A0A087XHP2_POEFO Loading...

Sulfotransferase

AlphaFold DB , UniProt , Accession A0A087XHP2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 370 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	40.5	Very low	233 Å²	233	160.5 Å²	160.5	100%	1.148	81%	0.81	S	S	*	*				0	116.7	0	-89.9	163.9	170.7	0	0	107.4
2	E	39.9	Very low	40.7	Very low	164 Å²	164	157.8 Å²	157.8	77%	0.766	81%	0.808	S	S	*	*			trans	66.8	120.3	134.5	-79.2	-173.9	174	0	0	123.2
3	Y	37.2	Very low	41.8	Very low	206 Å²	206	155.3 Å²	155.3	81%	0.808	80%	0.804	S	S	*	*			trans	75.2	113.2	142.3	-68.7	-75.5	0	0	0	122.8
4	S	43.3	Very low	42.1	Very low	108 Å²	108	152.1 Å²	152.1	76%	0.755	80%	0.798	S	S	*	*			trans	-60.4	177.6	152.7	-150.7	0	0	0	0	111.3
5	P	60.5	Low	42.9	Very low	90 Å²	90	147.2 Å²	147.2	58%	0.584	78%	0.781	S	S	*	*			cis	-157.8	-177.1	22.5	43.5	-19.9	0	0	0	120.9
6	F	41.2	Very low	44.1	Very low	180 Å²	180	142.9 Å²	142.9	79%	0.789	77%	0.767	S	S	*	*			trans	67.1	141.5	149.5	-70.4	-55.8	0	0	0	119.8
7	L	35.1	Very low	44.9	Very low	138 Å²	138	141.4 Å²	141.4	72%	0.723	75%	0.753	S	S	*	*			cis	-171	134.7	5.5	-142.9	140.1	0	0	0	106
8	H	37	Very low	46.4	Very low	193 Å²	193	139 Å²	139	89%	0.894	75%	0.745	S	S	*	*			trans	-132.2	110.7	163.6	-125.4	-49.8	0	0	0	109.1
9	S	36.9	Very low	47.7	Very low	105 Å²	105	141.4 Å²	141.4	73%	0.734	74%	0.742	S	S	*	*			trans	-85.1	128.6	172.8	-175.3	0	0	0	0	109.6
10	L	38.1	Very low	48.7	Very low	158 Å²	158	139 Å²	139	83%	0.827	73%	0.73	S	S	*	*			trans	-85.8	127.5	176.8	-81.7	155.9	0	0	0	110.4	V12	L10-V12 PolarHBondContact O-N 3.21Å
11	H	39.6	Very low	50.3	Low	190 Å²	190	139 Å²	139	88%	0.88	72%	0.724	S	S	*	*			trans	-63.6	115.7	165.2	-104.6	-91	0	0	0	110.2
12	V	42.8	Very low	52.5	Low	129 Å²	129	133.3 Å²	133.3	78%	0.782	70%	0.697	S	S	*	*			trans	-89.4	115.7	166	176.1	0	0	0	0	108.5	L10	L10-V12 PolarHBondContact O-N 3.21Å
13	V	55.2	Low	54.5	Low	125 Å²	125	132 Å²	132	76%	0.758	69%	0.69	S	S	*	*			trans	-73.7	129.5	169.6	176.7	0	0	0	0	108.8
14	P	46.2	Very low	57	Low	111 Å²	111	126.4 Å²	126.4	72%	0.721	68%	0.676	S	S	*	*			trans	-79.1	133.2	178.1	3.9	10.2	0	0	0	112.2
15	S	53.8	Low	59.3	Low	78 Å²	78	127.5 Å²	127.5	55%	0.545	67%	0.668	S	S	.	*			trans	-45.2	136.6	177	171.5	0	0	0	0	115.2	H17 V18	S15-H17 PolarHBondContact O-N 3.48Å; S15-H17 PolarHBondContact OG-N 3.25Å; S15-V18 PolarHBondContact O-N 3.23Å
16	S	61.8	Low	60.7	Low	79 Å²	79	126.4 Å²	126.4	55%	0.552	66%	0.662	S	S	*	*	H	α-helix	trans	-51	-17.5	176.2	57.5	0	0	0	0	115	N20	S16-N20 PolarHBondContact O-N 3.02Å
17	H	58.7	Low	63.2	Low	116 Å²	116	121.6 Å²	121.6	54%	0.537	64%	0.643	S	S	.	*	H	α-helix	trans	-74.3	-31.6	-177.2	-154.7	44.2	0	0	0	113.5	S15 K21	S15-H17 PolarHBondContact O-N 3.48Å; S15-H17 PolarHBondContact OG-N 3.25Å; H17-K21 PolarHBondContact O-N 3.49Å
18	V	71.1	Confident	65.9	Low	99 Å²	99	120.5 Å²	120.5	60%	0.6	64%	0.636	S	S	*	*	H	α-helix	trans	-71.3	-38.6	177.9	-179.5	0	0	0	0	110.8	S15 N20 K21 L22	S15-V18 PolarHBondContact O-N 3.23Å; V18-N20 VanDerWaalsContact C-N 3.33Å; V18-N20 PolarHBondContact O-N 3.23Å; V18-K21 PolarHBondContact O-N 3.06Å; V18-L22 WeakPolarHBondContact O-CB 3.39Å; V18-L22 PolarHBondContact O-N 2.92Å
19	R	70.8	Confident	68.6	Low	185 Å²	185	115.8 Å²	115.8	70%	0.698	62%	0.617	S	S	*	*	H	α-helix	trans	-63.1	-39.2	177.5	-168.5	172.1	65.2	-168.3	1.5	112	L22 F23	R19-L22 PolarHBondContact O-N 3.42Å; R19-F23 WeakPolarHBondContact O-CB 3.48Å; R19-F23 PolarHBondContact O-N 3.44Å
20	N	68.6	Low	71.1	Confident	92 Å²	92	114.6 Å²	114.6	49%	0.492	61%	0.609	S	S	.	*	H	α-helix	trans	-69.3	-38.7	177.2	-70.6	-2.2	0	0	0	112.2	S16 V18 F23 V24	S16-N20 PolarHBondContact O-N 3.02Å; V18-N20 VanDerWaalsContact C-N 3.33Å; V18-N20 PolarHBondContact O-N 3.23Å; N20-F23 PolarHBondContact O-N 3.29Å; N20-V24 WeakPolarHBondContact O-CG2 3.41Å; N20-V24 PolarHBondContact O-N 3.38Å
21	K	81.5	Confident	73.7	Confident	141 Å²	141	111.7 Å²	111.7	61%	0.613	59%	0.593	S	S	*	*	H	α-helix	trans	-65.9	-40.2	174.8	-72.6	-175	177.9	-174.6	0	112	H17 V18 F23 V24 F25	H17-K21 PolarHBondContact O-N 3.49Å; V18-K21 PolarHBondContact O-N 3.06Å; K21-F23 VanDerWaalsContact C-N 3.34Å; K21-V24 PolarHBondContact O-N 3.31Å; K21-F25 WeakPolarHBondContact O-CB 3.48Å; K21-F25 PolarHBondContact O-N 3.32Å
22	L	82.3	Confident	76.2	Confident	112 Å²	112	110.9 Å²	110.9	59%	0.586	58%	0.583	S	S	*	*	H	α-helix	trans	-64.6	-39.9	176	-160.6	73.7	0	0	0	111.4	V18 R19 F25 C26	V18-L22 WeakPolarHBondContact O-CB 3.39Å; V18-L22 PolarHBondContact O-N 2.92Å; R19-L22 PolarHBondContact O-N 3.42Å; L22-F25 PolarHBondContact O-N 3.42Å; L22-C26 PolarHBondContact O-N 2.97Å; L22-C26 PolarHBondContact O-SG 2.95Å
23	F	83.3	Confident	78.6	Confident	138 Å²	138	108.8 Å²	108.8	61%	0.605	57%	0.57	S	S	*	*	H	α-helix	trans	-63.7	-45.2	176.8	-174.9	-105.3	0	0	0	112.7	R19 N20 K21 F25 C26 I27	R19-F23 WeakPolarHBondContact O-CB 3.48Å; R19-F23 PolarHBondContact O-N 3.44Å; N20-F23 PolarHBondContact O-N 3.29Å; K21-F23 VanDerWaalsContact C-N 3.34Å; F23-F25 VanDerWaalsContact C-N 3.33Å; F23-F25 PolarHBondContact O-N 2.98Å; F23-C26 PolarHBondContact O-N 3.46Å; F23-I27 HydrophobicContact CD1-CD1 3.87Å; F23-I27 HydrophobicContact CE1-CD1 3.44Å; F23-I27 VanDerWaalsContact CE1-CD1 3.44Å; F23-I27 HydrophobicContact CE1-CG1 4.47Å; F23-I27 HydrophobicContact CZ-CD1 3.86Å; F23-I27 WeakPolarHBondContact O-CG1 3.48Å; F23-I27 PolarHBondContact O-N 3.46Å; F23-I27 VanDerWaalsContact O-N 3.09Å
24	V	88.4	Confident	80.2	Confident	87 Å²	87	110 Å²	110	53%	0.527	56%	0.562	S	S	.	*	H	α-helix	trans	-64.5	-39.2	175.8	174.7	0	0	0	0	111.2	N20 K21 I27 M28	N20-V24 WeakPolarHBondContact O-CG2 3.41Å; N20-V24 PolarHBondContact O-N 3.38Å; K21-V24 PolarHBondContact O-N 3.31Å; V24-I27 PolarHBondContact O-N 3.48Å; V24-M28 HydrophobicContact CG1-CG 4.43Å; V24-M28 VanDerWaalsContact O-CG 3.28Å; V24-M28 WeakPolarHBondContact O-CG 3.45Å; V24-M28 PolarHBondContact O-N 3.09Å
25	F	91.3	Very high	82.2	Confident	132 Å²	132	110.2 Å²	110.2	58%	0.579	56%	0.555	S	S	*	*	H	α-helix	trans	-62.7	-42.4	175.8	-174.5	-98.5	0	0	0	112	K21 L22 F23 I27 M28 L29	K21-F25 WeakPolarHBondContact O-CB 3.48Å; K21-F25 PolarHBondContact O-N 3.32Å; L22-F25 PolarHBondContact O-N 3.42Å; F23-F25 VanDerWaalsContact C-N 3.33Å; F23-F25 PolarHBondContact O-N 2.98Å; F25-I27 PolarHBondContact O-N 2.83Å; F25-M28 PolarHBondContact O-N 3.19Å; F25-L29 HydrophobicContact CE1-CD1 4.22Å; F25-L29 HydrophobicContact CZ-CD1 4.25Å; F25-L29 WeakPolarHBondContact O-CB 3.35Å; F25-L29 PolarHBondContact O-N 3.4Å
26	C	90.3	Very high	83.7	Confident	67 Å²	67	110 Å²	110	45%	0.453	55%	0.547	S	S	.	.	H	α-helix	trans	-61.3	-42.3	174.9	-70.4	0	0	0	0	112.3	L22 F23 L29 S30	L22-C26 PolarHBondContact O-N 2.97Å; L22-C26 PolarHBondContact O-SG 2.95Å; F23-C26 PolarHBondContact O-N 3.46Å; C26-L29 PolarHBondContact O-N 3.16Å; C26-S30 PolarHBondContact O-N 2.98Å; C26-S30 PolarHBondContact O-OG 2.99Å; C26-S30 VanDerWaalsContact O-OG 3.11Å
27	I	93.3	Very high	84.7	Confident	78 Å²	78	114.4 Å²	114.4	40%	0.4	55%	0.552	S	S	.	*	H	α-helix	trans	-62.4	-45.5	176.6	-68.3	170.6	0	0	0	111	F23 V24 F25 L29 S30 L31	F23-I27 HydrophobicContact CD1-CD1 3.87Å; F23-I27 HydrophobicContact CE1-CD1 3.44Å; F23-I27 VanDerWaalsContact CE1-CD1 3.44Å; F23-I27 HydrophobicContact CE1-CG1 4.47Å; F23-I27 HydrophobicContact CZ-CD1 3.86Å; F23-I27 WeakPolarHBondContact O-CG1 3.48Å; F23-I27 PolarHBondContact O-N 3.46Å; F23-I27 VanDerWaalsContact O-N 3.09Å; V24-I27 PolarHBondContact O-N 3.48Å; F25-I27 PolarHBondContact O-N 2.83Å; I27-L29 VanDerWaalsContact C-N 3.32Å; I27-L29 PolarHBondContact O-N 3.25Å; I27-S30 PolarHBondContact O-N 3.38Å; I27-L31 HydrophobicContact CG2-CD1 4.1Å; I27-L31 WeakPolarHBondContact O-CG 3.38Å; I27-L31 PolarHBondContact O-N 3.48Å
28	M	91.9	Very high	85.6	Confident	115 Å²	115	111 Å²	111	57%	0.567	54%	0.541	S	S	*	.	H	α-helix	trans	-61.4	-41.6	177.8	-68	-101.2	80.7	0	0	111.4	V24 F25 L31 W32	V24-M28 HydrophobicContact CG1-CG 4.43Å; V24-M28 VanDerWaalsContact O-CG 3.28Å; V24-M28 WeakPolarHBondContact O-CG 3.45Å; V24-M28 PolarHBondContact O-N 3.09Å; F25-M28 PolarHBondContact O-N 3.19Å; M28-L31 HydrophobicContact CE-CD1 4.31Å; M28-L31 PolarHBondContact O-N 2.59Å; M28-W32 WeakPolarHBondContact O-CB 3.47Å; M28-W32 PolarHBondContact O-N 3.47Å
29	L	94	Very high	85.7	Confident	94 Å²	94	110 Å²	110	49%	0.492	54%	0.538	S	S	.	.	H	α-helix	trans	-64.4	-43.2	177.4	-157.3	94.3	0	0	0	111.5	F25 C26 I27 W32 V33	F25-L29 HydrophobicContact CE1-CD1 4.22Å; F25-L29 HydrophobicContact CZ-CD1 4.25Å; F25-L29 WeakPolarHBondContact O-CB 3.35Å; F25-L29 PolarHBondContact O-N 3.4Å; C26-L29 PolarHBondContact O-N 3.16Å; I27-L29 VanDerWaalsContact C-N 3.32Å; I27-L29 PolarHBondContact O-N 3.25Å; L29-W32 PolarHBondContact O-N 3.34Å; L29-V33 WeakPolarHBondContact O-CG2 3.36Å; L29-V33 PolarHBondContact O-N 2.81Å
30	S	90.1	Very high	85.6	Confident	81 Å²	81	105.8 Å²	105.8	57%	0.566	53%	0.532	S	S	*	.	H	α-helix	trans	-63.8	-41.4	177.6	-63.9	0	0	0	0	112.6	C26 I27 W32 V33 Y34	C26-S30 PolarHBondContact O-N 2.98Å; C26-S30 PolarHBondContact O-OG 2.99Å; C26-S30 VanDerWaalsContact O-OG 3.11Å; I27-S30 PolarHBondContact O-N 3.38Å; S30-W32 VanDerWaalsContact C-N 3.33Å; S30-V33 PolarHBondContact O-N 3.23Å; S30-Y34 WeakPolarHBondContact O-CB 3.34Å; S30-Y34 PolarHBondContact O-N 3.33Å
31	L	92.3	Very high	85	Confident	96 Å²	96	103.6 Å²	103.6	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-65.2	-37.6	175.5	-70.3	172.8	0	0	0	111.8	I27 M28 Y34 M35	I27-L31 HydrophobicContact CG2-CD1 4.1Å; I27-L31 WeakPolarHBondContact O-CG 3.38Å; I27-L31 PolarHBondContact O-N 3.48Å; M28-L31 HydrophobicContact CE-CD1 4.31Å; M28-L31 PolarHBondContact O-N 2.59Å; L31-Y34 PolarHBondContact O-N 3.48Å; L31-M35 WeakPolarHBondContact O-CG 3.44Å; L31-M35 PolarHBondContact O-N 3.09Å
32	W	93.3	Very high	83.5	Confident	174 Å²	174	105.8 Å²	105.8	66%	0.659	54%	0.537	S	S	*	.	H	α-helix	trans	-68.6	-42.8	178.3	-161.5	78.4	0	0	0	112.2	M28 L29 S30 Y34 M35 I36	M28-W32 WeakPolarHBondContact O-CB 3.47Å; M28-W32 PolarHBondContact O-N 3.47Å; L29-W32 PolarHBondContact O-N 3.34Å; S30-W32 VanDerWaalsContact C-N 3.33Å; W32-Y34 VanDerWaalsContact C-N 3.34Å; W32-Y34 PolarHBondContact O-N 3.34Å; W32-M35 PolarHBondContact O-N 2.98Å; W32-I36 HydrophobicContact CD2-CD1 3.9Å; W32-I36 HydrophobicContact CE3-CD1 3.45Å; W32-I36 VanDerWaalsContact CE3-CD1 3.45Å; W32-I36 HydrophobicContact CH2-CD1 3.48Å; W32-I36 VanDerWaalsContact CH2-CD1 3.48Å; W32-I36 HydrophobicContact CZ2-CD1 3.9Å; W32-I36 HydrophobicContact CZ3-CD1 3.23Å; W32-I36 WeakPolarHBondContact O-CG1 3.35Å; W32-I36 PolarHBondContact O-N 2.93Å
33	V	91.9	Very high	81.9	Confident	85 Å²	85	105.6 Å²	105.6	52%	0.515	54%	0.544	S	S	.	.	H	α-helix	trans	-63.6	-40	173.5	173.2	0	0	0	0	111.3	L29 S30 I36 Y37	L29-V33 WeakPolarHBondContact O-CG2 3.36Å; L29-V33 PolarHBondContact O-N 2.81Å; S30-V33 PolarHBondContact O-N 3.23Å; V33-I36 PolarHBondContact O-N 3.44Å; V33-Y37 WeakPolarHBondContact O-CB 3.38Å; V33-Y37 PolarHBondContact O-N 2.93Å
34	Y	88.8	Confident	80.2	Confident	150 Å²	150	103.9 Å²	103.9	59%	0.588	55%	0.549	S	S	*	.	H	α-helix	trans	-63.2	-42.5	175.8	-175.9	-102.1	0	0	0	112.2	S30 L31 W32 I36 Y37 C38	S30-Y34 WeakPolarHBondContact O-CB 3.34Å; S30-Y34 PolarHBondContact O-N 3.33Å; L31-Y34 PolarHBondContact O-N 3.48Å; W32-Y34 VanDerWaalsContact C-N 3.34Å; W32-Y34 PolarHBondContact O-N 3.34Å; Y34-I36 PolarHBondContact O-N 3.32Å; Y34-Y37 WeakPolarHBondContact O-CB 3.38Å; Y34-Y37 PolarHBondContact O-N 3Å; Y34-C38 PolarHBondContact O-N 3.11Å; Y34-C38 PolarHBondContact O-SG 3.35Å; Y34-C38 VanDerWaalsContact O-SG 3.35Å
35	M	87.7	Confident	78.3	Confident	116 Å²	116	105 Å²	105	57%	0.571	56%	0.557	S	S	*	*	H	α-helix	trans	-60.3	-43	174	-81.9	-65.6	-62	0	0	112.3	L31 W32 C38 C39	L31-M35 WeakPolarHBondContact O-CG 3.44Å; L31-M35 PolarHBondContact O-N 3.09Å; W32-M35 PolarHBondContact O-N 2.98Å; M35-C38 PolarHBondContact O-N 2.94Å; M35-C39 PolarHBondContact O-N 3.31Å; M35-C39 PolarHBondContact O-SG 3.28Å
36	I	85.3	Confident	75.9	Confident	74 Å²	74	104.4 Å²	104.4	38%	0.379	56%	0.563	S	S	.	*	H	α-helix	trans	-64.6	-42.1	175.8	-68.6	172.1	0	0	0	110.9	W32 V33 Y34 C38 C39 V40	W32-I36 HydrophobicContact CD2-CD1 3.9Å; W32-I36 HydrophobicContact CE3-CD1 3.45Å; W32-I36 VanDerWaalsContact CE3-CD1 3.45Å; W32-I36 HydrophobicContact CH2-CD1 3.48Å; W32-I36 VanDerWaalsContact CH2-CD1 3.48Å; W32-I36 HydrophobicContact CZ2-CD1 3.9Å; W32-I36 HydrophobicContact CZ3-CD1 3.23Å; W32-I36 WeakPolarHBondContact O-CG1 3.35Å; W32-I36 PolarHBondContact O-N 2.93Å; V33-I36 PolarHBondContact O-N 3.44Å; Y34-I36 PolarHBondContact O-N 3.32Å; I36-C38 VanDerWaalsContact C-N 3.34Å; I36-C38 PolarHBondContact O-N 2.97Å; I36-C39 PolarHBondContact O-N 3.05Å; I36-C39 VanDerWaalsContact O-N 3.16Å; I36-V40 HydrophobicContact CG2-CG2 4.28Å; I36-V40 WeakPolarHBondContact O-CG2 3.28Å; I36-V40 PolarHBondContact O-N 3.31Å
37	Y	83.9	Confident	73.5	Confident	171 Å²	171	106.7 Å²	106.7	67%	0.671	58%	0.577	S	S	*	*	H	α-helix	trans	-59.3	-43.7	175.7	-178.2	-97.1	0	0	0	111.9	V33 Y34 C39 V40 G41	V33-Y37 WeakPolarHBondContact O-CB 3.38Å; V33-Y37 PolarHBondContact O-N 2.93Å; Y34-Y37 WeakPolarHBondContact O-CB 3.38Å; Y34-Y37 PolarHBondContact O-N 3Å; Y37-C39 PolarHBondContact O-N 2.95Å; Y37-V40 PolarHBondContact O-N 3.01Å; Y37-G41 PolarHBondContact O-N 3.36Å
38	C	76.9	Confident	70.5	Confident	43 Å²	43	110.5 Å²	110.5	29%	0.291	60%	0.599	S	S	.	*	H	α-helix	trans	-61.2	-42.8	173.3	-68.5	0	0	0	0	112	Y34 M35 I36 V40 G41 Y42	Y34-C38 PolarHBondContact O-N 3.11Å; Y34-C38 PolarHBondContact O-SG 3.35Å; Y34-C38 VanDerWaalsContact O-SG 3.35Å; M35-C38 PolarHBondContact O-N 2.94Å; I36-C38 VanDerWaalsContact C-N 3.34Å; I36-C38 PolarHBondContact O-N 2.97Å; C38-V40 PolarHBondContact O-N 3.5Å; C38-G41 PolarHBondContact O-N 3.43Å; C38-Y42 WeakPolarHBondContact O-CD2 3.39Å; C38-Y42 PolarHBondContact O-N 3.49Å
39	C	72.9	Confident	67.6	Low	80 Å²	80	113.5 Å²	113.5	54%	0.541	62%	0.616	S	S	.	*	H	α-helix	trans	-66.7	-34	178.6	-67.7	0	0	0	0	113.1	M35 I36 Y37	M35-C39 PolarHBondContact O-N 3.31Å; M35-C39 PolarHBondContact O-SG 3.28Å; I36-C39 PolarHBondContact O-N 3.05Å; I36-C39 VanDerWaalsContact O-N 3.16Å; Y37-C39 PolarHBondContact O-N 2.95Å
40	V	70.4	Confident	64.6	Low	95 Å²	95	115.2 Å²	115.2	58%	0.576	63%	0.631	S	S	*	*	H	α-helix	trans	-76.2	-35.5	177.7	176.8	0	0	0	0	111.5	I36 Y37 C38 Y42 C43	I36-V40 HydrophobicContact CG2-CG2 4.28Å; I36-V40 WeakPolarHBondContact O-CG2 3.28Å; I36-V40 PolarHBondContact O-N 3.31Å; Y37-V40 PolarHBondContact O-N 3.01Å; C38-V40 PolarHBondContact O-N 3.5Å; V40-Y42 VanDerWaalsContact C-N 3.28Å; V40-Y42 PolarHBondContact O-N 3.34Å; V40-C43 PolarHBondContact O-N 3.1Å
41	G	56.1	Low	61.7	Low	47 Å²	47	122.3 Å²	122.3	49%	0.485	65%	0.647	S	S	.	*	H	α-helix	trans	-66.5	-23.6	176.3	0	0	0	0	0	114.8	Y37 C38	Y37-G41 PolarHBondContact O-N 3.36Å; C38-G41 PolarHBondContact O-N 3.43Å
42	Y	49.9	Very low	58.7	Low	186 Å²	186	122.7 Å²	122.7	73%	0.729	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-80.4	-13.4	175.8	-95.3	-89.1	0	0	0	114	C38 V40	C38-Y42 WeakPolarHBondContact O-CD2 3.39Å; C38-Y42 PolarHBondContact O-N 3.49Å; V40-Y42 VanDerWaalsContact C-N 3.28Å; V40-Y42 PolarHBondContact O-N 3.34Å
43	C	47.3	Very low	55.6	Low	109 Å²	109	119.3 Å²	119.3	74%	0.736	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-86.9	0	178.1	-74.8	0	0	0	0	114	V40	V40-C43 PolarHBondContact O-N 3.1Å
44	S	47.4	Very low	52.6	Low	101 Å²	101	121.9 Å²	121.9	71%	0.706	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-102.1	0.9	-179.1	-46.9	0	0	0	0	114.5
45	T	48.5	Very low	49.6	Very low	111 Å²	111	126.5 Å²	126.5	68%	0.681	69%	0.692	S	S	*	*			trans	-131.1	72.1	179.5	58.3	0	0	0	0	111.4
46	V	41.3	Very low	46.6	Very low	119 Å²	119	131.9 Å²	131.9	72%	0.721	71%	0.706	S	S	*	*			trans	-132.2	118.7	161.2	-168.6	0	0	0	0	107.7
47	P	39.5	Very low	43.9	Very low	115 Å²	115	136 Å²	136	75%	0.747	72%	0.724	S	S	*	*			trans	-73.5	137.6	172.8	-8.6	24.6	0	0	0	110.4	L49	P47-L49 PolarHBondContact O-N 3.12Å
48	N	31.3	Very low	41.2	Very low	158 Å²	158	134.9 Å²	134.9	85%	0.845	72%	0.724	S	S	*	*			trans	-57.9	129.8	175.8	-79.3	-43.6	0	0	0	112.2	T50	N48-T50 PolarHBondContact O-N 3.48Å
49	L	30.3	Very low	38.9	Very low	178 Å²	178	138.9 Å²	138.9	93%	0.932	74%	0.743	S	S	*	*			trans	-75.6	108	161.6	-99.9	95.6	0	0	0	109.2	P47	P47-L49 PolarHBondContact O-N 3.12Å
50	T	31.7	Very low	36.7	Very low	131 Å²	131	142.1 Å²	142.1	80%	0.804	76%	0.755	S	S	*	*			trans	-80.1	124.5	163.8	44.4	0	0	0	0	110.4	N48	N48-T50 PolarHBondContact O-N 3.48Å
51	Y	29.3	Very low	34.7	Very low	230 Å²	230	142 Å²	142	90%	0.902	76%	0.763	S	S	*	*			trans	-75.1	124.2	171.3	-177	-93	0	0	0	110.6
52	S	28.6	Very low	33.3	Very low	103 Å²	103	144 Å²	144	72%	0.72	78%	0.775	S	S	*	*			trans	-154.9	110.7	159.6	65.3	0	0	0	0	113.6
53	S	28.6	Very low	32.3	Very low	104 Å²	104	142.3 Å²	142.3	73%	0.727	79%	0.785	S	S	*	*			trans	26.1	125.2	140.5	63.3	0	0	0	0	121.6
54	V	29.3	Very low	31.2	Very low	139 Å²	139	143.3 Å²	143.3	84%	0.842	78%	0.783	S	S	*	*			trans	-40.1	129.4	153.8	177.5	0	0	0	0	113.8
55	R	24.4	Very low	30.2	Very low	246 Å²	246	145.6 Å²	145.6	93%	0.928	79%	0.787	S	S	*	*			trans	-153.6	135.5	144.9	-106.9	-178.8	-161.5	-176.2	5.3	111.4
56	R	26.5	Very low	29.3	Very low	230 Å²	230	151.2 Å²	151.2	87%	0.868	80%	0.796	S	S	*	*			trans	-67	142.6	172	-70.4	173.2	178.2	168.3	-1.6	111.3
57	H	28.3	Very low	28.5	Very low	161 Å²	161	152.9 Å²	152.9	75%	0.745	80%	0.801	S	S	*	*				-178.2	132.9	114.3	-109.8	-82.8	0	0	0	111.8
58	E	27.4	Very low	28.1	Very low	146 Å²	146	152.5 Å²	152.5	68%	0.682	80%	0.801	S	S	*	*			trans	23.3	138.6	141.1	-78.6	170.1	148.9	0	0	124.5
59	N	27.8	Very low	27.9	Very low	128 Å²	128	150.6 Å²	150.6	68%	0.684	80%	0.8	S	S	*	*			trans	96.2	125.5	133.3	-72.5	2.2	0	0	0	122.4
60	D	27.3	Very low	28.1	Very low	148 Å²	148	150.8 Å²	150.8	79%	0.791	80%	0.801	S	S	*	*			trans	99.1	118.5	136.8	-65.9	-20.7	0	0	0	122.9
61	A	27.6	Very low	28.1	Very low	91 Å²	91	148.4 Å²	148.4	75%	0.752	80%	0.803	S	S	*	*			trans	76.9	105.4	130.9	0	0	0	0	0	121.2
62	A	27.4	Very low	28.1	Very low	89 Å²	89	141.9 Å²	141.9	74%	0.736	80%	0.796	S	S	*	*				36.7	120.9	124.9	0	0	0	0	0	119.9
63	T	27.6	Very low	28.3	Very low	152 Å²	152	141.9 Å²	141.9	93%	0.933	80%	0.796	S	S	*	*				-170.5	153.4	108.9	12.3	0	0	0	0	113.1
64	D	25.9	Very low	28.6	Very low	130 Å²	130	148.1 Å²	148.1	70%	0.695	80%	0.804	S	S	*	*			trans	-65.3	139.1	-175.9	-166.3	11.4	0	0	0	114
65	N	26.6	Very low	28.5	Very low	149 Å²	149	147.4 Å²	147.4	80%	0.797	80%	0.795	S	S	*	*				-175	140.8	122.1	-104.8	-35.3	0	0	0	114.1
66	R	28.1	Very low	29.1	Very low	229 Å²	229	142 Å²	142	86%	0.864	78%	0.784	S	S	*	*			trans	-56.5	133.6	170.2	-64.1	165.7	174.2	174.5	-2.6	111.3
67	D	25.7	Very low	29.7	Very low	153 Å²	153	136.9 Å²	136.9	82%	0.818	77%	0.773	S	S	*	*				-152.3	145	126.1	-139.5	-16.5	0	0	0	112.9
68	S	30.3	Very low	30.1	Very low	107 Å²	107	135 Å²	135	75%	0.748	77%	0.769	S	S	*	*			trans	-72.5	132.7	-178.8	53	0	0	0	0	112.3
69	S	27.4	Very low	30.3	Very low	118 Å²	118	135.1 Å²	135.1	83%	0.825	77%	0.774	S	S	*	*			trans	-149.8	123.9	148.8	65.3	0	0	0	0	112.7
70	L	34.6	Very low	31	Very low	183 Å²	183	132.2 Å²	132.2	96%	0.958	76%	0.756	S	S	*	*			trans	-52.1	130.4	166.5	-70.9	132.7	0	0	0	111
71	G	31.4	Very low	31.8	Very low	81 Å²	81	127 Å²	127	84%	0.835	73%	0.728	S	S	*	*			trans	158.7	41.7	169	0	0	0	0	0	117.3
72	A	28.7	Very low	32.3	Very low	93 Å²	93	131.1 Å²	131.1	77%	0.769	73%	0.732	S	S	*	*			trans	-140.8	74.5	176.3	0	0	0	0	0	111.6
73	S	32.9	Very low	32.7	Very low	102 Å²	102	134.6 Å²	134.6	71%	0.713	74%	0.737	S	S	*	*	S	Bend	trans	-149.2	9.8	166.8	-84.9	0	0	0	0	114.5
74	R	34.9	Very low	33.3	Very low	236 Å²	236	130.6 Å²	130.6	89%	0.891	71%	0.71	S	S	*	*	S	Bend	trans	-93.8	-13.1	176.1	-72.9	177.2	90.2	149.2	-0.3	114.4
75	D	28.4	Very low	33.8	Very low	124 Å²	124	127 Å²	127	66%	0.663	70%	0.695	S	S	*	*	S	Bend	trans	-109.7	0.8	-166.3	-66.4	-32.3	0	0	0	116.7	L77	D75-L77 PolarHBondContact O-N 2.89Å
76	L	35.8	Very low	34.3	Very low	131 Å²	131	130.5 Å²	130.5	69%	0.686	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	1.2	-176.6	-69.4	175.1	0	0	0	115.1
77	L	39.8	Very low	34.6	Very low	124 Å²	124	121.2 Å²	121.2	65%	0.649	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-16.4	174.1	-74.1	171.6	0	0	0	113.6	D75	D75-L77 PolarHBondContact O-N 2.89Å
78	N	36.5	Very low	35	Very low	122 Å²	122	119.3 Å²	119.3	65%	0.652	66%	0.663	S	S	*	*	S	Bend	trans	-94.9	-20.1	-161.7	-73.4	-10.9	0	0	0	115.8
79	N	31.4	Very low	35	Very low	148 Å²	148	122.7 Å²	122.7	79%	0.791	67%	0.667	S	S	*	*	S	Bend	trans	-120.8	0.5	-168.6	-93.4	-2.1	0	0	0	117.9
80	E	43.3	Very low	35.6	Very low	67 Å²	67	124.4 Å²	124.4	31%	0.313	66%	0.655	S	S	.	*	S	Bend	trans	-98.3	6.6	-166.2	-61.9	-161.7	156.9	0	0	117.4	K224 K225	E80-K224 PolarHBondContact O-NZ 3.49Å; E80-K225 WeakPolarHBondContact OE1-CE 3.39Å; E80-K225 IonicContact OE1-NZ 2.75Å; E80-K225 PolarHBondContact OE1-NZ 3.5Å
81	N	43.3	Very low	35.3	Very low	38 Å²	38	122.4 Å²	122.4	20%	0.203	65%	0.646	C	S	.	*			trans	-115.7	2.2	-170.6	-85.3	14	0	0	0	115.9	L83 R155	N81-L83 PolarHBondContact O-N 2.81Å; N81-L83 VanDerWaalsContact O-N 3.14Å; N81-R155 VanDerWaalsContact CB-NH2 3.35Å; N81-R155 VanDerWaalsContact CG-NH2 3.28Å; N81-R155 PolarHBondContact ND2-NH2 3.43Å
82	E	37.4	Very low	35.2	Very low	178 Å²	178	127.5 Å²	127.5	83%	0.832	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-17.5	-177.7	-116.6	179.7	168.2	0	0	114.2
83	L	35.7	Very low	35.1	Very low	162 Å²	162	129.1 Å²	129.1	85%	0.848	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-1.7	-169.8	-82.6	146	0	0	0	116.6	N81	N81-L83 PolarHBondContact O-N 2.81Å; N81-L83 VanDerWaalsContact O-N 3.14Å
84	D	41.6	Very low	35	Very low	68 Å²	68	134.9 Å²	134.9	36%	0.364	65%	0.654	S	S	.	*	S	Bend	trans	-110.3	2.7	176.4	-155.4	26	0	0	0	112.6
85	S	36.8	Very low	34.6	Very low	55 Å²	55	128.8 Å²	128.8	39%	0.385	65%	0.647	S	S	.	*			trans	-85.3	-11.4	177.5	-56.2	0	0	0	0	113.6	G87	S85-G87 PolarHBondContact O-N 2.84Å
86	R	36.3	Very low	34.6	Very low	221 Å²	221	131.7 Å²	131.7	83%	0.834	66%	0.657	S	S	*	*	S	Bend	trans	-73.4	87.4	160.8	-76.8	177.5	71.1	171.8	2.4	106.5	D88	R86-D88 PolarHBondContact O-N 3.07Å
87	G	34.9	Very low	34.3	Very low	35 Å²	35	130 Å²	130	36%	0.361	66%	0.662	S	S	.	*			trans	-48.9	137.1	166.3	0	0	0	0	0	108.5	S85 E89	S85-G87 PolarHBondContact O-N 2.84Å; G87-E89 PolarHBondContact O-N 3.09Å
88	D	33.7	Very low	33.7	Very low	113 Å²	113	133.4 Å²	133.4	60%	0.604	67%	0.672	S	S	*	*			trans	-46.3	113.5	163.8	-63.9	-48.5	0	0	0	106.5	R86 W90	R86-D88 PolarHBondContact O-N 3.07Å; D88-W90 PolarHBondContact O-N 2.98Å; D88-W90 VanDerWaalsContact O-N 3.16Å
89	E	30.7	Very low	33.5	Very low	178 Å²	178	132.4 Å²	132.4	83%	0.832	68%	0.68	S	S	*	*			trans	-63.2	114.3	-174.4	-163.2	164.8	-169.4	0	0	107.2	G87	G87-E89 PolarHBondContact O-N 3.09Å
90	W	39.5	Very low	33.5	Very low	153 Å²	153	131.7 Å²	131.7	58%	0.58	68%	0.681	S	S	*	*			trans	-89.7	106.3	178	-73.5	95	0	0	0	107.4	D88 E92 H327	D88-W90 PolarHBondContact O-N 2.98Å; D88-W90 VanDerWaalsContact O-N 3.16Å; W90-E92 PolarHBondContact O-N 2.86Å; W90-H327 AromaticContact CH2-CD2 3.55Å; W90-H327 AromaticContact CH2-CE1 3Å; W90-H327 WeakPolarHBondContact CH2-CE1 3.37Å; W90-H327 AromaticContact CH2-CG 3.7Å; W90-H327 AromaticContact CH2-ND1 3.36Å; W90-H327 WeakPolarHBondContact CH2-ND1 3.29Å; W90-H327 AromaticContact CH2-NE2 3.13Å; W90-H327 WeakPolarHBondContact CH2-NE2 3.21Å; W90-H327 AromaticContact CZ2-CE1 3.62Å; W90-H327 AromaticContact CZ2-NE2 3.47Å; W90-H327 WeakPolarHBondContact CZ2-NE2 3.38Å; W90-H327 AromaticContact CZ3-CE1 3.77Å; W90-H327 AromaticContact CZ3-ND1 3.82Å
91	D	27.2	Very low	33.4	Very low	142 Å²	142	135.3 Å²	135.3	76%	0.759	70%	0.702	S	S	*	*			trans	-57.5	111.2	168.2	-78.6	-36	0	0	0	108.9	V93	D91-V93 VanDerWaalsContact C-N 3.25Å; D91-V93 PolarHBondContact O-N 3.28Å
92	E	30	Very low	32.9	Very low	187 Å²	187	141.1 Å²	141.1	87%	0.874	73%	0.734	S	S	*	*			trans	-68.7	87.4	167.9	-162.5	170	-141.5	0	0	106.9	W90 R94	W90-E92 PolarHBondContact O-N 2.86Å; E92-R94 PolarHBondContact O-N 3.41Å
93	V	27.1	Very low	33.1	Very low	127 Å²	127	136 Å²	136	77%	0.77	73%	0.728	S	S	*	*			trans	-68.7	87.1	170.9	-179.7	0	0	0	0	107.5	D91 S95	D91-V93 VanDerWaalsContact C-N 3.25Å; D91-V93 PolarHBondContact O-N 3.28Å; V93-S95 PolarHBondContact O-N 3.39Å; V93-S95 VanDerWaalsContact O-N 3.12Å
94	R	30.6	Very low	33.5	Very low	223 Å²	223	132.5 Å²	132.5	84%	0.842	72%	0.723	S	S	*	*			trans	-61.3	106.9	167.1	-162.7	175.7	-172.9	174.5	1.1	107	E92 E96	E92-R94 PolarHBondContact O-N 3.41Å; R94-E96 PolarHBondContact O-N 2.99Å; R94-E96 VanDerWaalsContact O-N 3.12Å
95	S	27.3	Very low	33.4	Very low	108 Å²	108	137 Å²	137	76%	0.755	74%	0.744	S	S	*	*			trans	-67.4	106.9	165.1	-53.5	0	0	0	0	107.3	V93 A97	V93-S95 PolarHBondContact O-N 3.39Å; V93-S95 VanDerWaalsContact O-N 3.12Å; S95-A97 VanDerWaalsContact C-N 3.27Å; S95-A97 PolarHBondContact O-N 2.92Å
96	E	27.1	Very low	33.6	Very low	185 Å²	185	139.9 Å²	139.9	86%	0.864	76%	0.764	S	S	*	*			trans	-62.8	92.3	165.1	-74	-178.8	156.5	0	0	108.4	R94 K98	R94-E96 PolarHBondContact O-N 2.99Å; R94-E96 VanDerWaalsContact O-N 3.12Å; E96-K98 PolarHBondContact O-N 2.83Å
97	A	30.7	Very low	33.6	Very low	95 Å²	95	132.6 Å²	132.6	79%	0.785	76%	0.758	S	S	*	*			trans	-69.6	109.2	157.7	0	0	0	0	0	106.8	S95 A99	S95-A97 VanDerWaalsContact C-N 3.27Å; S95-A97 PolarHBondContact O-N 2.92Å; A97-A99 PolarHBondContact O-N 3.19Å
98	K	27.1	Very low	34.1	Very low	197 Å²	197	139.7 Å²	139.7	86%	0.857	78%	0.779	S	S	*	*			trans	-48.7	125.1	169.6	-83.7	177.3	172.4	175.3	0	109.3	E96 V100	E96-K98 PolarHBondContact O-N 2.83Å; K98-V100 PolarHBondContact O-N 2.92Å; K98-V100 VanDerWaalsContact O-N 3.15Å
99	A	31.9	Very low	34.8	Very low	101 Å²	101	142.1 Å²	142.1	84%	0.835	79%	0.791	S	S	*	*			trans	-54.2	116.2	167.1	0	0	0	0	0	109.2	A97	A97-A99 PolarHBondContact O-N 3.19Å
100	V	32.1	Very low	35.7	Very low	133 Å²	133	141.5 Å²	141.5	81%	0.806	79%	0.793	S	S	*	*			trans	-105.4	117.1	151.5	-178.7	0	0	0	0	104.7	K98 D102	K98-V100 PolarHBondContact O-N 2.92Å; K98-V100 VanDerWaalsContact O-N 3.15Å; V100-D102 PolarHBondContact O-N 3.46Å
101	D	39.5	Very low	36.5	Very low	142 Å²	142	142.4 Å²	142.4	76%	0.759	80%	0.804	S	S	*	*			trans	-57.9	118.5	175.9	-172.8	21.3	0	0	0	109.9
102	D	34.1	Very low	38.8	Very low	161 Å²	161	140 Å²	140	86%	0.861	79%	0.794	S	S	*	*			trans	-152.2	73.1	155.5	-95.9	-25.5	0	0	0	107.2	V100 A104	V100-D102 PolarHBondContact O-N 3.46Å; D102-A104 PolarHBondContact O-N 3.07Å
103	G	41.6	Very low	41.8	Very low	70 Å²	70	137 Å²	137	72%	0.722	78%	0.78	S	S	*	*			trans	-67	113.8	168.1	0	0	0	0	0	110.9
104	A	44.2	Very low	45.1	Very low	89 Å²	89	133.4 Å²	133.4	74%	0.736	76%	0.761	S	S	*	*	S	Bend	trans	164.5	45.8	138	0	0	0	0	0	112.9	D102	D102-A104 PolarHBondContact O-N 3.07Å
105	M	39.3	Very low	48.2	Very low	163 Å²	163	126 Å²	126	80%	0.803	74%	0.735	S	S	*	*	S	Bend	trans	-159.6	19	162.7	-106.3	-54.2	108.6	0	0	114.1
106	S	40.5	Very low	51.6	Low	115 Å²	115	122.2 Å²	122.2	80%	0.804	71%	0.705	S	S	*	*			trans	-109.4	23.8	-176.3	-170.1	0	0	0	0	113.7
107	G	37.8	Very low	55	Low	68 Å²	68	115.4 Å²	115.4	70%	0.701	67%	0.674	S	S	*	*	S	Bend	trans	-94.7	1	-178.5	0	0	0	0	0	115.6
108	F	43.4	Very low	58.2	Low	183 Å²	183	111 Å²	111	80%	0.803	64%	0.638	S	S	*	*	S	Bend	trans	-121.5	11.5	-167.7	-77.8	-78.1	0	0	0	115.8
109	L	48.4	Very low	61.6	Low	164 Å²	164	104.9 Å²	104.9	86%	0.859	61%	0.612	S	S	*	*	S	Bend	trans	-124.4	2.6	-179.8	-68.5	174.5	0	0	0	115.4	E111	L109-E111 VanDerWaalsContact C-N 3.32Å; L109-E111 PolarHBondContact O-N 2.95Å
110	N	49.9	Very low	64.8	Low	165 Å²	165	100.1 Å²	100.1	88%	0.882	57%	0.572	S	S	*	*			trans	-95.2	44.5	-179.5	-93.9	-2.8	0	0	0	113.1
111	E	57.1	Low	68	Low	172 Å²	172	93.8 Å²	93.8	80%	0.804	53%	0.534	S	S	*	.			trans	-121.2	135.3	165.6	-77	-166.9	157.4	0	0	111	L109	L109-E111 VanDerWaalsContact C-N 3.32Å; L109-E111 PolarHBondContact O-N 2.95Å
112	T	75.9	Confident	70.8	Confident	91 Å²	91	87 Å²	87	56%	0.558	50%	0.498	S	S	*	.			trans	105.1	16	154.7	76.6	0	0	0	0	120.5	S114	T112-S114 PolarHBondContact O-N 3.34Å
113	E	91.8	Very high	73.9	Confident	125 Å²	125	79.3 Å²	79.3	58%	0.584	46%	0.457	S	S	*	.			trans	-76.2	121.8	160.8	-76.4	-161.1	164.4	0	0	111.5	K170	E113-K170 HydrophobicContact CB-CB 4.24Å
114	S	96.1	Very high	76.6	Confident	51 Å²	51	76 Å²	76	36%	0.357	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	161.1	179.4	62.6	0	0	0	0	111.9	T112 K116 K170 S171	T112-S114 PolarHBondContact O-N 3.34Å; S114-K116 WeakPolarHBondContact OG-CE 3.03Å; S114-K170 WeakPolarHBondContact O-CA 3.4Å; S114-S171 PolarHBondContact N-O 2.95Å; S114-S171 PolarHBondContact O-N 2.91Å
