A0A087XI60_POEFO Loading...

Neutrophil cytosolic factor 1

AlphaFold DB , UniProt , Accession A0A087XI60, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 439 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	33.7	Very low	238 Å²	238	156.2 Å²	156.2	100%	1.172	87%	0.867	S	S	*	*				0	169.9	0	-70.8	-176.3	-178.7	0	0	108.8
2	I	38	Very low	33.5	Very low	166 Å²	166	159.5 Å²	159.5	85%	0.851	87%	0.866	S	S	*	*			trans	65.9	94.1	-177.9	-48.4	177.1	0	0	0	112.6
3	S	29.9	Very low	33.5	Very low	119 Å²	119	163.2 Å²	163.2	83%	0.832	87%	0.869	S	S	*	*			trans	-93.5	142.9	155.5	-179.9	0	0	0	0	108
4	C	31.6	Very low	33.4	Very low	116 Å²	116	164.3 Å²	164.3	78%	0.784	87%	0.867	S	S	*	*			trans	-118.4	106.4	177.4	-166.3	0	0	0	0	109.1
5	G	33.7	Very low	33.2	Very low	73 Å²	73	161.1 Å²	161.1	75%	0.753	86%	0.863	S	S	*	*			trans	-100.8	119.2	179.8	0	0	0	0	0	111.5
6	V	33.4	Very low	33.2	Very low	136 Å²	136	157.9 Å²	157.9	82%	0.824	86%	0.857	S	S	*	*			trans	-101.9	128	174.1	178.7	0	0	0	0	109.1
7	T	32.4	Very low	33.2	Very low	129 Å²	129	155.8 Å²	155.8	79%	0.791	86%	0.855	S	S	*	*			trans	-128.7	144.7	175.3	-56.1	0	0	0	0	110.5
8	T	33.9	Very low	33.3	Very low	134 Å²	134	154.5 Å²	154.5	82%	0.822	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-76.3	142.5	-163.2	42.4	0	0	0	0	115.2
9	H	31.8	Very low	33.6	Very low	185 Å²	185	152.8 Å²	152.8	86%	0.856	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-91.5	137.6	161.7	-98.4	-100.2	0	0	0	110.9
10	R	33.3	Very low	33.8	Very low	246 Å²	246	154.8 Å²	154.8	93%	0.928	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-74.1	140.7	165.6	-78.1	178.4	169	168.7	-4.2	110
11	L	33.8	Very low	33.7	Very low	176 Å²	176	154.4 Å²	154.4	92%	0.921	84%	0.844	S	S	*	*			trans	-110.4	138.3	166.5	-89.5	166.7	0	0	0	110.7
12	F	30.8	Very low	33.6	Very low	196 Å²	196	151.6 Å²	151.6	86%	0.86	83%	0.826	S	S	*	*			trans	-117.4	132.8	173.8	-129.9	-88.2	0	0	0	107.3
13	K	33.1	Very low	33.4	Very low	208 Å²	208	148.1 Å²	148.1	90%	0.904	82%	0.816	S	S	*	*			trans	-157.5	137.5	160.4	-127	172.6	-176.8	179.3	0	111.7
14	Q	32.9	Very low	34	Very low	178 Å²	178	150.6 Å²	150.6	83%	0.832	81%	0.813	S	S	*	*			trans	-84.8	153.1	177.5	-59.1	149.6	-74.2	0	0	110.6
15	S	30.1	Very low	34.1	Very low	117 Å²	117	153.6 Å²	153.6	82%	0.818	82%	0.815	S	S	*	*			trans	-147.9	127.3	152.2	-73.5	0	0	0	0	110.9
16	S	32.4	Very low	34.8	Very low	109 Å²	109	155 Å²	155	76%	0.762	81%	0.811	S	S	*	*			trans	42.7	101.2	149.8	-49.5	0	0	0	0	120.2
17	C	34.2	Very low	35.2	Very low	122 Å²	122	158.2 Å²	158.2	82%	0.824	81%	0.809	S	S	*	*			trans	-76.9	126.2	146	-177	0	0	0	0	108.5
18	N	34.2	Very low	35.9	Very low	133 Å²	133	157.5 Å²	157.5	71%	0.711	81%	0.81	S	S	*	*			trans	-118.3	118.1	167.3	-93	0.5	0	0	0	108.3	F20	N18-F20 PolarHBondContact O-N 2.81Å
19	S	40.2	Very low	36.6	Very low	122 Å²	122	159.1 Å²	159.1	85%	0.853	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-64.7	117.8	170.9	-54.7	0	0	0	0	109.6
20	F	36.3	Very low	37.9	Very low	192 Å²	192	157.1 Å²	157.1	84%	0.842	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-91.5	127.6	163.5	-107.3	-94	0	0	0	109.2	N18	N18-F20 PolarHBondContact O-N 2.81Å
21	D	31.8	Very low	40	Very low	147 Å²	147	151 Å²	151	79%	0.786	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-68.9	130.8	-172.7	-161.3	-8.4	0	0	0	110.8	S23	D21-S23 PolarHBondContact O-N 3.18Å
22	F	37.4	Very low	42.6	Very low	179 Å²	179	146.9 Å²	146.9	79%	0.785	76%	0.761	S	S	*	*			trans	-87.4	58.8	-170.5	-145.2	-83.3	0	0	0	110.8	F24	F22-F24 HydrophobicContact CD1-CD2 4.22Å; F22-F24 HydrophobicContact CD1-CE2 4.33Å; F22-F24 HydrophobicContact CE1-CD2 4.49Å; F22-F24 HydrophobicContact CE1-CE2 4.3Å; F22-F24 PolarHBondContact O-N 3.4Å
23	S	34.1	Very low	45.5	Very low	93 Å²	93	139.6 Å²	139.6	65%	0.65	73%	0.728	S	S	*	*			trans	-66.3	101.7	179.4	50.8	0	0	0	0	110.9	D21 Q25	D21-S23 PolarHBondContact O-N 3.18Å; S23-Q25 PolarHBondContact O-N 2.78Å
24	F	42.2	Very low	48.4	Very low	172 Å²	172	129.9 Å²	129.9	75%	0.754	69%	0.686	S	S	*	*			trans	-58.9	106.6	175.4	-113.4	-105	0	0	0	110.4	F22 P26	F22-F24 HydrophobicContact CD1-CD2 4.22Å; F22-F24 HydrophobicContact CD1-CE2 4.33Å; F22-F24 HydrophobicContact CE1-CD2 4.49Å; F22-F24 HydrophobicContact CE1-CE2 4.3Å; F22-F24 PolarHBondContact O-N 3.4Å; F24-P26 VanDerWaalsContact O-CD 3.23Å; F24-P26 WeakPolarHBondContact O-CD 2.88Å
25	Q	35	Very low	51.2	Low	178 Å²	178	128.6 Å²	128.6	83%	0.832	67%	0.674	S	S	*	*			trans	-103.8	92.3	164.8	-70.7	-162.9	-55.7	0	0	109.7	S23 Y27	S23-Q25 PolarHBondContact O-N 2.78Å; Q25-Y27 PolarHBondContact O-N 3.42Å
26	P	48.4	Very low	54.2	Low	102 Å²	102	126.5 Å²	126.5	66%	0.662	65%	0.651	S	S	*	*			trans	-80.1	64.3	179.6	35	-37.3	0	0	0	111.6	F24	F24-P26 VanDerWaalsContact O-CD 3.23Å; F24-P26 WeakPolarHBondContact O-CD 2.88Å
27	Y	39.9	Very low	57.1	Low	204 Å²	204	121.7 Å²	121.7	80%	0.8	62%	0.617	S	S	*	*			trans	-132.3	78.2	167.1	-81.2	-74.8	0	0	0	110.4	Q25 M29	Q25-Y27 PolarHBondContact O-N 3.42Å; Y27-M29 PolarHBondContact O-N 3.47Å
28	S	47.2	Very low	59.8	Low	114 Å²	114	120.2 Å²	120.2	80%	0.797	60%	0.598	S	S	*	*			trans	-68	83.7	158	55	0	0	0	0	108.9	E30	S28-E30 PolarHBondContact O-N 3.25Å; S28-E30 VanDerWaalsContact O-N 3.07Å
29	M	49.6	Very low	62.3	Low	168 Å²	168	115 Å²	115	83%	0.828	57%	0.57	S	S	*	*			trans	-59.4	109.1	153.9	-81.8	-177.7	-85.9	0	0	106.5	Y27 E31	Y27-M29 PolarHBondContact O-N 3.47Å; M29-E31 PolarHBondContact O-N 3.22Å
30	E	59.9	Low	64.5	Low	144 Å²	144	111.1 Å²	111.1	67%	0.673	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-57.2	125.5	171.5	-59.5	-167	138.2	0	0	107.8	S28 I32	S28-E30 PolarHBondContact O-N 3.25Å; S28-E30 VanDerWaalsContact O-N 3.07Å; E30-I32 PolarHBondContact O-N 3.36Å
31	E	76.4	Confident	66.7	Low	117 Å²	117	102.1 Å²	102.1	55%	0.547	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-60.8	116.5	-177.8	-69.1	-154.6	124.4	0	0	109.2	M29 Y33 K140	M29-E31 PolarHBondContact O-N 3.22Å; E31-Y33 PolarHBondContact O-N 3.36Å; E31-Y33 VanDerWaalsContact O-N 3.1Å; E31-K140 VanDerWaalsContact CD-NZ 3.27Å; E31-K140 WeakPolarHBondContact OE1-CE 3.26Å; E31-K140 IonicContact OE1-NZ 2.62Å; E31-K140 PolarHBondContact OE1-NZ 3.31Å; E31-K140 WeakPolarHBondContact OE2-CE 3.3Å; E31-K140 IonicContact OE2-NZ 3.75Å; E31-K140 PolarHBondContact OE2-NZ 3.32Å; E31-K140 VanDerWaalsContact OE2-NZ 3.14Å
32	I	88.8	Confident	69.2	Low	89 Å²	89	95.3 Å²	95.3	46%	0.456	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-56.4	119	-171.7	-61	169.1	0	0	0	109.2	E30 W60 S61	E30-I32 PolarHBondContact O-N 3.36Å; I32-W60 HydrophobicContact CG2-CB 4.09Å; I32-W60 HydrophobicContact CG2-CD2 4.38Å; I32-W60 HydrophobicContact CG2-CE3 3.87Å; I32-S61 WeakPolarHBondContact CA-OG 3.31Å
33	Y	91.4	Very high	71.2	Confident	44 Å²	44	87.2 Å²	87.2	17%	0.173	43%	0.428	C	S	.	.			trans	-123.4	158	-170.5	70.2	-90.7	0	0	0	111.3	E31 R35 W60 S61 R138	E31-Y33 PolarHBondContact O-N 3.36Å; E31-Y33 VanDerWaalsContact O-N 3.1Å; Y33-R35 HydrophobicContact CD2-CG 4.4Å; Y33-R35 HydrophobicContact CE2-CG 3.83Å; Y33-R35 PolarHBondContact O-N 3.12Å; Y33-W60 CarbonylContact O-C 3.58Å; Y33-W60 WeakPolarHBondContact O-CA 3.22Å; Y33-S61 PolarHBondContact N-OG 2.76Å; Y33-S61 VanDerWaalsContact N-OG 3.07Å; Y33-S61 PolarHBondContact O-N 2.64Å; Y33-R138 HydrophobicContact CD1-CG 4.49Å; Y33-R138 HydrophobicContact CD2-CG 3.99Å; Y33-R138 HydrophobicContact CG-CG 3.91Å; Y33-R138 PolarHBondContact OH-NH2 2.97Å
34	V	93.6	Very high	73.2	Confident	4 Å²	4	83.8 Å²	83.8	2%	0.024	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	122.4	-179.8	-179.4	0	0	0	0	109.4	V37 V58 W60 I130 L142 F146	V34-V37 HydrophobicContact CG1-CG2 3.46Å; V34-V37 VanDerWaalsContact CG1-CG2 3.46Å; V34-V58 HydrophobicContact CB-CG1 4.49Å; V34-V58 HydrophobicContact CG1-CG1 3.84Å; V34-V58 HydrophobicContact CG2-CG1 3.99Å; V34-W60 HydrophobicContact CG2-CE3 3.94Å; V34-W60 HydrophobicContact CG2-CH2 3.91Å; V34-W60 HydrophobicContact CG2-CZ2 4.46Å; V34-W60 HydrophobicContact CG2-CZ3 3.62Å; V34-I130 HydrophobicContact CB-CG2 4.45Å; V34-I130 HydrophobicContact CG1-CG2 3.82Å; V34-L142 HydrophobicContact CB-CD2 4.17Å; V34-L142 HydrophobicContact CG2-CD2 4.01Å; V34-F146 HydrophobicContact CG2-CB 3.73Å; V34-F146 HydrophobicContact CG2-CD2 4.03Å; V34-F146 HydrophobicContact CG2-CG 4.08Å
35	R	93	Very high	74.8	Confident	151 Å²	151	76.1 Å²	76.1	57%	0.57	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	-33.8	174.9	-75.6	-170.6	66.6	-177.5	-0.1	112.9	Y33 K59	Y33-R35 HydrophobicContact CD2-CG 4.4Å; Y33-R35 HydrophobicContact CE2-CG 3.83Å; Y33-R35 PolarHBondContact O-N 3.12Å; R35-K59 PolarHBondContact N-O 3.14Å
36	H	92.6	Very high	76.2	Confident	72 Å²	72	69.6 Å²	69.6	33%	0.333	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	150.9	178.7	-170.8	69.5	0	0	0	111.7	K59	H36-K59 HydrophobicContact CB-CB 4.07Å; H36-K59 HydrophobicContact CB-CD 4.37Å; H36-K59 HydrophobicContact CB-CG 4.21Å; H36-K59 PolarHBondContact N-O 3.17Å; H36-K59 VanDerWaalsContact N-O 3.09Å; H36-K59 PolarHBondContact O-N 2.84Å
37	V	93.3	Very high	76.8	Confident	8 Å²	8	71.1 Å²	71.1	5%	0.048	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	117.7	173.7	179.9	0	0	0	0	108.3	V34 L56 M57 C126 I130 F146	V34-V37 HydrophobicContact CG1-CG2 3.46Å; V34-V37 VanDerWaalsContact CG1-CG2 3.46Å; V37-L56 HydrophobicContact CG1-CB 4.34Å; V37-L56 HydrophobicContact CG1-CD2 3.73Å; V37-M57 WeakPolarHBondContact CA-O 3.45Å; V37-C126 HydrophobicContact CB-CB 4.21Å; V37-C126 HydrophobicContact CG1-CB 3.92Å; V37-I130 HydrophobicContact CG2-CG2 3.98Å; V37-F146 HydrophobicContact CB-CE1 4.4Å; V37-F146 HydrophobicContact CG1-CD1 4.48Å; V37-F146 HydrophobicContact CG1-CE1 3.81Å; V37-F146 HydrophobicContact CG1-CZ 4.44Å; V37-F146 HydrophobicContact CG2-CD1 4.01Å; V37-F146 HydrophobicContact CG2-CE1 3.71Å; V37-F146 HydrophobicContact CG2-CE2 4.48Å; V37-F146 HydrophobicContact CG2-CZ 3.97Å
38	E	90	Very high	77.8	Confident	91 Å²	91	66.6 Å²	66.6	43%	0.425	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	125.5	177.2	-172.8	-175.1	176.6	0	0	109.6	L40 L56 M57	E38-L40 HydrophobicContact CG-CD2 3.94Å; E38-L40 PolarHBondContact O-N 3.29Å; E38-L56 CarbonylContact O-C 3.46Å; E38-L56 WeakPolarHBondContact O-CA 3.26Å; E38-M57 HydrophobicContact CB-CB 4.3Å; E38-M57 PolarHBondContact N-O 3.32Å; E38-M57 PolarHBondContact O-N 2.87Å
39	L	88.1	Confident	78.9	Confident	23 Å²	23	64.7 Å²	64.7	12%	0.12	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	95.7	177.6	179.4	62.5	0	0	0	110.4	G41 Y54 L56 K119 L122 A123	L39-G41 WeakPolarHBondContact CD1-O 3.31Å; L39-G41 PolarHBondContact O-N 3.39Å; L39-G41 VanDerWaalsContact O-N 3.12Å; L39-Y54 HydrophobicContact CD1-CD1 4.15Å; L39-Y54 HydrophobicContact CD1-CG 4.47Å; L39-Y54 HydrophobicContact CD2-CD1 4.44Å; L39-L56 HydrophobicContact CB-CD2 4.18Å; L39-L56 HydrophobicContact CD1-CD2 3.66Å; L39-L56 HydrophobicContact CD1-CG 4.19Å; L39-L56 HydrophobicContact CG-CD2 4.47Å; L39-K119 HydrophobicContact CD2-CB 4.29Å; L39-K119 HydrophobicContact CD2-CG 3.93Å; L39-K119 WeakPolarHBondContact CD2-O 3.36Å; L39-K119 HydrophobicContact CG-CG 4.45Å; L39-L122 HydrophobicContact CD2-CB 3.68Å; L39-A123 HydrophobicContact CB-CB 4.28Å; L39-A123 HydrophobicContact CD2-CB 4.43Å
40	L	85.3	Confident	79.9	Confident	42 Å²	42	62.1 Å²	62.1	22%	0.22	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-1.1	180	-56.4	-176	0	0	0	114.2	E38 R55 M57 L67 A168	E38-L40 HydrophobicContact CG-CD2 3.94Å; E38-L40 PolarHBondContact O-N 3.29Å; L40-R55 HydrophobicContact CB-CB 4.32Å; L40-R55 PolarHBondContact N-O 2.85Å; L40-R55 PolarHBondContact O-NH1 2.84Å; L40-M57 HydrophobicContact CD1-CB 4.09Å; L40-M57 HydrophobicContact CD1-CE 4.34Å; L40-M57 HydrophobicContact CG-CB 4.17Å; L40-L67 HydrophobicContact CD1-CD1 4.04Å; L40-A168 VanDerWaalsContact O-CA 3.32Å; L40-A168 WeakPolarHBondContact O-CA 3.41Å; L40-A168 WeakPolarHBondContact O-CB 3.41Å
41	G	82.6	Confident	80.5	Confident	2 Å²	2	57.8 Å²	57.8	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	120.7	-143.2	179.8	0	0	0	0	0	113.3	L39 Y54 R55 F167	L39-G41 WeakPolarHBondContact CD1-O 3.31Å; L39-G41 PolarHBondContact O-N 3.39Å; L39-G41 VanDerWaalsContact O-N 3.12Å; G41-Y54 WeakPolarHBondContact O-CA 3.35Å; G41-R55 PolarHBondContact O-N 2.89Å; G41-F167 WeakPolarHBondContact CA-O 3.44Å
42	F	83.9	Confident	80.7	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	169.5	-176.2	60.7	-87.5	0	0	0	112.8	Y52 V53 Y54 R115 F167	F42-Y52 AromaticContact CD2-CD1 3.98Å; F42-Y52 HydrophobicContact CD2-CD1 3.98Å; F42-Y52 HydrophobicContact CE2-CD1 4.25Å; F42-Y52 HydrophobicContact CE2-CE1 4.42Å; F42-V53 CarbonylContact C-O 3.59Å; F42-V53 WeakPolarHBondContact CA-O 3.48Å; F42-V53 VanDerWaalsContact CB-O 3.3Å; F42-V53 WeakPolarHBondContact CB-O 3.37Å; F42-Y54 HydrophobicContact CB-CD1 3.97Å; F42-Y54 HydrophobicContact CB-CE1 4.23Å; F42-Y54 HydrophobicContact CB-CG 4.45Å; F42-R115 HydrophobicContact CZ-CB 4.24Å; F42-F167 HydrophobicContact CD1-CB 4.34Å; F42-F167 HydrophobicContact CD2-CB 4.3Å; F42-F167 AromaticContact CD2-CD2 3.37Å; F42-F167 HydrophobicContact CD2-CD2 3.37Å; F42-F167 HydrophobicContact CD2-CE2 4.08Å; F42-F167 HydrophobicContact CD2-CG 4.15Å; F42-F167 HydrophobicContact CE1-CB 4.24Å; F42-F167 HydrophobicContact CE2-CB 4.21Å; F42-F167 AromaticContact CE2-CD2 3.24Å; F42-F167 HydrophobicContact CE2-CD2 3.24Å; F42-F167 AromaticContact CE2-CE2 3.76Å; F42-F167 HydrophobicContact CE2-CE2 3.76Å; F42-F167 AromaticContact CE2-CG 3.82Å; F42-F167 HydrophobicContact CE2-CG 3.82Å; F42-F167 HydrophobicContact CG-CB 4.35Å; F42-F167 HydrophobicContact CG-CD2 4.19Å; F42-F167 HydrophobicContact CZ-CB 4.17Å; F42-F167 AromaticContact CZ-CD2 3.97Å; F42-F167 HydrophobicContact CZ-CD2 3.97Å; F42-F167 HydrophobicContact CZ-CG 4.08Å; F42-F167 PolarHBondContact N-O 2.7Å; F42-F167 WeakPolarHBondContact O-CA 3.39Å; F42-F167 WeakPolarHBondContact O-CB 3.45Å; F42-F167 WeakPolarHBondContact O-CD2 3.42Å; F42-F167 PolarHBondContact O-N 3.42Å
43	E	80.1	Confident	80.6	Confident	9 Å²	9	50.3 Å²	50.3	4%	0.042	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	134	-178.1	-177.8	-167.2	154.9	0	0	110.1	R45 Y52 V53 Y69 N164 D165 L166	E43-R45 HydrophobicContact CG-CG 4.12Å; E43-R45 VanDerWaalsContact OE1-CG 3.3Å; E43-R45 WeakPolarHBondContact OE1-CG 3.19Å; E43-R45 IonicContact OE1-CZ 3.92Å; E43-R45 IonicContact OE1-NE 3.39Å; E43-R45 PolarHBondContact OE1-NE 3.3Å; E43-R45 IonicContact OE1-NH2 2.93Å; E43-R45 IonicContact OE2-CZ 2.79Å; E43-R45 IonicContact OE2-NE 3.51Å; E43-R45 PolarHBondContact OE2-NE 2.8Å; E43-R45 IonicContact OE2-NH2 2.76Å; E43-R45 PolarHBondContact OE2-NH2 3.43Å; E43-Y52 WeakPolarHBondContact O-CA 3.3Å; E43-V53 HydrophobicContact CB-CG2 3.79Å; E43-V53 PolarHBondContact N-O 2.86Å; E43-V53 PolarHBondContact O-N 3.38Å; E43-Y69 VanDerWaalsContact OE2-CE1 3.28Å; E43-Y69 WeakPolarHBondContact OE2-CE1 3.3Å; E43-N164 HydrophobicContact CG-CB 4.1Å; E43-N164 WeakPolarHBondContact OE1-CB 3.32Å; E43-N164 PolarHBondContact OE1-ND2 3.38Å; E43-D165 CarbonylContact C-O 3.56Å; E43-D165 WeakPolarHBondContact CA-O 3.26Å; E43-L166 HydrophobicContact CB-CD2 4.06Å; E43-L166 HydrophobicContact CG-CD2 3.77Å; E43-L166 HydrophobicContact CG-CG 4.46Å
44	K	75.3	Confident	80.4	Confident	21 Å²	21	48.3 Å²	48.3	9%	0.091	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	114.4	170.2	-168	177.4	-178.5	-177.3	0	108.8	F46 Q50 Y52 N164 D165 F167 E213	K44-F46 HydrophobicContact CD-CE1 4.24Å; K44-F46 HydrophobicContact CD-CZ 3.8Å; K44-F46 HydrophobicContact CG-CE1 4.44Å; K44-F46 HydrophobicContact CG-CE2 4.42Å; K44-F46 HydrophobicContact CG-CZ 4.08Å; K44-Q50 VanDerWaalsContact CE-CD 3.49Å; K44-Y52 HydrophobicContact CB-CD1 3.94Å; K44-Y52 HydrophobicContact CB-CE1 3.63Å; K44-Y52 HydrophobicContact CD-CE1 3.92Å; K44-Y52 HydrophobicContact CG-CD1 4.17Å; K44-Y52 HydrophobicContact CG-CE1 3.59Å; K44-N164 WeakPolarHBondContact O-CA 3.42Å; K44-N164 WeakPolarHBondContact O-CB 3.25Å; K44-D165 HydrophobicContact CB-CB 4.02Å; K44-D165 WeakPolarHBondContact CD-OD2 3.43Å; K44-D165 PolarHBondContact N-O 2.99Å; K44-D165 PolarHBondContact O-N 2.74Å; K44-F167 HydrophobicContact CB-CE2 4.16Å; K44-E213 IonicContact NZ-OE1 2.69Å
45	R	76.8	Confident	80.3	Confident	12 Å²	12	49.9 Å²	49.9	5%	0.045	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	136.6	177.6	-68.9	-171.1	172.4	170.2	6.4	109.8	E43 Q50 H51 V53	E43-R45 HydrophobicContact CG-CG 4.12Å; E43-R45 VanDerWaalsContact OE1-CG 3.3Å; E43-R45 WeakPolarHBondContact OE1-CG 3.19Å; E43-R45 IonicContact OE1-CZ 3.92Å; E43-R45 IonicContact OE1-NE 3.39Å; E43-R45 PolarHBondContact OE1-NE 3.3Å; E43-R45 IonicContact OE1-NH2 2.93Å; E43-R45 IonicContact OE2-CZ 2.79Å; E43-R45 IonicContact OE2-NE 3.51Å; E43-R45 PolarHBondContact OE2-NE 2.8Å; E43-R45 IonicContact OE2-NH2 2.76Å; E43-R45 PolarHBondContact OE2-NH2 3.43Å; R45-Q50 CarbonylContact O-C 3.59Å; R45-Q50 WeakPolarHBondContact O-CA 3.35Å; R45-H51 VanDerWaalsContact CB-CE1 3.42Å; R45-H51 WeakPolarHBondContact CB-CE1 3.22Å; R45-H51 PolarHBondContact N-O 3.13Å; R45-H51 PolarHBondContact O-N 3.32Å; R45-V53 HydrophobicContact CG-CG2 4.35Å
46	F	63.8	Low	80.3	Confident	41 Å²	41	42.9 Å²	42.9	18%	0.18	22%	0.215	C	C	.	.			trans	-101.4	-9	-176.4	-66.2	-79.5	0	0	0	114.5	K44 S49 Q50 K162 R163	K44-F46 HydrophobicContact CD-CE1 4.24Å; K44-F46 HydrophobicContact CD-CZ 3.8Å; K44-F46 HydrophobicContact CG-CE1 4.44Å; K44-F46 HydrophobicContact CG-CE2 4.42Å; K44-F46 HydrophobicContact CG-CZ 4.08Å; F46-S49 CarbonylContact C-O 3.52Å; F46-S49 CarbonylContact O-C 3.52Å; F46-Q50 HydrophobicContact CD1-CG 4.38Å; F46-Q50 HydrophobicContact CE1-CG 4.47Å; F46-K162 HydrophobicContact CD1-CD 4.29Å; F46-K162 HydrophobicContact CD2-CB 4.12Å; F46-K162 HydrophobicContact CE1-CD 4.33Å; F46-K162 HydrophobicContact CE2-CB 4.4Å; F46-K162 HydrophobicContact CG-CB 4.42Å; F46-R163 WeakPolarHBondContact CE2-O 3.48Å
47	F	62.1	Low	80.4	Confident	133 Å²	133	41.4 Å²	41.4	58%	0.583	21%	0.209	S	C	*	.	S	Bend	trans	-128.5	137.4	-178	-178.2	-88.8	0	0	0	110.1	S49 H51 P156	F47-S49 VanDerWaalsContact C-N 3.31Å; F47-H51 PolarHBondContact O-CE1 2.83Å; F47-P156 HydrophobicContact CD1-CB 4.33Å
48	P	59.6	Low	80.4	Confident	109 Å²	109	41 Å²	41	71%	0.708	21%	0.206	S	C	*	.	S	Bend	cis	-73.6	-16	1.1	31.1	-36.6	0	0	0	114
49	S	70.4	Confident	80.6	Confident	75 Å²	75	39.7 Å²	39.7	52%	0.524	20%	0.199	S	C	.	.	S	Bend	trans	-146	170.9	171.2	62.5	0	0	0	0	109.7	F46 F47 H51	F46-S49 CarbonylContact C-O 3.52Å; F46-S49 CarbonylContact O-C 3.52Å; F47-S49 VanDerWaalsContact C-N 3.31Å; S49-H51 PolarHBondContact O-N 2.83Å; S49-H51 PolarHBondContact O-ND1 2.67Å
50	Q	70.2	Confident	80.9	Confident	114 Å²	114	39.6 Å²	39.6	53%	0.533	20%	0.197	S	C	.	.	S	Bend	trans	-68.3	114.9	177.2	-173.1	177.4	-94.1	0	0	111.1	K44 R45 F46	K44-Q50 VanDerWaalsContact CE-CD 3.49Å; R45-Q50 CarbonylContact O-C 3.59Å; R45-Q50 WeakPolarHBondContact O-CA 3.35Å; F46-Q50 HydrophobicContact CD1-CG 4.38Å; F46-Q50 HydrophobicContact CE1-CG 4.47Å
51	H	72.7	Confident	81.3	Confident	52 Å²	52	39 Å²	39	24%	0.241	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	169.2	177.5	66.4	-77.8	0	0	0	111.5	R45 F47 S49	R45-H51 VanDerWaalsContact CB-CE1 3.42Å; R45-H51 WeakPolarHBondContact CB-CE1 3.22Å; R45-H51 PolarHBondContact N-O 3.13Å; R45-H51 PolarHBondContact O-N 3.32Å; F47-H51 PolarHBondContact O-CE1 2.83Å; S49-H51 PolarHBondContact O-N 2.83Å; S49-H51 PolarHBondContact O-ND1 2.67Å
52	Y	80.6	Confident	81.8	Confident	44 Å²	44	43 Å²	43	17%	0.173	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.5	176.3	-63.6	-86.9	0	0	0	110.5	F42 E43 K44 R115	F42-Y52 AromaticContact CD2-CD1 3.98Å; F42-Y52 HydrophobicContact CD2-CD1 3.98Å; F42-Y52 HydrophobicContact CE2-CD1 4.25Å; F42-Y52 HydrophobicContact CE2-CE1 4.42Å; E43-Y52 WeakPolarHBondContact O-CA 3.3Å; K44-Y52 HydrophobicContact CB-CD1 3.94Å; K44-Y52 HydrophobicContact CB-CE1 3.63Å; K44-Y52 HydrophobicContact CD-CE1 3.92Å; K44-Y52 HydrophobicContact CG-CD1 4.17Å; K44-Y52 HydrophobicContact CG-CE1 3.59Å; Y52-R115 PolarHBondContact OH-NH1 3.41Å
53	V	86.9	Confident	82	Confident	6 Å²	6	50.6 Å²	50.6	4%	0.036	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.6	171.1	-64.3	0	0	0	0	110.3	F42 E43 R45 Y69 T71	F42-V53 CarbonylContact C-O 3.59Å; F42-V53 WeakPolarHBondContact CA-O 3.48Å; F42-V53 VanDerWaalsContact CB-O 3.3Å; F42-V53 WeakPolarHBondContact CB-O 3.37Å; E43-V53 HydrophobicContact CB-CG2 3.79Å; E43-V53 PolarHBondContact N-O 2.86Å; E43-V53 PolarHBondContact O-N 3.38Å; R45-V53 HydrophobicContact CG-CG2 4.35Å; V53-Y69 HydrophobicContact CG2-CD1 3.81Å; V53-Y69 HydrophobicContact CG2-CG 4.39Å; V53-T71 HydrophobicContact CG1-CG2 3.78Å
54	Y	88.7	Confident	82.5	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	135.9	173.9	-67.8	-89.1	0	0	0	109.6	L39 G41 F42 Y69 R70 Y72 I75 L122	L39-Y54 HydrophobicContact CD1-CD1 4.15Å; L39-Y54 HydrophobicContact CD1-CG 4.47Å; L39-Y54 HydrophobicContact CD2-CD1 4.44Å; G41-Y54 WeakPolarHBondContact O-CA 3.35Å; F42-Y54 HydrophobicContact CB-CD1 3.97Å; F42-Y54 HydrophobicContact CB-CE1 4.23Å; F42-Y54 HydrophobicContact CB-CG 4.45Å; Y54-Y69 WeakPolarHBondContact O-CA 3.17Å; Y54-R70 PolarHBondContact N-O 3.39Å; Y54-R70 PolarHBondContact O-N 3.17Å; Y54-R70 VanDerWaalsContact O-N 3.08Å; Y54-Y72 HydrophobicContact CE2-CD2 4.23Å; Y54-I75 HydrophobicContact CD2-CD1 4.05Å; Y54-I75 HydrophobicContact CG-CD1 4.43Å; Y54-L122 HydrophobicContact CD1-CD1 3.52Å; Y54-L122 HydrophobicContact CD2-CD1 3.95Å; Y54-L122 HydrophobicContact CE1-CD1 3.42Å; Y54-L122 VanDerWaalsContact CE1-CD1 3.42Å; Y54-L122 HydrophobicContact CE2-CD1 3.89Å; Y54-L122 HydrophobicContact CG-CD1 3.79Å
55	R	91.3	Very high	83.4	Confident	37 Å²	37	56 Å²	56	14%	0.14	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	103	-173.9	-67.4	179.6	61.9	-111.2	-2.3	109.5	L40 G41 L67 Y69	L40-R55 HydrophobicContact CB-CB 4.32Å; L40-R55 PolarHBondContact N-O 2.85Å; L40-R55 PolarHBondContact O-NH1 2.84Å; G41-R55 PolarHBondContact O-N 2.89Å; R55-L67 HydrophobicContact CB-CD1 4.28Å; R55-Y69 HydrophobicContact CG-CD1 3.92Å; R55-Y69 HydrophobicContact CG-CE1 3.79Å
56	L	92.7	Very high	84.1	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119.1	-173.3	-64.2	158.8	0	0	0	109.5	V37 E38 L39 L67 I68 R70 F146	V37-L56 HydrophobicContact CG1-CB 4.34Å; V37-L56 HydrophobicContact CG1-CD2 3.73Å; E38-L56 CarbonylContact O-C 3.46Å; E38-L56 WeakPolarHBondContact O-CA 3.26Å; L39-L56 HydrophobicContact CB-CD2 4.18Å; L39-L56 HydrophobicContact CD1-CD2 3.66Å; L39-L56 HydrophobicContact CD1-CG 4.19Å; L39-L56 HydrophobicContact CG-CD2 4.47Å; L56-L67 WeakPolarHBondContact O-CA 3.28Å; L56-I68 HydrophobicContact CB-CD1 4.32Å; L56-I68 HydrophobicContact CB-CG1 3.75Å; L56-I68 HydrophobicContact CD1-CD1 4.28Å; L56-I68 HydrophobicContact CD1-CG1 4.32Å; L56-I68 PolarHBondContact N-O 3.12Å; L56-I68 PolarHBondContact O-N 3.44Å; L56-R70 HydrophobicContact CD1-CB 4.21Å; L56-R70 HydrophobicContact CD1-CG 4.04Å; L56-F146 HydrophobicContact CD1-CE1 4.39Å
57	M	93.3	Very high	85.4	Confident	42 Å²	42	59.5 Å²	59.5	21%	0.207	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	116.5	167.2	-174.5	64.7	83	0	0	108.6	V37 E38 L40 E65 K66 L67	V37-M57 WeakPolarHBondContact CA-O 3.45Å; E38-M57 HydrophobicContact CB-CB 4.3Å; E38-M57 PolarHBondContact N-O 3.32Å; E38-M57 PolarHBondContact O-N 2.87Å; L40-M57 HydrophobicContact CD1-CB 4.09Å; L40-M57 HydrophobicContact CD1-CE 4.34Å; L40-M57 HydrophobicContact CG-CB 4.17Å; M57-E65 HydrophobicContact SD-CB 4.21Å; M57-K66 VanDerWaalsContact SD-C 3.56Å; M57-L67 HydrophobicContact CE-CB 4.4Å; M57-L67 HydrophobicContact SD-CB 4.4Å
58	V	94.8	Very high	86.9	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	125.6	-179.3	-174.4	0	0	0	0	108.8	V34 W60 E65 K66 I68 F146	V34-V58 HydrophobicContact CB-CG1 4.49Å; V34-V58 HydrophobicContact CG1-CG1 3.84Å; V34-V58 HydrophobicContact CG2-CG1 3.99Å; V58-W60 HydrophobicContact CG1-CD2 4.17Å; V58-W60 HydrophobicContact CG1-CG 4.48Å; V58-W60 HydrophobicContact CG1-CZ2 3.88Å; V58-E65 WeakPolarHBondContact O-CA 3.32Å; V58-K66 PolarHBondContact N-O 2.7Å; V58-K66 PolarHBondContact O-N 3.09Å; V58-I68 HydrophobicContact CG2-CD1 3.74Å; V58-I68 HydrophobicContact CG2-CG1 3.99Å; V58-F146 HydrophobicContact CG1-CB 4.15Å; V58-F146 HydrophobicContact CG2-CB 4.23Å; V58-F146 HydrophobicContact CG2-CD1 3.83Å; V58-F146 HydrophobicContact CG2-CG 4.44Å
59	K	94.4	Very high	88.5	Confident	62 Å²	62	49.6 Å²	49.6	27%	0.27	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.8	173.6	-43.7	-166.7	176.5	-143.7	0	108.9	R35 H36 S64 E65	R35-K59 PolarHBondContact N-O 3.14Å; H36-K59 HydrophobicContact CB-CB 4.07Å; H36-K59 HydrophobicContact CB-CD 4.37Å; H36-K59 HydrophobicContact CB-CG 4.21Å; H36-K59 PolarHBondContact N-O 3.17Å; H36-K59 VanDerWaalsContact N-O 3.09Å; H36-K59 PolarHBondContact O-N 2.84Å; K59-S64 WeakPolarHBondContact CA-O 3.33Å; K59-E65 HydrophobicContact CB-CG 4.37Å; K59-E65 HydrophobicContact CD-CG 4.13Å; K59-E65 WeakPolarHBondContact CD-OE1 3.44Å; K59-E65 VanDerWaalsContact CE-CD 3.44Å; K59-E65 WeakPolarHBondContact CE-OE1 3.3Å; K59-E65 WeakPolarHBondContact CE-OE2 3.15Å; K59-E65 HydrophobicContact CG-CG 3.96Å; K59-E65 IonicContact NZ-OE1 3.2Å; K59-E65 PolarHBondContact NZ-OE1 3.05Å; K59-E65 IonicContact NZ-OE2 3.56Å; K59-E65 PolarHBondContact NZ-OE2 3.3Å
60	W	93.9	Very high	89.5	Confident	21 Å²	21	46 Å²	46	8%	0.08	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	173.8	-172.1	-64.9	92.6	0	0	0	112.5	I32 Y33 V34 V58 D62 E63 S64 S143 F146 K147	I32-W60 HydrophobicContact CG2-CB 4.09Å; I32-W60 HydrophobicContact CG2-CD2 4.38Å; I32-W60 HydrophobicContact CG2-CE3 3.87Å; Y33-W60 CarbonylContact O-C 3.58Å; Y33-W60 WeakPolarHBondContact O-CA 3.22Å; V34-W60 HydrophobicContact CG2-CE3 3.94Å; V34-W60 HydrophobicContact CG2-CH2 3.91Å; V34-W60 HydrophobicContact CG2-CZ2 4.46Å; V34-W60 HydrophobicContact CG2-CZ3 3.62Å; V58-W60 HydrophobicContact CG1-CD2 4.17Å; V58-W60 HydrophobicContact CG1-CG 4.48Å; V58-W60 HydrophobicContact CG1-CZ2 3.88Å; W60-D62 VanDerWaalsContact C-N 3.26Å; W60-D62 WeakPolarHBondContact CB-OD1 3.36Å; W60-D62 PolarHBondContact O-N 2.72Å; W60-E63 PolarHBondContact O-N 2.76Å; W60-S64 PolarHBondContact N-O 3Å; W60-S143 WeakPolarHBondContact CH2-O 3.33Å; W60-F146 HydrophobicContact CH2-CB 4.2Å; W60-F146 HydrophobicContact CZ2-CB 4.33Å; W60-F146 WeakPolarHBondContact CZ2-O 3.27Å; W60-K147 HydrophobicContact CH2-CB 4.42Å
61	S	92.9	Very high	90.4	Very high	31 Å²	31	41.9 Å²	41.9	22%	0.217	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-17.9	177	60.5	0	0	0	0	114.2	I32 Y33 E63	I32-S61 WeakPolarHBondContact CA-OG 3.31Å; Y33-S61 PolarHBondContact N-OG 2.76Å; Y33-S61 VanDerWaalsContact N-OG 3.07Å; Y33-S61 PolarHBondContact O-N 2.64Å; S61-E63 VanDerWaalsContact C-N 3.26Å
62	D	92.6	Very high	91	Very high	86 Å²	86	39.8 Å²	39.8	46%	0.46	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	16.1	173.2	67.8	-5.7	0	0	0	113.3	W60 S64	W60-D62 VanDerWaalsContact C-N 3.26Å; W60-D62 WeakPolarHBondContact CB-OD1 3.36Å; W60-D62 PolarHBondContact O-N 2.72Å; D62-S64 PolarHBondContact O-N 3.39Å; D62-S64 VanDerWaalsContact O-N 3.1Å; D62-S64 VanDerWaalsContact OD1-CB 3.24Å; D62-S64 WeakPolarHBondContact OD1-CB 3.29Å; D62-S64 PolarHBondContact OD1-N 2.74Å; D62-S64 PolarHBondContact OD1-OG 3.46Å
63	E	88.9	Confident	91.2	Very high	163 Å²	163	41.1 Å²	41.1	76%	0.762	21%	0.207	S	C	*	.	S	Bend	trans	62.9	6.1	-176.3	-49.9	-168.1	148.3	0	0	115	W60 S61	W60-E63 PolarHBondContact O-N 2.76Å; S61-E63 VanDerWaalsContact C-N 3.26Å
64	S	91.6	Very high	91.4	Very high	40 Å²	40	43.4 Å²	43.4	28%	0.28	22%	0.217	S	C	.	.			trans	-71.8	138.6	174.6	71.1	0	0	0	0	112	K59 W60 D62	K59-S64 WeakPolarHBondContact CA-O 3.33Å; W60-S64 PolarHBondContact N-O 3Å; D62-S64 PolarHBondContact O-N 3.39Å; D62-S64 VanDerWaalsContact O-N 3.1Å; D62-S64 VanDerWaalsContact OD1-CB 3.24Å; D62-S64 WeakPolarHBondContact OD1-CB 3.29Å; D62-S64 PolarHBondContact OD1-N 2.74Å; D62-S64 PolarHBondContact OD1-OG 3.46Å
65	E	93.6	Very high	91.5	Very high	103 Å²	103	43.5 Å²	43.5	48%	0.481	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.8	173	-57.2	-160.9	-173.6	0	0	110.1	M57 V58 K59	M57-E65 HydrophobicContact SD-CB 4.21Å; V58-E65 WeakPolarHBondContact O-CA 3.32Å; K59-E65 HydrophobicContact CB-CG 4.37Å; K59-E65 HydrophobicContact CD-CG 4.13Å; K59-E65 WeakPolarHBondContact CD-OE1 3.44Å; K59-E65 VanDerWaalsContact CE-CD 3.44Å; K59-E65 WeakPolarHBondContact CE-OE1 3.3Å; K59-E65 WeakPolarHBondContact CE-OE2 3.15Å; K59-E65 HydrophobicContact CG-CG 3.96Å; K59-E65 IonicContact NZ-OE1 3.2Å; K59-E65 PolarHBondContact NZ-OE1 3.05Å; K59-E65 IonicContact NZ-OE2 3.56Å; K59-E65 PolarHBondContact NZ-OE2 3.3Å
