A0A077Z4E4_TRITR Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A077Z4E4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 351 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	31.9	Very low	31.7	Very low	241 Å²	241	151.1 Å²	151.1	100%	1.187	84%	0.844	S	S	*	*				0	143.9	0	-81	-173.7	-175.2	0	0	108.5
2	L	31.1	Very low	31.4	Very low	154 Å²	154	145.3 Å²	145.3	81%	0.806	83%	0.829	S	S	*	*			trans	100.7	84.7	174.9	-64.3	155.3	0	0	0	117
3	K	33.2	Very low	31.4	Very low	190 Å²	190	142.8 Å²	142.8	83%	0.826	82%	0.822	S	S	*	*				66	96	124	-69	-178.1	178.4	-178.5	0	118.2	A5	K3-A5 PolarHBondContact O-N 3.04Å
4	T	34.4	Very low	31.5	Very low	137 Å²	137	144.6 Å²	144.6	84%	0.84	83%	0.825	S	S	*	*			trans	-43.4	121.4	152.6	46.7	0	0	0	0	112.4
5	A	34.3	Very low	31.9	Very low	93 Å²	93	144.8 Å²	144.8	77%	0.769	82%	0.821	S	S	*	*			trans	-76.4	120.5	170	0	0	0	0	0	109.7	K3 T7	K3-A5 PolarHBondContact O-N 3.04Å; A5-T7 PolarHBondContact O-N 3.22Å; A5-T7 VanDerWaalsContact O-N 3.14Å
6	N	32.8	Very low	32.5	Very low	157 Å²	157	140.9 Å²	140.9	84%	0.84	80%	0.797	S	S	*	*			trans	-64.7	102.7	169.1	-82.5	-18.3	0	0	0	109.4	L8	N6-L8 PolarHBondContact O-N 3.3Å
7	T	33.3	Very low	33.1	Very low	140 Å²	140	137.2 Å²	137.2	86%	0.859	78%	0.782	S	S	*	*			trans	-75.3	106.6	162.6	21.4	0	0	0	0	108.6	A5 S9	A5-T7 PolarHBondContact O-N 3.22Å; A5-T7 VanDerWaalsContact O-N 3.14Å; T7-S9 PolarHBondContact O-N 3.14Å
8	L	29.6	Very low	33.6	Very low	164 Å²	164	132 Å²	132	86%	0.859	76%	0.763	S	S	*	*			trans	-48.8	117.9	167.7	-77.7	151	0	0	0	109.5	N6 I10	N6-L8 PolarHBondContact O-N 3.3Å; L8-I10 PolarHBondContact O-N 2.81Å
9	S	28.2	Very low	34.5	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	75%	0.75	S	S	*	*			trans	-69.3	110.7	170.2	61.8	0	0	0	0	108.4	T7 T11	T7-S9 PolarHBondContact O-N 3.14Å; S9-T11 VanDerWaalsContact C-N 3.35Å; S9-T11 PolarHBondContact O-N 3.5Å
10	I	29.9	Very low	35.5	Very low	162 Å²	162	129 Å²	129	83%	0.831	73%	0.733	S	S	*	*			trans	-71.7	98.7	167	-61.8	172.3	0	0	0	105.4	L8 A12	L8-I10 PolarHBondContact O-N 2.81Å; I10-A12 PolarHBondContact O-N 3.15Å
11	T	30.1	Very low	36.5	Very low	119 Å²	119	129 Å²	129	73%	0.73	73%	0.727	S	S	*	*			trans	-61.3	107.2	167.2	48.1	0	0	0	0	107.8	S9	S9-T11 VanDerWaalsContact C-N 3.35Å; S9-T11 PolarHBondContact O-N 3.5Å
12	A	28.2	Very low	37.8	Very low	81 Å²	81	118.6 Å²	118.6	67%	0.669	68%	0.68	S	S	*	*			trans	-54	133.4	166.9	0	0	0	0	0	108.4	I10 I14	I10-A12 PolarHBondContact O-N 3.15Å; A12-I14 PolarHBondContact O-N 3.44Å
13	P	31.2	Very low	39.1	Very low	113 Å²	113	115.6 Å²	115.6	73%	0.734	66%	0.66	S	S	*	*			trans	-61.6	135.7	179.2	-0.1	9.6	0	0	0	108.3	L15	P13-L15 PolarHBondContact O-N 3.06Å
14	I	32.6	Very low	40.4	Very low	169 Å²	169	112.5 Å²	112.5	87%	0.867	65%	0.648	S	S	*	*			trans	-56.1	92.5	167	-63.3	164.8	0	0	0	106.1	A12 D16	A12-I14 PolarHBondContact O-N 3.44Å; I14-D16 PolarHBondContact O-N 3.09Å; I14-D16 VanDerWaalsContact O-N 3.15Å
15	L	37.4	Very low	41.6	Very low	147 Å²	147	111 Å²	111	77%	0.77	63%	0.63	S	S	*	*			trans	-60.5	118.1	172.3	-85.9	157.6	0	0	0	106.4	P13 C17	P13-L15 PolarHBondContact O-N 3.06Å; L15-C17 PolarHBondContact O-N 3.39Å
16	D	42.3	Very low	42.9	Very low	82 Å²	82	106.6 Å²	106.6	44%	0.439	59%	0.594	S	S	.	*			trans	-39	95.1	-179.9	-172.4	-3.9	0	0	0	111.9	I14 G18 R19 T20	I14-D16 PolarHBondContact O-N 3.09Å; I14-D16 VanDerWaalsContact O-N 3.15Å; D16-G18 PolarHBondContact O-N 3.44Å; D16-G18 VanDerWaalsContact O-N 3.09Å; D16-G18 PolarHBondContact OD1-N 3.34Å; D16-R19 HydrophobicContact CB-CB 4.42Å; D16-R19 HydrophobicContact CB-CG 4.29Å; D16-R19 PolarHBondContact O-N 3.17Å; D16-R19 WeakPolarHBondContact OD2-CD 3.31Å; D16-R19 VanDerWaalsContact OD2-CG 3.31Å; D16-R19 WeakPolarHBondContact OD2-CG 3.34Å; D16-R19 IonicContact OD2-CZ 3.3Å; D16-R19 IonicContact OD2-NE 3.18Å; D16-R19 PolarHBondContact OD2-NE 3.38Å; D16-T20 PolarHBondContact O-N 3.09Å; D16-T20 PolarHBondContact O-OG1 2.85Å
17	C	42.5	Very low	44.3	Very low	79 Å²	79	101.2 Å²	101.2	53%	0.534	57%	0.565	S	S	.	*	H	α-helix	trans	-54.7	-31.7	-175.6	-177	0	0	0	0	111.7	L15 Q21	L15-C17 PolarHBondContact O-N 3.39Å; C17-Q21 WeakPolarHBondContact O-CG 3.4Å; C17-Q21 PolarHBondContact O-N 3.02Å; C17-Q21 VanDerWaalsContact O-N 3.09Å
18	G	41	Very low	45.4	Very low	43 Å²	43	102 Å²	102	44%	0.443	55%	0.553	S	S	.	*	H	α-helix	trans	-65.1	-42.4	178.2	0	0	0	0	0	113.3	D16 Q21 A22	D16-G18 PolarHBondContact O-N 3.44Å; D16-G18 VanDerWaalsContact O-N 3.09Å; D16-G18 PolarHBondContact OD1-N 3.34Å; G18-Q21 PolarHBondContact O-N 2.74Å; G18-A22 PolarHBondContact O-N 3.07Å
19	R	51.6	Low	46.9	Very low	136 Å²	136	95.7 Å²	95.7	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-67.1	-40.5	178.2	-71.4	-177.9	-159.2	-144.6	1.5	112.1	D16 A22 K23	D16-R19 HydrophobicContact CB-CB 4.42Å; D16-R19 HydrophobicContact CB-CG 4.29Å; D16-R19 PolarHBondContact O-N 3.17Å; D16-R19 WeakPolarHBondContact OD2-CD 3.31Å; D16-R19 VanDerWaalsContact OD2-CG 3.31Å; D16-R19 WeakPolarHBondContact OD2-CG 3.34Å; D16-R19 IonicContact OD2-CZ 3.3Å; D16-R19 IonicContact OD2-NE 3.18Å; D16-R19 PolarHBondContact OD2-NE 3.38Å; R19-A22 PolarHBondContact O-N 3.29Å; R19-K23 WeakPolarHBondContact O-CB 3.44Å; R19-K23 PolarHBondContact O-N 3.32Å
20	T	55.3	Low	48.3	Very low	67 Å²	67	91.2 Å²	91.2	41%	0.411	49%	0.487	S	S	.	.	H	α-helix	trans	-64	-42.4	178.3	-42.3	0	0	0	0	110.8	D16 K23 H24	D16-T20 PolarHBondContact O-N 3.09Å; D16-T20 PolarHBondContact O-OG1 2.85Å; T20-K23 PolarHBondContact O-N 3.02Å; T20-H24 PolarHBondContact O-CD2 3.34Å; T20-H24 PolarHBondContact O-N 2.94Å
21	Q	55.2	Low	49.6	Very low	130 Å²	130	89 Å²	89	61%	0.607	47%	0.473	S	S	*	.	H	α-helix	trans	-63.1	-45.6	175	-75.2	-177.8	8.9	0	0	112.4	C17 G18 K23 H24 F25	C17-Q21 WeakPolarHBondContact O-CG 3.4Å; C17-Q21 PolarHBondContact O-N 3.02Å; C17-Q21 VanDerWaalsContact O-N 3.09Å; G18-Q21 PolarHBondContact O-N 2.74Å; Q21-K23 VanDerWaalsContact C-N 3.3Å; Q21-K23 PolarHBondContact O-N 2.9Å; Q21-H24 PolarHBondContact O-N 2.96Å; Q21-F25 WeakPolarHBondContact O-CB 3.25Å; Q21-F25 PolarHBondContact O-N 3.01Å
22	A	59.2	Low	50.6	Low	23 Å²	23	85.6 Å²	85.6	19%	0.19	45%	0.454	C	S	.	.	H	α-helix	trans	-58.8	-43.3	176.3	0	0	0	0	0	111.2	G18 R19 F25 W26 P55	G18-A22 PolarHBondContact O-N 3.07Å; R19-A22 PolarHBondContact O-N 3.29Å; A22-F25 PolarHBondContact O-N 2.96Å; A22-W26 WeakPolarHBondContact O-CB 3.32Å; A22-W26 PolarHBondContact O-N 3.37Å; A22-P55 HydrophobicContact CB-CB 4.43Å; A22-P55 HydrophobicContact CB-CG 4.09Å
23	K	59.9	Low	51.6	Low	91 Å²	91	82.2 Å²	82.2	40%	0.396	43%	0.425	S	S	.	.	H	α-helix	trans	-62.7	-46.2	176.7	-170.8	177.3	-175.4	172.4	0	112.2	R19 T20 Q21 W26 L27 P55 L120	R19-K23 WeakPolarHBondContact O-CB 3.44Å; R19-K23 PolarHBondContact O-N 3.32Å; T20-K23 PolarHBondContact O-N 3.02Å; Q21-K23 VanDerWaalsContact C-N 3.3Å; Q21-K23 PolarHBondContact O-N 2.9Å; K23-W26 PolarHBondContact O-N 3.18Å; K23-L27 HydrophobicContact CG-CD1 4.08Å; K23-L27 WeakPolarHBondContact O-CB 3.11Å; K23-L27 VanDerWaalsContact O-CG 3.29Å; K23-L27 WeakPolarHBondContact O-CG 3.46Å; K23-L27 PolarHBondContact O-N 2.83Å; K23-P55 HydrophobicContact CB-CG 4.02Å; K23-L120 WeakPolarHBondContact CE-O 3.3Å; K23-L120 HydrophobicContact CG-CD2 4.21Å; K23-L120 PolarHBondContact NZ-O 3.37Å
24	H	58.9	Low	52.4	Low	125 Å²	125	80.7 Å²	80.7	58%	0.579	41%	0.411	S	S	*	.	H	α-helix	trans	-63.2	-43.4	176.8	-83.2	-70.2	0	0	0	112.5	T20 Q21 W26 L27 Y28	T20-H24 PolarHBondContact O-CD2 3.34Å; T20-H24 PolarHBondContact O-N 2.94Å; Q21-H24 PolarHBondContact O-N 2.96Å; H24-W26 VanDerWaalsContact C-N 3.31Å; H24-W26 PolarHBondContact O-N 3.34Å; H24-L27 PolarHBondContact O-N 3.35Å; H24-Y28 WeakPolarHBondContact O-CB 3.36Å; H24-Y28 PolarHBondContact O-N 2.75Å
25	F	60.6	Low	52.9	Low	104 Å²	104	77.6 Å²	77.6	46%	0.456	40%	0.404	S	S	.	.	H	α-helix	trans	-62	-41.8	176.6	-178.2	-103.1	0	0	0	111.6	Q21 A22 Y28 K29 I52	Q21-F25 WeakPolarHBondContact O-CB 3.25Å; Q21-F25 PolarHBondContact O-N 3.01Å; A22-F25 PolarHBondContact O-N 2.96Å; F25-Y28 PolarHBondContact O-N 3.42Å; F25-K29 HydrophobicContact CD1-CD 4.39Å; F25-K29 HydrophobicContact CE1-CD 3.71Å; F25-K29 HydrophobicContact CE1-CG 4.4Å; F25-K29 HydrophobicContact CZ-CD 4.01Å; F25-K29 VanDerWaalsContact CZ-CE 3.44Å; F25-K29 HydrophobicContact CZ-CG 4.47Å; F25-K29 PolarHBondContact O-N 2.83Å; F25-I52 HydrophobicContact CD1-CG2 4.18Å; F25-I52 HydrophobicContact CE1-CG2 4.06Å
26	W	61.9	Low	53.2	Low	2 Å²	2	73.9 Å²	73.9	1%	0.008	39%	0.39	C	S	.	.	H	α-helix	trans	-65.1	-47	175.3	-112.9	98.3	0	0	0	113	A22 K23 H24 Y28 K29 V30 L47 I52 L54 Q116	A22-W26 WeakPolarHBondContact O-CB 3.32Å; A22-W26 PolarHBondContact O-N 3.37Å; K23-W26 PolarHBondContact O-N 3.18Å; H24-W26 VanDerWaalsContact C-N 3.31Å; H24-W26 PolarHBondContact O-N 3.34Å; W26-Y28 VanDerWaalsContact C-N 3.26Å; W26-Y28 PolarHBondContact O-N 3.27Å; W26-K29 PolarHBondContact O-N 2.83Å; W26-V30 HydrophobicContact CE3-CG2 3.39Å; W26-V30 HydrophobicContact CZ3-CG2 3.49Å; W26-V30 VanDerWaalsContact CZ3-CG2 3.49Å; W26-V30 WeakPolarHBondContact O-CG2 3.22Å; W26-V30 PolarHBondContact O-N 3.09Å; W26-L47 HydrophobicContact CH2-CD1 4.15Å; W26-L47 HydrophobicContact CH2-CD2 3.21Å; W26-L47 HydrophobicContact CH2-CG 4.14Å; W26-L47 HydrophobicContact CZ2-CD2 2.96Å; W26-L47 HydrophobicContact CZ2-CG 4.27Å; W26-L47 HydrophobicContact CZ3-CD2 4.5Å; W26-I52 VanDerWaalsContact CD1-CG2 3.43Å; W26-I52 HydrophobicContact CG-CG2 4.38Å; W26-L54 HydrophobicContact CD2-CD2 3.59Å; W26-L54 HydrophobicContact CE3-CD2 3.98Å; W26-L54 HydrophobicContact CG-CD2 4.2Å; W26-L54 HydrophobicContact CH2-CD2 3.5Å; W26-L54 HydrophobicContact CH2-CG 4.24Å; W26-L54 HydrophobicContact CZ2-CD1 4.16Å; W26-L54 HydrophobicContact CZ2-CD2 3Å; W26-L54 HydrophobicContact CZ2-CG 3.49Å; W26-L54 VanDerWaalsContact CZ2-CG 3.49Å; W26-L54 HydrophobicContact CZ3-CD2 3.97Å; W26-Q116 HydrophobicContact CZ3-CG 4.35Å
27	L	60.7	Low	53.2	Low	44 Å²	44	73 Å²	73	23%	0.23	40%	0.401	C	S	.	.	H	α-helix	trans	-56.3	-44.4	174.5	-77.6	167.4	0	0	0	110.8	K23 H24 V30 Q31 L120	K23-L27 HydrophobicContact CG-CD1 4.08Å; K23-L27 WeakPolarHBondContact O-CB 3.11Å; K23-L27 VanDerWaalsContact O-CG 3.29Å; K23-L27 WeakPolarHBondContact O-CG 3.46Å; K23-L27 PolarHBondContact O-N 2.83Å; H24-L27 PolarHBondContact O-N 3.35Å; L27-V30 PolarHBondContact O-N 2.84Å; L27-Q31 VanDerWaalsContact O-CB 3.28Å; L27-Q31 WeakPolarHBondContact O-CB 3.23Å; L27-Q31 VanDerWaalsContact O-CG 3.24Å; L27-Q31 WeakPolarHBondContact O-CG 3.27Å; L27-Q31 PolarHBondContact O-N 2.98Å; L27-L120 HydrophobicContact CD2-CD1 3.6Å; L27-L120 HydrophobicContact CD2-CD2 3.74Å; L27-L120 HydrophobicContact CD2-CG 4.23Å; L27-L120 HydrophobicContact CG-CD1 4.47Å; L27-L120 HydrophobicContact CG-CD2 3.77Å
28	Y	57.7	Low	53.1	Low	157 Å²	157	71.4 Å²	71.4	62%	0.616	39%	0.386	S	S	*	.	H	α-helix	trans	-61.5	-44.7	176.2	177.5	-98.5	0	0	0	112.3	H24 F25 W26 Q31 S32	H24-Y28 WeakPolarHBondContact O-CB 3.36Å; H24-Y28 PolarHBondContact O-N 2.75Å; F25-Y28 PolarHBondContact O-N 3.42Å; W26-Y28 VanDerWaalsContact C-N 3.26Å; W26-Y28 PolarHBondContact O-N 3.27Å; Y28-Q31 PolarHBondContact O-N 2.59Å; Y28-S32 WeakPolarHBondContact O-CB 3.33Å; Y28-S32 PolarHBondContact O-N 2.9Å
29	K	60	Low	53.5	Low	31 Å²	31	76.4 Å²	76.4	14%	0.135	40%	0.398	C	S	.	.	H	α-helix	trans	-65	-40.8	175.4	-88.6	-171.6	168.8	-174.8	0	112.9	F25 W26 S32 V33 D50 I52	F25-K29 HydrophobicContact CD1-CD 4.39Å; F25-K29 HydrophobicContact CE1-CD 3.71Å; F25-K29 HydrophobicContact CE1-CG 4.4Å; F25-K29 HydrophobicContact CZ-CD 4.01Å; F25-K29 VanDerWaalsContact CZ-CE 3.44Å; F25-K29 HydrophobicContact CZ-CG 4.47Å; F25-K29 PolarHBondContact O-N 2.83Å; W26-K29 PolarHBondContact O-N 2.83Å; K29-S32 PolarHBondContact O-N 3.47Å; K29-S32 PolarHBondContact O-OG 2.96Å; K29-V33 VanDerWaalsContact O-CG2 3.32Å; K29-V33 WeakPolarHBondContact O-CG2 3.37Å; K29-V33 PolarHBondContact O-N 2.95Å; K29-D50 IonicContact NZ-OD2 2.8Å; K29-D50 PolarHBondContact NZ-OD2 3.27Å; K29-I52 HydrophobicContact CD-CD1 3.6Å
30	V	57.4	Low	53.4	Low	11 Å²	11	72.3 Å²	72.3	7%	0.067	39%	0.39	C	S	.	.	H	α-helix	trans	-66.4	-43.8	177	170.8	0	0	0	0	110.7	W26 L27 S32 V33 N34 Q116	W26-V30 HydrophobicContact CE3-CG2 3.39Å; W26-V30 HydrophobicContact CZ3-CG2 3.49Å; W26-V30 VanDerWaalsContact CZ3-CG2 3.49Å; W26-V30 WeakPolarHBondContact O-CG2 3.22Å; W26-V30 PolarHBondContact O-N 3.09Å; L27-V30 PolarHBondContact O-N 2.84Å; V30-S32 VanDerWaalsContact C-N 3.34Å; V30-V33 PolarHBondContact O-N 3.37Å; V30-N34 WeakPolarHBondContact O-CB 3.14Å; V30-N34 VanDerWaalsContact O-CG 3.29Å; V30-N34 PolarHBondContact O-N 2.83Å; V30-N34 PolarHBondContact O-ND2 3.36Å; V30-Q116 HydrophobicContact CG1-CG 4.34Å; V30-Q116 HydrophobicContact CG2-CG 3.94Å
31	Q	58	Low	53.2	Low	116 Å²	116	72.4 Å²	72.4	54%	0.542	40%	0.397	S	S	.	.	H	α-helix	trans	-61.2	-43.6	173.9	-76.5	175.7	-11.4	0	0	110.9	L27 Y28 V33 N34 S35	L27-Q31 VanDerWaalsContact O-CB 3.28Å; L27-Q31 WeakPolarHBondContact O-CB 3.23Å; L27-Q31 VanDerWaalsContact O-CG 3.24Å; L27-Q31 WeakPolarHBondContact O-CG 3.27Å; L27-Q31 PolarHBondContact O-N 2.98Å; Y28-Q31 PolarHBondContact O-N 2.59Å; Q31-V33 VanDerWaalsContact C-N 3.34Å; Q31-V33 PolarHBondContact O-N 3.4Å; Q31-N34 PolarHBondContact O-N 3.09Å; Q31-S35 VanDerWaalsContact O-CB 3.28Å; Q31-S35 WeakPolarHBondContact O-CB 3.3Å; Q31-S35 PolarHBondContact O-N 3.37Å; Q31-S35 PolarHBondContact O-OG 2.91Å
32	S	51.8	Low	53.3	Low	47 Å²	47	71.2 Å²	71.2	33%	0.329	39%	0.39	S	S	.	.	H	α-helix	trans	-63.2	-40.9	178.5	79.4	0	0	0	0	111.6	Y28 K29 V30 S35 S36	Y28-S32 WeakPolarHBondContact O-CB 3.33Å; Y28-S32 PolarHBondContact O-N 2.9Å; K29-S32 PolarHBondContact O-N 3.47Å; K29-S32 PolarHBondContact O-OG 2.96Å; V30-S32 VanDerWaalsContact C-N 3.34Å; S32-S35 PolarHBondContact O-N 3.2Å; S32-S36 VanDerWaalsContact O-CB 3.26Å; S32-S36 WeakPolarHBondContact O-CB 3.47Å; S32-S36 PolarHBondContact O-N 2.91Å; S32-S36 PolarHBondContact O-OG 3.44Å
33	V	48.9	Very low	53.2	Low	10 Å²	10	70.2 Å²	70.2	6%	0.061	38%	0.381	C	S	.	.	H	α-helix	trans	-63.4	-46.5	174.4	169.4	0	0	0	0	111.7	K29 V30 Q31 S35 S36 G37 I38 L43	K29-V33 VanDerWaalsContact O-CG2 3.32Å; K29-V33 WeakPolarHBondContact O-CG2 3.37Å; K29-V33 PolarHBondContact O-N 2.95Å; V30-V33 PolarHBondContact O-N 3.37Å; Q31-V33 VanDerWaalsContact C-N 3.34Å; Q31-V33 PolarHBondContact O-N 3.4Å; V33-S35 VanDerWaalsContact C-N 3.35Å; V33-S35 PolarHBondContact O-N 3.35Å; V33-S36 PolarHBondContact O-N 3.29Å; V33-S36 PolarHBondContact O-OG 2.88Å; V33-G37 PolarHBondContact O-N 2.95Å; V33-I38 HydrophobicContact CB-CB 4.5Å; V33-I38 HydrophobicContact CG1-CB 4.14Å; V33-I38 HydrophobicContact CG1-CG2 4.12Å; V33-I38 HydrophobicContact CG2-CG2 4.24Å; V33-I38 PolarHBondContact O-N 3.18Å; V33-L43 HydrophobicContact CG1-CB 4.3Å; V33-L43 HydrophobicContact CG1-CD2 4.34Å; V33-L43 HydrophobicContact CG2-CB 4.31Å; V33-L43 HydrophobicContact CG2-CD1 4.24Å
34	N	48.3	Very low	53.1	Low	81 Å²	81	67.1 Å²	67.1	43%	0.433	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-39.5	177.9	-72.6	-21.2	0	0	0	112.1	V30 Q31	V30-N34 WeakPolarHBondContact O-CB 3.14Å; V30-N34 VanDerWaalsContact O-CG 3.29Å; V30-N34 PolarHBondContact O-N 2.83Å; V30-N34 PolarHBondContact O-ND2 3.36Å; Q31-N34 PolarHBondContact O-N 3.09Å
35	S	43.4	Very low	53	Low	104 Å²	104	62.7 Å²	62.7	73%	0.727	35%	0.353	S	S	*	.	H	α-helix	trans	-72.5	-32.6	-177.5	-51.9	0	0	0	0	113	Q31 S32 V33	Q31-S35 VanDerWaalsContact O-CB 3.28Å; Q31-S35 WeakPolarHBondContact O-CB 3.3Å; Q31-S35 PolarHBondContact O-N 3.37Å; Q31-S35 PolarHBondContact O-OG 2.91Å; S32-S35 PolarHBondContact O-N 3.2Å; V33-S35 VanDerWaalsContact C-N 3.35Å; V33-S35 PolarHBondContact O-N 3.35Å
36	S	43.6	Very low	53.1	Low	68 Å²	68	59.5 Å²	59.5	48%	0.476	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-0.2	-174.7	54.3	0	0	0	0	113.5	S32 V33 I38	S32-S36 VanDerWaalsContact O-CB 3.26Å; S32-S36 WeakPolarHBondContact O-CB 3.47Å; S32-S36 PolarHBondContact O-N 2.91Å; S32-S36 PolarHBondContact O-OG 3.44Å; V33-S36 PolarHBondContact O-N 3.29Å; V33-S36 PolarHBondContact O-OG 2.88Å; S36-I38 PolarHBondContact O-N 3.26Å; S36-I38 VanDerWaalsContact O-N 3.14Å; S36-I38 WeakPolarHBondContact OG-CB 2.94Å; S36-I38 WeakPolarHBondContact OG-CD1 3.36Å; S36-I38 WeakPolarHBondContact OG-CG1 3.27Å
37	G	42.3	Very low	53.1	Low	65 Å²	65	59.5 Å²	59.5	67%	0.67	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	22.4	-172.2	0	0	0	0	0	112.5	V33 Q39	V33-G37 PolarHBondContact O-N 2.95Å; G37-Q39 PolarHBondContact O-N 3.33Å
38	I	40.5	Very low	53	Low	44 Å²	44	60.2 Å²	60.2	23%	0.226	34%	0.344	C	S	.	.			trans	-62.2	130.1	-176.6	-83.2	170.3	0	0	0	109	V33 S36 K42	V33-I38 HydrophobicContact CB-CB 4.5Å; V33-I38 HydrophobicContact CG1-CB 4.14Å; V33-I38 HydrophobicContact CG1-CG2 4.12Å; V33-I38 HydrophobicContact CG2-CG2 4.24Å; V33-I38 PolarHBondContact O-N 3.18Å; S36-I38 PolarHBondContact O-N 3.26Å; S36-I38 VanDerWaalsContact O-N 3.14Å; S36-I38 WeakPolarHBondContact OG-CB 2.94Å; S36-I38 WeakPolarHBondContact OG-CD1 3.36Å; S36-I38 WeakPolarHBondContact OG-CG1 3.27Å; I38-K42 HydrophobicContact CD1-CD 4.09Å; I38-K42 HydrophobicContact CG1-CD 4.23Å; I38-K42 HydrophobicContact CG2-CB 3.5Å; I38-K42 HydrophobicContact CG2-CD 3.65Å; I38-K42 HydrophobicContact CG2-CG 3.74Å
39	Q	49.5	Very low	53	Low	148 Å²	148	60.1 Å²	60.1	69%	0.692	35%	0.347	S	S	*	.			trans	-61.5	147.6	-177.5	-67.2	-130.6	-19.9	0	0	112.2	G37 A41 K42	G37-Q39 PolarHBondContact O-N 3.33Å; Q39-A41 PolarHBondContact O-N 3.37Å; Q39-K42 PolarHBondContact O-N 2.94Å
40	P	48.8	Very low	52.7	Low	51 Å²	51	62.9 Å²	62.9	33%	0.331	36%	0.363	S	S	.	.	H	α-helix	trans	-50.1	-35.7	178.9	-23.3	29.4	0	0	0	113.2	K42 L43 V44 I112	P40-K42 VanDerWaalsContact C-N 3.32Å; P40-K42 PolarHBondContact O-N 3.02Å; P40-L43 PolarHBondContact O-N 3.47Å; P40-V44 PolarHBondContact O-N 3.39Å; P40-V44 VanDerWaalsContact O-N 3.07Å; P40-I112 HydrophobicContact CB-CD1 3.27Å; P40-I112 WeakPolarHBondContact O-CD1 3.24Å
41	A	50.2	Low	52.5	Low	68 Å²	68	68.2 Å²	68.2	56%	0.562	39%	0.391	S	S	*	.	H	α-helix	trans	-59.6	-34.3	177.7	0	0	0	0	0	114.5	Q39 S45	Q39-A41 PolarHBondContact O-N 3.37Å; A41-S45 WeakPolarHBondContact O-CB 3.42Å; A41-S45 PolarHBondContact O-N 3.36Å
42	K	56.8	Low	52.3	Low	106 Å²	106	63.2 Å²	63.2	46%	0.461	37%	0.368	S	S	.	.	H	α-helix	trans	-74.9	-37.7	178.5	177.6	170.1	175.8	-173.2	0	111.2	I38 Q39 P40 V44 S45 D46	I38-K42 HydrophobicContact CD1-CD 4.09Å; I38-K42 HydrophobicContact CG1-CD 4.23Å; I38-K42 HydrophobicContact CG2-CB 3.5Å; I38-K42 HydrophobicContact CG2-CD 3.65Å; I38-K42 HydrophobicContact CG2-CG 3.74Å; Q39-K42 PolarHBondContact O-N 2.94Å; P40-K42 VanDerWaalsContact C-N 3.32Å; P40-K42 PolarHBondContact O-N 3.02Å; K42-V44 VanDerWaalsContact C-N 3.33Å; K42-V44 PolarHBondContact O-N 2.75Å; K42-S45 CarbonylContact O-C 3.36Å; K42-S45 WeakPolarHBondContact O-CB 3.48Å; K42-S45 PolarHBondContact O-N 2.88Å; K42-D46 WeakPolarHBondContact O-CB 3.49Å; K42-D46 PolarHBondContact O-N 3.49Å
43	L	57.8	Low	52.8	Low	2 Å²	2	64.8 Å²	64.8	1%	0.01	38%	0.38	C	S	.	.	H	α-helix	trans	-62.8	-41	172.5	178	57.4	0	0	0	111.2	V33 P40 S45 D46 L47 I112 Q116	V33-L43 HydrophobicContact CG1-CB 4.3Å; V33-L43 HydrophobicContact CG1-CD2 4.34Å; V33-L43 HydrophobicContact CG2-CB 4.31Å; V33-L43 HydrophobicContact CG2-CD1 4.24Å; P40-L43 PolarHBondContact O-N 3.47Å; L43-S45 VanDerWaalsContact C-N 3.35Å; L43-D46 PolarHBondContact O-N 2.84Å; L43-L47 HydrophobicContact CD1-CD1 4.24Å; L43-L47 HydrophobicContact CD1-CG 4.11Å; L43-L47 HydrophobicContact CG-CD1 4Å; L43-L47 HydrophobicContact CG-CG 4.37Å; L43-L47 WeakPolarHBondContact O-CB 3.4Å; L43-L47 WeakPolarHBondContact O-CG 3.44Å; L43-L47 PolarHBondContact O-N 2.95Å; L43-I112 HydrophobicContact CD2-CG2 3.38Å; L43-I112 HydrophobicContact CG-CG2 4.11Å; L43-Q116 HydrophobicContact CD2-CG 4.15Å
44	V	58.4	Low	53.8	Low	25 Å²	25	64.7 Å²	64.7	15%	0.152	38%	0.379	C	S	.	.	H	α-helix	trans	-61.4	-44.3	172.2	175.1	0	0	0	0	111.2	P40 K42 D46 L47 L48 I108 I112	P40-V44 PolarHBondContact O-N 3.39Å; P40-V44 VanDerWaalsContact O-N 3.07Å; K42-V44 VanDerWaalsContact C-N 3.33Å; K42-V44 PolarHBondContact O-N 2.75Å; V44-D46 VanDerWaalsContact C-N 3.33Å; V44-D46 PolarHBondContact O-N 2.96Å; V44-L47 WeakPolarHBondContact O-CB 3.29Å; V44-L47 PolarHBondContact O-N 3.04Å; V44-L48 HydrophobicContact CG1-CD1 3.77Å; V44-L48 HydrophobicContact CG1-CG 4.26Å; V44-L48 WeakPolarHBondContact O-CB 3.42Å; V44-L48 WeakPolarHBondContact O-CG 3.49Å; V44-L48 PolarHBondContact O-N 3.36Å; V44-I108 HydrophobicContact CG2-CG2 4.15Å; V44-I112 HydrophobicContact CG2-CD1 3.31Å; V44-I112 HydrophobicContact CG2-CG1 3.35Å
45	S	57.1	Low	54.7	Low	33 Å²	33	61.9 Å²	61.9	23%	0.231	37%	0.365	C	S	.	.	H	α-helix	trans	-57	-46.4	173.5	159.3	0	0	0	0	111.6	A41 K42 L43 L47 L48 K49	A41-S45 WeakPolarHBondContact O-CB 3.42Å; A41-S45 PolarHBondContact O-N 3.36Å; K42-S45 CarbonylContact O-C 3.36Å; K42-S45 WeakPolarHBondContact O-CB 3.48Å; K42-S45 PolarHBondContact O-N 2.88Å; L43-S45 VanDerWaalsContact C-N 3.35Å; S45-L47 VanDerWaalsContact C-N 3.34Å; S45-L48 PolarHBondContact O-N 3.01Å; S45-K49 VanDerWaalsContact O-CB 3.23Å; S45-K49 WeakPolarHBondContact O-CB 3.36Å; S45-K49 WeakPolarHBondContact O-CG 3.44Å; S45-K49 PolarHBondContact O-N 2.87Å; S45-K49 WeakPolarHBondContact OG-CE 3.47Å; S45-K49 PolarHBondContact OG-NZ 2.9Å
46	D	62.2	Low	56.1	Low	37 Å²	37	59.7 Å²	59.7	20%	0.198	34%	0.343	C	S	.	.	H	α-helix	trans	-68.2	-36.6	-179	-63.1	-11.3	0	0	0	110.6	K42 L43 V44 L48 K49 D50	K42-D46 WeakPolarHBondContact O-CB 3.49Å; K42-D46 PolarHBondContact O-N 3.49Å; L43-D46 PolarHBondContact O-N 2.84Å; V44-D46 VanDerWaalsContact C-N 3.33Å; V44-D46 PolarHBondContact O-N 2.96Å; D46-L48 VanDerWaalsContact C-N 3.33Å; D46-L48 PolarHBondContact O-N 3.26Å; D46-K49 PolarHBondContact O-N 3.5Å; D46-D50 VanDerWaalsContact O-CB 3.27Å; D46-D50 WeakPolarHBondContact O-CB 3.41Å; D46-D50 PolarHBondContact O-N 3.44Å
47	L	61.4	Low	58.1	Low	2 Å²	2	56.7 Å²	56.7	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-63	-39.2	172.2	-74.7	169.3	0	0	0	113	W26 L43 V44 S45 I52 L115 L134	W26-L47 HydrophobicContact CH2-CD1 4.15Å; W26-L47 HydrophobicContact CH2-CD2 3.21Å; W26-L47 HydrophobicContact CH2-CG 4.14Å; W26-L47 HydrophobicContact CZ2-CD2 2.96Å; W26-L47 HydrophobicContact CZ2-CG 4.27Å; W26-L47 HydrophobicContact CZ3-CD2 4.5Å; L43-L47 HydrophobicContact CD1-CD1 4.24Å; L43-L47 HydrophobicContact CD1-CG 4.11Å; L43-L47 HydrophobicContact CG-CD1 4Å; L43-L47 HydrophobicContact CG-CG 4.37Å; L43-L47 WeakPolarHBondContact O-CB 3.4Å; L43-L47 WeakPolarHBondContact O-CG 3.44Å; L43-L47 PolarHBondContact O-N 2.95Å; V44-L47 WeakPolarHBondContact O-CB 3.29Å; V44-L47 PolarHBondContact O-N 3.04Å; S45-L47 VanDerWaalsContact C-N 3.34Å; L47-I52 HydrophobicContact CD2-CD1 4.19Å; L47-L115 HydrophobicContact CD1-CD2 3.95Å; L47-L134 HydrophobicContact CB-CD1 3.73Å; L47-L134 HydrophobicContact CD1-CD1 4.13Å; L47-L134 HydrophobicContact CG-CD1 4.48Å
48	L	58.8	Low	60.4	Low	58 Å²	58	57.8 Å²	57.8	30%	0.304	31%	0.312	S	S	.	.	H	α-helix	trans	-74.2	-39.9	178.6	-74.3	171.7	0	0	0	111.8	V44 S45 D46 L134	V44-L48 HydrophobicContact CG1-CD1 3.77Å; V44-L48 HydrophobicContact CG1-CG 4.26Å; V44-L48 WeakPolarHBondContact O-CB 3.42Å; V44-L48 WeakPolarHBondContact O-CG 3.49Å; V44-L48 PolarHBondContact O-N 3.36Å; S45-L48 PolarHBondContact O-N 3.01Å; D46-L48 VanDerWaalsContact C-N 3.33Å; D46-L48 PolarHBondContact O-N 3.26Å; L48-L134 HydrophobicContact CD2-CB 3.6Å; L48-L134 HydrophobicContact CG-CB 4.28Å
49	K	57.5	Low	62.7	Low	156 Å²	156	60 Å²	60	68%	0.678	32%	0.317	S	S	*	.	H	α-helix	trans	-83.2	-41.5	-173.3	-75.1	177.5	-177.8	172.2	0	114.2	S45 D46 D51	S45-K49 VanDerWaalsContact O-CB 3.23Å; S45-K49 WeakPolarHBondContact O-CB 3.36Å; S45-K49 WeakPolarHBondContact O-CG 3.44Å; S45-K49 PolarHBondContact O-N 2.87Å; S45-K49 WeakPolarHBondContact OG-CE 3.47Å; S45-K49 PolarHBondContact OG-NZ 2.9Å; D46-K49 PolarHBondContact O-N 3.5Å; K49-D51 VanDerWaalsContact C-N 3.31Å; K49-D51 PolarHBondContact O-N 3.3Å
50	D	54.5	Low	64.7	Low	88 Å²	88	53 Å²	53	47%	0.471	29%	0.286	S	S	.	.	S	Bend	trans	-92.1	10	-167.6	-66.4	-20.4	0	0	0	113.2	K29 D46 I52	K29-D50 IonicContact NZ-OD2 2.8Å; K29-D50 PolarHBondContact NZ-OD2 3.27Å; D46-D50 VanDerWaalsContact O-CB 3.27Å; D46-D50 WeakPolarHBondContact O-CB 3.41Å; D46-D50 PolarHBondContact O-N 3.44Å; D50-I52 HydrophobicContact CB-CD1 4.05Å; D50-I52 HydrophobicContact CB-CG1 3.46Å; D50-I52 VanDerWaalsContact CB-CG1 3.46Å; D50-I52 PolarHBondContact O-N 2.75Å
51	D	53.2	Low	66.8	Low	123 Å²	123	57 Å²	57	66%	0.658	30%	0.297	S	S	*	.			trans	43.1	40.1	-175.1	-104.2	-18.8	0	0	0	112.1	K49 S53 R59	K49-D51 VanDerWaalsContact C-N 3.31Å; K49-D51 PolarHBondContact O-N 3.3Å; D51-S53 PolarHBondContact O-N 2.79Å; D51-R59 IonicContact OD1-CZ 3.82Å; D51-R59 IonicContact OD1-NH1 2.81Å; D51-R59 PolarHBondContact OD1-NH1 2.77Å
52	I	53.9	Low	68.8	Low	11 Å²	11	55.8 Å²	55.8	6%	0.056	28%	0.279	C	S	.	.			trans	-70.6	101.9	-173	-36.9	171.2	0	0	0	107.4	F25 W26 K29 L47 D50 L54 Y132	F25-I52 HydrophobicContact CD1-CG2 4.18Å; F25-I52 HydrophobicContact CE1-CG2 4.06Å; W26-I52 VanDerWaalsContact CD1-CG2 3.43Å; W26-I52 HydrophobicContact CG-CG2 4.38Å; K29-I52 HydrophobicContact CD-CD1 3.6Å; L47-I52 HydrophobicContact CD2-CD1 4.19Å; D50-I52 HydrophobicContact CB-CD1 4.05Å; D50-I52 HydrophobicContact CB-CG1 3.46Å; D50-I52 VanDerWaalsContact CB-CG1 3.46Å; D50-I52 PolarHBondContact O-N 2.75Å; I52-L54 PolarHBondContact O-N 2.61Å; I52-L54 VanDerWaalsContact O-N 3.09Å; I52-Y132 PolarHBondContact O-OH 3.22Å
53	S	62.3	Low	70.7	Confident	81 Å²	81	55.4 Å²	55.4	57%	0.566	28%	0.279	S	S	*	.			trans	-62.4	115	171.5	59.6	0	0	0	0	107.9	D51	D51-S53 PolarHBondContact O-N 2.79Å
54	L	69.3	Low	72.5	Confident	8 Å²	8	58 Å²	58	4%	0.042	29%	0.291	C	S	.	.			trans	-62.8	132.5	165.6	-81.1	172.1	0	0	0	108	W26 I52 E56 A57 L115 S119 Y132	W26-L54 HydrophobicContact CD2-CD2 3.59Å; W26-L54 HydrophobicContact CE3-CD2 3.98Å; W26-L54 HydrophobicContact CG-CD2 4.2Å; W26-L54 HydrophobicContact CH2-CD2 3.5Å; W26-L54 HydrophobicContact CH2-CG 4.24Å; W26-L54 HydrophobicContact CZ2-CD1 4.16Å; W26-L54 HydrophobicContact CZ2-CD2 3Å; W26-L54 HydrophobicContact CZ2-CG 3.49Å; W26-L54 VanDerWaalsContact CZ2-CG 3.49Å; W26-L54 HydrophobicContact CZ3-CD2 3.97Å; I52-L54 PolarHBondContact O-N 2.61Å; I52-L54 VanDerWaalsContact O-N 3.09Å; L54-E56 PolarHBondContact O-N 2.8Å; L54-A57 HydrophobicContact CB-CB 4.05Å; L54-A57 HydrophobicContact CD1-CB 4.16Å; L54-L115 HydrophobicContact CD1-CD1 3.31Å; L54-L115 HydrophobicContact CD1-CD2 3.8Å; L54-L115 HydrophobicContact CD1-CG 3.45Å; L54-L115 VanDerWaalsContact CD1-CG 3.45Å; L54-S119 VanDerWaalsContact CD2-CB 3.44Å; L54-S119 WeakPolarHBondContact CD2-OG 3.01Å; L54-Y132 HydrophobicContact CB-CE1 4.11Å; L54-Y132 HydrophobicContact CD1-CD1 3.89Å; L54-Y132 HydrophobicContact CD1-CE1 3.54Å; L54-Y132 HydrophobicContact CD1-CE2 4.28Å; L54-Y132 HydrophobicContact CD1-CG 4.43Å; L54-Y132 HydrophobicContact CG-CE1 4.15Å
55	P	66.5	Low	74.2	Confident	22 Å²	22	56.8 Å²	56.8	14%	0.143	28%	0.284	C	S	.	.	S	Bend	trans	-56.8	-25.9	-174.5	-22.1	30.5	0	0	0	112.7	A22 K23	A22-P55 HydrophobicContact CB-CB 4.43Å; A22-P55 HydrophobicContact CB-CG 4.09Å; K23-P55 HydrophobicContact CB-CG 4.02Å
56	E	74.5	Confident	76.1	Confident	57 Å²	57	56.5 Å²	56.5	27%	0.266	28%	0.28	S	S	.	.	S	Bend	trans	-134.2	2.2	-163.6	-73.3	-43.8	169.4	0	0	114.9	L54 R122	L54-E56 PolarHBondContact O-N 2.8Å; E56-R122 VanDerWaalsContact CB-CZ 3.44Å; E56-R122 VanDerWaalsContact CG-NH1 3.33Å; E56-R122 PolarHBondContact O-NH2 3.02Å; E56-R122 IonicContact OE1-NH1 2.59Å; E56-R122 IonicContact OE2-CZ 3.9Å; E56-R122 IonicContact OE2-NH1 3.2Å; E56-R122 PolarHBondContact OE2-NH1 3.26Å; E56-R122 IonicContact OE2-NH2 2.75Å; E56-R122 PolarHBondContact OE2-NH2 3.24Å
57	A	85.6	Confident	77.7	Confident	6 Å²	6	61 Å²	61	5%	0.05	30%	0.304	C	S	.	.			trans	-132.4	133.3	176.3	0	0	0	0	0	109.5	L54 L129 Y132	L54-A57 HydrophobicContact CB-CB 4.05Å; L54-A57 HydrophobicContact CD1-CB 4.16Å; A57-L129 HydrophobicContact CB-CD2 3.98Å; A57-L129 HydrophobicContact CB-CG 4.31Å; A57-Y132 HydrophobicContact CB-CD1 3.81Å; A57-Y132 HydrophobicContact CB-CE1 4.14Å; A57-Y132 WeakPolarHBondContact O-CE1 3.43Å
