TM9S4_HUMAN Loading...

Transmembrane 9 superfamily member 4

Associates with proteins harboring glycine-rich transmembrane domains and ensures their efficient localization to the cell surface¹. Regulates the assembly and activity of V-ATPase in colon cancer cells via its interaction with V-type proton ATPase subunit H (ATP6V1H) and contributes to V-ATPase-mediated pH alterations in cancer cells which play an important role in drug resistance and invasiveness of colon cancer cells². Plays an important role in an atypical phagocytic activity of metastatic melanoma cells called cannibalism and is involved in the pH regulation of the intracellular vesicles in tumor cells³.

AlphaFold DB , UniProt , Accession Q92544, Species HUMAN (Homo sapiens, Human), Gene TM9SF4, Length 642 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	47.3	Very low	57.5	Low	246 Å²	246	128.1 Å²	128.1	100%	1.212	69%	0.687	S	S	*	*				0	22	0	-84.7	-178.5	-178.3	0	0	113.5
2	A	47.9	Very low	58.2	Low	86 Å²	86	127.1 Å²	127.1	71%	0.711	68%	0.68	S	S	*	*			trans	-111.1	2.1	-174	0	0	0	0	0	114.7
3	T	54.6	Low	58.9	Low	122 Å²	122	125.2 Å²	125.2	75%	0.748	67%	0.669	S	S	*	*	S	Bend	trans	-106.4	-1	-172.4	48.4	0	0	0	0	114.4
4	A	53.2	Low	59.5	Low	81 Å²	81	124.2 Å²	124.2	67%	0.669	66%	0.663	S	S	*	*	S	Bend	trans	-94.7	-7.9	-177.9	0	0	0	0	0	114.1
5	M	54.4	Low	59.8	Low	149 Å²	149	127.3 Å²	127.3	73%	0.734	67%	0.669	S	S	*	*	S	Bend	trans	-97.1	-9.1	-168.6	-145.1	141.4	74.9	0	0	114.5
6	D	56.5	Low	60	Low	117 Å²	117	125.3 Å²	125.3	63%	0.626	67%	0.668	S	S	*	*	S	Bend	trans	-84.6	-15.1	-179.4	-65.8	-28.5	0	0	0	113.7	P9	D6-P9 WeakPolarHBondContact O-CD 3.13Å
7	W	55	Low	60.2	Low	193 Å²	193	125.3 Å²	125.3	73%	0.731	67%	0.668	S	S	*	*	S	Bend	trans	-87.8	-15.8	-179.8	-67.6	92.3	0	0	0	113.8	W10 S11	W7-W10 PolarHBondContact O-N 2.97Å; W7-S11 WeakPolarHBondContact O-CB 3.36Å; W7-S11 PolarHBondContact O-N 2.73Å; W7-S11 PolarHBondContact O-OG 3.4Å; W7-S11 VanDerWaalsContact O-OG 3.1Å
8	L	63.5	Low	60.1	Low	98 Å²	98	126.4 Å²	126.4	51%	0.513	67%	0.67	S	S	.	*	H	α-helix	trans	-63.3	-42.3	-178.9	-116.3	141.1	0	0	0	114.9	S11 L12	L8-S11 WeakPolarHBondContact CA-OG 3.35Å; L8-S11 PolarHBondContact O-OG 3.29Å; L8-S11 VanDerWaalsContact O-OG 3.07Å; L8-L12 HydrophobicContact CD2-CD1 4.25Å; L8-L12 WeakPolarHBondContact O-CB 3.07Å; L8-L12 WeakPolarHBondContact O-CG 3.27Å; L8-L12 PolarHBondContact O-N 2.69Å; L8-L12 VanDerWaalsContact O-N 3.08Å
9	P	65.9	Low	59.9	Low	79 Å²	79	124.6 Å²	124.6	51%	0.513	67%	0.668	S	S	.	*	H	α-helix	trans	-69.9	-33.7	175.2	24.9	-31.7	0	0	0	112.1	D6 L13	D6-P9 WeakPolarHBondContact O-CD 3.13Å; P9-L13 WeakPolarHBondContact O-CB 3.25Å; P9-L13 PolarHBondContact O-N 3.14Å
10	W	68.4	Low	59.5	Low	177 Å²	177	127.5 Å²	127.5	67%	0.67	68%	0.677	S	S	*	*	H	α-helix	trans	-72.6	-37.3	176.9	-72.8	96.5	0	0	0	112.4	W7 L13 L14	W7-W10 PolarHBondContact O-N 2.97Å; W10-L13 PolarHBondContact O-N 3.02Å; W10-L14 WeakPolarHBondContact O-CB 3.16Å; W10-L14 PolarHBondContact O-N 3.43Å
11	S	65.5	Low	59.3	Low	61 Å²	61	127.7 Å²	127.7	43%	0.427	68%	0.683	S	S	.	*	H	α-helix	trans	-71.1	-36	175.8	62.2	0	0	0	0	112.2	W7 L8 L14 F15	W7-S11 WeakPolarHBondContact O-CB 3.36Å; W7-S11 PolarHBondContact O-N 2.73Å; W7-S11 PolarHBondContact O-OG 3.4Å; W7-S11 VanDerWaalsContact O-OG 3.1Å; L8-S11 WeakPolarHBondContact CA-OG 3.35Å; L8-S11 PolarHBondContact O-OG 3.29Å; L8-S11 VanDerWaalsContact O-OG 3.07Å; S11-L14 PolarHBondContact O-N 3.21Å; S11-F15 WeakPolarHBondContact O-CB 3.37Å; S11-F15 PolarHBondContact O-N 3.2Å
