondContact OD1-CE1 3.04Å; N242-H246 PolarHBondContact OD1-ND1 3.06Å; F243-H246 PolarHBondContact O-N 3.44Å; H246-L249 PolarHBondContact O-N 3.37Å; H246-R250 WeakPolarHBondContact O-CB 3.36Å; H246-R250 PolarHBondContact O-N 3.16Å
247	I	95.4	Very high	88.6	Confident	49 Å²	49	53.5 Å²	53.5	25%	0.251	29%	0.293	S	S	.	.	H	α-helix	trans	-63.8	-45.3	173.9	-65.6	-70.3	0	0	0	111.3	V182 F243 I245 L249 R250 N251	V182-I247 HydrophobicContact CG1-CD1 3.84Å; V182-I247 HydrophobicContact CG1-CG1 4.48Å; V182-I247 HydrophobicContact CG2-CD1 3.95Å; F243-I247 HydrophobicContact CD1-CG1 4.17Å; F243-I247 HydrophobicContact CE1-CD1 4.24Å; F243-I247 HydrophobicContact CE1-CG1 3.7Å; F243-I247 HydrophobicContact CE2-CD1 4.12Å; F243-I247 HydrophobicContact CE2-CG1 4.08Å; F243-I247 HydrophobicContact CZ-CD1 3.71Å; F243-I247 HydrophobicContact CZ-CG1 3.64Å; F243-I247 WeakPolarHBondContact O-CG1 3.45Å; F243-I247 PolarHBondContact O-N 2.94Å; I245-I247 VanDerWaalsContact C-N 3.32Å; I245-I247 PolarHBondContact O-N 3.47Å; I247-L249 VanDerWaalsContact C-N 3.34Å; I247-L249 PolarHBondContact O-N 3.47Å; I247-R250 WeakPolarHBondContact O-CB 3.2Å; I247-R250 PolarHBondContact O-N 3.03Å; I247-N251 VanDerWaalsContact O-CG 3.27Å; I247-N251 PolarHBondContact O-N 3.38Å; I247-N251 PolarHBondContact O-ND2 2.99Å
248	A	94.6	Very high	87	Confident	10 Å²	10	53.7 Å²	53.7	8%	0.083	29%	0.294	C	S	.	.	H	α-helix	trans	-59.4	-45.5	176.1	0	0	0	0	0	111.5	S244 I245 R250 N251 L252 T266 T271 F274	S244-A248 PolarHBondContact O-N 3.35Å; I245-A248 PolarHBondContact O-N 2.86Å; A248-R250 VanDerWaalsContact C-N 3.35Å; A248-R250 PolarHBondContact O-N 3.45Å; A248-N251 PolarHBondContact O-N 2.9Å; A248-L252 WeakPolarHBondContact O-CG 3.39Å; A248-L252 PolarHBondContact O-N 3.4Å; A248-T266 HydrophobicContact CB-CG2 4.31Å; A248-T271 HydrophobicContact CB-CG2 3.97Å; A248-F274 HydrophobicContact CB-CE2 4.23Å
249	L	92.7	Very high	85.8	Confident	38 Å²	38	57.6 Å²	57.6	20%	0.199	32%	0.317	C	S	.	.	H	α-helix	trans	-64.3	-36.6	177.7	-70	177.6	0	0	0	112.9	I245 H246 I247 L252 P263 F274	I245-L249 HydrophobicContact CG2-CD1 3.86Å; I245-L249 HydrophobicContact CG2-CG 4.08Å; I245-L249 WeakPolarHBondContact O-CB 3.42Å; I245-L249 VanDerWaalsContact O-CG 3.3Å; I245-L249 WeakPolarHBondContact O-CG 3.49Å; I245-L249 PolarHBondContact O-N 3.15Å; H246-L249 PolarHBondContact O-N 3.37Å; I247-L249 VanDerWaalsContact C-N 3.34Å; I247-L249 PolarHBondContact O-N 3.47Å; L249-L252 HydrophobicContact CD2-CD1 4.12Å; L249-P263 HydrophobicContact CD2-CB 4.01Å; L249-P263 HydrophobicContact CD2-CG 4.44Å; L249-F274 HydrophobicContact CD2-CE1 4.36Å; L249-F274 HydrophobicContact CD2-CZ 3.87Å; L249-F274 HydrophobicContact CG-CZ 4.19Å
250	R	90.9	Very high	84.8	Confident	91 Å²	91	63 Å²	63	34%	0.343	34%	0.341	S	S	.	.	H	α-helix	trans	-60.6	-47.6	172.7	176	-168.3	-167.1	-127	9.6	111	V182 R184 H246 I247 A248 L252 K253	V182-R250 HydrophobicContact CG1-CB 4.23Å; V182-R250 WeakPolarHBondContact O-CB 3.38Å; V182-R250 WeakPolarHBondContact O-CD 3.34Å; V182-R250 WeakPolarHBondContact O-CG 3.23Å; R184-R250 HydrophobicContact CG-CG 4.4Å; H246-R250 WeakPolarHBondContact O-CB 3.36Å; H246-R250 PolarHBondContact O-N 3.16Å; I247-R250 WeakPolarHBondContact O-CB 3.2Å; I247-R250 PolarHBondContact O-N 3.03Å; A248-R250 VanDerWaalsContact C-N 3.35Å; A248-R250 PolarHBondContact O-N 3.45Å; R250-L252 VanDerWaalsContact C-N 3.25Å; R250-L252 PolarHBondContact O-N 2.91Å; R250-K253 PolarHBondContact O-N 3.43Å
251	N	90.3	Very high	84.3	Confident	105 Å²	105	65 Å²	65	56%	0.561	34%	0.343	S	S	*	.	H	α-helix	trans	-69.1	-23	-174.9	-67.4	-14.5	0	0	0	113	I247 A248	I247-N251 VanDerWaalsContact O-CG 3.27Å; I247-N251 PolarHBondContact O-N 3.38Å; I247-N251 PolarHBondContact O-ND2 2.99Å; A248-N251 PolarHBondContact O-N 2.9Å
252	L	85.9	Confident	83.9	Confident	49 Å²	49	66 Å²	66	26%	0.257	35%	0.349	S	S	.	.	H	α-helix	trans	-68.5	-32.9	174.5	-72	168.9	0	0	0	113.4	A248 L249 R250 A254 P263	A248-L252 WeakPolarHBondContact O-CG 3.39Å; A248-L252 PolarHBondContact O-N 3.4Å; L249-L252 HydrophobicContact CD2-CD1 4.12Å; R250-L252 VanDerWaalsContact C-N 3.25Å; R250-L252 PolarHBondContact O-N 2.91Å; L252-A254 PolarHBondContact O-N 3.18Å; L252-P263 VanDerWaalsContact CD1-CA 3.45Å; L252-P263 HydrophobicContact CD1-CB 3.43Å; L252-P263 VanDerWaalsContact CD1-CB 3.43Å
253	K	76.6	Confident	83.6	Confident	96 Å²	96	65.9 Å²	65.9	42%	0.417	35%	0.348	S	S	.	.	S	Bend	trans	-83.3	111.4	176.1	-68.8	175.6	173.4	-179.5	0	107.3	R184 R250	R184-K253 HydrophobicContact CB-CD 3.97Å; R184-K253 PolarHBondContact NH1-O 3.03Å; R184-K253 PolarHBondContact O-NZ 2.77Å; R250-K253 PolarHBondContact O-N 3.43Å
254	A	68.3	Low	83.3	Confident	53 Å²	53	66.4 Å²	66.4	44%	0.438	35%	0.348	S	S	.	.			trans	-63.5	152.3	169.2	0	0	0	0	0	110	L252 G256 S257	L252-A254 PolarHBondContact O-N 3.18Å; A254-G256 PolarHBondContact O-N 3.41Å; A254-G256 VanDerWaalsContact O-N 3.16Å; A254-S257 PolarHBondContact O-N 3.49Å
255	Q	59.9	Low	83.1	Confident	180 Å²	180	67.2 Å²	67.2	84%	0.841	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	121.7	-176.3	-171.3	169	-13.6	0	0	109.2	R184 S257	R184-Q255 VanDerWaalsContact NH1-CA 3.26Å; Q255-S257 VanDerWaalsContact C-N 3.26Å; Q255-S257 PolarHBondContact O-N 3.06Å
256	G	60.4	Low	83	Confident	81 Å²	81	70.3 Å²	70.3	84%	0.835	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	-8.2	-174.6	0	0	0	0	0	115.9	A254	A254-G256 PolarHBondContact O-N 3.41Å; A254-G256 VanDerWaalsContact O-N 3.16Å
257	S	66.7	Low	82.9	Confident	46 Å²	46	79.2 Å²	79.2	32%	0.322	41%	0.411	S	S	.	.			trans	-84.4	128.1	177.4	-173.9	0	0	0	0	111.6	A254 Q255 V259	A254-S257 PolarHBondContact O-N 3.49Å; Q255-S257 VanDerWaalsContact C-N 3.26Å; Q255-S257 PolarHBondContact O-N 3.06Å; S257-V259 PolarHBondContact OG-N 3.42Å
258	K	64.4	Low	82.9	Confident	122 Å²	122	79.5 Å²	79.5	53%	0.53	41%	0.413	S	S	.	.			trans	-97	3.4	175.2	-64.1	179.4	-177.9	175.2	0	112.9	E96 K260	E96-K258 HydrophobicContact CG-CD 3.98Å; E96-K258 IonicContact OE1-NZ 3.16Å; E96-K258 PolarHBondContact OE1-NZ 2.71Å; K258-K260 PolarHBondContact O-N 3.27Å
259	V	72.4	Confident	83	Confident	95 Å²	95	82.7 Å²	82.7	58%	0.576	43%	0.433	S	S	*	.			trans	-68.1	119.9	178.7	-178.6	0	0	0	0	109	S257	S257-V259 PolarHBondContact OG-N 3.42Å
260	K	78.9	Confident	83.2	Confident	113 Å²	113	83 Å²	83	49%	0.491	43%	0.432	S	S	.	.			trans	-71.2	140.5	173.4	-74.8	165	165.2	-179.1	0	109.3	K258 E326 F327	K258-K260 PolarHBondContact O-N 3.27Å; K260-E326 WeakPolarHBondContact CD-OE1 3.34Å; K260-E326 WeakPolarHBondContact CD-OE2 3.21Å; K260-E326 IonicContact NZ-OE1 3.03Å; K260-E326 IonicContact NZ-OE2 3.94Å; K260-E326 PolarHBondContact NZ-OE2 3Å; K260-F327 HydrophobicContact CB-CE2 4.4Å; K260-F327 HydrophobicContact CB-CZ 3.86Å; K260-F327 WeakPolarHBondContact O-CZ 3.37Å
261	K	86.9	Confident	83.5	Confident	113 Å²	113	78.7 Å²	78.7	49%	0.491	42%	0.416	S	S	.	.			trans	-128.8	151.4	175.2	-63.8	-174.5	-178.5	-179.2	0	109.4
262	I	89.7	Confident	83.8	Confident	21 Å²	21	80.6 Å²	80.6	11%	0.108	42%	0.416	C	S	.	.			trans	-71.6	126.7	171.6	-59.5	168.8	0	0	0	108.2	Y264 F327 Y330	I262-Y264 HydrophobicContact CB-CD2 4.35Å; I262-Y264 HydrophobicContact CB-CE2 3.66Å; I262-Y264 HydrophobicContact CG2-CD2 4.13Å; I262-Y264 HydrophobicContact CG2-CE1 4.34Å; I262-Y264 HydrophobicContact CG2-CE2 3.53Å; I262-Y264 WeakPolarHBondContact O-CD2 3.43Å; I262-F327 HydrophobicContact CD1-CB 3.58Å; I262-F327 HydrophobicContact CD1-CD1 3.98Å; I262-F327 HydrophobicContact CD1-CD2 4.38Å; I262-F327 HydrophobicContact CD1-CG 3.72Å; I262-F327 HydrophobicContact CG1-CB 4Å; I262-F327 HydrophobicContact CG1-CD1 3.84Å; I262-F327 HydrophobicContact CG1-CD2 3.82Å; I262-F327 HydrophobicContact CG1-CE1 4.29Å; I262-F327 HydrophobicContact CG1-CE2 4.29Å; I262-F327 HydrophobicContact CG1-CG 3.59Å; I262-Y330 HydrophobicContact CD1-CD2 3.94Å; I262-Y330 HydrophobicContact CG1-CD2 3.92Å; I262-Y330 HydrophobicContact CG1-CE2 4.48Å; I262-Y330 HydrophobicContact CG2-CD2 3.89Å; I262-Y330 HydrophobicContact CG2-CE2 3.83Å
