A0A087XFP8_POEFO Loading...

Gamma-aminobutyric acid type A receptor subunit beta1

AlphaFold DB , UniProt , Accession A0A087XFP8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 483 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	37.4	Very low	44.6	Very low	240 Å²	240	147.6 Å²	147.6	100%	1.182	80%	0.799	S	S	*	*				0	80.9	0	-161	176.2	-162.1	0	0	108
2	W	35.8	Very low	45.4	Very low	249 Å²	249	140.6 Å²	140.6	94%	0.943	78%	0.776	S	S	*	*			trans	-133.2	110.1	177.7	-80	82	0	0	0	106.3
3	K	36.7	Very low	46	Very low	197 Å²	197	139.1 Å²	139.1	86%	0.857	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-84.2	135.3	168.6	-82.7	-176.2	174	-178.2	0	107.8
4	P	44.4	Very low	46.6	Very low	126 Å²	126	141.8 Å²	141.8	82%	0.818	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-77.3	125.3	168.2	30.4	-27.8	0	0	0	108.8
5	L	43.3	Very low	47.6	Very low	176 Å²	176	140.2 Å²	140.2	92%	0.921	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-75.5	129.4	164.4	-99	116.2	0	0	0	108.6
6	A	42.1	Very low	48.3	Very low	83 Å²	83	136.6 Å²	136.6	69%	0.686	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-64.2	133.4	-175.8	0	0	0	0	0	112.2	S8	A6-S8 PolarHBondContact O-N 3.14Å; A6-S8 VanDerWaalsContact O-N 3.14Å
7	A	49.4	Very low	49.2	Very low	102 Å²	102	133.4 Å²	133.4	84%	0.843	72%	0.717	S	S	*	*	S	Bend	trans	-79.7	79.8	169.6	0	0	0	0	0	110
8	S	49.3	Very low	49.8	Very low	89 Å²	89	130.4 Å²	130.4	62%	0.622	71%	0.707	S	S	*	*			trans	-135.7	3.5	177.5	60.9	0	0	0	0	116.2	A6	A6-S8 PolarHBondContact O-N 3.14Å; A6-S8 VanDerWaalsContact O-N 3.14Å
9	E	47.9	Very low	50.4	Low	159 Å²	159	126.3 Å²	126.3	74%	0.743	69%	0.689	S	S	*	*	S	Bend	trans	-115.8	7.3	-177.8	-63.9	-153.9	164.1	0	0	115.6
10	L	50.3	Low	51.2	Low	115 Å²	115	123.6 Å²	123.6	60%	0.602	68%	0.676	S	S	*	*	H	α-helix	trans	-73.7	-38.7	178.9	-77.7	157.2	0	0	0	115	A12 W14	L10-A12 PolarHBondContact O-N 2.63Å; L10-W14 VanDerWaalsContact O-CD1 3.24Å
11	P	53.6	Low	51.6	Low	88 Å²	88	120.9 Å²	120.9	57%	0.571	67%	0.666	S	S	*	*	H	α-helix	trans	-75.1	-26.7	-171.6	26.8	-31.2	0	0	0	113.9	I15	P11-I15 VanDerWaalsContact O-CD1 3.3Å; P11-I15 WeakPolarHBondContact O-CD1 3.22Å; P11-I15 WeakPolarHBondContact O-CG1 3.32Å; P11-I15 PolarHBondContact O-N 3.13Å
12	A	54.2	Low	52.9	Low	63 Å²	63	115 Å²	115	52%	0.521	64%	0.639	S	S	.	*	H	α-helix	trans	-70.9	-39.8	-178.8	0	0	0	0	0	112.2	L10 I15 T16	L10-A12 PolarHBondContact O-N 2.63Å; A12-I15 PolarHBondContact O-N 3Å; A12-T16 PolarHBondContact O-N 2.86Å; A12-T16 VanDerWaalsContact O-N 3.1Å; A12-T16 PolarHBondContact O-OG1 3.1Å
13	M	53.1	Low	54.1	Low	121 Å²	121	108.6 Å²	108.6	60%	0.596	62%	0.623	S	S	*	*	H	α-helix	trans	-67.4	-40.2	-176.6	-140.9	-174	-52.1	0	0	112.3	T16 V17	M13-T16 PolarHBondContact O-N 3.46Å; M13-V17 VanDerWaalsContact O-CG2 3.29Å; M13-V17 WeakPolarHBondContact O-CG2 3.35Å; M13-V17 PolarHBondContact O-N 3.33Å
14	W	54.6	Low	55.2	Low	177 Å²	177	103.9 Å²	103.9	67%	0.67	61%	0.606	S	S	*	*	H	α-helix	trans	-67.5	-35.8	175.9	-73.4	101	0	0	0	112.6	L10 C18	L10-W14 VanDerWaalsContact O-CD1 3.24Å; W14-C18 VanDerWaalsContact O-CB 3.26Å; W14-C18 WeakPolarHBondContact O-CB 3.3Å; W14-C18 PolarHBondContact O-N 3.39Å; W14-C18 PolarHBondContact O-SG 3.44Å
15	I	61.5	Low	56	Low	118 Å²	118	102.2 Å²	102.2	61%	0.605	59%	0.594	S	S	*	*	H	α-helix	trans	-66.9	-41.8	176.6	-66.6	167	0	0	0	110.5	P11 A12 S19	P11-I15 VanDerWaalsContact O-CD1 3.3Å; P11-I15 WeakPolarHBondContact O-CD1 3.22Å; P11-I15 WeakPolarHBondContact O-CG1 3.32Å; P11-I15 PolarHBondContact O-N 3.13Å; A12-I15 PolarHBondContact O-N 3Å; I15-S19 WeakPolarHBondContact O-CB 3.22Å; I15-S19 PolarHBondContact O-N 3.49Å; I15-S19 PolarHBondContact O-OG 2.83Å
16	T	59.4	Low	56.8	Low	82 Å²	82	98.3 Å²	98.3	50%	0.503	58%	0.577	S	S	.	*	H	α-helix	trans	-67.9	-40.7	177.5	-37.6	0	0	0	0	111.9	A12 M13 S19 V20	A12-T16 PolarHBondContact O-N 2.86Å; A12-T16 VanDerWaalsContact O-N 3.1Å; A12-T16 PolarHBondContact O-OG1 3.1Å; M13-T16 PolarHBondContact O-N 3.46Å; T16-S19 VanDerWaalsContact CA-OG 3.32Å; T16-S19 WeakPolarHBondContact CA-OG 3.29Å; T16-S19 PolarHBondContact O-N 2.92Å; T16-S19 PolarHBondContact O-OG 3.4Å; T16-S19 VanDerWaalsContact O-OG 3.13Å; T16-V20 WeakPolarHBondContact O-CB 3.17Å; T16-V20 WeakPolarHBondContact O-CG2 3.29Å; T16-V20 PolarHBondContact O-N 3.42Å
17	V	63	Low	57.5	Low	83 Å²	83	97.8 Å²	97.8	50%	0.503	57%	0.565	S	S	.	*	H	α-helix	trans	-67.7	-39.9	176.7	172.4	0	0	0	0	111.7	M13 S21	M13-V17 VanDerWaalsContact O-CG2 3.29Å; M13-V17 WeakPolarHBondContact O-CG2 3.35Å; M13-V17 PolarHBondContact O-N 3.33Å; V17-S21 WeakPolarHBondContact O-CB 3.36Å; V17-S21 PolarHBondContact O-N 2.88Å; V17-S21 PolarHBondContact O-OG 3.45Å
18	C	60.4	Low	57.7	Low	79 Å²	79	96.3 Å²	96.3	53%	0.534	55%	0.547	S	S	.	.	H	α-helix	trans	-67.5	-41.1	175	-80.8	0	0	0	0	112.1	W14 S21 L22	W14-C18 VanDerWaalsContact O-CB 3.26Å; W14-C18 WeakPolarHBondContact O-CB 3.3Å; W14-C18 PolarHBondContact O-N 3.39Å; W14-C18 PolarHBondContact O-SG 3.44Å; C18-S21 PolarHBondContact O-N 3.32Å; C18-L22 VanDerWaalsContact O-CB 3.26Å; C18-L22 WeakPolarHBondContact O-CB 3.2Å; C18-L22 PolarHBondContact O-N 3.46Å
19	S	61.6	Low	58	Low	52 Å²	52	94 Å²	94	36%	0.364	54%	0.537	S	S	.	.	H	α-helix	trans	-71	-35.5	178.6	46	0	0	0	0	112.5	I15 T16 L22 L23	I15-S19 WeakPolarHBondContact O-CB 3.22Å; I15-S19 PolarHBondContact O-N 3.49Å; I15-S19 PolarHBondContact O-OG 2.83Å; T16-S19 VanDerWaalsContact CA-OG 3.32Å; T16-S19 WeakPolarHBondContact CA-OG 3.29Å; T16-S19 PolarHBondContact O-N 2.92Å; T16-S19 PolarHBondContact O-OG 3.4Å; T16-S19 VanDerWaalsContact O-OG 3.13Å; S19-L22 PolarHBondContact O-N 2.83Å; S19-L23 WeakPolarHBondContact O-CB 3.41Å; S19-L23 PolarHBondContact O-N 3.46Å
20	V	65.5	Low	58.1	Low	73 Å²	73	89.2 Å²	89.2	44%	0.442	53%	0.525	S	S	.	.	H	α-helix	trans	-69.1	-42.1	171.8	172.7	0	0	0	0	111.2	T16 L22 L23 I24	T16-V20 WeakPolarHBondContact O-CB 3.17Å; T16-V20 WeakPolarHBondContact O-CG2 3.29Å; T16-V20 PolarHBondContact O-N 3.42Å; V20-L22 VanDerWaalsContact C-N 3.33Å; V20-L22 PolarHBondContact O-N 2.83Å; V20-L23 PolarHBondContact O-N 2.89Å; V20-I24 HydrophobicContact CG1-CD1 3.66Å; V20-I24 HydrophobicContact CG1-CG1 4.33Å; V20-I24 WeakPolarHBondContact O-CB 3.33Å; V20-I24 WeakPolarHBondContact O-CG1 3.25Å; V20-I24 PolarHBondContact O-N 2.96Å
21	S	60.9	Low	58	Low	66 Å²	66	89.9 Å²	89.9	46%	0.462	53%	0.525	S	S	.	.	H	α-helix	trans	-63.4	-37	172.6	-77.9	0	0	0	0	112.7	V17 C18 I24 T25	V17-S21 WeakPolarHBondContact O-CB 3.36Å; V17-S21 PolarHBondContact O-N 2.88Å; V17-S21 PolarHBondContact O-OG 3.45Å; C18-S21 PolarHBondContact O-N 3.32Å; S21-I24 PolarHBondContact O-N 3.35Å; S21-T25 WeakPolarHBondContact O-CB 3.42Å; S21-T25 WeakPolarHBondContact O-CG2 3.33Å; S21-T25 PolarHBondContact O-N 2.79Å; S21-T25 PolarHBondContact O-OG1 2.8Å
22	L	63.1	Low	57.6	Low	116 Å²	116	88.8 Å²	88.8	61%	0.607	52%	0.52	S	S	*	.	H	α-helix	trans	-67.6	-42	175.4	-158.1	87.7	0	0	0	111	C18 S19 V20 T25 V26	C18-L22 VanDerWaalsContact O-CB 3.26Å; C18-L22 WeakPolarHBondContact O-CB 3.2Å; C18-L22 PolarHBondContact O-N 3.46Å; S19-L22 PolarHBondContact O-N 2.83Å; V20-L22 VanDerWaalsContact C-N 3.33Å; V20-L22 PolarHBondContact O-N 2.83Å; L22-T25 VanDerWaalsContact CA-OG1 3.3Å; L22-T25 WeakPolarHBondContact CA-OG1 3.35Å; L22-T25 PolarHBondContact O-N 3.27Å; L22-T25 PolarHBondContact O-OG1 2.9Å; L22-T25 VanDerWaalsContact O-OG1 3.04Å; L22-V26 WeakPolarHBondContact O-CB 3.4Å; L22-V26 WeakPolarHBondContact O-CG2 3.17Å; L22-V26 PolarHBondContact O-N 3.42Å
23	L	61.8	Low	57.4	Low	115 Å²	115	88.2 Å²	88.2	60%	0.602	52%	0.515	S	S	*	.	H	α-helix	trans	-64.8	-42.3	174.2	-95.5	150.4	0	0	0	111.8	S19 V20 V26 V27	S19-L23 WeakPolarHBondContact O-CB 3.41Å; S19-L23 PolarHBondContact O-N 3.46Å; V20-L23 PolarHBondContact O-N 2.89Å; L23-V26 PolarHBondContact O-N 3.44Å; L23-V27 VanDerWaalsContact O-CB 3.29Å; L23-V27 WeakPolarHBondContact O-CB 3.16Å; L23-V27 WeakPolarHBondContact O-CG2 3.26Å; L23-V27 PolarHBondContact O-N 2.91Å
24	I	60.7	Low	57.3	Low	99 Å²	99	87.7 Å²	87.7	51%	0.508	52%	0.515	S	S	.	.	H	α-helix	trans	-66.5	-40.1	176.9	-68.2	166.6	0	0	0	110.8	V20 S21 V27 C28	V20-I24 HydrophobicContact CG1-CD1 3.66Å; V20-I24 HydrophobicContact CG1-CG1 4.33Å; V20-I24 WeakPolarHBondContact O-CB 3.33Å; V20-I24 WeakPolarHBondContact O-CG1 3.25Å; V20-I24 PolarHBondContact O-N 2.96Å; S21-I24 PolarHBondContact O-N 3.35Å; I24-V27 PolarHBondContact O-N 2.87Å; I24-C28 WeakPolarHBondContact O-CB 3.26Å; I24-C28 PolarHBondContact O-N 3.43Å; I24-C28 PolarHBondContact O-SG 3.49Å
25	T	60.3	Low	57.2	Low	91 Å²	91	84.2 Å²	84.2	56%	0.558	51%	0.506	S	S	*	.	H	α-helix	trans	-70.7	-33.7	175.8	42.5	0	0	0	0	112.9	S21 L22 G29	S21-T25 WeakPolarHBondContact O-CB 3.42Å; S21-T25 WeakPolarHBondContact O-CG2 3.33Å; S21-T25 PolarHBondContact O-N 2.79Å; S21-T25 PolarHBondContact O-OG1 2.8Å; L22-T25 VanDerWaalsContact CA-OG1 3.3Å; L22-T25 WeakPolarHBondContact CA-OG1 3.35Å; L22-T25 PolarHBondContact O-N 3.27Å; L22-T25 PolarHBondContact O-OG1 2.9Å; L22-T25 VanDerWaalsContact O-OG1 3.04Å; T25-G29 WeakPolarHBondContact O-CA 3.49Å; T25-G29 PolarHBondContact O-N 3.04Å
26	V	60.4	Low	56.9	Low	93 Å²	93	81.4 Å²	81.4	56%	0.564	50%	0.495	S	S	*	.	H	α-helix	trans	-71.2	-40.1	173.4	170.8	0	0	0	0	111.3	L22 L23 G29 A30	L22-V26 WeakPolarHBondContact O-CB 3.4Å; L22-V26 WeakPolarHBondContact O-CG2 3.17Å; L22-V26 PolarHBondContact O-N 3.42Å; L23-V26 PolarHBondContact O-N 3.44Å; V26-G29 PolarHBondContact O-N 3.44Å; V26-A30 VanDerWaalsContact O-CB 3.25Å; V26-A30 WeakPolarHBondContact O-CB 3.3Å; V26-A30 PolarHBondContact O-N 3.49Å
27	V	57.2	Low	56.7	Low	73 Å²	73	81.8 Å²	81.8	44%	0.442	50%	0.501	S	S	.	.	H	α-helix	trans	-71.5	-42.4	177.2	172.4	0	0	0	0	111.3	L23 I24 A30 Q31	L23-V27 VanDerWaalsContact O-CB 3.29Å; L23-V27 WeakPolarHBondContact O-CB 3.16Å; L23-V27 WeakPolarHBondContact O-CG2 3.26Å; L23-V27 PolarHBondContact O-N 2.91Å; I24-V27 PolarHBondContact O-N 2.87Å; V27-A30 PolarHBondContact O-N 2.87Å; V27-Q31 WeakPolarHBondContact O-CB 3.48Å; V27-Q31 WeakPolarHBondContact O-CG 3.43Å; V27-Q31 PolarHBondContact O-N 2.88Å
28	C	53.9	Low	57.1	Low	70 Å²	70	80.4 Å²	80.4	47%	0.473	49%	0.491	S	S	.	.	H	α-helix	trans	-67.6	-35.6	172.4	-77.6	0	0	0	0	112.2	I24 Q31 S32	I24-C28 WeakPolarHBondContact O-CB 3.26Å; I24-C28 PolarHBondContact O-N 3.43Å; I24-C28 PolarHBondContact O-SG 3.49Å; C28-Q31 PolarHBondContact O-N 2.69Å; C28-S32 WeakPolarHBondContact O-CB 3.42Å; C28-S32 PolarHBondContact O-N 2.76Å
29	G	53.7	Low	57.9	Low	40 Å²	40	84 Å²	84	41%	0.412	50%	0.502	S	S	.	.	H	α-helix	trans	-67.4	-38	174.2	0	0	0	0	0	112.7	T25 V26 S32 A33	T25-G29 WeakPolarHBondContact O-CA 3.49Å; T25-G29 PolarHBondContact O-N 3.04Å; V26-G29 PolarHBondContact O-N 3.44Å; G29-S32 PolarHBondContact O-N 2.81Å; G29-A33 PolarHBondContact O-N 3.48Å; G29-A33 VanDerWaalsContact O-N 3.1Å
30	A	51.5	Low	59	Low	59 Å²	59	85 Å²	85	49%	0.488	51%	0.509	S	S	.	.	H	α-helix	trans	-69.4	-32.7	173	0	0	0	0	0	112.5	V26 V27	V26-A30 VanDerWaalsContact O-CB 3.25Å; V26-A30 WeakPolarHBondContact O-CB 3.3Å; V26-A30 PolarHBondContact O-N 3.49Å; V27-A30 PolarHBondContact O-N 2.87Å
31	Q	47.8	Very low	60.1	Low	129 Å²	129	84.6 Å²	84.6	60%	0.603	50%	0.5	S	S	*	.	H	α-helix	trans	-72.6	-36	172.4	-78.3	168.9	-5.1	0	0	112.3	V27 C28 A33 N34	V27-Q31 WeakPolarHBondContact O-CB 3.48Å; V27-Q31 WeakPolarHBondContact O-CG 3.43Å; V27-Q31 PolarHBondContact O-N 2.88Å; C28-Q31 PolarHBondContact O-N 2.69Å; Q31-A33 VanDerWaalsContact C-N 3.33Å; Q31-A33 PolarHBondContact O-N 3.15Å; Q31-N34 PolarHBondContact O-N 2.73Å
32	S	46.1	Very low	61.4	Low	65 Å²	65	83 Å²	83	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-68	-29.5	174.9	-176.8	0	0	0	0	113.1	C28 G29 N34 E35	C28-S32 WeakPolarHBondContact O-CB 3.42Å; C28-S32 PolarHBondContact O-N 2.76Å; G29-S32 PolarHBondContact O-N 2.81Å; S32-N34 PolarHBondContact O-N 3.34Å; S32-E35 PolarHBondContact O-N 3.28Å
33	A	49.3	Very low	62.7	Low	52 Å²	52	84.1 Å²	84.1	43%	0.43	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-22.7	174.6	0	0	0	0	0	113.8	G29 Q31	G29-A33 PolarHBondContact O-N 3.48Å; G29-A33 VanDerWaalsContact O-N 3.1Å; Q31-A33 VanDerWaalsContact C-N 3.33Å; Q31-A33 PolarHBondContact O-N 3.15Å
34	N	50.8	Low	64.1	Low	110 Å²	110	81.4 Å²	81.4	59%	0.588	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	15.8	178.8	-86.9	-13.6	0	0	0	113.1	Q31 S32	Q31-N34 PolarHBondContact O-N 2.73Å; S32-N34 PolarHBondContact O-N 3.34Å
35	E	53.1	Low	65.5	Low	103 Å²	103	77.7 Å²	77.7	48%	0.481	46%	0.464	S	S	.	.			trans	-66.7	128.4	171.9	-82.8	-162.8	166.7	0	0	110.8	S32 S37 N38	S32-E35 PolarHBondContact O-N 3.28Å; E35-S37 PolarHBondContact O-N 3.35Å; E35-S37 PolarHBondContact OE2-OG 3.27Å; E35-N38 WeakPolarHBondContact O-CB 3.38Å; E35-N38 PolarHBondContact O-N 3.36Å
36	P	53.8	Low	67	Low	59 Å²	59	74.5 Å²	74.5	38%	0.383	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-4.9	-179.5	24.9	-32.7	0	0	0	114.1	P108	P36-P108 HydrophobicContact CB-CG 4.19Å
37	S	56.1	Low	68.6	Low	90 Å²	90	74.4 Å²	74.4	63%	0.629	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-7.5	173.6	44.7	0	0	0	0	113.8	E35 M39	E35-S37 PolarHBondContact O-N 3.35Å; E35-S37 PolarHBondContact OE2-OG 3.27Å; S37-M39 PolarHBondContact O-N 3.48Å
38	N	71.4	Confident	70.3	Confident	54 Å²	54	78.8 Å²	78.8	29%	0.289	45%	0.454	S	S	.	.			trans	-77.7	108.5	-176.4	-166.3	-24.2	0	0	0	111.2	E35 S40 Y41 V42	E35-N38 WeakPolarHBondContact O-CB 3.38Å; E35-N38 PolarHBondContact O-N 3.36Å; N38-S40 PolarHBondContact O-N 3.41Å; N38-S40 VanDerWaalsContact O-N 3.09Å; N38-S40 PolarHBondContact OD1-N 2.87Å; N38-S40 PolarHBondContact OD1-OG 3.1Å; N38-Y41 WeakPolarHBondContact O-CB 3.42Å; N38-Y41 PolarHBondContact O-N 3.5Å; N38-V42 PolarHBondContact O-N 3.22Å
39	M	76.4	Confident	72.2	Confident	154 Å²	154	76.5 Å²	76.5	76%	0.759	44%	0.437	S	S	*	.	H	α-helix	trans	-53.2	-32.4	-179	-169.8	69.2	69.8	0	0	113.2	S37 K43	S37-M39 PolarHBondContact O-N 3.48Å; M39-K43 WeakPolarHBondContact O-CB 3.32Å; M39-K43 PolarHBondContact O-N 3.13Å
40	S	85.6	Confident	74.1	Confident	75 Å²	75	76.6 Å²	76.6	52%	0.524	43%	0.428	S	S	.	.	H	α-helix	trans	-68.5	-35.9	179	71.9	0	0	0	0	112.6	N38 K43 A44	N38-S40 PolarHBondContact O-N 3.41Å; N38-S40 VanDerWaalsContact O-N 3.09Å; N38-S40 PolarHBondContact OD1-N 2.87Å; N38-S40 PolarHBondContact OD1-OG 3.1Å; S40-K43 PolarHBondContact O-N 2.79Å; S40-A44 WeakPolarHBondContact O-CB 3.41Å; S40-A44 PolarHBondContact O-N 3.41Å
41	Y	87.8	Confident	76.1	Confident	63 Å²	63	82.2 Å²	82.2	25%	0.247	44%	0.441	C	S	.	.	H	α-helix	trans	-70	-42.7	177.9	-175.7	-103.2	0	0	0	111.3	N38 A44 T45 I107	N38-Y41 WeakPolarHBondContact O-CB 3.42Å; N38-Y41 PolarHBondContact O-N 3.5Å; Y41-A44 PolarHBondContact O-N 2.84Å; Y41-T45 WeakPolarHBondContact O-CB 3.27Å; Y41-T45 PolarHBondContact O-N 3.29Å; Y41-T45 PolarHBondContact O-OG1 3.14Å; Y41-I107 HydrophobicContact CD1-CD1 4.22Å; Y41-I107 HydrophobicContact CD1-CG1 3.98Å; Y41-I107 HydrophobicContact CE1-CD1 4.21Å; Y41-I107 HydrophobicContact CE1-CG1 3.68Å
42	V	87.7	Confident	78.3	Confident	33 Å²	33	80 Å²	80	20%	0.2	45%	0.453	C	S	.	.	H	α-helix	trans	-60.8	-47.2	174.4	-179.3	0	0	0	0	110.4	N38 T45 V46 I107 L111	N38-V42 PolarHBondContact O-N 3.22Å; V42-T45 WeakPolarHBondContact O-CB 3.41Å; V42-T45 PolarHBondContact O-N 3.29Å; V42-V46 WeakPolarHBondContact O-CG2 3.43Å; V42-V46 PolarHBondContact O-N 3.04Å; V42-I107 HydrophobicContact CG2-CD1 4.16Å; V42-L111 HydrophobicContact CG1-CD2 3.8Å
43	K	90.5	Very high	80.7	Confident	139 Å²	139	78.4 Å²	78.4	60%	0.604	44%	0.437	S	S	*	.	H	α-helix	trans	-58.6	-50.8	177.2	-176.1	-176	175.3	-173.2	0	111.9	M39 S40 T45 V46 D47	M39-K43 WeakPolarHBondContact O-CB 3.32Å; M39-K43 PolarHBondContact O-N 3.13Å; S40-K43 PolarHBondContact O-N 2.79Å; K43-T45 PolarHBondContact O-N 2.84Å; K43-V46 PolarHBondContact O-N 3.31Å; K43-D47 PolarHBondContact O-N 2.7Å
44	A	91.6	Very high	82.9	Confident	59 Å²	59	78.1 Å²	78.1	49%	0.488	43%	0.428	S	S	.	.	H	α-helix	trans	-60.5	-34.8	179.2	0	0	0	0	0	112.4	S40 Y41 K48	S40-A44 WeakPolarHBondContact O-CB 3.41Å; S40-A44 PolarHBondContact O-N 3.41Å; Y41-A44 PolarHBondContact O-N 2.84Å; A44-K48 VanDerWaalsContact O-CB 3.3Å; A44-K48 WeakPolarHBondContact O-CB 3.45Å; A44-K48 PolarHBondContact O-N 2.99Å
45	T	91.4	Very high	85	Confident	20 Å²	20	76.6 Å²	76.6	12%	0.123	42%	0.419	C	S	.	.	H	α-helix	trans	-66.8	-48.3	175.7	-56.5	0	0	0	0	111.1	Y41 V42 K43 D47 K48 L49 Y104 I107	Y41-T45 WeakPolarHBondContact O-CB 3.27Å; Y41-T45 PolarHBondContact O-N 3.29Å; Y41-T45 PolarHBondContact O-OG1 3.14Å; V42-T45 WeakPolarHBondContact O-CB 3.41Å; V42-T45 PolarHBondContact O-N 3.29Å; K43-T45 PolarHBondContact O-N 2.84Å; T45-D47 PolarHBondContact O-N 3.26Å; T45-K48 WeakPolarHBondContact O-CB 3.31Å; T45-K48 PolarHBondContact O-N 3.47Å; T45-L49 WeakPolarHBondContact O-CG 3Å; T45-L49 PolarHBondContact O-N 3.06Å; T45-Y104 HydrophobicContact CG2-CG 4.49Å; T45-I107 HydrophobicContact CG2-CD1 4.09Å
46	V	91.4	Very high	87	Confident	24 Å²	24	80.9 Å²	80.9	15%	0.145	43%	0.431	C	S	.	.	H	α-helix	trans	-62.7	-44.1	178.1	175.3	0	0	0	0	111.5	V42 K43 K48 L49 L50 L111 L113	V42-V46 WeakPolarHBondContact O-CG2 3.43Å; V42-V46 PolarHBondContact O-N 3.04Å; K43-V46 PolarHBondContact O-N 3.31Å; V46-K48 VanDerWaalsContact C-N 3.25Å; V46-K48 PolarHBondContact O-N 3.38Å; V46-L49 PolarHBondContact O-N 3.2Å; V46-L49 VanDerWaalsContact O-N 3.13Å; V46-L50 HydrophobicContact CG1-CD1 4.17Å; V46-L50 PolarHBondContact O-N 3.39Å; V46-L50 VanDerWaalsContact O-N 3.11Å; V46-L111 HydrophobicContact CG2-CD1 4.29Å; V46-L113 HydrophobicContact CG1-CD2 4.5Å; V46-L113 HydrophobicContact CG2-CD2 4.01Å
47	D	93.1	Very high	89	Confident	91 Å²	91	81.1 Å²	81.1	49%	0.487	43%	0.429	S	S	.	.	H	α-helix	trans	-61.3	-36.1	176.8	-70.4	-21.6	0	0	0	111.4	K43 T45 K51	K43-D47 PolarHBondContact O-N 2.7Å; T45-D47 PolarHBondContact O-N 3.26Å; D47-K51 WeakPolarHBondContact O-CB 3.33Å; D47-K51 PolarHBondContact O-N 2.84Å; D47-K51 VanDerWaalsContact O-N 3.14Å
48	K	93.3	Very high	90.9	Very high	165 Å²	165	77.3 Å²	77.3	72%	0.717	40%	0.401	S	S	*	.	H	α-helix	trans	-68.1	-38.5	174.7	-176.5	-177.7	176.7	-174.3	0	112.5	A44 T45 V46 L50 K51	A44-K48 VanDerWaalsContact O-CB 3.3Å; A44-K48 WeakPolarHBondContact O-CB 3.45Å; A44-K48 PolarHBondContact O-N 2.99Å; T45-K48 WeakPolarHBondContact O-CB 3.31Å; T45-K48 PolarHBondContact O-N 3.47Å; V46-K48 VanDerWaalsContact C-N 3.25Å; V46-K48 PolarHBondContact O-N 3.38Å; K48-L50 VanDerWaalsContact C-N 3.35Å; K48-K51 PolarHBondContact O-N 2.86Å
49	L	93.1	Very high	92.1	Very high	22 Å²	22	74.9 Å²	74.9	12%	0.115	39%	0.387	C	S	.	.	H	α-helix	trans	-65.3	-38.3	177.8	-68.4	176.3	0	0	0	112.1	T45 V46 L102 S103 Y104 L148	T45-L49 WeakPolarHBondContact O-CG 3Å; T45-L49 PolarHBondContact O-N 3.06Å; V46-L49 PolarHBondContact O-N 3.2Å; V46-L49 VanDerWaalsContact O-N 3.13Å; L49-L102 HydrophobicContact CB-CD2 4.47Å; L49-S103 WeakPolarHBondContact CD2-O 3.48Å; L49-Y104 HydrophobicContact CD1-CD1 4.1Å; L49-L148 HydrophobicContact CD1-CD1 4.34Å
50	L	93.9	Very high	93	Very high	43 Å²	43	70.8 Å²	70.8	23%	0.225	37%	0.369	C	S	.	.	H	α-helix	trans	-80.7	-18.8	-179.7	-63	175.2	0	0	0	112.9	V46 K48 G52 Y53 V117 L121	V46-L50 HydrophobicContact CG1-CD1 4.17Å; V46-L50 PolarHBondContact O-N 3.39Å; V46-L50 VanDerWaalsContact O-N 3.11Å; K48-L50 VanDerWaalsContact C-N 3.35Å; L50-G52 PolarHBondContact O-N 3.44Å; L50-G52 VanDerWaalsContact O-N 3.11Å; L50-Y53 PolarHBondContact O-N 2.75Å; L50-V117 HydrophobicContact CD1-CG2 4.19Å; L50-V117 HydrophobicContact CD2-CG2 4.26Å; L50-L121 HydrophobicContact CD2-CD2 3.81Å
51	K	94.8	Very high	93.4	Very high	177 Å²	177	74 Å²	74	77%	0.77	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	110	-179.4	-172.9	177.7	-178.6	179.4	0	111.1	D47 K48 Y53	D47-K51 WeakPolarHBondContact O-CB 3.33Å; D47-K51 PolarHBondContact O-N 2.84Å; D47-K51 VanDerWaalsContact O-N 3.14Å; K48-K51 PolarHBondContact O-N 2.86Å; K51-Y53 VanDerWaalsContact C-N 3.33Å
52	G	93.4	Very high	93.7	Very high	82 Å²	82	74.8 Å²	74.8	85%	0.845	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	12.1	-180	0	0	0	0	0	113.9	L50	L50-G52 PolarHBondContact O-N 3.44Å; L50-G52 VanDerWaalsContact O-N 3.11Å
53	Y	96.3	Very high	94	Very high	31 Å²	31	75.4 Å²	75.4	12%	0.122	41%	0.414	C	S	.	.			trans	-74.6	124.9	172.3	-171.9	-90.6	0	0	0	110.4	L50 K51 I55 D99 R101 L102 L121 W122	L50-Y53 PolarHBondContact O-N 2.75Å; K51-Y53 VanDerWaalsContact C-N 3.33Å; Y53-I55 HydrophobicContact CD1-CG2 3.96Å; Y53-I55 HydrophobicContact CE1-CG2 3.96Å; Y53-D99 WeakPolarHBondContact CE2-OD2 3.49Å; Y53-D99 PolarHBondContact OH-OD2 2.83Å; Y53-R101 HydrophobicContact CD2-CB 4.09Å; Y53-R101 HydrophobicContact CE2-CB 3.99Å; Y53-R101 PolarHBondContact OH-NH2 3.2Å; Y53-R101 VanDerWaalsContact OH-NH2 3.11Å; Y53-L102 HydrophobicContact CD2-CD2 3.97Å; Y53-L102 HydrophobicContact CE2-CD1 4.3Å; Y53-L102 HydrophobicContact CE2-CD2 3.79Å; Y53-L102 HydrophobicContact CE2-CG 3.91Å; Y53-L121 HydrophobicContact CD1-CD2 4.3Å; Y53-L121 HydrophobicContact CE1-CD2 3.97Å; Y53-W122 PolarHBondContact OH-N 3.42Å
54	D	95.3	Very high	94.3	Very high	46 Å²	46	71.8 Å²	71.8	25%	0.246	41%	0.41	C	S	.	.			trans	-102.1	112.7	174.4	-165.8	-18.4	0	0	0	110.4	R56 L57 R101	D54-R56 PolarHBondContact O-N 2.78Å; D54-R56 WeakPolarHBondContact OD1-CB 3.43Å; D54-R56 WeakPolarHBondContact OD1-CG 3.32Å; D54-R56 IonicContact OD1-CZ 3.78Å; D54-R56 PolarHBondContact OD1-N 3.42Å; D54-R56 IonicContact OD1-NE 3.74Å; D54-R56 PolarHBondContact OD1-NE 2.97Å; D54-R56 IonicContact OD1-NH2 2.96Å; D54-R56 IonicContact OD2-CZ 2.82Å; D54-R56 IonicContact OD2-NE 3.46Å; D54-R56 PolarHBondContact OD2-NE 2.96Å; D54-R56 IonicContact OD2-NH2 3.24Å; D54-R56 PolarHBondContact OD2-NH2 3.32Å; D54-L57 HydrophobicContact CB-CD1 4.31Å; D54-L57 HydrophobicContact CB-CG 4.47Å; D54-R101 PolarHBondContact O-NH1 3.24Å; D54-R101 VanDerWaalsContact O-NH1 3.14Å
55	I	95.8	Very high	94.6	Very high	79 Å²	79	71 Å²	71	41%	0.405	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-18	-179.9	64.9	175.8	0	0	0	113.5	Y53 L57 Q120	Y53-I55 HydrophobicContact CD1-CG2 3.96Å; Y53-I55 HydrophobicContact CE1-CG2 3.96Å; I55-L57 VanDerWaalsContact C-N 3.3Å; I55-Q120 WeakPolarHBondContact CG2-O 3.3Å
56	R	94.7	Very high	94.8	Very high	192 Å²	192	70.5 Å²	70.5	73%	0.725	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-15.9	-175.6	-59.5	170.7	-65.6	175.6	4.4	112.5	D54	D54-R56 PolarHBondContact O-N 2.78Å; D54-R56 WeakPolarHBondContact OD1-CB 3.43Å; D54-R56 WeakPolarHBondContact OD1-CG 3.32Å; D54-R56 IonicContact OD1-CZ 3.78Å; D54-R56 PolarHBondContact OD1-N 3.42Å; D54-R56 IonicContact OD1-NE 3.74Å; D54-R56 PolarHBondContact OD1-NE 2.97Å; D54-R56 IonicContact OD1-NH2 2.96Å; D54-R56 IonicContact OD2-CZ 2.82Å; D54-R56 IonicContact OD2-NE 3.46Å; D54-R56 PolarHBondContact OD2-NE 2.96Å; D54-R56 IonicContact OD2-NH2 3.24Å; D54-R56 PolarHBondContact OD2-NH2 3.32Å
57	L	95.8	Very high	95.1	Very high	64 Å²	64	73.5 Å²	73.5	34%	0.335	41%	0.412	S	S	.	.	S	Bend	trans	-103.4	127.6	-177	-60.7	177.4	0	0	0	110.1	D54 I55 F61 R101	D54-L57 HydrophobicContact CB-CD1 4.31Å; D54-L57 HydrophobicContact CB-CG 4.47Å; I55-L57 VanDerWaalsContact C-N 3.3Å; L57-F61 HydrophobicContact CB-CB 4.48Å; L57-F61 HydrophobicContact CD2-CD1 4.11Å; L57-F61 HydrophobicContact CD2-CD2 4.2Å; L57-F61 HydrophobicContact CD2-CE1 4.23Å; L57-F61 HydrophobicContact CD2-CE2 4.32Å; L57-F61 HydrophobicContact CD2-CG 4.1Å; L57-F61 HydrophobicContact CD2-CZ 4.33Å; L57-R101 PolarHBondContact O-NH1 3.07Å; L57-R101 PolarHBondContact O-NH2 3.33Å; L57-R101 VanDerWaalsContact O-NH2 3.11Å
58	R	96.4	Very high	95.3	Very high	11 Å²	11	69.2 Å²	69.2	4%	0.042	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-61.9	153.2	170.1	72.1	172.9	178.3	92.6	-12.9	110.9	D60 F61 G63 A64 W122 Y189 D193	R58-D60 PolarHBondContact NH1-O 2.81Å; R58-F61 HydrophobicContact CG-CB 4.4Å; R58-F61 HydrophobicContact CG-CD2 4.18Å; R58-F61 WeakPolarHBondContact O-CB 3.5Å; R58-F61 PolarHBondContact O-N 2.8Å; R58-G63 PolarHBondContact NH2-O 2.94Å; R58-A64 PolarHBondContact NH1-O 3.11Å; R58-W122 HydrophobicContact CB-CZ2 3.85Å; R58-Y189 HydrophobicContact CB-CE1 4.24Å; R58-D193 IonicContact CZ-OD1 3.48Å; R58-D193 VanDerWaalsContact CZ-OD1 3.22Å; R58-D193 IonicContact NE-OD1 3.7Å; R58-D193 PolarHBondContact NE-OD1 2.78Å; R58-D193 IonicContact NH2-OD1 2.89Å; R58-D193 PolarHBondContact NH2-OD1 2.73Å
59	P	96.4	Very high	95.4	Very high	2 Å²	2	61.3 Å²	61.3	1%	0.013	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	141.4	168.4	-23.7	34.3	0	0	0	111	F61 V66 D99 W122	P59-F61 VanDerWaalsContact C-N 3.26Å; P59-F61 PolarHBondContact O-N 2.86Å; P59-V66 HydrophobicContact CB-CG2 4.27Å; P59-V66 HydrophobicContact CG-CG2 4.24Å; P59-D99 HydrophobicContact CB-CB 4.32Å; P59-D99 HydrophobicContact CG-CB 3.95Å; P59-W122 VanDerWaalsContact CD-CE3 3.47Å; P59-W122 HydrophobicContact CG-CE3 3.92Å; P59-W122 HydrophobicContact CG-CZ3 4.05Å
60	D	95.1	Very high	95.5	Very high	68 Å²	68	60.3 Å²	60.3	36%	0.364	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	38.6	-177.5	-65.2	-37.5	0	0	0	113.8	R58 G62 G63 K100	R58-D60 PolarHBondContact NH1-O 2.81Å; D60-G62 PolarHBondContact O-N 2.95Å; D60-G63 WeakPolarHBondContact O-CA 3.42Å; D60-G63 PolarHBondContact O-N 3.02Å; D60-K100 IonicContact OD1-NZ 2.81Å; D60-K100 PolarHBondContact OD1-NZ 3.5Å; D60-K100 WeakPolarHBondContact OD2-CE 3.37Å; D60-K100 IonicContact OD2-NZ 2.76Å; D60-K100 PolarHBondContact OD2-NZ 2.92Å
61	F	94.5	Very high	95.5	Very high	143 Å²	143	62.9 Å²	62.9	63%	0.627	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	121.9	175.2	-174.8	-101.2	0	0	0	111.8	L57 R58 P59	L57-F61 HydrophobicContact CB-CB 4.48Å; L57-F61 HydrophobicContact CD2-CD1 4.11Å; L57-F61 HydrophobicContact CD2-CD2 4.2Å; L57-F61 HydrophobicContact CD2-CE1 4.23Å; L57-F61 HydrophobicContact CD2-CE2 4.32Å; L57-F61 HydrophobicContact CD2-CG 4.1Å; L57-F61 HydrophobicContact CD2-CZ 4.33Å; R58-F61 HydrophobicContact CG-CB 4.4Å; R58-F61 HydrophobicContact CG-CD2 4.18Å; R58-F61 WeakPolarHBondContact O-CB 3.5Å; R58-F61 PolarHBondContact O-N 2.8Å; P59-F61 VanDerWaalsContact C-N 3.26Å; P59-F61 PolarHBondContact O-N 2.86Å
62	G	93	Very high	95.5	Very high	79 Å²	79	54.5 Å²	54.5	81%	0.814	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	1.1	-173.6	0	0	0	0	0	115	D60	D60-G62 PolarHBondContact O-N 2.95Å
63	G	94.9	Very high	95.6	Very high	46 Å²	46	53.2 Å²	53.2	47%	0.474	29%	0.293	S	S	.	.	S	Bend	trans	-120.4	-145.1	176.4	0	0	0	0	0	112.9	R58 D60	R58-G63 PolarHBondContact NH2-O 2.94Å; D60-G63 WeakPolarHBondContact O-CA 3.42Å; D60-G63 PolarHBondContact O-N 3.02Å
64	A	96.1	Very high	95.5	Very high	63 Å²	63	52 Å²	52	52%	0.521	29%	0.289	S	S	.	.	S	Bend	trans	-60.3	153.9	-179	0	0	0	0	0	112.6	R58	R58-A64 PolarHBondContact NH1-O 3.11Å
65	P	96.9	Very high	95.5	Very high	43 Å²	43	52.1 Å²	52.1	28%	0.279	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-61.6	150.3	171.2	26.4	-34.1	0	0	0	110.9	D193 E195	P65-D193 WeakPolarHBondContact CA-O 3.34Å; P65-E195 HydrophobicContact CB-CG 4.2Å; P65-E195 HydrophobicContact CG-CG 4.2Å
66	V	97.2	Very high	95.4	Very high	10 Å²	10	50.2 Å²	50.2	6%	0.061	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	122.8	174.7	64.8	0	0	0	0	110	P59 V68 W97 W122 D193 I194 E195	P59-V66 HydrophobicContact CB-CG2 4.27Å; P59-V66 HydrophobicContact CG-CG2 4.24Å; V66-V68 HydrophobicContact CG1-CG2 4.37Å; V66-V68 PolarHBondContact O-N 3.22Å; V66-W97 HydrophobicContact CG2-CB 4.06Å; V66-W97 HydrophobicContact CG2-CG 4.47Å; V66-W122 HydrophobicContact CG1-CH2 3.68Å; V66-W122 HydrophobicContact CG1-CZ2 4.4Å; V66-W122 HydrophobicContact CG1-CZ3 4.39Å; V66-D193 PolarHBondContact N-O 3.29Å; V66-I194 HydrophobicContact CG1-CB 4.16Å; V66-I194 HydrophobicContact CG1-CD1 4.09Å; V66-I194 HydrophobicContact CG1-CG1 3.73Å; V66-I194 WeakPolarHBondContact O-CA 3.46Å; V66-I194 WeakPolarHBondContact O-CG1 3.43Å; V66-E195 PolarHBondContact O-N 2.8Å
67	D	96.2	Very high	95.4	Very high	87 Å²	87	41.5 Å²	41.5	47%	0.465	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	114.4	177.3	-63.4	-40.5	0	0	0	110.2	Y197	D67-Y197 HydrophobicContact CB-CD1 4.45Å; D67-Y197 HydrophobicContact CB-CE1 3.88Å
68	V	97.4	Very high	95.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	110.1	177.1	-173.3	0	0	0	0	110.2	V66 Q95 S96 W97 P124 I194 E195 F196 Y197	V66-V68 HydrophobicContact CG1-CG2 4.37Å; V66-V68 PolarHBondContact O-N 3.22Å; V68-Q95 HydrophobicContact CG1-CB 4.12Å; V68-Q95 HydrophobicContact CG1-CG 4.46Å; V68-S96 WeakPolarHBondContact CA-O 3.39Å; V68-W97 HydrophobicContact CG2-CB 4.06Å; V68-P124 HydrophobicContact CG1-CG 4.08Å; V68-P124 HydrophobicContact CG2-CG 3.88Å; V68-I194 HydrophobicContact CG2-CD1 3.74Å; V68-I194 HydrophobicContact CG2-CG1 3.8Å; V68-E195 PolarHBondContact N-O 2.05Å; V68-F196 HydrophobicContact CB-CD1 3.87Å; V68-F196 HydrophobicContact CB-CE1 4Å; V68-F196 HydrophobicContact CG1-CE1 4.46Å; V68-F196 HydrophobicContact CG2-CE1 4.3Å; V68-Y197 VanDerWaalsContact C-CE1 3.46Å; V68-Y197 PolarHBondContact O-N 2.94Å
69	G	95.8	Very high	94.9	Very high	0 Å²	0	47 Å²	47	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	126.4	173.5	0	0	0	0	0	110.7	Q95 S96 Y197	G69-Q95 CarbonylContact O-C 3.45Å; G69-Q95 WeakPolarHBondContact O-CA 3.44Å; G69-S96 PolarHBondContact N-O 2.84Å; G69-S96 PolarHBondContact O-N 3.01Å; G69-Y197 VanDerWaalsContact CA-CE1 3.46Å; G69-Y197 WeakPolarHBondContact CA-O 3.08Å
70	M	95.1	Very high	94.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	140.3	177.4	-61.4	-167.9	-176.1	0	0	111.3	F93 Q94 T126 I184 F196 Y197 W198 Q199 L240	M70-F93 HydrophobicContact CB-CE2 4.41Å; M70-F93 HydrophobicContact CE-CZ 4.37Å; M70-F93 HydrophobicContact CG-CE2 4.4Å; M70-F93 HydrophobicContact SD-CE2 3.87Å; M70-F93 HydrophobicContact SD-CZ 3.75Å; M70-Q94 WeakPolarHBondContact CA-O 3.38Å; M70-T126 HydrophobicContact CE-CG2 3.49Å; M70-T126 VanDerWaalsContact CE-CG2 3.49Å; M70-I184 HydrophobicContact CE-CG2 3.86Å; M70-I184 HydrophobicContact SD-CB 4.37Å; M70-I184 HydrophobicContact SD-CD1 4.25Å; M70-I184 HydrophobicContact SD-CG2 3.63Å; M70-F196 HydrophobicContact CE-CB 4.42Å; M70-F196 HydrophobicContact CE-CD1 3.66Å; M70-F196 HydrophobicContact CE-CD2 3.55Å; M70-F196 HydrophobicContact CE-CE1 3.6Å; M70-F196 HydrophobicContact CE-CE2 3.48Å; M70-F196 VanDerWaalsContact CE-CE2 3.48Å; M70-F196 HydrophobicContact CE-CG 3.64Å; M70-F196 HydrophobicContact CE-CZ 3.52Å; M70-Y197 PolarHBondContact N-O 2.87Å; M70-W198 HydrophobicContact CB-CE3 4.47Å; M70-Q199 PolarHBondContact O-N 2.84Å; M70-L240 HydrophobicContact CB-CD1 3.91Å; M70-L240 HydrophobicContact CG-CD1 3.92Å; M70-L240 HydrophobicContact SD-CD1 3.66Å; M70-L240 HydrophobicContact SD-CG 4.49Å
71	R	94.1	Very high	94.7	Very high	98 Å²	98	44.9 Å²	44.9	37%	0.37	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	136.2	172.5	-177.4	177.8	-176.8	171.1	1.8	109.4	Q94 Q199 S206	R71-Q94 HydrophobicContact CB-CB 4.19Å; R71-Q94 PolarHBondContact N-O 3.13Å; R71-Q94 PolarHBondContact O-N 3.44Å; R71-Q199 HydrophobicContact CB-CB 4.4Å; R71-S206 WeakPolarHBondContact CA-O 3.46Å; R71-S206 WeakPolarHBondContact CG-O 3.23Å
72	I	95.2	Very high	94.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.7	-179.8	-64.2	172.5	0	0	0	108.6	I74 M91 F93 I184 W198 S206 V207 T208 L242	I72-I74 HydrophobicContact CG2-CG1 3.82Å; I72-M91 HydrophobicContact CD1-SD 4.32Å; I72-M91 HydrophobicContact CG1-SD 4.44Å; I72-M91 HydrophobicContact CG2-CB 4.03Å; I72-M91 HydrophobicContact CG2-CG 4.39Å; I72-M91 HydrophobicContact CG2-SD 3.66Å; I72-F93 HydrophobicContact CD1-CD2 4.45Å; I72-F93 HydrophobicContact CG1-CD2 3.88Å; I72-F93 HydrophobicContact CG1-CE2 4.34Å; I72-I184 HydrophobicContact CD1-CD1 3.84Å; I72-W198 HydrophobicContact CD1-CH2 3.66Å; I72-W198 HydrophobicContact CD1-CZ3 3.67Å; I72-W198 HydrophobicContact CG1-CZ3 4.06Å; I72-S206 PolarHBondContact N-O 2.82Å; I72-V207 HydrophobicContact CB-CG2 4.39Å; I72-V207 CarbonylContact O-C 3.44Å; I72-V207 VanDerWaalsContact O-CA 3.26Å; I72-V207 WeakPolarHBondContact O-CA 3.24Å; I72-T208 PolarHBondContact O-N 2.99Å; I72-L242 HydrophobicContact CD1-CD2 4.08Å