12	L	66.6	Low	59.5	Low	116 Å²	116	121.3 Å²	121.3	61%	0.607	66%	0.663	S	S	*	*	H	α-helix	trans	-66.5	-37.5	171.1	-81.2	162.5	0	0	0	112.5	L8 F15 S16	L8-L12 HydrophobicContact CD2-CD1 4.25Å; L8-L12 WeakPolarHBondContact O-CB 3.07Å; L8-L12 WeakPolarHBondContact O-CG 3.27Å; L8-L12 PolarHBondContact O-N 2.69Å; L8-L12 VanDerWaalsContact O-N 3.08Å; L12-F15 PolarHBondContact O-N 3.42Å; L12-S16 WeakPolarHBondContact O-CB 3.09Å; L12-S16 PolarHBondContact O-N 2.89Å
13	L	67.4	Low	59.6	Low	103 Å²	103	122.2 Å²	122.2	54%	0.539	67%	0.671	S	S	.	*	H	α-helix	trans	-66.3	-42.1	173.8	-150.3	106.8	0	0	0	111	P9 W10 S16 L17	P9-L13 WeakPolarHBondContact O-CB 3.25Å; P9-L13 PolarHBondContact O-N 3.14Å; W10-L13 PolarHBondContact O-N 3.02Å; L13-S16 WeakPolarHBondContact O-CB 3.45Å; L13-S16 PolarHBondContact O-N 3.21Å; L13-L17 HydrophobicContact CD2-CD1 4.13Å; L13-L17 WeakPolarHBondContact O-CD1 3.48Å; L13-L17 WeakPolarHBondContact O-CG 3.07Å; L13-L17 PolarHBondContact O-N 3.02Å
14	L	66.6	Low	59.1	Low	111 Å²	111	123.9 Å²	123.9	58%	0.581	67%	0.668	S	S	*	*	H	α-helix	trans	-66.6	-38.7	176.1	-140.7	92.2	0	0	0	111.9	W10 S11 S16 L17 M18	W10-L14 WeakPolarHBondContact O-CB 3.16Å; W10-L14 PolarHBondContact O-N 3.43Å; S11-L14 PolarHBondContact O-N 3.21Å; L14-S16 VanDerWaalsContact C-N 3.34Å; L14-L17 PolarHBondContact O-N 3.27Å; L14-M18 WeakPolarHBondContact O-CB 3.4Å; L14-M18 WeakPolarHBondContact O-CG 3.01Å; L14-M18 PolarHBondContact O-N 3.06Å
15	F	64.2	Low	58.5	Low	171 Å²	171	125.6 Å²	125.6	75%	0.75	66%	0.657	S	S	*	*	H	α-helix	trans	-68.7	-33.4	175.5	-130.8	-93.4	0	0	0	112.1	S11 L12 L17 M18	S11-F15 WeakPolarHBondContact O-CB 3.37Å; S11-F15 PolarHBondContact O-N 3.2Å; L12-F15 PolarHBondContact O-N 3.42Å; F15-L17 VanDerWaalsContact C-N 3.31Å; F15-M18 PolarHBondContact O-N 3.37Å
16	S	62.5	Low	58	Low	94 Å²	94	121.8 Å²	121.8	66%	0.657	64%	0.643	S	S	*	*	H	α-helix	trans	-68.6	-29.1	171.1	178.5	0	0	0	0	112.8	L12 L13 L14	L12-S16 WeakPolarHBondContact O-CB 3.09Å; L12-S16 PolarHBondContact O-N 2.89Å; L13-S16 WeakPolarHBondContact O-CB 3.45Å; L13-S16 PolarHBondContact O-N 3.21Å; L14-S16 VanDerWaalsContact C-N 3.34Å
17	L	63.1	Low	57.4	Low	126 Å²	126	118.5 Å²	118.5	66%	0.66	63%	0.627	S	S	*	*	H	α-helix	trans	-82.8	-19.9	176.5	-82.9	152.9	0	0	0	113.1	L13 L14 F15	L13-L17 HydrophobicContact CD2-CD1 4.13Å; L13-L17 WeakPolarHBondContact O-CD1 3.48Å; L13-L17 WeakPolarHBondContact O-CG 3.07Å; L13-L17 PolarHBondContact O-N 3.02Å; L14-L17 PolarHBondContact O-N 3.27Å; F15-L17 VanDerWaalsContact C-N 3.31Å
18	M	59.2	Low	57.3	Low	145 Å²	145	109.6 Å²	109.6	71%	0.714	60%	0.596	S	S	*	*	S	Bend	trans	-90.7	0.5	179.8	-71.3	-83.1	129.8	0	0	113.7	L14 F15 E20	L14-M18 WeakPolarHBondContact O-CB 3.4Å; L14-M18 WeakPolarHBondContact O-CG 3.01Å; L14-M18 PolarHBondContact O-N 3.06Å; F15-M18 PolarHBondContact O-N 3.37Å; M18-E20 PolarHBondContact O-N 2.84Å
19	C	56.8	Low	57.2	Low	92 Å²	92	109.4 Å²	109.4	62%	0.622	60%	0.598	S	S	*	*	S	Bend	trans	-73.1	111	173.1	-157.6	0	0	0	0	107.7	T21	C19-T21 PolarHBondContact O-N 3.07Å
20	E	51.5	Low	57.4	Low	182 Å²	182	107.7 Å²	107.7	85%	0.85	59%	0.591	S	S	*	*			trans	-53	101.3	172.1	-73.4	-170.6	165	0	0	109	M18 S22	M18-E20 PolarHBondContact O-N 2.84Å; E20-S22 PolarHBondContact O-N 2.86Å
21	T	54.7	Low	57.9	Low	132 Å²	132	101.5 Å²	101.5	81%	0.81	57%	0.574	S	S	*	*			trans	-71.4	101.3	175	52	0	0	0	0	107.1	C19 A23	C19-T21 PolarHBondContact O-N 3.07Å; T21-A23 PolarHBondContact O-N 3.25Å
22	S	52.9	Low	58.8	Low	113 Å²	113	101.7 Å²	101.7	79%	0.79	57%	0.569	S	S	*	*			trans	-66.2	103.4	162.3	17.6	0	0	0	0	106.7	E20 F24	E20-S22 PolarHBondContact O-N 2.86Å; S22-F24 PolarHBondContact O-N 3.45Å