263	P	91.9	Very high	84.3	Confident	1 Å²	1	79.8 Å²	79.8	1%	0.006	41%	0.411	C	S	.	.			trans	-73.5	134.5	173	29.9	-33.4	0	0	0	110.7	L249 L252 F274 R334	L249-P263 HydrophobicContact CD2-CB 4.01Å; L249-P263 HydrophobicContact CD2-CG 4.44Å; L252-P263 VanDerWaalsContact CD1-CA 3.45Å; L252-P263 HydrophobicContact CD1-CB 3.43Å; L252-P263 VanDerWaalsContact CD1-CB 3.43Å; P263-F274 HydrophobicContact CB-CD1 3.83Å; P263-F274 HydrophobicContact CB-CE1 3.45Å; P263-F274 VanDerWaalsContact CB-CE1 3.45Å; P263-F274 HydrophobicContact CB-CE2 4.29Å; P263-F274 HydrophobicContact CB-CG 4.41Å; P263-F274 HydrophobicContact CB-CZ 3.71Å; P263-F274 HydrophobicContact CG-CD1 3.9Å; P263-F274 HydrophobicContact CG-CE1 3.59Å; P263-F274 HydrophobicContact CG-CZ 4.31Å; P263-R334 VanDerWaalsContact O-CZ 3.3Å; P263-R334 PolarHBondContact O-NH1 3.33Å; P263-R334 PolarHBondContact O-NH2 3.06Å
264	Y	92.6	Very high	85.2	Confident	97 Å²	97	75.3 Å²	75.3	38%	0.38	39%	0.392	S	S	.	.			trans	-125.2	158.1	173.8	-71.9	-81.9	0	0	0	110.8	I262 W275 P331	I262-Y264 HydrophobicContact CB-CD2 4.35Å; I262-Y264 HydrophobicContact CB-CE2 3.66Å; I262-Y264 HydrophobicContact CG2-CD2 4.13Å; I262-Y264 HydrophobicContact CG2-CE1 4.34Å; I262-Y264 HydrophobicContact CG2-CE2 3.53Å; I262-Y264 WeakPolarHBondContact O-CD2 3.43Å; Y264-W275 HydrophobicContact CD1-CZ3 4.45Å; Y264-P331 HydrophobicContact CE1-CG 4Å
265	P	93.9	Very high	86.4	Confident	29 Å²	29	80.1 Å²	80.1	19%	0.188	40%	0.399	C	S	.	.			trans	-50.5	146.6	170.4	-33.5	43.1	0	0	0	113.4	F274 W275	P265-F274 HydrophobicContact CG-CB 3.82Å; P265-W275 VanDerWaalsContact CG-CD1 3.5Å; P265-W275 HydrophobicContact CG-CD2 3.78Å; P265-W275 HydrophobicContact CG-CG 3.7Å; P265-W275 HydrophobicContact CG-CZ2 4.25Å
266	T	94.4	Very high	88	Confident	64 Å²	64	74.5 Å²	74.5	39%	0.393	37%	0.374	S	S	.	.			trans	-116.1	-175	176.9	73	0	0	0	0	109.8	A248 N268 T271 W272	A248-T266 HydrophobicContact CB-CG2 4.31Å; T266-N268 PolarHBondContact O-N 3.2Å; T266-N268 PolarHBondContact OG1-N 2.97Å; T266-T271 PolarHBondContact N-OG1 3.49Å; T266-T271 WeakPolarHBondContact OG1-CG2 3.44Å; T266-T271 PolarHBondContact OG1-OG1 2.89Å; T266-W272 PolarHBondContact O-NE1 3.24Å
267	K	94.3	Very high	89.7	Confident	210 Å²	210	70.7 Å²	70.7	91%	0.913	33%	0.334	S	S	*	.	S	Bend	trans	-60.6	-22.4	172.7	-63.1	-174.9	179.5	-176.6	0	113.2
268	N	95.9	Very high	91.1	Very high	56 Å²	56	68.7 Å²	68.7	30%	0.299	32%	0.321	S	S	.	.	S	Bend	trans	-76.9	121.6	177.1	179.2	-14.9	0	0	0	110.4	S244 T266 F270 T271	S244-N268 VanDerWaalsContact CB-ND2 3.31Å; S244-N268 WeakPolarHBondContact CB-ND2 3.43Å; S244-N268 PolarHBondContact OG-ND2 2.78Å; T266-N268 PolarHBondContact O-N 3.2Å; T266-N268 PolarHBondContact OG1-N 2.97Å; N268-F270 PolarHBondContact O-N 2.92Å; N268-F270 WeakPolarHBondContact OD1-CB 3.43Å; N268-F270 WeakPolarHBondContact OD1-CD2 3.39Å; N268-F270 PolarHBondContact OD1-N 3.33Å; N268-T271 HydrophobicContact CB-CG2 4.14Å; N268-T271 WeakPolarHBondContact O-CB 3.49Å; N268-T271 PolarHBondContact O-N 3.12Å; N268-T271 PolarHBondContact O-OG1 3.33Å
269	P	96.8	Very high	92.6	Very high	76 Å²	76	62.9 Å²	62.9	49%	0.494	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-60.8	-29	-176.9	24.9	-35.2	0	0	0	113.8	T271 W272	P269-T271 PolarHBondContact O-N 3.12Å; P269-W272 HydrophobicContact CB-CD2 4.27Å; P269-W272 HydrophobicContact CB-CE3 4.43Å; P269-W272 HydrophobicContact CB-CZ2 4.38Å; P269-W272 WeakPolarHBondContact O-CB 3.27Å; P269-W272 PolarHBondContact O-N 2.99Å
270	F	96.8	Very high	93.7	Very high	44 Å²	44	58.4 Å²	58.4	19%	0.193	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-63.3	-13.9	174.9	-71.5	-78	0	0	0	113.6	F237 V240 I245 N268 Y284	F237-F270 AromaticContact CD2-CE1 3.66Å; F237-F270 HydrophobicContact CD2-CE1 3.66Å; F237-F270 HydrophobicContact CD2-CZ 4.05Å; F237-F270 HydrophobicContact CE1-CE1 4.38Å; F237-F270 HydrophobicContact CE2-CD1 4.33Å; F237-F270 AromaticContact CE2-CE1 3.4Å; F237-F270 HydrophobicContact CE2-CE1 3.4Å; F237-F270 AromaticContact CE2-CZ 3.92Å; F237-F270 HydrophobicContact CE2-CZ 3.92Å; F237-F270 HydrophobicContact CG-CE1 4.26Å; F237-F270 HydrophobicContact CZ-CD1 4.34Å; F237-F270 AromaticContact CZ-CE1 3.8Å; F237-F270 HydrophobicContact CZ-CE1 3.8Å; V240-F270 HydrophobicContact CB-CE1 4.47Å; V240-F270 HydrophobicContact CB-CZ 4.25Å; V240-F270 HydrophobicContact CG1-CD2 4.11Å; V240-F270 HydrophobicContact CG1-CE1 4.31Å; V240-F270 HydrophobicContact CG1-CE2 3.65Å; V240-F270 HydrophobicContact CG1-CZ 3.76Å; I245-F270 WeakPolarHBondContact CD1-O 3.22Å; N268-F270 PolarHBondContact O-N 2.92Å; N268-F270 WeakPolarHBondContact OD1-CB 3.43Å; N268-F270 WeakPolarHBondContact OD1-CD2 3.39Å; N268-F270 PolarHBondContact OD1-N 3.33Å; F270-Y284 HydrophobicContact CD1-CE1 4.36Å; F270-Y284 WeakPolarHBondContact O-CE2 3.39Å; F270-Y284 PolarHBondContact O-OH 3.25Å
271	T	96.9	Very high	94.6	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-94.7	-8.3	177.4	68.6	0	0	0	0	113.1	I245 A248 T266 N268 P269 I273 F274	I245-T271 HydrophobicContact CD1-CG2 4.22Å; A248-T271 HydrophobicContact CB-CG2 3.97Å; T266-T271 PolarHBondContact N-OG1 3.49Å; T266-T271 WeakPolarHBondContact OG1-CG2 3.44Å; T266-T271 PolarHBondContact OG1-OG1 2.89Å; N268-T271 HydrophobicContact CB-CG2 4.14Å; N268-T271 WeakPolarHBondContact O-CB 3.49Å; N268-T271 PolarHBondContact O-N 3.12Å; N268-T271 PolarHBondContact O-OG1 3.33Å; P269-T271 PolarHBondContact O-N 3.12Å; T271-I273 PolarHBondContact O-N 3.38Å; T271-F274 WeakPolarHBondContact O-CB 3.39Å; T271-F274 VanDerWaalsContact O-CD2 3.25Å; T271-F274 WeakPolarHBondContact O-CD2 3.32Å; T271-F274 PolarHBondContact O-N 2.73Å
272	W	96.3	Very high	95.1	Very high	146 Å²	146	50.5 Å²	50.5	55%	0.553	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-66.6	-23.7	-176.2	-66	0.8	0	0	0	113.5	T266 P269 F274 W275	T266-W272 PolarHBondContact O-NE1 3.24Å; P269-W272 HydrophobicContact CB-CD2 4.27Å; P269-W272 HydrophobicContact CB-CE3 4.43Å; P269-W272 HydrophobicContact CB-CZ2 4.38Å; P269-W272 WeakPolarHBondContact O-CB 3.27Å; P269-W272 PolarHBondContact O-N 2.99Å; W272-F274 PolarHBondContact O-N 2.88Å; W272-W275 WeakPolarHBondContact O-CB 3.39Å; W272-W275 VanDerWaalsContact O-CD1 3.27Å; W272-W275 PolarHBondContact O-N 3.41Å
273	I	95.7	Very high	95.5	Very high	32 Å²	32	50.5 Å²	50.5	16%	0.164	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-58.9	-17.9	172.1	-168	168.1	0	0	0	113	I245 T271 W275 L276 V277 P280 T283 Y284	I245-I273 HydrophobicContact CD1-CG2 4.2Å; T271-I273 PolarHBondContact O-N 3.38Å; I273-W275 PolarHBondContact O-N 3.42Å; I273-W275 VanDerWaalsContact O-N 3.15Å; I273-L276 PolarHBondContact O-N 3.01Å; I273-V277 HydrophobicContact CD1-CG2 4.34Å; I273-V277 HydrophobicContact CG1-CG2 3.85Å; I273-V277 PolarHBondContact O-N 3.03Å; I273-P280 HydrophobicContact CB-CB 4.34Å; I273-P280 HydrophobicContact CG1-CB 4.32Å; I273-P280 HydrophobicContact CG2-CB 3.29Å; I273-P280 HydrophobicContact CG2-CG 4.12Å; I273-T283 HydrophobicContact CD1-CG2 3.9Å; I273-Y284 HydrophobicContact CG2-CE2 3.83Å
274	F	95.3	Very high	95.8	Very high	1 Å²	1	51.5 Å²	51.5	0%	0.004	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-59.5	-19.4	168.2	-81.9	-60.8	0	0	0	113.3	I245 A248 L249 P263 P265 T271 W272 L276 P280 R334	I245-F274 HydrophobicContact CD1-CD2 4.11Å; I245-F274 HydrophobicContact CD1-CE2 3.69Å; I245-F274 HydrophobicContact CD1-CZ 4.2Å; I245-F274 HydrophobicContact CG2-CE2 4.15Å; I245-F274 HydrophobicContact CG2-CZ 3.68Å; A248-F274 HydrophobicContact CB-CE2 4.23Å; L249-F274 HydrophobicContact CD2-CE1 4.36Å; L249-F274 HydrophobicContact CD2-CZ 3.87Å; L249-F274 HydrophobicContact CG-CZ 4.19Å; P263-F274 HydrophobicContact CB-CD1 3.83Å; P263-F274 HydrophobicContact CB-CE1 3.45Å; P263-F274 VanDerWaalsContact CB-CE1 3.45Å; P263-F274 HydrophobicContact CB-CE2 4.29Å; P263-F274 HydrophobicContact CB-CG 4.41Å; P263-F274 HydrophobicContact CB-CZ 3.71Å; P263-F274 HydrophobicContact CG-CD1 3.9Å; P263-F274 HydrophobicContact CG-CE1 3.59Å; P263-F274 HydrophobicContact CG-CZ 4.31Å; P265-F274 HydrophobicContact CG-CB 3.82Å; T271-F274 WeakPolarHBondContact O-CB 3.39Å; T271-F274 VanDerWaalsContact O-CD2 3.25Å; T271-F274 WeakPolarHBondContact O-CD2 3.32Å; T271-F274 PolarHBondContact O-N 2.73Å; W272-F274 PolarHBondContact O-N 2.88Å; F274-L276 PolarHBondContact O-N 2.92Å; F274-P280 HydrophobicContact CD1-CG 3.41Å; F274-P280 VanDerWaalsContact CD1-CG 3.41Å; F274-P280 HydrophobicContact CD2-CG 4.2Å; F274-P280 HydrophobicContact CE1-CG 3.25Å; F274-P280 HydrophobicContact CE2-CG 4.08Å; F274-P280 HydrophobicContact CG-CG 3.89Å; F274-P280 HydrophobicContact CZ-CG 3.62Å; F274-R334 PolarHBondContact O-NE 2.9Å; F274-R334 PolarHBondContact O-NH2 3.04Å