58	I	89.1	Confident	79.4	Confident	87 Å²	87	61.4 Å²	61.4	45%	0.446	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	129.6	-177.8	-64.7	165.4	0	0	0	109.3	A60 W91 Y130 G131 Y132	I58-A60 PolarHBondContact O-N 2.84Å; I58-W91 HydrophobicContact CB-CH2 3.81Å; I58-W91 HydrophobicContact CD1-CH2 4.45Å; I58-W91 HydrophobicContact CG2-CH2 3.73Å; I58-W91 HydrophobicContact CG2-CZ2 4.1Å; I58-Y130 PolarHBondContact N-O 3.38Å; I58-G131 CarbonylContact O-C 3.53Å; I58-G131 WeakPolarHBondContact O-CA 3.14Å; I58-Y132 PolarHBondContact O-N 3.35Å
59	R	89.7	Confident	81.3	Confident	90 Å²	90	58.6 Å²	58.6	34%	0.34	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	121.5	170.2	-170.4	177.2	-177.2	169.2	7.5	109	D51 Y132	D51-R59 IonicContact OD1-CZ 3.82Å; D51-R59 IonicContact OD1-NH1 2.81Å; D51-R59 PolarHBondContact OD1-NH1 2.77Å; R59-Y132 WeakPolarHBondContact CA-O 3.31Å; R59-Y132 HydrophobicContact CB-CE1 4.08Å; R59-Y132 HydrophobicContact CB-CE2 4.35Å; R59-Y132 HydrophobicContact CG-CE2 4.24Å
60	A	91.9	Very high	83.1	Confident	3 Å²	3	56.5 Å²	56.5	3%	0.025	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-102.3	150.9	174	0	0	0	0	0	110.3	I58 I65 W91 Y132 I142	I58-A60 PolarHBondContact O-N 2.84Å; A60-I65 HydrophobicContact CB-CD1 3.83Å; A60-I65 HydrophobicContact CB-CG1 4.38Å; A60-W91 HydrophobicContact CB-CZ2 3.72Å; A60-Y132 PolarHBondContact N-O 3.35Å; A60-I142 HydrophobicContact CB-CD1 3.78Å
61	K	92.3	Very high	85.1	Confident	133 Å²	133	57.7 Å²	57.7	58%	0.578	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-84.3	155.5	168.5	-62.8	-176.6	179.2	-178.9	0	111.3	E63 E64 I65 E135	K61-E63 VanDerWaalsContact C-N 3.28Å; K61-E63 PolarHBondContact O-N 3.47Å; K61-E64 HydrophobicContact CB-CG 4.34Å; K61-E64 PolarHBondContact N-OE2 3.32Å; K61-E64 WeakPolarHBondContact O-CB 3.44Å; K61-E64 PolarHBondContact O-N 3.23Å; K61-I65 PolarHBondContact O-N 2.94Å; K61-E135 WeakPolarHBondContact CA-OE1 3.44Å
62	Y	93.2	Very high	87.1	Confident	43 Å²	43	52.6 Å²	52.6	17%	0.169	27%	0.268	C	S	.	.	H	α-helix	trans	-56.6	-41.6	177.3	174.6	-102.7	0	0	0	112.4	E64 I65 V66 F72 E135 R137 A138	Y62-E64 VanDerWaalsContact C-N 3.3Å; Y62-E64 PolarHBondContact O-N 2.89Å; Y62-I65 WeakPolarHBondContact O-CB 3.32Å; Y62-I65 PolarHBondContact O-N 3.39Å; Y62-V66 HydrophobicContact CD1-CG2 3.95Å; Y62-V66 HydrophobicContact CD2-CG2 4.35Å; Y62-V66 HydrophobicContact CE1-CG2 3.4Å; Y62-V66 HydrophobicContact CE2-CG2 3.84Å; Y62-V66 HydrophobicContact CG-CG2 4.39Å; Y62-V66 WeakPolarHBondContact O-CG2 3.12Å; Y62-V66 PolarHBondContact O-N 3.4Å; Y62-F72 HydrophobicContact CE2-CE2 4.01Å; Y62-F72 HydrophobicContact CE2-CZ 4.27Å; Y62-E135 VanDerWaalsContact CB-CD 3.46Å; Y62-E135 WeakPolarHBondContact CB-OE2 3.5Å; Y62-E135 PolarHBondContact N-OE1 3.4Å; Y62-R137 HydrophobicContact CD2-CB 4.29Å; Y62-R137 HydrophobicContact CE2-CB 4.11Å; Y62-A138 HydrophobicContact CD2-CB 3.88Å; Y62-A138 HydrophobicContact CE2-CB 3.54Å
63	E	94.8	Very high	89.1	Confident	98 Å²	98	53.2 Å²	53.2	46%	0.458	27%	0.273	S	S	.	.	H	α-helix	trans	-60.4	-39.7	179.2	-62.9	75	-157.1	0	0	111.7	K61 I65 V66 D67	K61-E63 VanDerWaalsContact C-N 3.28Å; K61-E63 PolarHBondContact O-N 3.47Å; E63-I65 VanDerWaalsContact C-N 3.25Å; E63-I65 PolarHBondContact O-N 3.08Å; E63-V66 PolarHBondContact O-N 2.86Å; E63-D67 PolarHBondContact O-N 3.32Å
64	E	95.4	Very high	90.7	Very high	57 Å²	57	54.7 Å²	54.7	27%	0.266	28%	0.28	S	S	.	.	H	α-helix	trans	-62.6	-34.1	175.9	-64.5	177.2	75.8	0	0	112	K61 Y62 A68 W91 K92	K61-E64 HydrophobicContact CB-CG 4.34Å; K61-E64 PolarHBondContact N-OE2 3.32Å; K61-E64 WeakPolarHBondContact O-CB 3.44Å; K61-E64 PolarHBondContact O-N 3.23Å; Y62-E64 VanDerWaalsContact C-N 3.3Å; Y62-E64 PolarHBondContact O-N 2.89Å; E64-A68 WeakPolarHBondContact O-CB 3.21Å; E64-A68 PolarHBondContact O-N 3Å; E64-W91 PolarHBondContact OE1-NE1 3.12Å; E64-K92 VanDerWaalsContact OE1-CE 3.32Å; E64-K92 WeakPolarHBondContact OE1-CE 3.35Å
65	I	96.1	Very high	92	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-75.1	-40.5	178.7	-56	-54.1	0	0	0	111.2	A60 K61 Y62 E63 A68 T69 F72 V98 C133 C140 I142	A60-I65 HydrophobicContact CB-CD1 3.83Å; A60-I65 HydrophobicContact CB-CG1 4.38Å; K61-I65 PolarHBondContact O-N 2.94Å; Y62-I65 WeakPolarHBondContact O-CB 3.32Å; Y62-I65 PolarHBondContact O-N 3.39Å; E63-I65 VanDerWaalsContact C-N 3.25Å; E63-I65 PolarHBondContact O-N 3.08Å; I65-A68 PolarHBondContact O-N 2.91Å; I65-T69 HydrophobicContact CG2-CG2 4.31Å; I65-T69 WeakPolarHBondContact O-CB 3.35Å; I65-T69 WeakPolarHBondContact O-CG2 3.34Å; I65-T69 PolarHBondContact O-N 2.86Å; I65-T69 PolarHBondContact O-OG1 3.04Å; I65-F72 HydrophobicContact CG2-CE1 3.83Å; I65-F72 HydrophobicContact CG2-CZ 3.79Å; I65-V98 HydrophobicContact CG2-CG1 3.72Å; I65-C133 HydrophobicContact CD1-CB 4.47Å; I65-C133 HydrophobicContact CG1-CB 3.88Å; I65-C140 HydrophobicContact CG2-CB 4.4Å; I65-I142 HydrophobicContact CD1-CD1 3.46Å; I65-I142 VanDerWaalsContact CD1-CD1 3.46Å; I65-I142 HydrophobicContact CD1-CG1 3.89Å
66	V	96	Very high	93.4	Very high	26 Å²	26	60 Å²	60	16%	0.158	32%	0.315	C	S	.	.	H	α-helix	trans	-58.5	-50.8	174.3	169.9	0	0	0	0	109.5	Y62 E63 A68 T69 D70 N71 F72	Y62-V66 HydrophobicContact CD1-CG2 3.95Å; Y62-V66 HydrophobicContact CD2-CG2 4.35Å; Y62-V66 HydrophobicContact CE1-CG2 3.4Å; Y62-V66 HydrophobicContact CE2-CG2 3.84Å; Y62-V66 HydrophobicContact CG-CG2 4.39Å; Y62-V66 WeakPolarHBondContact O-CG2 3.12Å; Y62-V66 PolarHBondContact O-N 3.4Å; E63-V66 PolarHBondContact O-N 2.86Å; V66-A68 PolarHBondContact O-N 2.75Å; V66-T69 PolarHBondContact O-N 3.28Å; V66-T69 PolarHBondContact O-OG1 2.75Å; V66-D70 PolarHBondContact O-N 2.95Å; V66-N71 HydrophobicContact CG1-CB 4.19Å; V66-N71 PolarHBondContact O-N 2.82Å; V66-F72 HydrophobicContact CG2-CE2 3.94Å
67	D	96.9	Very high	94.5	Very high	132 Å²	132	60.1 Å²	60.1	71%	0.706	32%	0.32	S	S	*	.	H	α-helix	trans	-62.2	-44.6	178.3	-69.3	-12.4	0	0	0	111.2	E63 T69 D70	E63-D67 PolarHBondContact O-N 3.32Å; D67-T69 VanDerWaalsContact C-N 3.26Å; D67-T69 PolarHBondContact O-N 3.08Å; D67-D70 PolarHBondContact O-N 2.9Å
68	A	97	Very high	94.9	Very high	10 Å²	10	64 Å²	64	8%	0.083	34%	0.339	C	S	.	.	H	α-helix	trans	-63.9	-29.2	-178.6	0	0	0	0	0	113.8	E64 I65 V66 G89 R90 W91	E64-A68 WeakPolarHBondContact O-CB 3.21Å; E64-A68 PolarHBondContact O-N 3Å; I65-A68 PolarHBondContact O-N 2.91Å; V66-A68 PolarHBondContact O-N 2.75Å; A68-G89 CarbonylContact O-C 3.42Å; A68-G89 WeakPolarHBondContact O-CA 3.4Å; A68-R90 VanDerWaalsContact CA-O 3.27Å; A68-R90 WeakPolarHBondContact CA-O 3.44Å; A68-R90 VanDerWaalsContact CB-O 3.25Å; A68-R90 WeakPolarHBondContact CB-O 3.39Å; A68-R90 PolarHBondContact O-N 3.19Å; A68-W91 HydrophobicContact CB-CB 3.87Å; A68-W91 HydrophobicContact CB-CG 4.48Å
69	T	96.7	Very high	94.9	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	4.6	-175.4	58.9	0	0	0	0	113.7	I65 V66 D67 F72 S73 N76 V98	I65-T69 HydrophobicContact CG2-CG2 4.31Å; I65-T69 WeakPolarHBondContact O-CB 3.35Å; I65-T69 WeakPolarHBondContact O-CG2 3.34Å; I65-T69 PolarHBondContact O-N 2.86Å; I65-T69 PolarHBondContact O-OG1 3.04Å; V66-T69 PolarHBondContact O-N 3.28Å; V66-T69 PolarHBondContact O-OG1 2.75Å; D67-T69 VanDerWaalsContact C-N 3.26Å; D67-T69 PolarHBondContact O-N 3.08Å; T69-F72 HydrophobicContact CG2-CD1 4.32Å; T69-F72 HydrophobicContact CG2-CE1 4.42Å; T69-F72 PolarHBondContact O-N 3.14Å; T69-F72 PolarHBondContact OG1-N 2.78Å; T69-S73 PolarHBondContact O-N 2.82Å; T69-N76 PolarHBondContact O-ND2 3.47Å; T69-N76 VanDerWaalsContact O-ND2 3.08Å; T69-V98 HydrophobicContact CG2-CB 3.86Å; T69-V98 HydrophobicContact CG2-CG1 4.06Å; T69-V98 HydrophobicContact CG2-CG2 3.78Å
70	D	97	Very high	94.8	Very high	111 Å²	111	64.6 Å²	64.6	59%	0.594	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	55.6	-170.7	-170.8	31.5	0	0	0	110.9	V66 D67 F72 S73	V66-D70 PolarHBondContact O-N 2.95Å; D67-D70 PolarHBondContact O-N 2.9Å; D70-F72 VanDerWaalsContact C-N 3.34Å; D70-F72 PolarHBondContact O-N 3.42Å; D70-S73 VanDerWaalsContact O-CB 3.3Å; D70-S73 WeakPolarHBondContact O-CB 3.29Å; D70-S73 PolarHBondContact O-N 2.99Å; D70-S73 VanDerWaalsContact O-N 3.09Å
71	N	95.8	Very high	93.8	Very high	113 Å²	113	66.8 Å²	66.8	60%	0.604	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	45.3	-176.6	-168.9	39.5	0	0	0	113.5	V66 S73	V66-N71 HydrophobicContact CG1-CB 4.19Å; V66-N71 PolarHBondContact O-N 2.82Å; N71-S73 PolarHBondContact O-N 2.98Å
72	F	94.8	Very high	92.8	Very high	17 Å²	17	64 Å²	64	8%	0.075	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	42.2	-175.7	-54.1	-79.7	0	0	0	112.6	Y62 I65 V66 T69 D70 Y87 R100 A138	Y62-F72 HydrophobicContact CE2-CE2 4.01Å; Y62-F72 HydrophobicContact CE2-CZ 4.27Å; I65-F72 HydrophobicContact CG2-CE1 3.83Å; I65-F72 HydrophobicContact CG2-CZ 3.79Å; V66-F72 HydrophobicContact CG2-CE2 3.94Å; T69-F72 HydrophobicContact CG2-CD1 4.32Å; T69-F72 HydrophobicContact CG2-CE1 4.42Å; T69-F72 PolarHBondContact O-N 3.14Å; T69-F72 PolarHBondContact OG1-N 2.78Å; D70-F72 VanDerWaalsContact C-N 3.34Å; D70-F72 PolarHBondContact O-N 3.42Å; F72-Y87 HydrophobicContact CB-CD1 4.39Å; F72-Y87 HydrophobicContact CB-CE1 3.86Å; F72-Y87 HydrophobicContact CB-CE2 4.46Å; F72-Y87 HydrophobicContact CD1-CD2 4.02Å; F72-Y87 AromaticContact CD1-CE2 3.89Å; F72-Y87 HydrophobicContact CD1-CE2 3.89Å; F72-Y87 HydrophobicContact CD1-CG 4.46Å; F72-Y87 VanDerWaalsContact O-CE1 3.3Å; F72-Y87 WeakPolarHBondContact O-CE1 3.39Å; F72-R100 HydrophobicContact CE1-CB 4.42Å; F72-R100 HydrophobicContact CE1-CG 4.45Å; F72-A138 HydrophobicContact CE2-CB 4.49Å; F72-A138 HydrophobicContact CZ-CB 4Å
73	S	96.9	Very high	91.8	Very high	24 Å²	24	65.5 Å²	65.5	17%	0.168	39%	0.39	C	S	.	.			trans	-54.3	131.9	-177.8	176.1	0	0	0	0	111.3	T69 D70 N71 S75 N76	T69-S73 PolarHBondContact O-N 2.82Å; D70-S73 VanDerWaalsContact O-CB 3.3Å; D70-S73 WeakPolarHBondContact O-CB 3.29Å; D70-S73 PolarHBondContact O-N 2.99Å; D70-S73 VanDerWaalsContact O-N 3.09Å; N71-S73 PolarHBondContact O-N 2.98Å; S73-S75 PolarHBondContact O-N 3.26Å; S73-S75 VanDerWaalsContact O-N 3.11Å; S73-S75 PolarHBondContact OG-N 2.83Å; S73-S75 PolarHBondContact OG-OG 3.18Å; S73-N76 WeakPolarHBondContact O-CB 3.35Å; S73-N76 PolarHBondContact O-N 2.92Å
74	P	95.5	Very high	91.4	Very high	111 Å²	111	61.5 Å²	61.5	72%	0.721	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-56.4	-26.2	174.6	-26.6	35.3	0	0	0	113.7	N76 V77	P74-N76 PolarHBondContact O-N 3.07Å; P74-V77 WeakPolarHBondContact O-CG2 3.3Å; P74-V77 PolarHBondContact O-N 3.39Å
75	S	96.9	Very high	91.3	Very high	98 Å²	98	60.9 Å²	60.9	69%	0.685	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-68.1	-16.9	176.6	66.3	0	0	0	0	113.4	S73	S73-S75 PolarHBondContact O-N 3.26Å; S73-S75 VanDerWaalsContact O-N 3.11Å; S73-S75 PolarHBondContact OG-N 2.83Å; S73-S75 PolarHBondContact OG-OG 3.18Å
76	N	96.5	Very high	91.2	Very high	43 Å²	43	63 Å²	63	23%	0.23	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-97.3	1.6	179.6	-71.2	-25.5	0	0	0	112.8	T69 S73 P74 L78 Y87 K88	T69-N76 PolarHBondContact O-ND2 3.47Å; T69-N76 VanDerWaalsContact O-ND2 3.08Å; S73-N76 WeakPolarHBondContact O-CB 3.35Å; S73-N76 PolarHBondContact O-N 2.92Å; P74-N76 PolarHBondContact O-N 3.07Å; N76-L78 PolarHBondContact O-N 3.26Å; N76-Y87 HydrophobicContact CB-CD1 4.49Å; N76-Y87 CarbonylContact O-C 3.57Å; N76-Y87 VanDerWaalsContact O-CA 3.27Å; N76-Y87 WeakPolarHBondContact O-CA 3.42Å; N76-K88 WeakPolarHBondContact CB-O 3.4Å; N76-K88 PolarHBondContact O-N 3.18Å
77	V	96.7	Very high	91.3	Very high	61 Å²	61	62.4 Å²	62.4	37%	0.37	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	122.3	179.8	175.8	0	0	0	0	110.3	P74 I85 Y87	P74-V77 WeakPolarHBondContact O-CG2 3.3Å; P74-V77 PolarHBondContact O-N 3.39Å; V77-I85 HydrophobicContact CB-CG2 4.49Å; V77-I85 HydrophobicContact CG1-CG2 3.89Å; V77-I85 HydrophobicContact CG2-CG2 3.9Å; V77-Y87 HydrophobicContact CG2-CD1 3.96Å; V77-Y87 HydrophobicContact CG2-CE1 3.63Å
78	L	93.1	Very high	91.4	Very high	87 Å²	87	60.3 Å²	60.3	46%	0.455	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-30.4	173	-65.6	175.6	0	0	0	111.8	N76 V86 K88 A97 F145	N76-L78 PolarHBondContact O-N 3.26Å; L78-V86 HydrophobicContact CB-CB 4.43Å; L78-V86 HydrophobicContact CB-CG1 4.34Å; L78-V86 HydrophobicContact CD1-CG1 4.22Å; L78-V86 PolarHBondContact N-O 2.92Å; L78-K88 HydrophobicContact CD1-CB 3.99Å; L78-K88 HydrophobicContact CD2-CB 3.99Å; L78-K88 HydrophobicContact CG-CB 3.96Å; L78-A97 HydrophobicContact CD1-CB 4.15Å; L78-F145 HydrophobicContact CD1-CD2 4.01Å; L78-F145 HydrophobicContact CD1-CE2 3.77Å; L78-F145 HydrophobicContact CD2-CE2 3.99Å
79	G	89.7	Confident	91.4	Very high	31 Å²	31	60.3 Å²	60.3	32%	0.32	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.4	162.3	179.4	0	0	0	0	0	112.2	V86	G79-V86 PolarHBondContact O-N 2.89Å
80	Q	87	Confident	91.5	Very high	158 Å²	158	67.4 Å²	67.4	74%	0.738	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.9	123.7	176.8	179.3	172.9	10.4	0	0	109.1	I85	Q80-I85 HydrophobicContact CB-CG1 4.35Å; Q80-I85 HydrophobicContact CG-CG1 3.92Å
81	G	72.3	Confident	91.5	Very high	50 Å²	50	62.7 Å²	62.7	52%	0.515	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	-179.1	176	0	0	0	0	0	111.6	Y83 G84	G81-Y83 PolarHBondContact O-N 2.65Å; G81-G84 PolarHBondContact N-O 3.22Å; G81-G84 PolarHBondContact O-N 3.42Å
82	G	70.7	Confident	91.4	Very high	74 Å²	74	62.7 Å²	62.7	76%	0.763	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.5	-179.9	0	0	0	0	0	114.7
83	Y	72.3	Confident	91.4	Very high	74 Å²	74	68.7 Å²	68.7	29%	0.29	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-5.5	-171.9	-49.9	-63.8	0	0	0	114	G81 I101 S102 Q110	G81-Y83 PolarHBondContact O-N 2.65Å; Y83-I101 WeakPolarHBondContact O-CA 3.44Å; Y83-S102 PolarHBondContact O-N 3.28Å; Y83-Q110 VanDerWaalsContact CE2-OE1 3.24Å; Y83-Q110 PolarHBondContact OH-NE2 3.22Å
84	G	85.5	Confident	91.3	Very high	14 Å²	14	70.6 Å²	70.6	14%	0.144	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.2	-179.1	-174.3	0	0	0	0	0	115.3	G81 R100	G81-G84 PolarHBondContact N-O 3.22Å; G81-G84 PolarHBondContact O-N 3.42Å; G84-R100 CarbonylContact C-O 3.55Å; G84-R100 WeakPolarHBondContact CA-O 3.17Å
85	I	93.4	Very high	91.4	Very high	45 Å²	45	67.6 Å²	67.6	23%	0.231	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.7	174.7	-57.2	168.5	0	0	0	107.6	V77 Q80 Y87 R100	V77-I85 HydrophobicContact CB-CG2 4.49Å; V77-I85 HydrophobicContact CG1-CG2 3.89Å; V77-I85 HydrophobicContact CG2-CG2 3.9Å; Q80-I85 HydrophobicContact CB-CG1 4.35Å; Q80-I85 HydrophobicContact CG-CG1 3.92Å; I85-Y87 HydrophobicContact CB-CD2 4.46Å; I85-Y87 HydrophobicContact CB-CE2 3.6Å; I85-Y87 HydrophobicContact CG2-CD2 4.1Å; I85-Y87 HydrophobicContact CG2-CE1 4.06Å; I85-Y87 HydrophobicContact CG2-CE2 3.45Å; I85-Y87 VanDerWaalsContact CG2-CE2 3.45Å; I85-Y87 VanDerWaalsContact CG2-CZ 3.42Å; I85-R100 PolarHBondContact N-O 3.11Å; I85-R100 PolarHBondContact O-N 3.33Å
86	V	95.7	Very high	91.5	Very high	43 Å²	43	62.9 Å²	62.9	26%	0.261	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	127.1	176.9	-171.4	0	0	0	0	108.9	L78 G79 A97 V98 K99	L78-V86 HydrophobicContact CB-CB 4.43Å; L78-V86 HydrophobicContact CB-CG1 4.34Å; L78-V86 HydrophobicContact CD1-CG1 4.22Å; L78-V86 PolarHBondContact N-O 2.92Å; G79-V86 PolarHBondContact O-N 2.89Å; V86-A97 HydrophobicContact CG1-CB 4Å; V86-V98 CarbonylContact C-O 3.52Å; V86-V98 WeakPolarHBondContact CA-O 3.32Å; V86-K99 HydrophobicContact CG2-CB 4.16Å; V86-K99 HydrophobicContact CG2-CG 4.04Å
87	Y	97.6	Very high	91.5	Very high	15 Å²	15	61.4 Å²	61.4	6%	0.059	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	141.2	178.9	-59.1	-97.9	0	0	0	110.2	F72 N76 V77 I85 A97 V98 R100	F72-Y87 HydrophobicContact CB-CD1 4.39Å; F72-Y87 HydrophobicContact CB-CE1 3.86Å; F72-Y87 HydrophobicContact CB-CE2 4.46Å; F72-Y87 HydrophobicContact CD1-CD2 4.02Å; F72-Y87 AromaticContact CD1-CE2 3.89Å; F72-Y87 HydrophobicContact CD1-CE2 3.89Å; F72-Y87 HydrophobicContact CD1-CG 4.46Å; F72-Y87 VanDerWaalsContact O-CE1 3.3Å; F72-Y87 WeakPolarHBondContact O-CE1 3.39Å; N76-Y87 HydrophobicContact CB-CD1 4.49Å; N76-Y87 CarbonylContact O-C 3.57Å; N76-Y87 VanDerWaalsContact O-CA 3.27Å; N76-Y87 WeakPolarHBondContact O-CA 3.42Å; V77-Y87 HydrophobicContact CG2-CD1 3.96Å; V77-Y87 HydrophobicContact CG2-CE1 3.63Å; I85-Y87 HydrophobicContact CB-CD2 4.46Å; I85-Y87 HydrophobicContact CB-CE2 3.6Å; I85-Y87 HydrophobicContact CG2-CD2 4.1Å; I85-Y87 HydrophobicContact CG2-CE1 4.06Å; I85-Y87 HydrophobicContact CG2-CE2 3.45Å; I85-Y87 VanDerWaalsContact CG2-CE2 3.45Å; I85-Y87 VanDerWaalsContact CG2-CZ 3.42Å; Y87-A97 CarbonylContact O-C 3.56Å; Y87-A97 WeakPolarHBondContact O-CA 3.45Å; Y87-V98 PolarHBondContact N-O 2.82Å; Y87-V98 PolarHBondContact O-N 2.94Å; Y87-R100 HydrophobicContact CD2-CB 4.46Å; Y87-R100 HydrophobicContact CE2-CB 4.03Å
88	K	98	Very high	91.6	Very high	88 Å²	88	58.5 Å²	58.5	38%	0.383	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	139.6	161.4	-169.3	175.6	-179.4	178.6	0	108.5	N76 L78 V95 F145	N76-K88 WeakPolarHBondContact CB-O 3.4Å; N76-K88 PolarHBondContact O-N 3.18Å; L78-K88 HydrophobicContact CD1-CB 3.99Å; L78-K88 HydrophobicContact CD2-CB 3.99Å; L78-K88 HydrophobicContact CG-CB 3.96Å; K88-V95 HydrophobicContact CG-CG1 4.37Å; K88-F145 HydrophobicContact CD-CE2 4.08Å; K88-F145 HydrophobicContact CD-CZ 4.18Å; K88-F145 HydrophobicContact CG-CD2 4.28Å; K88-F145 HydrophobicContact CG-CE2 4.1Å
89	G	97.6	Very high	91.7	Very high	10 Å²	10	55.5 Å²	55.5	10%	0.103	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	177.2	176	0	0	0	0	0	113.2	A68 V95 V96	A68-G89 CarbonylContact O-C 3.42Å; A68-G89 WeakPolarHBondContact O-CA 3.4Å; G89-V95 WeakPolarHBondContact O-CA 3.43Å; G89-V96 PolarHBondContact N-O 2.9Å; G89-V96 PolarHBondContact O-N 3.35Å
90	R	98	Very high	91.9	Very high	148 Å²	148	57.9 Å²	57.9	56%	0.558	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	110.1	168.9	-177.4	176.6	-69.7	-87.3	2.2	109.2	A68 D93 T94	A68-R90 VanDerWaalsContact CA-O 3.27Å; A68-R90 WeakPolarHBondContact CA-O 3.44Å; A68-R90 VanDerWaalsContact CB-O 3.25Å; A68-R90 WeakPolarHBondContact CB-O 3.39Å; A68-R90 PolarHBondContact O-N 3.19Å; R90-D93 PolarHBondContact NH1-O 3.36Å; R90-T94 CarbonylContact C-O 3.52Å; R90-T94 VanDerWaalsContact CA-O 3.29Å; R90-T94 WeakPolarHBondContact CA-O 3.35Å
91	W	97	Very high	92	Very high	13 Å²	13	50.6 Å²	50.6	5%	0.049	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125.8	-179.6	-178.9	66	0	0	0	109.6	I58 A60 E64 A68 D93 T94 V96 I142	I58-W91 HydrophobicContact CB-CH2 3.81Å; I58-W91 HydrophobicContact CD1-CH2 4.45Å; I58-W91 HydrophobicContact CG2-CH2 3.73Å; I58-W91 HydrophobicContact CG2-CZ2 4.1Å; A60-W91 HydrophobicContact CB-CZ2 3.72Å; E64-W91 PolarHBondContact OE1-NE1 3.12Å; A68-W91 HydrophobicContact CB-CB 3.87Å; A68-W91 HydrophobicContact CB-CG 4.48Å; W91-D93 VanDerWaalsContact C-N 3.32Å; W91-D93 PolarHBondContact O-N 2.83Å; W91-T94 PolarHBondContact N-O 2.97Å; W91-T94 WeakPolarHBondContact O-CB 3.35Å; W91-T94 PolarHBondContact O-N 3.18Å; W91-V96 HydrophobicContact CB-CG1 4.36Å; W91-V96 HydrophobicContact CB-CG2 3.84Å; W91-I142 HydrophobicContact CD2-CD1 3.91Å; W91-I142 HydrophobicContact CE3-CD1 3.95Å; W91-I142 HydrophobicContact CE3-CG2 3.97Å; W91-I142 HydrophobicContact CH2-CD1 3.98Å; W91-I142 HydrophobicContact CZ2-CD1 4.01Å; W91-I142 HydrophobicContact CZ3-CD1 3.98Å; W91-I142 HydrophobicContact CZ3-CG2 4.44Å
92	K	95	Very high	92.6	Very high	113 Å²	113	50 Å²	50	49%	0.491	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	53.7	-175.6	-59.3	-176.6	177.5	-174.6	0	111.9	E64 T94	E64-K92 VanDerWaalsContact OE1-CE 3.32Å; E64-K92 WeakPolarHBondContact OE1-CE 3.35Å; K92-T94 PolarHBondContact O-N 3.38Å; K92-T94 PolarHBondContact O-OG1 3.44Å
93	D	94	Very high	93.1	Very high	142 Å²	142	52 Å²	52	76%	0.759	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	4.5	-177.6	-59.6	-52.4	0	0	0	116.6	R90 W91	R90-D93 PolarHBondContact NH1-O 3.36Å; W91-D93 VanDerWaalsContact C-N 3.32Å; W91-D93 PolarHBondContact O-N 2.83Å
94	T	95.9	Very high	93.5	Very high	64 Å²	64	51 Å²	51	39%	0.393	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	137.3	-178.3	-56.2	0	0	0	0	110.6	R90 W91 K92 V96 Y130	R90-T94 CarbonylContact C-O 3.52Å; R90-T94 VanDerWaalsContact CA-O 3.29Å; R90-T94 WeakPolarHBondContact CA-O 3.35Å; W91-T94 PolarHBondContact N-O 2.97Å; W91-T94 WeakPolarHBondContact O-CB 3.35Å; W91-T94 PolarHBondContact O-N 3.18Å; K92-T94 PolarHBondContact O-N 3.38Å; K92-T94 PolarHBondContact O-OG1 3.44Å; T94-V96 HydrophobicContact CG2-CG1 4.24Å; T94-Y130 HydrophobicContact CG2-CE2 3.94Å
95	V	97.5	Very high	93.2	Very high	48 Å²	48	59.4 Å²	59.4	29%	0.291	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	126.9	172.1	-176.2	0	0	0	0	108.9	K88 G89 F145	K88-V95 HydrophobicContact CG-CG1 4.37Å; G89-V95 WeakPolarHBondContact O-CA 3.43Å; V95-F145 HydrophobicContact CB-CB 4.43Å; V95-F145 HydrophobicContact CG1-CB 3.87Å; V95-F145 HydrophobicContact CG1-CD1 3.8Å; V95-F145 HydrophobicContact CG1-CD2 4.45Å; V95-F145 HydrophobicContact CG1-CE1 4.49Å; V95-F145 HydrophobicContact CG1-CG 3.77Å; V95-F145 WeakPolarHBondContact O-CB 3.27Å
96	V	97.9	Very high	92.6	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	162.1	-171.8	-63.9	0	0	0	0	112.1	G89 W91 T94 V98 Y130 I142 Y143	G89-V96 PolarHBondContact N-O 2.9Å; G89-V96 PolarHBondContact O-N 3.35Å; W91-V96 HydrophobicContact CB-CG1 4.36Å; W91-V96 HydrophobicContact CB-CG2 3.84Å; T94-V96 HydrophobicContact CG2-CG1 4.24Å; V96-V98 HydrophobicContact CG2-CG2 3.96Å; V96-Y130 HydrophobicContact CG1-CD2 3.78Å; V96-Y130 HydrophobicContact CG1-CE2 4.16Å; V96-I142 HydrophobicContact CB-CG2 3.72Å; V96-I142 HydrophobicContact CG1-CG2 3.85Å; V96-I142 HydrophobicContact CG2-CG2 3.9Å; V96-Y143 WeakPolarHBondContact CA-O 3.26Å; V96-Y143 WeakPolarHBondContact CB-O 3.21Å
97	A	97.7	Very high	92	Very high	11 Å²	11	60.7 Å²	60.7	9%	0.091	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.4	164.7	0	0	0	0	0	109.5	L78 V86 Y87 Y143	L78-A97 HydrophobicContact CD1-CB 4.15Å; V86-A97 HydrophobicContact CG1-CB 4Å; Y87-A97 CarbonylContact O-C 3.56Å; Y87-A97 WeakPolarHBondContact O-CA 3.45Å; A97-Y143 PolarHBondContact N-O 3.36Å; A97-Y143 PolarHBondContact O-N 2.6Å
98	V	97	Very high	91.3	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	105.9	-179.2	-178.6	0	0	0	0	109.1	I65 T69 V86 Y87 V96 R100 C140 L141	I65-V98 HydrophobicContact CG2-CG1 3.72Å; T69-V98 HydrophobicContact CG2-CB 3.86Å; T69-V98 HydrophobicContact CG2-CG1 4.06Å; T69-V98 HydrophobicContact CG2-CG2 3.78Å; V86-V98 CarbonylContact C-O 3.52Å; V86-V98 WeakPolarHBondContact CA-O 3.32Å; Y87-V98 PolarHBondContact N-O 2.82Å; Y87-V98 PolarHBondContact O-N 2.94Å; V96-V98 HydrophobicContact CG2-CG2 3.96Å; V98-R100 PolarHBondContact O-N 3.47Å; V98-C140 HydrophobicContact CG1-CB 3.91Å; V98-L141 CarbonylContact C-O 3.47Å; V98-L141 WeakPolarHBondContact CA-O 3.37Å
99	K	95.1	Very high	90.5	Very high	24 Å²	24	60.1 Å²	60.1	10%	0.104	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	102.1	174.1	-172.8	-179.2	-175.2	179.8	0	108.5	V86 I101 E114 C140 L141 Y143 D212	V86-K99 HydrophobicContact CG2-CB 4.16Å; V86-K99 HydrophobicContact CG2-CG 4.04Å; K99-I101 HydrophobicContact CD-CD1 3.9Å; K99-I101 HydrophobicContact CG-CD1 3.78Å; K99-E114 IonicContact NZ-OE1 2.61Å; K99-E114 PolarHBondContact NZ-OE1 3.26Å; K99-E114 IonicContact NZ-OE2 2.75Å; K99-C140 VanDerWaalsContact O-CA 3.27Å; K99-C140 WeakPolarHBondContact O-CA 3.26Å; K99-L141 HydrophobicContact CB-CB 4.49Å; K99-L141 PolarHBondContact N-O 2.83Å; K99-L141 PolarHBondContact O-N 3.14Å; K99-Y143 HydrophobicContact CB-CD2 4.45Å; K99-Y143 HydrophobicContact CB-CE2 3.81Å; K99-Y143 HydrophobicContact CD-CE2 4.24Å; K99-D212 IonicContact NZ-OD1 3.06Å; K99-D212 PolarHBondContact NZ-OD1 2.95Å
100	R	94.2	Very high	89.9	Confident	81 Å²	81	60.2 Å²	60.2	31%	0.306	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	120.5	172.1	-176.7	178.8	179.6	-172.4	2.6	109.3	F72 G84 I85 Y87 V98 A138	F72-R100 HydrophobicContact CE1-CB 4.42Å; F72-R100 HydrophobicContact CE1-CG 4.45Å; G84-R100 CarbonylContact C-O 3.55Å; G84-R100 WeakPolarHBondContact CA-O 3.17Å; I85-R100 PolarHBondContact N-O 3.11Å; I85-R100 PolarHBondContact O-N 3.33Å; Y87-R100 HydrophobicContact CD2-CB 4.46Å; Y87-R100 HydrophobicContact CE2-CB 4.03Å; V98-R100 PolarHBondContact O-N 3.47Å; R100-A138 HydrophobicContact CG-CB 4.38Å
101	I	90.3	Very high	89.4	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.026	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	142.4	-173.1	-53.9	-66.2	0	0	0	110.8	Y83 K99 G107 L111 P139	Y83-I101 WeakPolarHBondContact O-CA 3.44Å; K99-I101 HydrophobicContact CD-CD1 3.9Å; K99-I101 HydrophobicContact CG-CD1 3.78Å; I101-G107 WeakPolarHBondContact CG2-O 3.46Å; I101-L111 HydrophobicContact CG1-CB 4.25Å; I101-L111 HydrophobicContact CG1-CD1 4.16Å; I101-L111 HydrophobicContact CG2-CB 4.25Å; I101-P139 HydrophobicContact CB-CB 4.49Å; I101-P139 HydrophobicContact CB-CG 4.25Å; I101-P139 PolarHBondContact N-O 3.49Å
102	S	83.8	Confident	88.8	Confident	38 Å²	38	53 Å²	53	27%	0.266	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-68.3	147.9	171.8	71.5	0	0	0	0	112.1	Y83 S104	Y83-S102 PolarHBondContact O-N 3.28Å; S102-S104 PolarHBondContact O-N 2.8Å; S102-S104 PolarHBondContact OG-OG 3.26Å
103	H	81.1	Confident	88.3	Confident	117 Å²	117	49.3 Å²	49.3	54%	0.542	26%	0.257	S	S	.	.	S	Bend	trans	-73.7	10.5	175.6	-66	-71.9	0	0	0	114.5	E136 P139	H103-E136 PolarHBondContact CE1-O 2.9Å; H103-P139 WeakPolarHBondContact CE1-CD 3.35Å
104	S	81.5	Confident	88.1	Confident	51 Å²	51	42.6 Å²	42.6	36%	0.357	22%	0.221	S	C	.	.	S	Bend	trans	-66.8	151	175	66.1	0	0	0	0	110.5	S102 D106 G107 I108	S102-S104 PolarHBondContact O-N 2.8Å; S102-S104 PolarHBondContact OG-OG 3.26Å; S104-D106 PolarHBondContact O-N 2.82Å; S104-G107 PolarHBondContact O-N 2.83Å; S104-G107 VanDerWaalsContact O-N 3.12Å; S104-G107 PolarHBondContact OG-N 3.41Å; S104-I108 PolarHBondContact O-N 3.07Å
105	K	78.3	Confident	87.7	Confident	191 Å²	191	39.7 Å²	39.7	83%	0.83	20%	0.203	S	C	*	.	H	α-helix	trans	-55.8	-39.1	176.2	-70.5	-175.9	178.9	179.9	0	111.6	S109	K105-S109 WeakPolarHBondContact O-CB 3.32Å; K105-S109 PolarHBondContact O-N 2.73Å
106	D	81.7	Confident	87	Confident	115 Å²	115	37.9 Å²	37.9	62%	0.615	19%	0.192	S	C	*	.	H	α-helix	trans	-67.5	-44	177.5	-64.6	-24.8	0	0	0	111.4	S104 I108 S109 Q110	S104-D106 PolarHBondContact O-N 2.82Å; D106-I108 PolarHBondContact O-N 3.04Å; D106-S109 WeakPolarHBondContact O-CB 3.22Å; D106-S109 PolarHBondContact O-N 3.01Å; D106-Q110 WeakPolarHBondContact O-CG 3.35Å; D106-Q110 PolarHBondContact O-N 3.07Å
107	G	83.2	Confident	86.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.2	-46.6	175.6	0	0	0	0	0	112.6	I101 S104 Q110 L111	I101-G107 WeakPolarHBondContact CG2-O 3.46Å; S104-G107 PolarHBondContact O-N 2.83Å; S104-G107 VanDerWaalsContact O-N 3.12Å; S104-G107 PolarHBondContact OG-N 3.41Å; G107-Q110 PolarHBondContact O-N 2.87Å; G107-L111 WeakPolarHBondContact O-CB 3.5Å; G107-L111 PolarHBondContact O-N 2.83Å
108	I	82.1	Confident	86.1	Confident	41 Å²	41	37.9 Å²	37.9	21%	0.21	19%	0.19	C	C	.	.	H	α-helix	trans	-65.2	-42.2	176.7	-62.5	-59	0	0	0	111.6	V44 S104 D106 Q110 L111 I112 P139	V44-I108 HydrophobicContact CG2-CG2 4.15Å; S104-I108 PolarHBondContact O-N 3.07Å; D106-I108 PolarHBondContact O-N 3.04Å; I108-Q110 VanDerWaalsContact C-N 3.33Å; I108-Q110 PolarHBondContact O-N 2.86Å; I108-L111 HydrophobicContact CD1-CD2 4.27Å; I108-L111 WeakPolarHBondContact O-CB 3.32Å; I108-L111 PolarHBondContact O-N 3.43Å; I108-I112 HydrophobicContact CG2-CD1 3.81Å; I108-I112 WeakPolarHBondContact O-CD1 3.3Å; I108-I112 VanDerWaalsContact O-CG1 3.23Å; I108-I112 WeakPolarHBondContact O-CG1 2.96Å; I108-I112 PolarHBondContact O-N 2.93Å; I108-P139 HydrophobicContact CD1-CG 4.15Å
109	S	82	Confident	85.4	Confident	51 Å²	51	38 Å²	38	36%	0.357	19%	0.191	S	C	.	.	H	α-helix	trans	-59	-44.3	176.6	-171.2	0	0	0	0	111.9	K105 D106 I112 K113	K105-S109 WeakPolarHBondContact O-CB 3.32Å; K105-S109 PolarHBondContact O-N 2.73Å; D106-S109 WeakPolarHBondContact O-CB 3.22Å; D106-S109 PolarHBondContact O-N 3.01Å; S109-I112 PolarHBondContact O-N 3.36Å; S109-K113 PolarHBondContact O-N 3.12Å