23	A	49.6	Very low	59.9	Low	105 Å²	105	99.6 Å²	99.6	87%	0.868	56%	0.559	S	S	*	*			trans	-58.9	114.3	173.3	0	0	0	0	0	108.1	T21	T21-A23 PolarHBondContact O-N 3.25Å
24	F	43	Very low	61	Low	157 Å²	157	95.7 Å²	95.7	69%	0.689	54%	0.537	S	S	*	.			trans	-93.3	130	175.9	140.6	-99.8	0	0	0	108.6	S22 V26	S22-F24 PolarHBondContact O-N 3.45Å; F24-V26 HydrophobicContact CD1-CG2 4.11Å; F24-V26 HydrophobicContact CE1-CB 4.4Å; F24-V26 HydrophobicContact CE1-CG2 3.73Å; F24-V26 HydrophobicContact CZ-CG2 4.48Å; F24-V26 PolarHBondContact O-N 3.41Å
25	Y	42	Very low	62.1	Low	116 Å²	116	94.1 Å²	94.1	46%	0.455	53%	0.527	S	S	.	.			trans	-65.8	111	173.7	172	-101.2	0	0	0	109.5	P27 A30	Y25-P27 HydrophobicContact CD1-CB 4.41Å; Y25-P27 HydrophobicContact CD1-CG 4.14Å; Y25-P27 VanDerWaalsContact CE1-CA 3.47Å; Y25-P27 HydrophobicContact CE1-CB 3.9Å; Y25-P27 HydrophobicContact CE1-CG 4.12Å; Y25-P27 WeakPolarHBondContact O-CD 3.32Å; Y25-A30 HydrophobicContact CE2-CB 4.18Å
26	V	43.9	Very low	63.3	Low	70 Å²	70	89.5 Å²	89.5	42%	0.424	51%	0.508	S	S	.	.			trans	-77.3	109.7	170.1	-172.6	0	0	0	0	107.8	F24 G28 V29	F24-V26 HydrophobicContact CD1-CG2 4.11Å; F24-V26 HydrophobicContact CE1-CB 4.4Å; F24-V26 HydrophobicContact CE1-CG2 3.73Å; F24-V26 HydrophobicContact CZ-CG2 4.48Å; F24-V26 PolarHBondContact O-N 3.41Å; V26-G28 PolarHBondContact O-N 2.67Å; V26-V29 HydrophobicContact CB-CB 4.41Å; V26-V29 HydrophobicContact CB-CG2 3.78Å; V26-V29 HydrophobicContact CG1-CG2 3.57Å; V26-V29 PolarHBondContact O-N 2.77Å
27	P	43.3	Very low	64.7	Low	47 Å²	47	89.1 Å²	89.1	31%	0.305	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	132.6	-177.8	-18.2	32.3	0	0	0	110.9	Y25	Y25-P27 HydrophobicContact CD1-CB 4.41Å; Y25-P27 HydrophobicContact CD1-CG 4.14Å; Y25-P27 VanDerWaalsContact CE1-CA 3.47Å; Y25-P27 HydrophobicContact CE1-CB 3.9Å; Y25-P27 HydrophobicContact CE1-CG 4.12Å; Y25-P27 WeakPolarHBondContact O-CD 3.32Å
28	G	52.8	Low	66.1	Low	6 Å²	6	85.7 Å²	85.7	6%	0.062	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.7	-3.7	177.9	0	0	0	0	0	115.6	V26 N137	V26-G28 PolarHBondContact O-N 2.67Å; G28-N137 PolarHBondContact N-ND2 3.05Å
29	V	61.8	Low	67.7	Low	94 Å²	94	83 Å²	83	57%	0.57	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-30.1	176.5	-175.3	0	0	0	0	112.3	V26	V26-V29 HydrophobicContact CB-CB 4.41Å; V26-V29 HydrophobicContact CB-CG2 3.78Å; V26-V29 HydrophobicContact CG1-CG2 3.57Å; V26-V29 PolarHBondContact O-N 2.77Å
30	A	70	Confident	69.5	Low	44 Å²	44	78.8 Å²	78.8	36%	0.364	45%	0.445	S	S	.	.	S	Bend	trans	-116	140.6	177.5	0	0	0	0	0	111.3	Y25	Y25-A30 HydrophobicContact CE2-CB 4.18Å
31	P	79.2	Confident	71.5	Confident	47 Å²	47	76.1 Å²	76.1	31%	0.305	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-65.8	143.9	178	26.6	-33.1	0	0	0	111.3	W263	P31-W263 HydrophobicContact CB-CD2 3.67Å; P31-W263 HydrophobicContact CB-CE3 4.09Å; P31-W263 HydrophobicContact CB-CG 4Å; P31-W263 HydrophobicContact CB-CH2 4.47Å; P31-W263 HydrophobicContact CB-CZ2 4.07Å; P31-W263 HydrophobicContact CB-CZ3 4.47Å; P31-W263 HydrophobicContact CG-CD2 4.5Å; P31-W263 HydrophobicContact CG-CE3 4.45Å
32	I	84.9	Confident	73.4	Confident	65 Å²	65	70 Å²	70	33%	0.333	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-93.2	122.3	163.8	-56.4	-178.1	0	0	0	106.5	F34 D136	I32-F34 HydrophobicContact CB-CD2 4.47Å; I32-F34 HydrophobicContact CB-CE2 3.82Å; I32-F34 HydrophobicContact CB-CZ 4.05Å; I32-F34 HydrophobicContact CG2-CD1 4.39Å; I32-F34 HydrophobicContact CG2-CD2 4.14Å; I32-F34 HydrophobicContact CG2-CE1 3.97Å; I32-F34 HydrophobicContact CG2-CE2 3.68Å; I32-F34 HydrophobicContact CG2-CG 4.47Å; I32-F34 HydrophobicContact CG2-CZ 3.59Å; I32-D136 WeakPolarHBondContact CD1-OD1 3.17Å