115	K	97.7	Very high	79.2	Confident	67 Å²	67	71.8 Å²	71.8	29%	0.291	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	119.8	173	-66.4	-171.7	-179.8	174.7	0	109.3	R165 E166 M168 K170	K115-R165 HydrophobicContact CB-CG 4.09Å; K115-R165 WeakPolarHBondContact O-CD 3.26Å; K115-R165 WeakPolarHBondContact O-CG 3.41Å; K115-E166 PolarHBondContact NZ-O 3.41Å; K115-E166 IonicContact NZ-OE2 2.69Å; K115-E166 PolarHBondContact NZ-OE2 3.13Å; K115-M168 VanDerWaalsContact CD-O 3.3Å; K115-M168 WeakPolarHBondContact CD-O 3.17Å; K115-M168 WeakPolarHBondContact CE-O 3.26Å; K115-M168 WeakPolarHBondContact CG-O 3.33Å; K115-K170 HydrophobicContact CG-CG 4.2Å
116	K	97.3	Very high	82	Confident	29 Å²	29	66.6 Å²	66.6	13%	0.126	36%	0.361	C	S	.	.			trans	-113.5	149.5	-178.5	-60.7	179.7	-175.8	-179.9	0	110.1	S114 M168 S172 E173 T177	S114-K116 WeakPolarHBondContact OG-CE 3.03Å; K116-M168 WeakPolarHBondContact O-CB 3.48Å; K116-M168 WeakPolarHBondContact O-CG 3.48Å; K116-S172 PolarHBondContact NZ-O 3.02Å; K116-E173 WeakPolarHBondContact CE-OE1 3.23Å; K116-E173 VanDerWaalsContact NZ-CA 3.28Å; K116-E173 IonicContact NZ-OE1 2.71Å; K116-E173 PolarHBondContact NZ-OE1 3.01Å; K116-E173 IonicContact NZ-OE2 3.5Å; K116-E173 PolarHBondContact NZ-OE2 3.38Å; K116-T177 WeakPolarHBondContact O-CG2 3.46Å
117	L	98.5	Very high	84.8	Confident	43 Å²	43	62.9 Å²	62.9	23%	0.225	33%	0.33	C	S	.	.			trans	-64.9	148.7	168.6	-70	173	0	0	0	109.5	Q119 Y164 R165 M197	L117-Q119 PolarHBondContact O-N 2.89Å; L117-Y164 HydrophobicContact CD2-CD1 3.72Å; L117-Y164 HydrophobicContact CD2-CE1 4.33Å; L117-R165 HydrophobicContact CD2-CB 3.93Å; L117-M197 HydrophobicContact CB-SD 4.16Å; L117-M197 HydrophobicContact CD1-CG 3.95Å; L117-M197 HydrophobicContact CD1-SD 4.06Å; L117-M197 HydrophobicContact CD2-SD 4.09Å; L117-M197 HydrophobicContact CG-SD 4.34Å
118	P	98.4	Very high	87.7	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.019	30%	0.299	C	S	.	.			trans	-69.7	126.6	-173.2	26.2	-32.3	0	0	0	111.7	A120 I121 Y164 M168 T177 E179 M197	P118-A120 VanDerWaalsContact C-N 3.33Å; P118-I121 HydrophobicContact CB-CG1 4.15Å; P118-I121 HydrophobicContact CG-CD1 4.13Å; P118-I121 HydrophobicContact CG-CG1 4.06Å; P118-Y164 HydrophobicContact CG-CE1 3.77Å; P118-Y164 WeakPolarHBondContact CG-OH 3.46Å; P118-M168 HydrophobicContact CB-SD 4.4Å; P118-M168 HydrophobicContact CG-SD 4.27Å; P118-T177 CarbonylContact C-O 3.44Å; P118-T177 WeakPolarHBondContact CA-O 3.39Å; P118-T177 HydrophobicContact CB-CG2 4.38Å; P118-T177 WeakPolarHBondContact CB-O 3.37Å; P118-E179 HydrophobicContact CG-CG 4.27Å; P118-M197 HydrophobicContact CG-CE 4.44Å
119	Q	98.5	Very high	90.2	Very high	67 Å²	67	52.5 Å²	52.5	31%	0.313	27%	0.274	S	S	.	.	S	Bend	trans	-77.4	-23.8	174.9	-59.7	90.4	-20.5	0	0	111.8	L117 L176 T177 K202	L117-Q119 PolarHBondContact O-N 2.89Å; Q119-L176 HydrophobicContact CB-CD2 4.11Å; Q119-L176 HydrophobicContact CG-CD2 4.38Å; Q119-T177 PolarHBondContact N-O 2.93Å; Q119-T177 VanDerWaalsContact N-O 3.13Å; Q119-T177 PolarHBondContact OE1-O 3.15Å; Q119-K202 PolarHBondContact O-N 3.14Å
120	A	98.8	Very high	92.6	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.008	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	141.2	174.9	0	0	0	0	0	112.4	P118 M178 K202 L295	P118-A120 VanDerWaalsContact C-N 3.33Å; A120-M178 HydrophobicContact CB-CE 3.83Å; A120-M178 HydrophobicContact CB-CG 4.21Å; A120-M178 HydrophobicContact CB-SD 4.38Å; A120-M178 WeakPolarHBondContact O-CA 3.09Å; A120-K202 CarbonylContact C-O 3.54Å; A120-K202 WeakPolarHBondContact CA-O 3.26Å; A120-K202 HydrophobicContact CB-CB 4.04Å; A120-L295 HydrophobicContact CB-CD2 3.48Å; A120-L295 VanDerWaalsContact CB-CD2 3.48Å
121	I	98.9	Very high	94.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	131	-175.2	-54.4	176.4	0	0	0	110.6	P118 I123 F153 E179 Y184 I194 M197 T201 K202 L203 I204	P118-I121 HydrophobicContact CB-CG1 4.15Å; P118-I121 HydrophobicContact CG-CD1 4.13Å; P118-I121 HydrophobicContact CG-CG1 4.06Å; I121-I123 HydrophobicContact CB-CG2 4.04Å; I121-I123 HydrophobicContact CG2-CG2 3.64Å; I121-I123 PolarHBondContact O-N 2.91Å; I121-F153 HydrophobicContact CD1-CE2 3.86Å; I121-E179 HydrophobicContact CG1-CG 4.37Å; I121-E179 HydrophobicContact CG2-CG 4.06Å; I121-Y184 HydrophobicContact CG2-CD2 4.05Å; I121-Y184 HydrophobicContact CG2-CE2 4.07Å; I121-I194 HydrophobicContact CD1-CD1 4.16Å; I121-I194 HydrophobicContact CD1-CG1 4.47Å; I121-I194 HydrophobicContact CD1-CG2 4.16Å; I121-M197 HydrophobicContact CD1-CE 4.33Å; I121-T201 HydrophobicContact CD1-CG2 3.95Å; I121-T201 HydrophobicContact CG1-CG2 4Å; I121-K202 PolarHBondContact N-O 3.43Å; I121-L203 HydrophobicContact CB-CD2 4.47Å; I121-I204 PolarHBondContact O-N 2.93Å
122	I	98.9	Very high	96.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	95.3	168.5	-54.2	173.2	0	0	0	108.4	T130 L133 L134 L137 M178 E179 K180 T181 I204 V206	I122-T130 HydrophobicContact CG2-CG2 3.77Å; I122-L133 HydrophobicContact CD1-CB 4.46Å; I122-L133 HydrophobicContact CD1-CD2 3.97Å; I122-L133 HydrophobicContact CD1-CG 4.05Å; I122-L133 HydrophobicContact CG1-CD2 4.42Å; I122-L134 HydrophobicContact CD1-CB 4.01Å; I122-L134 HydrophobicContact CD1-CD1 3.79Å; I122-L137 HydrophobicContact CD1-CD1 4.15Å; I122-M178 HydrophobicContact CG1-CE 4.31Å; I122-E179 PolarHBondContact N-O 3.38Å; I122-K180 HydrophobicContact CB-CB 3.73Å; I122-K180 HydrophobicContact CD1-CB 4.35Å; I122-K180 HydrophobicContact CG1-CB 4.5Å; I122-K180 HydrophobicContact CG2-CB 4.25Å; I122-K180 WeakPolarHBondContact O-CA 3.45Å; I122-T181 PolarHBondContact O-N 2.8Å; I122-I204 CarbonylContact C-O 3.54Å; I122-I204 WeakPolarHBondContact CA-O 3.39Å; I122-I204 HydrophobicContact CG1-CB 4.24Å; I122-I204 HydrophobicContact CG1-CD1 4.5Å; I122-V206 HydrophobicContact CG2-CG2 4.26Å
123	I	98.9	Very high	97.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-11.6	-171.1	59	171.1	0	0	0	113.7	I121 T181 P182 Y184 F185 I194 L203 I204 V205 W263	I121-I123 HydrophobicContact CB-CG2 4.04Å; I121-I123 HydrophobicContact CG2-CG2 3.64Å; I121-I123 PolarHBondContact O-N 2.91Å; I123-T181 CarbonylContact C-O 3.04Å; I123-T181 VanDerWaalsContact O-O 3.12Å; I123-P182 CarbonylContact O-C 3.55Å; I123-Y184 HydrophobicContact CG2-CD2 4.18Å; I123-Y184 WeakPolarHBondContact O-CB 3.47Å; I123-F185 HydrophobicContact CD1-CD2 4Å; I123-F185 HydrophobicContact CG1-CD2 4.42Å; I123-F185 WeakPolarHBondContact O-CB 3.28Å; I123-F185 PolarHBondContact O-N 3.48Å; I123-I194 HydrophobicContact CG2-CD1 4.15Å; I123-L203 HydrophobicContact CD1-CB 4.04Å; I123-L203 HydrophobicContact CD1-CD1 4.33Å; I123-L203 HydrophobicContact CG2-CD2 3.87Å; I123-I204 PolarHBondContact N-O 2.81Å; I123-V205 HydrophobicContact CD1-CG2 3.78Å; I123-V205 HydrophobicContact CG1-CG2 3.78Å; I123-W263 HydrophobicContact CB-CH2 3.99Å; I123-W263 HydrophobicContact CB-CZ2 4.16Å; I123-W263 HydrophobicContact CD1-CD2 3.82Å; I123-W263 HydrophobicContact CD1-CE3 3.85Å; I123-W263 HydrophobicContact CD1-CH2 3.47Å; I123-W263 VanDerWaalsContact CD1-CH2 3.47Å; I123-W263 HydrophobicContact CD1-CZ2 3.48Å; I123-W263 VanDerWaalsContact CD1-CZ2 3.48Å; I123-W263 HydrophobicContact CD1-CZ3 3.68Å; I123-W263 HydrophobicContact CG1-CH2 4.32Å; I123-W263 HydrophobicContact CG1-CZ2 4.35Å; I123-W263 HydrophobicContact CG2-CH2 3.76Å; I123-W263 HydrophobicContact CG2-CZ2 4.43Å; I123-W263 HydrophobicContact CG2-CZ3 4.34Å
124	G	98.6	Very high	98.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.5	-177.7	-173.1	0	0	0	0	0	115.2	T130 V205 V206	G124-T130 VanDerWaalsContact O-CG2 3.26Å; G124-T130 WeakPolarHBondContact O-CG2 3.37Å; G124-V205 CarbonylContact O-C 3.21Å; G124-V205 WeakPolarHBondContact O-CA 3.45Å; G124-V206 PolarHBondContact O-N 2.81Å
125	V	98.7	Very high	98.1	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.103	C	C	.	.			cis	-97.9	159.8	-11.1	-55.6	0	0	0	0	111.3	K127 G128 F185 V205 V206 R213 I253 Y256	V125-K127 PolarHBondContact O-N 3.34Å; V125-G128 PolarHBondContact O-N 3.05Å; V125-F185 HydrophobicContact CG1-CB 4.4Å; V125-F185 HydrophobicContact CG1-CD1 3.4Å; V125-F185 HydrophobicContact CG1-CE1 3.75Å; V125-F185 HydrophobicContact CG1-CG 3.98Å; V125-V205 HydrophobicContact CG1-CG1 3.75Å; V125-V206 WeakPolarHBondContact CG2-O 3.34Å; V125-V206 PolarHBondContact N-O 3.16Å; V125-R213 HydrophobicContact CG2-CG 4.44Å; V125-I253 HydrophobicContact CB-CG2 4.41Å; V125-Y256 HydrophobicContact CB-CE1 4.3Å; V125-Y256 HydrophobicContact CG1-CD1 4.18Å; V125-Y256 HydrophobicContact CG1-CE1 3.92Å; V125-Y256 HydrophobicContact CG2-CE1 3.85Å
126	K	98.6	Very high	98.1	Very high	55 Å²	55	17.2 Å²	17.2	24%	0.239	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	125.9	171.4	-165.8	-169.1	179.7	-166.6	0	109.3	G128 P182 R213 D217 I253	K126-G128 VanDerWaalsContact C-N 3.27Å; K126-G128 PolarHBondContact O-N 3.09Å; K126-P182 HydrophobicContact CB-CB 4.33Å; K126-R213 WeakPolarHBondContact O-CG 3.32Å; K126-R213 PolarHBondContact O-NH1 3.19Å; K126-D217 WeakPolarHBondContact CE-OD1 3.29Å; K126-D217 IonicContact NZ-OD1 2.77Å; K126-D217 PolarHBondContact NZ-OD1 3.14Å; K126-D217 IonicContact NZ-OD2 3.3Å; K126-I253 HydrophobicContact CB-CD1 4.42Å; K126-I253 HydrophobicContact CD-CD1 4.12Å
127	K	98.2	Very high	98.1	Very high	37 Å²	37	15.8 Å²	15.8	16%	0.161	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	10.1	-176.6	-43.6	-55.1	-59.2	177.4	0	116.3	V125 R208 R213 S216 D217 Q220	V125-K127 PolarHBondContact O-N 3.34Å; K127-R208 WeakPolarHBondContact O-CD 3.33Å; K127-R213 HydrophobicContact CB-CG 4.1Å; K127-S216 WeakPolarHBondContact CE-O 3.33Å; K127-S216 WeakPolarHBondContact CE-OG 3.32Å; K127-D217 HydrophobicContact CG-CB 3.95Å; K127-Q220 VanDerWaalsContact CD-OE1 3.28Å
128	G	98.1	Very high	97.9	Very high	4 Å²	4	18.4 Å²	18.4	4%	0.041	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-24.8	177.3	0	0	0	0	0	114.8	V125 K126 V206	V125-G128 PolarHBondContact O-N 3.05Å; K126-G128 VanDerWaalsContact C-N 3.27Å; K126-G128 PolarHBondContact O-N 3.09Å; G128-V206 WeakPolarHBondContact CA-O 3.28Å; G128-V206 VanDerWaalsContact O-CG1 3.3Å; G128-V206 WeakPolarHBondContact O-CG1 3.47Å
129	G	97.6	Very high	97.8	Very high	28 Å²	28	19.8 Å²	19.8	29%	0.289	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	122.6	12.3	-174.6	0	0	0	0	0	114.2	R131 A132 L133	G129-R131 VanDerWaalsContact C-N 3.28Å; G129-R131 PolarHBondContact O-N 3Å; G129-R131 VanDerWaalsContact O-N 3.15Å; G129-A132 WeakPolarHBondContact O-CB 3.41Å; G129-A132 PolarHBondContact O-N 2.94Å; G129-L133 PolarHBondContact O-N 3.45Å
130	T	98.2	Very high	97.7	Very high	10 Å²	10	16.7 Å²	16.7	6%	0.061	8%	0.084	C	C	.	.	H	α-helix	trans	-52.9	-37.4	-176	58.2	0	0	0	0	114.7	I122 G124 L134 K180 P182 V206	I122-T130 HydrophobicContact CG2-CG2 3.77Å; G124-T130 VanDerWaalsContact O-CG2 3.26Å; G124-T130 WeakPolarHBondContact O-CG2 3.37Å; T130-L134 WeakPolarHBondContact O-CB 3.36Å; T130-L134 PolarHBondContact O-N 2.99Å; T130-K180 WeakPolarHBondContact O-CD 3.45Å; T130-P182 HydrophobicContact CG2-CB 4.23Å; T130-P182 HydrophobicContact CG2-CG 4Å; T130-P182 VanDerWaalsContact OG1-CG 3.3Å; T130-P182 WeakPolarHBondContact OG1-CG 3.45Å; T130-V206 HydrophobicContact CG2-CB 4.34Å; T130-V206 HydrophobicContact CG2-CG2 4.27Å
131	R	96.7	Very high	97.5	Very high	42 Å²	42	19.9 Å²	19.9	16%	0.158	11%	0.105	C	C	.	.	H	α-helix	trans	-65.6	-46	174.5	178.4	57.5	131.7	-151.5	-7.2	111.5	G129 L133 L134 E135 G147 L329 K333	G129-R131 VanDerWaalsContact C-N 3.28Å; G129-R131 PolarHBondContact O-N 3Å; G129-R131 VanDerWaalsContact O-N 3.15Å; R131-L133 VanDerWaalsContact C-N 3.35Å; R131-L133 PolarHBondContact O-N 3.36Å; R131-L134 PolarHBondContact O-N 3.17Å; R131-E135 WeakPolarHBondContact CD-OE1 3.39Å; R131-E135 HydrophobicContact CG-CG 4.46Å; R131-E135 IonicContact CZ-OE1 3.19Å; R131-E135 IonicContact NE-OE1 3.74Å; R131-E135 IonicContact NH1-OE1 2.67Å; R131-E135 PolarHBondContact NH1-OE1 3.3Å; R131-E135 WeakPolarHBondContact O-CG 3.43Å; R131-E135 PolarHBondContact O-N 2.98Å; R131-G147 PolarHBondContact NH1-O 3.28Å; R131-L329 HydrophobicContact CG-CD2 4.25Å; R131-K333 HydrophobicContact CG-CD 4.49Å
132	A	96.8	Very high	97.5	Very high	17 Å²	17	21.8 Å²	21.8	14%	0.14	12%	0.115	C	C	.	.	H	α-helix	trans	-59.5	-49.2	178.8	0	0	0	0	0	110.5	G129 L134 E135 F136 L280 L329	G129-A132 WeakPolarHBondContact O-CB 3.41Å; G129-A132 PolarHBondContact O-N 2.94Å; A132-L134 PolarHBondContact O-N 3.42Å; A132-E135 PolarHBondContact O-N 2.76Å; A132-F136 HydrophobicContact CB-CE1 4.46Å; A132-F136 HydrophobicContact CB-CE2 4.37Å; A132-F136 HydrophobicContact CB-CZ 4.13Å; A132-F136 WeakPolarHBondContact O-CD1 3.39Å; A132-F136 WeakPolarHBondContact O-CG 3.43Å; A132-F136 PolarHBondContact O-N 3.37Å; A132-L280 HydrophobicContact CB-CD2 4.22Å; A132-L329 HydrophobicContact CB-CD1 3.73Å
133	L	98.4	Very high	97.4	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.7	-46.4	178.4	179.3	60.9	0	0	0	112.3	I122 G129 R131 E135 F136 L137 I204 V206 V275 L280 M288 V291	I122-L133 HydrophobicContact CD1-CB 4.46Å; I122-L133 HydrophobicContact CD1-CD2 3.97Å; I122-L133 HydrophobicContact CD1-CG 4.05Å; I122-L133 HydrophobicContact CG1-CD2 4.42Å; G129-L133 PolarHBondContact O-N 3.45Å; R131-L133 VanDerWaalsContact C-N 3.35Å; R131-L133 PolarHBondContact O-N 3.36Å; L133-E135 PolarHBondContact O-N 3Å; L133-F136 PolarHBondContact O-N 3.17Å; L133-L137 HydrophobicContact CD1-CD1 4.07Å; L133-L137 HydrophobicContact CD1-CG 4.21Å; L133-L137 HydrophobicContact CD2-CD1 4.49Å; L133-L137 HydrophobicContact CG-CD1 3.9Å; L133-L137 HydrophobicContact CG-CG 4.48Å; L133-L137 WeakPolarHBondContact O-CG 3.44Å; L133-L137 PolarHBondContact O-N 3.15Å; L133-I204 HydrophobicContact CD2-CG2 3.68Å; L133-V206 HydrophobicContact CB-CG2 4.06Å; L133-V206 HydrophobicContact CD2-CG2 3.38Å; L133-V206 HydrophobicContact CG-CG2 4.35Å; L133-V275 HydrophobicContact CD2-CG2 4.21Å; L133-L280 HydrophobicContact CB-CD2 3.99Å; L133-L280 HydrophobicContact CD1-CD1 4.37Å; L133-M288 HydrophobicContact CD1-SD 3.8Å; L133-V291 HydrophobicContact CD1-CG1 4.48Å; L133-V291 HydrophobicContact CD1-CG2 4.03Å
134	L	98.2	Very high	97.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.2	-42.4	179.9	-168.1	73.2	0	0	0	111.8	I122 T130 R131 A132 F136 L137 R138 A145 K180	I122-L134 HydrophobicContact CD1-CB 4.01Å; I122-L134 HydrophobicContact CD1-CD1 3.79Å; T130-L134 WeakPolarHBondContact O-CB 3.36Å; T130-L134 PolarHBondContact O-N 2.99Å; R131-L134 PolarHBondContact O-N 3.17Å; A132-L134 PolarHBondContact O-N 3.42Å; L134-F136 VanDerWaalsContact C-N 3.29Å; L134-F136 PolarHBondContact O-N 3.01Å; L134-L137 PolarHBondContact O-N 3.36Å; L134-R138 VanDerWaalsContact O-CG 3.29Å; L134-R138 WeakPolarHBondContact O-CG 3.39Å; L134-R138 PolarHBondContact O-N 2.96Å; L134-A145 HydrophobicContact CD1-CB 3.79Å; L134-A145 HydrophobicContact CD2-CB 4.44Å; L134-A145 HydrophobicContact CG-CB 4.23Å; L134-K180 HydrophobicContact CB-CD 4.02Å; L134-K180 HydrophobicContact CD2-CB 4.29Å; L134-K180 HydrophobicContact CD2-CD 3.82Å; L134-K180 HydrophobicContact CD2-CG 3.91Å
135	E	96	Very high	97.4	Very high	21 Å²	21	27.1 Å²	27.1	10%	0.098	14%	0.137	C	C	.	.	H	α-helix	trans	-64.5	-34.9	176.2	-63.3	-45.1	134.3	0	0	112.1	R131 A132 L133 R138 L317 L329	R131-E135 WeakPolarHBondContact CD-OE1 3.39Å; R131-E135 HydrophobicContact CG-CG 4.46Å; R131-E135 IonicContact CZ-OE1 3.19Å; R131-E135 IonicContact NE-OE1 3.74Å; R131-E135 IonicContact NH1-OE1 2.67Å; R131-E135 PolarHBondContact NH1-OE1 3.3Å; R131-E135 WeakPolarHBondContact O-CG 3.43Å; R131-E135 PolarHBondContact O-N 2.98Å; A132-E135 PolarHBondContact O-N 2.76Å; L133-E135 PolarHBondContact O-N 3Å; E135-R138 PolarHBondContact O-N 3.34Å; E135-L317 HydrophobicContact CB-CD1 4.15Å; E135-L329 HydrophobicContact CB-CD2 4.46Å; E135-L329 HydrophobicContact CG-CD2 3.87Å
136	F	96.8	Very high	97.3	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.018	14%	0.141	C	C	.	.	H	α-helix	trans	-70.2	-39.7	177.7	-60.8	-4.5	0	0	0	111.2	A132 L133 L134 R138 L139 L280 P284 M288 F306 P315 L317	A132-F136 HydrophobicContact CB-CE1 4.46Å; A132-F136 HydrophobicContact CB-CE2 4.37Å; A132-F136 HydrophobicContact CB-CZ 4.13Å; A132-F136 WeakPolarHBondContact O-CD1 3.39Å; A132-F136 WeakPolarHBondContact O-CG 3.43Å; A132-F136 PolarHBondContact O-N 3.37Å; L133-F136 PolarHBondContact O-N 3.17Å; L134-F136 VanDerWaalsContact C-N 3.29Å; L134-F136 PolarHBondContact O-N 3.01Å; F136-R138 VanDerWaalsContact C-N 3.34Å; F136-R138 PolarHBondContact O-N 2.83Å; F136-L139 WeakPolarHBondContact O-CB 3.37Å; F136-L139 PolarHBondContact O-N 3.29Å; F136-L280 HydrophobicContact CD2-CD1 3.8Å; F136-L280 HydrophobicContact CD2-CG 4.4Å; F136-L280 HydrophobicContact CE2-CD1 3.89Å; F136-L280 HydrophobicContact CE2-CG 4.04Å; F136-P284 HydrophobicContact CD2-CB 4.28Å; F136-P284 HydrophobicContact CE2-CB 3.8Å; F136-M288 HydrophobicContact CB-CE 4.26Å; F136-M288 HydrophobicContact CB-CG 4.18Å; F136-M288 HydrophobicContact CB-SD 3.61Å; F136-M288 HydrophobicContact CD2-CG 4.47Å; F136-M288 HydrophobicContact CD2-SD 4.5Å; F136-F306 HydrophobicContact CB-CE1 4.24Å; F136-F306 HydrophobicContact CB-CZ 4.26Å; F136-F306 AromaticContact CD1-CE1 3.82Å; F136-F306 HydrophobicContact CD1-CE1 3.82Å; F136-F306 AromaticContact CD2-CE1 3.64Å; F136-F306 HydrophobicContact CD2-CE1 3.64Å; F136-F306 HydrophobicContact CD2-CZ 4.03Å; F136-F306 AromaticContact CE1-CE1 3.99Å; F136-F306 HydrophobicContact CE1-CE1 3.99Å; F136-F306 AromaticContact CE2-CE1 3.83Å; F136-F306 HydrophobicContact CE2-CE1 3.83Å; F136-F306 AromaticContact CG-CE1 3.63Å; F136-F306 HydrophobicContact CG-CE1 3.63Å; F136-F306 HydrophobicContact CG-CZ 4.08Å; F136-F306 HydrophobicContact CZ-CD1 4.41Å; F136-F306 AromaticContact CZ-CE1 3.99Å; F136-F306 HydrophobicContact CZ-CE1 3.99Å; F136-P315 HydrophobicContact CZ-CG 4.24Å; F136-L317 HydrophobicContact CD1-CD1 4.25Å; F136-L317 HydrophobicContact CD1-CD2 3.26Å; F136-L317 HydrophobicContact CD1-CG 4.02Å; F136-L317 HydrophobicContact CE1-CD2 3.53Å; F136-L317 HydrophobicContact CE1-CG 4.09Å; F136-L317 HydrophobicContact CG-CD2 4.2Å
137	L	97.1	Very high	96.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.3	-36	174.7	-77.3	166.6	0	0	0	112.6	I122 L133 L134 L139 H140 I143 M178 M288 V291 L295	I122-L137 HydrophobicContact CD1-CD1 4.15Å; L133-L137 HydrophobicContact CD1-CD1 4.07Å; L133-L137 HydrophobicContact CD1-CG 4.21Å; L133-L137 HydrophobicContact CD2-CD1 4.49Å; L133-L137 HydrophobicContact CG-CD1 3.9Å; L133-L137 HydrophobicContact CG-CG 4.48Å; L133-L137 WeakPolarHBondContact O-CG 3.44Å; L133-L137 PolarHBondContact O-N 3.15Å; L134-L137 PolarHBondContact O-N 3.36Å; L137-L139 PolarHBondContact O-N 2.88Å; L137-H140 VanDerWaalsContact O-CB 3.27Å; L137-H140 WeakPolarHBondContact O-CB 3.08Å; L137-H140 PolarHBondContact O-N 3.31Å; L137-I143 HydrophobicContact CB-CD1 3.78Å; L137-I143 HydrophobicContact CB-CG2 4.42Å; L137-I143 HydrophobicContact CD2-CD1 3.42Å; L137-I143 VanDerWaalsContact CD2-CD1 3.42Å; L137-I143 HydrophobicContact CG-CD1 4.16Å; L137-I143 WeakPolarHBondContact O-CD1 3.4Å; L137-M178 HydrophobicContact CD1-CE 3.95Å; L137-M178 HydrophobicContact CD1-SD 4.31Å; L137-M288 HydrophobicContact CD2-CE 3.59Å; L137-M288 HydrophobicContact CD2-SD 4.43Å; L137-M288 HydrophobicContact CG-CE 3.92Å; L137-M288 HydrophobicContact CG-SD 4.35Å; L137-V291 HydrophobicContact CD1-CG1 4.13Å; L137-V291 HydrophobicContact CD2-CG1 3.6Å; L137-V291 HydrophobicContact CG-CG1 4.31Å; L137-L295 HydrophobicContact CD2-CD1 3.98Å
138	R	95.9	Very high	96.7	Very high	97 Å²	97	27.1 Å²	27.1	37%	0.366	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-10.7	176.5	-72.6	172.1	83.9	114.3	5.9	114.2	L134 E135 F136 H140 A145	L134-R138 VanDerWaalsContact O-CG 3.29Å; L134-R138 WeakPolarHBondContact O-CG 3.39Å; L134-R138 PolarHBondContact O-N 2.96Å; E135-R138 PolarHBondContact O-N 3.34Å; F136-R138 VanDerWaalsContact C-N 3.34Å; F136-R138 PolarHBondContact O-N 2.83Å; R138-H140 VanDerWaalsContact C-N 3.28Å; R138-A145 HydrophobicContact CG-CB 4.1Å; R138-A145 PolarHBondContact NH1-O 3.06Å
139	L	94.8	Very high	96.7	Very high	32 Å²	32	29.4 Å²	29.4	17%	0.168	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-18.6	170.5	-63.4	173.7	0	0	0	112.9	F136 L137 V301 Y305 L317	F136-L139 WeakPolarHBondContact O-CB 3.37Å; F136-L139 PolarHBondContact O-N 3.29Å; L137-L139 PolarHBondContact O-N 2.88Å; L139-V301 HydrophobicContact CB-CG1 4.46Å; L139-V301 HydrophobicContact CB-CG2 3.88Å; L139-V301 HydrophobicContact CD1-CG1 4.15Å; L139-Y305 HydrophobicContact CB-CD1 4.3Å; L139-Y305 HydrophobicContact CB-CE1 4.47Å; L139-Y305 HydrophobicContact CD1-CD1 3.78Å; L139-Y305 HydrophobicContact CD1-CG 4.07Å; L139-Y305 HydrophobicContact CD2-CD1 4.27Å; L139-Y305 HydrophobicContact CG-CD1 4.37Å; L139-L317 HydrophobicContact CD1-CD1 4.26Å; L139-L317 HydrophobicContact CD1-CD2 3.51Å; L139-L317 HydrophobicContact CD1-CG 4.35Å; L139-L317 HydrophobicContact CD2-CD1 4.35Å; L139-L317 HydrophobicContact CG-CD1 4.35Å; L139-L317 HydrophobicContact CG-CD2 4.45Å
140	H	96.7	Very high	96.7	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.009	15%	0.154	C	C	.	.	S	Bend	trans	-77.2	129.8	178	-163.4	-80.2	0	0	0	110.1	L137 R138 D142 I143 Q292 R298 V300 V301	L137-H140 VanDerWaalsContact O-CB 3.27Å; L137-H140 WeakPolarHBondContact O-CB 3.08Å; L137-H140 PolarHBondContact O-N 3.31Å; R138-H140 VanDerWaalsContact C-N 3.28Å; H140-D142 IonicContact CE1-OD2 3.24Å; H140-D142 PolarHBondContact CE1-OD2 2.95Å; H140-D142 VanDerWaalsContact CE1-OD2 3.24Å; H140-D142 WeakPolarHBondContact ND1-CB 3.42Å; H140-D142 PolarHBondContact ND1-N 3.45Å; H140-D142 IonicContact ND1-OD2 3.92Å; H140-D142 PolarHBondContact O-N 3.03Å; H140-I143 HydrophobicContact CB-CB 4.26Å; H140-I143 HydrophobicContact CB-CD1 3.9Å; H140-I143 HydrophobicContact CB-CG1 3.96Å; H140-I143 PolarHBondContact O-N 3.24Å; H140-Q292 PolarHBondContact CD2-OE1 3.3Å; H140-R298 PolarHBondContact NE2-O 2.88Å; H140-V300 WeakPolarHBondContact NE2-CG2 3.39Å; H140-V301 HydrophobicContact CB-CG2 4.08Å
141	P	96.3	Very high	96.8	Very high	69 Å²	69	28.4 Å²	28.4	45%	0.448	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-29.3	-178.3	25.2	-34.7	0	0	0	112.9	I143 Q175	P141-I143 VanDerWaalsContact C-N 3.29Å; P141-I143 PolarHBondContact O-N 3.28Å; P141-Q175 PolarHBondContact O-NE2 2.63Å
142	D	97.9	Very high	96.9	Very high	40 Å²	40	26.4 Å²	26.4	21%	0.214	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	14.7	-177.1	-48.5	-26.8	0	0	0	112.9	H140 Q175 L176 L297 R298	H140-D142 IonicContact CE1-OD2 3.24Å; H140-D142 PolarHBondContact CE1-OD2 2.95Å; H140-D142 VanDerWaalsContact CE1-OD2 3.24Å; H140-D142 WeakPolarHBondContact ND1-CB 3.42Å; H140-D142 PolarHBondContact ND1-N 3.45Å; H140-D142 IonicContact ND1-OD2 3.92Å; H140-D142 PolarHBondContact O-N 3.03Å; D142-Q175 WeakPolarHBondContact O-CA 3.44Å; D142-L176 PolarHBondContact O-N 2.94Å; D142-L297 HydrophobicContact CB-CD2 4.02Å; D142-R298 IonicContact OD2-NH2 2.87Å
143	I	97.9	Very high	96.9	Very high	5 Å²	5	25.6 Å²	25.6	3%	0.026	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	128	177.4	-65.3	-177.6	0	0	0	110.9	L137 H140 P141 M178 L295 L297	L137-I143 HydrophobicContact CB-CD1 3.78Å; L137-I143 HydrophobicContact CB-CG2 4.42Å; L137-I143 HydrophobicContact CD2-CD1 3.42Å; L137-I143 VanDerWaalsContact CD2-CD1 3.42Å; L137-I143 HydrophobicContact CG-CD1 4.16Å; L137-I143 WeakPolarHBondContact O-CD1 3.4Å; H140-I143 HydrophobicContact CB-CB 4.26Å; H140-I143 HydrophobicContact CB-CD1 3.9Å; H140-I143 HydrophobicContact CB-CG1 3.96Å; H140-I143 PolarHBondContact O-N 3.24Å; P141-I143 VanDerWaalsContact C-N 3.29Å; P141-I143 PolarHBondContact O-N 3.28Å; I143-M178 HydrophobicContact CD1-SD 4.22Å; I143-M178 HydrophobicContact CG2-SD 4.05Å; I143-L295 HydrophobicContact CD1-CD1 4.28Å; I143-L297 HydrophobicContact CD1-CD1 3.53Å; I143-L297 HydrophobicContact CG1-CD1 3.68Å
144	R	98.2	Very high	96.9	Very high	101 Å²	101	27 Å²	27	38%	0.381	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.8	167.4	-56.4	-60.2	-66.5	156.6	-6.4	108.7	P169 Q175 L176 T177 M178	R144-P169 HydrophobicContact CB-CB 4.28Å; R144-P169 HydrophobicContact CB-CG 3.69Å; R144-Q175 HydrophobicContact CG-CB 4.24Å; R144-Q175 HydrophobicContact CG-CG 4.33Å; R144-Q175 VanDerWaalsContact CG-OE1 3.31Å; R144-L176 PolarHBondContact N-O 3.11Å; R144-T177 CarbonylContact O-C 3.57Å; R144-T177 VanDerWaalsContact O-CA 3.31Å; R144-T177 WeakPolarHBondContact O-CA 3.48Å; R144-M178 PolarHBondContact O-N 3.09Å
145	A	97.6	Very high	96.9	Very high	6 Å²	6	31.6 Å²	31.6	5%	0.05	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144.4	-176.7	0	0	0	0	0	114	L134 R138 G147 M178	L134-A145 HydrophobicContact CD1-CB 3.79Å; L134-A145 HydrophobicContact CD2-CB 4.44Å; L134-A145 HydrophobicContact CG-CB 4.23Å; R138-A145 HydrophobicContact CG-CB 4.1Å; R138-A145 PolarHBondContact NH1-O 3.06Å; A145-G147 PolarHBondContact O-N 3.34Å; A145-M178 WeakPolarHBondContact CA-O 3.24Å; A145-M178 HydrophobicContact CB-CB 4.3Å
146	V	96.7	Very high	97	Very high	16 Å²	16	32.4 Å²	32.4	10%	0.097	17%	0.168	C	C	.	.			trans	-63.6	134	170.3	-171.8	0	0	0	0	109.6	P150 M168 M178 E179	V146-P150 HydrophobicContact CB-CG 4.44Å; V146-P150 HydrophobicContact CG1-CG 4.19Å; V146-M168 HydrophobicContact CG2-CE 3.66Å; V146-M168 HydrophobicContact CG2-SD 3.52Å; V146-M168 VanDerWaalsContact CG2-SD 3.52Å; V146-M178 PolarHBondContact N-O 3.27Å; V146-E179 HydrophobicContact CB-CB 4.28Å; V146-E179 HydrophobicContact CG2-CB 4.22Å
147	G	89.8	Confident	97.1	Very high	33 Å²	33	35.6 Å²	35.6	34%	0.34	18%	0.18	S	C	.	.	S	Bend	trans	-74.9	-44.6	-179.7	0	0	0	0	0	113.5	R131 A145	R131-G147 PolarHBondContact NH1-O 3.28Å; A145-G147 PolarHBondContact O-N 3.34Å
148	A	94.7	Very high	97.2	Very high	42 Å²	42	43 Å²	43	35%	0.347	22%	0.22	S	C	.	.	S	Bend	trans	-81.1	167.5	175.9	0	0	0	0	0	111.8	P150	A148-P150 WeakPolarHBondContact O-CD 3.5Å
149	E	98.4	Very high	97.3	Very high	52 Å²	52	43.6 Å²	43.6	24%	0.243	23%	0.225	C	C	.	.			trans	-85.1	112.4	169.7	-58.3	-173.2	166	0	0	108.4	H151 K180 P182	E149-H151 VanDerWaalsContact C-N 3.26Å; E149-H151 PolarHBondContact O-N 3.35Å; E149-H151 IonicContact OE2-NE2 3.5Å; E149-K180 WeakPolarHBondContact CA-O 3.22Å; E149-K180 HydrophobicContact CG-CG 4.35Å; E149-K180 VanDerWaalsContact CG-NZ 3.31Å; E149-K180 IonicContact OE1-NZ 2.9Å; E149-K180 PolarHBondContact OE1-NZ 3.31Å; E149-P182 WeakPolarHBondContact OE1-CD 3.06Å; E149-P182 WeakPolarHBondContact OE1-CG 3.36Å; E149-P182 WeakPolarHBondContact OE2-CD 3.18Å
150	P	98.3	Very high	97.5	Very high	10 Å²	10	43.5 Å²	43.5	7%	0.065	23%	0.233	C	C	.	.			trans	-61.8	-31.6	-174.3	-28.3	37.4	0	0	0	114.3	V146 A148 F152 N156 Y164 L167 E179 T181	V146-P150 HydrophobicContact CB-CG 4.44Å; V146-P150 HydrophobicContact CG1-CG 4.19Å; A148-P150 WeakPolarHBondContact O-CD 3.5Å; P150-F152 HydrophobicContact CB-CB 4.4Å; P150-F152 PolarHBondContact O-N 3.46Å; P150-F152 VanDerWaalsContact O-N 3.15Å; P150-N156 PolarHBondContact O-ND2 2.97Å; P150-Y164 HydrophobicContact CB-CD2 4.26Å; P150-Y164 HydrophobicContact CB-CE2 3.81Å; P150-Y164 HydrophobicContact CG-CE2 4.14Å; P150-L167 HydrophobicContact CB-CD1 4Å; P150-E179 HydrophobicContact CG-CB 3.89Å; P150-E179 HydrophobicContact CG-CG 4.24Å; P150-T181 WeakPolarHBondContact CD-OG1 3.45Å
151	H	98.6	Very high	97.6	Very high	7 Å²	7	46.6 Å²	46.6	3%	0.032	25%	0.249	C	C	.	.			trans	50.1	37.8	-172.9	-77.2	-71.9	0	0	0	112.6	E149 D154 R155 N156 T181 S183	E149-H151 VanDerWaalsContact C-N 3.26Å; E149-H151 PolarHBondContact O-N 3.35Å; E149-H151 IonicContact OE2-NE2 3.5Å; H151-D154 WeakPolarHBondContact CA-OD1 3.4Å; H151-D154 VanDerWaalsContact CB-OD1 3.31Å; H151-D154 WeakPolarHBondContact CB-OD1 3.48Å; H151-D154 IonicContact CE1-OD2 3.41Å; H151-D154 IonicContact CG-OD1 3.51Å; H151-D154 IonicContact CG-OD2 2.91Å; H151-D154 IonicContact ND1-OD1 2.56Å; H151-D154 PolarHBondContact ND1-OD1 3.23Å; H151-D154 IonicContact ND1-OD2 3.91Å; H151-D154 PolarHBondContact ND1-OD2 3.49Å; H151-D154 VanDerWaalsContact O-OD1 3.09Å; H151-R155 HydrophobicContact CB-CB 4.25Å; H151-R155 HydrophobicContact CB-CG 4.35Å; H151-R155 PolarHBondContact CE1-NH1 3.46Å; H151-R155 PolarHBondContact NE2-NH1 3.33Å; H151-R155 PolarHBondContact O-N 3.16Å; H151-N156 WeakPolarHBondContact O-CB 3.47Å; H151-N156 PolarHBondContact O-N 2.91Å; H151-N156 PolarHBondContact O-ND2 3.45Å; H151-T181 HydrophobicContact CB-CG2 4.46Å; H151-T181 PolarHBondContact N-OG1 3.38Å; H151-T181 VanDerWaalsContact ND1-CG2 3.34Å; H151-T181 WeakPolarHBondContact ND1-CG2 3.37Å; H151-S183 PolarHBondContact CE1-OG 3.39Å; H151-S183 VanDerWaalsContact CE1-OG 3.25Å; H151-S183 PolarHBondContact ND1-OG 2.68Å