110	Q	84.4	Confident	84.8	Confident	11 Å²	11	37.4 Å²	37.4	5%	0.051	19%	0.189	C	C	.	.	H	α-helix	trans	-68	-43.7	177.4	-69.5	-166.5	4.9	0	0	112.6	Y83 D106 G107 I108 I112 K113 E114	Y83-Q110 VanDerWaalsContact CE2-OE1 3.24Å; Y83-Q110 PolarHBondContact OH-NE2 3.22Å; D106-Q110 WeakPolarHBondContact O-CG 3.35Å; D106-Q110 PolarHBondContact O-N 3.07Å; G107-Q110 PolarHBondContact O-N 2.87Å; I108-Q110 VanDerWaalsContact C-N 3.33Å; I108-Q110 PolarHBondContact O-N 2.86Å; Q110-I112 VanDerWaalsContact C-N 3.26Å; Q110-I112 PolarHBondContact O-N 3.45Å; Q110-K113 PolarHBondContact O-N 3.19Å; Q110-E114 WeakPolarHBondContact O-CB 3.38Å; Q110-E114 WeakPolarHBondContact O-CG 3.45Å; Q110-E114 PolarHBondContact O-N 3.18Å
111	L	87	Confident	84.5	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-50.3	-49.5	173.3	164	66.7	0	0	0	111.2	I101 G107 I108 K113 L115 L134 P139 L141	I101-L111 HydrophobicContact CG1-CB 4.25Å; I101-L111 HydrophobicContact CG1-CD1 4.16Å; I101-L111 HydrophobicContact CG2-CB 4.25Å; G107-L111 WeakPolarHBondContact O-CB 3.5Å; G107-L111 PolarHBondContact O-N 2.83Å; I108-L111 HydrophobicContact CD1-CD2 4.27Å; I108-L111 WeakPolarHBondContact O-CB 3.32Å; I108-L111 PolarHBondContact O-N 3.43Å; L111-K113 VanDerWaalsContact C-N 3.34Å; L111-K113 PolarHBondContact O-N 3.01Å; L111-L115 WeakPolarHBondContact O-CB 3.46Å; L111-L115 PolarHBondContact O-N 3.4Å; L111-L134 HydrophobicContact CD1-CD2 4.37Å; L111-L134 HydrophobicContact CD2-CD2 3.93Å; L111-L134 HydrophobicContact CG-CD2 4.38Å; L111-P139 HydrophobicContact CD2-CB 3.75Å; L111-L141 HydrophobicContact CD1-CD1 3.77Å; L111-L141 HydrophobicContact CD1-CD2 3.49Å; L111-L141 VanDerWaalsContact CD1-CD2 3.49Å; L111-L141 HydrophobicContact CD1-CG 3.45Å; L111-L141 VanDerWaalsContact CD1-CG 3.45Å
112	I	84.4	Confident	84.5	Confident	9 Å²	9	40.3 Å²	40.3	5%	0.046	20%	0.2	C	C	.	.	H	α-helix	trans	-63.7	-43.8	179.8	-66.5	155.3	0	0	0	110.6	P40 L43 V44 I108 S109 Q110 L115 Q116	P40-I112 HydrophobicContact CB-CD1 3.27Å; P40-I112 WeakPolarHBondContact O-CD1 3.24Å; L43-I112 HydrophobicContact CD2-CG2 3.38Å; L43-I112 HydrophobicContact CG-CG2 4.11Å; V44-I112 HydrophobicContact CG2-CD1 3.31Å; V44-I112 HydrophobicContact CG2-CG1 3.35Å; I108-I112 HydrophobicContact CG2-CD1 3.81Å; I108-I112 WeakPolarHBondContact O-CD1 3.3Å; I108-I112 VanDerWaalsContact O-CG1 3.23Å; I108-I112 WeakPolarHBondContact O-CG1 2.96Å; I108-I112 PolarHBondContact O-N 2.93Å; S109-I112 PolarHBondContact O-N 3.36Å; Q110-I112 VanDerWaalsContact C-N 3.26Å; Q110-I112 PolarHBondContact O-N 3.45Å; I112-L115 PolarHBondContact O-N 3.37Å; I112-Q116 HydrophobicContact CG2-CG 4.42Å; I112-Q116 WeakPolarHBondContact O-CB 3.27Å; I112-Q116 VanDerWaalsContact O-CG 3.26Å; I112-Q116 WeakPolarHBondContact O-CG 3.46Å; I112-Q116 PolarHBondContact O-N 2.79Å
113	K	84.5	Confident	85	Confident	35 Å²	35	41.2 Å²	41.2	15%	0.152	20%	0.199	C	C	.	.	H	α-helix	trans	-65.1	-45.5	-178.5	-165.9	58.4	167.9	176.6	0	111.7	S109 Q110 L111 Q116 I117 C216	S109-K113 PolarHBondContact O-N 3.12Å; Q110-K113 PolarHBondContact O-N 3.19Å; L111-K113 VanDerWaalsContact C-N 3.34Å; L111-K113 PolarHBondContact O-N 3.01Å; K113-Q116 WeakPolarHBondContact O-CB 3.34Å; K113-Q116 PolarHBondContact O-N 3.09Å; K113-I117 WeakPolarHBondContact O-CG1 3.28Å; K113-I117 PolarHBondContact O-N 2.63Å; K113-C216 WeakPolarHBondContact CE-O 3.29Å
114	E	90.2	Very high	85.7	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-59.6	-46.8	174.5	-72	-167.5	-125.4	0	0	111.3	K99 Q110 Q116 I117 L118 L141 Y143 F213 G214	K99-E114 IonicContact NZ-OE1 2.61Å; K99-E114 PolarHBondContact NZ-OE1 3.26Å; K99-E114 IonicContact NZ-OE2 2.75Å; Q110-E114 WeakPolarHBondContact O-CB 3.38Å; Q110-E114 WeakPolarHBondContact O-CG 3.45Å; Q110-E114 PolarHBondContact O-N 3.18Å; E114-Q116 VanDerWaalsContact C-N 3.33Å; E114-Q116 PolarHBondContact O-N 3.05Å; E114-I117 PolarHBondContact O-N 2.92Å; E114-L118 WeakPolarHBondContact O-CB 3.33Å; E114-L118 WeakPolarHBondContact O-CG 3.4Å; E114-L118 PolarHBondContact O-N 3.5Å; E114-L141 HydrophobicContact CB-CD1 3.91Å; E114-Y143 PolarHBondContact OE2-OH 3.43Å; E114-F213 HydrophobicContact CG-CB 4.07Å; E114-G214 VanDerWaalsContact CG-N 3.32Å
115	L	87.6	Confident	86.5	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-60.9	-42.4	178.5	-168.7	66.6	0	0	0	111.7	L47 L54 L111 I112 S119 L129 Y132 L141	L47-L115 HydrophobicContact CD1-CD2 3.95Å; L54-L115 HydrophobicContact CD1-CD1 3.31Å; L54-L115 HydrophobicContact CD1-CD2 3.8Å; L54-L115 HydrophobicContact CD1-CG 3.45Å; L54-L115 VanDerWaalsContact CD1-CG 3.45Å; L111-L115 WeakPolarHBondContact O-CB 3.46Å; L111-L115 PolarHBondContact O-N 3.4Å; I112-L115 PolarHBondContact O-N 3.37Å; L115-S119 WeakPolarHBondContact O-CB 3.43Å; L115-S119 PolarHBondContact O-N 2.81Å; L115-S119 PolarHBondContact O-OG 3.3Å; L115-L129 HydrophobicContact CD1-CD2 3.66Å; L115-Y132 HydrophobicContact CD1-CD1 4.06Å; L115-Y132 HydrophobicContact CD1-CD2 4.22Å; L115-Y132 HydrophobicContact CD1-CG 3.77Å; L115-Y132 HydrophobicContact CD2-CD2 4.07Å; L115-Y132 HydrophobicContact CD2-CE2 4.42Å; L115-Y132 HydrophobicContact CD2-CG 4.45Å; L115-L141 HydrophobicContact CD1-CD2 3.97Å
116	Q	82.9	Confident	87.4	Confident	11 Å²	11	31 Å²	31	5%	0.051	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-49.1	175.2	-76.7	178.6	-15.4	0	0	111.9	W26 V30 L43 I112 K113 E114 S119 L120	W26-Q116 HydrophobicContact CZ3-CG 4.35Å; V30-Q116 HydrophobicContact CG1-CG 4.34Å; V30-Q116 HydrophobicContact CG2-CG 3.94Å; L43-Q116 HydrophobicContact CD2-CG 4.15Å; I112-Q116 HydrophobicContact CG2-CG 4.42Å; I112-Q116 WeakPolarHBondContact O-CB 3.27Å; I112-Q116 VanDerWaalsContact O-CG 3.26Å; I112-Q116 WeakPolarHBondContact O-CG 3.46Å; I112-Q116 PolarHBondContact O-N 2.79Å; K113-Q116 WeakPolarHBondContact O-CB 3.34Å; K113-Q116 PolarHBondContact O-N 3.09Å; E114-Q116 VanDerWaalsContact C-N 3.33Å; E114-Q116 PolarHBondContact O-N 3.05Å; Q116-S119 PolarHBondContact O-OG 3.07Å; Q116-L120 WeakPolarHBondContact O-CB 3.23Å; Q116-L120 WeakPolarHBondContact O-CD1 3.38Å; Q116-L120 WeakPolarHBondContact O-CG 3.04Å
117	I	86.1	Confident	88.1	Confident	6 Å²	6	26 Å²	26	3%	0.031	13%	0.127	C	C	.	.	H	α-helix	trans	-70.2	-51.9	-175.4	-63.6	-63.2	0	0	0	110.6	K113 E114 S119 L120 Y121 L190 F213 C216	K113-I117 WeakPolarHBondContact O-CG1 3.28Å; K113-I117 PolarHBondContact O-N 2.63Å; E114-I117 PolarHBondContact O-N 2.92Å; I117-S119 VanDerWaalsContact C-N 3.26Å; I117-S119 PolarHBondContact O-N 3.07Å; I117-L120 PolarHBondContact O-N 3.45Å; I117-L120 VanDerWaalsContact O-N 3.12Å; I117-Y121 HydrophobicContact CD1-CD2 4.37Å; I117-Y121 HydrophobicContact CD1-CE2 4.25Å; I117-Y121 HydrophobicContact CG2-CD2 4.15Å; I117-Y121 VanDerWaalsContact O-CD2 3.3Å; I117-Y121 WeakPolarHBondContact O-CD2 2.98Å; I117-Y121 PolarHBondContact O-N 3.44Å; I117-L190 HydrophobicContact CD1-CD1 4.29Å; I117-L190 HydrophobicContact CD1-CD2 3.92Å; I117-F213 HydrophobicContact CB-CB 4.34Å; I117-F213 HydrophobicContact CB-CD1 4.4Å; I117-F213 HydrophobicContact CG2-CB 4.35Å; I117-F213 HydrophobicContact CG2-CD1 3.54Å; I117-F213 HydrophobicContact CG2-CE1 4.01Å; I117-F213 HydrophobicContact CG2-CG 4.04Å; I117-C216 HydrophobicContact CG1-CB 4.13Å
118	L	89.9	Confident	88.6	Confident	5 Å²	5	27.5 Å²	27.5	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-72.5	-18.7	-171.9	-67.2	177.4	0	0	0	114.1	E114 I126 L127 L129 Y143 F213	E114-L118 WeakPolarHBondContact O-CB 3.33Å; E114-L118 WeakPolarHBondContact O-CG 3.4Å; E114-L118 PolarHBondContact O-N 3.5Å; L118-I126 HydrophobicContact CD2-CG2 3.5Å; L118-L127 WeakPolarHBondContact CD2-O 3.18Å; L118-L129 HydrophobicContact CB-CB 3.91Å; L118-L129 HydrophobicContact CB-CD2 4.16Å; L118-L129 HydrophobicContact CD1-CB 4.2Å; L118-Y143 HydrophobicContact CD1-CD1 4.44Å; L118-Y143 HydrophobicContact CD1-CE1 3.58Å; L118-F213 HydrophobicContact CD1-CD2 4.23Å; L118-F213 HydrophobicContact CD2-CD2 3.64Å; L118-F213 HydrophobicContact CD2-CE2 3.57Å; L118-F213 HydrophobicContact CD2-CG 4.37Å; L118-F213 HydrophobicContact CD2-CZ 4.23Å; L118-F213 HydrophobicContact CG-CD2 4.03Å; L118-F213 HydrophobicContact CG-CE2 4.45Å
119	S	83.5	Confident	89.2	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.014	13%	0.128	C	C	.	.	H	α-helix	trans	-84	-19.6	172.7	62.7	0	0	0	0	114.5	L54 L115 Q116 I117	L54-S119 VanDerWaalsContact CD2-CB 3.44Å; L54-S119 WeakPolarHBondContact CD2-OG 3.01Å; L115-S119 WeakPolarHBondContact O-CB 3.43Å; L115-S119 PolarHBondContact O-N 2.81Å; L115-S119 PolarHBondContact O-OG 3.3Å; Q116-S119 PolarHBondContact O-OG 3.07Å; I117-S119 VanDerWaalsContact C-N 3.26Å; I117-S119 PolarHBondContact O-N 3.07Å
120	L	82.9	Confident	89.7	Confident	11 Å²	11	26.7 Å²	26.7	6%	0.058	12%	0.124	C	C	.	.	H	α-helix	trans	-100.2	-34.3	-177.5	-68.9	176.7	0	0	0	112.4	K23 L27 Q116 I117	K23-L120 WeakPolarHBondContact CE-O 3.3Å; K23-L120 HydrophobicContact CG-CD2 4.21Å; K23-L120 PolarHBondContact NZ-O 3.37Å; L27-L120 HydrophobicContact CD2-CD1 3.6Å; L27-L120 HydrophobicContact CD2-CD2 3.74Å; L27-L120 HydrophobicContact CD2-CG 4.23Å; L27-L120 HydrophobicContact CG-CD1 4.47Å; L27-L120 HydrophobicContact CG-CD2 3.77Å; Q116-L120 WeakPolarHBondContact O-CB 3.23Å; Q116-L120 WeakPolarHBondContact O-CD1 3.38Å; Q116-L120 WeakPolarHBondContact O-CG 3.04Å; I117-L120 PolarHBondContact O-N 3.45Å; I117-L120 VanDerWaalsContact O-N 3.12Å
121	Y	86.8	Confident	90.2	Very high	39 Å²	39	26.1 Å²	26.1	15%	0.153	12%	0.122	C	C	.	.			trans	-120.8	108.6	-169.5	-56.5	-76.4	0	0	0	110.1	I117 C185 L190	I117-Y121 HydrophobicContact CD1-CD2 4.37Å; I117-Y121 HydrophobicContact CD1-CE2 4.25Å; I117-Y121 HydrophobicContact CG2-CD2 4.15Å; I117-Y121 VanDerWaalsContact O-CD2 3.3Å; I117-Y121 WeakPolarHBondContact O-CD2 2.98Å; I117-Y121 PolarHBondContact O-N 3.44Å; Y121-C185 HydrophobicContact CD1-CB 4.28Å; Y121-C185 VanDerWaalsContact CD1-SG 3.52Å; Y121-C185 HydrophobicContact CE1-CB 4.48Å; Y121-C185 VanDerWaalsContact CE1-SG 3.57Å; Y121-L190 HydrophobicContact CD1-CD1 3.99Å; Y121-L190 HydrophobicContact CD2-CD1 3.54Å; Y121-L190 HydrophobicContact CE1-CD1 3.92Å; Y121-L190 HydrophobicContact CE2-CD1 3.49Å; Y121-L190 VanDerWaalsContact CE2-CD1 3.49Å; Y121-L190 HydrophobicContact CE2-CD2 4.37Å; Y121-L190 HydrophobicContact CE2-CG 4.49Å; Y121-L190 HydrophobicContact CG-CD1 3.8Å
122	R	89.9	Confident	90.4	Very high	109 Å²	109	26.2 Å²	26.2	41%	0.411	12%	0.122	S	C	.	.			trans	-111.4	139.1	174	-72.4	-123.3	-171.9	95.7	-11	109.7	E56 F181	E56-R122 VanDerWaalsContact CB-CZ 3.44Å; E56-R122 VanDerWaalsContact CG-NH1 3.33Å; E56-R122 PolarHBondContact O-NH2 3.02Å; E56-R122 IonicContact OE1-NH1 2.59Å; E56-R122 IonicContact OE2-CZ 3.9Å; E56-R122 IonicContact OE2-NH1 3.2Å; E56-R122 PolarHBondContact OE2-NH1 3.26Å; E56-R122 IonicContact OE2-NH2 2.75Å; E56-R122 PolarHBondContact OE2-NH2 3.24Å; R122-F181 WeakPolarHBondContact O-CZ 3.46Å
123	H	95.2	Very high	90.8	Very high	56 Å²	56	25.8 Å²	25.8	26%	0.259	12%	0.12	S	C	.	.			trans	-156.1	151.5	175.8	-174.6	-97.5	0	0	0	109	N125 I126 F181	H123-N125 PolarHBondContact CE1-OD1 2.99Å; H123-N125 PolarHBondContact ND1-N 2.6Å; H123-N125 PolarHBondContact O-N 3.3Å; H123-I126 HydrophobicContact CB-CB 4.2Å; H123-I126 HydrophobicContact CB-CD1 3.79Å; H123-I126 HydrophobicContact CB-CG1 3.95Å; H123-I126 PolarHBondContact O-N 2.85Å; H123-F181 HydrophobicContact CB-CD1 3.64Å; H123-F181 HydrophobicContact CB-CE1 3.84Å; H123-F181 HydrophobicContact CB-CG 4.05Å; H123-F181 HydrophobicContact CB-CZ 4.44Å; H123-F181 AromaticContact CD2-CD2 3.91Å; H123-F181 AromaticContact CD2-CG 3.66Å; H123-F181 AromaticContact CG-CD1 3.98Å; H123-F181 AromaticContact CG-CG 3.91Å
124	D	96.3	Very high	90.9	Very high	130 Å²	130	24.6 Å²	24.6	70%	0.695	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-18	-178.4	-69.4	-22.1	0	0	0	113.3	K209	D124-K209 WeakPolarHBondContact O-CD 3.19Å; D124-K209 WeakPolarHBondContact O-CE 3.28Å; D124-K209 PolarHBondContact O-NZ 3.33Å
125	N	98	Very high	90.7	Very high	7 Å²	7	27.3 Å²	27.3	4%	0.037	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	20.2	175.8	-56.4	112.6	0	0	0	114.1	H123 G174 P208 I210	H123-N125 PolarHBondContact CE1-OD1 2.99Å; H123-N125 PolarHBondContact ND1-N 2.6Å; H123-N125 PolarHBondContact O-N 3.3Å; N125-G174 WeakPolarHBondContact CB-O 3.23Å; N125-G174 WeakPolarHBondContact ND2-CA 3.46Å; N125-G174 PolarHBondContact OD1-O 3.05Å; N125-P208 WeakPolarHBondContact CA-O 3.48Å; N125-P208 PolarHBondContact ND2-O 3.06Å; N125-I210 WeakPolarHBondContact O-CG1 3.46Å; N125-I210 PolarHBondContact O-N 2.86Å
126	I	96.9	Very high	90.1	Very high	8 Å²	8	35.5 Å²	35.5	4%	0.041	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-116.2	138.2	171.9	-69.3	176.1	0	0	0	109	L118 H123 C128 F181 L182 F213	L118-I126 HydrophobicContact CD2-CG2 3.5Å; H123-I126 HydrophobicContact CB-CB 4.2Å; H123-I126 HydrophobicContact CB-CD1 3.79Å; H123-I126 HydrophobicContact CB-CG1 3.95Å; H123-I126 PolarHBondContact O-N 2.85Å; I126-C128 PolarHBondContact O-N 3.28Å; I126-F181 HydrophobicContact CD1-CD1 3.67Å; I126-F181 HydrophobicContact CD1-CE1 3.88Å; I126-L182 HydrophobicContact CD1-CD1 4.49Å; I126-L182 HydrophobicContact CD1-CD2 3.6Å; I126-L182 HydrophobicContact CD1-CG 3.94Å; I126-F213 HydrophobicContact CB-CZ 4.47Å; I126-F213 HydrophobicContact CD1-CZ 4.39Å; I126-F213 HydrophobicContact CG1-CZ 4.18Å; I126-F213 HydrophobicContact CG2-CE2 3.87Å; I126-F213 HydrophobicContact CG2-CZ 3.67Å
127	L	95.8	Very high	90	Very high	10 Å²	10	42.8 Å²	42.8	5%	0.052	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-61.9	123.3	-177.4	-174.9	65.6	0	0	0	110.9	L118 L129 Y143 M146 L201 K209 I210	L118-L127 WeakPolarHBondContact CD2-O 3.18Å; L127-L129 PolarHBondContact O-N 2.99Å; L127-Y143 HydrophobicContact CD2-CD1 3.5Å; L127-Y143 VanDerWaalsContact CD2-CD1 3.5Å; L127-Y143 HydrophobicContact CD2-CE1 3.92Å; L127-Y143 HydrophobicContact CD2-CG 3.92Å; L127-Y143 HydrophobicContact CG-CD1 3.75Å; L127-Y143 HydrophobicContact CG-CE1 4.46Å; L127-Y143 HydrophobicContact CG-CG 4.33Å; L127-M146 HydrophobicContact CD1-CE 4.5Å; L127-M146 HydrophobicContact CD1-CG 3.63Å; L127-M146 HydrophobicContact CD1-SD 3.74Å; L127-L201 HydrophobicContact CD1-CD1 4.13Å; L127-L201 HydrophobicContact CD2-CD1 3.86Å; L127-K209 HydrophobicContact CB-CB 4.15Å; L127-K209 HydrophobicContact CD1-CB 4.18Å; L127-I210 VanDerWaalsContact CB-O 3.3Å; L127-I210 WeakPolarHBondContact CB-O 3.19Å; L127-I210 PolarHBondContact N-O 2.87Å
128	C	94.5	Very high	89.8	Confident	31 Å²	31	42.5 Å²	42.5	21%	0.209	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-76.4	121.7	-176.3	-168.2	0	0	0	0	111.1	I126 Y130 Y143 Q144	I126-C128 PolarHBondContact O-N 3.28Å; C128-Y130 HydrophobicContact CB-CE1 4.21Å; C128-Y143 WeakPolarHBondContact O-CA 2.97Å; C128-Q144 HydrophobicContact CB-CB 4.21Å; C128-Q144 PolarHBondContact O-N 2.83Å
129	L	94.2	Very high	89.8	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.016	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	116.8	169.8	-175	73.4	0	0	0	109.3	A57 L115 L118 L127 G131 L141 I142 Y143	A57-L129 HydrophobicContact CB-CD2 3.98Å; A57-L129 HydrophobicContact CB-CG 4.31Å; L115-L129 HydrophobicContact CD1-CD2 3.66Å; L118-L129 HydrophobicContact CB-CB 3.91Å; L118-L129 HydrophobicContact CB-CD2 4.16Å; L118-L129 HydrophobicContact CD1-CB 4.2Å; L127-L129 PolarHBondContact O-N 2.99Å; L129-G131 WeakPolarHBondContact CD1-O 3.35Å; L129-L141 HydrophobicContact CD1-CB 3.88Å; L129-L141 HydrophobicContact CD1-CD2 3.99Å; L129-L141 HydrophobicContact CD1-CG 4.41Å; L129-L141 HydrophobicContact CD2-CD2 4.36Å; L129-I142 WeakPolarHBondContact CD1-O 3.06Å; L129-Y143 HydrophobicContact CB-CD1 4.4Å; L129-Y143 HydrophobicContact CD1-CD1 3.88Å; L129-Y143 HydrophobicContact CD1-CE1 3.72Å; L129-Y143 HydrophobicContact CD1-CE2 4.4Å; L129-Y143 HydrophobicContact CD1-CG 4.35Å
130	Y	93.4	Very high	90.3	Very high	72 Å²	72	42.5 Å²	42.5	28%	0.282	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-35.7	176.4	-65.3	-22.9	0	0	0	112.5	I58 T94 V96 C128 I142 Q144	I58-Y130 PolarHBondContact N-O 3.38Å; T94-Y130 HydrophobicContact CG2-CE2 3.94Å; V96-Y130 HydrophobicContact CG1-CD2 3.78Å; V96-Y130 HydrophobicContact CG1-CE2 4.16Å; C128-Y130 HydrophobicContact CB-CE1 4.21Å; Y130-I142 PolarHBondContact N-O 3.36Å; Y130-Q144 HydrophobicContact CE1-CB 4.17Å; Y130-Q144 VanDerWaalsContact CE2-CA 3.47Å; Y130-Q144 HydrophobicContact CE2-CB 4.07Å; Y130-Q144 WeakPolarHBondContact OH-CB 3.49Å; Y130-Q144 WeakPolarHBondContact OH-CG 3.38Å
131	G	93.4	Very high	90.8	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.7	178.1	-174.2	0	0	0	0	0	114.3	I58 L129 I142	I58-G131 CarbonylContact O-C 3.53Å; I58-G131 WeakPolarHBondContact O-CA 3.14Å; L129-G131 WeakPolarHBondContact CD1-O 3.35Å; G131-I142 PolarHBondContact N-O 3.42Å; G131-I142 VanDerWaalsContact N-O 3.14Å; G131-I142 PolarHBondContact O-N 2.71Å
132	Y	92.6	Very high	91.3	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.016	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	146.7	-174.9	64.7	-73.5	0	0	0	110.3	I52 L54 A57 I58 R59 A60 L115 L134 C140	I52-Y132 PolarHBondContact O-OH 3.22Å; L54-Y132 HydrophobicContact CB-CE1 4.11Å; L54-Y132 HydrophobicContact CD1-CD1 3.89Å; L54-Y132 HydrophobicContact CD1-CE1 3.54Å; L54-Y132 HydrophobicContact CD1-CE2 4.28Å; L54-Y132 HydrophobicContact CD1-CG 4.43Å; L54-Y132 HydrophobicContact CG-CE1 4.15Å; A57-Y132 HydrophobicContact CB-CD1 3.81Å; A57-Y132 HydrophobicContact CB-CE1 4.14Å; A57-Y132 WeakPolarHBondContact O-CE1 3.43Å; I58-Y132 PolarHBondContact O-N 3.35Å; R59-Y132 WeakPolarHBondContact CA-O 3.31Å; R59-Y132 HydrophobicContact CB-CE1 4.08Å; R59-Y132 HydrophobicContact CB-CE2 4.35Å; R59-Y132 HydrophobicContact CG-CE2 4.24Å; A60-Y132 PolarHBondContact N-O 3.35Å; L115-Y132 HydrophobicContact CD1-CD1 4.06Å; L115-Y132 HydrophobicContact CD1-CD2 4.22Å; L115-Y132 HydrophobicContact CD1-CG 3.77Å; L115-Y132 HydrophobicContact CD2-CD2 4.07Å; L115-Y132 HydrophobicContact CD2-CE2 4.42Å; L115-Y132 HydrophobicContact CD2-CG 4.45Å; Y132-L134 HydrophobicContact CD2-CD1 3.95Å; Y132-L134 HydrophobicContact CD2-CD2 4.17Å; Y132-L134 HydrophobicContact CD2-CG 3.72Å; Y132-L134 HydrophobicContact CE2-CD1 3.88Å; Y132-L134 HydrophobicContact CE2-CG 4.1Å; Y132-C140 CarbonylContact C-O 3.55Å; Y132-C140 WeakPolarHBondContact CA-O 3.46Å
133	C	91.3	Very high	91.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.7	170.3	177.1	0	0	0	0	107.6	I65 P139 C140	I65-C133 HydrophobicContact CD1-CB 4.47Å; I65-C133 HydrophobicContact CG1-CB 3.88Å; C133-P139 CarbonylContact O-C 3.46Å; C133-P139 VanDerWaalsContact O-CA 3.26Å; C133-P139 WeakPolarHBondContact O-CA 3.45Å; C133-C140 HydrophobicContact CB-CB 4.28Å; C133-C140 PolarHBondContact N-O 3.43Å; C133-C140 PolarHBondContact O-N 3.22Å
134	L	87.2	Confident	91.6	Very high	10 Å²	10	34.8 Å²	34.8	5%	0.052	16%	0.161	C	C	.	.			trans	-110.7	11.8	179.7	-58.8	179.5	0	0	0	112.5	L47 L48 L111 Y132 E136	L47-L134 HydrophobicContact CB-CD1 3.73Å; L47-L134 HydrophobicContact CD1-CD1 4.13Å; L47-L134 HydrophobicContact CG-CD1 4.48Å; L48-L134 HydrophobicContact CD2-CB 3.6Å; L48-L134 HydrophobicContact CG-CB 4.28Å; L111-L134 HydrophobicContact CD1-CD2 4.37Å; L111-L134 HydrophobicContact CD2-CD2 3.93Å; L111-L134 HydrophobicContact CG-CD2 4.38Å; Y132-L134 HydrophobicContact CD2-CD1 3.95Å; Y132-L134 HydrophobicContact CD2-CD2 4.17Å; Y132-L134 HydrophobicContact CD2-CG 3.72Å; Y132-L134 HydrophobicContact CE2-CD1 3.88Å; Y132-L134 HydrophobicContact CE2-CG 4.1Å; L134-E136 PolarHBondContact O-N 3.3Å
135	E	85.8	Confident	91.6	Very high	58 Å²	58	30.9 Å²	30.9	27%	0.271	14%	0.138	S	C	.	.			trans	-65.7	135.9	178.1	-66.8	-173.4	-141.1	0	0	110.7	K61 Y62 R137 A138	K61-E135 WeakPolarHBondContact CA-OE1 3.44Å; Y62-E135 VanDerWaalsContact CB-CD 3.46Å; Y62-E135 WeakPolarHBondContact CB-OE2 3.5Å; Y62-E135 PolarHBondContact N-OE1 3.4Å; E135-R137 PolarHBondContact O-N 3.05Å; E135-A138 CarbonylContact O-C 3.42Å; E135-A138 PolarHBondContact O-N 3.47Å; E135-A138 VanDerWaalsContact O-N 3.08Å
136	E	76.6	Confident	91.6	Very high	173 Å²	173	31.1 Å²	31.1	81%	0.808	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-20.1	-171	-68.1	-172.8	168	0	0	114.4	H103 L134	H103-E136 PolarHBondContact CE1-O 2.9Å; L134-E136 PolarHBondContact O-N 3.3Å
137	R	79.1	Confident	91.5	Very high	165 Å²	165	33.3 Å²	33.3	62%	0.623	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-32.5	-179.5	-57.8	-179.8	-165.4	168.4	6.7	112.6	Y62 E135	Y62-R137 HydrophobicContact CD2-CB 4.29Å; Y62-R137 HydrophobicContact CE2-CB 4.11Å; E135-R137 PolarHBondContact O-N 3.05Å
138	A	82.3	Confident	91.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.17	C	C	.	.			trans	-162.7	86.7	178.2	0	0	0	0	0	110.9	Y62 F72 R100 E135 C140	Y62-A138 HydrophobicContact CD2-CB 3.88Å; Y62-A138 HydrophobicContact CE2-CB 3.54Å; F72-A138 HydrophobicContact CE2-CB 4.49Å; F72-A138 HydrophobicContact CZ-CB 4Å; R100-A138 HydrophobicContact CG-CB 4.38Å; E135-A138 CarbonylContact O-C 3.42Å; E135-A138 PolarHBondContact O-N 3.47Å; E135-A138 VanDerWaalsContact O-N 3.08Å; A138-C140 PolarHBondContact O-N 3.21Å; A138-C140 PolarHBondContact O-SG 3.4Å
139	P	90.6	Very high	91.4	Very high	6 Å²	6	35.2 Å²	35.2	4%	0.039	17%	0.173	C	C	.	.			trans	-62.1	126.8	169.9	24.7	-32.3	0	0	0	109.6	I101 H103 I108 L111 C133	I101-P139 HydrophobicContact CB-CB 4.49Å; I101-P139 HydrophobicContact CB-CG 4.25Å; I101-P139 PolarHBondContact N-O 3.49Å; H103-P139 WeakPolarHBondContact CE1-CD 3.35Å; I108-P139 HydrophobicContact CD1-CG 4.15Å; L111-P139 HydrophobicContact CD2-CB 3.75Å; C133-P139 CarbonylContact O-C 3.46Å; C133-P139 VanDerWaalsContact O-CA 3.26Å; C133-P139 WeakPolarHBondContact O-CA 3.45Å
140	C	93.6	Very high	91.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	148.6	-174.9	-61.2	0	0	0	0	111.9	I65 V98 K99 Y132 C133 A138	I65-C140 HydrophobicContact CG2-CB 4.4Å; V98-C140 HydrophobicContact CG1-CB 3.91Å; K99-C140 VanDerWaalsContact O-CA 3.27Å; K99-C140 WeakPolarHBondContact O-CA 3.26Å; Y132-C140 CarbonylContact C-O 3.55Å; Y132-C140 WeakPolarHBondContact CA-O 3.46Å; C133-C140 HydrophobicContact CB-CB 4.28Å; C133-C140 PolarHBondContact N-O 3.43Å; C133-C140 PolarHBondContact O-N 3.22Å; A138-C140 PolarHBondContact O-N 3.21Å; A138-C140 PolarHBondContact O-SG 3.4Å
141	L	94.2	Very high	91.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	137.8	165.9	-66.4	176.6	0	0	0	109.4	V98 K99 L111 E114 L115 L129 Y143	V98-L141 CarbonylContact C-O 3.47Å; V98-L141 WeakPolarHBondContact CA-O 3.37Å; K99-L141 HydrophobicContact CB-CB 4.49Å; K99-L141 PolarHBondContact N-O 2.83Å; K99-L141 PolarHBondContact O-N 3.14Å; L111-L141 HydrophobicContact CD1-CD1 3.77Å; L111-L141 HydrophobicContact CD1-CD2 3.49Å; L111-L141 VanDerWaalsContact CD1-CD2 3.49Å; L111-L141 HydrophobicContact CD1-CG 3.45Å; L111-L141 VanDerWaalsContact CD1-CG 3.45Å; E114-L141 HydrophobicContact CB-CD1 3.91Å; L115-L141 HydrophobicContact CD1-CD2 3.97Å; L129-L141 HydrophobicContact CD1-CB 3.88Å; L129-L141 HydrophobicContact CD1-CD2 3.99Å; L129-L141 HydrophobicContact CD1-CG 4.41Å; L129-L141 HydrophobicContact CD2-CD2 4.36Å; L141-Y143 HydrophobicContact CB-CD2 4.3Å; L141-Y143 HydrophobicContact CB-CE2 3.42Å; L141-Y143 VanDerWaalsContact CB-CE2 3.42Å; L141-Y143 HydrophobicContact CD1-CE2 4.46Å; L141-Y143 WeakPolarHBondContact CD1-OH 3.4Å
142	I	95.7	Very high	91.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	114.8	-176	-45.2	169.6	0	0	0	108.1	A60 I65 W91 V96 L129 Y130 G131	A60-I142 HydrophobicContact CB-CD1 3.78Å; I65-I142 HydrophobicContact CD1-CD1 3.46Å; I65-I142 VanDerWaalsContact CD1-CD1 3.46Å; I65-I142 HydrophobicContact CD1-CG1 3.89Å; W91-I142 HydrophobicContact CD2-CD1 3.91Å; W91-I142 HydrophobicContact CE3-CD1 3.95Å; W91-I142 HydrophobicContact CE3-CG2 3.97Å; W91-I142 HydrophobicContact CH2-CD1 3.98Å; W91-I142 HydrophobicContact CZ2-CD1 4.01Å; W91-I142 HydrophobicContact CZ3-CD1 3.98Å; W91-I142 HydrophobicContact CZ3-CG2 4.44Å; V96-I142 HydrophobicContact CB-CG2 3.72Å; V96-I142 HydrophobicContact CG1-CG2 3.85Å; V96-I142 HydrophobicContact CG2-CG2 3.9Å; L129-I142 WeakPolarHBondContact CD1-O 3.06Å; Y130-I142 PolarHBondContact N-O 3.36Å; G131-I142 PolarHBondContact N-O 3.42Å; G131-I142 VanDerWaalsContact N-O 3.14Å; G131-I142 PolarHBondContact O-N 2.71Å
143	Y	96.2	Very high	91.1	Very high	11 Å²	11	37.7 Å²	37.7	4%	0.043	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	164	-177.9	-56.7	-92.9	0	0	0	111.9	V96 A97 K99 E114 L118 L127 C128 L129 L141 F145	V96-Y143 WeakPolarHBondContact CA-O 3.26Å; V96-Y143 WeakPolarHBondContact CB-O 3.21Å; A97-Y143 PolarHBondContact N-O 3.36Å; A97-Y143 PolarHBondContact O-N 2.6Å; K99-Y143 HydrophobicContact CB-CD2 4.45Å; K99-Y143 HydrophobicContact CB-CE2 3.81Å; K99-Y143 HydrophobicContact CD-CE2 4.24Å; E114-Y143 PolarHBondContact OE2-OH 3.43Å; L118-Y143 HydrophobicContact CD1-CD1 4.44Å; L118-Y143 HydrophobicContact CD1-CE1 3.58Å; L127-Y143 HydrophobicContact CD2-CD1 3.5Å; L127-Y143 VanDerWaalsContact CD2-CD1 3.5Å; L127-Y143 HydrophobicContact CD2-CE1 3.92Å; L127-Y143 HydrophobicContact CD2-CG 3.92Å; L127-Y143 HydrophobicContact CG-CD1 3.75Å; L127-Y143 HydrophobicContact CG-CE1 4.46Å; L127-Y143 HydrophobicContact CG-CG 4.33Å; C128-Y143 WeakPolarHBondContact O-CA 2.97Å; L129-Y143 HydrophobicContact CB-CD1 4.4Å; L129-Y143 HydrophobicContact CD1-CD1 3.88Å; L129-Y143 HydrophobicContact CD1-CE1 3.72Å; L129-Y143 HydrophobicContact CD1-CE2 4.4Å; L129-Y143 HydrophobicContact CD1-CG 4.35Å; L141-Y143 HydrophobicContact CB-CD2 4.3Å; L141-Y143 HydrophobicContact CB-CE2 3.42Å; L141-Y143 VanDerWaalsContact CB-CE2 3.42Å; L141-Y143 HydrophobicContact CD1-CE2 4.46Å; L141-Y143 WeakPolarHBondContact CD1-OH 3.4Å; Y143-F145 PolarHBondContact O-N 2.56Å
144	Q	95.3	Very high	90.9	Very high	43 Å²	43	38.8 Å²	38.8	20%	0.201	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-48.7	133.8	157.1	-179.5	174.1	20.8	0	0	110.7	C128 Y130 M146	C128-Q144 HydrophobicContact CB-CB 4.21Å; C128-Q144 PolarHBondContact O-N 2.83Å; Y130-Q144 HydrophobicContact CE1-CB 4.17Å; Y130-Q144 VanDerWaalsContact CE2-CA 3.47Å; Y130-Q144 HydrophobicContact CE2-CB 4.07Å; Y130-Q144 WeakPolarHBondContact OH-CB 3.49Å; Y130-Q144 WeakPolarHBondContact OH-CG 3.38Å; Q144-M146 HydrophobicContact CG-SD 4.13Å
145	F	97.1	Very high	90.8	Very high	47 Å²	47	38.9 Å²	38.9	21%	0.206	20%	0.197	C	C	.	.			trans	-75.2	128.6	172.2	177.4	-109.6	0	0	0	111	L78 K88 V95 Y143 A147	L78-F145 HydrophobicContact CD1-CD2 4.01Å; L78-F145 HydrophobicContact CD1-CE2 3.77Å; L78-F145 HydrophobicContact CD2-CE2 3.99Å; K88-F145 HydrophobicContact CD-CE2 4.08Å; K88-F145 HydrophobicContact CD-CZ 4.18Å; K88-F145 HydrophobicContact CG-CD2 4.28Å; K88-F145 HydrophobicContact CG-CE2 4.1Å; V95-F145 HydrophobicContact CB-CB 4.43Å; V95-F145 HydrophobicContact CG1-CB 3.87Å; V95-F145 HydrophobicContact CG1-CD1 3.8Å; V95-F145 HydrophobicContact CG1-CD2 4.45Å; V95-F145 HydrophobicContact CG1-CE1 4.49Å; V95-F145 HydrophobicContact CG1-CG 3.77Å; V95-F145 WeakPolarHBondContact O-CB 3.27Å; Y143-F145 PolarHBondContact O-N 2.56Å; F145-A147 HydrophobicContact CD1-CB 4.36Å; F145-A147 HydrophobicContact CE1-CB 3.91Å
146	M	97.1	Very high	90.5	Very high	12 Å²	12	38.2 Å²	38.2	6%	0.059	19%	0.194	C	C	.	.			trans	-104.4	95	-176.3	-60.4	-58.2	-70.3	0	0	109.4	L127 Q144 N148 G149 L201 L202 D203 K209	L127-M146 HydrophobicContact CD1-CE 4.5Å; L127-M146 HydrophobicContact CD1-CG 3.63Å; L127-M146 HydrophobicContact CD1-SD 3.74Å; Q144-M146 HydrophobicContact CG-SD 4.13Å; M146-N148 PolarHBondContact O-N 3.17Å; M146-G149 PolarHBondContact O-N 3.05Å; M146-L201 HydrophobicContact CB-CB 3.76Å; M146-L201 HydrophobicContact CB-CD1 4.21Å; M146-L201 HydrophobicContact CE-CB 3.73Å; M146-L201 VanDerWaalsContact CE-O 3.23Å; M146-L201 WeakPolarHBondContact CE-O 3.12Å; M146-L201 HydrophobicContact CG-CB 3.6Å; M146-L201 HydrophobicContact CG-CD1 3.78Å; M146-L201 HydrophobicContact CG-CG 4.34Å; M146-L202 CarbonylContact C-O 3.53Å; M146-D203 HydrophobicContact CE-CB 3.8Å; M146-D203 HydrophobicContact SD-CB 4.11Å; M146-K209 HydrophobicContact CE-CB 3.73Å; M146-K209 HydrophobicContact CE-CG 3.23Å; M146-K209 HydrophobicContact SD-CG 3.97Å