33	N	88.1	Confident	75.4	Confident	72 Å²	72	66.8 Å²	66.8	39%	0.385	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-88.3	118	172.1	-67.8	-20.4	0	0	0	107.6	T201 R203	N33-T201 HydrophobicContact CB-CG2 4.12Å; N33-R203 VanDerWaalsContact OD1-CZ 3.28Å; N33-R203 PolarHBondContact OD1-NE 2.94Å; N33-R203 PolarHBondContact OD1-NH2 3.44Å
34	F	90.4	Very high	77.5	Confident	20 Å²	20	61.8 Å²	61.8	9%	0.088	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-98.8	141	175.5	-64.2	-87.8	0	0	0	110	I32 D38 V40 M94 D136 Y202 V204	I32-F34 HydrophobicContact CB-CD2 4.47Å; I32-F34 HydrophobicContact CB-CE2 3.82Å; I32-F34 HydrophobicContact CB-CZ 4.05Å; I32-F34 HydrophobicContact CG2-CD1 4.39Å; I32-F34 HydrophobicContact CG2-CD2 4.14Å; I32-F34 HydrophobicContact CG2-CE1 3.97Å; I32-F34 HydrophobicContact CG2-CE2 3.68Å; I32-F34 HydrophobicContact CG2-CG 4.47Å; I32-F34 HydrophobicContact CG2-CZ 3.59Å; F34-D38 HydrophobicContact CB-CB 4.3Å; F34-D38 HydrophobicContact CD1-CB 4.06Å; F34-V40 HydrophobicContact CD1-CG2 4.1Å; F34-V40 HydrophobicContact CE1-CG2 4.04Å; F34-V40 HydrophobicContact CZ-CG2 4.46Å; F34-M94 HydrophobicContact CB-CB 4.3Å; F34-M94 HydrophobicContact CB-CE 4.49Å; F34-M94 HydrophobicContact CB-CG 3.79Å; F34-M94 HydrophobicContact CB-SD 4.07Å; F34-M94 HydrophobicContact CG-SD 4.33Å; F34-D136 HydrophobicContact CE2-CB 4.43Å; F34-Y202 PolarHBondContact N-O 3.43Å; F34-Y202 PolarHBondContact O-N 2.78Å; F34-V204 HydrophobicContact CD2-CG2 4.2Å; F34-V204 HydrophobicContact CE2-CG2 4.03Å
35	H	90.7	Very high	79.9	Confident	78 Å²	78	54.9 Å²	54.9	36%	0.361	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-90.8	169.3	166.1	-63.8	-84	0	0	0	110.8	N37 D38 M94 E199	H35-N37 PolarHBondContact O-N 2.75Å; H35-D38 WeakPolarHBondContact CB-OD2 3.24Å; H35-D38 IonicContact CD2-OD2 3.66Å; H35-D38 IonicContact CG-OD2 3.96Å; H35-D38 PolarHBondContact N-OD2 3.42Å; H35-D38 WeakPolarHBondContact O-CB 3.46Å; H35-D38 PolarHBondContact O-N 3.46Å; H35-D38 VanDerWaalsContact O-N 3.1Å; H35-M94 WeakPolarHBondContact O-CB 3.26Å; H35-E199 IonicContact ND1-OE2 3.82Å
36	Q	89.2	Confident	82.3	Confident	74 Å²	74	50.8 Å²	50.8	35%	0.346	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	132	176.9	-176	65.5	41.2	0	0	110.6	D38 M94 N95 Y202	Q36-D38 PolarHBondContact O-N 3.14Å; Q36-M94 PolarHBondContact NE2-O 3.4Å; Q36-N95 PolarHBondContact NE2-O 3.21Å; Q36-N95 PolarHBondContact OE1-ND2 2.9Å; Q36-Y202 HydrophobicContact CB-CE2 4.17Å; Q36-Y202 PolarHBondContact OE1-OH 3.05Å
37	N	91.7	Very high	84.7	Confident	86 Å²	86	47.5 Å²	47.5	46%	0.46	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	11.2	-176.6	-51	-46.6	0	0	0	115.9	H35 M94	H35-N37 PolarHBondContact O-N 2.75Å; N37-M94 PolarHBondContact N-O 2.83Å
38	D	92.4	Very high	87	Confident	55 Å²	55	45.7 Å²	45.7	29%	0.294	25%	0.249	S	C	.	.			trans	-63.9	145.3	171.1	-82.1	-5.7	0	0	0	111	F34 H35 Q36 V40 L93 M94	F34-D38 HydrophobicContact CB-CB 4.3Å; F34-D38 HydrophobicContact CD1-CB 4.06Å; H35-D38 WeakPolarHBondContact CB-OD2 3.24Å; H35-D38 IonicContact CD2-OD2 3.66Å; H35-D38 IonicContact CG-OD2 3.96Å; H35-D38 PolarHBondContact N-OD2 3.42Å; H35-D38 WeakPolarHBondContact O-CB 3.46Å; H35-D38 PolarHBondContact O-N 3.46Å; H35-D38 VanDerWaalsContact O-N 3.1Å; Q36-D38 PolarHBondContact O-N 3.14Å; D38-V40 PolarHBondContact O-N 3.13Å; D38-L93 CarbonylContact O-C 3.59Å; D38-L93 WeakPolarHBondContact O-CA 3.26Å; D38-M94 HydrophobicContact CB-CB 4.42Å; D38-M94 WeakPolarHBondContact O-CB 3.15Å; D38-M94 PolarHBondContact O-N 2.98Å