275	W	93.9	Very high	96	Very high	155 Å²	155	47.5 Å²	47.5	59%	0.587	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-61.8	-33.4	169.3	-74.4	126.5	0	0	0	112.1	Y264 P265 W272 I273 R334	Y264-W275 HydrophobicContact CD1-CZ3 4.45Å; P265-W275 VanDerWaalsContact CG-CD1 3.5Å; P265-W275 HydrophobicContact CG-CD2 3.78Å; P265-W275 HydrophobicContact CG-CG 3.7Å; P265-W275 HydrophobicContact CG-CZ2 4.25Å; W272-W275 WeakPolarHBondContact O-CB 3.39Å; W272-W275 VanDerWaalsContact O-CD1 3.27Å; W272-W275 PolarHBondContact O-N 3.41Å; I273-W275 PolarHBondContact O-N 3.42Å; I273-W275 VanDerWaalsContact O-N 3.15Å; W275-R334 WeakPolarHBondContact O-CG 3.39Å
276	L	94.8	Very high	96.2	Very high	62 Å²	62	46.8 Å²	46.8	33%	0.325	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-30.7	-168.5	-56.1	-177.9	0	0	0	113.5	I273 F274 R334 S335 P339 F340	I273-L276 PolarHBondContact O-N 3.01Å; F274-L276 PolarHBondContact O-N 2.92Å; L276-R334 CarbonylContact O-C 3.5Å; L276-R334 VanDerWaalsContact O-CA 3.31Å; L276-R334 WeakPolarHBondContact O-CA 3.29Å; L276-S335 PolarHBondContact O-N 2.8Å; L276-P339 HydrophobicContact CB-CB 4.09Å; L276-P339 HydrophobicContact CB-CG 4.31Å; L276-P339 HydrophobicContact CD1-CB 4.12Å; L276-P339 HydrophobicContact CD1-CG 4.37Å; L276-F340 HydrophobicContact CD1-CE2 4.15Å; L276-F340 HydrophobicContact CD1-CZ 4.1Å; L276-F340 HydrophobicContact CD2-CE1 4.07Å; L276-F340 HydrophobicContact CD2-CE2 4.44Å; L276-F340 HydrophobicContact CD2-CZ 3.61Å; L276-F340 HydrophobicContact CG-CZ 4.4Å
277	V	96.1	Very high	96.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-135.8	153.5	-176.2	-52.1	0	0	0	0	112.8	I273 P280 S335 P339	I273-V277 HydrophobicContact CD1-CG2 4.34Å; I273-V277 HydrophobicContact CG1-CG2 3.85Å; I273-V277 PolarHBondContact O-N 3.03Å; V277-P280 HydrophobicContact CG2-CB 3.65Å; V277-P280 HydrophobicContact CG2-CG 4.27Å; V277-S335 CarbonylContact C-O 3.54Å; V277-S335 VanDerWaalsContact CA-O 3.3Å; V277-S335 WeakPolarHBondContact CA-O 3.36Å; V277-P339 HydrophobicContact CG1-CB 4.26Å; V277-P339 HydrophobicContact CG1-CG 3.73Å
278	S	94.9	Very high	96.6	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.028	16%	0.162	C	C	.	.	S	Bend	trans	-83	-33.4	-176.8	-51.7	0	0	0	0	112.6	P280 H320 Y330 S335	S278-P280 VanDerWaalsContact C-CD 3.41Å; S278-P280 WeakPolarHBondContact O-CD 3.4Å; S278-H320 PolarHBondContact OG-ND1 3.42Å; S278-Y330 WeakPolarHBondContact CB-OH 3.25Å; S278-Y330 PolarHBondContact OG-OH 2.83Å; S278-S335 PolarHBondContact N-O 3.18Å; S278-S335 PolarHBondContact OG-O 3.05Å
279	C	95.9	Very high	96.7	Very high	1 Å²	1	32 Å²	32	1%	0.007	15%	0.149	C	C	.	.			trans	-123.7	64.3	-177.3	-55.8	0	0	0	0	112.1	N281 Y282 T283 A316 S336	C279-N281 PolarHBondContact O-N 2.56Å; C279-Y282 HydrophobicContact CB-CD2 3.54Å; C279-Y282 HydrophobicContact CB-CE2 4.13Å; C279-Y282 HydrophobicContact CB-CG 4.21Å; C279-Y282 WeakPolarHBondContact O-CB 3.31Å; C279-Y282 PolarHBondContact O-N 3.24Å; C279-T283 PolarHBondContact O-N 2.76Å; C279-T283 PolarHBondContact O-OG1 2.88Å; C279-A316 HydrophobicContact CB-CB 4.11Å; C279-S336 WeakPolarHBondContact CB-O 3.44Å; C279-S336 PolarHBondContact N-O 3.02Å
280	P	96.7	Very high	96.8	Very high	0 Å²	0	32 Å²	32	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.8	-21.4	-175.4	24.5	-31.7	0	0	0	114	I245 I273 F274 V277 S278 Y282 T283 Y284	I245-P280 HydrophobicContact CD1-CB 3.92Å; I245-P280 HydrophobicContact CD1-CG 3.66Å; I245-P280 HydrophobicContact CG1-CB 4Å; I245-P280 HydrophobicContact CG1-CG 3.95Å; I245-P280 HydrophobicContact CG2-CG 3.92Å; I273-P280 HydrophobicContact CB-CB 4.34Å; I273-P280 HydrophobicContact CG1-CB 4.32Å; I273-P280 HydrophobicContact CG2-CB 3.29Å; I273-P280 HydrophobicContact CG2-CG 4.12Å; F274-P280 HydrophobicContact CD1-CG 3.41Å; F274-P280 VanDerWaalsContact CD1-CG 3.41Å; F274-P280 HydrophobicContact CD2-CG 4.2Å; F274-P280 HydrophobicContact CE1-CG 3.25Å; F274-P280 HydrophobicContact CE2-CG 4.08Å; F274-P280 HydrophobicContact CG-CG 3.89Å; F274-P280 HydrophobicContact CZ-CG 3.62Å; V277-P280 HydrophobicContact CG2-CB 3.65Å; V277-P280 HydrophobicContact CG2-CG 4.27Å; S278-P280 VanDerWaalsContact C-CD 3.41Å; S278-P280 WeakPolarHBondContact O-CD 3.4Å; P280-Y282 PolarHBondContact O-N 3.03Å; P280-T283 WeakPolarHBondContact CA-OG1 3.41Å; P280-T283 WeakPolarHBondContact O-CB 3.42Å; P280-T283 PolarHBondContact O-N 3.16Å; P280-Y284 VanDerWaalsContact O-CD2 3.25Å; P280-Y284 WeakPolarHBondContact O-CD2 3.46Å; P280-Y284 PolarHBondContact O-N 3Å
281	N	96.9	Very high	96.9	Very high	13 Å²	13	30 Å²	30	7%	0.07	14%	0.135	C	C	.	.	H	α-helix	trans	-59	-39.7	171.2	60.1	-57.2	0	0	0	111	N242 I245 C279 E285	N242-N281 PolarHBondContact ND2-O 3.35Å; I245-N281 HydrophobicContact CB-CB 4.11Å; I245-N281 HydrophobicContact CG2-CB 3.64Å; C279-N281 PolarHBondContact O-N 2.56Å; N281-E285 VanDerWaalsContact O-CB 3.3Å; N281-E285 WeakPolarHBondContact O-CB 3.43Å; N281-E285 PolarHBondContact O-N 3.43Å
282	Y	97.5	Very high	97	Very high	47 Å²	47	29.9 Å²	29.9	18%	0.184	14%	0.135	C	C	.	.	H	α-helix	trans	-72.9	-32.7	176.1	-60.9	-27.8	0	0	0	112.5	C279 P280 E285 L286 M312 W315 A316	C279-Y282 HydrophobicContact CB-CD2 3.54Å; C279-Y282 HydrophobicContact CB-CE2 4.13Å; C279-Y282 HydrophobicContact CB-CG 4.21Å; C279-Y282 WeakPolarHBondContact O-CB 3.31Å; C279-Y282 PolarHBondContact O-N 3.24Å; P280-Y282 PolarHBondContact O-N 3.03Å; Y282-E285 PolarHBondContact O-N 3.24Å; Y282-L286 WeakPolarHBondContact O-CB 3.3Å; Y282-L286 PolarHBondContact O-N 3.33Å; Y282-M312 HydrophobicContact CD1-CG 4.23Å; Y282-M312 HydrophobicContact CD1-SD 3.92Å; Y282-M312 HydrophobicContact CD2-CB 4.41Å; Y282-M312 HydrophobicContact CG-CB 4.19Å; Y282-M312 HydrophobicContact CG-CG 4.31Å; Y282-M312 HydrophobicContact CG-SD 4.15Å; Y282-W315 HydrophobicContact CE2-CB 4.05Å; Y282-A316 HydrophobicContact CD2-CB 4.04Å
283	T	97.5	Very high	97.1	Very high	21 Å²	21	24.2 Å²	24.2	13%	0.129	12%	0.116	C	C	.	.	H	α-helix	trans	-61.5	-47.9	173.1	-41	0	0	0	0	111.4	I273 C279 P280 L286 G287 I337 L338	I273-T283 HydrophobicContact CD1-CG2 3.9Å; C279-T283 PolarHBondContact O-N 2.76Å; C279-T283 PolarHBondContact O-OG1 2.88Å; P280-T283 WeakPolarHBondContact CA-OG1 3.41Å; P280-T283 WeakPolarHBondContact O-CB 3.42Å; P280-T283 PolarHBondContact O-N 3.16Å; T283-L286 WeakPolarHBondContact O-CB 3.38Å; T283-L286 PolarHBondContact O-N 2.84Å; T283-G287 PolarHBondContact O-N 2.93Å; T283-I337 WeakPolarHBondContact CG2-O 3.37Å; T283-I337 PolarHBondContact OG1-O 3.5Å; T283-L338 HydrophobicContact CG2-CD2 4.29Å
284	Y	98.3	Very high	97.2	Very high	22 Å²	22	25.2 Å²	25.2	9%	0.086	12%	0.124	C	C	.	.	H	α-helix	trans	-69	-35.6	176.1	-76.8	-59.4	0	0	0	112.5	F237 C238 I245 F270 I273 P280 L286 G287 S288	F237-Y284 HydrophobicContact CD1-CE1 4.47Å; F237-Y284 AromaticContact CE1-CE1 3.94Å; F237-Y284 HydrophobicContact CE1-CE1 3.94Å; C238-Y284 HydrophobicContact CB-CD1 4.29Å; C238-Y284 VanDerWaalsContact CB-O 3.3Å; C238-Y284 WeakPolarHBondContact CB-O 3.46Å; C238-Y284 WeakPolarHBondContact O-CB 3.49Å; I245-Y284 HydrophobicContact CD1-CE2 4.26Å; I245-Y284 HydrophobicContact CG1-CD2 3.83Å; I245-Y284 HydrophobicContact CG1-CE2 3.92Å; F270-Y284 HydrophobicContact CD1-CE1 4.36Å; F270-Y284 WeakPolarHBondContact O-CE2 3.39Å; F270-Y284 PolarHBondContact O-OH 3.25Å; I273-Y284 HydrophobicContact CG2-CE2 3.83Å; P280-Y284 VanDerWaalsContact O-CD2 3.25Å; P280-Y284 WeakPolarHBondContact O-CD2 3.46Å; P280-Y284 PolarHBondContact O-N 3Å; Y284-L286 VanDerWaalsContact C-N 3.35Å; Y284-G287 PolarHBondContact O-N 3.46Å; Y284-S288 PolarHBondContact O-N 2.98Å; Y284-S288 PolarHBondContact O-OG 2.81Å
285	E	98.1	Very high	97.3	Very high	14 Å²	14	25.2 Å²	25.2	7%	0.065	12%	0.124	C	C	.	.	H	α-helix	trans	-58.9	-49.2	173.4	-172.6	66.7	-164.5	0	0	110.5	H171 R175 N242 N281 Y282 G287 S288 W289 M312	H171-E285 IonicContact CE1-OE1 3.43Å; H171-E285 PolarHBondContact CE1-OE1 3.1Å; H171-E285 IonicContact CE1-OE2 2.62Å; H171-E285 PolarHBondContact CE1-OE2 2.92Å; H171-E285 IonicContact NE2-OE1 3.29Å; H171-E285 PolarHBondContact NE2-OE1 3.27Å; R175-E285 IonicContact NH1-OE1 3.37Å; N242-E285 PolarHBondContact ND2-OE2 2.96Å; N281-E285 VanDerWaalsContact O-CB 3.3Å; N281-E285 WeakPolarHBondContact O-CB 3.43Å; N281-E285 PolarHBondContact O-N 3.43Å; Y282-E285 PolarHBondContact O-N 3.24Å; E285-G287 PolarHBondContact O-N 3.34Å; E285-S288 WeakPolarHBondContact O-CB 3.28Å; E285-S288 PolarHBondContact O-N 3.17Å; E285-S288 VanDerWaalsContact O-N 3.16Å; E285-W289 PolarHBondContact O-N 3.03Å; E285-W289 VanDerWaalsContact O-N 3.15Å; E285-W289 PolarHBondContact OE1-NE1 3.01Å; E285-M312 HydrophobicContact CB-CE 4.28Å; E285-M312 HydrophobicContact CB-SD 3.88Å; E285-M312 HydrophobicContact CG-CE 4.05Å; E285-M312 HydrophobicContact CG-SD 3.66Å