73	D	94.6	Very high	94.5	Very high	55 Å²	55	39.4 Å²	39.4	29%	0.294	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	112.6	167.3	-175.2	38.3	0	0	0	108.8	M91 Y92 T208	D73-M91 CarbonylContact O-C 3.58Å; D73-M91 WeakPolarHBondContact O-CA 3.49Å; D73-Y92 HydrophobicContact CB-CD2 4.38Å; D73-Y92 PolarHBondContact N-O 3.14Å; D73-Y92 PolarHBondContact O-N 3.11Å; D73-T208 WeakPolarHBondContact CB-OG1 3.48Å; D73-T208 VanDerWaalsContact CG-OG1 3.28Å; D73-T208 VanDerWaalsContact OD1-C 3.31Å; D73-T208 WeakPolarHBondContact OD1-CB 3.14Å; D73-T208 PolarHBondContact OD1-OG1 3.05Å
74	I	95.3	Very high	94.3	Very high	5 Å²	5	41.6 Å²	41.6	3%	0.026	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	124.4	-172.6	-54.3	168.9	0	0	0	108.4	I72 I89 V207 T208 V210 I213 L242 F244	I72-I74 HydrophobicContact CG2-CG1 3.82Å; I74-I89 HydrophobicContact CD1-CD1 4.19Å; I74-I89 HydrophobicContact CG1-CD1 4.22Å; I74-I89 HydrophobicContact CG2-CD1 3.91Å; I74-I89 HydrophobicContact CG2-CG1 3.97Å; I74-V207 HydrophobicContact CD1-CG1 3.87Å; I74-V207 HydrophobicContact CG1-CG1 4.31Å; I74-T208 PolarHBondContact N-O 3.3Å; I74-V210 HydrophobicContact CD1-CG2 3.72Å; I74-I213 HydrophobicContact CB-CD1 3.98Å; I74-I213 HydrophobicContact CD1-CD1 4.43Å; I74-I213 HydrophobicContact CG2-CD1 3.4Å; I74-I213 VanDerWaalsContact CG2-CD1 3.4Å; I74-I213 HydrophobicContact CG2-CG1 4.44Å; I74-L242 HydrophobicContact CD1-CD2 4.47Å; I74-F244 HydrophobicContact CD1-CE1 3.6Å; I74-F244 HydrophobicContact CD1-CZ 3.5Å; I74-F244 VanDerWaalsContact CD1-CZ 3.5Å
75	A	94.6	Very high	94.2	Very high	49 Å²	49	41.3 Å²	41.3	41%	0.405	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-47.3	176.8	0	0	0	0	0	111.2	T90 Y92	A75-T90 HydrophobicContact CB-CG2 4.22Å; A75-T90 WeakPolarHBondContact CB-O 3.24Å; A75-T90 PolarHBondContact N-O 3.17Å; A75-Y92 HydrophobicContact CB-CE2 4.22Å
76	S	94.4	Very high	94.2	Very high	39 Å²	39	39.9 Å²	39.9	27%	0.273	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	155.5	179.2	57.7	0	0	0	0	111.5	D78 T90	S76-D78 WeakPolarHBondContact CB-OD1 3.48Å; S76-D78 PolarHBondContact OG-OD1 3.24Å; S76-T90 PolarHBondContact N-O 2.78Å; S76-T90 VanDerWaalsContact N-O 3.16Å; S76-T90 PolarHBondContact O-N 2.78Å
77	I	94.9	Very high	94.2	Very high	9 Å²	9	39.5 Å²	39.5	5%	0.046	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	114.8	159.4	-63.1	172.9	0	0	0	105.5	V80 T88 I89 I213 L215 I220	I77-V80 HydrophobicContact CG2-CG2 4.11Å; I77-T88 CarbonylContact C-O 3.56Å; I77-T88 WeakPolarHBondContact CA-O 3.28Å; I77-I89 HydrophobicContact CG1-CB 4.45Å; I77-I89 HydrophobicContact CG1-CD1 4.28Å; I77-I89 HydrophobicContact CG1-CG1 4.1Å; I77-I213 HydrophobicContact CB-CG2 4.26Å; I77-I213 HydrophobicContact CD1-CD1 4.31Å; I77-I213 HydrophobicContact CD1-CG2 4.47Å; I77-I213 HydrophobicContact CG1-CD1 4.29Å; I77-I213 HydrophobicContact CG1-CG2 4.36Å; I77-L215 HydrophobicContact CB-CD1 4.42Å; I77-L215 HydrophobicContact CB-CD2 3.93Å; I77-L215 HydrophobicContact CD1-CD1 4.48Å; I77-L215 HydrophobicContact CG2-CD1 4.31Å; I77-L215 HydrophobicContact CG2-CD2 3.86Å; I77-L215 VanDerWaalsContact O-CD2 3.25Å; I77-L215 WeakPolarHBondContact O-CD2 3.26Å; I77-I220 HydrophobicContact CD1-CD1 4.03Å
78	D	90.9	Very high	94.2	Very high	84 Å²	84	36.1 Å²	36.1	45%	0.449	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-48.4	-164.8	-59.3	-37.4	0	0	0	111.4	S76 T88 T90	S76-D78 WeakPolarHBondContact CB-OD1 3.48Å; S76-D78 PolarHBondContact OG-OD1 3.24Å; D78-T88 HydrophobicContact CB-CG2 4.26Å; D78-T88 PolarHBondContact N-O 3.2Å; D78-T90 PolarHBondContact OD2-OG1 3.43Å
79	M	90.3	Very high	94.2	Very high	106 Å²	106	36.1 Å²	36.1	52%	0.522	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	143.8	177.8	66	-174.9	-59.2	0	0	111	Y87 T88	M79-Y87 CarbonylContact O-C 3.54Å; M79-Y87 VanDerWaalsContact O-CA 3.27Å; M79-Y87 WeakPolarHBondContact O-CA 3.41Å; M79-T88 PolarHBondContact O-N 2.96Å
80	V	94.6	Very high	94.2	Very high	14 Å²	14	36.4 Å²	36.4	9%	0.085	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114.1	170.3	-179.2	0	0	0	0	106	I77 M168 F218 L246	I77-V80 HydrophobicContact CG2-CG2 4.11Å; V80-M168 HydrophobicContact CG1-CE 3.48Å; V80-M168 VanDerWaalsContact CG1-CE 3.48Å; V80-F218 HydrophobicContact CB-CD2 4.06Å; V80-F218 HydrophobicContact CB-CE2 3.7Å; V80-F218 HydrophobicContact CB-CZ 4.35Å; V80-F218 HydrophobicContact CG1-CD2 4.35Å; V80-F218 HydrophobicContact CG1-CE2 3.72Å; V80-F218 HydrophobicContact CG1-CZ 3.85Å; V80-F218 HydrophobicContact CG2-CD2 4.26Å; V80-F218 HydrophobicContact CG2-CE2 4.37Å; V80-L246 HydrophobicContact CG2-CD1 4.31Å
81	S	93.4	Very high	94.3	Very high	13 Å²	13	36.4 Å²	36.4	9%	0.091	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	113.5	-176.7	-172.2	0	0	0	0	110.8	V83 N84 M85 D86	S81-V83 VanDerWaalsContact C-N 3.28Å; S81-V83 PolarHBondContact OG-N 3.24Å; S81-N84 PolarHBondContact OG-N 3.11Å; S81-M85 WeakPolarHBondContact O-CA 3.48Å; S81-M85 PolarHBondContact O-N 2.75Å; S81-D86 WeakPolarHBondContact CB-OD1 3.43Å; S81-D86 PolarHBondContact N-O 2.86Å; S81-D86 PolarHBondContact O-N 3.05Å
82	E	91.5	Very high	94.4	Very high	22 Å²	22	36.5 Å²	36.5	10%	0.103	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-30.1	170.2	-56.4	82	177.1	0	0	111.2	M168 L170 F218 R248 P305	E82-M168 HydrophobicContact CG-SD 4.16Å; E82-L170 HydrophobicContact CB-CD1 4.26Å; E82-L170 HydrophobicContact CG-CD2 4.36Å; E82-F218 WeakPolarHBondContact OE1-CZ 3.44Å; E82-R248 IonicContact OE1-CZ 3.36Å; E82-R248 VanDerWaalsContact OE1-CZ 3.26Å; E82-R248 IonicContact OE1-NH1 3.1Å; E82-R248 PolarHBondContact OE1-NH1 3.27Å; E82-R248 IonicContact OE1-NH2 2.8Å; E82-R248 PolarHBondContact OE1-NH2 2.76Å; E82-P305 HydrophobicContact CB-CG 4.08Å; E82-P305 WeakPolarHBondContact O-CG 3.26Å
83	V	90.3	Very high	94.5	Very high	84 Å²	84	36.6 Å²	36.6	51%	0.509	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-49.2	-180	-179.2	0	0	0	0	110.8	S81	S81-V83 VanDerWaalsContact C-N 3.28Å; S81-V83 PolarHBondContact OG-N 3.24Å
84	N	92.6	Very high	94.6	Very high	93 Å²	93	36.4 Å²	36.4	50%	0.497	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-8	-178	-61.5	-32.3	0	0	0	112.9	S81 D86 K132	S81-N84 PolarHBondContact OG-N 3.11Å; N84-D86 WeakPolarHBondContact CB-OD1 3.48Å; N84-D86 VanDerWaalsContact CB-OD2 3.25Å; N84-D86 WeakPolarHBondContact CB-OD2 3.45Å; N84-K132 PolarHBondContact O-NZ 2.9Å
85	M	93.8	Very high	94.7	Very high	56 Å²	56	36.3 Å²	36.3	28%	0.276	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	51.4	-173	-60.7	-176.5	174	0	0	111.6	S81 C166 M167	S81-M85 WeakPolarHBondContact O-CA 3.48Å; S81-M85 PolarHBondContact O-N 2.75Å; M85-C166 CarbonylContact C-O 3.58Å; M85-C166 WeakPolarHBondContact CB-O 3.38Å; M85-C166 PolarHBondContact O-N 3.29Å; M85-M167 HydrophobicContact SD-SD 4.45Å
86	D	96.5	Very high	94.8	Very high	13 Å²	13	34.5 Å²	34.5	7%	0.07	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	167.6	177.5	52.4	37.8	0	0	0	112.5	S81 N84 K132 T163 A164	S81-D86 WeakPolarHBondContact CB-OD1 3.43Å; S81-D86 PolarHBondContact N-O 2.86Å; S81-D86 PolarHBondContact O-N 3.05Å; N84-D86 WeakPolarHBondContact CB-OD1 3.48Å; N84-D86 VanDerWaalsContact CB-OD2 3.25Å; N84-D86 WeakPolarHBondContact CB-OD2 3.45Å; D86-K132 HydrophobicContact CB-CD 4.26Å; D86-K132 IonicContact OD2-NZ 3.46Å; D86-K132 PolarHBondContact OD2-NZ 2.93Å; D86-T163 HydrophobicContact CB-CG2 3.84Å; D86-A164 CarbonylContact C-O 3.51Å; D86-A164 VanDerWaalsContact CA-O 3.24Å; D86-A164 WeakPolarHBondContact CA-O 3.5Å; D86-A164 VanDerWaalsContact CB-O 3.23Å; D86-A164 WeakPolarHBondContact CB-O 3.31Å
87	Y	96.7	Very high	94.9	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.008	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	146.4	171.6	69.2	-75.6	0	0	0	109.9	M79 I89 T163 A164 C166 C180 T181 L182 F244	M79-Y87 CarbonylContact O-C 3.54Å; M79-Y87 VanDerWaalsContact O-CA 3.27Å; M79-Y87 WeakPolarHBondContact O-CA 3.41Å; Y87-I89 HydrophobicContact CD2-CB 4.31Å; Y87-I89 HydrophobicContact CE2-CB 4.14Å; Y87-I89 HydrophobicContact CE2-CG2 4.05Å; Y87-T163 CarbonylContact O-C 3.55Å; Y87-T163 WeakPolarHBondContact O-CA 3.36Å; Y87-A164 HydrophobicContact CD1-CB 4.3Å; Y87-A164 WeakPolarHBondContact CD1-O 3.46Å; Y87-A164 HydrophobicContact CE1-CB 3.67Å; Y87-A164 HydrophobicContact CE2-CB 4.49Å; Y87-A164 PolarHBondContact N-O 3.17Å; Y87-A164 PolarHBondContact O-N 2.76Å; Y87-C166 HydrophobicContact CD1-CB 3.76Å; Y87-C166 HydrophobicContact CE1-CB 4.06Å; Y87-C180 HydrophobicContact CD1-CB 3.89Å; Y87-C180 HydrophobicContact CE1-CB 3.67Å; Y87-T181 PolarHBondContact OH-O 2.84Å; Y87-T181 VanDerWaalsContact OH-O 3.12Å; Y87-L182 PolarHBondContact OH-N 3.09Å; Y87-F244 HydrophobicContact CE2-CD2 4.48Å; Y87-F244 HydrophobicContact CE2-CE2 4.44Å
88	T	96.8	Very high	95	Very high	16 Å²	16	39.1 Å²	39.1	10%	0.098	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.1	177.6	-58.8	0	0	0	0	109.5	I77 D78 M79 T161 T162 T163	I77-T88 CarbonylContact C-O 3.56Å; I77-T88 WeakPolarHBondContact CA-O 3.28Å; D78-T88 HydrophobicContact CB-CG2 4.26Å; D78-T88 PolarHBondContact N-O 3.2Å; M79-T88 PolarHBondContact O-N 2.96Å; T88-T161 HydrophobicContact CG2-CG2 3.51Å; T88-T162 WeakPolarHBondContact CA-O 2.96Å; T88-T163 PolarHBondContact OG1-OG1 2.92Å
89	I	96.2	Very high	95.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	133.3	179.1	-174.4	170.3	0	0	0	109.9	I74 I77 Y87 T161 T162 F244	I74-I89 HydrophobicContact CD1-CD1 4.19Å; I74-I89 HydrophobicContact CG1-CD1 4.22Å; I74-I89 HydrophobicContact CG2-CD1 3.91Å; I74-I89 HydrophobicContact CG2-CG1 3.97Å; I77-I89 HydrophobicContact CG1-CB 4.45Å; I77-I89 HydrophobicContact CG1-CD1 4.28Å; I77-I89 HydrophobicContact CG1-CG1 4.1Å; Y87-I89 HydrophobicContact CD2-CB 4.31Å; Y87-I89 HydrophobicContact CE2-CB 4.14Å; Y87-I89 HydrophobicContact CE2-CG2 4.05Å; I89-T161 WeakPolarHBondContact O-CA 3.15Å; I89-T162 HydrophobicContact CG2-CG2 3.56Å; I89-T162 PolarHBondContact N-O 2.93Å; I89-T162 PolarHBondContact O-N 3.06Å; I89-F244 HydrophobicContact CD1-CE2 4Å; I89-F244 HydrophobicContact CD1-CZ 3.89Å
90	T	96.8	Very high	95.5	Very high	6 Å²	6	35.4 Å²	35.4	4%	0.037	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.9	172.7	-63.2	0	0	0	0	108.8	A75 S76 D78 I160 T161	A75-T90 HydrophobicContact CB-CG2 4.22Å; A75-T90 WeakPolarHBondContact CB-O 3.24Å; A75-T90 PolarHBondContact N-O 3.17Å; S76-T90 PolarHBondContact N-O 2.78Å; S76-T90 VanDerWaalsContact N-O 3.16Å; S76-T90 PolarHBondContact O-N 2.78Å; D78-T90 PolarHBondContact OD2-OG1 3.43Å; T90-I160 WeakPolarHBondContact CA-O 3.39Å; T90-T161 WeakPolarHBondContact CG2-OG1 3.23Å; T90-T161 WeakPolarHBondContact OG1-CG2 3.4Å; T90-T161 PolarHBondContact OG1-OG1 3.26Å
91	M	96.7	Very high	95.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	156	-174.3	61.7	179.6	-177.8	0	0	112.6	I72 D73 F93 F128 I160 T162 L182	I72-M91 HydrophobicContact CD1-SD 4.32Å; I72-M91 HydrophobicContact CG1-SD 4.44Å; I72-M91 HydrophobicContact CG2-CB 4.03Å; I72-M91 HydrophobicContact CG2-CG 4.39Å; I72-M91 HydrophobicContact CG2-SD 3.66Å; D73-M91 CarbonylContact O-C 3.58Å; D73-M91 WeakPolarHBondContact O-CA 3.49Å; M91-F93 HydrophobicContact CE-CB 4.38Å; M91-F128 HydrophobicContact CE-CE1 3.59Å; M91-F128 HydrophobicContact CE-CE2 4.22Å; M91-F128 HydrophobicContact CE-CZ 3.33Å; M91-I160 PolarHBondContact N-O 2.79Å; M91-I160 PolarHBondContact O-N 2.77Å; M91-T162 HydrophobicContact CE-CG2 4.35Å; M91-L182 HydrophobicContact CE-CD2 3.75Å; M91-L182 HydrophobicContact SD-CD2 3.86Å
92	Y	96.9	Very high	95.6	Very high	100 Å²	100	38.2 Å²	38.2	39%	0.392	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	108.2	162	-57.2	-80.3	0	0	0	108.4	D73 A75 L158 R159	D73-Y92 HydrophobicContact CB-CD2 4.38Å; D73-Y92 PolarHBondContact N-O 3.14Å; D73-Y92 PolarHBondContact O-N 3.11Å; A75-Y92 HydrophobicContact CB-CE2 4.22Å; Y92-L158 CarbonylContact C-O 3.46Å; Y92-L158 WeakPolarHBondContact CA-O 3.26Å; Y92-R159 HydrophobicContact CD1-CB 4.02Å; Y92-R159 HydrophobicContact CD1-CG 3.98Å; Y92-R159 HydrophobicContact CE1-CB 4.08Å; Y92-R159 HydrophobicContact CE1-CG 3.76Å
93	F	97.2	Very high	95.8	Very high	2 Å²	2	40 Å²	40	1%	0.009	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	116.9	178.2	-176.4	-132.1	0	0	0	109.4	M70 I72 M91 Q95 F128 G157 L158 I160 I184	M70-F93 HydrophobicContact CB-CE2 4.41Å; M70-F93 HydrophobicContact CE-CZ 4.37Å; M70-F93 HydrophobicContact CG-CE2 4.4Å; M70-F93 HydrophobicContact SD-CE2 3.87Å; M70-F93 HydrophobicContact SD-CZ 3.75Å; I72-F93 HydrophobicContact CD1-CD2 4.45Å; I72-F93 HydrophobicContact CG1-CD2 3.88Å; I72-F93 HydrophobicContact CG1-CE2 4.34Å; M91-F93 HydrophobicContact CE-CB 4.38Å; F93-Q95 HydrophobicContact CE1-CG 4.15Å; F93-Q95 HydrophobicContact CZ-CG 4.18Å; F93-F128 HydrophobicContact CD1-CZ 4.3Å; F93-F128 HydrophobicContact CE1-CZ 4.29Å; F93-G157 CarbonylContact O-C 3.58Å; F93-G157 WeakPolarHBondContact O-CA 3.4Å; F93-L158 HydrophobicContact CB-CB 4.48Å; F93-L158 HydrophobicContact CD1-CD1 4.48Å; F93-L158 PolarHBondContact N-O 3.11Å; F93-L158 PolarHBondContact O-N 3.17Å; F93-I160 HydrophobicContact CB-CD1 4.06Å; F93-I160 HydrophobicContact CD1-CD1 3.92Å; F93-I160 HydrophobicContact CG-CD1 4.41Å; F93-I184 HydrophobicContact CE2-CD1 4.04Å; F93-I184 HydrophobicContact CZ-CD1 4.5Å; F93-I184 HydrophobicContact CZ-CG2 4.01Å
94	Q	96.2	Very high	95.9	Very high	52 Å²	52	36.5 Å²	36.5	24%	0.243	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137.6	-178.4	-64.2	179.4	0.3	0	0	110.3	M70 R71 L155 Y156	M70-Q94 WeakPolarHBondContact CA-O 3.38Å; R71-Q94 HydrophobicContact CB-CB 4.19Å; R71-Q94 PolarHBondContact N-O 3.13Å; R71-Q94 PolarHBondContact O-N 3.44Å; Q94-L155 HydrophobicContact CB-CD1 4.29Å; Q94-Y156 CarbonylContact C-O 3.53Å; Q94-Y156 WeakPolarHBondContact CA-O 3.28Å
95	Q	97	Very high	95.8	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.009	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.8	175.3	-62.8	176.1	22.5	0	0	108.8	V68 G69 F93 W97 T126 Y156	V68-Q95 HydrophobicContact CG1-CB 4.12Å; V68-Q95 HydrophobicContact CG1-CG 4.46Å; G69-Q95 CarbonylContact O-C 3.45Å; G69-Q95 WeakPolarHBondContact O-CA 3.44Å; F93-Q95 HydrophobicContact CE1-CG 4.15Å; F93-Q95 HydrophobicContact CZ-CG 4.18Å; Q95-W97 HydrophobicContact CB-CE3 4.25Å; Q95-W97 HydrophobicContact CB-CZ3 4.03Å; Q95-T126 PolarHBondContact NE2-OG1 2.93Å; Q95-Y156 PolarHBondContact N-O 2.84Å; Q95-Y156 PolarHBondContact O-N 2.99Å
96	S	96.3	Very high	95.4	Very high	11 Å²	11	37.8 Å²	37.8	8%	0.077	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	126.6	176.3	-169.4	0	0	0	0	110.3	V68 G69 T153 V154	V68-S96 WeakPolarHBondContact CA-O 3.39Å; G69-S96 PolarHBondContact N-O 2.84Å; G69-S96 PolarHBondContact O-N 3.01Å; S96-T153 WeakPolarHBondContact OG-CG2 3.48Å; S96-V154 VanDerWaalsContact CA-O 3.26Å; S96-V154 WeakPolarHBondContact CA-O 3.37Å; S96-V154 PolarHBondContact OG-O 3.32Å
97	W	97.3	Very high	95	Very high	6 Å²	6	37.5 Å²	37.5	2%	0.023	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	166.8	175.2	69.4	95.2	0	0	0	109.5	V66 V68 Q95 W122 V123 P124 T153 V154 Y156	V66-W97 HydrophobicContact CG2-CB 4.06Å; V66-W97 HydrophobicContact CG2-CG 4.47Å; V68-W97 HydrophobicContact CG2-CB 4.06Å; Q95-W97 HydrophobicContact CB-CE3 4.25Å; Q95-W97 HydrophobicContact CB-CZ3 4.03Å; W97-W122 AromaticContact CD1-CZ3 3.95Å; W97-W122 HydrophobicContact CD2-CZ3 4.4Å; W97-W122 HydrophobicContact CG-CZ3 4.33Å; W97-W122 HydrophobicContact CZ2-CE3 4.49Å; W97-W122 WeakPolarHBondContact CZ2-O 3.39Å; W97-W122 AromaticContact NE1-CE3 3.8Å; W97-W122 AromaticContact NE1-CZ3 3.79Å; W97-V123 HydrophobicContact CH2-CB 4.4Å; W97-V123 HydrophobicContact CH2-CG1 4.08Å; W97-V123 HydrophobicContact CZ2-CG1 4.42Å; W97-P124 HydrophobicContact CD2-CG 4.38Å; W97-P124 HydrophobicContact CE3-CG 4.05Å; W97-P124 HydrophobicContact CZ3-CG 4.19Å; W97-T153 CarbonylContact O-C 3.58Å; W97-T153 WeakPolarHBondContact O-CA 3.41Å; W97-V154 HydrophobicContact CD2-CB 4.21Å; W97-V154 HydrophobicContact CH2-CB 4.34Å; W97-V154 HydrophobicContact CH2-CG1 3.84Å; W97-V154 HydrophobicContact CZ2-CB 3.87Å; W97-V154 HydrophobicContact CZ2-CG1 3.64Å; W97-V154 HydrophobicContact CZ2-CG2 4.38Å; W97-V154 HydrophobicContact CZ3-CG1 4.46Å; W97-V154 PolarHBondContact N-O 3.31Å; W97-V154 VanDerWaalsContact N-O 3.17Å; W97-V154 PolarHBondContact O-N 3.04Å; W97-Y156 HydrophobicContact CH2-CG 4.27Å; W97-Y156 HydrophobicContact CZ3-CG 4.39Å
98	R	96.8	Very high	94.5	Very high	139 Å²	139	42.4 Å²	42.4	53%	0.525	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122.5	178.3	-168.9	175.7	-178.5	-173.8	-0.5	111	D151	R98-D151 PolarHBondContact NE-O 3.12Å; R98-D151 VanDerWaalsContact NE-O 3.15Å; R98-D151 PolarHBondContact NH2-O 2.89Å
99	D	97.1	Very high	94.1	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	25%	0.245	C	C	.	.			trans	-117.2	106.8	170.4	-170.3	-14.9	0	0	0	109.8	Y53 P59 R101 L102 G152 V154	Y53-D99 WeakPolarHBondContact CE2-OD2 3.49Å; Y53-D99 PolarHBondContact OH-OD2 2.83Å; P59-D99 HydrophobicContact CB-CB 4.32Å; P59-D99 HydrophobicContact CG-CB 3.95Å; D99-R101 PolarHBondContact O-N 3.33Å; D99-R101 VanDerWaalsContact O-N 3.14Å; D99-R101 VanDerWaalsContact OD1-CB 3.27Å; D99-R101 WeakPolarHBondContact OD1-CB 3.45Å; D99-R101 WeakPolarHBondContact OD1-CG 3.19Å; D99-R101 IonicContact OD1-CZ 3.22Å; D99-R101 PolarHBondContact OD1-N 3.39Å; D99-R101 IonicContact OD1-NE 3.81Å; D99-R101 PolarHBondContact OD1-NE 2.98Å; D99-R101 IonicContact OD1-NH2 2.86Å; D99-R101 IonicContact OD2-CZ 3.13Å; D99-R101 IonicContact OD2-NE 3.43Å; D99-R101 PolarHBondContact OD2-NE 3.2Å; D99-R101 IonicContact OD2-NH2 2.8Å; D99-R101 PolarHBondContact OD2-NH2 3.04Å; D99-L102 HydrophobicContact CB-CD1 4.1Å; D99-L102 HydrophobicContact CB-CG 4.3Å; D99-L102 PolarHBondContact O-N 2.86Å; D99-G152 PolarHBondContact N-O 3.46Å; D99-G152 WeakPolarHBondContact O-CA 3.41Å; D99-V154 HydrophobicContact CB-CG2 4.39Å
100	K	95.3	Very high	94	Very high	111 Å²	111	50.4 Å²	50.4	48%	0.483	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-59.5	-27.2	-178.1	-63.2	173	-171.3	147.8	0	112.6	D60 L102 S103	D60-K100 IonicContact OD1-NZ 2.81Å; D60-K100 PolarHBondContact OD1-NZ 3.5Å; D60-K100 WeakPolarHBondContact OD2-CE 3.37Å; D60-K100 IonicContact OD2-NZ 2.76Å; D60-K100 PolarHBondContact OD2-NZ 2.92Å; K100-L102 PolarHBondContact O-N 3.29Å; K100-S103 WeakPolarHBondContact O-CB 3.21Å; K100-S103 PolarHBondContact O-N 2.96Å; K100-S103 PolarHBondContact O-OG 3.24Å
101	R	95.3	Very high	93.7	Very high	84 Å²	84	51 Å²	51	32%	0.317	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-67.2	-25.1	178.7	-58	173.4	-68.4	-177.8	-0.7	112.5	Y53 D54 L57 D99	Y53-R101 HydrophobicContact CD2-CB 4.09Å; Y53-R101 HydrophobicContact CE2-CB 3.99Å; Y53-R101 PolarHBondContact OH-NH2 3.2Å; Y53-R101 VanDerWaalsContact OH-NH2 3.11Å; D54-R101 PolarHBondContact O-NH1 3.24Å; D54-R101 VanDerWaalsContact O-NH1 3.14Å; L57-R101 PolarHBondContact O-NH1 3.07Å; L57-R101 PolarHBondContact O-NH2 3.33Å; L57-R101 VanDerWaalsContact O-NH2 3.11Å; D99-R101 PolarHBondContact O-N 3.33Å; D99-R101 VanDerWaalsContact O-N 3.14Å; D99-R101 VanDerWaalsContact OD1-CB 3.27Å; D99-R101 WeakPolarHBondContact OD1-CB 3.45Å; D99-R101 WeakPolarHBondContact OD1-CG 3.19Å; D99-R101 IonicContact OD1-CZ 3.22Å; D99-R101 PolarHBondContact OD1-N 3.39Å; D99-R101 IonicContact OD1-NE 3.81Å; D99-R101 PolarHBondContact OD1-NE 2.98Å; D99-R101 IonicContact OD1-NH2 2.86Å; D99-R101 IonicContact OD2-CZ 3.13Å; D99-R101 IonicContact OD2-NE 3.43Å; D99-R101 PolarHBondContact OD2-NE 3.2Å; D99-R101 IonicContact OD2-NH2 2.8Å; D99-R101 PolarHBondContact OD2-NH2 3.04Å
102	L	95.3	Very high	93.6	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.01	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-97	12.3	-179.3	-60.4	175.4	0	0	0	112.8	L49 Y53 D99 K100 L121 L148 V154	L49-L102 HydrophobicContact CB-CD2 4.47Å; Y53-L102 HydrophobicContact CD2-CD2 3.97Å; Y53-L102 HydrophobicContact CE2-CD1 4.3Å; Y53-L102 HydrophobicContact CE2-CD2 3.79Å; Y53-L102 HydrophobicContact CE2-CG 3.91Å; D99-L102 HydrophobicContact CB-CD1 4.1Å; D99-L102 HydrophobicContact CB-CG 4.3Å; D99-L102 PolarHBondContact O-N 2.86Å; K100-L102 PolarHBondContact O-N 3.29Å; L102-L121 HydrophobicContact CD1-CD1 4.3Å; L102-L121 HydrophobicContact CD1-CD2 3.87Å; L102-L121 HydrophobicContact CD2-CD2 3.76Å; L102-L121 HydrophobicContact CG-CD2 4.46Å; L102-L148 HydrophobicContact CB-CD2 4.41Å; L102-L148 HydrophobicContact CD1-CD2 4.06Å; L102-V154 HydrophobicContact CD1-CG2 3.78Å
103	S	94.9	Very high	93.3	Very high	60 Å²	60	51.9 Å²	51.9	42%	0.42	28%	0.283	S	S	.	.			trans	-74	139.1	175	62.3	0	0	0	0	111.4	L49 K100	L49-S103 WeakPolarHBondContact CD2-O 3.48Å; K100-S103 WeakPolarHBondContact O-CB 3.21Å; K100-S103 PolarHBondContact O-N 2.96Å; K100-S103 PolarHBondContact O-OG 3.24Å
104	Y	93.6	Very high	93.1	Very high	11 Å²	11	55.5 Å²	55.5	4%	0.043	30%	0.302	C	S	.	.			trans	-135.7	148.9	-179.7	57.3	-89.5	0	0	0	111.4	T45 L49 I107 L109 L111 L148 H149 P150	T45-Y104 HydrophobicContact CG2-CG 4.49Å; L49-Y104 HydrophobicContact CD1-CD1 4.1Å; Y104-I107 HydrophobicContact CD2-CB 4.02Å; Y104-I107 HydrophobicContact CE2-CB 3.93Å; Y104-I107 HydrophobicContact CE2-CG2 4.37Å; Y104-L109 PolarHBondContact OH-O 2.85Å; Y104-L111 HydrophobicContact CD1-CD1 4.37Å; Y104-L111 HydrophobicContact CD2-CD1 4.43Å; Y104-L111 HydrophobicContact CE1-CD1 4.03Å; Y104-L111 HydrophobicContact CE1-CG 4.38Å; Y104-L111 HydrophobicContact CE2-CD1 4.09Å; Y104-L111 HydrophobicContact CE2-CG 4.22Å; Y104-L111 PolarHBondContact OH-N 2.68Å; Y104-L148 HydrophobicContact CE1-CB 3.98Å; Y104-L148 PolarHBondContact OH-O 3.34Å; Y104-H149 WeakPolarHBondContact CE1-O 3.42Å; Y104-P150 HydrophobicContact CD2-CB 4.24Å; Y104-P150 HydrophobicContact CE2-CB 3.79Å; Y104-P150 PolarHBondContact N-O 3.23Å
105	T	90	Very high	92.9	Very high	122 Å²	122	54.1 Å²	54.1	75%	0.748	30%	0.297	S	S	*	.	S	Bend	trans	-119.2	149.7	179.6	56.5	0	0	0	0	109.8
106	G	84.8	Confident	92.6	Very high	53 Å²	53	62.1 Å²	62.1	55%	0.546	33%	0.327	S	S	.	.	S	Bend	trans	95.8	-8.6	175.3	0	0	0	0	0	115.1
107	I	87.6	Confident	92.5	Very high	7 Å²	7	62.4 Å²	62.4	4%	0.036	33%	0.328	C	S	.	.			trans	-117.6	115.3	174.5	-55.9	172.1	0	0	0	108.7	Y41 V42 T45 Y104 L109 L111	Y41-I107 HydrophobicContact CD1-CD1 4.22Å; Y41-I107 HydrophobicContact CD1-CG1 3.98Å; Y41-I107 HydrophobicContact CE1-CD1 4.21Å; Y41-I107 HydrophobicContact CE1-CG1 3.68Å; V42-I107 HydrophobicContact CG2-CD1 4.16Å; T45-I107 HydrophobicContact CG2-CD1 4.09Å; Y104-I107 HydrophobicContact CD2-CB 4.02Å; Y104-I107 HydrophobicContact CE2-CB 3.93Å; Y104-I107 HydrophobicContact CE2-CG2 4.37Å; I107-L109 HydrophobicContact CG2-CB 3.95Å; I107-L109 PolarHBondContact O-N 2.98Å; I107-L111 HydrophobicContact CD1-CD1 4.27Å; I107-L111 HydrophobicContact CG2-CD2 4.22Å
108	P	86.5	Confident	92.3	Very high	106 Å²	106	62.4 Å²	62.4	69%	0.688	33%	0.329	S	S	*	.			trans	-83.6	17.2	-179.4	35.1	-36.1	0	0	0	113.4	P36	P36-P108 HydrophobicContact CB-CG 4.19Å
109	L	88.8	Confident	92.1	Very high	102 Å²	102	60.4 Å²	60.4	53%	0.534	33%	0.329	S	S	.	.	S	Bend	trans	-118.9	149.8	-173	-63.1	171.2	0	0	0	110.6	Y104 I107 L111	Y104-L109 PolarHBondContact OH-O 2.85Å; I107-L109 HydrophobicContact CG2-CB 3.95Å; I107-L109 PolarHBondContact O-N 2.98Å; L109-L111 PolarHBondContact O-N 3.31Å
110	N	93.4	Very high	92	Very high	82 Å²	82	65.6 Å²	65.6	44%	0.439	35%	0.353	S	S	.	.			trans	-80	114.4	170.8	-61.2	-32.1	0	0	0	109.7	T112 R147 H149	N110-T112 PolarHBondContact O-N 2.96Å; N110-R147 HydrophobicContact CB-CG 4.08Å; N110-H149 VanDerWaalsContact CG-CE1 3.48Å; N110-H149 PolarHBondContact ND2-CE1 2.78Å; N110-H149 VanDerWaalsContact ND2-CE1 3.34Å; N110-H149 PolarHBondContact ND2-ND1 2.88Å; N110-H149 PolarHBondContact OD1-ND1 2.7Å
111	L	91.5	Very high	92.1	Very high	17 Å²	17	60.8 Å²	60.8	9%	0.089	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	107.3	-178.9	-62.1	178.3	0	0	0	110.1	V42 V46 Y104 I107 L109 L113 R147 L148	V42-L111 HydrophobicContact CG1-CD2 3.8Å; V46-L111 HydrophobicContact CG2-CD1 4.29Å; Y104-L111 HydrophobicContact CD1-CD1 4.37Å; Y104-L111 HydrophobicContact CD2-CD1 4.43Å; Y104-L111 HydrophobicContact CE1-CD1 4.03Å; Y104-L111 HydrophobicContact CE1-CG 4.38Å; Y104-L111 HydrophobicContact CE2-CD1 4.09Å; Y104-L111 HydrophobicContact CE2-CG 4.22Å; Y104-L111 PolarHBondContact OH-N 2.68Å; I107-L111 HydrophobicContact CD1-CD1 4.27Å; I107-L111 HydrophobicContact CG2-CD2 4.22Å; L109-L111 PolarHBondContact O-N 3.31Å; L111-L113 HydrophobicContact CB-CD2 4.42Å; L111-R147 CarbonylContact O-C 3.54Å; L111-R147 WeakPolarHBondContact O-CA 3.46Å; L111-L148 HydrophobicContact CB-CB 4.47Å; L111-L148 PolarHBondContact N-O 2.75Å; L111-L148 PolarHBondContact O-N 3.01Å
112	T	93.8	Very high	92.2	Very high	83 Å²	83	57.2 Å²	57.2	51%	0.509	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	110.2	169.6	-55.5	0	0	0	0	108.2	N110 R147	N110-T112 PolarHBondContact O-N 2.96Å; T112-R147 PolarHBondContact OG1-NE 2.89Å; T112-R147 VanDerWaalsContact OG1-NE 3.16Å
113	L	91.4	Very high	92.2	Very high	36 Å²	36	59.2 Å²	59.2	19%	0.188	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	161.1	-175.6	-61.3	179.9	0	0	0	111.3	V46 L111 V117 I146 L148	V46-L113 HydrophobicContact CG1-CD2 4.5Å; V46-L113 HydrophobicContact CG2-CD2 4.01Å; L111-L113 HydrophobicContact CB-CD2 4.42Å; L113-V117 HydrophobicContact CB-CB 4.46Å; L113-V117 HydrophobicContact CB-CG1 3.67Å; L113-V117 HydrophobicContact CD1-CB 4.45Å; L113-V117 HydrophobicContact CD1-CG1 3.88Å; L113-V117 HydrophobicContact CD1-CG2 4.16Å; L113-V117 HydrophobicContact CG-CG1 4.45Å; L113-I146 HydrophobicContact CB-CG2 4.47Å; L113-I146 HydrophobicContact CD1-CG2 4.44Å; L113-I146 PolarHBondContact N-O 3.24Å; L113-L148 HydrophobicContact CD1-CD1 3.53Å; L113-L148 HydrophobicContact CD1-CG 4.01Å; L113-L148 HydrophobicContact CG-CD1 4.49Å
114	D	92.4	Very high	92.4	Very high	78 Å²	78	56.8 Å²	56.8	42%	0.417	31%	0.314	S	S	.	.			trans	-62.8	148.3	173.5	-179.5	105.3	0	0	0	111.3	R116 V117	D114-R116 PolarHBondContact O-N 3.24Å; D114-R116 IonicContact OD1-CZ 2.98Å; D114-R116 IonicContact OD1-NE 2.72Å; D114-R116 IonicContact OD1-NH2 3.63Å; D114-R116 PolarHBondContact OD1-NH2 3.5Å; D114-R116 VanDerWaalsContact OD2-CB 3.25Å; D114-R116 WeakPolarHBondContact OD2-CB 3.46Å; D114-R116 WeakPolarHBondContact OD2-CG 3.4Å; D114-R116 IonicContact OD2-CZ 3.26Å; D114-R116 PolarHBondContact OD2-N 3.09Å; D114-R116 IonicContact OD2-NE 2.74Å; D114-R116 PolarHBondContact OD2-NE 3.23Å; D114-R116 IonicContact OD2-NH2 3.58Å; D114-R116 PolarHBondContact OD2-NH2 3.02Å; D114-V117 VanDerWaalsContact O-CG1 3.3Å; D114-V117 WeakPolarHBondContact O-CG1 3.33Å; D114-V117 PolarHBondContact O-N 2.8Å; D114-V117 VanDerWaalsContact O-N 3.14Å
115	N	90.9	Very high	92.5	Very high	24 Å²	24	58.8 Å²	58.8	13%	0.128	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-15.9	-176	67.2	-2.3	0	0	0	114.9	A118 K142 R144	N115-A118 WeakPolarHBondContact O-CB 3.47Å; N115-K142 PolarHBondContact ND2-O 2.89Å; N115-R144 HydrophobicContact CB-CB 4.17Å; N115-R144 WeakPolarHBondContact CB-O 3.34Å; N115-R144 PolarHBondContact O-NH2 2.99Å
116	R	92	Very high	92.8	Very high	169 Å²	169	54.4 Å²	54.4	64%	0.638	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-24.7	177.3	-70	171	-76.8	-173.8	-5.2	113	D114 A118 D119	D114-R116 PolarHBondContact O-N 3.24Å; D114-R116 IonicContact OD1-CZ 2.98Å; D114-R116 IonicContact OD1-NE 2.72Å; D114-R116 IonicContact OD1-NH2 3.63Å; D114-R116 PolarHBondContact OD1-NH2 3.5Å; D114-R116 VanDerWaalsContact OD2-CB 3.25Å; D114-R116 WeakPolarHBondContact OD2-CB 3.46Å; D114-R116 WeakPolarHBondContact OD2-CG 3.4Å; D114-R116 IonicContact OD2-CZ 3.26Å; D114-R116 PolarHBondContact OD2-N 3.09Å; D114-R116 IonicContact OD2-NE 2.74Å; D114-R116 PolarHBondContact OD2-NE 3.23Å; D114-R116 IonicContact OD2-NH2 3.58Å; D114-R116 PolarHBondContact OD2-NH2 3.02Å; R116-A118 PolarHBondContact O-N 3.28Å; R116-D119 PolarHBondContact O-N 2.88Å
117	V	93.4	Very high	93.4	Very high	18 Å²	18	55.3 Å²	55.3	11%	0.109	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-65	-25.7	177.1	82.3	0	0	0	0	111.7	L50 L113 D114 D119 Q120 L121 I146	L50-V117 HydrophobicContact CD1-CG2 4.19Å; L50-V117 HydrophobicContact CD2-CG2 4.26Å; L113-V117 HydrophobicContact CB-CB 4.46Å; L113-V117 HydrophobicContact CB-CG1 3.67Å; L113-V117 HydrophobicContact CD1-CB 4.45Å; L113-V117 HydrophobicContact CD1-CG1 3.88Å; L113-V117 HydrophobicContact CD1-CG2 4.16Å; L113-V117 HydrophobicContact CG-CG1 4.45Å; D114-V117 VanDerWaalsContact O-CG1 3.3Å; D114-V117 WeakPolarHBondContact O-CG1 3.33Å; D114-V117 PolarHBondContact O-N 2.8Å; D114-V117 VanDerWaalsContact O-N 3.14Å; V117-D119 PolarHBondContact O-N 2.73Å; V117-Q120 CarbonylContact O-C 3.54Å; V117-Q120 WeakPolarHBondContact O-CA 3.46Å; V117-Q120 PolarHBondContact O-N 3.29Å; V117-L121 HydrophobicContact CG1-CD1 4.22Å; V117-L121 HydrophobicContact CG2-CD1 4.32Å; V117-L121 HydrophobicContact CG2-CG 4.4Å; V117-L121 WeakPolarHBondContact O-CG 3.28Å; V117-L121 PolarHBondContact O-N 3.33Å; V117-I146 HydrophobicContact CG1-CB 3.92Å; V117-I146 HydrophobicContact CG1-CG1 4Å; V117-I146 HydrophobicContact CG1-CG2 3.96Å
118	A	93	Very high	93.9	Very high	5 Å²	5	55.9 Å²	55.9	4%	0.041	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-58.4	-29.8	178.3	0	0	0	0	0	112.5	N115 R116 Q120 L121 I146 Y156	N115-A118 WeakPolarHBondContact O-CB 3.47Å; R116-A118 PolarHBondContact O-N 3.28Å; A118-Q120 PolarHBondContact O-N 2.82Å; A118-L121 PolarHBondContact O-N 2.67Å; A118-I146 HydrophobicContact CB-CD1 4.08Å; A118-I146 HydrophobicContact CB-CG1 3.78Å; A118-Y156 HydrophobicContact CB-CE2 4.12Å
119	D	93.8	Very high	94.4	Very high	98 Å²	98	53.7 Å²	53.7	52%	0.524	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-77.7	-8.8	178.4	-57.4	-43.9	0	0	0	112.4	R116 V117 R144	R116-D119 PolarHBondContact O-N 2.88Å; V117-D119 PolarHBondContact O-N 2.73Å; D119-R144 IonicContact OD1-CZ 3.81Å; D119-R144 IonicContact OD1-NH1 2.88Å; D119-R144 PolarHBondContact OD1-NH1 3.16Å; D119-R144 IonicContact OD1-NH2 2.81Å; D119-R144 PolarHBondContact OD1-NH2 2.88Å; D119-R144 IonicContact OD2-CZ 3.93Å; D119-R144 IonicContact OD2-NH1 2.75Å; D119-R144 IonicContact OD2-NH2 2.88Å; D119-R144 PolarHBondContact OD2-NH2 2.81Å
120	Q	94.9	Very high	94.7	Very high	109 Å²	109	50.5 Å²	50.5	51%	0.509	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-111.1	6.5	177.5	-58.1	-178.7	15.2	0	0	112.7	I55 V117 A118	I55-Q120 WeakPolarHBondContact CG2-O 3.3Å; V117-Q120 CarbonylContact O-C 3.54Å; V117-Q120 WeakPolarHBondContact O-CA 3.46Å; V117-Q120 PolarHBondContact O-N 3.29Å; A118-Q120 PolarHBondContact O-N 2.82Å
121	L	96	Very high	94.9	Very high	10 Å²	10	49 Å²	49	5%	0.052	25%	0.246	C	C	.	.	S	Bend	trans	-118.2	153.5	178	-65.4	178.9	0	0	0	109.8	L50 Y53 L102 V117 A118 V123 I146	L50-L121 HydrophobicContact CD2-CD2 3.81Å; Y53-L121 HydrophobicContact CD1-CD2 4.3Å; Y53-L121 HydrophobicContact CE1-CD2 3.97Å; L102-L121 HydrophobicContact CD1-CD1 4.3Å; L102-L121 HydrophobicContact CD1-CD2 3.87Å; L102-L121 HydrophobicContact CD2-CD2 3.76Å; L102-L121 HydrophobicContact CG-CD2 4.46Å; V117-L121 HydrophobicContact CG1-CD1 4.22Å; V117-L121 HydrophobicContact CG2-CD1 4.32Å; V117-L121 HydrophobicContact CG2-CG 4.4Å; V117-L121 WeakPolarHBondContact O-CG 3.28Å; V117-L121 PolarHBondContact O-N 3.33Å; A118-L121 PolarHBondContact O-N 2.67Å; L121-V123 PolarHBondContact O-N 3.14Å; L121-I146 HydrophobicContact CD1-CG2 4.07Å