39	P	93.8	Very high	88.8	Confident	89 Å²	89	45.4 Å²	45.4	58%	0.578	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	124.2	-179.6	28.5	-33.8	0	0	0	111.5	L93	P39-L93 HydrophobicContact CB-CD2 4.48Å
40	V	93.7	Very high	89.9	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	102.3	172.1	-178.2	0	0	0	0	108.2	F34 D38 I42 V92 M94 A135 L187 V204 W256	F34-V40 HydrophobicContact CD1-CG2 4.1Å; F34-V40 HydrophobicContact CE1-CG2 4.04Å; F34-V40 HydrophobicContact CZ-CG2 4.46Å; D38-V40 PolarHBondContact O-N 3.13Å; V40-I42 PolarHBondContact O-N 3.4Å; V40-V92 HydrophobicContact CB-CB 4.47Å; V40-V92 HydrophobicContact CB-CG1 4.19Å; V40-V92 PolarHBondContact N-O 2.98Å; V40-M94 HydrophobicContact CG2-CB 4.19Å; V40-M94 HydrophobicContact CG2-SD 3.77Å; V40-A135 HydrophobicContact CG1-CB 4.44Å; V40-L187 HydrophobicContact CG1-CD2 4.37Å; V40-V204 HydrophobicContact CG1-CG2 4.42Å; V40-W256 HydrophobicContact CG2-CH2 4.06Å; V40-W256 HydrophobicContact CG2-CZ2 4.18Å
41	E	93.3	Very high	90.6	Very high	125 Å²	125	44.6 Å²	44.6	58%	0.584	23%	0.23	S	C	*	.			trans	-69.8	114.8	-175.9	-62.7	-176.8	158.3	0	0	112	K43	E41-K43 WeakPolarHBondContact OE2-CE 3.3Å; E41-K43 IonicContact OE2-NZ 2.83Å; E41-K43 PolarHBondContact OE2-NZ 2.88Å
42	I	94.6	Very high	90.9	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.4	166.6	-50.5	-57	0	0	0	108.5	V40 T88 F90 V92 L133 I134 A135 F207	V40-I42 PolarHBondContact O-N 3.4Å; I42-T88 PolarHBondContact O-OG1 2.95Å; I42-F90 HydrophobicContact CB-CB 4.08Å; I42-F90 HydrophobicContact CB-CD2 4.14Å; I42-F90 HydrophobicContact CG1-CB 4.17Å; I42-F90 HydrophobicContact CG2-CD2 3.81Å; I42-F90 HydrophobicContact CG2-CE2 4.49Å; I42-V92 HydrophobicContact CD1-CG2 4.12Å; I42-V92 HydrophobicContact CG1-CB 4.29Å; I42-V92 HydrophobicContact CG1-CG2 3.61Å; I42-L133 HydrophobicContact CG2-CB 4.34Å; I42-L133 HydrophobicContact CG2-CD1 4.33Å; I42-I134 WeakPolarHBondContact CA-O 3.43Å; I42-A135 HydrophobicContact CD1-CB 3.56Å; I42-F207 HydrophobicContact CD1-CE1 4.33Å; I42-F207 HydrophobicContact CD1-CE2 4.31Å; I42-F207 HydrophobicContact CD1-CZ 3.88Å; I42-F207 HydrophobicContact CG2-CZ 4.28Å
43	K	94.6	Very high	90.9	Very high	46 Å²	46	40.8 Å²	40.8	20%	0.2	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	150.5	177.8	-62.7	170.9	-174.9	171.3	0	109.5	E41 I85 V86 L133 I134	E41-K43 WeakPolarHBondContact OE2-CE 3.3Å; E41-K43 IonicContact OE2-NZ 2.83Å; E41-K43 PolarHBondContact OE2-NZ 2.88Å; K43-I85 HydrophobicContact CB-CG2 3.99Å; K43-I85 HydrophobicContact CD-CG2 4.11Å; K43-V86 CarbonylContact C-O 3.54Å; K43-V86 WeakPolarHBondContact CA-O 3.2Å; K43-V86 WeakPolarHBondContact CB-O 3.27Å; K43-L133 CarbonylContact O-C 3.52Å; K43-L133 VanDerWaalsContact O-CA 3.31Å; K43-L133 WeakPolarHBondContact O-CA 3.5Å; K43-I134 HydrophobicContact CB-CD1 3.91Å; K43-I134 HydrophobicContact CB-CG1 3.62Å; K43-I134 PolarHBondContact N-O 3.05Å; K43-I134 PolarHBondContact O-N 3.19Å
44	A	94.4	Very high	91	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	146.5	172.5	0	0	0	0	0	110.1	Y58 I85 V86 T88 L133	A44-Y58 HydrophobicContact CB-CD1 3.52Å; A44-Y58 HydrophobicContact CB-CD2 3.53Å; A44-Y58 HydrophobicContact CB-CE1 4.02Å; A44-Y58 HydrophobicContact CB-CE2 4.02Å; A44-Y58 HydrophobicContact CB-CG 3.24Å; A44-I85 CarbonylContact O-C 3.51Å; A44-I85 VanDerWaalsContact O-CA 3.32Å; A44-I85 WeakPolarHBondContact O-CA 3.44Å; A44-V86 HydrophobicContact CB-CG2 3.95Å; A44-V86 PolarHBondContact N-O 3.47Å; A44-V86 PolarHBondContact O-N 2.81Å; A44-T88 HydrophobicContact CB-CG2 3.75Å; A44-L133 HydrophobicContact CB-CD2 3.66Å