286	L	98.1	Very high	97.5	Very high	14 Å²	14	17.9 Å²	17.9	7%	0.073	10%	0.096	C	C	.	.	H	α-helix	trans	-56.4	-49.4	174.7	176.3	63.7	0	0	0	111.9	Y282 T283 Y284 S288 W289 I290 T305 F309 M312 L338	Y282-L286 WeakPolarHBondContact O-CB 3.3Å; Y282-L286 PolarHBondContact O-N 3.33Å; T283-L286 WeakPolarHBondContact O-CB 3.38Å; T283-L286 PolarHBondContact O-N 2.84Å; Y284-L286 VanDerWaalsContact C-N 3.35Å; L286-S288 PolarHBondContact O-N 3.15Å; L286-W289 PolarHBondContact O-N 2.63Å; L286-W289 VanDerWaalsContact O-N 3.12Å; L286-I290 HydrophobicContact CD1-CD1 4.11Å; L286-I290 HydrophobicContact CD1-CG1 4.27Å; L286-I290 HydrophobicContact CD2-CD1 4.39Å; L286-I290 HydrophobicContact CG-CD1 3.84Å; L286-I290 HydrophobicContact CG-CG1 4.39Å; L286-I290 WeakPolarHBondContact O-CG1 3.26Å; L286-I290 PolarHBondContact O-N 3.27Å; L286-T305 HydrophobicContact CD1-CG2 4.04Å; L286-F309 HydrophobicContact CD1-CB 3.7Å; L286-F309 HydrophobicContact CD1-CD2 3.84Å; L286-F309 HydrophobicContact CD1-CG 3.96Å; L286-F309 HydrophobicContact CD2-CD2 3.38Å; L286-F309 HydrophobicContact CD2-CE2 3.59Å; L286-F309 HydrophobicContact CD2-CG 4.19Å; L286-F309 HydrophobicContact CG-CD2 4.14Å; L286-M312 HydrophobicContact CB-CE 4.29Å; L286-L338 HydrophobicContact CD2-CD2 4.04Å
287	G	98.2	Very high	97.6	Very high	13 Å²	13	19.3 Å²	19.3	13%	0.134	10%	0.101	C	C	.	.	H	α-helix	trans	-59	-35.9	178.5	0	0	0	0	0	112.8	I234 C238 T283 Y284 E285 I290 G291	I234-G287 WeakPolarHBondContact CG2-O 3.35Å; C238-G287 VanDerWaalsContact SG-C 3.59Å; T283-G287 PolarHBondContact O-N 2.93Å; Y284-G287 PolarHBondContact O-N 3.46Å; E285-G287 PolarHBondContact O-N 3.34Å; G287-I290 PolarHBondContact O-N 3.08Å; G287-G291 PolarHBondContact O-N 2.84Å
288	S	98.6	Very high	97.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61	-49.7	174.1	-54.4	0	0	0	0	110.9	F235 C238 Q239 Y284 E285 L286 I290 G291 F292	F235-S288 VanDerWaalsContact CD2-O 3.28Å; F235-S288 WeakPolarHBondContact CD2-O 3.24Å; C238-S288 WeakPolarHBondContact CB-OG 3.46Å; Q239-S288 VanDerWaalsContact NE2-CB 3.3Å; Q239-S288 PolarHBondContact NE2-OG 3.03Å; Y284-S288 PolarHBondContact O-N 2.98Å; Y284-S288 PolarHBondContact O-OG 2.81Å; E285-S288 WeakPolarHBondContact O-CB 3.28Å; E285-S288 PolarHBondContact O-N 3.17Å; E285-S288 VanDerWaalsContact O-N 3.16Å; L286-S288 PolarHBondContact O-N 3.15Å; S288-I290 PolarHBondContact O-N 3.19Å; S288-G291 PolarHBondContact O-N 3.41Å; S288-F292 PolarHBondContact O-N 3.32Å
289	W	98.3	Very high	97.7	Very high	5 Å²	5	25.2 Å²	25.2	2%	0.019	14%	0.137	C	C	.	.	H	α-helix	trans	-70.1	-30.1	-179.4	-69	110	0	0	0	113.4	H171 Y172 M209 E285 L286 F292 T293 F304 T305	H171-W289 AromaticContact CD2-CZ2 3.65Å; H171-W289 AromaticContact NE2-CZ2 3.66Å; Y172-W289 HydrophobicContact CE2-CH2 4.17Å; Y172-W289 HydrophobicContact CE2-CZ2 4.42Å; M209-W289 HydrophobicContact CE-CZ3 4.42Å; M209-W289 HydrophobicContact SD-CZ3 4.18Å; E285-W289 PolarHBondContact O-N 3.03Å; E285-W289 VanDerWaalsContact O-N 3.15Å; E285-W289 PolarHBondContact OE1-NE1 3.01Å; L286-W289 PolarHBondContact O-N 2.63Å; L286-W289 VanDerWaalsContact O-N 3.12Å; W289-F292 HydrophobicContact CE3-CB 4.37Å; W289-F292 HydrophobicContact CE3-CD1 4.09Å; W289-F292 HydrophobicContact CE3-CG 4.49Å; W289-F292 AromaticContact CZ3-CD1 3.94Å; W289-F292 HydrophobicContact CZ3-CD1 3.94Å; W289-F292 HydrophobicContact CZ3-CE1 4.37Å; W289-F292 PolarHBondContact O-N 2.88Å; W289-T293 WeakPolarHBondContact O-CB 3.31Å; W289-T293 PolarHBondContact O-N 3.04Å; W289-T293 PolarHBondContact O-OG1 2.84Å; W289-F304 HydrophobicContact CD2-CD1 4.11Å; W289-F304 AromaticContact CD2-CE1 3.6Å; W289-F304 HydrophobicContact CD2-CE1 3.6Å; W289-F304 AromaticContact CE2-CE1 3.59Å; W289-F304 AromaticContact CE3-CD1 3.93Å; W289-F304 HydrophobicContact CE3-CD1 3.93Å; W289-F304 AromaticContact CE3-CE1 3.77Å; W289-F304 HydrophobicContact CE3-CE1 3.77Å; W289-F304 HydrophobicContact CG-CE1 4.19Å; W289-F304 AromaticContact CH2-CE1 3.91Å; W289-F304 HydrophobicContact CH2-CE1 3.91Å; W289-F304 AromaticContact CZ2-CE1 3.75Å; W289-F304 HydrophobicContact CZ2-CE1 3.75Å; W289-F304 HydrophobicContact CZ2-CZ 4.29Å; W289-F304 HydrophobicContact CZ3-CD1 4.18Å; W289-F304 AromaticContact CZ3-CE1 3.92Å; W289-F304 HydrophobicContact CZ3-CE1 3.92Å; W289-T305 HydrophobicContact CB-CG2 3.86Å; W289-T305 PolarHBondContact O-OG1 3.18Å
290	I	98.5	Very high	97.7	Very high	78 Å²	78	25.6 Å²	25.6	40%	0.4	14%	0.139	S	C	.	.	H	α-helix	trans	-62.8	-49.6	168.1	-69.3	171.4	0	0	0	110.2	L286 G287 S288 F292 T293 V294 T305	L286-I290 HydrophobicContact CD1-CD1 4.11Å; L286-I290 HydrophobicContact CD1-CG1 4.27Å; L286-I290 HydrophobicContact CD2-CD1 4.39Å; L286-I290 HydrophobicContact CG-CD1 3.84Å; L286-I290 HydrophobicContact CG-CG1 4.39Å; L286-I290 WeakPolarHBondContact O-CG1 3.26Å; L286-I290 PolarHBondContact O-N 3.27Å; G287-I290 PolarHBondContact O-N 3.08Å; S288-I290 PolarHBondContact O-N 3.19Å; I290-F292 VanDerWaalsContact C-N 3.29Å; I290-F292 PolarHBondContact O-N 2.83Å; I290-T293 WeakPolarHBondContact O-CB 3.36Å; I290-T293 PolarHBondContact O-N 3.06Å; I290-T293 VanDerWaalsContact O-N 3.16Å; I290-V294 HydrophobicContact CG2-CG2 4.49Å; I290-V294 WeakPolarHBondContact O-CG2 3.3Å; I290-V294 PolarHBondContact O-N 3.23Å; I290-T305 HydrophobicContact CG1-CG2 4Å
291	G	98.5	Very high	97.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-57.3	-43	176	0	0	0	0	0	112.2	G231 G287 S288 V294 M295	G231-G291 CarbonylContact C-O 3.55Å; G231-G291 VanDerWaalsContact CA-O 3.29Å; G231-G291 WeakPolarHBondContact CA-O 3.2Å; G231-G291 CarbonylContact O-C 3.59Å; G231-G291 WeakPolarHBondContact O-CA 2.88Å; G287-G291 PolarHBondContact O-N 2.84Å; S288-G291 PolarHBondContact O-N 3.41Å; G291-V294 PolarHBondContact O-N 2.84Å; G291-M295 VanDerWaalsContact O-CB 3.25Å; G291-M295 WeakPolarHBondContact O-CB 3.27Å; G291-M295 PolarHBondContact O-N 2.87Å
292	F	98.5	Very high	97.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-38.9	176.4	-162.2	-109	0	0	0	112.8	A164 C167 H168 I213 F235 S288 W289 I290 M295 T296 V301	A164-F292 HydrophobicContact CB-CE2 4.02Å; A164-F292 HydrophobicContact CB-CZ 3.95Å; A164-F292 WeakPolarHBondContact O-CE2 3.33Å; C167-F292 HydrophobicContact CB-CD2 3.97Å; C167-F292 HydrophobicContact CB-CE2 3.81Å; H168-F292 HydrophobicContact CB-CE2 4.41Å; H168-F292 HydrophobicContact CB-CZ 4.15Å; I213-F292 HydrophobicContact CD1-CE1 3.96Å; I213-F292 HydrophobicContact CD1-CZ 4.18Å; F235-F292 HydrophobicContact CD2-CB 4.02Å; F235-F292 HydrophobicContact CD2-CD2 4.27Å; F235-F292 HydrophobicContact CE2-CB 4.36Å; F235-F292 HydrophobicContact CE2-CD2 4.21Å; S288-F292 PolarHBondContact O-N 3.32Å; W289-F292 HydrophobicContact CE3-CB 4.37Å; W289-F292 HydrophobicContact CE3-CD1 4.09Å; W289-F292 HydrophobicContact CE3-CG 4.49Å; W289-F292 AromaticContact CZ3-CD1 3.94Å; W289-F292 HydrophobicContact CZ3-CD1 3.94Å; W289-F292 HydrophobicContact CZ3-CE1 4.37Å; W289-F292 PolarHBondContact O-N 2.88Å; I290-F292 VanDerWaalsContact C-N 3.29Å; I290-F292 PolarHBondContact O-N 2.83Å; F292-M295 HydrophobicContact CD2-CE 3.48Å; F292-M295 VanDerWaalsContact CD2-CE 3.48Å; F292-M295 HydrophobicContact CE2-CE 3.61Å; F292-M295 PolarHBondContact O-N 3.17Å; F292-T296 HydrophobicContact CD1-CG2 4.44Å; F292-T296 HydrophobicContact CE1-CG2 4.15Å; F292-T296 HydrophobicContact CE2-CG2 4.32Å; F292-T296 HydrophobicContact CZ-CG2 4.08Å; F292-T296 WeakPolarHBondContact O-CB 3.35Å; F292-T296 WeakPolarHBondContact O-CG2 3.25Å; F292-T296 PolarHBondContact O-N 3.49Å; F292-T296 PolarHBondContact O-OG1 3.45Å; F292-V301 HydrophobicContact CD1-CG1 3.51Å; F292-V301 HydrophobicContact CD1-CG2 4.36Å; F292-V301 HydrophobicContact CE1-CG1 4.16Å; F292-V301 HydrophobicContact CE1-CG2 4.22Å; F292-V301 HydrophobicContact CG-CG1 4.48Å