122	W	97.3	Very high	95.1	Very high	9 Å²	9	53.4 Å²	53.4	3%	0.034	27%	0.265	C	S	.	.			trans	-69.9	130.6	167.2	178.8	93.2	0	0	0	108.4	Y53 R58 P59 V66 W97 P124 Y189 I194	Y53-W122 PolarHBondContact OH-N 3.42Å; R58-W122 HydrophobicContact CB-CZ2 3.85Å; P59-W122 VanDerWaalsContact CD-CE3 3.47Å; P59-W122 HydrophobicContact CG-CE3 3.92Å; P59-W122 HydrophobicContact CG-CZ3 4.05Å; V66-W122 HydrophobicContact CG1-CH2 3.68Å; V66-W122 HydrophobicContact CG1-CZ2 4.4Å; V66-W122 HydrophobicContact CG1-CZ3 4.39Å; W97-W122 AromaticContact CD1-CZ3 3.95Å; W97-W122 HydrophobicContact CD2-CZ3 4.4Å; W97-W122 HydrophobicContact CG-CZ3 4.33Å; W97-W122 HydrophobicContact CZ2-CE3 4.49Å; W97-W122 WeakPolarHBondContact CZ2-O 3.39Å; W97-W122 AromaticContact NE1-CE3 3.8Å; W97-W122 AromaticContact NE1-CZ3 3.79Å; W122-P124 HydrophobicContact CH2-CB 4.32Å; W122-P124 HydrophobicContact CH2-CG 3.85Å; W122-P124 HydrophobicContact CZ3-CG 3.82Å; W122-Y189 HydrophobicContact CZ2-CE2 4.02Å; W122-Y189 AromaticContact NE1-CE2 4Å; W122-Y189 AromaticContact NE1-CZ 3.77Å; W122-Y189 PolarHBondContact NE1-OH 2.82Å; W122-Y189 VanDerWaalsContact NE1-OH 3.14Å; W122-I194 HydrophobicContact CH2-CD1 4.25Å
123	V	97.1	Very high	95.2	Very high	45 Å²	45	56.8 Å²	56.8	27%	0.273	27%	0.272	S	S	.	.			trans	-127.9	144.8	172.9	-63.2	0	0	0	0	108.8	W97 L121 Y156	W97-V123 HydrophobicContact CH2-CB 4.4Å; W97-V123 HydrophobicContact CH2-CG1 4.08Å; W97-V123 HydrophobicContact CZ2-CG1 4.42Å; L121-V123 PolarHBondContact O-N 3.14Å; V123-Y156 HydrophobicContact CB-CE1 4.45Å; V123-Y156 HydrophobicContact CG1-CE1 4.43Å
124	P	97.2	Very high	95.5	Very high	8 Å²	8	57.4 Å²	57.4	5%	0.052	28%	0.28	C	S	.	.			trans	-57.8	140.2	176.1	-25	34.8	0	0	0	112.3	V68 W97 W122 T126 I194	V68-P124 HydrophobicContact CG1-CG 4.08Å; V68-P124 HydrophobicContact CG2-CG 3.88Å; W97-P124 HydrophobicContact CD2-CG 4.38Å; W97-P124 HydrophobicContact CE3-CG 4.05Å; W97-P124 HydrophobicContact CZ3-CG 4.19Å; W122-P124 HydrophobicContact CH2-CB 4.32Å; W122-P124 HydrophobicContact CH2-CG 3.85Å; W122-P124 HydrophobicContact CZ3-CG 3.82Å; P124-T126 HydrophobicContact CB-CG2 3.95Å; P124-T126 PolarHBondContact O-N 3.36Å; P124-I194 HydrophobicContact CB-CD1 4.08Å
125	D	96.3	Very high	95.7	Very high	53 Å²	53	58.8 Å²	58.8	28%	0.283	28%	0.282	S	S	.	.			trans	-85.7	48	178.9	65	-12	0	0	0	112	Y127 S186 Y187 G188 Y189	D125-Y127 PolarHBondContact O-N 2.98Å; D125-S186 PolarHBondContact OD1-OG 3.16Å; D125-Y187 PolarHBondContact O-N 3.19Å; D125-G188 WeakPolarHBondContact OD2-CA 3.34Å; D125-G188 PolarHBondContact OD2-N 2.81Å; D125-Y189 WeakPolarHBondContact OD1-CD2 3.25Å
126	T	97.1	Very high	96	Very high	31 Å²	31	60.6 Å²	60.6	19%	0.19	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	129.8	-179.9	55.4	0	0	0	0	110.8	M70 Q95 P124 E185 F196	M70-T126 HydrophobicContact CE-CG2 3.49Å; M70-T126 VanDerWaalsContact CE-CG2 3.49Å; Q95-T126 PolarHBondContact NE2-OG1 2.93Å; P124-T126 HydrophobicContact CB-CG2 3.95Å; P124-T126 PolarHBondContact O-N 3.36Å; T126-E185 CarbonylContact C-O 3.52Å; T126-E185 WeakPolarHBondContact CA-O 2.89Å; T126-F196 HydrophobicContact CG2-CE1 4.18Å; T126-F196 HydrophobicContact CG2-CE2 4.27Å; T126-F196 HydrophobicContact CG2-CZ 3.59Å
127	Y	97.3	Very high	96.2	Very high	72 Å²	72	54.3 Å²	54.3	28%	0.282	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	160.5	174.1	78.8	-71.9	0	0	0	110.8	D125 I129 E185 Y187	D125-Y127 PolarHBondContact O-N 2.98Å; Y127-I129 HydrophobicContact CE2-CG1 3.95Å; Y127-E185 HydrophobicContact CD1-CB 4.37Å; Y127-E185 WeakPolarHBondContact CD1-O 3.02Å; Y127-E185 HydrophobicContact CE1-CB 3.74Å; Y127-E185 HydrophobicContact CE1-CG 3.85Å; Y127-E185 PolarHBondContact N-O 2.8Å; Y127-E185 PolarHBondContact O-N 3.48Å; Y127-E185 PolarHBondContact OH-OE2 2.88Å; Y127-Y187 HydrophobicContact CD1-CD2 4.06Å; Y127-Y187 HydrophobicContact CD1-CG 4.4Å; Y127-Y187 AromaticContact CE1-CD2 3.96Å; Y127-Y187 HydrophobicContact CE1-CD2 3.96Å; Y127-Y187 HydrophobicContact CE1-CG 4.49Å; Y127-Y187 HydrophobicContact CE2-CD2 4.47Å; Y127-Y187 HydrophobicContact CG-CD2 4.39Å
128	F	97.6	Very high	96.3	Very high	19 Å²	19	55.4 Å²	55.4	8%	0.083	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	125.5	173.8	-49.3	-78	0	0	0	109.4	M91 F93 N130 D131 I160 L182 E183 I184	M91-F128 HydrophobicContact CE-CE1 3.59Å; M91-F128 HydrophobicContact CE-CE2 4.22Å; M91-F128 HydrophobicContact CE-CZ 3.33Å; F93-F128 HydrophobicContact CD1-CZ 4.3Å; F93-F128 HydrophobicContact CE1-CZ 4.29Å; F128-N130 VanDerWaalsContact C-N 3.33Å; F128-N130 PolarHBondContact O-N 3.14Å; F128-D131 HydrophobicContact CB-CB 4.06Å; F128-D131 WeakPolarHBondContact O-CB 3.45Å; F128-D131 PolarHBondContact O-N 3.32Å; F128-I160 HydrophobicContact CE2-CD1 4.13Å; F128-I160 HydrophobicContact CE2-CG2 4.38Å; F128-I160 HydrophobicContact CZ-CD1 4.22Å; F128-L182 HydrophobicContact CB-CD1 4.33Å; F128-L182 HydrophobicContact CD1-CD1 3.72Å; F128-L182 HydrophobicContact CD1-CD2 4.38Å; F128-L182 HydrophobicContact CD1-CG 4.03Å; F128-L182 HydrophobicContact CE1-CD1 4.32Å; F128-L182 HydrophobicContact CE1-CD2 4.23Å; F128-L182 HydrophobicContact CE1-CG 4.37Å; F128-L182 HydrophobicContact CG-CD1 4.16Å; F128-E183 CarbonylContact C-O 3.49Å; F128-E183 VanDerWaalsContact CA-O 3.23Å; F128-E183 WeakPolarHBondContact CA-O 3.48Å; F128-I184 HydrophobicContact CD1-CB 4.49Å; F128-I184 HydrophobicContact CD1-CG1 3.78Å; F128-I184 HydrophobicContact CE1-CD1 4.28Å; F128-I184 HydrophobicContact CE1-CG1 3.8Å; F128-I184 HydrophobicContact CE1-CG2 4.46Å
129	I	96.4	Very high	96.4	Very high	59 Å²	59	61.3 Å²	61.3	30%	0.303	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-39.5	-176.1	-58.7	177.6	0	0	0	110.9	Y127 D131 E183 E185 R239	Y127-I129 HydrophobicContact CE2-CG1 3.95Å; I129-D131 PolarHBondContact O-N 2.88Å; I129-E183 HydrophobicContact CB-CB 4.01Å; I129-E183 HydrophobicContact CD1-CB 4.04Å; I129-E183 HydrophobicContact CG1-CB 4.22Å; I129-E183 PolarHBondContact N-O 3.42Å; I129-E185 HydrophobicContact CD1-CB 3.99Å; I129-E185 WeakPolarHBondContact CD1-OE2 3.49Å; I129-E185 HydrophobicContact CG1-CB 4.11Å; I129-R239 HydrophobicContact CD1-CG 4.4Å; I129-R239 VanDerWaalsContact CD1-NH2 3.34Å
130	N	96.2	Very high	96.4	Very high	35 Å²	35	63.1 Å²	63.1	19%	0.187	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	3.1	-177.5	-61.7	-8.9	0	0	0	111.9	F128 K132 A164 A165 T181	F128-N130 VanDerWaalsContact C-N 3.33Å; F128-N130 PolarHBondContact O-N 3.14Å; N130-K132 PolarHBondContact O-N 2.83Å; N130-A164 HydrophobicContact CB-CB 4.21Å; N130-A164 CarbonylContact O-C 3.59Å; N130-A164 VanDerWaalsContact O-CA 3.31Å; N130-A164 WeakPolarHBondContact O-CA 3.33Å; N130-A165 HydrophobicContact CB-CB 4.47Å; N130-A165 PolarHBondContact O-N 2.84Å; N130-T181 PolarHBondContact ND2-O 3.48Å; N130-T181 PolarHBondContact ND2-OG1 2.95Å
131	D	97.3	Very high	96.4	Very high	51 Å²	51	62.1 Å²	62.1	27%	0.273	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	123.5	-176.5	-161.8	21.7	0	0	0	111.3	F128 I129 K133 S134 T162	F128-D131 HydrophobicContact CB-CB 4.06Å; F128-D131 WeakPolarHBondContact O-CB 3.45Å; F128-D131 PolarHBondContact O-N 3.32Å; I129-D131 PolarHBondContact O-N 2.88Å; D131-K133 PolarHBondContact OD1-N 3.16Å; D131-K133 VanDerWaalsContact OD1-N 3.16Å; D131-S134 WeakPolarHBondContact OD1-CB 3.43Å; D131-S134 PolarHBondContact OD1-N 2.84Å; D131-S134 WeakPolarHBondContact OD2-CB 3.46Å; D131-S134 PolarHBondContact OD2-N 3.33Å; D131-S134 PolarHBondContact OD2-OG 2.82Å; D131-T162 PolarHBondContact OD1-OG1 2.9Å
132	K	96.4	Very high	96.3	Very high	110 Å²	110	67.8 Å²	67.8	48%	0.478	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-38.4	164.2	-65.3	-174.2	-176.6	175.7	0	111.1	N84 D86 N130 T163 A165	N84-K132 PolarHBondContact O-NZ 2.9Å; D86-K132 HydrophobicContact CB-CD 4.26Å; D86-K132 IonicContact OD2-NZ 3.46Å; D86-K132 PolarHBondContact OD2-NZ 2.93Å; N130-K132 PolarHBondContact O-N 2.83Å; K132-T163 PolarHBondContact N-O 3.47Å; K132-A165 HydrophobicContact CG-CB 4.32Å
133	K	96.3	Very high	96.2	Very high	153 Å²	153	69.7 Å²	69.7	67%	0.665	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-161.2	123.8	-177.5	-175.4	178.4	-179.9	-178.4	0	109	D131 T163	D131-K133 PolarHBondContact OD1-N 3.16Å; D131-K133 VanDerWaalsContact OD1-N 3.16Å; K133-T163 PolarHBondContact O-N 3.43Å
134	S	96.9	Very high	96.1	Very high	50 Å²	50	69.5 Å²	69.5	35%	0.35	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	157.5	172.2	60.2	0	0	0	0	111.6	D131 T161	D131-S134 WeakPolarHBondContact OD1-CB 3.43Å; D131-S134 PolarHBondContact OD1-N 2.84Å; D131-S134 WeakPolarHBondContact OD2-CB 3.46Å; D131-S134 PolarHBondContact OD2-N 3.33Å; D131-S134 PolarHBondContact OD2-OG 2.82Å; S134-T161 CarbonylContact C-O 3.05Å; S134-T161 VanDerWaalsContact CA-O 3.26Å; S134-T161 WeakPolarHBondContact CA-O 3.48Å
135	F	97.3	Very high	96	Very high	107 Å²	107	71.7 Å²	71.7	47%	0.469	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	148.1	170.9	63.6	-86.5	0	0	0	110.8	H137 T161	F135-H137 AromaticContact CE2-CE1 3.61Å; F135-H137 AromaticContact CE2-ND1 3.93Å; F135-H137 AromaticContact CE2-NE2 3.83Å; F135-T161 HydrophobicContact CE1-CG2 3.82Å; F135-T161 HydrophobicContact CZ-CG2 3.95Å; F135-T161 PolarHBondContact N-O 2.99Å; F135-T161 PolarHBondContact O-N 2.9Å
136	V	97.1	Very high	96	Very high	62 Å²	62	69.1 Å²	69.1	38%	0.376	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	131	169	-178.2	0	0	0	0	108.1	R144 L158 I160	V136-R144 HydrophobicContact CG1-CG 4.41Å; V136-L158 HydrophobicContact CG1-CD2 4.35Å; V136-I160 HydrophobicContact CG2-CG1 4.42Å
137	H	96.4	Very high	95.9	Very high	36 Å²	36	71.8 Å²	71.8	17%	0.167	37%	0.37	C	S	.	.			trans	-61.9	141	179	-73.5	-92.3	0	0	0	111.5	F135 N143 R159 T161	F135-H137 AromaticContact CE2-CE1 3.61Å; F135-H137 AromaticContact CE2-ND1 3.93Å; F135-H137 AromaticContact CE2-NE2 3.83Å; H137-N143 HydrophobicContact CB-CB 4.21Å; H137-N143 WeakPolarHBondContact O-CB 3.36Å; H137-N143 PolarHBondContact O-N 2.96Å; H137-R159 HydrophobicContact CB-CB 4.47Å; H137-R159 HydrophobicContact CB-CG 4.48Å; H137-R159 PolarHBondContact CD2-O 2.84Å; H137-R159 PolarHBondContact CE1-NH1 2.81Å; H137-R159 VanDerWaalsContact CG-NH1 3.26Å; H137-R159 PolarHBondContact N-O 2.74Å; H137-R159 VanDerWaalsContact N-O 3.09Å; H137-R159 PolarHBondContact ND1-NH1 2.8Å; H137-T161 PolarHBondContact CE1-OG1 2.95Å; H137-T161 PolarHBondContact NE2-OG1 3.14Å
138	G	94.6	Very high	95.9	Very high	41 Å²	41	68.5 Å²	68.5	42%	0.423	36%	0.358	S	S	.	.			trans	-127.8	13.6	-167.4	0	0	0	0	0	116.4	T140 V141	G138-T140 CarbonylContact O-C 3.58Å; G138-V141 CarbonylContact C-O 3.58Å; G138-V141 WeakPolarHBondContact CA-O 3.35Å; G138-V141 CarbonylContact O-C 3.41Å
139	V	94.3	Very high	95.8	Very high	129 Å²	129	69.8 Å²	69.8	78%	0.782	36%	0.364	S	S	*	.	S	Bend	trans	-117.6	125.6	-173.8	-178.2	0	0	0	0	109.9	V141	V139-V141 VanDerWaalsContact C-N 3.35Å; V139-V141 PolarHBondContact N-O 2.83Å
140	T	94.3	Very high	95.7	Very high	137 Å²	137	69.4 Å²	69.4	84%	0.84	37%	0.365	S	S	*	.	S	Bend	cis	-77.5	-14.3	-6.6	51.7	0	0	0	0	113.7	G138	G138-T140 CarbonylContact O-C 3.58Å
141	V	95.2	Very high	95.6	Very high	88 Å²	88	71.2 Å²	71.2	53%	0.533	38%	0.375	S	S	.	.	S	Bend	trans	-132.6	170.4	174.4	-65	0	0	0	0	109.2	G138 V139 N143	G138-V141 CarbonylContact C-O 3.58Å; G138-V141 WeakPolarHBondContact CA-O 3.35Å; G138-V141 CarbonylContact O-C 3.41Å; V139-V141 VanDerWaalsContact C-N 3.35Å; V139-V141 PolarHBondContact N-O 2.83Å; V141-N143 PolarHBondContact O-N 2.89Å; V141-N143 PolarHBondContact O-OD1 3.2Å
142	K	94.6	Very high	95.4	Very high	128 Å²	128	68.8 Å²	68.8	56%	0.557	36%	0.362	S	S	*	.			trans	-59.4	121.8	171.7	-69.6	-173.8	179.2	-179.2	0	110.5	N115 R144	N115-K142 PolarHBondContact ND2-O 2.89Å; K142-R144 HydrophobicContact CB-CG 4.34Å; K142-R144 PolarHBondContact O-N 2.66Å
143	N	94.3	Very high	95.4	Very high	49 Å²	49	64.9 Å²	64.9	26%	0.262	35%	0.347	S	S	.	.			trans	-75.9	75	-176.6	-68.2	23.7	0	0	0	110.4	H137 V141 R159	H137-N143 HydrophobicContact CB-CB 4.21Å; H137-N143 WeakPolarHBondContact O-CB 3.36Å; H137-N143 PolarHBondContact O-N 2.96Å; V141-N143 PolarHBondContact O-N 2.89Å; V141-N143 PolarHBondContact O-OD1 3.2Å; N143-R159 HydrophobicContact CB-CB 3.79Å; N143-R159 PolarHBondContact O-N 3.24Å
144	R	95.6	Very high	95.5	Very high	41 Å²	41	57.6 Å²	57.6	16%	0.155	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	142.7	173.3	-44.2	-176.2	-71.9	-173.1	1.5	108.2	N115 D119 V136 K142 Y156 G157 L158	N115-R144 HydrophobicContact CB-CB 4.17Å; N115-R144 WeakPolarHBondContact CB-O 3.34Å; N115-R144 PolarHBondContact O-NH2 2.99Å; D119-R144 IonicContact OD1-CZ 3.81Å; D119-R144 IonicContact OD1-NH1 2.88Å; D119-R144 PolarHBondContact OD1-NH1 3.16Å; D119-R144 IonicContact OD1-NH2 2.81Å; D119-R144 PolarHBondContact OD1-NH2 2.88Å; D119-R144 IonicContact OD2-CZ 3.93Å; D119-R144 IonicContact OD2-NH1 2.75Å; D119-R144 IonicContact OD2-NH2 2.88Å; D119-R144 PolarHBondContact OD2-NH2 2.81Å; V136-R144 HydrophobicContact CG1-CG 4.41Å; K142-R144 HydrophobicContact CB-CG 4.34Å; K142-R144 PolarHBondContact O-N 2.66Å; R144-Y156 HydrophobicContact CB-CE2 4.24Å; R144-G157 CarbonylContact C-O 3.51Å; R144-G157 VanDerWaalsContact CA-O 3.24Å; R144-G157 WeakPolarHBondContact CA-O 3.22Å; R144-L158 HydrophobicContact CB-CD2 4.05Å; R144-L158 HydrophobicContact CG-CD2 3.58Å
145	M	94.5	Very high	95.4	Very high	54 Å²	54	56.2 Å²	56.2	27%	0.266	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139.7	171.7	61.6	169.5	-72.1	0	0	110.1	R147 L155 Y156 G157	M145-R147 HydrophobicContact CE-CB 4.19Å; M145-L155 HydrophobicContact CE-CD2 3.81Å; M145-L155 HydrophobicContact CE-CG 4.36Å; M145-Y156 WeakPolarHBondContact O-CA 3.5Å; M145-Y156 WeakPolarHBondContact O-CD2 3.27Å; M145-G157 PolarHBondContact N-O 2.92Å; M145-G157 PolarHBondContact O-N 3.4Å
146	I	95.9	Very high	95.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	123.1	169.2	-66.9	-73.7	0	0	0	106.9	L113 V117 A118 L121 L148 V154 L155 Y156	L113-I146 HydrophobicContact CB-CG2 4.47Å; L113-I146 HydrophobicContact CD1-CG2 4.44Å; L113-I146 PolarHBondContact N-O 3.24Å; V117-I146 HydrophobicContact CG1-CB 3.92Å; V117-I146 HydrophobicContact CG1-CG1 4Å; V117-I146 HydrophobicContact CG1-CG2 3.96Å; A118-I146 HydrophobicContact CB-CD1 4.08Å; A118-I146 HydrophobicContact CB-CG1 3.78Å; L121-I146 HydrophobicContact CD1-CG2 4.07Å; I146-L148 HydrophobicContact CG2-CD2 4.14Å; I146-L148 HydrophobicContact CG2-CG 4.26Å; I146-V154 HydrophobicContact CD1-CG1 4.39Å; I146-V154 HydrophobicContact CG2-CG1 4.42Å; I146-L155 WeakPolarHBondContact CA-O 3.37Å; I146-Y156 HydrophobicContact CD1-CD2 3.36Å; I146-Y156 HydrophobicContact CD1-CE2 4.03Å; I146-Y156 HydrophobicContact CD1-CG 4.11Å; I146-Y156 HydrophobicContact CG1-CD2 4.19Å
147	R	96.1	Very high	95.4	Very high	86 Å²	86	49.5 Å²	49.5	33%	0.325	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118	171.9	178.4	179.9	-64.2	152	1.5	108.9	N110 L111 T112 M145 L155	N110-R147 HydrophobicContact CB-CG 4.08Å; L111-R147 CarbonylContact O-C 3.54Å; L111-R147 WeakPolarHBondContact O-CA 3.46Å; T112-R147 PolarHBondContact OG1-NE 2.89Å; T112-R147 VanDerWaalsContact OG1-NE 3.16Å; M145-R147 HydrophobicContact CE-CB 4.19Å; R147-L155 HydrophobicContact CB-CB 4.2Å; R147-L155 HydrophobicContact CB-CD2 4.49Å; R147-L155 PolarHBondContact N-O 2.92Å; R147-L155 PolarHBondContact O-N 2.78Å
148	L	95.7	Very high	95.5	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	127.7	177.2	-60.2	-178.3	0	0	0	109.7	L49 L102 Y104 L111 L113 I146 V154	L49-L148 HydrophobicContact CD1-CD1 4.34Å; L102-L148 HydrophobicContact CB-CD2 4.41Å; L102-L148 HydrophobicContact CD1-CD2 4.06Å; Y104-L148 HydrophobicContact CE1-CB 3.98Å; Y104-L148 PolarHBondContact OH-O 3.34Å; L111-L148 HydrophobicContact CB-CB 4.47Å; L111-L148 PolarHBondContact N-O 2.75Å; L111-L148 PolarHBondContact O-N 3.01Å; L113-L148 HydrophobicContact CD1-CD1 3.53Å; L113-L148 HydrophobicContact CD1-CG 4.01Å; L113-L148 HydrophobicContact CG-CD1 4.49Å; I146-L148 HydrophobicContact CG2-CD2 4.14Å; I146-L148 HydrophobicContact CG2-CG 4.26Å; L148-V154 HydrophobicContact CD2-CB 4.28Å; L148-V154 HydrophobicContact CD2-CG1 4.02Å; L148-V154 HydrophobicContact CD2-CG2 3.69Å
149	H	95.7	Very high	95.6	Very high	45 Å²	45	50.1 Å²	50.1	21%	0.208	26%	0.26	C	S	.	.			trans	-93.8	152.7	170.9	-67.5	-84.1	0	0	0	110.3	Y104 N110 D151 G152 T153	Y104-H149 WeakPolarHBondContact CE1-O 3.42Å; N110-H149 VanDerWaalsContact CG-CE1 3.48Å; N110-H149 PolarHBondContact ND2-CE1 2.78Å; N110-H149 VanDerWaalsContact ND2-CE1 3.34Å; N110-H149 PolarHBondContact ND2-ND1 2.88Å; N110-H149 PolarHBondContact OD1-ND1 2.7Å; H149-D151 WeakPolarHBondContact CB-OD1 3.3Å; H149-D151 PolarHBondContact O-N 2.8Å; H149-G152 PolarHBondContact O-N 2.59Å; H149-T153 WeakPolarHBondContact CB-O 3.48Å; H149-T153 PolarHBondContact CD2-O 3.48Å; H149-T153 PolarHBondContact N-O 3Å
150	P	94.3	Very high	95.7	Very high	52 Å²	52	44.4 Å²	44.4	34%	0.338	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.6	-175	23.6	-34	0	0	0	113.7	Y104 G152	Y104-P150 HydrophobicContact CD2-CB 4.24Å; Y104-P150 HydrophobicContact CE2-CB 3.79Å; Y104-P150 PolarHBondContact N-O 3.23Å; P150-G152 PolarHBondContact O-N 2.75Å
151	D	94.3	Very high	95.9	Very high	73 Å²	73	38.3 Å²	38.3	39%	0.39	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-2.6	176.9	67.7	-26.5	0	0	0	114.3	R98 H149 T153	R98-D151 PolarHBondContact NE-O 3.12Å; R98-D151 VanDerWaalsContact NE-O 3.15Å; R98-D151 PolarHBondContact NH2-O 2.89Å; H149-D151 WeakPolarHBondContact CB-OD1 3.3Å; H149-D151 PolarHBondContact O-N 2.8Å; D151-T153 VanDerWaalsContact CG-OG1 3.26Å; D151-T153 VanDerWaalsContact OD1-CB 3.31Å; D151-T153 WeakPolarHBondContact OD1-CB 3.26Å; D151-T153 PolarHBondContact OD1-N 2.86Å; D151-T153 PolarHBondContact OD1-OG1 3.05Å; D151-T153 PolarHBondContact OD2-OG1 2.85Å
152	G	94.6	Very high	96	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	88.7	6.2	-174.3	0	0	0	0	0	113.8	D99 H149 P150 V154	D99-G152 PolarHBondContact N-O 3.46Å; D99-G152 WeakPolarHBondContact O-CA 3.41Å; H149-G152 PolarHBondContact O-N 2.59Å; P150-G152 PolarHBondContact O-N 2.75Å; G152-V154 PolarHBondContact O-N 2.79Å
153	T	96.3	Very high	96.1	Very high	27 Å²	27	29.4 Å²	29.4	17%	0.166	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	128.4	174.5	-61	0	0	0	0	110	S96 W97 H149 D151	S96-T153 WeakPolarHBondContact OG-CG2 3.48Å; W97-T153 CarbonylContact O-C 3.58Å; W97-T153 WeakPolarHBondContact O-CA 3.41Å; H149-T153 WeakPolarHBondContact CB-O 3.48Å; H149-T153 PolarHBondContact CD2-O 3.48Å; H149-T153 PolarHBondContact N-O 3Å; D151-T153 VanDerWaalsContact CG-OG1 3.26Å; D151-T153 VanDerWaalsContact OD1-CB 3.31Å; D151-T153 WeakPolarHBondContact OD1-CB 3.26Å; D151-T153 PolarHBondContact OD1-N 2.86Å; D151-T153 PolarHBondContact OD1-OG1 3.05Å; D151-T153 PolarHBondContact OD2-OG1 2.85Å
154	V	96.9	Very high	96.3	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.8	177.7	-173.4	0	0	0	0	107.9	S96 W97 D99 L102 I146 L148 G152	S96-V154 VanDerWaalsContact CA-O 3.26Å; S96-V154 WeakPolarHBondContact CA-O 3.37Å; S96-V154 PolarHBondContact OG-O 3.32Å; W97-V154 HydrophobicContact CD2-CB 4.21Å; W97-V154 HydrophobicContact CH2-CB 4.34Å; W97-V154 HydrophobicContact CH2-CG1 3.84Å; W97-V154 HydrophobicContact CZ2-CB 3.87Å; W97-V154 HydrophobicContact CZ2-CG1 3.64Å; W97-V154 HydrophobicContact CZ2-CG2 4.38Å; W97-V154 HydrophobicContact CZ3-CG1 4.46Å; W97-V154 PolarHBondContact N-O 3.31Å; W97-V154 VanDerWaalsContact N-O 3.17Å; W97-V154 PolarHBondContact O-N 3.04Å; D99-V154 HydrophobicContact CB-CG2 4.39Å; L102-V154 HydrophobicContact CD1-CG2 3.78Å; I146-V154 HydrophobicContact CD1-CG1 4.39Å; I146-V154 HydrophobicContact CG2-CG1 4.42Å; L148-V154 HydrophobicContact CD2-CB 4.28Å; L148-V154 HydrophobicContact CD2-CG1 4.02Å; L148-V154 HydrophobicContact CD2-CG2 3.69Å; G152-V154 PolarHBondContact O-N 2.79Å
155	L	96.4	Very high	96.4	Very high	21 Å²	21	26.6 Å²	26.6	11%	0.11	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.2	166.9	175.6	71.3	0	0	0	108.5	Q94 M145 I146 R147	Q94-L155 HydrophobicContact CB-CD1 4.29Å; M145-L155 HydrophobicContact CE-CD2 3.81Å; M145-L155 HydrophobicContact CE-CG 4.36Å; I146-L155 WeakPolarHBondContact CA-O 3.37Å; R147-L155 HydrophobicContact CB-CB 4.2Å; R147-L155 HydrophobicContact CB-CD2 4.49Å; R147-L155 PolarHBondContact N-O 2.92Å; R147-L155 PolarHBondContact O-N 2.78Å
156	Y	97.3	Very high	96.4	Very high	22 Å²	22	24.1 Å²	24.1	9%	0.086	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	118.3	175.7	-178.8	-131	0	0	0	109.8	Q94 Q95 W97 A118 V123 R144 M145 I146 L158	Q94-Y156 CarbonylContact C-O 3.53Å; Q94-Y156 WeakPolarHBondContact CA-O 3.28Å; Q95-Y156 PolarHBondContact N-O 2.84Å; Q95-Y156 PolarHBondContact O-N 2.99Å; W97-Y156 HydrophobicContact CH2-CG 4.27Å; W97-Y156 HydrophobicContact CZ3-CG 4.39Å; A118-Y156 HydrophobicContact CB-CE2 4.12Å; V123-Y156 HydrophobicContact CB-CE1 4.45Å; V123-Y156 HydrophobicContact CG1-CE1 4.43Å; R144-Y156 HydrophobicContact CB-CE2 4.24Å; M145-Y156 WeakPolarHBondContact O-CA 3.5Å; M145-Y156 WeakPolarHBondContact O-CD2 3.27Å; I146-Y156 HydrophobicContact CD1-CD2 3.36Å; I146-Y156 HydrophobicContact CD1-CE2 4.03Å; I146-Y156 HydrophobicContact CD1-CG 4.11Å; I146-Y156 HydrophobicContact CG1-CD2 4.19Å; Y156-L158 HydrophobicContact CD1-CD1 4.37Å; Y156-L158 HydrophobicContact CD1-CG 4.35Å; Y156-L158 HydrophobicContact CE1-CD1 3.58Å; Y156-L158 HydrophobicContact CE1-CD2 4.07Å; Y156-L158 HydrophobicContact CE1-CG 3.74Å; Y156-L158 HydrophobicContact CE2-CD2 4.09Å; Y156-L158 HydrophobicContact CE2-CG 4.42Å; Y156-L158 WeakPolarHBondContact OH-CD2 3.22Å
157	G	96.8	Very high	96.3	Very high	6 Å²	6	31.8 Å²	31.8	6%	0.062	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138.1	178.5	0	0	0	0	0	111.3	F93 R144 M145	F93-G157 CarbonylContact O-C 3.58Å; F93-G157 WeakPolarHBondContact O-CA 3.4Å; R144-G157 CarbonylContact C-O 3.51Å; R144-G157 VanDerWaalsContact CA-O 3.24Å; R144-G157 WeakPolarHBondContact CA-O 3.22Å; M145-G157 PolarHBondContact N-O 2.92Å; M145-G157 PolarHBondContact O-N 3.4Å
158	L	96.9	Very high	96.2	Very high	19 Å²	19	28.2 Å²	28.2	10%	0.099	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	138	177.1	-69.2	175.5	0	0	0	109.5	Y92 F93 V136 R144 Y156 I160	Y92-L158 CarbonylContact C-O 3.46Å; Y92-L158 WeakPolarHBondContact CA-O 3.26Å; F93-L158 HydrophobicContact CB-CB 4.48Å; F93-L158 HydrophobicContact CD1-CD1 4.48Å; F93-L158 PolarHBondContact N-O 3.11Å; F93-L158 PolarHBondContact O-N 3.17Å; V136-L158 HydrophobicContact CG1-CD2 4.35Å; R144-L158 HydrophobicContact CB-CD2 4.05Å; R144-L158 HydrophobicContact CG-CD2 3.58Å; Y156-L158 HydrophobicContact CD1-CD1 4.37Å; Y156-L158 HydrophobicContact CD1-CG 4.35Å; Y156-L158 HydrophobicContact CE1-CD1 3.58Å; Y156-L158 HydrophobicContact CE1-CD2 4.07Å; Y156-L158 HydrophobicContact CE1-CG 3.74Å; Y156-L158 HydrophobicContact CE2-CD2 4.09Å; Y156-L158 HydrophobicContact CE2-CG 4.42Å; Y156-L158 WeakPolarHBondContact OH-CD2 3.22Å; L158-I160 HydrophobicContact CB-CD1 3.86Å; L158-I160 HydrophobicContact CB-CG1 3.72Å; L158-I160 HydrophobicContact CD1-CD1 3.88Å
159	R	97.3	Very high	96.1	Very high	71 Å²	71	31.8 Å²	31.8	27%	0.268	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	110.1	163.6	-168.8	-176.3	179.8	-123.4	0.8	108.5	Y92 H137 N143	Y92-R159 HydrophobicContact CD1-CB 4.02Å; Y92-R159 HydrophobicContact CD1-CG 3.98Å; Y92-R159 HydrophobicContact CE1-CB 4.08Å; Y92-R159 HydrophobicContact CE1-CG 3.76Å; H137-R159 HydrophobicContact CB-CB 4.47Å; H137-R159 HydrophobicContact CB-CG 4.48Å; H137-R159 PolarHBondContact CD2-O 2.84Å; H137-R159 PolarHBondContact CE1-NH1 2.81Å; H137-R159 VanDerWaalsContact CG-NH1 3.26Å; H137-R159 PolarHBondContact N-O 2.74Å; H137-R159 VanDerWaalsContact N-O 3.09Å; H137-R159 PolarHBondContact ND1-NH1 2.8Å; N143-R159 HydrophobicContact CB-CB 3.79Å; N143-R159 PolarHBondContact O-N 3.24Å
160	I	97.3	Very high	96	Very high	10 Å²	10	29.8 Å²	29.8	5%	0.051	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.6	-173.5	-51	179.5	0	0	0	108.9	T90 M91 F93 F128 V136 L158	T90-I160 WeakPolarHBondContact CA-O 3.39Å; M91-I160 PolarHBondContact N-O 2.79Å; M91-I160 PolarHBondContact O-N 2.77Å; F93-I160 HydrophobicContact CB-CD1 4.06Å; F93-I160 HydrophobicContact CD1-CD1 3.92Å; F93-I160 HydrophobicContact CG-CD1 4.41Å; F128-I160 HydrophobicContact CE2-CD1 4.13Å; F128-I160 HydrophobicContact CE2-CG2 4.38Å; F128-I160 HydrophobicContact CZ-CD1 4.22Å; V136-I160 HydrophobicContact CG2-CG1 4.42Å; L158-I160 HydrophobicContact CB-CD1 3.86Å; L158-I160 HydrophobicContact CB-CG1 3.72Å; L158-I160 HydrophobicContact CD1-CD1 3.88Å
161	T	97.8	Very high	95.9	Very high	8 Å²	8	34.7 Å²	34.7	5%	0.049	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.5	158.6	-63.9	0	0	0	0	107.7	T88 I89 T90 S134 F135 H137	T88-T161 HydrophobicContact CG2-CG2 3.51Å; I89-T161 WeakPolarHBondContact O-CA 3.15Å; T90-T161 WeakPolarHBondContact CG2-OG1 3.23Å; T90-T161 WeakPolarHBondContact OG1-CG2 3.4Å; T90-T161 PolarHBondContact OG1-OG1 3.26Å; S134-T161 CarbonylContact C-O 3.05Å; S134-T161 VanDerWaalsContact CA-O 3.26Å; S134-T161 WeakPolarHBondContact CA-O 3.48Å; F135-T161 HydrophobicContact CE1-CG2 3.82Å; F135-T161 HydrophobicContact CZ-CG2 3.95Å; F135-T161 PolarHBondContact N-O 2.99Å; F135-T161 PolarHBondContact O-N 2.9Å; H137-T161 PolarHBondContact CE1-OG1 2.95Å; H137-T161 PolarHBondContact NE2-OG1 3.14Å
162	T	97.4	Very high	95.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.2	177.6	174.5	0	0	0	0	109.8	T88 I89 M91 D131 L182	T88-T162 WeakPolarHBondContact CA-O 2.96Å; I89-T162 HydrophobicContact CG2-CG2 3.56Å; I89-T162 PolarHBondContact N-O 2.93Å; I89-T162 PolarHBondContact O-N 3.06Å; M91-T162 HydrophobicContact CE-CG2 4.35Å; D131-T162 PolarHBondContact OD1-OG1 2.9Å; T162-L182 HydrophobicContact CG2-CD1 4.26Å
163	T	97.8	Very high	95.8	Very high	29 Å²	29	37 Å²	37	18%	0.178	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	103.2	168.1	-57.9	0	0	0	0	107.7	D86 Y87 T88 K132 K133	D86-T163 HydrophobicContact CB-CG2 3.84Å; Y87-T163 CarbonylContact O-C 3.55Å; Y87-T163 WeakPolarHBondContact O-CA 3.36Å; T88-T163 PolarHBondContact OG1-OG1 2.92Å; K132-T163 PolarHBondContact N-O 3.47Å; K133-T163 PolarHBondContact O-N 3.43Å
164	A	97.4	Very high	95.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	135.3	-177.7	0	0	0	0	0	110.9	D86 Y87 N130 L182	D86-A164 CarbonylContact C-O 3.51Å; D86-A164 VanDerWaalsContact CA-O 3.24Å; D86-A164 WeakPolarHBondContact CA-O 3.5Å; D86-A164 VanDerWaalsContact CB-O 3.23Å; D86-A164 WeakPolarHBondContact CB-O 3.31Å; Y87-A164 HydrophobicContact CD1-CB 4.3Å; Y87-A164 WeakPolarHBondContact CD1-O 3.46Å; Y87-A164 HydrophobicContact CE1-CB 3.67Å; Y87-A164 HydrophobicContact CE2-CB 4.49Å; Y87-A164 PolarHBondContact N-O 3.17Å; Y87-A164 PolarHBondContact O-N 2.76Å; N130-A164 HydrophobicContact CB-CB 4.21Å; N130-A164 CarbonylContact O-C 3.59Å; N130-A164 VanDerWaalsContact O-CA 3.31Å; N130-A164 WeakPolarHBondContact O-CA 3.33Å; A164-L182 HydrophobicContact CB-CD1 4.19Å
165	A	97.1	Very high	95.5	Very high	31 Å²	31	37.2 Å²	37.2	26%	0.256	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	135.5	173.5	0	0	0	0	0	110.8	N130 K132	N130-A165 HydrophobicContact CB-CB 4.47Å; N130-A165 PolarHBondContact O-N 2.84Å; K132-A165 HydrophobicContact CG-CB 4.32Å
166	C	96.3	Very high	95.4	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.02	17%	0.171	C	C	.	.			trans	-136.4	113.1	175.1	176.7	0	0	0	0	109.4	M85 Y87 M168 C180	M85-C166 CarbonylContact C-O 3.58Å; M85-C166 WeakPolarHBondContact CB-O 3.38Å; M85-C166 PolarHBondContact O-N 3.29Å; Y87-C166 HydrophobicContact CD1-CB 3.76Å; Y87-C166 HydrophobicContact CE1-CB 4.06Å; C166-M168 HydrophobicContact CB-CE 4.35Å; C166-M168 PolarHBondContact O-N 3.28Å; C166-C180 HydrophobicContact CB-CB 3.78Å; C166-C180 WeakPolarHBondContact CB-SG 3.32Å; C166-C180 WeakPolarHBondContact SG-CA 3.35Å; C166-C180 WeakPolarHBondContact SG-CB 3.37Å; C166-C180 CovalentContact SG-SG 2.05Å; C166-C180 PolarHBondContact SG-SG 2.8Å
167	M	93.3	Very high	95.3	Very high	161 Å²	161	39.6 Å²	39.6	79%	0.793	19%	0.187	S	C	*	.			trans	-77.2	102.9	177.9	-64.2	-64.5	-78.1	0	0	109.4	M85	M85-M167 HydrophobicContact SD-SD 4.45Å
168	M	93.2	Very high	95.2	Very high	11 Å²	11	39.6 Å²	39.6	5%	0.054	19%	0.185	C	C	.	.			trans	-91	139.3	-176.9	-61.9	175.1	-167.4	0	0	111.9	V80 E82 C166 L170 Q178	V80-M168 HydrophobicContact CG1-CE 3.48Å; V80-M168 VanDerWaalsContact CG1-CE 3.48Å; E82-M168 HydrophobicContact CG-SD 4.16Å; C166-M168 HydrophobicContact CB-CE 4.35Å; C166-M168 PolarHBondContact O-N 3.28Å; M168-L170 HydrophobicContact CB-CD1 4.46Å; M168-L170 HydrophobicContact CB-CD2 4.29Å; M168-L170 HydrophobicContact CB-CG 4.11Å; M168-Q178 HydrophobicContact CB-CG 4.44Å; M168-Q178 HydrophobicContact CG-CG 4.25Å
169	D	93.3	Very high	95.2	Very high	79 Å²	79	43.5 Å²	43.5	42%	0.422	21%	0.206	S	C	.	.			trans	-96.8	103.3	168.2	-174.1	-1.9	0	0	0	110	R171 Q178	D169-R171 WeakPolarHBondContact OD1-CB 3.47Å; D169-R171 VanDerWaalsContact OD1-CD 3.31Å; D169-R171 WeakPolarHBondContact OD1-CD 3.24Å; D169-R171 WeakPolarHBondContact OD1-CG 3.49Å; D169-R171 PolarHBondContact OD1-N 3.27Å; D169-R171 VanDerWaalsContact OD1-N 3.12Å; D169-R171 IonicContact OD1-NE 3.64Å; D169-Q178 PolarHBondContact O-NE2 3.12Å
170	L	93.4	Very high	95.1	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.016	19%	0.194	C	C	.	.			trans	-96.5	14.1	-173.2	-63.2	166.3	0	0	0	112.7	E82 M168 R172 Y173 D176 P305 I307 Y309	E82-L170 HydrophobicContact CB-CD1 4.26Å; E82-L170 HydrophobicContact CG-CD2 4.36Å; M168-L170 HydrophobicContact CB-CD1 4.46Å; M168-L170 HydrophobicContact CB-CD2 4.29Å; M168-L170 HydrophobicContact CB-CG 4.11Å; L170-R172 VanDerWaalsContact C-N 3.27Å; L170-R172 PolarHBondContact O-N 3.48Å; L170-Y173 HydrophobicContact CD2-CD2 3.9Å; L170-Y173 WeakPolarHBondContact O-CB 3.48Å; L170-Y173 PolarHBondContact O-N 2.86Å; L170-Y173 VanDerWaalsContact O-N 3.08Å; L170-D176 WeakPolarHBondContact CD2-OD2 3.18Å; L170-P305 HydrophobicContact CD1-CG 4.03Å; L170-I307 HydrophobicContact CB-CD1 3.96Å; L170-I307 HydrophobicContact CD1-CD1 3.26Å; L170-I307 HydrophobicContact CG-CD1 4.19Å; L170-Y309 HydrophobicContact CB-CE2 4.33Å; L170-Y309 PolarHBondContact N-OH 3.46Å; L170-Y309 VanDerWaalsContact N-OH 3.12Å
171	R	92.9	Very high	95.1	Very high	155 Å²	155	41.6 Å²	41.6	59%	0.585	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-39.5	178.1	-73.3	168.1	-175	174.3	1.9	112.5	D169 Y173 Y309 K311 A312	D169-R171 WeakPolarHBondContact OD1-CB 3.47Å; D169-R171 VanDerWaalsContact OD1-CD 3.31Å; D169-R171 WeakPolarHBondContact OD1-CD 3.24Å; D169-R171 WeakPolarHBondContact OD1-CG 3.49Å; D169-R171 PolarHBondContact OD1-N 3.27Å; D169-R171 VanDerWaalsContact OD1-N 3.12Å; D169-R171 IonicContact OD1-NE 3.64Å; R171-Y173 VanDerWaalsContact C-N 3.34Å; R171-Y309 HydrophobicContact CB-CE2 4.5Å; R171-Y309 HydrophobicContact CG-CD2 3.81Å; R171-Y309 HydrophobicContact CG-CE2 3.76Å; R171-K311 CarbonylContact O-C 3.51Å; R171-A312 PolarHBondContact O-N 3.01Å
172	R	93.8	Very high	95	Very high	110 Å²	110	41.2 Å²	41.2	42%	0.415	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	9.7	178	-69.3	-170.4	177.5	-141	0.3	113.8	L170 L175 D176 Y481 H483	L170-R172 VanDerWaalsContact C-N 3.27Å; L170-R172 PolarHBondContact O-N 3.48Å; R172-L175 CarbonylContact O-C 3.46Å; R172-L175 WeakPolarHBondContact O-CA 3.45Å; R172-L175 PolarHBondContact O-N 3.28Å; R172-D176 HydrophobicContact CB-CB 4.25Å; R172-Y481 HydrophobicContact CG-CD1 4.41Å; R172-H483 PolarHBondContact NH1-OXT 3.33Å