45	V	92.7	Very high	91.1	Very high	11 Å²	11	37.5 Å²	37.5	7%	0.067	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-61	-176	-175.5	0	0	0	0	111.6	D83 R84 I85 H132 I134	V45-D83 HydrophobicContact CG1-CB 3.85Å; V45-R84 CarbonylContact O-C 3.52Å; V45-R84 VanDerWaalsContact O-C 3.31Å; V45-R84 PolarHBondContact O-N 3.39Å; V45-R84 VanDerWaalsContact O-N 3.07Å; V45-I85 HydrophobicContact CG1-CG1 4.35Å; V45-I85 HydrophobicContact CG2-CG1 4.38Å; V45-H132 HydrophobicContact CB-CB 4.18Å; V45-H132 PolarHBondContact N-O 3.16Å; V45-I134 HydrophobicContact CG2-CB 4.4Å; V45-I134 HydrophobicContact CG2-CD1 3.99Å; V45-I134 HydrophobicContact CG2-CG1 4.12Å; V45-I134 HydrophobicContact CG2-CG2 3.52Å
46	K	92.9	Very high	91.2	Very high	31 Å²	31	34.5 Å²	34.5	14%	0.135	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	172	-179.1	63.9	-169.6	-174.1	-165.6	0	110.9	T48 P55 Y56 R81 D83 H132	K46-T48 HydrophobicContact CD-CG2 4.11Å; K46-T48 HydrophobicContact CG-CG2 4.02Å; K46-P55 HydrophobicContact CD-CB 3.99Å; K46-Y56 CarbonylContact C-O 3.57Å; K46-Y56 WeakPolarHBondContact CA-O 3.45Å; K46-Y56 WeakPolarHBondContact CB-O 3.2Å; K46-R81 PolarHBondContact NZ-O 2.94Å; K46-D83 WeakPolarHBondContact CD-OD1 3.4Å; K46-D83 VanDerWaalsContact CE-OD1 3.24Å; K46-D83 WeakPolarHBondContact CE-OD1 3.35Å; K46-D83 IonicContact NZ-OD1 2.9Å; K46-D83 PolarHBondContact NZ-OD1 3.41Å; K46-H132 WeakPolarHBondContact O-CB 3.5Å; K46-H132 PolarHBondContact O-CD2 2.99Å; K46-H132 PolarHBondContact O-N 3.4Å
47	L	93.6	Very high	91.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	137	166.9	-56	172	0	0	0	108.2	P55 Y56 L61 F63 Y129 Y130 V131	L47-P55 CarbonylContact O-C 3.31Å; L47-P55 WeakPolarHBondContact O-CA 3.25Å; L47-Y56 PolarHBondContact N-O 3.14Å; L47-Y56 PolarHBondContact O-N 3.09Å; L47-L61 HydrophobicContact CD1-CD1 3.61Å; L47-L61 HydrophobicContact CD1-CG 3.79Å; L47-L61 HydrophobicContact CD2-CD1 4.48Å; L47-F63 HydrophobicContact CD2-CE2 4.46Å; L47-Y129 HydrophobicContact CB-CD1 3.71Å; L47-Y129 HydrophobicContact CB-CE1 4.22Å; L47-Y130 CarbonylContact C-O 3.55Å; L47-Y130 VanDerWaalsContact CA-O 3.24Å; L47-Y130 WeakPolarHBondContact CA-O 3.36Å; L47-V131 HydrophobicContact CD2-CB 4.03Å; L47-V131 HydrophobicContact CD2-CG1 4.01Å; L47-V131 HydrophobicContact CD2-CG2 3.61Å
48	T	92.6	Very high	91.5	Very high	10 Å²	10	30.5 Å²	30.5	6%	0.061	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	151.9	173.3	62.5	0	0	0	0	111	K46 P55 Y129 Y130 H132	K46-T48 HydrophobicContact CD-CG2 4.11Å; K46-T48 HydrophobicContact CG-CG2 4.02Å; T48-P55 HydrophobicContact CG2-CB 4.36Å; T48-Y129 CarbonylContact O-C 3.54Å; T48-Y129 WeakPolarHBondContact O-CA 3.46Å; T48-Y130 PolarHBondContact N-O 2.95Å; T48-Y130 PolarHBondContact O-N 2.93Å; T48-H132 PolarHBondContact OG1-NE2 2.95Å
49	S	90.4	Very high	91.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	141.5	172.8	154.7	0	0	0	0	109.8	R51 T52 Q53 E127	S49-R51 PolarHBondContact OG-N 2.88Å; S49-T52 WeakPolarHBondContact CB-OG1 3.23Å; S49-T52 PolarHBondContact OG-N 3.24Å; S49-T52 VanDerWaalsContact OG-N 3.11Å; S49-T52 PolarHBondContact OG-OG1 2.87Å; S49-Q53 WeakPolarHBondContact O-CA 3.46Å; S49-Q53 PolarHBondContact O-N 3.49Å; S49-E127 VanDerWaalsContact CB-O 3.27Å; S49-E127 WeakPolarHBondContact CB-O 3.41Å; S49-E127 PolarHBondContact OG-O 3.49Å