66	K	91.3	Very high	91.2	Very high	80 Å²	80	43.9 Å²	43.9	35%	0.348	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	129.5	-175.7	-72.3	-70.3	-162.8	163.1	0	111.5	M57 V58 V148 E153	M57-K66 VanDerWaalsContact SD-C 3.56Å; V58-K66 PolarHBondContact N-O 2.7Å; V58-K66 PolarHBondContact O-N 3.09Å; K66-V148 HydrophobicContact CB-CG2 3.49Å; K66-V148 VanDerWaalsContact CB-CG2 3.49Å; K66-V148 HydrophobicContact CD-CG2 3.88Å; K66-V148 HydrophobicContact CG-CG2 3.57Å; K66-E153 IonicContact NZ-OE1 2.88Å; K66-E153 PolarHBondContact NZ-OE1 2.55Å
67	L	90.9	Very high	90.9	Very high	47 Å²	47	47.9 Å²	47.9	25%	0.246	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	128.4	172.5	-178.6	60.7	0	0	0	110.2	L40 R55 L56 M57 Y69	L40-L67 HydrophobicContact CD1-CD1 4.04Å; R55-L67 HydrophobicContact CB-CD1 4.28Å; L56-L67 WeakPolarHBondContact O-CA 3.28Å; M57-L67 HydrophobicContact CE-CB 4.4Å; M57-L67 HydrophobicContact SD-CB 4.4Å; L67-Y69 HydrophobicContact CD2-CE2 4.49Å; L67-Y69 WeakPolarHBondContact CD2-OH 3.34Å; L67-Y69 HydrophobicContact CG-CE2 4.3Å
68	I	94.1	Very high	91	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	162.4	174.3	71	173.9	0	0	0	111.5	L56 V58 R70 F146 V148 D152	L56-I68 HydrophobicContact CB-CD1 4.32Å; L56-I68 HydrophobicContact CB-CG1 3.75Å; L56-I68 HydrophobicContact CD1-CD1 4.28Å; L56-I68 HydrophobicContact CD1-CG1 4.32Å; L56-I68 PolarHBondContact N-O 3.12Å; L56-I68 PolarHBondContact O-N 3.44Å; V58-I68 HydrophobicContact CG2-CD1 3.74Å; V58-I68 HydrophobicContact CG2-CG1 3.99Å; I68-R70 HydrophobicContact CD1-CG 4.17Å; I68-F146 HydrophobicContact CD1-CB 4.44Å; I68-F146 HydrophobicContact CD1-CD1 3.92Å; I68-V148 HydrophobicContact CG2-CB 4.48Å; I68-V148 HydrophobicContact CG2-CG2 4.09Å; I68-D152 WeakPolarHBondContact CA-OD1 3.38Å; I68-D152 HydrophobicContact CG2-CB 4.44Å
69	Y	91.8	Very high	90.8	Very high	34 Å²	34	46.6 Å²	46.6	13%	0.133	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	121.3	-177.9	-57.8	-93.3	0	0	0	110.3	E43 V53 Y54 R55 L67 D152	E43-Y69 VanDerWaalsContact OE2-CE1 3.28Å; E43-Y69 WeakPolarHBondContact OE2-CE1 3.3Å; V53-Y69 HydrophobicContact CG2-CD1 3.81Å; V53-Y69 HydrophobicContact CG2-CG 4.39Å; Y54-Y69 WeakPolarHBondContact O-CA 3.17Å; R55-Y69 HydrophobicContact CG-CD1 3.92Å; R55-Y69 HydrophobicContact CG-CE1 3.79Å; L67-Y69 HydrophobicContact CD2-CE2 4.49Å; L67-Y69 WeakPolarHBondContact CD2-OH 3.34Å; L67-Y69 HydrophobicContact CG-CE2 4.3Å; Y69-D152 HydrophobicContact CD2-CB 4.37Å; Y69-D152 PolarHBondContact N-OD1 3.42Å
70	R	91.9	Very high	90.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	134.2	-179.8	-59.2	-69	174.1	-94.1	-2.8	111	Y54 L56 I68 I75 F145 K147 D152	Y54-R70 PolarHBondContact N-O 3.39Å; Y54-R70 PolarHBondContact O-N 3.17Å; Y54-R70 VanDerWaalsContact O-N 3.08Å; L56-R70 HydrophobicContact CD1-CB 4.21Å; L56-R70 HydrophobicContact CD1-CG 4.04Å; I68-R70 HydrophobicContact CD1-CG 4.17Å; R70-I75 HydrophobicContact CB-CD1 4.31Å; R70-I75 HydrophobicContact CB-CG1 4.01Å; R70-F145 HydrophobicContact CB-CZ 4.12Å; R70-F145 HydrophobicContact CG-CE1 4.21Å; R70-F145 HydrophobicContact CG-CZ 3.85Å; R70-F145 PolarHBondContact NE-O 3.04Å; R70-F145 PolarHBondContact NH2-O 2.73Å; R70-K147 PolarHBondContact NH2-O 3.47Å; R70-D152 IonicContact CZ-OD1 2.73Å; R70-D152 IonicContact CZ-OD2 2.85Å; R70-D152 VanDerWaalsContact NH1-CG 3.27Å; R70-D152 IonicContact NH1-OD1 2.81Å; R70-D152 PolarHBondContact NH1-OD1 2.89Å; R70-D152 IonicContact NH1-OD2 3.23Å; R70-D152 PolarHBondContact NH1-OD2 3.39Å; R70-D152 IonicContact NH2-OD2 3.92Å; R70-D152 PolarHBondContact NH2-OD2 3.48Å
71	T	88.7	Confident	90.2	Very high	27 Å²	27	49.7 Å²	49.7	17%	0.166	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	158.5	174.9	64.5	0	0	0	0	111.5	V53 E74 I75	V53-T71 HydrophobicContact CG1-CG2 3.78Å; T71-E74 WeakPolarHBondContact CB-OE2 3.14Å; T71-E74 WeakPolarHBondContact CG2-OE2 3.41Å; T71-E74 PolarHBondContact N-OE2 3.15Å; T71-E74 PolarHBondContact O-N 2.74Å; T71-E74 VanDerWaalsContact OG1-CG 3.32Å; T71-E74 WeakPolarHBondContact OG1-CG 3.39Å; T71-E74 PolarHBondContact OG1-N 3.12Å; T71-E74 PolarHBondContact OG1-OE2 2.63Å; T71-I75 WeakPolarHBondContact O-CG1 3.4Å; T71-I75 PolarHBondContact O-N 3.32Å; T71-I75 VanDerWaalsContact O-N 3.15Å
72	Y	86.1	Confident	90.1	Very high	7 Å²	7	48.2 Å²	48.2	3%	0.027	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-42.8	175.7	-162.2	-99.8	0	0	0	113.9	Y54 E74 I75 H76 L103 P104 P106 R118 L122	Y54-Y72 HydrophobicContact CE2-CD2 4.23Å; Y72-E74 VanDerWaalsContact C-N 3.3Å; Y72-E74 PolarHBondContact O-N 2.9Å; Y72-I75 PolarHBondContact O-N 3.13Å; Y72-H76 HydrophobicContact CE1-CB 4.44Å; Y72-H76 WeakPolarHBondContact O-CB 3.2Å; Y72-H76 PolarHBondContact O-N 3.47Å; Y72-L103 HydrophobicContact CE2-CD1 4.25Å; Y72-L103 HydrophobicContact CE2-CD2 4.48Å; Y72-L103 HydrophobicContact CE2-CG 4.49Å; Y72-L103 WeakPolarHBondContact OH-CG 3.14Å; Y72-P104 WeakPolarHBondContact OH-CD 3.31Å; Y72-P104 WeakPolarHBondContact OH-CG 3.4Å; Y72-P104 PolarHBondContact OH-O 3.42Å; Y72-P106 HydrophobicContact CD1-CB 3.96Å; Y72-P106 HydrophobicContact CD1-CG 3.98Å; Y72-P106 HydrophobicContact CE1-CB 4.22Å; Y72-P106 HydrophobicContact CE1-CG 4.06Å; Y72-R118 HydrophobicContact CE2-CG 4.22Å; Y72-L122 HydrophobicContact CD2-CD1 4.07Å; Y72-L122 HydrophobicContact CD2-CD2 4.38Å; Y72-L122 HydrophobicContact CE2-CD1 4.24Å; Y72-L122 HydrophobicContact CE2-CD2 4.03Å; Y72-L122 HydrophobicContact CE2-CG 4.25Å
73	P	85	Confident	90	Very high	73 Å²	73	47.6 Å²	47.6	47%	0.474	24%	0.241	S	C	.	.	H	α-helix	trans	-61.2	-34	176.3	-25.5	37.2	0	0	0	113.7	T77	P73-T77 VanDerWaalsContact O-CB 3.3Å; P73-T77 WeakPolarHBondContact O-CB 3.4Å; P73-T77 PolarHBondContact O-N 2.9Å; P73-T77 PolarHBondContact O-OG1 2.78Å
74	E	90.5	Very high	90.1	Very high	53 Å²	53	44.9 Å²	44.9	25%	0.248	23%	0.228	C	C	.	.	H	α-helix	trans	-66.6	-48.8	173.4	-72.9	168.9	97	0	0	111.6	T71 Y72 H76 T77 F78 F145 R149	T71-E74 WeakPolarHBondContact CB-OE2 3.14Å; T71-E74 WeakPolarHBondContact CG2-OE2 3.41Å; T71-E74 PolarHBondContact N-OE2 3.15Å; T71-E74 PolarHBondContact O-N 2.74Å; T71-E74 VanDerWaalsContact OG1-CG 3.32Å; T71-E74 WeakPolarHBondContact OG1-CG 3.39Å; T71-E74 PolarHBondContact OG1-N 3.12Å; T71-E74 PolarHBondContact OG1-OE2 2.63Å; Y72-E74 VanDerWaalsContact C-N 3.3Å; Y72-E74 PolarHBondContact O-N 2.9Å; E74-H76 VanDerWaalsContact C-N 3.25Å; E74-H76 PolarHBondContact O-N 2.88Å; E74-T77 PolarHBondContact O-N 3.03Å; E74-T77 VanDerWaalsContact O-N 3.14Å; E74-F78 WeakPolarHBondContact O-CB 3.5Å; E74-F78 PolarHBondContact O-N 2.99Å; E74-F145 HydrophobicContact CB-CE2 4.35Å; E74-R149 IonicContact OE1-CZ 3.74Å; E74-R149 VanDerWaalsContact OE1-CZ 3.23Å; E74-R149 IonicContact OE1-NH1 3.79Å; E74-R149 PolarHBondContact OE1-NH1 2.85Å; E74-R149 IonicContact OE1-NH2 2.9Å; E74-R149 PolarHBondContact OE1-NH2 3.42Å
75	I	91.2	Very high	90.1	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-59.7	-39.5	179.4	-56.9	160	0	0	0	110.2	Y54 R70 T71 Y72 H79 L103 L122 Y125 F145	Y54-I75 HydrophobicContact CD2-CD1 4.05Å; Y54-I75 HydrophobicContact CG-CD1 4.43Å; R70-I75 HydrophobicContact CB-CD1 4.31Å; R70-I75 HydrophobicContact CB-CG1 4.01Å; T71-I75 WeakPolarHBondContact O-CG1 3.4Å; T71-I75 PolarHBondContact O-N 3.32Å; T71-I75 VanDerWaalsContact O-N 3.15Å; Y72-I75 PolarHBondContact O-N 3.13Å; I75-H79 WeakPolarHBondContact O-CB 3.34Å; I75-H79 PolarHBondContact O-N 3.43Å; I75-L103 HydrophobicContact CG2-CD2 3.93Å; I75-L122 HydrophobicContact CD1-CD1 4.18Å; I75-L122 HydrophobicContact CD1-CD2 3.95Å; I75-L122 HydrophobicContact CG2-CD2 3.82Å; I75-Y125 HydrophobicContact CG2-CD1 4.38Å; I75-Y125 HydrophobicContact CG2-CE1 3.94Å; I75-F145 HydrophobicContact CB-CZ 4.24Å; I75-F145 HydrophobicContact CG1-CE1 4.44Å; I75-F145 HydrophobicContact CG1-CZ 3.76Å
76	H	85.9	Confident	90.2	Very high	46 Å²	46	43.8 Å²	43.8	21%	0.213	22%	0.219	C	C	.	.	H	α-helix	trans	-73.3	-34.2	176	-177.9	-90.1	0	0	0	113.9	Y72 E74 H79 K80 L103 P106	Y72-H76 HydrophobicContact CE1-CB 4.44Å; Y72-H76 WeakPolarHBondContact O-CB 3.2Å; Y72-H76 PolarHBondContact O-N 3.47Å; E74-H76 VanDerWaalsContact C-N 3.25Å; E74-H76 PolarHBondContact O-N 2.88Å; H76-H79 WeakPolarHBondContact O-CB 3.5Å; H76-H79 PolarHBondContact O-N 3.37Å; H76-K80 PolarHBondContact O-N 3.42Å; H76-L103 HydrophobicContact CB-CD2 3.99Å; H76-P106 HydrophobicContact CB-CG 3.89Å
77	T	86.1	Confident	90.2	Very high	86 Å²	86	42.2 Å²	42.2	53%	0.528	22%	0.217	S	C	.	.	H	α-helix	trans	-65.4	-45.2	174	-59.8	0	0	0	0	110.5	P73 E74 K80 S81	P73-T77 VanDerWaalsContact O-CB 3.3Å; P73-T77 WeakPolarHBondContact O-CB 3.4Å; P73-T77 PolarHBondContact O-N 2.9Å; P73-T77 PolarHBondContact O-OG1 2.78Å; E74-T77 PolarHBondContact O-N 3.03Å; E74-T77 VanDerWaalsContact O-N 3.14Å; T77-K80 PolarHBondContact O-N 3.41Å; T77-S81 PolarHBondContact O-N 2.94Å
78	F	94.3	Very high	90.2	Very high	8 Å²	8	43.9 Å²	43.9	4%	0.035	23%	0.226	C	C	.	.	H	α-helix	trans	-56.9	-47	169.5	163.8	-103	0	0	0	112	E74 K80 S81 L82 L129 H141 L142 F145	E74-F78 WeakPolarHBondContact O-CB 3.5Å; E74-F78 PolarHBondContact O-N 2.99Å; F78-K80 VanDerWaalsContact C-N 3.29Å; F78-K80 PolarHBondContact O-N 2.71Å; F78-S81 PolarHBondContact O-N 2.99Å; F78-L82 HydrophobicContact CZ-CD2 4.35Å; F78-L82 WeakPolarHBondContact O-CB 3.28Å; F78-L82 PolarHBondContact O-N 2.83Å; F78-L129 HydrophobicContact CE1-CD1 3.67Å; F78-L129 HydrophobicContact CZ-CD1 4.28Å; F78-H141 AromaticContact CD2-CD2 3.38Å; F78-H141 WeakPolarHBondContact CD2-CD2 3.27Å; F78-H141 AromaticContact CD2-NE2 3.37Å; F78-H141 WeakPolarHBondContact CD2-NE2 3.2Å; F78-H141 AromaticContact CE2-CD2 3.4Å; F78-H141 VanDerWaalsContact CE2-CD2 3.4Å; F78-H141 WeakPolarHBondContact CE2-CD2 3.49Å; F78-H141 AromaticContact CE2-NE2 3.92Å; F78-L142 HydrophobicContact CE2-CB 4.41Å; F78-L142 HydrophobicContact CZ-CB 4.29Å; F78-L142 HydrophobicContact CZ-CD1 4.43Å; F78-L142 HydrophobicContact CZ-CG 4.17Å; F78-F145 HydrophobicContact CB-CD2 3.52Å; F78-F145 HydrophobicContact CB-CE2 3.65Å; F78-F145 HydrophobicContact CB-CG 4.12Å; F78-F145 HydrophobicContact CB-CZ 4.35Å; F78-F145 HydrophobicContact CD1-CD1 4.05Å; F78-F145 HydrophobicContact CD1-CD2 4.28Å; F78-F145 HydrophobicContact CD1-CE1 4.25Å; F78-F145 HydrophobicContact CD1-CE2 4.46Å; F78-F145 HydrophobicContact CD1-CG 4.08Å; F78-F145 HydrophobicContact CD1-CZ 4.46Å; F78-F145 HydrophobicContact CD2-CB 3.56Å; F78-F145 HydrophobicContact CD2-CD1 4.34Å; F78-F145 AromaticContact CD2-CD2 3.84Å; F78-F145 HydrophobicContact CD2-CD2 3.84Å; F78-F145 AromaticContact CD2-CG 3.64Å; F78-F145 HydrophobicContact CD2-CG 3.64Å; F78-F145 HydrophobicContact CE1-CD1 4.22Å; F78-F145 HydrophobicContact CE1-CG 4.44Å; F78-F145 HydrophobicContact CE2-CB 3.69Å; F78-F145 HydrophobicContact CE2-CG 4.05Å; F78-F145 HydrophobicContact CG-CB 4.14Å; F78-F145 HydrophobicContact CG-CD1 4.12Å; F78-F145 AromaticContact CG-CD2 3.61Å; F78-F145 HydrophobicContact CG-CD2 3.61Å; F78-F145 HydrophobicContact CG-CE2 4.04Å; F78-F145 AromaticContact CG-CG 3.66Å; F78-F145 HydrophobicContact CG-CG 3.66Å; F78-F145 HydrophobicContact CG-CZ 4.48Å; F78-F145 HydrophobicContact CZ-CB 4.35Å; F78-F145 HydrophobicContact CZ-CD1 4.46Å; F78-F145 HydrophobicContact CZ-CG 4.44Å
79	H	90.9	Very high	90.2	Very high	8 Å²	8	45.5 Å²	45.5	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-56.1	-43	176.3	-178.9	57.2	0	0	0	112.6	I75 H76 K83 P101 L103 Y125	I75-H79 WeakPolarHBondContact O-CB 3.34Å; I75-H79 PolarHBondContact O-N 3.43Å; H76-H79 WeakPolarHBondContact O-CB 3.5Å; H76-H79 PolarHBondContact O-N 3.37Å; H79-K83 VanDerWaalsContact NE2-CD 3.33Å; H79-K83 WeakPolarHBondContact NE2-CD 3.39Å; H79-K83 WeakPolarHBondContact O-CG 3.31Å; H79-K83 PolarHBondContact O-N 3.1Å; H79-K83 VanDerWaalsContact O-N 3.15Å; H79-P101 PolarHBondContact CE1-O 3.09Å; H79-L103 HydrophobicContact CB-CB 4.25Å; H79-L103 HydrophobicContact CB-CD2 3.98Å; H79-Y125 VanDerWaalsContact CB-OH 3.26Å; H79-Y125 WeakPolarHBondContact CB-OH 3.49Å; H79-Y125 AromaticContact CE1-CE2 3.99Å; H79-Y125 AromaticContact ND1-CE2 3.45Å; H79-Y125 WeakPolarHBondContact ND1-CE2 3.4Å; H79-Y125 AromaticContact ND1-CZ 3.58Å; H79-Y125 PolarHBondContact ND1-OH 2.84Å
80	K	83.4	Confident	89.9	Confident	109 Å²	109	44.3 Å²	44.3	47%	0.474	23%	0.23	S	C	.	.	H	α-helix	trans	-62.5	-51.9	177.4	-176.7	178.6	173.2	-75.6	0	111	H76 T77 F78 L82 K83 E84	H76-K80 PolarHBondContact O-N 3.42Å; T77-K80 PolarHBondContact O-N 3.41Å; F78-K80 VanDerWaalsContact C-N 3.29Å; F78-K80 PolarHBondContact O-N 2.71Å; K80-L82 VanDerWaalsContact C-N 3.33Å; K80-L82 PolarHBondContact O-N 3.29Å; K80-K83 PolarHBondContact O-N 3.36Å; K80-E84 WeakPolarHBondContact CE-OE1 3.39Å; K80-E84 IonicContact NZ-OE1 2.56Å; K80-E84 PolarHBondContact NZ-OE1 2.81Å; K80-E84 IonicContact NZ-OE2 3.14Å; K80-E84 PolarHBondContact NZ-OE2 3.28Å; K80-E84 VanDerWaalsContact NZ-OE2 3.14Å; K80-E84 WeakPolarHBondContact O-CG 3.26Å; K80-E84 PolarHBondContact O-N 3.28Å
81	S	92.6	Very high	89.6	Confident	38 Å²	38	45.1 Å²	45.1	27%	0.266	24%	0.238	S	C	.	.	H	α-helix	trans	-65	-34.4	179.8	-66.1	0	0	0	0	113.2	T77 F78 K83 E84 M85 H141	T77-S81 PolarHBondContact O-N 2.94Å; F78-S81 PolarHBondContact O-N 2.99Å; S81-K83 VanDerWaalsContact C-N 3.35Å; S81-K83 PolarHBondContact O-N 3.02Å; S81-E84 PolarHBondContact O-N 2.76Å; S81-M85 VanDerWaalsContact O-CE 3.25Å; S81-M85 WeakPolarHBondContact O-CE 3.31Å; S81-M85 PolarHBondContact O-N 3.28Å; S81-H141 WeakPolarHBondContact CB-NE2 3.06Å
82	L	91.4	Very high	89.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.3	-46.2	172	-170.2	71.8	0	0	0	111.4	F78 K80 E84 M85 F86 I100 L129 I136	F78-L82 HydrophobicContact CZ-CD2 4.35Å; F78-L82 WeakPolarHBondContact O-CB 3.28Å; F78-L82 PolarHBondContact O-N 2.83Å; K80-L82 VanDerWaalsContact C-N 3.33Å; K80-L82 PolarHBondContact O-N 3.29Å; L82-E84 VanDerWaalsContact C-N 3.31Å; L82-E84 PolarHBondContact O-N 3.02Å; L82-M85 PolarHBondContact O-N 2.92Å; L82-F86 HydrophobicContact CD1-CD2 3.91Å; L82-F86 HydrophobicContact CD1-CE2 3.93Å; L82-F86 HydrophobicContact CG-CD2 4.37Å; L82-F86 WeakPolarHBondContact O-CD2 3.35Å; L82-F86 PolarHBondContact O-N 3.18Å; L82-F86 VanDerWaalsContact O-N 3.13Å; L82-I100 HydrophobicContact CD2-CG2 4.47Å; L82-L129 HydrophobicContact CD2-CD2 3.42Å; L82-L129 VanDerWaalsContact CD2-CD2 3.42Å; L82-I136 HydrophobicContact CD1-CG2 4.06Å
83	K	89.4	Confident	89.1	Confident	73 Å²	73	55.1 Å²	55.1	32%	0.317	29%	0.286	S	S	.	.	H	α-helix	trans	-66.7	-31.1	175.9	-71.3	177.7	56.4	-179.6	0	113.3	H79 K80 S81 F86 A90 Q92 I100	H79-K83 VanDerWaalsContact NE2-CD 3.33Å; H79-K83 WeakPolarHBondContact NE2-CD 3.39Å; H79-K83 WeakPolarHBondContact O-CG 3.31Å; H79-K83 PolarHBondContact O-N 3.1Å; H79-K83 VanDerWaalsContact O-N 3.15Å; K80-K83 PolarHBondContact O-N 3.36Å; S81-K83 VanDerWaalsContact C-N 3.35Å; S81-K83 PolarHBondContact O-N 3.02Å; K83-F86 CarbonylContact O-C 3.49Å; K83-A90 HydrophobicContact CB-CB 3.76Å; K83-A90 HydrophobicContact CD-CB 4.43Å; K83-A90 HydrophobicContact CG-CB 3.7Å; K83-Q92 PolarHBondContact O-NE2 2.98Å; K83-I100 HydrophobicContact CG-CG2 4.2Å
84	E	91.4	Very high	89	Confident	107 Å²	107	54.7 Å²	54.7	50%	0.5	28%	0.28	S	S	.	.	H	α-helix	trans	-70.9	-30.8	177.3	-71.1	171.9	146.8	0	0	112.5	K80 S81 L82	K80-E84 WeakPolarHBondContact CE-OE1 3.39Å; K80-E84 IonicContact NZ-OE1 2.56Å; K80-E84 PolarHBondContact NZ-OE1 2.81Å; K80-E84 IonicContact NZ-OE2 3.14Å; K80-E84 PolarHBondContact NZ-OE2 3.28Å; K80-E84 VanDerWaalsContact NZ-OE2 3.14Å; K80-E84 WeakPolarHBondContact O-CG 3.26Å; K80-E84 PolarHBondContact O-N 3.28Å; S81-E84 PolarHBondContact O-N 2.76Å; L82-E84 VanDerWaalsContact C-N 3.31Å; L82-E84 PolarHBondContact O-N 3.02Å
85	M	92.1	Very high	88.6	Confident	91 Å²	91	61 Å²	61	45%	0.448	31%	0.307	S	S	.	.	H	α-helix	trans	-80.8	-31.5	173.3	-67.6	175.6	-74.2	0	0	113.8	S81 L82 P87 H141	S81-M85 VanDerWaalsContact O-CE 3.25Å; S81-M85 WeakPolarHBondContact O-CE 3.31Å; S81-M85 PolarHBondContact O-N 3.28Å; L82-M85 PolarHBondContact O-N 2.92Å; M85-P87 VanDerWaalsContact O-CD 3.25Å; M85-P87 WeakPolarHBondContact O-CD 3.22Å; M85-H141 HydrophobicContact CE-CB 3.5Å; M85-H141 VanDerWaalsContact CE-CB 3.5Å; M85-H141 WeakPolarHBondContact CE-CD2 2.92Å; M85-H141 HydrophobicContact SD-CB 4.09Å
86	F	94.9	Very high	88.4	Confident	29 Å²	29	71.1 Å²	71.1	13%	0.127	35%	0.345	C	S	.	.			trans	-119.5	67	-176	-60.6	-71.5	0	0	0	111.4	L82 K83 I88 E89 A90 I100 H135 I136 C139	L82-F86 HydrophobicContact CD1-CD2 3.91Å; L82-F86 HydrophobicContact CD1-CE2 3.93Å; L82-F86 HydrophobicContact CG-CD2 4.37Å; L82-F86 WeakPolarHBondContact O-CD2 3.35Å; L82-F86 PolarHBondContact O-N 3.18Å; L82-F86 VanDerWaalsContact O-N 3.13Å; K83-F86 CarbonylContact O-C 3.49Å; F86-I88 PolarHBondContact O-N 3.14Å; F86-E89 HydrophobicContact CB-CB 4.31Å; F86-E89 PolarHBondContact O-N 3.12Å; F86-A90 WeakPolarHBondContact O-CB 3.37Å; F86-A90 PolarHBondContact O-N 3.07Å; F86-I100 HydrophobicContact CB-CD1 3.78Å; F86-H135 AromaticContact CE1-CD2 3.91Å; F86-H135 WeakPolarHBondContact CZ-O 3.49Å; F86-I136 HydrophobicContact CD1-CD1 4.34Å; F86-I136 HydrophobicContact CD1-CG1 3.87Å; F86-I136 HydrophobicContact CD2-CG1 4.27Å; F86-I136 HydrophobicContact CD2-CG2 3.94Å; F86-I136 HydrophobicContact CE1-CG1 3.89Å; F86-I136 HydrophobicContact CE2-CB 4.37Å; F86-I136 HydrophobicContact CE2-CG1 4.29Å; F86-I136 HydrophobicContact CE2-CG2 3.89Å; F86-I136 HydrophobicContact CG-CD1 4.3Å; F86-I136 HydrophobicContact CG-CG1 4.07Å; F86-I136 HydrophobicContact CZ-CB 4.39Å; F86-I136 HydrophobicContact CZ-CG1 4.11Å; F86-I136 HydrophobicContact CZ-CG2 4.41Å; F86-C139 HydrophobicContact CE2-CB 4.24Å; F86-C139 HydrophobicContact CZ-CB 3.96Å
87	P	91.6	Very high	88.4	Confident	47 Å²	47	72.8 Å²	72.8	31%	0.305	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-27.5	-170.3	27.6	-35.8	0	0	0	114.1	M85 Q92	M85-P87 VanDerWaalsContact O-CD 3.25Å; M85-P87 WeakPolarHBondContact O-CD 3.22Å; P87-Q92 HydrophobicContact CB-CB 4.38Å; P87-Q92 VanDerWaalsContact O-CB 3.26Å; P87-Q92 WeakPolarHBondContact O-CB 3.46Å; P87-Q92 PolarHBondContact O-N 3.13Å
88	I	91.5	Very high	88.6	Confident	82 Å²	82	74.2 Å²	74.2	42%	0.421	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-55	175.4	-63.8	165.4	0	0	0	108.5	F86 A90 G91 I93 D97	F86-I88 PolarHBondContact O-N 3.14Å; I88-A90 PolarHBondContact O-N 3.43Å; I88-G91 WeakPolarHBondContact O-CA 3.39Å; I88-G91 PolarHBondContact O-N 3.23Å; I88-I93 HydrophobicContact CG1-CD1 3.85Å; I88-D97 HydrophobicContact CG2-CB 3.71Å
89	E	92.6	Very high	88.4	Confident	34 Å²	34	77.5 Å²	77.5	16%	0.159	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-20.6	-176.4	-56.1	99.8	136.8	0	0	112.9	F86 G91 D97 R98 V99 I100 H135 I136	F86-E89 HydrophobicContact CB-CB 4.31Å; F86-E89 PolarHBondContact O-N 3.12Å; E89-G91 VanDerWaalsContact C-N 3.26Å; E89-D97 WeakPolarHBondContact CA-O 3.24Å; E89-R98 WeakPolarHBondContact O-CA 3.46Å; E89-V99 HydrophobicContact CB-CG2 3.71Å; E89-V99 HydrophobicContact CG-CG2 4.16Å; E89-V99 PolarHBondContact O-N 2.7Å; E89-I100 HydrophobicContact CB-CD1 4.05Å; E89-I100 HydrophobicContact CB-CG1 4.13Å; E89-I100 WeakPolarHBondContact O-CB 3.42Å; E89-I100 WeakPolarHBondContact O-CG1 3.42Å; E89-I100 PolarHBondContact O-N 2.94Å; E89-H135 IonicContact OE1-CD2 3.51Å; E89-H135 IonicContact OE1-CE1 3.6Å; E89-H135 IonicContact OE1-NE2 3.43Å; E89-H135 PolarHBondContact OE1-NE2 2.57Å; E89-I136 HydrophobicContact CB-CD1 3.81Å; E89-I136 HydrophobicContact CG-CD1 3.83Å
90	A	87.3	Confident	88.3	Confident	8 Å²	8	77.3 Å²	77.3	7%	0.066	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-7.3	167.8	0	0	0	0	0	114.2	K83 F86 I88 Q92 I100	K83-A90 HydrophobicContact CB-CB 3.76Å; K83-A90 HydrophobicContact CD-CB 4.43Å; K83-A90 HydrophobicContact CG-CB 3.7Å; F86-A90 WeakPolarHBondContact O-CB 3.37Å; F86-A90 PolarHBondContact O-N 3.07Å; I88-A90 PolarHBondContact O-N 3.43Å; A90-Q92 HydrophobicContact CB-CG 3.95Å; A90-I100 HydrophobicContact CB-CD1 4.25Å
91	G	85.1	Confident	88.6	Confident	17 Å²	17	73 Å²	73	18%	0.175	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	26.7	-179.1	0	0	0	0	0	114.7	I88 E89 D94	I88-G91 WeakPolarHBondContact O-CA 3.39Å; I88-G91 PolarHBondContact O-N 3.23Å; E89-G91 VanDerWaalsContact C-N 3.26Å; G91-D94 CarbonylContact C-O 3.52Å; G91-D94 VanDerWaalsContact CA-O 3.28Å; G91-D94 WeakPolarHBondContact CA-O 3.1Å
92	Q	83.2	Confident	88.1	Confident	113 Å²	113	74.9 Å²	74.9	53%	0.528	37%	0.367	S	S	.	.	S	Bend	trans	-86.1	-19.8	-177.2	-53	-168.5	55.5	0	0	113.2	K83 P87 A90	K83-Q92 PolarHBondContact O-NE2 2.98Å; P87-Q92 HydrophobicContact CB-CB 4.38Å; P87-Q92 VanDerWaalsContact O-CB 3.26Å; P87-Q92 WeakPolarHBondContact O-CB 3.46Å; P87-Q92 PolarHBondContact O-N 3.13Å; A90-Q92 HydrophobicContact CB-CG 3.95Å
93	I	80.5	Confident	87.6	Confident	131 Å²	131	75.5 Å²	75.5	67%	0.672	37%	0.37	S	S	*	.	S	Bend	trans	-100.3	-63.1	179.7	-55.2	-170.2	0	0	0	110.3	I88	I88-I93 HydrophobicContact CG1-CD1 3.85Å
94	D	82.7	Confident	87	Confident	65 Å²	65	74.9 Å²	74.9	35%	0.348	37%	0.374	S	S	.	.			trans	-116.3	145.2	160.1	-165.9	-31	0	0	0	108.7	G91 R96	G91-D94 CarbonylContact C-O 3.52Å; G91-D94 VanDerWaalsContact CA-O 3.28Å; G91-D94 WeakPolarHBondContact CA-O 3.1Å; D94-R96 PolarHBondContact O-N 3.12Å; D94-R96 WeakPolarHBondContact OD1-CB 3.45Å; D94-R96 WeakPolarHBondContact OD1-CG 3.34Å; D94-R96 PolarHBondContact OD1-N 3.01Å
95	K	82.1	Confident	85.8	Confident	184 Å²	184	73 Å²	73	80%	0.8	38%	0.377	S	S	*	.	S	Bend	trans	-69.6	-19.5	173.7	-66.9	175.4	177.2	173.1	0	112.5	R98	K95-R98 WeakPolarHBondContact O-CB 3.2Å
96	R	86.4	Confident	84.4	Confident	217 Å²	217	71.3 Å²	71.3	82%	0.819	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-34.6	179.7	-69.3	172.3	175.1	177.2	-2.1	113.2	D94 R98	D94-R96 PolarHBondContact O-N 3.12Å; D94-R96 WeakPolarHBondContact OD1-CB 3.45Å; D94-R96 WeakPolarHBondContact OD1-CG 3.34Å; D94-R96 PolarHBondContact OD1-N 3.01Å; R96-R98 PolarHBondContact O-N 3.22Å
97	D	86.7	Confident	82.7	Confident	82 Å²	82	76.9 Å²	76.9	44%	0.439	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	1.6	-178.7	-53.3	-38	0	0	0	112.6	I88 E89 V99	I88-D97 HydrophobicContact CG2-CB 3.71Å; E89-D97 WeakPolarHBondContact CA-O 3.24Å; D97-V99 PolarHBondContact O-N 3.34Å
98	R	89.9	Confident	80.3	Confident	116 Å²	116	87 Å²	87	44%	0.438	43%	0.425	S	S	.	.			trans	-72.1	101.5	-175.3	-170.8	-173.1	156.2	-146.1	-15.9	111.9	E89 K95 R96 I100 S102	E89-R98 WeakPolarHBondContact O-CA 3.46Å; K95-R98 WeakPolarHBondContact O-CB 3.2Å; R96-R98 PolarHBondContact O-N 3.22Å; R98-I100 PolarHBondContact NE-O 2.97Å; R98-I100 VanDerWaalsContact NE-O 3.08Å; R98-I100 PolarHBondContact NH2-O 2.94Å; R98-I100 VanDerWaalsContact NH2-O 3.14Å; R98-S102 PolarHBondContact NH2-OG 3.03Å
99	V	90.7	Very high	77.9	Confident	77 Å²	77	85.5 Å²	85.5	47%	0.467	42%	0.419	S	S	.	.			trans	-100.7	-21.9	167.7	-63.8	0	0	0	0	113.2	E89 D97 L132	E89-V99 HydrophobicContact CB-CG2 3.71Å; E89-V99 HydrophobicContact CG-CG2 4.16Å; E89-V99 PolarHBondContact O-N 2.7Å; D97-V99 PolarHBondContact O-N 3.34Å; V99-L132 HydrophobicContact CB-CD2 4.11Å; V99-L132 HydrophobicContact CG2-CD2 4.08Å; V99-L132 WeakPolarHBondContact O-CD2 3.17Å
100	I	89.3	Confident	76.1	Confident	3 Å²	3	86 Å²	86	2%	0.015	42%	0.422	C	S	.	.	S	Bend	trans	-70.8	125.3	-177.4	-66.3	176.1	0	0	0	110.8	L82 K83 F86 E89 A90 R98 L132	L82-I100 HydrophobicContact CD2-CG2 4.47Å; K83-I100 HydrophobicContact CG-CG2 4.2Å; F86-I100 HydrophobicContact CB-CD1 3.78Å; E89-I100 HydrophobicContact CB-CD1 4.05Å; E89-I100 HydrophobicContact CB-CG1 4.13Å; E89-I100 WeakPolarHBondContact O-CB 3.42Å; E89-I100 WeakPolarHBondContact O-CG1 3.42Å; E89-I100 PolarHBondContact O-N 2.94Å; A90-I100 HydrophobicContact CB-CD1 4.25Å; R98-I100 PolarHBondContact NE-O 2.97Å; R98-I100 VanDerWaalsContact NE-O 3.08Å; R98-I100 PolarHBondContact NH2-O 2.94Å; R98-I100 VanDerWaalsContact NH2-O 3.14Å; I100-L132 HydrophobicContact CG1-CD1 4.04Å
101	P	88.6	Confident	74.4	Confident	20 Å²	20	85.8 Å²	85.8	13%	0.13	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-64.5	147.3	179.6	29.3	-38	0	0	0	110.9	H79 Y125 L129	H79-P101 PolarHBondContact CE1-O 3.09Å; P101-Y125 HydrophobicContact CB-CD2 3.95Å; P101-Y125 HydrophobicContact CB-CE2 4.45Å; P101-Y125 HydrophobicContact CG-CD2 3.67Å; P101-Y125 HydrophobicContact CG-CE2 3.84Å; P101-L129 HydrophobicContact CG-CD2 4.07Å; P101-L129 HydrophobicContact CG-CG 4.25Å
102	S	83.4	Confident	72.8	Confident	77 Å²	77	88.2 Å²	88.2	54%	0.538	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-91.6	117.7	-177.5	36.5	0	0	0	0	110.8	R98	R98-S102 PolarHBondContact NH2-OG 3.03Å
103	L	81.2	Confident	71.4	Confident	12 Å²	12	88.2 Å²	88.2	6%	0.063	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-90.1	132.9	168.3	-165.8	74.2	0	0	0	109.9	Y72 I75 H76 H79 L122 Y125	Y72-L103 HydrophobicContact CE2-CD1 4.25Å; Y72-L103 HydrophobicContact CE2-CD2 4.48Å; Y72-L103 HydrophobicContact CE2-CG 4.49Å; Y72-L103 WeakPolarHBondContact OH-CG 3.14Å; I75-L103 HydrophobicContact CG2-CD2 3.93Å; H76-L103 HydrophobicContact CB-CD2 3.99Å; H79-L103 HydrophobicContact CB-CB 4.25Å; H79-L103 HydrophobicContact CB-CD2 3.98Å; L103-L122 HydrophobicContact CD1-CD2 3.74Å; L103-Y125 HydrophobicContact CB-CD2 4.1Å; L103-Y125 HydrophobicContact CB-CE2 3.88Å; L103-Y125 HydrophobicContact CD1-CD1 4.01Å; L103-Y125 HydrophobicContact CD1-CD2 4.12Å; L103-Y125 HydrophobicContact CD1-CE1 4.36Å; L103-Y125 HydrophobicContact CD1-CE2 4.48Å; L103-Y125 HydrophobicContact CD1-CG 3.9Å
104	P	74.9	Confident	70.3	Confident	61 Å²	61	82.1 Å²	82.1	40%	0.396	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-70.6	152.9	176.1	24.8	-28.2	0	0	0	112	Y72 T121	Y72-P104 WeakPolarHBondContact OH-CD 3.31Å; Y72-P104 WeakPolarHBondContact OH-CG 3.4Å; Y72-P104 PolarHBondContact OH-O 3.42Å; P104-T121 HydrophobicContact CG-CG2 4.5Å
105	A	67.4	Low	69.4	Low	67 Å²	67	79.3 Å²	79.3	55%	0.554	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-62.6	150.1	178.8	0	0	0	0	0	112.2	R107	A105-R107 PolarHBondContact O-N 3.29Å
106	P	61.8	Low	68.5	Low	55 Å²	55	74 Å²	74	36%	0.357	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-60.2	130.5	173.3	-20.4	33.7	0	0	0	109.8	Y72 H76	Y72-P106 HydrophobicContact CD1-CB 3.96Å; Y72-P106 HydrophobicContact CD1-CG 3.98Å; Y72-P106 HydrophobicContact CE1-CB 4.22Å; Y72-P106 HydrophobicContact CE1-CG 4.06Å; H76-P106 HydrophobicContact CB-CG 3.89Å
107	R	60.8	Low	67.4	Low	147 Å²	147	68 Å²	68	56%	0.555	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-92.9	133.1	171.7	-67.8	-163.8	-84.8	-126.3	6.8	107.6	A105 V109 E110 S114	A105-R107 PolarHBondContact O-N 3.29Å; R107-V109 PolarHBondContact O-N 2.93Å; R107-V109 VanDerWaalsContact O-N 3.13Å; R107-E110 WeakPolarHBondContact O-CG 3.35Å; R107-S114 PolarHBondContact NH2-OG 3.09Å
108	W	39.5	Very low	66.6	Low	259 Å²	259	64.6 Å²	64.6	98%	0.981	32%	0.321	S	S	*	.	S	Bend	trans	-67.5	-13.9	-173.4	-156.7	75.5	0	0	0	113.4
109	V	42.8	Very low	65.9	Low	51 Å²	51	60.6 Å²	60.6	31%	0.309	31%	0.306	S	S	.	.	S	Bend	trans	-132	138.7	171.6	-176.3	0	0	0	0	107.8	R107 F211 L242	R107-V109 PolarHBondContact O-N 2.93Å; R107-V109 VanDerWaalsContact O-N 3.13Å; V109-F211 HydrophobicContact CG1-CE1 4.12Å; V109-F211 HydrophobicContact CG2-CZ 4.43Å; V109-L242 HydrophobicContact CG1-CB 4.26Å; V109-L242 HydrophobicContact CG1-CD1 3.76Å; V109-L242 HydrophobicContact CG1-CD2 4.01Å; V109-L242 HydrophobicContact CG1-CG 4.22Å
110	E	53.6	Low	65.2	Low	44 Å²	44	61.3 Å²	61.3	21%	0.206	31%	0.307	C	S	.	.			trans	-138.3	121	-175.2	-48.8	-162.2	166.2	0	0	112.2	R107 R115 R118	R107-E110 WeakPolarHBondContact O-CG 3.35Å; E110-R115 HydrophobicContact CB-CG 4.4Å; E110-R115 PolarHBondContact O-NE 3.37Å; E110-R115 PolarHBondContact O-NH2 3.46Å; E110-R118 IonicContact OE1-CZ 2.65Å; E110-R118 IonicContact OE1-NE 3.59Å; E110-R118 IonicContact OE1-NH1 2.99Å; E110-R118 IonicContact OE1-NH2 2.74Å; E110-R118 PolarHBondContact OE1-NH2 3.38Å; E110-R118 IonicContact OE2-CZ 2.95Å; E110-R118 VanDerWaalsContact OE2-CZ 3.29Å; E110-R118 IonicContact OE2-NH1 3.52Å; E110-R118 PolarHBondContact OE2-NH1 3.32Å; E110-R118 IonicContact OE2-NH2 3.49Å
111	S	52.7	Low	64.8	Low	4 Å²	4	63.1 Å²	63.1	3%	0.028	32%	0.318	C	S	.	.			trans	-77.9	178.5	171.9	82.5	0	0	0	0	112.7	K113 S114 R115 D243	S111-K113 PolarHBondContact OG-N 3.38Å; S111-S114 PolarHBondContact OG-N 3.22Å; S111-R115 VanDerWaalsContact C-CZ 3.49Å; S111-R115 VanDerWaalsContact C-NH2 3.28Å; S111-R115 WeakPolarHBondContact O-CG 3.5Å; S111-R115 PolarHBondContact O-N 3.27Å; S111-R115 PolarHBondContact O-NE 3.31Å; S111-R115 PolarHBondContact O-NH2 2.8Å; S111-D243 VanDerWaalsContact CB-OD2 3.25Å; S111-D243 WeakPolarHBondContact CB-OD2 3.49Å; S111-D243 PolarHBondContact OG-OD1 2.9Å; S111-D243 PolarHBondContact OG-OD2 2.96Å