152	F	98.8	Very high	97.7	Very high	1 Å²	1	48 Å²	48	0%	0.004	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-58.3	-177.6	175.5	-116.3	0	0	0	110.5	P150 D154 N156 Y157 G160 L161 W163 Y164 Y184	P150-F152 HydrophobicContact CB-CB 4.4Å; P150-F152 PolarHBondContact O-N 3.46Å; P150-F152 VanDerWaalsContact O-N 3.15Å; F152-D154 PolarHBondContact O-N 3.31Å; F152-N156 WeakPolarHBondContact CD2-O 3.5Å; F152-N156 WeakPolarHBondContact CE2-O 3.39Å; F152-N156 CarbonylContact O-C 3.58Å; F152-N156 PolarHBondContact O-N 3.25Å; F152-Y157 HydrophobicContact CD1-CD2 4.42Å; F152-Y157 AromaticContact CE1-CD2 3.83Å; F152-Y157 HydrophobicContact CE1-CD2 3.83Å; F152-Y157 HydrophobicContact CE1-CE2 4.02Å; F152-Y157 HydrophobicContact CE2-CD2 4.32Å; F152-Y157 AromaticContact CZ-CD2 3.77Å; F152-Y157 HydrophobicContact CZ-CD2 3.77Å; F152-Y157 HydrophobicContact CZ-CE2 4.11Å; F152-Y157 VanDerWaalsContact O-CA 3.25Å; F152-Y157 WeakPolarHBondContact O-CA 3.45Å; F152-Y157 WeakPolarHBondContact O-CB 3.33Å; F152-Y157 PolarHBondContact O-N 2.97Å; F152-G160 VanDerWaalsContact CE2-O 3.28Å; F152-G160 WeakPolarHBondContact CE2-O 3.47Å; F152-L161 HydrophobicContact CE1-CD2 3.69Å; F152-L161 HydrophobicContact CZ-CD2 3.93Å; F152-W163 HydrophobicContact CB-CZ3 4.2Å; F152-W163 AromaticContact CD2-CE3 3.73Å; F152-W163 HydrophobicContact CD2-CE3 3.73Å; F152-W163 AromaticContact CD2-CZ3 3.72Å; F152-W163 HydrophobicContact CD2-CZ3 3.72Å; F152-W163 HydrophobicContact CE2-CE3 4.26Å; F152-W163 HydrophobicContact CG-CZ3 4.38Å; F152-Y164 HydrophobicContact CB-CD2 3.31Å; F152-Y164 HydrophobicContact CB-CE2 3.5Å; F152-Y164 VanDerWaalsContact CB-CE2 3.5Å; F152-Y164 HydrophobicContact CB-CG 3.93Å; F152-Y164 AromaticContact CD1-CD1 3.51Å; F152-Y164 HydrophobicContact CD1-CD1 3.51Å; F152-Y164 AromaticContact CD1-CD2 3.72Å; F152-Y164 HydrophobicContact CD1-CD2 3.72Å; F152-Y164 AromaticContact CD1-CE1 3.89Å; F152-Y164 HydrophobicContact CD1-CE1 3.89Å; F152-Y164 HydrophobicContact CD1-CE2 4.06Å; F152-Y164 AromaticContact CD1-CG 3.4Å; F152-Y164 HydrophobicContact CD1-CG 3.4Å; F152-Y164 HydrophobicContact CD2-CD2 4.21Å; F152-Y164 HydrophobicContact CD2-CG 4.09Å; F152-Y164 AromaticContact CE1-CD1 3.82Å; F152-Y164 HydrophobicContact CE1-CD1 3.82Å; F152-Y164 HydrophobicContact CE1-CE1 4.46Å; F152-Y164 AromaticContact CE1-CG 3.89Å; F152-Y164 HydrophobicContact CE1-CG 3.89Å; F152-Y164 HydrophobicContact CE2-CG 4.49Å; F152-Y164 HydrophobicContact CG-CD1 4.12Å; F152-Y164 AromaticContact CG-CD2 3.47Å; F152-Y164 HydrophobicContact CG-CD2 3.47Å; F152-Y164 VanDerWaalsContact CG-CD2 3.47Å; F152-Y164 AromaticContact CG-CE2 4Å; F152-Y164 HydrophobicContact CG-CE2 4Å; F152-Y164 AromaticContact CG-CG 3.51Å; F152-Y164 HydrophobicContact CG-CG 3.51Å; F152-Y164 HydrophobicContact CZ-CG 4.41Å; F152-Y184 PolarHBondContact N-OH 3.42Å
153	F	98.8	Very high	97.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-15	-172.3	-64	-71.6	0	0	0	114.5	I121 Y157 Y164 Y184 V190 R193 I194 M197	I121-F153 HydrophobicContact CD1-CE2 3.86Å; F153-Y157 HydrophobicContact CD1-CD2 4.02Å; F153-Y157 AromaticContact CD1-CE2 3.92Å; F153-Y157 HydrophobicContact CD1-CE2 3.92Å; F153-Y157 HydrophobicContact CE1-CE2 4.24Å; F153-Y164 AromaticContact CE2-CE1 3.73Å; F153-Y164 HydrophobicContact CE2-CE1 3.73Å; F153-Y164 AromaticContact CE2-CZ 3.73Å; F153-Y164 WeakPolarHBondContact CE2-OH 3.32Å; F153-Y164 HydrophobicContact CZ-CD1 4.46Å; F153-Y164 AromaticContact CZ-CE1 3.83Å; F153-Y164 HydrophobicContact CZ-CE1 3.83Å; F153-Y184 HydrophobicContact CB-CD1 4.2Å; F153-Y184 HydrophobicContact CB-CE1 3.79Å; F153-Y184 HydrophobicContact CB-CE2 4.45Å; F153-Y184 HydrophobicContact CD2-CD2 4.35Å; F153-Y184 HydrophobicContact CD2-CE1 4.38Å; F153-Y184 AromaticContact CD2-CE2 3.64Å; F153-Y184 HydrophobicContact CD2-CE2 3.64Å; F153-Y184 AromaticContact CD2-CZ 3.67Å; F153-Y184 HydrophobicContact CE2-CE2 4.49Å; F153-Y184 PolarHBondContact N-OH 2.76Å; F153-V190 HydrophobicContact CB-CB 4.37Å; F153-V190 HydrophobicContact CB-CG1 3.84Å; F153-V190 HydrophobicContact CB-CG2 3.89Å; F153-V190 VanDerWaalsContact O-CG2 3.32Å; F153-V190 WeakPolarHBondContact O-CG2 3.45Å; F153-R193 HydrophobicContact CD1-CB 3.71Å; F153-R193 HydrophobicContact CE1-CB 4.39Å; F153-R193 VanDerWaalsContact O-CD 3.24Å; F153-R193 WeakPolarHBondContact O-CD 3.49Å; F153-R193 PolarHBondContact O-NH1 2.92Å; F153-I194 HydrophobicContact CB-CG1 4.42Å; F153-I194 HydrophobicContact CD1-CG1 3.87Å; F153-I194 HydrophobicContact CD2-CD1 4.02Å; F153-I194 HydrophobicContact CD2-CG1 3.58Å; F153-I194 HydrophobicContact CE1-CG1 3.9Å; F153-I194 HydrophobicContact CE2-CD1 4.27Å; F153-I194 HydrophobicContact CE2-CG1 3.64Å; F153-I194 HydrophobicContact CG-CD1 4.4Å; F153-I194 HydrophobicContact CG-CG1 3.69Å; F153-I194 HydrophobicContact CZ-CB 4.46Å; F153-I194 HydrophobicContact CZ-CG1 3.79Å; F153-M197 HydrophobicContact CE1-CB 4.38Å; F153-M197 HydrophobicContact CZ-CB 4.35Å; F153-M197 HydrophobicContact CZ-CE 4Å; F153-M197 HydrophobicContact CZ-SD 3.7Å
154	D	98.1	Very high	97.7	Very high	28 Å²	28	49.6 Å²	49.6	15%	0.15	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-43.6	178.1	62.1	-16.4	0	0	0	113.4	H151 F152 S183 Y184 T187 V190	H151-D154 WeakPolarHBondContact CA-OD1 3.4Å; H151-D154 VanDerWaalsContact CB-OD1 3.31Å; H151-D154 WeakPolarHBondContact CB-OD1 3.48Å; H151-D154 IonicContact CE1-OD2 3.41Å; H151-D154 IonicContact CG-OD1 3.51Å; H151-D154 IonicContact CG-OD2 2.91Å; H151-D154 IonicContact ND1-OD1 2.56Å; H151-D154 PolarHBondContact ND1-OD1 3.23Å; H151-D154 IonicContact ND1-OD2 3.91Å; H151-D154 PolarHBondContact ND1-OD2 3.49Å; H151-D154 VanDerWaalsContact O-OD1 3.09Å; F152-D154 PolarHBondContact O-N 3.31Å; D154-S183 WeakPolarHBondContact OD2-CB 3.2Å; D154-S183 PolarHBondContact OD2-OG 2.99Å; D154-Y184 HydrophobicContact CB-CD1 4.16Å; D154-Y184 HydrophobicContact CB-CE1 4.27Å; D154-Y184 WeakPolarHBondContact OD1-CE1 3.34Å; D154-T187 HydrophobicContact CB-CG2 3.97Å; D154-V190 HydrophobicContact CB-CG2 4.21Å
155	R	98.1	Very high	97.8	Very high	97 Å²	97	48.7 Å²	48.7	37%	0.366	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-33.8	-172	-61.1	179.2	-177.9	158.1	0.2	115.5	N81 H151	N81-R155 VanDerWaalsContact CB-NH2 3.35Å; N81-R155 VanDerWaalsContact CG-NH2 3.28Å; N81-R155 PolarHBondContact ND2-NH2 3.43Å; H151-R155 HydrophobicContact CB-CB 4.25Å; H151-R155 HydrophobicContact CB-CG 4.35Å; H151-R155 PolarHBondContact CE1-NH1 3.46Å; H151-R155 PolarHBondContact NE2-NH1 3.33Å; H151-R155 PolarHBondContact O-N 3.16Å
156	N	98.4	Very high	97.8	Very high	38 Å²	38	53.1 Å²	53.1	20%	0.203	27%	0.268	C	S	.	.	S	Bend	trans	-110.9	21.2	-170.4	-63.2	-78.4	0	0	0	112.5	P150 H151 F152 D158 K159 W163	P150-N156 PolarHBondContact O-ND2 2.97Å; H151-N156 WeakPolarHBondContact O-CB 3.47Å; H151-N156 PolarHBondContact O-N 2.91Å; H151-N156 PolarHBondContact O-ND2 3.45Å; F152-N156 WeakPolarHBondContact CD2-O 3.5Å; F152-N156 WeakPolarHBondContact CE2-O 3.39Å; F152-N156 CarbonylContact O-C 3.58Å; F152-N156 PolarHBondContact O-N 3.25Å; N156-D158 VanDerWaalsContact C-N 3.26Å; N156-D158 PolarHBondContact O-N 2.9Å; N156-K159 HydrophobicContact CB-CD 4.08Å; N156-K159 HydrophobicContact CB-CG 4.42Å; N156-K159 WeakPolarHBondContact O-CB 3.34Å; N156-K159 PolarHBondContact O-N 2.92Å; N156-K159 VanDerWaalsContact O-N 3.08Å; N156-K159 WeakPolarHBondContact OD1-CE 3.46Å; N156-K159 PolarHBondContact OD1-NZ 2.99Å; N156-W163 HydrophobicContact CB-CE3 4.36Å; N156-W163 HydrophobicContact CB-CH2 3.58Å; N156-W163 HydrophobicContact CB-CZ2 4.45Å; N156-W163 HydrophobicContact CB-CZ3 3.55Å
157	Y	98.6	Very high	97.9	Very high	71 Å²	71	55.6 Å²	55.6	28%	0.278	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-63	-34.8	-170.8	-168.9	-114.2	0	0	0	112.3	F152 F153 K159 G160 R193	F152-Y157 HydrophobicContact CD1-CD2 4.42Å; F152-Y157 AromaticContact CE1-CD2 3.83Å; F152-Y157 HydrophobicContact CE1-CD2 3.83Å; F152-Y157 HydrophobicContact CE1-CE2 4.02Å; F152-Y157 HydrophobicContact CE2-CD2 4.32Å; F152-Y157 AromaticContact CZ-CD2 3.77Å; F152-Y157 HydrophobicContact CZ-CD2 3.77Å; F152-Y157 HydrophobicContact CZ-CE2 4.11Å; F152-Y157 VanDerWaalsContact O-CA 3.25Å; F152-Y157 WeakPolarHBondContact O-CA 3.45Å; F152-Y157 WeakPolarHBondContact O-CB 3.33Å; F152-Y157 PolarHBondContact O-N 2.97Å; F153-Y157 HydrophobicContact CD1-CD2 4.02Å; F153-Y157 AromaticContact CD1-CE2 3.92Å; F153-Y157 HydrophobicContact CD1-CE2 3.92Å; F153-Y157 HydrophobicContact CE1-CE2 4.24Å; Y157-K159 PolarHBondContact O-N 3.36Å; Y157-K159 VanDerWaalsContact O-N 3.13Å; Y157-G160 PolarHBondContact O-N 3.35Å; Y157-G160 VanDerWaalsContact O-N 3.11Å; Y157-R193 HydrophobicContact CD1-CG 4.26Å; Y157-R193 HydrophobicContact CD2-CB 4.28Å; Y157-R193 HydrophobicContact CD2-CG 4.23Å; Y157-R193 HydrophobicContact CE1-CG 3.82Å; Y157-R193 HydrophobicContact CE2-CB 3.68Å; Y157-R193 HydrophobicContact CE2-CG 3.82Å; Y157-R193 HydrophobicContact CG-CG 4.43Å
158	D	98.3	Very high	98.3	Very high	157 Å²	157	54.1 Å²	54.1	84%	0.84	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-66.9	-12.8	179.6	-55.6	-37.4	0	0	0	113.3	N156 G160	N156-D158 VanDerWaalsContact C-N 3.26Å; N156-D158 PolarHBondContact O-N 2.9Å; D158-G160 PolarHBondContact O-N 2.81Å
159	K	98.4	Very high	98.4	Very high	108 Å²	108	53.4 Å²	53.4	47%	0.47	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-74.7	-9.9	174.3	-60.3	-173	177.8	161.5	0	113.2	N156 Y157 W163	N156-K159 HydrophobicContact CB-CD 4.08Å; N156-K159 HydrophobicContact CB-CG 4.42Å; N156-K159 WeakPolarHBondContact O-CB 3.34Å; N156-K159 PolarHBondContact O-N 2.92Å; N156-K159 VanDerWaalsContact O-N 3.08Å; N156-K159 WeakPolarHBondContact OD1-CE 3.46Å; N156-K159 PolarHBondContact OD1-NZ 2.99Å; Y157-K159 PolarHBondContact O-N 3.36Å; Y157-K159 VanDerWaalsContact O-N 3.13Å; K159-W163 HydrophobicContact CB-CB 3.77Å; K159-W163 HydrophobicContact CB-CD2 3.64Å; K159-W163 HydrophobicContact CB-CE3 3.87Å; K159-W163 HydrophobicContact CB-CG 3.58Å; K159-W163 HydrophobicContact CD-CD2 3.57Å; K159-W163 HydrophobicContact CD-CE3 4.08Å; K159-W163 HydrophobicContact CD-CG 3.97Å; K159-W163 HydrophobicContact CD-CH2 4.17Å; K159-W163 HydrophobicContact CD-CZ2 3.69Å; K159-W163 HydrophobicContact CD-CZ3 4.36Å; K159-W163 HydrophobicContact CG-CD2 4.25Å; K159-W163 HydrophobicContact CG-CG 4.4Å; K159-W163 VanDerWaalsContact O-CB 3.23Å; K159-W163 WeakPolarHBondContact O-CB 3.46Å
160	G	98.4	Very high	98.4	Very high	31 Å²	31	56.8 Å²	56.8	32%	0.32	27%	0.27	S	S	.	.	H	α-helix	trans	79.8	164.3	175.7	0	0	0	0	0	114.6	F152 Y157 D158 E162 W163 Y164	F152-G160 VanDerWaalsContact CE2-O 3.28Å; F152-G160 WeakPolarHBondContact CE2-O 3.47Å; Y157-G160 PolarHBondContact O-N 3.35Å; Y157-G160 VanDerWaalsContact O-N 3.11Å; D158-G160 PolarHBondContact O-N 2.81Å; G160-E162 VanDerWaalsContact C-N 3.27Å; G160-E162 PolarHBondContact O-N 3.32Å; G160-W163 PolarHBondContact O-N 3.49Å; G160-Y164 PolarHBondContact O-N 2.88Å
161	L	98.4	Very high	98.3	Very high	67 Å²	67	56.3 Å²	56.3	35%	0.351	27%	0.267	S	S	.	.	H	α-helix	trans	-66	-27.5	-175.8	-71.5	177.6	0	0	0	113.4	F152 Y164 R165 M197	F152-L161 HydrophobicContact CE1-CD2 3.69Å; F152-L161 HydrophobicContact CZ-CD2 3.93Å; L161-Y164 PolarHBondContact O-N 3.32Å; L161-R165 WeakPolarHBondContact O-CB 3.39Å; L161-R165 PolarHBondContact O-N 3.46Å; L161-M197 HydrophobicContact CD1-CG 4.44Å; L161-M197 HydrophobicContact CD2-CB 4.21Å; L161-M197 HydrophobicContact CD2-CG 3.87Å; L161-M197 HydrophobicContact CD2-SD 4.15Å
162	E	98.4	Very high	98.2	Very high	99 Å²	99	57.6 Å²	57.6	46%	0.463	28%	0.278	S	S	.	.	H	α-helix	trans	-67.8	-44.3	177.9	-161.8	58.9	-140	0	0	111.2	G160 Y164 R165 E166	G160-E162 VanDerWaalsContact C-N 3.27Å; G160-E162 PolarHBondContact O-N 3.32Å; E162-Y164 PolarHBondContact O-N 3.13Å; E162-R165 VanDerWaalsContact CD-NH1 3.33Å; E162-R165 PolarHBondContact O-N 3.13Å; E162-R165 IonicContact OE1-NH1 3.7Å; E162-R165 PolarHBondContact OE1-NH1 3.03Å; E162-R165 IonicContact OE2-CZ 2.88Å; E162-R165 IonicContact OE2-NH1 3.63Å; E162-R165 PolarHBondContact OE2-NH1 3.48Å; E162-R165 IonicContact OE2-NH2 3.27Å; E162-E166 WeakPolarHBondContact O-CG 3.35Å; E162-E166 PolarHBondContact O-N 3.34Å
163	W	98.6	Very high	97.9	Very high	78 Å²	78	63.4 Å²	63.4	30%	0.295	31%	0.305	S	S	.	.	H	α-helix	trans	-57	-41.8	172.6	177.1	84.8	0	0	0	111.3	F152 N156 K159 G160 E166 L167	F152-W163 HydrophobicContact CB-CZ3 4.2Å; F152-W163 AromaticContact CD2-CE3 3.73Å; F152-W163 HydrophobicContact CD2-CE3 3.73Å; F152-W163 AromaticContact CD2-CZ3 3.72Å; F152-W163 HydrophobicContact CD2-CZ3 3.72Å; F152-W163 HydrophobicContact CE2-CE3 4.26Å; F152-W163 HydrophobicContact CG-CZ3 4.38Å; N156-W163 HydrophobicContact CB-CE3 4.36Å; N156-W163 HydrophobicContact CB-CH2 3.58Å; N156-W163 HydrophobicContact CB-CZ2 4.45Å; N156-W163 HydrophobicContact CB-CZ3 3.55Å; K159-W163 HydrophobicContact CB-CB 3.77Å; K159-W163 HydrophobicContact CB-CD2 3.64Å; K159-W163 HydrophobicContact CB-CE3 3.87Å; K159-W163 HydrophobicContact CB-CG 3.58Å; K159-W163 HydrophobicContact CD-CD2 3.57Å; K159-W163 HydrophobicContact CD-CE3 4.08Å; K159-W163 HydrophobicContact CD-CG 3.97Å; K159-W163 HydrophobicContact CD-CH2 4.17Å; K159-W163 HydrophobicContact CD-CZ2 3.69Å; K159-W163 HydrophobicContact CD-CZ3 4.36Å; K159-W163 HydrophobicContact CG-CD2 4.25Å; K159-W163 HydrophobicContact CG-CG 4.4Å; K159-W163 VanDerWaalsContact O-CB 3.23Å; K159-W163 WeakPolarHBondContact O-CB 3.46Å; G160-W163 PolarHBondContact O-N 3.49Å; W163-E166 PolarHBondContact O-N 3.41Å; W163-L167 HydrophobicContact CE3-CD1 4.19Å; W163-L167 HydrophobicContact CH2-CD1 3.53Å; W163-L167 HydrophobicContact CZ2-CD1 3.91Å; W163-L167 HydrophobicContact CZ2-CD2 4.41Å; W163-L167 HydrophobicContact CZ3-CD1 3.66Å; W163-L167 PolarHBondContact O-N 2.91Å
164	Y	98.8	Very high	97.7	Very high	0 Å²	0	70 Å²	70	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-66.1	-43.5	178	-176.6	-132.3	0	0	0	112.8	L117 P118 P150 F152 F153 G160 L161 E162 E166 L167 M168 E179 M197	L117-Y164 HydrophobicContact CD2-CD1 3.72Å; L117-Y164 HydrophobicContact CD2-CE1 4.33Å; P118-Y164 HydrophobicContact CG-CE1 3.77Å; P118-Y164 WeakPolarHBondContact CG-OH 3.46Å; P150-Y164 HydrophobicContact CB-CD2 4.26Å; P150-Y164 HydrophobicContact CB-CE2 3.81Å; P150-Y164 HydrophobicContact CG-CE2 4.14Å; F152-Y164 HydrophobicContact CB-CD2 3.31Å; F152-Y164 HydrophobicContact CB-CE2 3.5Å; F152-Y164 VanDerWaalsContact CB-CE2 3.5Å; F152-Y164 HydrophobicContact CB-CG 3.93Å; F152-Y164 AromaticContact CD1-CD1 3.51Å; F152-Y164 HydrophobicContact CD1-CD1 3.51Å; F152-Y164 AromaticContact CD1-CD2 3.72Å; F152-Y164 HydrophobicContact CD1-CD2 3.72Å; F152-Y164 AromaticContact CD1-CE1 3.89Å; F152-Y164 HydrophobicContact CD1-CE1 3.89Å; F152-Y164 HydrophobicContact CD1-CE2 4.06Å; F152-Y164 AromaticContact CD1-CG 3.4Å; F152-Y164 HydrophobicContact CD1-CG 3.4Å; F152-Y164 HydrophobicContact CD2-CD2 4.21Å; F152-Y164 HydrophobicContact CD2-CG 4.09Å; F152-Y164 AromaticContact CE1-CD1 3.82Å; F152-Y164 HydrophobicContact CE1-CD1 3.82Å; F152-Y164 HydrophobicContact CE1-CE1 4.46Å; F152-Y164 AromaticContact CE1-CG 3.89Å; F152-Y164 HydrophobicContact CE1-CG 3.89Å; F152-Y164 HydrophobicContact CE2-CG 4.49Å; F152-Y164 HydrophobicContact CG-CD1 4.12Å; F152-Y164 AromaticContact CG-CD2 3.47Å; F152-Y164 HydrophobicContact CG-CD2 3.47Å; F152-Y164 VanDerWaalsContact CG-CD2 3.47Å; F152-Y164 AromaticContact CG-CE2 4Å; F152-Y164 HydrophobicContact CG-CE2 4Å; F152-Y164 AromaticContact CG-CG 3.51Å; F152-Y164 HydrophobicContact CG-CG 3.51Å; F152-Y164 HydrophobicContact CZ-CG 4.41Å; F153-Y164 AromaticContact CE2-CE1 3.73Å; F153-Y164 HydrophobicContact CE2-CE1 3.73Å; F153-Y164 AromaticContact CE2-CZ 3.73Å; F153-Y164 WeakPolarHBondContact CE2-OH 3.32Å; F153-Y164 HydrophobicContact CZ-CD1 4.46Å; F153-Y164 AromaticContact CZ-CE1 3.83Å; F153-Y164 HydrophobicContact CZ-CE1 3.83Å; G160-Y164 PolarHBondContact O-N 2.88Å; L161-Y164 PolarHBondContact O-N 3.32Å; E162-Y164 PolarHBondContact O-N 3.13Å; Y164-E166 VanDerWaalsContact C-N 3.27Å; Y164-E166 PolarHBondContact O-N 2.89Å; Y164-L167 WeakPolarHBondContact O-CB 3.26Å; Y164-L167 PolarHBondContact O-N 3.39Å; Y164-M168 HydrophobicContact CD2-CE 3.69Å; Y164-M168 HydrophobicContact CE1-CE 4.28Å; Y164-M168 HydrophobicContact CE2-CE 3.37Å; Y164-M168 HydrophobicContact CG-CE 4.3Å; Y164-M168 WeakPolarHBondContact O-CE 3.39Å; Y164-E179 VanDerWaalsContact OH-CD 3.31Å; Y164-E179 VanDerWaalsContact OH-CG 3.24Å; Y164-E179 WeakPolarHBondContact OH-CG 3.27Å; Y164-E179 PolarHBondContact OH-OE1 3.14Å; Y164-M197 HydrophobicContact CD1-SD 4.23Å; Y164-M197 HydrophobicContact CE1-SD 3.89Å
165	R	98.6	Very high	97.6	Very high	82 Å²	82	70.1 Å²	70.1	31%	0.309	34%	0.34	S	S	.	.	H	α-helix	trans	-59.6	-39.3	174.9	-174.3	-173	-63.9	145.4	5.7	111.3	K115 L117 L161 E162 L167 M168	K115-R165 HydrophobicContact CB-CG 4.09Å; K115-R165 WeakPolarHBondContact O-CD 3.26Å; K115-R165 WeakPolarHBondContact O-CG 3.41Å; L117-R165 HydrophobicContact CD2-CB 3.93Å; L161-R165 WeakPolarHBondContact O-CB 3.39Å; L161-R165 PolarHBondContact O-N 3.46Å; E162-R165 VanDerWaalsContact CD-NH1 3.33Å; E162-R165 PolarHBondContact O-N 3.13Å; E162-R165 IonicContact OE1-NH1 3.7Å; E162-R165 PolarHBondContact OE1-NH1 3.03Å; E162-R165 IonicContact OE2-CZ 2.88Å; E162-R165 IonicContact OE2-NH1 3.63Å; E162-R165 PolarHBondContact OE2-NH1 3.48Å; E162-R165 IonicContact OE2-NH2 3.27Å; R165-L167 PolarHBondContact O-N 2.96Å; R165-M168 VanDerWaalsContact O-CB 3.22Å; R165-M168 WeakPolarHBondContact O-CB 3.48Å; R165-M168 WeakPolarHBondContact O-CG 3.48Å; R165-M168 PolarHBondContact O-N 3.11Å
166	E	98.3	Very high	97.6	Very high	99 Å²	99	67.2 Å²	67.2	46%	0.463	33%	0.331	S	S	.	.	H	α-helix	trans	-65.4	-19.5	179.3	-77.5	-55	126.1	0	0	114	K115 E162 W163 Y164 M168	K115-E166 PolarHBondContact NZ-O 3.41Å; K115-E166 IonicContact NZ-OE2 2.69Å; K115-E166 PolarHBondContact NZ-OE2 3.13Å; E162-E166 WeakPolarHBondContact O-CG 3.35Å; E162-E166 PolarHBondContact O-N 3.34Å; W163-E166 PolarHBondContact O-N 3.41Å; Y164-E166 VanDerWaalsContact C-N 3.27Å; Y164-E166 PolarHBondContact O-N 2.89Å; E166-M168 VanDerWaalsContact C-N 3.3Å
167	L	98.3	Very high	97.6	Very high	67 Å²	67	65.4 Å²	65.4	35%	0.351	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-18.1	171.5	-58.7	179.7	0	0	0	113.1	P150 W163 Y164 R165	P150-L167 HydrophobicContact CB-CD1 4Å; W163-L167 HydrophobicContact CE3-CD1 4.19Å; W163-L167 HydrophobicContact CH2-CD1 3.53Å; W163-L167 HydrophobicContact CZ2-CD1 3.91Å; W163-L167 HydrophobicContact CZ2-CD2 4.41Å; W163-L167 HydrophobicContact CZ3-CD1 3.66Å; W163-L167 PolarHBondContact O-N 2.91Å; Y164-L167 WeakPolarHBondContact O-CB 3.26Å; Y164-L167 PolarHBondContact O-N 3.39Å; R165-L167 PolarHBondContact O-N 2.96Å
168	M	98.4	Very high	97.6	Very high	3 Å²	3	62 Å²	62	2%	0.015	31%	0.308	C	S	.	.	S	Bend	trans	-73.3	141.8	-174.4	-59.4	-63.8	131.2	0	0	110.6	K115 K116 P118 V146 Y164 R165 E166 T177	K115-M168 VanDerWaalsContact CD-O 3.3Å; K115-M168 WeakPolarHBondContact CD-O 3.17Å; K115-M168 WeakPolarHBondContact CE-O 3.26Å; K115-M168 WeakPolarHBondContact CG-O 3.33Å; K116-M168 WeakPolarHBondContact O-CB 3.48Å; K116-M168 WeakPolarHBondContact O-CG 3.48Å; P118-M168 HydrophobicContact CB-SD 4.4Å; P118-M168 HydrophobicContact CG-SD 4.27Å; V146-M168 HydrophobicContact CG2-CE 3.66Å; V146-M168 HydrophobicContact CG2-SD 3.52Å; V146-M168 VanDerWaalsContact CG2-SD 3.52Å; Y164-M168 HydrophobicContact CD2-CE 3.69Å; Y164-M168 HydrophobicContact CE1-CE 4.28Å; Y164-M168 HydrophobicContact CE2-CE 3.37Å; Y164-M168 HydrophobicContact CG-CE 4.3Å; Y164-M168 WeakPolarHBondContact O-CE 3.39Å; R165-M168 VanDerWaalsContact O-CB 3.22Å; R165-M168 WeakPolarHBondContact O-CB 3.48Å; R165-M168 WeakPolarHBondContact O-CG 3.48Å; R165-M168 PolarHBondContact O-N 3.11Å; E166-M168 VanDerWaalsContact C-N 3.3Å; M168-T177 HydrophobicContact CB-CG2 3.93Å; M168-T177 HydrophobicContact CG-CG2 4.04Å; M168-T177 HydrophobicContact SD-CG2 3.65Å
169	P	97.8	Very high	97.6	Very high	27 Å²	27	54.6 Å²	54.6	18%	0.175	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-63.3	154.6	169.4	29.9	-35.6	0	0	0	109.8	R144	R144-P169 HydrophobicContact CB-CB 4.28Å; R144-P169 HydrophobicContact CB-CG 3.69Å
170	K	97.6	Very high	97.7	Very high	122 Å²	122	49.7 Å²	49.7	53%	0.53	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	140.6	164.7	-66.7	-174	179.3	-175.6	0	109.6	E113 S114 K115	E113-K170 HydrophobicContact CB-CB 4.24Å; S114-K170 WeakPolarHBondContact O-CA 3.4Å; K115-K170 HydrophobicContact CG-CG 4.2Å
171	S	96.9	Very high	97.7	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	146.4	178.4	57.8	0	0	0	0	110	S114 T177	S114-S171 PolarHBondContact N-O 2.95Å; S114-S171 PolarHBondContact O-N 2.91Å; S171-T177 WeakPolarHBondContact CB-OG1 3.43Å; S171-T177 PolarHBondContact OG-OG1 3.07Å
172	S	96.1	Very high	97.7	Very high	35 Å²	35	45.4 Å²	45.4	25%	0.245	22%	0.218	C	C	.	.			trans	-71.9	179.6	170.6	62.9	0	0	0	0	112.2	K116 Q175	K116-S172 PolarHBondContact NZ-O 3.02Å; S172-Q175 VanDerWaalsContact N-OE1 3.13Å; S172-Q175 WeakPolarHBondContact OG-CG 3.24Å; S172-Q175 PolarHBondContact OG-OE1 3.07Å
173	E	92.6	Very high	97.7	Very high	123 Å²	123	42 Å²	42	58%	0.575	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-39.4	175.4	-69.8	-51.4	129.3	0	0	113.9	K116 Q175	K116-E173 WeakPolarHBondContact CE-OE1 3.23Å; K116-E173 VanDerWaalsContact NZ-CA 3.28Å; K116-E173 IonicContact NZ-OE1 2.71Å; K116-E173 PolarHBondContact NZ-OE1 3.01Å; K116-E173 IonicContact NZ-OE2 3.5Å; K116-E173 PolarHBondContact NZ-OE2 3.38Å; E173-Q175 VanDerWaalsContact C-N 3.29Å; E173-Q175 PolarHBondContact O-N 2.93Å
174	D	93.7	Very high	97.7	Very high	139 Å²	139	38.2 Å²	38.2	74%	0.743	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.5	-176.6	-56.3	-47.6	0	0	0	113.8
175	Q	97.3	Very high	97.7	Very high	30 Å²	30	38.2 Å²	38.2	14%	0.14	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-95.7	135.5	-178.3	-83.5	178.3	-20.7	0	0	112.6	P141 D142 R144 S172 E173	P141-Q175 PolarHBondContact O-NE2 2.63Å; D142-Q175 WeakPolarHBondContact O-CA 3.44Å; R144-Q175 HydrophobicContact CG-CB 4.24Å; R144-Q175 HydrophobicContact CG-CG 4.33Å; R144-Q175 VanDerWaalsContact CG-OE1 3.31Å; S172-Q175 VanDerWaalsContact N-OE1 3.13Å; S172-Q175 WeakPolarHBondContact OG-CG 3.24Å; S172-Q175 PolarHBondContact OG-OE1 3.07Å; E173-Q175 VanDerWaalsContact C-N 3.29Å; E173-Q175 PolarHBondContact O-N 2.93Å
176	L	98.1	Very high	97.7	Very high	36 Å²	36	36.1 Å²	36.1	19%	0.188	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	129.9	169.3	-63.3	-179	0	0	0	110.4	Q119 D142 R144 L295 L297	Q119-L176 HydrophobicContact CB-CD2 4.11Å; Q119-L176 HydrophobicContact CG-CD2 4.38Å; D142-L176 PolarHBondContact O-N 2.94Å; R144-L176 PolarHBondContact N-O 3.11Å; L176-L295 HydrophobicContact CD1-CB 3.98Å; L176-L295 HydrophobicContact CD1-CD2 4.45Å; L176-L297 HydrophobicContact CD1-CD1 4.14Å; L176-L297 HydrophobicContact CD1-CD2 3.88Å; L176-L297 HydrophobicContact CD1-CG 4.04Å; L176-L297 HydrophobicContact CG-CD2 4.33Å
177	T	98.5	Very high	97.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.1	168.6	-70.6	0	0	0	0	109.9	K116 P118 Q119 R144 M168 S171	K116-T177 WeakPolarHBondContact O-CG2 3.46Å; P118-T177 CarbonylContact C-O 3.44Å; P118-T177 WeakPolarHBondContact CA-O 3.39Å; P118-T177 HydrophobicContact CB-CG2 4.38Å; P118-T177 WeakPolarHBondContact CB-O 3.37Å; Q119-T177 PolarHBondContact N-O 2.93Å; Q119-T177 VanDerWaalsContact N-O 3.13Å; Q119-T177 PolarHBondContact OE1-O 3.15Å; R144-T177 CarbonylContact O-C 3.57Å; R144-T177 VanDerWaalsContact O-CA 3.31Å; R144-T177 WeakPolarHBondContact O-CA 3.48Å; M168-T177 HydrophobicContact CB-CG2 3.93Å; M168-T177 HydrophobicContact CG-CG2 4.04Å; M168-T177 HydrophobicContact SD-CG2 3.65Å; S171-T177 WeakPolarHBondContact CB-OG1 3.43Å; S171-T177 PolarHBondContact OG-OG1 3.07Å
178	M	98.8	Very high	97.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	159.1	-176.6	-60.2	-173.9	68.8	0	0	113.1	A120 I122 L137 I143 R144 A145 V146 I204 L295	A120-M178 HydrophobicContact CB-CE 3.83Å; A120-M178 HydrophobicContact CB-CG 4.21Å; A120-M178 HydrophobicContact CB-SD 4.38Å; A120-M178 WeakPolarHBondContact O-CA 3.09Å; I122-M178 HydrophobicContact CG1-CE 4.31Å; L137-M178 HydrophobicContact CD1-CE 3.95Å; L137-M178 HydrophobicContact CD1-SD 4.31Å; I143-M178 HydrophobicContact CD1-SD 4.22Å; I143-M178 HydrophobicContact CG2-SD 4.05Å; R144-M178 PolarHBondContact O-N 3.09Å; A145-M178 WeakPolarHBondContact CA-O 3.24Å; A145-M178 HydrophobicContact CB-CB 4.3Å; V146-M178 PolarHBondContact N-O 3.27Å; M178-I204 HydrophobicContact CE-CD1 3.96Å; M178-L295 HydrophobicContact CE-CD1 4.2Å; M178-L295 HydrophobicContact SD-CD1 4.01Å
179	E	98.8	Very high	97.8	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	169.2	166.6	64.7	107.1	119.6	0	0	111.1	P118 I121 I122 V146 P150 Y164 T181 Y184	P118-E179 HydrophobicContact CG-CG 4.27Å; I121-E179 HydrophobicContact CG1-CG 4.37Å; I121-E179 HydrophobicContact CG2-CG 4.06Å; I122-E179 PolarHBondContact N-O 3.38Å; V146-E179 HydrophobicContact CB-CB 4.28Å; V146-E179 HydrophobicContact CG2-CB 4.22Å; P150-E179 HydrophobicContact CG-CB 3.89Å; P150-E179 HydrophobicContact CG-CG 4.24Å; Y164-E179 VanDerWaalsContact OH-CD 3.31Å; Y164-E179 VanDerWaalsContact OH-CG 3.24Å; Y164-E179 WeakPolarHBondContact OH-CG 3.27Å; Y164-E179 PolarHBondContact OH-OE1 3.14Å; E179-T181 PolarHBondContact OE2-N 2.9Å; E179-T181 PolarHBondContact OE2-OG1 2.91Å; E179-Y184 WeakPolarHBondContact OE1-CE2 3.4Å; E179-Y184 PolarHBondContact OE1-OH 3.32Å
180	K	98.8	Very high	97.8	Very high	5 Å²	5	41.7 Å²	41.7	2%	0.022	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.5	166.7	80.3	178.9	177.5	68.3	0	110.6	I122 T130 L134 E149	I122-K180 HydrophobicContact CB-CB 3.73Å; I122-K180 HydrophobicContact CD1-CB 4.35Å; I122-K180 HydrophobicContact CG1-CB 4.5Å; I122-K180 HydrophobicContact CG2-CB 4.25Å; I122-K180 WeakPolarHBondContact O-CA 3.45Å; T130-K180 WeakPolarHBondContact O-CD 3.45Å; L134-K180 HydrophobicContact CB-CD 4.02Å; L134-K180 HydrophobicContact CD2-CB 4.29Å; L134-K180 HydrophobicContact CD2-CD 3.82Å; L134-K180 HydrophobicContact CD2-CG 3.91Å; E149-K180 WeakPolarHBondContact CA-O 3.22Å; E149-K180 HydrophobicContact CG-CG 4.35Å; E149-K180 VanDerWaalsContact CG-NZ 3.31Å; E149-K180 IonicContact OE1-NZ 2.9Å; E149-K180 PolarHBondContact OE1-NZ 3.31Å
181	T	98.9	Very high	97.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.177	C	C	.	.			trans	-147.2	99.1	166.9	-53.6	0	0	0	0	108.8	I122 I123 P150 H151 E179 S183 Y184	I122-T181 PolarHBondContact O-N 2.8Å; I123-T181 CarbonylContact C-O 3.04Å; I123-T181 VanDerWaalsContact O-O 3.12Å; P150-T181 WeakPolarHBondContact CD-OG1 3.45Å; H151-T181 HydrophobicContact CB-CG2 4.46Å; H151-T181 PolarHBondContact N-OG1 3.38Å; H151-T181 VanDerWaalsContact ND1-CG2 3.34Å; H151-T181 WeakPolarHBondContact ND1-CG2 3.37Å; E179-T181 PolarHBondContact OE2-N 2.9Å; E179-T181 PolarHBondContact OE2-OG1 2.91Å; T181-S183 WeakPolarHBondContact CG2-OG 3.5Å; T181-S183 PolarHBondContact O-N 2.64Å; T181-S183 VanDerWaalsContact O-N 3.11Å; T181-Y184 HydrophobicContact CG2-CD1 3.65Å; T181-Y184 HydrophobicContact CG2-CD2 4.48Å; T181-Y184 HydrophobicContact CG2-CE1 3.4Å; T181-Y184 VanDerWaalsContact CG2-CE1 3.4Å; T181-Y184 HydrophobicContact CG2-CE2 4.27Å; T181-Y184 HydrophobicContact CG2-CG 4.19Å; T181-Y184 WeakPolarHBondContact O-CB 3.27Å; T181-Y184 PolarHBondContact O-N 3.35Å; T181-Y184 VanDerWaalsContact O-N 3.12Å; T181-Y184 VanDerWaalsContact OG1-CZ 3.26Å; T181-Y184 PolarHBondContact OG1-OH 3.29Å
182	P	98.8	Very high	98	Very high	9 Å²	9	38.2 Å²	38.2	6%	0.058	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-16.7	-168.2	-23.7	35.2	0	0	0	116	I123 K126 T130 E149 Y184	I123-P182 CarbonylContact O-C 3.55Å; K126-P182 HydrophobicContact CB-CB 4.33Å; T130-P182 HydrophobicContact CG2-CB 4.23Å; T130-P182 HydrophobicContact CG2-CG 4Å; T130-P182 VanDerWaalsContact OG1-CG 3.3Å; T130-P182 WeakPolarHBondContact OG1-CG 3.45Å; E149-P182 WeakPolarHBondContact OE1-CD 3.06Å; E149-P182 WeakPolarHBondContact OE1-CG 3.36Å; E149-P182 WeakPolarHBondContact OE2-CD 3.18Å; P182-Y184 VanDerWaalsContact C-N 3.31Å
183	S	98.8	Very high	98.1	Very high	26 Å²	26	39.2 Å²	39.2	18%	0.182	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-23.1	176	43.2	0	0	0	0	112.7	H151 D154 T181 F185 V186 T187	H151-S183 PolarHBondContact CE1-OG 3.39Å; H151-S183 VanDerWaalsContact CE1-OG 3.25Å; H151-S183 PolarHBondContact ND1-OG 2.68Å; D154-S183 WeakPolarHBondContact OD2-CB 3.2Å; D154-S183 PolarHBondContact OD2-OG 2.99Å; T181-S183 WeakPolarHBondContact CG2-OG 3.5Å; T181-S183 PolarHBondContact O-N 2.64Å; T181-S183 VanDerWaalsContact O-N 3.11Å; S183-F185 PolarHBondContact O-N 2.99Å; S183-V186 VanDerWaalsContact O-CG2 3.29Å; S183-V186 WeakPolarHBondContact O-CG2 3.38Å; S183-V186 PolarHBondContact O-N 3.49Å; S183-V186 VanDerWaalsContact O-N 3.1Å; S183-T187 PolarHBondContact O-N 2.8Å; S183-T187 PolarHBondContact O-OG1 3.14Å; S183-T187 VanDerWaalsContact O-OG1 3.08Å