293	T	98.4	Very high	97.7	Very high	26 Å²	26	29.5 Å²	29.5	16%	0.16	16%	0.163	C	C	.	.	H	α-helix	trans	-62.5	-48.4	174.2	-60.6	0	0	0	0	111.1	W289 I290 T296 Q297 V301 A302 T305	W289-T293 WeakPolarHBondContact O-CB 3.31Å; W289-T293 PolarHBondContact O-N 3.04Å; W289-T293 PolarHBondContact O-OG1 2.84Å; I290-T293 WeakPolarHBondContact O-CB 3.36Å; I290-T293 PolarHBondContact O-N 3.06Å; I290-T293 VanDerWaalsContact O-N 3.16Å; T293-T296 PolarHBondContact O-N 2.83Å; T293-Q297 WeakPolarHBondContact O-CA 3.34Å; T293-Q297 PolarHBondContact O-N 3.46Å; T293-V301 WeakPolarHBondContact OG1-CG1 3.4Å; T293-A302 HydrophobicContact CG2-CB 3.59Å; T293-T305 PolarHBondContact OG1-OG1 2.99Å
294	V	98.3	Very high	97.6	Very high	54 Å²	54	28.9 Å²	28.9	33%	0.327	16%	0.158	S	C	.	.	H	α-helix	trans	-62.3	-44.9	177.8	172.5	0	0	0	0	110.5	Q227 I290 G291 T296	Q227-V294 HydrophobicContact CG-CG1 3.87Å; Q227-V294 WeakPolarHBondContact CG-O 3.46Å; Q227-V294 PolarHBondContact NE2-O 2.84Å; I290-V294 HydrophobicContact CG2-CG2 4.49Å; I290-V294 WeakPolarHBondContact O-CG2 3.3Å; I290-V294 PolarHBondContact O-N 3.23Å; G291-V294 PolarHBondContact O-N 2.84Å; V294-T296 PolarHBondContact O-N 2.76Å
295	M	98.1	Very high	97.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-41.4	-179.1	-175.4	179.4	69.7	0	0	112.5	V160 L163 A164 C167 P221 V228 L232 G291 F292	V160-M295 HydrophobicContact CG2-CG 4.34Å; V160-M295 VanDerWaalsContact CG2-O 3.31Å; V160-M295 WeakPolarHBondContact CG2-O 3.24Å; L163-M295 HydrophobicContact CB-SD 4.31Å; A164-M295 HydrophobicContact CB-CE 4.24Å; C167-M295 HydrophobicContact CB-CE 4.13Å; P221-M295 WeakPolarHBondContact CG-O 3.5Å; V228-M295 HydrophobicContact CG1-CG 4Å; L232-M295 HydrophobicContact CB-SD 4.05Å; L232-M295 HydrophobicContact CD1-SD 4.32Å; G291-M295 VanDerWaalsContact O-CB 3.25Å; G291-M295 WeakPolarHBondContact O-CB 3.27Å; G291-M295 PolarHBondContact O-N 2.87Å; F292-M295 HydrophobicContact CD2-CE 3.48Å; F292-M295 VanDerWaalsContact CD2-CE 3.48Å; F292-M295 HydrophobicContact CE2-CE 3.61Å; F292-M295 PolarHBondContact O-N 3.17Å
296	T	97.5	Very high	97.5	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-93.2	-20	-174.6	57.8	0	0	0	0	113.8	A164 I213 Y218 F292 T293 V294 C298	A164-T296 HydrophobicContact CB-CG2 3.82Å; I213-T296 HydrophobicContact CD1-CG2 4.04Å; I213-T296 HydrophobicContact CG1-CG2 4.39Å; Y218-T296 PolarHBondContact OH-O 2.98Å; F292-T296 HydrophobicContact CD1-CG2 4.44Å; F292-T296 HydrophobicContact CE1-CG2 4.15Å; F292-T296 HydrophobicContact CE2-CG2 4.32Å; F292-T296 HydrophobicContact CZ-CG2 4.08Å; F292-T296 WeakPolarHBondContact O-CB 3.35Å; F292-T296 WeakPolarHBondContact O-CG2 3.25Å; F292-T296 PolarHBondContact O-N 3.49Å; F292-T296 PolarHBondContact O-OG1 3.45Å; T293-T296 PolarHBondContact O-N 2.83Å; V294-T296 PolarHBondContact O-N 2.76Å; T296-C298 PolarHBondContact O-N 3.01Å
297	Q	97.4	Very high	97.3	Very high	92 Å²	92	34.5 Å²	34.5	43%	0.43	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.9	44.3	-172	-158.5	-179.4	-62.7	0	0	112.8	P221 T293	P221-Q297 HydrophobicContact CB-CB 3.98Å; P221-Q297 HydrophobicContact CG-CB 4.24Å; T293-Q297 WeakPolarHBondContact O-CA 3.34Å; T293-Q297 PolarHBondContact O-N 3.46Å
298	C	95.9	Very high	97.1	Very high	13 Å²	13	34.5 Å²	34.5	9%	0.088	19%	0.19	C	C	.	.			trans	-113.2	123.9	-171.5	-170.4	0	0	0	0	111.1	I213 T296 V301 A302	I213-C298 HydrophobicContact CG1-CB 4.21Å; T296-C298 PolarHBondContact O-N 3.01Å; C298-V301 HydrophobicContact CB-CB 4.28Å; C298-V301 HydrophobicContact CB-CG2 3.73Å; C298-V301 WeakPolarHBondContact O-CB 3.35Å; C298-V301 PolarHBondContact O-N 3.16Å; C298-A302 PolarHBondContact O-N 2.77Å; C298-A302 VanDerWaalsContact O-N 3.12Å
299	V	96	Very high	97	Very high	116 Å²	116	36.9 Å²	36.9	70%	0.703	20%	0.201	S	C	*	.	H	α-helix	trans	-58.1	-47.3	-176.3	173.2	0	0	0	0	113.1	V301 A302 F303	V299-V301 PolarHBondContact O-N 3.45Å; V299-A302 WeakPolarHBondContact O-CB 3.25Å; V299-A302 PolarHBondContact O-N 3.38Å; V299-A302 VanDerWaalsContact O-N 3.12Å; V299-F303 PolarHBondContact O-N 3.47Å
300	P	96.4	Very high	96.9	Very high	8 Å²	8	40.7 Å²	40.7	5%	0.052	22%	0.224	C	C	.	.	H	α-helix	trans	-52.7	-36.3	173	-29.7	32.9	0	0	0	114.4	W208 M209 Y212 F304	W208-P300 HydrophobicContact CD2-CB 3.86Å; W208-P300 HydrophobicContact CD2-CG 4.21Å; W208-P300 HydrophobicContact CE3-CB 4.19Å; W208-P300 HydrophobicContact CG-CB 4.18Å; W208-P300 HydrophobicContact CG-CG 4.45Å; W208-P300 HydrophobicContact CZ2-CB 4.39Å; W208-P300 HydrophobicContact CZ2-CG 4.17Å; M209-P300 HydrophobicContact CB-CB 4.31Å; Y212-P300 HydrophobicContact CD2-CG 3.58Å; Y212-P300 HydrophobicContact CE2-CG 4.12Å; Y212-P300 HydrophobicContact CG-CG 4.01Å; P300-F304 WeakPolarHBondContact O-CB 3.36Å; P300-F304 PolarHBondContact O-N 2.85Å
301	V	97.2	Very high	96.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-70.7	-43.4	178.6	-174.8	0	0	0	0	110.8	M209 I213 F292 T293 C298 V299 F303 F304 T305	M209-V301 HydrophobicContact CB-CG2 3.88Å; I213-V301 HydrophobicContact CD1-CG2 3.8Å; I213-V301 HydrophobicContact CG1-CG2 4.49Å; F292-V301 HydrophobicContact CD1-CG1 3.51Å; F292-V301 HydrophobicContact CD1-CG2 4.36Å; F292-V301 HydrophobicContact CE1-CG1 4.16Å; F292-V301 HydrophobicContact CE1-CG2 4.22Å; F292-V301 HydrophobicContact CG-CG1 4.48Å; T293-V301 WeakPolarHBondContact OG1-CG1 3.4Å; C298-V301 HydrophobicContact CB-CB 4.28Å; C298-V301 HydrophobicContact CB-CG2 3.73Å; C298-V301 WeakPolarHBondContact O-CB 3.35Å; C298-V301 PolarHBondContact O-N 3.16Å; V299-V301 PolarHBondContact O-N 3.45Å; V301-F303 VanDerWaalsContact C-N 3.34Å; V301-F303 PolarHBondContact O-N 3.37Å; V301-F304 PolarHBondContact O-N 2.88Å; V301-T305 WeakPolarHBondContact O-CB 3.45Å; V301-T305 PolarHBondContact O-N 3.12Å; V301-T305 PolarHBondContact O-OG1 2.96Å
302	A	97.5	Very high	96.5	Very high	32 Å²	32	41.4 Å²	41.4	26%	0.264	23%	0.226	S	C	.	.	H	α-helix	trans	-60.4	-45.3	175.4	0	0	0	0	0	111.2	T293 C298 V299 T305 I306	T293-A302 HydrophobicContact CG2-CB 3.59Å; C298-A302 PolarHBondContact O-N 2.77Å; C298-A302 VanDerWaalsContact O-N 3.12Å; V299-A302 WeakPolarHBondContact O-CB 3.25Å; V299-A302 PolarHBondContact O-N 3.38Å; V299-A302 VanDerWaalsContact O-N 3.12Å; A302-T305 WeakPolarHBondContact O-CB 3.39Å; A302-T305 PolarHBondContact O-N 3.3Å; A302-I306 WeakPolarHBondContact O-CG1 3.45Å; A302-I306 PolarHBondContact O-N 3.22Å
303	F	96.6	Very high	96.4	Very high	110 Å²	110	42.1 Å²	42.1	48%	0.482	23%	0.231	S	C	.	.	H	α-helix	trans	-59.7	-50.2	176.6	179.9	-90.7	0	0	0	111.7	W208 V299 V301 T305 I306 V307	W208-F303 HydrophobicContact CH2-CD1 4.17Å; W208-F303 HydrophobicContact CH2-CG 4.28Å; W208-F303 HydrophobicContact CZ3-CB 4.38Å; W208-F303 AromaticContact CZ3-CD1 3.52Å; W208-F303 HydrophobicContact CZ3-CD1 3.52Å; W208-F303 AromaticContact CZ3-CE1 3.98Å; W208-F303 HydrophobicContact CZ3-CE1 3.98Å; W208-F303 HydrophobicContact CZ3-CG 4.05Å; V299-F303 PolarHBondContact O-N 3.47Å; V301-F303 VanDerWaalsContact C-N 3.34Å; V301-F303 PolarHBondContact O-N 3.37Å; F303-T305 VanDerWaalsContact C-N 3.27Å; F303-T305 PolarHBondContact O-N 2.92Å; F303-I306 PolarHBondContact O-N 2.91Å; F303-V307 HydrophobicContact CD1-CG2 4.11Å; F303-V307 HydrophobicContact CE1-CG2 3.66Å; F303-V307 HydrophobicContact CE2-CG2 4.29Å; F303-V307 HydrophobicContact CZ-CG2 3.76Å; F303-V307 WeakPolarHBondContact O-CG2 3.49Å; F303-V307 PolarHBondContact O-N 3.47Å
304	F	95.4	Very high	96.3	Very high	8 Å²	8	45 Å²	45	4%	0.035	25%	0.248	C	C	.	.	H	α-helix	trans	-56.3	-43.3	176.2	172	-99.2	0	0	0	111.7	Y201 M209 W289 P300 V301 I306 V307 A308	Y201-F304 HydrophobicContact CE1-CE2 4.29Å; M209-F304 HydrophobicContact CE-CB 4.01Å; M209-F304 HydrophobicContact CE-CD1 3.81Å; M209-F304 HydrophobicContact CE-CD2 4.12Å; M209-F304 HydrophobicContact CE-CE1 4.33Å; M209-F304 HydrophobicContact CE-CG 3.69Å; W289-F304 HydrophobicContact CD2-CD1 4.11Å; W289-F304 AromaticContact CD2-CE1 3.6Å; W289-F304 HydrophobicContact CD2-CE1 3.6Å; W289-F304 AromaticContact CE2-CE1 3.59Å; W289-F304 AromaticContact CE3-CD1 3.93Å; W289-F304 HydrophobicContact CE3-CD1 3.93Å; W289-F304 AromaticContact CE3-CE1 3.77Å; W289-F304 HydrophobicContact CE3-CE1 3.77Å; W289-F304 HydrophobicContact CG-CE1 4.19Å; W289-F304 AromaticContact CH2-CE1 3.91Å; W289-F304 HydrophobicContact CH2-CE1 3.91Å; W289-F304 AromaticContact CZ2-CE1 3.75Å; W289-F304 HydrophobicContact CZ2-CE1 3.75Å; W289-F304 HydrophobicContact CZ2-CZ 4.29Å; W289-F304 HydrophobicContact CZ3-CD1 4.18Å; W289-F304 AromaticContact CZ3-CE1 3.92Å; W289-F304 HydrophobicContact CZ3-CE1 3.92Å; P300-F304 WeakPolarHBondContact O-CB 3.36Å; P300-F304 PolarHBondContact O-N 2.85Å; V301-F304 PolarHBondContact O-N 2.88Å; F304-I306 VanDerWaalsContact C-N 3.33Å; F304-I306 PolarHBondContact O-N 3.43Å; F304-V307 PolarHBondContact O-N 2.88Å; F304-A308 HydrophobicContact CE1-CB 4.34Å; F304-A308 HydrophobicContact CZ-CB 4.31Å; F304-A308 WeakPolarHBondContact O-CB 3.41Å; F304-A308 PolarHBondContact O-N 2.96Å