112	Q	51.1	Low	64.8	Low	67 Å²	67	62.2 Å²	62.2	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-60.9	-49.1	165.8	178.5	171.7	-21.2	0	0	112.4	S114 R115 E116 I186	Q112-S114 PolarHBondContact O-N 3.16Å; Q112-R115 WeakPolarHBondContact O-CA 3.2Å; Q112-R115 WeakPolarHBondContact O-CB 3.2Å; Q112-R115 PolarHBondContact O-N 3.09Å; Q112-E116 PolarHBondContact O-N 3.33Å; Q112-I186 HydrophobicContact CB-CG2 4.49Å; Q112-I186 HydrophobicContact CG-CD1 4.31Å; Q112-I186 HydrophobicContact CG-CG2 4.36Å; Q112-I186 VanDerWaalsContact OE1-CB 3.3Å
113	K	53.1	Low	64.9	Low	114 Å²	114	60.5 Å²	60.5	50%	0.496	30%	0.302	S	S	.	.	H	α-helix	trans	-65.1	-37.5	-179.3	-167.8	171.5	-174.6	169.6	0	112.5	S111 R115 E116 I117	S111-K113 PolarHBondContact OG-N 3.38Å; K113-R115 VanDerWaalsContact C-N 3.29Å; K113-R115 PolarHBondContact O-N 2.95Å; K113-E116 PolarHBondContact O-N 3.43Å; K113-I117 HydrophobicContact CG-CD1 4.05Å; K113-I117 WeakPolarHBondContact O-CB 3.46Å; K113-I117 VanDerWaalsContact O-CG1 3.24Å; K113-I117 WeakPolarHBondContact O-CG1 3.45Å; K113-I117 PolarHBondContact O-N 3.24Å
114	S	57.5	Low	65.1	Low	2 Å²	2	65 Å²	65	1%	0.014	32%	0.323	C	S	.	.	H	α-helix	trans	-67.6	-23.1	169.8	-96.8	0	0	0	0	113.8	R107 S111 Q112 R118 D243	R107-S114 PolarHBondContact NH2-OG 3.09Å; S111-S114 PolarHBondContact OG-N 3.22Å; Q112-S114 PolarHBondContact O-N 3.16Å; S114-R118 WeakPolarHBondContact O-CB 3.42Å; S114-R118 WeakPolarHBondContact O-CG 3.36Å; S114-R118 PolarHBondContact O-N 2.74Å; S114-R118 PolarHBondContact O-NH1 2.82Å; S114-D243 WeakPolarHBondContact CB-OD1 3.41Å; S114-D243 PolarHBondContact OG-OD1 2.88Å
115	R	64.1	Low	65.9	Low	6 Å²	6	62.3 Å²	62.3	2%	0.023	31%	0.305	C	S	.	.	H	α-helix	trans	-82.9	-38.4	173.2	-81.8	175	-97.2	120.9	-4.6	111.8	F42 Y52 E110 S111 Q112 K113 R118 K119	F42-R115 HydrophobicContact CZ-CB 4.24Å; Y52-R115 PolarHBondContact OH-NH1 3.41Å; E110-R115 HydrophobicContact CB-CG 4.4Å; E110-R115 PolarHBondContact O-NE 3.37Å; E110-R115 PolarHBondContact O-NH2 3.46Å; S111-R115 VanDerWaalsContact C-CZ 3.49Å; S111-R115 VanDerWaalsContact C-NH2 3.28Å; S111-R115 WeakPolarHBondContact O-CG 3.5Å; S111-R115 PolarHBondContact O-N 3.27Å; S111-R115 PolarHBondContact O-NE 3.31Å; S111-R115 PolarHBondContact O-NH2 2.8Å; Q112-R115 WeakPolarHBondContact O-CA 3.2Å; Q112-R115 WeakPolarHBondContact O-CB 3.2Å; Q112-R115 PolarHBondContact O-N 3.09Å; K113-R115 VanDerWaalsContact C-N 3.29Å; K113-R115 PolarHBondContact O-N 2.95Å; R115-R118 CarbonylContact O-C 3.42Å; R115-R118 WeakPolarHBondContact O-CB 3.5Å; R115-R118 PolarHBondContact O-N 3.24Å; R115-K119 PolarHBondContact O-N 3.1Å
116	E	62.2	Low	67.1	Low	74 Å²	74	59.4 Å²	59.4	35%	0.346	28%	0.28	S	S	.	.	H	α-helix	trans	-70.8	-41.6	176.7	-164.3	57.2	-152.6	0	0	112.5	Q112 K113 R118 K119 I120	Q112-E116 PolarHBondContact O-N 3.33Å; K113-E116 PolarHBondContact O-N 3.43Å; E116-R118 VanDerWaalsContact C-N 3.26Å; E116-R118 PolarHBondContact O-N 3.28Å; E116-K119 WeakPolarHBondContact O-CB 3.26Å; E116-K119 PolarHBondContact O-N 3.33Å; E116-K119 VanDerWaalsContact O-N 3.12Å; E116-K119 WeakPolarHBondContact OE1-CD 3.49Å; E116-K119 WeakPolarHBondContact OE1-CE 3.49Å; E116-K119 IonicContact OE1-NZ 3.04Å; E116-K119 PolarHBondContact OE1-NZ 3.08Å; E116-K119 IonicContact OE2-NZ 3.32Å; E116-I120 PolarHBondContact O-N 3.03Å
117	I	63.8	Low	68.4	Low	90 Å²	90	62 Å²	62	46%	0.462	29%	0.287	S	S	.	.	H	α-helix	trans	-59.8	-39.9	170	-69.1	167.3	0	0	0	110.5	K113 I120 T121	K113-I117 HydrophobicContact CG-CD1 4.05Å; K113-I117 WeakPolarHBondContact O-CB 3.46Å; K113-I117 VanDerWaalsContact O-CG1 3.24Å; K113-I117 WeakPolarHBondContact O-CG1 3.45Å; K113-I117 PolarHBondContact O-N 3.24Å; I117-I120 PolarHBondContact O-N 3.4Å; I117-T121 PolarHBondContact O-N 3.29Å; I117-T121 PolarHBondContact O-OG1 3.48Å
118	R	71.3	Confident	69.9	Low	11 Å²	11	57.6 Å²	57.6	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-67.3	-31.9	174.7	-82.6	-174.2	-159.9	108.2	-19.4	113.6	Y72 E110 S114 R115 E116 I120 T121 L122	Y72-R118 HydrophobicContact CE2-CG 4.22Å; E110-R118 IonicContact OE1-CZ 2.65Å; E110-R118 IonicContact OE1-NE 3.59Å; E110-R118 IonicContact OE1-NH1 2.99Å; E110-R118 IonicContact OE1-NH2 2.74Å; E110-R118 PolarHBondContact OE1-NH2 3.38Å; E110-R118 IonicContact OE2-CZ 2.95Å; E110-R118 VanDerWaalsContact OE2-CZ 3.29Å; E110-R118 IonicContact OE2-NH1 3.52Å; E110-R118 PolarHBondContact OE2-NH1 3.32Å; E110-R118 IonicContact OE2-NH2 3.49Å; S114-R118 WeakPolarHBondContact O-CB 3.42Å; S114-R118 WeakPolarHBondContact O-CG 3.36Å; S114-R118 PolarHBondContact O-N 2.74Å; S114-R118 PolarHBondContact O-NH1 2.82Å; R115-R118 CarbonylContact O-C 3.42Å; R115-R118 WeakPolarHBondContact O-CB 3.5Å; R115-R118 PolarHBondContact O-N 3.24Å; E116-R118 VanDerWaalsContact C-N 3.26Å; E116-R118 PolarHBondContact O-N 3.28Å; R118-I120 VanDerWaalsContact C-N 3.31Å; R118-T121 PolarHBondContact O-N 2.79Å; R118-L122 WeakPolarHBondContact O-CB 3.49Å; R118-L122 WeakPolarHBondContact O-CG 3.29Å; R118-L122 PolarHBondContact O-N 3.26Å
119	K	74.5	Confident	72.4	Confident	31 Å²	31	45.2 Å²	45.2	14%	0.135	23%	0.232	C	C	.	.	H	α-helix	trans	-58.2	-46.8	172.1	170	-175.4	145.8	-153.2	0	109.9	L39 R115 E116 L122 A123 E169	L39-K119 HydrophobicContact CD2-CB 4.29Å; L39-K119 HydrophobicContact CD2-CG 3.93Å; L39-K119 WeakPolarHBondContact CD2-O 3.36Å; L39-K119 HydrophobicContact CG-CG 4.45Å; R115-K119 PolarHBondContact O-N 3.1Å; E116-K119 WeakPolarHBondContact O-CB 3.26Å; E116-K119 PolarHBondContact O-N 3.33Å; E116-K119 VanDerWaalsContact O-N 3.12Å; E116-K119 WeakPolarHBondContact OE1-CD 3.49Å; E116-K119 WeakPolarHBondContact OE1-CE 3.49Å; E116-K119 IonicContact OE1-NZ 3.04Å; E116-K119 PolarHBondContact OE1-NZ 3.08Å; E116-K119 IonicContact OE2-NZ 3.32Å; K119-L122 PolarHBondContact O-N 3.49Å; K119-A123 WeakPolarHBondContact O-CB 3.29Å; K119-A123 PolarHBondContact O-N 3.46Å; K119-E169 IonicContact NZ-OE2 3.74Å; K119-E169 PolarHBondContact NZ-OE2 2.75Å
120	I	75.1	Confident	74.8	Confident	93 Å²	93	43.8 Å²	43.8	48%	0.477	22%	0.223	S	C	.	.	H	α-helix	trans	-60.2	-55.6	174.9	-58.5	170.8	0	0	0	110.4	E116 I117 R118 L122 A123 E124	E116-I120 PolarHBondContact O-N 3.03Å; I117-I120 PolarHBondContact O-N 3.4Å; R118-I120 VanDerWaalsContact C-N 3.31Å; I120-L122 PolarHBondContact O-N 2.86Å; I120-A123 PolarHBondContact O-N 3.45Å; I120-A123 VanDerWaalsContact O-N 3.15Å; I120-E124 HydrophobicContact CG2-CG 4.48Å; I120-E124 WeakPolarHBondContact O-CG 3.26Å; I120-E124 PolarHBondContact O-N 2.83Å
121	T	82.4	Confident	76.7	Confident	40 Å²	40	47.4 Å²	47.4	25%	0.245	24%	0.244	C	C	.	.	H	α-helix	trans	-60.4	-30.9	-179.5	-54.3	0	0	0	0	113.5	P104 I117 R118 Y125	P104-T121 HydrophobicContact CG-CG2 4.5Å; I117-T121 PolarHBondContact O-N 3.29Å; I117-T121 PolarHBondContact O-OG1 3.48Å; R118-T121 PolarHBondContact O-N 2.79Å; T121-Y125 WeakPolarHBondContact O-CB 3.34Å; T121-Y125 PolarHBondContact O-N 3.1Å
122	L	87	Confident	78.7	Confident	2 Å²	2	48 Å²	48	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-77.4	-36.8	177.5	-78.1	170.8	0	0	0	112.5	L39 Y54 Y72 I75 L103 R118 K119 I120 Y125 C126	L39-L122 HydrophobicContact CD2-CB 3.68Å; Y54-L122 HydrophobicContact CD1-CD1 3.52Å; Y54-L122 HydrophobicContact CD2-CD1 3.95Å; Y54-L122 HydrophobicContact CE1-CD1 3.42Å; Y54-L122 VanDerWaalsContact CE1-CD1 3.42Å; Y54-L122 HydrophobicContact CE2-CD1 3.89Å; Y54-L122 HydrophobicContact CG-CD1 3.79Å; Y72-L122 HydrophobicContact CD2-CD1 4.07Å; Y72-L122 HydrophobicContact CD2-CD2 4.38Å; Y72-L122 HydrophobicContact CE2-CD1 4.24Å; Y72-L122 HydrophobicContact CE2-CD2 4.03Å; Y72-L122 HydrophobicContact CE2-CG 4.25Å; I75-L122 HydrophobicContact CD1-CD1 4.18Å; I75-L122 HydrophobicContact CD1-CD2 3.95Å; I75-L122 HydrophobicContact CG2-CD2 3.82Å; L103-L122 HydrophobicContact CD1-CD2 3.74Å; R118-L122 WeakPolarHBondContact O-CB 3.49Å; R118-L122 WeakPolarHBondContact O-CG 3.29Å; R118-L122 PolarHBondContact O-N 3.26Å; K119-L122 PolarHBondContact O-N 3.49Å; I120-L122 PolarHBondContact O-N 2.86Å; L122-Y125 PolarHBondContact O-N 3.3Å; L122-C126 VanDerWaalsContact O-CB 3.3Å; L122-C126 WeakPolarHBondContact O-CB 3.34Å; L122-C126 PolarHBondContact O-N 3.43Å; L122-C126 PolarHBondContact O-SG 3.47Å; L122-C126 VanDerWaalsContact O-SG 3.36Å
123	A	85.9	Confident	80.7	Confident	40 Å²	40	47.6 Å²	47.6	33%	0.331	25%	0.25	S	C	.	.	H	α-helix	trans	-61.9	-52.5	171.9	0	0	0	0	0	110.3	L39 K119 I120 Y125 C126 E127	L39-A123 HydrophobicContact CB-CB 4.28Å; L39-A123 HydrophobicContact CD2-CB 4.43Å; K119-A123 WeakPolarHBondContact O-CB 3.29Å; K119-A123 PolarHBondContact O-N 3.46Å; I120-A123 PolarHBondContact O-N 3.45Å; I120-A123 VanDerWaalsContact O-N 3.15Å; A123-Y125 VanDerWaalsContact C-N 3.28Å; A123-Y125 PolarHBondContact O-N 3.24Å; A123-C126 PolarHBondContact O-N 3.38Å; A123-E127 WeakPolarHBondContact O-CB 3.31Å; A123-E127 PolarHBondContact O-N 2.93Å
124	E	85.9	Confident	82.6	Confident	106 Å²	106	44.9 Å²	44.9	50%	0.495	25%	0.248	S	C	.	.	H	α-helix	trans	-55.4	-42	174.8	-67.1	171.1	158.7	0	0	112	I120 S128	I120-E124 HydrophobicContact CG2-CG 4.48Å; I120-E124 WeakPolarHBondContact O-CG 3.26Å; I120-E124 PolarHBondContact O-N 2.83Å; E124-S128 WeakPolarHBondContact O-CB 3.4Å; E124-S128 PolarHBondContact O-N 3.1Å; E124-S128 PolarHBondContact O-OG 3.01Å
125	Y	91.5	Very high	84.3	Confident	6 Å²	6	49.8 Å²	49.8	2%	0.024	27%	0.271	C	S	.	.	H	α-helix	trans	-67.5	-47	178.7	173.9	-101.1	0	0	0	112.2	I75 H79 P101 L103 T121 L122 A123 S128 L129	I75-Y125 HydrophobicContact CG2-CD1 4.38Å; I75-Y125 HydrophobicContact CG2-CE1 3.94Å; H79-Y125 VanDerWaalsContact CB-OH 3.26Å; H79-Y125 WeakPolarHBondContact CB-OH 3.49Å; H79-Y125 AromaticContact CE1-CE2 3.99Å; H79-Y125 AromaticContact ND1-CE2 3.45Å; H79-Y125 WeakPolarHBondContact ND1-CE2 3.4Å; H79-Y125 AromaticContact ND1-CZ 3.58Å; H79-Y125 PolarHBondContact ND1-OH 2.84Å; P101-Y125 HydrophobicContact CB-CD2 3.95Å; P101-Y125 HydrophobicContact CB-CE2 4.45Å; P101-Y125 HydrophobicContact CG-CD2 3.67Å; P101-Y125 HydrophobicContact CG-CE2 3.84Å; L103-Y125 HydrophobicContact CB-CD2 4.1Å; L103-Y125 HydrophobicContact CB-CE2 3.88Å; L103-Y125 HydrophobicContact CD1-CD1 4.01Å; L103-Y125 HydrophobicContact CD1-CD2 4.12Å; L103-Y125 HydrophobicContact CD1-CE1 4.36Å; L103-Y125 HydrophobicContact CD1-CE2 4.48Å; L103-Y125 HydrophobicContact CD1-CG 3.9Å; T121-Y125 WeakPolarHBondContact O-CB 3.34Å; T121-Y125 PolarHBondContact O-N 3.1Å; L122-Y125 PolarHBondContact O-N 3.3Å; A123-Y125 VanDerWaalsContact C-N 3.28Å; A123-Y125 PolarHBondContact O-N 3.24Å; Y125-S128 PolarHBondContact O-N 3.35Å; Y125-L129 HydrophobicContact CD1-CD1 4.02Å; Y125-L129 HydrophobicContact CE1-CD1 3.43Å; Y125-L129 VanDerWaalsContact CE1-CD1 3.43Å; Y125-L129 HydrophobicContact CE1-CG 4.2Å; Y125-L129 HydrophobicContact CE2-CD1 4.32Å; Y125-L129 HydrophobicContact CE2-CD2 4.42Å; Y125-L129 HydrophobicContact CE2-CG 4.31Å; Y125-L129 VanDerWaalsContact O-CG 3.31Å; Y125-L129 WeakPolarHBondContact O-CG 3.45Å; Y125-L129 PolarHBondContact O-N 3.1Å
126	C	91.6	Very high	85.7	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.034	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-42.5	178.4	-76.3	0	0	0	0	111.8	V37 L122 A123 L129 I130	V37-C126 HydrophobicContact CB-CB 4.21Å; V37-C126 HydrophobicContact CG1-CB 3.92Å; L122-C126 VanDerWaalsContact O-CB 3.3Å; L122-C126 WeakPolarHBondContact O-CB 3.34Å; L122-C126 PolarHBondContact O-N 3.43Å; L122-C126 PolarHBondContact O-SG 3.47Å; L122-C126 VanDerWaalsContact O-SG 3.36Å; A123-C126 PolarHBondContact O-N 3.38Å; C126-L129 PolarHBondContact O-N 3.21Å; C126-I130 PolarHBondContact O-N 2.85Å
127	E	90.2	Very high	87.2	Confident	110 Å²	110	46.5 Å²	46.5	51%	0.514	26%	0.257	S	S	.	.	H	α-helix	trans	-63	-43.8	173.4	-178.3	173.7	-141.2	0	0	111.8	A123 L129 I130 N131	A123-E127 WeakPolarHBondContact O-CB 3.31Å; A123-E127 PolarHBondContact O-N 2.93Å; E127-L129 VanDerWaalsContact C-N 3.3Å; E127-L129 PolarHBondContact O-N 2.86Å; E127-I130 WeakPolarHBondContact O-CG1 3.44Å; E127-N131 PolarHBondContact O-N 3.15Å; E127-N131 PolarHBondContact O-ND2 3.21Å
128	S	91.6	Very high	88.6	Confident	54 Å²	54	47.5 Å²	47.5	38%	0.378	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-38.8	175.6	-65.7	0	0	0	0	112.1	E124 Y125 L132	E124-S128 WeakPolarHBondContact O-CB 3.4Å; E124-S128 PolarHBondContact O-N 3.1Å; E124-S128 PolarHBondContact O-OG 3.01Å; Y125-S128 PolarHBondContact O-N 3.35Å; S128-L132 WeakPolarHBondContact O-CG 3.38Å; S128-L132 PolarHBondContact O-N 3.21Å
129	L	92.9	Very high	89.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.3	-46	-179.5	-78.8	-179.2	0	0	0	113.7	F78 L82 P101 Y125 C126 E127 N131 L132 L142	F78-L129 HydrophobicContact CE1-CD1 3.67Å; F78-L129 HydrophobicContact CZ-CD1 4.28Å; L82-L129 HydrophobicContact CD2-CD2 3.42Å; L82-L129 VanDerWaalsContact CD2-CD2 3.42Å; P101-L129 HydrophobicContact CG-CD2 4.07Å; P101-L129 HydrophobicContact CG-CG 4.25Å; Y125-L129 HydrophobicContact CD1-CD1 4.02Å; Y125-L129 HydrophobicContact CE1-CD1 3.43Å; Y125-L129 VanDerWaalsContact CE1-CD1 3.43Å; Y125-L129 HydrophobicContact CE1-CG 4.2Å; Y125-L129 HydrophobicContact CE2-CD1 4.32Å; Y125-L129 HydrophobicContact CE2-CD2 4.42Å; Y125-L129 HydrophobicContact CE2-CG 4.31Å; Y125-L129 VanDerWaalsContact O-CG 3.31Å; Y125-L129 WeakPolarHBondContact O-CG 3.45Å; Y125-L129 PolarHBondContact O-N 3.1Å; C126-L129 PolarHBondContact O-N 3.21Å; E127-L129 VanDerWaalsContact C-N 3.3Å; E127-L129 PolarHBondContact O-N 2.86Å; L129-N131 PolarHBondContact O-N 3.23Å; L129-L132 HydrophobicContact CD2-CD1 3.88Å; L129-L132 WeakPolarHBondContact O-CB 3.26Å; L129-L132 WeakPolarHBondContact O-CG 2.95Å; L129-L132 PolarHBondContact O-N 3.4Å; L129-L142 HydrophobicContact CB-CD1 4.33Å
130	I	93.4	Very high	90.4	Very high	20 Å²	20	53 Å²	53	10%	0.103	28%	0.281	C	S	.	.	H	α-helix	trans	-68	-27.2	-179.4	58.8	174.1	0	0	0	111.9	V34 V37 C126 E127 L132 S137	V34-I130 HydrophobicContact CB-CG2 4.45Å; V34-I130 HydrophobicContact CG1-CG2 3.82Å; V37-I130 HydrophobicContact CG2-CG2 3.98Å; C126-I130 PolarHBondContact O-N 2.85Å; E127-I130 WeakPolarHBondContact O-CG1 3.44Å; I130-L132 VanDerWaalsContact C-N 3.33Å; I130-S137 VanDerWaalsContact O-CB 3.3Å; I130-S137 WeakPolarHBondContact O-CB 3.32Å
131	N	93.2	Very high	91.2	Very high	121 Å²	121	51.6 Å²	51.6	65%	0.647	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	2.9	176.5	-71.2	-57.9	0	0	0	113.9	E127 L129	E127-N131 PolarHBondContact O-N 3.15Å; E127-N131 PolarHBondContact O-ND2 3.21Å; L129-N131 PolarHBondContact O-N 3.23Å
132	L	93.6	Very high	91.7	Very high	15 Å²	15	49.7 Å²	49.7	8%	0.079	26%	0.26	C	S	.	.	S	Bend	trans	-65.8	160.3	171.6	-70.8	-179.5	0	0	0	111.9	V99 I100 S128 L129 I130 I136 S137	V99-L132 HydrophobicContact CB-CD2 4.11Å; V99-L132 HydrophobicContact CG2-CD2 4.08Å; V99-L132 WeakPolarHBondContact O-CD2 3.17Å; I100-L132 HydrophobicContact CG1-CD1 4.04Å; S128-L132 WeakPolarHBondContact O-CG 3.38Å; S128-L132 PolarHBondContact O-N 3.21Å; L129-L132 HydrophobicContact CD2-CD1 3.88Å; L129-L132 WeakPolarHBondContact O-CB 3.26Å; L129-L132 WeakPolarHBondContact O-CG 2.95Å; L129-L132 PolarHBondContact O-N 3.4Å; I130-L132 VanDerWaalsContact C-N 3.33Å; L132-I136 HydrophobicContact CB-CB 4.19Å; L132-I136 HydrophobicContact CB-CG2 4.42Å; L132-I136 HydrophobicContact CD1-CB 4.29Å; L132-I136 HydrophobicContact CD1-CD1 4.47Å; L132-I136 HydrophobicContact CD1-CG2 3.68Å; L132-S137 VanDerWaalsContact O-CB 3.24Å; L132-S137 WeakPolarHBondContact O-CB 3.4Å; L132-S137 PolarHBondContact O-OG 3.27Å
133	P	94.6	Very high	92	Very high	60 Å²	60	50.6 Å²	50.6	39%	0.39	27%	0.267	S	S	.	.			trans	-48.4	145	171.8	-30.6	37.5	0	0	0	113.4	H135 I136 S137	P133-H135 PolarHBondContact O-N 2.78Å; P133-I136 PolarHBondContact O-N 2.66Å; P133-S137 PolarHBondContact O-N 3.43Å; P133-S137 PolarHBondContact O-OG 2.9Å
134	A	92.4	Very high	92.3	Very high	56 Å²	56	52.5 Å²	52.5	46%	0.463	28%	0.278	S	S	.	.	H	α-helix	trans	-56.9	-28.7	-166.8	0	0	0	0	0	114.8	I136 S137 R138	A134-I136 PolarHBondContact O-N 2.91Å; A134-S137 WeakPolarHBondContact CA-OG 3.46Å; A134-R138 VanDerWaalsContact O-CB 3.27Å; A134-R138 WeakPolarHBondContact O-CB 3.38Å; A134-R138 WeakPolarHBondContact O-CG 3.46Å; A134-R138 PolarHBondContact O-N 3.26Å
135	H	93.2	Very high	92.7	Very high	106 Å²	106	48.4 Å²	48.4	49%	0.491	26%	0.258	S	S	.	.	H	α-helix	trans	-70.3	-17.2	176.8	69.5	-73.6	0	0	0	113.6	F86 E89 P133 C139	F86-H135 AromaticContact CE1-CD2 3.91Å; F86-H135 WeakPolarHBondContact CZ-O 3.49Å; E89-H135 IonicContact OE1-CD2 3.51Å; E89-H135 IonicContact OE1-CE1 3.6Å; E89-H135 IonicContact OE1-NE2 3.43Å; E89-H135 PolarHBondContact OE1-NE2 2.57Å; P133-H135 PolarHBondContact O-N 2.78Å; H135-C139 WeakPolarHBondContact O-CB 3.48Å
136	I	93.4	Very high	92.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-102.2	-52	173.1	-49.3	175.9	0	0	0	110.3	L82 F86 E89 L132 P133 A134 R138 C139	L82-I136 HydrophobicContact CD1-CG2 4.06Å; F86-I136 HydrophobicContact CD1-CD1 4.34Å; F86-I136 HydrophobicContact CD1-CG1 3.87Å; F86-I136 HydrophobicContact CD2-CG1 4.27Å; F86-I136 HydrophobicContact CD2-CG2 3.94Å; F86-I136 HydrophobicContact CE1-CG1 3.89Å; F86-I136 HydrophobicContact CE2-CB 4.37Å; F86-I136 HydrophobicContact CE2-CG1 4.29Å; F86-I136 HydrophobicContact CE2-CG2 3.89Å; F86-I136 HydrophobicContact CG-CD1 4.3Å; F86-I136 HydrophobicContact CG-CG1 4.07Å; F86-I136 HydrophobicContact CZ-CB 4.39Å; F86-I136 HydrophobicContact CZ-CG1 4.11Å; F86-I136 HydrophobicContact CZ-CG2 4.41Å; E89-I136 HydrophobicContact CB-CD1 3.81Å; E89-I136 HydrophobicContact CG-CD1 3.83Å; L132-I136 HydrophobicContact CB-CB 4.19Å; L132-I136 HydrophobicContact CB-CG2 4.42Å; L132-I136 HydrophobicContact CD1-CB 4.29Å; L132-I136 HydrophobicContact CD1-CD1 4.47Å; L132-I136 HydrophobicContact CD1-CG2 3.68Å; P133-I136 PolarHBondContact O-N 2.66Å; A134-I136 PolarHBondContact O-N 2.91Å; I136-R138 PolarHBondContact O-N 3.33Å; I136-C139 WeakPolarHBondContact O-CB 3.2Å; I136-C139 PolarHBondContact O-N 3.11Å; I136-C139 PolarHBondContact O-SG 2.98Å
137	S	93.3	Very high	93	Very high	10 Å²	10	54.5 Å²	54.5	7%	0.07	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-20.1	-175.8	53	0	0	0	0	113.9	I130 L132 P133 A134	I130-S137 VanDerWaalsContact O-CB 3.3Å; I130-S137 WeakPolarHBondContact O-CB 3.32Å; L132-S137 VanDerWaalsContact O-CB 3.24Å; L132-S137 WeakPolarHBondContact O-CB 3.4Å; L132-S137 PolarHBondContact O-OG 3.27Å; P133-S137 PolarHBondContact O-N 3.43Å; P133-S137 PolarHBondContact O-OG 2.9Å; A134-S137 WeakPolarHBondContact CA-OG 3.46Å
138	R	93.1	Very high	93.1	Very high	112 Å²	112	50.7 Å²	50.7	42%	0.423	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	13.4	172.6	-45.6	-175.1	-171.7	-171.8	0.1	113.1	Y33 A134 I136	Y33-R138 HydrophobicContact CD1-CG 4.49Å; Y33-R138 HydrophobicContact CD2-CG 3.99Å; Y33-R138 HydrophobicContact CG-CG 3.91Å; Y33-R138 PolarHBondContact OH-NH2 2.97Å; A134-R138 VanDerWaalsContact O-CB 3.27Å; A134-R138 WeakPolarHBondContact O-CB 3.38Å; A134-R138 WeakPolarHBondContact O-CG 3.46Å; A134-R138 PolarHBondContact O-N 3.26Å; I136-R138 PolarHBondContact O-N 3.33Å
139	C	93.1	Very high	93.1	Very high	18 Å²	18	51.5 Å²	51.5	12%	0.122	26%	0.264	C	S	.	.			trans	-68.4	146.7	179.5	80.8	0	0	0	0	111.5	F86 H135 I136 H141 L142 S143	F86-C139 HydrophobicContact CE2-CB 4.24Å; F86-C139 HydrophobicContact CZ-CB 3.96Å; H135-C139 WeakPolarHBondContact O-CB 3.48Å; I136-C139 WeakPolarHBondContact O-CB 3.2Å; I136-C139 PolarHBondContact O-N 3.11Å; I136-C139 PolarHBondContact O-SG 2.98Å; C139-H141 PolarHBondContact O-N 3.28Å; C139-L142 PolarHBondContact O-N 3.15Å; C139-S143 PolarHBondContact O-N 2.93Å; C139-S143 VanDerWaalsContact O-N 3.14Å
140	K	91.5	Very high	92.8	Very high	139 Å²	139	56.7 Å²	56.7	60%	0.604	30%	0.297	S	S	*	.	H	α-helix	trans	-60.6	-24.7	-175.4	-51.5	-160.6	-170.1	-144	0	113.5	E31 S144	E31-K140 VanDerWaalsContact CD-NZ 3.27Å; E31-K140 WeakPolarHBondContact OE1-CE 3.26Å; E31-K140 IonicContact OE1-NZ 2.62Å; E31-K140 PolarHBondContact OE1-NZ 3.31Å; E31-K140 WeakPolarHBondContact OE2-CE 3.3Å; E31-K140 IonicContact OE2-NZ 3.75Å; E31-K140 PolarHBondContact OE2-NZ 3.32Å; E31-K140 VanDerWaalsContact OE2-NZ 3.14Å; K140-S144 WeakPolarHBondContact O-CB 3.47Å; K140-S144 PolarHBondContact O-N 2.96Å
141	H	92.3	Very high	92.2	Very high	63 Å²	63	59.7 Å²	59.7	29%	0.292	31%	0.311	S	S	.	.	H	α-helix	trans	-69.3	-40.8	174.9	-169.1	75.2	0	0	0	112.3	F78 S81 M85 C139 F145	F78-H141 AromaticContact CD2-CD2 3.38Å; F78-H141 WeakPolarHBondContact CD2-CD2 3.27Å; F78-H141 AromaticContact CD2-NE2 3.37Å; F78-H141 WeakPolarHBondContact CD2-NE2 3.2Å; F78-H141 AromaticContact CE2-CD2 3.4Å; F78-H141 VanDerWaalsContact CE2-CD2 3.4Å; F78-H141 WeakPolarHBondContact CE2-CD2 3.49Å; F78-H141 AromaticContact CE2-NE2 3.92Å; S81-H141 WeakPolarHBondContact CB-NE2 3.06Å; M85-H141 HydrophobicContact CE-CB 3.5Å; M85-H141 VanDerWaalsContact CE-CB 3.5Å; M85-H141 WeakPolarHBondContact CE-CD2 2.92Å; M85-H141 HydrophobicContact SD-CB 4.09Å; C139-H141 PolarHBondContact O-N 3.28Å; H141-F145 PolarHBondContact O-N 2.65Å
142	L	93.1	Very high	91.8	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-69.2	-50.2	176.9	-170.7	151	0	0	0	110.7	V34 F78 L129 C139 S144 F145 F146	V34-L142 HydrophobicContact CB-CD2 4.17Å; V34-L142 HydrophobicContact CG2-CD2 4.01Å; F78-L142 HydrophobicContact CE2-CB 4.41Å; F78-L142 HydrophobicContact CZ-CB 4.29Å; F78-L142 HydrophobicContact CZ-CD1 4.43Å; F78-L142 HydrophobicContact CZ-CG 4.17Å; L129-L142 HydrophobicContact CB-CD1 4.33Å; C139-L142 PolarHBondContact O-N 3.15Å; L142-S144 VanDerWaalsContact C-N 3.25Å; L142-S144 PolarHBondContact O-N 2.81Å; L142-F145 PolarHBondContact O-N 2.87Å; L142-F145 VanDerWaalsContact O-N 3.12Å; L142-F146 HydrophobicContact CD2-CD2 3.64Å; L142-F146 HydrophobicContact CD2-CE2 3.87Å; L142-F146 HydrophobicContact CG-CD2 3.98Å; L142-F146 HydrophobicContact CG-CE2 3.91Å; L142-F146 WeakPolarHBondContact O-CD2 3.47Å; L142-F146 PolarHBondContact O-N 3.44Å; L142-F146 VanDerWaalsContact O-N 3.17Å
143	S	92.1	Very high	91.2	Very high	21 Å²	21	59.2 Å²	59.2	15%	0.147	31%	0.305	C	S	.	.	H	α-helix	trans	-59.3	-36.4	175.4	-60.2	0	0	0	0	112	W60 C139 K147	W60-S143 WeakPolarHBondContact CH2-O 3.33Å; C139-S143 PolarHBondContact O-N 2.93Å; C139-S143 VanDerWaalsContact O-N 3.14Å; S143-K147 WeakPolarHBondContact O-CB 3.34Å; S143-K147 PolarHBondContact O-N 3.1Å
144	S	92.8	Very high	90.2	Very high	80 Å²	80	63 Å²	63	56%	0.559	32%	0.322	S	S	*	.	H	α-helix	trans	-67.2	-39.3	175.1	-172.4	0	0	0	0	113	K140 L142 K147	K140-S144 WeakPolarHBondContact O-CB 3.47Å; K140-S144 PolarHBondContact O-N 2.96Å; L142-S144 VanDerWaalsContact C-N 3.25Å; L142-S144 PolarHBondContact O-N 2.81Å; S144-K147 WeakPolarHBondContact O-CB 3.35Å; S144-K147 PolarHBondContact O-N 2.79Å
145	F	94.8	Very high	88.9	Confident	20 Å²	20	63 Å²	63	9%	0.088	32%	0.316	C	S	.	.	H	α-helix	trans	-64.5	-43.1	179.1	-179.5	-99.2	0	0	0	113.1	R70 E74 I75 F78 H141 L142	R70-F145 HydrophobicContact CB-CZ 4.12Å; R70-F145 HydrophobicContact CG-CE1 4.21Å; R70-F145 HydrophobicContact CG-CZ 3.85Å; R70-F145 PolarHBondContact NE-O 3.04Å; R70-F145 PolarHBondContact NH2-O 2.73Å; E74-F145 HydrophobicContact CB-CE2 4.35Å; I75-F145 HydrophobicContact CB-CZ 4.24Å; I75-F145 HydrophobicContact CG1-CE1 4.44Å; I75-F145 HydrophobicContact CG1-CZ 3.76Å; F78-F145 HydrophobicContact CB-CD2 3.52Å; F78-F145 HydrophobicContact CB-CE2 3.65Å; F78-F145 HydrophobicContact CB-CG 4.12Å; F78-F145 HydrophobicContact CB-CZ 4.35Å; F78-F145 HydrophobicContact CD1-CD1 4.05Å; F78-F145 HydrophobicContact CD1-CD2 4.28Å; F78-F145 HydrophobicContact CD1-CE1 4.25Å; F78-F145 HydrophobicContact CD1-CE2 4.46Å; F78-F145 HydrophobicContact CD1-CG 4.08Å; F78-F145 HydrophobicContact CD1-CZ 4.46Å; F78-F145 HydrophobicContact CD2-CB 3.56Å; F78-F145 HydrophobicContact CD2-CD1 4.34Å; F78-F145 AromaticContact CD2-CD2 3.84Å; F78-F145 HydrophobicContact CD2-CD2 3.84Å; F78-F145 AromaticContact CD2-CG 3.64Å; F78-F145 HydrophobicContact CD2-CG 3.64Å; F78-F145 HydrophobicContact CE1-CD1 4.22Å; F78-F145 HydrophobicContact CE1-CG 4.44Å; F78-F145 HydrophobicContact CE2-CB 3.69Å; F78-F145 HydrophobicContact CE2-CG 4.05Å; F78-F145 HydrophobicContact CG-CB 4.14Å; F78-F145 HydrophobicContact CG-CD1 4.12Å; F78-F145 AromaticContact CG-CD2 3.61Å; F78-F145 HydrophobicContact CG-CD2 3.61Å; F78-F145 HydrophobicContact CG-CE2 4.04Å; F78-F145 AromaticContact CG-CG 3.66Å; F78-F145 HydrophobicContact CG-CG 3.66Å; F78-F145 HydrophobicContact CG-CZ 4.48Å; F78-F145 HydrophobicContact CZ-CB 4.35Å; F78-F145 HydrophobicContact CZ-CD1 4.46Å; F78-F145 HydrophobicContact CZ-CG 4.44Å; H141-F145 PolarHBondContact O-N 2.65Å; L142-F145 PolarHBondContact O-N 2.87Å; L142-F145 VanDerWaalsContact O-N 3.12Å
146	F	94.7	Very high	87.3	Confident	1 Å²	1	60.2 Å²	60.2	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-82.3	-11.3	178.2	-71.2	-71.3	0	0	0	113.7	V34 V37 L56 V58 W60 I68 L142 V148	V34-F146 HydrophobicContact CG2-CB 3.73Å; V34-F146 HydrophobicContact CG2-CD2 4.03Å; V34-F146 HydrophobicContact CG2-CG 4.08Å; V37-F146 HydrophobicContact CB-CE1 4.4Å; V37-F146 HydrophobicContact CG1-CD1 4.48Å; V37-F146 HydrophobicContact CG1-CE1 3.81Å; V37-F146 HydrophobicContact CG1-CZ 4.44Å; V37-F146 HydrophobicContact CG2-CD1 4.01Å; V37-F146 HydrophobicContact CG2-CE1 3.71Å; V37-F146 HydrophobicContact CG2-CE2 4.48Å; V37-F146 HydrophobicContact CG2-CZ 3.97Å; L56-F146 HydrophobicContact CD1-CE1 4.39Å; V58-F146 HydrophobicContact CG1-CB 4.15Å; V58-F146 HydrophobicContact CG2-CB 4.23Å; V58-F146 HydrophobicContact CG2-CD1 3.83Å; V58-F146 HydrophobicContact CG2-CG 4.44Å; W60-F146 HydrophobicContact CH2-CB 4.2Å; W60-F146 HydrophobicContact CZ2-CB 4.33Å; W60-F146 WeakPolarHBondContact CZ2-O 3.27Å; I68-F146 HydrophobicContact CD1-CB 4.44Å; I68-F146 HydrophobicContact CD1-CD1 3.92Å; L142-F146 HydrophobicContact CD2-CD2 3.64Å; L142-F146 HydrophobicContact CD2-CE2 3.87Å; L142-F146 HydrophobicContact CG-CD2 3.98Å; L142-F146 HydrophobicContact CG-CE2 3.91Å; L142-F146 WeakPolarHBondContact O-CD2 3.47Å; L142-F146 PolarHBondContact O-N 3.44Å; L142-F146 VanDerWaalsContact O-N 3.17Å; F146-V148 PolarHBondContact O-N 3.25Å
147	K	93.1	Very high	85.4	Confident	138 Å²	138	64.2 Å²	64.2	60%	0.6	34%	0.341	S	S	*	.	S	Bend	trans	-59.6	135.2	177	-170.5	172.3	-179	176.2	0	111	W60 R70 S143 S144 R149	W60-K147 HydrophobicContact CH2-CB 4.42Å; R70-K147 PolarHBondContact NH2-O 3.47Å; S143-K147 WeakPolarHBondContact O-CB 3.34Å; S143-K147 PolarHBondContact O-N 3.1Å; S144-K147 WeakPolarHBondContact O-CB 3.35Å; S144-K147 PolarHBondContact O-N 2.79Å; K147-R149 PolarHBondContact O-N 2.89Å
148	V	93	Very high	83.5	Confident	31 Å²	31	67.3 Å²	67.3	19%	0.188	36%	0.361	C	S	.	.			trans	-58.4	133.7	173.8	-168.9	0	0	0	0	110.3	K66 I68 F146 D152 E153	K66-V148 HydrophobicContact CB-CG2 3.49Å; K66-V148 VanDerWaalsContact CB-CG2 3.49Å; K66-V148 HydrophobicContact CD-CG2 3.88Å; K66-V148 HydrophobicContact CG-CG2 3.57Å; I68-V148 HydrophobicContact CG2-CB 4.48Å; I68-V148 HydrophobicContact CG2-CG2 4.09Å; F146-V148 PolarHBondContact O-N 3.25Å; V148-D152 HydrophobicContact CG1-CB 3.88Å; V148-E153 HydrophobicContact CG1-CG 3.5Å; V148-E153 VanDerWaalsContact CG1-CG 3.5Å
149	R	91.6	Very high	81.5	Confident	71 Å²	71	65.5 Å²	65.5	27%	0.268	36%	0.36	S	S	.	.			trans	-111.9	163.8	176.1	-50.2	176.7	-171.9	164.9	5.6	111	E74 K147 E151 D152 E153	E74-R149 IonicContact OE1-CZ 3.74Å; E74-R149 VanDerWaalsContact OE1-CZ 3.23Å; E74-R149 IonicContact OE1-NH1 3.79Å; E74-R149 PolarHBondContact OE1-NH1 2.85Å; E74-R149 IonicContact OE1-NH2 2.9Å; E74-R149 PolarHBondContact OE1-NH2 3.42Å; K147-R149 PolarHBondContact O-N 2.89Å; R149-E151 HydrophobicContact CB-CG 4.4Å; R149-E151 WeakPolarHBondContact CB-OE2 3.22Å; R149-E151 WeakPolarHBondContact CD-OE1 3.32Å; R149-E151 IonicContact CZ-OE1 3.14Å; R149-E151 IonicContact NE-OE1 2.76Å; R149-E151 IonicContact NH1-OE1 3.69Å; R149-E151 PolarHBondContact NH1-OE1 2.88Å; R149-E151 PolarHBondContact O-N 3.49Å; R149-D152 PolarHBondContact N-OD2 3.15Å; R149-D152 VanDerWaalsContact O-CB 3.31Å; R149-D152 WeakPolarHBondContact O-CB 3.43Å; R149-D152 PolarHBondContact O-N 2.78Å; R149-E153 PolarHBondContact O-N 2.97Å
150	P	86.3	Confident	79.4	Confident	109 Å²	109	71.7 Å²	71.7	71%	0.708	40%	0.397	S	S	*	.	H	α-helix	trans	-56.5	-34.1	177.4	-25.8	36.2	0	0	0	113.9	D152 E153 N154	P150-D152 VanDerWaalsContact C-N 3.25Å; P150-D152 PolarHBondContact O-N 3.36Å; P150-E153 PolarHBondContact O-N 3.27Å; P150-N154 PolarHBondContact O-N 3.49Å