173	Y	93.3	Very high	95	Very high	11 Å²	11	41.9 Å²	41.9	4%	0.043	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	132	-176.8	-179.5	-88.4	0	0	0	113	L170 R171 F253 L304 I313	L170-Y173 HydrophobicContact CD2-CD2 3.9Å; L170-Y173 WeakPolarHBondContact O-CB 3.48Å; L170-Y173 PolarHBondContact O-N 2.86Å; L170-Y173 VanDerWaalsContact O-N 3.08Å; R171-Y173 VanDerWaalsContact C-N 3.34Å; Y173-F253 HydrophobicContact CE1-CE1 4.2Å; Y173-F253 HydrophobicContact CE2-CZ 4.39Å; Y173-F253 AromaticContact CZ-CE1 3.78Å; Y173-F253 AromaticContact CZ-CZ 3.8Å; Y173-F253 WeakPolarHBondContact OH-CE1 3.46Å; Y173-F253 WeakPolarHBondContact OH-CZ 3.35Å; Y173-L304 HydrophobicContact CD1-CD1 4.14Å; Y173-L304 HydrophobicContact CE1-CD1 3.63Å; Y173-L304 HydrophobicContact CE1-CD2 3.66Å; Y173-L304 HydrophobicContact CE1-CG 4.32Å; Y173-L304 HydrophobicContact CE2-CD2 4.07Å; Y173-L304 WeakPolarHBondContact OH-CD2 3.36Å; Y173-I313 HydrophobicContact CD1-CB 4.36Å; Y173-I313 HydrophobicContact CD1-CG2 3.78Å; Y173-I313 HydrophobicContact CE1-CD1 4.23Å; Y173-I313 HydrophobicContact CE1-CG2 4.3Å; Y173-I313 PolarHBondContact O-N 3.3Å; Y173-I313 VanDerWaalsContact O-N 3.09Å
174	P	94.1	Very high	95	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	cis	-97.6	19.1	2.9	39.7	-37.6	0	0	0	114.6	D176 R248 F253 Y258	P174-D176 VanDerWaalsContact C-N 3.26Å; P174-D176 WeakPolarHBondContact CA-OD1 3.32Å; P174-D176 PolarHBondContact O-N 2.8Å; P174-R248 WeakPolarHBondContact O-CD 3.46Å; P174-F253 HydrophobicContact CB-CB 4.44Å; P174-F253 HydrophobicContact CB-CD1 4.18Å; P174-F253 HydrophobicContact CB-CD2 3.47Å; P174-F253 VanDerWaalsContact CB-CD2 3.47Å; P174-F253 HydrophobicContact CB-CE1 4.37Å; P174-F253 HydrophobicContact CB-CE2 3.69Å; P174-F253 HydrophobicContact CB-CG 3.74Å; P174-F253 HydrophobicContact CB-CZ 4.13Å; P174-F253 HydrophobicContact CG-CB 3.87Å; P174-F253 HydrophobicContact CG-CD1 4.24Å; P174-F253 HydrophobicContact CG-CD2 3.85Å; P174-F253 HydrophobicContact CG-CG 3.68Å; P174-Y258 HydrophobicContact CG-CE2 4.2Å
175	L	93.4	Very high	94.9	Very high	31 Å²	31	40.6 Å²	40.6	16%	0.162	20%	0.195	C	C	.	.	S	Bend	trans	-95.6	33.9	-179.8	-66.5	160.8	0	0	0	111.2	R172 I250 W478 V482	R172-L175 CarbonylContact O-C 3.46Å; R172-L175 WeakPolarHBondContact O-CA 3.45Å; R172-L175 PolarHBondContact O-N 3.28Å; L175-I250 HydrophobicContact CD2-CD1 4.41Å; L175-I250 HydrophobicContact CD2-CG2 3.64Å; L175-I250 HydrophobicContact CG-CG2 4.49Å; L175-W478 HydrophobicContact CD1-CE3 4.45Å; L175-W478 HydrophobicContact CD1-CZ3 4.08Å; L175-W478 HydrophobicContact CD2-CZ3 4.27Å; L175-V482 HydrophobicContact CD1-CG2 4.45Å; L175-V482 HydrophobicContact CD2-CG2 4.24Å
176	D	94.1	Very high	94.9	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.027	18%	0.183	C	C	.	.			trans	-100.8	152.7	-169.5	57.1	-42.8	0	0	0	113.4	L170 R172 P174 Q178 R248	L170-D176 WeakPolarHBondContact CD2-OD2 3.18Å; R172-D176 HydrophobicContact CB-CB 4.25Å; P174-D176 VanDerWaalsContact C-N 3.26Å; P174-D176 WeakPolarHBondContact CA-OD1 3.32Å; P174-D176 PolarHBondContact O-N 2.8Å; D176-Q178 PolarHBondContact OD2-NE2 2.72Å; D176-R248 PolarHBondContact O-N 2.99Å; D176-R248 WeakPolarHBondContact OD1-CD 3.41Å; D176-R248 IonicContact OD1-CZ 2.66Å; D176-R248 IonicContact OD1-NE 2.66Å; D176-R248 PolarHBondContact OD1-NE 3.39Å; D176-R248 IonicContact OD2-NE 3.62Å; D176-R248 IonicContact OD2-NH2 3.68Å
177	E	94.6	Very high	94.9	Very high	88 Å²	88	47 Å²	47	41%	0.411	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.9	166.5	-63.5	-175.2	171.9	0	0	107.8	I221 K245 L246 K247	E177-I221 HydrophobicContact CG-CD1 4.32Å; E177-K245 WeakPolarHBondContact OE2-CE 3.34Å; E177-K245 IonicContact OE2-NZ 3.7Å; E177-K245 PolarHBondContact OE2-NZ 2.98Å; E177-L246 CarbonylContact C-O 3.5Å; E177-L246 WeakPolarHBondContact CA-O 3.17Å; E177-K247 HydrophobicContact CG-CB 4.39Å; E177-K247 HydrophobicContact CG-CG 4.35Å; E177-K247 IonicContact OE1-NZ 2.8Å
178	Q	95.5	Very high	95	Very high	6 Å²	6	41.4 Å²	41.4	3%	0.028	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	138.2	-176.6	-59.8	-58.5	-24.8	0	0	110.5	M168 D169 D176 L246	M168-Q178 HydrophobicContact CB-CG 4.44Å; M168-Q178 HydrophobicContact CG-CG 4.25Å; D169-Q178 PolarHBondContact O-NE2 3.12Å; D176-Q178 PolarHBondContact OD2-NE2 2.72Å; Q178-L246 HydrophobicContact CB-CB 4.48Å; Q178-L246 PolarHBondContact N-O 2.89Å; Q178-L246 PolarHBondContact O-N 3.17Å
179	N	95.8	Very high	95.2	Very high	101 Å²	101	43.4 Å²	43.4	54%	0.54	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	106	174.2	-72.2	-18.3	0	0	0	109.2	F244	N179-F244 WeakPolarHBondContact CA-O 3.23Å
180	C	96.5	Very high	95.4	Very high	1 Å²	1	41 Å²	41	1%	0.007	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.7	178	-67.4	0	0	0	0	110.5	Y87 C166 S243 F244 L246	Y87-C180 HydrophobicContact CD1-CB 3.89Å; Y87-C180 HydrophobicContact CE1-CB 3.67Å; C166-C180 HydrophobicContact CB-CB 3.78Å; C166-C180 WeakPolarHBondContact CB-SG 3.32Å; C166-C180 WeakPolarHBondContact SG-CA 3.35Å; C166-C180 WeakPolarHBondContact SG-CB 3.37Å; C166-C180 CovalentContact SG-SG 2.05Å; C166-C180 PolarHBondContact SG-SG 2.8Å; C180-S243 WeakPolarHBondContact O-CA 3.37Å; C180-F244 PolarHBondContact N-O 3.36Å; C180-F244 PolarHBondContact O-N 2.8Å; C180-L246 HydrophobicContact CB-CD1 4.38Å
181	T	96.1	Very high	95.5	Very high	39 Å²	39	41.5 Å²	41.5	24%	0.239	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	142.7	-174.6	56.1	0	0	0	0	111.9	Y87 N130 L242	Y87-T181 PolarHBondContact OH-O 2.84Å; Y87-T181 VanDerWaalsContact OH-O 3.12Å; N130-T181 PolarHBondContact ND2-O 3.48Å; N130-T181 PolarHBondContact ND2-OG1 2.95Å; T181-L242 CarbonylContact C-O 3.56Å; T181-L242 VanDerWaalsContact CA-O 3.31Å; T181-L242 WeakPolarHBondContact CA-O 3.4Å
182	L	96.7	Very high	95.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	108.2	165.9	-175.3	67.2	0	0	0	108.1	Y87 M91 F128 T162 A164 S241 L242	Y87-L182 PolarHBondContact OH-N 3.09Å; M91-L182 HydrophobicContact CE-CD2 3.75Å; M91-L182 HydrophobicContact SD-CD2 3.86Å; F128-L182 HydrophobicContact CB-CD1 4.33Å; F128-L182 HydrophobicContact CD1-CD1 3.72Å; F128-L182 HydrophobicContact CD1-CD2 4.38Å; F128-L182 HydrophobicContact CD1-CG 4.03Å; F128-L182 HydrophobicContact CE1-CD1 4.32Å; F128-L182 HydrophobicContact CE1-CD2 4.23Å; F128-L182 HydrophobicContact CE1-CG 4.37Å; F128-L182 HydrophobicContact CG-CD1 4.16Å; T162-L182 HydrophobicContact CG2-CD1 4.26Å; A164-L182 HydrophobicContact CB-CD1 4.19Å; L182-S241 WeakPolarHBondContact O-CA 3.34Å; L182-L242 HydrophobicContact CB-CB 4.34Å; L182-L242 PolarHBondContact N-O 2.92Å; L182-L242 PolarHBondContact O-N 2.81Å
183	E	96.3	Very high	95.8	Very high	15 Å²	15	36.9 Å²	36.9	7%	0.07	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.8	-177.8	-63.1	-71.7	160.2	0	0	109.6	F128 I129 K228 R239 S241	F128-E183 CarbonylContact C-O 3.49Å; F128-E183 VanDerWaalsContact CA-O 3.23Å; F128-E183 WeakPolarHBondContact CA-O 3.48Å; I129-E183 HydrophobicContact CB-CB 4.01Å; I129-E183 HydrophobicContact CD1-CB 4.04Å; I129-E183 HydrophobicContact CG1-CB 4.22Å; I129-E183 PolarHBondContact N-O 3.42Å; E183-K228 IonicContact OE1-NZ 2.75Å; E183-K228 PolarHBondContact OE1-NZ 2.73Å; E183-K228 WeakPolarHBondContact OE2-CE 3.27Å; E183-K228 IonicContact OE2-NZ 3.01Å; E183-K228 PolarHBondContact OE2-NZ 3.49Å; E183-R239 VanDerWaalsContact OE2-CD 3.22Å; E183-R239 WeakPolarHBondContact OE2-CD 3.12Å; E183-S241 VanDerWaalsContact CD-OG 3.28Å; E183-S241 VanDerWaalsContact OE1-CB 3.23Å; E183-S241 WeakPolarHBondContact OE1-CB 3.25Å; E183-S241 PolarHBondContact OE1-OG 2.87Å; E183-S241 WeakPolarHBondContact OE2-CB 3.46Å
184	I	97.2	Very high	96	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.1	-175.7	-48.4	167.7	0	0	0	108.3	M70 I72 F93 F128 W198 R239 L240	M70-I184 HydrophobicContact CE-CG2 3.86Å; M70-I184 HydrophobicContact SD-CB 4.37Å; M70-I184 HydrophobicContact SD-CD1 4.25Å; M70-I184 HydrophobicContact SD-CG2 3.63Å; I72-I184 HydrophobicContact CD1-CD1 3.84Å; F93-I184 HydrophobicContact CE2-CD1 4.04Å; F93-I184 HydrophobicContact CZ-CD1 4.5Å; F93-I184 HydrophobicContact CZ-CG2 4.01Å; F128-I184 HydrophobicContact CD1-CB 4.49Å; F128-I184 HydrophobicContact CD1-CG1 3.78Å; F128-I184 HydrophobicContact CE1-CD1 4.28Å; F128-I184 HydrophobicContact CE1-CG1 3.8Å; F128-I184 HydrophobicContact CE1-CG2 4.46Å; I184-W198 HydrophobicContact CD1-CH2 4.01Å; I184-R239 CarbonylContact O-C 3.6Å; I184-R239 VanDerWaalsContact O-CA 3.28Å; I184-R239 WeakPolarHBondContact O-CA 3.08Å; I184-L240 HydrophobicContact CB-CB 4.37Å; I184-L240 PolarHBondContact N-O 2.67Å; I184-L240 PolarHBondContact O-N 3.12Å
185	E	97.3	Very high	96.1	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	156.7	-173.9	-177.3	165.4	-112.5	0	0	111.2	T126 Y127 I129 A230 R239	T126-E185 CarbonylContact C-O 3.52Å; T126-E185 WeakPolarHBondContact CA-O 2.89Å; Y127-E185 HydrophobicContact CD1-CB 4.37Å; Y127-E185 WeakPolarHBondContact CD1-O 3.02Å; Y127-E185 HydrophobicContact CE1-CB 3.74Å; Y127-E185 HydrophobicContact CE1-CG 3.85Å; Y127-E185 PolarHBondContact N-O 2.8Å; Y127-E185 PolarHBondContact O-N 3.48Å; Y127-E185 PolarHBondContact OH-OE2 2.88Å; I129-E185 HydrophobicContact CD1-CB 3.99Å; I129-E185 WeakPolarHBondContact CD1-OE2 3.49Å; I129-E185 HydrophobicContact CG1-CB 4.11Å; E185-A230 WeakPolarHBondContact OE1-CB 3.34Å; E185-R239 HydrophobicContact CB-CG 4.4Å; E185-R239 VanDerWaalsContact CD-NH2 3.27Å; E185-R239 IonicContact OE1-CZ 3.67Å; E185-R239 VanDerWaalsContact OE1-CZ 3.24Å; E185-R239 IonicContact OE1-NE 3.24Å; E185-R239 PolarHBondContact OE1-NE 3.47Å; E185-R239 IonicContact OE1-NH2 2.93Å; E185-R239 PolarHBondContact OE1-NH2 3.48Å; E185-R239 IonicContact OE2-CZ 2.73Å; E185-R239 IonicContact OE2-NE 3.75Å; E185-R239 IonicContact OE2-NH2 3.36Å; E185-R239 PolarHBondContact OE2-NH2 3.12Å
186	S	97	Very high	96.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	137.9	169.7	174.2	0	0	0	0	109.4	D125 Y189 Y237	D125-S186 PolarHBondContact OD1-OG 3.16Å; S186-Y189 PolarHBondContact OG-N 2.82Å; S186-Y189 PolarHBondContact OG-O 3.19Å; S186-Y237 VanDerWaalsContact O-CD1 3.27Å; S186-Y237 WeakPolarHBondContact O-CD1 3.31Å
187	Y	96	Very high	96.2	Very high	168 Å²	168	43.2 Å²	43.2	66%	0.659	22%	0.217	S	C	*	.	S	Bend	trans	-81.1	-52.7	-175.9	-171.6	-100.2	0	0	0	112.9	D125 Y127 Y237	D125-Y187 PolarHBondContact O-N 3.19Å; Y127-Y187 HydrophobicContact CD1-CD2 4.06Å; Y127-Y187 HydrophobicContact CD1-CG 4.4Å; Y127-Y187 AromaticContact CE1-CD2 3.96Å; Y127-Y187 HydrophobicContact CE1-CD2 3.96Å; Y127-Y187 HydrophobicContact CE1-CG 4.49Å; Y127-Y187 HydrophobicContact CE2-CD2 4.47Å; Y127-Y187 HydrophobicContact CG-CD2 4.39Å; Y187-Y237 VanDerWaalsContact O-CE1 3.28Å; Y187-Y237 WeakPolarHBondContact O-CE1 3.41Å
188	G	95.2	Very high	96.2	Very high	44 Å²	44	39.8 Å²	39.8	45%	0.454	20%	0.2	S	C	.	.	S	Bend	trans	-98.8	-32.8	-173.7	0	0	0	0	0	114.3	D125	D125-G188 WeakPolarHBondContact OD2-CA 3.34Å; D125-G188 PolarHBondContact OD2-N 2.81Å
189	Y	96.8	Very high	95.8	Very high	54 Å²	54	42.7 Å²	42.7	21%	0.212	21%	0.213	C	C	.	.			trans	-90.4	127.1	-174.3	-62	-74.7	0	0	0	111.6	R58 W122 D125 S186 D193 Y237	R58-Y189 HydrophobicContact CB-CE1 4.24Å; W122-Y189 HydrophobicContact CZ2-CE2 4.02Å; W122-Y189 AromaticContact NE1-CE2 4Å; W122-Y189 AromaticContact NE1-CZ 3.77Å; W122-Y189 PolarHBondContact NE1-OH 2.82Å; W122-Y189 VanDerWaalsContact NE1-OH 3.14Å; D125-Y189 WeakPolarHBondContact OD1-CD2 3.25Å; S186-Y189 PolarHBondContact OG-N 2.82Å; S186-Y189 PolarHBondContact OG-O 3.19Å; Y189-D193 HydrophobicContact CD1-CB 3.75Å; Y189-D193 HydrophobicContact CG-CB 4.23Å; Y189-Y237 VanDerWaalsContact O-CD1 3.22Å; Y189-Y237 WeakPolarHBondContact O-CD1 3.15Å
190	T	97.1	Very high	94.8	Very high	27 Å²	27	40.6 Å²	40.6	17%	0.166	22%	0.216	C	C	.	.			trans	-79.4	175.6	175.8	66.2	0	0	0	0	111.1	D192 D193 I194 S236 Y237	T190-D192 PolarHBondContact O-N 3.26Å; T190-D193 PolarHBondContact O-N 3.33Å; T190-I194 PolarHBondContact O-N 2.76Å; T190-S236 CarbonylContact C-O 3.55Å; T190-S236 WeakPolarHBondContact CA-O 3.44Å; T190-S236 WeakPolarHBondContact CB-O 3.46Å; T190-Y237 HydrophobicContact CG2-CE1 4.24Å
191	T	96.2	Very high	93.5	Very high	15 Å²	15	42.4 Å²	42.4	9%	0.092	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.1	175.9	50.5	0	0	0	0	114.2	D193 I194 K229 S236 P238	T191-D193 VanDerWaalsContact C-N 3.31Å; T191-I194 WeakPolarHBondContact CA-O 3.48Å; T191-K229 HydrophobicContact CG2-CD 4.01Å; T191-K229 HydrophobicContact CG2-CG 4.16Å; T191-S236 WeakPolarHBondContact CG2-OG 3.36Å; T191-S236 PolarHBondContact N-O 3.48Å; T191-S236 PolarHBondContact OG1-OG 2.89Å; T191-P238 HydrophobicContact CG2-CB 4.26Å
192	D	95.8	Very high	91.7	Very high	121 Å²	121	45 Å²	45	65%	0.647	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-19.1	176.7	-59.7	-21.5	0	0	0	112	T190	T190-D192 PolarHBondContact O-N 3.26Å
193	D	96.6	Very high	89.7	Confident	47 Å²	47	50.9 Å²	50.9	25%	0.251	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-34	-177.8	-73.6	-47.5	0	0	0	113.4	R58 P65 V66 Y189 T190 T191	R58-D193 IonicContact CZ-OD1 3.48Å; R58-D193 VanDerWaalsContact CZ-OD1 3.22Å; R58-D193 IonicContact NE-OD1 3.7Å; R58-D193 PolarHBondContact NE-OD1 2.78Å; R58-D193 IonicContact NH2-OD1 2.89Å; R58-D193 PolarHBondContact NH2-OD1 2.73Å; P65-D193 WeakPolarHBondContact CA-O 3.34Å; V66-D193 PolarHBondContact N-O 3.29Å; Y189-D193 HydrophobicContact CD1-CB 3.75Å; Y189-D193 HydrophobicContact CG-CB 4.23Å; T190-D193 PolarHBondContact O-N 3.33Å; T191-D193 VanDerWaalsContact C-N 3.31Å
194	I	97.2	Very high	87.9	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	140	-176.1	-161.6	162.6	0	0	0	110.6	V66 V68 W122 P124 T190 T191 F196 P238	V66-I194 HydrophobicContact CG1-CB 4.16Å; V66-I194 HydrophobicContact CG1-CD1 4.09Å; V66-I194 HydrophobicContact CG1-CG1 3.73Å; V66-I194 WeakPolarHBondContact O-CA 3.46Å; V66-I194 WeakPolarHBondContact O-CG1 3.43Å; V68-I194 HydrophobicContact CG2-CD1 3.74Å; V68-I194 HydrophobicContact CG2-CG1 3.8Å; W122-I194 HydrophobicContact CH2-CD1 4.25Å; P124-I194 HydrophobicContact CB-CD1 4.08Å; T190-I194 PolarHBondContact O-N 2.76Å; T191-I194 WeakPolarHBondContact CA-O 3.48Å; I194-F196 HydrophobicContact CD1-CE1 3.61Å; I194-F196 HydrophobicContact CD1-CZ 4.26Å; I194-F196 HydrophobicContact CG1-CD1 4.21Å; I194-F196 HydrophobicContact CG1-CE1 3.74Å; I194-F196 HydrophobicContact CG2-CE1 4.5Å; I194-P238 HydrophobicContact CG2-CG 3.83Å; I194-P238 WeakPolarHBondContact O-CG 3.31Å
195	E	96.5	Very high	86.5	Confident	69 Å²	69	55.2 Å²	55.2	32%	0.322	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	140.5	170.9	-69	-152.8	136.8	0	0	110.7	P65 V66 V68 K229	P65-E195 HydrophobicContact CB-CG 4.2Å; P65-E195 HydrophobicContact CG-CG 4.2Å; V66-E195 PolarHBondContact O-N 2.8Å; V68-E195 PolarHBondContact N-O 2.05Å; E195-K229 IonicContact OE1-NZ 3.56Å; E195-K229 PolarHBondContact OE1-NZ 2.91Å; E195-K229 VanDerWaalsContact OE1-NZ 3.13Å
196	F	96.2	Very high	85.8	Confident	11 Å²	11	55.2 Å²	55.2	5%	0.048	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138.1	-179.5	-66.9	-18.5	0	0	0	111.8	V68 M70 T126 I194 P238 L240	V68-F196 HydrophobicContact CB-CD1 3.87Å; V68-F196 HydrophobicContact CB-CE1 4Å; V68-F196 HydrophobicContact CG1-CE1 4.46Å; V68-F196 HydrophobicContact CG2-CE1 4.3Å; M70-F196 HydrophobicContact CE-CB 4.42Å; M70-F196 HydrophobicContact CE-CD1 3.66Å; M70-F196 HydrophobicContact CE-CD2 3.55Å; M70-F196 HydrophobicContact CE-CE1 3.6Å; M70-F196 HydrophobicContact CE-CE2 3.48Å; M70-F196 VanDerWaalsContact CE-CE2 3.48Å; M70-F196 HydrophobicContact CE-CG 3.64Å; M70-F196 HydrophobicContact CE-CZ 3.52Å; T126-F196 HydrophobicContact CG2-CE1 4.18Å; T126-F196 HydrophobicContact CG2-CE2 4.27Å; T126-F196 HydrophobicContact CG2-CZ 3.59Å; I194-F196 HydrophobicContact CD1-CE1 3.61Å; I194-F196 HydrophobicContact CD1-CZ 4.26Å; I194-F196 HydrophobicContact CG1-CD1 4.21Å; I194-F196 HydrophobicContact CG1-CE1 3.74Å; I194-F196 HydrophobicContact CG2-CE1 4.5Å; F196-P238 HydrophobicContact CB-CB 4.14Å; F196-P238 HydrophobicContact CD1-CG 4.44Å; F196-P238 HydrophobicContact CD2-CB 4.07Å; F196-P238 HydrophobicContact CD2-CG 3.96Å; F196-P238 WeakPolarHBondContact CD2-O 3.48Å; F196-P238 HydrophobicContact CE2-CG 4.24Å; F196-P238 HydrophobicContact CG-CB 4.08Å; F196-P238 HydrophobicContact CG-CG 4.08Å; F196-L240 HydrophobicContact CB-CD1 4Å; F196-L240 HydrophobicContact CB-CD2 4.05Å; F196-L240 HydrophobicContact CB-CG 3.77Å
197	Y	94.3	Very high	85.5	Confident	100 Å²	100	55.3 Å²	55.3	39%	0.392	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	155	173.9	67.2	-84.7	0	0	0	111.5	D67 V68 G69 M70	D67-Y197 HydrophobicContact CB-CD1 4.45Å; D67-Y197 HydrophobicContact CB-CE1 3.88Å; V68-Y197 VanDerWaalsContact C-CE1 3.46Å; V68-Y197 PolarHBondContact O-N 2.94Å; G69-Y197 VanDerWaalsContact CA-CE1 3.46Å; G69-Y197 WeakPolarHBondContact CA-O 3.08Å; M70-Y197 PolarHBondContact N-O 2.87Å
198	W	93.3	Very high	85.2	Confident	16 Å²	16	49.3 Å²	49.3	6%	0.061	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	119.5	173.5	-69.7	109.4	0	0	0	110	M70 I72 I184 G200 G201 V207 T225 L226 L240 L242	M70-W198 HydrophobicContact CB-CE3 4.47Å; I72-W198 HydrophobicContact CD1-CH2 3.66Å; I72-W198 HydrophobicContact CD1-CZ3 3.67Å; I72-W198 HydrophobicContact CG1-CZ3 4.06Å; I184-W198 HydrophobicContact CD1-CH2 4.01Å; W198-G200 PolarHBondContact O-N 2.75Å; W198-G200 VanDerWaalsContact O-N 3.12Å; W198-G201 PolarHBondContact O-N 2.57Å; W198-V207 HydrophobicContact CE3-CG2 4.42Å; W198-V207 HydrophobicContact CH2-CG2 4.47Å; W198-V207 HydrophobicContact CZ3-CG2 4.04Å; W198-T225 HydrophobicContact CD2-CG2 4.35Å; W198-T225 HydrophobicContact CZ2-CG2 4.34Å; W198-L226 PolarHBondContact NE1-O 3.21Å; W198-L226 VanDerWaalsContact NE1-O 3.16Å; W198-L240 HydrophobicContact CD2-CD1 3.96Å; W198-L240 HydrophobicContact CE3-CD1 4.36Å; W198-L240 HydrophobicContact CG-CD1 4.31Å; W198-L240 HydrophobicContact CH2-CB 4.42Å; W198-L240 HydrophobicContact CZ2-CB 3.67Å; W198-L240 HydrophobicContact CZ2-CD1 4.24Å; W198-L242 HydrophobicContact CH2-CB 4.21Å; W198-L242 HydrophobicContact CZ2-CB 4.36Å
199	Q	86.8	Confident	84.9	Confident	66 Å²	66	48.1 Å²	48.1	31%	0.308	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	108.1	179.9	-166.3	172.4	26	0	0	109.3	M70 R71 S206	M70-Q199 PolarHBondContact O-N 2.84Å; R71-Q199 HydrophobicContact CB-CB 4.4Å; Q199-S206 VanDerWaalsContact O-CA 3.24Å; Q199-S206 WeakPolarHBondContact O-CA 3.06Å; Q199-S206 VanDerWaalsContact O-CB 3.28Å; Q199-S206 WeakPolarHBondContact O-CB 3.34Å
200	G	76.6	Confident	84.4	Confident	58 Å²	58	46.1 Å²	46.1	60%	0.598	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.2	2.3	-170.8	0	0	0	0	0	114.8	W198	W198-G200 PolarHBondContact O-N 2.75Å; W198-G200 VanDerWaalsContact O-N 3.12Å
201	G	68.6	Low	83.8	Confident	39 Å²	39	53.8 Å²	53.8	40%	0.402	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	-167	179.1	0	0	0	0	0	113.5	W198 N203 S206	W198-G201 PolarHBondContact O-N 2.57Å; G201-N203 PolarHBondContact O-N 3.32Å; G201-S206 PolarHBondContact O-OG 3.45Å
202	S	57.5	Low	83.3	Confident	92 Å²	92	59.8 Å²	59.8	64%	0.643	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-7.1	177.5	53.7	0	0	0	0	114
203	N	55.8	Low	83	Confident	124 Å²	124	55.1 Å²	55.1	66%	0.663	33%	0.331	S	S	*	.	S	Bend	trans	-97	162.7	-179	-62.5	-7.3	0	0	0	110.7	G201 G205	G201-N203 PolarHBondContact O-N 3.32Å; N203-G205 PolarHBondContact O-N 3.16Å
204	A	57.4	Low	82.4	Confident	71 Å²	71	61.9 Å²	61.9	59%	0.587	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	8.8	-166.6	0	0	0	0	0	120.4
205	G	68.8	Low	82	Confident	36 Å²	36	62.7 Å²	62.7	37%	0.371	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-24	176.6	0	0	0	0	0	115	N203	N203-G205 PolarHBondContact O-N 3.16Å
206	S	82.3	Confident	81.6	Confident	1 Å²	1	65 Å²	65	1%	0.007	39%	0.386	C	S	.	.	S	Bend	trans	-83.8	-28.7	-173.5	57.6	0	0	0	0	114	R71 I72 Q199 G201	R71-S206 WeakPolarHBondContact CA-O 3.46Å; R71-S206 WeakPolarHBondContact CG-O 3.23Å; I72-S206 PolarHBondContact N-O 2.82Å; Q199-S206 VanDerWaalsContact O-CA 3.24Å; Q199-S206 WeakPolarHBondContact O-CA 3.06Å; Q199-S206 VanDerWaalsContact O-CB 3.28Å; Q199-S206 WeakPolarHBondContact O-CB 3.34Å; G201-S206 PolarHBondContact O-OG 3.45Å
207	V	89.7	Confident	81.2	Confident	2 Å²	2	68.6 Å²	68.6	1%	0.012	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	117.3	175.8	-175.7	0	0	0	0	108.9	I72 I74 W198 V210 Y223 T225 L242	I72-V207 HydrophobicContact CB-CG2 4.39Å; I72-V207 CarbonylContact O-C 3.44Å; I72-V207 VanDerWaalsContact O-CA 3.26Å; I72-V207 WeakPolarHBondContact O-CA 3.24Å; I74-V207 HydrophobicContact CD1-CG1 3.87Å; I74-V207 HydrophobicContact CG1-CG1 4.31Å; W198-V207 HydrophobicContact CE3-CG2 4.42Å; W198-V207 HydrophobicContact CH2-CG2 4.47Å; W198-V207 HydrophobicContact CZ3-CG2 4.04Å; V207-V210 HydrophobicContact CG1-CG2 3.91Å; V207-Y223 HydrophobicContact CB-CD2 4.47Å; V207-Y223 HydrophobicContact CB-CE2 3.99Å; V207-Y223 HydrophobicContact CG1-CE2 4.41Å; V207-T225 HydrophobicContact CG2-CG2 3.71Å; V207-L242 HydrophobicContact CG1-CD1 4.34Å; V207-L242 HydrophobicContact CG1-CD2 4.06Å; V207-L242 HydrophobicContact CG2-CD1 4.11Å; V207-L242 HydrophobicContact CG2-CD2 4.23Å
208	T	91.1	Very high	81.2	Confident	41 Å²	41	64.2 Å²	64.2	25%	0.252	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	166.6	179.3	56.5	0	0	0	0	111.5	I72 D73 I74 V210	I72-T208 PolarHBondContact O-N 2.99Å; D73-T208 WeakPolarHBondContact CB-OG1 3.48Å; D73-T208 VanDerWaalsContact CG-OG1 3.28Å; D73-T208 VanDerWaalsContact OD1-C 3.31Å; D73-T208 WeakPolarHBondContact OD1-CB 3.14Å; D73-T208 PolarHBondContact OD1-OG1 3.05Å; I74-T208 PolarHBondContact N-O 3.3Å; T208-V210 VanDerWaalsContact C-N 3.34Å; T208-V210 PolarHBondContact O-N 3.44Å
209	G	87.6	Confident	81.1	Confident	19 Å²	19	65.6 Å²	65.6	20%	0.196	40%	0.398	C	S	.	.	S	Bend	trans	88.8	-12.5	176.7	0	0	0	0	0	115.2	E211 N212 I213	G209-E211 VanDerWaalsContact C-N 3.32Å; G209-E211 PolarHBondContact O-N 3Å; G209-N212 PolarHBondContact O-N 3.34Å; G209-N212 VanDerWaalsContact O-N 3.17Å; G209-I213 WeakPolarHBondContact O-CG1 3.42Å
210	V	87.9	Confident	81.4	Confident	13 Å²	13	64.2 Å²	64.2	8%	0.079	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-56.4	-41.6	-177.4	-175.6	0	0	0	0	112.9	I74 V207 T208 N212 I213 I220 Y223 F244	I74-V210 HydrophobicContact CD1-CG2 3.72Å; V207-V210 HydrophobicContact CG1-CG2 3.91Å; T208-V210 VanDerWaalsContact C-N 3.34Å; T208-V210 PolarHBondContact O-N 3.44Å; V210-N212 PolarHBondContact O-N 2.79Å; V210-I213 PolarHBondContact O-N 2.91Å; V210-I220 HydrophobicContact CG1-CD1 4.14Å; V210-I220 HydrophobicContact CG1-CG2 3.95Å; V210-Y223 HydrophobicContact CB-CD1 4.13Å; V210-Y223 HydrophobicContact CB-CE1 4.17Å; V210-Y223 HydrophobicContact CG1-CD1 3.8Å; V210-Y223 HydrophobicContact CG1-CE1 4.3Å; V210-Y223 HydrophobicContact CG1-CG 4.5Å; V210-Y223 HydrophobicContact CG2-CD1 3.92Å; V210-Y223 HydrophobicContact CG2-CE1 4.02Å; V210-Y223 HydrophobicContact CG2-CG 4.21Å; V210-F244 HydrophobicContact CG2-CE1 4.45Å
211	E	83.7	Confident	82.2	Confident	188 Å²	188	65.3 Å²	65.3	88%	0.879	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-66.9	-23.5	-176.6	-63.2	178.8	-175.8	0	0	113.5	G209 I213	G209-E211 VanDerWaalsContact C-N 3.32Å; G209-E211 PolarHBondContact O-N 3Å; E211-I213 VanDerWaalsContact C-N 3.33Å
212	N	85.4	Confident	83.2	Confident	140 Å²	140	67 Å²	67	75%	0.749	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-90.6	2.2	-178.5	-62.3	-38.4	0	0	0	112.7	G209 V210 E214	G209-N212 PolarHBondContact O-N 3.34Å; G209-N212 VanDerWaalsContact O-N 3.17Å; V210-N212 PolarHBondContact O-N 2.79Å; N212-E214 PolarHBondContact O-N 2.96Å
213	I	89.4	Confident	84.9	Confident	23 Å²	23	65.2 Å²	65.2	12%	0.118	36%	0.363	C	S	.	.			trans	-88.9	111.7	-175.6	-57.3	171.9	0	0	0	109.4	I74 I77 G209 V210 E211 L215 I220	I74-I213 HydrophobicContact CB-CD1 3.98Å; I74-I213 HydrophobicContact CD1-CD1 4.43Å; I74-I213 HydrophobicContact CG2-CD1 3.4Å; I74-I213 VanDerWaalsContact CG2-CD1 3.4Å; I74-I213 HydrophobicContact CG2-CG1 4.44Å; I77-I213 HydrophobicContact CB-CG2 4.26Å; I77-I213 HydrophobicContact CD1-CD1 4.31Å; I77-I213 HydrophobicContact CD1-CG2 4.47Å; I77-I213 HydrophobicContact CG1-CD1 4.29Å; I77-I213 HydrophobicContact CG1-CG2 4.36Å; G209-I213 WeakPolarHBondContact O-CG1 3.42Å; V210-I213 PolarHBondContact O-N 2.91Å; E211-I213 VanDerWaalsContact C-N 3.33Å; I213-L215 HydrophobicContact CG2-CG 4.18Å; I213-I220 HydrophobicContact CB-CD1 3.94Å; I213-I220 HydrophobicContact CD1-CD1 4.11Å; I213-I220 HydrophobicContact CG2-CD1 3.98Å
214	E	84	Confident	86.6	Confident	189 Å²	189	64.6 Å²	64.6	88%	0.883	36%	0.356	S	S	*	.			trans	-99.5	116	170.5	-67.1	-176.4	177.6	0	0	110	N212	N212-E214 PolarHBondContact O-N 2.96Å
215	L	89.3	Confident	88.2	Confident	19 Å²	19	62.2 Å²	62.2	10%	0.099	33%	0.334	C	S	.	.			trans	-101.8	135.6	172.9	-75.2	168	0	0	0	109.3	I77 I213 Q217 F218 I220 L246	I77-L215 HydrophobicContact CB-CD1 4.42Å; I77-L215 HydrophobicContact CB-CD2 3.93Å; I77-L215 HydrophobicContact CD1-CD1 4.48Å; I77-L215 HydrophobicContact CG2-CD1 4.31Å; I77-L215 HydrophobicContact CG2-CD2 3.86Å; I77-L215 VanDerWaalsContact O-CD2 3.25Å; I77-L215 WeakPolarHBondContact O-CD2 3.26Å; I213-L215 HydrophobicContact CG2-CG 4.18Å; L215-Q217 PolarHBondContact O-N 2.96Å; L215-F218 HydrophobicContact CB-CB 4.15Å; L215-F218 VanDerWaalsContact CB-O 3.23Å; L215-F218 WeakPolarHBondContact CB-O 3.36Å; L215-F218 HydrophobicContact CD1-CB 4.04Å; L215-I220 HydrophobicContact CD1-CG1 4.22Å; L215-L246 HydrophobicContact CD1-CD2 4.27Å
216	P	87.5	Confident	89.3	Confident	118 Å²	118	64.8 Å²	64.8	77%	0.766	34%	0.339	S	S	*	.	S	Bend	trans	-69.8	-34.6	-176.5	25.2	-33.4	0	0	0	113
217	Q	89.1	Confident	89.8	Confident	86 Å²	86	68.5 Å²	68.5	40%	0.402	37%	0.365	S	S	.	.	S	Bend	trans	-106.8	-14.8	-175	-69.4	-177.3	-33.5	0	0	113.9	L215 N249	L215-Q217 PolarHBondContact O-N 2.96Å; Q217-N249 PolarHBondContact O-N 2.88Å
218	F	92.8	Very high	89.9	Confident	7 Å²	7	72.2 Å²	72.2	3%	0.031	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	159.7	-175.1	-67	-90.2	0	0	0	110.6	V80 E82 L215 L246 K247 R248	V80-F218 HydrophobicContact CB-CD2 4.06Å; V80-F218 HydrophobicContact CB-CE2 3.7Å; V80-F218 HydrophobicContact CB-CZ 4.35Å; V80-F218 HydrophobicContact CG1-CD2 4.35Å; V80-F218 HydrophobicContact CG1-CE2 3.72Å; V80-F218 HydrophobicContact CG1-CZ 3.85Å; V80-F218 HydrophobicContact CG2-CD2 4.26Å; V80-F218 HydrophobicContact CG2-CE2 4.37Å; E82-F218 WeakPolarHBondContact OE1-CZ 3.44Å; L215-F218 HydrophobicContact CB-CB 4.15Å; L215-F218 VanDerWaalsContact CB-O 3.23Å; L215-F218 WeakPolarHBondContact CB-O 3.36Å; L215-F218 HydrophobicContact CD1-CB 4.04Å; F218-L246 HydrophobicContact CD1-CB 4.11Å; F218-K247 CarbonylContact C-O 3.54Å; F218-K247 VanDerWaalsContact CA-O 3.3Å; F218-K247 WeakPolarHBondContact CA-O 3.36Å; F218-R248 HydrophobicContact CD1-CB 4.21Å; F218-R248 HydrophobicContact CE1-CB 4.15Å; F218-R248 HydrophobicContact CE1-CG 4.4Å; F218-R248 VanDerWaalsContact CZ-NH2 3.28Å
219	S	92.6	Very high	90	Very high	45 Å²	45	76.4 Å²	76.4	32%	0.315	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	137.4	167.1	48.8	0	0	0	0	108.3	I221 K247 N249	S219-I221 PolarHBondContact O-N 2.93Å; S219-K247 PolarHBondContact N-O 3.27Å; S219-K247 PolarHBondContact O-N 3.07Å; S219-K247 PolarHBondContact OG-O 3.06Å; S219-N249 PolarHBondContact OG-OD1 3.46Å
220	I	93.3	Very high	90.3	Very high	38 Å²	38	76.1 Å²	76.1	20%	0.195	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	115.1	174.3	-52.2	177.3	0	0	0	106.6	I77 V210 I213 L215 L246	I77-I220 HydrophobicContact CD1-CD1 4.03Å; V210-I220 HydrophobicContact CG1-CD1 4.14Å; V210-I220 HydrophobicContact CG1-CG2 3.95Å; I213-I220 HydrophobicContact CB-CD1 3.94Å; I213-I220 HydrophobicContact CD1-CD1 4.11Å; I213-I220 HydrophobicContact CG2-CD1 3.98Å; L215-I220 HydrophobicContact CD1-CG1 4.22Å; I220-L246 HydrophobicContact CB-CD2 4.49Å; I220-L246 HydrophobicContact CG1-CD2 3.79Å
221	I	92	Very high	90.7	Very high	81 Å²	81	81.3 Å²	81.3	42%	0.415	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-48.7	177.3	-58.8	163.5	0	0	0	109.9	E177 S219 K245 K247	E177-I221 HydrophobicContact CG-CD1 4.32Å; S219-I221 PolarHBondContact O-N 2.93Å; I221-K245 HydrophobicContact CB-CB 4.49Å; I221-K245 HydrophobicContact CB-CD 4.46Å; I221-K245 HydrophobicContact CB-CG 4.4Å; I221-K245 HydrophobicContact CD1-CD 4.07Å; I221-K245 HydrophobicContact CD1-CG 4Å; I221-K245 PolarHBondContact N-O 3.19Å; I221-K247 HydrophobicContact CD1-CB 3.53Å; I221-K247 HydrophobicContact CD1-CD 3.98Å; I221-K247 HydrophobicContact CD1-CG 4.35Å; I221-K247 HydrophobicContact CG1-CB 3.69Å; I221-K247 HydrophobicContact CG1-CD 4.32Å
222	D	91.3	Very high	91.2	Very high	75 Å²	75	77.1 Å²	77.1	40%	0.401	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	161.2	-170.8	-167.8	20.3	0	0	0	110	K245	D222-K245 HydrophobicContact CB-CB 4.4Å; D222-K245 WeakPolarHBondContact O-CB 3.27Å; D222-K245 PolarHBondContact O-N 3.08Å
223	Y	91.6	Very high	91.7	Very high	54 Å²	54	76.1 Å²	76.1	21%	0.212	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.6	170.9	71.3	-84	0	0	0	110.6	V207 V210 L242 S243	V207-Y223 HydrophobicContact CB-CD2 4.47Å; V207-Y223 HydrophobicContact CB-CE2 3.99Å; V207-Y223 HydrophobicContact CG1-CE2 4.41Å; V210-Y223 HydrophobicContact CB-CD1 4.13Å; V210-Y223 HydrophobicContact CB-CE1 4.17Å; V210-Y223 HydrophobicContact CG1-CD1 3.8Å; V210-Y223 HydrophobicContact CG1-CE1 4.3Å; V210-Y223 HydrophobicContact CG1-CG 4.5Å; V210-Y223 HydrophobicContact CG2-CD1 3.92Å; V210-Y223 HydrophobicContact CG2-CE1 4.02Å; V210-Y223 HydrophobicContact CG2-CG 4.21Å; Y223-L242 HydrophobicContact CD2-CD1 4.04Å; Y223-S243 CarbonylContact C-O 3.59Å; Y223-S243 WeakPolarHBondContact CA-O 3.39Å
224	Q	91.1	Very high	91.9	Very high	111 Å²	111	80.2 Å²	80.2	52%	0.519	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	139	-178.6	-63.8	-176.7	1.2	0	0	110.3	S243	Q224-S243 PolarHBondContact N-O 3.32Å; Q224-S243 PolarHBondContact O-N 2.89Å
225	T	91.9	Very high	92.5	Very high	20 Å²	20	72.3 Å²	72.3	12%	0.123	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.9	174	58.3	0	0	0	0	109	W198 V207 S241 L242	W198-T225 HydrophobicContact CD2-CG2 4.35Å; W198-T225 HydrophobicContact CZ2-CG2 4.34Å; V207-T225 HydrophobicContact CG2-CG2 3.71Å; T225-S241 WeakPolarHBondContact CA-O 3.49Å; T225-L242 HydrophobicContact CG2-CD1 4.07Å
226	L	91.6	Very high	92.8	Very high	90 Å²	90	73 Å²	73	47%	0.471	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	146.1	179.6	-65.6	168	0	0	0	109.4	W198 L240 S241	W198-L226 PolarHBondContact NE1-O 3.21Å; W198-L226 VanDerWaalsContact NE1-O 3.16Å; L226-L240 WeakPolarHBondContact O-CA 3.49Å; L226-S241 PolarHBondContact N-O 2.76Å; L226-S241 PolarHBondContact O-N 2.86Å
227	S	92.7	Very high	93.3	Very high	80 Å²	80	68.4 Å²	68.4	56%	0.559	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.7	168	-179.5	0	0	0	0	108.3	L240	S227-L240 WeakPolarHBondContact OG-CD2 3.34Å
228	K	92.2	Very high	93.7	Very high	80 Å²	80	64.7 Å²	64.7	35%	0.348	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	159.6	-176.2	64.6	-165.2	-179.3	-162.7	0	110.7	E183 R239	E183-K228 IonicContact OE1-NZ 2.75Å; E183-K228 PolarHBondContact OE1-NZ 2.73Å; E183-K228 WeakPolarHBondContact OE2-CE 3.27Å; E183-K228 IonicContact OE2-NZ 3.01Å; E183-K228 PolarHBondContact OE2-NZ 3.49Å; K228-R239 HydrophobicContact CG-CB 3.92Å; K228-R239 HydrophobicContact CG-CG 4.18Å; K228-R239 PolarHBondContact N-O 2.87Å; K228-R239 WeakPolarHBondContact O-CA 3.46Å; K228-R239 PolarHBondContact O-N 2.72Å
229	K	94.1	Very high	93.8	Very high	129 Å²	129	66.2 Å²	66.2	56%	0.561	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.5	171.9	-64.5	-174.3	174.9	-162.5	0	108.1	T191 E195 Y237	T191-K229 HydrophobicContact CG2-CD 4.01Å; T191-K229 HydrophobicContact CG2-CG 4.16Å; E195-K229 IonicContact OE1-NZ 3.56Å; E195-K229 PolarHBondContact OE1-NZ 2.91Å; E195-K229 VanDerWaalsContact OE1-NZ 3.13Å; K229-Y237 WeakPolarHBondContact CA-O 3.23Å