147	A	94.7	Very high	90.8	Very high	54 Å²	54	33.6 Å²	33.6	45%	0.446	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-24	-164.9	0	0	0	0	0	114.9	F145 L202 H204	F145-A147 HydrophobicContact CD1-CB 4.36Å; F145-A147 HydrophobicContact CE1-CB 3.91Å; A147-L202 PolarHBondContact N-O 2.89Å; A147-H204 HydrophobicContact CB-CB 4.43Å
148	N	94.6	Very high	90.6	Very high	55 Å²	55	34.5 Å²	34.5	29%	0.294	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	12.9	-178.4	-75	-59.2	0	0	0	113.2	M146 R154 L202 D203 L206	M146-N148 PolarHBondContact O-N 3.17Å; N148-R154 WeakPolarHBondContact O-CD 3.47Å; N148-R154 WeakPolarHBondContact O-CG 3.44Å; N148-L202 HydrophobicContact CB-CB 3.76Å; N148-L202 PolarHBondContact N-O 3.43Å; N148-L202 VanDerWaalsContact N-O 3.07Å; N148-D203 PolarHBondContact ND2-O 2.97Å; N148-L206 HydrophobicContact CB-CD2 3.82Å
149	G	93.8	Very high	90.6	Very high	27 Å²	27	38.8 Å²	38.8	28%	0.278	22%	0.219	S	C	.	.			trans	68.7	-152.9	176.8	0	0	0	0	0	112.7	M146 L201 L202	M146-G149 PolarHBondContact O-N 3.05Å; G149-L201 WeakPolarHBondContact O-CA 3.43Å; G149-L202 PolarHBondContact O-N 3.09Å
150	S	94.3	Very high	90.3	Very high	10 Å²	10	41.9 Å²	41.9	7%	0.07	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-86.5	159.3	175.6	72.1	0	0	0	0	112	D152 D153 R154 I200	S150-D152 PolarHBondContact O-N 2.94Å; S150-D153 WeakPolarHBondContact CB-OD2 3.41Å; S150-D153 PolarHBondContact N-OD2 2.79Å; S150-D153 WeakPolarHBondContact O-CB 3.49Å; S150-D153 PolarHBondContact O-N 3.02Å; S150-D153 PolarHBondContact OG-N 3.12Å; S150-D153 VanDerWaalsContact OG-N 3.15Å; S150-D153 PolarHBondContact OG-OD2 3.44Å; S150-R154 WeakPolarHBondContact O-CG 3.25Å; S150-R154 PolarHBondContact O-N 3.01Å; S150-I200 CarbonylContact C-O 3.48Å; S150-I200 VanDerWaalsContact CA-O 3.28Å; S150-I200 WeakPolarHBondContact CA-O 3.28Å
151	L	93.3	Very high	89.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-38	171.4	175.3	60.3	0	0	0	110.9	D153 R154 L155 L163 I171 I175 S197 I200 V264 E268	L151-D153 VanDerWaalsContact C-N 3.32Å; L151-D153 PolarHBondContact O-N 2.85Å; L151-R154 PolarHBondContact O-N 2.88Å; L151-L155 HydrophobicContact CD1-CD1 3.89Å; L151-L155 HydrophobicContact CD1-CD2 4.19Å; L151-L155 HydrophobicContact CD1-CG 3.79Å; L151-L155 HydrophobicContact CD2-CD1 4.36Å; L151-L155 HydrophobicContact CG-CD1 3.71Å; L151-L155 HydrophobicContact CG-CG 4.09Å; L151-L155 WeakPolarHBondContact O-CB 3.26Å; L151-L155 VanDerWaalsContact O-CG 3.23Å; L151-L155 WeakPolarHBondContact O-CG 3.3Å; L151-L155 PolarHBondContact O-N 2.87Å; L151-L163 HydrophobicContact CD1-CD1 3.84Å; L151-I171 HydrophobicContact CD1-CD1 4.48Å; L151-I171 HydrophobicContact CD1-CG2 4.21Å; L151-I171 HydrophobicContact CD2-CG2 4.15Å; L151-I175 HydrophobicContact CD2-CD1 4.14Å; L151-S197 WeakPolarHBondContact CB-O 3.45Å; L151-S197 PolarHBondContact N-O 3.4Å; L151-I200 HydrophobicContact CB-CB 3.95Å; L151-I200 HydrophobicContact CB-CG2 4.23Å; L151-I200 HydrophobicContact CD2-CB 4.24Å; L151-I200 HydrophobicContact CD2-CG1 4.43Å; L151-I200 HydrophobicContact CD2-CG2 4.35Å; L151-I200 PolarHBondContact N-O 3.05Å; L151-V264 HydrophobicContact CD2-CG1 4.01Å; L151-E268 HydrophobicContact CD1-CG 4.45Å; L151-E268 VanDerWaalsContact CD1-OE1 3.23Å; L151-E268 WeakPolarHBondContact CD1-OE1 3.21Å; L151-E268 HydrophobicContact CD2-CG 3.88Å; L151-E268 WeakPolarHBondContact CD2-OE1 3.44Å
152	D	90.9	Very high	89.2	Confident	49 Å²	49	52.4 Å²	52.4	26%	0.262	29%	0.286	S	S	.	.	H	α-helix	trans	-54.7	-47.1	174.7	-168.2	82.8	0	0	0	111.9	S150 R154 L155 H156 S197 A198	S150-D152 PolarHBondContact O-N 2.94Å; D152-R154 VanDerWaalsContact C-N 3.29Å; D152-R154 PolarHBondContact O-N 3.43Å; D152-L155 PolarHBondContact O-N 3.45Å; D152-H156 PolarHBondContact O-CD2 2.91Å; D152-H156 PolarHBondContact O-N 3.15Å; D152-H156 IonicContact OD1-CD2 2.76Å; D152-H156 PolarHBondContact OD1-CD2 3.05Å; D152-H156 VanDerWaalsContact OD1-CD2 3.3Å; D152-H156 IonicContact OD1-NE2 3.25Å; D152-H156 IonicContact OD2-CD2 3.65Å; D152-S197 WeakPolarHBondContact CB-OG 3.4Å; D152-S197 PolarHBondContact N-O 2.72Å; D152-S197 PolarHBondContact OD1-OG 3.08Å; D152-A198 HydrophobicContact CB-CB 4.04Å
153	D	88.8	Confident	88.7	Confident	71 Å²	71	52.4 Å²	52.4	38%	0.38	29%	0.286	S	S	.	.	H	α-helix	trans	-58.6	-43.5	175.5	-61.2	-54.2	0	0	0	110.9	S150 L151 L155 N157	S150-D153 WeakPolarHBondContact CB-OD2 3.41Å; S150-D153 PolarHBondContact N-OD2 2.79Å; S150-D153 WeakPolarHBondContact O-CB 3.49Å; S150-D153 PolarHBondContact O-N 3.02Å; S150-D153 PolarHBondContact OG-N 3.12Å; S150-D153 VanDerWaalsContact OG-N 3.15Å; S150-D153 PolarHBondContact OG-OD2 3.44Å; L151-D153 VanDerWaalsContact C-N 3.32Å; L151-D153 PolarHBondContact O-N 2.85Å; D153-L155 VanDerWaalsContact C-N 3.31Å; D153-L155 PolarHBondContact O-N 3.25Å; D153-N157 WeakPolarHBondContact O-CA 3.28Å; D153-N157 WeakPolarHBondContact O-CB 3.44Å; D153-N157 PolarHBondContact O-N 2.9Å
154	R	87.2	Confident	88.1	Confident	24 Å²	24	53.6 Å²	53.6	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-71.8	-26.3	-176.3	-64	-66.3	-64.2	104.9	1.2	113.5	N148 S150 L151 D152 L160 K161 L163 L202	N148-R154 WeakPolarHBondContact O-CD 3.47Å; N148-R154 WeakPolarHBondContact O-CG 3.44Å; S150-R154 WeakPolarHBondContact O-CG 3.25Å; S150-R154 PolarHBondContact O-N 3.01Å; L151-R154 PolarHBondContact O-N 2.88Å; D152-R154 VanDerWaalsContact C-N 3.29Å; D152-R154 PolarHBondContact O-N 3.43Å; R154-L160 VanDerWaalsContact NH1-CB 3.25Å; R154-K161 PolarHBondContact NH1-O 2.89Å; R154-K161 PolarHBondContact NH2-O 3.34Å; R154-L163 HydrophobicContact CB-CD1 3.85Å; R154-L163 HydrophobicContact CB-CG 4.2Å; R154-L202 HydrophobicContact CB-CD1 4.35Å; R154-L202 HydrophobicContact CG-CD1 3.76Å
155	L	85	Confident	87.5	Confident	11 Å²	11	52.7 Å²	52.7	6%	0.058	29%	0.291	C	S	.	.	H	α-helix	trans	-86.5	-38.3	179.7	-71.6	179.6	0	0	0	112.4	L151 D152 D153 L163 E268 A271	L151-L155 HydrophobicContact CD1-CD1 3.89Å; L151-L155 HydrophobicContact CD1-CD2 4.19Å; L151-L155 HydrophobicContact CD1-CG 3.79Å; L151-L155 HydrophobicContact CD2-CD1 4.36Å; L151-L155 HydrophobicContact CG-CD1 3.71Å; L151-L155 HydrophobicContact CG-CG 4.09Å; L151-L155 WeakPolarHBondContact O-CB 3.26Å; L151-L155 VanDerWaalsContact O-CG 3.23Å; L151-L155 WeakPolarHBondContact O-CG 3.3Å; L151-L155 PolarHBondContact O-N 2.87Å; D152-L155 PolarHBondContact O-N 3.45Å; D153-L155 VanDerWaalsContact C-N 3.31Å; D153-L155 PolarHBondContact O-N 3.25Å; L155-L163 HydrophobicContact CD2-CD1 4.3Å; L155-E268 HydrophobicContact CD1-CB 4.47Å; L155-E268 HydrophobicContact CD1-CG 4.05Å; L155-A271 HydrophobicContact CB-CB 3.58Å; L155-A271 HydrophobicContact CD1-CB 4.33Å; L155-A271 HydrophobicContact CD2-CB 3.75Å; L155-A271 HydrophobicContact CG-CB 4.05Å
156	H	81.1	Confident	86.9	Confident	45 Å²	45	54.2 Å²	54.2	21%	0.208	30%	0.304	C	S	.	.	H	α-helix	trans	-109.4	-19.1	-170.1	-55.8	-51.9	0	0	0	114.2	D152 K158 D267	D152-H156 PolarHBondContact O-CD2 2.91Å; D152-H156 PolarHBondContact O-N 3.15Å; D152-H156 IonicContact OD1-CD2 2.76Å; D152-H156 PolarHBondContact OD1-CD2 3.05Å; D152-H156 VanDerWaalsContact OD1-CD2 3.3Å; D152-H156 IonicContact OD1-NE2 3.25Å; D152-H156 IonicContact OD2-CD2 3.65Å; H156-K158 PolarHBondContact O-N 2.91Å; H156-D267 IonicContact CE1-OD1 2.68Å; H156-D267 PolarHBondContact CE1-OD1 3.22Å; H156-D267 IonicContact NE2-OD1 2.71Å; H156-D267 PolarHBondContact NE2-OD1 2.99Å; H156-D267 IonicContact NE2-OD2 2.94Å
157	N	82.2	Confident	86.5	Confident	76 Å²	76	56 Å²	56	41%	0.406	31%	0.312	S	S	.	.			trans	-82.6	99.1	177.4	-168.4	-16.6	0	0	0	111.7	D153 A159 L160	D153-N157 WeakPolarHBondContact O-CA 3.28Å; D153-N157 WeakPolarHBondContact O-CB 3.44Å; D153-N157 PolarHBondContact O-N 2.9Å; N157-A159 PolarHBondContact O-N 3.42Å; N157-A159 VanDerWaalsContact OD1-CB 3.29Å; N157-A159 WeakPolarHBondContact OD1-CB 3.26Å; N157-A159 PolarHBondContact OD1-N 3.27Å; N157-L160 HydrophobicContact CB-CD1 4.06Å; N157-L160 HydrophobicContact CB-CG 4.16Å; N157-L160 PolarHBondContact O-N 2.92Å
158	K	74.8	Confident	86.2	Confident	183 Å²	183	53.6 Å²	53.6	80%	0.796	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-14.2	179	-62.8	-175.1	179.4	-177.9	0	114.8	H156 L160	H156-K158 PolarHBondContact O-N 2.91Å; K158-L160 VanDerWaalsContact C-N 3.29Å
159	A	83.1	Confident	85.8	Confident	91 Å²	91	52.2 Å²	52.2	75%	0.752	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-17	174.9	0	0	0	0	0	112.8	N157	N157-A159 PolarHBondContact O-N 3.42Å; N157-A159 VanDerWaalsContact OD1-CB 3.29Å; N157-A159 WeakPolarHBondContact OD1-CB 3.26Å; N157-A159 PolarHBondContact OD1-N 3.27Å
160	L	82.7	Confident	85.7	Confident	71 Å²	71	58.6 Å²	58.6	37%	0.372	30%	0.299	S	S	.	.	S	Bend	trans	-92.8	149.5	178	-56.5	178.6	0	0	0	110.6	R154 N157 K158	R154-L160 VanDerWaalsContact NH1-CB 3.25Å; N157-L160 HydrophobicContact CB-CD1 4.06Å; N157-L160 HydrophobicContact CB-CG 4.16Å; N157-L160 PolarHBondContact O-N 2.92Å; K158-L160 VanDerWaalsContact C-N 3.29Å
161	K	83.2	Confident	85.7	Confident	160 Å²	160	58.1 Å²	58.1	70%	0.696	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-56	127.9	173.7	-178.2	-170.2	174.2	-166.7	0	109.3	R154	R154-K161 PolarHBondContact NH1-O 2.89Å; R154-K161 PolarHBondContact NH2-O 3.34Å
162	P	81.5	Confident	85.7	Confident	60 Å²	60	58.1 Å²	58.1	39%	0.39	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-57.9	148.3	176.8	-25.7	35	0	0	0	112.6	C307	P162-C307 HydrophobicContact CB-CB 4.14Å; P162-C307 HydrophobicContact CG-CB 4.03Å
163	L	86.4	Confident	85.9	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-73	129.9	169.7	-66.7	170	0	0	0	109.5	L151 R154 L155 E167 R168 I171 L206	L151-L163 HydrophobicContact CD1-CD1 3.84Å; R154-L163 HydrophobicContact CB-CD1 3.85Å; R154-L163 HydrophobicContact CB-CG 4.2Å; L155-L163 HydrophobicContact CD2-CD1 4.3Å; L163-E167 HydrophobicContact CD2-CB 4.28Å; L163-R168 HydrophobicContact CB-CG 3.81Å; L163-R168 HydrophobicContact CD1-CG 4.45Å; L163-R168 PolarHBondContact O-NE 2.92Å; L163-R168 PolarHBondContact O-NH2 3Å; L163-I171 HydrophobicContact CD1-CD1 3.78Å; L163-I171 HydrophobicContact CD2-CD1 4.16Å; L163-L206 HydrophobicContact CD2-CD1 3.9Å; L163-L206 HydrophobicContact CD2-CD2 4.13Å
164	S	83.7	Confident	86.3	Confident	35 Å²	35	53 Å²	53	25%	0.245	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-67.6	159.4	171	64.8	0	0	0	0	111.3	T166 E167 R168	S164-T166 VanDerWaalsContact C-N 3.29Å; S164-T166 PolarHBondContact O-N 3.34Å; S164-E167 WeakPolarHBondContact CB-OE2 3.35Å; S164-E167 PolarHBondContact N-OE2 3.26Å; S164-E167 PolarHBondContact O-N 2.93Å; S164-E167 VanDerWaalsContact O-N 3.13Å; S164-E167 VanDerWaalsContact OG-CG 3.25Å; S164-E167 WeakPolarHBondContact OG-CG 3.48Å; S164-E167 PolarHBondContact OG-N 3.46Å; S164-E167 PolarHBondContact OG-OE2 2.99Å; S164-R168 WeakPolarHBondContact O-CG 3.45Å; S164-R168 PolarHBondContact O-N 3.11Å
165	W	81.6	Confident	86.8	Confident	25 Å²	25	51.8 Å²	51.8	10%	0.095	26%	0.264	C	S	.	.	H	α-helix	trans	-54.6	-43.6	177.2	-174.6	-110.5	0	0	0	113.6	E167 R168 Q169 Y269 A308 I318 Y319 F322	W165-E167 VanDerWaalsContact C-N 3.33Å; W165-E167 PolarHBondContact O-N 2.95Å; W165-R168 PolarHBondContact O-N 3.43Å; W165-Q169 WeakPolarHBondContact O-CB 3.37Å; W165-Q169 PolarHBondContact O-N 3.48Å; W165-Y269 HydrophobicContact CE3-CD1 4.35Å; W165-Y269 HydrophobicContact CE3-CE1 4.21Å; W165-Y269 AromaticContact CH2-CD1 3.29Å; W165-Y269 HydrophobicContact CH2-CD1 3.29Å; W165-Y269 AromaticContact CH2-CE1 2.98Å; W165-Y269 HydrophobicContact CH2-CE1 2.98Å; W165-Y269 HydrophobicContact CH2-CG 4.31Å; W165-Y269 AromaticContact CH2-CZ 3.84Å; W165-Y269 AromaticContact CZ2-CE1 3.95Å; W165-Y269 HydrophobicContact CZ2-CE1 3.95Å; W165-Y269 AromaticContact CZ3-CD1 3.17Å; W165-Y269 HydrophobicContact CZ3-CD1 3.17Å; W165-Y269 AromaticContact CZ3-CE1 3.17Å; W165-Y269 HydrophobicContact CZ3-CE1 3.17Å; W165-Y269 HydrophobicContact CZ3-CG 4.37Å; W165-A308 PolarHBondContact N-O 2.79Å; W165-I318 HydrophobicContact CZ2-CG2 4Å; W165-Y319 AromaticContact CH2-CD2 3.65Å; W165-Y319 HydrophobicContact CH2-CD2 3.65Å; W165-Y319 HydrophobicContact CH2-CG 4.31Å; W165-Y319 AromaticContact CZ3-CD2 3.83Å; W165-Y319 HydrophobicContact CZ3-CD2 3.83Å; W165-F322 HydrophobicContact CZ2-CD2 4.34Å; W165-F322 HydrophobicContact CZ2-CG 4.45Å
166	T	84.3	Confident	87.4	Confident	78 Å²	78	51.3 Å²	51.3	48%	0.479	26%	0.262	S	S	.	.	H	α-helix	trans	-64.6	-37.4	179.2	-54.4	0	0	0	0	112.1	S164 R170	S164-T166 VanDerWaalsContact C-N 3.29Å; S164-T166 PolarHBondContact O-N 3.34Å; T166-R170 WeakPolarHBondContact O-CG 3.37Å; T166-R170 PolarHBondContact O-N 3.27Å; T166-R170 VanDerWaalsContact O-N 3.09Å
167	E	88.7	Confident	88.2	Confident	50 Å²	50	54.1 Å²	54.1	23%	0.234	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-46.2	174.3	-71.9	161.5	150.6	0	0	110.8	L163 S164 W165 Q169 R170 I171 L206	L163-E167 HydrophobicContact CD2-CB 4.28Å; S164-E167 WeakPolarHBondContact CB-OE2 3.35Å; S164-E167 PolarHBondContact N-OE2 3.26Å; S164-E167 PolarHBondContact O-N 2.93Å; S164-E167 VanDerWaalsContact O-N 3.13Å; S164-E167 VanDerWaalsContact OG-CG 3.25Å; S164-E167 WeakPolarHBondContact OG-CG 3.48Å; S164-E167 PolarHBondContact OG-N 3.46Å; S164-E167 PolarHBondContact OG-OE2 2.99Å; W165-E167 VanDerWaalsContact C-N 3.33Å; W165-E167 PolarHBondContact O-N 2.95Å; E167-Q169 PolarHBondContact O-N 3.42Å; E167-R170 PolarHBondContact O-N 3.28Å; E167-I171 WeakPolarHBondContact O-CD1 3.45Å; E167-I171 VanDerWaalsContact O-CG1 3.26Å; E167-I171 WeakPolarHBondContact O-CG1 3.46Å; E167-I171 PolarHBondContact O-N 3.49Å; E167-L206 HydrophobicContact CB-CD1 4.46Å; E167-L206 HydrophobicContact CG-CD1 3.97Å; E167-L206 VanDerWaalsContact OE1-CD1 3.3Å; E167-L206 WeakPolarHBondContact OE1-CD1 3.38Å
168	R	88.3	Confident	89	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-43.9	176.5	-64	-172.1	-160.1	-161.6	-1.5	112.2	L163 S164 W165 R170 I171 V172 E268 D305	L163-R168 HydrophobicContact CB-CG 3.81Å; L163-R168 HydrophobicContact CD1-CG 4.45Å; L163-R168 PolarHBondContact O-NE 2.92Å; L163-R168 PolarHBondContact O-NH2 3Å; S164-R168 WeakPolarHBondContact O-CG 3.45Å; S164-R168 PolarHBondContact O-N 3.11Å; W165-R168 PolarHBondContact O-N 3.43Å; R168-R170 VanDerWaalsContact C-N 3.34Å; R168-R170 PolarHBondContact O-N 2.81Å; R168-I171 PolarHBondContact O-N 2.71Å; R168-V172 WeakPolarHBondContact O-CB 3.48Å; R168-V172 WeakPolarHBondContact O-CG2 3.18Å; R168-V172 PolarHBondContact O-N 3.28Å; R168-E268 VanDerWaalsContact CB-OE2 3.27Å; R168-E268 WeakPolarHBondContact CB-OE2 3.36Å; R168-E268 WeakPolarHBondContact CD-OE2 3.2Å; R168-E268 WeakPolarHBondContact CG-OE2 3.39Å; R168-E268 PolarHBondContact NH1-O 2.93Å; R168-D305 IonicContact CZ-OD2 3.07Å; R168-D305 IonicContact NH1-OD2 2.68Å; R168-D305 PolarHBondContact NH1-OD2 3.36Å; R168-D305 IonicContact NH2-OD2 2.72Å; R168-D305 PolarHBondContact NH2-OD2 2.83Å
169	Q	87	Confident	90.1	Very high	25 Å²	25	41.8 Å²	41.8	12%	0.117	21%	0.213	C	C	.	.	H	α-helix	trans	-58.7	-45.2	175.3	170.3	166.6	7.3	0	0	111.8	W165 E167 T173 F322	W165-Q169 WeakPolarHBondContact O-CB 3.37Å; W165-Q169 PolarHBondContact O-N 3.48Å; E167-Q169 PolarHBondContact O-N 3.42Å; Q169-T173 WeakPolarHBondContact O-CB 3.48Å; Q169-T173 PolarHBondContact O-N 3.15Å; Q169-T173 PolarHBondContact O-OG1 3.44Å; Q169-F322 HydrophobicContact CB-CZ 4.26Å; Q169-F322 HydrophobicContact CG-CZ 3.76Å
170	R	91.3	Very high	90.7	Very high	161 Å²	161	38.7 Å²	38.7	61%	0.608	18%	0.184	S	C	*	.	H	α-helix	trans	-63.4	-44	176.9	-73.7	175.6	178.9	-179.6	0.2	111.8	T166 E167 R168 T173 G174	T166-R170 WeakPolarHBondContact O-CG 3.37Å; T166-R170 PolarHBondContact O-N 3.27Å; T166-R170 VanDerWaalsContact O-N 3.09Å; E167-R170 PolarHBondContact O-N 3.28Å; R168-R170 VanDerWaalsContact C-N 3.34Å; R168-R170 PolarHBondContact O-N 2.81Å; R170-T173 PolarHBondContact O-N 2.83Å; R170-G174 PolarHBondContact O-N 3.39Å
171	I	94.4	Very high	91.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.4	-52.9	177.9	-71.3	163.4	0	0	0	110.3	L151 L163 E167 R168 T173 G174 I175 L202 L206 P208 E268	L151-I171 HydrophobicContact CD1-CD1 4.48Å; L151-I171 HydrophobicContact CD1-CG2 4.21Å; L151-I171 HydrophobicContact CD2-CG2 4.15Å; L163-I171 HydrophobicContact CD1-CD1 3.78Å; L163-I171 HydrophobicContact CD2-CD1 4.16Å; E167-I171 WeakPolarHBondContact O-CD1 3.45Å; E167-I171 VanDerWaalsContact O-CG1 3.26Å; E167-I171 WeakPolarHBondContact O-CG1 3.46Å; E167-I171 PolarHBondContact O-N 3.49Å; R168-I171 PolarHBondContact O-N 2.71Å; I171-T173 VanDerWaalsContact C-N 3.34Å; I171-T173 PolarHBondContact O-N 2.94Å; I171-G174 PolarHBondContact O-N 2.71Å; I171-G174 VanDerWaalsContact O-N 3.14Å; I171-I175 HydrophobicContact CG2-CD1 3.77Å; I171-I175 HydrophobicContact CG2-CG1 4.41Å; I171-I175 VanDerWaalsContact O-CG1 3.28Å; I171-I175 WeakPolarHBondContact O-CG1 3.21Å; I171-I175 PolarHBondContact O-N 3.25Å; I171-L202 HydrophobicContact CD1-CD1 4Å; I171-L202 HydrophobicContact CD1-CD2 4.1Å; I171-L202 HydrophobicContact CG1-CD2 4.04Å; I171-L202 HydrophobicContact CG2-CD2 4.27Å; I171-L206 WeakPolarHBondContact CG1-O 3.05Å; I171-P208 HydrophobicContact CG2-CB 4.14Å; I171-P208 WeakPolarHBondContact O-CG 3.22Å; I171-E268 WeakPolarHBondContact CG2-OE1 3.44Å
172	V	93.2	Very high	91.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.4	-45.1	179.3	163.3	0	0	0	0	112.2	R168 G174 I175 C176 F261 L265 E268 F322 L347	R168-V172 WeakPolarHBondContact O-CB 3.48Å; R168-V172 WeakPolarHBondContact O-CG2 3.18Å; R168-V172 PolarHBondContact O-N 3.28Å; V172-G174 VanDerWaalsContact C-N 3.34Å; V172-G174 PolarHBondContact O-N 2.92Å; V172-I175 PolarHBondContact O-N 3.05Å; V172-C176 WeakPolarHBondContact O-CB 3.4Å; V172-C176 PolarHBondContact O-N 2.97Å; V172-F261 HydrophobicContact CG1-CE2 4.26Å; V172-F261 HydrophobicContact CG1-CZ 3.88Å; V172-L265 HydrophobicContact CB-CD2 4.29Å; V172-L265 HydrophobicContact CG1-CD2 3.26Å; V172-L265 HydrophobicContact CG1-CG 4.12Å; V172-L265 HydrophobicContact CG2-CD2 4.03Å; V172-E268 HydrophobicContact CG2-CG 4.18Å; V172-F322 HydrophobicContact CB-CE1 4.4Å; V172-F322 HydrophobicContact CG1-CD1 4.22Å; V172-F322 HydrophobicContact CG1-CE1 3.85Å; V172-L347 HydrophobicContact CG1-CD1 4.18Å; V172-L347 HydrophobicContact CG1-CD2 4.15Å
173	T	94.8	Very high	92.5	Very high	11 Å²	11	28.4 Å²	28.4	7%	0.067	13%	0.131	C	C	.	.	H	α-helix	trans	-62.5	-42.4	177.2	-63	0	0	0	0	111.2	Q169 R170 I171 C176 R177 L344 E348	Q169-T173 WeakPolarHBondContact O-CB 3.48Å; Q169-T173 PolarHBondContact O-N 3.15Å; Q169-T173 PolarHBondContact O-OG1 3.44Å; R170-T173 PolarHBondContact O-N 2.83Å; I171-T173 VanDerWaalsContact C-N 3.34Å; I171-T173 PolarHBondContact O-N 2.94Å; T173-C176 WeakPolarHBondContact O-CB 3.46Å; T173-C176 PolarHBondContact O-N 3.45Å; T173-R177 WeakPolarHBondContact O-CG 2.78Å; T173-R177 PolarHBondContact O-N 3.38Å; T173-L344 HydrophobicContact CG2-CD1 4Å; T173-E348 HydrophobicContact CG2-CG 4.13Å
174	G	97.5	Very high	92.7	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-62.7	-43.6	175.6	0	0	0	0	0	113	N125 R170 I171 V172 C176 R177 G178	N125-G174 WeakPolarHBondContact CB-O 3.23Å; N125-G174 WeakPolarHBondContact ND2-CA 3.46Å; N125-G174 PolarHBondContact OD1-O 3.05Å; R170-G174 PolarHBondContact O-N 3.39Å; I171-G174 PolarHBondContact O-N 2.71Å; I171-G174 VanDerWaalsContact O-N 3.14Å; V172-G174 VanDerWaalsContact C-N 3.34Å; V172-G174 PolarHBondContact O-N 2.92Å; G174-C176 VanDerWaalsContact C-N 3.31Å; G174-C176 PolarHBondContact O-N 3.25Å; G174-R177 PolarHBondContact O-N 3.07Å; G174-G178 PolarHBondContact O-N 2.7Å
175	I	98	Very high	92.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.6	-46.4	173.8	-61.3	161.1	0	0	0	110	L151 I171 V172 R177 G178 L179 I200 P208 I210 F261 V264	L151-I175 HydrophobicContact CD2-CD1 4.14Å; I171-I175 HydrophobicContact CG2-CD1 3.77Å; I171-I175 HydrophobicContact CG2-CG1 4.41Å; I171-I175 VanDerWaalsContact O-CG1 3.28Å; I171-I175 WeakPolarHBondContact O-CG1 3.21Å; I171-I175 PolarHBondContact O-N 3.25Å; V172-I175 PolarHBondContact O-N 3.05Å; I175-R177 PolarHBondContact O-N 2.78Å; I175-G178 PolarHBondContact O-N 3.12Å; I175-L179 HydrophobicContact CG2-CD1 3.93Å; I175-L179 HydrophobicContact CG2-CG 4.34Å; I175-L179 WeakPolarHBondContact O-CG 3.45Å; I175-L179 PolarHBondContact O-N 2.81Å; I175-I200 HydrophobicContact CD1-CB 4.44Å; I175-I200 HydrophobicContact CD1-CD1 4.36Å; I175-I200 HydrophobicContact CD1-CG1 3.92Å; I175-I200 HydrophobicContact CD1-CG2 3.84Å; I175-I200 HydrophobicContact CG1-CD1 4.09Å; I175-I200 HydrophobicContact CG1-CG1 4.15Å; I175-I200 HydrophobicContact CG1-CG2 3.79Å; I175-I200 HydrophobicContact CG2-CD1 4.07Å; I175-P208 HydrophobicContact CG1-CB 3.97Å; I175-P208 HydrophobicContact CG1-CG 4.39Å; I175-I210 HydrophobicContact CG2-CG1 4.49Å; I175-F261 HydrophobicContact CB-CD2 4.43Å; I175-F261 HydrophobicContact CB-CE2 4.1Å; I175-F261 HydrophobicContact CG2-CD2 3.72Å; I175-F261 HydrophobicContact CG2-CE2 3.9Å; I175-V264 HydrophobicContact CD1-CG1 4.21Å
176	C	97.9	Very high	93	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.3	-43.6	179.2	-165.2	0	0	0	0	111.8	V172 T173 G174 L179 N180 F261 L344 L347	V172-C176 WeakPolarHBondContact O-CB 3.4Å; V172-C176 PolarHBondContact O-N 2.97Å; T173-C176 WeakPolarHBondContact O-CB 3.46Å; T173-C176 PolarHBondContact O-N 3.45Å; G174-C176 VanDerWaalsContact C-N 3.31Å; G174-C176 PolarHBondContact O-N 3.25Å; C176-L179 PolarHBondContact O-N 3.08Å; C176-N180 WeakPolarHBondContact O-CB 3.41Å; C176-N180 PolarHBondContact O-N 3.17Å; C176-F261 HydrophobicContact CB-CE1 4.35Å; C176-F261 HydrophobicContact CB-CE2 3.98Å; C176-F261 HydrophobicContact CB-CZ 3.67Å; C176-L344 HydrophobicContact CB-CD1 4.23Å; C176-L347 HydrophobicContact CB-CD1 3.71Å
177	R	98.1	Very high	92.9	Very high	105 Å²	105	38 Å²	38	40%	0.396	19%	0.187	S	C	.	.	H	α-helix	trans	-59.7	-47.3	175	-71.6	175.1	-177.6	152.9	-0.2	112	T173 G174 I175 N180 F181 L344 E348	T173-R177 WeakPolarHBondContact O-CG 2.78Å; T173-R177 PolarHBondContact O-N 3.38Å; G174-R177 PolarHBondContact O-N 3.07Å; I175-R177 PolarHBondContact O-N 2.78Å; R177-N180 PolarHBondContact O-N 3.34Å; R177-F181 WeakPolarHBondContact O-CB 3.47Å; R177-F181 PolarHBondContact O-N 3.43Å; R177-L344 HydrophobicContact CG-CD1 3.58Å; R177-L344 HydrophobicContact CG-CD2 3.82Å; R177-L344 HydrophobicContact CG-CG 4.37Å; R177-E348 IonicContact CZ-OE1 3.53Å; R177-E348 VanDerWaalsContact CZ-OE1 3.25Å; R177-E348 IonicContact NE-OE1 2.75Å; R177-E348 PolarHBondContact NE-OE1 3.29Å; R177-E348 IonicContact NH2-OE1 3.24Å; R177-E348 PolarHBondContact NH2-OE1 3.41Å
178	G	97.9	Very high	92.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.1	-46.1	178.7	0	0	0	0	0	112.9	G174 I175 F181 L182	G174-G178 PolarHBondContact O-N 2.7Å; I175-G178 PolarHBondContact O-N 3.12Å; G178-F181 PolarHBondContact O-N 3.47Å; G178-L182 WeakPolarHBondContact O-CG 2.97Å; G178-L182 PolarHBondContact O-N 2.87Å; G178-L182 VanDerWaalsContact O-N 3.15Å
179	L	98	Very high	92.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-69.3	-39	177.3	-66.8	175.1	0	0	0	112.2	I175 C176 F181 L182 H183 H192 V195 I210 F261 L340	I175-L179 HydrophobicContact CG2-CD1 3.93Å; I175-L179 HydrophobicContact CG2-CG 4.34Å; I175-L179 WeakPolarHBondContact O-CG 3.45Å; I175-L179 PolarHBondContact O-N 2.81Å; C176-L179 PolarHBondContact O-N 3.08Å; L179-F181 VanDerWaalsContact C-N 3.29Å; L179-F181 PolarHBondContact O-N 3.44Å; L179-L182 HydrophobicContact CD2-CD1 4.23Å; L179-L182 WeakPolarHBondContact O-CB 3.29Å; L179-L182 PolarHBondContact O-N 3.03Å; L179-H183 PolarHBondContact O-CD2 3.32Å; L179-H183 PolarHBondContact O-N 3.35Å; L179-H192 HydrophobicContact CD2-CB 4.32Å; L179-V195 HydrophobicContact CD1-CG1 4.12Å; L179-V195 HydrophobicContact CD1-CG2 4.24Å; L179-V195 HydrophobicContact CD2-CG2 3.67Å; L179-I210 HydrophobicContact CD2-CD1 3.84Å; L179-I210 HydrophobicContact CG-CD1 3.73Å; L179-F261 HydrophobicContact CD1-CB 3.85Å; L179-F261 HydrophobicContact CD1-CD2 4Å; L179-F261 HydrophobicContact CD1-CG 4.19Å; L179-L340 VanDerWaalsContact C-CD1 3.47Å; L179-L340 HydrophobicContact CB-CD1 3.31Å
180	N	97.1	Very high	92.8	Very high	25 Å²	25	38 Å²	38	13%	0.134	19%	0.19	C	C	.	.	H	α-helix	trans	-61.7	-41	175.8	-173.9	55.2	0	0	0	111.1	C176 R177 H183 T184 L340 S341	C176-N180 WeakPolarHBondContact O-CB 3.41Å; C176-N180 PolarHBondContact O-N 3.17Å; R177-N180 PolarHBondContact O-N 3.34Å; N180-H183 PolarHBondContact O-N 3.2Å; N180-T184 WeakPolarHBondContact O-CB 3.46Å; N180-T184 WeakPolarHBondContact O-CG2 3.36Å; N180-T184 PolarHBondContact O-N 3.01Å; N180-T184 VanDerWaalsContact O-N 3.12Å; N180-T184 PolarHBondContact O-OG1 3.04Å; N180-L340 HydrophobicContact CB-CB 3.81Å; N180-S341 PolarHBondContact ND2-OG 2.7Å; N180-S341 WeakPolarHBondContact OD1-CA 3.34Å; N180-S341 PolarHBondContact OD1-N 2.67Å; N180-S341 PolarHBondContact OD1-OG 2.96Å
181	F	96.6	Very high	92.9	Very high	51 Å²	51	30.5 Å²	30.5	22%	0.224	16%	0.162	C	C	.	.	H	α-helix	trans	-58.1	-48.2	172.9	168.8	-99.5	0	0	0	111.2	R122 H123 I126 R177 G178 L179 H183 T184 C185	R122-F181 WeakPolarHBondContact O-CZ 3.46Å; H123-F181 HydrophobicContact CB-CD1 3.64Å; H123-F181 HydrophobicContact CB-CE1 3.84Å; H123-F181 HydrophobicContact CB-CG 4.05Å; H123-F181 HydrophobicContact CB-CZ 4.44Å; H123-F181 AromaticContact CD2-CD2 3.91Å; H123-F181 AromaticContact CD2-CG 3.66Å; H123-F181 AromaticContact CG-CD1 3.98Å; H123-F181 AromaticContact CG-CG 3.91Å; I126-F181 HydrophobicContact CD1-CD1 3.67Å; I126-F181 HydrophobicContact CD1-CE1 3.88Å; R177-F181 WeakPolarHBondContact O-CB 3.47Å; R177-F181 PolarHBondContact O-N 3.43Å; G178-F181 PolarHBondContact O-N 3.47Å; L179-F181 VanDerWaalsContact C-N 3.29Å; L179-F181 PolarHBondContact O-N 3.44Å; F181-H183 PolarHBondContact O-N 2.93Å; F181-T184 PolarHBondContact O-N 2.64Å; F181-T184 VanDerWaalsContact O-N 3.07Å; F181-C185 HydrophobicContact CD1-CB 4.42Å; F181-C185 HydrophobicContact CD2-CB 3.89Å; F181-C185 HydrophobicContact CE1-CB 4.14Å; F181-C185 HydrophobicContact CE2-CB 3.55Å; F181-C185 HydrophobicContact CG-CB 4.32Å; F181-C185 HydrophobicContact CZ-CB 3.69Å; F181-C185 WeakPolarHBondContact O-CB 3.48Å; F181-C185 PolarHBondContact O-N 2.98Å; F181-C185 PolarHBondContact O-SG 3.27Å; F181-C185 VanDerWaalsContact O-SG 3.36Å
182	L	94.1	Very high	92.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.8	-37	177.4	-68.5	173.8	0	0	0	113	I126 G178 L179 T184 L190 H192 F213	I126-L182 HydrophobicContact CD1-CD1 4.49Å; I126-L182 HydrophobicContact CD1-CD2 3.6Å; I126-L182 HydrophobicContact CD1-CG 3.94Å; G178-L182 WeakPolarHBondContact O-CG 2.97Å; G178-L182 PolarHBondContact O-N 2.87Å; G178-L182 VanDerWaalsContact O-N 3.15Å; L179-L182 HydrophobicContact CD2-CD1 4.23Å; L179-L182 WeakPolarHBondContact O-CB 3.29Å; L179-L182 PolarHBondContact O-N 3.03Å; L182-T184 VanDerWaalsContact C-N 3.32Å; L182-L190 HydrophobicContact CB-CB 4.14Å; L182-L190 HydrophobicContact CD2-CB 4.3Å; L182-L190 HydrophobicContact CD2-CD1 3.96Å; L182-L190 WeakPolarHBondContact O-CB 3.23Å; L182-L190 PolarHBondContact O-N 2.81Å; L182-H192 HydrophobicContact CD1-CB 4.49Å; L182-F213 HydrophobicContact CD1-CE1 3.67Å; L182-F213 HydrophobicContact CD1-CZ 4.28Å; L182-F213 HydrophobicContact CD2-CE1 3.94Å; L182-F213 HydrophobicContact CG-CE1 4.44Å
183	H	93.4	Very high	92.9	Very high	25 Å²	25	31 Å²	31	12%	0.116	17%	0.167	C	C	.	.	H	α-helix	trans	-75.9	-19.6	179.9	-70.1	-170.2	0	0	0	113.3	L179 N180 F181 P189 L190 S254 D257 L340	L179-H183 PolarHBondContact O-CD2 3.32Å; L179-H183 PolarHBondContact O-N 3.35Å; N180-H183 PolarHBondContact O-N 3.2Å; F181-H183 PolarHBondContact O-N 2.93Å; H183-P189 HydrophobicContact CB-CB 4.41Å; H183-P189 WeakPolarHBondContact O-CB 3.39Å; H183-L190 PolarHBondContact CD2-O 2.76Å; H183-L190 VanDerWaalsContact CD2-O 3.28Å; H183-S254 PolarHBondContact CE1-O 3.38Å; H183-D257 IonicContact CD2-OD2 2.8Å; H183-D257 IonicContact CE1-OD2 3.18Å; H183-D257 IonicContact NE2-OD2 2.86Å; H183-D257 PolarHBondContact NE2-OD2 3.25Å; H183-L340 VanDerWaalsContact CE1-CD1 3.48Å; H183-L340 WeakPolarHBondContact CE1-CD1 3.4Å; H183-L340 WeakPolarHBondContact ND1-CD1 3.34Å