50	S	84.2	Confident	91.4	Very high	47 Å²	47	27.3 Å²	27.3	33%	0.329	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-20.3	171.3	53.1	0	0	0	0	112.6	Q53	S50-Q53 PolarHBondContact O-NE2 3.08Å
51	R	85.7	Confident	91.3	Very high	73 Å²	73	27.3 Å²	27.3	28%	0.275	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-42.4	-178.8	-57.2	-168.2	68.9	178.6	6.5	112.7	S49 T126 D128 I596	S49-R51 PolarHBondContact OG-N 2.88Å; R51-T126 PolarHBondContact NH1-O 2.89Å; R51-D128 VanDerWaalsContact CD-OD2 3.26Å; R51-D128 WeakPolarHBondContact CD-OD2 3.39Å; R51-D128 HydrophobicContact CG-CB 4.37Å; R51-I596 WeakPolarHBondContact O-CA 3.16Å; R51-I596 WeakPolarHBondContact O-CG1 3.4Å
52	T	86.1	Confident	91.2	Very high	3 Å²	3	22.5 Å²	22.5	2%	0.018	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-19.9	-178.5	66.5	0	0	0	0	112.9	S49 L54 E127 Y129 P601	S49-T52 WeakPolarHBondContact CB-OG1 3.23Å; S49-T52 PolarHBondContact OG-N 3.24Å; S49-T52 VanDerWaalsContact OG-N 3.11Å; S49-T52 PolarHBondContact OG-OG1 2.87Å; T52-L54 PolarHBondContact O-N 2.98Å; T52-E127 HydrophobicContact CG2-CB 3.93Å; T52-E127 HydrophobicContact CG2-CG 3.84Å; T52-Y129 HydrophobicContact CG2-CE2 4.15Å; T52-Y129 VanDerWaalsContact OG1-CZ 3.28Å; T52-Y129 PolarHBondContact OG1-OH 3.47Å; T52-P601 WeakPolarHBondContact O-CB 3.22Å; T52-P601 WeakPolarHBondContact O-CG 3.25Å
53	Q	84.6	Confident	91	Very high	29 Å²	29	23.2 Å²	23.2	14%	0.136	12%	0.118	C	C	.	.			trans	53.6	19	-178.8	-57.7	-65.4	-28	0	0	114.2	S49 S50 W526 I596	S49-Q53 WeakPolarHBondContact O-CA 3.46Å; S49-Q53 PolarHBondContact O-N 3.49Å; S50-Q53 PolarHBondContact O-NE2 3.08Å; Q53-W526 HydrophobicContact CG-CE3 4.16Å; Q53-W526 HydrophobicContact CG-CZ3 4.49Å; Q53-W526 PolarHBondContact NE2-O 2.99Å; Q53-W526 PolarHBondContact OE1-O 3.1Å; Q53-I596 HydrophobicContact CG-CD1 3.87Å; Q53-I596 HydrophobicContact CG-CG1 4.3Å
54	L	88.9	Confident	90.7	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.01	11%	0.111	C	C	.	.			trans	-113.5	110.6	-177.5	-80	172.3	0	0	0	108.9	T52 Y56 Y129 I435 K438 I600 P601 L604	T52-L54 PolarHBondContact O-N 2.98Å; L54-Y56 HydrophobicContact CB-CE2 3.94Å; L54-Y56 WeakPolarHBondContact O-CD2 3.23Å; L54-Y129 WeakPolarHBondContact O-CE1 3.44Å; L54-Y129 PolarHBondContact O-OH 3.2Å; L54-I435 HydrophobicContact CD2-CG2 4.38Å; L54-K438 HydrophobicContact CD1-CB 4.41Å; L54-K438 HydrophobicContact CD1-CG 4.31Å; L54-I600 HydrophobicContact CD1-CG2 4.28Å; L54-P601 HydrophobicContact CD1-CG 4.06Å; L54-P601 HydrophobicContact CG-CG 4.35Å; L54-L604 HydrophobicContact CD2-CD1 3.48Å; L54-L604 VanDerWaalsContact CD2-CD1 3.48Å; L54-L604 HydrophobicContact CG-CD1 4.22Å
55	P	92	Very high	90.5	Very high	21 Å²	21	26.8 Å²	26.8	14%	0.136	14%	0.136	C	C	.	.			trans	-75.6	144.1	177.7	30	-33.4	0	0	0	111.4	K46 L47 T48 S440 S441	K46-P55 HydrophobicContact CD-CB 3.99Å; L47-P55 CarbonylContact O-C 3.31Å; L47-P55 WeakPolarHBondContact O-CA 3.25Å; T48-P55 HydrophobicContact CG2-CB 4.36Å; P55-S440 CarbonylContact O-C 3.44Å; P55-S440 WeakPolarHBondContact O-CA 3.46Å; P55-S440 WeakPolarHBondContact O-CB 3.3Å; P55-S440 PolarHBondContact O-OG 2.87Å; P55-S441 PolarHBondContact O-N 3.21Å; P55-S441 PolarHBondContact O-OG 3.34Å