230	A	93.8	Very high	93.9	Very high	13 Å²	13	64.1 Å²	64.1	11%	0.107	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	132.7	179	0	0	0	0	0	110.1	E185 F232 S236 Y237	E185-A230 WeakPolarHBondContact OE1-CB 3.34Å; A230-F232 HydrophobicContact CB-CE2 4.05Å; A230-S236 CarbonylContact O-C 3.6Å; A230-S236 WeakPolarHBondContact O-CA 3.25Å; A230-Y237 PolarHBondContact N-O 3.42Å; A230-Y237 PolarHBondContact O-N 3.32Å
231	V	95.4	Very high	94	Very high	121 Å²	121	62.4 Å²	62.4	73%	0.733	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.2	-178.3	-176.5	0	0	0	0	109
232	F	94.7	Very high	94.1	Very high	101 Å²	101	58.5 Å²	58.5	44%	0.443	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	174.8	172.8	-65.7	-83	0	0	0	110.3	A230 T234 G235 Y237	A230-F232 HydrophobicContact CB-CE2 4.05Å; F232-T234 PolarHBondContact O-N 3Å; F232-G235 PolarHBondContact N-O 2.88Å; F232-G235 PolarHBondContact O-N 3.04Å; F232-Y237 HydrophobicContact CB-CE2 4.38Å; F232-Y237 AromaticContact CD2-CD2 3.68Å; F232-Y237 HydrophobicContact CD2-CD2 3.68Å; F232-Y237 HydrophobicContact CD2-CE2 4.1Å; F232-Y237 HydrophobicContact CE2-CD2 4.36Å
233	A	94.8	Very high	94.3	Very high	119 Å²	119	55.9 Å²	55.9	98%	0.983	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-26.4	176.1	0	0	0	0	0	113.2
234	T	94.7	Very high	94.4	Very high	109 Å²	109	53.4 Å²	53.4	67%	0.669	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-18.9	-179.4	51.3	0	0	0	0	113.8	F232 Y237	F232-T234 PolarHBondContact O-N 3Å; T234-Y237 WeakPolarHBondContact CB-OH 3.18Å; T234-Y237 WeakPolarHBondContact OG1-CE2 3.14Å; T234-Y237 PolarHBondContact OG1-OH 3.44Å
235	G	95.3	Very high	94.6	Very high	23 Å²	23	51.6 Å²	51.6	24%	0.237	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.1	-174.5	-176.3	0	0	0	0	0	113.8	F232 Y237	F232-G235 PolarHBondContact N-O 2.88Å; F232-G235 PolarHBondContact O-N 3.04Å; G235-Y237 WeakPolarHBondContact O-CD2 3.3Å
236	S	97	Very high	94.7	Very high	33 Å²	33	50.7 Å²	50.7	23%	0.231	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.8	174.2	169.7	0	0	0	0	109.7	T190 T191 A230	T190-S236 CarbonylContact C-O 3.55Å; T190-S236 WeakPolarHBondContact CA-O 3.44Å; T190-S236 WeakPolarHBondContact CB-O 3.46Å; T191-S236 WeakPolarHBondContact CG2-OG 3.36Å; T191-S236 PolarHBondContact N-O 3.48Å; T191-S236 PolarHBondContact OG1-OG 2.89Å; A230-S236 CarbonylContact O-C 3.6Å; A230-S236 WeakPolarHBondContact O-CA 3.25Å
237	Y	97.4	Very high	94.8	Very high	22 Å²	22	51.1 Å²	51.1	9%	0.086	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	141.1	-176.3	-64.2	-96.3	0	0	0	111	S186 Y187 Y189 T190 K229 A230 F232 T234 G235	S186-Y237 VanDerWaalsContact O-CD1 3.27Å; S186-Y237 WeakPolarHBondContact O-CD1 3.31Å; Y187-Y237 VanDerWaalsContact O-CE1 3.28Å; Y187-Y237 WeakPolarHBondContact O-CE1 3.41Å; Y189-Y237 VanDerWaalsContact O-CD1 3.22Å; Y189-Y237 WeakPolarHBondContact O-CD1 3.15Å; T190-Y237 HydrophobicContact CG2-CE1 4.24Å; K229-Y237 WeakPolarHBondContact CA-O 3.23Å; A230-Y237 PolarHBondContact N-O 3.42Å; A230-Y237 PolarHBondContact O-N 3.32Å; F232-Y237 HydrophobicContact CB-CE2 4.38Å; F232-Y237 AromaticContact CD2-CD2 3.68Å; F232-Y237 HydrophobicContact CD2-CD2 3.68Å; F232-Y237 HydrophobicContact CD2-CE2 4.1Å; F232-Y237 HydrophobicContact CE2-CD2 4.36Å; T234-Y237 WeakPolarHBondContact CB-OH 3.18Å; T234-Y237 WeakPolarHBondContact OG1-CE2 3.14Å; T234-Y237 PolarHBondContact OG1-OH 3.44Å; G235-Y237 WeakPolarHBondContact O-CD2 3.3Å
238	P	96.6	Very high	94.9	Very high	7 Å²	7	47.6 Å²	47.6	5%	0.045	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	136	174.2	32.6	-34.5	0	0	0	110.1	T191 I194 F196	T191-P238 HydrophobicContact CG2-CB 4.26Å; I194-P238 HydrophobicContact CG2-CG 3.83Å; I194-P238 WeakPolarHBondContact O-CG 3.31Å; F196-P238 HydrophobicContact CB-CB 4.14Å; F196-P238 HydrophobicContact CD1-CG 4.44Å; F196-P238 HydrophobicContact CD2-CB 4.07Å; F196-P238 HydrophobicContact CD2-CG 3.96Å; F196-P238 WeakPolarHBondContact CD2-O 3.48Å; F196-P238 HydrophobicContact CE2-CG 4.24Å; F196-P238 HydrophobicContact CG-CB 4.08Å; F196-P238 HydrophobicContact CG-CG 4.08Å
239	R	96.3	Very high	94.9	Very high	40 Å²	40	47 Å²	47	15%	0.151	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	127.3	-177.2	-173.8	179.7	-64.3	-176.7	-0.9	111.3	I129 E183 I184 E185 K228	I129-R239 HydrophobicContact CD1-CG 4.4Å; I129-R239 VanDerWaalsContact CD1-NH2 3.34Å; E183-R239 VanDerWaalsContact OE2-CD 3.22Å; E183-R239 WeakPolarHBondContact OE2-CD 3.12Å; I184-R239 CarbonylContact O-C 3.6Å; I184-R239 VanDerWaalsContact O-CA 3.28Å; I184-R239 WeakPolarHBondContact O-CA 3.08Å; E185-R239 HydrophobicContact CB-CG 4.4Å; E185-R239 VanDerWaalsContact CD-NH2 3.27Å; E185-R239 IonicContact OE1-CZ 3.67Å; E185-R239 VanDerWaalsContact OE1-CZ 3.24Å; E185-R239 IonicContact OE1-NE 3.24Å; E185-R239 PolarHBondContact OE1-NE 3.47Å; E185-R239 IonicContact OE1-NH2 2.93Å; E185-R239 PolarHBondContact OE1-NH2 3.48Å; E185-R239 IonicContact OE2-CZ 2.73Å; E185-R239 IonicContact OE2-NE 3.75Å; E185-R239 IonicContact OE2-NH2 3.36Å; E185-R239 PolarHBondContact OE2-NH2 3.12Å; K228-R239 HydrophobicContact CG-CB 3.92Å; K228-R239 HydrophobicContact CG-CG 4.18Å; K228-R239 PolarHBondContact N-O 2.87Å; K228-R239 WeakPolarHBondContact O-CA 3.46Å; K228-R239 PolarHBondContact O-N 2.72Å
240	L	95.4	Very high	94.9	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	141.7	169.3	-59.6	-172.7	0	0	0	109.6	M70 I184 F196 W198 L226 S227	M70-L240 HydrophobicContact CB-CD1 3.91Å; M70-L240 HydrophobicContact CG-CD1 3.92Å; M70-L240 HydrophobicContact SD-CD1 3.66Å; M70-L240 HydrophobicContact SD-CG 4.49Å; I184-L240 HydrophobicContact CB-CB 4.37Å; I184-L240 PolarHBondContact N-O 2.67Å; I184-L240 PolarHBondContact O-N 3.12Å; F196-L240 HydrophobicContact CB-CD1 4Å; F196-L240 HydrophobicContact CB-CD2 4.05Å; F196-L240 HydrophobicContact CB-CG 3.77Å; W198-L240 HydrophobicContact CD2-CD1 3.96Å; W198-L240 HydrophobicContact CE3-CD1 4.36Å; W198-L240 HydrophobicContact CG-CD1 4.31Å; W198-L240 HydrophobicContact CH2-CB 4.42Å; W198-L240 HydrophobicContact CZ2-CB 3.67Å; W198-L240 HydrophobicContact CZ2-CD1 4.24Å; L226-L240 WeakPolarHBondContact O-CA 3.49Å; S227-L240 WeakPolarHBondContact OG-CD2 3.34Å
241	S	94.8	Very high	94.7	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.014	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	127.6	179.4	-180	0	0	0	0	109.7	L182 E183 T225 L226	L182-S241 WeakPolarHBondContact O-CA 3.34Å; E183-S241 VanDerWaalsContact CD-OG 3.28Å; E183-S241 VanDerWaalsContact OE1-CB 3.23Å; E183-S241 WeakPolarHBondContact OE1-CB 3.25Å; E183-S241 PolarHBondContact OE1-OG 2.87Å; E183-S241 WeakPolarHBondContact OE2-CB 3.46Å; T225-S241 WeakPolarHBondContact CA-O 3.49Å; L226-S241 PolarHBondContact N-O 2.76Å; L226-S241 PolarHBondContact O-N 2.86Å
242	L	94.3	Very high	94.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	114.1	170.1	171.5	57.8	0	0	0	108.2	I72 I74 T181 L182 W198 V207 Y223 T225 F244	I72-L242 HydrophobicContact CD1-CD2 4.08Å; I74-L242 HydrophobicContact CD1-CD2 4.47Å; T181-L242 CarbonylContact C-O 3.56Å; T181-L242 VanDerWaalsContact CA-O 3.31Å; T181-L242 WeakPolarHBondContact CA-O 3.4Å; L182-L242 HydrophobicContact CB-CB 4.34Å; L182-L242 PolarHBondContact N-O 2.92Å; L182-L242 PolarHBondContact O-N 2.81Å; W198-L242 HydrophobicContact CH2-CB 4.21Å; W198-L242 HydrophobicContact CZ2-CB 4.36Å; V207-L242 HydrophobicContact CG1-CD1 4.34Å; V207-L242 HydrophobicContact CG1-CD2 4.06Å; V207-L242 HydrophobicContact CG2-CD1 4.11Å; V207-L242 HydrophobicContact CG2-CD2 4.23Å; Y223-L242 HydrophobicContact CD2-CD1 4.04Å; T225-L242 HydrophobicContact CG2-CD1 4.07Å; L242-F244 HydrophobicContact CD1-CE1 4.32Å; L242-F244 HydrophobicContact CD1-CZ 4.24Å; L242-F244 HydrophobicContact CD2-CE1 4.23Å; L242-F244 HydrophobicContact CD2-CE2 3.98Å; L242-F244 HydrophobicContact CD2-CZ 3.47Å; L242-F244 VanDerWaalsContact CD2-CZ 3.47Å; L242-F244 HydrophobicContact CG-CE1 4.25Å; L242-F244 HydrophobicContact CG-CE2 3.89Å; L242-F244 HydrophobicContact CG-CZ 3.68Å
243	S	93.9	Very high	94.5	Very high	20 Å²	20	41.1 Å²	41.1	14%	0.14	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	126.6	-178.8	-175.5	0	0	0	0	110.5	C180 Y223 Q224	C180-S243 WeakPolarHBondContact O-CA 3.37Å; Y223-S243 CarbonylContact C-O 3.59Å; Y223-S243 WeakPolarHBondContact CA-O 3.39Å; Q224-S243 PolarHBondContact N-O 3.32Å; Q224-S243 PolarHBondContact O-N 2.89Å
244	F	94.1	Very high	94.4	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.009	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131	171.9	-57.8	-77.6	0	0	0	110.2	I74 Y87 I89 N179 C180 V210 L242 L246	I74-F244 HydrophobicContact CD1-CE1 3.6Å; I74-F244 HydrophobicContact CD1-CZ 3.5Å; I74-F244 VanDerWaalsContact CD1-CZ 3.5Å; Y87-F244 HydrophobicContact CE2-CD2 4.48Å; Y87-F244 HydrophobicContact CE2-CE2 4.44Å; I89-F244 HydrophobicContact CD1-CE2 4Å; I89-F244 HydrophobicContact CD1-CZ 3.89Å; N179-F244 WeakPolarHBondContact CA-O 3.23Å; C180-F244 PolarHBondContact N-O 3.36Å; C180-F244 PolarHBondContact O-N 2.8Å; V210-F244 HydrophobicContact CG2-CE1 4.45Å; L242-F244 HydrophobicContact CD1-CE1 4.32Å; L242-F244 HydrophobicContact CD1-CZ 4.24Å; L242-F244 HydrophobicContact CD2-CE1 4.23Å; L242-F244 HydrophobicContact CD2-CE2 3.98Å; L242-F244 HydrophobicContact CD2-CZ 3.47Å; L242-F244 VanDerWaalsContact CD2-CZ 3.47Å; L242-F244 HydrophobicContact CG-CE1 4.25Å; L242-F244 HydrophobicContact CG-CE2 3.89Å; L242-F244 HydrophobicContact CG-CZ 3.68Å; F244-L246 HydrophobicContact CB-CD2 4.23Å; F244-L246 HydrophobicContact CB-CG 4.33Å
245	K	94.8	Very high	94.3	Very high	72 Å²	72	38.3 Å²	38.3	31%	0.313	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	101.8	170.1	-168.7	175.5	-173.3	-163.3	0	109.2	E177 I221 D222	E177-K245 WeakPolarHBondContact OE2-CE 3.34Å; E177-K245 IonicContact OE2-NZ 3.7Å; E177-K245 PolarHBondContact OE2-NZ 2.98Å; I221-K245 HydrophobicContact CB-CB 4.49Å; I221-K245 HydrophobicContact CB-CD 4.46Å; I221-K245 HydrophobicContact CB-CG 4.4Å; I221-K245 HydrophobicContact CD1-CD 4.07Å; I221-K245 HydrophobicContact CD1-CG 4Å; I221-K245 PolarHBondContact N-O 3.19Å; D222-K245 HydrophobicContact CB-CB 4.4Å; D222-K245 WeakPolarHBondContact O-CB 3.27Å; D222-K245 PolarHBondContact O-N 3.08Å
246	L	94.8	Very high	94.1	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	128.1	-177.9	-58	177.5	0	0	0	110.2	V80 E177 Q178 C180 L215 F218 I220 F244	V80-L246 HydrophobicContact CG2-CD1 4.31Å; E177-L246 CarbonylContact C-O 3.5Å; E177-L246 WeakPolarHBondContact CA-O 3.17Å; Q178-L246 HydrophobicContact CB-CB 4.48Å; Q178-L246 PolarHBondContact N-O 2.89Å; Q178-L246 PolarHBondContact O-N 3.17Å; C180-L246 HydrophobicContact CB-CD1 4.38Å; L215-L246 HydrophobicContact CD1-CD2 4.27Å; F218-L246 HydrophobicContact CD1-CB 4.11Å; I220-L246 HydrophobicContact CB-CD2 4.49Å; I220-L246 HydrophobicContact CG1-CD2 3.79Å; F244-L246 HydrophobicContact CB-CD2 4.23Å; F244-L246 HydrophobicContact CB-CG 4.33Å
247	K	94.3	Very high	93.9	Very high	98 Å²	98	39.8 Å²	39.8	43%	0.426	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	131.2	172.2	179.1	165.5	-172.8	154.8	0	110.7	E177 F218 S219 I221	E177-K247 HydrophobicContact CG-CB 4.39Å; E177-K247 HydrophobicContact CG-CG 4.35Å; E177-K247 IonicContact OE1-NZ 2.8Å; F218-K247 CarbonylContact C-O 3.54Å; F218-K247 VanDerWaalsContact CA-O 3.3Å; F218-K247 WeakPolarHBondContact CA-O 3.36Å; S219-K247 PolarHBondContact N-O 3.27Å; S219-K247 PolarHBondContact O-N 3.07Å; S219-K247 PolarHBondContact OG-O 3.06Å; I221-K247 HydrophobicContact CD1-CB 3.53Å; I221-K247 HydrophobicContact CD1-CD 3.98Å; I221-K247 HydrophobicContact CD1-CG 4.35Å; I221-K247 HydrophobicContact CG1-CB 3.69Å; I221-K247 HydrophobicContact CG1-CD 4.32Å
248	R	94.6	Very high	93.7	Very high	6 Å²	6	39 Å²	39	2%	0.023	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	135.4	179.6	-169.8	176.9	-60	-81.1	2.8	111.5	E82 P174 D176 F218 F253	E82-R248 IonicContact OE1-CZ 3.36Å; E82-R248 VanDerWaalsContact OE1-CZ 3.26Å; E82-R248 IonicContact OE1-NH1 3.1Å; E82-R248 PolarHBondContact OE1-NH1 3.27Å; E82-R248 IonicContact OE1-NH2 2.8Å; E82-R248 PolarHBondContact OE1-NH2 2.76Å; P174-R248 WeakPolarHBondContact O-CD 3.46Å; D176-R248 PolarHBondContact O-N 2.99Å; D176-R248 WeakPolarHBondContact OD1-CD 3.41Å; D176-R248 IonicContact OD1-CZ 2.66Å; D176-R248 IonicContact OD1-NE 2.66Å; D176-R248 PolarHBondContact OD1-NE 3.39Å; D176-R248 IonicContact OD2-NE 3.62Å; D176-R248 IonicContact OD2-NH2 3.68Å; F218-R248 HydrophobicContact CD1-CB 4.21Å; F218-R248 HydrophobicContact CE1-CB 4.15Å; F218-R248 HydrophobicContact CE1-CG 4.4Å; F218-R248 VanDerWaalsContact CZ-NH2 3.28Å; R248-F253 HydrophobicContact CG-CE2 4.14Å
249	N	92.5	Very high	93.6	Very high	68 Å²	68	43.1 Å²	43.1	36%	0.364	22%	0.216	S	C	.	.			trans	-80.3	121.7	172.7	-67.7	-23.4	0	0	0	109.8	Q217 S219	Q217-N249 PolarHBondContact O-N 2.88Å; S219-N249 PolarHBondContact OG-OD1 3.46Å
250	I	92.9	Very high	93.6	Very high	66 Å²	66	43.1 Å²	43.1	34%	0.338	22%	0.221	S	C	.	.			trans	-85.6	-15.8	-171	63.1	162.8	0	0	0	114.3	L175 Y252 F253 I254	L175-I250 HydrophobicContact CD2-CD1 4.41Å; L175-I250 HydrophobicContact CD2-CG2 3.64Å; L175-I250 HydrophobicContact CG-CG2 4.49Å; I250-Y252 VanDerWaalsContact C-N 3.3Å; I250-Y252 PolarHBondContact O-N 2.98Å; I250-F253 PolarHBondContact O-N 2.86Å; I250-I254 HydrophobicContact CD1-CG1 4.39Å; I250-I254 WeakPolarHBondContact O-CG1 3.27Å; I250-I254 PolarHBondContact O-N 2.89Å
251	G	91.2	Very high	93.6	Very high	43 Å²	43	43.1 Å²	43.1	44%	0.443	22%	0.221	S	C	.	.	H	α-helix	trans	-57.6	-39.1	-168.6	0	0	0	0	0	114.2	I254 L255	G251-I254 PolarHBondContact O-N 3.47Å; G251-L255 PolarHBondContact O-N 2.87Å
252	Y	91.9	Very high	93.7	Very high	122 Å²	122	44.8 Å²	44.8	48%	0.478	23%	0.229	S	C	.	.	H	α-helix	trans	-59.4	-48.2	174.4	172.3	-101.8	0	0	0	112.2	I250 I254 L255 Q256	I250-Y252 VanDerWaalsContact C-N 3.3Å; I250-Y252 PolarHBondContact O-N 2.98Å; Y252-I254 VanDerWaalsContact C-N 3.33Å; Y252-I254 PolarHBondContact O-N 2.97Å; Y252-L255 PolarHBondContact O-N 2.67Å; Y252-Q256 WeakPolarHBondContact O-CB 3.47Å; Y252-Q256 PolarHBondContact O-N 2.66Å; Y252-Q256 PolarHBondContact OH-NE2 2.79Å; Y252-Q256 PolarHBondContact OH-OE1 3.33Å
253	F	92.8	Very high	93.7	Very high	9 Å²	9	49.7 Å²	49.7	4%	0.039	26%	0.255	C	S	.	.	H	α-helix	trans	-67.3	-34.4	-179.2	-61.1	-73.6	0	0	0	112.4	Y173 P174 R248 I250 T257 Y258	Y173-F253 HydrophobicContact CE1-CE1 4.2Å; Y173-F253 HydrophobicContact CE2-CZ 4.39Å; Y173-F253 AromaticContact CZ-CE1 3.78Å; Y173-F253 AromaticContact CZ-CZ 3.8Å; Y173-F253 WeakPolarHBondContact OH-CE1 3.46Å; Y173-F253 WeakPolarHBondContact OH-CZ 3.35Å; P174-F253 HydrophobicContact CB-CB 4.44Å; P174-F253 HydrophobicContact CB-CD1 4.18Å; P174-F253 HydrophobicContact CB-CD2 3.47Å; P174-F253 VanDerWaalsContact CB-CD2 3.47Å; P174-F253 HydrophobicContact CB-CE1 4.37Å; P174-F253 HydrophobicContact CB-CE2 3.69Å; P174-F253 HydrophobicContact CB-CG 3.74Å; P174-F253 HydrophobicContact CB-CZ 4.13Å; P174-F253 HydrophobicContact CG-CB 3.87Å; P174-F253 HydrophobicContact CG-CD1 4.24Å; P174-F253 HydrophobicContact CG-CD2 3.85Å; P174-F253 HydrophobicContact CG-CG 3.68Å; R248-F253 HydrophobicContact CG-CE2 4.14Å; I250-F253 PolarHBondContact O-N 2.86Å; F253-T257 WeakPolarHBondContact O-CA 3.43Å; F253-T257 WeakPolarHBondContact O-CB 3.36Å; F253-T257 PolarHBondContact O-N 3.01Å; F253-Y258 HydrophobicContact CB-CD2 4.29Å; F253-Y258 HydrophobicContact CB-CE2 4.14Å; F253-Y258 WeakPolarHBondContact O-CD2 3.45Å; F253-Y258 PolarHBondContact O-N 3.02Å
254	I	93.6	Very high	93.8	Very high	40 Å²	40	49.6 Å²	49.6	21%	0.205	25%	0.253	C	S	.	.	I	π-helix	trans	-58.4	-51.4	175.1	-64.2	-64.2	0	0	0	110.4	I250 G251 Y252 Y258 M259 W478	I250-I254 HydrophobicContact CD1-CG1 4.39Å; I250-I254 WeakPolarHBondContact O-CG1 3.27Å; I250-I254 PolarHBondContact O-N 2.89Å; G251-I254 PolarHBondContact O-N 3.47Å; Y252-I254 VanDerWaalsContact C-N 3.33Å; Y252-I254 PolarHBondContact O-N 2.97Å; I254-Y258 HydrophobicContact CD1-CD2 3.94Å; I254-Y258 HydrophobicContact CD1-CG 4.28Å; I254-Y258 PolarHBondContact O-N 3.31Å; I254-M259 HydrophobicContact CG2-CE 4.32Å; I254-M259 HydrophobicContact CG2-CG 4.09Å; I254-M259 VanDerWaalsContact O-CB 3.31Å; I254-M259 WeakPolarHBondContact O-CB 3.41Å; I254-M259 WeakPolarHBondContact O-CG 3.34Å; I254-M259 PolarHBondContact O-N 3.49Å; I254-W478 HydrophobicContact CD1-CH2 3.35Å; I254-W478 HydrophobicContact CD1-CZ2 3.95Å; I254-W478 HydrophobicContact CD1-CZ3 4.19Å
255	L	92.2	Very high	93.9	Very high	129 Å²	129	49.5 Å²	49.5	68%	0.675	25%	0.252	S	S	*	.	I	π-helix	trans	-74.6	-38.4	-175.8	-67	174.4	0	0	0	113	G251 Y252 P260	G251-L255 PolarHBondContact O-N 2.87Å; Y252-L255 PolarHBondContact O-N 2.67Å; L255-P260 VanDerWaalsContact O-CD 3.26Å; L255-P260 WeakPolarHBondContact O-CD 3.42Å
256	Q	90.3	Very high	93.8	Very high	85 Å²	85	49.7 Å²	49.7	40%	0.397	26%	0.256	S	S	.	.	I	π-helix	trans	-88.1	-26.8	-174.2	-174.2	154.6	-17.8	0	0	113.8	Y252	Y252-Q256 WeakPolarHBondContact O-CB 3.47Å; Y252-Q256 PolarHBondContact O-N 2.66Å; Y252-Q256 PolarHBondContact OH-NE2 2.79Å; Y252-Q256 PolarHBondContact OH-OE1 3.33Å
257	T	92.8	Very high	93.8	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.018	28%	0.279	C	S	.	.	I	π-helix	trans	-121.9	-58	-174.1	-54.8	0	0	0	0	113.1	F253 S261 L300 I313 L317	F253-T257 WeakPolarHBondContact O-CA 3.43Å; F253-T257 WeakPolarHBondContact O-CB 3.36Å; F253-T257 PolarHBondContact O-N 3.01Å; T257-S261 VanDerWaalsContact O-CB 3.3Å; T257-S261 WeakPolarHBondContact O-CB 3.46Å; T257-S261 PolarHBondContact O-N 3.15Å; T257-S261 VanDerWaalsContact O-N 3.15Å; T257-S261 PolarHBondContact O-OG 2.97Å; T257-L300 HydrophobicContact CG2-CD1 3.43Å; T257-L300 VanDerWaalsContact CG2-CD1 3.43Å; T257-L300 HydrophobicContact CG2-CD2 4.42Å; T257-I313 HydrophobicContact CG2-CD1 4.05Å; T257-I313 HydrophobicContact CG2-CG1 4.37Å; T257-L317 HydrophobicContact CG2-CD1 4.43Å; T257-L317 HydrophobicContact CG2-CD2 3.98Å
258	Y	94.4	Very high	93.8	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.016	26%	0.259	C	S	.	.	I	π-helix	trans	-66.7	-48.7	-172.5	-70.5	-85.7	0	0	0	111.7	P174 F253 I254 S261 I262 Y316 Y477 W478	P174-Y258 HydrophobicContact CG-CE2 4.2Å; F253-Y258 HydrophobicContact CB-CD2 4.29Å; F253-Y258 HydrophobicContact CB-CE2 4.14Å; F253-Y258 WeakPolarHBondContact O-CD2 3.45Å; F253-Y258 PolarHBondContact O-N 3.02Å; I254-Y258 HydrophobicContact CD1-CD2 3.94Å; I254-Y258 HydrophobicContact CD1-CG 4.28Å; I254-Y258 PolarHBondContact O-N 3.31Å; Y258-S261 PolarHBondContact O-N 3.01Å; Y258-I262 VanDerWaalsContact O-CG1 3.27Å; Y258-I262 WeakPolarHBondContact O-CG1 3.49Å; Y258-I262 PolarHBondContact O-N 2.77Å; Y258-Y316 AromaticContact CD1-CD1 3.51Å; Y258-Y316 HydrophobicContact CD1-CD1 3.51Å; Y258-Y316 HydrophobicContact CD1-CD2 4.12Å; Y258-Y316 AromaticContact CD1-CE1 3.4Å; Y258-Y316 HydrophobicContact CD1-CE1 3.4Å; Y258-Y316 VanDerWaalsContact CD1-CE1 3.4Å; Y258-Y316 HydrophobicContact CD1-CE2 4.02Å; Y258-Y316 AromaticContact CD1-CG 3.88Å; Y258-Y316 HydrophobicContact CD1-CG 3.88Å; Y258-Y316 AromaticContact CD1-CZ 3.66Å; Y258-Y316 AromaticContact CE1-CD1 3.63Å; Y258-Y316 HydrophobicContact CE1-CD1 3.63Å; Y258-Y316 AromaticContact CE1-CD2 3.89Å; Y258-Y316 HydrophobicContact CE1-CD2 3.89Å; Y258-Y316 AromaticContact CE1-CE1 4Å; Y258-Y316 HydrophobicContact CE1-CE1 4Å; Y258-Y316 HydrophobicContact CE1-CE2 4.23Å; Y258-Y316 AromaticContact CE1-CG 3.57Å; Y258-Y316 HydrophobicContact CE1-CG 3.57Å; Y258-Y316 HydrophobicContact CG-CE1 4.35Å; Y258-Y477 AromaticContact CE1-CE1 3.73Å; Y258-Y477 HydrophobicContact CE1-CE1 3.73Å; Y258-Y477 PolarHBondContact OH-OH 3.13Å; Y258-W478 HydrophobicContact CD1-CH2 4.05Å; Y258-W478 AromaticContact CD1-CZ2 3.67Å; Y258-W478 HydrophobicContact CD1-CZ2 3.67Å; Y258-W478 HydrophobicContact CD2-CH2 4.28Å; Y258-W478 AromaticContact CE1-CH2 3.98Å; Y258-W478 HydrophobicContact CE1-CH2 3.98Å; Y258-W478 AromaticContact CE1-CZ2 3.9Å; Y258-W478 HydrophobicContact CE1-CZ2 3.9Å; Y258-W478 HydrophobicContact CE2-CH2 4.2Å; Y258-W478 HydrophobicContact CG-CH2 4.21Å; Y258-W478 HydrophobicContact CG-CZ2 4.06Å
259	M	94.9	Very high	93.7	Very high	95 Å²	95	50.3 Å²	50.3	47%	0.468	26%	0.262	S	S	.	.	H	α-helix	trans	-60.9	-51.3	-179.3	-78	-68.1	179.7	0	0	112.6	I254 S261 I262 L263	I254-M259 HydrophobicContact CG2-CE 4.32Å; I254-M259 HydrophobicContact CG2-CG 4.09Å; I254-M259 VanDerWaalsContact O-CB 3.31Å; I254-M259 WeakPolarHBondContact O-CB 3.41Å; I254-M259 WeakPolarHBondContact O-CG 3.34Å; I254-M259 PolarHBondContact O-N 3.49Å; M259-S261 VanDerWaalsContact C-N 3.3Å; M259-S261 PolarHBondContact O-N 3.2Å; M259-I262 PolarHBondContact O-N 3.09Å; M259-L263 VanDerWaalsContact O-CG 3.31Å; M259-L263 WeakPolarHBondContact O-CG 3.38Å; M259-L263 PolarHBondContact O-N 3.45Å
260	P	95.4	Very high	93.7	Very high	40 Å²	40	50 Å²	50	26%	0.26	26%	0.263	S	S	.	.	H	α-helix	trans	-58.3	-40.6	175.2	-27.4	36.5	0	0	0	113.1	L255 L263 I264 I296	L255-P260 VanDerWaalsContact O-CD 3.26Å; L255-P260 WeakPolarHBondContact O-CD 3.42Å; P260-L263 PolarHBondContact O-N 3.05Å; P260-I264 WeakPolarHBondContact O-CB 3.43Å; P260-I264 WeakPolarHBondContact O-CD1 3.25Å; P260-I264 VanDerWaalsContact O-CG1 3.24Å; P260-I264 WeakPolarHBondContact O-CG1 3.33Å; P260-I264 PolarHBondContact O-N 2.93Å; P260-I296 HydrophobicContact CB-CD1 4.31Å
261	S	95.6	Very high	93.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.8	-39.5	179.7	-56.5	0	0	0	0	112.3	T257 Y258 M259 T265 L317	T257-S261 VanDerWaalsContact O-CB 3.3Å; T257-S261 WeakPolarHBondContact O-CB 3.46Å; T257-S261 PolarHBondContact O-N 3.15Å; T257-S261 VanDerWaalsContact O-N 3.15Å; T257-S261 PolarHBondContact O-OG 2.97Å; Y258-S261 PolarHBondContact O-N 3.01Å; M259-S261 VanDerWaalsContact C-N 3.3Å; M259-S261 PolarHBondContact O-N 3.2Å; S261-T265 WeakPolarHBondContact O-CB 2.99Å; S261-T265 PolarHBondContact O-N 3.29Å; S261-T265 PolarHBondContact O-OG1 3.47Å; S261-L317 WeakPolarHBondContact OG-CD2 3.38Å
262	I	95.5	Very high	93.5	Very high	37 Å²	37	45.1 Å²	45.1	19%	0.19	23%	0.227	C	C	.	.	H	α-helix	trans	-62.8	-49.6	173	-68.9	165.2	0	0	0	110.1	Y258 M259 I264 T265 I266 Y316 F470	Y258-I262 VanDerWaalsContact O-CG1 3.27Å; Y258-I262 WeakPolarHBondContact O-CG1 3.49Å; Y258-I262 PolarHBondContact O-N 2.77Å; M259-I262 PolarHBondContact O-N 3.09Å; I262-I264 PolarHBondContact O-N 3.32Å; I262-T265 WeakPolarHBondContact O-CB 2.93Å; I262-T265 PolarHBondContact O-N 3.34Å; I262-T265 VanDerWaalsContact O-N 3.14Å; I262-I266 HydrophobicContact CG2-CD1 3.69Å; I262-I266 HydrophobicContact CG2-CG1 4.38Å; I262-I266 WeakPolarHBondContact O-CG1 3.44Å; I262-I266 PolarHBondContact O-N 2.93Å; I262-Y316 WeakPolarHBondContact CD1-OH 3.4Å; I262-Y316 WeakPolarHBondContact CG1-OH 3.25Å; I262-F470 HydrophobicContact CG1-CE1 4.39Å; I262-F470 HydrophobicContact CG1-CZ 4.19Å; I262-F470 HydrophobicContact CG2-CE1 4.26Å
263	L	95.4	Very high	93.4	Very high	103 Å²	103	45.9 Å²	45.9	54%	0.539	23%	0.229	S	C	.	.	H	α-helix	trans	-61.3	-42.7	-178.8	-68.4	174.1	0	0	0	111.9	M259 P260 T265 I266 L267	M259-L263 VanDerWaalsContact O-CG 3.31Å; M259-L263 WeakPolarHBondContact O-CG 3.38Å; M259-L263 PolarHBondContact O-N 3.45Å; P260-L263 PolarHBondContact O-N 3.05Å; L263-T265 VanDerWaalsContact C-N 3.32Å; L263-T265 PolarHBondContact O-N 2.91Å; L263-I266 PolarHBondContact O-N 3.32Å; L263-L267 WeakPolarHBondContact O-CB 3.46Å; L263-L267 VanDerWaalsContact O-CG 3.27Å; L263-L267 WeakPolarHBondContact O-CG 3.13Å; L263-L267 PolarHBondContact O-N 3.39Å
264	I	95.6	Very high	93.2	Very high	18 Å²	18	47.8 Å²	47.8	9%	0.092	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-40.2	175.4	-69.4	161	0	0	0	111.1	P260 I262 L267 S268 T289 T292 M293 I296	P260-I264 WeakPolarHBondContact O-CB 3.43Å; P260-I264 WeakPolarHBondContact O-CD1 3.25Å; P260-I264 VanDerWaalsContact O-CG1 3.24Å; P260-I264 WeakPolarHBondContact O-CG1 3.33Å; P260-I264 PolarHBondContact O-N 2.93Å; I262-I264 PolarHBondContact O-N 3.32Å; I264-L267 PolarHBondContact O-N 2.85Å; I264-S268 PolarHBondContact O-N 2.94Å; I264-T289 HydrophobicContact CG2-CG2 4.34Å; I264-T292 HydrophobicContact CD1-CG2 3.47Å; I264-T292 VanDerWaalsContact CD1-CG2 3.47Å; I264-T292 HydrophobicContact CG1-CG2 4.2Å; I264-M293 HydrophobicContact CG2-CE 4.46Å; I264-I296 HydrophobicContact CD1-CD1 3.33Å
265	T	95.5	Very high	92.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-44.1	176.6	-54.2	0	0	0	0	110.8	S261 I262 L263 L267 S268 W269 F323 V324 F470	S261-T265 WeakPolarHBondContact O-CB 2.99Å; S261-T265 PolarHBondContact O-N 3.29Å; S261-T265 PolarHBondContact O-OG1 3.47Å; I262-T265 WeakPolarHBondContact O-CB 2.93Å; I262-T265 PolarHBondContact O-N 3.34Å; I262-T265 VanDerWaalsContact O-N 3.14Å; L263-T265 VanDerWaalsContact C-N 3.32Å; L263-T265 PolarHBondContact O-N 2.91Å; T265-L267 VanDerWaalsContact C-N 3.35Å; T265-L267 PolarHBondContact O-N 3.25Å; T265-S268 WeakPolarHBondContact O-CB 3.41Å; T265-S268 PolarHBondContact O-N 3.43Å; T265-S268 PolarHBondContact O-OG 3.28Å; T265-W269 HydrophobicContact CG2-CZ2 3.98Å; T265-W269 VanDerWaalsContact O-CD1 3.3Å; T265-W269 PolarHBondContact O-NE1 3.05Å; T265-F323 HydrophobicContact CG2-CB 3.93Å; T265-V324 HydrophobicContact CG2-CG2 4.45Å; T265-F470 HydrophobicContact CG2-CD2 4.01Å; T265-F470 HydrophobicContact CG2-CE2 3.84Å; T265-F470 HydrophobicContact CG2-CG 4.44Å; T265-F470 HydrophobicContact CG2-CZ 4.13Å
266	I	94.5	Very high	92.3	Very high	75 Å²	75	46.6 Å²	46.6	39%	0.385	23%	0.233	S	C	.	.	H	α-helix	trans	-63.6	-40.6	175	-65.4	167.5	0	0	0	111.2	I262 L263 S268 W269	I262-I266 HydrophobicContact CG2-CD1 3.69Å; I262-I266 HydrophobicContact CG2-CG1 4.38Å; I262-I266 WeakPolarHBondContact O-CG1 3.44Å; I262-I266 PolarHBondContact O-N 2.93Å; L263-I266 PolarHBondContact O-N 3.32Å; I266-S268 VanDerWaalsContact C-N 3.26Å; I266-S268 PolarHBondContact O-N 3.13Å; I266-W269 HydrophobicContact CB-CE3 4.34Å; I266-W269 HydrophobicContact CB-CZ3 4.45Å; I266-W269 HydrophobicContact CG1-CE3 4.19Å; I266-W269 HydrophobicContact CG1-CH2 4.1Å; I266-W269 HydrophobicContact CG1-CZ3 3.8Å; I266-W269 HydrophobicContact CG2-CE3 4.29Å; I266-W269 WeakPolarHBondContact O-CB 3.36Å; I266-W269 PolarHBondContact O-N 3.43Å
267	L	93.7	Very high	91.8	Very high	97 Å²	97	47.9 Å²	47.9	51%	0.508	24%	0.242	S	C	.	.	H	α-helix	trans	-60.1	-36.8	176.3	-76.3	173.2	0	0	0	111.7	L263 I264 T265 W269 V270	L263-L267 WeakPolarHBondContact O-CB 3.46Å; L263-L267 VanDerWaalsContact O-CG 3.27Å; L263-L267 WeakPolarHBondContact O-CG 3.13Å; L263-L267 PolarHBondContact O-N 3.39Å; I264-L267 PolarHBondContact O-N 2.85Å; T265-L267 VanDerWaalsContact C-N 3.35Å; T265-L267 PolarHBondContact O-N 3.25Å; L267-W269 PolarHBondContact O-N 3.4Å; L267-V270 HydrophobicContact CD2-CG2 4.49Å; L267-V270 VanDerWaalsContact O-CB 3.29Å; L267-V270 WeakPolarHBondContact O-CB 3.46Å; L267-V270 WeakPolarHBondContact O-CG2 3.2Å; L267-V270 PolarHBondContact O-N 3.02Å; L267-V270 VanDerWaalsContact O-N 3.08Å
268	S	94.3	Very high	91.5	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.007	26%	0.257	C	S	.	.	H	α-helix	trans	-57.9	-32.4	175.5	80.7	0	0	0	0	112.4	I264 T265 I266 V270 S271	I264-S268 PolarHBondContact O-N 2.94Å; T265-S268 WeakPolarHBondContact O-CB 3.41Å; T265-S268 PolarHBondContact O-N 3.43Å; T265-S268 PolarHBondContact O-OG 3.28Å; I266-S268 VanDerWaalsContact C-N 3.26Å; I266-S268 PolarHBondContact O-N 3.13Å; S268-V270 VanDerWaalsContact C-N 3.31Å; S268-V270 PolarHBondContact O-N 2.94Å; S268-S271 WeakPolarHBondContact O-CB 3.14Å; S268-S271 PolarHBondContact O-N 3.02Å; S268-S271 PolarHBondContact O-OG 3.34Å
269	W	93.3	Very high	91	Very high	21 Å²	21	52 Å²	52	8%	0.08	27%	0.274	C	S	.	.	H	α-helix	trans	-73.1	-23.2	-179.6	-50.6	-19.9	0	0	0	112.7	T265 I266 L267 S271 F272 W273 P467 F470	T265-W269 HydrophobicContact CG2-CZ2 3.98Å; T265-W269 VanDerWaalsContact O-CD1 3.3Å; T265-W269 PolarHBondContact O-NE1 3.05Å; I266-W269 HydrophobicContact CB-CE3 4.34Å; I266-W269 HydrophobicContact CB-CZ3 4.45Å; I266-W269 HydrophobicContact CG1-CE3 4.19Å; I266-W269 HydrophobicContact CG1-CH2 4.1Å; I266-W269 HydrophobicContact CG1-CZ3 3.8Å; I266-W269 HydrophobicContact CG2-CE3 4.29Å; I266-W269 WeakPolarHBondContact O-CB 3.36Å; I266-W269 PolarHBondContact O-N 3.43Å; L267-W269 PolarHBondContact O-N 3.4Å; W269-S271 PolarHBondContact O-N 3.06Å; W269-F272 HydrophobicContact CB-CD2 3.84Å; W269-F272 HydrophobicContact CB-CE2 3.83Å; W269-F272 AromaticContact CD1-CE2 3.84Å; W269-F272 HydrophobicContact CG-CD2 4.5Å; W269-F272 HydrophobicContact CG-CE2 4.03Å; W269-F272 WeakPolarHBondContact O-CB 3.48Å; W269-F272 VanDerWaalsContact O-CD2 3.23Å; W269-F272 WeakPolarHBondContact O-CD2 3.24Å; W269-F272 WeakPolarHBondContact O-CG 3.36Å; W269-F272 PolarHBondContact O-N 2.91Å; W269-W273 HydrophobicContact CB-CZ3 3.85Å; W269-W273 WeakPolarHBondContact O-CZ3 3.42Å; W269-P467 HydrophobicContact CD2-CG 4.39Å; W269-P467 HydrophobicContact CE3-CB 4.4Å; W269-P467 HydrophobicContact CE3-CG 3.8Å; W269-P467 HydrophobicContact CH2-CB 4.12Å; W269-P467 HydrophobicContact CH2-CG 4.3Å; W269-P467 HydrophobicContact CZ3-CB 3.82Å; W269-P467 HydrophobicContact CZ3-CG 3.75Å; W269-F470 HydrophobicContact CH2-CB 3.95Å; W269-F470 AromaticContact CH2-CD1 3.71Å; W269-F470 HydrophobicContact CH2-CD1 3.71Å; W269-F470 HydrophobicContact CH2-CG 4.07Å; W269-F470 HydrophobicContact CZ2-CB 3.68Å; W269-F470 AromaticContact CZ2-CD1 3.87Å; W269-F470 HydrophobicContact CZ2-CD1 3.87Å; W269-F470 AromaticContact CZ2-CG 3.82Å; W269-F470 HydrophobicContact CZ2-CG 3.82Å
270	V	91.9	Very high	90.8	Very high	63 Å²	63	51.1 Å²	51.1	38%	0.382	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-54.3	-28.8	177.2	178.2	0	0	0	0	111.1	L267 S268 F272 W273 I274 L285	L267-V270 HydrophobicContact CD2-CG2 4.49Å; L267-V270 VanDerWaalsContact O-CB 3.29Å; L267-V270 WeakPolarHBondContact O-CB 3.46Å; L267-V270 WeakPolarHBondContact O-CG2 3.2Å; L267-V270 PolarHBondContact O-N 3.02Å; L267-V270 VanDerWaalsContact O-N 3.08Å; S268-V270 VanDerWaalsContact C-N 3.31Å; S268-V270 PolarHBondContact O-N 2.94Å; V270-F272 PolarHBondContact O-N 3.13Å; V270-W273 PolarHBondContact O-N 2.87Å; V270-I274 PolarHBondContact O-N 3.5Å; V270-L285 HydrophobicContact CB-CD1 4.19Å; V270-L285 HydrophobicContact CG1-CD1 4.39Å
271	S	90.5	Very high	90.6	Very high	5 Å²	5	51.4 Å²	51.4	4%	0.035	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-56.5	-30	174	67.3	0	0	0	0	114.1	S268 W269 W273 I274 R282	S268-S271 WeakPolarHBondContact O-CB 3.14Å; S268-S271 PolarHBondContact O-N 3.02Å; S268-S271 PolarHBondContact O-OG 3.34Å; W269-S271 PolarHBondContact O-N 3.06Å; S271-W273 VanDerWaalsContact C-N 3.26Å; S271-W273 PolarHBondContact O-N 3.1Å; S271-I274 PolarHBondContact O-N 3.22Å; S271-R282 PolarHBondContact O-NE 2.99Å
272	F	89.8	Confident	90.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-71.9	-17.2	177.7	-50.7	-38.1	0	0	0	113.5	W269 V270 A327 E330 R463 F466	W269-F272 HydrophobicContact CB-CD2 3.84Å; W269-F272 HydrophobicContact CB-CE2 3.83Å; W269-F272 AromaticContact CD1-CE2 3.84Å; W269-F272 HydrophobicContact CG-CD2 4.5Å; W269-F272 HydrophobicContact CG-CE2 4.03Å; W269-F272 WeakPolarHBondContact O-CB 3.48Å; W269-F272 VanDerWaalsContact O-CD2 3.23Å; W269-F272 WeakPolarHBondContact O-CD2 3.24Å; W269-F272 WeakPolarHBondContact O-CG 3.36Å; W269-F272 PolarHBondContact O-N 2.91Å; V270-F272 PolarHBondContact O-N 3.13Å; F272-A327 HydrophobicContact CE1-CB 4.23Å; F272-A327 HydrophobicContact CZ-CB 3.86Å; F272-E330 HydrophobicContact CE1-CB 4.16Å; F272-E330 HydrophobicContact CE1-CG 3.98Å; F272-R463 HydrophobicContact CB-CG 3.94Å; F272-R463 PolarHBondContact O-NE 3.35Å; F272-R463 PolarHBondContact O-NH2 2.66Å; F272-F466 HydrophobicContact CE2-CB 4.04Å; F272-F466 HydrophobicContact CE2-CD1 4.34Å; F272-F466 AromaticContact CE2-CD2 3.86Å; F272-F466 HydrophobicContact CE2-CD2 3.86Å; F272-F466 HydrophobicContact CE2-CE2 4.35Å; F272-F466 AromaticContact CE2-CG 3.84Å; F272-F466 HydrophobicContact CE2-CG 3.84Å; F272-F466 HydrophobicContact CZ-CD1 4.15Å; F272-F466 AromaticContact CZ-CD2 3.76Å; F272-F466 HydrophobicContact CZ-CD2 3.76Å; F272-F466 HydrophobicContact CZ-CE1 4.18Å; F272-F466 AromaticContact CZ-CE2 3.79Å; F272-F466 HydrophobicContact CZ-CE2 3.79Å; F272-F466 AromaticContact CZ-CG 3.94Å; F272-F466 HydrophobicContact CZ-CG 3.94Å; F272-F466 AromaticContact CZ-CZ 4Å; F272-F466 HydrophobicContact CZ-CZ 4Å