184	T	91.5	Very high	92.9	Very high	82 Å²	82	30.9 Å²	30.9	50%	0.503	17%	0.166	S	C	.	.	H	α-helix	trans	-122.7	-9.7	-170	59.2	0	0	0	0	114.6	N180 F181 L182 S186	N180-T184 WeakPolarHBondContact O-CB 3.46Å; N180-T184 WeakPolarHBondContact O-CG2 3.36Å; N180-T184 PolarHBondContact O-N 3.01Å; N180-T184 VanDerWaalsContact O-N 3.12Å; N180-T184 PolarHBondContact O-OG1 3.04Å; F181-T184 PolarHBondContact O-N 2.64Å; F181-T184 VanDerWaalsContact O-N 3.07Å; L182-T184 VanDerWaalsContact C-N 3.32Å; T184-S186 PolarHBondContact O-N 3.15Å; T184-S186 VanDerWaalsContact O-N 3.17Å
185	C	87.5	Confident	92.8	Very high	41 Å²	41	30.9 Å²	30.9	28%	0.277	17%	0.166	S	C	.	.	S	Bend	trans	-71.4	-8.8	-174.5	63.7	0	0	0	0	114.8	Y121 F181	Y121-C185 HydrophobicContact CD1-CB 4.28Å; Y121-C185 VanDerWaalsContact CD1-SG 3.52Å; Y121-C185 HydrophobicContact CE1-CB 4.48Å; Y121-C185 VanDerWaalsContact CE1-SG 3.57Å; F181-C185 HydrophobicContact CD1-CB 4.42Å; F181-C185 HydrophobicContact CD2-CB 3.89Å; F181-C185 HydrophobicContact CE1-CB 4.14Å; F181-C185 HydrophobicContact CE2-CB 3.55Å; F181-C185 HydrophobicContact CG-CB 4.32Å; F181-C185 HydrophobicContact CZ-CB 3.69Å; F181-C185 WeakPolarHBondContact O-CB 3.48Å; F181-C185 PolarHBondContact O-N 2.98Å; F181-C185 PolarHBondContact O-SG 3.27Å; F181-C185 VanDerWaalsContact O-SG 3.36Å
186	S	83.5	Confident	92.7	Very high	40 Å²	40	32.5 Å²	32.5	28%	0.28	17%	0.173	S	C	.	.	S	Bend	trans	-150.1	163.9	179.8	44.1	0	0	0	0	111.1	T184 Q188	T184-S186 PolarHBondContact O-N 3.15Å; T184-S186 VanDerWaalsContact O-N 3.17Å; S186-Q188 PolarHBondContact O-N 3.43Å; S186-Q188 VanDerWaalsContact O-N 3.08Å; S186-Q188 PolarHBondContact OG-O 3.42Å
187	D	81.2	Confident	92.4	Very high	178 Å²	178	32.6 Å²	32.6	95%	0.952	17%	0.173	S	C	*	.	S	Bend	trans	-55.5	-28.6	177.8	-59	-30.1	0	0	0	113
188	Q	82.9	Confident	92.2	Very high	45 Å²	45	29.5 Å²	29.5	21%	0.21	17%	0.171	C	C	.	.	S	Bend	trans	-109.2	132.8	170.9	-68.1	-173.7	-22.2	0	0	110.1	S186 G219	S186-Q188 PolarHBondContact O-N 3.43Å; S186-Q188 VanDerWaalsContact O-N 3.08Å; S186-Q188 PolarHBondContact OG-O 3.42Å; Q188-G219 WeakPolarHBondContact CB-O 3.43Å; Q188-G219 WeakPolarHBondContact CG-O 3.45Å; Q188-G219 PolarHBondContact NE2-O 3.47Å; Q188-G219 PolarHBondContact OE1-O 2.77Å
189	P	88.9	Confident	92	Very high	34 Å²	34	30.3 Å²	30.3	22%	0.221	18%	0.175	C	C	.	.			trans	-67.1	139.6	178.1	26.9	-33.9	0	0	0	110.8	H183 G219	H183-P189 HydrophobicContact CB-CB 4.41Å; H183-P189 WeakPolarHBondContact O-CB 3.39Å; P189-G219 PolarHBondContact O-N 3.21Å
190	L	90.8	Very high	92	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	113.1	167.6	-60.7	173.7	0	0	0	109	I117 Y121 L182 H183 T218	I117-L190 HydrophobicContact CD1-CD1 4.29Å; I117-L190 HydrophobicContact CD1-CD2 3.92Å; Y121-L190 HydrophobicContact CD1-CD1 3.99Å; Y121-L190 HydrophobicContact CD2-CD1 3.54Å; Y121-L190 HydrophobicContact CE1-CD1 3.92Å; Y121-L190 HydrophobicContact CE2-CD1 3.49Å; Y121-L190 VanDerWaalsContact CE2-CD1 3.49Å; Y121-L190 HydrophobicContact CE2-CD2 4.37Å; Y121-L190 HydrophobicContact CE2-CG 4.49Å; Y121-L190 HydrophobicContact CG-CD1 3.8Å; L182-L190 HydrophobicContact CB-CB 4.14Å; L182-L190 HydrophobicContact CD2-CB 4.3Å; L182-L190 HydrophobicContact CD2-CD1 3.96Å; L182-L190 WeakPolarHBondContact O-CB 3.23Å; L182-L190 PolarHBondContact O-N 2.81Å; H183-L190 PolarHBondContact CD2-O 2.76Å; H183-L190 VanDerWaalsContact CD2-O 3.28Å; L190-T218 HydrophobicContact CD2-CG2 3.7Å
191	I	93.1	Very high	92	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.015	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	116.8	178.3	-53.7	169.8	0	0	0	106.9	C216 R217 F230 V252 S253 L256 D257	I191-C216 CarbonylContact O-C 3.55Å; I191-C216 WeakPolarHBondContact O-CA 3.28Å; I191-C216 PolarHBondContact O-SG 3.08Å; I191-C216 VanDerWaalsContact O-SG 3.39Å; I191-R217 PolarHBondContact N-O 2.81Å; I191-R217 PolarHBondContact O-N 3.36Å; I191-F230 HydrophobicContact CD1-CE1 4.1Å; I191-V252 HydrophobicContact CD1-CG1 3.67Å; I191-V252 HydrophobicContact CG2-CG1 4.2Å; I191-S253 VanDerWaalsContact CD1-C 3.44Å; I191-L256 HydrophobicContact CG2-CB 4.41Å; I191-D257 VanDerWaalsContact CA-OD2 3.29Å; I191-D257 WeakPolarHBondContact CA-OD2 3.48Å
192	H	94.7	Very high	92	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.169	C	C	.	.			trans	-63.7	-49.1	-178.4	-175.7	-85.4	0	0	0	111.5	L179 L182 D194 V195 G211 D212 F213 L215 C216 D257	L179-H192 HydrophobicContact CD2-CB 4.32Å; L182-H192 HydrophobicContact CD1-CB 4.49Å; H192-D194 VanDerWaalsContact C-N 3.31Å; H192-D194 PolarHBondContact CE1-O 3.36Å; H192-D194 VanDerWaalsContact ND1-C 3.32Å; H192-D194 PolarHBondContact ND1-N 2.78Å; H192-D194 PolarHBondContact O-N 2.75Å; H192-V195 HydrophobicContact CB-CG2 3.78Å; H192-V195 PolarHBondContact ND1-N 3.13Å; H192-G211 PolarHBondContact CE1-O 2.77Å; H192-G211 PolarHBondContact NE2-O 2.86Å; H192-D212 PolarHBondContact CE1-O 3.25Å; H192-D212 PolarHBondContact NE2-O 3.42Å; H192-F213 AromaticContact CD2-CD1 3.68Å; H192-F213 AromaticContact CD2-CE1 3.64Å; H192-L215 CarbonylContact O-C 3.5Å; H192-C216 WeakPolarHBondContact O-CA 3.48Å; H192-C216 PolarHBondContact O-N 3.48Å; H192-D257 PolarHBondContact N-OD1 2.71Å; H192-D257 PolarHBondContact N-OD2 3.15Å
193	G	93.3	Very high	92.1	Very high	10 Å²	10	29.4 Å²	29.4	10%	0.103	17%	0.172	C	C	.	.	S	Bend	trans	85.6	-17.8	171.5	0	0	0	0	0	116.3	D257	G193-D257 PolarHBondContact N-OD1 3.18Å
194	D	94.4	Very high	92.2	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.043	19%	0.192	C	C	.	.			trans	-138.7	50.1	174.8	-162.7	37.6	0	0	0	112.5	H192 K196 N199 L215 G237 T238	H192-D194 VanDerWaalsContact C-N 3.31Å; H192-D194 PolarHBondContact CE1-O 3.36Å; H192-D194 VanDerWaalsContact ND1-C 3.32Å; H192-D194 PolarHBondContact ND1-N 2.78Å; H192-D194 PolarHBondContact O-N 2.75Å; D194-K196 PolarHBondContact O-N 3.44Å; D194-K196 IonicContact OD1-NZ 2.94Å; D194-K196 VanDerWaalsContact OD2-CE 3.28Å; D194-K196 WeakPolarHBondContact OD2-CE 3.4Å; D194-K196 IonicContact OD2-NZ 3.6Å; D194-K196 PolarHBondContact OD2-NZ 3.29Å; D194-N199 PolarHBondContact O-ND2 3.31Å; D194-N199 PolarHBondContact OD2-ND2 3.27Å; D194-L215 HydrophobicContact CB-CD1 3.91Å; D194-G237 VanDerWaalsContact OD1-CA 3.32Å; D194-G237 WeakPolarHBondContact OD1-CA 3.41Å; D194-T238 WeakPolarHBondContact OD1-CB 3.45Å; D194-T238 PolarHBondContact OD1-N 3.07Å; D194-T238 PolarHBondContact OD1-OG1 2.94Å
195	V	96.8	Very high	92.4	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	20%	0.198	C	C	.	.			trans	-71.2	122.6	173.5	179.3	0	0	0	0	109	L179 H192 D257 S260 V264	L179-V195 HydrophobicContact CD1-CG1 4.12Å; L179-V195 HydrophobicContact CD1-CG2 4.24Å; L179-V195 HydrophobicContact CD2-CG2 3.67Å; H192-V195 HydrophobicContact CB-CG2 3.78Å; H192-V195 PolarHBondContact ND1-N 3.13Å; V195-D257 HydrophobicContact CG2-CB 4.29Å; V195-S260 WeakPolarHBondContact O-CB 3.48Å; V195-V264 HydrophobicContact CG1-CG2 4.17Å
196	K	94.2	Very high	92.7	Very high	35 Å²	35	35.7 Å²	35.7	15%	0.152	19%	0.192	C	C	.	.			trans	-159.9	159.9	177	59.7	-174	168.8	-158.5	0	109.7	D194 A198 N199 I200 T238 Y241	D194-K196 PolarHBondContact O-N 3.44Å; D194-K196 IonicContact OD1-NZ 2.94Å; D194-K196 VanDerWaalsContact OD2-CE 3.28Å; D194-K196 WeakPolarHBondContact OD2-CE 3.4Å; D194-K196 IonicContact OD2-NZ 3.6Å; D194-K196 PolarHBondContact OD2-NZ 3.29Å; K196-A198 HydrophobicContact CD-CB 4.28Å; K196-A198 HydrophobicContact CG-CB 4.25Å; K196-A198 PolarHBondContact O-N 2.96Å; K196-N199 WeakPolarHBondContact CE-ND2 3.49Å; K196-N199 VanDerWaalsContact CE-OD1 3.22Å; K196-N199 WeakPolarHBondContact CE-OD1 3.27Å; K196-N199 HydrophobicContact CG-CB 3.93Å; K196-N199 PolarHBondContact O-N 3.41Å; K196-I200 PolarHBondContact O-N 2.92Å; K196-T238 HydrophobicContact CD-CG2 4.11Å; K196-T238 WeakPolarHBondContact CD-OG1 3.47Å; K196-T238 PolarHBondContact NZ-OG1 3Å; K196-Y241 HydrophobicContact CB-CD1 4.02Å; K196-Y241 HydrophobicContact CB-CD2 3.68Å; K196-Y241 HydrophobicContact CB-CE1 3.97Å; K196-Y241 HydrophobicContact CB-CE2 3.58Å; K196-Y241 HydrophobicContact CB-CG 3.9Å
197	S	93.1	Very high	93.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.007	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-52.4	-40.2	178.4	53.6	0	0	0	0	112.4	L151 D152 N199 I200 Y241 D267	L151-S197 WeakPolarHBondContact CB-O 3.45Å; L151-S197 PolarHBondContact N-O 3.4Å; D152-S197 WeakPolarHBondContact CB-OG 3.4Å; D152-S197 PolarHBondContact N-O 2.72Å; D152-S197 PolarHBondContact OD1-OG 3.08Å; S197-N199 PolarHBondContact O-N 3.28Å; S197-I200 PolarHBondContact O-N 3.42Å; S197-I200 VanDerWaalsContact O-N 3.08Å; S197-Y241 PolarHBondContact OG-OH 3.39Å; S197-D267 PolarHBondContact OG-OD2 3.22Å
198	A	92.5	Very high	94.2	Very high	41 Å²	41	28.9 Å²	28.9	34%	0.339	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-65.3	-22.3	179.1	0	0	0	0	0	114.1	D152 K196	D152-A198 HydrophobicContact CB-CB 4.04Å; K196-A198 HydrophobicContact CD-CB 4.28Å; K196-A198 HydrophobicContact CG-CB 4.25Å; K196-A198 PolarHBondContact O-N 2.96Å
199	N	95	Very high	94.9	Very high	17 Å²	17	27.9 Å²	27.9	9%	0.091	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-96.8	0.2	177.4	-75.3	-0.5	0	0	0	112.7	D194 K196 S197 G211 D212	D194-N199 PolarHBondContact O-ND2 3.31Å; D194-N199 PolarHBondContact OD2-ND2 3.27Å; K196-N199 WeakPolarHBondContact CE-ND2 3.49Å; K196-N199 VanDerWaalsContact CE-OD1 3.22Å; K196-N199 WeakPolarHBondContact CE-OD1 3.27Å; K196-N199 HydrophobicContact CG-CB 3.93Å; K196-N199 PolarHBondContact O-N 3.41Å; S197-N199 PolarHBondContact O-N 3.28Å; N199-G211 PolarHBondContact O-N 2.93Å; N199-D212 HydrophobicContact CB-CB 4.39Å; N199-D212 WeakPolarHBondContact ND2-CB 3.41Å; N199-D212 PolarHBondContact ND2-OD2 3.2Å
200	I	97.1	Very high	95.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	111.7	170.1	-52.2	-51.1	0	0	0	107.7	S150 L151 I175 K196 S197 L202 P208 I210	S150-I200 CarbonylContact C-O 3.48Å; S150-I200 VanDerWaalsContact CA-O 3.28Å; S150-I200 WeakPolarHBondContact CA-O 3.28Å; L151-I200 HydrophobicContact CB-CB 3.95Å; L151-I200 HydrophobicContact CB-CG2 4.23Å; L151-I200 HydrophobicContact CD2-CB 4.24Å; L151-I200 HydrophobicContact CD2-CG1 4.43Å; L151-I200 HydrophobicContact CD2-CG2 4.35Å; L151-I200 PolarHBondContact N-O 3.05Å; I175-I200 HydrophobicContact CD1-CB 4.44Å; I175-I200 HydrophobicContact CD1-CD1 4.36Å; I175-I200 HydrophobicContact CD1-CG1 3.92Å; I175-I200 HydrophobicContact CD1-CG2 3.84Å; I175-I200 HydrophobicContact CG1-CD1 4.09Å; I175-I200 HydrophobicContact CG1-CG1 4.15Å; I175-I200 HydrophobicContact CG1-CG2 3.79Å; I175-I200 HydrophobicContact CG2-CD1 4.07Å; K196-I200 PolarHBondContact O-N 2.92Å; S197-I200 PolarHBondContact O-N 3.42Å; S197-I200 VanDerWaalsContact O-N 3.08Å; I200-L202 HydrophobicContact CG2-CD2 4.43Å; I200-P208 HydrophobicContact CG2-CB 3.8Å; I200-I210 HydrophobicContact CD1-CB 4.36Å; I200-I210 HydrophobicContact CD1-CG1 3.8Å; I200-I210 HydrophobicContact CD1-CG2 4.44Å
201	L	97.4	Very high	95.5	Very high	45 Å²	45	26.4 Å²	26.4	24%	0.236	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	147.6	177.8	-57.6	-177.6	0	0	0	110.6	L127 M146 G149 P208 K209	L127-L201 HydrophobicContact CD1-CD1 4.13Å; L127-L201 HydrophobicContact CD2-CD1 3.86Å; M146-L201 HydrophobicContact CB-CB 3.76Å; M146-L201 HydrophobicContact CB-CD1 4.21Å; M146-L201 HydrophobicContact CE-CB 3.73Å; M146-L201 VanDerWaalsContact CE-O 3.23Å; M146-L201 WeakPolarHBondContact CE-O 3.12Å; M146-L201 HydrophobicContact CG-CB 3.6Å; M146-L201 HydrophobicContact CG-CD1 3.78Å; M146-L201 HydrophobicContact CG-CG 4.34Å; G149-L201 WeakPolarHBondContact O-CA 3.43Å; L201-P208 CarbonylContact O-C 3.54Å; L201-P208 WeakPolarHBondContact O-CA 3.23Å; L201-K209 PolarHBondContact N-O 3.29Å; L201-K209 PolarHBondContact O-N 3.37Å
202	L	97.5	Very high	95.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.9	-178	-57.6	-175.7	0	0	0	111	M146 A147 N148 G149 R154 I171 I200 L206 P208	M146-L202 CarbonylContact C-O 3.53Å; A147-L202 PolarHBondContact N-O 2.89Å; N148-L202 HydrophobicContact CB-CB 3.76Å; N148-L202 PolarHBondContact N-O 3.43Å; N148-L202 VanDerWaalsContact N-O 3.07Å; G149-L202 PolarHBondContact O-N 3.09Å; R154-L202 HydrophobicContact CB-CD1 4.35Å; R154-L202 HydrophobicContact CG-CD1 3.76Å; I171-L202 HydrophobicContact CD1-CD1 4Å; I171-L202 HydrophobicContact CD1-CD2 4.1Å; I171-L202 HydrophobicContact CG1-CD2 4.04Å; I171-L202 HydrophobicContact CG2-CD2 4.27Å; I200-L202 HydrophobicContact CG2-CD2 4.43Å; L202-L206 HydrophobicContact CB-CD2 4.34Å; L202-L206 HydrophobicContact CD1-CD2 3.91Å; L202-P208 HydrophobicContact CD2-CB 4.07Å
203	D	96.2	Very high	95.3	Very high	11 Å²	11	27.6 Å²	27.6	6%	0.059	14%	0.142	C	C	.	.			trans	-77.6	-175.2	177.3	77.5	11.4	0	0	0	111.2	M146 N148 H205 L206 E207	M146-D203 HydrophobicContact CE-CB 3.8Å; M146-D203 HydrophobicContact SD-CB 4.11Å; N148-D203 PolarHBondContact ND2-O 2.97Å; D203-H205 PolarHBondContact O-N 3.18Å; D203-H205 VanDerWaalsContact O-N 3.12Å; D203-H205 WeakPolarHBondContact OD1-CA 3.09Å; D203-H205 PolarHBondContact OD1-N 3.02Å; D203-L206 PolarHBondContact O-N 3.01Å; D203-L206 PolarHBondContact OD1-N 2.87Å; D203-E207 PolarHBondContact N-O 3.14Å; D203-E207 VanDerWaalsContact N-O 3.09Å; D203-E207 PolarHBondContact OD1-N 3.36Å
204	H	94.4	Very high	94.9	Very high	118 Å²	118	27.6 Å²	27.6	55%	0.546	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-26.3	178.4	67.6	-50.2	0	0	0	115.9	A147	A147-H204 HydrophobicContact CB-CB 4.43Å
205	H	95.4	Very high	94.6	Very high	135 Å²	135	28.2 Å²	28.2	63%	0.625	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	11.1	179.8	-67.4	-39.9	0	0	0	112.9	D203 E207	D203-H205 PolarHBondContact O-N 3.18Å; D203-H205 VanDerWaalsContact O-N 3.12Å; D203-H205 WeakPolarHBondContact OD1-CA 3.09Å; D203-H205 PolarHBondContact OD1-N 3.02Å; H205-E207 HydrophobicContact CB-CG 4.33Å; H205-E207 PolarHBondContact O-N 3.43Å
206	L	94.8	Very high	94.3	Very high	28 Å²	28	28.3 Å²	28.3	15%	0.147	15%	0.146	C	C	.	.			trans	62	23.2	-172.1	-57.9	170.4	0	0	0	113.1	N148 L163 E167 I171 L202 D203	N148-L206 HydrophobicContact CB-CD2 3.82Å; L163-L206 HydrophobicContact CD2-CD1 3.9Å; L163-L206 HydrophobicContact CD2-CD2 4.13Å; E167-L206 HydrophobicContact CB-CD1 4.46Å; E167-L206 HydrophobicContact CG-CD1 3.97Å; E167-L206 VanDerWaalsContact OE1-CD1 3.3Å; E167-L206 WeakPolarHBondContact OE1-CD1 3.38Å; I171-L206 WeakPolarHBondContact CG1-O 3.05Å; L202-L206 HydrophobicContact CB-CD2 4.34Å; L202-L206 HydrophobicContact CD1-CD2 3.91Å; D203-L206 PolarHBondContact O-N 3.01Å; D203-L206 PolarHBondContact OD1-N 2.87Å
207	E	97.3	Very high	93.9	Very high	74 Å²	74	29.8 Å²	29.8	35%	0.346	15%	0.151	S	C	.	.			trans	-76.1	129.4	172	-70.5	-65.2	147.4	0	0	109.7	D203 H205	D203-E207 PolarHBondContact N-O 3.14Å; D203-E207 VanDerWaalsContact N-O 3.09Å; D203-E207 PolarHBondContact OD1-N 3.36Å; H205-E207 HydrophobicContact CB-CG 4.33Å; H205-E207 PolarHBondContact O-N 3.43Å
208	P	98	Very high	93.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	138.8	-175.4	33.7	-38.2	0	0	0	111.8	N125 I171 I175 I200 L201 L202	N125-P208 WeakPolarHBondContact CA-O 3.48Å; N125-P208 PolarHBondContact ND2-O 3.06Å; I171-P208 HydrophobicContact CG2-CB 4.14Å; I171-P208 WeakPolarHBondContact O-CG 3.22Å; I175-P208 HydrophobicContact CG1-CB 3.97Å; I175-P208 HydrophobicContact CG1-CG 4.39Å; I200-P208 HydrophobicContact CG2-CB 3.8Å; L201-P208 CarbonylContact O-C 3.54Å; L201-P208 WeakPolarHBondContact O-CA 3.23Å; L202-P208 HydrophobicContact CD2-CB 4.07Å
209	K	98.1	Very high	91.9	Very high	24 Å²	24	30.7 Å²	30.7	10%	0.104	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.6	170	-46	-68.8	174.8	-170.6	0	109.4	D124 L127 M146 L201	D124-K209 WeakPolarHBondContact O-CD 3.19Å; D124-K209 WeakPolarHBondContact O-CE 3.28Å; D124-K209 PolarHBondContact O-NZ 3.33Å; L127-K209 HydrophobicContact CB-CB 4.15Å; L127-K209 HydrophobicContact CD1-CB 4.18Å; M146-K209 HydrophobicContact CE-CB 3.73Å; M146-K209 HydrophobicContact CE-CG 3.23Å; M146-K209 HydrophobicContact SD-CG 3.97Å; L201-K209 PolarHBondContact N-O 3.29Å; L201-K209 PolarHBondContact O-N 3.37Å
210	I	98.1	Very high	89.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	128.3	173.7	-57.3	155.7	0	0	0	108.1	N125 L127 I175 L179 I200 F213	N125-I210 WeakPolarHBondContact O-CG1 3.46Å; N125-I210 PolarHBondContact O-N 2.86Å; L127-I210 VanDerWaalsContact CB-O 3.3Å; L127-I210 WeakPolarHBondContact CB-O 3.19Å; L127-I210 PolarHBondContact N-O 2.87Å; I175-I210 HydrophobicContact CG2-CG1 4.49Å; L179-I210 HydrophobicContact CD2-CD1 3.84Å; L179-I210 HydrophobicContact CG-CD1 3.73Å; I200-I210 HydrophobicContact CD1-CB 4.36Å; I200-I210 HydrophobicContact CD1-CG1 3.8Å; I200-I210 HydrophobicContact CD1-CG2 4.44Å; I210-F213 HydrophobicContact CB-CZ 4.46Å; I210-F213 HydrophobicContact CG2-CE2 4.48Å; I210-F213 HydrophobicContact CG2-CZ 4.12Å; I210-F213 VanDerWaalsContact O-CE2 3.31Å; I210-F213 WeakPolarHBondContact O-CE2 3.37Å
211	G	94.7	Very high	87.7	Confident	3 Å²	3	35.2 Å²	35.2	3%	0.031	19%	0.189	C	C	.	.			trans	-122.8	-177.6	175	0	0	0	0	0	112.8	H192 N199	H192-G211 PolarHBondContact CE1-O 2.77Å; H192-G211 PolarHBondContact NE2-O 2.86Å; N199-G211 PolarHBondContact O-N 2.93Å
212	D	91.2	Very high	85.2	Confident	28 Å²	28	39.7 Å²	39.7	15%	0.15	21%	0.212	C	C	.	.			trans	65.1	59.7	175.5	-155.2	32.4	0	0	0	115.3	K99 H192 N199 G214	K99-D212 IonicContact NZ-OD1 3.06Å; K99-D212 PolarHBondContact NZ-OD1 2.95Å; H192-D212 PolarHBondContact CE1-O 3.25Å; H192-D212 PolarHBondContact NE2-O 3.42Å; N199-D212 HydrophobicContact CB-CB 4.39Å; N199-D212 WeakPolarHBondContact ND2-CB 3.41Å; N199-D212 PolarHBondContact ND2-OD2 3.2Å; D212-G214 PolarHBondContact O-N 2.88Å; D212-G214 VanDerWaalsContact O-N 3.15Å
213	F	91.2	Very high	82.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-78.6	12.3	-180	-68.6	-97.2	0	0	0	114.3	E114 I117 L118 I126 L182 H192 I210 L215 C216	E114-F213 HydrophobicContact CG-CB 4.07Å; I117-F213 HydrophobicContact CB-CB 4.34Å; I117-F213 HydrophobicContact CB-CD1 4.4Å; I117-F213 HydrophobicContact CG2-CB 4.35Å; I117-F213 HydrophobicContact CG2-CD1 3.54Å; I117-F213 HydrophobicContact CG2-CE1 4.01Å; I117-F213 HydrophobicContact CG2-CG 4.04Å; L118-F213 HydrophobicContact CD1-CD2 4.23Å; L118-F213 HydrophobicContact CD2-CD2 3.64Å; L118-F213 HydrophobicContact CD2-CE2 3.57Å; L118-F213 HydrophobicContact CD2-CG 4.37Å; L118-F213 HydrophobicContact CD2-CZ 4.23Å; L118-F213 HydrophobicContact CG-CD2 4.03Å; L118-F213 HydrophobicContact CG-CE2 4.45Å; I126-F213 HydrophobicContact CB-CZ 4.47Å; I126-F213 HydrophobicContact CD1-CZ 4.39Å; I126-F213 HydrophobicContact CG1-CZ 4.18Å; I126-F213 HydrophobicContact CG2-CE2 3.87Å; I126-F213 HydrophobicContact CG2-CZ 3.67Å; L182-F213 HydrophobicContact CD1-CE1 3.67Å; L182-F213 HydrophobicContact CD1-CZ 4.28Å; L182-F213 HydrophobicContact CD2-CE1 3.94Å; L182-F213 HydrophobicContact CG-CE1 4.44Å; H192-F213 AromaticContact CD2-CD1 3.68Å; H192-F213 AromaticContact CD2-CE1 3.64Å; I210-F213 HydrophobicContact CB-CZ 4.46Å; I210-F213 HydrophobicContact CG2-CE2 4.48Å; I210-F213 HydrophobicContact CG2-CZ 4.12Å; I210-F213 VanDerWaalsContact O-CE2 3.31Å; I210-F213 WeakPolarHBondContact O-CE2 3.37Å; F213-L215 PolarHBondContact O-N 2.93Å; F213-L215 VanDerWaalsContact O-N 3.11Å; F213-C216 HydrophobicContact CB-CB 4.23Å; F213-C216 HydrophobicContact CD1-CB 4.33Å; F213-C216 WeakPolarHBondContact O-CB 3.45Å; F213-C216 PolarHBondContact O-N 3Å
214	G	85.6	Confident	80.4	Confident	9 Å²	9	50.2 Å²	50.2	9%	0.093	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-60.9	-24.7	-174.9	0	0	0	0	0	113.6	E114 D212	E114-G214 VanDerWaalsContact CG-N 3.32Å; D212-G214 PolarHBondContact O-N 2.88Å; D212-G214 VanDerWaalsContact O-N 3.15Å
215	L	88.5	Confident	78.6	Confident	21 Å²	21	47.6 Å²	47.6	11%	0.11	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-101.7	3.4	178.4	-64	179.8	0	0	0	114	H192 D194 F213 R217 N236	H192-L215 CarbonylContact O-C 3.5Å; D194-L215 HydrophobicContact CB-CD1 3.91Å; F213-L215 PolarHBondContact O-N 2.93Å; F213-L215 VanDerWaalsContact O-N 3.11Å; L215-R217 WeakPolarHBondContact O-CG 3.4Å; L215-N236 HydrophobicContact CD1-CB 3.89Å; L215-N236 HydrophobicContact CD2-CB 3.72Å; L215-N236 HydrophobicContact CG-CB 4.44Å
216	C	89.8	Confident	77	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.027	27%	0.266	C	S	.	.			trans	-60.6	143.3	-176.1	-177.5	0	0	0	0	111.6	K113 I117 I191 H192 F213	K113-C216 WeakPolarHBondContact CE-O 3.29Å; I117-C216 HydrophobicContact CG1-CB 4.13Å; I191-C216 CarbonylContact O-C 3.55Å; I191-C216 WeakPolarHBondContact O-CA 3.28Å; I191-C216 PolarHBondContact O-SG 3.08Å; I191-C216 VanDerWaalsContact O-SG 3.39Å; H192-C216 WeakPolarHBondContact O-CA 3.48Å; H192-C216 PolarHBondContact O-N 3.48Å; F213-C216 HydrophobicContact CB-CB 4.23Å; F213-C216 HydrophobicContact CD1-CB 4.33Å; F213-C216 WeakPolarHBondContact O-CB 3.45Å; F213-C216 PolarHBondContact O-N 3Å
217	R	86.6	Confident	75.5	Confident	66 Å²	66	48.5 Å²	48.5	25%	0.249	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	141.5	-179.7	-60	178.4	-174.2	-118.5	3.2	110.4	I191 L215 F230	I191-R217 PolarHBondContact N-O 2.81Å; I191-R217 PolarHBondContact O-N 3.36Å; L215-R217 WeakPolarHBondContact O-CG 3.4Å; R217-F230 HydrophobicContact CB-CZ 4.13Å
218	T	77.5	Confident	74.5	Confident	52 Å²	52	46.5 Å²	46.5	32%	0.319	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	130.1	167.1	47.4	0	0	0	0	108.4	L190 G220	L190-T218 HydrophobicContact CD2-CG2 3.7Å; T218-G220 PolarHBondContact O-N 3.4Å
219	G	64.8	Low	73.8	Confident	8 Å²	8	51.4 Å²	51.4	8%	0.082	30%	0.296	C	S	.	.			trans	-59	107.2	174	0	0	0	0	0	109.9	Q188 P189 L221	Q188-G219 WeakPolarHBondContact CB-O 3.43Å; Q188-G219 WeakPolarHBondContact CG-O 3.45Å; Q188-G219 PolarHBondContact NE2-O 3.47Å; Q188-G219 PolarHBondContact OE1-O 2.77Å; P189-G219 PolarHBondContact O-N 3.21Å; G219-L221 PolarHBondContact O-N 3.16Å
220	G	53	Low	73.3	Confident	48 Å²	48	52.5 Å²	52.5	50%	0.495	30%	0.301	S	S	.	.			trans	-72.8	26.5	-167.9	0	0	0	0	0	116.3	T218	T218-G220 PolarHBondContact O-N 3.4Å
221	L	50.9	Low	72.7	Confident	65 Å²	65	57.5 Å²	57.5	34%	0.34	33%	0.326	S	S	.	.			trans	-127.8	95.2	-172.5	-65.3	167	0	0	0	109.4	G219 H223 A224 S228 Y229	G219-L221 PolarHBondContact O-N 3.16Å; L221-H223 PolarHBondContact O-N 3Å; L221-A224 HydrophobicContact CB-CB 4.01Å; L221-A224 HydrophobicContact CD1-CB 4.45Å; L221-S228 WeakPolarHBondContact CD1-OG 3.21Å; L221-Y229 WeakPolarHBondContact CD1-O 3.48Å
222	L	45.2	Very low	72.3	Confident	138 Å²	138	57.5 Å²	57.5	72%	0.723	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-17.4	-179.9	-71	163.8	0	0	0	113.9
223	H	43.5	Very low	72	Confident	186 Å²	186	59.9 Å²	59.9	86%	0.861	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149.1	24.6	-171.2	-64.6	-58.9	0	0	0	115.6	L221	L221-H223 PolarHBondContact O-N 3Å
224	A	49.7	Very low	71.8	Confident	47 Å²	47	65.6 Å²	65.6	39%	0.388	37%	0.372	S	S	.	.			trans	-126.2	122.5	-179	0	0	0	0	0	109.8	L221 S228	L221-A224 HydrophobicContact CB-CB 4.01Å; L221-A224 HydrophobicContact CD1-CB 4.45Å; A224-S228 VanDerWaalsContact O-CB 3.25Å; A224-S228 WeakPolarHBondContact O-CB 3.5Å; A224-S228 PolarHBondContact O-OG 3.1Å
225	G	57	Low	71.8	Confident	62 Å²	62	68.6 Å²	68.6	64%	0.639	39%	0.385	S	S	*	.			trans	-58.6	-175.5	-175.1	0	0	0	0	0	114.1	N227 S228	G225-N227 PolarHBondContact O-N 3.09Å; G225-S228 WeakPolarHBondContact O-CB 3.33Å; G225-S228 PolarHBondContact O-N 3.39Å; G225-S228 PolarHBondContact O-OG 3.3Å; G225-S228 VanDerWaalsContact O-OG 3.1Å
226	D	61.1	Low	71.7	Confident	90 Å²	90	70.7 Å²	70.7	48%	0.481	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.3	-26.1	-169.8	-76.3	1.4	0	0	0	117.6	S228	D226-S228 VanDerWaalsContact C-N 3.3Å
227	N	63.9	Low	71.6	Confident	93 Å²	93	72 Å²	72	50%	0.497	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	2.4	179.1	-68.5	-20.2	0	0	0	113.9	G225	G225-N227 PolarHBondContact O-N 3.09Å
228	S	75.6	Confident	71.7	Confident	31 Å²	31	70.8 Å²	70.8	22%	0.217	41%	0.41	C	S	.	.			trans	-73.1	130	177.8	81.1	0	0	0	0	110	L221 A224 G225 D226 S253	L221-S228 WeakPolarHBondContact CD1-OG 3.21Å; A224-S228 VanDerWaalsContact O-CB 3.25Å; A224-S228 WeakPolarHBondContact O-CB 3.5Å; A224-S228 PolarHBondContact O-OG 3.1Å; G225-S228 WeakPolarHBondContact O-CB 3.33Å; G225-S228 PolarHBondContact O-N 3.39Å; G225-S228 PolarHBondContact O-OG 3.3Å; G225-S228 VanDerWaalsContact O-OG 3.1Å; D226-S228 VanDerWaalsContact C-N 3.3Å; S228-S253 WeakPolarHBondContact O-CB 3.43Å
229	Y	84.7	Confident	72.2	Confident	104 Å²	104	74.5 Å²	74.5	41%	0.408	42%	0.422	S	S	.	.			trans	-129.4	149.6	-176.9	68.4	-91.8	0	0	0	110.8	L221 I231 R251 V252	L221-Y229 WeakPolarHBondContact CD1-O 3.48Å; Y229-I231 HydrophobicContact CD2-CD1 4.06Å; Y229-I231 HydrophobicContact CE2-CD1 3.91Å; Y229-R251 HydrophobicContact CD2-CB 4.03Å; Y229-R251 HydrophobicContact CD2-CG 3.6Å; Y229-R251 HydrophobicContact CE2-CG 3.82Å; Y229-R251 HydrophobicContact CG-CB 4.29Å; Y229-R251 HydrophobicContact CG-CG 4.2Å; Y229-R251 PolarHBondContact OH-NH2 3.4Å; Y229-V252 WeakPolarHBondContact CA-O 3.27Å; Y229-V252 WeakPolarHBondContact CB-O 2.71Å
230	F	86.3	Confident	73.4	Confident	48 Å²	48	74.8 Å²	74.8	21%	0.211	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	165.8	164.6	65.5	-88.1	0	0	0	110	I191 R217 V252	I191-F230 HydrophobicContact CD1-CE1 4.1Å; R217-F230 HydrophobicContact CB-CZ 4.13Å; F230-V252 HydrophobicContact CD1-CB 4.28Å; F230-V252 HydrophobicContact CD1-CG1 4.5Å; F230-V252 HydrophobicContact CD2-CB 4.32Å; F230-V252 HydrophobicContact CE1-CB 3.8Å; F230-V252 HydrophobicContact CE1-CG1 3.6Å; F230-V252 HydrophobicContact CE2-CB 3.83Å; F230-V252 HydrophobicContact CE2-CG1 4.14Å; F230-V252 HydrophobicContact CE2-CG2 4.19Å; F230-V252 HydrophobicContact CZ-CB 3.56Å; F230-V252 HydrophobicContact CZ-CG1 3.38Å; F230-V252 HydrophobicContact CZ-CG2 4.25Å; F230-V252 PolarHBondContact N-O 2.78Å; F230-V252 PolarHBondContact O-N 2.72Å
231	I	86.8	Confident	75.3	Confident	104 Å²	104	73 Å²	73	53%	0.533	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	119	177.7	-56.9	-58.1	0	0	0	108.8	Y229 K250 R251	Y229-I231 HydrophobicContact CD2-CD1 4.06Å; Y229-I231 HydrophobicContact CE2-CD1 3.91Å; I231-K250 WeakPolarHBondContact CA-O 3.43Å; I231-K250 HydrophobicContact CG2-CB 4.19Å; I231-R251 HydrophobicContact CD1-CG 3.77Å
232	A	86.5	Confident	77.3	Confident	4 Å²	4	70.1 Å²	70.1	3%	0.033	39%	0.387	C	S	.	.			trans	-74.7	149.1	172.9	0	0	0	0	0	111.2	F246 K250 V252	A232-F246 HydrophobicContact CB-CE2 3.95Å; A232-K250 HydrophobicContact CB-CB 4.41Å; A232-K250 PolarHBondContact N-O 2.85Å; A232-K250 WeakPolarHBondContact O-CB 3.21Å; A232-K250 WeakPolarHBondContact O-CD 3.32Å; A232-V252 HydrophobicContact CB-CG2 3.87Å
233	S	84.6	Confident	79.7	Confident	77 Å²	77	63.6 Å²	63.6	54%	0.538	35%	0.353	S	S	.	.	S	Bend	trans	-68.2	-42.1	173.2	48.6	0	0	0	0	112.2	K250	S233-K250 PolarHBondContact O-NZ 3.41Å
234	H	86.3	Confident	82.1	Confident	121 Å²	121	56.9 Å²	56.9	56%	0.56	33%	0.325	S	S	*	.	S	Bend	trans	-129.5	153.2	-177.3	-58.9	-76.8	0	0	0	111.3
235	I	86.5	Confident	84.1	Confident	71 Å²	71	55.6 Å²	55.6	36%	0.364	31%	0.311	S	S	.	.			trans	-88.8	110	170.3	-59.6	164.4	0	0	0	106	L242 F246 I247 K250	I235-L242 HydrophobicContact CG2-CD1 3.9Å; I235-F246 HydrophobicContact CB-CE1 4.48Å; I235-F246 HydrophobicContact CG2-CD1 4.24Å; I235-F246 HydrophobicContact CG2-CE1 3.81Å; I235-F246 HydrophobicContact CG2-CZ 4.37Å; I235-I247 WeakPolarHBondContact CD1-O 3.46Å; I235-K250 HydrophobicContact CD1-CG 4.37Å; I235-K250 HydrophobicContact CG1-CD 4.46Å; I235-K250 HydrophobicContact CG1-CG 3.93Å
236	N	85.4	Confident	85.9	Confident	65 Å²	65	52.9 Å²	52.9	35%	0.348	28%	0.282	S	S	.	.			trans	-122.4	150.6	175.7	-65.3	-2.7	0	0	0	108.3	L215 F246	L215-N236 HydrophobicContact CD1-CB 3.89Å; L215-N236 HydrophobicContact CD2-CB 3.72Å; L215-N236 HydrophobicContact CG-CB 4.44Å; N236-F246 WeakPolarHBondContact O-CE1 3.43Å