305	T	97.3	Very high	96.1	Very high	11 Å²	11	47.9 Å²	47.9	7%	0.067	25%	0.253	C	S	.	.	H	α-helix	trans	-59.1	-43.8	178.6	-58.4	0	0	0	0	111.6	L286 W289 I290 T293 V301 A302 F303 F309	L286-T305 HydrophobicContact CD1-CG2 4.04Å; W289-T305 HydrophobicContact CB-CG2 3.86Å; W289-T305 PolarHBondContact O-OG1 3.18Å; I290-T305 HydrophobicContact CG1-CG2 4Å; T293-T305 PolarHBondContact OG1-OG1 2.99Å; V301-T305 WeakPolarHBondContact O-CB 3.45Å; V301-T305 PolarHBondContact O-N 3.12Å; V301-T305 PolarHBondContact O-OG1 2.96Å; A302-T305 WeakPolarHBondContact O-CB 3.39Å; A302-T305 PolarHBondContact O-N 3.3Å; F303-T305 VanDerWaalsContact C-N 3.27Å; F303-T305 PolarHBondContact O-N 2.92Å; T305-F309 VanDerWaalsContact O-CB 3.27Å; T305-F309 WeakPolarHBondContact O-CB 3.4Å; T305-F309 PolarHBondContact O-N 3.34Å
306	I	96.8	Very high	96	Very high	110 Å²	110	47.9 Å²	47.9	56%	0.564	25%	0.253	S	S	*	.	H	α-helix	trans	-65.3	-48.3	178.1	-66.7	165	0	0	0	111	A302 F303 F304 A308 F309 V310	A302-I306 WeakPolarHBondContact O-CG1 3.45Å; A302-I306 PolarHBondContact O-N 3.22Å; F303-I306 PolarHBondContact O-N 2.91Å; F304-I306 VanDerWaalsContact C-N 3.33Å; F304-I306 PolarHBondContact O-N 3.43Å; I306-A308 PolarHBondContact O-N 3.01Å; I306-F309 WeakPolarHBondContact O-CB 3.5Å; I306-F309 PolarHBondContact O-N 3.42Å; I306-V310 WeakPolarHBondContact O-CG2 3.44Å; I306-V310 PolarHBondContact O-N 2.58Å
307	V	94.8	Very high	95.9	Very high	48 Å²	48	52.5 Å²	52.5	29%	0.291	27%	0.273	S	S	.	.	H	α-helix	trans	-64.9	-43.5	-179.4	-179.2	0	0	0	0	110.9	Y201 F303 F304 F309 V310 Q311	Y201-V307 HydrophobicContact CE2-CG1 3.99Å; Y201-V307 WeakPolarHBondContact OH-CG1 3.19Å; F303-V307 HydrophobicContact CD1-CG2 4.11Å; F303-V307 HydrophobicContact CE1-CG2 3.66Å; F303-V307 HydrophobicContact CE2-CG2 4.29Å; F303-V307 HydrophobicContact CZ-CG2 3.76Å; F303-V307 WeakPolarHBondContact O-CG2 3.49Å; F303-V307 PolarHBondContact O-N 3.47Å; F304-V307 PolarHBondContact O-N 2.88Å; V307-F309 VanDerWaalsContact C-N 3.31Å; V307-F309 PolarHBondContact O-N 3.37Å; V307-V310 PolarHBondContact O-N 3.2Å; V307-Q311 PolarHBondContact O-N 2.85Å
308	A	93.4	Very high	95.7	Very high	13 Å²	13	49.6 Å²	49.6	11%	0.107	27%	0.268	C	S	.	.	H	α-helix	trans	-60.4	-40.8	174.9	0	0	0	0	0	111.6	F304 I306 Q311 M312	F304-A308 HydrophobicContact CE1-CB 4.34Å; F304-A308 HydrophobicContact CZ-CB 4.31Å; F304-A308 WeakPolarHBondContact O-CB 3.41Å; F304-A308 PolarHBondContact O-N 2.96Å; I306-A308 PolarHBondContact O-N 3.01Å; A308-Q311 PolarHBondContact O-N 2.78Å; A308-M312 HydrophobicContact CB-CE 4.35Å; A308-M312 WeakPolarHBondContact O-CB 3.3Å; A308-M312 VanDerWaalsContact O-CG 3.3Å; A308-M312 WeakPolarHBondContact O-CG 3.19Å; A308-M312 PolarHBondContact O-N 2.78Å
309	F	96.1	Very high	95.5	Very high	49 Å²	49	52.7 Å²	52.7	22%	0.215	28%	0.28	C	S	.	.	H	α-helix	trans	-59.8	-48.1	175.6	176.3	-125.4	0	0	0	112.3	L286 T305 I306 V307 Q311 M312 T313 I337 L338 L342	L286-F309 HydrophobicContact CD1-CB 3.7Å; L286-F309 HydrophobicContact CD1-CD2 3.84Å; L286-F309 HydrophobicContact CD1-CG 3.96Å; L286-F309 HydrophobicContact CD2-CD2 3.38Å; L286-F309 HydrophobicContact CD2-CE2 3.59Å; L286-F309 HydrophobicContact CD2-CG 4.19Å; L286-F309 HydrophobicContact CG-CD2 4.14Å; T305-F309 VanDerWaalsContact O-CB 3.27Å; T305-F309 WeakPolarHBondContact O-CB 3.4Å; T305-F309 PolarHBondContact O-N 3.34Å; I306-F309 WeakPolarHBondContact O-CB 3.5Å; I306-F309 PolarHBondContact O-N 3.42Å; V307-F309 VanDerWaalsContact C-N 3.31Å; V307-F309 PolarHBondContact O-N 3.37Å; F309-Q311 VanDerWaalsContact C-N 3.35Å; F309-Q311 PolarHBondContact O-N 3.24Å; F309-M312 PolarHBondContact O-N 2.92Å; F309-T313 WeakPolarHBondContact CE2-OG1 3.43Å; F309-T313 VanDerWaalsContact O-CB 3.32Å; F309-T313 WeakPolarHBondContact O-CB 3.47Å; F309-T313 PolarHBondContact O-N 3.23Å; F309-T313 PolarHBondContact O-OG1 2.86Å; F309-I337 HydrophobicContact CD2-CD1 4.3Å; F309-I337 HydrophobicContact CE2-CD1 4.19Å; F309-I337 HydrophobicContact CE2-CG2 4.43Å; F309-L338 HydrophobicContact CE2-CD1 3.9Å; F309-L338 HydrophobicContact CE2-CG 4.16Å; F309-L338 HydrophobicContact CZ-CD1 3.64Å; F309-L338 HydrophobicContact CZ-CG 4.34Å; F309-L342 HydrophobicContact CZ-CD1 4.26Å
310	V	95.4	Very high	95.4	Very high	85 Å²	85	48.5 Å²	48.5	52%	0.515	25%	0.252	S	S	.	.	H	α-helix	trans	-59.2	-48.7	178	172	0	0	0	0	110.2	I306 V307 M312 T313 V314	I306-V310 WeakPolarHBondContact O-CG2 3.44Å; I306-V310 PolarHBondContact O-N 2.58Å; V307-V310 PolarHBondContact O-N 3.2Å; V310-M312 PolarHBondContact O-N 2.87Å; V310-T313 WeakPolarHBondContact O-CB 3.36Å; V310-T313 PolarHBondContact O-N 2.94Å; V310-V314 WeakPolarHBondContact O-CG2 3.43Å; V310-V314 PolarHBondContact O-N 3.2Å
311	Q	94	Very high	95.3	Very high	80 Å²	80	55.4 Å²	55.4	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-62.6	-46.1	-179.3	-174	58.4	48	0	0	112.3	V307 A308 F309 T313 V314 W315	V307-Q311 PolarHBondContact O-N 2.85Å; A308-Q311 PolarHBondContact O-N 2.78Å; F309-Q311 VanDerWaalsContact C-N 3.35Å; F309-Q311 PolarHBondContact O-N 3.24Å; Q311-T313 VanDerWaalsContact C-N 3.29Å; Q311-T313 PolarHBondContact O-N 3.18Å; Q311-V314 PolarHBondContact O-N 3.42Å; Q311-W315 HydrophobicContact CG-CD2 4.29Å; Q311-W315 HydrophobicContact CG-CE3 4.37Å; Q311-W315 HydrophobicContact CG-CH2 3.77Å; Q311-W315 HydrophobicContact CG-CZ2 3.67Å; Q311-W315 HydrophobicContact CG-CZ3 4.12Å; Q311-W315 PolarHBondContact O-N 3.37Å; Q311-W315 VanDerWaalsContact O-N 3.15Å
312	M	95.7	Very high	95	Very high	14 Å²	14	57.6 Å²	57.6	7%	0.069	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-35.4	177	-73.7	-170.1	-69.3	0	0	112.1	Y282 E285 L286 A308 F309 V310 W315 A316 I337	Y282-M312 HydrophobicContact CD1-CG 4.23Å; Y282-M312 HydrophobicContact CD1-SD 3.92Å; Y282-M312 HydrophobicContact CD2-CB 4.41Å; Y282-M312 HydrophobicContact CG-CB 4.19Å; Y282-M312 HydrophobicContact CG-CG 4.31Å; Y282-M312 HydrophobicContact CG-SD 4.15Å; E285-M312 HydrophobicContact CB-CE 4.28Å; E285-M312 HydrophobicContact CB-SD 3.88Å; E285-M312 HydrophobicContact CG-CE 4.05Å; E285-M312 HydrophobicContact CG-SD 3.66Å; L286-M312 HydrophobicContact CB-CE 4.29Å; A308-M312 HydrophobicContact CB-CE 4.35Å; A308-M312 WeakPolarHBondContact O-CB 3.3Å; A308-M312 VanDerWaalsContact O-CG 3.3Å; A308-M312 WeakPolarHBondContact O-CG 3.19Å; A308-M312 PolarHBondContact O-N 2.78Å; F309-M312 PolarHBondContact O-N 2.92Å; V310-M312 PolarHBondContact O-N 2.87Å; M312-W315 HydrophobicContact CG-CE3 4.41Å; M312-W315 PolarHBondContact O-N 3.43Å; M312-A316 VanDerWaalsContact O-CB 3.26Å; M312-A316 WeakPolarHBondContact O-CB 3.11Å; M312-A316 PolarHBondContact O-N 2.82Å; M312-I337 HydrophobicContact CB-CD1 4.01Å
313	T	95.8	Very high	94.7	Very high	15 Å²	15	57.4 Å²	57.4	9%	0.092	29%	0.286	C	S	.	.	H	α-helix	trans	-63.9	-43.6	175.5	-61.4	0	0	0	0	111.3	F309 V310 Q311 W315 A316 K317 I337 L342	F309-T313 WeakPolarHBondContact CE2-OG1 3.43Å; F309-T313 VanDerWaalsContact O-CB 3.32Å; F309-T313 WeakPolarHBondContact O-CB 3.47Å; F309-T313 PolarHBondContact O-N 3.23Å; F309-T313 PolarHBondContact O-OG1 2.86Å; V310-T313 WeakPolarHBondContact O-CB 3.36Å; V310-T313 PolarHBondContact O-N 2.94Å; Q311-T313 VanDerWaalsContact C-N 3.29Å; Q311-T313 PolarHBondContact O-N 3.18Å; T313-W315 VanDerWaalsContact C-N 3.32Å; T313-W315 PolarHBondContact O-N 3.14Å; T313-A316 PolarHBondContact O-N 2.96Å; T313-K317 HydrophobicContact CG2-CD 4.08Å; T313-K317 HydrophobicContact CG2-CG 4.39Å; T313-K317 WeakPolarHBondContact O-CB 3.31Å; T313-K317 WeakPolarHBondContact O-CG 3.36Å; T313-K317 PolarHBondContact O-N 3.49Å; T313-I337 HydrophobicContact CG2-CG2 4.21Å; T313-L342 HydrophobicContact CG2-CD1 4.34Å