151	E	81.4	Confident	77.2	Confident	82 Å²	82	73.2 Å²	73.2	38%	0.383	41%	0.408	S	S	.	.	H	α-helix	trans	-74.1	-10	175.7	71.1	-90.8	-151.6	0	0	114.8	R149	R149-E151 HydrophobicContact CB-CG 4.4Å; R149-E151 WeakPolarHBondContact CB-OE2 3.22Å; R149-E151 WeakPolarHBondContact CD-OE1 3.32Å; R149-E151 IonicContact CZ-OE1 3.14Å; R149-E151 IonicContact NE-OE1 2.76Å; R149-E151 IonicContact NH1-OE1 3.69Å; R149-E151 PolarHBondContact NH1-OE1 2.88Å; R149-E151 PolarHBondContact O-N 3.49Å
152	D	84.7	Confident	75.1	Confident	9 Å²	9	76 Å²	76	5%	0.048	42%	0.42	C	S	.	.	H	α-helix	trans	-84	-40	171.9	-63.9	-48.3	0	0	0	111.3	I68 Y69 R70 V148 R149 P150	I68-D152 WeakPolarHBondContact CA-OD1 3.38Å; I68-D152 HydrophobicContact CG2-CB 4.44Å; Y69-D152 HydrophobicContact CD2-CB 4.37Å; Y69-D152 PolarHBondContact N-OD1 3.42Å; R70-D152 IonicContact CZ-OD1 2.73Å; R70-D152 IonicContact CZ-OD2 2.85Å; R70-D152 VanDerWaalsContact NH1-CG 3.27Å; R70-D152 IonicContact NH1-OD1 2.81Å; R70-D152 PolarHBondContact NH1-OD1 2.89Å; R70-D152 IonicContact NH1-OD2 3.23Å; R70-D152 PolarHBondContact NH1-OD2 3.39Å; R70-D152 IonicContact NH2-OD2 3.92Å; R70-D152 PolarHBondContact NH2-OD2 3.48Å; V148-D152 HydrophobicContact CG1-CB 3.88Å; R149-D152 PolarHBondContact N-OD2 3.15Å; R149-D152 VanDerWaalsContact O-CB 3.31Å; R149-D152 WeakPolarHBondContact O-CB 3.43Å; R149-D152 PolarHBondContact O-N 2.78Å; P150-D152 VanDerWaalsContact C-N 3.25Å; P150-D152 PolarHBondContact O-N 3.36Å
153	E	80.9	Confident	73	Confident	118 Å²	118	86.1 Å²	86.1	55%	0.551	46%	0.458	S	S	*	.	H	α-helix	trans	-82.9	-34.9	179.7	-57.4	-166	138.8	0	0	112.3	K66 V148 R149 P150 P155	K66-E153 IonicContact NZ-OE1 2.88Å; K66-E153 PolarHBondContact NZ-OE1 2.55Å; V148-E153 HydrophobicContact CG1-CG 3.5Å; V148-E153 VanDerWaalsContact CG1-CG 3.5Å; R149-E153 PolarHBondContact O-N 2.97Å; P150-E153 PolarHBondContact O-N 3.27Å; E153-P155 VanDerWaalsContact C-CD 3.48Å; E153-P155 WeakPolarHBondContact O-CD 3.41Å
154	N	73.1	Confident	71.2	Confident	139 Å²	139	86.4 Å²	86.4	74%	0.743	46%	0.458	S	S	*	.	S	Bend	trans	-119	74.2	173.6	-97.7	100.8	0	0	0	110.7	P150	P150-N154 PolarHBondContact O-N 3.49Å
155	P	66.2	Low	69.4	Low	55 Å²	55	84.5 Å²	84.5	36%	0.357	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-60.7	146.1	175	26.3	-34.6	0	0	0	110.9	E153 A157	E153-P155 VanDerWaalsContact C-CD 3.48Å; E153-P155 WeakPolarHBondContact O-CD 3.41Å; P155-A157 PolarHBondContact O-N 2.76Å
156	P	59.5	Low	67.7	Low	48 Å²	48	88.2 Å²	88.2	31%	0.312	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-59.8	133.5	-177.6	24.7	-34	0	0	0	110.6	F47	F47-P156 HydrophobicContact CD1-CB 4.33Å
157	A	53.2	Low	65.9	Low	84 Å²	84	89.7 Å²	89.7	69%	0.694	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-54	132.9	-173.7	0	0	0	0	0	111.3	P155 N159	P155-A157 PolarHBondContact O-N 2.76Å; A157-N159 PolarHBondContact O-N 3.04Å
158	P	54.2	Low	63.6	Low	75 Å²	75	86.3 Å²	86.3	49%	0.487	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-59.8	136.4	178.9	25.7	-34	0	0	0	109.5	T160	P158-T160 PolarHBondContact O-N 2.75Å
159	N	49.6	Very low	61.3	Low	75 Å²	75	91.4 Å²	91.4	40%	0.401	49%	0.488	S	S	.	.	B	Isolated β-bridge	trans	-59.3	128.9	-178.1	178.7	-21.2	0	0	0	109.1	A157 M161 K162	A157-N159 PolarHBondContact O-N 3.04Å; N159-M161 PolarHBondContact O-N 2.95Å; N159-M161 PolarHBondContact OD1-N 2.65Å; N159-K162 HydrophobicContact CB-CB 4.48Å; N159-K162 WeakPolarHBondContact CB-O 3.46Å; N159-K162 PolarHBondContact N-O 3.49Å; N159-K162 CarbonylContact O-C 3.59Å; N159-K162 PolarHBondContact O-N 2.69Å
160	T	48.7	Very low	58.7	Low	147 Å²	147	93.5 Å²	93.5	90%	0.902	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-16.8	-177.5	53.3	0	0	0	0	113.5	P158	P158-T160 PolarHBondContact O-N 2.75Å
161	M	47.1	Very low	56.8	Low	171 Å²	171	99.8 Å²	99.8	84%	0.842	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-12.1	172.7	-60.7	-173.5	176.8	0	0	114.5	N159	N159-M161 PolarHBondContact O-N 2.95Å; N159-M161 PolarHBondContact OD1-N 2.65Å
162	K	47.5	Very low	54.5	Low	123 Å²	123	104.6 Å²	104.6	54%	0.535	55%	0.545	S	S	.	.	B	Isolated β-bridge	trans	-149.1	106.2	177.5	-70.2	-166.6	178	-173.5	0	111.3	F46 N159	F46-K162 HydrophobicContact CD1-CD 4.29Å; F46-K162 HydrophobicContact CD2-CB 4.12Å; F46-K162 HydrophobicContact CE1-CD 4.33Å; F46-K162 HydrophobicContact CE2-CB 4.4Å; F46-K162 HydrophobicContact CG-CB 4.42Å; N159-K162 HydrophobicContact CB-CB 4.48Å; N159-K162 WeakPolarHBondContact CB-O 3.46Å; N159-K162 PolarHBondContact N-O 3.49Å; N159-K162 CarbonylContact O-C 3.59Å; N159-K162 PolarHBondContact O-N 2.69Å
163	R	49.2	Very low	52.6	Low	212 Å²	212	112.2 Å²	112.2	80%	0.8	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-63.2	145.8	173.4	-164	174.4	-171	161.5	1.7	110	F46	F46-R163 WeakPolarHBondContact CE2-O 3.48Å
164	N	54.1	Low	50.6	Low	26 Å²	26	111.2 Å²	111.2	14%	0.139	60%	0.597	C	S	.	*	P	Polyproline II helix	trans	-71.5	135.3	171.5	-61.9	-4	0	0	0	109.4	E43 K44	E43-N164 HydrophobicContact CG-CB 4.1Å; E43-N164 WeakPolarHBondContact OE1-CB 3.32Å; E43-N164 PolarHBondContact OE1-ND2 3.38Å; K44-N164 WeakPolarHBondContact O-CA 3.42Å; K44-N164 WeakPolarHBondContact O-CB 3.25Å
165	D	55.7	Low	48.9	Very low	41 Å²	41	116.2 Å²	116.2	22%	0.219	61%	0.605	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.7	119.3	179.7	-53.6	-57.4	0	0	0	109.5	E43 K44 F167 P184	E43-D165 CarbonylContact C-O 3.56Å; E43-D165 WeakPolarHBondContact CA-O 3.26Å; K44-D165 HydrophobicContact CB-CB 4.02Å; K44-D165 WeakPolarHBondContact CD-OD2 3.43Å; K44-D165 PolarHBondContact N-O 2.99Å; K44-D165 PolarHBondContact O-N 2.74Å; D165-F167 HydrophobicContact CB-CE1 4.13Å; D165-F167 HydrophobicContact CB-CE2 3.69Å; D165-F167 HydrophobicContact CB-CZ 3.34Å; D165-F167 WeakPolarHBondContact O-CE2 3.18Å; D165-P184 HydrophobicContact CB-CB 4.22Å; D165-P184 HydrophobicContact CB-CG 4.09Å; D165-P184 WeakPolarHBondContact OD1-CB 3.41Å
166	L	57.8	Low	47.3	Very low	98 Å²	98	116.8 Å²	116.8	51%	0.513	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.4	122.5	178.4	-74	167.3	0	0	0	110.3	E43	E43-L166 HydrophobicContact CB-CD2 4.06Å; E43-L166 HydrophobicContact CG-CD2 3.77Å; E43-L166 HydrophobicContact CG-CG 4.46Å
167	F	57.3	Low	46.5	Very low	31 Å²	31	121.1 Å²	121.1	14%	0.136	64%	0.64	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.8	115.2	176.1	-50.7	-69.8	0	0	0	108.9	G41 F42 K44 D165 P184 I186	G41-F167 WeakPolarHBondContact CA-O 3.44Å; F42-F167 HydrophobicContact CD1-CB 4.34Å; F42-F167 HydrophobicContact CD2-CB 4.3Å; F42-F167 AromaticContact CD2-CD2 3.37Å; F42-F167 HydrophobicContact CD2-CD2 3.37Å; F42-F167 HydrophobicContact CD2-CE2 4.08Å; F42-F167 HydrophobicContact CD2-CG 4.15Å; F42-F167 HydrophobicContact CE1-CB 4.24Å; F42-F167 HydrophobicContact CE2-CB 4.21Å; F42-F167 AromaticContact CE2-CD2 3.24Å; F42-F167 HydrophobicContact CE2-CD2 3.24Å; F42-F167 AromaticContact CE2-CE2 3.76Å; F42-F167 HydrophobicContact CE2-CE2 3.76Å; F42-F167 AromaticContact CE2-CG 3.82Å; F42-F167 HydrophobicContact CE2-CG 3.82Å; F42-F167 HydrophobicContact CG-CB 4.35Å; F42-F167 HydrophobicContact CG-CD2 4.19Å; F42-F167 HydrophobicContact CZ-CB 4.17Å; F42-F167 AromaticContact CZ-CD2 3.97Å; F42-F167 HydrophobicContact CZ-CD2 3.97Å; F42-F167 HydrophobicContact CZ-CG 4.08Å; F42-F167 PolarHBondContact N-O 2.7Å; F42-F167 WeakPolarHBondContact O-CA 3.39Å; F42-F167 WeakPolarHBondContact O-CB 3.45Å; F42-F167 WeakPolarHBondContact O-CD2 3.42Å; F42-F167 PolarHBondContact O-N 3.42Å; K44-F167 HydrophobicContact CB-CE2 4.16Å; D165-F167 HydrophobicContact CB-CE1 4.13Å; D165-F167 HydrophobicContact CB-CE2 3.69Å; D165-F167 HydrophobicContact CB-CZ 3.34Å; D165-F167 WeakPolarHBondContact O-CE2 3.18Å; F167-P184 HydrophobicContact CE1-CG 3.92Å; F167-I186 HydrophobicContact CD1-CD1 3.69Å; F167-I186 HydrophobicContact CD1-CG1 4.11Å; F167-I186 HydrophobicContact CE1-CD1 3.34Å; F167-I186 HydrophobicContact CE1-CG1 3.3Å; F167-I186 HydrophobicContact CE2-CD1 4.48Å; F167-I186 HydrophobicContact CG-CD1 4.39Å; F167-I186 HydrophobicContact CZ-CD1 3.77Å; F167-I186 HydrophobicContact CZ-CG1 3.7Å
168	A	44.2	Very low	45.9	Very low	67 Å²	67	120.9 Å²	120.9	55%	0.554	64%	0.638	S	S	*	*			trans	-149	140.3	-180	0	0	0	0	0	109.5	L40	L40-A168 VanDerWaalsContact O-CA 3.32Å; L40-A168 WeakPolarHBondContact O-CA 3.41Å; L40-A168 WeakPolarHBondContact O-CB 3.41Å
169	E	44.8	Very low	45.1	Very low	139 Å²	139	121.5 Å²	121.5	65%	0.65	65%	0.645	S	S	*	*			trans	-102.6	131.6	167	-73.8	-176.1	111	0	0	109.2	K119	K119-E169 IonicContact NZ-OE2 3.74Å; K119-E169 PolarHBondContact NZ-OE2 2.75Å
170	S	36.9	Very low	44.6	Very low	115 Å²	115	125.7 Å²	125.7	80%	0.804	66%	0.662	S	S	*	*			trans	-112.8	114.4	160.6	-176.2	0	0	0	0	107.1	E172	S170-E172 PolarHBondContact O-N 2.63Å
171	R	46.4	Very low	44.2	Very low	240 Å²	240	126.3 Å²	126.3	91%	0.906	66%	0.658	S	S	*	*			trans	-86.4	82.7	174.8	-77.4	-176	65.5	-172	0.3	110
172	E	33.5	Very low	43.9	Very low	183 Å²	183	123.1 Å²	123.1	86%	0.855	65%	0.653	S	S	*	*			trans	-137.6	137.8	155.8	-129.7	174.2	-158.2	0	0	111.1	S170	S170-E172 PolarHBondContact O-N 2.63Å
173	L	44.3	Very low	43.4	Very low	170 Å²	170	119.4 Å²	119.4	89%	0.89	65%	0.649	S	S	*	*			trans	-99	156.7	-160.7	-136.7	73.9	0	0	0	112.5
174	A	39.5	Very low	42.9	Very low	96 Å²	96	112 Å²	112	79%	0.793	63%	0.629	S	S	*	*	S	Bend	trans	77.3	31.4	154.8	0	0	0	0	0	120.2
175	R	37	Very low	42.5	Very low	244 Å²	244	117.7 Å²	117.7	92%	0.921	66%	0.658	S	S	*	*			trans	-145	149.6	158.1	-108.4	-176.1	-179.9	99.6	0.5	114.4
176	A	33.7	Very low	42.5	Very low	68 Å²	68	118.2 Å²	118.2	56%	0.562	66%	0.66	S	S	*	*			trans	71.8	66.6	171.3	0	0	0	0	0	118.1	A178 S179	A176-A178 PolarHBondContact O-N 2.75Å; A176-S179 PolarHBondContact O-N 2.9Å
177	T	41.8	Very low	42.9	Very low	138 Å²	138	115 Å²	115	85%	0.847	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	43.2	166.3	-35.7	0	0	0	0	114.1
178	A	40.9	Very low	43.8	Very low	79 Å²	79	115.5 Å²	115.5	65%	0.653	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.4	-16.7	-178.5	0	0	0	0	0	112.9	A176	A176-A178 PolarHBondContact O-N 2.75Å
179	S	37.6	Very low	45.5	Very low	89 Å²	89	113.6 Å²	113.6	62%	0.622	63%	0.629	S	S	*	*	S	Bend	trans	-89.9	-15	-178	-161.4	0	0	0	0	114.1	A176 I181 S182	A176-S179 PolarHBondContact O-N 2.9Å; S179-I181 PolarHBondContact O-N 3.03Å; S179-S182 PolarHBondContact O-N 3.37Å
180	E	38.7	Very low	47.5	Very low	163 Å²	163	107.4 Å²	107.4	76%	0.762	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-68	-21.3	-174.2	-64.2	172	159	0	0	113.1	S182	E180-S182 PolarHBondContact O-N 3.44Å
181	I	40.2	Very low	49.9	Very low	159 Å²	159	103.8 Å²	103.8	82%	0.815	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-71.2	-15.6	-179.6	-54.4	174.9	0	0	0	112.1	S179	S179-I181 PolarHBondContact O-N 3.03Å
182	S	39.9	Very low	52.1	Low	105 Å²	105	92.3 Å²	92.3	73%	0.734	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-92.9	4.1	-174.2	-169.4	0	0	0	0	115.2	S179 E180	S179-S182 PolarHBondContact O-N 3.37Å; E180-S182 PolarHBondContact O-N 3.44Å
183	G	37.4	Very low	54.9	Low	44 Å²	44	83.8 Å²	83.8	45%	0.454	49%	0.485	S	S	.	.	S	Bend	trans	-71.1	141.3	174.6	0	0	0	0	0	112.2	I185	G183-I185 PolarHBondContact O-N 3.35Å; G183-I185 VanDerWaalsContact O-N 3.11Å
184	P	39.8	Very low	57.3	Low	57 Å²	57	76.1 Å²	76.1	37%	0.37	45%	0.446	S	S	.	.			trans	-66.7	112.1	172.3	27.1	-31.9	0	0	0	109.4	D165 F167 I186	D165-P184 HydrophobicContact CB-CB 4.22Å; D165-P184 HydrophobicContact CB-CG 4.09Å; D165-P184 WeakPolarHBondContact OD1-CB 3.41Å; F167-P184 HydrophobicContact CE1-CG 3.92Å; P184-I186 PolarHBondContact O-N 3.15Å
185	I	45.2	Very low	59.9	Low	146 Å²	146	76.4 Å²	76.4	75%	0.749	43%	0.434	S	S	*	.			trans	-66	103.4	178.5	-52.6	177.6	0	0	0	108.3	G183 L187	G183-I185 PolarHBondContact O-N 3.35Å; G183-I185 VanDerWaalsContact O-N 3.11Å; I185-L187 HydrophobicContact CG2-CD2 3.97Å; I185-L187 PolarHBondContact O-N 3.24Å
186	I	54.8	Low	62.6	Low	51 Å²	51	65.5 Å²	65.5	26%	0.262	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-68.5	128.1	170.1	-43.1	176.2	0	0	0	107.5	Q112 F167 P184	Q112-I186 HydrophobicContact CB-CG2 4.49Å; Q112-I186 HydrophobicContact CG-CD1 4.31Å; Q112-I186 HydrophobicContact CG-CG2 4.36Å; Q112-I186 VanDerWaalsContact OE1-CB 3.3Å; F167-I186 HydrophobicContact CD1-CD1 3.69Å; F167-I186 HydrophobicContact CD1-CG1 4.11Å; F167-I186 HydrophobicContact CE1-CD1 3.34Å; F167-I186 HydrophobicContact CE1-CG1 3.3Å; F167-I186 HydrophobicContact CE2-CD1 4.48Å; F167-I186 HydrophobicContact CG-CD1 4.39Å; F167-I186 HydrophobicContact CZ-CD1 3.77Å; F167-I186 HydrophobicContact CZ-CG1 3.7Å; P184-I186 PolarHBondContact O-N 3.15Å
187	L	67.7	Low	65.5	Low	32 Å²	32	70 Å²	70	17%	0.168	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-93.6	137.1	174.3	-58.4	-171.5	0	0	0	110	I185 T189 E213 I214 V215	I185-L187 HydrophobicContact CG2-CD2 3.97Å; I185-L187 PolarHBondContact O-N 3.24Å; L187-T189 PolarHBondContact O-N 3.33Å; L187-E213 HydrophobicContact CB-CB 3.78Å; L187-E213 HydrophobicContact CB-CG 4.35Å; L187-E213 HydrophobicContact CD1-CB 3.92Å; L187-E213 HydrophobicContact CG-CB 4.49Å; L187-I214 WeakPolarHBondContact CB-O 3.44Å; L187-I214 WeakPolarHBondContact CD2-O 3.41Å; L187-V215 HydrophobicContact CD1-CG2 3.77Å
188	D	74.9	Confident	67.8	Low	41 Å²	41	68.4 Å²	68.4	22%	0.219	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	130	175.7	-126.4	1.4	0	0	0	108.9	Y190 E213 I214 K217	D188-Y190 HydrophobicContact CB-CD2 4.3Å; D188-Y190 HydrophobicContact CB-CE2 3.89Å; D188-E213 CarbonylContact O-C 3.57Å; D188-E213 WeakPolarHBondContact O-CA 3.35Å; D188-I214 HydrophobicContact CB-CB 4.12Å; D188-I214 HydrophobicContact CB-CG1 4.16Å; D188-I214 WeakPolarHBondContact O-CG1 3.39Å; D188-I214 PolarHBondContact O-N 3.17Å; D188-K217 WeakPolarHBondContact OD2-CE 3.49Å; D188-K217 IonicContact OD2-NZ 2.63Å; D188-K217 PolarHBondContact OD2-NZ 2.98Å
189	T	80.9	Confident	70	Confident	27 Å²	27	69.5 Å²	69.5	17%	0.166	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123	-179.8	-38.7	0	0	0	0	110.1	L187 F211 V212 L242	L187-T189 PolarHBondContact O-N 3.33Å; T189-F211 HydrophobicContact CG2-CB 4.2Å; T189-V212 WeakPolarHBondContact CA-O 3.47Å; T189-L242 HydrophobicContact CG2-CD1 3.92Å; T189-L242 VanDerWaalsContact O-CD1 3.26Å; T189-L242 WeakPolarHBondContact O-CD1 3.38Å; T189-L242 VanDerWaalsContact O-CG 3.27Å; T189-L242 WeakPolarHBondContact O-CG 3.27Å
190	Y	86.8	Confident	72.4	Confident	9 Å²	9	67.2 Å²	67.2	4%	0.035	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	161.1	177.6	-78.9	-121.3	0	0	0	109.8	D188 F211 V212 I214 K217 W223 L239 E240 P241 E247	D188-Y190 HydrophobicContact CB-CD2 4.3Å; D188-Y190 HydrophobicContact CB-CE2 3.89Å; Y190-F211 CarbonylContact O-C 3.58Å; Y190-F211 WeakPolarHBondContact O-CA 3.4Å; Y190-V212 PolarHBondContact N-O 2.99Å; Y190-V212 PolarHBondContact O-N 3.45Å; Y190-I214 HydrophobicContact CD2-CD1 3.94Å; Y190-I214 HydrophobicContact CD2-CG1 3.4Å; Y190-I214 VanDerWaalsContact CD2-CG1 3.4Å; Y190-I214 HydrophobicContact CE2-CG1 3.86Å; Y190-I214 HydrophobicContact CG-CD1 4.05Å; Y190-I214 HydrophobicContact CG-CG1 4.03Å; Y190-K217 PolarHBondContact OH-NZ 3.11Å; Y190-W223 AromaticContact CD1-CZ3 3.93Å; Y190-W223 HydrophobicContact CD1-CZ3 3.93Å; Y190-W223 AromaticContact CE1-CH2 3.87Å; Y190-W223 HydrophobicContact CE1-CH2 3.87Å; Y190-W223 AromaticContact CE1-CZ3 3.53Å; Y190-W223 HydrophobicContact CE1-CZ3 3.53Å; Y190-W223 HydrophobicContact CE2-CZ3 4.39Å; Y190-W223 AromaticContact CZ-CZ3 3.82Å; Y190-L239 HydrophobicContact CD1-CB 4.02Å; Y190-E240 WeakPolarHBondContact CA-O 3.47Å; Y190-E240 WeakPolarHBondContact CB-O 3.48Å; Y190-E240 WeakPolarHBondContact CD1-O 3.24Å; Y190-P241 HydrophobicContact CD1-CG 4.31Å; Y190-P241 HydrophobicContact CE1-CB 4.05Å; Y190-P241 HydrophobicContact CE1-CG 3.62Å; Y190-E247 WeakPolarHBondContact CE1-OE2 3.19Å; Y190-E247 PolarHBondContact OH-OE1 3.06Å; Y190-E247 PolarHBondContact OH-OE2 3.1Å
191	R	87.7	Confident	74.8	Confident	38 Å²	38	67.9 Å²	67.9	14%	0.143	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	145	174.9	-175.1	174.3	169	-82.9	-170	111.6	D210 F211 L239 E240 L242 K339 I341	R191-D210 CarbonylContact C-O 3.59Å; R191-D210 WeakPolarHBondContact CA-O 3.36Å; R191-D210 WeakPolarHBondContact CG-O 3.4Å; R191-F211 HydrophobicContact CB-CD1 4.08Å; R191-F211 HydrophobicContact CB-CE1 4.12Å; R191-F211 HydrophobicContact CG-CD1 4.31Å; R191-F211 HydrophobicContact CG-CE1 4.13Å; R191-L239 CarbonylContact O-C 3.13Å; R191-L239 VanDerWaalsContact O-CA 3.32Å; R191-L239 WeakPolarHBondContact O-CA 3.44Å; R191-E240 HydrophobicContact CB-CG 4.14Å; R191-E240 PolarHBondContact N-O 3.27Å; R191-E240 PolarHBondContact O-N 2.94Å; R191-L242 HydrophobicContact CB-CD2 3.72Å; R191-K339 PolarHBondContact NH1-O 3.43Å; R191-I341 VanDerWaalsContact CD-CG2 3.48Å
192	V	91.4	Very high	77	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	127.6	174.3	-179.9	0	0	0	0	110.8	A194 L206 Y207 G209 D210 V212 L239	V192-A194 WeakPolarHBondContact CG1-O 3.15Å; V192-L206 HydrophobicContact CB-CB 4.47Å; V192-L206 HydrophobicContact CG1-CB 3.66Å; V192-L206 HydrophobicContact CG1-CD1 4.31Å; V192-L206 HydrophobicContact CG2-CB 3.92Å; V192-L206 HydrophobicContact CG2-CD1 4.24Å; V192-L206 HydrophobicContact CG2-CD2 3.82Å; V192-L206 HydrophobicContact CG2-CG 4.23Å; V192-Y207 VanDerWaalsContact CB-O 3.29Å; V192-Y207 WeakPolarHBondContact CB-O 3.32Å; V192-Y207 VanDerWaalsContact CG1-O 3.23Å; V192-Y207 WeakPolarHBondContact CG1-O 3.37Å; V192-G209 PolarHBondContact O-N 3.37Å; V192-D210 HydrophobicContact CB-CB 4.43Å; V192-D210 HydrophobicContact CG2-CB 4.02Å; V192-D210 PolarHBondContact N-O 2.71Å; V192-V212 HydrophobicContact CG2-CG1 4.2Å; V192-L239 HydrophobicContact CG2-CD2 4.06Å
193	I	92.9	Very high	79.5	Confident	3 Å²	3	62 Å²	62	2%	0.015	33%	0.325	C	S	.	.			trans	-96.4	-17.9	179.2	79.7	-165.4	0	0	0	113.7	T208 S237 Y238 E240 R332 I335 A338 K339	I193-T208 WeakPolarHBondContact O-CG2 3.3Å; I193-S237 WeakPolarHBondContact CD1-O 3.15Å; I193-Y238 WeakPolarHBondContact CG1-O 3.39Å; I193-Y238 PolarHBondContact N-O 3.28Å; I193-E240 HydrophobicContact CG2-CB 3.82Å; I193-E240 VanDerWaalsContact CG2-CD 3.47Å; I193-E240 HydrophobicContact CG2-CG 3.6Å; I193-R332 HydrophobicContact CD1-CG 4.36Å; I193-R332 VanDerWaalsContact CD1-NH1 3.29Å; I193-I335 HydrophobicContact CD1-CD1 4.15Å; I193-I335 HydrophobicContact CG1-CD1 4.44Å; I193-A338 HydrophobicContact CB-CB 4.43Å; I193-A338 HydrophobicContact CD1-CB 4.04Å; I193-A338 HydrophobicContact CG1-CB 3.98Å; I193-A338 CarbonylContact O-C 3.42Å; I193-A338 WeakPolarHBondContact O-CA 3.44Å; I193-K339 PolarHBondContact O-N 2.88Å
194	A	95.1	Very high	82	Confident	9 Å²	9	60.6 Å²	60.6	7%	0.074	31%	0.307	C	S	.	.	S	Bend	trans	-156.8	157.7	-177.6	0	0	0	0	0	111.5	V192 T208 Y238 I335	V192-A194 WeakPolarHBondContact CG1-O 3.15Å; A194-T208 VanDerWaalsContact C-OG1 3.29Å; A194-T208 VanDerWaalsContact CA-OG1 3.25Å; A194-T208 WeakPolarHBondContact CA-OG1 3.39Å; A194-Y238 HydrophobicContact CB-CD1 3.88Å; A194-Y238 HydrophobicContact CB-CE1 3.98Å; A194-Y238 WeakPolarHBondContact O-CD1 3.44Å; A194-I335 HydrophobicContact CB-CG2 3.33Å
195	D	94	Very high	84.4	Confident	102 Å²	102	60.1 Å²	60.1	55%	0.545	30%	0.301	S	S	.	.			trans	-72.2	128.9	179.4	-52.3	-31.8	0	0	0	110.7	L206 T208 Y238	D195-L206 WeakPolarHBondContact CA-O 3.43Å; D195-T208 VanDerWaalsContact CG-OG1 3.28Å; D195-T208 PolarHBondContact N-OG1 3.3Å; D195-T208 VanDerWaalsContact N-OG1 3.09Å; D195-T208 VanDerWaalsContact OD1-CB 3.31Å; D195-T208 WeakPolarHBondContact OD1-CB 3.28Å; D195-T208 PolarHBondContact OD1-N 3.25Å; D195-T208 PolarHBondContact OD1-OG1 3.12Å; D195-Y238 WeakPolarHBondContact O-CE1 3.49Å
196	F	94	Very high	86.6	Confident	16 Å²	16	53.3 Å²	53.3	7%	0.07	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-120.7	118.2	173.4	175.6	-103.8	0	0	0	109.4	E203 L204 N205 L206 W222 P235 Y238 P330	F196-E203 HydrophobicContact CE1-CB 4.47Å; F196-L204 WeakPolarHBondContact CD1-O 3.42Å; F196-N205 CarbonylContact O-C 3.5Å; F196-N205 VanDerWaalsContact O-CA 3.3Å; F196-N205 WeakPolarHBondContact O-CA 3.5Å; F196-L206 HydrophobicContact CB-CB 3.95Å; F196-L206 HydrophobicContact CB-CD1 4.17Å; F196-L206 HydrophobicContact CB-CG 4.15Å; F196-L206 PolarHBondContact N-O 3.03Å; F196-L206 PolarHBondContact O-N 3.4Å; F196-W222 HydrophobicContact CE1-CZ3 4.32Å; F196-W222 HydrophobicContact CE2-CH2 4.41Å; F196-W222 AromaticContact CZ-CH2 3.83Å; F196-W222 HydrophobicContact CZ-CH2 3.83Å; F196-W222 AromaticContact CZ-CZ3 3.9Å; F196-W222 HydrophobicContact CZ-CZ3 3.9Å; F196-P235 HydrophobicContact CD1-CG 4.47Å; F196-P235 HydrophobicContact CD2-CG 3.81Å; F196-P235 HydrophobicContact CE2-CG 3.93Å; F196-P235 HydrophobicContact CG-CG 4.11Å; F196-P235 HydrophobicContact CZ-CG 4.33Å; F196-Y238 HydrophobicContact CB-CD1 3.77Å; F196-Y238 HydrophobicContact CB-CE1 3.94Å; F196-Y238 HydrophobicContact CB-CG 4.42Å; F196-Y238 HydrophobicContact CD2-CE1 4.42Å; F196-P330 HydrophobicContact CE2-CG 4.32Å
197	E	93.4	Very high	88.3	Confident	162 Å²	162	57 Å²	57	76%	0.757	28%	0.278	S	S	*	.			trans	-91	127.5	171.3	-176.8	167.7	-148.9	0	0	109.7
198	K	90.3	Very high	89.4	Confident	104 Å²	104	57.1 Å²	57.1	45%	0.452	28%	0.28	S	S	.	.			trans	-67.1	138.3	-177.7	74.4	-174.3	-178.1	170	0	112.1	E203 N205	K198-E203 HydrophobicContact CB-CB 3.64Å; K198-E203 VanDerWaalsContact CD-O 3.26Å; K198-E203 WeakPolarHBondContact CD-O 3.45Å; K198-N205 WeakPolarHBondContact CB-OD1 3.25Å; K198-N205 WeakPolarHBondContact CG-OD1 3.44Å; K198-N205 PolarHBondContact N-OD1 3.47Å
199	T	87.7	Confident	89.6	Confident	102 Å²	102	56.1 Å²	56.1	63%	0.626	28%	0.279	S	S	*	.	S	Bend	trans	-96.6	-23.6	174	70.8	0	0	0	0	112.4	E203	T199-E203 WeakPolarHBondContact CA-OE2 3.46Å; T199-E203 PolarHBondContact N-OE2 3.12Å; T199-E203 PolarHBondContact OG1-OE1 2.95Å; T199-E203 PolarHBondContact OG1-OE2 3.34Å
200	S	87.8	Confident	89.7	Confident	41 Å²	41	58 Å²	58	29%	0.287	29%	0.288	S	S	.	.	S	Bend	trans	-116.3	158.7	179.5	-173.8	0	0	0	0	113.4	H202 E203	S200-H202 PolarHBondContact O-N 3.04Å; S200-H202 PolarHBondContact OG-N 2.84Å; S200-E203 VanDerWaalsContact CB-CD 3.48Å; S200-E203 WeakPolarHBondContact CB-OE1 3.37Å; S200-E203 PolarHBondContact N-OE1 2.81Å; S200-E203 PolarHBondContact N-OE2 2.67Å; S200-E203 VanDerWaalsContact N-OE2 3.1Å; S200-E203 PolarHBondContact O-N 3.06Å
201	K	88	Confident	89.6	Confident	178 Å²	178	62.3 Å²	62.3	77%	0.774	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.9	169	71.6	-176.4	-176.7	-176.3	0	113.5
202	H	87.9	Confident	89.4	Confident	112 Å²	112	60.6 Å²	60.6	52%	0.519	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-7.3	178.8	-61.1	-79.1	0	0	0	113.3	S200 G232 W233	S200-H202 PolarHBondContact O-N 3.04Å; S200-H202 PolarHBondContact OG-N 2.84Å; H202-G232 CarbonylContact O-C 3.59Å; H202-G232 VanDerWaalsContact O-CA 3.26Å; H202-G232 WeakPolarHBondContact O-CA 3.34Å; H202-W233 PolarHBondContact O-N 2.91Å
203	E	91.2	Very high	89	Confident	28 Å²	28	63.5 Å²	63.5	13%	0.131	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-93.4	159	178.2	-77.4	153.5	-132.3	0	0	111.1	F196 K198 T199 S200 W222 W233	F196-E203 HydrophobicContact CE1-CB 4.47Å; K198-E203 HydrophobicContact CB-CB 3.64Å; K198-E203 VanDerWaalsContact CD-O 3.26Å; K198-E203 WeakPolarHBondContact CD-O 3.45Å; T199-E203 WeakPolarHBondContact CA-OE2 3.46Å; T199-E203 PolarHBondContact N-OE2 3.12Å; T199-E203 PolarHBondContact OG1-OE1 2.95Å; T199-E203 PolarHBondContact OG1-OE2 3.34Å; S200-E203 VanDerWaalsContact CB-CD 3.48Å; S200-E203 WeakPolarHBondContact CB-OE1 3.37Å; S200-E203 PolarHBondContact N-OE1 2.81Å; S200-E203 PolarHBondContact N-OE2 2.67Å; S200-E203 VanDerWaalsContact N-OE2 3.1Å; S200-E203 PolarHBondContact O-N 3.06Å; E203-W222 HydrophobicContact CG-CH2 4.33Å; E203-W222 HydrophobicContact CG-CZ3 3.9Å; E203-W233 WeakPolarHBondContact CA-O 3.35Å; E203-W233 WeakPolarHBondContact CB-O 3.3Å; E203-W233 HydrophobicContact CG-CB 4.3Å
204	L	89.7	Confident	88.5	Confident	15 Å²	15	63.7 Å²	63.7	8%	0.079	32%	0.316	C	S	.	.			trans	-115.3	139.6	179.3	179.8	64.7	0	0	0	110.1	F196 C227 K230 W233 V234	F196-L204 WeakPolarHBondContact CD1-O 3.42Å; L204-C227 HydrophobicContact CD2-CB 4.02Å; L204-K230 HydrophobicContact CD1-CB 3.74Å; L204-K230 HydrophobicContact CD1-CD 4.39Å; L204-W233 PolarHBondContact N-O 3.42Å; L204-V234 HydrophobicContact CB-CG1 3.7Å; L204-V234 HydrophobicContact CG-CG1 4.42Å
205	N	91.4	Very high	87.8	Confident	47 Å²	47	66 Å²	66	25%	0.251	33%	0.328	S	S	.	.			trans	-70.4	140.4	171.6	-74.1	6.6	0	0	0	109.9	F196 K198 Y207	F196-N205 CarbonylContact O-C 3.5Å; F196-N205 VanDerWaalsContact O-CA 3.3Å; F196-N205 WeakPolarHBondContact O-CA 3.5Å; K198-N205 WeakPolarHBondContact CB-OD1 3.25Å; K198-N205 WeakPolarHBondContact CG-OD1 3.44Å; K198-N205 PolarHBondContact N-OD1 3.47Å; N205-Y207 HydrophobicContact CB-CE2 4.02Å; N205-Y207 PolarHBondContact ND2-OH 2.79Å; N205-Y207 VanDerWaalsContact ND2-OH 3.09Å
206	L	91.4	Very high	87.2	Confident	3 Å²	3	65.3 Å²	65.3	2%	0.016	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-114.5	141.9	169.4	-57.8	-179.8	0	0	0	110.1	V192 D195 F196 V212 V234 L239	V192-L206 HydrophobicContact CB-CB 4.47Å; V192-L206 HydrophobicContact CG1-CB 3.66Å; V192-L206 HydrophobicContact CG1-CD1 4.31Å; V192-L206 HydrophobicContact CG2-CB 3.92Å; V192-L206 HydrophobicContact CG2-CD1 4.24Å; V192-L206 HydrophobicContact CG2-CD2 3.82Å; V192-L206 HydrophobicContact CG2-CG 4.23Å; D195-L206 WeakPolarHBondContact CA-O 3.43Å; F196-L206 HydrophobicContact CB-CB 3.95Å; F196-L206 HydrophobicContact CB-CD1 4.17Å; F196-L206 HydrophobicContact CB-CG 4.15Å; F196-L206 PolarHBondContact N-O 3.03Å; F196-L206 PolarHBondContact O-N 3.4Å; L206-V212 HydrophobicContact CD2-CG1 3.83Å; L206-V234 HydrophobicContact CD1-CB 4Å; L206-V234 HydrophobicContact CD1-CG1 4.35Å; L206-V234 HydrophobicContact CD1-CG2 4.34Å; L206-V234 HydrophobicContact CD2-CB 4.28Å; L206-V234 HydrophobicContact CD2-CG1 3.81Å; L206-V234 HydrophobicContact CD2-CG2 4.47Å; L206-V234 HydrophobicContact CG-CB 4.22Å; L206-V234 HydrophobicContact CG-CG1 4.01Å; L206-L239 HydrophobicContact CD1-CD2 3.76Å; L206-L239 HydrophobicContact CD2-CD2 4.48Å
207	Y	89.9	Confident	86.7	Confident	128 Å²	128	66.8 Å²	66.8	50%	0.502	33%	0.329	S	S	.	.			trans	-121.2	140.4	172.5	-54.5	-79.5	0	0	0	111.1	V192 N205 G209 D210	V192-Y207 VanDerWaalsContact CB-O 3.29Å; V192-Y207 WeakPolarHBondContact CB-O 3.32Å; V192-Y207 VanDerWaalsContact CG1-O 3.23Å; V192-Y207 WeakPolarHBondContact CG1-O 3.37Å; N205-Y207 HydrophobicContact CB-CE2 4.02Å; N205-Y207 PolarHBondContact ND2-OH 2.79Å; N205-Y207 VanDerWaalsContact ND2-OH 3.09Å; Y207-G209 PolarHBondContact O-N 2.93Å; Y207-D210 WeakPolarHBondContact CB-OD2 3.22Å; Y207-D210 WeakPolarHBondContact O-CB 3.49Å; Y207-D210 PolarHBondContact O-N 2.88Å; Y207-D210 VanDerWaalsContact O-N 3.09Å
208	T	90.1	Very high	86.2	Confident	34 Å²	34	61.5 Å²	61.5	21%	0.209	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	110.8	-167.1	-55.2	0	0	0	0	112.3	I193 A194 D195 K339	I193-T208 WeakPolarHBondContact O-CG2 3.3Å; A194-T208 VanDerWaalsContact C-OG1 3.29Å; A194-T208 VanDerWaalsContact CA-OG1 3.25Å; A194-T208 WeakPolarHBondContact CA-OG1 3.39Å; D195-T208 VanDerWaalsContact CG-OG1 3.28Å; D195-T208 PolarHBondContact N-OG1 3.3Å; D195-T208 VanDerWaalsContact N-OG1 3.09Å; D195-T208 VanDerWaalsContact OD1-CB 3.31Å; D195-T208 WeakPolarHBondContact OD1-CB 3.28Å; D195-T208 PolarHBondContact OD1-N 3.25Å; D195-T208 PolarHBondContact OD1-OG1 3.12Å; T208-K339 HydrophobicContact CG2-CB 3.86Å; T208-K339 HydrophobicContact CG2-CD 3.57Å; T208-K339 HydrophobicContact CG2-CG 3.86Å
209	G	79.8	Confident	85.9	Confident	21 Å²	21	60.8 Å²	60.8	22%	0.216	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	111.7	-12.9	178.7	0	0	0	0	0	114.6	V192 Y207	V192-G209 PolarHBondContact O-N 3.37Å; Y207-G209 PolarHBondContact O-N 2.93Å
210	D	83.9	Confident	85.9	Confident	65 Å²	65	57.7 Å²	57.7	35%	0.348	28%	0.283	S	S	.	.			trans	-61.5	161.8	174.4	-71.7	-2.4	0	0	0	112.1	R191 V192 Y207	R191-D210 CarbonylContact C-O 3.59Å; R191-D210 WeakPolarHBondContact CA-O 3.36Å; R191-D210 WeakPolarHBondContact CG-O 3.4Å; V192-D210 HydrophobicContact CB-CB 4.43Å; V192-D210 HydrophobicContact CG2-CB 4.02Å; V192-D210 PolarHBondContact N-O 2.71Å; Y207-D210 WeakPolarHBondContact CB-OD2 3.22Å; Y207-D210 WeakPolarHBondContact O-CB 3.49Å; Y207-D210 PolarHBondContact O-N 2.88Å; Y207-D210 VanDerWaalsContact O-N 3.09Å