184	Y	98.9	Very high	98.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-44.1	-178.2	-74.7	-5.1	0	0	0	112.5	I121 I123 F152 F153 D154 E179 T181 P182 V186 T187 V190 I194 W263	I121-Y184 HydrophobicContact CG2-CD2 4.05Å; I121-Y184 HydrophobicContact CG2-CE2 4.07Å; I123-Y184 HydrophobicContact CG2-CD2 4.18Å; I123-Y184 WeakPolarHBondContact O-CB 3.47Å; F152-Y184 PolarHBondContact N-OH 3.42Å; F153-Y184 HydrophobicContact CB-CD1 4.2Å; F153-Y184 HydrophobicContact CB-CE1 3.79Å; F153-Y184 HydrophobicContact CB-CE2 4.45Å; F153-Y184 HydrophobicContact CD2-CD2 4.35Å; F153-Y184 HydrophobicContact CD2-CE1 4.38Å; F153-Y184 AromaticContact CD2-CE2 3.64Å; F153-Y184 HydrophobicContact CD2-CE2 3.64Å; F153-Y184 AromaticContact CD2-CZ 3.67Å; F153-Y184 HydrophobicContact CE2-CE2 4.49Å; F153-Y184 PolarHBondContact N-OH 2.76Å; D154-Y184 HydrophobicContact CB-CD1 4.16Å; D154-Y184 HydrophobicContact CB-CE1 4.27Å; D154-Y184 WeakPolarHBondContact OD1-CE1 3.34Å; E179-Y184 WeakPolarHBondContact OE1-CE2 3.4Å; E179-Y184 PolarHBondContact OE1-OH 3.32Å; T181-Y184 HydrophobicContact CG2-CD1 3.65Å; T181-Y184 HydrophobicContact CG2-CD2 4.48Å; T181-Y184 HydrophobicContact CG2-CE1 3.4Å; T181-Y184 VanDerWaalsContact CG2-CE1 3.4Å; T181-Y184 HydrophobicContact CG2-CE2 4.27Å; T181-Y184 HydrophobicContact CG2-CG 4.19Å; T181-Y184 WeakPolarHBondContact O-CB 3.27Å; T181-Y184 PolarHBondContact O-N 3.35Å; T181-Y184 VanDerWaalsContact O-N 3.12Å; T181-Y184 VanDerWaalsContact OG1-CZ 3.26Å; T181-Y184 PolarHBondContact OG1-OH 3.29Å; P182-Y184 VanDerWaalsContact C-N 3.31Å; Y184-V186 PolarHBondContact O-N 2.91Å; Y184-T187 PolarHBondContact O-N 3.21Å; Y184-V190 HydrophobicContact CD1-CG1 4.19Å; Y184-V190 HydrophobicContact CD1-CG2 4.14Å; Y184-V190 HydrophobicContact CD2-CG1 4.43Å; Y184-V190 HydrophobicContact CG-CG1 3.87Å; Y184-I194 HydrophobicContact CD2-CD1 4.41Å; Y184-W263 WeakPolarHBondContact O-CZ2 3.35Å
185	F	98.9	Very high	98.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-32.5	-177.3	-172.4	-111.8	0	0	0	113.8	I123 V125 S183 V205 Y256 H259 W263	I123-F185 HydrophobicContact CD1-CD2 4Å; I123-F185 HydrophobicContact CG1-CD2 4.42Å; I123-F185 WeakPolarHBondContact O-CB 3.28Å; I123-F185 PolarHBondContact O-N 3.48Å; V125-F185 HydrophobicContact CG1-CB 4.4Å; V125-F185 HydrophobicContact CG1-CD1 3.4Å; V125-F185 HydrophobicContact CG1-CE1 3.75Å; V125-F185 HydrophobicContact CG1-CG 3.98Å; S183-F185 PolarHBondContact O-N 2.99Å; F185-V205 HydrophobicContact CD2-CG1 4.08Å; F185-V205 HydrophobicContact CD2-CG2 3.98Å; F185-V205 HydrophobicContact CE2-CG1 4.02Å; F185-V205 HydrophobicContact CE2-CG2 3.95Å; F185-V205 HydrophobicContact CG-CG1 4.43Å; F185-V205 HydrophobicContact CZ-CG1 4.29Å; F185-Y256 HydrophobicContact CE1-CD1 4.15Å; F185-H259 HydrophobicContact CD1-CB 3.84Å; F185-H259 HydrophobicContact CE1-CB 3.37Å; F185-H259 HydrophobicContact CE2-CB 4.37Å; F185-H259 HydrophobicContact CZ-CB 3.68Å; F185-W263 AromaticContact CD2-CD1 3.81Å; F185-W263 AromaticContact CD2-NE1 3.47Å; F185-W263 AromaticContact CE2-CD1 3.83Å; F185-W263 AromaticContact CE2-NE1 3.99Å; F185-W263 PolarHBondContact O-NE1 3.32Å
186	V	98.7	Very high	98.7	Very high	38 Å²	38	32.8 Å²	32.8	23%	0.23	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-19.1	-175.2	-58.8	0	0	0	0	114	S183 Y184 I253 R262	S183-V186 VanDerWaalsContact O-CG2 3.29Å; S183-V186 WeakPolarHBondContact O-CG2 3.38Å; S183-V186 PolarHBondContact O-N 3.49Å; S183-V186 VanDerWaalsContact O-N 3.1Å; Y184-V186 PolarHBondContact O-N 2.91Å; V186-I253 HydrophobicContact CG1-CB 4.35Å; V186-I253 HydrophobicContact CG1-CG1 4.05Å; V186-I253 HydrophobicContact CG1-CG2 4.19Å; V186-I253 HydrophobicContact CG2-CG1 4.46Å; V186-R262 PolarHBondContact O-NH2 3.23Å
187	T	98.7	Very high	98.7	Very high	29 Å²	29	32.5 Å²	32.5	18%	0.178	16%	0.162	C	C	.	.			trans	-70.2	131	177.6	-55.3	0	0	0	0	110.6	D154 S183 Y184 E189 V190	D154-T187 HydrophobicContact CB-CG2 3.97Å; S183-T187 PolarHBondContact O-N 2.8Å; S183-T187 PolarHBondContact O-OG1 3.14Å; S183-T187 VanDerWaalsContact O-OG1 3.08Å; Y184-T187 PolarHBondContact O-N 3.21Å; T187-E189 WeakPolarHBondContact CG2-OE2 3.47Å; T187-E189 PolarHBondContact O-N 3.26Å; T187-V190 VanDerWaalsContact CB-CG2 3.47Å; T187-V190 HydrophobicContact CG2-CG2 3.55Å
188	R	98.4	Very high	98.7	Very high	193 Å²	193	34.6 Å²	34.6	73%	0.728	18%	0.176	S	C	*	.	S	Bend	trans	-69.2	-38.6	-166.6	-179.6	-177.1	-179.4	-175.9	-0.7	113
189	E	98.7	Very high	98.7	Very high	90 Å²	90	40.2 Å²	40.2	42%	0.421	20%	0.201	S	C	.	.	S	Bend	trans	-82.6	-21.4	-172.8	-58.5	70.2	-152.3	0	0	112.2	T187 S192 R193	T187-E189 WeakPolarHBondContact CG2-OE2 3.47Å; T187-E189 PolarHBondContact O-N 3.26Å; E189-S192 PolarHBondContact O-N 3.02Å; E189-R193 WeakPolarHBondContact O-CG 3.32Å; E189-R193 PolarHBondContact O-N 3.19Å; E189-R193 VanDerWaalsContact O-N 3.14Å
190	V	98.9	Very high	98.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.1	-43.5	-169.9	172.9	0	0	0	0	114.2	F153 D154 Y184 T187 S192 R193 I194 W263	F153-V190 HydrophobicContact CB-CB 4.37Å; F153-V190 HydrophobicContact CB-CG1 3.84Å; F153-V190 HydrophobicContact CB-CG2 3.89Å; F153-V190 VanDerWaalsContact O-CG2 3.32Å; F153-V190 WeakPolarHBondContact O-CG2 3.45Å; D154-V190 HydrophobicContact CB-CG2 4.21Å; Y184-V190 HydrophobicContact CD1-CG1 4.19Å; Y184-V190 HydrophobicContact CD1-CG2 4.14Å; Y184-V190 HydrophobicContact CD2-CG1 4.43Å; Y184-V190 HydrophobicContact CG-CG1 3.87Å; T187-V190 VanDerWaalsContact CB-CG2 3.47Å; T187-V190 HydrophobicContact CG2-CG2 3.55Å; V190-S192 VanDerWaalsContact C-N 3.32Å; V190-S192 PolarHBondContact O-N 3.16Å; V190-R193 PolarHBondContact O-N 2.86Å; V190-R193 VanDerWaalsContact O-N 3.14Å; V190-I194 HydrophobicContact CG1-CD1 3.57Å; V190-I194 HydrophobicContact CG1-CG1 3.99Å; V190-I194 WeakPolarHBondContact O-CG1 3.37Å; V190-I194 PolarHBondContact O-N 2.83Å; V190-W263 HydrophobicContact CG1-CH2 3.77Å; V190-W263 HydrophobicContact CG1-CZ2 4.09Å
191	P	98.9	Very high	98.7	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-54.2	-47.3	177.8	-26.7	34.6	0	0	0	112.6	R193 Y195 W263 F266 F267	P191-R193 PolarHBondContact O-N 3.16Å; P191-Y195 VanDerWaalsContact O-CB 3.28Å; P191-Y195 WeakPolarHBondContact O-CB 3.47Å; P191-Y195 PolarHBondContact O-N 3.3Å; P191-W263 HydrophobicContact CB-CD2 4.19Å; P191-W263 HydrophobicContact CB-CE3 4.02Å; P191-W263 HydrophobicContact CB-CZ3 4.36Å; P191-W263 HydrophobicContact CG-CD2 3.75Å; P191-W263 HydrophobicContact CG-CE3 4.03Å; P191-W263 HydrophobicContact CG-CG 4.16Å; P191-W263 HydrophobicContact CG-CH2 4.43Å; P191-W263 HydrophobicContact CG-CZ2 4.11Å; P191-W263 HydrophobicContact CG-CZ3 4.37Å; P191-F266 HydrophobicContact CB-CB 4.42Å; P191-F266 HydrophobicContact CB-CD2 3.55Å; P191-F266 HydrophobicContact CB-CE2 4.09Å; P191-F266 HydrophobicContact CB-CG 4.11Å; P191-F267 WeakPolarHBondContact O-CE2 3.48Å
192	S	98.8	Very high	98.7	Very high	49 Å²	49	49.8 Å²	49.8	34%	0.343	25%	0.249	S	C	.	.	H	α-helix	trans	-64.4	-40.8	178.3	-175.4	0	0	0	0	112.4	E189 V190 Y195 S196 F266	E189-S192 PolarHBondContact O-N 3.02Å; V190-S192 VanDerWaalsContact C-N 3.32Å; V190-S192 PolarHBondContact O-N 3.16Å; S192-Y195 PolarHBondContact O-N 3.24Å; S192-S196 WeakPolarHBondContact O-CB 3.38Å; S192-S196 PolarHBondContact O-N 3.01Å; S192-S196 PolarHBondContact O-OG 3.49Å; S192-F266 VanDerWaalsContact CB-CE1 3.47Å
193	R	98.8	Very high	98.7	Very high	56 Å²	56	49.3 Å²	49.3	21%	0.211	25%	0.246	C	C	.	.	H	α-helix	trans	-66.7	-42.9	-179.6	-67.8	174.6	169.8	172.5	-3.2	112.3	F153 Y157 E189 V190 P191 S196 M197	F153-R193 HydrophobicContact CD1-CB 3.71Å; F153-R193 HydrophobicContact CE1-CB 4.39Å; F153-R193 VanDerWaalsContact O-CD 3.24Å; F153-R193 WeakPolarHBondContact O-CD 3.49Å; F153-R193 PolarHBondContact O-NH1 2.92Å; Y157-R193 HydrophobicContact CD1-CG 4.26Å; Y157-R193 HydrophobicContact CD2-CB 4.28Å; Y157-R193 HydrophobicContact CD2-CG 4.23Å; Y157-R193 HydrophobicContact CE1-CG 3.82Å; Y157-R193 HydrophobicContact CE2-CB 3.68Å; Y157-R193 HydrophobicContact CE2-CG 3.82Å; Y157-R193 HydrophobicContact CG-CG 4.43Å; E189-R193 WeakPolarHBondContact O-CG 3.32Å; E189-R193 PolarHBondContact O-N 3.19Å; E189-R193 VanDerWaalsContact O-N 3.14Å; V190-R193 PolarHBondContact O-N 2.86Å; V190-R193 VanDerWaalsContact O-N 3.14Å; P191-R193 PolarHBondContact O-N 3.16Å; R193-S196 PolarHBondContact O-N 3.38Å; R193-M197 PolarHBondContact O-N 2.79Å
194	I	98.9	Very high	98.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.8	-43.9	175.6	-63.1	176.2	0	0	0	109.9	I121 I123 F153 Y184 V190 S196 M197 S198 T201 L203 W263 F267	I121-I194 HydrophobicContact CD1-CD1 4.16Å; I121-I194 HydrophobicContact CD1-CG1 4.47Å; I121-I194 HydrophobicContact CD1-CG2 4.16Å; I123-I194 HydrophobicContact CG2-CD1 4.15Å; F153-I194 HydrophobicContact CB-CG1 4.42Å; F153-I194 HydrophobicContact CD1-CG1 3.87Å; F153-I194 HydrophobicContact CD2-CD1 4.02Å; F153-I194 HydrophobicContact CD2-CG1 3.58Å; F153-I194 HydrophobicContact CE1-CG1 3.9Å; F153-I194 HydrophobicContact CE2-CD1 4.27Å; F153-I194 HydrophobicContact CE2-CG1 3.64Å; F153-I194 HydrophobicContact CG-CD1 4.4Å; F153-I194 HydrophobicContact CG-CG1 3.69Å; F153-I194 HydrophobicContact CZ-CB 4.46Å; F153-I194 HydrophobicContact CZ-CG1 3.79Å; Y184-I194 HydrophobicContact CD2-CD1 4.41Å; V190-I194 HydrophobicContact CG1-CD1 3.57Å; V190-I194 HydrophobicContact CG1-CG1 3.99Å; V190-I194 WeakPolarHBondContact O-CG1 3.37Å; V190-I194 PolarHBondContact O-N 2.83Å; I194-S196 PolarHBondContact O-N 3.16Å; I194-M197 WeakPolarHBondContact O-CA 3.4Å; I194-M197 WeakPolarHBondContact O-CB 3.34Å; I194-M197 PolarHBondContact O-N 2.75Å; I194-S198 PolarHBondContact O-N 2.91Å; I194-T201 HydrophobicContact CG2-CG2 3.93Å; I194-L203 HydrophobicContact CD1-CD2 4.49Å; I194-L203 HydrophobicContact CG2-CD2 4.29Å; I194-W263 HydrophobicContact CD1-CH2 3.73Å; I194-W263 HydrophobicContact CD1-CZ3 4.01Å; I194-F267 HydrophobicContact CB-CE2 4.35Å; I194-F267 HydrophobicContact CB-CZ 4.15Å; I194-F267 HydrophobicContact CG2-CE2 4.34Å; I194-F267 HydrophobicContact CG2-CZ 3.76Å
195	Y	98.8	Very high	98.7	Very high	73 Å²	73	48.1 Å²	48.1	29%	0.286	24%	0.237	S	C	.	.	H	α-helix	trans	-59.4	-35.7	177.6	-174.9	-93.9	0	0	0	112.5	P191 S192 M197 S198 K199 F266 F267	P191-Y195 VanDerWaalsContact O-CB 3.28Å; P191-Y195 WeakPolarHBondContact O-CB 3.47Å; P191-Y195 PolarHBondContact O-N 3.3Å; S192-Y195 PolarHBondContact O-N 3.24Å; Y195-M197 VanDerWaalsContact C-N 3.33Å; Y195-S198 CarbonylContact O-C 3.32Å; Y195-K199 HydrophobicContact CD1-CG 4.25Å; Y195-K199 HydrophobicContact CD2-CB 4.29Å; Y195-K199 HydrophobicContact CD2-CG 4.09Å; Y195-K199 HydrophobicContact CE1-CD 3.94Å; Y195-K199 HydrophobicContact CE1-CG 3.86Å; Y195-K199 HydrophobicContact CE2-CB 3.89Å; Y195-K199 HydrophobicContact CE2-CD 4.09Å; Y195-K199 HydrophobicContact CE2-CG 3.69Å; Y195-K199 HydrophobicContact CG-CG 4.36Å; Y195-K199 WeakPolarHBondContact OH-CD 3.27Å; Y195-K199 WeakPolarHBondContact OH-CE 3.48Å; Y195-F266 HydrophobicContact CD1-CD1 4.26Å; Y195-F266 HydrophobicContact CD2-CB 4.05Å; Y195-F266 WeakPolarHBondContact CD2-O 3.19Å; Y195-F266 WeakPolarHBondContact CE2-O 3.37Å; Y195-F266 HydrophobicContact CG-CB 4.2Å; Y195-F266 HydrophobicContact CG-CD1 4.06Å; Y195-F267 HydrophobicContact CD2-CE1 4.27Å; Y195-F267 HydrophobicContact CD2-CE2 4.43Å; Y195-F267 HydrophobicContact CD2-CZ 4.18Å
196	S	98.7	Very high	98.7	Very high	83 Å²	83	48.1 Å²	48.1	58%	0.58	24%	0.237	S	C	*	.	H	α-helix	trans	-70.4	-28	175.5	-58.6	0	0	0	0	113	S192 R193 I194	S192-S196 WeakPolarHBondContact O-CB 3.38Å; S192-S196 PolarHBondContact O-N 3.01Å; S192-S196 PolarHBondContact O-OG 3.49Å; R193-S196 PolarHBondContact O-N 3.38Å; I194-S196 PolarHBondContact O-N 3.16Å
197	M	98.6	Very high	98.7	Very high	30 Å²	30	46.3 Å²	46.3	15%	0.148	23%	0.226	C	C	.	.	H	α-helix	trans	-73.2	-52.2	173	179.9	-171.2	70.7	0	0	110.8	L117 P118 I121 F153 L161 Y164 R193 I194 Y195	L117-M197 HydrophobicContact CB-SD 4.16Å; L117-M197 HydrophobicContact CD1-CG 3.95Å; L117-M197 HydrophobicContact CD1-SD 4.06Å; L117-M197 HydrophobicContact CD2-SD 4.09Å; L117-M197 HydrophobicContact CG-SD 4.34Å; P118-M197 HydrophobicContact CG-CE 4.44Å; I121-M197 HydrophobicContact CD1-CE 4.33Å; F153-M197 HydrophobicContact CE1-CB 4.38Å; F153-M197 HydrophobicContact CZ-CB 4.35Å; F153-M197 HydrophobicContact CZ-CE 4Å; F153-M197 HydrophobicContact CZ-SD 3.7Å; L161-M197 HydrophobicContact CD1-CG 4.44Å; L161-M197 HydrophobicContact CD2-CB 4.21Å; L161-M197 HydrophobicContact CD2-CG 3.87Å; L161-M197 HydrophobicContact CD2-SD 4.15Å; Y164-M197 HydrophobicContact CD1-SD 4.23Å; Y164-M197 HydrophobicContact CE1-SD 3.89Å; R193-M197 PolarHBondContact O-N 2.79Å; I194-M197 WeakPolarHBondContact O-CA 3.4Å; I194-M197 WeakPolarHBondContact O-CB 3.34Å; I194-M197 PolarHBondContact O-N 2.75Å; Y195-M197 VanDerWaalsContact C-N 3.33Å
198	S	98.2	Very high	98.7	Very high	44 Å²	44	47.5 Å²	47.5	31%	0.308	23%	0.228	S	C	.	.			trans	-158	132.6	173.7	177.3	0	0	0	0	110	I194 Y195 D200 T201	I194-S198 PolarHBondContact O-N 2.91Å; Y195-S198 CarbonylContact O-C 3.32Å; S198-D200 VanDerWaalsContact C-N 3.25Å; S198-D200 PolarHBondContact O-N 2.85Å; S198-D200 PolarHBondContact OG-N 2.88Å; S198-T201 PolarHBondContact O-OG1 3.01Å
199	K	98.4	Very high	98.7	Very high	119 Å²	119	39 Å²	39	52%	0.517	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-22.7	178	-57.8	-177.7	176.7	-169.5	0	111.9	Y195 Q271	Y195-K199 HydrophobicContact CD1-CG 4.25Å; Y195-K199 HydrophobicContact CD2-CB 4.29Å; Y195-K199 HydrophobicContact CD2-CG 4.09Å; Y195-K199 HydrophobicContact CE1-CD 3.94Å; Y195-K199 HydrophobicContact CE1-CG 3.86Å; Y195-K199 HydrophobicContact CE2-CB 3.89Å; Y195-K199 HydrophobicContact CE2-CD 4.09Å; Y195-K199 HydrophobicContact CE2-CG 3.69Å; Y195-K199 HydrophobicContact CG-CG 4.36Å; Y195-K199 WeakPolarHBondContact OH-CD 3.27Å; Y195-K199 WeakPolarHBondContact OH-CE 3.48Å; K199-Q271 PolarHBondContact O-NE2 2.92Å; K199-Q271 PolarHBondContact O-OE1 2.75Å
200	D	98.4	Very high	98.8	Very high	130 Å²	130	34.7 Å²	34.7	70%	0.695	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.5	1.4	-174.9	-54.6	-43.4	0	0	0	113	S198 K202 Q271	S198-D200 VanDerWaalsContact C-N 3.25Å; S198-D200 PolarHBondContact O-N 2.85Å; S198-D200 PolarHBondContact OG-N 2.88Å; D200-K202 PolarHBondContact O-N 3.09Å; D200-Q271 VanDerWaalsContact C-NE2 3.28Å
201	T	98.8	Very high	98.7	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.012	18%	0.177	C	C	.	.			trans	-57.5	129	178.8	-62.7	0	0	0	0	110.8	I121 I194 S198 L203 Q271	I121-T201 HydrophobicContact CD1-CG2 3.95Å; I121-T201 HydrophobicContact CG1-CG2 4Å; I194-T201 HydrophobicContact CG2-CG2 3.93Å; S198-T201 PolarHBondContact O-OG1 3.01Å; T201-L203 HydrophobicContact CG2-CD2 3.91Å; T201-Q271 PolarHBondContact O-NE2 3.34Å
202	K	98.9	Very high	98.7	Very high	73 Å²	73	36.5 Å²	36.5	32%	0.317	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138.7	172.6	-69.7	-172.8	178.2	-174.8	0	110.6	Q119 A120 I121 D200 F294 L295	Q119-K202 PolarHBondContact O-N 3.14Å; A120-K202 CarbonylContact C-O 3.54Å; A120-K202 WeakPolarHBondContact CA-O 3.26Å; A120-K202 HydrophobicContact CB-CB 4.04Å; I121-K202 PolarHBondContact N-O 3.43Å; D200-K202 PolarHBondContact O-N 3.09Å; K202-F294 HydrophobicContact CB-CE1 3.8Å; K202-F294 HydrophobicContact CB-CZ 3.88Å; K202-F294 HydrophobicContact CD-CE1 4.19Å; K202-F294 HydrophobicContact CD-CZ 4.24Å; K202-F294 WeakPolarHBondContact CD-O 3.19Å; K202-F294 HydrophobicContact CG-CE1 4.38Å; K202-F294 HydrophobicContact CG-CZ 4.2Å; K202-F294 PolarHBondContact NZ-O 3.35Å; K202-L295 HydrophobicContact CD-CD2 4.44Å
203	L	98.9	Very high	98.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.5	-173.4	-54.8	174	0	0	0	110.1	I121 I123 I194 T201 W263 F267 Q271 L272 L273	I121-L203 HydrophobicContact CB-CD2 4.47Å; I123-L203 HydrophobicContact CD1-CB 4.04Å; I123-L203 HydrophobicContact CD1-CD1 4.33Å; I123-L203 HydrophobicContact CG2-CD2 3.87Å; I194-L203 HydrophobicContact CD1-CD2 4.49Å; I194-L203 HydrophobicContact CG2-CD2 4.29Å; T201-L203 HydrophobicContact CG2-CD2 3.91Å; L203-W263 HydrophobicContact CD1-CE3 3.48Å; L203-W263 VanDerWaalsContact CD1-CE3 3.48Å; L203-W263 HydrophobicContact CD1-CZ3 3.48Å; L203-W263 VanDerWaalsContact CD1-CZ3 3.48Å; L203-W263 HydrophobicContact CD2-CZ3 4.17Å; L203-W263 HydrophobicContact CG-CZ3 4.44Å; L203-F267 HydrophobicContact CD1-CB 4.1Å; L203-F267 HydrophobicContact CD1-CD1 4.03Å; L203-F267 HydrophobicContact CD1-CD2 3.61Å; L203-F267 HydrophobicContact CD1-CE1 4.37Å; L203-F267 HydrophobicContact CD1-CE2 3.99Å; L203-F267 HydrophobicContact CD1-CG 3.63Å; L203-F267 HydrophobicContact CD1-CZ 4.35Å; L203-Q271 PolarHBondContact N-O 2.77Å; L203-L272 HydrophobicContact CB-CG 4.19Å; L203-L272 HydrophobicContact CD1-CD2 4.34Å; L203-L272 HydrophobicContact CD1-CG 4.21Å; L203-L272 CarbonylContact O-C 3.51Å; L203-L272 WeakPolarHBondContact O-CA 3.45Å; L203-L273 PolarHBondContact O-N 3.44Å
204	I	98.9	Very high	98.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.7	177.3	-57.8	169.1	0	0	0	109.7	I121 I122 I123 L133 M178 L273 V275 V291 F294 L295	I121-I204 PolarHBondContact O-N 2.93Å; I122-I204 CarbonylContact C-O 3.54Å; I122-I204 WeakPolarHBondContact CA-O 3.39Å; I122-I204 HydrophobicContact CG1-CB 4.24Å; I122-I204 HydrophobicContact CG1-CD1 4.5Å; I123-I204 PolarHBondContact N-O 2.81Å; L133-I204 HydrophobicContact CD2-CG2 3.68Å; M178-I204 HydrophobicContact CE-CD1 3.96Å; I204-L273 WeakPolarHBondContact CA-O 3.45Å; I204-L273 HydrophobicContact CG1-CB 4.35Å; I204-V275 HydrophobicContact CG2-CG2 3.72Å; I204-V291 HydrophobicContact CD1-CG1 3.94Å; I204-F294 HydrophobicContact CD1-CD1 4.47Å; I204-F294 HydrophobicContact CD1-CE1 4.47Å; I204-F294 HydrophobicContact CG1-CD1 4.17Å; I204-F294 HydrophobicContact CG1-CE1 3.81Å; I204-L295 HydrophobicContact CD1-CD1 4.41Å; I204-L295 HydrophobicContact CD1-CD2 4.22Å; I204-L295 HydrophobicContact CD1-CG 4.48Å
205	V	98.9	Very high	98.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	110.3	176.5	-168.1	0	0	0	0	109	I123 G124 V125 F185 V207 L273 F274 V275	I123-V205 HydrophobicContact CD1-CG2 3.78Å; I123-V205 HydrophobicContact CG1-CG2 3.78Å; G124-V205 CarbonylContact O-C 3.21Å; G124-V205 WeakPolarHBondContact O-CA 3.45Å; V125-V205 HydrophobicContact CG1-CG1 3.75Å; F185-V205 HydrophobicContact CD2-CG1 4.08Å; F185-V205 HydrophobicContact CD2-CG2 3.98Å; F185-V205 HydrophobicContact CE2-CG1 4.02Å; F185-V205 HydrophobicContact CE2-CG2 3.95Å; F185-V205 HydrophobicContact CG-CG1 4.43Å; F185-V205 HydrophobicContact CZ-CG1 4.29Å; V205-V207 HydrophobicContact CG1-CG1 3.8Å; V205-V207 PolarHBondContact O-N 3.29Å; V205-L273 PolarHBondContact N-O 2.94Å; V205-F274 HydrophobicContact CB-CD1 3.75Å; V205-F274 HydrophobicContact CB-CE1 3.97Å; V205-F274 HydrophobicContact CG1-CD1 4.28Å; V205-F274 HydrophobicContact CG1-CE1 4.44Å; V205-F274 HydrophobicContact CG2-CD1 4.17Å; V205-F274 HydrophobicContact CG2-CE1 3.88Å; V205-F274 WeakPolarHBondContact O-CA 3.43Å; V205-V275 PolarHBondContact O-N 3.32Å
206	V	98.9	Very high	98.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	103.8	170.6	-165	0	0	0	0	108.2	I122 G124 V125 G128 T130 L133 V275 L280	I122-V206 HydrophobicContact CG2-CG2 4.26Å; G124-V206 PolarHBondContact O-N 2.81Å; V125-V206 WeakPolarHBondContact CG2-O 3.34Å; V125-V206 PolarHBondContact N-O 3.16Å; G128-V206 WeakPolarHBondContact CA-O 3.28Å; G128-V206 VanDerWaalsContact O-CG1 3.3Å; G128-V206 WeakPolarHBondContact O-CG1 3.47Å; T130-V206 HydrophobicContact CG2-CB 4.34Å; T130-V206 HydrophobicContact CG2-CG2 4.27Å; L133-V206 HydrophobicContact CB-CG2 4.06Å; L133-V206 HydrophobicContact CD2-CG2 3.38Å; L133-V206 HydrophobicContact CG-CG2 4.35Å; V206-V275 WeakPolarHBondContact CA-O 3.48Å; V206-V275 HydrophobicContact CG1-CB 4.38Å; V206-V275 HydrophobicContact CG1-CG1 4.23Å; V206-V275 HydrophobicContact CG2-CB 4.29Å; V206-L280 HydrophobicContact CG1-CD2 4.19Å
207	V	98.9	Very high	98.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	162.5	179.6	-66.4	0	0	0	0	111.1	V205 Y256 F274 V275 G277 F359 F367 W369	V205-V207 HydrophobicContact CG1-CG1 3.8Å; V205-V207 PolarHBondContact O-N 3.29Å; V207-Y256 HydrophobicContact CB-CE2 4.18Å; V207-Y256 HydrophobicContact CG1-CD2 4.32Å; V207-Y256 HydrophobicContact CG1-CE2 4.37Å; V207-F274 HydrophobicContact CG1-CD1 4.36Å; V207-V275 WeakPolarHBondContact CG2-O 3.45Å; V207-V275 PolarHBondContact N-O 2.97Å; V207-G277 VanDerWaalsContact O-CA 3.25Å; V207-G277 WeakPolarHBondContact O-CA 3.38Å; V207-G277 PolarHBondContact O-N 3.05Å; V207-F359 HydrophobicContact CG1-CE1 4.09Å; V207-F359 HydrophobicContact CG1-CZ 3.8Å; V207-F359 HydrophobicContact CG2-CE1 4.39Å; V207-F367 HydrophobicContact CG2-CD1 3.65Å; V207-F367 HydrophobicContact CG2-CE1 3.38Å; V207-F367 HydrophobicContact CG2-CE2 4.4Å; V207-F367 HydrophobicContact CG2-CG 4.28Å; V207-F367 HydrophobicContact CG2-CZ 3.8Å; V207-W369 HydrophobicContact CB-CH2 3.8Å; V207-W369 HydrophobicContact CB-CZ2 3.95Å; V207-W369 HydrophobicContact CG2-CH2 3.79Å; V207-W369 HydrophobicContact CG2-CZ2 3.73Å
208	R	98.8	Very high	98.7	Very high	54 Å²	54	24.5 Å²	24.5	20%	0.204	12%	0.123	C	C	.	.			trans	-150	158.1	-179.4	179.6	-179.3	175	168.1	6.5	107.9	K127 P210 T212 R213 S216 Y256 E278 H337	K127-R208 WeakPolarHBondContact O-CD 3.33Å; R208-P210 WeakPolarHBondContact O-CD 3.34Å; R208-T212 PolarHBondContact NE-OG1 2.81Å; R208-R213 HydrophobicContact CB-CB 4.32Å; R208-R213 HydrophobicContact CG-CB 4.36Å; R208-S216 PolarHBondContact NH1-OG 3.41Å; R208-Y256 VanDerWaalsContact O-CE2 3.27Å; R208-Y256 WeakPolarHBondContact O-CE2 3.38Å; R208-Y256 PolarHBondContact O-OH 3.01Å; R208-E278 VanDerWaalsContact CG-OE1 3.26Å; R208-E278 WeakPolarHBondContact CG-OE1 3.05Å; R208-H337 PolarHBondContact NH2-CE1 2.95Å
209	N	98.8	Very high	98.7	Very high	14 Å²	14	22.8 Å²	22.8	8%	0.075	11%	0.111	C	C	.	.			trans	-48.2	119	170.3	179.3	-53.1	0	0	0	109.7	V211 T212 R213 E278 W369	N209-V211 PolarHBondContact O-N 3.45Å; N209-V211 VanDerWaalsContact O-N 3.14Å; N209-V211 WeakPolarHBondContact OD1-CB 3.48Å; N209-V211 PolarHBondContact OD1-N 3.32Å; N209-T212 HydrophobicContact CB-CG2 4.27Å; N209-T212 PolarHBondContact O-N 3.31Å; N209-T212 VanDerWaalsContact O-N 3.09Å; N209-T212 PolarHBondContact O-OG1 2.93Å; N209-T212 PolarHBondContact OD1-N 3.18Å; N209-R213 WeakPolarHBondContact O-CB 3.43Å; N209-R213 PolarHBondContact O-N 3.48Å; N209-E278 WeakPolarHBondContact CB-OE1 3.31Å; N209-E278 PolarHBondContact N-OE1 2.92Å; N209-W369 HydrophobicContact CB-CB 4.25Å; N209-W369 HydrophobicContact CB-CD2 4.41Å; N209-W369 HydrophobicContact CB-CG 3.81Å; N209-W369 WeakPolarHBondContact ND2-CB 3Å
210	P	98.8	Very high	98.6	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63.4	-27.1	-167.4	23.6	-34.9	0	0	0	113	R208 A214 Y256 Y352 N356	R208-P210 WeakPolarHBondContact O-CD 3.34Å; P210-A214 WeakPolarHBondContact O-CB 3.41Å; P210-A214 PolarHBondContact O-N 2.85Å; P210-Y256 HydrophobicContact CB-CE2 4.39Å; P210-Y352 HydrophobicContact CB-CD1 3.85Å; P210-Y352 HydrophobicContact CB-CD2 3.82Å; P210-Y352 HydrophobicContact CB-CE1 3.9Å; P210-Y352 HydrophobicContact CB-CE2 3.86Å; P210-Y352 HydrophobicContact CB-CG 3.81Å; P210-Y352 HydrophobicContact CG-CD1 3.99Å; P210-Y352 HydrophobicContact CG-CD2 3.76Å; P210-Y352 HydrophobicContact CG-CE2 4.32Å; P210-Y352 HydrophobicContact CG-CG 3.57Å; P210-N356 WeakPolarHBondContact CG-OD1 3.28Å
211	V	98.7	Very high	98.5	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.018	7%	0.068	C	C	.	.	H	α-helix	trans	-67.4	-54.1	174	-176.4	0	0	0	0	110.3	N209 R213 A214 I215 V345 L348 R349 Y352	N209-V211 PolarHBondContact O-N 3.45Å; N209-V211 VanDerWaalsContact O-N 3.14Å; N209-V211 WeakPolarHBondContact OD1-CB 3.48Å; N209-V211 PolarHBondContact OD1-N 3.32Å; V211-R213 PolarHBondContact O-N 3.24Å; V211-A214 PolarHBondContact O-N 3.14Å; V211-A214 VanDerWaalsContact O-N 3.16Å; V211-I215 HydrophobicContact CG1-CD1 4.12Å; V211-I215 WeakPolarHBondContact O-CG1 3.36Å; V211-I215 PolarHBondContact O-N 2.98Å; V211-V345 HydrophobicContact CG1-CG1 4.22Å; V211-L348 HydrophobicContact CG1-CB 4.31Å; V211-L348 HydrophobicContact CG1-CD1 4.46Å; V211-L348 HydrophobicContact CG2-CB 3.99Å; V211-R349 HydrophobicContact CG2-CG 3.83Å; V211-Y352 HydrophobicContact CG2-CD2 3.81Å; V211-Y352 HydrophobicContact CG2-CE2 4.22Å
212	T	98.5	Very high	98.4	Very high	37 Å²	37	17.5 Å²	17.5	23%	0.227	8%	0.082	C	C	.	.	H	α-helix	trans	-65.9	-29.7	180	71.9	0	0	0	0	112.1	R208 N209 S216	R208-T212 PolarHBondContact NE-OG1 2.81Å; N209-T212 HydrophobicContact CB-CG2 4.27Å; N209-T212 PolarHBondContact O-N 3.31Å; N209-T212 VanDerWaalsContact O-N 3.09Å; N209-T212 PolarHBondContact O-OG1 2.93Å; N209-T212 PolarHBondContact OD1-N 3.18Å; T212-S216 WeakPolarHBondContact O-CB 3.49Å; T212-S216 PolarHBondContact O-N 3.11Å
213	R	98.8	Very high	98.2	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64.7	-47.2	172.3	-170.8	-132.9	73.8	75.9	1.2	111.3	V125 K126 K127 R208 N209 V211 S216 D217 A250 Y256	V125-R213 HydrophobicContact CG2-CG 4.44Å; K126-R213 WeakPolarHBondContact O-CG 3.32Å; K126-R213 PolarHBondContact O-NH1 3.19Å; K127-R213 HydrophobicContact CB-CG 4.1Å; R208-R213 HydrophobicContact CB-CB 4.32Å; R208-R213 HydrophobicContact CG-CB 4.36Å; N209-R213 WeakPolarHBondContact O-CB 3.43Å; N209-R213 PolarHBondContact O-N 3.48Å; V211-R213 PolarHBondContact O-N 3.24Å; R213-S216 WeakPolarHBondContact O-CB 3.5Å; R213-S216 PolarHBondContact O-N 2.96Å; R213-D217 IonicContact CZ-OD2 3.51Å; R213-D217 IonicContact NH1-OD2 3.43Å; R213-D217 PolarHBondContact NH1-OD2 3.14Å; R213-D217 IonicContact NH2-OD2 2.62Å; R213-D217 PolarHBondContact NH2-OD2 3.06Å; R213-D217 VanDerWaalsContact NH2-OD2 3.11Å; R213-D217 PolarHBondContact O-N 3.48Å; R213-A250 VanDerWaalsContact NH2-C 3.32Å; R213-A250 VanDerWaalsContact NH2-CA 3.3Å; R213-A250 PolarHBondContact NH2-O 3.38Å; R213-Y256 VanDerWaalsContact CD-OH 3.28Å; R213-Y256 WeakPolarHBondContact CD-OH 3.47Å
214	A	98.8	Very high	98	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.2	-45.4	176.6	0	0	0	0	0	111.8	P210 V211 S216 D217 Y218 F231 A250	P210-A214 WeakPolarHBondContact O-CB 3.41Å; P210-A214 PolarHBondContact O-N 2.85Å; V211-A214 PolarHBondContact O-N 3.14Å; V211-A214 VanDerWaalsContact O-N 3.16Å; A214-S216 VanDerWaalsContact C-N 3.3Å; A214-S216 PolarHBondContact O-N 3.39Å; A214-D217 VanDerWaalsContact O-CB 3.32Å; A214-D217 WeakPolarHBondContact O-CB 3.34Å; A214-D217 PolarHBondContact O-N 2.98Å; A214-D217 VanDerWaalsContact O-N 3.14Å; A214-Y218 PolarHBondContact O-N 3.08Å; A214-F231 HydrophobicContact CB-CE2 4.26Å; A214-F231 HydrophobicContact CB-CZ 4.28Å; A214-A250 HydrophobicContact CB-CB 4.41Å; A214-A250 VanDerWaalsContact CB-O 3.27Å; A214-A250 WeakPolarHBondContact CB-O 3.19Å
215	I	98.6	Very high	97.8	Very high	15 Å²	15	26 Å²	26	8%	0.077	13%	0.128	C	C	.	.	H	α-helix	trans	-60.9	-40.9	175.4	-62.4	167.7	0	0	0	110.7	V211 D217 Y218 T219 F231 H337 I340	V211-I215 HydrophobicContact CG1-CD1 4.12Å; V211-I215 WeakPolarHBondContact O-CG1 3.36Å; V211-I215 PolarHBondContact O-N 2.98Å; I215-D217 VanDerWaalsContact C-N 3.31Å; I215-D217 PolarHBondContact O-N 2.93Å; I215-Y218 PolarHBondContact O-N 3.1Å; I215-T219 WeakPolarHBondContact O-CB 3.48Å; I215-T219 PolarHBondContact O-N 3.12Å; I215-T219 PolarHBondContact O-OG1 3.2Å; I215-F231 HydrophobicContact CB-CE2 4.32Å; I215-F231 HydrophobicContact CG1-CD2 4.34Å; I215-F231 HydrophobicContact CG1-CE1 4.12Å; I215-F231 HydrophobicContact CG1-CE2 3.76Å; I215-F231 HydrophobicContact CG1-CZ 3.63Å; I215-H337 HydrophobicContact CG2-CB 3.79Å; I215-I340 HydrophobicContact CD1-CG1 3.93Å; I215-I340 HydrophobicContact CG1-CG1 4.09Å; I215-I340 HydrophobicContact CG2-CG1 4.24Å
216	S	98.3	Very high	97.5	Very high	14 Å²	14	30.3 Å²	30.3	10%	0.098	16%	0.156	C	C	.	.	H	α-helix	trans	-65.5	-34.8	177	-162.3	0	0	0	0	112.7	K127 R208 T212 R213 A214 Q220 H337	K127-S216 WeakPolarHBondContact CE-O 3.33Å; K127-S216 WeakPolarHBondContact CE-OG 3.32Å; R208-S216 PolarHBondContact NH1-OG 3.41Å; T212-S216 WeakPolarHBondContact O-CB 3.49Å; T212-S216 PolarHBondContact O-N 3.11Å; R213-S216 WeakPolarHBondContact O-CB 3.5Å; R213-S216 PolarHBondContact O-N 2.96Å; A214-S216 VanDerWaalsContact C-N 3.3Å; A214-S216 PolarHBondContact O-N 3.39Å; S216-Q220 PolarHBondContact O-N 3.27Å; S216-Q220 VanDerWaalsContact O-N 3.14Å; S216-H337 WeakPolarHBondContact CB-NE2 3.49Å; S216-H337 PolarHBondContact OG-NE2 3Å