314	V	95.9	Very high	94.5	Very high	86 Å²	86	56 Å²	56	52%	0.521	28%	0.283	S	S	.	.	H	α-helix	trans	-58.5	-46	175.3	172.7	0	0	0	0	110.7	V310 Q311 G318	V310-V314 WeakPolarHBondContact O-CG2 3.43Å; V310-V314 PolarHBondContact O-N 3.2Å; Q311-V314 PolarHBondContact O-N 3.42Å; V314-G318 PolarHBondContact O-N 3Å; V314-G318 VanDerWaalsContact O-N 3.07Å
315	W	94.8	Very high	94.3	Very high	114 Å²	114	64.4 Å²	64.4	43%	0.432	32%	0.319	S	S	.	.	H	α-helix	trans	-65	-42.9	176.5	-66.6	-24.5	0	0	0	112.8	Y282 Q311 M312 T313 G318 K319	Y282-W315 HydrophobicContact CE2-CB 4.05Å; Q311-W315 HydrophobicContact CG-CD2 4.29Å; Q311-W315 HydrophobicContact CG-CE3 4.37Å; Q311-W315 HydrophobicContact CG-CH2 3.77Å; Q311-W315 HydrophobicContact CG-CZ2 3.67Å; Q311-W315 HydrophobicContact CG-CZ3 4.12Å; Q311-W315 PolarHBondContact O-N 3.37Å; Q311-W315 VanDerWaalsContact O-N 3.15Å; M312-W315 HydrophobicContact CG-CE3 4.41Å; M312-W315 PolarHBondContact O-N 3.43Å; T313-W315 VanDerWaalsContact C-N 3.32Å; T313-W315 PolarHBondContact O-N 3.14Å; W315-G318 PolarHBondContact O-N 3.47Å; W315-K319 PolarHBondContact O-N 3.2Å
316	A	95.6	Very high	94	Very high	0 Å²	0	68 Å²	68	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-47.2	178.4	0	0	0	0	0	111.5	C279 Y282 M312 T313 G318 K319 H320 I337	C279-A316 HydrophobicContact CB-CB 4.11Å; Y282-A316 HydrophobicContact CD2-CB 4.04Å; M312-A316 VanDerWaalsContact O-CB 3.26Å; M312-A316 WeakPolarHBondContact O-CB 3.11Å; M312-A316 PolarHBondContact O-N 2.82Å; T313-A316 PolarHBondContact O-N 2.96Å; A316-G318 VanDerWaalsContact C-N 3.31Å; A316-G318 PolarHBondContact O-N 3.22Å; A316-K319 PolarHBondContact O-N 3.06Å; A316-H320 VanDerWaalsContact O-CB 3.32Å; A316-H320 WeakPolarHBondContact O-CB 3.35Å; A316-H320 PolarHBondContact O-N 3.2Å; A316-I337 HydrophobicContact CB-CB 3.82Å; A316-I337 HydrophobicContact CB-CG2 4.49Å
317	K	95.1	Very high	93.8	Very high	98 Å²	98	64.9 Å²	64.9	43%	0.426	32%	0.317	S	S	.	.	H	α-helix	trans	-62.9	-37.4	176.4	-70.1	-179.7	77.8	165.2	0	111.9	T313 R321 S336	T313-K317 HydrophobicContact CG2-CD 4.08Å; T313-K317 HydrophobicContact CG2-CG 4.39Å; T313-K317 WeakPolarHBondContact O-CB 3.31Å; T313-K317 WeakPolarHBondContact O-CG 3.36Å; T313-K317 PolarHBondContact O-N 3.49Å; K317-R321 WeakPolarHBondContact O-CB 3.36Å; K317-R321 VanDerWaalsContact O-CG 3.25Å; K317-R321 WeakPolarHBondContact O-CG 3.41Å; K317-R321 PolarHBondContact O-N 3.31Å; K317-R321 PolarHBondContact O-NE 3.26Å; K317-S336 WeakPolarHBondContact CG-OG 3.3Å
318	G	94.1	Very high	93.5	Very high	31 Å²	31	73.6 Å²	73.6	32%	0.32	35%	0.345	S	S	.	.	H	α-helix	trans	-59.1	-49.1	171.9	0	0	0	0	0	112.2	V314 W315 A316 R321 S322	V314-G318 PolarHBondContact O-N 3Å; V314-G318 VanDerWaalsContact O-N 3.07Å; W315-G318 PolarHBondContact O-N 3.47Å; A316-G318 VanDerWaalsContact C-N 3.31Å; A316-G318 PolarHBondContact O-N 3.22Å; G318-R321 PolarHBondContact O-N 2.91Å; G318-S322 PolarHBondContact O-N 3.45Å
319	K	92.1	Very high	93.4	Very high	79 Å²	79	78.8 Å²	78.8	34%	0.343	37%	0.371	S	S	.	.	H	α-helix	trans	-66.7	-44.8	-179.1	-144.3	177	-162.1	173.8	0	112.3	W315 A316 R321 S322 Y323	W315-K319 PolarHBondContact O-N 3.2Å; A316-K319 PolarHBondContact O-N 3.06Å; K319-R321 PolarHBondContact O-N 2.9Å; K319-S322 WeakPolarHBondContact O-CB 3.27Å; K319-S322 PolarHBondContact O-N 3.26Å; K319-S322 VanDerWaalsContact O-N 3.14Å; K319-Y323 HydrophobicContact CG-CE2 4.24Å; K319-Y323 PolarHBondContact O-N 3.05Å
320	H	93.8	Very high	93.2	Very high	28 Å²	28	76.9 Å²	76.9	13%	0.13	36%	0.362	C	S	.	.	H	α-helix	trans	-58.8	-47.3	176.3	-179.6	72.6	0	0	0	111.8	S278 A316 S322 Y323 L324 Y330 R334	S278-H320 PolarHBondContact OG-ND1 3.42Å; A316-H320 VanDerWaalsContact O-CB 3.32Å; A316-H320 WeakPolarHBondContact O-CB 3.35Å; A316-H320 PolarHBondContact O-N 3.2Å; H320-S322 VanDerWaalsContact C-N 3.3Å; H320-S322 PolarHBondContact O-N 2.92Å; H320-Y323 PolarHBondContact O-N 2.95Å; H320-Y323 VanDerWaalsContact O-N 3.09Å; H320-L324 WeakPolarHBondContact NE2-CD1 3.4Å; H320-L324 PolarHBondContact O-N 3.04Å; H320-Y330 AromaticContact CE1-CE1 3.81Å; H320-Y330 AromaticContact ND1-CE1 3.81Å; H320-R334 PolarHBondContact CE1-O 2.95Å
321	R	93.1	Very high	93	Very high	152 Å²	152	74.5 Å²	74.5	57%	0.574	35%	0.349	S	S	*	.	H	α-helix	trans	-61.4	-36.4	174.4	-73.7	-176.1	-64.5	-172.4	1.8	112.8	K317 G318 K319 Y323 K325	K317-R321 WeakPolarHBondContact O-CB 3.36Å; K317-R321 VanDerWaalsContact O-CG 3.25Å; K317-R321 WeakPolarHBondContact O-CG 3.41Å; K317-R321 PolarHBondContact O-N 3.31Å; K317-R321 PolarHBondContact O-NE 3.26Å; G318-R321 PolarHBondContact O-N 2.91Å; K319-R321 PolarHBondContact O-N 2.9Å; R321-Y323 VanDerWaalsContact C-N 3.33Å; R321-K325 WeakPolarHBondContact O-CG 3.4Å; R321-K325 PolarHBondContact O-N 3.42Å
322	S	91.6	Very high	92.5	Very high	47 Å²	47	76.5 Å²	76.5	33%	0.329	37%	0.367	S	S	.	.	H	α-helix	trans	-63.2	-41.4	173.8	-171.8	0	0	0	0	111.3	G318 K319 H320 K325 E326	G318-S322 PolarHBondContact O-N 3.45Å; K319-S322 WeakPolarHBondContact O-CB 3.27Å; K319-S322 PolarHBondContact O-N 3.26Å; K319-S322 VanDerWaalsContact O-N 3.14Å; H320-S322 VanDerWaalsContact C-N 3.3Å; H320-S322 PolarHBondContact O-N 2.92Å; S322-K325 PolarHBondContact O-N 3.47Å; S322-E326 WeakPolarHBondContact O-CB 3.35Å; S322-E326 PolarHBondContact O-N 3.5Å
323	Y	92.2	Very high	92	Very high	28 Å²	28	83 Å²	83	11%	0.11	40%	0.401	C	S	.	.	H	α-helix	trans	-65.2	-45.1	178.5	-73.6	-44.6	0	0	0	112.7	K319 H320 R321 K325 E326 F327 Y330	K319-Y323 HydrophobicContact CG-CE2 4.24Å; K319-Y323 PolarHBondContact O-N 3.05Å; H320-Y323 PolarHBondContact O-N 2.95Å; H320-Y323 VanDerWaalsContact O-N 3.09Å; R321-Y323 VanDerWaalsContact C-N 3.33Å; Y323-K325 VanDerWaalsContact C-N 3.25Å; Y323-K325 PolarHBondContact O-N 3.29Å; Y323-E326 PolarHBondContact O-N 2.95Å; Y323-F327 AromaticContact CD1-CD2 3.81Å; Y323-F327 HydrophobicContact CD1-CD2 3.81Å; Y323-F327 AromaticContact CD1-CE2 3.64Å; Y323-F327 HydrophobicContact CD1-CE2 3.64Å; Y323-F327 HydrophobicContact CE1-CE2 4.09Å; Y323-F327 PolarHBondContact O-N 3.48Å; Y323-Y330 VanDerWaalsContact CB-CE2 3.48Å; Y323-Y330 HydrophobicContact CD1-CE2 4.5Å; Y323-Y330 AromaticContact CD2-CE2 3.88Å; Y323-Y330 HydrophobicContact CD2-CE2 3.88Å; Y323-Y330 HydrophobicContact CG-CD2 4.26Å; Y323-Y330 AromaticContact CG-CE2 3.74Å; Y323-Y330 HydrophobicContact CG-CE2 3.74Å
324	L	91.7	Very high	91.9	Very high	81 Å²	81	82.5 Å²	82.5	42%	0.424	40%	0.397	S	S	.	.	H	α-helix	trans	-59.5	-34.6	176.6	-72.8	170.5	0	0	0	113.2	H320 Y330	H320-L324 WeakPolarHBondContact NE2-CD1 3.4Å; H320-L324 PolarHBondContact O-N 3.04Å; L324-Y330 HydrophobicContact CD2-CD1 3.76Å; L324-Y330 HydrophobicContact CG-CD1 4.24Å
325	K	91.6	Very high	91.8	Very high	184 Å²	184	79.2 Å²	79.2	80%	0.8	38%	0.378	S	S	*	.	H	α-helix	trans	-78.2	-35.7	178.4	-72.2	179.3	179.6	-170.2	0	113.1	R321 S322 Y323	R321-K325 WeakPolarHBondContact O-CG 3.4Å; R321-K325 PolarHBondContact O-N 3.42Å; S322-K325 PolarHBondContact O-N 3.47Å; Y323-K325 VanDerWaalsContact C-N 3.25Å; Y323-K325 PolarHBondContact O-N 3.29Å
326	E	90.3	Very high	91.7	Very high	87 Å²	87	73.8 Å²	73.8	41%	0.407	36%	0.358	S	S	.	.	H	α-helix	trans	-88.9	-31.6	-171	-170.4	172.4	167	0	0	112.6	K260 S322 Y323	K260-E326 WeakPolarHBondContact CD-OE1 3.34Å; K260-E326 WeakPolarHBondContact CD-OE2 3.21Å; K260-E326 IonicContact NZ-OE1 3.03Å; K260-E326 IonicContact NZ-OE2 3.94Å; K260-E326 PolarHBondContact NZ-OE2 3Å; S322-E326 WeakPolarHBondContact O-CB 3.35Å; S322-E326 PolarHBondContact O-N 3.5Å; Y323-E326 PolarHBondContact O-N 2.95Å
327	F	91.8	Very high	91.6	Very high	43 Å²	43	73.8 Å²	73.8	19%	0.189	36%	0.358	C	S	.	.			trans	-119.6	112.8	-176.3	-58.7	-80.9	0	0	0	110.9	K260 I262 Y323 D329 Y330	K260-F327 HydrophobicContact CB-CE2 4.4Å; K260-F327 HydrophobicContact CB-CZ 3.86Å; K260-F327 WeakPolarHBondContact O-CZ 3.37Å; I262-F327 HydrophobicContact CD1-CB 3.58Å; I262-F327 HydrophobicContact CD1-CD1 3.98Å; I262-F327 HydrophobicContact CD1-CD2 4.38Å; I262-F327 HydrophobicContact CD1-CG 3.72Å; I262-F327 HydrophobicContact CG1-CB 4Å; I262-F327 HydrophobicContact CG1-CD1 3.84Å; I262-F327 HydrophobicContact CG1-CD2 3.82Å; I262-F327 HydrophobicContact CG1-CE1 4.29Å; I262-F327 HydrophobicContact CG1-CE2 4.29Å; I262-F327 HydrophobicContact CG1-CG 3.59Å; Y323-F327 AromaticContact CD1-CD2 3.81Å; Y323-F327 HydrophobicContact CD1-CD2 3.81Å; Y323-F327 AromaticContact CD1-CE2 3.64Å; Y323-F327 HydrophobicContact CD1-CE2 3.64Å; Y323-F327 HydrophobicContact CE1-CE2 4.09Å; Y323-F327 PolarHBondContact O-N 3.48Å; F327-D329 PolarHBondContact O-N 3.03Å; F327-Y330 WeakPolarHBondContact O-CB 3.31Å; F327-Y330 PolarHBondContact O-N 2.89Å