211	F	84	Confident	86.1	Confident	100 Å²	100	55.7 Å²	55.7	44%	0.439	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	139.2	173.3	-59.1	-82.7	0	0	0	110.4	V109 T189 Y190 R191 L242	V109-F211 HydrophobicContact CG1-CE1 4.12Å; V109-F211 HydrophobicContact CG2-CZ 4.43Å; T189-F211 HydrophobicContact CG2-CB 4.2Å; Y190-F211 CarbonylContact O-C 3.58Å; Y190-F211 WeakPolarHBondContact O-CA 3.4Å; R191-F211 HydrophobicContact CB-CD1 4.08Å; R191-F211 HydrophobicContact CB-CE1 4.12Å; R191-F211 HydrophobicContact CG-CD1 4.31Å; R191-F211 HydrophobicContact CG-CE1 4.13Å; F211-L242 HydrophobicContact CD1-CD1 4.32Å; F211-L242 HydrophobicContact CD1-CD2 4Å; F211-L242 HydrophobicContact CE1-CD1 4.5Å; F211-L242 HydrophobicContact CE1-CD2 3.77Å
212	V	83.5	Confident	86.3	Confident	2 Å²	2	48 Å²	48	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	144.1	176.9	-61.8	0	0	0	0	110.7	T189 Y190 V192 L206 I214 C225 C227 L239	T189-V212 WeakPolarHBondContact CA-O 3.47Å; Y190-V212 PolarHBondContact N-O 2.99Å; Y190-V212 PolarHBondContact O-N 3.45Å; V192-V212 HydrophobicContact CG2-CG1 4.2Å; L206-V212 HydrophobicContact CD2-CG1 3.83Å; V212-I214 HydrophobicContact CG2-CD1 4Å; V212-C225 HydrophobicContact CB-CB 4.26Å; V212-C227 HydrophobicContact CG1-CB 4.27Å; V212-L239 HydrophobicContact CG2-CD1 3.92Å; V212-L239 HydrophobicContact CG2-CD2 3.67Å; V212-L239 HydrophobicContact CG2-CG 4.44Å
213	E	82.2	Confident	86.5	Confident	61 Å²	61	43 Å²	43	29%	0.285	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	116.9	175.4	-75.5	-179.2	154.1	0	0	108.7	K44 L187 D188 V215 C225 Q226	K44-E213 IonicContact NZ-OE1 2.69Å; L187-E213 HydrophobicContact CB-CB 3.78Å; L187-E213 HydrophobicContact CB-CG 4.35Å; L187-E213 HydrophobicContact CD1-CB 3.92Å; L187-E213 HydrophobicContact CG-CB 4.49Å; D188-E213 CarbonylContact O-C 3.57Å; D188-E213 WeakPolarHBondContact O-CA 3.35Å; E213-V215 PolarHBondContact O-N 3.45Å; E213-C225 CarbonylContact O-C 3.56Å; E213-C225 WeakPolarHBondContact O-CA 3.36Å; E213-Q226 HydrophobicContact CB-CB 4.45Å; E213-Q226 PolarHBondContact N-O 3.07Å; E213-Q226 PolarHBondContact O-N 2.85Å
214	I	83.7	Confident	86.3	Confident	8 Å²	8	44 Å²	44	4%	0.041	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	118.1	-176.9	-46.5	-53.9	0	0	0	109.6	L187 D188 Y190 V212 K217 W223 C225 L239	L187-I214 WeakPolarHBondContact CB-O 3.44Å; L187-I214 WeakPolarHBondContact CD2-O 3.41Å; D188-I214 HydrophobicContact CB-CB 4.12Å; D188-I214 HydrophobicContact CB-CG1 4.16Å; D188-I214 WeakPolarHBondContact O-CG1 3.39Å; D188-I214 PolarHBondContact O-N 3.17Å; Y190-I214 HydrophobicContact CD2-CD1 3.94Å; Y190-I214 HydrophobicContact CD2-CG1 3.4Å; Y190-I214 VanDerWaalsContact CD2-CG1 3.4Å; Y190-I214 HydrophobicContact CE2-CG1 3.86Å; Y190-I214 HydrophobicContact CG-CD1 4.05Å; Y190-I214 HydrophobicContact CG-CG1 4.03Å; V212-I214 HydrophobicContact CG2-CD1 4Å; I214-K217 HydrophobicContact CG2-CG 3.62Å; I214-W223 HydrophobicContact CD1-CE3 3.92Å; I214-W223 HydrophobicContact CD1-CZ3 4.37Å; I214-W223 HydrophobicContact CG1-CE3 4.25Å; I214-W223 HydrophobicContact CG1-CZ3 4.43Å; I214-W223 HydrophobicContact CG2-CE3 4.11Å; I214-C225 WeakPolarHBondContact CD1-SG 3.4Å; I214-L239 HydrophobicContact CD1-CD1 3.74Å
215	V	80.3	Confident	86.2	Confident	56 Å²	56	43.3 Å²	43.3	34%	0.339	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-39.2	176.2	-173.9	0	0	0	0	110.8	L187 E213 F224 Q226	L187-V215 HydrophobicContact CD1-CG2 3.77Å; E213-V215 PolarHBondContact O-N 3.45Å; V215-F224 WeakPolarHBondContact CA-O 3.32Å; V215-F224 HydrophobicContact CB-CD1 3.78Å; V215-F224 WeakPolarHBondContact CB-O 3.39Å; V215-F224 HydrophobicContact CG1-CD1 3.87Å; V215-F224 HydrophobicContact CG1-CE1 4.4Å; V215-F224 HydrophobicContact CG2-CD1 4.19Å; V215-F224 PolarHBondContact N-O 3.23Å; V215-Q226 HydrophobicContact CG2-CB 4.2Å
216	E	80.6	Confident	85.7	Confident	89 Å²	89	42.9 Å²	42.9	42%	0.416	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	124.7	-175.1	-165.1	-176	127.4	0	0	110.5	N218 W223 F224 W233	E216-N218 PolarHBondContact OE1-ND2 3.22Å; E216-W223 CarbonylContact O-C 3.57Å; E216-W223 VanDerWaalsContact O-CA 3.32Å; E216-W223 WeakPolarHBondContact O-CA 3.47Å; E216-F224 HydrophobicContact CB-CB 3.84Å; E216-F224 PolarHBondContact N-O 3.41Å; E216-F224 VanDerWaalsContact N-O 3.15Å; E216-F224 PolarHBondContact O-N 3.07Å; E216-W233 WeakPolarHBondContact OE1-CH2 3.4Å
217	K	84.1	Confident	84.9	Confident	47 Å²	47	44.2 Å²	44.2	20%	0.204	22%	0.218	C	C	.	.			trans	-99.6	119.5	172.2	-63.3	177.3	-169.5	167.6	0	109.2	D188 Y190 I214 W223 E247 E249	D188-K217 WeakPolarHBondContact OD2-CE 3.49Å; D188-K217 IonicContact OD2-NZ 2.63Å; D188-K217 PolarHBondContact OD2-NZ 2.98Å; Y190-K217 PolarHBondContact OH-NZ 3.11Å; I214-K217 HydrophobicContact CG2-CG 3.62Å; K217-W223 HydrophobicContact CB-CD2 4.18Å; K217-W223 HydrophobicContact CB-CG 4.36Å; K217-W223 HydrophobicContact CB-CZ2 4.35Å; K217-W223 HydrophobicContact CD-CH2 3.99Å; K217-W223 HydrophobicContact CD-CZ2 4.05Å; K217-W223 HydrophobicContact CD-CZ3 4.28Å; K217-W223 HydrophobicContact CG-CD2 3.82Å; K217-W223 HydrophobicContact CG-CE3 4Å; K217-W223 HydrophobicContact CG-CG 4.36Å; K217-W223 HydrophobicContact CG-CH2 4.21Å; K217-W223 HydrophobicContact CG-CZ2 4.05Å; K217-W223 HydrophobicContact CG-CZ3 4.18Å; K217-E247 IonicContact NZ-OE1 3.32Å; K217-E249 WeakPolarHBondContact CD-OE2 3.05Å; K217-E249 IonicContact NZ-OE1 3.58Å; K217-E249 PolarHBondContact NZ-OE1 3.17Å; K217-E249 IonicContact NZ-OE2 2.85Å; K217-E249 PolarHBondContact NZ-OE2 2.85Å
218	N	83.4	Confident	84.1	Confident	50 Å²	50	45.5 Å²	45.5	27%	0.267	23%	0.229	S	C	.	.			trans	-108.6	143.2	172.5	-78.8	-51.8	0	0	0	112.2	E216 N220 G221 W223 W233	E216-N218 PolarHBondContact OE1-ND2 3.22Å; N218-N220 WeakPolarHBondContact CB-OD1 3.38Å; N218-N220 PolarHBondContact O-N 2.7Å; N218-N220 VanDerWaalsContact O-N 3.08Å; N218-G221 PolarHBondContact O-N 3.29Å; N218-G221 VanDerWaalsContact O-N 3.1Å; N218-W223 PolarHBondContact O-NE1 3.19Å; N218-W233 VanDerWaalsContact ND2-CH2 3.35Å; N218-W233 WeakPolarHBondContact ND2-CH2 3.49Å; N218-W233 WeakPolarHBondContact ND2-CZ3 3.3Å
219	Q	84	Confident	83.3	Confident	89 Å²	89	48.9 Å²	48.9	42%	0.416	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-6	176.8	-60.2	-173.8	-12.9	0	0	113.5	G221 L289 W293 S306	Q219-G221 VanDerWaalsContact C-N 3.27Å; Q219-L289 HydrophobicContact CG-CD2 3.88Å; Q219-W293 HydrophobicContact CB-CZ2 3.96Å; Q219-W293 PolarHBondContact O-NE1 3.03Å; Q219-S306 PolarHBondContact O-OG 3.4Å
220	N	87.7	Confident	83.3	Confident	37 Å²	37	53.8 Å²	53.8	20%	0.198	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-0.7	172.1	72	1.7	0	0	0	113.7	N218 W222 G291 S306 P329	N218-N220 WeakPolarHBondContact CB-OD1 3.38Å; N218-N220 PolarHBondContact O-N 2.7Å; N218-N220 VanDerWaalsContact O-N 3.08Å; N220-W222 VanDerWaalsContact C-N 3.28Å; N220-W222 PolarHBondContact O-N 3.15Å; N220-W222 PolarHBondContact OD1-N 3.23Å; N220-W222 PolarHBondContact OD1-O 3.19Å; N220-G291 WeakPolarHBondContact O-CA 3.42Å; N220-S306 WeakPolarHBondContact CA-OG 3.38Å; N220-P329 WeakPolarHBondContact O-CG 3.47Å
221	G	90.8	Very high	83.4	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	80	-1	177.7	0	0	0	0	0	115.9	N218 Q219 P235 A236 L289 D290	N218-G221 PolarHBondContact O-N 3.29Å; N218-G221 VanDerWaalsContact O-N 3.1Å; Q219-G221 VanDerWaalsContact C-N 3.27Å; G221-P235 WeakPolarHBondContact O-CA 3.21Å; G221-A236 PolarHBondContact O-N 2.93Å; G221-L289 WeakPolarHBondContact CA-O 3.17Å; G221-D290 VanDerWaalsContact CA-C 3.43Å
222	W	92.6	Very high	83.5	Confident	17 Å²	17	53.4 Å²	53.4	6%	0.064	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	116.4	168.9	-71.2	102.2	0	0	0	109	F196 E203 N220 W233 P235 R327 P329	F196-W222 HydrophobicContact CE1-CZ3 4.32Å; F196-W222 HydrophobicContact CE2-CH2 4.41Å; F196-W222 AromaticContact CZ-CH2 3.83Å; F196-W222 HydrophobicContact CZ-CH2 3.83Å; F196-W222 AromaticContact CZ-CZ3 3.9Å; F196-W222 HydrophobicContact CZ-CZ3 3.9Å; E203-W222 HydrophobicContact CG-CH2 4.33Å; E203-W222 HydrophobicContact CG-CZ3 3.9Å; N220-W222 VanDerWaalsContact C-N 3.28Å; N220-W222 PolarHBondContact O-N 3.15Å; N220-W222 PolarHBondContact OD1-N 3.23Å; N220-W222 PolarHBondContact OD1-O 3.19Å; W222-W233 HydrophobicContact CB-CE3 4.03Å; W222-W233 HydrophobicContact CE3-CB 4.11Å; W222-W233 VanDerWaalsContact O-CZ3 3.31Å; W222-W233 WeakPolarHBondContact O-CZ3 3.12Å; W222-P235 HydrophobicContact CZ3-CB 4.42Å; W222-P235 HydrophobicContact CZ3-CG 4.5Å; W222-R327 PolarHBondContact NE1-O 3.39Å; W222-P329 HydrophobicContact CD2-CB 4.32Å; W222-P329 HydrophobicContact CZ2-CB 4.32Å
223	W	93.1	Very high	84	Confident	5 Å²	5	56.7 Å²	56.7	2%	0.019	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	136.9	179.9	-66.9	4.2	0	0	0	110.2	Y190 I214 E216 K217 N218 W233 V234 A236 L239 L289	Y190-W223 AromaticContact CD1-CZ3 3.93Å; Y190-W223 HydrophobicContact CD1-CZ3 3.93Å; Y190-W223 AromaticContact CE1-CH2 3.87Å; Y190-W223 HydrophobicContact CE1-CH2 3.87Å; Y190-W223 AromaticContact CE1-CZ3 3.53Å; Y190-W223 HydrophobicContact CE1-CZ3 3.53Å; Y190-W223 HydrophobicContact CE2-CZ3 4.39Å; Y190-W223 AromaticContact CZ-CZ3 3.82Å; I214-W223 HydrophobicContact CD1-CE3 3.92Å; I214-W223 HydrophobicContact CD1-CZ3 4.37Å; I214-W223 HydrophobicContact CG1-CE3 4.25Å; I214-W223 HydrophobicContact CG1-CZ3 4.43Å; I214-W223 HydrophobicContact CG2-CE3 4.11Å; E216-W223 CarbonylContact O-C 3.57Å; E216-W223 VanDerWaalsContact O-CA 3.32Å; E216-W223 WeakPolarHBondContact O-CA 3.47Å; K217-W223 HydrophobicContact CB-CD2 4.18Å; K217-W223 HydrophobicContact CB-CG 4.36Å; K217-W223 HydrophobicContact CB-CZ2 4.35Å; K217-W223 HydrophobicContact CD-CH2 3.99Å; K217-W223 HydrophobicContact CD-CZ2 4.05Å; K217-W223 HydrophobicContact CD-CZ3 4.28Å; K217-W223 HydrophobicContact CG-CD2 3.82Å; K217-W223 HydrophobicContact CG-CE3 4Å; K217-W223 HydrophobicContact CG-CG 4.36Å; K217-W223 HydrophobicContact CG-CH2 4.21Å; K217-W223 HydrophobicContact CG-CZ2 4.05Å; K217-W223 HydrophobicContact CG-CZ3 4.18Å; N218-W223 PolarHBondContact O-NE1 3.19Å; W223-W233 VanDerWaalsContact C-CE3 3.47Å; W223-W233 WeakPolarHBondContact O-CA 3.3Å; W223-V234 PolarHBondContact N-O 3.27Å; W223-V234 PolarHBondContact O-N 3.37Å; W223-A236 HydrophobicContact CD2-CB 3.57Å; W223-A236 HydrophobicContact CE3-CB 4.12Å; W223-A236 HydrophobicContact CG-CB 3.9Å; W223-A236 HydrophobicContact CH2-CB 4.35Å; W223-A236 HydrophobicContact CZ2-CB 3.81Å; W223-A236 HydrophobicContact CZ3-CB 4.48Å; W223-L239 HydrophobicContact CE3-CD1 4.1Å; W223-L289 HydrophobicContact CZ2-CB 4.08Å; W223-L289 HydrophobicContact CZ2-CD1 4.37Å; W223-L289 PolarHBondContact NE1-O 3.23Å
224	F	86.5	Confident	84.6	Confident	50 Å²	50	53.8 Å²	53.8	22%	0.219	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	119.4	177	-165.5	-123.3	0	0	0	108.6	V215 E216 R231 W233	V215-F224 WeakPolarHBondContact CA-O 3.32Å; V215-F224 HydrophobicContact CB-CD1 3.78Å; V215-F224 WeakPolarHBondContact CB-O 3.39Å; V215-F224 HydrophobicContact CG1-CD1 3.87Å; V215-F224 HydrophobicContact CG1-CE1 4.4Å; V215-F224 HydrophobicContact CG2-CD1 4.19Å; V215-F224 PolarHBondContact N-O 3.23Å; E216-F224 HydrophobicContact CB-CB 3.84Å; E216-F224 PolarHBondContact N-O 3.41Å; E216-F224 VanDerWaalsContact N-O 3.15Å; E216-F224 PolarHBondContact O-N 3.07Å; F224-R231 HydrophobicContact CE1-CB 4.23Å; F224-R231 HydrophobicContact CE2-CB 4.24Å; F224-R231 HydrophobicContact CZ-CB 3.69Å; F224-W233 HydrophobicContact CB-CD2 4.26Å; F224-W233 HydrophobicContact CB-CE3 3.91Å; F224-W233 HydrophobicContact CB-CH2 3.81Å; F224-W233 HydrophobicContact CB-CZ2 4.17Å; F224-W233 HydrophobicContact CB-CZ3 3.67Å; F224-W233 HydrophobicContact CD2-CD2 4.04Å; F224-W233 AromaticContact CD2-CE2 3.89Å; F224-W233 HydrophobicContact CD2-CG 4.3Å; F224-W233 HydrophobicContact CD2-CZ2 4.25Å; F224-W233 HydrophobicContact CG-CZ2 4.42Å
225	C	86.9	Confident	85.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	149.1	-173.2	-63.7	0	0	0	0	111.4	V212 E213 I214 R231 G232 V234	V212-C225 HydrophobicContact CB-CB 4.26Å; E213-C225 CarbonylContact O-C 3.56Å; E213-C225 WeakPolarHBondContact O-CA 3.36Å; I214-C225 WeakPolarHBondContact CD1-SG 3.4Å; C225-R231 VanDerWaalsContact O-CA 3.25Å; C225-R231 WeakPolarHBondContact O-CA 3.42Å; C225-G232 PolarHBondContact N-O 3.18Å; C225-G232 PolarHBondContact O-N 3.48Å; C225-V234 HydrophobicContact CB-CG2 4.06Å; C225-V234 WeakPolarHBondContact SG-CG2 3.22Å
226	Q	81.4	Confident	85.9	Confident	38 Å²	38	51 Å²	51	18%	0.178	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	137.5	164.2	179.7	161.6	-17.2	0	0	110.2	E213 V215 E228 K230 R231	E213-Q226 HydrophobicContact CB-CB 4.45Å; E213-Q226 PolarHBondContact N-O 3.07Å; E213-Q226 PolarHBondContact O-N 2.85Å; V215-Q226 HydrophobicContact CG2-CB 4.2Å; Q226-E228 PolarHBondContact NE2-O 3.16Å; Q226-K230 WeakPolarHBondContact CA-O 3.5Å; Q226-R231 HydrophobicContact CB-CG 3.95Å; Q226-R231 HydrophobicContact CG-CG 4.09Å; Q226-R231 VanDerWaalsContact OE1-CZ 3.23Å
227	C	75.6	Confident	86.6	Confident	31 Å²	31	46.8 Å²	46.8	21%	0.209	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	124.4	163.5	-173.3	0	0	0	0	108.2	L204 V212 S229 K230	L204-C227 HydrophobicContact CD2-CB 4.02Å; V212-C227 HydrophobicContact CG1-CB 4.27Å; C227-S229 PolarHBondContact O-N 2.75Å; C227-K230 PolarHBondContact N-O 3.5Å; C227-K230 PolarHBondContact O-N 3.4Å; C227-K230 VanDerWaalsContact O-O 3.1Å
228	E	71.9	Confident	87.1	Confident	156 Å²	156	46 Å²	46	73%	0.729	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	-104	-173.4	-55.1	-178.7	138.7	0	0	113.2	Q226	Q226-E228 PolarHBondContact NE2-O 3.16Å
229	S	73.2	Confident	87.6	Confident	105 Å²	105	43.7 Å²	43.7	73%	0.734	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.9	1.5	-178.2	55.9	0	0	0	0	113.3	C227	C227-S229 PolarHBondContact O-N 2.75Å
230	K	79.6	Confident	87.9	Confident	123 Å²	123	39.7 Å²	39.7	54%	0.535	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	148.8	-176.2	-62.2	164.4	-170.9	150.9	0	110.2	L204 Q226 C227	L204-K230 HydrophobicContact CD1-CB 3.74Å; L204-K230 HydrophobicContact CD1-CD 4.39Å; Q226-K230 WeakPolarHBondContact CA-O 3.5Å; C227-K230 PolarHBondContact N-O 3.5Å; C227-K230 PolarHBondContact O-N 3.4Å; C227-K230 VanDerWaalsContact O-O 3.1Å
231	R	86.4	Confident	87.8	Confident	156 Å²	156	38.8 Å²	38.8	59%	0.589	18%	0.184	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	149.4	173.6	-65.9	-177.7	175.4	171.2	-3.9	110.2	F224 C225 Q226	F224-R231 HydrophobicContact CE1-CB 4.23Å; F224-R231 HydrophobicContact CE2-CB 4.24Å; F224-R231 HydrophobicContact CZ-CB 3.69Å; C225-R231 VanDerWaalsContact O-CA 3.25Å; C225-R231 WeakPolarHBondContact O-CA 3.42Å; Q226-R231 HydrophobicContact CB-CG 3.95Å; Q226-R231 HydrophobicContact CG-CG 4.09Å; Q226-R231 VanDerWaalsContact OE1-CZ 3.23Å
232	G	87	Confident	87.2	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.2	170.2	176.1	0	0	0	0	0	112.8	H202 C225	H202-G232 CarbonylContact O-C 3.59Å; H202-G232 VanDerWaalsContact O-CA 3.26Å; H202-G232 WeakPolarHBondContact O-CA 3.34Å; C225-G232 PolarHBondContact N-O 3.18Å; C225-G232 PolarHBondContact O-N 3.48Å
233	W	93	Very high	86	Confident	72 Å²	72	42.4 Å²	42.4	27%	0.273	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	139.4	173.6	-62.8	100.2	0	0	0	111.2	H202 E203 L204 E216 N218 W222 W223 F224	H202-W233 PolarHBondContact O-N 2.91Å; E203-W233 WeakPolarHBondContact CA-O 3.35Å; E203-W233 WeakPolarHBondContact CB-O 3.3Å; E203-W233 HydrophobicContact CG-CB 4.3Å; L204-W233 PolarHBondContact N-O 3.42Å; E216-W233 WeakPolarHBondContact OE1-CH2 3.4Å; N218-W233 VanDerWaalsContact ND2-CH2 3.35Å; N218-W233 WeakPolarHBondContact ND2-CH2 3.49Å; N218-W233 WeakPolarHBondContact ND2-CZ3 3.3Å; W222-W233 HydrophobicContact CB-CE3 4.03Å; W222-W233 HydrophobicContact CE3-CB 4.11Å; W222-W233 VanDerWaalsContact O-CZ3 3.31Å; W222-W233 WeakPolarHBondContact O-CZ3 3.12Å; W223-W233 VanDerWaalsContact C-CE3 3.47Å; W223-W233 WeakPolarHBondContact O-CA 3.3Å; F224-W233 HydrophobicContact CB-CD2 4.26Å; F224-W233 HydrophobicContact CB-CE3 3.91Å; F224-W233 HydrophobicContact CB-CH2 3.81Å; F224-W233 HydrophobicContact CB-CZ2 4.17Å; F224-W233 HydrophobicContact CB-CZ3 3.67Å; F224-W233 HydrophobicContact CD2-CD2 4.04Å; F224-W233 AromaticContact CD2-CE2 3.89Å; F224-W233 HydrophobicContact CD2-CG 4.3Å; F224-W233 HydrophobicContact CD2-CZ2 4.25Å; F224-W233 HydrophobicContact CG-CZ2 4.42Å
234	V	94.7	Very high	85.1	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	153.4	174.8	-55.2	0	0	0	0	110.2	L204 L206 W223 C225 A236 L239	L204-V234 HydrophobicContact CB-CG1 3.7Å; L204-V234 HydrophobicContact CG-CG1 4.42Å; L206-V234 HydrophobicContact CD1-CB 4Å; L206-V234 HydrophobicContact CD1-CG1 4.35Å; L206-V234 HydrophobicContact CD1-CG2 4.34Å; L206-V234 HydrophobicContact CD2-CB 4.28Å; L206-V234 HydrophobicContact CD2-CG1 3.81Å; L206-V234 HydrophobicContact CD2-CG2 4.47Å; L206-V234 HydrophobicContact CG-CB 4.22Å; L206-V234 HydrophobicContact CG-CG1 4.01Å; W223-V234 PolarHBondContact N-O 3.27Å; W223-V234 PolarHBondContact O-N 3.37Å; C225-V234 HydrophobicContact CB-CG2 4.06Å; C225-V234 WeakPolarHBondContact SG-CG2 3.22Å; V234-A236 PolarHBondContact O-N 3.02Å; V234-L239 HydrophobicContact CG2-CD1 3.91Å; V234-L239 HydrophobicContact CG2-CG 4.49Å
235	P	95.9	Very high	84.6	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	124.7	179.9	31	-34.5	0	0	0	111.4	F196 G221 W222 S237 Y238 P329 P330	F196-P235 HydrophobicContact CD1-CG 4.47Å; F196-P235 HydrophobicContact CD2-CG 3.81Å; F196-P235 HydrophobicContact CE2-CG 3.93Å; F196-P235 HydrophobicContact CG-CG 4.11Å; F196-P235 HydrophobicContact CZ-CG 4.33Å; G221-P235 WeakPolarHBondContact O-CA 3.21Å; W222-P235 HydrophobicContact CZ3-CB 4.42Å; W222-P235 HydrophobicContact CZ3-CG 4.5Å; P235-S237 PolarHBondContact O-N 3.38Å; P235-S237 VanDerWaalsContact O-N 3.11Å; P235-Y238 HydrophobicContact CB-CD2 4.18Å; P235-Y238 HydrophobicContact CG-CD2 3.56Å; P235-Y238 HydrophobicContact CG-CE2 4.15Å; P235-Y238 HydrophobicContact CG-CG 3.98Å; P235-Y238 PolarHBondContact O-N 3.48Å; P235-P329 HydrophobicContact CB-CB 3.91Å; P235-P330 HydrophobicContact CB-CG 4Å; P235-P330 HydrophobicContact CG-CG 3.93Å
236	A	95.1	Very high	84.2	Confident	6 Å²	6	45.6 Å²	45.6	5%	0.05	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-59.1	-25.5	-179.2	0	0	0	0	0	113.5	G221 W223 V234 Y238 L239 R332	G221-A236 PolarHBondContact O-N 2.93Å; W223-A236 HydrophobicContact CD2-CB 3.57Å; W223-A236 HydrophobicContact CE3-CB 4.12Å; W223-A236 HydrophobicContact CG-CB 3.9Å; W223-A236 HydrophobicContact CH2-CB 4.35Å; W223-A236 HydrophobicContact CZ2-CB 3.81Å; W223-A236 HydrophobicContact CZ3-CB 4.48Å; V234-A236 PolarHBondContact O-N 3.02Å; A236-Y238 PolarHBondContact O-N 3.47Å; A236-L239 PolarHBondContact O-N 3.24Å; A236-L239 VanDerWaalsContact O-N 3.15Å; A236-R332 PolarHBondContact O-NH2 3.02Å
237	S	95.3	Very high	84.3	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-60.5	-21.1	173	52.8	0	0	0	0	114.5	I193 P235 P330 R332 I335	I193-S237 WeakPolarHBondContact CD1-O 3.15Å; P235-S237 PolarHBondContact O-N 3.38Å; P235-S237 VanDerWaalsContact O-N 3.11Å; S237-P330 VanDerWaalsContact CB-O 3.27Å; S237-P330 WeakPolarHBondContact CB-O 3.26Å; S237-P330 PolarHBondContact OG-O 2.84Å; S237-R332 PolarHBondContact O-NE 3.04Å; S237-R332 PolarHBondContact O-NH2 2.94Å; S237-I335 WeakPolarHBondContact O-CD1 3.48Å
238	Y	95.9	Very high	84.1	Confident	30 Å²	30	46.5 Å²	46.5	12%	0.118	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-93.1	-3.7	178	-79.5	-118.5	0	0	0	113.3	I193 A194 D195 F196 P235 A236 P330 I335	I193-Y238 WeakPolarHBondContact CG1-O 3.39Å; I193-Y238 PolarHBondContact N-O 3.28Å; A194-Y238 HydrophobicContact CB-CD1 3.88Å; A194-Y238 HydrophobicContact CB-CE1 3.98Å; A194-Y238 WeakPolarHBondContact O-CD1 3.44Å; D195-Y238 WeakPolarHBondContact O-CE1 3.49Å; F196-Y238 HydrophobicContact CB-CD1 3.77Å; F196-Y238 HydrophobicContact CB-CE1 3.94Å; F196-Y238 HydrophobicContact CB-CG 4.42Å; F196-Y238 HydrophobicContact CD2-CE1 4.42Å; P235-Y238 HydrophobicContact CB-CD2 4.18Å; P235-Y238 HydrophobicContact CG-CD2 3.56Å; P235-Y238 HydrophobicContact CG-CE2 4.15Å; P235-Y238 HydrophobicContact CG-CG 3.98Å; P235-Y238 PolarHBondContact O-N 3.48Å; A236-Y238 PolarHBondContact O-N 3.47Å; Y238-P330 HydrophobicContact CD2-CG 4.25Å; Y238-P330 HydrophobicContact CE2-CB 3.91Å; Y238-P330 HydrophobicContact CE2-CG 3.51Å; Y238-I335 HydrophobicContact CD1-CD1 4.18Å; Y238-I335 HydrophobicContact CD2-CD1 3.48Å; Y238-I335 VanDerWaalsContact CD2-CD1 3.48Å; Y238-I335 HydrophobicContact CD2-CG1 4.22Å; Y238-I335 HydrophobicContact CE1-CD1 4.21Å; Y238-I335 HydrophobicContact CE1-CG1 4.35Å; Y238-I335 HydrophobicContact CE2-CD1 3.48Å; Y238-I335 VanDerWaalsContact CE2-CD1 3.48Å; Y238-I335 HydrophobicContact CE2-CG1 3.68Å; Y238-I335 HydrophobicContact CG-CD1 3.84Å
239	L	93.4	Very high	84.4	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	155.1	-176.9	-56.9	-175.7	0	0	0	111.5	Y190 R191 V192 L206 V212 I214 W223 V234 A236 R332	Y190-L239 HydrophobicContact CD1-CB 4.02Å; R191-L239 CarbonylContact O-C 3.13Å; R191-L239 VanDerWaalsContact O-CA 3.32Å; R191-L239 WeakPolarHBondContact O-CA 3.44Å; V192-L239 HydrophobicContact CG2-CD2 4.06Å; L206-L239 HydrophobicContact CD1-CD2 3.76Å; L206-L239 HydrophobicContact CD2-CD2 4.48Å; V212-L239 HydrophobicContact CG2-CD1 3.92Å; V212-L239 HydrophobicContact CG2-CD2 3.67Å; V212-L239 HydrophobicContact CG2-CG 4.44Å; I214-L239 HydrophobicContact CD1-CD1 3.74Å; W223-L239 HydrophobicContact CE3-CD1 4.1Å; V234-L239 HydrophobicContact CG2-CD1 3.91Å; V234-L239 HydrophobicContact CG2-CG 4.49Å; A236-L239 PolarHBondContact O-N 3.24Å; A236-L239 VanDerWaalsContact O-N 3.15Å; L239-R332 PolarHBondContact O-NH1 3.16Å; L239-R332 PolarHBondContact O-NH2 3.21Å
240	E	90.2	Very high	84.8	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.019	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143	168.8	67.6	-175.2	174.5	0	0	112.1	Y190 R191 I193 S340 I341 H342	Y190-E240 WeakPolarHBondContact CA-O 3.47Å; Y190-E240 WeakPolarHBondContact CB-O 3.48Å; Y190-E240 WeakPolarHBondContact CD1-O 3.24Å; R191-E240 HydrophobicContact CB-CG 4.14Å; R191-E240 PolarHBondContact N-O 3.27Å; R191-E240 PolarHBondContact O-N 2.94Å; I193-E240 HydrophobicContact CG2-CB 3.82Å; I193-E240 VanDerWaalsContact CG2-CD 3.47Å; I193-E240 HydrophobicContact CG2-CG 3.6Å; E240-S340 WeakPolarHBondContact OE1-CA 3.46Å; E240-S340 VanDerWaalsContact OE2-CA 3.31Å; E240-S340 WeakPolarHBondContact OE2-CA 3.25Å; E240-S340 WeakPolarHBondContact OE2-CB 3.26Å; E240-S340 PolarHBondContact OE2-OG 3Å; E240-I341 PolarHBondContact OE1-N 2.92Å; E240-H342 IonicContact OE2-CD2 3.82Å
241	P	84.4	Confident	84.9	Confident	18 Å²	18	37.6 Å²	37.6	12%	0.117	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	153.2	172.8	-14.1	26.1	0	0	0	111.1	Y190 H342	Y190-P241 HydrophobicContact CD1-CG 4.31Å; Y190-P241 HydrophobicContact CE1-CB 4.05Å; Y190-P241 HydrophobicContact CE1-CG 3.62Å; P241-H342 PolarHBondContact O-NE2 2.94Å
242	L	79	Confident	85	Confident	20 Å²	20	38.8 Å²	38.8	11%	0.105	21%	0.206	C	C	.	.	S	Bend	trans	-83.7	-20.7	-178.4	-60.1	176.4	0	0	0	113.9	V109 T189 R191 F211 I341	V109-L242 HydrophobicContact CG1-CB 4.26Å; V109-L242 HydrophobicContact CG1-CD1 3.76Å; V109-L242 HydrophobicContact CG1-CD2 4.01Å; V109-L242 HydrophobicContact CG1-CG 4.22Å; T189-L242 HydrophobicContact CG2-CD1 3.92Å; T189-L242 VanDerWaalsContact O-CD1 3.26Å; T189-L242 WeakPolarHBondContact O-CD1 3.38Å; T189-L242 VanDerWaalsContact O-CG 3.27Å; T189-L242 WeakPolarHBondContact O-CG 3.27Å; R191-L242 HydrophobicContact CB-CD2 3.72Å; F211-L242 HydrophobicContact CD1-CD1 4.32Å; F211-L242 HydrophobicContact CD1-CD2 4Å; F211-L242 HydrophobicContact CE1-CD1 4.5Å; F211-L242 HydrophobicContact CE1-CD2 3.77Å; L242-I341 HydrophobicContact CD2-CD1 4.1Å
243	D	68.4	Low	85.2	Confident	74 Å²	74	40.5 Å²	40.5	40%	0.396	22%	0.217	S	C	.	.	S	Bend	trans	-83.8	-22.2	-178.3	-69.3	-51.6	0	0	0	114.5	S111 S114	S111-D243 VanDerWaalsContact CB-OD2 3.25Å; S111-D243 WeakPolarHBondContact CB-OD2 3.49Å; S111-D243 PolarHBondContact OG-OD1 2.9Å; S111-D243 PolarHBondContact OG-OD2 2.96Å; S114-D243 WeakPolarHBondContact CB-OD1 3.41Å; S114-D243 PolarHBondContact OG-OD1 2.88Å
244	G	73.1	Confident	85.1	Confident	16 Å²	16	41.2 Å²	41.2	17%	0.165	23%	0.226	C	C	.	.			trans	176.6	170.6	-174.8	0	0	0	0	0	111.1	E246 H342	G244-E246 PolarHBondContact O-N 3.41Å; G244-H342 VanDerWaalsContact C-NE2 3.26Å; G244-H342 WeakPolarHBondContact CA-CE1 3.38Å; G244-H342 PolarHBondContact N-CE1 2.78Å; G244-H342 VanDerWaalsContact N-CE1 3.3Å; G244-H342 PolarHBondContact O-NE2 3.36Å
245	P	75.2	Confident	85	Confident	31 Å²	31	42.8 Å²	42.8	20%	0.201	23%	0.232	C	C	.	.	S	Bend	trans	-75.1	-5.5	-179.6	33.8	-38.8	0	0	0	113.4	H342 K344 R346	P245-H342 HydrophobicContact CB-CB 4.05Å; P245-H342 HydrophobicContact CG-CB 4.37Å; P245-K344 WeakPolarHBondContact CB-O 3.23Å; P245-K344 HydrophobicContact CG-CB 4.45Å; P245-K344 WeakPolarHBondContact CG-O 3.32Å; P245-R346 HydrophobicContact CB-CB 4.31Å; P245-R346 WeakPolarHBondContact O-CB 3.02Å; P245-R346 WeakPolarHBondContact O-CD 3.32Å; P245-R346 WeakPolarHBondContact O-CG 3.29Å
246	E	80.1	Confident	84.8	Confident	75 Å²	75	47.5 Å²	47.5	35%	0.35	25%	0.254	S	S	.	.	S	Bend	trans	-103.2	139.4	-170.6	-154.5	59.5	-105.4	0	0	112.5	G244 R346 Q347	G244-E246 PolarHBondContact O-N 3.41Å; E246-R346 WeakPolarHBondContact OE1-CG 3.48Å; E246-R346 IonicContact OE1-CZ 2.76Å; E246-R346 VanDerWaalsContact OE1-CZ 3.32Å; E246-R346 IonicContact OE1-NE 2.75Å; E246-R346 PolarHBondContact OE1-NE 3.02Å; E246-R346 IonicContact OE1-NH1 3.2Å; E246-R346 PolarHBondContact OE1-NH1 3.03Å; E246-R346 WeakPolarHBondContact OE2-CG 3.48Å; E246-Q347 WeakPolarHBondContact OE2-CB 3.37Å; E246-Q347 PolarHBondContact OE2-N 3.06Å
247	E	82.3	Confident	84.7	Confident	18 Å²	18	48 Å²	48	8%	0.084	26%	0.26	C	S	.	.			trans	-85.3	123	-178.4	-176.8	49.3	-109	0	0	110.5	Y190 K217 E249 E250 L289	Y190-E247 WeakPolarHBondContact CE1-OE2 3.19Å; Y190-E247 PolarHBondContact OH-OE1 3.06Å; Y190-E247 PolarHBondContact OH-OE2 3.1Å; K217-E247 IonicContact NZ-OE1 3.32Å; E247-E249 VanDerWaalsContact C-N 3.32Å; E247-E249 PolarHBondContact O-N 2.91Å; E247-E249 PolarHBondContact OE1-N 2.77Å; E247-E250 HydrophobicContact CB-CB 3.98Å; E247-E250 HydrophobicContact CG-CB 3.97Å; E247-L289 HydrophobicContact CG-CD1 3.93Å
248	A	72.3	Confident	84.6	Confident	69 Å²	69	50.6 Å²	50.6	57%	0.57	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-14.4	-171.9	0	0	0	0	0	113.7
249	E	77.5	Confident	84.6	Confident	112 Å²	112	53 Å²	53	52%	0.523	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	5.2	-180	-71.7	160.6	-144.7	0	0	112.9	K217 E247 P251 L289	K217-E249 WeakPolarHBondContact CD-OE2 3.05Å; K217-E249 IonicContact NZ-OE1 3.58Å; K217-E249 PolarHBondContact NZ-OE1 3.17Å; K217-E249 IonicContact NZ-OE2 2.85Å; K217-E249 PolarHBondContact NZ-OE2 2.85Å; E247-E249 VanDerWaalsContact C-N 3.32Å; E247-E249 PolarHBondContact O-N 2.91Å; E247-E249 PolarHBondContact OE1-N 2.77Å; E249-P251 WeakPolarHBondContact O-CD 3.38Å; E249-L289 HydrophobicContact CB-CD1 4.01Å
250	E	81.3	Confident	84.8	Confident	36 Å²	36	53.2 Å²	53.2	17%	0.168	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-69.7	122.7	174.3	-174.9	155.4	-82	0	0	109.8	E247 L288 L289 R346	E247-E250 HydrophobicContact CB-CB 3.98Å; E247-E250 HydrophobicContact CG-CB 3.97Å; E250-L288 HydrophobicContact CG-CD2 4.1Å; E250-L288 WeakPolarHBondContact OE1-CD2 3.31Å; E250-L288 VanDerWaalsContact OE2-CD2 3.29Å; E250-L288 WeakPolarHBondContact OE2-CD2 3.44Å; E250-L289 PolarHBondContact OE1-N 2.82Å; E250-R346 IonicContact OE1-CZ 2.96Å; E250-R346 IonicContact OE1-NH1 2.84Å; E250-R346 IonicContact OE1-NH2 3.93Å; E250-R346 PolarHBondContact OE1-NH2 2.81Å; E250-R346 IonicContact OE2-CZ 2.71Å; E250-R346 VanDerWaalsContact OE2-CZ 3.28Å; E250-R346 IonicContact OE2-NH1 2.79Å; E250-R346 PolarHBondContact OE2-NH1 3.35Å; E250-R346 IonicContact OE2-NH2 2.81Å; E250-R346 PolarHBondContact OE2-NH2 3.46Å
251	P	83.4	Confident	85	Confident	50 Å²	50	55.2 Å²	55.2	33%	0.325	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-68.8	151.1	-177.7	28.4	-35.5	0	0	0	111.2	E249 H286 K287	E249-P251 WeakPolarHBondContact O-CD 3.38Å; P251-H286 PolarHBondContact O-CD2 2.89Å; P251-H286 VanDerWaalsContact O-CD2 3.3Å; P251-H286 PolarHBondContact O-NE2 3.26Å; P251-K287 WeakPolarHBondContact CD-O 3.34Å; P251-K287 HydrophobicContact CG-CB 4.08Å; P251-K287 VanDerWaalsContact CG-O 3.31Å; P251-K287 WeakPolarHBondContact CG-O 3.12Å
252	E	87.5	Confident	85.6	Confident	180 Å²	180	54.4 Å²	54.4	84%	0.841	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-66.8	152.7	172.6	-67.8	-166.7	168.3	0	0	112.1	D254	E252-D254 PolarHBondContact O-N 2.88Å