273	W	89.1	Confident	90.2	Very high	138 Å²	138	52.2 Å²	52.2	52%	0.523	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-20.4	176.4	-75.4	-94.1	0	0	0	113.1	W269 V270 S271 R463	W269-W273 HydrophobicContact CB-CZ3 3.85Å; W269-W273 WeakPolarHBondContact O-CZ3 3.42Å; V270-W273 PolarHBondContact O-N 2.87Å; S271-W273 VanDerWaalsContact C-N 3.26Å; S271-W273 PolarHBondContact O-N 3.1Å; W273-R463 HydrophobicContact CD2-CG 4.42Å; W273-R463 HydrophobicContact CH2-CG 4.34Å; W273-R463 HydrophobicContact CZ2-CB 4.5Å; W273-R463 HydrophobicContact CZ2-CG 4.06Å
274	I	88.8	Confident	90.1	Very high	49 Å²	49	49.8 Å²	49.8	25%	0.251	29%	0.289	S	S	.	.	S	Bend	trans	-73.4	139.2	176.5	-64.2	174.8	0	0	0	108.3	V270 S271 A278 A281 R282 L285	V270-I274 PolarHBondContact O-N 3.5Å; S271-I274 PolarHBondContact O-N 3.22Å; I274-A278 HydrophobicContact CG2-CB 3.86Å; I274-A281 HydrophobicContact CG2-CB 4.43Å; I274-R282 HydrophobicContact CB-CG 4.17Å; I274-R282 HydrophobicContact CG2-CG 4.02Å; I274-R282 PolarHBondContact O-NE 3.08Å; I274-R282 PolarHBondContact O-NH2 3.49Å; I274-L285 HydrophobicContact CD1-CD1 4.34Å
275	N	84.4	Confident	90	Very high	116 Å²	116	50.8 Å²	50.8	62%	0.62	29%	0.294	S	S	*	.			trans	-60.1	144.2	177.3	-67.5	-31.3	0	0	0	112.2	D277 A278	N275-D277 PolarHBondContact O-N 2.94Å; N275-A278 PolarHBondContact O-N 3.4Å; N275-A278 VanDerWaalsContact O-N 3.07Å
276	Y	81.6	Confident	89.9	Confident	29 Å²	29	51.1 Å²	51.1	11%	0.114	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-23.8	-178.8	66.1	-96.1	0	0	0	113.1	A278 F338 L452 V455	Y276-A278 PolarHBondContact O-N 2.88Å; Y276-F338 HydrophobicContact CD2-CD2 4.26Å; Y276-F338 HydrophobicContact CD2-CE2 4.3Å; Y276-F338 HydrophobicContact CD2-CG 4.4Å; Y276-F338 HydrophobicContact CD2-CZ 4.47Å; Y276-F338 AromaticContact CE2-CD2 3.82Å; Y276-F338 HydrophobicContact CE2-CD2 3.82Å; Y276-F338 HydrophobicContact CE2-CE1 4.2Å; Y276-F338 AromaticContact CE2-CE2 3.46Å; Y276-F338 HydrophobicContact CE2-CE2 3.46Å; Y276-F338 VanDerWaalsContact CE2-CE2 3.46Å; Y276-F338 HydrophobicContact CE2-CG 4.33Å; Y276-F338 AromaticContact CE2-CZ 3.67Å; Y276-F338 HydrophobicContact CE2-CZ 3.67Å; Y276-L452 HydrophobicContact CE1-CD2 4.48Å; Y276-V455 HydrophobicContact CD1-CG1 3.99Å; Y276-V455 HydrophobicContact CG-CG1 4.1Å
277	D	79.9	Confident	89.9	Confident	111 Å²	111	52.2 Å²	52.2	59%	0.594	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.8	175.2	-68.5	-36.6	0	0	0	112.7	N275 S279	N275-D277 PolarHBondContact O-N 2.94Å; D277-S279 VanDerWaalsContact C-N 3.27Å; D277-S279 PolarHBondContact O-N 3.24Å
278	A	87.6	Confident	90	Very high	41 Å²	41	51.4 Å²	51.4	34%	0.339	30%	0.302	S	S	.	.			trans	-87	60	179.9	0	0	0	0	0	112	I274 N275 Y276 A280 A281 R282	I274-A278 HydrophobicContact CG2-CB 3.86Å; N275-A278 PolarHBondContact O-N 3.4Å; N275-A278 VanDerWaalsContact O-N 3.07Å; Y276-A278 PolarHBondContact O-N 2.88Å; A278-A280 VanDerWaalsContact C-N 3.34Å; A278-A280 PolarHBondContact O-N 3.34Å; A278-A281 HydrophobicContact CB-CB 4.35Å; A278-A281 PolarHBondContact O-N 3.44Å; A278-A281 VanDerWaalsContact O-N 3.16Å; A278-R282 PolarHBondContact O-N 3.26Å
279	S	84.1	Confident	90	Very high	52 Å²	52	51.9 Å²	51.9	36%	0.364	31%	0.305	S	S	.	.	H	α-helix	trans	-52.9	-44.9	-177.3	54.8	0	0	0	0	113.8	D277 A281 R282 V283 Y331	D277-S279 VanDerWaalsContact C-N 3.27Å; D277-S279 PolarHBondContact O-N 3.24Å; S279-A281 VanDerWaalsContact C-N 3.33Å; S279-A281 PolarHBondContact O-N 3Å; S279-R282 PolarHBondContact O-N 3.23Å; S279-V283 WeakPolarHBondContact O-CG2 3.3Å; S279-V283 PolarHBondContact O-N 3.47Å; S279-V283 VanDerWaalsContact O-N 3.08Å; S279-Y331 VanDerWaalsContact CA-OH 3.31Å; S279-Y331 WeakPolarHBondContact CA-OH 3.4Å; S279-Y331 WeakPolarHBondContact CB-OH 3.48Å; S279-Y331 PolarHBondContact O-OH 3.02Å
280	A	89.8	Confident	90.1	Very high	78 Å²	78	52.1 Å²	52.1	65%	0.645	31%	0.309	S	S	*	.	H	α-helix	trans	-60.6	-39.1	-179.8	0	0	0	0	0	112.9	A278 A284	A278-A280 VanDerWaalsContact C-N 3.34Å; A278-A280 PolarHBondContact O-N 3.34Å; A280-A284 WeakPolarHBondContact O-CB 3.29Å; A280-A284 PolarHBondContact O-N 2.97Å; A280-A284 VanDerWaalsContact O-N 3.08Å
281	A	91.2	Very high	90.3	Very high	46 Å²	46	54.2 Å²	54.2	38%	0.38	32%	0.317	S	S	.	.	H	α-helix	trans	-71.1	-44.2	-178.9	0	0	0	0	0	111.9	I274 A278 S279 L285	I274-A281 HydrophobicContact CG2-CB 4.43Å; A278-A281 HydrophobicContact CB-CB 4.35Å; A278-A281 PolarHBondContact O-N 3.44Å; A278-A281 VanDerWaalsContact O-N 3.16Å; S279-A281 VanDerWaalsContact C-N 3.33Å; S279-A281 PolarHBondContact O-N 3Å; A281-L285 WeakPolarHBondContact O-CB 3.13Å; A281-L285 PolarHBondContact O-N 3.47Å; A281-L285 VanDerWaalsContact O-N 3.08Å
282	R	91.7	Very high	90.5	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.015	33%	0.332	C	S	.	.	H	α-helix	trans	-65.1	-44	178.8	-69.6	-170.3	177.1	-160	8.8	111.8	S271 I274 A278 S279 L285 G286 Y331 D459	S271-R282 PolarHBondContact O-NE 2.99Å; I274-R282 HydrophobicContact CB-CG 4.17Å; I274-R282 HydrophobicContact CG2-CG 4.02Å; I274-R282 PolarHBondContact O-NE 3.08Å; I274-R282 PolarHBondContact O-NH2 3.49Å; A278-R282 PolarHBondContact O-N 3.26Å; S279-R282 PolarHBondContact O-N 3.23Å; R282-L285 PolarHBondContact O-N 2.7Å; R282-G286 PolarHBondContact O-N 3.27Å; R282-Y331 HydrophobicContact CB-CD2 3.61Å; R282-Y331 HydrophobicContact CB-CE2 3.77Å; R282-Y331 HydrophobicContact CB-CG 4.11Å; R282-Y331 HydrophobicContact CG-CD2 4.17Å; R282-Y331 HydrophobicContact CG-CE2 4.39Å; R282-D459 IonicContact CZ-OD1 3.57Å; R282-D459 IonicContact CZ-OD2 3.68Å; R282-D459 IonicContact NH1-OD1 2.76Å; R282-D459 PolarHBondContact NH1-OD1 2.95Å; R282-D459 IonicContact NH1-OD2 3.63Å; R282-D459 IonicContact NH2-OD1 3.31Å; R282-D459 PolarHBondContact NH2-OD1 3.02Å; R282-D459 IonicContact NH2-OD2 2.77Å; R282-D459 PolarHBondContact NH2-OD2 3.31Å
283	V	92	Very high	90.7	Very high	49 Å²	49	56.6 Å²	56.6	30%	0.297	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-47.2	177.3	174.7	0	0	0	0	111.5	S279 L285 G286 I287 Y331	S279-V283 WeakPolarHBondContact O-CG2 3.3Å; S279-V283 PolarHBondContact O-N 3.47Å; S279-V283 VanDerWaalsContact O-N 3.08Å; V283-L285 VanDerWaalsContact C-N 3.33Å; V283-L285 PolarHBondContact O-N 2.86Å; V283-G286 PolarHBondContact O-N 3.27Å; V283-I287 HydrophobicContact CG1-CD1 3.54Å; V283-I287 HydrophobicContact CG1-CG1 4.17Å; V283-I287 WeakPolarHBondContact O-CG1 3.46Å; V283-I287 PolarHBondContact O-N 2.97Å; V283-Y331 HydrophobicContact CB-CE1 4.47Å; V283-Y331 HydrophobicContact CG2-CD1 3.92Å; V283-Y331 HydrophobicContact CG2-CE1 3.13Å
284	A	93.6	Very high	90.9	Very high	53 Å²	53	52.8 Å²	52.8	44%	0.438	32%	0.324	S	S	.	.	H	α-helix	trans	-60.2	-44.1	-179.2	0	0	0	0	0	111.5	A280 T288	A280-A284 WeakPolarHBondContact O-CB 3.29Å; A280-A284 PolarHBondContact O-N 2.97Å; A280-A284 VanDerWaalsContact O-N 3.08Å; A284-T288 WeakPolarHBondContact O-CB 3.47Å; A284-T288 PolarHBondContact O-N 3.34Å; A284-T288 PolarHBondContact O-OG1 3.36Å
285	L	93.4	Very high	91.2	Very high	39 Å²	39	54.1 Å²	54.1	20%	0.204	33%	0.334	C	S	.	.	H	α-helix	trans	-62.8	-48	176.3	-170.1	164.7	0	0	0	111.3	V270 I274 A281 R282 V283 T288 T289	V270-L285 HydrophobicContact CB-CD1 4.19Å; V270-L285 HydrophobicContact CG1-CD1 4.39Å; I274-L285 HydrophobicContact CD1-CD1 4.34Å; A281-L285 WeakPolarHBondContact O-CB 3.13Å; A281-L285 PolarHBondContact O-N 3.47Å; A281-L285 VanDerWaalsContact O-N 3.08Å; R282-L285 PolarHBondContact O-N 2.7Å; V283-L285 VanDerWaalsContact C-N 3.33Å; V283-L285 PolarHBondContact O-N 2.86Å; L285-T288 PolarHBondContact O-N 2.7Å; L285-T289 HydrophobicContact CD2-CG2 3.97Å; L285-T289 WeakPolarHBondContact O-CB 3.43Å; L285-T289 VanDerWaalsContact O-CG2 3.32Å; L285-T289 WeakPolarHBondContact O-CG2 3.46Å; L285-T289 PolarHBondContact O-N 3.15Å; L285-T289 PolarHBondContact O-OG1 3.23Å
286	G	92.5	Very high	91.6	Very high	6 Å²	6	50.1 Å²	50.1	6%	0.062	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-44.6	-179.2	0	0	0	0	0	113.7	R282 V283 T289 V290	R282-G286 PolarHBondContact O-N 3.27Å; V283-G286 PolarHBondContact O-N 3.27Å; G286-T289 WeakPolarHBondContact CA-OG1 3.19Å; G286-T289 PolarHBondContact O-OG1 3.14Å; G286-V290 WeakPolarHBondContact O-CG2 3.37Å; G286-V290 PolarHBondContact O-N 2.94Å; G286-V290 VanDerWaalsContact O-N 3.17Å
287	I	94.2	Very high	92	Very high	98 Å²	98	49.9 Å²	49.9	50%	0.503	31%	0.313	S	S	.	.	H	α-helix	trans	-66.8	-43.6	177	-66.4	176.9	0	0	0	110.8	V283 T289 V290 L291	V283-I287 HydrophobicContact CG1-CD1 3.54Å; V283-I287 HydrophobicContact CG1-CG1 4.17Å; V283-I287 WeakPolarHBondContact O-CG1 3.46Å; V283-I287 PolarHBondContact O-N 2.97Å; I287-T289 PolarHBondContact O-N 3.44Å; I287-V290 PolarHBondContact O-N 3.49Å; I287-L291 WeakPolarHBondContact O-CB 3.27Å; I287-L291 PolarHBondContact O-N 3.19Å
288	T	95.7	Very high	92.6	Very high	80 Å²	80	47.8 Å²	47.8	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-63.6	-42.7	-179.2	-56.3	0	0	0	0	111	A284 L285 L291 T292	A284-T288 WeakPolarHBondContact O-CB 3.47Å; A284-T288 PolarHBondContact O-N 3.34Å; A284-T288 PolarHBondContact O-OG1 3.36Å; L285-T288 PolarHBondContact O-N 2.7Å; T288-L291 WeakPolarHBondContact O-CB 3.3Å; T288-L291 PolarHBondContact O-N 2.93Å; T288-T292 PolarHBondContact O-N 3.3Å; T288-T292 PolarHBondContact O-OG1 2.84Å
289	T	95.1	Very high	92.7	Very high	11 Å²	11	49.8 Å²	49.8	7%	0.067	31%	0.307	C	S	.	.	H	α-helix	trans	-65	-39.3	178.1	48.3	0	0	0	0	112.8	I264 L285 G286 I287 T292 M293 V324	I264-T289 HydrophobicContact CG2-CG2 4.34Å; L285-T289 HydrophobicContact CD2-CG2 3.97Å; L285-T289 WeakPolarHBondContact O-CB 3.43Å; L285-T289 VanDerWaalsContact O-CG2 3.32Å; L285-T289 WeakPolarHBondContact O-CG2 3.46Å; L285-T289 PolarHBondContact O-N 3.15Å; L285-T289 PolarHBondContact O-OG1 3.23Å; G286-T289 WeakPolarHBondContact CA-OG1 3.19Å; G286-T289 PolarHBondContact O-OG1 3.14Å; I287-T289 PolarHBondContact O-N 3.44Å; T289-T292 PolarHBondContact O-N 2.76Å; T289-M293 WeakPolarHBondContact O-CB 3.44Å; T289-M293 PolarHBondContact O-N 3.21Å; T289-V324 WeakPolarHBondContact OG1-CG1 3.36Å
290	V	95.6	Very high	92.9	Very high	27 Å²	27	48 Å²	48	16%	0.164	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-43.8	172.1	172.1	0	0	0	0	111.2	G286 I287 M293 T294 F321 V324 L328	G286-V290 WeakPolarHBondContact O-CG2 3.37Å; G286-V290 PolarHBondContact O-N 2.94Å; G286-V290 VanDerWaalsContact O-N 3.17Å; I287-V290 PolarHBondContact O-N 3.49Å; V290-M293 PolarHBondContact O-N 3.32Å; V290-T294 WeakPolarHBondContact O-CB 3.48Å; V290-T294 PolarHBondContact O-N 2.84Å; V290-T294 PolarHBondContact O-OG1 3.45Å; V290-F321 HydrophobicContact CG1-CE2 3.92Å; V290-F321 HydrophobicContact CG1-CZ 4.3Å; V290-V324 HydrophobicContact CG2-CG1 3.77Å; V290-L328 HydrophobicContact CG2-CD2 4.41Å
291	L	95.3	Very high	92.7	Very high	107 Å²	107	51.9 Å²	51.9	56%	0.56	29%	0.291	S	S	*	.	H	α-helix	trans	-61.8	-48	176.5	179	62.5	0	0	0	110.9	I287 T288 M293 T294 T295	I287-L291 WeakPolarHBondContact O-CB 3.27Å; I287-L291 PolarHBondContact O-N 3.19Å; T288-L291 WeakPolarHBondContact O-CB 3.3Å; T288-L291 PolarHBondContact O-N 2.93Å; L291-M293 VanDerWaalsContact C-N 3.35Å; L291-M293 PolarHBondContact O-N 3.34Å; L291-T294 WeakPolarHBondContact O-CB 3.3Å; L291-T294 PolarHBondContact O-N 3.22Å; L291-T294 VanDerWaalsContact O-N 3.11Å; L291-T295 PolarHBondContact O-N 3.05Å; L291-T295 PolarHBondContact O-OG1 3.04Å
292	T	95.4	Very high	92.5	Very high	55 Å²	55	57.2 Å²	57.2	34%	0.337	31%	0.308	S	S	.	.	H	α-helix	trans	-60.2	-43.2	178.8	-48.5	0	0	0	0	111.8	I264 T288 T289 T294 T295 I296	I264-T292 HydrophobicContact CD1-CG2 3.47Å; I264-T292 VanDerWaalsContact CD1-CG2 3.47Å; I264-T292 HydrophobicContact CG1-CG2 4.2Å; T288-T292 PolarHBondContact O-N 3.3Å; T288-T292 PolarHBondContact O-OG1 2.84Å; T289-T292 PolarHBondContact O-N 2.76Å; T292-T294 VanDerWaalsContact C-N 3.32Å; T292-T294 PolarHBondContact O-N 3.04Å; T292-T295 PolarHBondContact O-N 3.37Å; T292-I296 WeakPolarHBondContact O-CG1 3.37Å; T292-I296 PolarHBondContact O-N 3.4Å
293	M	93.6	Very high	92.2	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.5	-39.5	175.4	-173	65	81.3	0	0	111.6	I264 T289 V290 L291 I296 N297 L317 C320 F321 V324	I264-M293 HydrophobicContact CG2-CE 4.46Å; T289-M293 WeakPolarHBondContact O-CB 3.44Å; T289-M293 PolarHBondContact O-N 3.21Å; V290-M293 PolarHBondContact O-N 3.32Å; L291-M293 VanDerWaalsContact C-N 3.35Å; L291-M293 PolarHBondContact O-N 3.34Å; M293-I296 PolarHBondContact O-N 2.86Å; M293-N297 VanDerWaalsContact O-CG 3.27Å; M293-N297 PolarHBondContact O-N 3.01Å; M293-L317 HydrophobicContact SD-CD2 4.5Å; M293-C320 HydrophobicContact CE-CB 3.35Å; M293-C320 HydrophobicContact SD-CB 4.3Å; M293-F321 HydrophobicContact CB-CD2 4.26Å; M293-F321 HydrophobicContact CG-CB 3.96Å; M293-F321 HydrophobicContact CG-CD2 3.85Å; M293-F321 HydrophobicContact CG-CG 4.42Å; M293-V324 HydrophobicContact CE-CG2 4.22Å
294	T	93.8	Very high	91.8	Very high	57 Å²	57	59 Å²	59	35%	0.35	32%	0.319	S	S	.	.	H	α-helix	trans	-62.9	-42.8	175.3	-54.7	0	0	0	0	111.2	V290 L291 T292 I296 N297 T298	V290-T294 WeakPolarHBondContact O-CB 3.48Å; V290-T294 PolarHBondContact O-N 2.84Å; V290-T294 PolarHBondContact O-OG1 3.45Å; L291-T294 WeakPolarHBondContact O-CB 3.3Å; L291-T294 PolarHBondContact O-N 3.22Å; L291-T294 VanDerWaalsContact O-N 3.11Å; T292-T294 VanDerWaalsContact C-N 3.32Å; T292-T294 PolarHBondContact O-N 3.04Å; T294-I296 PolarHBondContact O-N 3.3Å; T294-N297 WeakPolarHBondContact O-CB 3.3Å; T294-N297 PolarHBondContact O-N 3.43Å; T294-T298 WeakPolarHBondContact O-CG2 3.36Å; T294-T298 PolarHBondContact O-N 3.38Å; T294-T298 PolarHBondContact O-OG1 3.11Å
295	T	94.9	Very high	91.5	Very high	78 Å²	78	57.2 Å²	57.2	48%	0.479	30%	0.303	S	S	.	.	H	α-helix	trans	-62	-41.3	177.1	-54.2	0	0	0	0	112.4	L291 T292 T298 H299	L291-T295 PolarHBondContact O-N 3.05Å; L291-T295 PolarHBondContact O-OG1 3.04Å; T292-T295 PolarHBondContact O-N 3.37Å; T295-T298 WeakPolarHBondContact CA-OG1 3.44Å; T295-T298 PolarHBondContact O-N 3.3Å; T295-T298 PolarHBondContact O-OG1 3.21Å; T295-H299 WeakPolarHBondContact O-CB 3.37Å; T295-H299 PolarHBondContact O-N 3.22Å
296	I	93.4	Very high	90.9	Very high	31 Å²	31	65.3 Å²	65.3	16%	0.159	34%	0.336	C	S	.	.	H	α-helix	trans	-62.7	-44.5	174.5	-69.4	172.9	0	0	0	110.4	P260 I264 T292 M293 T294 T298 H299 L300 L317	P260-I296 HydrophobicContact CB-CD1 4.31Å; I264-I296 HydrophobicContact CD1-CD1 3.33Å; T292-I296 WeakPolarHBondContact O-CG1 3.37Å; T292-I296 PolarHBondContact O-N 3.4Å; M293-I296 PolarHBondContact O-N 2.86Å; T294-I296 PolarHBondContact O-N 3.3Å; I296-T298 VanDerWaalsContact C-N 3.34Å; I296-T298 PolarHBondContact O-N 3.32Å; I296-H299 PolarHBondContact O-N 3Å; I296-L300 HydrophobicContact CG2-CD1 3.86Å; I296-L300 WeakPolarHBondContact O-CG 3Å; I296-L300 PolarHBondContact O-N 3.29Å; I296-L317 HydrophobicContact CG2-CD2 4.23Å
297	N	89.9	Confident	90.6	Very high	24 Å²	24	66.3 Å²	66.3	13%	0.128	34%	0.34	C	S	.	.	H	α-helix	trans	-63.3	-38.4	178.8	-71.3	-10.8	0	0	0	112.8	M293 T294 R301 L317	M293-N297 VanDerWaalsContact O-CG 3.27Å; M293-N297 PolarHBondContact O-N 3.01Å; T294-N297 WeakPolarHBondContact O-CB 3.3Å; T294-N297 PolarHBondContact O-N 3.43Å; N297-R301 VanDerWaalsContact O-CG 3.32Å; N297-R301 WeakPolarHBondContact O-CG 3.44Å; N297-R301 PolarHBondContact O-N 3.15Å; N297-L317 VanDerWaalsContact OD1-CB 3.3Å; N297-L317 WeakPolarHBondContact OD1-CB 3.41Å; N297-L317 WeakPolarHBondContact OD1-CD1 3.45Å
298	T	91.1	Very high	90.2	Very high	68 Å²	68	68.1 Å²	68.1	42%	0.417	36%	0.358	S	S	.	.	H	α-helix	trans	-69	-43.3	176.1	50.2	0	0	0	0	111.4	T294 T295 I296 L300 R301 E302	T294-T298 WeakPolarHBondContact O-CG2 3.36Å; T294-T298 PolarHBondContact O-N 3.38Å; T294-T298 PolarHBondContact O-OG1 3.11Å; T295-T298 WeakPolarHBondContact CA-OG1 3.44Å; T295-T298 PolarHBondContact O-N 3.3Å; T295-T298 PolarHBondContact O-OG1 3.21Å; I296-T298 VanDerWaalsContact C-N 3.34Å; I296-T298 PolarHBondContact O-N 3.32Å; T298-L300 VanDerWaalsContact C-N 3.32Å; T298-L300 PolarHBondContact O-N 2.9Å; T298-R301 PolarHBondContact O-N 3.13Å; T298-R301 VanDerWaalsContact O-N 3.11Å; T298-E302 PolarHBondContact O-N 2.74Å
299	H	90.9	Very high	89.9	Confident	83 Å²	83	67.7 Å²	67.7	38%	0.384	35%	0.348	S	S	.	.	H	α-helix	trans	-59.3	-42.9	178.3	178.5	60.5	0	0	0	112	T295 I296 R301 E302 T303	T295-H299 WeakPolarHBondContact O-CB 3.37Å; T295-H299 PolarHBondContact O-N 3.22Å; I296-H299 PolarHBondContact O-N 3Å; H299-R301 VanDerWaalsContact C-N 3.29Å; H299-R301 PolarHBondContact O-N 3.24Å; H299-E302 PolarHBondContact O-N 3.05Å; H299-T303 PolarHBondContact O-N 3.07Å
300	L	87.5	Confident	89.7	Confident	15 Å²	15	71.9 Å²	71.9	8%	0.079	37%	0.373	C	S	.	.	H	α-helix	trans	-68.4	-26.2	178.1	-72.1	165.4	0	0	0	113.8	T257 I296 T298 E302 T303 L304 I313 L317	T257-L300 HydrophobicContact CG2-CD1 3.43Å; T257-L300 VanDerWaalsContact CG2-CD1 3.43Å; T257-L300 HydrophobicContact CG2-CD2 4.42Å; I296-L300 HydrophobicContact CG2-CD1 3.86Å; I296-L300 WeakPolarHBondContact O-CG 3Å; I296-L300 PolarHBondContact O-N 3.29Å; T298-L300 VanDerWaalsContact C-N 3.32Å; T298-L300 PolarHBondContact O-N 2.9Å; L300-E302 VanDerWaalsContact C-N 3.34Å; L300-T303 PolarHBondContact O-OG1 2.89Å; L300-L304 WeakPolarHBondContact O-CB 3.21Å; L300-L304 WeakPolarHBondContact O-CD1 3.31Å; L300-L304 WeakPolarHBondContact O-CG 3.27Å; L300-L304 PolarHBondContact O-N 3.29Å; L300-I313 HydrophobicContact CD1-CD1 4.5Å; L300-I313 HydrophobicContact CD2-CD1 4.47Å; L300-L317 HydrophobicContact CD1-CD1 3.34Å; L300-L317 HydrophobicContact CD1-CD2 4.35Å; L300-L317 HydrophobicContact CD1-CG 4.45Å
301	R	85.1	Confident	89.6	Confident	158 Å²	158	71.4 Å²	71.4	60%	0.596	37%	0.369	S	S	*	.	H	α-helix	trans	-76.7	-23.1	174.8	-73.7	174.3	179.4	-160.3	0.5	112.9	N297 T298 H299	N297-R301 VanDerWaalsContact O-CG 3.32Å; N297-R301 WeakPolarHBondContact O-CG 3.44Å; N297-R301 PolarHBondContact O-N 3.15Å; T298-R301 PolarHBondContact O-N 3.13Å; T298-R301 VanDerWaalsContact O-N 3.11Å; H299-R301 VanDerWaalsContact C-N 3.29Å; H299-R301 PolarHBondContact O-N 3.24Å
302	E	87.9	Confident	89.5	Confident	158 Å²	158	66.3 Å²	66.3	74%	0.738	34%	0.342	S	S	*	.	H	α-helix	trans	-79.6	-33.6	176.6	-70.5	176.1	175.7	0	0	112	T298 H299 L300	T298-E302 PolarHBondContact O-N 2.74Å; H299-E302 PolarHBondContact O-N 3.05Å; L300-E302 VanDerWaalsContact C-N 3.34Å
303	T	85.4	Confident	89.4	Confident	73 Å²	73	63.7 Å²	63.7	45%	0.448	33%	0.326	S	S	.	.	H	α-helix	trans	-81.5	-18.8	-179.5	57	0	0	0	0	113.6	H299 L300	H299-T303 PolarHBondContact O-N 3.07Å; L300-T303 PolarHBondContact O-OG1 2.89Å
304	L	84.2	Confident	89.4	Confident	17 Å²	17	65.3 Å²	65.3	9%	0.089	34%	0.335	C	S	.	.	S	Bend	trans	-104.9	150.8	-177.4	-60	177.1	0	0	0	112.6	Y173 L300 K306	Y173-L304 HydrophobicContact CD1-CD1 4.14Å; Y173-L304 HydrophobicContact CE1-CD1 3.63Å; Y173-L304 HydrophobicContact CE1-CD2 3.66Å; Y173-L304 HydrophobicContact CE1-CG 4.32Å; Y173-L304 HydrophobicContact CE2-CD2 4.07Å; Y173-L304 WeakPolarHBondContact OH-CD2 3.36Å; L300-L304 WeakPolarHBondContact O-CB 3.21Å; L300-L304 WeakPolarHBondContact O-CD1 3.31Å; L300-L304 WeakPolarHBondContact O-CG 3.27Å; L300-L304 PolarHBondContact O-N 3.29Å; L304-K306 PolarHBondContact O-N 3.22Å
305	P	86.3	Confident	89.4	Confident	16 Å²	16	65.7 Å²	65.7	10%	0.104	33%	0.334	C	S	.	.			trans	-51.8	141.9	166.6	20.7	-33.8	0	0	0	111.7	E82 L170 I307	E82-P305 HydrophobicContact CB-CG 4.08Å; E82-P305 WeakPolarHBondContact O-CG 3.26Å; L170-P305 HydrophobicContact CD1-CG 4.03Å; P305-I307 HydrophobicContact CB-CD1 4.07Å; P305-I307 HydrophobicContact CB-CG1 3.89Å; P305-I307 HydrophobicContact CG-CD1 3.62Å; P305-I307 HydrophobicContact CG-CG1 3.99Å; P305-I307 PolarHBondContact O-N 3.48Å
306	K	82.2	Confident	89.4	Confident	209 Å²	209	62 Å²	62	91%	0.909	31%	0.312	S	S	*	.			trans	-74.1	93.4	171.9	-67.1	-178.4	-176.7	176.4	0	109.5	L304	L304-K306 PolarHBondContact O-N 3.22Å
307	I	85.1	Confident	89.4	Confident	27 Å²	27	60.8 Å²	60.8	14%	0.138	31%	0.305	C	S	.	.			trans	-105.3	137.4	-178.9	-63.8	176.7	0	0	0	109.3	L170 P305 Y309	L170-I307 HydrophobicContact CB-CD1 3.96Å; L170-I307 HydrophobicContact CD1-CD1 3.26Å; L170-I307 HydrophobicContact CG-CD1 4.19Å; P305-I307 HydrophobicContact CB-CD1 4.07Å; P305-I307 HydrophobicContact CB-CG1 3.89Å; P305-I307 HydrophobicContact CG-CD1 3.62Å; P305-I307 HydrophobicContact CG-CG1 3.99Å; P305-I307 PolarHBondContact O-N 3.48Å; I307-Y309 VanDerWaalsContact C-N 3.27Å; I307-Y309 HydrophobicContact CG2-CD1 3.32Å; I307-Y309 HydrophobicContact CG2-CD2 3.65Å; I307-Y309 HydrophobicContact CG2-CE1 3.11Å; I307-Y309 HydrophobicContact CG2-CE2 3.43Å; I307-Y309 VanDerWaalsContact CG2-CE2 3.43Å; I307-Y309 HydrophobicContact CG2-CG 3.6Å; I307-Y309 PolarHBondContact O-N 3.14Å
308	P	86	Confident	89.6	Confident	136 Å²	136	64.1 Å²	64.1	88%	0.883	32%	0.321	S	S	*	.	S	Bend	trans	-78.3	-3.9	-173.9	31.9	-37	0	0	0	114.6
309	Y	89.3	Confident	89.8	Confident	72 Å²	72	61.6 Å²	61.6	28%	0.282	31%	0.309	S	S	.	.	S	Bend	trans	-107.9	156.1	179.4	55.4	-105.5	0	0	0	112.4	L170 R171 I307	L170-Y309 HydrophobicContact CB-CE2 4.33Å; L170-Y309 PolarHBondContact N-OH 3.46Å; L170-Y309 VanDerWaalsContact N-OH 3.12Å; R171-Y309 HydrophobicContact CB-CE2 4.5Å; R171-Y309 HydrophobicContact CG-CD2 3.81Å; R171-Y309 HydrophobicContact CG-CE2 3.76Å; I307-Y309 VanDerWaalsContact C-N 3.27Å; I307-Y309 HydrophobicContact CG2-CD1 3.32Å; I307-Y309 HydrophobicContact CG2-CD2 3.65Å; I307-Y309 HydrophobicContact CG2-CE1 3.11Å; I307-Y309 HydrophobicContact CG2-CE2 3.43Å; I307-Y309 VanDerWaalsContact CG2-CE2 3.43Å; I307-Y309 HydrophobicContact CG2-CG 3.6Å; I307-Y309 PolarHBondContact O-N 3.14Å
310	V	90.6	Very high	90	Very high	98 Å²	98	57.7 Å²	57.7	59%	0.594	29%	0.291	S	S	*	.			trans	-74.2	129.1	179.4	-176.9	0	0	0	0	109.8	D314 I315	V310-D314 HydrophobicContact CG1-CB 4.12Å; V310-I315 HydrophobicContact CG1-CD1 3.93Å; V310-I315 HydrophobicContact CG1-CG1 3.54Å
311	K	93.1	Very high	90.4	Very high	17 Å²	17	59.6 Å²	59.6	7%	0.074	30%	0.298	C	S	.	.			trans	-95.3	158.1	176.5	-57.1	177.2	-61	-57	0	110.8	R171 I313 D314 I315	R171-K311 CarbonylContact O-C 3.51Å; K311-I313 VanDerWaalsContact C-N 3.28Å; K311-I313 HydrophobicContact CB-CG2 4.05Å; K311-I313 PolarHBondContact O-N 2.89Å; K311-D314 WeakPolarHBondContact CB-OD2 3.33Å; K311-D314 PolarHBondContact N-OD2 3.43Å; K311-D314 VanDerWaalsContact NZ-CG 3.26Å; K311-D314 IonicContact NZ-OD1 3.56Å; K311-D314 PolarHBondContact NZ-OD1 2.87Å; K311-D314 VanDerWaalsContact NZ-OD1 3.1Å; K311-D314 IonicContact NZ-OD2 2.93Å; K311-D314 PolarHBondContact NZ-OD2 3.35Å; K311-D314 WeakPolarHBondContact O-CB 3.31Å; K311-D314 PolarHBondContact O-N 2.83Å; K311-I315 PolarHBondContact O-N 3.31Å; K311-I315 VanDerWaalsContact O-N 3.15Å
312	A	93.9	Very high	90.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-54.1	-45	175.7	0	0	0	0	0	112.2	R171 D314 I315 Y316 Y477 Y481	R171-A312 PolarHBondContact O-N 3.01Å; A312-D314 VanDerWaalsContact C-N 3.28Å; A312-D314 PolarHBondContact O-N 3.45Å; A312-I315 WeakPolarHBondContact O-CB 3.32Å; A312-I315 PolarHBondContact O-N 2.97Å; A312-I315 VanDerWaalsContact O-N 3.13Å; A312-Y316 PolarHBondContact O-N 3.01Å; A312-Y477 WeakPolarHBondContact O-CE2 3.31Å; A312-Y477 PolarHBondContact O-OH 3.09Å; A312-Y481 HydrophobicContact CB-CD1 3.48Å; A312-Y481 VanDerWaalsContact CB-CD1 3.48Å; A312-Y481 HydrophobicContact CB-CD2 4.26Å; A312-Y481 HydrophobicContact CB-CE1 3.34Å; A312-Y481 HydrophobicContact CB-CE2 4.15Å; A312-Y481 HydrophobicContact CB-CG 3.97Å
313	I	93.5	Very high	91.3	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-59.2	-36.2	174.8	-160.8	167.8	0	0	0	113.3	Y173 T257 L300 K311 I315 Y316 L317	Y173-I313 HydrophobicContact CD1-CB 4.36Å; Y173-I313 HydrophobicContact CD1-CG2 3.78Å; Y173-I313 HydrophobicContact CE1-CD1 4.23Å; Y173-I313 HydrophobicContact CE1-CG2 4.3Å; Y173-I313 PolarHBondContact O-N 3.3Å; Y173-I313 VanDerWaalsContact O-N 3.09Å; T257-I313 HydrophobicContact CG2-CD1 4.05Å; T257-I313 HydrophobicContact CG2-CG1 4.37Å; L300-I313 HydrophobicContact CD1-CD1 4.5Å; L300-I313 HydrophobicContact CD2-CD1 4.47Å; K311-I313 VanDerWaalsContact C-N 3.28Å; K311-I313 HydrophobicContact CB-CG2 4.05Å; K311-I313 PolarHBondContact O-N 2.89Å; I313-I315 VanDerWaalsContact C-N 3.33Å; I313-Y316 PolarHBondContact O-N 3.2Å; I313-L317 HydrophobicContact CG1-CD1 4.05Å; I313-L317 HydrophobicContact CG1-CG 4.5Å; I313-L317 WeakPolarHBondContact O-CB 3.29Å; I313-L317 VanDerWaalsContact O-CG 3.27Å; I313-L317 WeakPolarHBondContact O-CG 3.49Å; I313-L317 PolarHBondContact O-N 2.88Å
314	D	92.8	Very high	91.8	Very high	34 Å²	34	45.9 Å²	45.9	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-67.9	-37.5	178.6	-59.7	-35.3	0	0	0	110.4	V310 K311 A312 M318	V310-D314 HydrophobicContact CG1-CB 4.12Å; K311-D314 WeakPolarHBondContact CB-OD2 3.33Å; K311-D314 PolarHBondContact N-OD2 3.43Å; K311-D314 VanDerWaalsContact NZ-CG 3.26Å; K311-D314 IonicContact NZ-OD1 3.56Å; K311-D314 PolarHBondContact NZ-OD1 2.87Å; K311-D314 VanDerWaalsContact NZ-OD1 3.1Å; K311-D314 IonicContact NZ-OD2 2.93Å; K311-D314 PolarHBondContact NZ-OD2 3.35Å; K311-D314 WeakPolarHBondContact O-CB 3.31Å; K311-D314 PolarHBondContact O-N 2.83Å; A312-D314 VanDerWaalsContact C-N 3.28Å; A312-D314 PolarHBondContact O-N 3.45Å; D314-M318 VanDerWaalsContact O-CB 3.24Å; D314-M318 WeakPolarHBondContact O-CB 3.42Å; D314-M318 VanDerWaalsContact O-CG 3.3Å; D314-M318 WeakPolarHBondContact O-CG 3.3Å; D314-M318 PolarHBondContact O-N 3.29Å
315	I	94.1	Very high	92.3	Very high	65 Å²	65	49.5 Å²	49.5	33%	0.333	26%	0.256	S	S	.	.	H	α-helix	trans	-64.7	-42.9	175.9	-68.1	164.1	0	0	0	110.2	V310 K311 A312 I313 G319 Y481	V310-I315 HydrophobicContact CG1-CD1 3.93Å; V310-I315 HydrophobicContact CG1-CG1 3.54Å; K311-I315 PolarHBondContact O-N 3.31Å; K311-I315 VanDerWaalsContact O-N 3.15Å; A312-I315 WeakPolarHBondContact O-CB 3.32Å; A312-I315 PolarHBondContact O-N 2.97Å; A312-I315 VanDerWaalsContact O-N 3.13Å; I313-I315 VanDerWaalsContact C-N 3.33Å; I315-G319 PolarHBondContact O-N 3.21Å; I315-Y481 WeakPolarHBondContact CD1-OH 3.3Å
316	Y	95.2	Very high	92.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-51.1	177.1	-171.7	-98	0	0	0	112.1	Y258 I262 A312 I313 G319 C320 F473 N474 Y477	Y258-Y316 AromaticContact CD1-CD1 3.51Å; Y258-Y316 HydrophobicContact CD1-CD1 3.51Å; Y258-Y316 HydrophobicContact CD1-CD2 4.12Å; Y258-Y316 AromaticContact CD1-CE1 3.4Å; Y258-Y316 HydrophobicContact CD1-CE1 3.4Å; Y258-Y316 VanDerWaalsContact CD1-CE1 3.4Å; Y258-Y316 HydrophobicContact CD1-CE2 4.02Å; Y258-Y316 AromaticContact CD1-CG 3.88Å; Y258-Y316 HydrophobicContact CD1-CG 3.88Å; Y258-Y316 AromaticContact CD1-CZ 3.66Å; Y258-Y316 AromaticContact CE1-CD1 3.63Å; Y258-Y316 HydrophobicContact CE1-CD1 3.63Å; Y258-Y316 AromaticContact CE1-CD2 3.89Å; Y258-Y316 HydrophobicContact CE1-CD2 3.89Å; Y258-Y316 AromaticContact CE1-CE1 4Å; Y258-Y316 HydrophobicContact CE1-CE1 4Å; Y258-Y316 HydrophobicContact CE1-CE2 4.23Å; Y258-Y316 AromaticContact CE1-CG 3.57Å; Y258-Y316 HydrophobicContact CE1-CG 3.57Å; Y258-Y316 HydrophobicContact CG-CE1 4.35Å; I262-Y316 WeakPolarHBondContact CD1-OH 3.4Å; I262-Y316 WeakPolarHBondContact CG1-OH 3.25Å; A312-Y316 PolarHBondContact O-N 3.01Å; I313-Y316 PolarHBondContact O-N 3.2Å; Y316-G319 PolarHBondContact O-N 3.37Å; Y316-C320 VanDerWaalsContact CE1-SG 3.54Å; Y316-C320 PolarHBondContact O-N 2.76Å; Y316-C320 PolarHBondContact O-SG 3.5Å; Y316-F473 AromaticContact CD2-CE1 3.95Å; Y316-F473 HydrophobicContact CD2-CE1 3.95Å; Y316-F473 HydrophobicContact CD2-CZ 4.36Å; Y316-F473 HydrophobicContact CE2-CE1 4.05Å; Y316-N474 WeakPolarHBondContact CE2-OD1 3.11Å; Y316-N474 PolarHBondContact OH-OD1 3.11Å; Y316-N474 VanDerWaalsContact OH-OD1 3.13Å; Y316-Y477 AromaticContact CD2-CD1 3.66Å; Y316-Y477 HydrophobicContact CD2-CD1 3.66Å; Y316-Y477 HydrophobicContact CD2-CD2 4.01Å; Y316-Y477 AromaticContact CD2-CE1 3.69Å; Y316-Y477 HydrophobicContact CD2-CE1 3.69Å; Y316-Y477 HydrophobicContact CD2-CE2 4.04Å; Y316-Y477 AromaticContact CD2-CG 3.84Å; Y316-Y477 HydrophobicContact CD2-CG 3.84Å; Y316-Y477 AromaticContact CD2-CZ 3.89Å; Y316-Y477 HydrophobicContact CE2-CD1 4.17Å; Y316-Y477 HydrophobicContact CE2-CE1 4.41Å; Y316-Y477 HydrophobicContact CG-CE1 4.27Å; Y316-Y477 HydrophobicContact CG-CE2 4.33Å
317	L	93.9	Very high	93.2	Very high	5 Å²	5	42.5 Å²	42.5	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-67	-40	-178.5	-70.3	168.6	0	0	0	112.9	T257 S261 M293 I296 N297 L300 I313 G319 C320 F321	T257-L317 HydrophobicContact CG2-CD1 4.43Å; T257-L317 HydrophobicContact CG2-CD2 3.98Å; S261-L317 WeakPolarHBondContact OG-CD2 3.38Å; M293-L317 HydrophobicContact SD-CD2 4.5Å; I296-L317 HydrophobicContact CG2-CD2 4.23Å; N297-L317 VanDerWaalsContact OD1-CB 3.3Å; N297-L317 WeakPolarHBondContact OD1-CB 3.41Å; N297-L317 WeakPolarHBondContact OD1-CD1 3.45Å; L300-L317 HydrophobicContact CD1-CD1 3.34Å; L300-L317 HydrophobicContact CD1-CD2 4.35Å; L300-L317 HydrophobicContact CD1-CG 4.45Å; I313-L317 HydrophobicContact CG1-CD1 4.05Å; I313-L317 HydrophobicContact CG1-CG 4.5Å; I313-L317 WeakPolarHBondContact O-CB 3.29Å; I313-L317 VanDerWaalsContact O-CG 3.27Å; I313-L317 WeakPolarHBondContact O-CG 3.49Å; I313-L317 PolarHBondContact O-N 2.88Å; L317-G319 VanDerWaalsContact C-N 3.34Å; L317-C320 PolarHBondContact O-N 2.94Å; L317-F321 VanDerWaalsContact O-CB 3.29Å; L317-F321 WeakPolarHBondContact O-CB 3.47Å; L317-F321 PolarHBondContact O-N 3.27Å
318	M	93.8	Very high	93.5	Very high	95 Å²	95	43.2 Å²	43.2	47%	0.468	23%	0.231	S	C	.	.	H	α-helix	trans	-65.3	-38.6	172.6	-77.4	-60.4	-156.1	0	0	111.6	D314 F321 V322	D314-M318 VanDerWaalsContact O-CB 3.24Å; D314-M318 WeakPolarHBondContact O-CB 3.42Å; D314-M318 VanDerWaalsContact O-CG 3.3Å; D314-M318 WeakPolarHBondContact O-CG 3.3Å; D314-M318 PolarHBondContact O-N 3.29Å; M318-F321 PolarHBondContact O-N 3.49Å; M318-V322 VanDerWaalsContact O-CG2 3.3Å; M318-V322 WeakPolarHBondContact O-CG2 3.45Å; M318-V322 PolarHBondContact O-N 3.24Å
319	G	94.9	Very high	93.8	Very high	15 Å²	15	40.7 Å²	40.7	16%	0.155	21%	0.21	C	C	.	.	H	α-helix	trans	-57.1	-52.4	172.3	0	0	0	0	0	111.6	I315 Y316 L317 F321 V322 F323	I315-G319 PolarHBondContact O-N 3.21Å; Y316-G319 PolarHBondContact O-N 3.37Å; L317-G319 VanDerWaalsContact C-N 3.34Å; G319-F321 VanDerWaalsContact C-N 3.33Å; G319-F321 PolarHBondContact O-N 3.45Å; G319-V322 PolarHBondContact O-N 2.92Å; G319-F323 WeakPolarHBondContact O-CD2 3.37Å; G319-F323 PolarHBondContact O-N 2.85Å; G319-F323 VanDerWaalsContact O-N 3.14Å
320	C	95.6	Very high	93.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-40.4	178.1	-60.9	0	0	0	0	112	M293 Y316 L317 V322 F323 V324	M293-C320 HydrophobicContact CE-CB 3.35Å; M293-C320 HydrophobicContact SD-CB 4.3Å; Y316-C320 VanDerWaalsContact CE1-SG 3.54Å; Y316-C320 PolarHBondContact O-N 2.76Å; Y316-C320 PolarHBondContact O-SG 3.5Å; L317-C320 PolarHBondContact O-N 2.94Å; C320-V322 VanDerWaalsContact C-N 3.34Å; C320-V322 PolarHBondContact O-N 3.11Å; C320-F323 PolarHBondContact O-N 3.42Å; C320-V324 WeakPolarHBondContact O-CG2 3.47Å; C320-V324 PolarHBondContact O-N 2.86Å