328	R	90.1	Very high	91.4	Very high	232 Å²	232	71 Å²	71	88%	0.875	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-35.6	176.3	-165.8	-178.5	72.8	164.8	1.9	112.3	Y330	R328-Y330 VanDerWaalsContact C-N 3.3Å; R328-Y330 PolarHBondContact O-N 2.87Å
329	D	90.4	Very high	91	Very high	121 Å²	121	71.2 Å²	71.2	65%	0.647	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	21.8	-176.1	-48.3	-35.7	0	0	0	112.5	F327	F327-D329 PolarHBondContact O-N 3.03Å
330	Y	92.4	Very high	90.5	Very high	9 Å²	9	75.1 Å²	75.1	4%	0.035	36%	0.36	C	S	.	.			trans	-68.5	134.3	178.5	-168.3	-101.4	0	0	0	111.6	I262 S278 H320 Y323 L324 F327 R328 T332 R334	I262-Y330 HydrophobicContact CD1-CD2 3.94Å; I262-Y330 HydrophobicContact CG1-CD2 3.92Å; I262-Y330 HydrophobicContact CG1-CE2 4.48Å; I262-Y330 HydrophobicContact CG2-CD2 3.89Å; I262-Y330 HydrophobicContact CG2-CE2 3.83Å; S278-Y330 WeakPolarHBondContact CB-OH 3.25Å; S278-Y330 PolarHBondContact OG-OH 2.83Å; H320-Y330 AromaticContact CE1-CE1 3.81Å; H320-Y330 AromaticContact ND1-CE1 3.81Å; Y323-Y330 VanDerWaalsContact CB-CE2 3.48Å; Y323-Y330 HydrophobicContact CD1-CE2 4.5Å; Y323-Y330 AromaticContact CD2-CE2 3.88Å; Y323-Y330 HydrophobicContact CD2-CE2 3.88Å; Y323-Y330 HydrophobicContact CG-CD2 4.26Å; Y323-Y330 AromaticContact CG-CE2 3.74Å; Y323-Y330 HydrophobicContact CG-CE2 3.74Å; L324-Y330 HydrophobicContact CD2-CD1 3.76Å; L324-Y330 HydrophobicContact CG-CD1 4.24Å; F327-Y330 WeakPolarHBondContact O-CB 3.31Å; F327-Y330 PolarHBondContact O-N 2.89Å; R328-Y330 VanDerWaalsContact C-N 3.3Å; R328-Y330 PolarHBondContact O-N 2.87Å; Y330-T332 PolarHBondContact O-N 2.94Å; Y330-T332 VanDerWaalsContact O-N 3.14Å; Y330-R334 HydrophobicContact CE1-CB 4.24Å; Y330-R334 WeakPolarHBondContact OH-CD 3.34Å
331	P	90.1	Very high	89.9	Confident	35 Å²	35	79.9 Å²	79.9	23%	0.227	39%	0.385	C	S	.	.			trans	-62.3	117.1	179.3	-23.6	34.5	0	0	0	112.4	Y264 L333 R334	Y264-P331 HydrophobicContact CE1-CG 4Å; P331-L333 PolarHBondContact O-N 3.39Å; P331-R334 HydrophobicContact CB-CG 4.09Å; P331-R334 PolarHBondContact O-N 2.9Å
332	T	83.6	Confident	88.6	Confident	123 Å²	123	76.1 Å²	76.1	76%	0.755	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-25.4	-174.5	52.9	0	0	0	0	113.8	Y330 R334	Y330-T332 PolarHBondContact O-N 2.94Å; Y330-T332 VanDerWaalsContact O-N 3.14Å; T332-R334 PolarHBondContact O-N 3.15Å
333	L	86.2	Confident	88.5	Confident	150 Å²	150	77.6 Å²	77.6	79%	0.785	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-9.4	178.7	-70	170	0	0	0	113.7	P331 S335	P331-L333 PolarHBondContact O-N 3.39Å; L333-S335 PolarHBondContact O-N 2.88Å
334	R	93.1	Very high	88.3	Confident	5 Å²	5	80.2 Å²	80.2	2%	0.019	39%	0.393	C	S	.	.			trans	-71.1	131	179	-75.7	176.3	-177.9	-168.3	-2.5	110.8	P263 F274 W275 L276 H320 Y330 P331 T332	P263-R334 VanDerWaalsContact O-CZ 3.3Å; P263-R334 PolarHBondContact O-NH1 3.33Å; P263-R334 PolarHBondContact O-NH2 3.06Å; F274-R334 PolarHBondContact O-NE 2.9Å; F274-R334 PolarHBondContact O-NH2 3.04Å; W275-R334 WeakPolarHBondContact O-CG 3.39Å; L276-R334 CarbonylContact O-C 3.5Å; L276-R334 VanDerWaalsContact O-CA 3.31Å; L276-R334 WeakPolarHBondContact O-CA 3.29Å; H320-R334 PolarHBondContact CE1-O 2.95Å; Y330-R334 HydrophobicContact CE1-CB 4.24Å; Y330-R334 WeakPolarHBondContact OH-CD 3.34Å; P331-R334 HydrophobicContact CB-CG 4.09Å; P331-R334 PolarHBondContact O-N 2.9Å; T332-R334 PolarHBondContact O-N 3.15Å
335	S	93.8	Very high	88.1	Confident	17 Å²	17	80.2 Å²	80.2	12%	0.119	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-81.2	171.6	165	-45.4	0	0	0	0	110.7	L276 V277 S278 L333 L338 F340 L342	L276-S335 PolarHBondContact O-N 2.8Å; V277-S335 CarbonylContact C-O 3.54Å; V277-S335 VanDerWaalsContact CA-O 3.3Å; V277-S335 WeakPolarHBondContact CA-O 3.36Å; S278-S335 PolarHBondContact N-O 3.18Å; S278-S335 PolarHBondContact OG-O 3.05Å; L333-S335 PolarHBondContact O-N 2.88Å; S335-L338 WeakPolarHBondContact CB-O 3.33Å; S335-L338 PolarHBondContact OG-O 3.3Å; S335-F340 PolarHBondContact OG-N 3.5Å; S335-L342 WeakPolarHBondContact CB-O 3.39Å
336	S	93.4	Very high	87.9	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	37%	0.367	C	S	.	.	S	Bend	trans	-78.4	-44.9	-178.8	70	0	0	0	0	112.9	C279 K317 L342	C279-S336 WeakPolarHBondContact CB-O 3.44Å; C279-S336 PolarHBondContact N-O 3.02Å; K317-S336 WeakPolarHBondContact CG-OG 3.3Å; S336-L342 VanDerWaalsContact CB-OXT 3.22Å; S336-L342 WeakPolarHBondContact CB-OXT 3Å; S336-L342 PolarHBondContact N-O 3.42Å; S336-L342 PolarHBondContact N-OXT 3.33Å; S336-L342 PolarHBondContact OG-O 3.42Å; S336-L342 PolarHBondContact OG-OXT 2.9Å
337	I	93.5	Very high	87.7	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	37%	0.365	C	S	.	.	S	Bend	trans	-139.5	-40.5	-174.2	-171.9	169.7	0	0	0	113.8	T283 F309 M312 T313 A316 L342	T283-I337 WeakPolarHBondContact CG2-O 3.37Å; T283-I337 PolarHBondContact OG1-O 3.5Å; F309-I337 HydrophobicContact CD2-CD1 4.3Å; F309-I337 HydrophobicContact CE2-CD1 4.19Å; F309-I337 HydrophobicContact CE2-CG2 4.43Å; M312-I337 HydrophobicContact CB-CD1 4.01Å; T313-I337 HydrophobicContact CG2-CG2 4.21Å; A316-I337 HydrophobicContact CB-CB 3.82Å; A316-I337 HydrophobicContact CB-CG2 4.49Å; I337-L342 HydrophobicContact CG2-CB 4.04Å; I337-L342 PolarHBondContact N-O 3.49Å
338	L	90.6	Very high	87.5	Confident	40 Å²	40	75.3 Å²	75.3	21%	0.209	38%	0.376	C	S	.	.	S	Bend	trans	-114.5	125.5	-178.9	-73.1	-177.3	0	0	0	109.5	T283 L286 F309 S335 F340 I341 L342	T283-L338 HydrophobicContact CG2-CD2 4.29Å; L286-L338 HydrophobicContact CD2-CD2 4.04Å; F309-L338 HydrophobicContact CE2-CD1 3.9Å; F309-L338 HydrophobicContact CE2-CG 4.16Å; F309-L338 HydrophobicContact CZ-CD1 3.64Å; F309-L338 HydrophobicContact CZ-CG 4.34Å; S335-L338 WeakPolarHBondContact CB-O 3.33Å; S335-L338 PolarHBondContact OG-O 3.3Å; L338-F340 PolarHBondContact O-N 3.29Å; L338-I341 HydrophobicContact CB-CB 4.11Å; L338-I341 PolarHBondContact O-N 3.38Å; L338-L342 PolarHBondContact N-O 3.3Å; L338-L342 PolarHBondContact O-N 3.17Å
339	P	85.1	Confident	87.3	Confident	35 Å²	35	64.1 Å²	64.1	23%	0.227	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	128.4	-179.5	-24.2	31.9	0	0	0	111.5	L276 V277 I341	L276-P339 HydrophobicContact CB-CB 4.09Å; L276-P339 HydrophobicContact CB-CG 4.31Å; L276-P339 HydrophobicContact CD1-CB 4.12Å; L276-P339 HydrophobicContact CD1-CG 4.37Å; V277-P339 HydrophobicContact CG1-CB 4.26Å; V277-P339 HydrophobicContact CG1-CG 3.73Å; P339-I341 PolarHBondContact O-N 3.42Å
340	F	82.1	Confident	87	Confident	161 Å²	161	59.7 Å²	59.7	71%	0.706	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	5.1	174.5	-40.6	-70.1	0	0	0	116.1	L276 S335 L338	L276-F340 HydrophobicContact CD1-CE2 4.15Å; L276-F340 HydrophobicContact CD1-CZ 4.1Å; L276-F340 HydrophobicContact CD2-CE1 4.07Å; L276-F340 HydrophobicContact CD2-CE2 4.44Å; L276-F340 HydrophobicContact CD2-CZ 3.61Å; L276-F340 HydrophobicContact CG-CZ 4.4Å; S335-F340 PolarHBondContact OG-N 3.5Å; L338-F340 PolarHBondContact O-N 3.29Å
341	I	81.9	Confident	86.6	Confident	128 Å²	128	63.9 Å²	63.9	66%	0.656	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-56.8	-177.1	-61.4	168.2	0	0	0	110.9	L338 P339	L338-I341 HydrophobicContact CB-CB 4.11Å; L338-I341 PolarHBondContact O-N 3.38Å; P339-I341 PolarHBondContact O-N 3.42Å
342	L	65.8	Low	86.3	Confident	73 Å²	73	66.5 Å²	66.5	38%	0.382	35%	0.351	S	S	.	.			trans	-142.1	0	-169.1	-84.2	167.5	0	0	0	113	F309 T313 S335 S336 I337 L338	F309-L342 HydrophobicContact CZ-CD1 4.26Å; T313-L342 HydrophobicContact CG2-CD1 4.34Å; S335-L342 WeakPolarHBondContact CB-O 3.39Å; S336-L342 VanDerWaalsContact CB-OXT 3.22Å; S336-L342 WeakPolarHBondContact CB-OXT 3Å; S336-L342 PolarHBondContact N-O 3.42Å; S336-L342 PolarHBondContact N-OXT 3.33Å; S336-L342 PolarHBondContact OG-O 3.42Å; S336-L342 PolarHBondContact OG-OXT 2.9Å; I337-L342 HydrophobicContact CG2-CB 4.04Å; I337-L342 PolarHBondContact N-O 3.49Å; L338-L342 PolarHBondContact N-O 3.3Å; L338-L342 PolarHBondContact O-N 3.17Å

Retrieved 342 of 342 residues in 1010.6 ms (Link to these results)

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