217	D	98.4	Very high	97.3	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.011	20%	0.196	C	C	.	.	H	α-helix	trans	-65.4	-54	176.3	-152.5	-20.8	0	0	0	110.2	K126 K127 R213 A214 I215 T219 Q220 T221 A250	K126-D217 WeakPolarHBondContact CE-OD1 3.29Å; K126-D217 IonicContact NZ-OD1 2.77Å; K126-D217 PolarHBondContact NZ-OD1 3.14Å; K126-D217 IonicContact NZ-OD2 3.3Å; K127-D217 HydrophobicContact CG-CB 3.95Å; R213-D217 IonicContact CZ-OD2 3.51Å; R213-D217 IonicContact NH1-OD2 3.43Å; R213-D217 PolarHBondContact NH1-OD2 3.14Å; R213-D217 IonicContact NH2-OD2 2.62Å; R213-D217 PolarHBondContact NH2-OD2 3.06Å; R213-D217 VanDerWaalsContact NH2-OD2 3.11Å; R213-D217 PolarHBondContact O-N 3.48Å; A214-D217 VanDerWaalsContact O-CB 3.32Å; A214-D217 WeakPolarHBondContact O-CB 3.34Å; A214-D217 PolarHBondContact O-N 2.98Å; A214-D217 VanDerWaalsContact O-N 3.14Å; I215-D217 VanDerWaalsContact C-N 3.31Å; I215-D217 PolarHBondContact O-N 2.93Å; D217-T219 VanDerWaalsContact C-N 3.31Å; D217-T219 PolarHBondContact O-N 2.68Å; D217-Q220 WeakPolarHBondContact O-CB 3.24Å; D217-Q220 PolarHBondContact O-N 2.82Å; D217-T221 PolarHBondContact O-N 2.6Å; D217-T221 PolarHBondContact O-OG1 3.17Å; D217-A250 HydrophobicContact CB-CB 4.13Å
218	Y	98.4	Very high	97.2	Very high	7 Å²	7	39.6 Å²	39.6	3%	0.027	21%	0.205	C	C	.	.	H	α-helix	trans	-53.8	-46.2	173.9	172.2	-101.3	0	0	0	112.5	A214 I215 Q220 T221 R222 I228 P229 S230 F231 L234 W248 P338	A214-Y218 PolarHBondContact O-N 3.08Å; I215-Y218 PolarHBondContact O-N 3.1Å; Y218-Q220 VanDerWaalsContact C-N 3.26Å; Y218-Q220 PolarHBondContact O-N 2.73Å; Y218-T221 PolarHBondContact O-N 3.48Å; Y218-T221 VanDerWaalsContact O-N 3.12Å; Y218-R222 WeakPolarHBondContact O-CB 3.43Å; Y218-R222 PolarHBondContact O-N 2.9Å; Y218-R222 WeakPolarHBondContact OH-CD 3.19Å; Y218-I228 HydrophobicContact CD2-CD1 3.87Å; Y218-I228 HydrophobicContact CE2-CD1 3.51Å; Y218-I228 HydrophobicContact CE2-CG1 4Å; Y218-P229 WeakPolarHBondContact CE2-O 3.41Å; Y218-P229 PolarHBondContact OH-O 2.84Å; Y218-S230 WeakPolarHBondContact OH-CA 3.2Å; Y218-F231 HydrophobicContact CD1-CB 3.88Å; Y218-F231 AromaticContact CD1-CD2 3.91Å; Y218-F231 HydrophobicContact CD1-CD2 3.91Å; Y218-F231 HydrophobicContact CD1-CG 4.38Å; Y218-F231 HydrophobicContact CD2-CB 4.39Å; Y218-F231 HydrophobicContact CD2-CD2 4.28Å; Y218-F231 HydrophobicContact CE1-CB 3.84Å; Y218-F231 HydrophobicContact CE2-CB 4.36Å; Y218-F231 HydrophobicContact CG-CB 4.16Å; Y218-F231 AromaticContact CG-CD2 3.67Å; Y218-F231 HydrophobicContact CG-CD2 3.67Å; Y218-F231 HydrophobicContact CG-CG 4.42Å; Y218-F231 PolarHBondContact OH-N 2.69Å; Y218-L234 HydrophobicContact CD2-CD1 4.04Å; Y218-L234 HydrophobicContact CE2-CD1 3.91Å; Y218-W248 HydrophobicContact CD2-CH2 4.5Å; Y218-W248 HydrophobicContact CD2-CZ2 4.19Å; Y218-P338 HydrophobicContact CD1-CG 4.16Å; Y218-P338 HydrophobicContact CE1-CG 4.06Å
219	T	98.1	Very high	97.1	Very high	8 Å²	8	40.4 Å²	40.4	5%	0.049	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-38.2	178.9	-57.9	0	0	0	0	111.7	I215 D217 S223 R335 T336 P338	I215-T219 WeakPolarHBondContact O-CB 3.48Å; I215-T219 PolarHBondContact O-N 3.12Å; I215-T219 PolarHBondContact O-OG1 3.2Å; D217-T219 VanDerWaalsContact C-N 3.31Å; D217-T219 PolarHBondContact O-N 2.68Å; T219-S223 PolarHBondContact O-N 3.41Å; T219-S223 VanDerWaalsContact O-N 3.14Å; T219-R335 HydrophobicContact CG2-CB 3.95Å; T219-T336 WeakPolarHBondContact CG2-O 3.37Å; T219-P338 WeakPolarHBondContact OG1-CD 3.5Å
220	Q	97	Very high	97	Very high	22 Å²	22	42 Å²	42	10%	0.103	23%	0.23	C	C	.	.	H	α-helix	trans	-67.5	-46.3	174.7	176.3	171.1	-17.8	0	0	111.2	K127 S216 D217 Y218 R222 S223 K224	K127-Q220 VanDerWaalsContact CD-OE1 3.28Å; S216-Q220 PolarHBondContact O-N 3.27Å; S216-Q220 VanDerWaalsContact O-N 3.14Å; D217-Q220 WeakPolarHBondContact O-CB 3.24Å; D217-Q220 PolarHBondContact O-N 2.82Å; Y218-Q220 VanDerWaalsContact C-N 3.26Å; Y218-Q220 PolarHBondContact O-N 2.73Å; Q220-R222 PolarHBondContact O-N 2.88Å; Q220-S223 PolarHBondContact O-N 3.44Å; Q220-S223 PolarHBondContact O-OG 3.33Å; Q220-K224 PolarHBondContact O-N 3.22Å
221	T	96.8	Very high	96.9	Very high	33 Å²	33	42.1 Å²	42.1	20%	0.202	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-46.9	177.8	-53.8	0	0	0	0	110.9	D217 Y218 S223 K224 K225 I228	D217-T221 PolarHBondContact O-N 2.6Å; D217-T221 PolarHBondContact O-OG1 3.17Å; Y218-T221 PolarHBondContact O-N 3.48Å; Y218-T221 VanDerWaalsContact O-N 3.12Å; T221-S223 VanDerWaalsContact C-N 3.28Å; T221-S223 PolarHBondContact O-N 3.1Å; T221-K224 PolarHBondContact O-N 3.36Å; T221-K225 PolarHBondContact O-N 2.77Å; T221-I228 HydrophobicContact CG2-CD1 3.86Å
222	R	95.8	Very high	96.8	Very high	85 Å²	85	44.3 Å²	44.3	32%	0.321	24%	0.24	S	C	.	.	H	α-helix	trans	-60.7	-34.8	178.2	-163.8	171.3	64.8	-178.5	4.9	113.1	Y218 Q220 K224 K225 P226 I228	Y218-R222 WeakPolarHBondContact O-CB 3.43Å; Y218-R222 PolarHBondContact O-N 2.9Å; Y218-R222 WeakPolarHBondContact OH-CD 3.19Å; Q220-R222 PolarHBondContact O-N 2.88Å; R222-K224 PolarHBondContact O-N 2.84Å; R222-K225 WeakPolarHBondContact CA-O 3.48Å; R222-K225 CarbonylContact O-C 3.58Å; R222-K225 PolarHBondContact O-N 3.31Å; R222-P226 WeakPolarHBondContact O-CA 3.32Å; R222-I228 HydrophobicContact CB-CD1 3.79Å; R222-I228 HydrophobicContact CB-CG1 4.15Å; R222-I228 HydrophobicContact CG-CD1 4.31Å; R222-I228 HydrophobicContact CG-CG1 4.11Å
223	S	94.8	Very high	96.6	Very high	66 Å²	66	45.6 Å²	45.6	46%	0.462	25%	0.251	S	S	.	.	H	α-helix	trans	-66.8	-22.5	176	73.4	0	0	0	0	113.9	T219 Q220 T221 R335	T219-S223 PolarHBondContact O-N 3.41Å; T219-S223 VanDerWaalsContact O-N 3.14Å; Q220-S223 PolarHBondContact O-N 3.44Å; Q220-S223 PolarHBondContact O-OG 3.33Å; T221-S223 VanDerWaalsContact C-N 3.28Å; T221-S223 PolarHBondContact O-N 3.1Å; S223-R335 PolarHBondContact OG-NE 3.38Å
224	K	94.4	Very high	96.5	Very high	90 Å²	90	47.8 Å²	47.8	39%	0.391	26%	0.262	S	S	.	.	H	α-helix	trans	-95.7	-31.9	175.6	-65.9	-178.8	173.6	-171.6	0	112.2	E80 Q220 T221 R222	E80-K224 PolarHBondContact O-NZ 3.49Å; Q220-K224 PolarHBondContact O-N 3.22Å; T221-K224 PolarHBondContact O-N 3.36Å; R222-K224 PolarHBondContact O-N 2.84Å
225	K	94.8	Very high	96.4	Very high	96 Å²	96	47.8 Å²	47.8	42%	0.417	26%	0.262	S	S	.	.			trans	-132.1	87.2	-178	-64.1	-174.6	174.5	-172.4	0	108.8	E80 T221 R222 D227 I228	E80-K225 WeakPolarHBondContact OE1-CE 3.39Å; E80-K225 IonicContact OE1-NZ 2.75Å; E80-K225 PolarHBondContact OE1-NZ 3.5Å; T221-K225 PolarHBondContact O-N 2.77Å; R222-K225 WeakPolarHBondContact CA-O 3.48Å; R222-K225 CarbonylContact O-C 3.58Å; R222-K225 PolarHBondContact O-N 3.31Å; K225-D227 PolarHBondContact O-N 3.05Å; K225-I228 HydrophobicContact CB-CG2 3.7Å; K225-I228 WeakPolarHBondContact O-CG2 3.46Å; K225-I228 PolarHBondContact O-N 3.42Å
226	P	92.5	Very high	96.2	Very high	91 Å²	91	48.1 Å²	48.1	59%	0.591	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-30.2	-175.5	-26.3	36.3	0	0	0	113.7	R222 I228	R222-P226 WeakPolarHBondContact O-CA 3.32Å; P226-I228 VanDerWaalsContact C-N 3.29Å; P226-I228 PolarHBondContact O-N 3.13Å
227	D	95.1	Very high	95.9	Very high	156 Å²	156	55.1 Å²	55.1	83%	0.834	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	11	-172.3	-50.1	-48.8	0	0	0	114.5	K225	K225-D227 PolarHBondContact O-N 3.05Å
228	I	96.2	Very high	95.4	Very high	39 Å²	39	58.7 Å²	58.7	20%	0.2	31%	0.311	C	S	.	.	S	Bend	trans	-68.3	152	174.3	65.2	174.9	0	0	0	110.8	Y218 T221 R222 K225 P226	Y218-I228 HydrophobicContact CD2-CD1 3.87Å; Y218-I228 HydrophobicContact CE2-CD1 3.51Å; Y218-I228 HydrophobicContact CE2-CG1 4Å; T221-I228 HydrophobicContact CG2-CD1 3.86Å; R222-I228 HydrophobicContact CB-CD1 3.79Å; R222-I228 HydrophobicContact CB-CG1 4.15Å; R222-I228 HydrophobicContact CG-CD1 4.31Å; R222-I228 HydrophobicContact CG-CG1 4.11Å; K225-I228 HydrophobicContact CB-CG2 3.7Å; K225-I228 WeakPolarHBondContact O-CG2 3.46Å; K225-I228 PolarHBondContact O-N 3.42Å; P226-I228 VanDerWaalsContact C-N 3.29Å; P226-I228 PolarHBondContact O-N 3.13Å
229	P	96.8	Very high	94.8	Very high	71 Å²	71	63.5 Å²	63.5	46%	0.461	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-56.6	167	175.6	-23.7	33.8	0	0	0	113.2	Y218 L234	Y218-P229 WeakPolarHBondContact CE2-O 3.41Å; Y218-P229 PolarHBondContact OH-O 2.84Å; P229-L234 HydrophobicContact CB-CD2 4.07Å; P229-L234 HydrophobicContact CB-CG 4.08Å; P229-L234 HydrophobicContact CG-CD2 4.03Å
230	S	96.8	Very high	94.2	Very high	48 Å²	48	69.1 Å²	69.1	34%	0.336	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-61.1	159.3	174.9	69	0	0	0	0	111.9	Y218 E232 S233 L234	Y218-S230 WeakPolarHBondContact OH-CA 3.2Å; S230-E232 WeakPolarHBondContact CB-OE2 3.33Å; S230-E232 PolarHBondContact O-N 2.74Å; S230-S233 PolarHBondContact O-N 3.48Å; S230-S233 WeakPolarHBondContact OG-CB 3.47Å; S230-S233 PolarHBondContact OG-N 2.93Å; S230-S233 VanDerWaalsContact OG-N 3.16Å; S230-S233 PolarHBondContact OG-OG 3.01Å; S230-L234 WeakPolarHBondContact O-CG 3.32Å; S230-L234 PolarHBondContact O-N 2.91Å; S230-L234 VanDerWaalsContact O-N 3.16Å
231	F	97.6	Very high	93.8	Very high	1 Å²	1	71.5 Å²	71.5	0%	0.004	40%	0.399	C	S	.	.	H	α-helix	trans	-59.4	-41.1	176.3	179.4	-90.8	0	0	0	110.7	A214 I215 Y218 L234 T235 W248 I340 V344 L348	A214-F231 HydrophobicContact CB-CE2 4.26Å; A214-F231 HydrophobicContact CB-CZ 4.28Å; I215-F231 HydrophobicContact CB-CE2 4.32Å; I215-F231 HydrophobicContact CG1-CD2 4.34Å; I215-F231 HydrophobicContact CG1-CE1 4.12Å; I215-F231 HydrophobicContact CG1-CE2 3.76Å; I215-F231 HydrophobicContact CG1-CZ 3.63Å; Y218-F231 HydrophobicContact CD1-CB 3.88Å; Y218-F231 AromaticContact CD1-CD2 3.91Å; Y218-F231 HydrophobicContact CD1-CD2 3.91Å; Y218-F231 HydrophobicContact CD1-CG 4.38Å; Y218-F231 HydrophobicContact CD2-CB 4.39Å; Y218-F231 HydrophobicContact CD2-CD2 4.28Å; Y218-F231 HydrophobicContact CE1-CB 3.84Å; Y218-F231 HydrophobicContact CE2-CB 4.36Å; Y218-F231 HydrophobicContact CG-CB 4.16Å; Y218-F231 AromaticContact CG-CD2 3.67Å; Y218-F231 HydrophobicContact CG-CD2 3.67Å; Y218-F231 HydrophobicContact CG-CG 4.42Å; Y218-F231 PolarHBondContact OH-N 2.69Å; F231-L234 PolarHBondContact O-N 3.4Å; F231-T235 WeakPolarHBondContact CE1-OG1 3.33Å; F231-T235 WeakPolarHBondContact O-CB 3.46Å; F231-T235 PolarHBondContact O-N 2.88Å; F231-T235 PolarHBondContact O-OG1 2.97Å; F231-W248 AromaticContact CD2-CH2 3.62Å; F231-W248 HydrophobicContact CD2-CH2 3.62Å; F231-W248 HydrophobicContact CD2-CZ3 4.33Å; F231-W248 AromaticContact CE2-CH2 3.54Å; F231-W248 HydrophobicContact CE2-CH2 3.54Å; F231-W248 AromaticContact CE2-CZ3 3.98Å; F231-W248 HydrophobicContact CE2-CZ3 3.98Å; F231-W248 HydrophobicContact CG-CH2 4.41Å; F231-W248 HydrophobicContact CZ-CH2 4.31Å; F231-W248 HydrophobicContact CZ-CZ3 4.31Å; F231-I340 HydrophobicContact CB-CD1 3.56Å; F231-I340 HydrophobicContact CD1-CD1 3.89Å; F231-I340 HydrophobicContact CD1-CG1 4.16Å; F231-I340 HydrophobicContact CD1-CG2 3.64Å; F231-I340 HydrophobicContact CE1-CG2 4.01Å; F231-I340 HydrophobicContact CG-CD1 3.76Å; F231-I340 HydrophobicContact CG-CG1 4.4Å; F231-V344 HydrophobicContact CD1-CG1 4.42Å; F231-V344 HydrophobicContact CE1-CG1 4.29Å; F231-L348 HydrophobicContact CE1-CD1 3.53Å; F231-L348 HydrophobicContact CZ-CD1 3.61Å
232	E	96.1	Very high	93.3	Very high	49 Å²	49	71.6 Å²	71.6	23%	0.229	41%	0.406	C	S	.	.	H	α-helix	trans	-59.2	-49.2	177.7	-63.2	80.5	-178.7	0	0	110.8	S230 L234 T235 F236 I340 D341 V344	S230-E232 WeakPolarHBondContact CB-OE2 3.33Å; S230-E232 PolarHBondContact O-N 2.74Å; E232-L234 VanDerWaalsContact C-N 3.31Å; E232-L234 PolarHBondContact O-N 3.29Å; E232-T235 WeakPolarHBondContact O-CB 3.4Å; E232-T235 PolarHBondContact O-N 2.98Å; E232-T235 VanDerWaalsContact O-N 3.15Å; E232-F236 WeakPolarHBondContact O-CD2 3.47Å; E232-I340 WeakPolarHBondContact OE1-CA 3.47Å; E232-D341 HydrophobicContact CG-CB 4.15Å; E232-D341 PolarHBondContact OE1-N 3.1Å; E232-V344 HydrophobicContact CB-CG2 4.33Å; E232-V344 HydrophobicContact CG-CB 4.34Å; E232-V344 HydrophobicContact CG-CG1 4.39Å; E232-V344 HydrophobicContact CG-CG2 3.85Å
233	S	95.4	Very high	93.2	Very high	64 Å²	64	72.1 Å²	72.1	45%	0.448	42%	0.415	S	S	.	.	H	α-helix	trans	-63.3	-35.6	180	-65.5	0	0	0	0	113.1	S230	S230-S233 PolarHBondContact O-N 3.48Å; S230-S233 WeakPolarHBondContact OG-CB 3.47Å; S230-S233 PolarHBondContact OG-N 2.93Å; S230-S233 VanDerWaalsContact OG-N 3.16Å; S230-S233 PolarHBondContact OG-OG 3.01Å
234	L	96.7	Very high	93.3	Very high	47 Å²	47	69.7 Å²	69.7	25%	0.246	40%	0.397	C	S	.	.	H	α-helix	trans	-79.6	-20.1	177.6	-63.9	175.5	0	0	0	113.3	Y218 P229 S230 F231 E232 W248	Y218-L234 HydrophobicContact CD2-CD1 4.04Å; Y218-L234 HydrophobicContact CE2-CD1 3.91Å; P229-L234 HydrophobicContact CB-CD2 4.07Å; P229-L234 HydrophobicContact CB-CG 4.08Å; P229-L234 HydrophobicContact CG-CD2 4.03Å; S230-L234 WeakPolarHBondContact O-CG 3.32Å; S230-L234 PolarHBondContact O-N 2.91Å; S230-L234 VanDerWaalsContact O-N 3.16Å; F231-L234 PolarHBondContact O-N 3.4Å; E232-L234 VanDerWaalsContact C-N 3.31Å; E232-L234 PolarHBondContact O-N 3.29Å; L234-W248 HydrophobicContact CB-CD2 4.06Å; L234-W248 HydrophobicContact CB-CE3 4.15Å; L234-W248 HydrophobicContact CB-CH2 4Å; L234-W248 HydrophobicContact CB-CZ2 3.88Å; L234-W248 HydrophobicContact CB-CZ3 4.15Å; L234-W248 HydrophobicContact CD1-CZ2 4Å; L234-W248 VanDerWaalsContact O-CE3 3.24Å
235	T	96.4	Very high	93.4	Very high	0 Å²	0	67 Å²	67	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-72.1	-32.5	-176.9	-67.2	0	0	0	0	112.1	F231 E232 I244 D245 V344 L348	F231-T235 WeakPolarHBondContact CE1-OG1 3.33Å; F231-T235 WeakPolarHBondContact O-CB 3.46Å; F231-T235 PolarHBondContact O-N 2.88Å; F231-T235 PolarHBondContact O-OG1 2.97Å; E232-T235 WeakPolarHBondContact O-CB 3.4Å; E232-T235 PolarHBondContact O-N 2.98Å; E232-T235 VanDerWaalsContact O-N 3.15Å; T235-I244 HydrophobicContact CG2-CG1 4.26Å; T235-I244 CarbonylContact O-C 3.54Å; T235-I244 WeakPolarHBondContact O-CA 3.47Å; T235-D245 PolarHBondContact O-N 3.3Å; T235-V344 HydrophobicContact CG2-CG1 4.01Å; T235-L348 HydrophobicContact CG2-CD1 3.92Å; T235-L348 HydrophobicContact CG2-CD2 3.85Å; T235-L348 HydrophobicContact CG2-CG 3.83Å
236	F	94.5	Very high	93.5	Very high	22 Å²	22	65.1 Å²	65.1	10%	0.096	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	135.5	-172.4	-61.5	-80	0	0	0	112.2	E232 I239 L243 I244 V344 T347	E232-F236 WeakPolarHBondContact O-CD2 3.47Å; F236-I239 HydrophobicContact CB-CB 4.4Å; F236-I239 HydrophobicContact CB-CG1 3.68Å; F236-I239 HydrophobicContact CD2-CG1 4.04Å; F236-I239 HydrophobicContact CG-CG1 4.1Å; F236-L243 CarbonylContact C-O 3.57Å; F236-L243 WeakPolarHBondContact CA-O 3.45Å; F236-I244 HydrophobicContact CD1-CG1 4.21Å; F236-I244 HydrophobicContact CE1-CG1 4.04Å; F236-V344 HydrophobicContact CE2-CB 4.23Å; F236-V344 HydrophobicContact CE2-CG1 3.74Å; F236-V344 HydrophobicContact CE2-CG2 3.67Å; F236-V344 HydrophobicContact CZ-CB 4.45Å; F236-V344 HydrophobicContact CZ-CG1 4.1Å; F236-V344 HydrophobicContact CZ-CG2 4.13Å; F236-T347 HydrophobicContact CE1-CG2 3.83Å; F236-T347 HydrophobicContact CZ-CG2 4.16Å
237	K	90.7	Very high	93.6	Very high	160 Å²	160	65.5 Å²	65.5	70%	0.696	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	-33.4	163.2	-170.8	175.4	-177.4	180	0	110.9	L243 D245	K237-L243 HydrophobicContact CB-CD2 4.42Å; K237-L243 HydrophobicContact CB-CG 4.49Å; K237-L243 HydrophobicContact CD-CD2 4.42Å; K237-L243 PolarHBondContact N-O 3.06Å; K237-D245 HydrophobicContact CB-CB 4.08Å
238	N	87.8	Confident	93.8	Very high	78 Å²	78	60 Å²	60	42%	0.417	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	109.2	172.1	-177	-35.1	0	0	0	109	S240 A241 G242 L243	N238-S240 PolarHBondContact OD1-N 2.76Å; N238-S240 VanDerWaalsContact OD1-N 3.09Å; N238-A241 HydrophobicContact CB-CB 4.17Å; N238-A241 PolarHBondContact O-N 2.9Å; N238-A241 PolarHBondContact OD1-N 3.41Å; N238-G242 PolarHBondContact O-N 3.45Å; N238-L243 HydrophobicContact CB-CB 4.27Å; N238-L243 PolarHBondContact N-O 2.95Å; N238-L243 PolarHBondContact O-N 3.36Å
239	I	85.6	Confident	93.8	Very high	108 Å²	108	60.2 Å²	60.2	55%	0.554	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-46.4	-177.2	-62.7	171	0	0	0	110.7	F236 A241 G242	F236-I239 HydrophobicContact CB-CB 4.4Å; F236-I239 HydrophobicContact CB-CG1 3.68Å; F236-I239 HydrophobicContact CD2-CG1 4.04Å; F236-I239 HydrophobicContact CG-CG1 4.1Å; I239-A241 PolarHBondContact O-N 3.49Å; I239-G242 PolarHBondContact O-N 3.23Å
240	S	86.7	Confident	93.8	Very high	126 Å²	126	56.9 Å²	56.9	88%	0.881	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-30.6	-177.3	-53.3	0	0	0	0	113.1	N238	N238-S240 PolarHBondContact OD1-N 2.76Å; N238-S240 VanDerWaalsContact OD1-N 3.09Å
241	A	87.9	Confident	93.9	Very high	72 Å²	72	54.6 Å²	54.6	60%	0.595	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-2.1	176.2	0	0	0	0	0	113.7	N238 I239 L243	N238-A241 HydrophobicContact CB-CB 4.17Å; N238-A241 PolarHBondContact O-N 2.9Å; N238-A241 PolarHBondContact OD1-N 3.41Å; I239-A241 PolarHBondContact O-N 3.49Å; A241-L243 HydrophobicContact CB-CB 4.44Å; A241-L243 PolarHBondContact O-N 3.41Å
242	G	87.4	Confident	93.9	Very high	34 Å²	34	58.4 Å²	58.4	35%	0.351	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	20	-173.2	0	0	0	0	0	113.9	N238 I239 I244	N238-G242 PolarHBondContact O-N 3.45Å; I239-G242 PolarHBondContact O-N 3.23Å; G242-I244 PolarHBondContact O-N 3.17Å
243	L	92.7	Very high	94	Very high	97 Å²	97	56.7 Å²	56.7	51%	0.508	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	105.6	-174.3	-176.7	65.6	0	0	0	110.3	F236 K237 N238 A241	F236-L243 CarbonylContact C-O 3.57Å; F236-L243 WeakPolarHBondContact CA-O 3.45Å; K237-L243 HydrophobicContact CB-CD2 4.42Å; K237-L243 HydrophobicContact CB-CG 4.49Å; K237-L243 HydrophobicContact CD-CD2 4.42Å; K237-L243 PolarHBondContact N-O 3.06Å; N238-L243 HydrophobicContact CB-CB 4.27Å; N238-L243 PolarHBondContact N-O 2.95Å; N238-L243 PolarHBondContact O-N 3.36Å; A241-L243 HydrophobicContact CB-CB 4.44Å; A241-L243 PolarHBondContact O-N 3.41Å
244	I	96.4	Very high	94.2	Very high	15 Å²	15	53.7 Å²	53.7	8%	0.077	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	135.4	177.5	-74.3	159.6	0	0	0	111.4	T235 F236 G242 T246 V251 T347 L348 F351	T235-I244 HydrophobicContact CG2-CG1 4.26Å; T235-I244 CarbonylContact O-C 3.54Å; T235-I244 WeakPolarHBondContact O-CA 3.47Å; F236-I244 HydrophobicContact CD1-CG1 4.21Å; F236-I244 HydrophobicContact CE1-CG1 4.04Å; G242-I244 PolarHBondContact O-N 3.17Å; I244-T246 HydrophobicContact CG2-CG2 4.48Å; I244-T246 PolarHBondContact O-N 2.88Å; I244-T246 VanDerWaalsContact O-N 3.16Å; I244-V251 HydrophobicContact CG2-CG1 3.74Å; I244-V251 HydrophobicContact CG2-CG2 4.12Å; I244-T347 HydrophobicContact CD1-CG2 4.01Å; I244-T347 HydrophobicContact CG1-CG2 4.43Å; I244-L348 HydrophobicContact CD1-CD2 3.93Å; I244-L348 HydrophobicContact CD1-CG 4.49Å; I244-L348 HydrophobicContact CG1-CD2 4.35Å; I244-L348 HydrophobicContact CG2-CD2 4.41Å; I244-F351 HydrophobicContact CB-CD2 4.3Å; I244-F351 HydrophobicContact CD1-CB 3.23Å; I244-F351 HydrophobicContact CD1-CD1 4.12Å; I244-F351 HydrophobicContact CD1-CD2 3.84Å; I244-F351 HydrophobicContact CD1-CG 3.46Å; I244-F351 VanDerWaalsContact CD1-CG 3.46Å; I244-F351 HydrophobicContact CG2-CD1 4.45Å; I244-F351 HydrophobicContact CG2-CD2 4.36Å; I244-F351 HydrophobicContact CG2-CE1 4.41Å; I244-F351 HydrophobicContact CG2-CE2 4.31Å; I244-F351 HydrophobicContact CG2-CG 4.45Å; I244-F351 HydrophobicContact CG2-CZ 4.35Å
245	D	97	Very high	94.3	Very high	34 Å²	34	51.7 Å²	51.7	18%	0.182	30%	0.297	C	S	.	.			trans	-78.4	95.5	172.3	-174.4	8.9	0	0	0	111.1	T235 K237 T247 W248	T235-D245 PolarHBondContact O-N 3.3Å; K237-D245 HydrophobicContact CB-CB 4.08Å; D245-T247 VanDerWaalsContact CG-OG1 3.31Å; D245-T247 PolarHBondContact O-N 3.14Å; D245-T247 WeakPolarHBondContact OD1-CA 3.4Å; D245-T247 WeakPolarHBondContact OD1-CB 3.3Å; D245-T247 PolarHBondContact OD1-N 2.71Å; D245-T247 PolarHBondContact OD1-OG1 3.33Å; D245-T247 PolarHBondContact OD2-OG1 3.45Å; D245-W248 HydrophobicContact CB-CB 4.44Å; D245-W248 PolarHBondContact O-N 2.85Å
246	T	96.5	Very high	94.4	Very high	56 Å²	56	51.8 Å²	51.8	34%	0.344	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-8	175.7	65.5	0	0	0	0	114.2	I244 F351	I244-T246 HydrophobicContact CG2-CG2 4.48Å; I244-T246 PolarHBondContact O-N 2.88Å; I244-T246 VanDerWaalsContact O-N 3.16Å; T246-F351 HydrophobicContact CG2-CE2 3.67Å; T246-F351 HydrophobicContact CG2-CZ 3.56Å
247	T	95.9	Very high	94.6	Very high	99 Å²	99	50.8 Å²	50.8	61%	0.607	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-20.9	174.5	75	0	0	0	0	111.9	D245 S249	D245-T247 VanDerWaalsContact CG-OG1 3.31Å; D245-T247 PolarHBondContact O-N 3.14Å; D245-T247 WeakPolarHBondContact OD1-CA 3.4Å; D245-T247 WeakPolarHBondContact OD1-CB 3.3Å; D245-T247 PolarHBondContact OD1-N 2.71Å; D245-T247 PolarHBondContact OD1-OG1 3.33Å; D245-T247 PolarHBondContact OD2-OG1 3.45Å; T247-S249 PolarHBondContact O-N 3.21Å
248	W	97.5	Very high	95	Very high	40 Å²	40	49.1 Å²	49.1	15%	0.152	28%	0.283	C	S	.	.	S	Bend	trans	-66	123.1	172.6	-178.7	39.4	0	0	0	110.6	Y218 F231 L234 D245 A250 V251 Q252	Y218-W248 HydrophobicContact CD2-CH2 4.5Å; Y218-W248 HydrophobicContact CD2-CZ2 4.19Å; F231-W248 AromaticContact CD2-CH2 3.62Å; F231-W248 HydrophobicContact CD2-CH2 3.62Å; F231-W248 HydrophobicContact CD2-CZ3 4.33Å; F231-W248 AromaticContact CE2-CH2 3.54Å; F231-W248 HydrophobicContact CE2-CH2 3.54Å; F231-W248 AromaticContact CE2-CZ3 3.98Å; F231-W248 HydrophobicContact CE2-CZ3 3.98Å; F231-W248 HydrophobicContact CG-CH2 4.41Å; F231-W248 HydrophobicContact CZ-CH2 4.31Å; F231-W248 HydrophobicContact CZ-CZ3 4.31Å; L234-W248 HydrophobicContact CB-CD2 4.06Å; L234-W248 HydrophobicContact CB-CE3 4.15Å; L234-W248 HydrophobicContact CB-CH2 4Å; L234-W248 HydrophobicContact CB-CZ2 3.88Å; L234-W248 HydrophobicContact CB-CZ3 4.15Å; L234-W248 HydrophobicContact CD1-CZ2 4Å; L234-W248 VanDerWaalsContact O-CE3 3.24Å; D245-W248 HydrophobicContact CB-CB 4.44Å; D245-W248 PolarHBondContact O-N 2.85Å; W248-A250 HydrophobicContact CD2-CB 3.78Å; W248-A250 HydrophobicContact CE3-CB 4.11Å; W248-A250 HydrophobicContact CG-CB 4.47Å; W248-A250 HydrophobicContact CH2-CB 3.75Å; W248-A250 HydrophobicContact CZ2-CB 3.38Å; W248-A250 HydrophobicContact CZ3-CB 4.09Å; W248-A250 PolarHBondContact O-N 2.95Å; W248-A250 VanDerWaalsContact O-N 3.14Å; W248-V251 HydrophobicContact CD2-CG2 4.47Å; W248-V251 HydrophobicContact CE3-CB 4.48Å; W248-V251 HydrophobicContact CE3-CG2 3.55Å; W248-V251 HydrophobicContact CZ3-CG2 4.07Å; W248-V251 WeakPolarHBondContact O-CA 3.41Å; W248-V251 PolarHBondContact O-N 2.58Å; W248-Q252 PolarHBondContact O-N 3.38Å
249	S	96.6	Very high	95.5	Very high	43 Å²	43	45.6 Å²	45.6	30%	0.301	26%	0.264	S	S	.	.	H	α-helix	trans	-57.2	-33.9	-174.1	62.1	0	0	0	0	113.3	T247 V251 Q252 I253	T247-S249 PolarHBondContact O-N 3.21Å; S249-V251 VanDerWaalsContact C-N 3.27Å; S249-V251 PolarHBondContact O-N 3.25Å; S249-Q252 PolarHBondContact O-N 3.11Å; S249-I253 VanDerWaalsContact O-CD1 3.32Å; S249-I253 WeakPolarHBondContact O-CD1 3.25Å; S249-I253 WeakPolarHBondContact O-CG1 3.48Å; S249-I253 PolarHBondContact O-N 3.49Å; S249-I253 VanDerWaalsContact O-N 3.09Å
250	A	97.4	Very high	96.1	Very high	2 Å²	2	40.4 Å²	40.4	2%	0.017	24%	0.238	C	C	.	.	H	α-helix	trans	-67.4	-27.8	177.4	0	0	0	0	0	112.6	R213 A214 D217 W248	R213-A250 VanDerWaalsContact NH2-C 3.32Å; R213-A250 VanDerWaalsContact NH2-CA 3.3Å; R213-A250 PolarHBondContact NH2-O 3.38Å; A214-A250 HydrophobicContact CB-CB 4.41Å; A214-A250 VanDerWaalsContact CB-O 3.27Å; A214-A250 WeakPolarHBondContact CB-O 3.19Å; D217-A250 HydrophobicContact CB-CB 4.13Å; W248-A250 HydrophobicContact CD2-CB 3.78Å; W248-A250 HydrophobicContact CE3-CB 4.11Å; W248-A250 HydrophobicContact CG-CB 4.47Å; W248-A250 HydrophobicContact CH2-CB 3.75Å; W248-A250 HydrophobicContact CZ2-CB 3.38Å; W248-A250 HydrophobicContact CZ3-CB 4.09Å; W248-A250 PolarHBondContact O-N 2.95Å; W248-A250 VanDerWaalsContact O-N 3.14Å
251	V	98.3	Very high	96.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-81	-46.8	170.7	170.9	0	0	0	0	110.1	I244 W248 S249 I253 G254 L348 F351 Y352	I244-V251 HydrophobicContact CG2-CG1 3.74Å; I244-V251 HydrophobicContact CG2-CG2 4.12Å; W248-V251 HydrophobicContact CD2-CG2 4.47Å; W248-V251 HydrophobicContact CE3-CB 4.48Å; W248-V251 HydrophobicContact CE3-CG2 3.55Å; W248-V251 HydrophobicContact CZ3-CG2 4.07Å; W248-V251 WeakPolarHBondContact O-CA 3.41Å; W248-V251 PolarHBondContact O-N 2.58Å; S249-V251 VanDerWaalsContact C-N 3.27Å; S249-V251 PolarHBondContact O-N 3.25Å; V251-I253 PolarHBondContact O-N 2.81Å; V251-G254 PolarHBondContact O-N 3.28Å; V251-G254 VanDerWaalsContact O-N 3.07Å; V251-L348 HydrophobicContact CG2-CD2 4.19Å; V251-F351 HydrophobicContact CG1-CD1 4.5Å; V251-F351 HydrophobicContact CG1-CE1 3.66Å; V251-F351 HydrophobicContact CG1-CZ 4.03Å; V251-Y352 VanDerWaalsContact CA-OH 3.22Å; V251-Y352 WeakPolarHBondContact CA-OH 3.46Å; V251-Y352 PolarHBondContact O-OH 3.4Å
252	Q	98.3	Very high	97.2	Very high	80 Å²	80	38 Å²	38	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-56.3	-47.2	-172.3	-163.8	-165.7	11.9	0	0	113.2	W248 S249 G254 M255 H259	W248-Q252 PolarHBondContact O-N 3.38Å; S249-Q252 PolarHBondContact O-N 3.11Å; Q252-G254 PolarHBondContact O-N 3.12Å; Q252-G254 VanDerWaalsContact O-N 3.15Å; Q252-M255 HydrophobicContact CB-CE 4.21Å; Q252-M255 HydrophobicContact CG-CE 3.83Å; Q252-M255 PolarHBondContact O-N 3.01Å; Q252-M255 VanDerWaalsContact O-N 3.11Å; Q252-H259 PolarHBondContact O-NE2 3.15Å; Q252-H259 VanDerWaalsContact O-NE2 3.11Å
253	I	98.7	Very high	97.7	Very high	14 Å²	14	36.4 Å²	36.4	7%	0.072	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-29.2	-177.9	-66	162.2	0	0	0	112.2	V125 K126 V186 S249 V251 M255 Y256	V125-I253 HydrophobicContact CB-CG2 4.41Å; K126-I253 HydrophobicContact CB-CD1 4.42Å; K126-I253 HydrophobicContact CD-CD1 4.12Å; V186-I253 HydrophobicContact CG1-CB 4.35Å; V186-I253 HydrophobicContact CG1-CG1 4.05Å; V186-I253 HydrophobicContact CG1-CG2 4.19Å; V186-I253 HydrophobicContact CG2-CG1 4.46Å; S249-I253 VanDerWaalsContact O-CD1 3.32Å; S249-I253 WeakPolarHBondContact O-CD1 3.25Å; S249-I253 WeakPolarHBondContact O-CG1 3.48Å; S249-I253 PolarHBondContact O-N 3.49Å; S249-I253 VanDerWaalsContact O-N 3.09Å; V251-I253 PolarHBondContact O-N 2.81Å; I253-M255 VanDerWaalsContact C-N 3.26Å; I253-M255 PolarHBondContact O-N 2.69Å; I253-Y256 VanDerWaalsContact O-CD1 3.27Å; I253-Y256 WeakPolarHBondContact O-CD1 3.17Å; I253-Y256 VanDerWaalsContact O-CE1 3.24Å; I253-Y256 WeakPolarHBondContact O-CE1 3.45Å
254	G	98.6	Very high	98	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-12.8	-178.9	0	0	0	0	0	114.3	V251 Q252 Y256	V251-G254 PolarHBondContact O-N 3.28Å; V251-G254 VanDerWaalsContact O-N 3.07Å; Q252-G254 PolarHBondContact O-N 3.12Å; Q252-G254 VanDerWaalsContact O-N 3.15Å; G254-Y256 PolarHBondContact O-N 3.25Å
255	M	98.6	Very high	98.1	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.025	20%	0.2	C	C	.	.			trans	-80	60.3	178.4	-65.2	-173.9	-85.4	0	0	111.6	Q252 I253 A257 R258 H259 F351 Y352 F355	Q252-M255 HydrophobicContact CB-CE 4.21Å; Q252-M255 HydrophobicContact CG-CE 3.83Å; Q252-M255 PolarHBondContact O-N 3.01Å; Q252-M255 VanDerWaalsContact O-N 3.11Å; I253-M255 VanDerWaalsContact C-N 3.26Å; I253-M255 PolarHBondContact O-N 2.69Å; M255-A257 VanDerWaalsContact C-N 3.32Å; M255-A257 PolarHBondContact O-N 3.06Å; M255-R258 HydrophobicContact CB-CB 4.41Å; M255-R258 HydrophobicContact CB-CG 4.45Å; M255-R258 WeakPolarHBondContact O-CB 3.26Å; M255-R258 PolarHBondContact O-N 3.26Å; M255-R258 PolarHBondContact SD-NH1 3.18Å; M255-H259 PolarHBondContact O-CD2 3.41Å; M255-F351 HydrophobicContact CG-CE1 4.41Å; M255-F351 HydrophobicContact CG-CZ 4.47Å; M255-F351 HydrophobicContact SD-CZ 4.12Å; M255-Y352 HydrophobicContact CG-CE1 4.28Å; M255-F355 HydrophobicContact CB-CD1 4.44Å; M255-F355 HydrophobicContact CG-CD1 4.44Å; M255-F355 HydrophobicContact CG-CD2 4.29Å; M255-F355 HydrophobicContact CG-CE1 4.47Å; M255-F355 HydrophobicContact CG-CE2 4.32Å; M255-F355 HydrophobicContact CG-CG 4.35Å; M255-F355 HydrophobicContact CG-CZ 4.41Å; M255-F355 HydrophobicContact SD-CE1 4.11Å; M255-F355 HydrophobicContact SD-CE2 4.19Å; M255-F355 HydrophobicContact SD-CZ 3.86Å