253	P	90.4	Very high	86.3	Confident	38 Å²	38	57.3 Å²	57.3	25%	0.247	31%	0.309	C	S	.	.			trans	-71.3	115.9	178.6	28	-34.9	0	0	0	112.2	Y255 I285 H286 L349 Y354	P253-Y255 HydrophobicContact CB-CE2 4.19Å; P253-Y255 HydrophobicContact CG-CE2 4.1Å; P253-I285 CarbonylContact C-O 3.58Å; P253-I285 WeakPolarHBondContact CA-O 3.44Å; P253-H286 HydrophobicContact CB-CB 4.05Å; P253-L349 HydrophobicContact CG-CD1 4.08Å; P253-Y354 HydrophobicContact CB-CE1 4.11Å
254	D	92.2	Very high	87.5	Confident	86 Å²	86	57.4 Å²	57.4	46%	0.46	31%	0.308	S	S	.	.			trans	-86.3	107	172.4	175.8	24.1	0	0	0	111.1	E252 E256 G257 I285	E252-D254 PolarHBondContact O-N 2.88Å; D254-E256 VanDerWaalsContact C-N 3.27Å; D254-E256 PolarHBondContact O-N 2.97Å; D254-E256 WeakPolarHBondContact OD1-CB 3.46Å; D254-E256 PolarHBondContact OD1-N 2.95Å; D254-G257 PolarHBondContact O-N 2.83Å; D254-G257 PolarHBondContact OD2-N 2.88Å; D254-I285 CarbonylContact C-O 3.59Å; D254-I285 PolarHBondContact N-O 2.9Å; D254-I285 CarbonylContact O-C 3.55Å; D254-I285 WeakPolarHBondContact O-CA 3.43Å; D254-I285 VanDerWaalsContact O-CB 3.28Å; D254-I285 WeakPolarHBondContact O-CB 3.27Å; D254-I285 VanDerWaalsContact O-O 3.13Å
255	Y	92.7	Very high	88.5	Confident	33 Å²	33	58.7 Å²	58.7	13%	0.129	32%	0.317	C	S	.	.	S	Bend	trans	-78.1	-6.6	177.3	-63.4	-70.2	0	0	0	114.2	P253 I285 R296 Y354 N357 Y361	P253-Y255 HydrophobicContact CB-CE2 4.19Å; P253-Y255 HydrophobicContact CG-CE2 4.1Å; Y255-I285 HydrophobicContact CD1-CD1 4.25Å; Y255-I285 HydrophobicContact CE1-CD1 4.28Å; Y255-R296 PolarHBondContact O-NH1 2.88Å; Y255-Y354 HydrophobicContact CE1-CD1 4.11Å; Y255-N357 HydrophobicContact CD1-CB 4.09Å; Y255-N357 HydrophobicContact CD2-CB 4.21Å; Y255-N357 HydrophobicContact CE1-CB 3.55Å; Y255-N357 HydrophobicContact CE2-CB 3.68Å; Y255-N357 HydrophobicContact CG-CB 4.4Å; Y255-N357 PolarHBondContact OH-ND2 2.84Å; Y255-Y361 WeakPolarHBondContact O-CD1 3.21Å; Y255-Y361 WeakPolarHBondContact O-CE1 3.48Å
256	E	91.5	Very high	89.5	Confident	99 Å²	99	58.5 Å²	58.5	46%	0.463	31%	0.312	S	S	.	.	S	Bend	trans	-61	-57	164.9	-173.6	136.8	-177	0	0	109.7	D254 R296 Y361 K365	D254-E256 VanDerWaalsContact C-N 3.27Å; D254-E256 PolarHBondContact O-N 2.97Å; D254-E256 WeakPolarHBondContact OD1-CB 3.46Å; D254-E256 PolarHBondContact OD1-N 2.95Å; E256-R296 PolarHBondContact O-NH2 2.89Å; E256-Y361 VanDerWaalsContact CA-CZ 3.42Å; E256-Y361 WeakPolarHBondContact CA-OH 3.41Å; E256-Y361 HydrophobicContact CB-CE1 4.37Å; E256-Y361 HydrophobicContact CB-CE2 4.43Å; E256-Y361 WeakPolarHBondContact CB-OH 3.38Å; E256-Y361 VanDerWaalsContact CD-OH 3.22Å; E256-Y361 VanDerWaalsContact CG-OH 3.32Å; E256-Y361 WeakPolarHBondContact CG-OH 3.48Å; E256-Y361 PolarHBondContact OE2-OH 3.07Å; E256-K365 IonicContact OE1-NZ 2.7Å; E256-K365 PolarHBondContact OE1-NZ 3.41Å; E256-K365 IonicContact OE2-NZ 2.67Å; E256-K365 PolarHBondContact OE2-NZ 2.9Å; E256-K365 VanDerWaalsContact OE2-NZ 3.14Å
257	G	91.7	Very high	90.3	Very high	16 Å²	16	62.3 Å²	62.3	17%	0.165	33%	0.33	C	S	.	.			trans	91.1	132	172	0	0	0	0	0	113.1	D254 V284	D254-G257 PolarHBondContact O-N 2.83Å; D254-G257 PolarHBondContact OD2-N 2.88Å; G257-V284 VanDerWaalsContact CA-O 3.3Å; G257-V284 WeakPolarHBondContact CA-O 3.48Å
258	E	94.4	Very high	90.9	Very high	55 Å²	55	62.6 Å²	62.6	26%	0.257	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127	-177.7	-170.9	175.8	-140.6	0	0	111.2	H260 V284 K287 K311	E258-H260 PolarHBondContact O-N 2.94Å; E258-H260 PolarHBondContact O-ND1 2.86Å; E258-H260 IonicContact OE2-CE1 2.64Å; E258-H260 PolarHBondContact OE2-CE1 3.09Å; E258-V284 PolarHBondContact N-O 3.39Å; E258-V284 PolarHBondContact O-N 2.85Å; E258-K287 VanDerWaalsContact OE2-CE 3.27Å; E258-K287 WeakPolarHBondContact OE2-CE 3.46Å; E258-K287 IonicContact OE2-NZ 3.14Å; E258-K287 PolarHBondContact OE2-NZ 2.84Å; E258-K311 HydrophobicContact CG-CD 4.27Å; E258-K311 VanDerWaalsContact OE1-CD 3.3Å; E258-K311 WeakPolarHBondContact OE1-CD 3.24Å; E258-K311 VanDerWaalsContact OE1-CE 3.26Å; E258-K311 WeakPolarHBondContact OE1-CE 3.38Å; E258-K311 IonicContact OE1-NZ 3.54Å; E258-K311 PolarHBondContact OE1-NZ 2.8Å
259	L	96.1	Very high	91.9	Very high	81 Å²	81	67 Å²	67	42%	0.424	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	123.5	-173	-152.5	104.2	0	0	0	112.3	T281 E283 S312	L259-T281 HydrophobicContact CD1-CG2 4.08Å; L259-T281 HydrophobicContact CD2-CG2 3.73Å; L259-T281 HydrophobicContact CG-CG2 3.8Å; L259-E283 HydrophobicContact CD1-CG 4.37Å; L259-S312 PolarHBondContact O-N 3.48Å; L259-S312 VanDerWaalsContact O-N 3.13Å; L259-S312 PolarHBondContact O-OG 3.44Å
260	H	96.2	Very high	92.8	Very high	7 Å²	7	64.4 Å²	64.4	3%	0.032	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.7	179.9	-72.3	69.1	0	0	0	111.1	E258 T281 V282 V284 W293 L309 Q310 K311	E258-H260 PolarHBondContact O-N 2.94Å; E258-H260 PolarHBondContact O-ND1 2.86Å; E258-H260 IonicContact OE2-CE1 2.64Å; E258-H260 PolarHBondContact OE2-CE1 3.09Å; H260-T281 WeakPolarHBondContact O-CA 3.31Å; H260-V282 HydrophobicContact CB-CG2 4.35Å; H260-V282 PolarHBondContact N-O 2.8Å; H260-V282 PolarHBondContact O-N 3.02Å; H260-V284 HydrophobicContact CB-CG2 4.08Å; H260-V284 VanDerWaalsContact ND1-CG2 3.31Å; H260-V284 WeakPolarHBondContact ND1-CG2 3.42Å; H260-W293 AromaticContact NE2-CZ3 3.73Å; H260-L309 HydrophobicContact CB-CB 4.22Å; H260-Q310 CarbonylContact C-O 3.55Å; H260-Q310 VanDerWaalsContact CA-O 3.31Å; H260-Q310 WeakPolarHBondContact CA-O 3.27Å; H260-K311 PolarHBondContact CD2-N 3.08Å; H260-K311 VanDerWaalsContact CD2-N 3.32Å
261	V	95.9	Very high	93.4	Very high	46 Å²	46	72.6 Å²	72.6	28%	0.279	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.9	173.2	-176.4	0	0	0	0	109.2	I263 D280 Q310	V261-I263 PolarHBondContact O-N 3.09Å; V261-D280 CarbonylContact C-O 3.56Å; V261-D280 WeakPolarHBondContact CA-O 3.48Å; V261-Q310 PolarHBondContact N-O 2.86Å; V261-Q310 PolarHBondContact O-N 3.07Å
262	V	96	Very high	94	Very high	1 Å²	1	72.7 Å²	72.7	1%	0.006	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	118.9	174.7	176.8	0	0	0	0	109.7	Q264 L276 E277 G279 D280 Y304 F308 L309	V262-Q264 VanDerWaalsContact CG1-O 3.22Å; V262-Q264 WeakPolarHBondContact CG1-O 3.37Å; V262-L276 HydrophobicContact CG2-CB 4.03Å; V262-L276 HydrophobicContact CG2-CD1 3.82Å; V262-E277 WeakPolarHBondContact CB-O 3.19Å; V262-E277 VanDerWaalsContact CG1-O 3.29Å; V262-E277 WeakPolarHBondContact CG1-O 3.48Å; V262-G279 PolarHBondContact O-N 2.98Å; V262-D280 HydrophobicContact CB-CB 4.14Å; V262-D280 HydrophobicContact CG2-CB 3.79Å; V262-D280 PolarHBondContact N-O 3.43Å; V262-Y304 HydrophobicContact CG1-CE1 4.33Å; V262-Y304 VanDerWaalsContact CG1-OH 3.3Å; V262-Y304 WeakPolarHBondContact CG1-OH 3.46Å; V262-Y304 HydrophobicContact CG2-CE1 4.25Å; V262-F308 WeakPolarHBondContact CA-O 3.32Å; V262-L309 HydrophobicContact CG2-CD2 3.8Å
263	I	93.9	Very high	94.4	Very high	80 Å²	80	65.1 Å²	65.1	41%	0.41	34%	0.335	S	S	.	.	S	Bend	trans	-100.1	-12	-179.7	55.8	163.9	0	0	0	113.6	V261 F308 Q310	V261-I263 PolarHBondContact O-N 3.09Å; I263-F308 VanDerWaalsContact CG1-C 3.47Å; I263-F308 VanDerWaalsContact CG1-O 3.26Å; I263-F308 WeakPolarHBondContact CG1-O 3.49Å; I263-F308 PolarHBondContact N-O 3.35Å; I263-Q310 HydrophobicContact CD1-CB 4.48Å; I263-Q310 HydrophobicContact CG2-CB 3.63Å
264	Q	93.4	Very high	94.7	Very high	77 Å²	77	64.2 Å²	64.2	36%	0.36	33%	0.327	S	S	.	.	S	Bend	trans	-147.7	129.2	173.8	173.8	168.1	-31.7	0	0	108.7	V262 Y304 F308	V262-Q264 VanDerWaalsContact CG1-O 3.22Å; V262-Q264 WeakPolarHBondContact CG1-O 3.37Å; Q264-Y304 PolarHBondContact O-OH 3.41Å; Q264-F308 HydrophobicContact CB-CB 4.17Å; Q264-F308 HydrophobicContact CB-CD1 3.77Å; Q264-F308 HydrophobicContact CB-CE1 4.35Å; Q264-F308 HydrophobicContact CB-CG 3.94Å; Q264-F308 HydrophobicContact CG-CD1 3.94Å; Q264-F308 HydrophobicContact CG-CD2 4.47Å; Q264-F308 HydrophobicContact CG-CE1 4.04Å; Q264-F308 HydrophobicContact CG-CG 4.19Å; Q264-F308 HydrophobicContact CG-CZ 4.34Å; Q264-F308 VanDerWaalsContact NE2-CE1 3.27Å; Q264-F308 VanDerWaalsContact NE2-CZ 3.28Å
265	A	95.3	Very high	94.9	Very high	43 Å²	43	63.4 Å²	63.4	36%	0.355	33%	0.329	S	S	.	.			trans	-66.5	150.6	179.6	0	0	0	0	0	111.7	L276 V278	A265-L276 WeakPolarHBondContact CA-O 3.41Å; A265-L276 WeakPolarHBondContact CB-O 3.18Å; A265-V278 HydrophobicContact CB-CG2 4.05Å
266	Y	95.5	Very high	95.1	Very high	27 Å²	27	62.2 Å²	62.2	11%	0.106	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-147.8	141.6	175.8	176.8	-109.3	0	0	0	109.9	E273 S275 L276 W292 Y304 P305 F308	Y266-E273 PolarHBondContact OH-OE2 3.33Å; Y266-S275 CarbonylContact O-C 3.58Å; Y266-S275 VanDerWaalsContact O-CA 3.31Å; Y266-S275 WeakPolarHBondContact O-CA 3.24Å; Y266-L276 PolarHBondContact N-O 3.31Å; Y266-L276 VanDerWaalsContact N-O 3.13Å; Y266-L276 PolarHBondContact O-N 2.79Å; Y266-W292 HydrophobicContact CE1-CH2 4.12Å; Y266-W292 AromaticContact CE1-CZ3 3.8Å; Y266-W292 HydrophobicContact CE1-CZ3 3.8Å; Y266-W292 AromaticContact CZ-CH2 3.8Å; Y266-W292 AromaticContact CZ-CZ3 3.97Å; Y266-W292 WeakPolarHBondContact OH-CH2 3.4Å; Y266-Y304 HydrophobicContact CD1-CD2 4.17Å; Y266-Y304 AromaticContact CD1-CE2 3.97Å; Y266-Y304 HydrophobicContact CD1-CE2 3.97Å; Y266-Y304 HydrophobicContact CG-CE2 4.37Å; Y266-Y304 PolarHBondContact N-OH 3.44Å; Y266-P305 HydrophobicContact CD1-CG 4.01Å; Y266-P305 HydrophobicContact CD2-CG 4.44Å; Y266-P305 HydrophobicContact CE1-CG 4.25Å; Y266-P305 HydrophobicContact CG-CG 4.11Å; Y266-F308 HydrophobicContact CD2-CE2 4.16Å; Y266-F308 HydrophobicContact CG-CD2 4.43Å; Y266-F308 HydrophobicContact CG-CE2 4.3Å
267	Q	96.4	Very high	95.4	Very high	155 Å²	155	63.9 Å²	63.9	72%	0.724	33%	0.332	S	S	*	.			trans	-109.1	124.6	175.9	179	176.6	-2.9	0	0	107.9	E269	Q267-E269 PolarHBondContact O-N 3.05Å
268	G	94.2	Very high	95.6	Very high	23 Å²	23	67.7 Å²	67.7	24%	0.237	35%	0.352	C	S	.	.			trans	-61	131.8	178.6	0	0	0	0	0	111.9	S275	G268-S275 PolarHBondContact N-OG 3.26Å
269	E	94.8	Very high	95.5	Very high	161 Å²	161	67.3 Å²	67.3	75%	0.752	36%	0.363	S	S	*	.	S	Bend	trans	-96.3	-21.4	175.4	-66.7	175.6	-136.1	0	0	111.5	Q267 E273	Q267-E269 PolarHBondContact O-N 3.05Å; E269-E273 PolarHBondContact N-OE2 2.93Å
270	Q	94.9	Very high	95.6	Very high	59 Å²	59	65.2 Å²	65.2	28%	0.276	35%	0.352	S	S	.	.	S	Bend	trans	-120.1	153.1	179	-48.1	-154.8	-92	0	0	112.3	D272 E273 S333	Q270-D272 PolarHBondContact O-N 3.45Å; Q270-E273 HydrophobicContact CB-CG 4.35Å; Q270-E273 WeakPolarHBondContact CG-OE1 3.32Å; Q270-E273 PolarHBondContact N-OE2 2.91Å; Q270-E273 WeakPolarHBondContact O-CB 3.42Å; Q270-E273 PolarHBondContact O-N 2.94Å; Q270-E273 VanDerWaalsContact O-N 3.1Å; Q270-S333 VanDerWaalsContact OE1-CB 3.27Å; Q270-S333 PolarHBondContact OE1-OG 2.92Å
271	E	94.6	Very high	95.6	Very high	208 Å²	208	68.4 Å²	68.4	97%	0.972	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-16.3	-176.6	-61.1	-177.3	166.7	0	0	114.7
272	D	95.8	Very high	95.6	Very high	51 Å²	51	66.3 Å²	66.3	27%	0.273	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	13.5	-178.7	75.8	-45.3	0	0	0	113.7	Q270 H303 R331 Q351	Q270-D272 PolarHBondContact O-N 3.45Å; D272-H303 PolarHBondContact O-N 3.24Å; D272-H303 PolarHBondContact O-ND1 3.02Å; D272-H303 IonicContact OD2-CE1 2.89Å; D272-H303 PolarHBondContact OD2-CE1 3.24Å; D272-H303 IonicContact OD2-ND1 2.72Å; D272-H303 PolarHBondContact OD2-ND1 3.49Å; D272-R331 IonicContact OD1-CZ 3.94Å; D272-R331 IonicContact OD1-NH1 3.72Å; D272-R331 PolarHBondContact OD1-NH1 2.8Å; D272-R331 IonicContact OD1-NH2 2.65Å; D272-R331 IonicContact OD2-CZ 2.76Å; D272-R331 IonicContact OD2-NH1 3.29Å; D272-R331 IonicContact OD2-NH2 2.57Å; D272-R331 PolarHBondContact OD2-NH2 2.94Å; D272-Q351 HydrophobicContact CB-CG 3.79Å; D272-Q351 PolarHBondContact O-NE2 2.89Å
273	E	97.1	Very high	95.7	Very high	22 Å²	22	69 Å²	69	10%	0.103	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-108.4	162.3	173.8	-68.3	157.8	-167.5	0	0	111.3	Y266 E269 Q270 W292 H303 R331	Y266-E273 PolarHBondContact OH-OE2 3.33Å; E269-E273 PolarHBondContact N-OE2 2.93Å; Q270-E273 HydrophobicContact CB-CG 4.35Å; Q270-E273 WeakPolarHBondContact CG-OE1 3.32Å; Q270-E273 PolarHBondContact N-OE2 2.91Å; Q270-E273 WeakPolarHBondContact O-CB 3.42Å; Q270-E273 PolarHBondContact O-N 2.94Å; Q270-E273 VanDerWaalsContact O-N 3.1Å; E273-W292 HydrophobicContact CG-CE3 4.44Å; E273-W292 HydrophobicContact CG-CZ3 4.13Å; E273-H303 WeakPolarHBondContact CA-O 3.47Å; E273-H303 HydrophobicContact CG-CB 4.16Å; E273-R331 WeakPolarHBondContact OE1-CD 3.33Å; E273-R331 IonicContact OE1-CZ 2.78Å; E273-R331 IonicContact OE1-NE 2.91Å; E273-R331 PolarHBondContact OE1-NE 2.76Å; E273-R331 IonicContact OE1-NH1 3.28Å; E273-R331 PolarHBondContact OE1-NH1 3.14Å
274	I	95.8	Very high	95.9	Very high	18 Å²	18	65.3 Å²	65.3	9%	0.092	35%	0.354	C	S	.	.			trans	-121.5	133.5	178.6	-171.7	170.9	0	0	0	111.6	L276 I295 K297 H303 Y304	I274-L276 HydrophobicContact CD1-CD2 4.1Å; I274-L276 HydrophobicContact CG1-CD2 4.11Å; I274-L276 HydrophobicContact CG1-CG 4.26Å; I274-L276 HydrophobicContact CG2-CD1 4.18Å; I274-L276 HydrophobicContact CG2-CG 4.32Å; I274-I295 HydrophobicContact CG2-CD1 3.73Å; I274-I295 HydrophobicContact CG2-CG1 3.86Å; I274-K297 HydrophobicContact CD1-CB 4.09Å; I274-H303 PolarHBondContact N-O 3.05Å; I274-H303 VanDerWaalsContact N-O 3.15Å; I274-Y304 HydrophobicContact CG2-CD2 3.9Å; I274-Y304 VanDerWaalsContact O-CD2 3.22Å; I274-Y304 WeakPolarHBondContact O-CD2 3.38Å; I274-Y304 WeakPolarHBondContact O-CE2 3.44Å
275	S	97.3	Very high	96	Very high	70 Å²	70	61.8 Å²	61.8	49%	0.49	34%	0.337	S	S	.	.			trans	-84.5	129.4	174.6	-59.7	0	0	0	0	110.6	Y266 G268	Y266-S275 CarbonylContact O-C 3.58Å; Y266-S275 VanDerWaalsContact O-CA 3.31Å; Y266-S275 WeakPolarHBondContact O-CA 3.24Å; G268-S275 PolarHBondContact N-OG 3.26Å
276	L	96.8	Very high	96	Very high	8 Å²	8	60.3 Å²	60.3	4%	0.042	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-143.3	150.3	-176.4	-60.7	176.1	0	0	0	113.1	V262 A265 Y266 I274 D280 V282 I295 K297 Y304	V262-L276 HydrophobicContact CG2-CB 4.03Å; V262-L276 HydrophobicContact CG2-CD1 3.82Å; A265-L276 WeakPolarHBondContact CA-O 3.41Å; A265-L276 WeakPolarHBondContact CB-O 3.18Å; Y266-L276 PolarHBondContact N-O 3.31Å; Y266-L276 VanDerWaalsContact N-O 3.13Å; Y266-L276 PolarHBondContact O-N 2.79Å; I274-L276 HydrophobicContact CD1-CD2 4.1Å; I274-L276 HydrophobicContact CG1-CD2 4.11Å; I274-L276 HydrophobicContact CG1-CG 4.26Å; I274-L276 HydrophobicContact CG2-CD1 4.18Å; I274-L276 HydrophobicContact CG2-CG 4.32Å; L276-D280 HydrophobicContact CB-CB 4.45Å; L276-D280 HydrophobicContact CD2-CB 4.5Å; L276-D280 WeakPolarHBondContact CD2-OD2 3.3Å; L276-V282 HydrophobicContact CD1-CG1 3.75Å; L276-V282 HydrophobicContact CD2-CG1 4.47Å; L276-I295 HydrophobicContact CD1-CD1 3.47Å; L276-I295 VanDerWaalsContact CD1-CD1 3.47Å; L276-K297 HydrophobicContact CD2-CD 3.36Å; L276-Y304 HydrophobicContact CB-CE2 3.69Å; L276-Y304 HydrophobicContact CD1-CD2 3.85Å; L276-Y304 HydrophobicContact CD1-CE1 4.44Å; L276-Y304 HydrophobicContact CD1-CE2 3.7Å; L276-Y304 HydrophobicContact CD1-CG 4.28Å; L276-Y304 HydrophobicContact CG-CD2 4.25Å; L276-Y304 HydrophobicContact CG-CE2 3.8Å
277	E	96.8	Very high	95.9	Very high	134 Å²	134	61.6 Å²	61.6	63%	0.626	33%	0.329	S	S	*	.			trans	-98.6	158	-178.5	-74.2	-69	179.4	0	0	112.6	V262 G279 D280	V262-E277 WeakPolarHBondContact CB-O 3.19Å; V262-E277 VanDerWaalsContact CG1-O 3.29Å; V262-E277 WeakPolarHBondContact CG1-O 3.48Å; E277-G279 PolarHBondContact O-N 3.15Å; E277-D280 PolarHBondContact N-OD2 3.2Å; E277-D280 WeakPolarHBondContact O-CB 3.37Å; E277-D280 PolarHBondContact O-N 2.85Å; E277-D280 VanDerWaalsContact O-N 3.12Å
278	V	95.7	Very high	95.7	Very high	95 Å²	95	54.2 Å²	54.2	58%	0.576	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	128.1	176.5	-178	0	0	0	0	110.4	A265	A265-V278 HydrophobicContact CB-CG2 4.05Å
279	G	93.9	Very high	95.5	Very high	47 Å²	47	53.8 Å²	53.8	49%	0.485	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	-6.8	-176	0	0	0	0	0	114.6	V262 E277 T281	V262-G279 PolarHBondContact O-N 2.98Å; E277-G279 PolarHBondContact O-N 3.15Å; G279-T281 PolarHBondContact O-N 3.36Å
280	D	96.2	Very high	95.4	Very high	37 Å²	37	46.8 Å²	46.8	20%	0.198	25%	0.254	C	S	.	.			trans	-56.4	136	169.5	-94.3	-37.8	0	0	0	110.8	V261 V262 L276 E277 K297	V261-D280 CarbonylContact C-O 3.56Å; V261-D280 WeakPolarHBondContact CA-O 3.48Å; V262-D280 HydrophobicContact CB-CB 4.14Å; V262-D280 HydrophobicContact CG2-CB 3.79Å; V262-D280 PolarHBondContact N-O 3.43Å; L276-D280 HydrophobicContact CB-CB 4.45Å; L276-D280 HydrophobicContact CD2-CB 4.5Å; L276-D280 WeakPolarHBondContact CD2-OD2 3.3Å; E277-D280 PolarHBondContact N-OD2 3.2Å; E277-D280 WeakPolarHBondContact O-CB 3.37Å; E277-D280 PolarHBondContact O-N 2.85Å; E277-D280 VanDerWaalsContact O-N 3.12Å; D280-K297 VanDerWaalsContact OD1-CE 3.3Å; D280-K297 WeakPolarHBondContact OD1-CE 3.34Å; D280-K297 IonicContact OD1-NZ 2.75Å; D280-K297 PolarHBondContact OD1-NZ 3.39Å; D280-K297 IonicContact OD2-NZ 3.59Å; D280-K297 PolarHBondContact OD2-NZ 3.21Å
281	T	96.5	Very high	95.3	Very high	74 Å²	74	44 Å²	44	45%	0.454	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	131	173.5	-58.1	0	0	0	0	109.7	L259 H260 G279	L259-T281 HydrophobicContact CD1-CG2 4.08Å; L259-T281 HydrophobicContact CD2-CG2 3.73Å; L259-T281 HydrophobicContact CG-CG2 3.8Å; H260-T281 WeakPolarHBondContact O-CA 3.31Å; G279-T281 PolarHBondContact O-N 3.36Å
282	V	97.3	Very high	95.4	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	159.8	-173.9	-63.5	0	0	0	0	111.5	H260 L276 I295 K297 L309	H260-V282 HydrophobicContact CB-CG2 4.35Å; H260-V282 PolarHBondContact N-O 2.8Å; H260-V282 PolarHBondContact O-N 3.02Å; L276-V282 HydrophobicContact CD1-CG1 3.75Å; L276-V282 HydrophobicContact CD2-CG1 4.47Å; V282-I295 HydrophobicContact CB-CD1 4.18Å; V282-I295 HydrophobicContact CG1-CD1 4.19Å; V282-I295 HydrophobicContact CG2-CD1 4.02Å; V282-K297 HydrophobicContact CG1-CB 4.21Å; V282-K297 HydrophobicContact CG1-CD 4.25Å; V282-K297 HydrophobicContact CG1-CG 4.33Å; V282-L309 HydrophobicContact CG2-CD2 3.86Å
283	E	97.1	Very high	95.5	Very high	56 Å²	56	33.1 Å²	33.1	26%	0.262	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	115.6	179	-59.6	162.2	104.7	0	0	109	L259 I285 I295 R296	L259-E283 HydrophobicContact CD1-CG 4.37Å; E283-I285 PolarHBondContact O-N 3.44Å; E283-I295 CarbonylContact O-C 3.56Å; E283-I295 WeakPolarHBondContact O-CA 3.19Å; E283-R296 HydrophobicContact CB-CB 4.25Å; E283-R296 PolarHBondContact N-O 2.75Å; E283-R296 PolarHBondContact O-N 3.16Å; E283-R296 IonicContact OE1-CZ 2.71Å; E283-R296 IonicContact OE1-NE 3.96Å; E283-R296 IonicContact OE1-NH2 2.88Å; E283-R296 PolarHBondContact OE1-NH2 2.88Å; E283-R296 IonicContact OE2-CZ 2.67Å; E283-R296 IonicContact OE2-NE 3.38Å; E283-R296 PolarHBondContact OE2-NE 3.4Å; E283-R296 IonicContact OE2-NH2 3.37Å; E283-R296 PolarHBondContact OE2-NH2 3.26Å
284	V	97.6	Very high	95.6	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.024	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	115	177.6	173.2	0	0	0	0	109.1	G257 E258 H260 K287 W293 I295 L309	G257-V284 VanDerWaalsContact CA-O 3.3Å; G257-V284 WeakPolarHBondContact CA-O 3.48Å; E258-V284 PolarHBondContact N-O 3.39Å; E258-V284 PolarHBondContact O-N 2.85Å; H260-V284 HydrophobicContact CB-CG2 4.08Å; H260-V284 VanDerWaalsContact ND1-CG2 3.31Å; H260-V284 WeakPolarHBondContact ND1-CG2 3.42Å; V284-K287 HydrophobicContact CG1-CG 3.73Å; V284-W293 HydrophobicContact CB-CE3 4.3Å; V284-W293 HydrophobicContact CG1-CB 4.32Å; V284-W293 HydrophobicContact CG1-CD2 4.09Å; V284-W293 HydrophobicContact CG1-CE3 3.49Å; V284-W293 VanDerWaalsContact CG1-CE3 3.49Å; V284-W293 HydrophobicContact CG1-CG 4.48Å; V284-W293 HydrophobicContact CG1-CZ3 4.09Å; V284-W293 HydrophobicContact CG2-CE3 3.79Å; V284-W293 HydrophobicContact CG2-CZ3 4.18Å; V284-I295 HydrophobicContact CB-CG2 4.42Å; V284-I295 HydrophobicContact CG2-CG2 3.84Å; V284-L309 HydrophobicContact CG2-CD1 3.85Å
285	I	96.4	Very high	95.7	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-9.2	-176	63.5	169.2	0	0	0	114.5	P253 D254 Y255 E283 V294 R296 T301	P253-I285 CarbonylContact C-O 3.58Å; P253-I285 WeakPolarHBondContact CA-O 3.44Å; D254-I285 CarbonylContact C-O 3.59Å; D254-I285 PolarHBondContact N-O 2.9Å; D254-I285 CarbonylContact O-C 3.55Å; D254-I285 WeakPolarHBondContact O-CA 3.43Å; D254-I285 VanDerWaalsContact O-CB 3.28Å; D254-I285 WeakPolarHBondContact O-CB 3.27Å; D254-I285 VanDerWaalsContact O-O 3.13Å; Y255-I285 HydrophobicContact CD1-CD1 4.25Å; Y255-I285 HydrophobicContact CE1-CD1 4.28Å; E283-I285 PolarHBondContact O-N 3.44Å; I285-V294 HydrophobicContact CD1-CG1 4.03Å; I285-V294 HydrophobicContact CG1-CB 4.2Å; I285-V294 HydrophobicContact CG1-CG1 3.95Å; I285-V294 WeakPolarHBondContact CG1-O 3.44Å; I285-V294 PolarHBondContact N-O 3.17Å; I285-R296 HydrophobicContact CG2-CB 4.2Å; I285-T301 HydrophobicContact CD1-CG2 3.85Å
286	H	96	Very high	95.7	Very high	12 Å²	12	28 Å²	28	6%	0.056	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	118.1	172.1	-165.5	-175.4	0	0	0	111.7	P251 P253 L288 W293 V294 Y354	P251-H286 PolarHBondContact O-CD2 2.89Å; P251-H286 VanDerWaalsContact O-CD2 3.3Å; P251-H286 PolarHBondContact O-NE2 3.26Å; P253-H286 HydrophobicContact CB-CB 4.05Å; H286-L288 WeakPolarHBondContact CE1-CD2 3.4Å; H286-L288 PolarHBondContact O-N 2.92Å; H286-W293 CarbonylContact O-C 3.51Å; H286-W293 VanDerWaalsContact O-CA 3.26Å; H286-W293 WeakPolarHBondContact O-CA 3.25Å; H286-W293 WeakPolarHBondContact O-CB 3.31Å; H286-V294 HydrophobicContact CB-CB 3.88Å; H286-V294 HydrophobicContact CB-CG2 4.04Å; H286-V294 PolarHBondContact N-O 2.99Å; H286-V294 VanDerWaalsContact N-O 3.09Å; H286-V294 PolarHBondContact O-N 2.97Å; H286-Y354 HydrophobicContact CB-CE1 4.22Å; H286-Y354 PolarHBondContact CE1-OH 2.92Å; H286-Y354 AromaticContact ND1-CE1 3.49Å; H286-Y354 WeakPolarHBondContact ND1-CE1 3.48Å; H286-Y354 AromaticContact ND1-CZ 3.53Å; H286-Y354 PolarHBondContact ND1-OH 2.51Å
287	K	93.5	Very high	95.6	Very high	54 Å²	54	31.2 Å²	31.2	24%	0.235	17%	0.169	C	C	.	.			trans	-91.4	64.6	-178.7	-65	-173.7	178.7	176.4	0	112.7	P251 E258 V284 L289 W293	P251-K287 WeakPolarHBondContact CD-O 3.34Å; P251-K287 HydrophobicContact CG-CB 4.08Å; P251-K287 VanDerWaalsContact CG-O 3.31Å; P251-K287 WeakPolarHBondContact CG-O 3.12Å; E258-K287 VanDerWaalsContact OE2-CE 3.27Å; E258-K287 WeakPolarHBondContact OE2-CE 3.46Å; E258-K287 IonicContact OE2-NZ 3.14Å; E258-K287 PolarHBondContact OE2-NZ 2.84Å; V284-K287 HydrophobicContact CG1-CG 3.73Å; K287-L289 PolarHBondContact O-N 2.84Å; K287-W293 HydrophobicContact CB-CD2 4.22Å; K287-W293 HydrophobicContact CB-CG 4.42Å; K287-W293 HydrophobicContact CB-CZ2 4.22Å; K287-W293 HydrophobicContact CD-CH2 3.88Å; K287-W293 HydrophobicContact CD-CZ2 3.84Å; K287-W293 HydrophobicContact CD-CZ3 4.27Å; K287-W293 HydrophobicContact CG-CD2 3.84Å; K287-W293 HydrophobicContact CG-CE3 4.11Å; K287-W293 HydrophobicContact CG-CG 4.37Å; K287-W293 HydrophobicContact CG-CH2 4.19Å; K287-W293 HydrophobicContact CG-CZ2 3.93Å; K287-W293 HydrophobicContact CG-CZ3 4.28Å
288	L	91.6	Very high	95.2	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	17%	0.166	C	C	.	.			trans	-52.9	134.8	177.4	-69.3	173.7	0	0	0	111.8	E250 H286 D290 G291 W292 V294	E250-L288 HydrophobicContact CG-CD2 4.1Å; E250-L288 WeakPolarHBondContact OE1-CD2 3.31Å; E250-L288 VanDerWaalsContact OE2-CD2 3.29Å; E250-L288 WeakPolarHBondContact OE2-CD2 3.44Å; H286-L288 WeakPolarHBondContact CE1-CD2 3.4Å; H286-L288 PolarHBondContact O-N 2.92Å; L288-D290 PolarHBondContact O-N 3.37Å; L288-G291 PolarHBondContact O-N 2.9Å; L288-W292 WeakPolarHBondContact CD1-O 3.33Å; L288-V294 HydrophobicContact CD1-CG2 3.99Å
289	L	90.6	Very high	94.8	Very high	13 Å²	13	27.7 Å²	27.7	7%	0.068	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-5.8	-176	-66.2	-173.8	0	0	0	114.2	Q219 G221 W223 E247 E249 E250 K287 G291	Q219-L289 HydrophobicContact CG-CD2 3.88Å; G221-L289 WeakPolarHBondContact CA-O 3.17Å; W223-L289 HydrophobicContact CZ2-CB 4.08Å; W223-L289 HydrophobicContact CZ2-CD1 4.37Å; W223-L289 PolarHBondContact NE1-O 3.23Å; E247-L289 HydrophobicContact CG-CD1 3.93Å; E249-L289 HydrophobicContact CB-CD1 4.01Å; E250-L289 PolarHBondContact OE1-N 2.82Å; K287-L289 PolarHBondContact O-N 2.84Å; L289-G291 PolarHBondContact O-N 3.31Å
290	D	91.9	Very high	94.7	Very high	15 Å²	15	31.6 Å²	31.6	8%	0.08	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	3.9	170.7	63.8	17	0	0	0	113.8	G221 L288 W292 P329 K348	G221-D290 VanDerWaalsContact CA-C 3.43Å; L288-D290 PolarHBondContact O-N 3.37Å; D290-W292 PolarHBondContact OD1-N 3.38Å; D290-P329 WeakPolarHBondContact O-CG 3.4Å; D290-K348 IonicContact OD2-NZ 2.66Å; D290-K348 PolarHBondContact OD2-NZ 2.81Å
291	G	93.6	Very high	94.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	90.8	-8.2	172.7	0	0	0	0	0	115	N220 L288 L289 S306	N220-G291 WeakPolarHBondContact O-CA 3.42Å; L288-G291 PolarHBondContact O-N 2.9Å; L289-G291 PolarHBondContact O-N 3.31Å; G291-S306 VanDerWaalsContact O-CB 3.28Å; G291-S306 WeakPolarHBondContact O-CB 3.36Å; G291-S306 PolarHBondContact O-N 3.44Å; G291-S306 PolarHBondContact O-OG 2.63Å
292	W	97.1	Very high	94.7	Very high	11 Å²	11	27.3 Å²	27.3	4%	0.042	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	84.2	-177.4	-69.7	81.1	0	0	0	109.7	Y266 E273 L288 D290 H303 Y304 P305 P328 P329 R331	Y266-W292 HydrophobicContact CE1-CH2 4.12Å; Y266-W292 AromaticContact CE1-CZ3 3.8Å; Y266-W292 HydrophobicContact CE1-CZ3 3.8Å; Y266-W292 AromaticContact CZ-CH2 3.8Å; Y266-W292 AromaticContact CZ-CZ3 3.97Å; Y266-W292 WeakPolarHBondContact OH-CH2 3.4Å; E273-W292 HydrophobicContact CG-CE3 4.44Å; E273-W292 HydrophobicContact CG-CZ3 4.13Å; L288-W292 WeakPolarHBondContact CD1-O 3.33Å; D290-W292 PolarHBondContact OD1-N 3.38Å; W292-H303 HydrophobicContact CB-CB 4.41Å; W292-H303 HydrophobicContact CE3-CB 4.38Å; W292-H303 PolarHBondContact O-CD2 2.72Å; W292-Y304 CarbonylContact C-O 3.56Å; W292-P305 HydrophobicContact CE3-CG 4.16Å; W292-P305 HydrophobicContact CH2-CG 3.87Å; W292-P305 HydrophobicContact CZ2-CG 4.38Å; W292-P305 HydrophobicContact CZ3-CG 3.73Å; W292-P328 HydrophobicContact CH2-CB 4.24Å; W292-P328 HydrophobicContact CH2-CG 4.32Å; W292-P328 HydrophobicContact CZ2-CB 3.65Å; W292-P328 HydrophobicContact CZ2-CG 4.02Å; W292-P329 PolarHBondContact NE1-O 2.95Å; W292-R331 HydrophobicContact CD2-CG 3.55Å; W292-R331 HydrophobicContact CE3-CG 4.16Å; W292-R331 HydrophobicContact CG-CG 3.84Å; W292-R331 HydrophobicContact CH2-CG 4.19Å; W292-R331 HydrophobicContact CZ2-CG 3.61Å; W292-R331 HydrophobicContact CZ3-CG 4.44Å
293	W	97.7	Very high	94.8	Very high	20 Å²	20	27.8 Å²	27.8	8%	0.076	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	144.4	-177	-66.7	-0.6	0	0	0	111.1	Q219 H260 V284 H286 K287 I295 H303 Y304 S306 L309	Q219-W293 HydrophobicContact CB-CZ2 3.96Å; Q219-W293 PolarHBondContact O-NE1 3.03Å; H260-W293 AromaticContact NE2-CZ3 3.73Å; V284-W293 HydrophobicContact CB-CE3 4.3Å; V284-W293 HydrophobicContact CG1-CB 4.32Å; V284-W293 HydrophobicContact CG1-CD2 4.09Å; V284-W293 HydrophobicContact CG1-CE3 3.49Å; V284-W293 VanDerWaalsContact CG1-CE3 3.49Å; V284-W293 HydrophobicContact CG1-CG 4.48Å; V284-W293 HydrophobicContact CG1-CZ3 4.09Å; V284-W293 HydrophobicContact CG2-CE3 3.79Å; V284-W293 HydrophobicContact CG2-CZ3 4.18Å; H286-W293 CarbonylContact O-C 3.51Å; H286-W293 VanDerWaalsContact O-CA 3.26Å; H286-W293 WeakPolarHBondContact O-CA 3.25Å; H286-W293 WeakPolarHBondContact O-CB 3.31Å; K287-W293 HydrophobicContact CB-CD2 4.22Å; K287-W293 HydrophobicContact CB-CG 4.42Å; K287-W293 HydrophobicContact CB-CZ2 4.22Å; K287-W293 HydrophobicContact CD-CH2 3.88Å; K287-W293 HydrophobicContact CD-CZ2 3.84Å; K287-W293 HydrophobicContact CD-CZ3 4.27Å; K287-W293 HydrophobicContact CG-CD2 3.84Å; K287-W293 HydrophobicContact CG-CE3 4.11Å; K287-W293 HydrophobicContact CG-CG 4.37Å; K287-W293 HydrophobicContact CG-CH2 4.19Å; K287-W293 HydrophobicContact CG-CZ2 3.93Å; K287-W293 HydrophobicContact CG-CZ3 4.28Å; W293-I295 HydrophobicContact CB-CG2 4.46Å; W293-H303 CarbonylContact O-C 3.45Å; W293-H303 WeakPolarHBondContact O-CA 3.46Å; W293-Y304 PolarHBondContact N-O 2.76Å; W293-Y304 PolarHBondContact O-N 2.95Å; W293-S306 VanDerWaalsContact CD2-CB 3.41Å; W293-L309 HydrophobicContact CE3-CD1 4.16Å