237	G	86.9	Confident	87.4	Confident	31 Å²	31	50.7 Å²	50.7	32%	0.32	27%	0.27	S	S	.	.	S	Bend	trans	117	178.7	-176.6	0	0	0	0	0	111.8	D194 F239	D194-G237 VanDerWaalsContact OD1-CA 3.32Å; D194-G237 WeakPolarHBondContact OD1-CA 3.41Å; G237-F239 PolarHBondContact O-N 2.94Å
238	T	89.7	Confident	88.8	Confident	42 Å²	42	51.1 Å²	51.1	26%	0.258	28%	0.276	S	S	.	.			trans	-91	109	-171.5	-54.4	0	0	0	0	110.8	D194 K196 A240 Y241 L242	D194-T238 WeakPolarHBondContact OD1-CB 3.45Å; D194-T238 PolarHBondContact OD1-N 3.07Å; D194-T238 PolarHBondContact OD1-OG1 2.94Å; K196-T238 HydrophobicContact CD-CG2 4.11Å; K196-T238 WeakPolarHBondContact CD-OG1 3.47Å; K196-T238 PolarHBondContact NZ-OG1 3Å; T238-A240 PolarHBondContact O-N 3.16Å; T238-Y241 HydrophobicContact CG2-CD2 3.83Å; T238-Y241 HydrophobicContact CG2-CE2 4.2Å; T238-Y241 PolarHBondContact O-N 3.41Å; T238-L242 PolarHBondContact O-N 3.2Å
239	F	88.8	Confident	89.5	Confident	130 Å²	130	55.3 Å²	55.3	57%	0.57	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-47.7	-37.8	-168	-167.4	-93.8	0	0	0	114.9	G237 Y241 L242 I247	G237-F239 PolarHBondContact O-N 2.94Å; F239-Y241 PolarHBondContact O-N 3.04Å; F239-L242 PolarHBondContact O-N 3.45Å; F239-I247 HydrophobicContact CD2-CD1 4.16Å; F239-I247 HydrophobicContact CD2-CG1 4.36Å; F239-I247 HydrophobicContact CE1-CD1 4.43Å; F239-I247 HydrophobicContact CE2-CD1 3.78Å; F239-I247 HydrophobicContact CE2-CG1 4.01Å; F239-I247 HydrophobicContact CE2-CG2 3.67Å; F239-I247 HydrophobicContact CZ-CD1 3.92Å; F239-I247 HydrophobicContact CZ-CG2 4.1Å
240	A	88.5	Confident	89.9	Confident	13 Å²	13	54 Å²	54	11%	0.107	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-63	-25.5	179.4	0	0	0	0	0	114.3	T238 P276	T238-A240 PolarHBondContact O-N 3.16Å; A240-P276 HydrophobicContact CB-CB 3.85Å
241	Y	93.3	Very high	90.1	Very high	11 Å²	11	56 Å²	56	4%	0.043	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-104.3	-2.5	-178.6	-61.3	-96.9	0	0	0	112.9	K196 S197 T238 F239 S260 T263 V264 D267 P276	K196-Y241 HydrophobicContact CB-CD1 4.02Å; K196-Y241 HydrophobicContact CB-CD2 3.68Å; K196-Y241 HydrophobicContact CB-CE1 3.97Å; K196-Y241 HydrophobicContact CB-CE2 3.58Å; K196-Y241 HydrophobicContact CB-CG 3.9Å; S197-Y241 PolarHBondContact OG-OH 3.39Å; T238-Y241 HydrophobicContact CG2-CD2 3.83Å; T238-Y241 HydrophobicContact CG2-CE2 4.2Å; T238-Y241 PolarHBondContact O-N 3.41Å; F239-Y241 PolarHBondContact O-N 3.04Å; Y241-S260 WeakPolarHBondContact O-CA 3.42Å; Y241-S260 WeakPolarHBondContact O-CB 3.46Å; Y241-S260 PolarHBondContact O-OG 3.16Å; Y241-T263 HydrophobicContact CD1-CG2 3.54Å; Y241-T263 HydrophobicContact CE1-CG2 3.93Å; Y241-T263 HydrophobicContact CG-CG2 4.12Å; Y241-V264 HydrophobicContact CD1-CG2 3.98Å; Y241-V264 HydrophobicContact CE1-CG2 3.77Å; Y241-D267 PolarHBondContact OH-OD2 3.11Å; Y241-P276 HydrophobicContact CE1-CG 4.43Å; Y241-P276 HydrophobicContact CE2-CB 4.18Å; Y241-P276 HydrophobicContact CE2-CG 3.97Å; Y241-P276 WeakPolarHBondContact OH-CG 3.1Å
242	L	93.9	Very high	90.3	Very high	5 Å²	5	51.1 Å²	51.1	3%	0.026	27%	0.268	C	S	.	.	S	Bend	trans	-85.5	138.1	-176.8	-69.3	-178.7	0	0	0	111.3	I235 T238 F239 F246 I247	I235-L242 HydrophobicContact CG2-CD1 3.9Å; T238-L242 PolarHBondContact O-N 3.2Å; F239-L242 PolarHBondContact O-N 3.45Å; L242-F246 HydrophobicContact CB-CD1 4.36Å; L242-F246 HydrophobicContact CD1-CD1 3.91Å; L242-F246 HydrophobicContact CD1-CE1 3.89Å; L242-F246 HydrophobicContact CD2-CD1 3.79Å; L242-F246 HydrophobicContact CD2-CE1 3.92Å; L242-F246 HydrophobicContact CG-CD1 4.23Å; L242-F246 HydrophobicContact CG-CE1 4.48Å; L242-I247 HydrophobicContact CB-CD1 3.96Å; L242-I247 HydrophobicContact CB-CG1 3.92Å
243	P	94.3	Very high	90.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.271	C	S	.	.			trans	-74.2	153.2	177.7	33	-37.9	0	0	0	112	E245 F246 I247 L256 Y259	P243-E245 VanDerWaalsContact C-N 3.33Å; P243-E245 VanDerWaalsContact CB-OE1 3.23Å; P243-E245 WeakPolarHBondContact CB-OE1 3.31Å; P243-E245 WeakPolarHBondContact CB-OE2 3.38Å; P243-E245 WeakPolarHBondContact CG-OE1 3.47Å; P243-E245 PolarHBondContact O-N 3.07Å; P243-F246 HydrophobicContact CG-CB 3.82Å; P243-F246 PolarHBondContact O-N 2.68Å; P243-F246 VanDerWaalsContact O-N 3.12Å; P243-I247 PolarHBondContact O-N 3.3Å; P243-L256 HydrophobicContact CG-CB 4.4Å; P243-L256 HydrophobicContact CG-CG 4.03Å; P243-Y259 HydrophobicContact CB-CD1 3.76Å; P243-Y259 HydrophobicContact CB-CD2 3.85Å; P243-Y259 HydrophobicContact CB-CE1 4.31Å; P243-Y259 HydrophobicContact CB-CE2 4.39Å; P243-Y259 HydrophobicContact CB-CG 3.52Å; P243-Y259 HydrophobicContact CG-CG 4.45Å
244	P	93.6	Very high	90.9	Very high	45 Å²	45	48.2 Å²	48.2	29%	0.292	25%	0.248	S	C	.	.	H	α-helix	trans	-62.5	-35.1	-174	24	-34.2	0	0	0	113.5	F246 I247 T248	P244-F246 VanDerWaalsContact C-N 3.3Å; P244-F246 PolarHBondContact O-N 3.26Å; P244-I247 PolarHBondContact O-N 3.34Å; P244-T248 WeakPolarHBondContact O-CB 3.42Å; P244-T248 WeakPolarHBondContact O-CG2 3.46Å; P244-T248 PolarHBondContact O-N 2.71Å; P244-T248 PolarHBondContact O-OG1 3.46Å
245	E	93.3	Very high	91.3	Very high	20 Å²	20	43 Å²	43	9%	0.093	22%	0.223	C	C	.	.	H	α-helix	trans	-69.6	-27	178.6	72.8	-75.2	177.4	0	0	113.3	P243 K249 K250 R251 P334 R337	P243-E245 VanDerWaalsContact C-N 3.33Å; P243-E245 VanDerWaalsContact CB-OE1 3.23Å; P243-E245 WeakPolarHBondContact CB-OE1 3.31Å; P243-E245 WeakPolarHBondContact CB-OE2 3.38Å; P243-E245 WeakPolarHBondContact CG-OE1 3.47Å; P243-E245 PolarHBondContact O-N 3.07Å; E245-K249 CarbonylContact O-C 3.37Å; E245-K249 WeakPolarHBondContact O-CA 3.49Å; E245-K249 WeakPolarHBondContact O-CB 3.17Å; E245-K249 PolarHBondContact O-N 3.26Å; E245-K250 PolarHBondContact O-N 2.71Å; E245-R251 HydrophobicContact CG-CB 4.47Å; E245-R251 PolarHBondContact O-N 3.39Å; E245-P334 HydrophobicContact CB-CG 4.43Å; E245-P334 VanDerWaalsContact CD-CG 3.43Å; E245-P334 HydrophobicContact CG-CG 3.66Å; E245-P334 WeakPolarHBondContact OE1-CG 3.49Å; E245-R337 VanDerWaalsContact CD-NH2 3.3Å; E245-R337 IonicContact OE1-CZ 3.63Å; E245-R337 VanDerWaalsContact OE1-CZ 3.29Å; E245-R337 IonicContact OE1-NH1 3.89Å; E245-R337 PolarHBondContact OE1-NH1 2.99Å; E245-R337 IonicContact OE1-NH2 3.41Å; E245-R337 PolarHBondContact OE1-NH2 3.25Å; E245-R337 IonicContact OE2-CZ 3.84Å; E245-R337 IonicContact OE2-NH1 3.95Å; E245-R337 IonicContact OE2-NH2 2.85Å; E245-R337 PolarHBondContact OE2-NH2 2.99Å
246	F	93.4	Very high	91.7	Very high	5 Å²	5	39.8 Å²	39.8	2%	0.022	21%	0.207	C	C	.	.	H	α-helix	trans	-75.6	-43.6	173.1	179.6	-120.2	0	0	0	110.3	A232 I235 N236 L242 P243 P244 T248 K250 V252 L256	A232-F246 HydrophobicContact CB-CE2 3.95Å; I235-F246 HydrophobicContact CB-CE1 4.48Å; I235-F246 HydrophobicContact CG2-CD1 4.24Å; I235-F246 HydrophobicContact CG2-CE1 3.81Å; I235-F246 HydrophobicContact CG2-CZ 4.37Å; N236-F246 WeakPolarHBondContact O-CE1 3.43Å; L242-F246 HydrophobicContact CB-CD1 4.36Å; L242-F246 HydrophobicContact CD1-CD1 3.91Å; L242-F246 HydrophobicContact CD1-CE1 3.89Å; L242-F246 HydrophobicContact CD2-CD1 3.79Å; L242-F246 HydrophobicContact CD2-CE1 3.92Å; L242-F246 HydrophobicContact CG-CD1 4.23Å; L242-F246 HydrophobicContact CG-CE1 4.48Å; P243-F246 HydrophobicContact CG-CB 3.82Å; P243-F246 PolarHBondContact O-N 2.68Å; P243-F246 VanDerWaalsContact O-N 3.12Å; P244-F246 VanDerWaalsContact C-N 3.3Å; P244-F246 PolarHBondContact O-N 3.26Å; F246-T248 PolarHBondContact O-N 2.93Å; F246-K250 WeakPolarHBondContact O-CA 3.4Å; F246-K250 PolarHBondContact O-N 3.41Å; F246-V252 HydrophobicContact CD2-CG2 3.45Å; F246-V252 VanDerWaalsContact CD2-CG2 3.45Å; F246-V252 HydrophobicContact CE2-CG2 3.25Å; F246-V252 HydrophobicContact CZ-CG2 4.3Å; F246-L256 HydrophobicContact CB-CD1 4.14Å; F246-L256 HydrophobicContact CD1-CD1 3.9Å; F246-L256 HydrophobicContact CD2-CD1 3.94Å; F246-L256 HydrophobicContact CE1-CD1 4.25Å; F246-L256 HydrophobicContact CE2-CD1 4.33Å; F246-L256 HydrophobicContact CG-CD1 3.72Å; F246-L256 HydrophobicContact CZ-CD1 4.45Å
247	I	92.7	Very high	92.3	Very high	45 Å²	45	36.7 Å²	36.7	23%	0.231	19%	0.19	C	C	.	.	H	α-helix	trans	-61.9	-44.3	177.5	-64	165.2	0	0	0	111.3	I235 F239 L242 P243 P244	I235-I247 WeakPolarHBondContact CD1-O 3.46Å; F239-I247 HydrophobicContact CD2-CD1 4.16Å; F239-I247 HydrophobicContact CD2-CG1 4.36Å; F239-I247 HydrophobicContact CE1-CD1 4.43Å; F239-I247 HydrophobicContact CE2-CD1 3.78Å; F239-I247 HydrophobicContact CE2-CG1 4.01Å; F239-I247 HydrophobicContact CE2-CG2 3.67Å; F239-I247 HydrophobicContact CZ-CD1 3.92Å; F239-I247 HydrophobicContact CZ-CG2 4.1Å; L242-I247 HydrophobicContact CB-CD1 3.96Å; L242-I247 HydrophobicContact CB-CG1 3.92Å; P243-I247 PolarHBondContact O-N 3.3Å; P244-I247 PolarHBondContact O-N 3.34Å
248	T	92.9	Very high	92.8	Very high	102 Å²	102	35.2 Å²	35.2	63%	0.626	18%	0.175	S	C	*	.	H	α-helix	trans	-88.2	-38	-172.4	55.6	0	0	0	0	113.5	P244 F246	P244-T248 WeakPolarHBondContact O-CB 3.42Å; P244-T248 WeakPolarHBondContact O-CG2 3.46Å; P244-T248 PolarHBondContact O-N 2.71Å; P244-T248 PolarHBondContact O-OG1 3.46Å; F246-T248 PolarHBondContact O-N 2.93Å
249	K	92.1	Very high	93.1	Very high	119 Å²	119	33.9 Å²	33.9	52%	0.517	17%	0.165	S	C	.	.	H	α-helix	trans	-119.5	0.2	-171.3	-59.1	173.2	-174.6	173.3	0	113.2	E245 R251	E245-K249 CarbonylContact O-C 3.37Å; E245-K249 WeakPolarHBondContact O-CA 3.49Å; E245-K249 WeakPolarHBondContact O-CB 3.17Å; E245-K249 PolarHBondContact O-N 3.26Å; K249-R251 HydrophobicContact CB-CG 3.87Å; K249-R251 PolarHBondContact O-N 2.86Å; K249-R251 VanDerWaalsContact O-N 3.09Å
250	K	91.9	Very high	93.6	Very high	76 Å²	76	27.7 Å²	27.7	33%	0.33	14%	0.139	S	C	.	.			trans	54	25.3	-175.3	-53.6	-175.2	-175.3	176.1	0	113.5	I231 A232 S233 I235 E245 F246	I231-K250 WeakPolarHBondContact CA-O 3.43Å; I231-K250 HydrophobicContact CG2-CB 4.19Å; A232-K250 HydrophobicContact CB-CB 4.41Å; A232-K250 PolarHBondContact N-O 2.85Å; A232-K250 WeakPolarHBondContact O-CB 3.21Å; A232-K250 WeakPolarHBondContact O-CD 3.32Å; S233-K250 PolarHBondContact O-NZ 3.41Å; I235-K250 HydrophobicContact CD1-CG 4.37Å; I235-K250 HydrophobicContact CG1-CD 4.46Å; I235-K250 HydrophobicContact CG1-CG 3.93Å; E245-K250 PolarHBondContact O-N 2.71Å; F246-K250 WeakPolarHBondContact O-CA 3.4Å; F246-K250 PolarHBondContact O-N 3.41Å
251	R	91.6	Very high	94	Very high	89 Å²	89	27.1 Å²	27.1	34%	0.336	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	124.6	178.6	-70.4	-176.4	174.5	175.9	-5.4	109.2	Y229 I231 E245 K249	Y229-R251 HydrophobicContact CD2-CB 4.03Å; Y229-R251 HydrophobicContact CD2-CG 3.6Å; Y229-R251 HydrophobicContact CE2-CG 3.82Å; Y229-R251 HydrophobicContact CG-CB 4.29Å; Y229-R251 HydrophobicContact CG-CG 4.2Å; Y229-R251 PolarHBondContact OH-NH2 3.4Å; I231-R251 HydrophobicContact CD1-CG 3.77Å; E245-R251 HydrophobicContact CG-CB 4.47Å; E245-R251 PolarHBondContact O-N 3.39Å; K249-R251 HydrophobicContact CB-CG 3.87Å; K249-R251 PolarHBondContact O-N 2.86Å; K249-R251 VanDerWaalsContact O-N 3.09Å
252	V	89.4	Confident	94.1	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.012	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124.7	178.6	179.8	0	0	0	0	109.2	I191 Y229 F230 A232 F246 L256	I191-V252 HydrophobicContact CD1-CG1 3.67Å; I191-V252 HydrophobicContact CG2-CG1 4.2Å; Y229-V252 WeakPolarHBondContact CA-O 3.27Å; Y229-V252 WeakPolarHBondContact CB-O 2.71Å; F230-V252 HydrophobicContact CD1-CB 4.28Å; F230-V252 HydrophobicContact CD1-CG1 4.5Å; F230-V252 HydrophobicContact CD2-CB 4.32Å; F230-V252 HydrophobicContact CE1-CB 3.8Å; F230-V252 HydrophobicContact CE1-CG1 3.6Å; F230-V252 HydrophobicContact CE2-CB 3.83Å; F230-V252 HydrophobicContact CE2-CG1 4.14Å; F230-V252 HydrophobicContact CE2-CG2 4.19Å; F230-V252 HydrophobicContact CZ-CB 3.56Å; F230-V252 HydrophobicContact CZ-CG1 3.38Å; F230-V252 HydrophobicContact CZ-CG2 4.25Å; F230-V252 PolarHBondContact N-O 2.78Å; F230-V252 PolarHBondContact O-N 2.72Å; A232-V252 HydrophobicContact CB-CG2 3.87Å; F246-V252 HydrophobicContact CD2-CG2 3.45Å; F246-V252 VanDerWaalsContact CD2-CG2 3.45Å; F246-V252 HydrophobicContact CE2-CG2 3.25Å; F246-V252 HydrophobicContact CZ-CG2 4.3Å; V252-L256 HydrophobicContact CG1-CD1 4.3Å; V252-L256 HydrophobicContact CG2-CD1 4.3Å
253	S	91.4	Very high	94.1	Very high	13 Å²	13	26.4 Å²	26.4	9%	0.091	13%	0.131	C	C	.	.	S	Bend	trans	-142.7	175.5	168.8	68.9	0	0	0	0	109.2	I191 S228 K255 L256	I191-S253 VanDerWaalsContact CD1-C 3.44Å; S228-S253 WeakPolarHBondContact O-CB 3.43Å; S253-K255 PolarHBondContact O-N 2.83Å; S253-K255 VanDerWaalsContact O-N 3.11Å; S253-K255 WeakPolarHBondContact OG-CB 3.25Å; S253-K255 PolarHBondContact OG-N 3.47Å; S253-L256 VanDerWaalsContact O-CB 3.26Å; S253-L256 WeakPolarHBondContact O-CB 3.44Å; S253-L256 PolarHBondContact O-N 3.1Å
254	S	92.5	Very high	94.1	Very high	8 Å²	8	26.4 Å²	26.4	6%	0.056	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-26.9	172.9	54.2	0	0	0	0	112.5	H183 L256 D257 V258	H183-S254 PolarHBondContact CE1-O 3.38Å; S254-L256 PolarHBondContact O-N 2.93Å; S254-L256 VanDerWaalsContact O-N 3.12Å; S254-D257 PolarHBondContact O-N 3.28Å; S254-V258 PolarHBondContact O-N 3.2Å
255	K	95.3	Very high	94	Very high	10 Å²	10	24.2 Å²	24.2	4%	0.043	12%	0.117	C	C	.	.	H	α-helix	trans	-63.5	-14.1	175.7	-55.3	-60.3	-175.1	170.4	0	114.2	S253 V258 Y259 P334 R337 P338	S253-K255 PolarHBondContact O-N 2.83Å; S253-K255 VanDerWaalsContact O-N 3.11Å; S253-K255 WeakPolarHBondContact OG-CB 3.25Å; S253-K255 PolarHBondContact OG-N 3.47Å; K255-V258 HydrophobicContact CD-CG2 4.32Å; K255-Y259 PolarHBondContact O-N 3.48Å; K255-P334 HydrophobicContact CB-CB 4.06Å; K255-P334 HydrophobicContact CG-CB 4.33Å; K255-R337 HydrophobicContact CD-CB 4.21Å; K255-R337 PolarHBondContact NZ-O 2.86Å; K255-R337 PolarHBondContact O-NH1 3.49Å; K255-P338 PolarHBondContact NZ-O 3.43Å
256	L	95.3	Very high	93.8	Very high	4 Å²	4	23.3 Å²	23.3	2%	0.021	11%	0.112	C	C	.	.	H	α-helix	trans	-63.6	-53.9	171.1	-174.7	159.5	0	0	0	110.3	I191 P243 F246 V252 S253 S254 V258 Y259 S260	I191-L256 HydrophobicContact CG2-CB 4.41Å; P243-L256 HydrophobicContact CG-CB 4.4Å; P243-L256 HydrophobicContact CG-CG 4.03Å; F246-L256 HydrophobicContact CB-CD1 4.14Å; F246-L256 HydrophobicContact CD1-CD1 3.9Å; F246-L256 HydrophobicContact CD2-CD1 3.94Å; F246-L256 HydrophobicContact CE1-CD1 4.25Å; F246-L256 HydrophobicContact CE2-CD1 4.33Å; F246-L256 HydrophobicContact CG-CD1 3.72Å; F246-L256 HydrophobicContact CZ-CD1 4.45Å; V252-L256 HydrophobicContact CG1-CD1 4.3Å; V252-L256 HydrophobicContact CG2-CD1 4.3Å; S253-L256 VanDerWaalsContact O-CB 3.26Å; S253-L256 WeakPolarHBondContact O-CB 3.44Å; S253-L256 PolarHBondContact O-N 3.1Å; S254-L256 PolarHBondContact O-N 2.93Å; S254-L256 VanDerWaalsContact O-N 3.12Å; L256-V258 PolarHBondContact O-N 2.94Å; L256-Y259 PolarHBondContact O-N 2.79Å; L256-Y259 VanDerWaalsContact O-N 3.16Å; L256-S260 PolarHBondContact O-N 3.34Å; L256-S260 VanDerWaalsContact O-N 3.08Å; L256-S260 PolarHBondContact O-OG 3.19Å
257	D	96.8	Very high	93.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-65.1	-31.8	179.3	-63.8	-25.1	0	0	0	111.6	H183 I191 H192 G193 V195 S254 Y259 S260 F261	H183-D257 IonicContact CD2-OD2 2.8Å; H183-D257 IonicContact CE1-OD2 3.18Å; H183-D257 IonicContact NE2-OD2 2.86Å; H183-D257 PolarHBondContact NE2-OD2 3.25Å; I191-D257 VanDerWaalsContact CA-OD2 3.29Å; I191-D257 WeakPolarHBondContact CA-OD2 3.48Å; H192-D257 PolarHBondContact N-OD1 2.71Å; H192-D257 PolarHBondContact N-OD2 3.15Å; G193-D257 PolarHBondContact N-OD1 3.18Å; V195-D257 HydrophobicContact CG2-CB 4.29Å; S254-D257 PolarHBondContact O-N 3.28Å; D257-Y259 VanDerWaalsContact C-N 3.34Å; D257-Y259 PolarHBondContact O-N 3.47Å; D257-S260 PolarHBondContact O-N 3.08Å; D257-F261 VanDerWaalsContact O-CB 3.25Å; D257-F261 WeakPolarHBondContact O-CB 3.37Å; D257-F261 PolarHBondContact O-N 3.32Å
258	V	97.6	Very high	92.4	Very high	1 Å²	1	21 Å²	21	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-60.6	-44.5	174.9	-178.2	0	0	0	0	110.9	S254 K255 L256 F261 G262 C329 R337 L340	S254-V258 PolarHBondContact O-N 3.2Å; K255-V258 HydrophobicContact CD-CG2 4.32Å; L256-V258 PolarHBondContact O-N 2.94Å; V258-F261 PolarHBondContact O-N 3.43Å; V258-G262 PolarHBondContact O-N 2.8Å; V258-C329 HydrophobicContact CG1-CB 3.95Å; V258-C329 WeakPolarHBondContact O-CB 3.5Å; V258-R337 HydrophobicContact CG1-CB 4.03Å; V258-L340 HydrophobicContact CG2-CD2 4.19Å; V258-L340 HydrophobicContact CG2-CG 4Å
259	Y	97.7	Very high	91.4	Very high	13 Å²	13	16.2 Å²	16.2	5%	0.051	7%	0.071	C	C	.	.	H	α-helix	trans	-65.6	-44.6	176.9	-175.3	-82.3	0	0	0	111.7	P243 K255 L256 D257 F261 G262 T263 C329 T330	P243-Y259 HydrophobicContact CB-CD1 3.76Å; P243-Y259 HydrophobicContact CB-CD2 3.85Å; P243-Y259 HydrophobicContact CB-CE1 4.31Å; P243-Y259 HydrophobicContact CB-CE2 4.39Å; P243-Y259 HydrophobicContact CB-CG 3.52Å; P243-Y259 HydrophobicContact CG-CG 4.45Å; K255-Y259 PolarHBondContact O-N 3.48Å; L256-Y259 PolarHBondContact O-N 2.79Å; L256-Y259 VanDerWaalsContact O-N 3.16Å; D257-Y259 VanDerWaalsContact C-N 3.34Å; D257-Y259 PolarHBondContact O-N 3.47Å; Y259-F261 VanDerWaalsContact C-N 3.33Å; Y259-F261 PolarHBondContact O-N 3.18Å; Y259-G262 PolarHBondContact O-N 3.2Å; Y259-T263 PolarHBondContact O-N 2.75Å; Y259-T263 PolarHBondContact O-OG1 2.86Å; Y259-C329 WeakPolarHBondContact CA-O 3.24Å; Y259-T330 HydrophobicContact CD2-CG2 4.36Å; Y259-T330 HydrophobicContact CE2-CG2 4.34Å; Y259-T330 WeakPolarHBondContact CE2-O 3.44Å
260	S	97.4	Very high	90.1	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.007	5%	0.048	C	C	.	.	H	α-helix	trans	-63.6	-39.8	178.6	-57.8	0	0	0	0	111.7	V195 Y241 L256 D257 T263 V264	V195-S260 WeakPolarHBondContact O-CB 3.48Å; Y241-S260 WeakPolarHBondContact O-CA 3.42Å; Y241-S260 WeakPolarHBondContact O-CB 3.46Å; Y241-S260 PolarHBondContact O-OG 3.16Å; L256-S260 PolarHBondContact O-N 3.34Å; L256-S260 VanDerWaalsContact O-N 3.08Å; L256-S260 PolarHBondContact O-OG 3.19Å; D257-S260 PolarHBondContact O-N 3.08Å; S260-T263 WeakPolarHBondContact O-CB 3.43Å; S260-T263 PolarHBondContact O-N 3.49Å; S260-T263 VanDerWaalsContact O-N 3.15Å; S260-V264 WeakPolarHBondContact O-CG2 3.25Å; S260-V264 PolarHBondContact O-N 3.38Å
261	F	97.6	Very high	88.4	Confident	0 Å²	0	7.4 Å²	7.4	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-60.2	-46.3	170.7	173.5	-107.1	0	0	0	112.2	V172 I175 C176 L179 D257 V258 Y259 T263 V264 L265 L340 T343 L347	V172-F261 HydrophobicContact CG1-CE2 4.26Å; V172-F261 HydrophobicContact CG1-CZ 3.88Å; I175-F261 HydrophobicContact CB-CD2 4.43Å; I175-F261 HydrophobicContact CB-CE2 4.1Å; I175-F261 HydrophobicContact CG2-CD2 3.72Å; I175-F261 HydrophobicContact CG2-CE2 3.9Å; C176-F261 HydrophobicContact CB-CE1 4.35Å; C176-F261 HydrophobicContact CB-CE2 3.98Å; C176-F261 HydrophobicContact CB-CZ 3.67Å; L179-F261 HydrophobicContact CD1-CB 3.85Å; L179-F261 HydrophobicContact CD1-CD2 4Å; L179-F261 HydrophobicContact CD1-CG 4.19Å; D257-F261 VanDerWaalsContact O-CB 3.25Å; D257-F261 WeakPolarHBondContact O-CB 3.37Å; D257-F261 PolarHBondContact O-N 3.32Å; V258-F261 PolarHBondContact O-N 3.43Å; Y259-F261 VanDerWaalsContact C-N 3.33Å; Y259-F261 PolarHBondContact O-N 3.18Å; F261-T263 PolarHBondContact O-N 2.9Å; F261-V264 WeakPolarHBondContact O-CB 3.21Å; F261-V264 PolarHBondContact O-N 3.04Å; F261-V264 VanDerWaalsContact O-N 3.1Å; F261-L265 HydrophobicContact CD1-CD1 3.69Å; F261-L265 HydrophobicContact CD1-CG 4.5Å; F261-L265 HydrophobicContact CE1-CD1 3.25Å; F261-L265 HydrophobicContact CE1-CG 4.01Å; F261-L265 HydrophobicContact CE2-CD1 4.47Å; F261-L265 HydrophobicContact CE2-CG 4.39Å; F261-L265 HydrophobicContact CG-CD1 4.46Å; F261-L265 HydrophobicContact CZ-CD1 3.7Å; F261-L265 HydrophobicContact CZ-CD2 4.34Å; F261-L265 HydrophobicContact CZ-CG 3.95Å; F261-L265 PolarHBondContact O-N 3.2Å; F261-L340 HydrophobicContact CD1-CD2 4.08Å; F261-L340 HydrophobicContact CG-CD2 4.42Å; F261-T343 HydrophobicContact CD1-CG2 4.4Å; F261-T343 HydrophobicContact CE1-CG2 3.69Å; F261-L347 HydrophobicContact CZ-CD1 4.08Å
262	G	96.3	Very high	86.6	Confident	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-59.1	-32.2	173.2	0	0	0	0	0	113.4	V258 Y259 L265 I266 T330	V258-G262 PolarHBondContact O-N 2.8Å; Y259-G262 PolarHBondContact O-N 3.2Å; G262-L265 WeakPolarHBondContact O-CB 3.48Å; G262-I266 WeakPolarHBondContact O-CG1 3.43Å; G262-I266 PolarHBondContact O-N 3.32Å; G262-I266 VanDerWaalsContact O-N 3.08Å; G262-T330 VanDerWaalsContact C-CG2 3.43Å
263	T	93.7	Very high	84.8	Confident	1 Å²	1	8 Å²	8	1%	0.006	5%	0.054	C	C	.	.	H	α-helix	trans	-73.3	-38.6	174.4	-51.6	0	0	0	0	111.5	Y241 Y259 S260 F261 I266 D267 V287	Y241-T263 HydrophobicContact CD1-CG2 3.54Å; Y241-T263 HydrophobicContact CE1-CG2 3.93Å; Y241-T263 HydrophobicContact CG-CG2 4.12Å; Y259-T263 PolarHBondContact O-N 2.75Å; Y259-T263 PolarHBondContact O-OG1 2.86Å; S260-T263 WeakPolarHBondContact O-CB 3.43Å; S260-T263 PolarHBondContact O-N 3.49Å; S260-T263 VanDerWaalsContact O-N 3.15Å; F261-T263 PolarHBondContact O-N 2.9Å; T263-I266 WeakPolarHBondContact O-CB 3.26Å; T263-I266 PolarHBondContact O-N 2.92Å; T263-D267 WeakPolarHBondContact O-CB 3.37Å; T263-D267 PolarHBondContact O-N 3.12Å; T263-V287 HydrophobicContact CG2-CG2 4Å
264	V	93.4	Very high	83.2	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-63.5	-42.5	172.5	172.5	0	0	0	0	111.5	L151 I175 V195 Y241 S260 F261 I266 D267 E268	L151-V264 HydrophobicContact CD2-CG1 4.01Å; I175-V264 HydrophobicContact CD1-CG1 4.21Å; V195-V264 HydrophobicContact CG1-CG2 4.17Å; Y241-V264 HydrophobicContact CD1-CG2 3.98Å; Y241-V264 HydrophobicContact CE1-CG2 3.77Å; S260-V264 WeakPolarHBondContact O-CG2 3.25Å; S260-V264 PolarHBondContact O-N 3.38Å; F261-V264 WeakPolarHBondContact O-CB 3.21Å; F261-V264 PolarHBondContact O-N 3.04Å; F261-V264 VanDerWaalsContact O-N 3.1Å; V264-I266 PolarHBondContact O-N 2.75Å; V264-D267 WeakPolarHBondContact O-CB 3.12Å; V264-D267 PolarHBondContact O-N 2.98Å; V264-E268 HydrophobicContact CG1-CG 4.41Å; V264-E268 WeakPolarHBondContact O-CB 3.47Å; V264-E268 WeakPolarHBondContact O-CG 3.46Å; V264-E268 PolarHBondContact O-N 3.05Å
265	L	91.5	Very high	81.6	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-53.5	-53.5	171.3	-84.9	158.9	0	0	0	110.5	V172 F261 G262 D267 E268 Y269 F322 I325 A326	V172-L265 HydrophobicContact CB-CD2 4.29Å; V172-L265 HydrophobicContact CG1-CD2 3.26Å; V172-L265 HydrophobicContact CG1-CG 4.12Å; V172-L265 HydrophobicContact CG2-CD2 4.03Å; F261-L265 HydrophobicContact CD1-CD1 3.69Å; F261-L265 HydrophobicContact CD1-CG 4.5Å; F261-L265 HydrophobicContact CE1-CD1 3.25Å; F261-L265 HydrophobicContact CE1-CG 4.01Å; F261-L265 HydrophobicContact CE2-CD1 4.47Å; F261-L265 HydrophobicContact CE2-CG 4.39Å; F261-L265 HydrophobicContact CG-CD1 4.46Å; F261-L265 HydrophobicContact CZ-CD1 3.7Å; F261-L265 HydrophobicContact CZ-CD2 4.34Å; F261-L265 HydrophobicContact CZ-CG 3.95Å; F261-L265 PolarHBondContact O-N 3.2Å; G262-L265 WeakPolarHBondContact O-CB 3.48Å; L265-D267 VanDerWaalsContact C-N 3.34Å; L265-D267 PolarHBondContact O-N 3.31Å; L265-E268 WeakPolarHBondContact O-CB 3.19Å; L265-E268 PolarHBondContact O-N 2.9Å; L265-Y269 HydrophobicContact CB-CD2 4.5Å; L265-Y269 HydrophobicContact CB-CE2 4.04Å; L265-Y269 HydrophobicContact CD2-CE2 3.58Å; L265-Y269 HydrophobicContact CG-CE2 4.46Å; L265-Y269 WeakPolarHBondContact O-CD2 3.25Å; L265-Y269 VanDerWaalsContact O-CE2 3.25Å; L265-Y269 WeakPolarHBondContact O-CE2 3.11Å; L265-Y269 VanDerWaalsContact O-CG 3.3Å; L265-Y269 PolarHBondContact O-N 2.9Å; L265-Y269 VanDerWaalsContact O-N 3.14Å; L265-F322 HydrophobicContact CD2-CD1 3.91Å; L265-I325 HydrophobicContact CD1-CG2 4.13Å; L265-A326 HydrophobicContact CB-CB 3.71Å; L265-A326 HydrophobicContact CD1-CB 4.1Å; L265-A326 HydrophobicContact CG-CB 4.49Å
266	I	88.9	Confident	79.7	Confident	1 Å²	1	14.2 Å²	14.2	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-55.2	-51.8	176.7	-82	165.8	0	0	0	110	G262 T263 V264 E268 Y269 F270 L286 V287 M290 A326 T330	G262-I266 WeakPolarHBondContact O-CG1 3.43Å; G262-I266 PolarHBondContact O-N 3.32Å; G262-I266 VanDerWaalsContact O-N 3.08Å; T263-I266 WeakPolarHBondContact O-CB 3.26Å; T263-I266 PolarHBondContact O-N 2.92Å; V264-I266 PolarHBondContact O-N 2.75Å; I266-E268 PolarHBondContact O-N 3.07Å; I266-Y269 PolarHBondContact O-N 2.81Å; I266-F270 HydrophobicContact CB-CD2 4.33Å; I266-F270 HydrophobicContact CB-CE2 4.12Å; I266-F270 HydrophobicContact CG1-CE2 4.27Å; I266-F270 HydrophobicContact CG2-CD2 3.57Å; I266-F270 HydrophobicContact CG2-CE2 3.69Å; I266-F270 WeakPolarHBondContact O-CD2 3.43Å; I266-F270 VanDerWaalsContact O-CE2 3.3Å; I266-F270 WeakPolarHBondContact O-CE2 3.34Å; I266-F270 PolarHBondContact O-N 2.79Å; I266-L286 HydrophobicContact CG2-CB 4.46Å; I266-L286 HydrophobicContact CG2-CD1 4.39Å; I266-L286 HydrophobicContact CG2-CD2 3.5Å; I266-L286 HydrophobicContact CG2-CG 3.46Å; I266-L286 VanDerWaalsContact CG2-CG 3.46Å; I266-V287 HydrophobicContact CD1-CB 4.4Å; I266-V287 HydrophobicContact CD1-CG1 4.3Å; I266-V287 HydrophobicContact CD1-CG2 3.97Å; I266-M290 HydrophobicContact CG2-CG 3.94Å; I266-A326 HydrophobicContact CD1-CB 4.26Å; I266-A326 HydrophobicContact CG1-CB 3.8Å; I266-T330 HydrophobicContact CD1-CG2 4.13Å
267	D	83.4	Confident	77.9	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-54.9	-49.8	179.8	-161.3	20.6	0	0	0	113	H156 S197 Y241 T263 V264 L265 Y269 F270 A271 P276	H156-D267 IonicContact CE1-OD1 2.68Å; H156-D267 PolarHBondContact CE1-OD1 3.22Å; H156-D267 IonicContact NE2-OD1 2.71Å; H156-D267 PolarHBondContact NE2-OD1 2.99Å; H156-D267 IonicContact NE2-OD2 2.94Å; S197-D267 PolarHBondContact OG-OD2 3.22Å; Y241-D267 PolarHBondContact OH-OD2 3.11Å; T263-D267 WeakPolarHBondContact O-CB 3.37Å; T263-D267 PolarHBondContact O-N 3.12Å; V264-D267 WeakPolarHBondContact O-CB 3.12Å; V264-D267 PolarHBondContact O-N 2.98Å; L265-D267 VanDerWaalsContact C-N 3.34Å; L265-D267 PolarHBondContact O-N 3.31Å; D267-Y269 PolarHBondContact O-N 2.7Å; D267-F270 PolarHBondContact O-N 2.75Å; D267-A271 WeakPolarHBondContact O-CB 3.49Å; D267-A271 PolarHBondContact O-N 3.1Å; D267-P276 WeakPolarHBondContact OD1-CD 2.85Å; D267-P276 WeakPolarHBondContact OD2-CG 3.27Å
268	E	74.7	Confident	76.4	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-50.6	-38.8	172.2	-81.9	-108.4	-162.4	0	0	112.6	L151 L155 R168 I171 V172 V264 L265 I266	L151-E268 HydrophobicContact CD1-CG 4.45Å; L151-E268 VanDerWaalsContact CD1-OE1 3.23Å; L151-E268 WeakPolarHBondContact CD1-OE1 3.21Å; L151-E268 HydrophobicContact CD2-CG 3.88Å; L151-E268 WeakPolarHBondContact CD2-OE1 3.44Å; L155-E268 HydrophobicContact CD1-CB 4.47Å; L155-E268 HydrophobicContact CD1-CG 4.05Å; R168-E268 VanDerWaalsContact CB-OE2 3.27Å; R168-E268 WeakPolarHBondContact CB-OE2 3.36Å; R168-E268 WeakPolarHBondContact CD-OE2 3.2Å; R168-E268 WeakPolarHBondContact CG-OE2 3.39Å; R168-E268 PolarHBondContact NH1-O 2.93Å; I171-E268 WeakPolarHBondContact CG2-OE1 3.44Å; V172-E268 HydrophobicContact CG2-CG 4.18Å; V264-E268 HydrophobicContact CG1-CG 4.41Å; V264-E268 WeakPolarHBondContact O-CB 3.47Å; V264-E268 WeakPolarHBondContact O-CG 3.46Å; V264-E268 PolarHBondContact O-N 3.05Å; L265-E268 WeakPolarHBondContact O-CB 3.19Å; L265-E268 PolarHBondContact O-N 2.9Å; I266-E268 PolarHBondContact O-N 3.07Å