256	Y	98.9	Very high	98.2	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-53.7	-41.7	-168.4	-55.7	-37.8	0	0	0	114.6	V125 F185 V207 R208 P210 R213 I253 G254 R258 H259 L260 F359 W369	V125-Y256 HydrophobicContact CB-CE1 4.3Å; V125-Y256 HydrophobicContact CG1-CD1 4.18Å; V125-Y256 HydrophobicContact CG1-CE1 3.92Å; V125-Y256 HydrophobicContact CG2-CE1 3.85Å; F185-Y256 HydrophobicContact CE1-CD1 4.15Å; V207-Y256 HydrophobicContact CB-CE2 4.18Å; V207-Y256 HydrophobicContact CG1-CD2 4.32Å; V207-Y256 HydrophobicContact CG1-CE2 4.37Å; R208-Y256 VanDerWaalsContact O-CE2 3.27Å; R208-Y256 WeakPolarHBondContact O-CE2 3.38Å; R208-Y256 PolarHBondContact O-OH 3.01Å; P210-Y256 HydrophobicContact CB-CE2 4.39Å; R213-Y256 VanDerWaalsContact CD-OH 3.28Å; R213-Y256 WeakPolarHBondContact CD-OH 3.47Å; I253-Y256 VanDerWaalsContact O-CD1 3.27Å; I253-Y256 WeakPolarHBondContact O-CD1 3.17Å; I253-Y256 VanDerWaalsContact O-CE1 3.24Å; I253-Y256 WeakPolarHBondContact O-CE1 3.45Å; G254-Y256 PolarHBondContact O-N 3.25Å; Y256-R258 VanDerWaalsContact C-N 3.27Å; Y256-R258 PolarHBondContact O-N 3.2Å; Y256-H259 PolarHBondContact O-N 3.31Å; Y256-H259 VanDerWaalsContact O-N 3.13Å; Y256-L260 WeakPolarHBondContact O-CB 3.49Å; Y256-L260 PolarHBondContact O-N 2.95Å; Y256-F359 HydrophobicContact CD2-CD1 4.41Å; Y256-F359 HydrophobicContact CD2-CE1 4.39Å; Y256-W369 AromaticContact CD2-CH2 3.74Å; Y256-W369 HydrophobicContact CD2-CH2 3.74Å; Y256-W369 AromaticContact CD2-CZ3 3.68Å; Y256-W369 HydrophobicContact CD2-CZ3 3.68Å; Y256-W369 AromaticContact CE2-CH2 3.54Å; Y256-W369 HydrophobicContact CE2-CH2 3.54Å; Y256-W369 HydrophobicContact CE2-CZ2 4.37Å; Y256-W369 AromaticContact CE2-CZ3 3.67Å; Y256-W369 HydrophobicContact CE2-CZ3 3.67Å
257	A	98.8	Very high	98.3	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-54.9	-41.8	177.7	0	0	0	0	0	112.6	M255 H259 L260 E261 K358 F359 M362	M255-A257 VanDerWaalsContact C-N 3.32Å; M255-A257 PolarHBondContact O-N 3.06Å; A257-H259 VanDerWaalsContact C-N 3.33Å; A257-H259 PolarHBondContact O-N 3.14Å; A257-L260 PolarHBondContact O-N 2.88Å; A257-E261 WeakPolarHBondContact O-CG 3.35Å; A257-E261 PolarHBondContact O-N 2.87Å; A257-K358 HydrophobicContact CB-CB 4.07Å; A257-K358 HydrophobicContact CB-CD 3.95Å; A257-K358 HydrophobicContact CB-CG 3.92Å; A257-F359 HydrophobicContact CB-CB 4.13Å; A257-M362 HydrophobicContact CB-SD 3.91Å
258	R	98.3	Very high	98.4	Very high	125 Å²	125	37.4 Å²	37.4	47%	0.472	18%	0.175	S	C	.	.	H	α-helix	trans	-65.9	-37	179.9	-74.2	-176.6	145.5	-179.9	-5.4	112.6	M255 Y256 F355	M255-R258 HydrophobicContact CB-CB 4.41Å; M255-R258 HydrophobicContact CB-CG 4.45Å; M255-R258 WeakPolarHBondContact O-CB 3.26Å; M255-R258 PolarHBondContact O-N 3.26Å; M255-R258 PolarHBondContact SD-NH1 3.18Å; Y256-R258 VanDerWaalsContact C-N 3.27Å; Y256-R258 PolarHBondContact O-N 3.2Å; R258-F355 HydrophobicContact CG-CD1 4.39Å; R258-F355 HydrophobicContact CG-CE1 4.25Å
259	H	98.8	Very high	98.5	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.019	18%	0.182	C	C	.	.	H	α-helix	trans	-72.5	-44.4	177.1	-62.6	-56	0	0	0	110.3	F185 Q252 M255 Y256 A257 E261 R262 W263	F185-H259 HydrophobicContact CD1-CB 3.84Å; F185-H259 HydrophobicContact CE1-CB 3.37Å; F185-H259 HydrophobicContact CE2-CB 4.37Å; F185-H259 HydrophobicContact CZ-CB 3.68Å; Q252-H259 PolarHBondContact O-NE2 3.15Å; Q252-H259 VanDerWaalsContact O-NE2 3.11Å; M255-H259 PolarHBondContact O-CD2 3.41Å; Y256-H259 PolarHBondContact O-N 3.31Å; Y256-H259 VanDerWaalsContact O-N 3.13Å; A257-H259 VanDerWaalsContact C-N 3.33Å; A257-H259 PolarHBondContact O-N 3.14Å; H259-E261 VanDerWaalsContact C-N 3.3Å; H259-E261 PolarHBondContact O-N 2.85Å; H259-R262 PolarHBondContact ND1-NH2 3.27Å; H259-R262 WeakPolarHBondContact O-CB 3.49Å; H259-R262 PolarHBondContact O-N 2.83Å; H259-W263 VanDerWaalsContact O-CD1 3.28Å; H259-W263 PolarHBondContact O-N 3.42Å
260	L	98.9	Very high	98.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.3	-39.6	179	-179.3	54.4	0	0	0	112.5	Y256 A257 R262 W263 L264 M269 L272 F274 F359 M362 T363	Y256-L260 WeakPolarHBondContact O-CB 3.49Å; Y256-L260 PolarHBondContact O-N 2.95Å; A257-L260 PolarHBondContact O-N 2.88Å; L260-R262 PolarHBondContact O-N 2.92Å; L260-R262 VanDerWaalsContact O-N 3.09Å; L260-W263 HydrophobicContact CD1-CB 4.37Å; L260-W263 PolarHBondContact O-N 3.32Å; L260-L264 HydrophobicContact CD1-CD1 4.15Å; L260-L264 HydrophobicContact CD1-CD2 4.05Å; L260-L264 HydrophobicContact CD1-CG 3.81Å; L260-L264 HydrophobicContact CD2-CD1 4.45Å; L260-L264 HydrophobicContact CG-CD1 3.89Å; L260-L264 HydrophobicContact CG-CG 4.05Å; L260-L264 WeakPolarHBondContact O-CG 3.45Å; L260-L264 PolarHBondContact O-N 3.47Å; L260-M269 HydrophobicContact CD2-CE 4.33Å; L260-L272 HydrophobicContact CD1-CD2 3.97Å; L260-F274 HydrophobicContact CD1-CE1 4.22Å; L260-F274 HydrophobicContact CD1-CZ 3.56Å; L260-F274 HydrophobicContact CD2-CE1 4.31Å; L260-F274 HydrophobicContact CD2-CE2 4.48Å; L260-F274 HydrophobicContact CD2-CZ 3.8Å; L260-F274 HydrophobicContact CG-CZ 4.31Å; L260-F359 HydrophobicContact CD2-CD2 3.97Å; L260-F359 HydrophobicContact CD2-CE2 3.8Å; L260-M362 HydrophobicContact CB-CE 3.93Å; L260-M362 HydrophobicContact CD2-CB 3.92Å; L260-M362 HydrophobicContact CD2-CE 3.72Å; L260-M362 HydrophobicContact CD2-SD 4.32Å; L260-M362 HydrophobicContact CG-CE 3.61Å; L260-T363 HydrophobicContact CD2-CG2 4.02Å
261	E	98.7	Very high	98.6	Very high	81 Å²	81	44.8 Å²	44.8	38%	0.379	21%	0.207	S	C	.	.	H	α-helix	trans	-53.7	-31.1	174.5	-76.2	176.2	138.2	0	0	113.7	A257 H259 Q265 K358 M362	A257-E261 WeakPolarHBondContact O-CG 3.35Å; A257-E261 PolarHBondContact O-N 2.87Å; H259-E261 VanDerWaalsContact C-N 3.3Å; H259-E261 PolarHBondContact O-N 2.85Å; E261-Q265 PolarHBondContact O-NE2 3.13Å; E261-K358 VanDerWaalsContact CD-NZ 3.27Å; E261-K358 WeakPolarHBondContact OE1-CE 3.3Å; E261-K358 IonicContact OE1-NZ 3.33Å; E261-K358 PolarHBondContact OE1-NZ 3.33Å; E261-K358 IonicContact OE2-NZ 3.99Å; E261-K358 PolarHBondContact OE2-NZ 2.99Å; E261-M362 HydrophobicContact CG-CE 3.79Å
262	R	98.4	Very high	98.7	Very high	67 Å²	67	45.3 Å²	45.3	25%	0.253	21%	0.21	S	C	.	.	H	α-helix	trans	-78.9	-37.4	176.2	-61.6	-170.7	-59.1	-125.1	8.7	112.3	V186 H259 L260 L264 Q265 F266	V186-R262 PolarHBondContact O-NH2 3.23Å; H259-R262 PolarHBondContact ND1-NH2 3.27Å; H259-R262 WeakPolarHBondContact O-CB 3.49Å; H259-R262 PolarHBondContact O-N 2.83Å; L260-R262 PolarHBondContact O-N 2.92Å; L260-R262 VanDerWaalsContact O-N 3.09Å; R262-L264 VanDerWaalsContact C-N 3.33Å; R262-Q265 WeakPolarHBondContact O-CB 3.38Å; R262-Q265 PolarHBondContact O-N 3.38Å; R262-F266 WeakPolarHBondContact O-CD2 3.34Å
263	W	98.9	Very high	98.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65	-39.9	176.5	-75.2	93.4	0	0	0	111.6	I123 Y184 F185 V190 P191 I194 L203 H259 L260 Q265 F266 F267 L272	I123-W263 HydrophobicContact CB-CH2 3.99Å; I123-W263 HydrophobicContact CB-CZ2 4.16Å; I123-W263 HydrophobicContact CD1-CD2 3.82Å; I123-W263 HydrophobicContact CD1-CE3 3.85Å; I123-W263 HydrophobicContact CD1-CH2 3.47Å; I123-W263 VanDerWaalsContact CD1-CH2 3.47Å; I123-W263 HydrophobicContact CD1-CZ2 3.48Å; I123-W263 VanDerWaalsContact CD1-CZ2 3.48Å; I123-W263 HydrophobicContact CD1-CZ3 3.68Å; I123-W263 HydrophobicContact CG1-CH2 4.32Å; I123-W263 HydrophobicContact CG1-CZ2 4.35Å; I123-W263 HydrophobicContact CG2-CH2 3.76Å; I123-W263 HydrophobicContact CG2-CZ2 4.43Å; I123-W263 HydrophobicContact CG2-CZ3 4.34Å; Y184-W263 WeakPolarHBondContact O-CZ2 3.35Å; F185-W263 AromaticContact CD2-CD1 3.81Å; F185-W263 AromaticContact CD2-NE1 3.47Å; F185-W263 AromaticContact CE2-CD1 3.83Å; F185-W263 AromaticContact CE2-NE1 3.99Å; F185-W263 PolarHBondContact O-NE1 3.32Å; V190-W263 HydrophobicContact CG1-CH2 3.77Å; V190-W263 HydrophobicContact CG1-CZ2 4.09Å; P191-W263 HydrophobicContact CB-CD2 4.19Å; P191-W263 HydrophobicContact CB-CE3 4.02Å; P191-W263 HydrophobicContact CB-CZ3 4.36Å; P191-W263 HydrophobicContact CG-CD2 3.75Å; P191-W263 HydrophobicContact CG-CE3 4.03Å; P191-W263 HydrophobicContact CG-CG 4.16Å; P191-W263 HydrophobicContact CG-CH2 4.43Å; P191-W263 HydrophobicContact CG-CZ2 4.11Å; P191-W263 HydrophobicContact CG-CZ3 4.37Å; I194-W263 HydrophobicContact CD1-CH2 3.73Å; I194-W263 HydrophobicContact CD1-CZ3 4.01Å; L203-W263 HydrophobicContact CD1-CE3 3.48Å; L203-W263 VanDerWaalsContact CD1-CE3 3.48Å; L203-W263 HydrophobicContact CD1-CZ3 3.48Å; L203-W263 VanDerWaalsContact CD1-CZ3 3.48Å; L203-W263 HydrophobicContact CD2-CZ3 4.17Å; L203-W263 HydrophobicContact CG-CZ3 4.44Å; H259-W263 VanDerWaalsContact O-CD1 3.28Å; H259-W263 PolarHBondContact O-N 3.42Å; L260-W263 HydrophobicContact CD1-CB 4.37Å; L260-W263 PolarHBondContact O-N 3.32Å; W263-Q265 PolarHBondContact O-N 3.11Å; W263-F266 PolarHBondContact O-N 3.08Å; W263-F267 HydrophobicContact CE3-CD2 4.07Å; W263-F267 HydrophobicContact CE3-CE2 4.38Å; W263-F267 HydrophobicContact CZ3-CD2 4.42Å; W263-F267 HydrophobicContact CZ3-CE2 4.3Å; W263-F267 PolarHBondContact O-N 3.27Å; W263-L272 HydrophobicContact CB-CD2 4.14Å
264	L	98.8	Very high	98.7	Very high	61 Å²	61	42.2 Å²	42.2	32%	0.319	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-8.4	179.8	-63.1	178.3	0	0	0	114.5	L260 R262 F267 M269 L272 M362	L260-L264 HydrophobicContact CD1-CD1 4.15Å; L260-L264 HydrophobicContact CD1-CD2 4.05Å; L260-L264 HydrophobicContact CD1-CG 3.81Å; L260-L264 HydrophobicContact CD2-CD1 4.45Å; L260-L264 HydrophobicContact CG-CD1 3.89Å; L260-L264 HydrophobicContact CG-CG 4.05Å; L260-L264 WeakPolarHBondContact O-CG 3.45Å; L260-L264 PolarHBondContact O-N 3.47Å; R262-L264 VanDerWaalsContact C-N 3.33Å; L264-F267 WeakPolarHBondContact CA-O 3.17Å; L264-M269 HydrophobicContact CD1-CE 3.7Å; L264-M269 HydrophobicContact CD2-CB 4.45Å; L264-M269 HydrophobicContact CD2-CE 3.76Å; L264-M269 HydrophobicContact CD2-SD 4.37Å; L264-M269 HydrophobicContact CG-CE 4.35Å; L264-L272 HydrophobicContact CD2-CD1 4.09Å; L264-M362 HydrophobicContact CD1-CE 3.73Å
265	Q	98.6	Very high	98.7	Very high	142 Å²	142	42.2 Å²	42.2	66%	0.664	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-17.6	169	-68.3	170	41.4	0	0	112.5	E261 R262 W263	E261-Q265 PolarHBondContact O-NE2 3.13Å; R262-Q265 WeakPolarHBondContact O-CB 3.38Å; R262-Q265 PolarHBondContact O-N 3.38Å; W263-Q265 PolarHBondContact O-N 3.11Å
266	F	98.8	Very high	98.7	Very high	67 Å²	67	42.5 Å²	42.5	29%	0.294	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121	-41	-174.7	-65	-88.9	0	0	0	112.5	P191 S192 Y195 R262 W263	P191-F266 HydrophobicContact CB-CB 4.42Å; P191-F266 HydrophobicContact CB-CD2 3.55Å; P191-F266 HydrophobicContact CB-CE2 4.09Å; P191-F266 HydrophobicContact CB-CG 4.11Å; S192-F266 VanDerWaalsContact CB-CE1 3.47Å; Y195-F266 HydrophobicContact CD1-CD1 4.26Å; Y195-F266 HydrophobicContact CD2-CB 4.05Å; Y195-F266 WeakPolarHBondContact CD2-O 3.19Å; Y195-F266 WeakPolarHBondContact CE2-O 3.37Å; Y195-F266 HydrophobicContact CG-CB 4.2Å; Y195-F266 HydrophobicContact CG-CD1 4.06Å; R262-F266 WeakPolarHBondContact O-CD2 3.34Å; W263-F266 PolarHBondContact O-N 3.08Å
267	F	98.8	Very high	98.7	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.009	20%	0.2	C	C	.	.	S	Bend	trans	-116	134.6	-175.6	-67.5	-84.9	0	0	0	110.9	P191 I194 Y195 L203 W263 L264 L272	P191-F267 WeakPolarHBondContact O-CE2 3.48Å; I194-F267 HydrophobicContact CB-CE2 4.35Å; I194-F267 HydrophobicContact CB-CZ 4.15Å; I194-F267 HydrophobicContact CG2-CE2 4.34Å; I194-F267 HydrophobicContact CG2-CZ 3.76Å; Y195-F267 HydrophobicContact CD2-CE1 4.27Å; Y195-F267 HydrophobicContact CD2-CE2 4.43Å; Y195-F267 HydrophobicContact CD2-CZ 4.18Å; L203-F267 HydrophobicContact CD1-CB 4.1Å; L203-F267 HydrophobicContact CD1-CD1 4.03Å; L203-F267 HydrophobicContact CD1-CD2 3.61Å; L203-F267 HydrophobicContact CD1-CE1 4.37Å; L203-F267 HydrophobicContact CD1-CE2 3.99Å; L203-F267 HydrophobicContact CD1-CG 3.63Å; L203-F267 HydrophobicContact CD1-CZ 4.35Å; W263-F267 HydrophobicContact CE3-CD2 4.07Å; W263-F267 HydrophobicContact CE3-CE2 4.38Å; W263-F267 HydrophobicContact CZ3-CD2 4.42Å; W263-F267 HydrophobicContact CZ3-CE2 4.3Å; W263-F267 PolarHBondContact O-N 3.27Å; L264-F267 WeakPolarHBondContact CA-O 3.17Å; F267-L272 HydrophobicContact CB-CD1 3.88Å
268	P	98.6	Very high	98.7	Very high	49 Å²	49	45.2 Å²	45.2	32%	0.318	21%	0.212	S	C	.	.			trans	-73.3	154.2	175.3	37.2	-39.2	0	0	0	110.3	E270 Q271 L272	P268-E270 VanDerWaalsContact CB-CD 3.49Å; P268-E270 HydrophobicContact CB-CG 4.36Å; P268-E270 WeakPolarHBondContact CB-OE1 3.16Å; P268-E270 WeakPolarHBondContact CB-OE2 3.34Å; P268-E270 HydrophobicContact CG-CG 4.18Å; P268-E270 PolarHBondContact O-N 3.43Å; P268-E270 VanDerWaalsContact O-N 3.13Å; P268-Q271 HydrophobicContact CG-CB 4.37Å; P268-Q271 HydrophobicContact CG-CG 4.06Å; P268-Q271 VanDerWaalsContact CG-OE1 3.23Å; P268-Q271 PolarHBondContact O-N 2.62Å; P268-L272 VanDerWaalsContact O-CD1 3.24Å; P268-L272 WeakPolarHBondContact O-CD1 3.42Å
269	M	98.4	Very high	98.7	Very high	59 Å²	59	43.4 Å²	43.4	29%	0.291	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-55.9	-36.2	-171.2	-176.2	63.7	67.7	0	0	112.9	L260 L264 Q271 L272 F274 M362	L260-M269 HydrophobicContact CD2-CE 4.33Å; L264-M269 HydrophobicContact CD1-CE 3.7Å; L264-M269 HydrophobicContact CD2-CB 4.45Å; L264-M269 HydrophobicContact CD2-CE 3.76Å; L264-M269 HydrophobicContact CD2-SD 4.37Å; L264-M269 HydrophobicContact CG-CE 4.35Å; M269-Q271 PolarHBondContact O-N 3.3Å; M269-L272 PolarHBondContact O-N 2.74Å; M269-L272 VanDerWaalsContact O-O 3.11Å; M269-F274 HydrophobicContact SD-CE2 3.74Å; M269-F274 HydrophobicContact SD-CZ 4.47Å; M269-M362 WeakPolarHBondContact CE-O 3.48Å
270	E	98.4	Very high	98.6	Very high	148 Å²	148	43.5 Å²	43.5	69%	0.692	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-63.3	-17.5	178.4	60.3	-91.7	-153.1	0	0	114.4	P268 F294	P268-E270 VanDerWaalsContact CB-CD 3.49Å; P268-E270 HydrophobicContact CB-CG 4.36Å; P268-E270 WeakPolarHBondContact CB-OE1 3.16Å; P268-E270 WeakPolarHBondContact CB-OE2 3.34Å; P268-E270 HydrophobicContact CG-CG 4.18Å; P268-E270 PolarHBondContact O-N 3.43Å; P268-E270 VanDerWaalsContact O-N 3.13Å; E270-F294 WeakPolarHBondContact O-CE2 3.45Å
271	Q	98.8	Very high	98.4	Very high	33 Å²	33	46.1 Å²	46.1	15%	0.154	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-90.4	0.2	171.8	-74.6	-177.7	-110.5	0	0	113	K199 D200 T201 L203 P268 M269 F294	K199-Q271 PolarHBondContact O-NE2 2.92Å; K199-Q271 PolarHBondContact O-OE1 2.75Å; D200-Q271 VanDerWaalsContact C-NE2 3.28Å; T201-Q271 PolarHBondContact O-NE2 3.34Å; L203-Q271 PolarHBondContact N-O 2.77Å; P268-Q271 HydrophobicContact CG-CB 4.37Å; P268-Q271 HydrophobicContact CG-CG 4.06Å; P268-Q271 VanDerWaalsContact CG-OE1 3.23Å; P268-Q271 PolarHBondContact O-N 2.62Å; M269-Q271 PolarHBondContact O-N 3.3Å; Q271-F294 WeakPolarHBondContact O-CZ 3.42Å
272	L	98.9	Very high	98.3	Very high	11 Å²	11	47.8 Å²	47.8	6%	0.058	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.6	175.5	-65	98.4	0	0	0	111.2	L203 L260 W263 L264 F267 P268 M269 F274	L203-L272 HydrophobicContact CB-CG 4.19Å; L203-L272 HydrophobicContact CD1-CD2 4.34Å; L203-L272 HydrophobicContact CD1-CG 4.21Å; L203-L272 CarbonylContact O-C 3.51Å; L203-L272 WeakPolarHBondContact O-CA 3.45Å; L260-L272 HydrophobicContact CD1-CD2 3.97Å; W263-L272 HydrophobicContact CB-CD2 4.14Å; L264-L272 HydrophobicContact CD2-CD1 4.09Å; F267-L272 HydrophobicContact CB-CD1 3.88Å; P268-L272 VanDerWaalsContact O-CD1 3.24Å; P268-L272 WeakPolarHBondContact O-CD1 3.42Å; M269-L272 PolarHBondContact O-N 2.74Å; M269-L272 VanDerWaalsContact O-O 3.11Å; L272-F274 HydrophobicContact CB-CE2 3.86Å; L272-F274 HydrophobicContact CB-CZ 3.96Å; L272-F274 HydrophobicContact CD2-CZ 4.1Å
273	L	98.9	Very high	98.3	Very high	18 Å²	18	47.3 Å²	47.3	9%	0.094	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.9	168.3	180	68.7	0	0	0	110.8	L203 I204 V205 V275 V291 F294	L203-L273 PolarHBondContact O-N 3.44Å; I204-L273 WeakPolarHBondContact CA-O 3.45Å; I204-L273 HydrophobicContact CG1-CB 4.35Å; V205-L273 PolarHBondContact N-O 2.94Å; L273-V275 HydrophobicContact CD2-CG2 3.87Å; L273-V275 HydrophobicContact CG-CG2 4.06Å; L273-V291 HydrophobicContact CD2-CB 4.12Å; L273-V291 HydrophobicContact CD2-CG1 4.39Å; L273-V291 HydrophobicContact CD2-CG2 3.67Å; L273-F294 HydrophobicContact CB-CB 4.42Å; L273-F294 HydrophobicContact CB-CD1 3.6Å; L273-F294 HydrophobicContact CB-CD2 3.82Å; L273-F294 HydrophobicContact CB-CE1 3.66Å; L273-F294 HydrophobicContact CB-CE2 3.87Å; L273-F294 HydrophobicContact CB-CG 3.67Å; L273-F294 HydrophobicContact CB-CZ 3.79Å; L273-F294 HydrophobicContact CD1-CB 4.36Å; L273-F294 HydrophobicContact CD1-CG 4.4Å; L273-F294 HydrophobicContact CD2-CB 3.76Å; L273-F294 HydrophobicContact CD2-CD1 3.82Å; L273-F294 HydrophobicContact CD2-CG 3.85Å; L273-F294 HydrophobicContact CG-CB 4.4Å; L273-F294 HydrophobicContact CG-CD1 4.3Å; L273-F294 HydrophobicContact CG-CG 4.17Å
274	F	98.9	Very high	98.2	Very high	11 Å²	11	48 Å²	48	5%	0.048	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	113.9	171.7	-56.7	-84.5	0	0	0	110.5	V205 V207 L260 M269 L272 R290 F359 T363 F367	V205-F274 HydrophobicContact CB-CD1 3.75Å; V205-F274 HydrophobicContact CB-CE1 3.97Å; V205-F274 HydrophobicContact CG1-CD1 4.28Å; V205-F274 HydrophobicContact CG1-CE1 4.44Å; V205-F274 HydrophobicContact CG2-CD1 4.17Å; V205-F274 HydrophobicContact CG2-CE1 3.88Å; V205-F274 WeakPolarHBondContact O-CA 3.43Å; V207-F274 HydrophobicContact CG1-CD1 4.36Å; L260-F274 HydrophobicContact CD1-CE1 4.22Å; L260-F274 HydrophobicContact CD1-CZ 3.56Å; L260-F274 HydrophobicContact CD2-CE1 4.31Å; L260-F274 HydrophobicContact CD2-CE2 4.48Å; L260-F274 HydrophobicContact CD2-CZ 3.8Å; L260-F274 HydrophobicContact CG-CZ 4.31Å; M269-F274 HydrophobicContact SD-CE2 3.74Å; M269-F274 HydrophobicContact SD-CZ 4.47Å; L272-F274 HydrophobicContact CB-CE2 3.86Å; L272-F274 HydrophobicContact CB-CZ 3.96Å; L272-F274 HydrophobicContact CD2-CZ 4.1Å; F274-R290 PolarHBondContact O-NH1 3.45Å; F274-R290 PolarHBondContact O-NH2 3.09Å; F274-F359 HydrophobicContact CD1-CE2 4.03Å; F274-F359 AromaticContact CD1-CZ 3.47Å; F274-F359 HydrophobicContact CD1-CZ 3.47Å; F274-F359 VanDerWaalsContact CD1-CZ 3.47Å; F274-F359 AromaticContact CE1-CE2 3.82Å; F274-F359 HydrophobicContact CE1-CE2 3.82Å; F274-F359 AromaticContact CE1-CZ 3.77Å; F274-F359 HydrophobicContact CE1-CZ 3.77Å; F274-F359 HydrophobicContact CG-CZ 4.12Å; F274-F359 HydrophobicContact CZ-CE2 4.49Å; F274-T363 HydrophobicContact CD1-CG2 4.21Å; F274-T363 HydrophobicContact CD2-CG2 3.49Å; F274-T363 VanDerWaalsContact CD2-CG2 3.49Å; F274-T363 HydrophobicContact CE1-CG2 4.27Å; F274-T363 HydrophobicContact CE2-CG2 3.59Å; F274-T363 HydrophobicContact CG-CG2 3.83Å; F274-T363 HydrophobicContact CZ-CG2 3.99Å; F274-F367 HydrophobicContact CB-CE1 4.3Å; F274-F367 HydrophobicContact CB-CZ 3.61Å
275	V	98.9	Very high	98.1	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	131.1	-179.6	177.7	0	0	0	0	108.6	L133 I204 V205 V206 V207 L273 G277 E287 V291	L133-V275 HydrophobicContact CD2-CG2 4.21Å; I204-V275 HydrophobicContact CG2-CG2 3.72Å; V205-V275 PolarHBondContact O-N 3.32Å; V206-V275 WeakPolarHBondContact CA-O 3.48Å; V206-V275 HydrophobicContact CG1-CB 4.38Å; V206-V275 HydrophobicContact CG1-CG1 4.23Å; V206-V275 HydrophobicContact CG2-CB 4.29Å; V207-V275 WeakPolarHBondContact CG2-O 3.45Å; V207-V275 PolarHBondContact N-O 2.97Å; L273-V275 HydrophobicContact CD2-CG2 3.87Å; L273-V275 HydrophobicContact CG-CG2 4.06Å; V275-G277 PolarHBondContact O-N 3.44Å; V275-E287 WeakPolarHBondContact CA-OE2 3.4Å; V275-E287 HydrophobicContact CG1-CB 4.36Å; V275-E287 HydrophobicContact CG1-CG 4.43Å; V275-E287 VanDerWaalsContact CG1-OE2 3.32Å; V275-E287 WeakPolarHBondContact CG1-OE2 3.35Å; V275-V291 HydrophobicContact CG2-CG2 3.63Å
276	S	98.8	Very high	98.1	Very high	10 Å²	10	39.3 Å²	39.3	7%	0.07	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.7	176.3	171.8	0	0	0	0	109.5	E278 R279 L280 E287	S276-E278 VanDerWaalsContact C-N 3.3Å; S276-E278 PolarHBondContact O-N 3.01Å; S276-R279 PolarHBondContact O-N 3.43Å; S276-R279 PolarHBondContact OG-N 3.38Å; S276-R279 VanDerWaalsContact OG-N 3.1Å; S276-L280 WeakPolarHBondContact O-CB 3.28Å; S276-L280 PolarHBondContact O-N 3.39Å; S276-E287 PolarHBondContact N-OE2 2.95Å
277	G	98.3	Very high	98.1	Very high	5 Å²	5	36.1 Å²	36.1	5%	0.052	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-32.8	176	0	0	0	0	0	112.5	V207 V275 I281	V207-G277 VanDerWaalsContact O-CA 3.25Å; V207-G277 WeakPolarHBondContact O-CA 3.38Å; V207-G277 PolarHBondContact O-N 3.05Å; V275-G277 PolarHBondContact O-N 3.44Å; G277-I281 WeakPolarHBondContact O-CG1 3.25Å; G277-I281 PolarHBondContact O-N 2.91Å
278	E	98.1	Very high	98.1	Very high	55 Å²	55	36 Å²	36	26%	0.257	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-50	171.4	-70.2	72.7	-156.1	0	0	110.9	R208 N209 S276 L280 I281 T282 W369	R208-E278 VanDerWaalsContact CG-OE1 3.26Å; R208-E278 WeakPolarHBondContact CG-OE1 3.05Å; N209-E278 WeakPolarHBondContact CB-OE1 3.31Å; N209-E278 PolarHBondContact N-OE1 2.92Å; S276-E278 VanDerWaalsContact C-N 3.3Å; S276-E278 PolarHBondContact O-N 3.01Å; E278-L280 VanDerWaalsContact C-N 3.31Å; E278-L280 PolarHBondContact O-N 3.21Å; E278-I281 WeakPolarHBondContact O-CB 3.47Å; E278-I281 PolarHBondContact O-N 2.85Å; E278-T282 PolarHBondContact O-N 3.36Å; E278-T282 VanDerWaalsContact O-N 3.13Å; E278-T282 PolarHBondContact O-OG1 3.24Å; E278-W369 PolarHBondContact OE2-NE1 3.4Å; E278-W369 VanDerWaalsContact OE2-NE1 3.16Å
279	R	98	Very high	98.1	Very high	88 Å²	88	34.7 Å²	34.7	33%	0.332	18%	0.183	S	C	.	.	H	α-helix	trans	-69.6	-29.8	-179.4	-162.3	174.9	168.1	-130.1	2.4	112.3	S276 I281 T282 D283 E287	S276-R279 PolarHBondContact O-N 3.43Å; S276-R279 PolarHBondContact OG-N 3.38Å; S276-R279 VanDerWaalsContact OG-N 3.1Å; R279-I281 PolarHBondContact O-N 2.9Å; R279-I281 VanDerWaalsContact O-N 3.14Å; R279-T282 PolarHBondContact O-N 3.04Å; R279-D283 HydrophobicContact CG-CB 3.96Å; R279-D283 IonicContact CZ-OD2 3.48Å; R279-D283 VanDerWaalsContact CZ-OD2 3.31Å; R279-D283 IonicContact NE-OD2 3.11Å; R279-D283 PolarHBondContact NE-OD2 3.17Å; R279-D283 IonicContact NH2-OD2 3.67Å; R279-D283 PolarHBondContact NH2-OD2 3.14Å; R279-D283 CarbonylContact O-C 3.51Å; R279-D283 WeakPolarHBondContact O-CA 3.32Å; R279-D283 PolarHBondContact O-N 3.48Å; R279-D283 VanDerWaalsContact O-O 3.09Å; R279-E287 HydrophobicContact CB-CG 3.74Å; R279-E287 WeakPolarHBondContact CD-OE1 3.45Å; R279-E287 HydrophobicContact CG-CG 3.83Å; R279-E287 IonicContact CZ-OE1 2.59Å; R279-E287 IonicContact NE-OE1 2.81Å; R279-E287 IonicContact NH1-OE1 3.46Å; R279-E287 PolarHBondContact NH1-OE1 3.37Å
280	L	97.1	Very high	98.1	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-61.8	-20.9	172.1	-167.4	66.7	0	0	0	112.6	A132 L133 F136 V206 S276 E278 P284 E287	A132-L280 HydrophobicContact CB-CD2 4.22Å; L133-L280 HydrophobicContact CB-CD2 3.99Å; L133-L280 HydrophobicContact CD1-CD1 4.37Å; F136-L280 HydrophobicContact CD2-CD1 3.8Å; F136-L280 HydrophobicContact CD2-CG 4.4Å; F136-L280 HydrophobicContact CE2-CD1 3.89Å; F136-L280 HydrophobicContact CE2-CG 4.04Å; V206-L280 HydrophobicContact CG1-CD2 4.19Å; S276-L280 WeakPolarHBondContact O-CB 3.28Å; S276-L280 PolarHBondContact O-N 3.39Å; E278-L280 VanDerWaalsContact C-N 3.31Å; E278-L280 PolarHBondContact O-N 3.21Å; L280-P284 WeakPolarHBondContact O-CB 3.37Å; L280-E287 HydrophobicContact CD1-CB 4.09Å
281	I	95.6	Very high	98.1	Very high	55 Å²	55	28.2 Å²	28.2	28%	0.282	15%	0.149	S	C	.	.	H	α-helix	trans	-88.4	-48.7	173.7	-61.5	163.6	0	0	0	110.5	G277 E278 R279 F314 P315	G277-I281 WeakPolarHBondContact O-CG1 3.25Å; G277-I281 PolarHBondContact O-N 2.91Å; E278-I281 WeakPolarHBondContact O-CB 3.47Å; E278-I281 PolarHBondContact O-N 2.85Å; R279-I281 PolarHBondContact O-N 2.9Å; R279-I281 VanDerWaalsContact O-N 3.14Å; I281-F314 HydrophobicContact CD1-CD1 4.18Å; I281-F314 HydrophobicContact CD1-CE1 3.68Å; I281-F314 HydrophobicContact CG1-CD1 4Å; I281-F314 HydrophobicContact CG1-CE1 4.02Å; I281-F314 HydrophobicContact CG2-CD1 4.14Å; I281-F314 HydrophobicContact CG2-CE1 4.49Å; I281-P315 WeakPolarHBondContact O-CD 3.35Å
282	T	96.4	Very high	98.1	Very high	117 Å²	117	26.7 Å²	26.7	72%	0.718	14%	0.142	S	C	*	.	H	α-helix	trans	-82.5	-31.2	-171.6	59.6	0	0	0	0	113.8	E278 R279	E278-T282 PolarHBondContact O-N 3.36Å; E278-T282 VanDerWaalsContact O-N 3.13Å; E278-T282 PolarHBondContact O-OG1 3.24Å; R279-T282 PolarHBondContact O-N 3.04Å
283	D	97.5	Very high	98.1	Very high	57 Å²	57	29.8 Å²	29.8	31%	0.305	16%	0.158	S	C	.	.			trans	-145.5	69	-178.3	176.6	19.9	0	0	0	110.1	R279 A285 G286 E287	R279-D283 HydrophobicContact CG-CB 3.96Å; R279-D283 IonicContact CZ-OD2 3.48Å; R279-D283 VanDerWaalsContact CZ-OD2 3.31Å; R279-D283 IonicContact NE-OD2 3.11Å; R279-D283 PolarHBondContact NE-OD2 3.17Å; R279-D283 IonicContact NH2-OD2 3.67Å; R279-D283 PolarHBondContact NH2-OD2 3.14Å; R279-D283 CarbonylContact O-C 3.51Å; R279-D283 WeakPolarHBondContact O-CA 3.32Å; R279-D283 PolarHBondContact O-N 3.48Å; R279-D283 VanDerWaalsContact O-O 3.09Å; D283-A285 VanDerWaalsContact C-N 3.27Å; D283-A285 PolarHBondContact O-N 3.35Å; D283-G286 PolarHBondContact O-N 3.49Å; D283-G286 PolarHBondContact OD1-N 3.05Å; D283-E287 PolarHBondContact O-N 3.15Å
284	P	97.6	Very high	98.1	Very high	14 Å²	14	30.4 Å²	30.4	9%	0.091	16%	0.16	C	C	.	.	H	α-helix	trans	-61.4	-34.8	-178.8	23.8	-34.2	0	0	0	112.7	F136 L280 E287 M288 F306 P315	F136-P284 HydrophobicContact CD2-CB 4.28Å; F136-P284 HydrophobicContact CE2-CB 3.8Å; L280-P284 WeakPolarHBondContact O-CB 3.37Å; P284-E287 PolarHBondContact O-N 3.05Å; P284-M288 WeakPolarHBondContact O-CB 3.48Å; P284-M288 WeakPolarHBondContact O-CG 3.47Å; P284-M288 PolarHBondContact O-N 3.13Å; P284-F306 HydrophobicContact CB-CD1 3.83Å; P284-F306 HydrophobicContact CB-CD2 4.17Å; P284-F306 HydrophobicContact CB-CE1 3.8Å; P284-F306 HydrophobicContact CB-CE2 4.14Å; P284-F306 HydrophobicContact CB-CG 4.02Å; P284-F306 HydrophobicContact CB-CZ 3.97Å; P284-F306 HydrophobicContact CG-CB 3.96Å; P284-F306 HydrophobicContact CG-CD1 3.78Å; P284-F306 HydrophobicContact CG-CD2 3.94Å; P284-F306 HydrophobicContact CG-CE1 4.27Å; P284-F306 HydrophobicContact CG-CE2 4.42Å; P284-F306 HydrophobicContact CG-CG 3.6Å; P284-P315 HydrophobicContact CG-CB 4.03Å; P284-P315 HydrophobicContact CG-CG 4.27Å
285	A	97.6	Very high	98.1	Very high	5 Å²	5	30.4 Å²	30.4	4%	0.041	16%	0.161	C	C	.	.	H	α-helix	trans	-66	-43.2	179.1	0	0	0	0	0	111.8	D283 E287 M288 A289 E303 F306	D283-A285 VanDerWaalsContact C-N 3.27Å; D283-A285 PolarHBondContact O-N 3.35Å; A285-E287 PolarHBondContact O-N 3.49Å; A285-M288 PolarHBondContact O-N 3.26Å; A285-A289 PolarHBondContact O-N 3Å; A285-E303 HydrophobicContact CB-CB 4.28Å; A285-E303 HydrophobicContact CB-CG 3.72Å; A285-F306 HydrophobicContact CB-CD2 4.13Å; A285-F306 HydrophobicContact CB-CE2 4.19Å
286	G	98.2	Very high	98.1	Very high	15 Å²	15	33.4 Å²	33.4	16%	0.155	19%	0.192	C	C	.	.	H	α-helix	trans	-64.7	-36.9	177	0	0	0	0	0	113.8	D283	D283-G286 PolarHBondContact O-N 3.49Å; D283-G286 PolarHBondContact OD1-N 3.05Å
287	E	98.4	Very high	98	Very high	1 Å²	1	34 Å²	34	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-71.1	-39.7	171.4	-74.6	-62.3	100.5	0	0	111.8	V275 S276 R279 L280 D283 P284 A285 A289 R290 V291	V275-E287 WeakPolarHBondContact CA-OE2 3.4Å; V275-E287 HydrophobicContact CG1-CB 4.36Å; V275-E287 HydrophobicContact CG1-CG 4.43Å; V275-E287 VanDerWaalsContact CG1-OE2 3.32Å; V275-E287 WeakPolarHBondContact CG1-OE2 3.35Å; S276-E287 PolarHBondContact N-OE2 2.95Å; R279-E287 HydrophobicContact CB-CG 3.74Å; R279-E287 WeakPolarHBondContact CD-OE1 3.45Å; R279-E287 HydrophobicContact CG-CG 3.83Å; R279-E287 IonicContact CZ-OE1 2.59Å; R279-E287 IonicContact NE-OE1 2.81Å; R279-E287 IonicContact NH1-OE1 3.46Å; R279-E287 PolarHBondContact NH1-OE1 3.37Å; L280-E287 HydrophobicContact CD1-CB 4.09Å; D283-E287 PolarHBondContact O-N 3.15Å; P284-E287 PolarHBondContact O-N 3.05Å; A285-E287 PolarHBondContact O-N 3.49Å; E287-A289 VanDerWaalsContact C-N 3.29Å; E287-A289 PolarHBondContact O-N 3.34Å; E287-R290 VanDerWaalsContact CD-NH1 3.29Å; E287-R290 WeakPolarHBondContact O-CB 3.48Å; E287-R290 PolarHBondContact O-N 2.56Å; E287-R290 VanDerWaalsContact O-N 3.17Å; E287-R290 WeakPolarHBondContact OE1-CD 3.45Å; E287-R290 IonicContact OE1-CZ 3.77Å; E287-R290 IonicContact OE1-NH1 2.6Å; E287-R290 PolarHBondContact OE1-NH1 2.67Å; E287-R290 IonicContact OE2-NH1 2.68Å; E287-R290 PolarHBondContact OE2-NH1 3.49Å; E287-V291 WeakPolarHBondContact O-CG2 3.25Å; E287-V291 PolarHBondContact O-N 2.64Å