294	V	97.8	Very high	94.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.1	169.8	-170.5	0	0	0	0	108	I285 H286 L288 G302 Y354	I285-V294 HydrophobicContact CD1-CG1 4.03Å; I285-V294 HydrophobicContact CG1-CB 4.2Å; I285-V294 HydrophobicContact CG1-CG1 3.95Å; I285-V294 WeakPolarHBondContact CG1-O 3.44Å; I285-V294 PolarHBondContact N-O 3.17Å; H286-V294 HydrophobicContact CB-CB 3.88Å; H286-V294 HydrophobicContact CB-CG2 4.04Å; H286-V294 PolarHBondContact N-O 2.99Å; H286-V294 VanDerWaalsContact N-O 3.09Å; H286-V294 PolarHBondContact O-N 2.97Å; L288-V294 HydrophobicContact CD1-CG2 3.99Å; V294-G302 WeakPolarHBondContact CA-O 3.46Å; V294-Y354 HydrophobicContact CG1-CD1 4.16Å; V294-Y354 HydrophobicContact CG1-CD2 4.16Å; V294-Y354 HydrophobicContact CG1-CG 3.95Å; V294-Y354 HydrophobicContact CG2-CD2 4.25Å; V294-Y354 HydrophobicContact CG2-CE1 4.15Å; V294-Y354 HydrophobicContact CG2-CE2 3.84Å
295	I	98.1	Very high	94.8	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	161.3	-179.1	66.9	170.3	0	0	0	111.1	I274 L276 V282 E283 V284 W293 T301 G302 Y304 L309	I274-I295 HydrophobicContact CG2-CD1 3.73Å; I274-I295 HydrophobicContact CG2-CG1 3.86Å; L276-I295 HydrophobicContact CD1-CD1 3.47Å; L276-I295 VanDerWaalsContact CD1-CD1 3.47Å; V282-I295 HydrophobicContact CB-CD1 4.18Å; V282-I295 HydrophobicContact CG1-CD1 4.19Å; V282-I295 HydrophobicContact CG2-CD1 4.02Å; E283-I295 CarbonylContact O-C 3.56Å; E283-I295 WeakPolarHBondContact O-CA 3.19Å; V284-I295 HydrophobicContact CB-CG2 4.42Å; V284-I295 HydrophobicContact CG2-CG2 3.84Å; W293-I295 HydrophobicContact CB-CG2 4.46Å; I295-T301 VanDerWaalsContact O-CA 3.24Å; I295-T301 WeakPolarHBondContact O-CA 3.38Å; I295-G302 PolarHBondContact N-O 3Å; I295-G302 PolarHBondContact O-N 3.39Å; I295-G302 VanDerWaalsContact O-N 3.16Å; I295-Y304 VanDerWaalsContact CD1-CB 3.43Å; I295-Y304 HydrophobicContact CD1-CD1 4.3Å; I295-Y304 HydrophobicContact CD1-CD2 4.22Å; I295-Y304 HydrophobicContact CD1-CG 3.74Å; I295-L309 HydrophobicContact CG2-CD1 3.89Å
296	R	97.6	Very high	94.7	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.008	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	135.6	177	174.2	170.5	76.7	-141	-3.5	110.3	Y255 E256 E283 I285 G298 E300 T301 S358	Y255-R296 PolarHBondContact O-NH1 2.88Å; E256-R296 PolarHBondContact O-NH2 2.89Å; E283-R296 HydrophobicContact CB-CB 4.25Å; E283-R296 PolarHBondContact N-O 2.75Å; E283-R296 PolarHBondContact O-N 3.16Å; E283-R296 IonicContact OE1-CZ 2.71Å; E283-R296 IonicContact OE1-NE 3.96Å; E283-R296 IonicContact OE1-NH2 2.88Å; E283-R296 PolarHBondContact OE1-NH2 2.88Å; E283-R296 IonicContact OE2-CZ 2.67Å; E283-R296 IonicContact OE2-NE 3.38Å; E283-R296 PolarHBondContact OE2-NE 3.4Å; E283-R296 IonicContact OE2-NH2 3.37Å; E283-R296 PolarHBondContact OE2-NH2 3.26Å; I285-R296 HydrophobicContact CG2-CB 4.2Å; R296-G298 WeakPolarHBondContact CG-O 3.14Å; R296-E300 WeakPolarHBondContact CA-O 3.31Å; R296-T301 HydrophobicContact CB-CG2 4.3Å; R296-S358 WeakPolarHBondContact CD-OG 3.48Å; R296-S358 PolarHBondContact NH1-OG 2.95Å
297	K	94.7	Very high	94.6	Very high	75 Å²	75	25.3 Å²	25.3	33%	0.326	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	101.8	169.1	-169.6	174.2	-176.9	-172.7	0	108.2	I274 L276 D280 V282 E299 E300	I274-K297 HydrophobicContact CD1-CB 4.09Å; L276-K297 HydrophobicContact CD2-CD 3.36Å; D280-K297 VanDerWaalsContact OD1-CE 3.3Å; D280-K297 WeakPolarHBondContact OD1-CE 3.34Å; D280-K297 IonicContact OD1-NZ 2.75Å; D280-K297 PolarHBondContact OD1-NZ 3.39Å; D280-K297 IonicContact OD2-NZ 3.59Å; D280-K297 PolarHBondContact OD2-NZ 3.21Å; V282-K297 HydrophobicContact CG1-CB 4.21Å; V282-K297 HydrophobicContact CG1-CD 4.25Å; V282-K297 HydrophobicContact CG1-CG 4.33Å; K297-E299 PolarHBondContact O-N 2.81Å; K297-E300 PolarHBondContact N-O 2.53Å; K297-E300 VanDerWaalsContact N-O 3.09Å; K297-E300 PolarHBondContact O-N 2.9Å
298	G	88.8	Confident	94.7	Very high	54 Å²	54	23.1 Å²	23.1	56%	0.557	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.9	-120.6	-171.3	0	0	0	0	0	112	R296	R296-G298 WeakPolarHBondContact CG-O 3.14Å
299	E	86.5	Confident	94.8	Very high	101 Å²	101	23.8 Å²	23.8	47%	0.472	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-0.3	179	-59.3	-163.2	171.8	0	0	115.1	K297 R359	K297-E299 PolarHBondContact O-N 2.81Å; E299-R359 VanDerWaalsContact CB-NH2 3.31Å; E299-R359 PolarHBondContact O-NE 3.3Å; E299-R359 PolarHBondContact O-NH2 2.53Å; E299-R359 IonicContact OE2-CZ 2.77Å; E299-R359 IonicContact OE2-NE 3.59Å; E299-R359 IonicContact OE2-NH1 3.67Å; E299-R359 PolarHBondContact OE2-NH1 3.31Å; E299-R359 IonicContact OE2-NH2 3.17Å; E299-R359 PolarHBondContact OE2-NH2 3.36Å
300	E	91.8	Very high	94.9	Very high	130 Å²	130	26.2 Å²	26.2	61%	0.607	14%	0.138	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	145.6	-176.5	-67.9	175.4	-173.2	0	0	111.1	R296 K297	R296-E300 WeakPolarHBondContact CA-O 3.31Å; K297-E300 PolarHBondContact N-O 2.53Å; K297-E300 VanDerWaalsContact N-O 3.09Å; K297-E300 PolarHBondContact O-N 2.9Å
301	T	96.8	Very high	95	Very high	19 Å²	19	28.7 Å²	28.7	12%	0.117	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	136.1	173.3	61.1	0	0	0	0	110.2	I285 I295 R296 Q351 R355	I285-T301 HydrophobicContact CD1-CG2 3.85Å; I295-T301 VanDerWaalsContact O-CA 3.24Å; I295-T301 WeakPolarHBondContact O-CA 3.38Å; R296-T301 HydrophobicContact CB-CG2 4.3Å; T301-Q351 PolarHBondContact O-OE1 3.14Å; T301-Q351 PolarHBondContact OG1-OE1 2.91Å; T301-Q351 VanDerWaalsContact OG1-OE1 3.09Å; T301-R355 PolarHBondContact OG1-N 2.96Å
302	G	97.3	Very high	94.5	Very high	2 Å²	2	31 Å²	31	2%	0.021	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	164.7	-177.6	0	0	0	0	0	111.2	V294 I295 Q351	V294-G302 WeakPolarHBondContact CA-O 3.46Å; I295-G302 PolarHBondContact N-O 3Å; I295-G302 PolarHBondContact O-N 3.39Å; I295-G302 VanDerWaalsContact O-N 3.16Å; G302-Q351 VanDerWaalsContact C-NE2 3.31Å
303	H	98	Very high	93.4	Very high	13 Å²	13	36 Å²	36	6%	0.06	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	145.1	168.6	-63.7	100.5	0	0	0	110.6	D272 E273 I274 W292 W293 R331 Q351	D272-H303 PolarHBondContact O-N 3.24Å; D272-H303 PolarHBondContact O-ND1 3.02Å; D272-H303 IonicContact OD2-CE1 2.89Å; D272-H303 PolarHBondContact OD2-CE1 3.24Å; D272-H303 IonicContact OD2-ND1 2.72Å; D272-H303 PolarHBondContact OD2-ND1 3.49Å; E273-H303 WeakPolarHBondContact CA-O 3.47Å; E273-H303 HydrophobicContact CG-CB 4.16Å; I274-H303 PolarHBondContact N-O 3.05Å; I274-H303 VanDerWaalsContact N-O 3.15Å; W292-H303 HydrophobicContact CB-CB 4.41Å; W292-H303 HydrophobicContact CE3-CB 4.38Å; W292-H303 PolarHBondContact O-CD2 2.72Å; W293-H303 CarbonylContact O-C 3.45Å; W293-H303 WeakPolarHBondContact O-CA 3.46Å; H303-R331 PolarHBondContact CE1-NH2 3.01Å; H303-R331 PolarHBondContact ND1-NH2 3.4Å; H303-R331 VanDerWaalsContact ND1-NH2 3.1Å; H303-Q351 PolarHBondContact CE1-NE2 3.28Å; H303-Q351 PolarHBondContact ND1-NE2 3.3Å
304	Y	97.7	Very high	91.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	146.6	175.5	-159.6	-101.8	0	0	0	111.3	V262 Q264 Y266 I274 L276 W292 W293 I295 S306 F308 L309	V262-Y304 HydrophobicContact CG1-CE1 4.33Å; V262-Y304 VanDerWaalsContact CG1-OH 3.3Å; V262-Y304 WeakPolarHBondContact CG1-OH 3.46Å; V262-Y304 HydrophobicContact CG2-CE1 4.25Å; Q264-Y304 PolarHBondContact O-OH 3.41Å; Y266-Y304 HydrophobicContact CD1-CD2 4.17Å; Y266-Y304 AromaticContact CD1-CE2 3.97Å; Y266-Y304 HydrophobicContact CD1-CE2 3.97Å; Y266-Y304 HydrophobicContact CG-CE2 4.37Å; Y266-Y304 PolarHBondContact N-OH 3.44Å; I274-Y304 HydrophobicContact CG2-CD2 3.9Å; I274-Y304 VanDerWaalsContact O-CD2 3.22Å; I274-Y304 WeakPolarHBondContact O-CD2 3.38Å; I274-Y304 WeakPolarHBondContact O-CE2 3.44Å; L276-Y304 HydrophobicContact CB-CE2 3.69Å; L276-Y304 HydrophobicContact CD1-CD2 3.85Å; L276-Y304 HydrophobicContact CD1-CE1 4.44Å; L276-Y304 HydrophobicContact CD1-CE2 3.7Å; L276-Y304 HydrophobicContact CD1-CG 4.28Å; L276-Y304 HydrophobicContact CG-CD2 4.25Å; L276-Y304 HydrophobicContact CG-CE2 3.8Å; W292-Y304 CarbonylContact C-O 3.56Å; W293-Y304 PolarHBondContact N-O 2.76Å; W293-Y304 PolarHBondContact O-N 2.95Å; I295-Y304 VanDerWaalsContact CD1-CB 3.43Å; I295-Y304 HydrophobicContact CD1-CD1 4.3Å; I295-Y304 HydrophobicContact CD1-CD2 4.22Å; I295-Y304 HydrophobicContact CD1-CG 3.74Å; Y304-S306 PolarHBondContact O-N 3.37Å; Y304-S306 VanDerWaalsContact O-N 3.12Å; Y304-F308 HydrophobicContact CE1-CB 3.82Å; Y304-L309 HydrophobicContact CD1-CD1 4.12Å; Y304-L309 HydrophobicContact CD1-CD2 3.72Å; Y304-L309 HydrophobicContact CD1-CG 3.85Å; Y304-L309 HydrophobicContact CE1-CD2 3.82Å; Y304-L309 HydrophobicContact CE1-CG 4.24Å
305	P	96.9	Very high	89.3	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	114.4	174.5	-26	36.3	0	0	0	112.5	Y266 W292 M307 F308 P328	Y266-P305 HydrophobicContact CD1-CG 4.01Å; Y266-P305 HydrophobicContact CD2-CG 4.44Å; Y266-P305 HydrophobicContact CE1-CG 4.25Å; Y266-P305 HydrophobicContact CG-CG 4.11Å; W292-P305 HydrophobicContact CE3-CG 4.16Å; W292-P305 HydrophobicContact CH2-CG 3.87Å; W292-P305 HydrophobicContact CZ2-CG 4.38Å; W292-P305 HydrophobicContact CZ3-CG 3.73Å; P305-M307 HydrophobicContact CB-CG 4.38Å; P305-M307 PolarHBondContact O-N 2.88Å; P305-F308 HydrophobicContact CB-CB 4.43Å; P305-F308 HydrophobicContact CB-CD2 3.56Å; P305-F308 HydrophobicContact CB-CE2 3.91Å; P305-F308 HydrophobicContact CB-CG 4.01Å; P305-F308 HydrophobicContact CG-CD2 3.77Å; P305-F308 HydrophobicContact CG-CE2 3.88Å; P305-F308 PolarHBondContact O-N 2.91Å; P305-P328 HydrophobicContact CB-CB 4Å; P305-P328 HydrophobicContact CG-CB 3.98Å; P305-P328 HydrophobicContact CG-CG 4.42Å
306	S	95.4	Very high	87	Confident	8 Å²	8	56.2 Å²	56.2	6%	0.056	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-52.9	-38.5	176.4	52.5	0	0	0	0	113.7	Q219 N220 G291 W293 Y304 F308 L309	Q219-S306 PolarHBondContact O-OG 3.4Å; N220-S306 WeakPolarHBondContact CA-OG 3.38Å; G291-S306 VanDerWaalsContact O-CB 3.28Å; G291-S306 WeakPolarHBondContact O-CB 3.36Å; G291-S306 PolarHBondContact O-N 3.44Å; G291-S306 PolarHBondContact O-OG 2.63Å; W293-S306 VanDerWaalsContact CD2-CB 3.41Å; Y304-S306 PolarHBondContact O-N 3.37Å; Y304-S306 VanDerWaalsContact O-N 3.12Å; S306-F308 PolarHBondContact O-N 2.78Å; S306-F308 VanDerWaalsContact O-N 3.13Å; S306-L309 WeakPolarHBondContact O-CB 3.38Å; S306-L309 PolarHBondContact O-N 3.46Å
307	M	93.7	Very high	84.3	Confident	13 Å²	13	64.2 Å²	64.2	6%	0.064	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-66.2	-11	178.9	72.7	-164.7	-62.9	0	0	114.5	P305 L323 Q326 P328	P305-M307 HydrophobicContact CB-CG 4.38Å; P305-M307 PolarHBondContact O-N 2.88Å; M307-L323 HydrophobicContact CB-CD2 4.46Å; M307-L323 HydrophobicContact CE-CD2 4.22Å; M307-Q326 HydrophobicContact CE-CB 3.51Å; M307-P328 VanDerWaalsContact SD-CA 3.55Å; M307-P328 HydrophobicContact SD-CB 4.32Å
308	F	94.9	Very high	81.8	Confident	7 Å²	7	66.4 Å²	66.4	3%	0.031	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-99.7	8.3	174.7	-60.3	-18.8	0	0	0	112.6	V262 I263 Q264 Y266 Y304 P305 S306	V262-F308 WeakPolarHBondContact CA-O 3.32Å; I263-F308 VanDerWaalsContact CG1-C 3.47Å; I263-F308 VanDerWaalsContact CG1-O 3.26Å; I263-F308 WeakPolarHBondContact CG1-O 3.49Å; I263-F308 PolarHBondContact N-O 3.35Å; Q264-F308 HydrophobicContact CB-CB 4.17Å; Q264-F308 HydrophobicContact CB-CD1 3.77Å; Q264-F308 HydrophobicContact CB-CE1 4.35Å; Q264-F308 HydrophobicContact CB-CG 3.94Å; Q264-F308 HydrophobicContact CG-CD1 3.94Å; Q264-F308 HydrophobicContact CG-CD2 4.47Å; Q264-F308 HydrophobicContact CG-CE1 4.04Å; Q264-F308 HydrophobicContact CG-CG 4.19Å; Q264-F308 HydrophobicContact CG-CZ 4.34Å; Q264-F308 VanDerWaalsContact NE2-CE1 3.27Å; Q264-F308 VanDerWaalsContact NE2-CZ 3.28Å; Y266-F308 HydrophobicContact CD2-CE2 4.16Å; Y266-F308 HydrophobicContact CG-CD2 4.43Å; Y266-F308 HydrophobicContact CG-CE2 4.3Å; Y304-F308 HydrophobicContact CE1-CB 3.82Å; P305-F308 HydrophobicContact CB-CB 4.43Å; P305-F308 HydrophobicContact CB-CD2 3.56Å; P305-F308 HydrophobicContact CB-CE2 3.91Å; P305-F308 HydrophobicContact CB-CG 4.01Å; P305-F308 HydrophobicContact CG-CD2 3.77Å; P305-F308 HydrophobicContact CG-CE2 3.88Å; P305-F308 PolarHBondContact O-N 2.91Å; S306-F308 PolarHBondContact O-N 2.78Å; S306-F308 VanDerWaalsContact O-N 3.13Å
309	L	94.3	Very high	79.7	Confident	16 Å²	16	70.5 Å²	70.5	8%	0.084	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	140.9	178.5	-59.3	175.1	0	0	0	111.1	H260 V262 V282 V284 W293 I295 Y304 S306	H260-L309 HydrophobicContact CB-CB 4.22Å; V262-L309 HydrophobicContact CG2-CD2 3.8Å; V282-L309 HydrophobicContact CG2-CD2 3.86Å; V284-L309 HydrophobicContact CG2-CD1 3.85Å; W293-L309 HydrophobicContact CE3-CD1 4.16Å; I295-L309 HydrophobicContact CG2-CD1 3.89Å; Y304-L309 HydrophobicContact CD1-CD1 4.12Å; Y304-L309 HydrophobicContact CD1-CD2 3.72Å; Y304-L309 HydrophobicContact CD1-CG 3.85Å; Y304-L309 HydrophobicContact CE1-CD2 3.82Å; Y304-L309 HydrophobicContact CE1-CG 4.24Å; S306-L309 WeakPolarHBondContact O-CB 3.38Å; S306-L309 PolarHBondContact O-N 3.46Å
310	Q	93.1	Very high	77.8	Confident	64 Å²	64	74.3 Å²	74.3	30%	0.299	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.5	170.3	-179.5	175.7	-16.6	0	0	109.9	H260 V261 I263 S312 K314	H260-Q310 CarbonylContact C-O 3.55Å; H260-Q310 VanDerWaalsContact CA-O 3.31Å; H260-Q310 WeakPolarHBondContact CA-O 3.27Å; V261-Q310 PolarHBondContact N-O 2.86Å; V261-Q310 PolarHBondContact O-N 3.07Å; I263-Q310 HydrophobicContact CD1-CB 4.48Å; I263-Q310 HydrophobicContact CG2-CB 3.63Å; Q310-S312 PolarHBondContact O-N 2.83Å; Q310-K314 PolarHBondContact NE2-O 2.76Å
311	K	93	Very high	75.4	Confident	66 Å²	66	73.6 Å²	73.6	29%	0.287	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	132.3	174.8	178.8	172.1	-179.5	164.5	0	110.7	E258 H260 D313 K314	E258-K311 HydrophobicContact CG-CD 4.27Å; E258-K311 VanDerWaalsContact OE1-CD 3.3Å; E258-K311 WeakPolarHBondContact OE1-CD 3.24Å; E258-K311 VanDerWaalsContact OE1-CE 3.26Å; E258-K311 WeakPolarHBondContact OE1-CE 3.38Å; E258-K311 IonicContact OE1-NZ 3.54Å; E258-K311 PolarHBondContact OE1-NZ 2.8Å; H260-K311 PolarHBondContact CD2-N 3.08Å; H260-K311 VanDerWaalsContact CD2-N 3.32Å; K311-D313 VanDerWaalsContact C-N 3.28Å; K311-D313 WeakPolarHBondContact CE-OD2 3.42Å; K311-D313 IonicContact NZ-OD2 2.7Å; K311-D313 PolarHBondContact O-N 3.23Å; K311-K314 PolarHBondContact O-N 3.32Å
312	S	84.1	Confident	73	Confident	48 Å²	48	78.3 Å²	78.3	34%	0.336	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-38.3	-175.6	52.2	0	0	0	0	114.5	L259 Q310 K314	L259-S312 PolarHBondContact O-N 3.48Å; L259-S312 VanDerWaalsContact O-N 3.13Å; L259-S312 PolarHBondContact O-OG 3.44Å; Q310-S312 PolarHBondContact O-N 2.83Å; S312-K314 PolarHBondContact O-N 2.79Å
313	D	72.7	Confident	70.8	Confident	116 Å²	116	81.5 Å²	81.5	62%	0.62	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-16.5	-166.8	-45	-32.6	0	0	0	113	K311 K315	K311-D313 VanDerWaalsContact C-N 3.28Å; K311-D313 WeakPolarHBondContact CE-OD2 3.42Å; K311-D313 IonicContact NZ-OD2 2.7Å; K311-D313 PolarHBondContact O-N 3.23Å; D313-K315 PolarHBondContact O-N 3.09Å
314	K	59.2	Low	68.2	Low	150 Å²	150	92.3 Å²	92.3	65%	0.652	45%	0.448	S	S	*	.			trans	-81.9	96.5	-179.1	-76.9	-163.1	172	-167	0	110.9	Q310 K311 S312	Q310-K314 PolarHBondContact NE2-O 2.76Å; K311-K314 PolarHBondContact O-N 3.32Å; S312-K314 PolarHBondContact O-N 2.79Å
315	K	50.3	Low	66.2	Low	191 Å²	191	95.7 Å²	95.7	83%	0.83	48%	0.482	S	S	*	.			trans	-51.8	145	159	-72	-176.4	178	176.7	0	109.5	D313 E317	D313-K315 PolarHBondContact O-N 3.09Å; K315-E317 PolarHBondContact O-N 2.93Å
316	N	49.8	Very low	64.8	Low	105 Å²	105	99.4 Å²	99.4	56%	0.561	50%	0.499	S	S	*	.			trans	-60.3	83.9	-163.4	-65.7	-79.4	0	0	0	115.9	R320	N316-R320 PolarHBondContact OD1-NH2 3.06Å
317	E	42.2	Very low	64.2	Low	170 Å²	170	108 Å²	108	79%	0.794	53%	0.53	S	S	*	.			trans	-92.8	99.8	162.2	-75.6	-172.8	134.2	0	0	111.2	K315 D319	K315-E317 PolarHBondContact O-N 2.93Å; E317-D319 VanDerWaalsContact C-N 3.33Å; E317-D319 PolarHBondContact O-N 3.09Å
318	T	42.2	Very low	64.1	Low	121 Å²	121	108.9 Å²	108.9	74%	0.742	54%	0.537	S	S	*	.	S	Bend	trans	46.4	6.9	134.2	43.2	0	0	0	0	124.4	R320	T318-R320 PolarHBondContact O-N 2.6Å
319	D	44	Very low	64	Low	139 Å²	139	108.6 Å²	108.6	74%	0.743	54%	0.536	S	S	*	.			trans	-84.5	18.6	165.5	-82.4	-38.2	0	0	0	113.9	E317 T321	E317-D319 VanDerWaalsContact C-N 3.33Å; E317-D319 PolarHBondContact O-N 3.09Å; D319-T321 PolarHBondContact O-N 2.73Å; D319-T321 VanDerWaalsContact O-N 3.12Å
320	R	46.2	Very low	64	Low	181 Å²	181	109.6 Å²	109.6	68%	0.683	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	2.1	-173.2	-76.5	-173.1	169	-155.2	-2.6	115.7	N316 T318	N316-R320 PolarHBondContact OD1-NH2 3.06Å; T318-R320 PolarHBondContact O-N 2.6Å
321	T	41.2	Very low	64.1	Low	115 Å²	115	107.5 Å²	107.5	71%	0.706	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-16.8	-159.4	46.5	0	0	0	0	116.7	D319	D319-T321 PolarHBondContact O-N 2.73Å; D319-T321 VanDerWaalsContact O-N 3.12Å
322	N	46.6	Very low	64.1	Low	119 Å²	119	108.1 Å²	108.1	64%	0.636	53%	0.534	S	S	*	.	S	Bend	trans	-129.3	-17.6	-173.7	-75.2	-67.4	0	0	0	117.2	Q326	N322-Q326 VanDerWaalsContact O-CD 3.31Å; N322-Q326 WeakPolarHBondContact O-CG 3.48Å; N322-Q326 PolarHBondContact O-NE2 2.69Å; N322-Q326 VanDerWaalsContact O-NE2 3.14Å
323	L	50.7	Low	64.5	Low	69 Å²	69	109 Å²	109	36%	0.361	54%	0.539	S	S	.	.			trans	-82.1	-20.8	-169.1	-66.2	170.8	0	0	0	115.4	M307 G325 Q326	M307-L323 HydrophobicContact CB-CD2 4.46Å; M307-L323 HydrophobicContact CE-CD2 4.22Å; L323-G325 PolarHBondContact O-N 3.21Å; L323-G325 VanDerWaalsContact O-N 3.12Å; L323-Q326 PolarHBondContact O-N 3.36Å
324	R	44.3	Very low	65.4	Low	240 Å²	240	106.7 Å²	106.7	91%	0.906	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	114.3	-176.5	-87.2	-169.5	168.5	-133.6	-7	111.6
325	G	55.1	Low	67.1	Low	70 Å²	70	100.5 Å²	100.5	72%	0.722	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	0.5	177.8	0	0	0	0	0	114.9	L323	L323-G325 PolarHBondContact O-N 3.21Å; L323-G325 VanDerWaalsContact O-N 3.12Å
326	Q	67	Low	68.9	Low	79 Å²	79	102.9 Å²	102.9	37%	0.369	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-71.1	143.4	166.2	-67.8	-171.5	-7.3	0	0	110.1	M307 N322 L323	M307-Q326 HydrophobicContact CE-CB 3.51Å; N322-Q326 VanDerWaalsContact O-CD 3.31Å; N322-Q326 WeakPolarHBondContact O-CG 3.48Å; N322-Q326 PolarHBondContact O-NE2 2.69Å; N322-Q326 VanDerWaalsContact O-NE2 3.14Å; L323-Q326 PolarHBondContact O-N 3.36Å
327	R	83.3	Confident	70.7	Confident	188 Å²	188	104.2 Å²	104.2	71%	0.709	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-84	152.1	175.6	-69.2	-179.7	178.7	175.6	-0.9	110.3	W222	W222-R327 PolarHBondContact NE1-O 3.39Å
328	P	91.3	Very high	73.1	Confident	33 Å²	33	98.4 Å²	98.4	21%	0.214	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-58.6	146.8	167.2	29.3	-36	0	0	0	110	W292 P305 M307	W292-P328 HydrophobicContact CH2-CB 4.24Å; W292-P328 HydrophobicContact CH2-CG 4.32Å; W292-P328 HydrophobicContact CZ2-CB 3.65Å; W292-P328 HydrophobicContact CZ2-CG 4.02Å; P305-P328 HydrophobicContact CB-CB 4Å; P305-P328 HydrophobicContact CG-CB 3.98Å; P305-P328 HydrophobicContact CG-CG 4.42Å; M307-P328 VanDerWaalsContact SD-CA 3.55Å; M307-P328 HydrophobicContact SD-CB 4.32Å
329	P	93.1	Very high	75.3	Confident	1 Å²	1	98.5 Å²	98.5	1%	0.006	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-62	137.4	174.5	28.1	-34.4	0	0	0	108.9	N220 W222 P235 D290 W292 R331	N220-P329 WeakPolarHBondContact O-CG 3.47Å; W222-P329 HydrophobicContact CD2-CB 4.32Å; W222-P329 HydrophobicContact CZ2-CB 4.32Å; P235-P329 HydrophobicContact CB-CB 3.91Å; D290-P329 WeakPolarHBondContact O-CG 3.4Å; W292-P329 PolarHBondContact NE1-O 2.95Å; P329-R331 PolarHBondContact O-N 2.63Å
330	P	94.4	Very high	77.5	Confident	37 Å²	37	94.8 Å²	94.8	24%	0.24	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-56	140.2	176.8	22.3	-34.9	0	0	0	111.4	F196 P235 S237 Y238	F196-P330 HydrophobicContact CE2-CG 4.32Å; P235-P330 HydrophobicContact CB-CG 4Å; P235-P330 HydrophobicContact CG-CG 3.93Å; S237-P330 VanDerWaalsContact CB-O 3.27Å; S237-P330 WeakPolarHBondContact CB-O 3.26Å; S237-P330 PolarHBondContact OG-O 2.84Å; Y238-P330 HydrophobicContact CD2-CG 4.25Å; Y238-P330 HydrophobicContact CE2-CB 3.91Å; Y238-P330 HydrophobicContact CE2-CG 3.51Å
331	R	94.6	Very high	79.3	Confident	20 Å²	20	89.7 Å²	89.7	8%	0.075	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-76.1	155.2	-177.4	-63	-177.3	74.3	-147	-4.3	111.7	D272 E273 W292 H303 P329 S333 T334	D272-R331 IonicContact OD1-CZ 3.94Å; D272-R331 IonicContact OD1-NH1 3.72Å; D272-R331 PolarHBondContact OD1-NH1 2.8Å; D272-R331 IonicContact OD1-NH2 2.65Å; D272-R331 IonicContact OD2-CZ 2.76Å; D272-R331 IonicContact OD2-NH1 3.29Å; D272-R331 IonicContact OD2-NH2 2.57Å; D272-R331 PolarHBondContact OD2-NH2 2.94Å; E273-R331 WeakPolarHBondContact OE1-CD 3.33Å; E273-R331 IonicContact OE1-CZ 2.78Å; E273-R331 IonicContact OE1-NE 2.91Å; E273-R331 PolarHBondContact OE1-NE 2.76Å; E273-R331 IonicContact OE1-NH1 3.28Å; E273-R331 PolarHBondContact OE1-NH1 3.14Å; W292-R331 HydrophobicContact CD2-CG 3.55Å; W292-R331 HydrophobicContact CE3-CG 4.16Å; W292-R331 HydrophobicContact CG-CG 3.84Å; W292-R331 HydrophobicContact CH2-CG 4.19Å; W292-R331 HydrophobicContact CZ2-CG 3.61Å; W292-R331 HydrophobicContact CZ3-CG 4.44Å; H303-R331 PolarHBondContact CE1-NH2 3.01Å; H303-R331 PolarHBondContact ND1-NH2 3.4Å; H303-R331 VanDerWaalsContact ND1-NH2 3.1Å; P329-R331 PolarHBondContact O-N 2.63Å; R331-S333 WeakPolarHBondContact CB-OG 3.45Å; R331-S333 PolarHBondContact O-N 3.38Å; R331-T334 HydrophobicContact CB-CG2 4.49Å; R331-T334 PolarHBondContact O-N 2.86Å; R331-T334 VanDerWaalsContact O-N 3.07Å; R331-T334 PolarHBondContact O-OG1 2.93Å
332	R	93	Very high	81.3	Confident	79 Å²	79	86.1 Å²	86.1	30%	0.298	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-62.1	-28.6	172.8	-166.5	173.2	-59.5	-121.3	-5.9	111.9	I193 A236 S237 L239 T334 I335	I193-R332 HydrophobicContact CD1-CG 4.36Å; I193-R332 VanDerWaalsContact CD1-NH1 3.29Å; A236-R332 PolarHBondContact O-NH2 3.02Å; S237-R332 PolarHBondContact O-NE 3.04Å; S237-R332 PolarHBondContact O-NH2 2.94Å; L239-R332 PolarHBondContact O-NH1 3.16Å; L239-R332 PolarHBondContact O-NH2 3.21Å; R332-T334 VanDerWaalsContact C-N 3.29Å; R332-T334 PolarHBondContact O-N 3.3Å; R332-I335 HydrophobicContact CG-CD1 4.29Å; R332-I335 WeakPolarHBondContact O-CB 3.49Å; R332-I335 PolarHBondContact O-N 3.34Å
333	S	92.6	Very high	83	Confident	65 Å²	65	86.8 Å²	86.8	46%	0.455	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-67	-19	174.3	40.5	0	0	0	0	114.7	Q270 R331	Q270-S333 VanDerWaalsContact OE1-CB 3.27Å; Q270-S333 PolarHBondContact OE1-OG 2.92Å; R331-S333 WeakPolarHBondContact CB-OG 3.45Å; R331-S333 PolarHBondContact O-N 3.38Å
334	T	93.1	Very high	84.6	Confident	69 Å²	69	91.2 Å²	91.2	42%	0.423	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-87.9	-7	173.8	59.6	0	0	0	0	112.9	R331 R332 R336	R331-T334 HydrophobicContact CB-CG2 4.49Å; R331-T334 PolarHBondContact O-N 2.86Å; R331-T334 VanDerWaalsContact O-N 3.07Å; R331-T334 PolarHBondContact O-OG1 2.93Å; R332-T334 VanDerWaalsContact C-N 3.29Å; R332-T334 PolarHBondContact O-N 3.3Å; T334-R336 PolarHBondContact O-N 2.92Å
335	I	94.1	Very high	86.5	Confident	20 Å²	20	84.1 Å²	84.1	10%	0.103	45%	0.449	C	S	.	.			trans	-84.8	99.8	-178.3	-52.2	178.1	0	0	0	110.4	I193 A194 S237 Y238 R332 N337 A338	I193-I335 HydrophobicContact CD1-CD1 4.15Å; I193-I335 HydrophobicContact CG1-CD1 4.44Å; A194-I335 HydrophobicContact CB-CG2 3.33Å; S237-I335 WeakPolarHBondContact O-CD1 3.48Å; Y238-I335 HydrophobicContact CD1-CD1 4.18Å; Y238-I335 HydrophobicContact CD2-CD1 3.48Å; Y238-I335 VanDerWaalsContact CD2-CD1 3.48Å; Y238-I335 HydrophobicContact CD2-CG1 4.22Å; Y238-I335 HydrophobicContact CE1-CD1 4.21Å; Y238-I335 HydrophobicContact CE1-CG1 4.35Å; Y238-I335 HydrophobicContact CE2-CD1 3.48Å; Y238-I335 VanDerWaalsContact CE2-CD1 3.48Å; Y238-I335 HydrophobicContact CE2-CG1 3.68Å; Y238-I335 HydrophobicContact CG-CD1 3.84Å; R332-I335 HydrophobicContact CG-CD1 4.29Å; R332-I335 WeakPolarHBondContact O-CB 3.49Å; R332-I335 PolarHBondContact O-N 3.34Å; I335-N337 PolarHBondContact O-N 2.88Å; I335-A338 HydrophobicContact CG2-CB 3.86Å
336	R	88.1	Confident	87.9	Confident	240 Å²	240	83.1 Å²	83.1	91%	0.906	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-35.9	-174.8	-63.2	-176.6	-178.4	-178.6	0.1	115	T334	T334-R336 PolarHBondContact O-N 2.92Å
337	N	88	Confident	88.7	Confident	133 Å²	133	86.1 Å²	86.1	71%	0.711	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.5	46.2	-168.2	-69.8	-31.4	0	0	0	112.6	I335 K339	I335-N337 PolarHBondContact O-N 2.88Å; N337-K339 PolarHBondContact O-N 3.5Å
338	A	91.3	Very high	88.9	Confident	49 Å²	49	81.4 Å²	81.4	41%	0.405	42%	0.422	S	S	.	.			trans	-63.8	120	179.8	0	0	0	0	0	112.2	I193 I335	I193-A338 HydrophobicContact CB-CB 4.43Å; I193-A338 HydrophobicContact CD1-CB 4.04Å; I193-A338 HydrophobicContact CG1-CB 3.98Å; I193-A338 CarbonylContact O-C 3.42Å; I193-A338 WeakPolarHBondContact O-CA 3.44Å; I335-A338 HydrophobicContact CG2-CB 3.86Å
339	K	90	Very high	88.8	Confident	123 Å²	123	83.3 Å²	83.3	54%	0.535	43%	0.43	S	S	.	.			trans	-100.4	84.9	-179.1	-55.4	-175.3	-156.4	149.1	0	110.9	R191 I193 T208 N337	R191-K339 PolarHBondContact NH1-O 3.43Å; I193-K339 PolarHBondContact O-N 2.88Å; T208-K339 HydrophobicContact CG2-CB 3.86Å; T208-K339 HydrophobicContact CG2-CD 3.57Å; T208-K339 HydrophobicContact CG2-CG 3.86Å; N337-K339 PolarHBondContact O-N 3.5Å
340	S	89.6	Confident	88.8	Confident	60 Å²	60	86.5 Å²	86.5	42%	0.42	45%	0.453	S	S	.	.			trans	-72.7	150.7	174.8	-171.6	0	0	0	0	112.6	E240 H342	E240-S340 WeakPolarHBondContact OE1-CA 3.46Å; E240-S340 VanDerWaalsContact OE2-CA 3.31Å; E240-S340 WeakPolarHBondContact OE2-CA 3.25Å; E240-S340 WeakPolarHBondContact OE2-CB 3.26Å; E240-S340 PolarHBondContact OE2-OG 3Å; S340-H342 VanDerWaalsContact C-N 3.34Å; S340-H342 PolarHBondContact OG-N 2.85Å
341	I	84.7	Confident	88.7	Confident	75 Å²	75	86.2 Å²	86.2	39%	0.385	45%	0.448	S	S	.	.	S	Bend	trans	-81.1	-13.6	163.3	64.4	-177.7	0	0	0	113.1	R191 E240 L242	R191-I341 VanDerWaalsContact CD-CG2 3.48Å; E240-I341 PolarHBondContact OE1-N 2.92Å; L242-I341 HydrophobicContact CD2-CD1 4.1Å
342	H	82.6	Confident	88.6	Confident	40 Å²	40	89.4 Å²	89.4	19%	0.185	47%	0.466	C	S	.	.			trans	-92.8	129.2	-171.4	-60.6	-63.2	0	0	0	111.7	E240 P241 G244 P245 S340 K344	E240-H342 IonicContact OE2-CD2 3.82Å; P241-H342 PolarHBondContact O-NE2 2.94Å; G244-H342 VanDerWaalsContact C-NE2 3.26Å; G244-H342 WeakPolarHBondContact CA-CE1 3.38Å; G244-H342 PolarHBondContact N-CE1 2.78Å; G244-H342 VanDerWaalsContact N-CE1 3.3Å; G244-H342 PolarHBondContact O-NE2 3.36Å; P245-H342 HydrophobicContact CB-CB 4.05Å; P245-H342 HydrophobicContact CG-CB 4.37Å; S340-H342 VanDerWaalsContact C-N 3.34Å; S340-H342 PolarHBondContact OG-N 2.85Å; H342-K344 PolarHBondContact O-N 3.21Å
343	S	81.4	Confident	88.7	Confident	133 Å²	133	86.1 Å²	86.1	93%	0.93	46%	0.456	S	S	*	.	S	Bend	trans	-75.8	-5.4	174.4	58	0	0	0	0	114
344	K	85.4	Confident	88.8	Confident	162 Å²	162	83.2 Å²	83.2	70%	0.704	44%	0.436	S	S	*	.	S	Bend	trans	-116.2	141.1	173.8	-65	-177.1	-179.8	-179.3	0	109.3	P245 H342	P245-K344 WeakPolarHBondContact CB-O 3.23Å; P245-K344 HydrophobicContact CG-CB 4.45Å; P245-K344 WeakPolarHBondContact CG-O 3.32Å; H342-K344 PolarHBondContact O-N 3.21Å
345	S	83.6	Confident	88.8	Confident	90 Å²	90	84.2 Å²	84.2	63%	0.629	43%	0.432	S	S	*	.			trans	-73.8	152.9	169.3	48.3	0	0	0	0	112.1	Q347	S345-Q347 PolarHBondContact O-NE2 2.86Å
346	R	84.8	Confident	88.8	Confident	49 Å²	49	90.5 Å²	90.5	19%	0.185	45%	0.454	C	S	.	.			trans	-59.5	139.9	167.8	-167.2	174.1	-163.2	-82.5	34.1	110.4	P245 E246 E250 K348	P245-R346 HydrophobicContact CB-CB 4.31Å; P245-R346 WeakPolarHBondContact O-CB 3.02Å; P245-R346 WeakPolarHBondContact O-CD 3.32Å; P245-R346 WeakPolarHBondContact O-CG 3.29Å; E246-R346 WeakPolarHBondContact OE1-CG 3.48Å; E246-R346 IonicContact OE1-CZ 2.76Å; E246-R346 VanDerWaalsContact OE1-CZ 3.32Å; E246-R346 IonicContact OE1-NE 2.75Å; E246-R346 PolarHBondContact OE1-NE 3.02Å; E246-R346 IonicContact OE1-NH1 3.2Å; E246-R346 PolarHBondContact OE1-NH1 3.03Å; E246-R346 WeakPolarHBondContact OE2-CG 3.48Å; E250-R346 IonicContact OE1-CZ 2.96Å; E250-R346 IonicContact OE1-NH1 2.84Å; E250-R346 IonicContact OE1-NH2 3.93Å; E250-R346 PolarHBondContact OE1-NH2 2.81Å; E250-R346 IonicContact OE2-CZ 2.71Å; E250-R346 VanDerWaalsContact OE2-CZ 3.28Å; E250-R346 IonicContact OE2-NH1 2.79Å; E250-R346 PolarHBondContact OE2-NH1 3.35Å; E250-R346 IonicContact OE2-NH2 2.81Å; E250-R346 PolarHBondContact OE2-NH2 3.46Å; R346-K348 PolarHBondContact O-N 2.73Å; R346-K348 VanDerWaalsContact O-N 3.16Å
347	Q	84.5	Confident	89.1	Confident	143 Å²	143	81.5 Å²	81.5	67%	0.668	42%	0.424	S	S	*	.			trans	-87.1	81.6	-177.1	-59.3	-56.6	-71	0	0	110.6	E246 S345	E246-Q347 WeakPolarHBondContact OE2-CB 3.37Å; E246-Q347 PolarHBondContact OE2-N 3.06Å; S345-Q347 PolarHBondContact O-NE2 2.86Å