269	Y	70.5	Confident	74.8	Confident	2 Å²	2	25.3 Å²	25.3	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-84.6	-27.3	-174.7	-65.5	-40.7	0	0	0	115	W165 L265 I266 D267 D305 Y319 F322 I323	W165-Y269 HydrophobicContact CE3-CD1 4.35Å; W165-Y269 HydrophobicContact CE3-CE1 4.21Å; W165-Y269 AromaticContact CH2-CD1 3.29Å; W165-Y269 HydrophobicContact CH2-CD1 3.29Å; W165-Y269 AromaticContact CH2-CE1 2.98Å; W165-Y269 HydrophobicContact CH2-CE1 2.98Å; W165-Y269 HydrophobicContact CH2-CG 4.31Å; W165-Y269 AromaticContact CH2-CZ 3.84Å; W165-Y269 AromaticContact CZ2-CE1 3.95Å; W165-Y269 HydrophobicContact CZ2-CE1 3.95Å; W165-Y269 AromaticContact CZ3-CD1 3.17Å; W165-Y269 HydrophobicContact CZ3-CD1 3.17Å; W165-Y269 AromaticContact CZ3-CE1 3.17Å; W165-Y269 HydrophobicContact CZ3-CE1 3.17Å; W165-Y269 HydrophobicContact CZ3-CG 4.37Å; L265-Y269 HydrophobicContact CB-CD2 4.5Å; L265-Y269 HydrophobicContact CB-CE2 4.04Å; L265-Y269 HydrophobicContact CD2-CE2 3.58Å; L265-Y269 HydrophobicContact CG-CE2 4.46Å; L265-Y269 WeakPolarHBondContact O-CD2 3.25Å; L265-Y269 VanDerWaalsContact O-CE2 3.25Å; L265-Y269 WeakPolarHBondContact O-CE2 3.11Å; L265-Y269 VanDerWaalsContact O-CG 3.3Å; L265-Y269 PolarHBondContact O-N 2.9Å; L265-Y269 VanDerWaalsContact O-N 3.14Å; I266-Y269 PolarHBondContact O-N 2.81Å; D267-Y269 PolarHBondContact O-N 2.7Å; Y269-D305 PolarHBondContact O-N 2.91Å; Y269-Y319 HydrophobicContact CD1-CE2 4.48Å; Y269-Y319 HydrophobicContact CG-CE2 4.27Å; Y269-F322 HydrophobicContact CD2-CB 4.45Å; Y269-F322 HydrophobicContact CE1-CB 4.45Å; Y269-F322 HydrophobicContact CE2-CB 3.6Å; Y269-F322 HydrophobicContact CE2-CD1 4.09Å; Y269-F322 HydrophobicContact CE2-CG 4.29Å; Y269-F322 AromaticContact CZ-CD1 3.59Å; Y269-F322 AromaticContact CZ-CG 3.91Å; Y269-F322 WeakPolarHBondContact OH-CD1 3.22Å; Y269-F322 VanDerWaalsContact OH-CE1 3.27Å; Y269-F322 WeakPolarHBondContact OH-CE1 3.37Å; Y269-F322 WeakPolarHBondContact OH-CG 3.46Å; Y269-I323 HydrophobicContact CD2-CD1 3.99Å; Y269-I323 HydrophobicContact CG-CD1 4.31Å
270	F	65.5	Low	73.3	Confident	8 Å²	8	29.6 Å²	29.6	4%	0.035	18%	0.178	C	C	.	.	H	α-helix	trans	-93.4	-6.8	179.3	-64.1	-61.7	0	0	0	114	I266 D267 T272 L286 M290 L303 Y319 I323	I266-F270 HydrophobicContact CB-CD2 4.33Å; I266-F270 HydrophobicContact CB-CE2 4.12Å; I266-F270 HydrophobicContact CG1-CE2 4.27Å; I266-F270 HydrophobicContact CG2-CD2 3.57Å; I266-F270 HydrophobicContact CG2-CE2 3.69Å; I266-F270 WeakPolarHBondContact O-CD2 3.43Å; I266-F270 VanDerWaalsContact O-CE2 3.3Å; I266-F270 WeakPolarHBondContact O-CE2 3.34Å; I266-F270 PolarHBondContact O-N 2.79Å; D267-F270 PolarHBondContact O-N 2.75Å; F270-T272 VanDerWaalsContact C-N 3.28Å; F270-T272 PolarHBondContact O-N 2.78Å; F270-L286 HydrophobicContact CD2-CD1 4.25Å; F270-L286 HydrophobicContact CD2-CD2 4.39Å; F270-L286 HydrophobicContact CG-CD1 4.42Å; F270-M290 HydrophobicContact CD1-CE 4.44Å; F270-M290 HydrophobicContact CD1-SD 3.72Å; F270-M290 HydrophobicContact CD2-CE 4.32Å; F270-M290 HydrophobicContact CD2-CG 3.97Å; F270-M290 HydrophobicContact CD2-SD 3.68Å; F270-M290 HydrophobicContact CE1-CE 3.44Å; F270-M290 VanDerWaalsContact CE1-CE 3.44Å; F270-M290 HydrophobicContact CE1-SD 3.27Å; F270-M290 WeakPolarHBondContact CE1-SD 2.9Å; F270-M290 HydrophobicContact CE2-CE 3.33Å; F270-M290 HydrophobicContact CE2-CG 3.67Å; F270-M290 HydrophobicContact CE2-SD 3.28Å; F270-M290 WeakPolarHBondContact CE2-SD 3.36Å; F270-M290 HydrophobicContact CG-SD 3.99Å; F270-M290 HydrophobicContact CZ-CE 2.85Å; F270-M290 HydrophobicContact CZ-CG 4.12Å; F270-M290 HydrophobicContact CZ-SD 3.13Å; F270-M290 WeakPolarHBondContact CZ-SD 3.34Å; F270-L303 HydrophobicContact CD1-CB 3.64Å; F270-L303 WeakPolarHBondContact CD1-O 3.23Å; F270-L303 HydrophobicContact CE1-CB 3.51Å; F270-L303 HydrophobicContact CE1-CD1 4.26Å; F270-Y319 WeakPolarHBondContact CE1-OH 3.33Å; F270-I323 HydrophobicContact CE2-CD1 4.11Å; F270-I323 HydrophobicContact CZ-CD1 3.67Å
271	A	56.5	Low	72	Confident	3 Å²	3	30 Å²	30	3%	0.025	18%	0.18	C	C	.	.			trans	-71.2	67.4	-169	0	0	0	0	0	116	L155 D267 G273	L155-A271 HydrophobicContact CB-CB 3.58Å; L155-A271 HydrophobicContact CD1-CB 4.33Å; L155-A271 HydrophobicContact CD2-CB 3.75Å; L155-A271 HydrophobicContact CG-CB 4.05Å; D267-A271 WeakPolarHBondContact O-CB 3.49Å; D267-A271 PolarHBondContact O-N 3.1Å; A271-G273 VanDerWaalsContact C-N 3.31Å
272	T	52.4	Low	70.5	Confident	66 Å²	66	36 Å²	36	41%	0.405	22%	0.217	S	C	.	.	S	Bend	trans	-100.2	47.4	139.9	31.4	0	0	0	0	110.7	F270 D305 C307	F270-T272 VanDerWaalsContact C-N 3.28Å; F270-T272 PolarHBondContact O-N 2.78Å; T272-D305 HydrophobicContact CG2-CB 4.5Å; T272-D305 WeakPolarHBondContact CG2-OD1 3.45Å; T272-C307 HydrophobicContact CG2-CB 3.95Å; T272-C307 VanDerWaalsContact CG2-SG 3.55Å
273	G	52	Low	69.6	Low	37 Å²	37	37.6 Å²	37.6	38%	0.381	23%	0.227	S	C	.	.	S	Bend	trans	92.6	22.5	168.8	0	0	0	0	0	115.7	A271	A271-G273 VanDerWaalsContact C-N 3.31Å
274	Q	58.3	Low	68.8	Low	95 Å²	95	41.8 Å²	41.8	44%	0.444	25%	0.246	S	C	.	.			trans	-94.8	108.4	170.2	-66.3	-67	-34.8	0	0	109.5
275	S	59.3	Low	68.3	Low	59 Å²	59	43 Å²	43	41%	0.413	25%	0.253	S	S	.	.			trans	-62.2	146.9	176.1	161.6	0	0	0	0	111.9	Y277 R281	S275-Y277 VanDerWaalsContact CB-O 3.27Å; S275-Y277 WeakPolarHBondContact CB-O 3.39Å; S275-Y277 PolarHBondContact O-N 3.26Å; S275-Y277 PolarHBondContact OG-N 2.76Å; S275-Y277 PolarHBondContact OG-O 2.98Å; S275-R281 VanDerWaalsContact O-CZ 3.3Å; S275-R281 PolarHBondContact O-NH1 3.26Å; S275-R281 PolarHBondContact O-NH2 3.45Å
276	P	54.9	Low	67.9	Low	8 Å²	8	43.2 Å²	43.2	5%	0.052	25%	0.254	C	S	.	.	S	Bend	trans	-50.1	-27.3	172.1	-25.4	28.1	0	0	0	114.5	A240 Y241 D267 R281 L286	A240-P276 HydrophobicContact CB-CB 3.85Å; Y241-P276 HydrophobicContact CE1-CG 4.43Å; Y241-P276 HydrophobicContact CE2-CB 4.18Å; Y241-P276 HydrophobicContact CE2-CG 3.97Å; Y241-P276 WeakPolarHBondContact OH-CG 3.1Å; D267-P276 WeakPolarHBondContact OD1-CD 2.85Å; D267-P276 WeakPolarHBondContact OD2-CG 3.27Å; P276-R281 VanDerWaalsContact C-NH2 3.25Å; P276-R281 PolarHBondContact O-NH2 3.44Å; P276-L286 VanDerWaalsContact O-CB 3.24Å; P276-L286 WeakPolarHBondContact O-CB 3.4Å; P276-L286 PolarHBondContact O-N 3.25Å
277	Y	57.6	Low	67.9	Low	104 Å²	104	43.3 Å²	43.3	41%	0.408	25%	0.254	S	S	.	.	B	Isolated β-bridge	trans	-126	127.2	170.7	-179.5	-96.4	0	0	0	109.9	S275 T279 E284	S275-Y277 VanDerWaalsContact CB-O 3.27Å; S275-Y277 WeakPolarHBondContact CB-O 3.39Å; S275-Y277 PolarHBondContact O-N 3.26Å; S275-Y277 PolarHBondContact OG-N 2.76Å; S275-Y277 PolarHBondContact OG-O 2.98Å; Y277-T279 HydrophobicContact CE1-CG2 3.85Å; Y277-E284 HydrophobicContact CD2-CB 4.05Å; Y277-E284 HydrophobicContact CE2-CB 3.6Å; Y277-E284 HydrophobicContact CE2-CG 4.35Å; Y277-E284 WeakPolarHBondContact CE2-OE2 3.3Å; Y277-E284 VanDerWaalsContact CZ-OE2 3.24Å; Y277-E284 PolarHBondContact OH-OE2 2.98Å
278	S	64.8	Low	68.1	Low	24 Å²	24	48.8 Å²	48.8	17%	0.168	28%	0.28	C	S	.	.			trans	-143.6	125.5	173	-179.1	0	0	0	0	110.2	S280 R281 E284	S278-S280 PolarHBondContact O-N 3.19Å; S278-S280 PolarHBondContact OG-N 2.8Å; S278-S280 PolarHBondContact OG-OG 2.75Å; S278-R281 PolarHBondContact O-N 3.4Å; S278-R281 VanDerWaalsContact O-N 3.14Å; S278-E284 PolarHBondContact N-O 3.18Å; S278-E284 WeakPolarHBondContact O-CA 3.45Å
279	T	64.1	Low	68.7	Low	109 Å²	109	51.2 Å²	51.2	67%	0.669	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-17.7	174.8	53.3	0	0	0	0	112.7	Y277 R281	Y277-T279 HydrophobicContact CE1-CG2 3.85Å; T279-R281 VanDerWaalsContact C-N 3.26Å
280	S	65.6	Low	69.5	Low	103 Å²	103	51.1 Å²	51.1	72%	0.72	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-3.2	174.8	76	0	0	0	0	112.9	S278	S278-S280 PolarHBondContact O-N 3.19Å; S278-S280 PolarHBondContact OG-N 2.8Å; S278-S280 PolarHBondContact OG-OG 2.75Å
281	R	70.3	Confident	70.7	Confident	11 Å²	11	54.4 Å²	54.4	4%	0.042	30%	0.302	C	S	.	.	S	Bend	trans	-111.6	137.2	-177.1	-170.7	174.8	56.9	-136.2	-5	109.4	S275 P276 S278 T279 P283 E284 Y289	S275-R281 VanDerWaalsContact O-CZ 3.3Å; S275-R281 PolarHBondContact O-NH1 3.26Å; S275-R281 PolarHBondContact O-NH2 3.45Å; P276-R281 VanDerWaalsContact C-NH2 3.25Å; P276-R281 PolarHBondContact O-NH2 3.44Å; S278-R281 PolarHBondContact O-N 3.4Å; S278-R281 VanDerWaalsContact O-N 3.14Å; T279-R281 VanDerWaalsContact C-N 3.26Å; R281-P283 CarbonylContact C-O 3.17Å; R281-P283 WeakPolarHBondContact CG-O 3.36Å; R281-P283 CarbonylContact O-C 3.46Å; R281-E284 PolarHBondContact NH2-O 3.29Å; R281-E284 VanDerWaalsContact O-CA 3.23Å; R281-E284 WeakPolarHBondContact O-CA 3.3Å; R281-E284 PolarHBondContact O-N 2.67Å; R281-E284 VanDerWaalsContact O-N 3.12Å; R281-Y289 VanDerWaalsContact CD-CG 3.48Å; R281-Y289 HydrophobicContact CG-CD1 4.38Å; R281-Y289 HydrophobicContact CG-CD2 3.51Å; R281-Y289 HydrophobicContact CG-CE2 3.85Å; R281-Y289 HydrophobicContact CG-CG 3.81Å
282	T	67.8	Low	72.2	Confident	126 Å²	126	58.2 Å²	58.2	77%	0.773	32%	0.318	S	S	*	.	S	Bend	trans	-123.6	114.2	176	-47.9	0	0	0	0	108.5
283	P	77.6	Confident	74	Confident	32 Å²	32	56.2 Å²	56.2	21%	0.208	31%	0.305	C	S	.	.	S	Bend	cis	-64.4	152.2	-6.2	-20.5	33.1	0	0	0	115	R281 N285 Q288	R281-P283 CarbonylContact C-O 3.17Å; R281-P283 WeakPolarHBondContact CG-O 3.36Å; R281-P283 CarbonylContact O-C 3.46Å; P283-N285 VanDerWaalsContact C-N 3.32Å; P283-N285 PolarHBondContact O-N 3.06Å; P283-Q288 HydrophobicContact CB-CB 3.75Å; P283-Q288 HydrophobicContact CG-CB 3.92Å
284	E	75.4	Confident	75.7	Confident	89 Å²	89	57.5 Å²	57.5	42%	0.416	30%	0.298	S	S	.	.	S	Bend	trans	-66.6	-35	-179.2	-60.5	179.6	167.2	0	0	112.3	Y277 S278 R281	Y277-E284 HydrophobicContact CD2-CB 4.05Å; Y277-E284 HydrophobicContact CE2-CB 3.6Å; Y277-E284 HydrophobicContact CE2-CG 4.35Å; Y277-E284 WeakPolarHBondContact CE2-OE2 3.3Å; Y277-E284 VanDerWaalsContact CZ-OE2 3.24Å; Y277-E284 PolarHBondContact OH-OE2 2.98Å; S278-E284 PolarHBondContact N-O 3.18Å; S278-E284 WeakPolarHBondContact O-CA 3.45Å; R281-E284 PolarHBondContact NH2-O 3.29Å; R281-E284 VanDerWaalsContact O-CA 3.23Å; R281-E284 WeakPolarHBondContact O-CA 3.3Å; R281-E284 PolarHBondContact O-N 2.67Å; R281-E284 VanDerWaalsContact O-N 3.12Å
285	N	83.4	Confident	77.3	Confident	27 Å²	27	61.2 Å²	61.2	14%	0.144	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-74.5	125.9	176.1	176.5	-85	0	0	0	110.7	P283 V287 Q288 Y289	P283-N285 VanDerWaalsContact C-N 3.32Å; P283-N285 PolarHBondContact O-N 3.06Å; N285-V287 PolarHBondContact O-N 3.14Å; N285-V287 WeakPolarHBondContact OD1-CB 3.5Å; N285-V287 PolarHBondContact OD1-N 3.42Å; N285-Q288 HydrophobicContact CB-CB 4.29Å; N285-Q288 HydrophobicContact CB-CG 4.21Å; N285-Q288 PolarHBondContact O-N 3.42Å; N285-Q288 PolarHBondContact OD1-N 2.86Å; N285-Y289 PolarHBondContact O-N 3.24Å
286	L	83.7	Confident	78.8	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-41	-175.6	-178	59.5	0	0	0	112.9	I266 F270 P276 Q288 Y289 M290	I266-L286 HydrophobicContact CG2-CB 4.46Å; I266-L286 HydrophobicContact CG2-CD1 4.39Å; I266-L286 HydrophobicContact CG2-CD2 3.5Å; I266-L286 HydrophobicContact CG2-CG 3.46Å; I266-L286 VanDerWaalsContact CG2-CG 3.46Å; F270-L286 HydrophobicContact CD2-CD1 4.25Å; F270-L286 HydrophobicContact CD2-CD2 4.39Å; F270-L286 HydrophobicContact CG-CD1 4.42Å; P276-L286 VanDerWaalsContact O-CB 3.24Å; P276-L286 WeakPolarHBondContact O-CB 3.4Å; P276-L286 PolarHBondContact O-N 3.25Å; L286-Q288 PolarHBondContact O-N 2.85Å; L286-Y289 HydrophobicContact CD1-CD1 4.44Å; L286-Y289 PolarHBondContact O-N 2.97Å; L286-M290 HydrophobicContact CD1-CG 4.15Å; L286-M290 HydrophobicContact CG-CG 4.39Å; L286-M290 VanDerWaalsContact O-CB 3.3Å; L286-M290 WeakPolarHBondContact O-CB 2.78Å; L286-M290 WeakPolarHBondContact O-CG 3.46Å; L286-M290 PolarHBondContact O-N 3.27Å
287	V	88.8	Confident	80.3	Confident	3 Å²	3	69.4 Å²	69.4	2%	0.018	34%	0.342	C	S	.	.	H	α-helix	trans	-61.8	-45.1	178.3	179.6	0	0	0	0	111.2	T263 I266 N285 M290 R291 T330	T263-V287 HydrophobicContact CG2-CG2 4Å; I266-V287 HydrophobicContact CD1-CB 4.4Å; I266-V287 HydrophobicContact CD1-CG1 4.3Å; I266-V287 HydrophobicContact CD1-CG2 3.97Å; N285-V287 PolarHBondContact O-N 3.14Å; N285-V287 WeakPolarHBondContact OD1-CB 3.5Å; N285-V287 PolarHBondContact OD1-N 3.42Å; V287-M290 WeakPolarHBondContact O-CB 3.31Å; V287-M290 PolarHBondContact O-N 3.32Å; V287-R291 WeakPolarHBondContact O-CG 3.12Å; V287-R291 PolarHBondContact O-N 2.83Å; V287-T330 HydrophobicContact CG1-CG2 4.07Å; V287-T330 HydrophobicContact CG2-CG2 4.01Å
288	Q	88	Confident	81.7	Confident	115 Å²	115	66.8 Å²	66.8	54%	0.537	35%	0.347	S	S	.	.	H	α-helix	trans	-64.8	-43	178.2	-69.4	180	-12.3	0	0	111.7	P283 N285 L286 M290 R291 H292	P283-Q288 HydrophobicContact CB-CB 3.75Å; P283-Q288 HydrophobicContact CG-CB 3.92Å; N285-Q288 HydrophobicContact CB-CB 4.29Å; N285-Q288 HydrophobicContact CB-CG 4.21Å; N285-Q288 PolarHBondContact O-N 3.42Å; N285-Q288 PolarHBondContact OD1-N 2.86Å; L286-Q288 PolarHBondContact O-N 2.85Å; Q288-M290 VanDerWaalsContact C-N 3.32Å; Q288-M290 PolarHBondContact O-N 3.08Å; Q288-R291 PolarHBondContact O-N 3.48Å; Q288-H292 WeakPolarHBondContact O-CB 3.45Å; Q288-H292 PolarHBondContact O-N 3.27Å
289	Y	87	Confident	82.7	Confident	51 Å²	51	67.4 Å²	67.4	20%	0.2	35%	0.35	C	S	.	.	H	α-helix	trans	-58.1	-45.7	173.4	175.3	-100	0	0	0	112	R281 N285 L286 R291 H292 Q293 L303	R281-Y289 VanDerWaalsContact CD-CG 3.48Å; R281-Y289 HydrophobicContact CG-CD1 4.38Å; R281-Y289 HydrophobicContact CG-CD2 3.51Å; R281-Y289 HydrophobicContact CG-CE2 3.85Å; R281-Y289 HydrophobicContact CG-CG 3.81Å; N285-Y289 PolarHBondContact O-N 3.24Å; L286-Y289 HydrophobicContact CD1-CD1 4.44Å; L286-Y289 PolarHBondContact O-N 2.97Å; Y289-R291 PolarHBondContact O-N 3.48Å; Y289-H292 WeakPolarHBondContact O-CB 3.5Å; Y289-H292 PolarHBondContact O-N 2.75Å; Y289-H292 VanDerWaalsContact O-N 3.15Å; Y289-Q293 HydrophobicContact CD1-CG 4.09Å; Y289-Q293 HydrophobicContact CD2-CG 4.3Å; Y289-Q293 HydrophobicContact CE1-CG 3.75Å; Y289-Q293 HydrophobicContact CE2-CG 3.96Å; Y289-Q293 HydrophobicContact CG-CG 4.36Å; Y289-Q293 VanDerWaalsContact O-CG 3.23Å; Y289-Q293 WeakPolarHBondContact O-CG 3.37Å; Y289-Q293 PolarHBondContact O-N 2.81Å; Y289-Q293 PolarHBondContact OH-NE2 3.39Å; Y289-L303 HydrophobicContact CE1-CD1 3.96Å; Y289-L303 HydrophobicContact CE1-CD2 4.49Å
290	M	87.2	Confident	83.7	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-44	178.8	-79.2	-55.4	-54.6	0	0	113.2	I266 F270 L286 V287 Q288 H292 Q293 R294 V300 L303 F327	I266-M290 HydrophobicContact CG2-CG 3.94Å; F270-M290 HydrophobicContact CD1-CE 4.44Å; F270-M290 HydrophobicContact CD1-SD 3.72Å; F270-M290 HydrophobicContact CD2-CE 4.32Å; F270-M290 HydrophobicContact CD2-CG 3.97Å; F270-M290 HydrophobicContact CD2-SD 3.68Å; F270-M290 HydrophobicContact CE1-CE 3.44Å; F270-M290 VanDerWaalsContact CE1-CE 3.44Å; F270-M290 HydrophobicContact CE1-SD 3.27Å; F270-M290 WeakPolarHBondContact CE1-SD 2.9Å; F270-M290 HydrophobicContact CE2-CE 3.33Å; F270-M290 HydrophobicContact CE2-CG 3.67Å; F270-M290 HydrophobicContact CE2-SD 3.28Å; F270-M290 WeakPolarHBondContact CE2-SD 3.36Å; F270-M290 HydrophobicContact CG-SD 3.99Å; F270-M290 HydrophobicContact CZ-CE 2.85Å; F270-M290 HydrophobicContact CZ-CG 4.12Å; F270-M290 HydrophobicContact CZ-SD 3.13Å; F270-M290 WeakPolarHBondContact CZ-SD 3.34Å; L286-M290 HydrophobicContact CD1-CG 4.15Å; L286-M290 HydrophobicContact CG-CG 4.39Å; L286-M290 VanDerWaalsContact O-CB 3.3Å; L286-M290 WeakPolarHBondContact O-CB 2.78Å; L286-M290 WeakPolarHBondContact O-CG 3.46Å; L286-M290 PolarHBondContact O-N 3.27Å; V287-M290 WeakPolarHBondContact O-CB 3.31Å; V287-M290 PolarHBondContact O-N 3.32Å; Q288-M290 VanDerWaalsContact C-N 3.32Å; Q288-M290 PolarHBondContact O-N 3.08Å; M290-H292 VanDerWaalsContact C-N 3.34Å; M290-H292 PolarHBondContact O-N 2.9Å; M290-Q293 PolarHBondContact O-N 2.97Å; M290-R294 PolarHBondContact O-N 2.98Å; M290-V300 HydrophobicContact CE-CB 3.56Å; M290-V300 HydrophobicContact CE-CG1 3.57Å; M290-V300 HydrophobicContact CE-CG2 3.62Å; M290-L303 HydrophobicContact CE-CD1 4.45Å; M290-L303 HydrophobicContact SD-CD1 3.7Å; M290-F327 HydrophobicContact CB-CE1 3.85Å; M290-F327 HydrophobicContact CB-CZ 4.1Å; M290-F327 HydrophobicContact CE-CZ 4.15Å
291	R	89.6	Confident	84.4	Confident	78 Å²	78	59.3 Å²	59.3	29%	0.294	29%	0.294	S	S	.	.	H	α-helix	trans	-63.8	-40.7	174.2	-71.5	-176.4	177.6	-74.8	-2.3	112	V287 Q288 Y289 R294 F295 F327 T330	V287-R291 WeakPolarHBondContact O-CG 3.12Å; V287-R291 PolarHBondContact O-N 2.83Å; Q288-R291 PolarHBondContact O-N 3.48Å; Y289-R291 PolarHBondContact O-N 3.48Å; R291-R294 PolarHBondContact O-N 3.48Å; R291-F295 WeakPolarHBondContact O-CB 3.44Å; R291-F295 PolarHBondContact O-N 2.84Å; R291-F327 HydrophobicContact CG-CD1 3.95Å; R291-F327 HydrophobicContact CG-CE1 3.7Å; R291-F327 PolarHBondContact NH2-O 3.2Å; R291-T330 PolarHBondContact NH2-O 3.07Å; R291-T330 PolarHBondContact NH2-OG1 3.37Å
292	H	89.1	Confident	84.9	Confident	82 Å²	82	63.4 Å²	63.4	38%	0.38	31%	0.314	S	S	.	.	H	α-helix	trans	-61.6	-43.9	176.3	-176.9	-81.3	0	0	0	111.5	Q288 Y289 M290 F295 H296	Q288-H292 WeakPolarHBondContact O-CB 3.45Å; Q288-H292 PolarHBondContact O-N 3.27Å; Y289-H292 WeakPolarHBondContact O-CB 3.5Å; Y289-H292 PolarHBondContact O-N 2.75Å; Y289-H292 VanDerWaalsContact O-N 3.15Å; M290-H292 VanDerWaalsContact C-N 3.34Å; M290-H292 PolarHBondContact O-N 2.9Å; H292-F295 PolarHBondContact O-N 3.46Å; H292-H296 AromaticContact CD2-CE1 3.51Å; H292-H296 AromaticContact CD2-ND1 3.86Å; H292-H296 AromaticContact CE1-CE1 3.16Å; H292-H296 PolarHBondContact CE1-CE1 3.14Å; H292-H296 AromaticContact CE1-ND1 3.29Å; H292-H296 PolarHBondContact CE1-ND1 3.43Å; H292-H296 VanDerWaalsContact CE1-ND1 3.29Å; H292-H296 AromaticContact CE1-NE2 3.81Å; H292-H296 AromaticContact CG-CE1 3.9Å; H292-H296 AromaticContact CG-ND1 3.77Å; H292-H296 AromaticContact ND1-CE1 3.7Å; H292-H296 AromaticContact ND1-ND1 3.41Å; H292-H296 PolarHBondContact ND1-ND1 2.86Å; H292-H296 AromaticContact NE2-CE1 3.03Å; H292-H296 PolarHBondContact NE2-CE1 3.25Å; H292-H296 AromaticContact NE2-ND1 3.59Å; H292-H296 AromaticContact NE2-NE2 3.77Å; H292-H296 PolarHBondContact O-N 2.9Å; H292-H296 VanDerWaalsContact O-N 3.08Å; H292-H296 PolarHBondContact O-ND1 3.29Å
293	Q	89.2	Confident	85.4	Confident	24 Å²	24	59.1 Å²	59.1	11%	0.112	29%	0.286	C	S	.	.	H	α-helix	trans	-64.3	-47.4	177.8	-66.9	-72.2	-34.1	0	0	111.5	Y289 M290 F295 H296 F297 V300 H302 L303	Y289-Q293 HydrophobicContact CD1-CG 4.09Å; Y289-Q293 HydrophobicContact CD2-CG 4.3Å; Y289-Q293 HydrophobicContact CE1-CG 3.75Å; Y289-Q293 HydrophobicContact CE2-CG 3.96Å; Y289-Q293 HydrophobicContact CG-CG 4.36Å; Y289-Q293 VanDerWaalsContact O-CG 3.23Å; Y289-Q293 WeakPolarHBondContact O-CG 3.37Å; Y289-Q293 PolarHBondContact O-N 2.81Å; Y289-Q293 PolarHBondContact OH-NE2 3.39Å; M290-Q293 PolarHBondContact O-N 2.97Å; Q293-F295 VanDerWaalsContact C-N 3.29Å; Q293-F295 PolarHBondContact O-N 2.92Å; Q293-H296 PolarHBondContact O-N 3.33Å; Q293-F297 WeakPolarHBondContact O-CD2 3.38Å; Q293-F297 PolarHBondContact O-N 3.26Å; Q293-V300 HydrophobicContact CB-CG1 4.02Å; Q293-H302 PolarHBondContact OE1-NE2 3.09Å; Q293-L303 HydrophobicContact CB-CD1 3.88Å; Q293-L303 HydrophobicContact CG-CD1 3.81Å
294	R	89.3	Confident	85.4	Confident	64 Å²	64	59.2 Å²	59.2	24%	0.242	28%	0.284	C	S	.	.	H	α-helix	trans	-58.9	-39.9	175.6	-175.8	63.7	155.1	172	-15.2	112	M290 R291 G298 V300 D324 F327	M290-R294 PolarHBondContact O-N 2.98Å; R291-R294 PolarHBondContact O-N 3.48Å; R294-G298 PolarHBondContact NH1-O 3.44Å; R294-G298 CarbonylContact O-C 3.56Å; R294-G298 WeakPolarHBondContact O-CA 3.16Å; R294-G298 PolarHBondContact O-N 3.17Å; R294-V300 HydrophobicContact CB-CG1 3.72Å; R294-D324 IonicContact NH2-OD1 3.93Å; R294-D324 PolarHBondContact NH2-OD1 3.12Å; R294-F327 HydrophobicContact CB-CE2 3.89Å; R294-F327 HydrophobicContact CB-CZ 3.97Å; R294-F327 HydrophobicContact CG-CE2 3.79Å; R294-F327 HydrophobicContact CG-CZ 4.39Å
295	F	90.5	Very high	85.2	Confident	173 Å²	173	55.1 Å²	55.1	76%	0.759	27%	0.265	S	S	*	.	H	α-helix	trans	-65.7	-43	178	180	-97.1	0	0	0	112.7	R291 H292 Q293	R291-F295 WeakPolarHBondContact O-CB 3.44Å; R291-F295 PolarHBondContact O-N 2.84Å; H292-F295 PolarHBondContact O-N 3.46Å; Q293-F295 VanDerWaalsContact C-N 3.29Å; Q293-F295 PolarHBondContact O-N 2.92Å
296	H	90.2	Very high	84.6	Confident	108 Å²	108	57.7 Å²	57.7	50%	0.5	29%	0.29	S	S	.	.	H	α-helix	trans	-79.2	-40.5	-175.8	-74.9	78.9	0	0	0	113.6	H292 Q293	H292-H296 AromaticContact CD2-CE1 3.51Å; H292-H296 AromaticContact CD2-ND1 3.86Å; H292-H296 AromaticContact CE1-CE1 3.16Å; H292-H296 PolarHBondContact CE1-CE1 3.14Å; H292-H296 AromaticContact CE1-ND1 3.29Å; H292-H296 PolarHBondContact CE1-ND1 3.43Å; H292-H296 VanDerWaalsContact CE1-ND1 3.29Å; H292-H296 AromaticContact CE1-NE2 3.81Å; H292-H296 AromaticContact CG-CE1 3.9Å; H292-H296 AromaticContact CG-ND1 3.77Å; H292-H296 AromaticContact ND1-CE1 3.7Å; H292-H296 AromaticContact ND1-ND1 3.41Å; H292-H296 PolarHBondContact ND1-ND1 2.86Å; H292-H296 AromaticContact NE2-CE1 3.03Å; H292-H296 PolarHBondContact NE2-CE1 3.25Å; H292-H296 AromaticContact NE2-ND1 3.59Å; H292-H296 AromaticContact NE2-NE2 3.77Å; H292-H296 PolarHBondContact O-N 2.9Å; H292-H296 VanDerWaalsContact O-N 3.08Å; H292-H296 PolarHBondContact O-ND1 3.29Å; Q293-H296 PolarHBondContact O-N 3.33Å
297	F	87.7	Confident	83.8	Confident	131 Å²	131	61.2 Å²	61.2	58%	0.575	31%	0.314	S	S	*	.	H	α-helix	trans	-100.7	-6.7	-174.2	-64.6	-75.9	0	0	0	113.3	Q293 T299 H302	Q293-F297 WeakPolarHBondContact O-CD2 3.38Å; Q293-F297 PolarHBondContact O-N 3.26Å; F297-T299 PolarHBondContact O-N 2.87Å; F297-H302 AromaticContact CD2-CE1 3.69Å; F297-H302 AromaticContact CD2-NE2 3.73Å; F297-H302 AromaticContact CG-CE1 3.9Å
298	G	87.2	Confident	82.6	Confident	50 Å²	50	61.4 Å²	61.4	52%	0.515	32%	0.316	S	S	.	.	S	Bend	trans	71.6	-12.2	-173.3	0	0	0	0	0	113.9	R294	R294-G298 PolarHBondContact NH1-O 3.44Å; R294-G298 CarbonylContact O-C 3.56Å; R294-G298 WeakPolarHBondContact O-CA 3.16Å; R294-G298 PolarHBondContact O-N 3.17Å
299	T	85.6	Confident	81.4	Confident	37 Å²	37	58.5 Å²	58.5	23%	0.227	30%	0.302	C	S	.	.			trans	-147	167.6	177	-174	0	0	0	0	110.6	F297 N301 H302	F297-T299 PolarHBondContact O-N 2.87Å; T299-N301 HydrophobicContact CG2-CB 4.46Å; T299-N301 PolarHBondContact OG1-N 3.44Å; T299-N301 PolarHBondContact OG1-ND2 2.74Å; T299-N301 PolarHBondContact OG1-OD1 3.29Å; T299-H302 PolarHBondContact O-CE1 3.44Å
300	V	84.6	Confident	80	Confident	1 Å²	1	62 Å²	62	1%	0.006	32%	0.324	C	S	.	.			trans	-124	16.8	173.2	-63.1	0	0	0	0	111.3	M290 Q293 R294 H302 L303 Y319 I323	M290-V300 HydrophobicContact CE-CB 3.56Å; M290-V300 HydrophobicContact CE-CG1 3.57Å; M290-V300 HydrophobicContact CE-CG2 3.62Å; Q293-V300 HydrophobicContact CB-CG1 4.02Å; R294-V300 HydrophobicContact CB-CG1 3.72Å; V300-H302 PolarHBondContact O-N 3.12Å; V300-L303 HydrophobicContact CB-CD1 4.29Å; V300-L303 HydrophobicContact CG1-CD1 4.49Å; V300-L303 WeakPolarHBondContact O-CB 3.46Å; V300-L303 PolarHBondContact O-N 3.45Å; V300-Y319 HydrophobicContact CG2-CE1 4.39Å; V300-Y319 PolarHBondContact O-OH 2.79Å; V300-I323 HydrophobicContact CG2-CB 4.43Å; V300-I323 HydrophobicContact CG2-CD1 4.35Å; V300-I323 HydrophobicContact CG2-CG1 4.06Å; V300-I323 HydrophobicContact CG2-CG2 3.64Å
301	N	80.8	Confident	78.2	Confident	41 Å²	41	72.2 Å²	72.2	22%	0.219	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-64.8	-25.7	179.9	-64.7	-9.5	0	0	0	112.1	T299 L303 I304 Y319 E320	T299-N301 HydrophobicContact CG2-CB 4.46Å; T299-N301 PolarHBondContact OG1-N 3.44Å; T299-N301 PolarHBondContact OG1-ND2 2.74Å; T299-N301 PolarHBondContact OG1-OD1 3.29Å; N301-L303 PolarHBondContact O-N 2.9Å; N301-I304 HydrophobicContact CB-CD1 3.83Å; N301-I304 WeakPolarHBondContact O-CB 3.11Å; N301-I304 WeakPolarHBondContact O-CD1 3.32Å; N301-I304 VanDerWaalsContact O-CG1 3.23Å; N301-I304 WeakPolarHBondContact O-CG1 3.16Å; N301-I304 PolarHBondContact O-N 3.38Å; N301-Y319 WeakPolarHBondContact OD1-CD1 3.23Å; N301-Y319 VanDerWaalsContact OD1-CE1 3.27Å; N301-Y319 WeakPolarHBondContact OD1-CE1 3.39Å; N301-E320 PolarHBondContact ND2-OE1 3.47Å
302	H	80	Confident	76.1	Confident	97 Å²	97	74.8 Å²	74.8	45%	0.449	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-68.2	-10.6	173.8	62.1	-73.9	0	0	0	113.8	Q293 F297 T299 V300	Q293-H302 PolarHBondContact OE1-NE2 3.09Å; F297-H302 AromaticContact CD2-CE1 3.69Å; F297-H302 AromaticContact CD2-NE2 3.73Å; F297-H302 AromaticContact CG-CE1 3.9Å; T299-H302 PolarHBondContact O-CE1 3.44Å; V300-H302 PolarHBondContact O-N 3.12Å
303	L	79.2	Confident	74.3	Confident	35 Å²	35	75.7 Å²	75.7	18%	0.183	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-103.8	0.8	178.3	-56.8	175.2	0	0	0	112.6	F270 Y289 M290 Q293 V300 N301 D305	F270-L303 HydrophobicContact CD1-CB 3.64Å; F270-L303 WeakPolarHBondContact CD1-O 3.23Å; F270-L303 HydrophobicContact CE1-CB 3.51Å; F270-L303 HydrophobicContact CE1-CD1 4.26Å; Y289-L303 HydrophobicContact CE1-CD1 3.96Å; Y289-L303 HydrophobicContact CE1-CD2 4.49Å; M290-L303 HydrophobicContact CE-CD1 4.45Å; M290-L303 HydrophobicContact SD-CD1 3.7Å; Q293-L303 HydrophobicContact CB-CD1 3.88Å; Q293-L303 HydrophobicContact CG-CD1 3.81Å; V300-L303 HydrophobicContact CB-CD1 4.29Å; V300-L303 HydrophobicContact CG1-CD1 4.49Å; V300-L303 WeakPolarHBondContact O-CB 3.46Å; V300-L303 PolarHBondContact O-N 3.45Å; N301-L303 PolarHBondContact O-N 2.9Å; L303-D305 PolarHBondContact O-N 3.45Å
304	I	76.4	Confident	72.6	Confident	34 Å²	34	80.2 Å²	80.2	17%	0.174	43%	0.433	C	S	.	.	S	Bend	trans	-54.7	135.2	177.5	-74.3	167.8	0	0	0	110.1	N301 A306 F309 Y319	N301-I304 HydrophobicContact CB-CD1 3.83Å; N301-I304 WeakPolarHBondContact O-CB 3.11Å; N301-I304 WeakPolarHBondContact O-CD1 3.32Å; N301-I304 VanDerWaalsContact O-CG1 3.23Å; N301-I304 WeakPolarHBondContact O-CG1 3.16Å; N301-I304 PolarHBondContact O-N 3.38Å; I304-A306 PolarHBondContact O-N 2.7Å; I304-F309 HydrophobicContact CD1-CE2 4.43Å; I304-F309 HydrophobicContact CG2-CD2 3.5Å; I304-F309 HydrophobicContact CG2-CE2 3.36Å; I304-Y319 HydrophobicContact CB-CE2 4.4Å; I304-Y319 HydrophobicContact CD1-CD1 3.58Å; I304-Y319 HydrophobicContact CD1-CD2 4.25Å; I304-Y319 HydrophobicContact CD1-CE1 3.63Å; I304-Y319 HydrophobicContact CD1-CE2 4.3Å; I304-Y319 HydrophobicContact CD1-CG 3.91Å; I304-Y319 HydrophobicContact CG1-CD1 3.76Å; I304-Y319 HydrophobicContact CG1-CD2 3.85Å; I304-Y319 HydrophobicContact CG1-CE1 3.35Å; I304-Y319 HydrophobicContact CG1-CE2 3.46Å; I304-Y319 VanDerWaalsContact CG1-CE2 3.46Å; I304-Y319 HydrophobicContact CG1-CG 3.99Å
305	D	72.5	Confident	71.3	Confident	4 Å²	4	77.5 Å²	77.5	2%	0.021	43%	0.425	C	S	.	.			trans	-61	103.6	167	179	-5.2	0	0	0	111.4	R168 Y269 T272 L303 C307 A308	R168-D305 IonicContact CZ-OD2 3.07Å; R168-D305 IonicContact NH1-OD2 2.68Å; R168-D305 PolarHBondContact NH1-OD2 3.36Å; R168-D305 IonicContact NH2-OD2 2.72Å; R168-D305 PolarHBondContact NH2-OD2 2.83Å; Y269-D305 PolarHBondContact O-N 2.91Å; T272-D305 HydrophobicContact CG2-CB 4.5Å; T272-D305 WeakPolarHBondContact CG2-OD1 3.45Å; L303-D305 PolarHBondContact O-N 3.45Å; D305-C307 PolarHBondContact O-N 2.88Å; D305-C307 WeakPolarHBondContact OD1-CA 3.46Å; D305-C307 VanDerWaalsContact OD1-CB 3.22Å; D305-C307 WeakPolarHBondContact OD1-CB 3.47Å; D305-C307 PolarHBondContact OD1-N 3.23Å; D305-A308 HydrophobicContact CB-CB 4.25Å; D305-A308 WeakPolarHBondContact O-CB 3.47Å; D305-A308 PolarHBondContact O-N 2.88Å; D305-A308 VanDerWaalsContact O-N 3.16Å; D305-A308 PolarHBondContact OD1-N 3.29Å
306	A	69.5	Low	70.3	Confident	80 Å²	80	72.3 Å²	72.3	66%	0.661	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-19	178.3	0	0	0	0	0	113.9	I304	I304-A306 PolarHBondContact O-N 2.7Å
307	C	67.9	Low	69.5	Low	78 Å²	78	72.9 Å²	72.9	53%	0.527	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-19.1	175.9	-65	0	0	0	0	112.7	P162 T272 D305	P162-C307 HydrophobicContact CB-CB 4.14Å; P162-C307 HydrophobicContact CG-CB 4.03Å; T272-C307 HydrophobicContact CG2-CB 3.95Å; T272-C307 VanDerWaalsContact CG2-SG 3.55Å; D305-C307 PolarHBondContact O-N 2.88Å; D305-C307 WeakPolarHBondContact OD1-CA 3.46Å; D305-C307 VanDerWaalsContact OD1-CB 3.22Å; D305-C307 WeakPolarHBondContact OD1-CB 3.47Å; D305-C307 PolarHBondContact OD1-N 3.23Å
308	A	63.7	Low	68.9	Low	7 Å²	7	69.2 Å²	69.2	6%	0.058	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-21.7	178.6	0	0	0	0	0	113.4	W165 D305	W165-A308 PolarHBondContact N-O 2.79Å; D305-A308 HydrophobicContact CB-CB 4.25Å; D305-A308 WeakPolarHBondContact O-CB 3.47Å; D305-A308 PolarHBondContact O-N 2.88Å; D305-A308 VanDerWaalsContact O-N 3.16Å; D305-A308 PolarHBondContact OD1-N 3.29Å
309	F	63.2	Low	68.4	Low	54 Å²	54	66.9 Å²	66.9	24%	0.237	38%	0.376	C	S	.	.			trans	-88.6	107.3	-176.6	-93.3	-92.3	0	0	0	111.6	I304 K311	I304-F309 HydrophobicContact CD1-CE2 4.43Å; I304-F309 HydrophobicContact CG2-CD2 3.5Å; I304-F309 HydrophobicContact CG2-CE2 3.36Å; F309-K311 PolarHBondContact O-N 3.07Å