288	M	98.5	Very high	98	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.3	-33.4	176.2	-77.2	-57.4	-59.7	0	0	112.9	L133 F136 L137 P284 A285 V291 Q292 V301 F306	L133-M288 HydrophobicContact CD1-SD 3.8Å; F136-M288 HydrophobicContact CB-CE 4.26Å; F136-M288 HydrophobicContact CB-CG 4.18Å; F136-M288 HydrophobicContact CB-SD 3.61Å; F136-M288 HydrophobicContact CD2-CG 4.47Å; F136-M288 HydrophobicContact CD2-SD 4.5Å; L137-M288 HydrophobicContact CD2-CE 3.59Å; L137-M288 HydrophobicContact CD2-SD 4.43Å; L137-M288 HydrophobicContact CG-CE 3.92Å; L137-M288 HydrophobicContact CG-SD 4.35Å; P284-M288 WeakPolarHBondContact O-CB 3.48Å; P284-M288 WeakPolarHBondContact O-CG 3.47Å; P284-M288 PolarHBondContact O-N 3.13Å; A285-M288 PolarHBondContact O-N 3.26Å; M288-V291 PolarHBondContact O-N 3.03Å; M288-Q292 WeakPolarHBondContact O-CB 3.47Å; M288-Q292 VanDerWaalsContact O-CG 3.25Å; M288-Q292 WeakPolarHBondContact O-CG 3.31Å; M288-Q292 PolarHBondContact O-N 3.48Å; M288-Q292 PolarHBondContact O-NE2 3.21Å; M288-V301 HydrophobicContact CB-CG1 4.46Å; M288-V301 HydrophobicContact CE-CB 4.09Å; M288-V301 HydrophobicContact CE-CG1 4.13Å; M288-V301 HydrophobicContact CE-CG2 4.32Å; M288-V301 HydrophobicContact CG-CG1 4.27Å; M288-F306 HydrophobicContact CG-CE2 4.41Å; M288-F306 HydrophobicContact CG-CZ 3.93Å
289	A	98.6	Very high	98	Very high	20 Å²	20	45.8 Å²	45.8	17%	0.165	24%	0.235	C	C	.	.	H	α-helix	trans	-58.3	-48.4	172.5	0	0	0	0	0	111.1	A285 E287 V291 Q292 D293	A285-A289 PolarHBondContact O-N 3Å; E287-A289 VanDerWaalsContact C-N 3.29Å; E287-A289 PolarHBondContact O-N 3.34Å; A289-V291 VanDerWaalsContact C-N 3.34Å; A289-V291 PolarHBondContact O-N 3.06Å; A289-Q292 PolarHBondContact O-N 3.29Å; A289-D293 PolarHBondContact O-N 3.3Å
290	R	98.7	Very high	97.9	Very high	72 Å²	72	43 Å²	43	27%	0.272	23%	0.227	S	C	.	.	H	α-helix	trans	-61.7	-41.5	177.8	-65.4	174.1	61.7	-138.3	-5.3	112.3	F274 E287 F294	F274-R290 PolarHBondContact O-NH1 3.45Å; F274-R290 PolarHBondContact O-NH2 3.09Å; E287-R290 VanDerWaalsContact CD-NH1 3.29Å; E287-R290 WeakPolarHBondContact O-CB 3.48Å; E287-R290 PolarHBondContact O-N 2.56Å; E287-R290 VanDerWaalsContact O-N 3.17Å; E287-R290 WeakPolarHBondContact OE1-CD 3.45Å; E287-R290 IonicContact OE1-CZ 3.77Å; E287-R290 IonicContact OE1-NH1 2.6Å; E287-R290 PolarHBondContact OE1-NH1 2.67Å; E287-R290 IonicContact OE2-NH1 2.68Å; E287-R290 PolarHBondContact OE2-NH1 3.49Å; R290-F294 WeakPolarHBondContact O-CB 3.39Å; R290-F294 PolarHBondContact O-N 3.26Å
291	V	98.8	Very high	97.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-68.1	-42.5	-180	-179.4	0	0	0	0	111.2	L133 L137 I204 L273 V275 E287 M288 A289 F294 L295	L133-V291 HydrophobicContact CD1-CG1 4.48Å; L133-V291 HydrophobicContact CD1-CG2 4.03Å; L137-V291 HydrophobicContact CD1-CG1 4.13Å; L137-V291 HydrophobicContact CD2-CG1 3.6Å; L137-V291 HydrophobicContact CG-CG1 4.31Å; I204-V291 HydrophobicContact CD1-CG1 3.94Å; L273-V291 HydrophobicContact CD2-CB 4.12Å; L273-V291 HydrophobicContact CD2-CG1 4.39Å; L273-V291 HydrophobicContact CD2-CG2 3.67Å; V275-V291 HydrophobicContact CG2-CG2 3.63Å; E287-V291 WeakPolarHBondContact O-CG2 3.25Å; E287-V291 PolarHBondContact O-N 2.64Å; M288-V291 PolarHBondContact O-N 3.03Å; A289-V291 VanDerWaalsContact C-N 3.34Å; A289-V291 PolarHBondContact O-N 3.06Å; V291-F294 PolarHBondContact O-N 3.38Å; V291-L295 HydrophobicContact CG1-CD1 3.97Å; V291-L295 HydrophobicContact CG1-CG 4.42Å; V291-L295 WeakPolarHBondContact O-CB 3.37Å; V291-L295 VanDerWaalsContact O-CG 3.31Å; V291-L295 WeakPolarHBondContact O-CG 3.24Å; V291-L295 PolarHBondContact O-N 3.34Å
292	Q	98.8	Very high	97.9	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-46.9	176.8	-73.3	166.7	114.9	0	0	110.9	H140 M288 A289 F294 L295 G296 L297 R298 R299 V301	H140-Q292 PolarHBondContact CD2-OE1 3.3Å; M288-Q292 WeakPolarHBondContact O-CB 3.47Å; M288-Q292 VanDerWaalsContact O-CG 3.25Å; M288-Q292 WeakPolarHBondContact O-CG 3.31Å; M288-Q292 PolarHBondContact O-N 3.48Å; M288-Q292 PolarHBondContact O-NE2 3.21Å; A289-Q292 PolarHBondContact O-N 3.29Å; Q292-F294 PolarHBondContact O-N 3.14Å; Q292-L295 PolarHBondContact O-N 2.86Å; Q292-G296 PolarHBondContact O-N 2.84Å; Q292-G296 VanDerWaalsContact O-N 3.09Å; Q292-L297 HydrophobicContact CB-CB 4.27Å; Q292-L297 PolarHBondContact O-N 3.21Å; Q292-R298 PolarHBondContact OE1-O 3.22Å; Q292-R299 HydrophobicContact CB-CG 4.42Å; Q292-V301 PolarHBondContact NE2-O 3.34Å; Q292-V301 VanDerWaalsContact NE2-O 3.16Å
293	D	98.8	Very high	97.8	Very high	75 Å²	75	42.8 Å²	42.8	40%	0.401	22%	0.22	S	C	.	.	H	α-helix	trans	-59.3	-47.2	176.7	-61.3	-25.2	0	0	0	111.9	A289 L295 G296 R299	A289-D293 PolarHBondContact O-N 3.3Å; D293-L295 VanDerWaalsContact C-N 3.25Å; D293-L295 PolarHBondContact O-N 3.3Å; D293-G296 PolarHBondContact O-N 3.24Å; D293-R299 IonicContact OD1-CZ 3.67Å; D293-R299 IonicContact OD1-NE 3.87Å; D293-R299 PolarHBondContact OD1-NE 2.96Å; D293-R299 IonicContact OD1-NH2 3.17Å; D293-R299 PolarHBondContact OD1-NH2 3.16Å; D293-R299 IonicContact OD2-CZ 3.31Å; D293-R299 IonicContact OD2-NE 3.89Å; D293-R299 PolarHBondContact OD2-NE 3.37Å; D293-R299 IonicContact OD2-NH2 2.77Å; D293-R299 PolarHBondContact OD2-NH2 3.48Å
294	F	98.8	Very high	97.6	Very high	32 Å²	32	45.8 Å²	45.8	14%	0.14	23%	0.23	C	C	.	.	H	α-helix	trans	-59.7	-38	179	171.3	-104.4	0	0	0	112.1	K202 I204 E270 Q271 L273 R290 V291 Q292 G296	K202-F294 HydrophobicContact CB-CE1 3.8Å; K202-F294 HydrophobicContact CB-CZ 3.88Å; K202-F294 HydrophobicContact CD-CE1 4.19Å; K202-F294 HydrophobicContact CD-CZ 4.24Å; K202-F294 WeakPolarHBondContact CD-O 3.19Å; K202-F294 HydrophobicContact CG-CE1 4.38Å; K202-F294 HydrophobicContact CG-CZ 4.2Å; K202-F294 PolarHBondContact NZ-O 3.35Å; I204-F294 HydrophobicContact CD1-CD1 4.47Å; I204-F294 HydrophobicContact CD1-CE1 4.47Å; I204-F294 HydrophobicContact CG1-CD1 4.17Å; I204-F294 HydrophobicContact CG1-CE1 3.81Å; E270-F294 WeakPolarHBondContact O-CE2 3.45Å; Q271-F294 WeakPolarHBondContact O-CZ 3.42Å; L273-F294 HydrophobicContact CB-CB 4.42Å; L273-F294 HydrophobicContact CB-CD1 3.6Å; L273-F294 HydrophobicContact CB-CD2 3.82Å; L273-F294 HydrophobicContact CB-CE1 3.66Å; L273-F294 HydrophobicContact CB-CE2 3.87Å; L273-F294 HydrophobicContact CB-CG 3.67Å; L273-F294 HydrophobicContact CB-CZ 3.79Å; L273-F294 HydrophobicContact CD1-CB 4.36Å; L273-F294 HydrophobicContact CD1-CG 4.4Å; L273-F294 HydrophobicContact CD2-CB 3.76Å; L273-F294 HydrophobicContact CD2-CD1 3.82Å; L273-F294 HydrophobicContact CD2-CG 3.85Å; L273-F294 HydrophobicContact CG-CB 4.4Å; L273-F294 HydrophobicContact CG-CD1 4.3Å; L273-F294 HydrophobicContact CG-CG 4.17Å; R290-F294 WeakPolarHBondContact O-CB 3.39Å; R290-F294 PolarHBondContact O-N 3.26Å; V291-F294 PolarHBondContact O-N 3.38Å; Q292-F294 PolarHBondContact O-N 3.14Å; F294-G296 PolarHBondContact O-N 3.49Å
295	L	98.6	Very high	97.4	Very high	11 Å²	11	46.5 Å²	46.5	6%	0.058	23%	0.231	C	C	.	.	H	α-helix	trans	-77.1	-8.8	176.1	-67.8	176.5	0	0	0	113.2	A120 L137 I143 L176 M178 K202 I204 V291 Q292 D293 L297	A120-L295 HydrophobicContact CB-CD2 3.48Å; A120-L295 VanDerWaalsContact CB-CD2 3.48Å; L137-L295 HydrophobicContact CD2-CD1 3.98Å; I143-L295 HydrophobicContact CD1-CD1 4.28Å; L176-L295 HydrophobicContact CD1-CB 3.98Å; L176-L295 HydrophobicContact CD1-CD2 4.45Å; M178-L295 HydrophobicContact CE-CD1 4.2Å; M178-L295 HydrophobicContact SD-CD1 4.01Å; K202-L295 HydrophobicContact CD-CD2 4.44Å; I204-L295 HydrophobicContact CD1-CD1 4.41Å; I204-L295 HydrophobicContact CD1-CD2 4.22Å; I204-L295 HydrophobicContact CD1-CG 4.48Å; V291-L295 HydrophobicContact CG1-CD1 3.97Å; V291-L295 HydrophobicContact CG1-CG 4.42Å; V291-L295 WeakPolarHBondContact O-CB 3.37Å; V291-L295 VanDerWaalsContact O-CG 3.31Å; V291-L295 WeakPolarHBondContact O-CG 3.24Å; V291-L295 PolarHBondContact O-N 3.34Å; Q292-L295 PolarHBondContact O-N 2.86Å; D293-L295 VanDerWaalsContact C-N 3.25Å; D293-L295 PolarHBondContact O-N 3.3Å; L295-L297 VanDerWaalsContact C-N 3.33Å; L295-L297 HydrophobicContact CB-CD1 3.88Å; L295-L297 HydrophobicContact CB-CG 3.87Å; L295-L297 HydrophobicContact CD1-CD1 4.01Å
296	G	98.3	Very high	97.2	Very high	64 Å²	64	47.6 Å²	47.6	66%	0.66	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.4	23.8	-174.9	0	0	0	0	0	113.1	Q292 D293 F294	Q292-G296 PolarHBondContact O-N 2.84Å; Q292-G296 VanDerWaalsContact O-N 3.09Å; D293-G296 PolarHBondContact O-N 3.24Å; F294-G296 PolarHBondContact O-N 3.49Å
297	L	98.1	Very high	96.9	Very high	22 Å²	22	51.1 Å²	51.1	12%	0.115	25%	0.247	C	C	.	.			trans	-95.6	155.8	-179.4	-62.9	174.8	0	0	0	111.1	D142 I143 L176 Q292 L295	D142-L297 HydrophobicContact CB-CD2 4.02Å; I143-L297 HydrophobicContact CD1-CD1 3.53Å; I143-L297 HydrophobicContact CG1-CD1 3.68Å; L176-L297 HydrophobicContact CD1-CD1 4.14Å; L176-L297 HydrophobicContact CD1-CD2 3.88Å; L176-L297 HydrophobicContact CD1-CG 4.04Å; L176-L297 HydrophobicContact CG-CD2 4.33Å; Q292-L297 HydrophobicContact CB-CB 4.27Å; Q292-L297 PolarHBondContact O-N 3.21Å; L295-L297 VanDerWaalsContact C-N 3.33Å; L295-L297 HydrophobicContact CB-CD1 3.88Å; L295-L297 HydrophobicContact CB-CG 3.87Å; L295-L297 HydrophobicContact CD1-CD1 4.01Å
298	R	97.6	Very high	96.6	Very high	158 Å²	158	56.2 Å²	56.2	60%	0.596	27%	0.27	S	S	*	.			trans	-67	148.4	168.6	-64.3	-179.8	-61.7	110.5	5.9	109.7	H140 D142 Q292 V300	H140-R298 PolarHBondContact NE2-O 2.88Å; D142-R298 IonicContact OD2-NH2 2.87Å; Q292-R298 PolarHBondContact OE1-O 3.22Å; R298-V300 VanDerWaalsContact C-N 3.32Å; R298-V300 HydrophobicContact CB-CG2 4.25Å; R298-V300 PolarHBondContact O-N 2.93Å
299	R	97.4	Very high	96.2	Very high	150 Å²	150	58.3 Å²	58.3	57%	0.566	28%	0.281	S	S	*	.			trans	-78.6	78	177.2	-63.5	-173.6	-176.7	174.8	1.4	111.5	Q292 D293	Q292-R299 HydrophobicContact CB-CG 4.42Å; D293-R299 IonicContact OD1-CZ 3.67Å; D293-R299 IonicContact OD1-NE 3.87Å; D293-R299 PolarHBondContact OD1-NE 2.96Å; D293-R299 IonicContact OD1-NH2 3.17Å; D293-R299 PolarHBondContact OD1-NH2 3.16Å; D293-R299 IonicContact OD2-CZ 3.31Å; D293-R299 IonicContact OD2-NE 3.89Å; D293-R299 PolarHBondContact OD2-NE 3.37Å; D293-R299 IonicContact OD2-NH2 2.77Å; D293-R299 PolarHBondContact OD2-NH2 3.48Å
300	V	96.4	Very high	95.7	Very high	28 Å²	28	62.1 Å²	62.1	17%	0.17	30%	0.304	C	S	.	.			trans	-87.9	-41.5	179	177.6	0	0	0	0	111.7	H140 R298 T302 Y305	H140-V300 WeakPolarHBondContact NE2-CG2 3.39Å; R298-V300 VanDerWaalsContact C-N 3.32Å; R298-V300 HydrophobicContact CB-CG2 4.25Å; R298-V300 PolarHBondContact O-N 2.93Å; V300-T302 PolarHBondContact O-N 3.34Å; V300-Y305 VanDerWaalsContact O-CE2 3.27Å; V300-Y305 WeakPolarHBondContact O-CE2 3.23Å
301	V	96.1	Very high	95	Very high	2 Å²	2	65.3 Å²	65.3	1%	0.012	33%	0.331	C	S	.	.			trans	-81.5	102.7	-178.4	-173.7	0	0	0	0	108.9	L139 H140 M288 Q292 Y305 F306	L139-V301 HydrophobicContact CB-CG1 4.46Å; L139-V301 HydrophobicContact CB-CG2 3.88Å; L139-V301 HydrophobicContact CD1-CG1 4.15Å; H140-V301 HydrophobicContact CB-CG2 4.08Å; M288-V301 HydrophobicContact CB-CG1 4.46Å; M288-V301 HydrophobicContact CE-CB 4.09Å; M288-V301 HydrophobicContact CE-CG1 4.13Å; M288-V301 HydrophobicContact CE-CG2 4.32Å; M288-V301 HydrophobicContact CG-CG1 4.27Å; Q292-V301 PolarHBondContact NE2-O 3.34Å; Q292-V301 VanDerWaalsContact NE2-O 3.16Å; V301-Y305 HydrophobicContact CG1-CD2 4.32Å; V301-Y305 HydrophobicContact CG1-CG 4.35Å; V301-F306 HydrophobicContact CG1-CE2 3.91Å; V301-F306 HydrophobicContact CG1-CZ 3.79Å
302	T	96.1	Very high	94.4	Very high	40 Å²	40	68 Å²	68	25%	0.245	34%	0.343	C	S	.	.			trans	-120.3	-173	-178.1	72.9	0	0	0	0	111.9	V300 K304 Y305 F306	V300-T302 PolarHBondContact O-N 3.34Å; T302-K304 PolarHBondContact O-N 3.43Å; T302-K304 WeakPolarHBondContact OG1-CG 3.38Å; T302-Y305 PolarHBondContact O-N 2.92Å; T302-F306 WeakPolarHBondContact O-CD2 3.37Å; T302-F306 WeakPolarHBondContact O-CE2 3.41Å
303	E	94.6	Very high	93.9	Very high	132 Å²	132	69.5 Å²	69.5	62%	0.617	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-53.5	-31.8	-177.3	-53.9	74.2	-160.1	0	0	112.8	A285 Y305 F306	A285-E303 HydrophobicContact CB-CB 4.28Å; A285-E303 HydrophobicContact CB-CG 3.72Å; E303-Y305 PolarHBondContact O-N 3.21Å; E303-Y305 VanDerWaalsContact O-N 3.1Å; E303-F306 PolarHBondContact O-N 2.95Å
304	K	93.3	Very high	93.5	Very high	119 Å²	119	69 Å²	69	52%	0.517	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-60	-22.4	179.6	73.4	-171.1	178.2	179.9	0	113.9	T302 F306 P320	T302-K304 PolarHBondContact O-N 3.43Å; T302-K304 WeakPolarHBondContact OG1-CG 3.38Å; K304-F306 VanDerWaalsContact C-N 3.32Å; K304-P320 HydrophobicContact CD-CG 4.45Å; K304-P320 HydrophobicContact CG-CG 4.42Å
305	Y	93.6	Very high	93.2	Very high	30 Å²	30	68 Å²	68	12%	0.118	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-85.8	-4.9	179	-73.2	-87.9	0	0	0	113.7	L139 V300 V301 T302 E303 L317 K318 P320	L139-Y305 HydrophobicContact CB-CD1 4.3Å; L139-Y305 HydrophobicContact CB-CE1 4.47Å; L139-Y305 HydrophobicContact CD1-CD1 3.78Å; L139-Y305 HydrophobicContact CD1-CG 4.07Å; L139-Y305 HydrophobicContact CD2-CD1 4.27Å; L139-Y305 HydrophobicContact CG-CD1 4.37Å; V300-Y305 VanDerWaalsContact O-CE2 3.27Å; V300-Y305 WeakPolarHBondContact O-CE2 3.23Å; V301-Y305 HydrophobicContact CG1-CD2 4.32Å; V301-Y305 HydrophobicContact CG1-CG 4.35Å; T302-Y305 PolarHBondContact O-N 2.92Å; E303-Y305 PolarHBondContact O-N 3.21Å; E303-Y305 VanDerWaalsContact O-N 3.1Å; Y305-L317 CarbonylContact O-C 3.45Å; Y305-L317 WeakPolarHBondContact O-CA 3.46Å; Y305-K318 CarbonylContact C-O 3.59Å; Y305-K318 VanDerWaalsContact CA-O 3.28Å; Y305-K318 WeakPolarHBondContact CA-O 3.32Å; Y305-K318 PolarHBondContact O-N 3.4Å; Y305-P320 HydrophobicContact CD1-CG 4.12Å; Y305-P320 VanDerWaalsContact CE1-CD 3.42Å; Y305-P320 HydrophobicContact CE1-CG 3.63Å; Y305-P320 HydrophobicContact CE2-CG 4.27Å
306	F	94.1	Very high	92.9	Very high	28 Å²	28	67.5 Å²	67.5	12%	0.123	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	142.1	-174	-58.8	-71.7	0	0	0	111.5	F136 P284 A285 M288 V301 T302 E303 K304 C316 L317	F136-F306 HydrophobicContact CB-CE1 4.24Å; F136-F306 HydrophobicContact CB-CZ 4.26Å; F136-F306 AromaticContact CD1-CE1 3.82Å; F136-F306 HydrophobicContact CD1-CE1 3.82Å; F136-F306 AromaticContact CD2-CE1 3.64Å; F136-F306 HydrophobicContact CD2-CE1 3.64Å; F136-F306 HydrophobicContact CD2-CZ 4.03Å; F136-F306 AromaticContact CE1-CE1 3.99Å; F136-F306 HydrophobicContact CE1-CE1 3.99Å; F136-F306 AromaticContact CE2-CE1 3.83Å; F136-F306 HydrophobicContact CE2-CE1 3.83Å; F136-F306 AromaticContact CG-CE1 3.63Å; F136-F306 HydrophobicContact CG-CE1 3.63Å; F136-F306 HydrophobicContact CG-CZ 4.08Å; F136-F306 HydrophobicContact CZ-CD1 4.41Å; F136-F306 AromaticContact CZ-CE1 3.99Å; F136-F306 HydrophobicContact CZ-CE1 3.99Å; P284-F306 HydrophobicContact CB-CD1 3.83Å; P284-F306 HydrophobicContact CB-CD2 4.17Å; P284-F306 HydrophobicContact CB-CE1 3.8Å; P284-F306 HydrophobicContact CB-CE2 4.14Å; P284-F306 HydrophobicContact CB-CG 4.02Å; P284-F306 HydrophobicContact CB-CZ 3.97Å; P284-F306 HydrophobicContact CG-CB 3.96Å; P284-F306 HydrophobicContact CG-CD1 3.78Å; P284-F306 HydrophobicContact CG-CD2 3.94Å; P284-F306 HydrophobicContact CG-CE1 4.27Å; P284-F306 HydrophobicContact CG-CE2 4.42Å; P284-F306 HydrophobicContact CG-CG 3.6Å; A285-F306 HydrophobicContact CB-CD2 4.13Å; A285-F306 HydrophobicContact CB-CE2 4.19Å; M288-F306 HydrophobicContact CG-CE2 4.41Å; M288-F306 HydrophobicContact CG-CZ 3.93Å; V301-F306 HydrophobicContact CG1-CE2 3.91Å; V301-F306 HydrophobicContact CG1-CZ 3.79Å; T302-F306 WeakPolarHBondContact O-CD2 3.37Å; T302-F306 WeakPolarHBondContact O-CE2 3.41Å; E303-F306 PolarHBondContact O-N 2.95Å; K304-F306 VanDerWaalsContact C-N 3.32Å; F306-C316 WeakPolarHBondContact CA-O 3.44Å; F306-L317 HydrophobicContact CD1-CD2 3.99Å; F306-L317 HydrophobicContact CE1-CD2 3.68Å
307	H	91.8	Very high	92.6	Very high	89 Å²	89	65.4 Å²	65.4	41%	0.412	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	123.5	172	172.3	68.2	0	0	0	108.8	N309 C316 K318	H307-N309 PolarHBondContact O-N 2.85Å; H307-C316 PolarHBondContact N-O 3.04Å; H307-C316 PolarHBondContact O-N 2.84Å; H307-K318 HydrophobicContact CB-CB 4.35Å
308	F	90.9	Very high	92.1	Very high	108 Å²	108	69.2 Å²	69.2	47%	0.474	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	124.8	178.2	-171.2	-100.7	0	0	0	110.8	P310	F308-P310 HydrophobicContact CE1-CB 4.35Å; F308-P310 WeakPolarHBondContact O-CD 3.4Å
309	N	90.3	Very high	91.2	Very high	43 Å²	43	68.9 Å²	68.9	23%	0.23	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	106.5	174	-178.3	-35.9	0	0	0	109.1	H307 T311 K312 G313 F314 C316	H307-N309 PolarHBondContact O-N 2.85Å; N309-T311 VanDerWaalsContact C-N 3.32Å; N309-T311 PolarHBondContact O-N 3.47Å; N309-T311 WeakPolarHBondContact OD1-CB 3.33Å; N309-T311 PolarHBondContact OD1-N 2.95Å; N309-T311 VanDerWaalsContact OD1-N 3.08Å; N309-K312 HydrophobicContact CB-CB 3.99Å; N309-K312 PolarHBondContact O-N 3.23Å; N309-K312 PolarHBondContact OD1-N 2.75Å; N309-G313 PolarHBondContact O-N 3.03Å; N309-F314 PolarHBondContact N-O 3.02Å; N309-F314 VanDerWaalsContact N-O 3.13Å; N309-C316 VanDerWaalsContact CB-SG 3.53Å
310	P	87.8	Confident	89.8	Confident	101 Å²	101	65.1 Å²	65.1	66%	0.656	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-34	-175.9	26	-34.1	0	0	0	112.8	F308 K312 G313	F308-P310 HydrophobicContact CE1-CB 4.35Å; F308-P310 WeakPolarHBondContact O-CD 3.4Å; P310-K312 VanDerWaalsContact C-N 3.33Å; P310-K312 PolarHBondContact O-N 3.37Å; P310-G313 PolarHBondContact O-N 3.35Å
311	T	85.8	Confident	88.7	Confident	138 Å²	138	70.1 Å²	70.1	85%	0.847	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-38.3	176.6	-50.5	0	0	0	0	111.7	N309	N309-T311 VanDerWaalsContact C-N 3.32Å; N309-T311 PolarHBondContact O-N 3.47Å; N309-T311 WeakPolarHBondContact OD1-CB 3.33Å; N309-T311 PolarHBondContact OD1-N 2.95Å; N309-T311 VanDerWaalsContact OD1-N 3.08Å
312	K	85.9	Confident	86.7	Confident	56 Å²	56	76.5 Å²	76.5	24%	0.243	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-31.9	176.3	-165.8	179.8	169.4	73.7	0	111.6	N309 P310 F314 C328 L329 G330 K333	N309-K312 HydrophobicContact CB-CB 3.99Å; N309-K312 PolarHBondContact O-N 3.23Å; N309-K312 PolarHBondContact OD1-N 2.75Å; P310-K312 VanDerWaalsContact C-N 3.33Å; P310-K312 PolarHBondContact O-N 3.37Å; K312-F314 VanDerWaalsContact C-N 3.33Å; K312-F314 HydrophobicContact CD-CB 4.35Å; K312-F314 HydrophobicContact CG-CB 4.34Å; K312-F314 HydrophobicContact CG-CD2 4.19Å; K312-F314 VanDerWaalsContact O-CD2 3.24Å; K312-F314 WeakPolarHBondContact O-CD2 3.5Å; K312-C328 HydrophobicContact CD-CB 3.94Å; K312-L329 WeakPolarHBondContact CE-O 3.21Å; K312-L329 PolarHBondContact NZ-O 3.32Å; K312-G330 PolarHBondContact NZ-O 2.91Å; K312-K333 PolarHBondContact NZ-O 3.41Å
313	G	87.2	Confident	85.1	Confident	33 Å²	33	81.9 Å²	81.9	34%	0.34	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	17.8	-172.3	0	0	0	0	0	114	N309 P310	N309-G313 PolarHBondContact O-N 3.03Å; P310-G313 PolarHBondContact O-N 3.35Å
314	F	91.9	Very high	84.1	Confident	66 Å²	66	77.1 Å²	77.1	29%	0.289	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	152.4	-176.7	-71	-87.3	0	0	0	111.4	I281 N309 K312	I281-F314 HydrophobicContact CD1-CD1 4.18Å; I281-F314 HydrophobicContact CD1-CE1 3.68Å; I281-F314 HydrophobicContact CG1-CD1 4Å; I281-F314 HydrophobicContact CG1-CE1 4.02Å; I281-F314 HydrophobicContact CG2-CD1 4.14Å; I281-F314 HydrophobicContact CG2-CE1 4.49Å; N309-F314 PolarHBondContact N-O 3.02Å; N309-F314 VanDerWaalsContact N-O 3.13Å; K312-F314 VanDerWaalsContact C-N 3.33Å; K312-F314 HydrophobicContact CD-CB 4.35Å; K312-F314 HydrophobicContact CG-CB 4.34Å; K312-F314 HydrophobicContact CG-CD2 4.19Å; K312-F314 VanDerWaalsContact O-CD2 3.24Å; K312-F314 WeakPolarHBondContact O-CD2 3.5Å
315	P	91.4	Very high	83.4	Confident	10 Å²	10	80.6 Å²	80.6	7%	0.065	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	141.7	170.3	28.4	-34	0	0	0	111.2	F136 I281 P284	F136-P315 HydrophobicContact CZ-CG 4.24Å; I281-P315 WeakPolarHBondContact O-CD 3.35Å; P284-P315 HydrophobicContact CG-CB 4.03Å; P284-P315 HydrophobicContact CG-CG 4.27Å
316	C	92.7	Very high	83	Confident	1 Å²	1	82.3 Å²	82.3	1%	0.007	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	157.1	173.5	-56.5	0	0	0	0	109.7	F306 H307 N309 H327 C328	F306-C316 WeakPolarHBondContact CA-O 3.44Å; H307-C316 PolarHBondContact N-O 3.04Å; H307-C316 PolarHBondContact O-N 2.84Å; N309-C316 VanDerWaalsContact CB-SG 3.53Å; C316-H327 WeakPolarHBondContact CB-O 3.24Å; C316-C328 HydrophobicContact CB-CB 3.93Å; C316-C328 WeakPolarHBondContact CB-SG 3.43Å; C316-C328 VanDerWaalsContact SG-CA 3.52Å; C316-C328 WeakPolarHBondContact SG-CB 3.09Å; C316-C328 CovalentContact SG-SG 2.03Å; C316-C328 PolarHBondContact SG-SG 2.93Å
317	L	92	Very high	82.7	Confident	20 Å²	20	84.3 Å²	84.3	11%	0.105	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	135.7	178.4	-62.9	-179	0	0	0	110.7	E135 F136 L139 Y305 F306 P326 H327	E135-L317 HydrophobicContact CB-CD1 4.15Å; F136-L317 HydrophobicContact CD1-CD1 4.25Å; F136-L317 HydrophobicContact CD1-CD2 3.26Å; F136-L317 HydrophobicContact CD1-CG 4.02Å; F136-L317 HydrophobicContact CE1-CD2 3.53Å; F136-L317 HydrophobicContact CE1-CG 4.09Å; F136-L317 HydrophobicContact CG-CD2 4.2Å; L139-L317 HydrophobicContact CD1-CD1 4.26Å; L139-L317 HydrophobicContact CD1-CD2 3.51Å; L139-L317 HydrophobicContact CD1-CG 4.35Å; L139-L317 HydrophobicContact CD2-CD1 4.35Å; L139-L317 HydrophobicContact CG-CD1 4.35Å; L139-L317 HydrophobicContact CG-CD2 4.45Å; Y305-L317 CarbonylContact O-C 3.45Å; Y305-L317 WeakPolarHBondContact O-CA 3.46Å; F306-L317 HydrophobicContact CD1-CD2 3.99Å; F306-L317 HydrophobicContact CE1-CD2 3.68Å; L317-P326 CarbonylContact O-C 3.43Å; L317-P326 WeakPolarHBondContact O-CA 3.11Å; L317-H327 PolarHBondContact N-O 3.11Å; L317-H327 PolarHBondContact O-N 2.96Å
318	K	86.9	Confident	82.6	Confident	101 Å²	101	81.7 Å²	81.7	44%	0.439	43%	0.432	S	S	.	.			trans	-124.1	118.4	173.2	-176.1	179.8	178	-176.5	0	107.6	Y305 H307	Y305-K318 CarbonylContact C-O 3.59Å; Y305-K318 VanDerWaalsContact CA-O 3.28Å; Y305-K318 WeakPolarHBondContact CA-O 3.32Å; Y305-K318 PolarHBondContact O-N 3.4Å; H307-K318 HydrophobicContact CB-CB 4.35Å
319	R	78.9	Confident	82.6	Confident	151 Å²	151	78 Å²	78	57%	0.57	42%	0.417	S	S	*	.			trans	-74.7	140.8	171.5	-66.7	-171.7	-179.3	-172.4	1.9	108.9	E321 A324	R319-E321 PolarHBondContact O-N 3.03Å; R319-E321 VanDerWaalsContact O-N 3.14Å; R319-A324 HydrophobicContact CB-CB 3.76Å
320	P	67.6	Low	82.5	Confident	72 Å²	72	77.4 Å²	77.4	47%	0.468	42%	0.421	S	S	.	.	S	Bend	trans	-66.4	-9.3	180	-20.3	31.8	0	0	0	114.6	K304 Y305	K304-P320 HydrophobicContact CD-CG 4.45Å; K304-P320 HydrophobicContact CG-CG 4.42Å; Y305-P320 HydrophobicContact CD1-CG 4.12Å; Y305-P320 VanDerWaalsContact CE1-CD 3.42Å; Y305-P320 HydrophobicContact CE1-CG 3.63Å; Y305-P320 HydrophobicContact CE2-CG 4.27Å
321	E	73.9	Confident	82.5	Confident	133 Å²	133	82.3 Å²	82.3	62%	0.621	43%	0.432	S	S	*	.	S	Bend	trans	-63.3	138.5	178	-70	162.6	-151.3	0	0	111.9	R319 N323 A324	R319-E321 PolarHBondContact O-N 3.03Å; R319-E321 VanDerWaalsContact O-N 3.14Å; E321-N323 PolarHBondContact O-N 2.85Å; E321-A324 HydrophobicContact CB-CB 4.39Å; E321-A324 PolarHBondContact O-N 3.5Å; E321-A324 VanDerWaalsContact O-N 3.16Å
322	V	53.4	Low	82.6	Confident	135 Å²	135	77.9 Å²	77.9	82%	0.818	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	108.8	-178.3	-172.1	0	0	0	0	108.1
323	N	63.9	Low	82.9	Confident	154 Å²	154	77.7 Å²	77.7	82%	0.824	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	8.2	-179.4	-49.1	-35.6	0	0	0	118	E321 K325	E321-N323 PolarHBondContact O-N 2.85Å; N323-K325 PolarHBondContact O-N 2.78Å
324	A	72.4	Confident	83	Confident	31 Å²	31	78.1 Å²	78.1	26%	0.256	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-68.3	118.4	172.1	0	0	0	0	0	111.2	R319 E321	R319-A324 HydrophobicContact CB-CB 3.76Å; E321-A324 HydrophobicContact CB-CB 4.39Å; E321-A324 PolarHBondContact O-N 3.5Å; E321-A324 VanDerWaalsContact O-N 3.16Å
325	K	79.1	Confident	83	Confident	193 Å²	193	77.9 Å²	77.9	84%	0.839	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-63	135.8	174.2	-72.5	-177.7	-179.8	176.3	0	109.9	N323 H327	N323-K325 PolarHBondContact O-N 2.78Å; K325-H327 PolarHBondContact O-N 3.3Å
326	P	84.4	Confident	83.1	Confident	65 Å²	65	83.7 Å²	83.7	42%	0.422	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-58.2	134	174	-23.6	33.2	0	0	0	111.2	L317	L317-P326 CarbonylContact O-C 3.43Å; L317-P326 WeakPolarHBondContact O-CA 3.11Å
327	H	87.6	Confident	83.3	Confident	70 Å²	70	86.6 Å²	86.6	32%	0.324	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-102.2	115.8	175.2	178.9	74.3	0	0	0	110.3	W90 C316 L317 K325	W90-H327 AromaticContact CH2-CD2 3.55Å; W90-H327 AromaticContact CH2-CE1 3Å; W90-H327 WeakPolarHBondContact CH2-CE1 3.37Å; W90-H327 AromaticContact CH2-CG 3.7Å; W90-H327 AromaticContact CH2-ND1 3.36Å; W90-H327 WeakPolarHBondContact CH2-ND1 3.29Å; W90-H327 AromaticContact CH2-NE2 3.13Å; W90-H327 WeakPolarHBondContact CH2-NE2 3.21Å; W90-H327 AromaticContact CZ2-CE1 3.62Å; W90-H327 AromaticContact CZ2-NE2 3.47Å; W90-H327 WeakPolarHBondContact CZ2-NE2 3.38Å; W90-H327 AromaticContact CZ3-CE1 3.77Å; W90-H327 AromaticContact CZ3-ND1 3.82Å; C316-H327 WeakPolarHBondContact CB-O 3.24Å; L317-H327 PolarHBondContact N-O 3.11Å; L317-H327 PolarHBondContact O-N 2.96Å; K325-H327 PolarHBondContact O-N 3.3Å
328	C	91.4	Very high	83.5	Confident	35 Å²	35	86.9 Å²	86.9	24%	0.236	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-97.9	144.7	173.6	-62.3	0	0	0	0	110.5	K312 C316	K312-C328 HydrophobicContact CD-CB 3.94Å; C316-C328 HydrophobicContact CB-CB 3.93Å; C316-C328 WeakPolarHBondContact CB-SG 3.43Å; C316-C328 VanDerWaalsContact SG-CA 3.52Å; C316-C328 WeakPolarHBondContact SG-CB 3.09Å; C316-C328 CovalentContact SG-SG 2.03Å; C316-C328 PolarHBondContact SG-SG 2.93Å
329	L	90.3	Very high	83.9	Confident	31 Å²	31	89.6 Å²	89.6	16%	0.162	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-53.8	145.6	171.1	-64.8	175	0	0	0	111.3	R131 A132 E135 K312 K333	R131-L329 HydrophobicContact CG-CD2 4.25Å; A132-L329 HydrophobicContact CB-CD1 3.73Å; E135-L329 HydrophobicContact CB-CD2 4.46Å; E135-L329 HydrophobicContact CG-CD2 3.87Å; K312-L329 WeakPolarHBondContact CE-O 3.21Å; K312-L329 PolarHBondContact NZ-O 3.32Å; L329-K333 HydrophobicContact CB-CB 3.83Å; L329-K333 HydrophobicContact CB-CG 4.02Å; L329-K333 HydrophobicContact CD1-CB 4.2Å; L329-K333 HydrophobicContact CD1-CG 4.42Å
330	G	87.7	Confident	84.8	Confident	30 Å²	30	83 Å²	83	31%	0.309	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-59.1	173.7	-176.3	0	0	0	0	0	115.3	K312 T332 K333	K312-G330 PolarHBondContact NZ-O 2.91Å; G330-T332 PolarHBondContact O-N 3.19Å; G330-T332 VanDerWaalsContact O-N 3.11Å; G330-K333 PolarHBondContact O-N 2.67Å
331	K	88.1	Confident	86.2	Confident	204 Å²	204	83 Å²	83	89%	0.887	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.3	-175.9	-61.8	-179.5	-177.4	177.3	0	113.4	K333	K331-K333 PolarHBondContact O-N 2.94Å
332	T	86.9	Confident	87.3	Confident	45 Å²	45	81.4 Å²	81.4	28%	0.276	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-5.2	177.1	65.2	0	0	0	0	113.4	G330 R335	G330-T332 PolarHBondContact O-N 3.19Å; G330-T332 VanDerWaalsContact O-N 3.11Å; T332-R335 VanDerWaalsContact CB-NH2 3.34Å; T332-R335 PolarHBondContact O-NH1 3.2Å
333	K	92.4	Very high	89.3	Confident	52 Å²	52	82.1 Å²	82.1	23%	0.226	44%	0.444	C	S	.	.	S	Bend	trans	-116.1	123.4	178.1	-46.9	-58.8	168.4	-171.7	0	109.3	R131 K312 L329 G330 K331	R131-K333 HydrophobicContact CG-CD 4.49Å; K312-K333 PolarHBondContact NZ-O 3.41Å; L329-K333 HydrophobicContact CB-CB 3.83Å; L329-K333 HydrophobicContact CB-CG 4.02Å; L329-K333 HydrophobicContact CD1-CB 4.2Å; L329-K333 HydrophobicContact CD1-CG 4.42Å; G330-K333 PolarHBondContact O-N 2.67Å; K331-K333 PolarHBondContact O-N 2.94Å
334	G	89.8	Confident	90.9	Very high	42 Å²	42	75.3 Å²	75.3	43%	0.433	41%	0.409	S	S	.	.	S	Bend	trans	83.7	40.6	-172	0	0	0	0	0	114.1
335	R	92.6	Very high	92.1	Very high	60 Å²	60	75.3 Å²	75.3	23%	0.226	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-63.5	141.7	175.9	-67.5	-174.5	-176.2	74.4	1.1	110.4	T219 S223 T332 H337	T219-R335 HydrophobicContact CG2-CB 3.95Å; S223-R335 PolarHBondContact OG-NE 3.38Å; T332-R335 VanDerWaalsContact CB-NH2 3.34Å; T332-R335 PolarHBondContact O-NH1 3.2Å; R335-H337 PolarHBondContact O-CD2 3.5Å; R335-H337 VanDerWaalsContact O-CD2 3.23Å; R335-H337 PolarHBondContact O-N 3.17Å
336	T	94.1	Very high	93	Very high	133 Å²	133	70.5 Å²	70.5	82%	0.816	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-60.6	126.9	168.6	-49.9	0	0	0	0	109.8	T219	T219-T336 WeakPolarHBondContact CG2-O 3.37Å
337	H	96.1	Very high	93.6	Very high	61 Å²	61	69.7 Å²	69.7	28%	0.282	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-81.6	147.7	177.4	-67.5	-178.3	0	0	0	110.3	R208 I215 S216 R335	R208-H337 PolarHBondContact NH2-CE1 2.95Å; I215-H337 HydrophobicContact CG2-CB 3.79Å; S216-H337 WeakPolarHBondContact CB-NE2 3.49Å; S216-H337 PolarHBondContact OG-NE2 3Å; R335-H337 PolarHBondContact O-CD2 3.5Å; R335-H337 VanDerWaalsContact O-CD2 3.23Å; R335-H337 PolarHBondContact O-N 3.17Å