348	K	86.5	Confident	89.4	Confident	89 Å²	89	75.3 Å²	75.3	39%	0.387	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-89.7	133.4	171.3	-69.5	-152.3	173	-152.8	0	112	D290 R346	D290-K348 IonicContact OD2-NZ 2.66Å; D290-K348 PolarHBondContact OD2-NZ 2.81Å; R346-K348 PolarHBondContact O-N 2.73Å; R346-K348 VanDerWaalsContact O-N 3.16Å
349	L	89.1	Confident	89.4	Confident	72 Å²	72	76.7 Å²	76.7	38%	0.377	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-63.6	138.9	164.8	-72.6	162.2	0	0	0	110	P253 A353 Y354	P253-L349 HydrophobicContact CG-CD1 4.08Å; L349-A353 HydrophobicContact CB-CB 4.24Å; L349-A353 HydrophobicContact CD2-CB 3.73Å; L349-Y354 HydrophobicContact CB-CD2 4.16Å; L349-Y354 HydrophobicContact CB-CE1 4.12Å; L349-Y354 HydrophobicContact CB-CE2 3.58Å; L349-Y354 HydrophobicContact CD1-CD1 4.37Å; L349-Y354 HydrophobicContact CD1-CE1 3.72Å; L349-Y354 WeakPolarHBondContact O-CE2 3.37Å
350	S	92.5	Very high	89.5	Confident	69 Å²	69	78.1 Å²	78.1	48%	0.483	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-78.3	160.3	171.3	64.5	0	0	0	0	111.6	D352 A353 Y354	S350-D352 PolarHBondContact O-N 2.68Å; S350-A353 WeakPolarHBondContact O-CA 3.49Å; S350-A353 VanDerWaalsContact O-CB 3.31Å; S350-A353 WeakPolarHBondContact O-CB 2.92Å; S350-A353 PolarHBondContact O-N 2.8Å; S350-A353 PolarHBondContact OG-N 3.12Å; S350-Y354 VanDerWaalsContact O-CD2 3.29Å; S350-Y354 WeakPolarHBondContact O-CD2 3.45Å; S350-Y354 PolarHBondContact O-N 3.1Å; S350-Y354 VanDerWaalsContact O-N 3.1Å
351	Q	92.8	Very high	89.6	Confident	31 Å²	31	77.6 Å²	77.6	15%	0.145	38%	0.377	C	S	.	.	H	α-helix	trans	-56.7	-35.7	173.9	-77.2	-61	-5.9	0	0	112.5	D272 T301 G302 H303 A353 Y354 R355	D272-Q351 HydrophobicContact CB-CG 3.79Å; D272-Q351 PolarHBondContact O-NE2 2.89Å; T301-Q351 PolarHBondContact O-OE1 3.14Å; T301-Q351 PolarHBondContact OG1-OE1 2.91Å; T301-Q351 VanDerWaalsContact OG1-OE1 3.09Å; G302-Q351 VanDerWaalsContact C-NE2 3.31Å; H303-Q351 PolarHBondContact CE1-NE2 3.28Å; H303-Q351 PolarHBondContact ND1-NE2 3.3Å; Q351-A353 PolarHBondContact O-N 3.17Å; Q351-Y354 PolarHBondContact O-N 3.27Å; Q351-R355 WeakPolarHBondContact O-CB 3.47Å; Q351-R355 PolarHBondContact O-N 3.15Å
352	D	92.4	Very high	89.8	Confident	86 Å²	86	75.7 Å²	75.7	46%	0.46	37%	0.367	S	S	.	.	H	α-helix	trans	-65.2	-22.6	172.5	-96.6	-14.2	0	0	0	114.5	S350 R355 R356	S350-D352 PolarHBondContact O-N 2.68Å; D352-R355 IonicContact OD1-CZ 3.63Å; D352-R355 IonicContact OD1-NE 3.39Å; D352-R355 PolarHBondContact OD1-NE 3.22Å; D352-R355 IonicContact OD1-NH2 3.49Å; D352-R355 PolarHBondContact OD1-NH2 3.36Å; D352-R356 WeakPolarHBondContact O-CB 3.1Å; D352-R356 VanDerWaalsContact O-CG 3.26Å; D352-R356 WeakPolarHBondContact O-CG 3.07Å; D352-R356 PolarHBondContact O-N 3.04Å; D352-R356 PolarHBondContact O-NE 3.29Å
353	A	94.9	Very high	90	Very high	11 Å²	11	81 Å²	81	9%	0.091	39%	0.392	C	S	.	.	H	α-helix	trans	-76.6	-48.7	168.9	0	0	0	0	0	111.2	L349 S350 Q351 R355 R356 N357	L349-A353 HydrophobicContact CB-CB 4.24Å; L349-A353 HydrophobicContact CD2-CB 3.73Å; S350-A353 WeakPolarHBondContact O-CA 3.49Å; S350-A353 VanDerWaalsContact O-CB 3.31Å; S350-A353 WeakPolarHBondContact O-CB 2.92Å; S350-A353 PolarHBondContact O-N 2.8Å; S350-A353 PolarHBondContact OG-N 3.12Å; Q351-A353 PolarHBondContact O-N 3.17Å; A353-R355 PolarHBondContact O-N 3.44Å; A353-R356 PolarHBondContact O-N 3.22Å; A353-N357 WeakPolarHBondContact O-CB 3.36Å; A353-N357 VanDerWaalsContact O-CG 3.28Å; A353-N357 PolarHBondContact O-N 3.14Å
354	Y	95.4	Very high	90.2	Very high	4 Å²	4	81.8 Å²	81.8	2%	0.016	38%	0.381	C	S	.	.	H	α-helix	trans	-56.8	-50.2	175.7	-68.3	-70.7	0	0	0	112.1	P253 Y255 H286 V294 L349 S350 Q351 R356 N357 S358	P253-Y354 HydrophobicContact CB-CE1 4.11Å; Y255-Y354 HydrophobicContact CE1-CD1 4.11Å; H286-Y354 HydrophobicContact CB-CE1 4.22Å; H286-Y354 PolarHBondContact CE1-OH 2.92Å; H286-Y354 AromaticContact ND1-CE1 3.49Å; H286-Y354 WeakPolarHBondContact ND1-CE1 3.48Å; H286-Y354 AromaticContact ND1-CZ 3.53Å; H286-Y354 PolarHBondContact ND1-OH 2.51Å; V294-Y354 HydrophobicContact CG1-CD1 4.16Å; V294-Y354 HydrophobicContact CG1-CD2 4.16Å; V294-Y354 HydrophobicContact CG1-CG 3.95Å; V294-Y354 HydrophobicContact CG2-CD2 4.25Å; V294-Y354 HydrophobicContact CG2-CE1 4.15Å; V294-Y354 HydrophobicContact CG2-CE2 3.84Å; L349-Y354 HydrophobicContact CB-CD2 4.16Å; L349-Y354 HydrophobicContact CB-CE1 4.12Å; L349-Y354 HydrophobicContact CB-CE2 3.58Å; L349-Y354 HydrophobicContact CD1-CD1 4.37Å; L349-Y354 HydrophobicContact CD1-CE1 3.72Å; L349-Y354 WeakPolarHBondContact O-CE2 3.37Å; S350-Y354 VanDerWaalsContact O-CD2 3.29Å; S350-Y354 WeakPolarHBondContact O-CD2 3.45Å; S350-Y354 PolarHBondContact O-N 3.1Å; S350-Y354 VanDerWaalsContact O-N 3.1Å; Q351-Y354 PolarHBondContact O-N 3.27Å; Y354-R356 VanDerWaalsContact C-N 3.35Å; Y354-R356 PolarHBondContact O-N 3.35Å; Y354-N357 PolarHBondContact O-N 3.05Å; Y354-S358 WeakPolarHBondContact O-CB 3.47Å; Y354-S358 PolarHBondContact O-N 2.95Å
355	R	93.7	Very high	89.8	Confident	90 Å²	90	79.2 Å²	79.2	34%	0.34	37%	0.37	S	S	.	.	H	α-helix	trans	-56.8	-42.5	178.4	-170.9	177.5	67.3	85.5	-4.2	112.8	T301 Q351 D352 A353 R359	T301-R355 PolarHBondContact OG1-N 2.96Å; Q351-R355 WeakPolarHBondContact O-CB 3.47Å; Q351-R355 PolarHBondContact O-N 3.15Å; D352-R355 IonicContact OD1-CZ 3.63Å; D352-R355 IonicContact OD1-NE 3.39Å; D352-R355 PolarHBondContact OD1-NE 3.22Å; D352-R355 IonicContact OD1-NH2 3.49Å; D352-R355 PolarHBondContact OD1-NH2 3.36Å; A353-R355 PolarHBondContact O-N 3.44Å; R355-R359 WeakPolarHBondContact O-CB 3.4Å; R355-R359 WeakPolarHBondContact O-CD 3.25Å; R355-R359 WeakPolarHBondContact O-CG 3.38Å; R355-R359 PolarHBondContact O-N 3.13Å; R355-R359 VanDerWaalsContact O-N 3.1Å
356	R	93.9	Very high	88.9	Confident	152 Å²	152	77.6 Å²	77.6	57%	0.574	37%	0.367	S	S	*	.	H	α-helix	trans	-71.2	-43.6	177.2	-78.1	-179.2	-64.8	153.8	3.8	112.5	D352 A353 Y354 R360	D352-R356 WeakPolarHBondContact O-CB 3.1Å; D352-R356 VanDerWaalsContact O-CG 3.26Å; D352-R356 WeakPolarHBondContact O-CG 3.07Å; D352-R356 PolarHBondContact O-N 3.04Å; D352-R356 PolarHBondContact O-NE 3.29Å; A353-R356 PolarHBondContact O-N 3.22Å; Y354-R356 VanDerWaalsContact C-N 3.35Å; Y354-R356 PolarHBondContact O-N 3.35Å; R356-R360 WeakPolarHBondContact O-CB 3.3Å; R356-R360 PolarHBondContact O-N 3.2Å
357	N	94.6	Very high	87.5	Confident	50 Å²	50	79.4 Å²	79.4	27%	0.267	38%	0.384	S	S	.	.	H	α-helix	trans	-66.9	-45.7	-180	-70.1	-7.4	0	0	0	111.2	Y255 A353 Y354 R360 Y361	Y255-N357 HydrophobicContact CD1-CB 4.09Å; Y255-N357 HydrophobicContact CD2-CB 4.21Å; Y255-N357 HydrophobicContact CE1-CB 3.55Å; Y255-N357 HydrophobicContact CE2-CB 3.68Å; Y255-N357 HydrophobicContact CG-CB 4.4Å; Y255-N357 PolarHBondContact OH-ND2 2.84Å; A353-N357 WeakPolarHBondContact O-CB 3.36Å; A353-N357 VanDerWaalsContact O-CG 3.28Å; A353-N357 PolarHBondContact O-N 3.14Å; Y354-N357 PolarHBondContact O-N 3.05Å; N357-R360 WeakPolarHBondContact O-CB 3.42Å; N357-R360 PolarHBondContact O-N 2.88Å; N357-Y361 PolarHBondContact O-N 2.99Å
358	S	93.9	Very high	85.8	Confident	3 Å²	3	78.2 Å²	78.2	2%	0.021	39%	0.386	C	S	.	.	H	α-helix	trans	-56.1	-51.3	173.6	175.8	0	0	0	0	112.4	R296 Y354 R360 Y361 L362	R296-S358 WeakPolarHBondContact CD-OG 3.48Å; R296-S358 PolarHBondContact NH1-OG 2.95Å; Y354-S358 WeakPolarHBondContact O-CB 3.47Å; Y354-S358 PolarHBondContact O-N 2.95Å; S358-R360 VanDerWaalsContact C-N 3.32Å; S358-R360 PolarHBondContact O-N 3.32Å; S358-Y361 PolarHBondContact O-N 2.86Å; S358-L362 PolarHBondContact O-N 3.36Å
359	R	92	Very high	84	Confident	79 Å²	79	77.7 Å²	77.7	30%	0.298	39%	0.392	S	S	.	.	H	α-helix	trans	-61.1	-37.8	176.3	-74.6	171.7	179.8	-122.2	-0.5	112.6	E299 R355 Q363	E299-R359 VanDerWaalsContact CB-NH2 3.31Å; E299-R359 PolarHBondContact O-NE 3.3Å; E299-R359 PolarHBondContact O-NH2 2.53Å; E299-R359 IonicContact OE2-CZ 2.77Å; E299-R359 IonicContact OE2-NE 3.59Å; E299-R359 IonicContact OE2-NH1 3.67Å; E299-R359 PolarHBondContact OE2-NH1 3.31Å; E299-R359 IonicContact OE2-NH2 3.17Å; E299-R359 PolarHBondContact OE2-NH2 3.36Å; R355-R359 WeakPolarHBondContact O-CB 3.4Å; R355-R359 WeakPolarHBondContact O-CD 3.25Å; R355-R359 WeakPolarHBondContact O-CG 3.38Å; R355-R359 PolarHBondContact O-N 3.13Å; R355-R359 VanDerWaalsContact O-N 3.1Å; R359-Q363 WeakPolarHBondContact O-CG 3.09Å; R359-Q363 PolarHBondContact O-N 2.91Å; R359-Q363 VanDerWaalsContact O-N 3.17Å
360	R	92.1	Very high	81.6	Confident	153 Å²	153	80.3 Å²	80.3	58%	0.577	41%	0.413	S	S	*	.	H	α-helix	trans	-64	-43.4	174.7	177.1	-175.7	-73.1	155.4	-6.6	111.6	R356 N357 S358 Q363 Q364	R356-R360 WeakPolarHBondContact O-CB 3.3Å; R356-R360 PolarHBondContact O-N 3.2Å; N357-R360 WeakPolarHBondContact O-CB 3.42Å; N357-R360 PolarHBondContact O-N 2.88Å; S358-R360 VanDerWaalsContact C-N 3.32Å; S358-R360 PolarHBondContact O-N 3.32Å; R360-Q363 PolarHBondContact O-N 2.99Å; R360-Q364 WeakPolarHBondContact O-CG 3.43Å; R360-Q364 PolarHBondContact O-N 3.08Å; R360-Q364 VanDerWaalsContact O-N 3.09Å
361	Y	90.3	Very high	79.1	Confident	49 Å²	49	86 Å²	86	19%	0.192	43%	0.429	C	S	.	.	H	α-helix	trans	-62	-49.2	178.2	177.3	-83.3	0	0	0	111.5	Y255 E256 N357 S358 Q363 Q364 K365	Y255-Y361 WeakPolarHBondContact O-CD1 3.21Å; Y255-Y361 WeakPolarHBondContact O-CE1 3.48Å; E256-Y361 VanDerWaalsContact CA-CZ 3.42Å; E256-Y361 WeakPolarHBondContact CA-OH 3.41Å; E256-Y361 HydrophobicContact CB-CE1 4.37Å; E256-Y361 HydrophobicContact CB-CE2 4.43Å; E256-Y361 WeakPolarHBondContact CB-OH 3.38Å; E256-Y361 VanDerWaalsContact CD-OH 3.22Å; E256-Y361 VanDerWaalsContact CG-OH 3.32Å; E256-Y361 WeakPolarHBondContact CG-OH 3.48Å; E256-Y361 PolarHBondContact OE2-OH 3.07Å; N357-Y361 PolarHBondContact O-N 2.99Å; S358-Y361 PolarHBondContact O-N 2.86Å; Y361-Q363 VanDerWaalsContact C-N 3.28Å; Y361-Q363 PolarHBondContact O-N 3.03Å; Y361-Q364 PolarHBondContact O-N 2.94Å; Y361-K365 HydrophobicContact CE1-CD 3.81Å; Y361-K365 PolarHBondContact O-N 3.05Å; Y361-K365 WeakPolarHBondContact OH-CD 3.49Å; Y361-K365 WeakPolarHBondContact OH-CE 3.28Å; Y361-K365 PolarHBondContact OH-NZ 2.92Å
362	L	88.9	Confident	76.7	Confident	35 Å²	35	96.1 Å²	96.1	18%	0.183	47%	0.466	C	S	.	.	H	α-helix	trans	-59.7	-37.6	178.4	-69.2	174.4	0	0	0	112.7	S358 K365 G366 V367	S358-L362 PolarHBondContact O-N 3.36Å; L362-K365 PolarHBondContact O-N 3.26Å; L362-G366 PolarHBondContact O-N 2.91Å; L362-V367 HydrophobicContact CD2-CB 4.45Å; L362-V367 PolarHBondContact O-N 3.14Å; L362-V367 VanDerWaalsContact O-N 3.12Å
363	Q	87.6	Confident	73.9	Confident	150 Å²	150	99.8 Å²	99.8	70%	0.701	49%	0.486	S	S	*	.	H	α-helix	trans	-64.6	-40	174	-72.6	166	20.4	0	0	112.4	R359 R360 Y361 G366	R359-Q363 WeakPolarHBondContact O-CG 3.09Å; R359-Q363 PolarHBondContact O-N 2.91Å; R359-Q363 VanDerWaalsContact O-N 3.17Å; R360-Q363 PolarHBondContact O-N 2.99Å; Y361-Q363 VanDerWaalsContact C-N 3.28Å; Y361-Q363 PolarHBondContact O-N 3.03Å; Q363-G366 PolarHBondContact O-N 3.07Å
364	Q	85.3	Confident	71.1	Confident	151 Å²	151	104.8 Å²	104.8	71%	0.706	52%	0.52	S	S	*	.	H	α-helix	trans	-68.5	-36.2	177.4	-72.8	174.3	-7.1	0	0	112.5	R360 Y361 G366	R360-Q364 WeakPolarHBondContact O-CG 3.43Å; R360-Q364 PolarHBondContact O-N 3.08Å; R360-Q364 VanDerWaalsContact O-N 3.09Å; Y361-Q364 PolarHBondContact O-N 2.94Å; Q364-G366 PolarHBondContact O-N 3.26Å
365	K	77.8	Confident	68.2	Low	108 Å²	108	108.4 Å²	108.4	47%	0.47	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	1	175.7	-119.6	-173.1	-175.8	171.7	0	114.4	E256 Y361 L362 V367	E256-K365 IonicContact OE1-NZ 2.7Å; E256-K365 PolarHBondContact OE1-NZ 3.41Å; E256-K365 IonicContact OE2-NZ 2.67Å; E256-K365 PolarHBondContact OE2-NZ 2.9Å; E256-K365 VanDerWaalsContact OE2-NZ 3.14Å; Y361-K365 HydrophobicContact CE1-CD 3.81Å; Y361-K365 PolarHBondContact O-N 3.05Å; Y361-K365 WeakPolarHBondContact OH-CD 3.49Å; Y361-K365 WeakPolarHBondContact OH-CE 3.28Å; Y361-K365 PolarHBondContact OH-NZ 2.92Å; L362-K365 PolarHBondContact O-N 3.26Å; K365-V367 VanDerWaalsContact C-N 3.27Å; K365-V367 HydrophobicContact CB-CG2 4.26Å; K365-V367 PolarHBondContact O-N 2.9Å
366	G	64	Low	65.4	Low	56 Å²	56	114.1 Å²	114.1	58%	0.577	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.6	13.1	178.4	0	0	0	0	0	115.1	L362 Q363 Q364 T368	L362-G366 PolarHBondContact O-N 2.91Å; Q363-G366 PolarHBondContact O-N 3.07Å; Q364-G366 PolarHBondContact O-N 3.26Å; G366-T368 PolarHBondContact O-N 2.94Å
367	V	55.8	Low	62.4	Low	87 Å²	87	113.3 Å²	113.3	53%	0.527	60%	0.598	S	S	.	*			trans	-80.4	82	-177	-177.4	0	0	0	0	109.8	L362 K365	L362-V367 HydrophobicContact CD2-CB 4.45Å; L362-V367 PolarHBondContact O-N 3.14Å; L362-V367 VanDerWaalsContact O-N 3.12Å; K365-V367 VanDerWaalsContact C-N 3.27Å; K365-V367 HydrophobicContact CB-CG2 4.26Å; K365-V367 PolarHBondContact O-N 2.9Å
368	T	48.9	Very low	59.5	Low	117 Å²	117	116.7 Å²	116.7	72%	0.718	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-75.5	129.1	169	46.5	0	0	0	0	111	G366	G366-T368 PolarHBondContact O-N 2.94Å
369	P	47.8	Very low	56.4	Low	79 Å²	79	125 Å²	125	51%	0.513	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-60	156.5	170.5	-22.9	33.7	0	0	0	112.7	K371	P369-K371 PolarHBondContact O-N 3.01Å; P369-K371 VanDerWaalsContact O-N 3.17Å
370	P	37.9	Very low	53.6	Low	127 Å²	127	131 Å²	131	83%	0.825	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-61.2	118.8	171.6	26.2	-33.8	0	0	0	110.3	R372	P370-R372 PolarHBondContact O-N 3.06Å
371	K	40.6	Very low	50.5	Low	188 Å²	188	131.9 Å²	131.9	82%	0.817	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-66.4	120.8	-179.2	-68.7	174.4	-179.7	169.1	0	110.6	P369 N373	P369-K371 PolarHBondContact O-N 3.01Å; P369-K371 VanDerWaalsContact O-N 3.17Å; K371-N373 PolarHBondContact O-N 2.99Å
372	R	42	Very low	47.5	Very low	243 Å²	243	140.2 Å²	140.2	92%	0.917	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-68.2	121.9	157.3	-69	-179.5	72.2	173.6	2.4	107.8	P370 S374	P370-R372 PolarHBondContact O-N 3.06Å; R372-S374 PolarHBondContact O-N 2.84Å
373	N	34.1	Very low	44.5	Very low	164 Å²	164	146 Å²	146	88%	0.877	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-70.6	121.5	177.5	-82	-21.7	0	0	0	111	K371	K371-N373 PolarHBondContact O-N 2.99Å
374	S	36.1	Very low	41.5	Very low	115 Å²	115	146.5 Å²	146.5	80%	0.804	77%	0.767	S	S	*	*			trans	-133.7	137.5	155.8	54.6	0	0	0	0	108.8	R372	R372-S374 PolarHBondContact O-N 2.84Å
375	G	34.2	Very low	38.9	Very low	81 Å²	81	146 Å²	146	84%	0.835	77%	0.765	S	S	*	*			trans	-75.2	146.8	-169.5	0	0	0	0	0	113.6
376	K	35.5	Very low	36.7	Very low	210 Å²	210	147.3 Å²	147.3	91%	0.913	78%	0.777	S	S	*	*			trans	-79.2	136.1	167.9	-71.2	178.7	174.3	-178.9	0	110.7
377	V	30.6	Very low	35	Very low	135 Å²	135	150.3 Å²	150.3	82%	0.818	78%	0.779	S	S	*	*			trans	-136.1	131.2	149	-173.1	0	0	0	0	107.8
378	P	34.6	Very low	33.7	Very low	121 Å²	121	153.2 Å²	153.2	79%	0.786	79%	0.791	S	S	*	*			trans	-85.5	143.5	-178.6	-7.2	25.9	0	0	0	113
379	L	29.3	Very low	33.3	Very low	177 Å²	177	152.3 Å²	152.3	93%	0.927	79%	0.787	S	S	*	*			trans	-81.9	148.9	168.7	-84.7	139.5	0	0	0	111.8
380	K	31.3	Very low	32.3	Very low	205 Å²	205	156.9 Å²	156.9	89%	0.891	80%	0.801	S	S	*	*			trans	-109.4	159.2	166.7	-90.9	-175.2	172.8	-179.6	0	110.4
381	E	27	Very low	31.7	Very low	172 Å²	172	156.4 Å²	156.4	80%	0.804	80%	0.796	S	S	*	*			trans	-82.7	170.1	-171.2	-51	170.7	113.5	0	0	115.1
382	R	27.3	Very low	31.2	Very low	224 Å²	224	153 Å²	153	85%	0.845	80%	0.796	S	S	*	*			trans	109.4	109.9	159.4	-63	165.9	-178.4	-147.1	-5.1	112.8
383	K	26	Very low	30.3	Very low	156 Å²	156	150.3 Å²	150.3	68%	0.678	79%	0.793	S	S	*	*				91.6	104.1	58.8	-170	-146.7	-175.3	-153.8	0	109.7	E385	K383-E385 IonicContact NZ-OE1 2.74Å; K383-E385 PolarHBondContact NZ-OE1 3.26Å
384	N	26.1	Very low	30	Very low	161 Å²	161	147.7 Å²	147.7	86%	0.861	79%	0.788	S	S	*	*			trans	-112.9	163.9	168.7	-78.4	11.4	0	0	0	110.3
385	E	29.7	Very low	29.5	Very low	140 Å²	140	147.5 Å²	147.5	65%	0.654	79%	0.787	S	S	*	*			trans	-123.2	141.3	-179.1	-74.6	166.5	173.6	0	0	110.7	K383	K383-E385 IonicContact NZ-OE1 2.74Å; K383-E385 PolarHBondContact NZ-OE1 3.26Å
386	D	31.3	Very low	29.2	Very low	135 Å²	135	148.7 Å²	148.7	72%	0.722	78%	0.782	S	S	*	*			trans	52.5	124.7	148.7	-64.9	-62.9	0	0	0	125.3
387	N	29.7	Very low	28.8	Very low	119 Å²	119	147.7 Å²	147.7	64%	0.636	78%	0.781	S	S	*	*			trans	54.6	120.5	135.2	-68.4	-80.8	0	0	0	121.4
388	I	28.1	Very low	28.8	Very low	148 Å²	148	146.7 Å²	146.7	76%	0.759	78%	0.78	S	S	*	*				74.1	137.9	63.3	-68.1	173.8	0	0	0	112.5
389	P	40.3	Very low	28.9	Very low	98 Å²	98	150 Å²	150	64%	0.636	79%	0.785	S	S	*	*			cis	-132.3	-177.6	-0.4	38.9	-20.5	0	0	0	117.1
390	E	25.6	Very low	29.1	Very low	175 Å²	175	150 Å²	150	82%	0.818	79%	0.785	S	S	*	*			trans	64.8	154.3	140.8	-91.7	174.7	-157	0	0	122.1
391	V	27	Very low	29.3	Very low	117 Å²	117	149.6 Å²	149.6	71%	0.709	78%	0.783	S	S	*	*			cis	-145.5	168.5	-3.1	-147.3	0	0	0	0	110.6
392	S	29.4	Very low	29.8	Very low	117 Å²	117	151.5 Å²	151.5	82%	0.818	79%	0.789	S	S	*	*			trans	92.8	157.8	147.9	79.7	0	0	0	0	119.9
393	E	24.1	Very low	30.3	Very low	186 Å²	186	150 Å²	150	87%	0.869	79%	0.791	S	S	*	*			trans	-110.9	147.9	-159.5	-55.3	169.1	115.9	0	0	112.6
394	S	26.8	Very low	31.3	Very low	109 Å²	109	146.6 Å²	146.6	76%	0.762	79%	0.792	S	S	*	*				174.5	143.5	117.9	45.3	0	0	0	0	114.5
395	S	25.7	Very low	32	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	79%	0.789	S	S	*	*			trans	66.2	136.8	146.2	-60.5	0	0	0	0	123.3
396	S	27.8	Very low	33.1	Very low	106 Å²	106	144.7 Å²	144.7	74%	0.741	80%	0.798	S	S	*	*			trans	80.5	107.3	152.2	50.8	0	0	0	0	122.2
397	E	28.2	Very low	33.9	Very low	188 Å²	188	145.4 Å²	145.4	88%	0.879	80%	0.8	S	S	*	*			trans	77.8	153	134.1	-61.8	-163.9	141.9	0	0	123.5
398	S	29.5	Very low	34.9	Very low	114 Å²	114	144.7 Å²	144.7	80%	0.797	80%	0.802	S	S	*	*			trans	83	124	171.8	72.3	0	0	0	0	120.3
399	E	37.4	Very low	36.6	Very low	192 Å²	192	143.5 Å²	143.5	90%	0.897	80%	0.804	S	S	*	*			trans	4.4	124.3	163.1	-52.1	-168.3	134.7	0	0	121.4
400	L	32.5	Very low	37.2	Very low	175 Å²	175	149.4 Å²	149.4	92%	0.916	81%	0.814	S	S	*	*			trans	-124.6	124.5	162.9	-77.9	173.1	0	0	0	112.8
401	K	35.4	Very low	39.2	Very low	197 Å²	197	144.8 Å²	144.8	86%	0.857	80%	0.799	S	S	*	*			trans	-78.4	147.4	162.9	-68.9	167	-177.4	163.2	0	108.9	E403	K401-E403 PolarHBondContact O-N 3.32Å
402	K	37.1	Very low	41	Very low	213 Å²	213	141.5 Å²	141.5	93%	0.926	78%	0.781	S	S	*	*			trans	-75.5	114.3	174.8	-69.2	179.5	177.6	177.9	0	110.3
403	E	39.1	Very low	42.6	Very low	191 Å²	191	140.6 Å²	140.6	89%	0.893	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-87.6	159.6	166.9	-64.1	-161.9	137.5	0	0	111.8	K401	K401-E403 PolarHBondContact O-N 3.32Å
404	A	46.1	Very low	44.5	Very low	85 Å²	85	139 Å²	139	70%	0.702	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-91.9	152.7	-179.7	0	0	0	0	0	111.5	V406	A404-V406 PolarHBondContact O-N 3.32Å
405	P	41.9	Very low	46.2	Very low	123 Å²	123	137.3 Å²	137.3	80%	0.799	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-64.5	132.5	-175.9	25.7	-34.8	0	0	0	112.7	I407	P405-I407 PolarHBondContact O-N 2.89Å
406	V	51.4	Low	48	Very low	138 Å²	138	134.8 Å²	134.8	84%	0.836	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-71.4	119.9	179.9	180	0	0	0	0	110.5	A404	A404-V406 PolarHBondContact O-N 3.32Å
407	I	49.2	Very low	49.5	Very low	150 Å²	150	133.3 Å²	133.3	77%	0.769	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-76.8	127.2	172.5	-56.3	175.9	0	0	0	108.4	P405	P405-I407 PolarHBondContact O-N 2.89Å
408	P	49.6	Very low	51.1	Low	104 Å²	104	131.6 Å²	131.6	68%	0.675	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-65.3	145.6	179.2	26.7	-34.5	0	0	0	111.6
409	P	64.6	Low	52.6	Low	124 Å²	124	136.2 Å²	136.2	81%	0.805	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-63.2	142	-179.1	26.4	-34.4	0	0	0	111.5
410	R	53.3	Low	53.6	Low	222 Å²	222	129.1 Å²	129.1	84%	0.838	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-60.3	130.5	179.2	-173.3	-178	-175.1	-179.8	2.5	110.3
411	P	67.4	Low	55.2	Low	78 Å²	78	125.4 Å²	125.4	51%	0.506	66%	0.655	S	S	.	*	P	Polyproline II helix	trans	-62.4	155.7	178.5	25	-33.9	0	0	0	112.1	L415 I416	P411-L415 HydrophobicContact CB-CB 4.43Å; P411-I416 HydrophobicContact CG-CD1 4.32Å; P411-I416 HydrophobicContact CG-CG1 4.1Å; P411-I416 WeakPolarHBondContact O-CD1 3.26Å
412	S	64.5	Low	56.4	Low	48 Å²	48	121.6 Å²	121.6	34%	0.336	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-63.2	154.7	-176.6	71.4	0	0	0	0	112.3	E414 L415 I416	S412-E414 PolarHBondContact O-N 3.05Å; S412-E414 VanDerWaalsContact O-N 3.16Å; S412-L415 PolarHBondContact O-N 3.25Å; S412-L415 PolarHBondContact OG-N 2.96Å; S412-I416 WeakPolarHBondContact O-CG1 3.49Å; S412-I416 PolarHBondContact O-N 2.87Å
413	P	63.3	Low	57.1	Low	98 Å²	98	117.2 Å²	117.2	64%	0.636	63%	0.631	S	S	*	*	H	α-helix	trans	-55.3	-32.4	176.7	-26.5	35.8	0	0	0	113.5	I416 L417	P413-I416 PolarHBondContact O-N 3.14Å; P413-L417 WeakPolarHBondContact O-CB 3.36Å; P413-L417 VanDerWaalsContact O-CG 3.25Å; P413-L417 WeakPolarHBondContact O-CG 3.25Å; P413-L417 PolarHBondContact O-N 3.36Å
414	E	64.4	Low	58	Low	153 Å²	153	111 Å²	111	72%	0.715	61%	0.606	S	S	*	*	H	α-helix	trans	-74.1	-44.7	-179.9	-65.9	170.7	150.8	0	0	111.8	S412 I416 L417 E418	S412-E414 PolarHBondContact O-N 3.05Å; S412-E414 VanDerWaalsContact O-N 3.16Å; E414-I416 PolarHBondContact O-N 3.47Å; E414-L417 CarbonylContact O-C 3.51Å; E414-L417 PolarHBondContact O-N 3.45Å; E414-E418 WeakPolarHBondContact O-CB 3.23Å; E414-E418 PolarHBondContact O-N 2.69Å
415	L	62.6	Low	58.4	Low	72 Å²	72	114.2 Å²	114.2	38%	0.377	60%	0.6	S	S	.	*	H	α-helix	trans	-60.5	-31.9	171.5	-87.7	165.7	0	0	0	112.4	P411 S412 R419	P411-L415 HydrophobicContact CB-CB 4.43Å; S412-L415 PolarHBondContact O-N 3.25Å; S412-L415 PolarHBondContact OG-N 2.96Å; L415-R419 WeakPolarHBondContact O-CB 3.25Å; L415-R419 PolarHBondContact O-N 3.13Å
416	I	63.1	Low	59.2	Low	60 Å²	60	115.3 Å²	115.3	31%	0.308	59%	0.592	S	S	.	*	H	α-helix	trans	-69.5	-44.5	171.7	-66.1	167.1	0	0	0	110.5	P411 S412 P413 E414 E418 R419 C420	P411-I416 HydrophobicContact CG-CD1 4.32Å; P411-I416 HydrophobicContact CG-CG1 4.1Å; P411-I416 WeakPolarHBondContact O-CD1 3.26Å; S412-I416 WeakPolarHBondContact O-CG1 3.49Å; S412-I416 PolarHBondContact O-N 2.87Å; P413-I416 PolarHBondContact O-N 3.14Å; E414-I416 PolarHBondContact O-N 3.47Å; I416-E418 VanDerWaalsContact C-N 3.3Å; I416-E418 PolarHBondContact O-N 3.18Å; I416-R419 PolarHBondContact O-N 3.15Å; I416-C420 WeakPolarHBondContact O-CB 3.4Å; I416-C420 PolarHBondContact O-N 3.42Å; I416-C420 PolarHBondContact O-SG 3.03Å
417	L	58.4	Low	59.5	Low	74 Å²	74	116.6 Å²	116.6	39%	0.387	59%	0.587	S	S	.	*	H	α-helix	trans	-69.3	-21.5	179.9	-77.2	165.9	0	0	0	114.9	P413 E414 R425	P413-L417 WeakPolarHBondContact O-CB 3.36Å; P413-L417 VanDerWaalsContact O-CG 3.25Å; P413-L417 WeakPolarHBondContact O-CG 3.25Å; P413-L417 PolarHBondContact O-N 3.36Å; E414-L417 CarbonylContact O-C 3.51Å; E414-L417 PolarHBondContact O-N 3.45Å; L417-R425 PolarHBondContact O-NE 2.85Å
418	E	61.4	Low	59.7	Low	152 Å²	152	115.7 Å²	115.7	71%	0.71	58%	0.581	S	S	*	*	H	α-helix	trans	-90.1	-30.6	177.6	-167.3	174.5	-116.3	0	0	112.6	E414 I416	E414-E418 WeakPolarHBondContact O-CB 3.23Å; E414-E418 PolarHBondContact O-N 2.69Å; I416-E418 VanDerWaalsContact C-N 3.3Å; I416-E418 PolarHBondContact O-N 3.18Å
419	R	61.1	Low	59.9	Low	211 Å²	211	115 Å²	115	80%	0.796	58%	0.578	S	S	*	*	H	α-helix	trans	-101.9	1.5	179.2	-61.7	-176.4	179.5	-172.9	-0.6	114.8	L415 I416	L415-R419 WeakPolarHBondContact O-CB 3.25Å; L415-R419 PolarHBondContact O-N 3.13Å; I416-R419 PolarHBondContact O-N 3.15Å
420	C	60.3	Low	59.4	Low	43 Å²	43	114 Å²	114	29%	0.291	57%	0.57	S	S	.	*	S	Bend	trans	-80.5	144.8	175.3	-89.4	0	0	0	0	113.2	I416 T424	I416-C420 WeakPolarHBondContact O-CB 3.4Å; I416-C420 PolarHBondContact O-N 3.42Å; I416-C420 PolarHBondContact O-SG 3.03Å; C420-T424 HydrophobicContact CB-CG2 4.31Å
421	T	65.7	Low	59.3	Low	98 Å²	98	111.4 Å²	111.4	60%	0.601	57%	0.567	S	S	*	*			trans	-67.6	154.2	166.2	57.8	0	0	0	0	111.5	N423 T424	T421-N423 PolarHBondContact O-N 3.42Å; T421-T424 PolarHBondContact O-N 3.47Å
422	D	59.4	Low	58.2	Low	116 Å²	116	116.8 Å²	116.8	62%	0.62	58%	0.582	S	S	*	*	H	α-helix	trans	-54	-31	-171.8	-64	-70	0	0	0	114.9	T424 R425 K426	D422-T424 VanDerWaalsContact C-N 3.29Å; D422-T424 PolarHBondContact O-N 2.89Å; D422-R425 PolarHBondContact O-N 2.76Å; D422-K426 PolarHBondContact O-N 2.93Å
423	N	52	Low	57.4	Low	122 Å²	122	119.6 Å²	119.6	65%	0.652	60%	0.602	S	S	*	*	H	α-helix	trans	-64.2	-31.2	178.8	-75.1	-30.5	0	0	0	112.9	T421	T421-N423 PolarHBondContact O-N 3.42Å
424	T	57.5	Low	56.7	Low	61 Å²	61	118.3 Å²	118.3	37%	0.374	61%	0.607	S	S	.	*	H	α-helix	trans	-76.7	-41	173.9	-49.7	0	0	0	0	110.5	C420 T421 D422 K426 K427 M428	C420-T424 HydrophobicContact CB-CG2 4.31Å; T421-T424 PolarHBondContact O-N 3.47Å; D422-T424 VanDerWaalsContact C-N 3.29Å; D422-T424 PolarHBondContact O-N 2.89Å; T424-K426 VanDerWaalsContact C-N 3.33Å; T424-K426 PolarHBondContact O-N 3.27Å; T424-K427 PolarHBondContact O-N 2.62Å; T424-M428 PolarHBondContact O-N 3.18Å
425	R	56.3	Low	55.8	Low	151 Å²	151	116.6 Å²	116.6	57%	0.57	61%	0.611	S	S	*	*	H	α-helix	trans	-58.2	-43.5	178.4	-132.8	176	-162.5	-126.8	2.8	111.6	L417 D422 K427 S429	L417-R425 PolarHBondContact O-NE 2.85Å; D422-R425 PolarHBondContact O-N 2.76Å; R425-K427 PolarHBondContact O-N 3.07Å; R425-S429 PolarHBondContact O-N 2.56Å
426	K	57.5	Low	54.5	Low	146 Å²	146	116.8 Å²	116.8	64%	0.635	63%	0.631	S	S	*	*	H	α-helix	trans	-61	-41	176.1	-76.4	177	177.5	174.1	0	113.3	D422 T424 M428 S429	D422-K426 PolarHBondContact O-N 2.93Å; T424-K426 VanDerWaalsContact C-N 3.33Å; T424-K426 PolarHBondContact O-N 3.27Å; K426-M428 PolarHBondContact O-N 3.14Å; K426-S429 PolarHBondContact O-N 3.01Å
427	K	58.2	Low	53.1	Low	165 Å²	165	119.8 Å²	119.8	72%	0.717	66%	0.657	S	S	*	*	H	α-helix	trans	-65.8	-32	-177.1	-79.8	-172.4	174	-176	0	114.1	T424 R425	T424-K427 PolarHBondContact O-N 2.62Å; R425-K427 PolarHBondContact O-N 3.07Å
428	M	53.3	Low	52.1	Low	132 Å²	132	122.2 Å²	122.2	65%	0.65	68%	0.68	S	S	*	*	H	α-helix	trans	-83	-26.1	179	-68.8	-161.9	168.6	0	0	113.9	T424 K426 V430 H431	T424-M428 PolarHBondContact O-N 3.18Å; K426-M428 PolarHBondContact O-N 3.14Å; M428-V430 VanDerWaalsContact C-N 3.27Å; M428-V430 PolarHBondContact O-N 3Å; M428-H431 PolarHBondContact O-N 2.95Å
429	S	53.7	Low	51	Low	89 Å²	89	125 Å²	125	62%	0.622	72%	0.715	S	S	*	*	H	α-helix	trans	-58.9	-38.6	175.3	-165.3	0	0	0	0	112.5	R425 K426 H431 K432	R425-S429 PolarHBondContact O-N 2.56Å; K426-S429 PolarHBondContact O-N 3.01Å; S429-H431 PolarHBondContact O-N 3.26Å; S429-H431 VanDerWaalsContact O-N 3.15Å; S429-K432 PolarHBondContact O-N 2.81Å; S429-K432 VanDerWaalsContact O-N 3.17Å
430	V	53.9	Low	50.5	Low	102 Å²	102	120.7 Å²	120.7	62%	0.618	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-22.9	-179	179.7	0	0	0	0	113.3	M428	M428-V430 VanDerWaalsContact C-N 3.27Å; M428-V430 PolarHBondContact O-N 3Å
431	H	50.9	Low	50	Low	169 Å²	169	124.8 Å²	124.8	78%	0.782	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-2.6	-179.8	-86.4	60	0	0	0	114.5	M428 S429	M428-H431 PolarHBondContact O-N 2.95Å; S429-H431 PolarHBondContact O-N 3.26Å; S429-H431 VanDerWaalsContact O-N 3.15Å
432	K	45.4	Very low	49.1	Very low	190 Å²	190	126.3 Å²	126.3	83%	0.826	74%	0.74	S	S	*	*	S	Bend	trans	-97.9	-7.6	-179	-152.4	174.6	-178.5	-178.3	0	114.4	S429	S429-K432 PolarHBondContact O-N 2.81Å; S429-K432 VanDerWaalsContact O-N 3.17Å
433	S	46.3	Very low	48.5	Very low	107 Å²	107	126.9 Å²	126.9	75%	0.748	75%	0.747	S	S	*	*	S	Bend	trans	-100.4	23	-179.2	59.5	0	0	0	0	113.9
434	G	48.6	Very low	48.3	Very low	72 Å²	72	127.2 Å²	127.2	74%	0.742	75%	0.753	S	S	*	*	S	Bend	trans	-111.7	6.4	-169	0	0	0	0	0	116.5
435	S	46.8	Very low	47.7	Very low	116 Å²	116	131.6 Å²	131.6	81%	0.811	78%	0.778	S	S	*	*	S	Bend	trans	-152.9	110.5	-175.8	59.4	0	0	0	0	112.4
436	G	35.3	Very low	47	Very low	77 Å²	77	130.2 Å²	130.2	79%	0.794	79%	0.793	S	S	*	*			trans	140.4	85.3	168.7	0	0	0	0	0	115.1
437	S	32.3	Very low	46.2	Very low	122 Å²	122	129 Å²	129	85%	0.853	81%	0.805	S	S	*	*			trans	-168.9	91.1	151.1	-104.2	0	0	0	0	109.8
438	S	37.5	Very low	45.3	Very low	125 Å²	125	126 Å²	126	87%	0.874	81%	0.812	S	S	*	*			trans	-152.1	78.1	170.8	-66.3	0	0	0	0	109.5
439	C	39.1	Very low	44.5	Very low	211 Å²	211	125.5 Å²	125.5	100%	1.426	83%	0.827	S	S	*	*			trans	-150.1	0	162.6	-83.2	0	0	0	0	106.4

Retrieved 439 of 439 residues in 523.1 ms (Link to these results)

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