310	D	56	Low	68.2	Low	125 Å²	125	68 Å²	68	67%	0.668	38%	0.379	S	S	*	.			trans	-65.9	127.4	153.6	-82.4	-29.6	0	0	0	107.8	V312	D310-V312 PolarHBondContact O-N 2.98Å
311	K	50	Low	68.2	Low	214 Å²	214	72 Å²	72	93%	0.93	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	8.9	-170	-68.3	-179.2	175.8	178.6	0	116.4	F309	F309-K311 PolarHBondContact O-N 3.07Å
312	V	44.7	Very low	68.5	Low	132 Å²	132	70.2 Å²	70.2	80%	0.8	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	-6	-163.4	-179.1	0	0	0	0	114.8	D310	D310-V312 PolarHBondContact O-N 2.98Å
313	T	51.6	Low	68.9	Low	101 Å²	101	65.7 Å²	65.7	62%	0.62	36%	0.363	S	S	*	.	S	Bend	trans	-134.7	147.7	-168.4	14.1	0	0	0	0	116.9	G315	T313-G315 PolarHBondContact O-N 2.68Å
314	T	54.1	Low	69.5	Low	119 Å²	119	67.2 Å²	67.2	73%	0.73	37%	0.371	S	S	*	.			trans	-47.1	34.5	171	43.3	0	0	0	0	116.5	V316	T314-V316 PolarHBondContact O-N 3.3Å
315	G	62.5	Low	70.3	Confident	7 Å²	7	65.9 Å²	65.9	7%	0.072	36%	0.364	C	S	.	.	H	α-helix	trans	-80.6	-11.4	-171.5	0	0	0	0	0	115.4	T313 I318 Y319	T313-G315 PolarHBondContact O-N 2.68Å; G315-I318 PolarHBondContact O-N 3.17Å; G315-Y319 VanDerWaalsContact O-CB 3.3Å; G315-Y319 WeakPolarHBondContact O-CB 3.49Å; G315-Y319 PolarHBondContact O-N 3.32Å
316	V	69	Low	71.3	Confident	64 Å²	64	65.7 Å²	65.7	39%	0.388	36%	0.363	S	S	.	.	H	α-helix	trans	-65.4	-42.1	-177	-178.9	0	0	0	0	111.3	T314 I318 Y319 E320	T314-V316 PolarHBondContact O-N 3.3Å; V316-I318 VanDerWaalsContact C-N 3.34Å; V316-I318 PolarHBondContact O-N 3.32Å; V316-Y319 WeakPolarHBondContact O-CB 3.12Å; V316-Y319 PolarHBondContact O-N 2.78Å; V316-E320 HydrophobicContact CG1-CG 4.45Å; V316-E320 WeakPolarHBondContact O-CG 3.43Å; V316-E320 PolarHBondContact O-N 3Å
317	D	74.1	Confident	72.5	Confident	119 Å²	119	62.7 Å²	62.7	64%	0.636	34%	0.336	S	S	*	.	H	α-helix	trans	-65.8	-39	178.9	-61	-25.8	0	0	0	111.7	R321	D317-R321 PolarHBondContact O-N 2.91Å; D317-R321 VanDerWaalsContact O-N 3.14Å
318	I	74.4	Confident	73.9	Confident	54 Å²	54	62 Å²	62	28%	0.277	33%	0.326	S	S	.	.	H	α-helix	trans	-65.6	-45.2	174.3	-55.3	177.2	0	0	0	109	W165 G315 V316 E320 R321 F322	W165-I318 HydrophobicContact CZ2-CG2 4Å; G315-I318 PolarHBondContact O-N 3.17Å; V316-I318 VanDerWaalsContact C-N 3.34Å; V316-I318 PolarHBondContact O-N 3.32Å; I318-E320 PolarHBondContact O-N 3.34Å; I318-R321 WeakPolarHBondContact O-CB 3.43Å; I318-R321 PolarHBondContact O-N 2.86Å; I318-F322 HydrophobicContact CG2-CD2 3.79Å; I318-F322 HydrophobicContact CG2-CE2 3.61Å; I318-F322 WeakPolarHBondContact O-CD2 3.34Å; I318-F322 PolarHBondContact O-N 2.96Å
319	Y	76.5	Confident	75.5	Confident	1 Å²	1	61.6 Å²	61.6	0%	0.004	32%	0.323	C	S	.	.	H	α-helix	trans	-57.3	-50.8	176.8	174	-91.5	0	0	0	112.1	W165 Y269 F270 V300 N301 I304 G315 V316 R321 F322 I323	W165-Y319 AromaticContact CH2-CD2 3.65Å; W165-Y319 HydrophobicContact CH2-CD2 3.65Å; W165-Y319 HydrophobicContact CH2-CG 4.31Å; W165-Y319 AromaticContact CZ3-CD2 3.83Å; W165-Y319 HydrophobicContact CZ3-CD2 3.83Å; Y269-Y319 HydrophobicContact CD1-CE2 4.48Å; Y269-Y319 HydrophobicContact CG-CE2 4.27Å; F270-Y319 WeakPolarHBondContact CE1-OH 3.33Å; V300-Y319 HydrophobicContact CG2-CE1 4.39Å; V300-Y319 PolarHBondContact O-OH 2.79Å; N301-Y319 WeakPolarHBondContact OD1-CD1 3.23Å; N301-Y319 VanDerWaalsContact OD1-CE1 3.27Å; N301-Y319 WeakPolarHBondContact OD1-CE1 3.39Å; I304-Y319 HydrophobicContact CB-CE2 4.4Å; I304-Y319 HydrophobicContact CD1-CD1 3.58Å; I304-Y319 HydrophobicContact CD1-CD2 4.25Å; I304-Y319 HydrophobicContact CD1-CE1 3.63Å; I304-Y319 HydrophobicContact CD1-CE2 4.3Å; I304-Y319 HydrophobicContact CD1-CG 3.91Å; I304-Y319 HydrophobicContact CG1-CD1 3.76Å; I304-Y319 HydrophobicContact CG1-CD2 3.85Å; I304-Y319 HydrophobicContact CG1-CE1 3.35Å; I304-Y319 HydrophobicContact CG1-CE2 3.46Å; I304-Y319 VanDerWaalsContact CG1-CE2 3.46Å; I304-Y319 HydrophobicContact CG1-CG 3.99Å; G315-Y319 VanDerWaalsContact O-CB 3.3Å; G315-Y319 WeakPolarHBondContact O-CB 3.49Å; G315-Y319 PolarHBondContact O-N 3.32Å; V316-Y319 WeakPolarHBondContact O-CB 3.12Å; V316-Y319 PolarHBondContact O-N 2.78Å; Y319-R321 VanDerWaalsContact C-N 3.25Å; Y319-R321 PolarHBondContact O-N 3.22Å; Y319-F322 PolarHBondContact O-N 3.32Å; Y319-F322 VanDerWaalsContact O-N 3.12Å; Y319-I323 HydrophobicContact CD1-CG1 4.1Å; Y319-I323 HydrophobicContact CE1-CD1 4.34Å; Y319-I323 HydrophobicContact CE1-CG1 3.58Å; Y319-I323 HydrophobicContact CE2-CD1 4.15Å; Y319-I323 HydrophobicContact CE2-CG1 4.07Å; Y319-I323 WeakPolarHBondContact O-CG1 3.42Å; Y319-I323 PolarHBondContact O-N 3.23Å
320	E	81.7	Confident	77.1	Confident	62 Å²	62	59.1 Å²	59.1	29%	0.29	31%	0.312	S	S	.	.	H	α-helix	trans	-58.2	-40.5	179.5	-74.5	-164	162.6	0	0	111.5	N301 V316 I318 F322 I323 D324	N301-E320 PolarHBondContact ND2-OE1 3.47Å; V316-E320 HydrophobicContact CG1-CG 4.45Å; V316-E320 WeakPolarHBondContact O-CG 3.43Å; V316-E320 PolarHBondContact O-N 3Å; I318-E320 PolarHBondContact O-N 3.34Å; E320-F322 PolarHBondContact O-N 3.45Å; E320-I323 PolarHBondContact O-N 3.2Å; E320-D324 PolarHBondContact O-N 3.31Å
321	R	84.6	Confident	79	Confident	84 Å²	84	55 Å²	55	32%	0.317	29%	0.29	S	S	.	.	H	α-helix	trans	-61.1	-45.2	175.7	-176.5	-178.3	-56.4	-148.7	-1.7	112.8	D317 I318 Y319 I323 D324 I325 E350	D317-R321 PolarHBondContact O-N 2.91Å; D317-R321 VanDerWaalsContact O-N 3.14Å; I318-R321 WeakPolarHBondContact O-CB 3.43Å; I318-R321 PolarHBondContact O-N 2.86Å; Y319-R321 VanDerWaalsContact C-N 3.25Å; Y319-R321 PolarHBondContact O-N 3.22Å; R321-I323 VanDerWaalsContact C-N 3.32Å; R321-D324 PolarHBondContact O-N 3.06Å; R321-I325 HydrophobicContact CG-CD1 4.18Å; R321-I325 VanDerWaalsContact O-CG1 3.31Å; R321-I325 WeakPolarHBondContact O-CG1 3.34Å; R321-I325 PolarHBondContact O-N 3.2Å; R321-E350 IonicContact CZ-OE1 2.86Å; R321-E350 VanDerWaalsContact CZ-OE1 3.24Å; R321-E350 IonicContact CZ-OE2 3.4Å; R321-E350 IonicContact NH1-OE1 3.84Å; R321-E350 PolarHBondContact NH1-OE1 3.03Å; R321-E350 IonicContact NH1-OE2 3.29Å; R321-E350 PolarHBondContact NH1-OE2 3.16Å; R321-E350 IonicContact NH2-OE1 3.8Å; R321-E350 PolarHBondContact NH2-OE1 2.86Å; R321-E350 IonicContact NH2-OE2 2.7Å; R321-E350 PolarHBondContact NH2-OE2 3.39Å
322	F	86.9	Confident	81.1	Confident	3 Å²	3	50.4 Å²	50.4	1%	0.013	28%	0.275	C	S	.	.	H	α-helix	trans	-68.9	-33.8	-179.5	-85.9	-103.8	0	0	0	112.1	W165 Q169 V172 L265 Y269 I318 Y319 E320 I325 A326 L347	W165-F322 HydrophobicContact CZ2-CD2 4.34Å; W165-F322 HydrophobicContact CZ2-CG 4.45Å; Q169-F322 HydrophobicContact CB-CZ 4.26Å; Q169-F322 HydrophobicContact CG-CZ 3.76Å; V172-F322 HydrophobicContact CB-CE1 4.4Å; V172-F322 HydrophobicContact CG1-CD1 4.22Å; V172-F322 HydrophobicContact CG1-CE1 3.85Å; L265-F322 HydrophobicContact CD2-CD1 3.91Å; Y269-F322 HydrophobicContact CD2-CB 4.45Å; Y269-F322 HydrophobicContact CE1-CB 4.45Å; Y269-F322 HydrophobicContact CE2-CB 3.6Å; Y269-F322 HydrophobicContact CE2-CD1 4.09Å; Y269-F322 HydrophobicContact CE2-CG 4.29Å; Y269-F322 AromaticContact CZ-CD1 3.59Å; Y269-F322 AromaticContact CZ-CG 3.91Å; Y269-F322 WeakPolarHBondContact OH-CD1 3.22Å; Y269-F322 VanDerWaalsContact OH-CE1 3.27Å; Y269-F322 WeakPolarHBondContact OH-CE1 3.37Å; Y269-F322 WeakPolarHBondContact OH-CG 3.46Å; I318-F322 HydrophobicContact CG2-CD2 3.79Å; I318-F322 HydrophobicContact CG2-CE2 3.61Å; I318-F322 WeakPolarHBondContact O-CD2 3.34Å; I318-F322 PolarHBondContact O-N 2.96Å; Y319-F322 PolarHBondContact O-N 3.32Å; Y319-F322 VanDerWaalsContact O-N 3.12Å; E320-F322 PolarHBondContact O-N 3.45Å; F322-I325 PolarHBondContact O-N 3.03Å; F322-A326 WeakPolarHBondContact O-CB 3.41Å; F322-A326 PolarHBondContact O-N 3.02Å; F322-L347 HydrophobicContact CD1-CD2 3.54Å; F322-L347 HydrophobicContact CE1-CD2 3.21Å; F322-L347 HydrophobicContact CE2-CD2 4.35Å; F322-L347 HydrophobicContact CG-CD2 4.38Å; F322-L347 HydrophobicContact CZ-CD2 3.64Å
323	I	87.6	Confident	83.4	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-44.6	169.7	-69.1	-56.7	0	0	0	111.3	Y269 F270 V300 Y319 E320 R321 I325 A326 F327	Y269-I323 HydrophobicContact CD2-CD1 3.99Å; Y269-I323 HydrophobicContact CG-CD1 4.31Å; F270-I323 HydrophobicContact CE2-CD1 4.11Å; F270-I323 HydrophobicContact CZ-CD1 3.67Å; V300-I323 HydrophobicContact CG2-CB 4.43Å; V300-I323 HydrophobicContact CG2-CD1 4.35Å; V300-I323 HydrophobicContact CG2-CG1 4.06Å; V300-I323 HydrophobicContact CG2-CG2 3.64Å; Y319-I323 HydrophobicContact CD1-CG1 4.1Å; Y319-I323 HydrophobicContact CE1-CD1 4.34Å; Y319-I323 HydrophobicContact CE1-CG1 3.58Å; Y319-I323 HydrophobicContact CE2-CD1 4.15Å; Y319-I323 HydrophobicContact CE2-CG1 4.07Å; Y319-I323 WeakPolarHBondContact O-CG1 3.42Å; Y319-I323 PolarHBondContact O-N 3.23Å; E320-I323 PolarHBondContact O-N 3.2Å; R321-I323 VanDerWaalsContact C-N 3.32Å; I323-I325 VanDerWaalsContact C-N 3.35Å; I323-I325 PolarHBondContact O-N 2.78Å; I323-A326 PolarHBondContact O-N 3.49Å; I323-A326 VanDerWaalsContact O-N 3.17Å; I323-F327 HydrophobicContact CG2-CD2 3.72Å; I323-F327 HydrophobicContact CG2-CE2 3.42Å; I323-F327 VanDerWaalsContact CG2-CE2 3.42Å; I323-F327 HydrophobicContact CG2-CZ 4.14Å; I323-F327 PolarHBondContact O-N 3.49Å
324	D	91.8	Very high	85.4	Confident	68 Å²	68	45.3 Å²	45.3	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-63.9	-41.5	177.9	-71.1	-20	0	0	0	111	R294 E320 R321 A326 F327 D328	R294-D324 IonicContact NH2-OD1 3.93Å; R294-D324 PolarHBondContact NH2-OD1 3.12Å; E320-D324 PolarHBondContact O-N 3.31Å; R321-D324 PolarHBondContact O-N 3.06Å; D324-A326 VanDerWaalsContact C-N 3.33Å; D324-A326 PolarHBondContact O-N 3.29Å; D324-F327 PolarHBondContact O-N 2.85Å; D324-D328 PolarHBondContact O-N 3.04Å
325	I	94.2	Very high	87.3	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-58.5	-45.5	171.5	-68.8	167.8	0	0	0	110.8	L265 R321 F322 I323 F327 D328 C329 T343 K346 L347	L265-I325 HydrophobicContact CD1-CG2 4.13Å; R321-I325 HydrophobicContact CG-CD1 4.18Å; R321-I325 VanDerWaalsContact O-CG1 3.31Å; R321-I325 WeakPolarHBondContact O-CG1 3.34Å; R321-I325 PolarHBondContact O-N 3.2Å; F322-I325 PolarHBondContact O-N 3.03Å; I323-I325 VanDerWaalsContact C-N 3.35Å; I323-I325 PolarHBondContact O-N 2.78Å; I325-F327 VanDerWaalsContact C-N 3.32Å; I325-F327 PolarHBondContact O-N 2.68Å; I325-D328 WeakPolarHBondContact O-CB 3.27Å; I325-D328 PolarHBondContact O-N 3.37Å; I325-C329 WeakPolarHBondContact O-CB 3.3Å; I325-C329 PolarHBondContact O-N 3.18Å; I325-C329 PolarHBondContact O-SG 3.3Å; I325-T343 HydrophobicContact CG2-CG2 3.68Å; I325-K346 HydrophobicContact CD1-CB 3.73Å; I325-K346 HydrophobicContact CG1-CB 4.09Å; I325-K346 HydrophobicContact CG1-CD 4.09Å; I325-L347 HydrophobicContact CD1-CD2 3.65Å; I325-L347 HydrophobicContact CD1-CG 4.15Å; I325-L347 HydrophobicContact CG2-CD2 4.5Å
326	A	94	Very high	88.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.1	-36.7	179.9	0	0	0	0	0	112	L265 I266 F322 I323 D324 C329 T330	L265-A326 HydrophobicContact CB-CB 3.71Å; L265-A326 HydrophobicContact CD1-CB 4.1Å; L265-A326 HydrophobicContact CG-CB 4.49Å; I266-A326 HydrophobicContact CD1-CB 4.26Å; I266-A326 HydrophobicContact CG1-CB 3.8Å; F322-A326 WeakPolarHBondContact O-CB 3.41Å; F322-A326 PolarHBondContact O-N 3.02Å; I323-A326 PolarHBondContact O-N 3.49Å; I323-A326 VanDerWaalsContact O-N 3.17Å; D324-A326 VanDerWaalsContact C-N 3.33Å; D324-A326 PolarHBondContact O-N 3.29Å; A326-C329 PolarHBondContact O-N 2.7Å; A326-T330 WeakPolarHBondContact O-CB 3.46Å; A326-T330 WeakPolarHBondContact O-CG2 3.13Å; A326-T330 PolarHBondContact O-N 3.07Å; A326-T330 PolarHBondContact O-OG1 2.9Å
327	F	94.8	Very high	90.2	Very high	18 Å²	18	45.5 Å²	45.5	8%	0.079	23%	0.227	C	C	.	.	H	α-helix	trans	-69.6	-35.1	173	-74.4	-35.6	0	0	0	113.3	M290 R291 R294 I323 D324 I325 N331	M290-F327 HydrophobicContact CB-CE1 3.85Å; M290-F327 HydrophobicContact CB-CZ 4.1Å; M290-F327 HydrophobicContact CE-CZ 4.15Å; R291-F327 HydrophobicContact CG-CD1 3.95Å; R291-F327 HydrophobicContact CG-CE1 3.7Å; R291-F327 PolarHBondContact NH2-O 3.2Å; R294-F327 HydrophobicContact CB-CE2 3.89Å; R294-F327 HydrophobicContact CB-CZ 3.97Å; R294-F327 HydrophobicContact CG-CE2 3.79Å; R294-F327 HydrophobicContact CG-CZ 4.39Å; I323-F327 HydrophobicContact CG2-CD2 3.72Å; I323-F327 HydrophobicContact CG2-CE2 3.42Å; I323-F327 VanDerWaalsContact CG2-CE2 3.42Å; I323-F327 HydrophobicContact CG2-CZ 4.14Å; I323-F327 PolarHBondContact O-N 3.49Å; D324-F327 PolarHBondContact O-N 2.85Å; I325-F327 VanDerWaalsContact C-N 3.32Å; I325-F327 PolarHBondContact O-N 2.68Å; F327-N331 PolarHBondContact O-N 2.81Å
328	D	96.5	Very high	91.3	Very high	62 Å²	62	40.5 Å²	40.5	33%	0.332	20%	0.201	S	C	.	.	H	α-helix	trans	-63.2	-48.7	171.3	-75.7	-12.7	0	0	0	110.3	D324 I325 T330 N331 P338 K346	D324-D328 PolarHBondContact O-N 3.04Å; I325-D328 WeakPolarHBondContact O-CB 3.27Å; I325-D328 PolarHBondContact O-N 3.37Å; D328-T330 VanDerWaalsContact C-N 3.31Å; D328-T330 PolarHBondContact O-N 3.25Å; D328-N331 WeakPolarHBondContact O-CB 3.18Å; D328-N331 PolarHBondContact O-N 2.88Å; D328-P338 HydrophobicContact CB-CG 4.17Å; D328-P338 WeakPolarHBondContact O-CD 3.37Å; D328-K346 IonicContact OD2-NZ 3.02Å; D328-K346 PolarHBondContact OD2-NZ 2.98Å
329	C	97.5	Very high	92.3	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.6	-35.4	178.5	-71.6	0	0	0	0	112.9	V258 Y259 I325 A326 R337	V258-C329 HydrophobicContact CG1-CB 3.95Å; V258-C329 WeakPolarHBondContact O-CB 3.5Å; Y259-C329 WeakPolarHBondContact CA-O 3.24Å; I325-C329 WeakPolarHBondContact O-CB 3.3Å; I325-C329 PolarHBondContact O-N 3.18Å; I325-C329 PolarHBondContact O-SG 3.3Å; A326-C329 PolarHBondContact O-N 2.7Å; C329-R337 WeakPolarHBondContact O-CD 3.27Å; C329-R337 WeakPolarHBondContact O-CG 3.38Å
330	T	96	Very high	93.2	Very high	1 Å²	1	39 Å²	39	1%	0.006	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	23	179.9	60.5	0	0	0	0	113.8	Y259 G262 I266 V287 R291 A326 D328 I332	Y259-T330 HydrophobicContact CD2-CG2 4.36Å; Y259-T330 HydrophobicContact CE2-CG2 4.34Å; Y259-T330 WeakPolarHBondContact CE2-O 3.44Å; G262-T330 VanDerWaalsContact C-CG2 3.43Å; I266-T330 HydrophobicContact CD1-CG2 4.13Å; V287-T330 HydrophobicContact CG1-CG2 4.07Å; V287-T330 HydrophobicContact CG2-CG2 4.01Å; R291-T330 PolarHBondContact NH2-O 3.07Å; R291-T330 PolarHBondContact NH2-OG1 3.37Å; A326-T330 WeakPolarHBondContact O-CB 3.46Å; A326-T330 WeakPolarHBondContact O-CG2 3.13Å; A326-T330 PolarHBondContact O-N 3.07Å; A326-T330 PolarHBondContact O-OG1 2.9Å; D328-T330 VanDerWaalsContact C-N 3.31Å; D328-T330 PolarHBondContact O-N 3.25Å; T330-I332 PolarHBondContact O-N 2.96Å
331	N	96.4	Very high	93.9	Very high	38 Å²	38	38.8 Å²	38.8	20%	0.203	20%	0.2	C	C	.	.			trans	-58.7	140.4	177.1	-162	-52.3	0	0	0	110.8	F327 D328 Q333 L336 R337	F327-N331 PolarHBondContact O-N 2.81Å; D328-N331 WeakPolarHBondContact O-CB 3.18Å; D328-N331 PolarHBondContact O-N 2.88Å; N331-Q333 PolarHBondContact O-N 3.33Å; N331-Q333 PolarHBondContact OD1-N 3.14Å; N331-L336 HydrophobicContact CB-CB 4.32Å; N331-R337 HydrophobicContact CB-CG 3.89Å; N331-R337 VanDerWaalsContact O-CZ 3.31Å; N331-R337 PolarHBondContact O-NE 3.47Å; N331-R337 PolarHBondContact O-NH2 3.37Å
332	I	94	Very high	94.4	Very high	119 Å²	119	39.4 Å²	39.4	61%	0.61	21%	0.207	S	C	*	.	S	Bend	trans	-63.4	-33.9	178.8	-63.2	171	0	0	0	110.4	T330 P334	T330-I332 PolarHBondContact O-N 2.96Å; I332-P334 WeakPolarHBondContact O-CD 3.33Å
333	Q	93.8	Very high	94.9	Very high	96 Å²	96	39.3 Å²	39.3	45%	0.449	21%	0.206	S	C	.	.	S	Bend	trans	-87.7	113.5	175.2	-70.2	-175.1	-96	0	0	110	N331 E335 L336	N331-Q333 PolarHBondContact O-N 3.33Å; N331-Q333 PolarHBondContact OD1-N 3.14Å; Q333-E335 HydrophobicContact CB-CG 4.48Å; Q333-E335 WeakPolarHBondContact CB-OE1 3.28Å; Q333-E335 PolarHBondContact NE2-OE1 2.96Å; Q333-E335 PolarHBondContact O-N 3.12Å; Q333-L336 HydrophobicContact CB-CB 4.19Å; Q333-L336 HydrophobicContact CB-CD1 3.87Å; Q333-L336 HydrophobicContact CB-CG 3.83Å; Q333-L336 HydrophobicContact CG-CD1 4.35Å; Q333-L336 PolarHBondContact O-N 2.66Å; Q333-L336 VanDerWaalsContact O-N 3.07Å
334	P	94.1	Very high	95.2	Very high	29 Å²	29	40.2 Å²	40.2	19%	0.188	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-57.8	-35.7	-177.9	-24.6	34.4	0	0	0	113.6	E245 K255 I332 L336 R337	E245-P334 HydrophobicContact CB-CG 4.43Å; E245-P334 VanDerWaalsContact CD-CG 3.43Å; E245-P334 HydrophobicContact CG-CG 3.66Å; E245-P334 WeakPolarHBondContact OE1-CG 3.49Å; K255-P334 HydrophobicContact CB-CB 4.06Å; K255-P334 HydrophobicContact CG-CB 4.33Å; I332-P334 WeakPolarHBondContact O-CD 3.33Å; P334-L336 PolarHBondContact O-N 3.29Å; P334-R337 WeakPolarHBondContact O-CB 3.49Å; P334-R337 PolarHBondContact O-N 3.36Å
335	E	93.1	Very high	95.3	Very high	96 Å²	96	43.6 Å²	43.6	45%	0.449	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-66.6	-21	179.3	65.3	-83.9	-167.7	0	0	113.8	Q333	Q333-E335 HydrophobicContact CB-CG 4.48Å; Q333-E335 WeakPolarHBondContact CB-OE1 3.28Å; Q333-E335 PolarHBondContact NE2-OE1 2.96Å; Q333-E335 PolarHBondContact O-N 3.12Å
336	L	95.9	Very high	95.2	Very high	95 Å²	95	47 Å²	47	50%	0.497	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-91.3	-10.6	176.7	-62.2	-174.4	0	0	0	112.8	N331 Q333 P334	N331-L336 HydrophobicContact CB-CB 4.32Å; Q333-L336 HydrophobicContact CB-CB 4.19Å; Q333-L336 HydrophobicContact CB-CD1 3.87Å; Q333-L336 HydrophobicContact CB-CG 3.83Å; Q333-L336 HydrophobicContact CG-CD1 4.35Å; Q333-L336 PolarHBondContact O-N 2.66Å; Q333-L336 VanDerWaalsContact O-N 3.07Å; P334-L336 PolarHBondContact O-N 3.29Å
337	R	96.8	Very high	95	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.015	23%	0.234	C	C	.	.	S	Bend	trans	-71.7	139.5	174.9	-58.4	173.6	-169.2	149	13.3	108.6	E245 K255 V258 C329 N331 P334	E245-R337 VanDerWaalsContact CD-NH2 3.3Å; E245-R337 IonicContact OE1-CZ 3.63Å; E245-R337 VanDerWaalsContact OE1-CZ 3.29Å; E245-R337 IonicContact OE1-NH1 3.89Å; E245-R337 PolarHBondContact OE1-NH1 2.99Å; E245-R337 IonicContact OE1-NH2 3.41Å; E245-R337 PolarHBondContact OE1-NH2 3.25Å; E245-R337 IonicContact OE2-CZ 3.84Å; E245-R337 IonicContact OE2-NH1 3.95Å; E245-R337 IonicContact OE2-NH2 2.85Å; E245-R337 PolarHBondContact OE2-NH2 2.99Å; K255-R337 HydrophobicContact CD-CB 4.21Å; K255-R337 PolarHBondContact NZ-O 2.86Å; K255-R337 PolarHBondContact O-NH1 3.49Å; V258-R337 HydrophobicContact CG1-CB 4.03Å; C329-R337 WeakPolarHBondContact O-CD 3.27Å; C329-R337 WeakPolarHBondContact O-CG 3.38Å; N331-R337 HydrophobicContact CB-CG 3.89Å; N331-R337 VanDerWaalsContact O-CZ 3.31Å; N331-R337 PolarHBondContact O-NE 3.47Å; N331-R337 PolarHBondContact O-NH2 3.37Å; P334-R337 WeakPolarHBondContact O-CB 3.49Å; P334-R337 PolarHBondContact O-N 3.36Å
338	P	96.4	Very high	94.6	Very high	14 Å²	14	49.6 Å²	49.6	9%	0.091	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-65	163.2	175.6	28.1	-35	0	0	0	111.4	K255 D328 E342 T343	K255-P338 PolarHBondContact NZ-O 3.43Å; D328-P338 HydrophobicContact CB-CG 4.17Å; D328-P338 WeakPolarHBondContact O-CD 3.37Å; P338-E342 HydrophobicContact CB-CB 4.2Å; P338-T343 WeakPolarHBondContact CG-OG1 3.36Å
339	S	95.7	Very high	93.3	Very high	21 Å²	21	53.8 Å²	53.8	15%	0.147	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-69.8	159.1	160.5	63.8	0	0	0	0	110.1	S341 E342 T343	S339-S341 PolarHBondContact O-N 2.95Å; S339-E342 PolarHBondContact N-OE2 3.5Å; S339-E342 PolarHBondContact O-N 3.46Å; S339-E342 WeakPolarHBondContact OG-CB 3.35Å; S339-E342 VanDerWaalsContact OG-CD 3.29Å; S339-E342 WeakPolarHBondContact OG-CG 3.41Å; S339-E342 PolarHBondContact OG-N 3.34Å; S339-E342 VanDerWaalsContact OG-N 3.1Å; S339-E342 PolarHBondContact OG-OE2 2.88Å; S339-T343 WeakPolarHBondContact O-CB 3.48Å; S339-T343 PolarHBondContact O-N 3.15Å; S339-T343 PolarHBondContact O-OG1 3.38Å
340	L	96.2	Very high	91.3	Very high	3 Å²	3	60 Å²	60	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-67.9	-26.1	173.5	-69.1	175.2	0	0	0	112.3	L179 N180 H183 V258 F261 T343 L344	L179-L340 VanDerWaalsContact C-CD1 3.47Å; L179-L340 HydrophobicContact CB-CD1 3.31Å; N180-L340 HydrophobicContact CB-CB 3.81Å; H183-L340 VanDerWaalsContact CE1-CD1 3.48Å; H183-L340 WeakPolarHBondContact CE1-CD1 3.4Å; H183-L340 WeakPolarHBondContact ND1-CD1 3.34Å; V258-L340 HydrophobicContact CG2-CD2 4.19Å; V258-L340 HydrophobicContact CG2-CG 4Å; F261-L340 HydrophobicContact CD1-CD2 4.08Å; F261-L340 HydrophobicContact CG-CD2 4.42Å; L340-T343 PolarHBondContact O-N 3.21Å; L340-L344 WeakPolarHBondContact O-CB 3.23Å; L340-L344 PolarHBondContact O-N 3Å
341	S	95.5	Very high	88.8	Confident	56 Å²	56	67.8 Å²	67.8	39%	0.392	34%	0.338	S	S	.	.	H	α-helix	trans	-62.9	-46.8	171.3	-67.6	0	0	0	0	111.6	N180 S339 T343 R345	N180-S341 PolarHBondContact ND2-OG 2.7Å; N180-S341 WeakPolarHBondContact OD1-CA 3.34Å; N180-S341 PolarHBondContact OD1-N 2.67Å; N180-S341 PolarHBondContact OD1-OG 2.96Å; S339-S341 PolarHBondContact O-N 2.95Å; S341-T343 VanDerWaalsContact C-N 3.35Å; S341-R345 PolarHBondContact O-N 3.32Å; S341-R345 VanDerWaalsContact O-N 3.09Å
342	E	95.8	Very high	88.4	Confident	98 Å²	98	69.3 Å²	69.3	46%	0.458	35%	0.345	S	S	.	.	H	α-helix	trans	-66.6	-38.5	175.5	-71.5	162.8	145.5	0	0	112.1	P338 S339 R345 K346	P338-E342 HydrophobicContact CB-CB 4.2Å; S339-E342 PolarHBondContact N-OE2 3.5Å; S339-E342 PolarHBondContact O-N 3.46Å; S339-E342 WeakPolarHBondContact OG-CB 3.35Å; S339-E342 VanDerWaalsContact OG-CD 3.29Å; S339-E342 WeakPolarHBondContact OG-CG 3.41Å; S339-E342 PolarHBondContact OG-N 3.34Å; S339-E342 VanDerWaalsContact OG-N 3.1Å; S339-E342 PolarHBondContact OG-OE2 2.88Å; E342-R345 WeakPolarHBondContact O-CB 3.48Å; E342-R345 PolarHBondContact O-N 2.74Å; E342-K346 WeakPolarHBondContact O-CG 3.39Å; E342-K346 PolarHBondContact O-N 2.95Å
343	T	96.1	Very high	88.1	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.1	-47.8	177.5	-55.9	0	0	0	0	110.6	F261 I325 P338 S339 L340 S341 R345 K346 L347	F261-T343 HydrophobicContact CD1-CG2 4.4Å; F261-T343 HydrophobicContact CE1-CG2 3.69Å; I325-T343 HydrophobicContact CG2-CG2 3.68Å; P338-T343 WeakPolarHBondContact CG-OG1 3.36Å; S339-T343 WeakPolarHBondContact O-CB 3.48Å; S339-T343 PolarHBondContact O-N 3.15Å; S339-T343 PolarHBondContact O-OG1 3.38Å; L340-T343 PolarHBondContact O-N 3.21Å; S341-T343 VanDerWaalsContact C-N 3.35Å; T343-R345 VanDerWaalsContact C-N 3.3Å; T343-R345 PolarHBondContact O-N 3.44Å; T343-K346 WeakPolarHBondContact O-CB 3.23Å; T343-K346 PolarHBondContact O-N 2.94Å; T343-L347 HydrophobicContact CG2-CD1 4.16Å; T343-L347 WeakPolarHBondContact O-CG 3.43Å; T343-L347 PolarHBondContact O-N 3.03Å
344	L	95	Very high	87.8	Confident	22 Å²	22	65 Å²	65	12%	0.115	32%	0.324	C	S	.	.	H	α-helix	trans	-58.7	-43.6	176.9	-177.1	61.2	0	0	0	111.3	T173 C176 R177 L340 K346 L347 E348	T173-L344 HydrophobicContact CG2-CD1 4Å; C176-L344 HydrophobicContact CB-CD1 4.23Å; R177-L344 HydrophobicContact CG-CD1 3.58Å; R177-L344 HydrophobicContact CG-CD2 3.82Å; R177-L344 HydrophobicContact CG-CG 4.37Å; L340-L344 WeakPolarHBondContact O-CB 3.23Å; L340-L344 PolarHBondContact O-N 3Å; L344-K346 VanDerWaalsContact C-N 3.31Å; L344-K346 PolarHBondContact O-N 3.47Å; L344-L347 WeakPolarHBondContact O-CB 3.41Å; L344-L347 PolarHBondContact O-N 2.96Å; L344-L347 VanDerWaalsContact O-N 3.08Å; L344-E348 HydrophobicContact CD1-CG 3.96Å; L344-E348 HydrophobicContact CG-CG 4.31Å; L344-E348 WeakPolarHBondContact O-CG 3.35Å; L344-E348 PolarHBondContact O-N 3.26Å
345	R	94.2	Very high	87.4	Confident	139 Å²	139	67.1 Å²	67.1	53%	0.525	33%	0.332	S	S	.	.	H	α-helix	trans	-57.3	-42.9	174	-169	-177.5	64.2	94.8	-0.5	111.9	S341 E342 T343 L347 F349	S341-R345 PolarHBondContact O-N 3.32Å; S341-R345 VanDerWaalsContact O-N 3.09Å; E342-R345 WeakPolarHBondContact O-CB 3.48Å; E342-R345 PolarHBondContact O-N 2.74Å; T343-R345 VanDerWaalsContact C-N 3.3Å; T343-R345 PolarHBondContact O-N 3.44Å; R345-L347 VanDerWaalsContact C-N 3.31Å; R345-L347 PolarHBondContact O-N 3.35Å; R345-F349 HydrophobicContact CG-CD2 3.4Å; R345-F349 HydrophobicContact CG-CE2 3.45Å; R345-F349 VanDerWaalsContact CG-CE2 3.45Å; R345-F349 WeakPolarHBondContact O-CB 3.46Å; R345-F349 VanDerWaalsContact O-CD2 3.31Å; R345-F349 WeakPolarHBondContact O-CD2 3.19Å; R345-F349 PolarHBondContact O-N 2.8Å
346	K	92.4	Very high	87.1	Confident	75 Å²	75	65.3 Å²	65.3	33%	0.326	33%	0.325	S	S	.	.	H	α-helix	trans	-65.8	-33.3	176.7	-69.2	179.7	179.1	-177.6	0	112.5	I325 D328 E342 T343 L344	I325-K346 HydrophobicContact CD1-CB 3.73Å; I325-K346 HydrophobicContact CG1-CB 4.09Å; I325-K346 HydrophobicContact CG1-CD 4.09Å; D328-K346 IonicContact OD2-NZ 3.02Å; D328-K346 PolarHBondContact OD2-NZ 2.98Å; E342-K346 WeakPolarHBondContact O-CG 3.39Å; E342-K346 PolarHBondContact O-N 2.95Å; T343-K346 WeakPolarHBondContact O-CB 3.23Å; T343-K346 PolarHBondContact O-N 2.94Å; L344-K346 VanDerWaalsContact C-N 3.31Å; L344-K346 PolarHBondContact O-N 3.47Å
347	L	89.8	Confident	86.5	Confident	5 Å²	5	63.3 Å²	63.3	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-75.2	-35	179.2	-65.9	170.4	0	0	0	112.9	V172 C176 F261 F322 I325 T343 L344 R345	V172-L347 HydrophobicContact CG1-CD1 4.18Å; V172-L347 HydrophobicContact CG1-CD2 4.15Å; C176-L347 HydrophobicContact CB-CD1 3.71Å; F261-L347 HydrophobicContact CZ-CD1 4.08Å; F322-L347 HydrophobicContact CD1-CD2 3.54Å; F322-L347 HydrophobicContact CE1-CD2 3.21Å; F322-L347 HydrophobicContact CE2-CD2 4.35Å; F322-L347 HydrophobicContact CG-CD2 4.38Å; F322-L347 HydrophobicContact CZ-CD2 3.64Å; I325-L347 HydrophobicContact CD1-CD2 3.65Å; I325-L347 HydrophobicContact CD1-CG 4.15Å; I325-L347 HydrophobicContact CG2-CD2 4.5Å; T343-L347 HydrophobicContact CG2-CD1 4.16Å; T343-L347 WeakPolarHBondContact O-CG 3.43Å; T343-L347 PolarHBondContact O-N 3.03Å; L344-L347 WeakPolarHBondContact O-CB 3.41Å; L344-L347 PolarHBondContact O-N 2.96Å; L344-L347 VanDerWaalsContact O-N 3.08Å; R345-L347 VanDerWaalsContact C-N 3.31Å; R345-L347 PolarHBondContact O-N 3.35Å
348	E	85.9	Confident	85.8	Confident	68 Å²	68	67.6 Å²	67.6	32%	0.318	34%	0.335	S	S	.	.	H	α-helix	trans	-88.9	-27.3	-174.4	-69.6	-179	154	0	0	114.3	T173 R177 L344 E350 T351	T173-E348 HydrophobicContact CG2-CG 4.13Å; R177-E348 IonicContact CZ-OE1 3.53Å; R177-E348 VanDerWaalsContact CZ-OE1 3.25Å; R177-E348 IonicContact NE-OE1 2.75Å; R177-E348 PolarHBondContact NE-OE1 3.29Å; R177-E348 IonicContact NH2-OE1 3.24Å; R177-E348 PolarHBondContact NH2-OE1 3.41Å; L344-E348 HydrophobicContact CD1-CG 3.96Å; L344-E348 HydrophobicContact CG-CG 4.31Å; L344-E348 WeakPolarHBondContact O-CG 3.35Å; L344-E348 PolarHBondContact O-N 3.26Å; E348-E350 PolarHBondContact O-N 3.08Å; E348-T351 PolarHBondContact O-N 3.03Å; E348-T351 PolarHBondContact O-OG1 2.99Å
349	F	68.6	Low	84.9	Confident	150 Å²	150	71.7 Å²	71.7	66%	0.658	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	8	-167.7	-106.7	-92.3	0	0	0	117.1	R345	R345-F349 HydrophobicContact CG-CD2 3.4Å; R345-F349 HydrophobicContact CG-CE2 3.45Å; R345-F349 VanDerWaalsContact CG-CE2 3.45Å; R345-F349 WeakPolarHBondContact O-CB 3.46Å; R345-F349 VanDerWaalsContact O-CD2 3.31Å; R345-F349 WeakPolarHBondContact O-CD2 3.19Å; R345-F349 PolarHBondContact O-N 2.8Å
350	E	55.1	Low	84	Confident	132 Å²	132	75.9 Å²	75.9	62%	0.617	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.7	27.3	174.7	-82.1	-175	-148.2	0	0	115.5	R321 E348	R321-E350 IonicContact CZ-OE1 2.86Å; R321-E350 VanDerWaalsContact CZ-OE1 3.24Å; R321-E350 IonicContact CZ-OE2 3.4Å; R321-E350 IonicContact NH1-OE1 3.84Å; R321-E350 PolarHBondContact NH1-OE1 3.03Å; R321-E350 IonicContact NH1-OE2 3.29Å; R321-E350 PolarHBondContact NH1-OE2 3.16Å; R321-E350 IonicContact NH2-OE1 3.8Å; R321-E350 PolarHBondContact NH2-OE1 2.86Å; R321-E350 IonicContact NH2-OE2 2.7Å; R321-E350 PolarHBondContact NH2-OE2 3.39Å; E348-E350 PolarHBondContact O-N 3.08Å
351	T	44	Very low	82.9	Confident	163 Å²	163	82.5 Å²	82.5	100%	1	40%	0.403	S	S	*	.			trans	-89.7	0	153.7	50.3	0	0	0	0	109.9	E348	E348-T351 PolarHBondContact O-N 3.03Å; E348-T351 PolarHBondContact O-OG1 2.99Å

Retrieved 351 of 351 residues in 199.6 ms (Link to these results)

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