321	F	95.4	Very high	93.8	Very high	55 Å²	55	34.1 Å²	34.1	24%	0.241	18%	0.175	C	C	.	.	H	α-helix	trans	-59.1	-43.1	174.9	-179.2	-93.8	0	0	0	112.2	V290 M293 L317 M318 G319 F323 V324 F325	V290-F321 HydrophobicContact CG1-CE2 3.92Å; V290-F321 HydrophobicContact CG1-CZ 4.3Å; M293-F321 HydrophobicContact CB-CD2 4.26Å; M293-F321 HydrophobicContact CG-CB 3.96Å; M293-F321 HydrophobicContact CG-CD2 3.85Å; M293-F321 HydrophobicContact CG-CG 4.42Å; L317-F321 VanDerWaalsContact O-CB 3.29Å; L317-F321 WeakPolarHBondContact O-CB 3.47Å; L317-F321 PolarHBondContact O-N 3.27Å; M318-F321 PolarHBondContact O-N 3.49Å; G319-F321 VanDerWaalsContact C-N 3.33Å; G319-F321 PolarHBondContact O-N 3.45Å; F321-F323 PolarHBondContact O-N 3.16Å; F321-V324 PolarHBondContact O-N 2.89Å; F321-F325 VanDerWaalsContact O-CB 3.3Å; F321-F325 WeakPolarHBondContact O-CB 3.44Å; F321-F325 PolarHBondContact O-N 2.86Å
322	V	95.9	Very high	93.6	Very high	74 Å²	74	35.6 Å²	35.6	45%	0.448	19%	0.19	S	C	.	.	H	α-helix	trans	-62	-42.6	176.1	169.8	0	0	0	0	111.1	M318 G319 C320 F325 L326	M318-V322 VanDerWaalsContact O-CG2 3.3Å; M318-V322 WeakPolarHBondContact O-CG2 3.45Å; M318-V322 PolarHBondContact O-N 3.24Å; G319-V322 PolarHBondContact O-N 2.92Å; C320-V322 VanDerWaalsContact C-N 3.34Å; C320-V322 PolarHBondContact O-N 3.11Å; V322-F325 PolarHBondContact O-N 3.47Å; V322-L326 HydrophobicContact CG1-CD1 3.88Å; V322-L326 HydrophobicContact CG1-CG 4.25Å; V322-L326 WeakPolarHBondContact O-CB 3.44Å; V322-L326 VanDerWaalsContact O-CG 3.25Å; V322-L326 WeakPolarHBondContact O-CG 3.49Å; V322-L326 PolarHBondContact O-N 3.39Å
323	F	95.6	Very high	93.3	Very high	28 Å²	28	41 Å²	41	12%	0.123	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-44.6	176.5	-77.8	-74.1	0	0	0	112.8	T265 G319 C320 F321 F325 L326 A327 F466 T469 F470 F473	T265-F323 HydrophobicContact CG2-CB 3.93Å; G319-F323 WeakPolarHBondContact O-CD2 3.37Å; G319-F323 PolarHBondContact O-N 2.85Å; G319-F323 VanDerWaalsContact O-N 3.14Å; C320-F323 PolarHBondContact O-N 3.42Å; F321-F323 PolarHBondContact O-N 3.16Å; F323-F325 VanDerWaalsContact C-N 3.33Å; F323-F325 PolarHBondContact O-N 3.25Å; F323-L326 PolarHBondContact O-N 3.12Å; F323-A327 PolarHBondContact O-N 2.96Å; F323-F466 HydrophobicContact CD1-CD1 4.33Å; F323-T469 WeakPolarHBondContact CE1-OG1 3.33Å; F323-F470 AromaticContact CD2-CD2 3.66Å; F323-F470 HydrophobicContact CD2-CD2 3.66Å; F323-F470 HydrophobicContact CD2-CE2 4.28Å; F323-F470 HydrophobicContact CE1-CB 4.37Å; F323-F470 AromaticContact CE2-CD2 3.84Å; F323-F470 HydrophobicContact CE2-CD2 3.84Å; F323-F470 HydrophobicContact CG-CD2 4.12Å; F323-F470 HydrophobicContact CZ-CB 4.38Å; F323-F470 HydrophobicContact CZ-CD2 4.41Å; F323-F473 HydrophobicContact CE2-CB 4.07Å; F323-F473 HydrophobicContact CE2-CD1 4.2Å; F323-F473 HydrophobicContact CE2-CG 4.02Å; F323-F473 HydrophobicContact CZ-CB 4.21Å
324	V	95.6	Very high	92.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.4	-41.6	176.6	174.9	0	0	0	0	110.8	T265 T289 V290 M293 C320 F321 A327 L328	T265-V324 HydrophobicContact CG2-CG2 4.45Å; T289-V324 WeakPolarHBondContact OG1-CG1 3.36Å; V290-V324 HydrophobicContact CG2-CG1 3.77Å; M293-V324 HydrophobicContact CE-CG2 4.22Å; C320-V324 WeakPolarHBondContact O-CG2 3.47Å; C320-V324 PolarHBondContact O-N 2.86Å; F321-V324 PolarHBondContact O-N 2.89Å; V324-A327 PolarHBondContact O-N 2.6Å; V324-L328 PolarHBondContact O-N 3.2Å
325	F	95.2	Very high	92.6	Very high	92 Å²	92	42 Å²	42	40%	0.404	22%	0.219	S	C	.	.	H	α-helix	trans	-65	-41.3	176.8	-176.9	-106.2	0	0	0	112.4	F321 V322 F323 A327 L328 L329	F321-F325 VanDerWaalsContact O-CB 3.3Å; F321-F325 WeakPolarHBondContact O-CB 3.44Å; F321-F325 PolarHBondContact O-N 2.86Å; V322-F325 PolarHBondContact O-N 3.47Å; F323-F325 VanDerWaalsContact C-N 3.33Å; F323-F325 PolarHBondContact O-N 3.25Å; F325-A327 VanDerWaalsContact C-N 3.31Å; F325-A327 PolarHBondContact O-N 3.42Å; F325-L328 PolarHBondContact O-N 3.46Å; F325-L329 HydrophobicContact CD1-CD1 3.86Å; F325-L329 HydrophobicContact CD1-CG 4.28Å; F325-L329 HydrophobicContact CE1-CD1 3.42Å; F325-L329 VanDerWaalsContact CE1-CD1 3.42Å; F325-L329 HydrophobicContact CE1-CD2 4.44Å; F325-L329 HydrophobicContact CE1-CG 3.93Å; F325-L329 HydrophobicContact CZ-CD1 4.08Å; F325-L329 HydrophobicContact CZ-CD2 4.29Å; F325-L329 HydrophobicContact CZ-CG 4.18Å; F325-L329 PolarHBondContact O-N 3.26Å
326	L	94.6	Very high	92.2	Very high	76 Å²	76	45.9 Å²	45.9	40%	0.398	23%	0.23	S	C	.	.	H	α-helix	trans	-64.1	-34.9	175.1	-73.7	173.3	0	0	0	112.1	V322 F323 L328 L329 E330 F466	V322-L326 HydrophobicContact CG1-CD1 3.88Å; V322-L326 HydrophobicContact CG1-CG 4.25Å; V322-L326 WeakPolarHBondContact O-CB 3.44Å; V322-L326 VanDerWaalsContact O-CG 3.25Å; V322-L326 WeakPolarHBondContact O-CG 3.49Å; V322-L326 PolarHBondContact O-N 3.39Å; F323-L326 PolarHBondContact O-N 3.12Å; L326-L328 VanDerWaalsContact C-N 3.33Å; L326-L329 HydrophobicContact CD2-CD1 4.3Å; L326-L329 PolarHBondContact O-N 3.2Å; L326-E330 WeakPolarHBondContact O-CB 3.27Å; L326-E330 PolarHBondContact O-N 3Å; L326-F466 HydrophobicContact CB-CE1 3.83Å; L326-F466 HydrophobicContact CB-CZ 4Å
327	A	92.3	Very high	91.6	Very high	3 Å²	3	47.5 Å²	47.5	3%	0.025	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-37.2	173.7	0	0	0	0	0	112.1	F272 F323 V324 F325 E330 Y331 F466	F272-A327 HydrophobicContact CE1-CB 4.23Å; F272-A327 HydrophobicContact CZ-CB 3.86Å; F323-A327 PolarHBondContact O-N 2.96Å; V324-A327 PolarHBondContact O-N 2.6Å; F325-A327 VanDerWaalsContact C-N 3.31Å; F325-A327 PolarHBondContact O-N 3.42Å; A327-E330 WeakPolarHBondContact O-CB 3.24Å; A327-E330 PolarHBondContact O-N 3.04Å; A327-Y331 PolarHBondContact O-N 3Å; A327-F466 HydrophobicContact CB-CE1 4.24Å
328	L	92.2	Very high	90.7	Very high	42 Å²	42	50.5 Å²	50.5	22%	0.22	25%	0.252	C	S	.	.	H	α-helix	trans	-68.5	-39.8	173.1	179.5	64	0	0	0	112.2	V290 V324 F325 L326 E330 Y331 A332	V290-L328 HydrophobicContact CG2-CD2 4.41Å; V324-L328 PolarHBondContact O-N 3.2Å; F325-L328 PolarHBondContact O-N 3.46Å; L326-L328 VanDerWaalsContact C-N 3.33Å; L328-E330 VanDerWaalsContact C-N 3.32Å; L328-Y331 PolarHBondContact O-N 3.43Å; L328-A332 PolarHBondContact O-N 2.96Å; L328-A332 VanDerWaalsContact O-N 3.12Å
329	L	92.1	Very high	89.8	Confident	82 Å²	82	52.1 Å²	52.1	43%	0.429	26%	0.256	S	S	.	.	H	α-helix	trans	-65.7	-34.9	175.6	-74.7	-178.1	0	0	0	112.6	F325 L326 Y331 A332 F333	F325-L329 HydrophobicContact CD1-CD1 3.86Å; F325-L329 HydrophobicContact CD1-CG 4.28Å; F325-L329 HydrophobicContact CE1-CD1 3.42Å; F325-L329 VanDerWaalsContact CE1-CD1 3.42Å; F325-L329 HydrophobicContact CE1-CD2 4.44Å; F325-L329 HydrophobicContact CE1-CG 3.93Å; F325-L329 HydrophobicContact CZ-CD1 4.08Å; F325-L329 HydrophobicContact CZ-CD2 4.29Å; F325-L329 HydrophobicContact CZ-CG 4.18Å; F325-L329 PolarHBondContact O-N 3.26Å; L326-L329 HydrophobicContact CD2-CD1 4.3Å; L326-L329 PolarHBondContact O-N 3.2Å; L329-Y331 VanDerWaalsContact C-N 3.33Å; L329-Y331 PolarHBondContact O-N 3.08Å; L329-A332 PolarHBondContact O-N 3.41Å; L329-F333 WeakPolarHBondContact O-CB 3.42Å; L329-F333 PolarHBondContact O-N 2.87Å
330	E	91.8	Very high	88.5	Confident	15 Å²	15	53.3 Å²	53.3	7%	0.07	27%	0.269	C	S	.	.	H	α-helix	trans	-57.8	-47.6	174.1	-171.3	-85.5	-179.3	0	0	110.8	F272 L326 A327 L328 A332 F333 V334 I458 S462	F272-E330 HydrophobicContact CE1-CB 4.16Å; F272-E330 HydrophobicContact CE1-CG 3.98Å; L326-E330 WeakPolarHBondContact O-CB 3.27Å; L326-E330 PolarHBondContact O-N 3Å; A327-E330 WeakPolarHBondContact O-CB 3.24Å; A327-E330 PolarHBondContact O-N 3.04Å; L328-E330 VanDerWaalsContact C-N 3.32Å; E330-A332 PolarHBondContact O-N 3.07Å; E330-F333 WeakPolarHBondContact O-CB 3.3Å; E330-F333 PolarHBondContact O-N 3.22Å; E330-F333 VanDerWaalsContact O-N 3.15Å; E330-V334 WeakPolarHBondContact O-CG2 3.46Å; E330-V334 PolarHBondContact O-N 3.35Å; E330-I458 HydrophobicContact CG-CG2 4.49Å; E330-S462 WeakPolarHBondContact CG-OG 3.35Å; E330-S462 PolarHBondContact OE1-OG 3.49Å
331	Y	88.1	Confident	87	Confident	18 Å²	18	60.3 Å²	60.3	7%	0.071	30%	0.295	C	S	.	.	H	α-helix	trans	-60.9	-44.1	174.7	166.4	-100.5	0	0	0	112	S279 R282 V283 A327 L328 L329 F333 V334 N335	S279-Y331 VanDerWaalsContact CA-OH 3.31Å; S279-Y331 WeakPolarHBondContact CA-OH 3.4Å; S279-Y331 WeakPolarHBondContact CB-OH 3.48Å; S279-Y331 PolarHBondContact O-OH 3.02Å; R282-Y331 HydrophobicContact CB-CD2 3.61Å; R282-Y331 HydrophobicContact CB-CE2 3.77Å; R282-Y331 HydrophobicContact CB-CG 4.11Å; R282-Y331 HydrophobicContact CG-CD2 4.17Å; R282-Y331 HydrophobicContact CG-CE2 4.39Å; V283-Y331 HydrophobicContact CB-CE1 4.47Å; V283-Y331 HydrophobicContact CG2-CD1 3.92Å; V283-Y331 HydrophobicContact CG2-CE1 3.13Å; A327-Y331 PolarHBondContact O-N 3Å; L328-Y331 PolarHBondContact O-N 3.43Å; L329-Y331 VanDerWaalsContact C-N 3.33Å; L329-Y331 PolarHBondContact O-N 3.08Å; Y331-F333 PolarHBondContact O-N 3.04Å; Y331-V334 PolarHBondContact O-N 3.01Å; Y331-N335 HydrophobicContact CE1-CB 4.48Å; Y331-N335 HydrophobicContact CE2-CB 4.41Å; Y331-N335 VanDerWaalsContact O-CB 3.27Å; Y331-N335 WeakPolarHBondContact O-CB 3.48Å; Y331-N335 PolarHBondContact O-N 2.87Å
332	A	88.8	Confident	85.6	Confident	47 Å²	47	58.5 Å²	58.5	39%	0.388	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-38	177.6	0	0	0	0	0	111.6	L328 L329 E330 Y336	L328-A332 PolarHBondContact O-N 2.96Å; L328-A332 VanDerWaalsContact O-N 3.12Å; L329-A332 PolarHBondContact O-N 3.41Å; E330-A332 PolarHBondContact O-N 3.07Å; A332-Y336 VanDerWaalsContact O-CB 3.3Å; A332-Y336 WeakPolarHBondContact O-CB 3.39Å; A332-Y336 PolarHBondContact O-N 3.29Å
333	F	88	Confident	84	Confident	115 Å²	115	58.4 Å²	58.4	50%	0.504	29%	0.293	S	S	.	.	H	α-helix	trans	-67.8	-46.2	176.1	-175.5	-105.4	0	0	0	112.4	L329 E330 Y331 N335 Y336 I337 I458	L329-F333 WeakPolarHBondContact O-CB 3.42Å; L329-F333 PolarHBondContact O-N 2.87Å; E330-F333 WeakPolarHBondContact O-CB 3.3Å; E330-F333 PolarHBondContact O-N 3.22Å; E330-F333 VanDerWaalsContact O-N 3.15Å; Y331-F333 PolarHBondContact O-N 3.04Å; F333-N335 VanDerWaalsContact C-N 3.33Å; F333-N335 PolarHBondContact O-N 2.71Å; F333-Y336 PolarHBondContact O-N 3.44Å; F333-I337 HydrophobicContact CD1-CD1 3.92Å; F333-I337 HydrophobicContact CE1-CD1 3.33Å; F333-I337 HydrophobicContact CE1-CG1 4.4Å; F333-I337 HydrophobicContact CE2-CD1 4.09Å; F333-I337 HydrophobicContact CZ-CD1 3.44Å; F333-I337 VanDerWaalsContact CZ-CD1 3.44Å; F333-I337 HydrophobicContact CZ-CG1 4.35Å; F333-I337 PolarHBondContact O-N 3.15Å; F333-I458 HydrophobicContact CD1-CD1 4.2Å; F333-I458 HydrophobicContact CE1-CD1 3.89Å
334	V	86.3	Confident	82.3	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.006	31%	0.311	C	S	.	.	H	α-helix	trans	-56	-48.4	173.2	162.9	0	0	0	0	110.7	E330 Y331 Y336 I337 F338 V455 I458	E330-V334 WeakPolarHBondContact O-CG2 3.46Å; E330-V334 PolarHBondContact O-N 3.35Å; Y331-V334 PolarHBondContact O-N 3.01Å; V334-Y336 PolarHBondContact O-N 3.3Å; V334-I337 PolarHBondContact O-N 2.87Å; V334-F338 WeakPolarHBondContact O-CB 3.45Å; V334-F338 PolarHBondContact O-N 3.5Å; V334-V455 HydrophobicContact CG1-CG1 3.59Å; V334-I458 HydrophobicContact CG2-CB 4.38Å; V334-I458 HydrophobicContact CG2-CG2 3.89Å
335	N	85.8	Confident	80.5	Confident	53 Å²	53	67.3 Å²	67.3	28%	0.283	34%	0.337	S	S	.	.	H	α-helix	trans	-64.1	-39.9	179.8	-165.1	46.5	0	0	0	112	Y331 F333 F339	Y331-N335 HydrophobicContact CE1-CB 4.48Å; Y331-N335 HydrophobicContact CE2-CB 4.41Å; Y331-N335 VanDerWaalsContact O-CB 3.27Å; Y331-N335 WeakPolarHBondContact O-CB 3.48Å; Y331-N335 PolarHBondContact O-N 2.87Å; F333-N335 VanDerWaalsContact C-N 3.33Å; F333-N335 PolarHBondContact O-N 2.71Å; N335-F339 PolarHBondContact O-N 3.35Å; N335-F339 WeakPolarHBondContact OD1-CD2 3.47Å; N335-F339 WeakPolarHBondContact OD1-CE2 3.12Å
336	Y	85.1	Confident	78.9	Confident	147 Å²	147	69.1 Å²	69.1	58%	0.576	35%	0.347	S	S	*	.	H	α-helix	trans	-67.4	-41.9	177.2	177.5	-100	0	0	0	112.9	A332 F333 V334 G340 R341	A332-Y336 VanDerWaalsContact O-CB 3.3Å; A332-Y336 WeakPolarHBondContact O-CB 3.39Å; A332-Y336 PolarHBondContact O-N 3.29Å; F333-Y336 PolarHBondContact O-N 3.44Å; V334-Y336 PolarHBondContact O-N 3.3Å; Y336-G340 WeakPolarHBondContact O-CA 3.49Å; Y336-G340 PolarHBondContact O-N 3.36Å; Y336-R341 PolarHBondContact O-N 3.42Å
337	I	82.1	Confident	77.5	Confident	35 Å²	35	71.9 Å²	71.9	18%	0.179	36%	0.356	C	S	.	.	I	π-helix	trans	-64.1	-45.1	176.1	-71.7	179.8	0	0	0	110.2	F333 V334 R341 G342 V455 I458	F333-I337 HydrophobicContact CD1-CD1 3.92Å; F333-I337 HydrophobicContact CE1-CD1 3.33Å; F333-I337 HydrophobicContact CE1-CG1 4.4Å; F333-I337 HydrophobicContact CE2-CD1 4.09Å; F333-I337 HydrophobicContact CZ-CD1 3.44Å; F333-I337 VanDerWaalsContact CZ-CD1 3.44Å; F333-I337 HydrophobicContact CZ-CG1 4.35Å; F333-I337 PolarHBondContact O-N 3.15Å; V334-I337 PolarHBondContact O-N 2.87Å; I337-R341 WeakPolarHBondContact O-CB 3.41Å; I337-R341 PolarHBondContact O-N 3.49Å; I337-G342 PolarHBondContact O-N 3.34Å; I337-G342 VanDerWaalsContact O-N 3.09Å; I337-V455 HydrophobicContact CG2-CG2 4.39Å; I337-I458 HydrophobicContact CD1-CD1 3.84Å
338	F	76.1	Confident	76.2	Confident	68 Å²	68	77 Å²	77	30%	0.298	38%	0.377	S	S	.	.	I	π-helix	trans	-66.3	-55.2	-177.8	-175.2	-100.7	0	0	0	112.8	Y276 V334 G342	Y276-F338 HydrophobicContact CD2-CD2 4.26Å; Y276-F338 HydrophobicContact CD2-CE2 4.3Å; Y276-F338 HydrophobicContact CD2-CG 4.4Å; Y276-F338 HydrophobicContact CD2-CZ 4.47Å; Y276-F338 AromaticContact CE2-CD2 3.82Å; Y276-F338 HydrophobicContact CE2-CD2 3.82Å; Y276-F338 HydrophobicContact CE2-CE1 4.2Å; Y276-F338 AromaticContact CE2-CE2 3.46Å; Y276-F338 HydrophobicContact CE2-CE2 3.46Å; Y276-F338 VanDerWaalsContact CE2-CE2 3.46Å; Y276-F338 HydrophobicContact CE2-CG 4.33Å; Y276-F338 AromaticContact CE2-CZ 3.67Å; Y276-F338 HydrophobicContact CE2-CZ 3.67Å; V334-F338 WeakPolarHBondContact O-CB 3.45Å; V334-F338 PolarHBondContact O-N 3.5Å; F338-G342 VanDerWaalsContact O-CA 3.31Å; F338-G342 WeakPolarHBondContact O-CA 3.49Å; F338-G342 PolarHBondContact O-N 3.2Å
339	F	75.1	Confident	74.9	Confident	129 Å²	129	77.1 Å²	77.1	57%	0.566	39%	0.385	S	S	*	.	I	π-helix	trans	-86.4	-30.6	-176.7	-70.9	-75.6	0	0	0	114.1	N335 P343	N335-F339 PolarHBondContact O-N 3.35Å; N335-F339 WeakPolarHBondContact OD1-CD2 3.47Å; N335-F339 WeakPolarHBondContact OD1-CE2 3.12Å; F339-P343 WeakPolarHBondContact O-CD 3.49Å; F339-P343 VanDerWaalsContact O-CG 3.27Å; F339-P343 WeakPolarHBondContact O-CG 3.38Å
340	G	68	Low	73.8	Confident	40 Å²	40	76.2 Å²	76.2	41%	0.412	39%	0.389	S	S	.	.	I	π-helix	trans	-85.1	-49	-177.7	0	0	0	0	0	113.1	Y336	Y336-G340 WeakPolarHBondContact O-CA 3.49Å; Y336-G340 PolarHBondContact O-N 3.36Å
341	R	64.3	Low	72.9	Confident	146 Å²	146	80.3 Å²	80.3	55%	0.551	41%	0.408	S	S	*	.	I	π-helix	trans	-90.9	-26.1	179.9	-70.9	-172.4	171.9	-174.3	-0.2	113.6	Y336 I337 H344 L345	Y336-R341 PolarHBondContact O-N 3.42Å; I337-R341 WeakPolarHBondContact O-CB 3.41Å; I337-R341 PolarHBondContact O-N 3.49Å; R341-H344 PolarHBondContact O-N 3.12Å; R341-L345 HydrophobicContact CB-CD1 4.22Å; R341-L345 WeakPolarHBondContact O-CB 3.45Å; R341-L345 VanDerWaalsContact O-CG 3.29Å; R341-L345 WeakPolarHBondContact O-CG 3.16Å; R341-L345 PolarHBondContact O-N 2.85Å
342	G	64.4	Low	72.1	Confident	17 Å²	17	87 Å²	87	18%	0.175	44%	0.438	C	S	.	.	H	α-helix	trans	-52.7	-54.8	178.2	0	0	0	0	0	114.2	I337 F338 H344 L345 Q346	I337-G342 PolarHBondContact O-N 3.34Å; I337-G342 VanDerWaalsContact O-N 3.09Å; F338-G342 VanDerWaalsContact O-CA 3.31Å; F338-G342 WeakPolarHBondContact O-CA 3.49Å; F338-G342 PolarHBondContact O-N 3.2Å; G342-H344 VanDerWaalsContact C-N 3.32Å; G342-H344 PolarHBondContact O-N 2.53Å; G342-L345 PolarHBondContact O-N 3.38Å; G342-Q346 WeakPolarHBondContact O-CB 3.4Å; G342-Q346 VanDerWaalsContact O-CG 3.28Å; G342-Q346 WeakPolarHBondContact O-CG 3.47Å; G342-Q346 PolarHBondContact O-N 2.95Å
343	P	62.8	Low	71.2	Confident	72 Å²	72	87.1 Å²	87.1	47%	0.468	44%	0.438	S	S	.	.	H	α-helix	trans	-64.2	-34.3	-179.3	-21.8	32.5	0	0	0	113.4	F339 K347	F339-P343 WeakPolarHBondContact O-CD 3.49Å; F339-P343 VanDerWaalsContact O-CG 3.27Å; F339-P343 WeakPolarHBondContact O-CG 3.38Å; P343-K347 WeakPolarHBondContact O-CB 3.21Å; P343-K347 PolarHBondContact O-N 2.83Å
344	H	59.8	Low	70.4	Confident	109 Å²	109	84.6 Å²	84.6	51%	0.505	44%	0.439	S	S	.	.	H	α-helix	trans	-73.2	-37	179.4	-173.6	-106.3	0	0	0	112.1	R341 G342 K348	R341-H344 PolarHBondContact O-N 3.12Å; G342-H344 VanDerWaalsContact C-N 3.32Å; G342-H344 PolarHBondContact O-N 2.53Å; H344-K348 WeakPolarHBondContact CE1-CE 3.32Å; H344-K348 PolarHBondContact CE1-NZ 3Å; H344-K348 WeakPolarHBondContact O-CG 3.23Å; H344-K348 PolarHBondContact O-N 3.35Å; H344-K348 VanDerWaalsContact O-N 3.07Å
345	L	58.7	Low	69.7	Low	106 Å²	106	92.1 Å²	92.1	56%	0.555	47%	0.472	S	S	*	.	H	α-helix	trans	-69.9	-39.8	172.4	-70.3	167.6	0	0	0	111.5	R341 G342 K347 K348 A349	R341-L345 HydrophobicContact CB-CD1 4.22Å; R341-L345 WeakPolarHBondContact O-CB 3.45Å; R341-L345 VanDerWaalsContact O-CG 3.29Å; R341-L345 WeakPolarHBondContact O-CG 3.16Å; R341-L345 PolarHBondContact O-N 2.85Å; G342-L345 PolarHBondContact O-N 3.38Å; L345-K347 PolarHBondContact O-N 2.93Å; L345-K348 PolarHBondContact O-N 3.29Å; L345-A349 VanDerWaalsContact O-CB 3.3Å; L345-A349 WeakPolarHBondContact O-CB 3.32Å; L345-A349 PolarHBondContact O-N 2.94Å
346	Q	60.8	Low	68.7	Low	130 Å²	130	92.5 Å²	92.5	61%	0.607	48%	0.478	S	S	*	.	H	α-helix	trans	-60.3	-43.6	172.8	-74.6	175.1	15.6	0	0	111.8	G342 A349 A350	G342-Q346 WeakPolarHBondContact O-CB 3.4Å; G342-Q346 VanDerWaalsContact O-CG 3.28Å; G342-Q346 WeakPolarHBondContact O-CG 3.47Å; G342-Q346 PolarHBondContact O-N 2.95Å; Q346-A349 PolarHBondContact O-N 3.44Å; Q346-A350 VanDerWaalsContact O-CB 3.27Å; Q346-A350 WeakPolarHBondContact O-CB 3.06Å; Q346-A350 PolarHBondContact O-N 3.23Å
347	K	66.1	Low	67.7	Low	134 Å²	134	90.8 Å²	90.8	58%	0.583	48%	0.479	S	S	*	.	H	α-helix	trans	-62.7	-46.1	176	-171.2	177.7	177.2	-177	0	111.9	P343 L345 A349 A350 E351	P343-K347 WeakPolarHBondContact O-CB 3.21Å; P343-K347 PolarHBondContact O-N 2.83Å; L345-K347 PolarHBondContact O-N 2.93Å; K347-A349 PolarHBondContact O-N 2.9Å; K347-A350 PolarHBondContact O-N 3.17Å; K347-E351 WeakPolarHBondContact CE-OE1 3.29Å; K347-E351 WeakPolarHBondContact O-CB 3.45Å; K347-E351 VanDerWaalsContact O-CG 3.31Å; K347-E351 WeakPolarHBondContact O-CG 3.44Å; K347-E351 PolarHBondContact O-N 2.95Å
348	K	65.1	Low	66.8	Low	110 Å²	110	94.8 Å²	94.8	48%	0.478	50%	0.501	S	S	.	.	H	α-helix	trans	-65.7	-36.5	177	-77.2	-175.5	174.1	-175.3	0	113.3	H344 L345 K352	H344-K348 WeakPolarHBondContact CE1-CE 3.32Å; H344-K348 PolarHBondContact CE1-NZ 3Å; H344-K348 WeakPolarHBondContact O-CG 3.23Å; H344-K348 PolarHBondContact O-N 3.35Å; H344-K348 VanDerWaalsContact O-N 3.07Å; L345-K348 PolarHBondContact O-N 3.29Å; K348-K352 WeakPolarHBondContact O-CG 3.39Å; K348-K352 PolarHBondContact O-N 3.47Å
349	A	64.8	Low	66.1	Low	46 Å²	46	98.4 Å²	98.4	38%	0.38	52%	0.519	S	S	.	.	H	α-helix	trans	-70.6	-40.6	175.9	0	0	0	0	0	111.7	L345 Q346 K347 K352 A353	L345-A349 VanDerWaalsContact O-CB 3.3Å; L345-A349 WeakPolarHBondContact O-CB 3.32Å; L345-A349 PolarHBondContact O-N 2.94Å; Q346-A349 PolarHBondContact O-N 3.44Å; K347-A349 PolarHBondContact O-N 2.9Å; A349-K352 PolarHBondContact O-N 2.85Å; A349-A353 WeakPolarHBondContact O-CB 3.42Å; A349-A353 PolarHBondContact O-N 2.82Å
350	A	68.1	Low	65.3	Low	62 Å²	62	97.2 Å²	97.2	51%	0.512	52%	0.519	S	S	.	.	H	α-helix	trans	-63.5	-40.1	173.6	0	0	0	0	0	111.9	Q346 K347 A353 A354	Q346-A350 VanDerWaalsContact O-CB 3.27Å; Q346-A350 WeakPolarHBondContact O-CB 3.06Å; Q346-A350 PolarHBondContact O-N 3.23Å; K347-A350 PolarHBondContact O-N 3.17Å; A350-A353 PolarHBondContact O-N 3Å; A350-A354 VanDerWaalsContact O-CB 3.3Å; A350-A354 WeakPolarHBondContact O-CB 3.35Å; A350-A354 PolarHBondContact O-N 3Å
351	E	71.9	Confident	64.7	Low	101 Å²	101	101.2 Å²	101.2	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-65	-40	174.5	-75.8	171.1	-171.6	0	0	112.5	K347 A354 K355	K347-E351 WeakPolarHBondContact CE-OE1 3.29Å; K347-E351 WeakPolarHBondContact O-CB 3.45Å; K347-E351 VanDerWaalsContact O-CG 3.31Å; K347-E351 WeakPolarHBondContact O-CG 3.44Å; K347-E351 PolarHBondContact O-N 2.95Å; E351-A354 PolarHBondContact O-N 3.36Å; E351-K355 WeakPolarHBondContact O-CG 3.34Å; E351-K355 PolarHBondContact O-N 3.36Å
352	K	71.3	Confident	64.2	Low	160 Å²	160	96.2 Å²	96.2	70%	0.696	52%	0.518	S	S	*	.	H	α-helix	trans	-67.2	-41.7	174.6	-77	-177.4	178.1	-174.5	0	112.5	K348 A349 A354 K355 S356	K348-K352 WeakPolarHBondContact O-CG 3.39Å; K348-K352 PolarHBondContact O-N 3.47Å; A349-K352 PolarHBondContact O-N 2.85Å; K352-A354 VanDerWaalsContact C-N 3.33Å; K352-K355 PolarHBondContact O-N 2.77Å; K352-S356 PolarHBondContact O-N 3.05Å
353	A	69.9	Low	63.8	Low	48 Å²	48	104.9 Å²	104.9	40%	0.397	55%	0.546	S	S	.	.	H	α-helix	trans	-66.9	-34.4	175.4	0	0	0	0	0	112.2	A349 A350 S356 N357	A349-A353 WeakPolarHBondContact O-CB 3.42Å; A349-A353 PolarHBondContact O-N 2.82Å; A350-A353 PolarHBondContact O-N 3Å; A353-S356 PolarHBondContact O-OG 3.21Å; A353-S356 VanDerWaalsContact O-OG 3.14Å; A353-N357 WeakPolarHBondContact O-CB 3.45Å; A353-N357 PolarHBondContact O-N 3.19Å; A353-N357 VanDerWaalsContact O-N 3.14Å
354	A	71.1	Confident	63.2	Low	63 Å²	63	108 Å²	108	52%	0.521	56%	0.558	S	S	.	*	H	α-helix	trans	-67	-39.2	173.4	0	0	0	0	0	112	A350 E351 K352 N358	A350-A354 VanDerWaalsContact O-CB 3.3Å; A350-A354 WeakPolarHBondContact O-CB 3.35Å; A350-A354 PolarHBondContact O-N 3Å; E351-A354 PolarHBondContact O-N 3.36Å; K352-A354 VanDerWaalsContact C-N 3.33Å; A354-N358 PolarHBondContact O-N 3.37Å; A354-N358 VanDerWaalsContact O-N 3.15Å
355	K	71.6	Confident	62.8	Low	158 Å²	158	108.9 Å²	108.9	69%	0.687	56%	0.562	S	S	*	*	H	α-helix	trans	-65.9	-45.7	175.7	-77.1	-177.5	178.1	-175.2	0	112.8	E351 K352 N357 N358 E359	E351-K355 WeakPolarHBondContact O-CG 3.34Å; E351-K355 PolarHBondContact O-N 3.36Å; K352-K355 PolarHBondContact O-N 2.77Å; K355-N357 VanDerWaalsContact C-N 3.32Å; K355-N357 PolarHBondContact O-N 3.31Å; K355-N358 PolarHBondContact O-N 2.61Å; K355-N358 VanDerWaalsContact O-N 3.16Å; K355-E359 PolarHBondContact O-N 3.37Å
356	S	65.2	Low	62.4	Low	61 Å²	61	108.9 Å²	108.9	43%	0.427	57%	0.571	S	S	.	*	H	α-helix	trans	-65.7	-34.9	178.5	67.7	0	0	0	0	112.7	K352 A353 N358 E359 N360	K352-S356 PolarHBondContact O-N 3.05Å; A353-S356 PolarHBondContact O-OG 3.21Å; A353-S356 VanDerWaalsContact O-OG 3.14Å; S356-N358 VanDerWaalsContact C-N 3.3Å; S356-N358 PolarHBondContact O-N 2.82Å; S356-E359 PolarHBondContact O-N 3.04Å; S356-N360 PolarHBondContact O-N 3.27Å
357	N	65	Low	61.7	Low	112 Å²	112	107.8 Å²	107.8	60%	0.599	58%	0.578	S	S	*	*	H	α-helix	trans	-69.5	-30.2	176	-146.4	12	0	0	0	111.9	A353 K355 K361	A353-N357 WeakPolarHBondContact O-CB 3.45Å; A353-N357 PolarHBondContact O-N 3.19Å; A353-N357 VanDerWaalsContact O-N 3.14Å; K355-N357 VanDerWaalsContact C-N 3.32Å; K355-N357 PolarHBondContact O-N 3.31Å; N357-K361 WeakPolarHBondContact O-CB 3.42Å; N357-K361 PolarHBondContact O-N 3.45Å; N357-K361 VanDerWaalsContact O-N 3.11Å
358	N	63.8	Low	60.7	Low	118 Å²	118	110 Å²	110	63%	0.631	59%	0.587	S	S	*	*	H	α-helix	trans	-75.3	-37.4	175.1	-139.4	21.2	0	0	0	112.1	A354 K355 S356 K361 G362	A354-N358 PolarHBondContact O-N 3.37Å; A354-N358 VanDerWaalsContact O-N 3.15Å; K355-N358 PolarHBondContact O-N 2.61Å; K355-N358 VanDerWaalsContact O-N 3.16Å; S356-N358 VanDerWaalsContact C-N 3.3Å; S356-N358 PolarHBondContact O-N 2.82Å; N358-K361 PolarHBondContact O-N 3.48Å; N358-G362 PolarHBondContact O-N 3.09Å
359	E	60.2	Low	59.8	Low	144 Å²	144	110.8 Å²	110.8	67%	0.673	60%	0.601	S	S	*	*	H	α-helix	trans	-63.2	-42.9	171.7	-84.7	-177.6	134.6	0	0	112.5	K355 S356 K361 G362 R363	K355-E359 PolarHBondContact O-N 3.37Å; S356-E359 PolarHBondContact O-N 3.04Å; E359-K361 VanDerWaalsContact C-N 3.32Å; E359-K361 PolarHBondContact O-N 3.4Å; E359-G362 PolarHBondContact O-N 2.96Å; E359-R363 PolarHBondContact O-N 3.46Å
360	N	57.7	Low	58.4	Low	105 Å²	105	117 Å²	117	56%	0.561	62%	0.622	S	S	*	*	H	α-helix	trans	-65.7	-34.4	175.1	-88.3	-9	0	0	0	112.5	S356 L364	S356-N360 PolarHBondContact O-N 3.27Å; N360-L364 PolarHBondContact O-N 2.86Å; N360-L364 VanDerWaalsContact O-N 3.09Å
361	K	56.3	Low	57.1	Low	123 Å²	123	120.5 Å²	120.5	54%	0.535	64%	0.637	S	S	.	*	H	α-helix	trans	-69.4	-39	174.8	-163.4	-178.1	176.5	-163.9	0	112.1	N357 N358 E359 L364 E365	N357-K361 WeakPolarHBondContact O-CB 3.42Å; N357-K361 PolarHBondContact O-N 3.45Å; N357-K361 VanDerWaalsContact O-N 3.11Å; N358-K361 PolarHBondContact O-N 3.48Å; E359-K361 VanDerWaalsContact C-N 3.32Å; E359-K361 PolarHBondContact O-N 3.4Å; K361-L364 PolarHBondContact O-N 3.3Å; K361-E365 PolarHBondContact O-N 3.21Å
362	G	54.3	Low	55.3	Low	41 Å²	41	121.9 Å²	121.9	42%	0.423	65%	0.648	S	S	.	*	H	α-helix	trans	-63.6	-37.7	173.4	0	0	0	0	0	113.3	N358 E359 S366	N358-G362 PolarHBondContact O-N 3.09Å; E359-G362 PolarHBondContact O-N 2.96Å; G362-S366 WeakPolarHBondContact O-CB 3.49Å; G362-S366 PolarHBondContact O-N 2.93Å
363	R	55.4	Low	54.1	Low	200 Å²	200	118.8 Å²	118.8	76%	0.755	65%	0.652	S	S	*	*	H	α-helix	trans	-68	-36	172.9	-82.3	-177.4	165	-177.4	-4.3	113.3	E359 S367	E359-R363 PolarHBondContact O-N 3.46Å; R363-S367 PolarHBondContact O-N 3.08Å
364	L	51.3	Low	52.9	Low	137 Å²	137	124.9 Å²	124.9	72%	0.717	67%	0.672	S	S	*	*	H	α-helix	trans	-74.5	-31	178.2	-148.5	83.3	0	0	0	112.8	N360 K361	N360-L364 PolarHBondContact O-N 2.86Å; N360-L364 VanDerWaalsContact O-N 3.09Å; K361-L364 PolarHBondContact O-N 3.3Å
365	E	50.4	Low	51.8	Low	128 Å²	128	125.5 Å²	125.5	60%	0.598	68%	0.684	S	S	*	*	H	α-helix	trans	-75.9	-36	173.5	-79.7	-178.1	-179.3	0	0	112.3	K361 S367 K368	K361-E365 PolarHBondContact O-N 3.21Å; E365-S367 PolarHBondContact O-N 3.5Å; E365-K368 PolarHBondContact O-N 2.67Å
366	S	49.5	Very low	50.1	Low	106 Å²	106	125.7 Å²	125.7	74%	0.741	69%	0.693	S	S	*	*	H	α-helix	trans	-66.8	-19.9	174.8	-166.1	0	0	0	0	113.4	G362	G362-S366 WeakPolarHBondContact O-CB 3.49Å; G362-S366 PolarHBondContact O-N 2.93Å
367	S	46.2	Very low	48.9	Very low	107 Å²	107	130.5 Å²	130.5	75%	0.748	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	4	178.6	-156.9	0	0	0	0	113.6	R363 E365	R363-S367 PolarHBondContact O-N 3.08Å; E365-S367 PolarHBondContact O-N 3.5Å
368	K	46.2	Very low	47.4	Very low	180 Å²	180	132.7 Å²	132.7	78%	0.783	72%	0.723	S	S	*	*	S	Bend	trans	-116.1	10.6	-172.6	-132.1	178.8	-173.5	179.6	0	116	E365	E365-K368 PolarHBondContact O-N 2.67Å
369	V	46.5	Very low	46.2	Very low	126 Å²	126	134.1 Å²	134.1	76%	0.764	73%	0.73	S	S	*	*			trans	-136	86.5	172.4	-172.6	0	0	0	0	110
370	Q	35.3	Very low	45	Very low	176 Å²	176	133.8 Å²	133.8	82%	0.822	74%	0.738	S	S	*	*			trans	-141.8	106.9	148.9	-149.2	167.8	-5.9	0	0	106.7
371	V	40	Very low	43.8	Very low	136 Å²	136	136.1 Å²	136.1	82%	0.824	75%	0.75	S	S	*	*			trans	-101.7	112.4	176.2	175.5	0	0	0	0	105.7
372	D	35.2	Very low	42.7	Very low	131 Å²	131	138 Å²	138	70%	0.701	77%	0.765	S	S	*	*			trans	-108.7	143.3	169.8	-76.5	-27.5	0	0	0	110.8	H374	D372-H374 VanDerWaalsContact C-N 3.27Å; D372-H374 PolarHBondContact O-N 3.08Å
373	A	44.3	Very low	41.8	Very low	95 Å²	95	142 Å²	142	79%	0.785	78%	0.784	S	S	*	*	S	Bend	trans	-77	21.2	-158.8	0	0	0	0	0	116.9
374	H	46.2	Very low	40.5	Very low	176 Å²	176	138.8 Å²	138.8	82%	0.815	79%	0.787	S	S	*	*	S	Bend	trans	-137.5	103.3	177.4	-68.5	81.1	0	0	0	109.4	D372 N376	D372-H374 VanDerWaalsContact C-N 3.27Å; D372-H374 PolarHBondContact O-N 3.08Å; H374-N376 PolarHBondContact O-N 3.42Å; H374-N376 VanDerWaalsContact O-N 3.13Å
375	G	46.7	Very low	39.4	Very low	76 Å²	76	141.6 Å²	141.6	78%	0.784	80%	0.796	S	S	*	*			trans	-61.7	113.2	-175.3	0	0	0	0	0	112.2
376	N	36.6	Very low	38.4	Very low	161 Å²	161	144.9 Å²	144.9	86%	0.861	81%	0.814	S	S	*	*			trans	-155.9	132.4	154.3	-81.8	-32.5	0	0	0	108.9	H374	H374-N376 PolarHBondContact O-N 3.42Å; H374-N376 VanDerWaalsContact O-N 3.13Å
377	I	39.3	Very low	37.5	Very low	162 Å²	162	143.6 Å²	143.6	83%	0.831	82%	0.817	S	S	*	*			trans	-88.7	122	178.7	-66.5	168	0	0	0	108.5	L379	I377-L379 HydrophobicContact CG2-CD1 4.43Å
378	L	34.2	Very low	36.8	Very low	158 Å²	158	142.1 Å²	142.1	83%	0.827	82%	0.819	S	S	*	*			trans	-110	110.1	169.9	-103.3	162.2	0	0	0	109.8
379	L	38.6	Very low	36.7	Very low	149 Å²	149	139 Å²	139	78%	0.78	82%	0.817	S	S	*	*			trans	-76.5	126.8	161.1	-96.8	107.4	0	0	0	108.3	I377	I377-L379 HydrophobicContact CG2-CD1 4.43Å
380	T	35.4	Very low	35.9	Very low	137 Å²	137	140.2 Å²	140.2	84%	0.84	82%	0.819	S	S	*	*			trans	-109.2	132.8	168.1	30	0	0	0	0	112.2
381	N	32.8	Very low	35.6	Very low	153 Å²	153	139.6 Å²	139.6	82%	0.818	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-63.9	154.2	-164.1	-62.8	-27.7	0	0	0	117.6
382	L	32.3	Very low	35.1	Very low	162 Å²	162	141.1 Å²	141.1	85%	0.848	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-68	148.5	156.6	-77.8	132.2	0	0	0	111
383	P	34.9	Very low	34.7	Very low	125 Å²	125	138.3 Å²	138.3	81%	0.812	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-92.5	135.2	156.9	32.3	-24.3	0	0	0	111
384	T	28.4	Very low	34	Very low	134 Å²	134	138.7 Å²	138.7	82%	0.822	82%	0.824	S	S	*	*			trans	-109.5	129.6	171.1	-37.9	0	0	0	0	107.2
385	E	28.3	Very low	33.2	Very low	196 Å²	196	137.9 Å²	137.9	92%	0.916	83%	0.825	S	S	*	*			trans	-112.4	136	163.5	-89.4	-165.4	159.6	0	0	110.6
386	M	30.6	Very low	32.4	Very low	197 Å²	197	142.2 Å²	142.2	97%	0.97	83%	0.83	S	S	*	*			trans	-80	145.5	-178.9	-80.4	178.7	172.9	0	0	112.5
387	G	29.6	Very low	32.2	Very low	79 Å²	79	142.1 Å²	142.1	81%	0.814	83%	0.829	S	S	*	*			trans	-153.1	113.6	155.9	0	0	0	0	0	109.8
388	G	30.9	Very low	32.4	Very low	75 Å²	75	139.5 Å²	139.5	77%	0.773	82%	0.823	S	S	*	*			trans	-86.2	-172.8	176.9	0	0	0	0	0	114
389	P	45.4	Very low	32.2	Very low	115 Å²	115	144 Å²	144	75%	0.747	83%	0.829	S	S	*	*				-125.5	176.7	-116.4	41.8	-30.1	0	0	0	117.1
390	D	28.4	Very low	31.8	Very low	152 Å²	152	141 Å²	141	81%	0.813	83%	0.825	S	S	*	*			trans	89.5	112.4	145.1	-70.2	-19.9	0	0	0	122.8
391	M	29.2	Very low	31.6	Very low	163 Å²	163	141.1 Å²	141.1	80%	0.803	83%	0.826	S	S	*	*				127.8	127.7	106.1	-168.5	161.9	157.3	0	0	119.2
392	M	29.2	Very low	31.5	Very low	167 Å²	167	141.4 Å²	141.4	82%	0.823	83%	0.825	S	S	*	*			trans	81.4	114.2	151.3	-82.9	-79.1	-161.8	0	0	122.4
393	G	27.1	Very low	31.4	Very low	72 Å²	72	143.5 Å²	143.5	74%	0.742	83%	0.827	S	S	*	*				127.1	98.3	116.8	0	0	0	0	0	117.4
394	A	29.4	Very low	31.2	Very low	104 Å²	104	141.5 Å²	141.5	86%	0.86	82%	0.816	S	S	*	*				170.7	121.2	123.5	0	0	0	0	0	112
395	L	29.8	Very low	31.2	Very low	159 Å²	159	145 Å²	145	83%	0.832	82%	0.816	S	S	*	*			trans	-64.4	148.7	166.2	-85.1	79	0	0	0	111.7
396	N	30.9	Very low	31.1	Very low	167 Å²	167	141.7 Å²	141.7	89%	0.893	80%	0.804	S	S	*	*				-165.1	147.9	115.8	-95.6	-15.7	0	0	0	113.3
397	D	31.3	Very low	31.2	Very low	158 Å²	158	137 Å²	137	85%	0.845	79%	0.791	S	S	*	*			trans	-69.3	168.5	-157	-131	9.7	0	0	0	117.2
398	P	44.2	Very low	31.2	Very low	107 Å²	107	138.2 Å²	138.2	70%	0.695	79%	0.793	S	S	*	*			trans	-98.7	167.5	-170.6	39.6	-33.1	0	0	0	113.1
399	R	29.1	Very low	31.2	Very low	253 Å²	253	139.8 Å²	139.8	96%	0.955	79%	0.792	S	S	*	*			trans	-143.4	113	152.6	-121.5	178.3	176.7	125	-1.5	111.2
400	A	30.4	Very low	30.6	Very low	86 Å²	86	142.3 Å²	142.3	71%	0.711	80%	0.798	S	S	*	*			trans	-70.3	148.7	165.3	0	0	0	0	0	110.6
401	T	31.2	Very low	30.7	Very low	139 Å²	139	143.6 Å²	143.6	85%	0.853	80%	0.799	S	S	*	*				-160	119.6	128.2	28.9	0	0	0	0	110.3
402	M	30.8	Very low	30.7	Very low	160 Å²	160	145.2 Å²	145.2	79%	0.788	80%	0.797	S	S	*	*			trans	-56.4	149.1	155.1	-80.8	167.2	51.1	0	0	110.5
403	F	30.9	Very low	30.7	Very low	206 Å²	206	147.2 Å²	147.2	90%	0.904	80%	0.796	S	S	*	*				-158.2	131.2	124.6	-97.6	-71	0	0	0	110.3