338	P	95.3	Very high	94.1	Very high	26 Å²	26	66.3 Å²	66.3	17%	0.169	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-59	153.3	166.5	22.1	-27.9	0	0	0	111.2	Y218 T219 I340	Y218-P338 HydrophobicContact CD1-CG 4.16Å; Y218-P338 HydrophobicContact CE1-CG 4.06Å; T219-P338 WeakPolarHBondContact OG1-CD 3.5Å; P338-I340 HydrophobicContact CB-CD1 4.07Å; P338-I340 HydrophobicContact CG-CD1 3.74Å; P338-I340 PolarHBondContact O-N 3.07Å
339	N	96.6	Very high	94.4	Very high	159 Å²	159	68.9 Å²	68.9	85%	0.85	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-68.1	127.2	162.5	-167.3	26.7	0	0	0	108.4
340	I	97.3	Very high	94.7	Very high	13 Å²	13	71.5 Å²	71.5	7%	0.067	38%	0.383	C	S	.	.			trans	-111.7	142.3	180	-57.1	-52.8	0	0	0	107.9	I215 F231 E232 P338 P342 V344 V345	I215-I340 HydrophobicContact CD1-CG1 3.93Å; I215-I340 HydrophobicContact CG1-CG1 4.09Å; I215-I340 HydrophobicContact CG2-CG1 4.24Å; F231-I340 HydrophobicContact CB-CD1 3.56Å; F231-I340 HydrophobicContact CD1-CD1 3.89Å; F231-I340 HydrophobicContact CD1-CG1 4.16Å; F231-I340 HydrophobicContact CD1-CG2 3.64Å; F231-I340 HydrophobicContact CE1-CG2 4.01Å; F231-I340 HydrophobicContact CG-CD1 3.76Å; F231-I340 HydrophobicContact CG-CG1 4.4Å; E232-I340 WeakPolarHBondContact OE1-CA 3.47Å; P338-I340 HydrophobicContact CB-CD1 4.07Å; P338-I340 HydrophobicContact CG-CD1 3.74Å; P338-I340 PolarHBondContact O-N 3.07Å; I340-P342 WeakPolarHBondContact O-CD 3.31Å; I340-V344 HydrophobicContact CG2-CB 4.35Å; I340-V344 HydrophobicContact CG2-CG1 4.35Å; I340-V345 HydrophobicContact CB-CG2 3.97Å; I340-V345 HydrophobicContact CG2-CG2 3.78Å
341	D	97.1	Very high	95.2	Very high	72 Å²	72	72 Å²	72	39%	0.385	38%	0.376	S	S	.	.			trans	-50.5	122.7	174.6	-173.7	-35.2	0	0	0	111	E232 Q343 V344 V345	E232-D341 HydrophobicContact CG-CB 4.15Å; E232-D341 PolarHBondContact OE1-N 3.1Å; D341-Q343 PolarHBondContact O-N 3.03Å; D341-Q343 WeakPolarHBondContact OD1-CB 3.21Å; D341-Q343 PolarHBondContact OD1-N 3.24Å; D341-V344 HydrophobicContact CB-CB 4.21Å; D341-V344 HydrophobicContact CB-CG2 3.86Å; D341-V344 WeakPolarHBondContact O-CB 3.32Å; D341-V344 PolarHBondContact O-N 2.8Å; D341-V345 PolarHBondContact O-N 2.89Å
342	P	97.5	Very high	95.8	Very high	99 Å²	99	62.3 Å²	62.3	64%	0.643	33%	0.334	S	S	*	.	H	α-helix	trans	-54.8	-32.9	179.2	-27.3	35.4	0	0	0	114.5	I340 V345 Q346	I340-P342 WeakPolarHBondContact O-CD 3.31Å; P342-V345 PolarHBondContact O-N 3Å; P342-Q346 WeakPolarHBondContact O-CB 3.41Å; P342-Q346 PolarHBondContact O-N 3.13Å
343	Q	95.9	Very high	96.3	Very high	149 Å²	149	63.2 Å²	63.2	70%	0.696	33%	0.334	S	S	*	.	H	α-helix	trans	-68.1	-37.5	176.9	-63.6	-173.1	2.3	0	0	111.4	D341 Q346 T347	D341-Q343 PolarHBondContact O-N 3.03Å; D341-Q343 WeakPolarHBondContact OD1-CB 3.21Å; D341-Q343 PolarHBondContact OD1-N 3.24Å; Q343-Q346 PolarHBondContact O-N 2.77Å; Q343-T347 WeakPolarHBondContact O-CB 3.48Å; Q343-T347 PolarHBondContact O-N 3.08Å; Q343-T347 PolarHBondContact O-OG1 3.07Å
344	V	96.4	Very high	96.6	Very high	12 Å²	12	64.4 Å²	64.4	7%	0.073	35%	0.348	C	S	.	.	H	α-helix	trans	-68.4	-41	175.9	177.4	0	0	0	0	110.6	F231 E232 T235 F236 I340 D341 T347 L348	F231-V344 HydrophobicContact CD1-CG1 4.42Å; F231-V344 HydrophobicContact CE1-CG1 4.29Å; E232-V344 HydrophobicContact CB-CG2 4.33Å; E232-V344 HydrophobicContact CG-CB 4.34Å; E232-V344 HydrophobicContact CG-CG1 4.39Å; E232-V344 HydrophobicContact CG-CG2 3.85Å; T235-V344 HydrophobicContact CG2-CG1 4.01Å; F236-V344 HydrophobicContact CE2-CB 4.23Å; F236-V344 HydrophobicContact CE2-CG1 3.74Å; F236-V344 HydrophobicContact CE2-CG2 3.67Å; F236-V344 HydrophobicContact CZ-CB 4.45Å; F236-V344 HydrophobicContact CZ-CG1 4.1Å; F236-V344 HydrophobicContact CZ-CG2 4.13Å; I340-V344 HydrophobicContact CG2-CB 4.35Å; I340-V344 HydrophobicContact CG2-CG1 4.35Å; D341-V344 HydrophobicContact CB-CB 4.21Å; D341-V344 HydrophobicContact CB-CG2 3.86Å; D341-V344 WeakPolarHBondContact O-CB 3.32Å; D341-V344 PolarHBondContact O-N 2.8Å; V344-T347 PolarHBondContact O-N 3.24Å; V344-L348 HydrophobicContact CG1-CD1 4.49Å; V344-L348 PolarHBondContact O-N 3.21Å
345	V	97.6	Very high	97	Very high	31 Å²	31	64.4 Å²	64.4	19%	0.188	34%	0.336	C	S	.	.	H	α-helix	trans	-58.5	-48	172.5	172.3	0	0	0	0	110.8	V211 I340 D341 P342 L348 R349	V211-V345 HydrophobicContact CG1-CG1 4.22Å; I340-V345 HydrophobicContact CB-CG2 3.97Å; I340-V345 HydrophobicContact CG2-CG2 3.78Å; D341-V345 PolarHBondContact O-N 2.89Å; P342-V345 PolarHBondContact O-N 3Å; V345-L348 PolarHBondContact O-N 3.48Å; V345-R349 WeakPolarHBondContact O-CG 3.34Å; V345-R349 PolarHBondContact O-N 3.18Å
346	Q	97.1	Very high	97.3	Very high	92 Å²	92	61.7 Å²	61.7	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-63.2	-45	179.8	-174.1	55.2	45.6	0	0	111.5	P342 Q343 L348 R349 D350	P342-Q346 WeakPolarHBondContact O-CB 3.41Å; P342-Q346 PolarHBondContact O-N 3.13Å; Q343-Q346 PolarHBondContact O-N 2.77Å; Q346-L348 VanDerWaalsContact C-N 3.31Å; Q346-L348 PolarHBondContact O-N 3.22Å; Q346-R349 WeakPolarHBondContact O-CB 3.47Å; Q346-R349 PolarHBondContact O-N 2.91Å; Q346-D350 PolarHBondContact NE2-OD1 2.8Å; Q346-D350 VanDerWaalsContact NE2-OD1 3.07Å; Q346-D350 PolarHBondContact NE2-OD2 3.39Å; Q346-D350 VanDerWaalsContact NE2-OD2 3.09Å; Q346-D350 PolarHBondContact O-N 3.26Å
347	T	97.1	Very high	97.5	Very high	47 Å²	47	62.6 Å²	62.6	29%	0.288	31%	0.314	S	S	.	.	H	α-helix	trans	-59.3	-41.5	177	-54	0	0	0	0	111.8	F236 I244 Q343 V344 D350 F351	F236-T347 HydrophobicContact CE1-CG2 3.83Å; F236-T347 HydrophobicContact CZ-CG2 4.16Å; I244-T347 HydrophobicContact CD1-CG2 4.01Å; I244-T347 HydrophobicContact CG1-CG2 4.43Å; Q343-T347 WeakPolarHBondContact O-CB 3.48Å; Q343-T347 PolarHBondContact O-N 3.08Å; Q343-T347 PolarHBondContact O-OG1 3.07Å; V344-T347 PolarHBondContact O-N 3.24Å; T347-D350 PolarHBondContact O-N 3.5Å; T347-F351 WeakPolarHBondContact O-CB 3.22Å; T347-F351 PolarHBondContact O-N 2.81Å
348	L	98.1	Very high	97.7	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.8	-38.5	174.4	-81.2	171.6	0	0	0	112.7	V211 F231 T235 I244 V251 V344 V345 Q346 F351 Y352	V211-L348 HydrophobicContact CG1-CB 4.31Å; V211-L348 HydrophobicContact CG1-CD1 4.46Å; V211-L348 HydrophobicContact CG2-CB 3.99Å; F231-L348 HydrophobicContact CE1-CD1 3.53Å; F231-L348 HydrophobicContact CZ-CD1 3.61Å; T235-L348 HydrophobicContact CG2-CD1 3.92Å; T235-L348 HydrophobicContact CG2-CD2 3.85Å; T235-L348 HydrophobicContact CG2-CG 3.83Å; I244-L348 HydrophobicContact CD1-CD2 3.93Å; I244-L348 HydrophobicContact CD1-CG 4.49Å; I244-L348 HydrophobicContact CG1-CD2 4.35Å; I244-L348 HydrophobicContact CG2-CD2 4.41Å; V251-L348 HydrophobicContact CG2-CD2 4.19Å; V344-L348 HydrophobicContact CG1-CD1 4.49Å; V344-L348 PolarHBondContact O-N 3.21Å; V345-L348 PolarHBondContact O-N 3.48Å; Q346-L348 VanDerWaalsContact C-N 3.31Å; Q346-L348 PolarHBondContact O-N 3.22Å; L348-F351 PolarHBondContact O-N 2.03Å; L348-Y352 HydrophobicContact CB-CE2 4.48Å; L348-Y352 HydrophobicContact CD2-CE2 4.06Å; L348-Y352 WeakPolarHBondContact O-CD2 3.2Å; L348-Y352 PolarHBondContact O-N 3.46Å
349	R	98.3	Very high	97.8	Very high	89 Å²	89	62.7 Å²	62.7	34%	0.336	31%	0.311	S	S	.	.	H	α-helix	trans	-59.5	-49.6	174.2	-73	177.8	-179.5	-84	2.5	110.6	V211 V345 Q346 F351 Y352 K353 W369	V211-R349 HydrophobicContact CG2-CG 3.83Å; V345-R349 WeakPolarHBondContact O-CG 3.34Å; V345-R349 PolarHBondContact O-N 3.18Å; Q346-R349 WeakPolarHBondContact O-CB 3.47Å; Q346-R349 PolarHBondContact O-N 2.91Å; R349-F351 VanDerWaalsContact C-N 3.29Å; R349-F351 PolarHBondContact O-N 2.94Å; R349-Y352 PolarHBondContact O-N 3.05Å; R349-K353 WeakPolarHBondContact O-CB 3.32Å; R349-K353 PolarHBondContact O-N 2.9Å; R349-W369 PolarHBondContact NH1-O 3.31Å
350	D	98	Very high	98	Very high	85 Å²	85	56 Å²	56	46%	0.455	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-38	-180	-66.8	-32.8	0	0	0	111.8	Q346 T347 P354	Q346-D350 PolarHBondContact NE2-OD1 2.8Å; Q346-D350 VanDerWaalsContact NE2-OD1 3.07Å; Q346-D350 PolarHBondContact NE2-OD2 3.39Å; Q346-D350 VanDerWaalsContact NE2-OD2 3.09Å; Q346-D350 PolarHBondContact O-N 3.26Å; T347-D350 PolarHBondContact O-N 3.5Å; D350-P354 WeakPolarHBondContact O-CD 3.48Å
351	F	98.2	Very high	98	Very high	41 Å²	41	64.2 Å²	64.2	18%	0.18	31%	0.309	C	S	.	.	H	α-helix	trans	-62.7	-44.7	172.8	169	-96	0	0	0	113.6	I244 T246 V251 M255 T347 L348 R349 P354 F355	I244-F351 HydrophobicContact CB-CD2 4.3Å; I244-F351 HydrophobicContact CD1-CB 3.23Å; I244-F351 HydrophobicContact CD1-CD1 4.12Å; I244-F351 HydrophobicContact CD1-CD2 3.84Å; I244-F351 HydrophobicContact CD1-CG 3.46Å; I244-F351 VanDerWaalsContact CD1-CG 3.46Å; I244-F351 HydrophobicContact CG2-CD1 4.45Å; I244-F351 HydrophobicContact CG2-CD2 4.36Å; I244-F351 HydrophobicContact CG2-CE1 4.41Å; I244-F351 HydrophobicContact CG2-CE2 4.31Å; I244-F351 HydrophobicContact CG2-CG 4.45Å; I244-F351 HydrophobicContact CG2-CZ 4.35Å; T246-F351 HydrophobicContact CG2-CE2 3.67Å; T246-F351 HydrophobicContact CG2-CZ 3.56Å; V251-F351 HydrophobicContact CG1-CD1 4.5Å; V251-F351 HydrophobicContact CG1-CE1 3.66Å; V251-F351 HydrophobicContact CG1-CZ 4.03Å; M255-F351 HydrophobicContact CG-CE1 4.41Å; M255-F351 HydrophobicContact CG-CZ 4.47Å; M255-F351 HydrophobicContact SD-CZ 4.12Å; T347-F351 WeakPolarHBondContact O-CB 3.22Å; T347-F351 PolarHBondContact O-N 2.81Å; L348-F351 PolarHBondContact O-N 2.03Å; R349-F351 VanDerWaalsContact C-N 3.29Å; R349-F351 PolarHBondContact O-N 2.94Å; F351-P354 WeakPolarHBondContact O-CD 3.27Å; F351-P354 WeakPolarHBondContact O-CG 3.48Å; F351-F355 HydrophobicContact CE1-CE2 4.27Å; F351-F355 HydrophobicContact CE2-CE2 4.1Å; F351-F355 AromaticContact CZ-CE2 3.9Å; F351-F355 HydrophobicContact CZ-CE2 3.9Å; F351-F355 WeakPolarHBondContact O-CD2 3.44Å
352	Y	98.7	Very high	98.1	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-77.1	-28.6	-178.3	-75.5	-60.5	0	0	0	113.8	P210 V211 V251 M255 L348 R349 F355 N356	P210-Y352 HydrophobicContact CB-CD1 3.85Å; P210-Y352 HydrophobicContact CB-CD2 3.82Å; P210-Y352 HydrophobicContact CB-CE1 3.9Å; P210-Y352 HydrophobicContact CB-CE2 3.86Å; P210-Y352 HydrophobicContact CB-CG 3.81Å; P210-Y352 HydrophobicContact CG-CD1 3.99Å; P210-Y352 HydrophobicContact CG-CD2 3.76Å; P210-Y352 HydrophobicContact CG-CE2 4.32Å; P210-Y352 HydrophobicContact CG-CG 3.57Å; V211-Y352 HydrophobicContact CG2-CD2 3.81Å; V211-Y352 HydrophobicContact CG2-CE2 4.22Å; V251-Y352 VanDerWaalsContact CA-OH 3.22Å; V251-Y352 WeakPolarHBondContact CA-OH 3.46Å; V251-Y352 PolarHBondContact O-OH 3.4Å; M255-Y352 HydrophobicContact CG-CE1 4.28Å; L348-Y352 HydrophobicContact CB-CE2 4.48Å; L348-Y352 HydrophobicContact CD2-CE2 4.06Å; L348-Y352 WeakPolarHBondContact O-CD2 3.2Å; L348-Y352 PolarHBondContact O-N 3.46Å; R349-Y352 PolarHBondContact O-N 3.05Å; Y352-F355 CarbonylContact O-C 3.55Å; Y352-F355 WeakPolarHBondContact O-CA 3.42Å; Y352-F355 WeakPolarHBondContact O-CB 3.48Å; Y352-F355 PolarHBondContact O-N 2.71Å; Y352-N356 PolarHBondContact O-N 3.18Å
353	K	98.6	Very high	98.1	Very high	64 Å²	64	59.5 Å²	59.5	28%	0.278	28%	0.279	S	S	.	.	H	α-helix	trans	-44.3	-49	-177.3	-171	167.5	-170.6	159.9	0	115.2	R349 F355 N356 R357 D370	R349-K353 WeakPolarHBondContact O-CB 3.32Å; R349-K353 PolarHBondContact O-N 2.9Å; K353-F355 VanDerWaalsContact C-N 3.33Å; K353-F355 PolarHBondContact O-N 2.95Å; K353-N356 PolarHBondContact O-N 3.43Å; K353-R357 VanDerWaalsContact CE-NH2 3.25Å; K353-R357 WeakPolarHBondContact O-CB 3.47Å; K353-R357 WeakPolarHBondContact O-CG 3.35Å; K353-R357 PolarHBondContact O-N 2.98Å; K353-D370 HydrophobicContact CG-CB 4.41Å
354	P	98.5	Very high	98.2	Very high	78 Å²	78	55.8 Å²	55.8	51%	0.506	28%	0.28	S	S	.	.	H	α-helix	trans	-63.6	-35.4	175.7	24.1	-34.8	0	0	0	113.3	D350 F351 K358	D350-P354 WeakPolarHBondContact O-CD 3.48Å; F351-P354 WeakPolarHBondContact O-CD 3.27Å; F351-P354 WeakPolarHBondContact O-CG 3.48Å; P354-K358 WeakPolarHBondContact O-CB 3.46Å; P354-K358 PolarHBondContact O-N 3.46Å
355	F	98.6	Very high	98.3	Very high	42 Å²	42	59 Å²	59	18%	0.184	30%	0.295	C	S	.	.	H	α-helix	trans	-72.5	-39	176.6	-59.5	-76	0	0	0	112.1	M255 R258 F351 Y352 K353 K358 F359	M255-F355 HydrophobicContact CB-CD1 4.44Å; M255-F355 HydrophobicContact CG-CD1 4.44Å; M255-F355 HydrophobicContact CG-CD2 4.29Å; M255-F355 HydrophobicContact CG-CE1 4.47Å; M255-F355 HydrophobicContact CG-CE2 4.32Å; M255-F355 HydrophobicContact CG-CG 4.35Å; M255-F355 HydrophobicContact CG-CZ 4.41Å; M255-F355 HydrophobicContact SD-CE1 4.11Å; M255-F355 HydrophobicContact SD-CE2 4.19Å; M255-F355 HydrophobicContact SD-CZ 3.86Å; R258-F355 HydrophobicContact CG-CD1 4.39Å; R258-F355 HydrophobicContact CG-CE1 4.25Å; F351-F355 HydrophobicContact CE1-CE2 4.27Å; F351-F355 HydrophobicContact CE2-CE2 4.1Å; F351-F355 AromaticContact CZ-CE2 3.9Å; F351-F355 HydrophobicContact CZ-CE2 3.9Å; F351-F355 WeakPolarHBondContact O-CD2 3.44Å; Y352-F355 CarbonylContact O-C 3.55Å; Y352-F355 WeakPolarHBondContact O-CA 3.42Å; Y352-F355 WeakPolarHBondContact O-CB 3.48Å; Y352-F355 PolarHBondContact O-N 2.71Å; K353-F355 VanDerWaalsContact C-N 3.33Å; K353-F355 PolarHBondContact O-N 2.95Å; F355-K358 PolarHBondContact O-N 2.86Å; F355-F359 WeakPolarHBondContact O-CB 3.32Å; F355-F359 PolarHBondContact O-N 3.16Å
356	N	98.8	Very high	98.4	Very high	3 Å²	3	62.5 Å²	62.5	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-61.9	-52.8	176.2	-71.3	-10.2	0	0	0	110.7	P210 Y352 K353 K358 F359 Y360 W369 D370	P210-N356 WeakPolarHBondContact CG-OD1 3.28Å; Y352-N356 PolarHBondContact O-N 3.18Å; K353-N356 PolarHBondContact O-N 3.43Å; N356-K358 VanDerWaalsContact C-N 3.28Å; N356-K358 PolarHBondContact O-N 3.5Å; N356-F359 CarbonylContact O-C 3.58Å; N356-F359 WeakPolarHBondContact O-CA 3.27Å; N356-F359 WeakPolarHBondContact O-CB 3.46Å; N356-F359 PolarHBondContact O-N 3.4Å; N356-Y360 HydrophobicContact CB-CE1 4.38Å; N356-Y360 HydrophobicContact CB-CE2 4.18Å; N356-Y360 VanDerWaalsContact O-CD1 3.26Å; N356-Y360 WeakPolarHBondContact O-CD1 3.42Å; N356-Y360 PolarHBondContact O-N 2.92Å; N356-W369 HydrophobicContact CB-CE3 4.44Å; N356-D370 WeakPolarHBondContact CB-OD2 3.36Å; N356-D370 PolarHBondContact ND2-OD1 3.15Å
357	R	98.7	Very high	98.4	Very high	152 Å²	152	59 Å²	59	57%	0.574	30%	0.295	S	S	*	.	H	α-helix	trans	-55.8	-42	175.7	-71.9	175	171.2	-170.2	-7.2	112.8	K353 Y360 K361	K353-R357 VanDerWaalsContact CE-NH2 3.25Å; K353-R357 WeakPolarHBondContact O-CB 3.47Å; K353-R357 WeakPolarHBondContact O-CG 3.35Å; K353-R357 PolarHBondContact O-N 2.98Å; R357-Y360 PolarHBondContact O-N 2.69Å; R357-K361 PolarHBondContact O-N 3.16Å; R357-K361 VanDerWaalsContact O-N 3.1Å
358	K	98.8	Very high	98.4	Very high	88 Å²	88	59.7 Å²	59.7	38%	0.383	31%	0.312	S	S	.	.	H	α-helix	trans	-63.1	-45.2	174.3	-176.1	176.8	177.7	-179.7	0	111	A257 E261 P354 F355 N356 K361 M362	A257-K358 HydrophobicContact CB-CB 4.07Å; A257-K358 HydrophobicContact CB-CD 3.95Å; A257-K358 HydrophobicContact CB-CG 3.92Å; E261-K358 VanDerWaalsContact CD-NZ 3.27Å; E261-K358 WeakPolarHBondContact OE1-CE 3.3Å; E261-K358 IonicContact OE1-NZ 3.33Å; E261-K358 PolarHBondContact OE1-NZ 3.33Å; E261-K358 IonicContact OE2-NZ 3.99Å; E261-K358 PolarHBondContact OE2-NZ 2.99Å; P354-K358 WeakPolarHBondContact O-CB 3.46Å; P354-K358 PolarHBondContact O-N 3.46Å; F355-K358 PolarHBondContact O-N 2.86Å; N356-K358 VanDerWaalsContact C-N 3.28Å; N356-K358 PolarHBondContact O-N 3.5Å; K358-K361 PolarHBondContact O-N 3.14Å; K358-M362 HydrophobicContact CG-CG 4.48Å; K358-M362 HydrophobicContact CG-SD 4.01Å; K358-M362 VanDerWaalsContact O-CG 3.23Å; K358-M362 WeakPolarHBondContact O-CG 3.37Å; K358-M362 PolarHBondContact O-N 3.32Å
359	F	98.9	Very high	98.4	Very high	1 Å²	1	60.1 Å²	60.1	0%	0.004	31%	0.314	C	S	.	.	H	α-helix	trans	-60.5	-45.9	177.7	-175.7	-109.3	0	0	0	111.6	V207 Y256 A257 L260 F274 F355 N356 K361 M362 T363 F367 W369	V207-F359 HydrophobicContact CG1-CE1 4.09Å; V207-F359 HydrophobicContact CG1-CZ 3.8Å; V207-F359 HydrophobicContact CG2-CE1 4.39Å; Y256-F359 HydrophobicContact CD2-CD1 4.41Å; Y256-F359 HydrophobicContact CD2-CE1 4.39Å; A257-F359 HydrophobicContact CB-CB 4.13Å; L260-F359 HydrophobicContact CD2-CD2 3.97Å; L260-F359 HydrophobicContact CD2-CE2 3.8Å; F274-F359 HydrophobicContact CD1-CE2 4.03Å; F274-F359 AromaticContact CD1-CZ 3.47Å; F274-F359 HydrophobicContact CD1-CZ 3.47Å; F274-F359 VanDerWaalsContact CD1-CZ 3.47Å; F274-F359 AromaticContact CE1-CE2 3.82Å; F274-F359 HydrophobicContact CE1-CE2 3.82Å; F274-F359 AromaticContact CE1-CZ 3.77Å; F274-F359 HydrophobicContact CE1-CZ 3.77Å; F274-F359 HydrophobicContact CG-CZ 4.12Å; F274-F359 HydrophobicContact CZ-CE2 4.49Å; F355-F359 WeakPolarHBondContact O-CB 3.32Å; F355-F359 PolarHBondContact O-N 3.16Å; N356-F359 CarbonylContact O-C 3.58Å; N356-F359 WeakPolarHBondContact O-CA 3.27Å; N356-F359 WeakPolarHBondContact O-CB 3.46Å; N356-F359 PolarHBondContact O-N 3.4Å; F359-K361 VanDerWaalsContact C-N 3.31Å; F359-K361 PolarHBondContact O-N 3.2Å; F359-M362 WeakPolarHBondContact O-CB 3.13Å; F359-M362 PolarHBondContact O-N 2.92Å; F359-T363 HydrophobicContact CD1-CG2 4.38Å; F359-T363 HydrophobicContact CD2-CG2 4.12Å; F359-T363 HydrophobicContact CE1-CG2 4.03Å; F359-T363 HydrophobicContact CE2-CG2 3.74Å; F359-T363 HydrophobicContact CG-CG2 4.43Å; F359-T363 HydrophobicContact CZ-CG2 3.68Å; F359-T363 WeakPolarHBondContact O-CG2 3.05Å; F359-T363 PolarHBondContact O-N 3.12Å; F359-T363 PolarHBondContact O-OG1 3.12Å; F359-T363 VanDerWaalsContact O-OG1 3.13Å; F359-F367 HydrophobicContact CD1-CD2 4.23Å; F359-F367 HydrophobicContact CD1-CE2 4.04Å; F359-F367 AromaticContact CE1-CD2 3.98Å; F359-F367 HydrophobicContact CE1-CD2 3.98Å; F359-F367 AromaticContact CE1-CE2 3.49Å; F359-F367 HydrophobicContact CE1-CE2 3.49Å; F359-F367 VanDerWaalsContact CE1-CE2 3.49Å; F359-F367 HydrophobicContact CE1-CZ 4.12Å; F359-F367 HydrophobicContact CZ-CE2 4.43Å; F359-W369 HydrophobicContact CD1-CH2 4.23Å; F359-W369 HydrophobicContact CD1-CZ3 4.13Å; F359-W369 HydrophobicContact CE1-CH2 4.08Å; F359-W369 HydrophobicContact CE1-CZ3 4.43Å
360	Y	98.8	Very high	98.1	Very high	19 Å²	19	60.6 Å²	60.6	8%	0.075	32%	0.323	C	S	.	.	H	α-helix	trans	-59.9	-42	178	-56.1	-19.6	0	0	0	112.2	N356 R357 T363 G364 H365 D366 F367 W369	N356-Y360 HydrophobicContact CB-CE1 4.38Å; N356-Y360 HydrophobicContact CB-CE2 4.18Å; N356-Y360 VanDerWaalsContact O-CD1 3.26Å; N356-Y360 WeakPolarHBondContact O-CD1 3.42Å; N356-Y360 PolarHBondContact O-N 2.92Å; R357-Y360 PolarHBondContact O-N 2.69Å; Y360-T363 PolarHBondContact O-N 2.73Å; Y360-T363 PolarHBondContact O-OG1 2.76Å; Y360-G364 WeakPolarHBondContact O-CA 3.41Å; Y360-G364 PolarHBondContact O-N 3.38Å; Y360-H365 VanDerWaalsContact CA-O 3.26Å; Y360-H365 WeakPolarHBondContact CA-O 3.02Å; Y360-H365 WeakPolarHBondContact CB-O 3.4Å; Y360-H365 WeakPolarHBondContact CD1-O 3.45Å; Y360-H365 PolarHBondContact O-N 3.02Å; Y360-H365 VanDerWaalsContact O-N 3.12Å; Y360-D366 HydrophobicContact CD2-CB 4.38Å; Y360-D366 VanDerWaalsContact CE2-OD1 3.26Å; Y360-D366 WeakPolarHBondContact CE2-OD1 3.3Å; Y360-F367 AromaticContact CD1-CD2 3.71Å; Y360-F367 HydrophobicContact CD1-CD2 3.71Å; Y360-F367 HydrophobicContact CD1-CE2 4.48Å; Y360-F367 HydrophobicContact CE1-CB 3.88Å; Y360-F367 AromaticContact CE1-CD2 3.68Å; Y360-F367 HydrophobicContact CE1-CD2 3.68Å; Y360-F367 HydrophobicContact CE1-CG 4.26Å; Y360-W369 HydrophobicContact CE1-CD2 4.3Å; Y360-W369 AromaticContact CE1-CE3 3.67Å; Y360-W369 HydrophobicContact CE1-CE3 3.67Å; Y360-W369 HydrophobicContact CE1-CH2 4.43Å; Y360-W369 AromaticContact CE1-CZ3 3.74Å; Y360-W369 HydrophobicContact CE1-CZ3 3.74Å; Y360-W369 AromaticContact CZ-CE3 3.82Å; Y360-W369 WeakPolarHBondContact OH-CB 3.47Å; Y360-W369 VanDerWaalsContact OH-CD2 3.3Å; Y360-W369 PolarHBondContact OH-N 3.05Å; Y360-W369 VanDerWaalsContact OH-N 3.14Å
361	K	98.7	Very high	98.1	Very high	184 Å²	184	59.4 Å²	59.4	80%	0.8	32%	0.317	S	S	*	.	H	α-helix	trans	-62.9	-42.8	174	-175.5	179.2	179.5	-180	0	111.8	R357 K358 F359	R357-K361 PolarHBondContact O-N 3.16Å; R357-K361 VanDerWaalsContact O-N 3.1Å; K358-K361 PolarHBondContact O-N 3.14Å; F359-K361 VanDerWaalsContact C-N 3.31Å; F359-K361 PolarHBondContact O-N 3.2Å
362	M	98.7	Very high	98.1	Very high	46 Å²	46	60.4 Å²	60.4	23%	0.227	32%	0.324	C	S	.	.	H	α-helix	trans	-64.9	-43.4	179.1	-69.7	170.3	77	0	0	111.5	A257 L260 E261 L264 M269 K358 F359	A257-M362 HydrophobicContact CB-SD 3.91Å; L260-M362 HydrophobicContact CB-CE 3.93Å; L260-M362 HydrophobicContact CD2-CB 3.92Å; L260-M362 HydrophobicContact CD2-CE 3.72Å; L260-M362 HydrophobicContact CD2-SD 4.32Å; L260-M362 HydrophobicContact CG-CE 3.61Å; E261-M362 HydrophobicContact CG-CE 3.79Å; L264-M362 HydrophobicContact CD1-CE 3.73Å; M269-M362 WeakPolarHBondContact CE-O 3.48Å; K358-M362 HydrophobicContact CG-CG 4.48Å; K358-M362 HydrophobicContact CG-SD 4.01Å; K358-M362 VanDerWaalsContact O-CG 3.23Å; K358-M362 WeakPolarHBondContact O-CG 3.37Å; K358-M362 PolarHBondContact O-N 3.32Å; F359-M362 WeakPolarHBondContact O-CB 3.13Å; F359-M362 PolarHBondContact O-N 2.92Å
363	T	98.4	Very high	98.1	Very high	26 Å²	26	63.7 Å²	63.7	16%	0.16	34%	0.342	C	S	.	.	H	α-helix	trans	-85.9	-9.5	-176.9	61.3	0	0	0	0	113.7	L260 F274 F359 Y360 H365	L260-T363 HydrophobicContact CD2-CG2 4.02Å; F274-T363 HydrophobicContact CD1-CG2 4.21Å; F274-T363 HydrophobicContact CD2-CG2 3.49Å; F274-T363 VanDerWaalsContact CD2-CG2 3.49Å; F274-T363 HydrophobicContact CE1-CG2 4.27Å; F274-T363 HydrophobicContact CE2-CG2 3.59Å; F274-T363 HydrophobicContact CG-CG2 3.83Å; F274-T363 HydrophobicContact CZ-CG2 3.99Å; F359-T363 HydrophobicContact CD1-CG2 4.38Å; F359-T363 HydrophobicContact CD2-CG2 4.12Å; F359-T363 HydrophobicContact CE1-CG2 4.03Å; F359-T363 HydrophobicContact CE2-CG2 3.74Å; F359-T363 HydrophobicContact CG-CG2 4.43Å; F359-T363 HydrophobicContact CZ-CG2 3.68Å; F359-T363 WeakPolarHBondContact O-CG2 3.05Å; F359-T363 PolarHBondContact O-N 3.12Å; F359-T363 PolarHBondContact O-OG1 3.12Å; F359-T363 VanDerWaalsContact O-OG1 3.13Å; Y360-T363 PolarHBondContact O-N 2.73Å; Y360-T363 PolarHBondContact O-OG1 2.76Å; T363-H365 PolarHBondContact O-N 2.78Å; T363-H365 PolarHBondContact OG1-N 3.25Å; T363-H365 PolarHBondContact OG1-O 2.91Å
364	G	98.3	Very high	98	Very high	71 Å²	71	63.7 Å²	63.7	73%	0.732	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	25.4	-172.5	0	0	0	0	0	113.4	Y360	Y360-G364 WeakPolarHBondContact O-CA 3.41Å; Y360-G364 PolarHBondContact O-N 3.38Å
365	H	97.9	Very high	98	Very high	80 Å²	80	62.8 Å²	62.8	37%	0.37	34%	0.335	S	S	.	.			trans	-146.4	127.7	-175	-171.8	75.8	0	0	0	111.1	Y360 T363 F367	Y360-H365 VanDerWaalsContact CA-O 3.26Å; Y360-H365 WeakPolarHBondContact CA-O 3.02Å; Y360-H365 WeakPolarHBondContact CB-O 3.4Å; Y360-H365 WeakPolarHBondContact CD1-O 3.45Å; Y360-H365 PolarHBondContact O-N 3.02Å; Y360-H365 VanDerWaalsContact O-N 3.12Å; T363-H365 PolarHBondContact O-N 2.78Å; T363-H365 PolarHBondContact OG1-N 3.25Å; T363-H365 PolarHBondContact OG1-O 2.91Å; H365-F367 HydrophobicContact CB-CE2 4.25Å; H365-F367 HydrophobicContact CB-CZ 4.44Å; H365-F367 AromaticContact CD2-CD1 3.76Å; H365-F367 AromaticContact CD2-CD2 3.89Å; H365-F367 AromaticContact CD2-CE1 3.59Å; H365-F367 AromaticContact CD2-CE2 3.74Å; H365-F367 AromaticContact CD2-CG 3.9Å; H365-F367 AromaticContact CD2-CZ 3.57Å; H365-F367 WeakPolarHBondContact O-CD2 3.2Å
366	D	98.4	Very high	97.9	Very high	105 Å²	105	64.2 Å²	64.2	56%	0.561	35%	0.345	S	S	*	.			trans	-89.6	122.9	172.7	-167.1	-26.4	0	0	0	109.7	Y360 G368	Y360-D366 HydrophobicContact CD2-CB 4.38Å; Y360-D366 VanDerWaalsContact CE2-OD1 3.26Å; Y360-D366 WeakPolarHBondContact CE2-OD1 3.3Å; D366-G368 PolarHBondContact OD1-N 3.24Å
367	F	98.3	Very high	97.9	Very high	17 Å²	17	68.6 Å²	68.6	8%	0.075	37%	0.369	C	S	.	.			trans	-91.7	0.2	-179.4	-65.4	-94.2	0	0	0	113.3	V207 F274 F359 Y360 H365 W369	V207-F367 HydrophobicContact CG2-CD1 3.65Å; V207-F367 HydrophobicContact CG2-CE1 3.38Å; V207-F367 HydrophobicContact CG2-CE2 4.4Å; V207-F367 HydrophobicContact CG2-CG 4.28Å; V207-F367 HydrophobicContact CG2-CZ 3.8Å; F274-F367 HydrophobicContact CB-CE1 4.3Å; F274-F367 HydrophobicContact CB-CZ 3.61Å; F359-F367 HydrophobicContact CD1-CD2 4.23Å; F359-F367 HydrophobicContact CD1-CE2 4.04Å; F359-F367 AromaticContact CE1-CD2 3.98Å; F359-F367 HydrophobicContact CE1-CD2 3.98Å; F359-F367 AromaticContact CE1-CE2 3.49Å; F359-F367 HydrophobicContact CE1-CE2 3.49Å; F359-F367 VanDerWaalsContact CE1-CE2 3.49Å; F359-F367 HydrophobicContact CE1-CZ 4.12Å; F359-F367 HydrophobicContact CZ-CE2 4.43Å; Y360-F367 AromaticContact CD1-CD2 3.71Å; Y360-F367 HydrophobicContact CD1-CD2 3.71Å; Y360-F367 HydrophobicContact CD1-CE2 4.48Å; Y360-F367 HydrophobicContact CE1-CB 3.88Å; Y360-F367 AromaticContact CE1-CD2 3.68Å; Y360-F367 HydrophobicContact CE1-CD2 3.68Å; Y360-F367 HydrophobicContact CE1-CG 4.26Å; H365-F367 HydrophobicContact CB-CE2 4.25Å; H365-F367 HydrophobicContact CB-CZ 4.44Å; H365-F367 AromaticContact CD2-CD1 3.76Å; H365-F367 AromaticContact CD2-CD2 3.89Å; H365-F367 AromaticContact CD2-CE1 3.59Å; H365-F367 AromaticContact CD2-CE2 3.74Å; H365-F367 AromaticContact CD2-CG 3.9Å; H365-F367 AromaticContact CD2-CZ 3.57Å; H365-F367 WeakPolarHBondContact O-CD2 3.2Å; F367-W369 HydrophobicContact CB-CD2 3.9Å; F367-W369 HydrophobicContact CB-CE3 4.4Å; F367-W369 HydrophobicContact CB-CG 4.42Å; F367-W369 HydrophobicContact CB-CH2 3.96Å; F367-W369 HydrophobicContact CB-CZ2 3.43Å; F367-W369 VanDerWaalsContact CB-CZ2 3.43Å; F367-W369 HydrophobicContact CB-CZ3 4.42Å; F367-W369 HydrophobicContact CD1-CZ2 4.05Å; F367-W369 HydrophobicContact CD2-CH2 4.09Å; F367-W369 HydrophobicContact CD2-CZ2 4.3Å; F367-W369 AromaticContact CG-CH2 3.94Å; F367-W369 HydrophobicContact CG-CH2 3.94Å; F367-W369 AromaticContact CG-CZ2 3.68Å; F367-W369 HydrophobicContact CG-CZ2 3.68Å
368	G	97.7	Very high	97.8	Very high	62 Å²	62	62.2 Å²	62.2	64%	0.639	35%	0.353	S	S	*	.	S	Bend	trans	70.5	36.1	173.3	0	0	0	0	0	114.5	D366	D366-G368 PolarHBondContact OD1-N 3.24Å
369	W	98.1	Very high	97.7	Very high	10 Å²	10	60 Å²	60	4%	0.038	35%	0.351	C	S	.	.			trans	-92.7	-16.5	179.7	-51.8	-33.3	0	0	0	114.4	V207 N209 Y256 E278 R349 N356 F359 Y360 F367	V207-W369 HydrophobicContact CB-CH2 3.8Å; V207-W369 HydrophobicContact CB-CZ2 3.95Å; V207-W369 HydrophobicContact CG2-CH2 3.79Å; V207-W369 HydrophobicContact CG2-CZ2 3.73Å; N209-W369 HydrophobicContact CB-CB 4.25Å; N209-W369 HydrophobicContact CB-CD2 4.41Å; N209-W369 HydrophobicContact CB-CG 3.81Å; N209-W369 WeakPolarHBondContact ND2-CB 3Å; Y256-W369 AromaticContact CD2-CH2 3.74Å; Y256-W369 HydrophobicContact CD2-CH2 3.74Å; Y256-W369 AromaticContact CD2-CZ3 3.68Å; Y256-W369 HydrophobicContact CD2-CZ3 3.68Å; Y256-W369 AromaticContact CE2-CH2 3.54Å; Y256-W369 HydrophobicContact CE2-CH2 3.54Å; Y256-W369 HydrophobicContact CE2-CZ2 4.37Å; Y256-W369 AromaticContact CE2-CZ3 3.67Å; Y256-W369 HydrophobicContact CE2-CZ3 3.67Å; E278-W369 PolarHBondContact OE2-NE1 3.4Å; E278-W369 VanDerWaalsContact OE2-NE1 3.16Å; R349-W369 PolarHBondContact NH1-O 3.31Å; N356-W369 HydrophobicContact CB-CE3 4.44Å; F359-W369 HydrophobicContact CD1-CH2 4.23Å; F359-W369 HydrophobicContact CD1-CZ3 4.13Å; F359-W369 HydrophobicContact CE1-CH2 4.08Å; F359-W369 HydrophobicContact CE1-CZ3 4.43Å; Y360-W369 HydrophobicContact CE1-CD2 4.3Å; Y360-W369 AromaticContact CE1-CE3 3.67Å; Y360-W369 HydrophobicContact CE1-CE3 3.67Å; Y360-W369 HydrophobicContact CE1-CH2 4.43Å; Y360-W369 AromaticContact CE1-CZ3 3.74Å; Y360-W369 HydrophobicContact CE1-CZ3 3.74Å; Y360-W369 AromaticContact CZ-CE3 3.82Å; Y360-W369 WeakPolarHBondContact OH-CB 3.47Å; Y360-W369 VanDerWaalsContact OH-CD2 3.3Å; Y360-W369 PolarHBondContact OH-N 3.05Å; Y360-W369 VanDerWaalsContact OH-N 3.14Å; F367-W369 HydrophobicContact CB-CD2 3.9Å; F367-W369 HydrophobicContact CB-CE3 4.4Å; F367-W369 HydrophobicContact CB-CG 4.42Å; F367-W369 HydrophobicContact CB-CH2 3.96Å; F367-W369 HydrophobicContact CB-CZ2 3.43Å; F367-W369 VanDerWaalsContact CB-CZ2 3.43Å; F367-W369 HydrophobicContact CB-CZ3 4.42Å; F367-W369 HydrophobicContact CD1-CZ2 4.05Å; F367-W369 HydrophobicContact CD2-CH2 4.09Å; F367-W369 HydrophobicContact CD2-CZ2 4.3Å; F367-W369 AromaticContact CG-CH2 3.94Å; F367-W369 HydrophobicContact CG-CH2 3.94Å; F367-W369 AromaticContact CG-CZ2 3.68Å; F367-W369 HydrophobicContact CG-CZ2 3.68Å
370	D	90.9	Very high	97.6	Very high	99 Å²	99	65.4 Å²	65.4	53%	0.529	38%	0.382	S	S	.	.			trans	-115.3	0	-170.8	-64.4	-33	0	0	0	114.6	K353 N356	K353-D370 HydrophobicContact CG-CB 4.41Å; N356-D370 WeakPolarHBondContact CB-OD2 3.36Å; N356-D370 PolarHBondContact ND2-OD1 3.15Å

Retrieved 370 of 370 residues in 1085.9 ms (Link to these results)

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