404	S	30.5	Very low	30.9	Very low	82 Å²	82	152.7 Å²	152.7	57%	0.573	80%	0.799	S	S	*	*			trans	-96.1	177.3	171.3	49.6	0	0	0	0	110.9
405	Y	28.7	Very low	31	Very low	209 Å²	209	154 Å²	154	82%	0.82	80%	0.799	S	S	*	*			trans	93	140	178.6	-78.5	-94.5	0	0	0	114.6
406	D	25.6	Very low	31	Very low	125 Å²	125	154.8 Å²	154.8	67%	0.668	80%	0.8	S	S	*	*			cis	-157.8	163.4	-7	-151.3	-15.6	0	0	0	108.7
407	S	32.6	Very low	31	Very low	100 Å²	100	153.3 Å²	153.3	70%	0.699	80%	0.798	S	S	*	*			trans	-58.3	145.3	168.3	53.4	0	0	0	0	115.4
408	A	30.3	Very low	31	Very low	104 Å²	104	151.3 Å²	151.3	86%	0.86	80%	0.796	S	S	*	*			trans	-156.7	123.7	151.2	0	0	0	0	0	111.6
409	S	30.5	Very low	30.3	Very low	108 Å²	108	156.6 Å²	156.6	76%	0.755	80%	0.802	S	S	*	*			trans	-59.4	152.4	170.4	50	0	0	0	0	114.6
410	I	32.5	Very low	30.3	Very low	168 Å²	168	152.8 Å²	152.8	86%	0.862	80%	0.801	S	S	*	*			trans	-147.7	122.8	141.4	-88.5	140.1	0	0	0	108.9
411	Q	31	Very low	30.3	Very low	178 Å²	178	154.8 Å²	154.8	83%	0.832	80%	0.799	S	S	*	*			trans	-85.2	147.6	169.7	-69.1	170.5	-24.3	0	0	110
412	Y	29.6	Very low	30.5	Very low	197 Å²	197	159.1 Å²	159.1	77%	0.773	80%	0.801	S	S	*	*			trans	-148	108.7	149.7	-117.7	-91.2	0	0	0	112.8
413	R	27.4	Very low	30.5	Very low	209 Å²	209	155 Å²	155	79%	0.789	80%	0.799	S	S	*	*			trans	57.8	115.6	131.1	-134.4	171.8	-159.3	161.1	5.1	121.2
414	K	32	Very low	30.7	Very low	188 Å²	188	157.1 Å²	157.1	82%	0.817	80%	0.801	S	S	*	*			trans	-88.8	164.1	150	-79.1	-173.1	177.1	-179.2	0	110.9
415	P	32.7	Very low	31.2	Very low	131 Å²	131	158.8 Å²	158.8	85%	0.851	81%	0.81	S	S	*	*			trans	-123.3	155.2	134.3	25	-8	0	0	0	113.3
416	M	29.6	Very low	31.4	Very low	176 Å²	176	153.3 Å²	153.3	87%	0.867	81%	0.808	S	S	*	*			trans	-95.5	156.6	179.8	-61.9	168.8	89.3	0	0	111.5
417	T	30.7	Very low	31.8	Very low	136 Å²	136	155 Å²	155	83%	0.834	82%	0.816	S	S	*	*			trans	-149.4	112.9	144.9	48.4	0	0	0	0	106.5
418	S	29.7	Very low	31.8	Very low	115 Å²	115	157.8 Å²	157.8	80%	0.804	82%	0.823	S	S	*	*				86.2	99.5	81.8	-68.7	0	0	0	0	114.6
419	R	30.2	Very low	32	Very low	218 Å²	218	164 Å²	164	82%	0.823	83%	0.825	S	S	*	*			trans	4.7	139.3	142.5	-102.2	171.9	154.6	156.2	-6.6	119.4
420	D	29.4	Very low	32.5	Very low	174 Å²	174	163.7 Å²	163.7	93%	0.93	82%	0.82	S	S	*	*				-153.3	160.3	123.5	-100.9	-29.4	0	0	0	113.6
421	L	31	Very low	32.6	Very low	128 Å²	128	163.6 Å²	163.6	67%	0.67	82%	0.82	S	S	*	*			trans	-117.7	-174.4	-152.9	-145.8	83.6	0	0	0	112.5
422	Y	34.6	Very low	32.7	Very low	230 Å²	230	158.1 Å²	158.1	90%	0.902	81%	0.811	S	S	*	*			trans	95.7	120.3	177.7	-66.3	-81.1	0	0	0	114.3
423	G	30.5	Very low	32.9	Very low	73 Å²	73	157.8 Å²	157.8	75%	0.753	82%	0.816	S	S	*	*			cis	125.3	118.2	22.4	0	0	0	0	0	106.3
424	R	34.7	Very low	33	Very low	251 Å²	251	157.4 Å²	157.4	95%	0.947	82%	0.82	S	S	*	*				178.3	175	68.2	-103	-161.2	-175.7	-166.1	3.6	110.4
425	P	41.4	Very low	32.9	Very low	116 Å²	116	158 Å²	158	75%	0.753	82%	0.823	S	S	*	*			trans	-120.2	169.2	-146.4	42.9	-32.3	0	0	0	117
426	A	32.9	Very low	32.9	Very low	95 Å²	95	157 Å²	157	79%	0.785	82%	0.818	S	S	*	*			trans	176.6	109.9	140.6	0	0	0	0	0	109.4
427	L	35.1	Very low	33	Very low	159 Å²	159	159.5 Å²	159.5	83%	0.832	82%	0.818	S	S	*	*				70.4	93.6	83.6	-126.8	155	0	0	0	114.7
428	D	31.9	Very low	33.3	Very low	159 Å²	159	160.7 Å²	160.7	85%	0.85	82%	0.818	S	S	*	*				-172.1	156.6	120.3	-105.7	-24.8	0	0	0	114.1
429	R	35.4	Very low	33.5	Very low	236 Å²	236	165.3 Å²	165.3	89%	0.891	82%	0.818	S	S	*	*			trans	-107.4	-169	-151.9	-147.8	-168.7	176.5	175.3	-1.7	112.3
430	P	40.1	Very low	33.9	Very low	101 Å²	101	166 Å²	166	66%	0.656	82%	0.821	S	S	*	*				-113.9	155.8	-101.8	39.7	-24.9	0	0	0	115.3
431	I	35	Very low	34.1	Very low	166 Å²	166	168 Å²	168	85%	0.851	82%	0.815	S	S	*	*			trans	-142.4	121.5	151.7	-59.9	-178.3	0	0	0	108.9
432	G	32.2	Very low	34.3	Very low	63 Å²	63	166.2 Å²	166.2	65%	0.649	82%	0.819	S	S	*	*			trans	-83.7	144.6	-176.1	0	0	0	0	0	113.4
433	H	33.5	Very low	34.5	Very low	190 Å²	190	159.9 Å²	159.9	88%	0.88	81%	0.809	S	S	*	*			trans	-143.8	144.5	148.8	-92.8	-75.2	0	0	0	111
434	K	30.6	Very low	34.9	Very low	200 Å²	200	165.6 Å²	165.6	87%	0.87	82%	0.816	S	S	*	*			trans	-62.5	140	-159.6	-66.7	166.7	175	174	0	113.8	S436	K434-S436 PolarHBondContact O-N 2.96Å
435	K	30.1	Very low	35.1	Very low	202 Å²	202	159.3 Å²	159.3	88%	0.878	80%	0.801	S	S	*	*			trans	-56.1	122.2	158.7	-71.8	176.4	177.4	173.5	0	109.3
436	S	31.6	Very low	34.9	Very low	108 Å²	108	163.3 Å²	163.3	76%	0.755	81%	0.806	S	S	*	*			trans	-112.1	112.7	152.1	81.3	0	0	0	0	108.7	K434 L438	K434-S436 PolarHBondContact O-N 2.96Å; S436-L438 PolarHBondContact O-N 3.07Å
437	R	33.1	Very low	35.2	Very low	230 Å²	230	163.2 Å²	163.2	87%	0.868	80%	0.796	S	S	*	*			trans	-70.9	105.9	171.7	-74.2	174.8	169.3	174.5	-4.1	107.2	R439	R437-R439 PolarHBondContact O-N 3.2Å
438	L	37.3	Very low	35.3	Very low	160 Å²	160	164.9 Å²	164.9	84%	0.838	80%	0.796	S	S	*	*			trans	-70	86.7	163.6	-102.8	150.8	0	0	0	108.4	S436 R440	S436-L438 PolarHBondContact O-N 3.07Å; L438-R440 PolarHBondContact O-N 3.08Å
439	R	33.9	Very low	35.9	Very low	212 Å²	212	163.4 Å²	163.4	80%	0.8	79%	0.787	S	S	*	*			trans	-65.6	86.7	166	-172.8	179.9	-177.5	-169.8	2.2	107.2	R437 R441	R437-R439 PolarHBondContact O-N 3.2Å; R439-R441 VanDerWaalsContact C-N 3.33Å; R439-R441 PolarHBondContact O-N 3.3Å
440	R	37.6	Very low	36.3	Very low	233 Å²	233	156.7 Å²	156.7	88%	0.879	77%	0.774	S	S	*	*			trans	-59.9	100	163.7	-93.3	-176.3	178	170.4	0.1	106.8	L438 A442	L438-R440 PolarHBondContact O-N 3.08Å; R440-A442 VanDerWaalsContact C-N 3.29Å; R440-A442 PolarHBondContact O-N 3.32Å
441	R	33	Very low	36.6	Very low	215 Å²	215	156.2 Å²	156.2	81%	0.811	77%	0.766	S	S	*	*			trans	-60.6	100.2	158.5	-86.1	-179	168.5	175	-3.4	105.6	R439 S443	R439-R441 VanDerWaalsContact C-N 3.33Å; R439-R441 PolarHBondContact O-N 3.3Å; R441-S443 VanDerWaalsContact C-N 3.26Å; R441-S443 PolarHBondContact O-N 3.47Å
442	A	36.3	Very low	37.4	Very low	92 Å²	92	152.4 Å²	152.4	76%	0.76	75%	0.746	S	S	*	*			trans	-62	98.3	160.7	0	0	0	0	0	106	R440 Q444	R440-A442 VanDerWaalsContact C-N 3.29Å; R440-A442 PolarHBondContact O-N 3.32Å; A442-Q444 PolarHBondContact O-N 2.93Å; A442-Q444 VanDerWaalsContact O-N 3.09Å
443	S	37.5	Very low	38.3	Very low	97 Å²	97	153.9 Å²	153.9	68%	0.678	74%	0.743	S	S	*	*			trans	-58.7	113.8	162	50	0	0	0	0	105.6	R441 L445	R441-S443 VanDerWaalsContact C-N 3.26Å; R441-S443 PolarHBondContact O-N 3.47Å; S443-L445 PolarHBondContact O-N 3.18Å
444	Q	38.8	Very low	39.5	Very low	192 Å²	192	149.8 Å²	149.8	90%	0.897	73%	0.728	S	S	*	*			trans	-60.6	93.8	168	-71.4	-147.2	-7.2	0	0	107.6	A442 K446	A442-Q444 PolarHBondContact O-N 2.93Å; A442-Q444 VanDerWaalsContact O-N 3.09Å; Q444-K446 PolarHBondContact O-N 3.07Å
445	L	40.2	Very low	40.9	Very low	120 Å²	120	140.8 Å²	140.8	63%	0.628	69%	0.689	S	S	*	*			trans	-73.5	89.7	168.7	-145.1	141.5	0	0	0	103.9	S443 V447	S443-L445 PolarHBondContact O-N 3.18Å; L445-V447 HydrophobicContact CD2-CG2 3.52Å; L445-V447 PolarHBondContact O-N 3.32Å
446	K	35.9	Very low	42.7	Very low	199 Å²	199	134.4 Å²	134.4	87%	0.865	67%	0.665	S	S	*	*			trans	-64.8	84.2	165.8	-164.8	170.7	-173.6	177.2	0	105.2	Q444 K448	Q444-K446 PolarHBondContact O-N 3.07Å; K446-K448 VanDerWaalsContact C-N 3.26Å; K446-K448 PolarHBondContact O-N 3.43Å
447	V	40.8	Very low	44.6	Very low	94 Å²	94	130.9 Å²	130.9	57%	0.57	64%	0.642	S	S	*	*			trans	-60.1	98.7	170.9	177	0	0	0	0	104.6	L445 I449	L445-V447 HydrophobicContact CD2-CG2 3.52Å; L445-V447 PolarHBondContact O-N 3.32Å; V447-I449 VanDerWaalsContact C-N 3.27Å; V447-I449 PolarHBondContact O-N 2.85Å
448	K	36.4	Very low	46.8	Very low	193 Å²	193	121.7 Å²	121.7	84%	0.839	61%	0.61	S	S	*	*			trans	-66.4	96.5	170.6	-163.8	177.5	-173.3	-176.4	0	104.9	K446 P450	K446-K448 VanDerWaalsContact C-N 3.26Å; K446-K448 PolarHBondContact O-N 3.43Å; K448-P450 WeakPolarHBondContact O-CD 3.32Å; K448-P450 VanDerWaalsContact O-N 3.14Å
449	I	45.5	Very low	49	Very low	129 Å²	129	114.1 Å²	114.1	66%	0.662	57%	0.57	S	S	*	*			trans	-45	114.5	-179.9	-60.1	156	0	0	0	108.8	V447 L452	V447-I449 VanDerWaalsContact C-N 3.27Å; V447-I449 PolarHBondContact O-N 2.85Å; I449-L452 HydrophobicContact CG2-CD1 4.09Å
450	P	43.1	Very low	51.4	Low	94 Å²	94	111 Å²	111	61%	0.61	56%	0.563	S	S	*	*			trans	-103.1	131.3	153.8	30.2	-12	0	0	0	106.6	K448	K448-P450 WeakPolarHBondContact O-CD 3.32Å; K448-P450 VanDerWaalsContact O-N 3.14Å
451	D	46.9	Very low	53.7	Low	91 Å²	91	108.8 Å²	108.8	49%	0.487	55%	0.554	S	S	.	*			cis	-157.5	97	23.9	-164.8	-7.2	0	0	0	106.4	T453	D451-T453 PolarHBondContact O-N 2.89Å; D451-T453 WeakPolarHBondContact OD1-CB 3.47Å; D451-T453 PolarHBondContact OD1-N 3.49Å; D451-T453 PolarHBondContact OD1-OG1 2.81Å
452	L	50.7	Low	56.3	Low	86 Å²	86	99.1 Å²	99.1	45%	0.45	52%	0.519	S	S	.	.	H	α-helix	trans	-68.7	-5.6	174.8	-116.5	96.6	0	0	0	111.8	Y276 I449 N456	Y276-L452 HydrophobicContact CE1-CD2 4.48Å; I449-L452 HydrophobicContact CG2-CD1 4.09Å; L452-N456 PolarHBondContact O-ND2 3.36Å
453	T	52.4	Low	58.9	Low	94 Å²	94	98.8 Å²	98.8	58%	0.577	50%	0.499	S	S	*	.	H	α-helix	trans	-80.1	-30.2	-174.7	73	0	0	0	0	112.3	D451 A457	D451-T453 PolarHBondContact O-N 2.89Å; D451-T453 WeakPolarHBondContact OD1-CB 3.47Å; D451-T453 PolarHBondContact OD1-N 3.49Å; D451-T453 PolarHBondContact OD1-OG1 2.81Å; T453-A457 WeakPolarHBondContact O-CB 3.39Å; T453-A457 PolarHBondContact O-N 3.3Å
454	D	56.7	Low	61.4	Low	105 Å²	105	98.1 Å²	98.1	56%	0.561	49%	0.49	S	S	*	.	H	α-helix	trans	-72.6	-40.2	-176.3	-117.2	-2.5	0	0	0	112.9	A457 I458	D454-A457 WeakPolarHBondContact O-CB 3.41Å; D454-A457 PolarHBondContact O-N 2.95Å; D454-I458 WeakPolarHBondContact O-CG1 3.47Å; D454-I458 PolarHBondContact O-N 3.29Å; D454-I458 VanDerWaalsContact O-N 3.16Å
455	V	61.4	Low	63.9	Low	10 Å²	10	92.1 Å²	92.1	6%	0.061	47%	0.466	C	S	.	.	H	α-helix	trans	-72	-43.4	178.3	177.8	0	0	0	0	111.3	Y276 V334 I337 A457 I458 D459	Y276-V455 HydrophobicContact CD1-CG1 3.99Å; Y276-V455 HydrophobicContact CG-CG1 4.1Å; V334-V455 HydrophobicContact CG1-CG1 3.59Å; I337-V455 HydrophobicContact CG2-CG2 4.39Å; V455-A457 PolarHBondContact O-N 3.49Å; V455-I458 PolarHBondContact O-N 3.07Å; V455-D459 PolarHBondContact O-N 3.42Å
456	N	66.6	Low	66.4	Low	69 Å²	69	87.5 Å²	87.5	37%	0.369	44%	0.441	S	S	.	.	H	α-helix	trans	-67.2	-25.7	173.2	-81.9	-32.5	0	0	0	112.4	L452 K460	L452-N456 PolarHBondContact O-ND2 3.36Å; N456-K460 WeakPolarHBondContact O-CB 3.42Å; N456-K460 PolarHBondContact O-N 3.04Å
457	A	73	Confident	69.1	Low	33 Å²	33	79.7 Å²	79.7	27%	0.273	41%	0.411	S	S	.	.	H	α-helix	trans	-68.1	-41.9	173.1	0	0	0	0	0	111.1	T453 D454 V455 K460 W461	T453-A457 WeakPolarHBondContact O-CB 3.39Å; T453-A457 PolarHBondContact O-N 3.3Å; D454-A457 WeakPolarHBondContact O-CB 3.41Å; D454-A457 PolarHBondContact O-N 2.95Å; V455-A457 PolarHBondContact O-N 3.49Å; A457-K460 WeakPolarHBondContact O-CB 3.3Å; A457-K460 PolarHBondContact O-N 3.43Å; A457-W461 PolarHBondContact O-N 2.93Å
458	I	79.2	Confident	71.6	Confident	37 Å²	37	80.3 Å²	80.3	19%	0.19	41%	0.41	C	S	.	.	H	α-helix	trans	-59.7	-54.2	176.4	-64.1	162.8	0	0	0	110.1	E330 F333 V334 I337 D454 V455 K460 W461 S462	E330-I458 HydrophobicContact CG-CG2 4.49Å; F333-I458 HydrophobicContact CD1-CD1 4.2Å; F333-I458 HydrophobicContact CE1-CD1 3.89Å; V334-I458 HydrophobicContact CG2-CB 4.38Å; V334-I458 HydrophobicContact CG2-CG2 3.89Å; I337-I458 HydrophobicContact CD1-CD1 3.84Å; D454-I458 WeakPolarHBondContact O-CG1 3.47Å; D454-I458 PolarHBondContact O-N 3.29Å; D454-I458 VanDerWaalsContact O-N 3.16Å; V455-I458 PolarHBondContact O-N 3.07Å; I458-K460 PolarHBondContact O-N 3.16Å; I458-W461 PolarHBondContact O-N 3.3Å; I458-W461 VanDerWaalsContact O-N 3.12Å; I458-S462 WeakPolarHBondContact O-CB 3.44Å; I458-S462 PolarHBondContact O-N 2.93Å; I458-S462 PolarHBondContact O-OG 3.16Å
459	D	82.9	Confident	74.4	Confident	2 Å²	2	73.9 Å²	73.9	1%	0.011	39%	0.387	C	S	.	.	H	α-helix	trans	-57.3	-37.3	177	-74.3	-41.1	0	0	0	111.2	R282 V455 S462 R463	R282-D459 IonicContact CZ-OD1 3.57Å; R282-D459 IonicContact CZ-OD2 3.68Å; R282-D459 IonicContact NH1-OD1 2.76Å; R282-D459 PolarHBondContact NH1-OD1 2.95Å; R282-D459 IonicContact NH1-OD2 3.63Å; R282-D459 IonicContact NH2-OD1 3.31Å; R282-D459 PolarHBondContact NH2-OD1 3.02Å; R282-D459 IonicContact NH2-OD2 2.77Å; R282-D459 PolarHBondContact NH2-OD2 3.31Å; V455-D459 PolarHBondContact O-N 3.42Å; D459-S462 PolarHBondContact O-N 3.34Å; D459-R463 WeakPolarHBondContact O-CG 3.27Å; D459-R463 PolarHBondContact O-N 3.3Å; D459-R463 VanDerWaalsContact O-N 3.07Å
460	K	84.4	Confident	76.8	Confident	146 Å²	146	68.1 Å²	68.1	64%	0.635	36%	0.357	S	S	*	.	H	α-helix	trans	-67.4	-39.2	178.6	-174.3	179.2	-179	-176.9	0	112.8	N456 A457 I458	N456-K460 WeakPolarHBondContact O-CB 3.42Å; N456-K460 PolarHBondContact O-N 3.04Å; A457-K460 WeakPolarHBondContact O-CB 3.3Å; A457-K460 PolarHBondContact O-N 3.43Å; I458-K460 PolarHBondContact O-N 3.16Å
461	W	86.1	Confident	79.2	Confident	187 Å²	187	68 Å²	68	71%	0.708	35%	0.354	S	S	*	.	H	α-helix	trans	-70.9	-42.5	173.9	-83.4	97.5	0	0	0	111.1	A457 I458 R463 V464 V465	A457-W461 PolarHBondContact O-N 2.93Å; I458-W461 PolarHBondContact O-N 3.3Å; I458-W461 VanDerWaalsContact O-N 3.12Å; W461-R463 VanDerWaalsContact C-N 3.27Å; W461-R463 PolarHBondContact O-N 3.33Å; W461-V464 PolarHBondContact O-N 3.04Å; W461-V465 HydrophobicContact CE3-CG2 4.17Å; W461-V465 WeakPolarHBondContact O-CG2 3.32Å; W461-V465 PolarHBondContact O-N 3.45Å
462	S	88.2	Confident	81.5	Confident	11 Å²	11	70.2 Å²	70.2	8%	0.077	36%	0.36	C	S	.	.	H	α-helix	trans	-55.8	-41	176.8	-60.7	0	0	0	0	112	E330 I458 D459 V464 F466	E330-S462 WeakPolarHBondContact CG-OG 3.35Å; E330-S462 PolarHBondContact OE1-OG 3.49Å; I458-S462 WeakPolarHBondContact O-CB 3.44Å; I458-S462 PolarHBondContact O-N 2.93Å; I458-S462 PolarHBondContact O-OG 3.16Å; D459-S462 PolarHBondContact O-N 3.34Å; S462-V464 PolarHBondContact O-N 3.39Å; S462-V464 VanDerWaalsContact O-N 3.13Å; S462-F466 WeakPolarHBondContact O-CB 3.2Å; S462-F466 WeakPolarHBondContact O-CD2 3.21Å; S462-F466 PolarHBondContact O-N 3.33Å; S462-F466 VanDerWaalsContact O-N 3.15Å
463	R	89.8	Confident	83.7	Confident	86 Å²	86	68.2 Å²	68.2	33%	0.325	35%	0.348	S	S	.	.	H	α-helix	trans	-58.8	-23.4	176	-73.1	168.3	-160.3	178.2	5.4	114.8	F272 W273 D459 W461 P467	F272-R463 HydrophobicContact CB-CG 3.94Å; F272-R463 PolarHBondContact O-NE 3.35Å; F272-R463 PolarHBondContact O-NH2 2.66Å; W273-R463 HydrophobicContact CD2-CG 4.42Å; W273-R463 HydrophobicContact CH2-CG 4.34Å; W273-R463 HydrophobicContact CZ2-CB 4.5Å; W273-R463 HydrophobicContact CZ2-CG 4.06Å; D459-R463 WeakPolarHBondContact O-CG 3.27Å; D459-R463 PolarHBondContact O-N 3.3Å; D459-R463 VanDerWaalsContact O-N 3.07Å; W461-R463 VanDerWaalsContact C-N 3.27Å; W461-R463 PolarHBondContact O-N 3.33Å; R463-P467 WeakPolarHBondContact O-CD 3.42Å; R463-P467 WeakPolarHBondContact O-CG 3.31Å
464	V	89.9	Confident	85.7	Confident	82 Å²	82	64.8 Å²	64.8	50%	0.497	33%	0.326	S	S	.	.	H	α-helix	trans	-103.6	-44.2	-178.6	179.7	0	0	0	0	110.7	W461 S462 I468	W461-V464 PolarHBondContact O-N 3.04Å; S462-V464 PolarHBondContact O-N 3.39Å; S462-V464 VanDerWaalsContact O-N 3.13Å; V464-I468 HydrophobicContact CG1-CD1 3.52Å; V464-I468 HydrophobicContact CG1-CG1 4.49Å; V464-I468 WeakPolarHBondContact O-CB 3.49Å; V464-I468 WeakPolarHBondContact O-CD1 3.29Å; V464-I468 WeakPolarHBondContact O-CG1 3.3Å; V464-I468 PolarHBondContact O-N 3.05Å
465	V	92.2	Very high	87.4	Confident	66 Å²	66	64.4 Å²	64.4	40%	0.4	32%	0.324	S	S	.	.	H	α-helix	trans	-67.6	-45	-175.2	174.6	0	0	0	0	111.9	W461 I468 T469	W461-V465 HydrophobicContact CE3-CG2 4.17Å; W461-V465 WeakPolarHBondContact O-CG2 3.32Å; W461-V465 PolarHBondContact O-N 3.45Å; V465-I468 PolarHBondContact O-N 3.03Å; V465-T469 HydrophobicContact CG1-CG2 4.1Å; V465-T469 WeakPolarHBondContact O-CB 3.42Å; V465-T469 VanDerWaalsContact O-CG2 3.29Å; V465-T469 WeakPolarHBondContact O-CG2 3.28Å; V465-T469 PolarHBondContact O-N 3.14Å; V465-T469 PolarHBondContact O-OG1 2.88Å
466	F	92.4	Very high	89	Confident	24 Å²	24	67.2 Å²	67.2	11%	0.105	34%	0.341	C	S	.	.	H	α-helix	trans	-64	-49.5	-177	-84	-101.3	0	0	0	112.6	F272 F323 L326 A327 S462 I468 T469 F470	F272-F466 HydrophobicContact CE2-CB 4.04Å; F272-F466 HydrophobicContact CE2-CD1 4.34Å; F272-F466 AromaticContact CE2-CD2 3.86Å; F272-F466 HydrophobicContact CE2-CD2 3.86Å; F272-F466 HydrophobicContact CE2-CE2 4.35Å; F272-F466 AromaticContact CE2-CG 3.84Å; F272-F466 HydrophobicContact CE2-CG 3.84Å; F272-F466 HydrophobicContact CZ-CD1 4.15Å; F272-F466 AromaticContact CZ-CD2 3.76Å; F272-F466 HydrophobicContact CZ-CD2 3.76Å; F272-F466 HydrophobicContact CZ-CE1 4.18Å; F272-F466 AromaticContact CZ-CE2 3.79Å; F272-F466 HydrophobicContact CZ-CE2 3.79Å; F272-F466 AromaticContact CZ-CG 3.94Å; F272-F466 HydrophobicContact CZ-CG 3.94Å; F272-F466 AromaticContact CZ-CZ 4Å; F272-F466 HydrophobicContact CZ-CZ 4Å; F323-F466 HydrophobicContact CD1-CD1 4.33Å; L326-F466 HydrophobicContact CB-CE1 3.83Å; L326-F466 HydrophobicContact CB-CZ 4Å; A327-F466 HydrophobicContact CB-CE1 4.24Å; S462-F466 WeakPolarHBondContact O-CB 3.2Å; S462-F466 WeakPolarHBondContact O-CD2 3.21Å; S462-F466 PolarHBondContact O-N 3.33Å; S462-F466 VanDerWaalsContact O-N 3.15Å; F466-I468 PolarHBondContact O-N 3.46Å; F466-T469 PolarHBondContact O-OG1 3.46Å; F466-T469 VanDerWaalsContact O-OG1 3.08Å; F466-F470 VanDerWaalsContact O-CB 3.3Å; F466-F470 WeakPolarHBondContact O-CB 3.45Å; F466-F470 PolarHBondContact O-N 2.91Å
467	P	93	Very high	90.4	Very high	34 Å²	34	64.3 Å²	64.3	22%	0.221	32%	0.324	C	S	.	.	H	α-helix	trans	-61.1	-44.5	175.9	-25.6	35.4	0	0	0	113.2	W269 R463 T469 F470 T471	W269-P467 HydrophobicContact CD2-CG 4.39Å; W269-P467 HydrophobicContact CE3-CB 4.4Å; W269-P467 HydrophobicContact CE3-CG 3.8Å; W269-P467 HydrophobicContact CH2-CB 4.12Å; W269-P467 HydrophobicContact CH2-CG 4.3Å; W269-P467 HydrophobicContact CZ3-CB 3.82Å; W269-P467 HydrophobicContact CZ3-CG 3.75Å; R463-P467 WeakPolarHBondContact O-CD 3.42Å; R463-P467 WeakPolarHBondContact O-CG 3.31Å; P467-T469 PolarHBondContact O-N 3.04Å; P467-F470 PolarHBondContact O-N 2.88Å; P467-T471 WeakPolarHBondContact O-CB 3.31Å; P467-T471 PolarHBondContact O-N 2.77Å; P467-T471 PolarHBondContact O-OG1 3.33Å
468	I	93.6	Very high	91.3	Very high	108 Å²	108	65.9 Å²	65.9	55%	0.554	32%	0.323	S	S	*	.	H	α-helix	trans	-62.7	-47.1	-178.8	-69.3	174.3	0	0	0	111.1	V464 V465 F466 T471 F472	V464-I468 HydrophobicContact CG1-CD1 3.52Å; V464-I468 HydrophobicContact CG1-CG1 4.49Å; V464-I468 WeakPolarHBondContact O-CB 3.49Å; V464-I468 WeakPolarHBondContact O-CD1 3.29Å; V464-I468 WeakPolarHBondContact O-CG1 3.3Å; V464-I468 PolarHBondContact O-N 3.05Å; V465-I468 PolarHBondContact O-N 3.03Å; F466-I468 PolarHBondContact O-N 3.46Å; I468-T471 PolarHBondContact O-N 3.48Å; I468-F472 WeakPolarHBondContact O-CB 3.12Å; I468-F472 PolarHBondContact O-N 3.14Å
469	T	94.8	Very high	92	Very high	57 Å²	57	68.9 Å²	68.9	35%	0.35	34%	0.339	S	S	.	.	H	α-helix	trans	-66.8	-37	179.9	51.8	0	0	0	0	112	F323 V465 F466 P467 F472 F473	F323-T469 WeakPolarHBondContact CE1-OG1 3.33Å; V465-T469 HydrophobicContact CG1-CG2 4.1Å; V465-T469 WeakPolarHBondContact O-CB 3.42Å; V465-T469 VanDerWaalsContact O-CG2 3.29Å; V465-T469 WeakPolarHBondContact O-CG2 3.28Å; V465-T469 PolarHBondContact O-N 3.14Å; V465-T469 PolarHBondContact O-OG1 2.88Å; F466-T469 PolarHBondContact O-OG1 3.46Å; F466-T469 VanDerWaalsContact O-OG1 3.08Å; P467-T469 PolarHBondContact O-N 3.04Å; T469-F472 PolarHBondContact O-N 2.95Å; T469-F473 WeakPolarHBondContact O-CB 3.08Å; T469-F473 PolarHBondContact O-N 3Å
470	F	95.3	Very high	92.4	Very high	9 Å²	9	75.8 Å²	75.8	4%	0.039	37%	0.366	C	S	.	.	H	α-helix	trans	-68.9	-40.2	174.9	-174.8	-108.4	0	0	0	112.7	I262 T265 W269 F323 F466 P467 F472 F473 N474	I262-F470 HydrophobicContact CG1-CE1 4.39Å; I262-F470 HydrophobicContact CG1-CZ 4.19Å; I262-F470 HydrophobicContact CG2-CE1 4.26Å; T265-F470 HydrophobicContact CG2-CD2 4.01Å; T265-F470 HydrophobicContact CG2-CE2 3.84Å; T265-F470 HydrophobicContact CG2-CG 4.44Å; T265-F470 HydrophobicContact CG2-CZ 4.13Å; W269-F470 HydrophobicContact CH2-CB 3.95Å; W269-F470 AromaticContact CH2-CD1 3.71Å; W269-F470 HydrophobicContact CH2-CD1 3.71Å; W269-F470 HydrophobicContact CH2-CG 4.07Å; W269-F470 HydrophobicContact CZ2-CB 3.68Å; W269-F470 AromaticContact CZ2-CD1 3.87Å; W269-F470 HydrophobicContact CZ2-CD1 3.87Å; W269-F470 AromaticContact CZ2-CG 3.82Å; W269-F470 HydrophobicContact CZ2-CG 3.82Å; F323-F470 AromaticContact CD2-CD2 3.66Å; F323-F470 HydrophobicContact CD2-CD2 3.66Å; F323-F470 HydrophobicContact CD2-CE2 4.28Å; F323-F470 HydrophobicContact CE1-CB 4.37Å; F323-F470 AromaticContact CE2-CD2 3.84Å; F323-F470 HydrophobicContact CE2-CD2 3.84Å; F323-F470 HydrophobicContact CG-CD2 4.12Å; F323-F470 HydrophobicContact CZ-CB 4.38Å; F323-F470 HydrophobicContact CZ-CD2 4.41Å; F466-F470 VanDerWaalsContact O-CB 3.3Å; F466-F470 WeakPolarHBondContact O-CB 3.45Å; F466-F470 PolarHBondContact O-N 2.91Å; P467-F470 PolarHBondContact O-N 2.88Å; F470-F472 VanDerWaalsContact C-N 3.35Å; F470-F473 HydrophobicContact CD2-CD1 4.35Å; F470-F473 HydrophobicContact CE2-CD1 4.32Å; F470-F473 WeakPolarHBondContact O-CB 3.27Å; F470-F473 PolarHBondContact O-N 3.3Å; F470-N474 WeakPolarHBondContact CD1-ND2 3.03Å; F470-N474 WeakPolarHBondContact CE1-ND2 3.02Å; F470-N474 WeakPolarHBondContact CZ-ND2 3.12Å; F470-N474 PolarHBondContact O-N 2.96Å; F470-N474 PolarHBondContact O-ND2 2.86Å
471	T	94.3	Very high	92.7	Very high	90 Å²	90	70.2 Å²	70.2	55%	0.552	34%	0.341	S	S	*	.	H	α-helix	trans	-62.9	-43.1	173.8	-62.9	0	0	0	0	111	P467 I468 N474 L475	P467-T471 WeakPolarHBondContact O-CB 3.31Å; P467-T471 PolarHBondContact O-N 2.77Å; P467-T471 PolarHBondContact O-OG1 3.33Å; I468-T471 PolarHBondContact O-N 3.48Å; T471-N474 PolarHBondContact O-N 3.04Å; T471-L475 WeakPolarHBondContact O-CB 3.31Å; T471-L475 PolarHBondContact O-N 3.44Å
472	F	95.6	Very high	92.6	Very high	138 Å²	138	65.3 Å²	65.3	61%	0.605	33%	0.332	S	S	*	.	H	α-helix	trans	-61.3	-45.1	174.6	180	-102.9	0	0	0	111.8	I468 T469 F470 N474 L475 V476	I468-F472 WeakPolarHBondContact O-CB 3.12Å; I468-F472 PolarHBondContact O-N 3.14Å; T469-F472 PolarHBondContact O-N 2.95Å; F470-F472 VanDerWaalsContact C-N 3.35Å; F472-N474 PolarHBondContact O-N 3.39Å; F472-L475 PolarHBondContact O-N 3.26Å; F472-V476 HydrophobicContact CD1-CG2 4.32Å; F472-V476 HydrophobicContact CD2-CG2 4.4Å; F472-V476 HydrophobicContact CE1-CG2 3.89Å; F472-V476 HydrophobicContact CE2-CG2 3.97Å; F472-V476 HydrophobicContact CZ-CG2 3.7Å; F472-V476 WeakPolarHBondContact O-CG2 3.46Å; F472-V476 PolarHBondContact O-N 3.15Å
473	F	95.3	Very high	91.9	Very high	45 Å²	45	73.1 Å²	73.1	20%	0.197	37%	0.367	C	S	.	.	H	α-helix	trans	-56.2	-47.4	174.4	169	-100.6	0	0	0	112.1	Y316 F323 T469 F470 V476 Y477	Y316-F473 AromaticContact CD2-CE1 3.95Å; Y316-F473 HydrophobicContact CD2-CE1 3.95Å; Y316-F473 HydrophobicContact CD2-CZ 4.36Å; Y316-F473 HydrophobicContact CE2-CE1 4.05Å; F323-F473 HydrophobicContact CE2-CB 4.07Å; F323-F473 HydrophobicContact CE2-CD1 4.2Å; F323-F473 HydrophobicContact CE2-CG 4.02Å; F323-F473 HydrophobicContact CZ-CB 4.21Å; T469-F473 WeakPolarHBondContact O-CB 3.08Å; T469-F473 PolarHBondContact O-N 3Å; F470-F473 HydrophobicContact CD2-CD1 4.35Å; F470-F473 HydrophobicContact CE2-CD1 4.32Å; F470-F473 WeakPolarHBondContact O-CB 3.27Å; F470-F473 PolarHBondContact O-N 3.3Å; F473-V476 PolarHBondContact O-N 3.09Å; F473-Y477 VanDerWaalsContact O-CB 3.25Å; F473-Y477 WeakPolarHBondContact O-CB 3.34Å; F473-Y477 PolarHBondContact O-N 2.94Å
474	N	94.4	Very high	92.1	Very high	22 Å²	22	72.5 Å²	72.5	12%	0.118	37%	0.369	C	S	.	.	H	α-helix	trans	-61.9	-45.2	177.3	-85	-88	0	0	0	111.7	Y316 F470 T471 F472 V476 Y477 W478	Y316-N474 WeakPolarHBondContact CE2-OD1 3.11Å; Y316-N474 PolarHBondContact OH-OD1 3.11Å; Y316-N474 VanDerWaalsContact OH-OD1 3.13Å; F470-N474 WeakPolarHBondContact CD1-ND2 3.03Å; F470-N474 WeakPolarHBondContact CE1-ND2 3.02Å; F470-N474 WeakPolarHBondContact CZ-ND2 3.12Å; F470-N474 PolarHBondContact O-N 2.96Å; F470-N474 PolarHBondContact O-ND2 2.86Å; T471-N474 PolarHBondContact O-N 3.04Å; F472-N474 PolarHBondContact O-N 3.39Å; N474-V476 PolarHBondContact O-N 2.77Å; N474-Y477 PolarHBondContact O-N 3.23Å; N474-W478 PolarHBondContact O-N 3.01Å
475	L	94.1	Very high	92.2	Very high	97 Å²	97	72 Å²	72	51%	0.508	36%	0.362	S	S	.	.	H	α-helix	trans	-60.1	-47.8	180	-173.1	152.9	0	0	0	111	T471 F472 L479	T471-L475 WeakPolarHBondContact O-CB 3.31Å; T471-L475 PolarHBondContact O-N 3.44Å; F472-L475 PolarHBondContact O-N 3.26Å; L475-L479 HydrophobicContact CD2-CD1 3.47Å; L475-L479 VanDerWaalsContact CD2-CD1 3.47Å; L475-L479 HydrophobicContact CD2-CG 4.32Å; L475-L479 HydrophobicContact CG-CD1 4.27Å; L475-L479 WeakPolarHBondContact O-CB 3.45Å; L475-L479 VanDerWaalsContact O-CG 3.27Å; L475-L479 WeakPolarHBondContact O-CG 3.43Å; L475-L479 PolarHBondContact O-N 2.94Å
476	V	95.1	Very high	92.2	Very high	69 Å²	69	72.3 Å²	72.3	42%	0.418	36%	0.36	S	S	.	.	H	α-helix	trans	-63	-44	176.9	173.6	0	0	0	0	111.1	F472 F473 N474 Y480	F472-V476 HydrophobicContact CD1-CG2 4.32Å; F472-V476 HydrophobicContact CD2-CG2 4.4Å; F472-V476 HydrophobicContact CE1-CG2 3.89Å; F472-V476 HydrophobicContact CE2-CG2 3.97Å; F472-V476 HydrophobicContact CZ-CG2 3.7Å; F472-V476 WeakPolarHBondContact O-CG2 3.46Å; F472-V476 PolarHBondContact O-N 3.15Å; F473-V476 PolarHBondContact O-N 3.09Å; N474-V476 PolarHBondContact O-N 2.77Å; V476-Y480 VanDerWaalsContact O-CB 3.27Å; V476-Y480 WeakPolarHBondContact O-CB 3.32Å; V476-Y480 PolarHBondContact O-N 2.96Å
477	Y	94.4	Very high	92.2	Very high	8 Å²	8	75.2 Å²	75.2	3%	0.031	38%	0.375	C	S	.	.	H	α-helix	trans	-59.4	-53.9	179.4	177.4	-92.6	0	0	0	111.8	Y258 A312 Y316 F473 N474 Y480 Y481	Y258-Y477 AromaticContact CE1-CE1 3.73Å; Y258-Y477 HydrophobicContact CE1-CE1 3.73Å; Y258-Y477 PolarHBondContact OH-OH 3.13Å; A312-Y477 WeakPolarHBondContact O-CE2 3.31Å; A312-Y477 PolarHBondContact O-OH 3.09Å; Y316-Y477 AromaticContact CD2-CD1 3.66Å; Y316-Y477 HydrophobicContact CD2-CD1 3.66Å; Y316-Y477 HydrophobicContact CD2-CD2 4.01Å; Y316-Y477 AromaticContact CD2-CE1 3.69Å; Y316-Y477 HydrophobicContact CD2-CE1 3.69Å; Y316-Y477 HydrophobicContact CD2-CE2 4.04Å; Y316-Y477 AromaticContact CD2-CG 3.84Å; Y316-Y477 HydrophobicContact CD2-CG 3.84Å; Y316-Y477 AromaticContact CD2-CZ 3.89Å; Y316-Y477 HydrophobicContact CE2-CD1 4.17Å; Y316-Y477 HydrophobicContact CE2-CE1 4.41Å; Y316-Y477 HydrophobicContact CG-CE1 4.27Å; Y316-Y477 HydrophobicContact CG-CE2 4.33Å; F473-Y477 VanDerWaalsContact O-CB 3.25Å; F473-Y477 WeakPolarHBondContact O-CB 3.34Å; F473-Y477 PolarHBondContact O-N 2.94Å; N474-Y477 PolarHBondContact O-N 3.23Å; Y477-Y480 PolarHBondContact O-N 2.9Å; Y477-Y481 HydrophobicContact CD1-CD2 4.47Å; Y477-Y481 AromaticContact CD2-CD2 3.5Å; Y477-Y481 HydrophobicContact CD2-CD2 3.5Å; Y477-Y481 AromaticContact CD2-CE2 3.57Å; Y477-Y481 HydrophobicContact CD2-CE2 3.57Å; Y477-Y481 HydrophobicContact CE1-CD2 4.35Å; Y477-Y481 AromaticContact CE2-CD2 3.33Å; Y477-Y481 HydrophobicContact CE2-CD2 3.33Å; Y477-Y481 AromaticContact CE2-CE2 3.41Å; Y477-Y481 HydrophobicContact CE2-CE2 3.41Å; Y477-Y481 VanDerWaalsContact CE2-CE2 3.41Å; Y477-Y481 HydrophobicContact CE2-CG 4.36Å; Y477-Y481 HydrophobicContact CG-CD2 4.08Å; Y477-Y481 AromaticContact CZ-CD2 3.8Å; Y477-Y481 WeakPolarHBondContact O-CD2 3.4Å; Y477-Y481 PolarHBondContact O-N 2.89Å
478	W	93.1	Very high	92.1	Very high	65 Å²	65	77.8 Å²	77.8	25%	0.246	39%	0.385	C	S	.	.	H	α-helix	trans	-66.6	-40.2	-177.4	-72.3	109.5	0	0	0	111.6	L175 I254 Y258 N474 Y480 V482	L175-W478 HydrophobicContact CD1-CE3 4.45Å; L175-W478 HydrophobicContact CD1-CZ3 4.08Å; L175-W478 HydrophobicContact CD2-CZ3 4.27Å; I254-W478 HydrophobicContact CD1-CH2 3.35Å; I254-W478 HydrophobicContact CD1-CZ2 3.95Å; I254-W478 HydrophobicContact CD1-CZ3 4.19Å; Y258-W478 HydrophobicContact CD1-CH2 4.05Å; Y258-W478 AromaticContact CD1-CZ2 3.67Å; Y258-W478 HydrophobicContact CD1-CZ2 3.67Å; Y258-W478 HydrophobicContact CD2-CH2 4.28Å; Y258-W478 AromaticContact CE1-CH2 3.98Å; Y258-W478 HydrophobicContact CE1-CH2 3.98Å; Y258-W478 AromaticContact CE1-CZ2 3.9Å; Y258-W478 HydrophobicContact CE1-CZ2 3.9Å; Y258-W478 HydrophobicContact CE2-CH2 4.2Å; Y258-W478 HydrophobicContact CG-CH2 4.21Å; Y258-W478 HydrophobicContact CG-CZ2 4.06Å; N474-W478 PolarHBondContact O-N 3.01Å; W478-Y480 VanDerWaalsContact C-N 3.34Å; W478-Y480 PolarHBondContact O-N 2.9Å; W478-V482 HydrophobicContact CE3-CG2 3.67Å; W478-V482 HydrophobicContact CZ3-CG2 4.32Å; W478-V482 WeakPolarHBondContact O-CB 3.27Å; W478-V482 WeakPolarHBondContact O-CG2 3.45Å; W478-V482 PolarHBondContact O-N 3.24Å
479	L	92.4	Very high	92	Very high	101 Å²	101	75.7 Å²	75.7	53%	0.529	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-39	175.5	-74	179.5	0	0	0	112.6	L475 H483	L475-L479 HydrophobicContact CD2-CD1 3.47Å; L475-L479 VanDerWaalsContact CD2-CD1 3.47Å; L475-L479 HydrophobicContact CD2-CG 4.32Å; L475-L479 HydrophobicContact CG-CD1 4.27Å; L475-L479 WeakPolarHBondContact O-CB 3.45Å; L475-L479 VanDerWaalsContact O-CG 3.27Å; L475-L479 WeakPolarHBondContact O-CG 3.43Å; L475-L479 PolarHBondContact O-N 2.94Å; L479-H483 WeakPolarHBondContact O-CB 3.42Å
480	Y	93.1	Very high	91.8	Very high	146 Å²	146	77.1 Å²	77.1	57%	0.573	38%	0.375	S	S	*	.	H	α-helix	trans	-75.8	-34.2	-177.3	179.7	-94.9	0	0	0	113.8	V476 Y477 W478 H483	V476-Y480 VanDerWaalsContact O-CB 3.27Å; V476-Y480 WeakPolarHBondContact O-CB 3.32Å; V476-Y480 PolarHBondContact O-N 2.96Å; Y477-Y480 PolarHBondContact O-N 2.9Å; W478-Y480 VanDerWaalsContact C-N 3.34Å; W478-Y480 PolarHBondContact O-N 2.9Å; Y480-H483 VanDerWaalsContact O-OXT 3.08Å
481	Y	89.3	Confident	91.5	Very high	29 Å²	29	82.3 Å²	82.3	11%	0.114	40%	0.401	C	S	.	.	H	α-helix	trans	-98.5	-19.7	-175.2	-72.9	-70.6	0	0	0	114.5	R172 A312 I315 Y477	R172-Y481 HydrophobicContact CG-CD1 4.41Å; A312-Y481 HydrophobicContact CB-CD1 3.48Å; A312-Y481 VanDerWaalsContact CB-CD1 3.48Å; A312-Y481 HydrophobicContact CB-CD2 4.26Å; A312-Y481 HydrophobicContact CB-CE1 3.34Å; A312-Y481 HydrophobicContact CB-CE2 4.15Å; A312-Y481 HydrophobicContact CB-CG 3.97Å; I315-Y481 WeakPolarHBondContact CD1-OH 3.3Å; Y477-Y481 HydrophobicContact CD1-CD2 4.47Å; Y477-Y481 AromaticContact CD2-CD2 3.5Å; Y477-Y481 HydrophobicContact CD2-CD2 3.5Å; Y477-Y481 AromaticContact CD2-CE2 3.57Å; Y477-Y481 HydrophobicContact CD2-CE2 3.57Å; Y477-Y481 HydrophobicContact CE1-CD2 4.35Å; Y477-Y481 AromaticContact CE2-CD2 3.33Å; Y477-Y481 HydrophobicContact CE2-CD2 3.33Å; Y477-Y481 AromaticContact CE2-CE2 3.41Å; Y477-Y481 HydrophobicContact CE2-CE2 3.41Å; Y477-Y481 VanDerWaalsContact CE2-CE2 3.41Å; Y477-Y481 HydrophobicContact CE2-CG 4.36Å; Y477-Y481 HydrophobicContact CG-CD2 4.08Å; Y477-Y481 AromaticContact CZ-CD2 3.8Å; Y477-Y481 WeakPolarHBondContact O-CD2 3.4Å; Y477-Y481 PolarHBondContact O-N 2.89Å
482	V	85.2	Confident	91.3	Very high	85 Å²	85	81.7 Å²	81.7	52%	0.515	39%	0.389	S	S	.	.	H	α-helix	trans	-86.9	-32.4	175.7	177.7	0	0	0	0	111.9	L175 W478	L175-V482 HydrophobicContact CD1-CG2 4.45Å; L175-V482 HydrophobicContact CD2-CG2 4.24Å; W478-V482 HydrophobicContact CE3-CG2 3.67Å; W478-V482 HydrophobicContact CZ3-CG2 4.32Å; W478-V482 WeakPolarHBondContact O-CB 3.27Å; W478-V482 WeakPolarHBondContact O-CG2 3.45Å; W478-V482 PolarHBondContact O-N 3.24Å
483	H	73.8	Confident	90.9	Very high	175 Å²	175	76.5 Å²	76.5	81%	0.81	37%	0.369	S	S	*	.			trans	-96.1	0	171.1	-72.8	-58.4	0	0	0	111.5	R172 L479 Y480	R172-H483 PolarHBondContact NH1-OXT 3.33Å; L479-H483 WeakPolarHBondContact O-CB 3.42Å; Y480-H483 VanDerWaalsContact O-OXT 3.08Å

Retrieved 483 of 483 residues in 246.4 ms (Link to these results)

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