56	Y	93.4	Very high	90.3	Very high	16 Å²	16	27.3 Å²	27.3	6%	0.063	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	-126	154.6	175.4	-73.7	-81.4	0	0	0	110.9	K46 L47 L54 R124 Y129 K438 H439	K46-Y56 CarbonylContact C-O 3.57Å; K46-Y56 WeakPolarHBondContact CA-O 3.45Å; K46-Y56 WeakPolarHBondContact CB-O 3.2Å; L47-Y56 PolarHBondContact N-O 3.14Å; L47-Y56 PolarHBondContact O-N 3.09Å; L54-Y56 HydrophobicContact CB-CE2 3.94Å; L54-Y56 WeakPolarHBondContact O-CD2 3.23Å; Y56-R124 PolarHBondContact OH-NH2 3.44Å; Y56-Y129 AromaticContact CD2-CE1 3.77Å; Y56-Y129 HydrophobicContact CD2-CE1 3.77Å; Y56-Y129 AromaticContact CD2-CZ 3.73Å; Y56-Y129 VanDerWaalsContact CD2-OH 3.26Å; Y56-Y129 WeakPolarHBondContact CD2-OH 3.5Å; Y56-Y129 HydrophobicContact CE2-CE1 4.45Å; Y56-Y129 AromaticContact CE2-CZ 3.97Å; Y56-Y129 WeakPolarHBondContact CE2-OH 3.04Å; Y56-K438 VanDerWaalsContact CE1-O 3.28Å; Y56-K438 WeakPolarHBondContact CE1-O 3.44Å; Y56-K438 PolarHBondContact OH-O 3.17Å; Y56-K438 VanDerWaalsContact OH-O 3.09Å; Y56-H439 WeakPolarHBondContact CE1-O 3.15Å
57	E	92.9	Very high	90	Very high	66 Å²	66	32 Å²	32	31%	0.308	18%	0.176	S	C	.	.			trans	-66.9	150.3	175.8	-60	-171.5	171.4	0	0	110.4	Y59 S60 R84	E57-Y59 VanDerWaalsContact C-N 3.33Å; E57-Y59 PolarHBondContact O-N 2.9Å; E57-S60 VanDerWaalsContact O-CB 3.23Å; E57-S60 WeakPolarHBondContact O-CB 3.45Å; E57-S60 PolarHBondContact O-N 3.5Å; E57-S60 PolarHBondContact O-OG 3.42Å; E57-R84 HydrophobicContact CG-CB 4.12Å; E57-R84 HydrophobicContact CG-CG 4.06Å
58	Y	93.6	Very high	89.8	Confident	10 Å²	10	39.2 Å²	39.2	4%	0.039	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-56	-47.2	179.9	179.8	-105.8	0	0	0	112.3	A44 S60 L61 F63 V131 L133	A44-Y58 HydrophobicContact CB-CD1 3.52Å; A44-Y58 HydrophobicContact CB-CD2 3.53Å; A44-Y58 HydrophobicContact CB-CE1 4.02Å; A44-Y58 HydrophobicContact CB-CE2 4.02Å; A44-Y58 HydrophobicContact CB-CG 3.24Å; Y58-S60 PolarHBondContact O-N 3.39Å; Y58-L61 PolarHBondContact O-N 2.81Å; Y58-F63 HydrophobicContact CD1-CD2 4.15Å; Y58-F63 AromaticContact CD2-CD2 3.94Å; Y58-F63 HydrophobicContact CD2-CD2 3.94Å; Y58-F63 AromaticContact CD2-CE2 3.92Å; Y58-F63 HydrophobicContact CD2-CE2 3.92Å; Y58-F63 HydrophobicContact CE1-CB 4.01Å; Y58-F63 AromaticContact CE1-CD2 3.84Å; Y58-F63 HydrophobicContact CE1-CD2 3.84Å; Y58-F63 HydrophobicContact CE1-CG 4.21Å; Y58-F63 AromaticContact CE2-CD2 3.61Å; Y58-F63 HydrophobicContact CE2-CD2 3.61Å; Y58-F63 AromaticContact CE2-CE2 3.66Å; Y58-F63 HydrophobicContact CE2-CE2 3.66Å; Y58-F63 HydrophobicContact CE2-CG 4.35Å; Y58-F63 HydrophobicContact CE2-CZ 4.43Å; Y58-F63 HydrophobicContact CG-CD2 4.2Å; Y58-F63 AromaticContact CZ-CD2 3.56Å; Y58-F63 AromaticContact CZ-CG 3.92Å; Y58-F63 VanDerWaalsContact O-CD2 3.3Å; Y58-F63 WeakPolarHBondContact O-CD2 3.13Å; Y58-V131 HydrophobicContact CD2-CG1 3.77Å; Y58-V131 HydrophobicContact CE2-CG1 3.58Å; Y58-L133 HydrophobicContact CD2-CD2 4.47Å; Y58-L133 HydrophobicContact CE2-CD2 4Å
59	Y	93.6	Very high	89.7	Confident	29 Å²	29	41.3 Å²	41.3	11%	0.114	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-80.5	11.2	179.1	-63	-57.9	0	0	0	114.6	E57 L61 C64 Q65 P66 I69 V86 N87	E57-Y59 VanDerWaalsContact C-N 3.33Å; E57-Y59 PolarHBondContact O-N 2.9Å; Y59-L61 CarbonylContact C-O 3.53Å; Y59-L61 PolarHBondContact O-N 2.93Å; Y59-C64 WeakPolarHBondContact CE1-O 3.15Å; Y59-Q65 HydrophobicContact CD1-CG 3.68Å; Y59-Q65 HydrophobicContact CE1-CB 4.39Å; Y59-Q65 HydrophobicContact CE1-CG 3.82Å; Y59-Q65 HydrophobicContact CG-CG 4.36Å; Y59-P66 WeakPolarHBondContact OH-CD 3.18Å; Y59-I69 HydrophobicContact CD2-CD1 3.85Å; Y59-I69 HydrophobicContact CD2-CG1 4.32Å; Y59-I69 HydrophobicContact CD2-CG2 4.19Å; Y59-I69 HydrophobicContact CE2-CD1 4.14Å; Y59-I69 HydrophobicContact CE2-CG1 4.13Å; Y59-I69 HydrophobicContact CE2-CG2 4.07Å; Y59-I69 HydrophobicContact CG-CD1 4.26Å; Y59-V86 HydrophobicContact CD2-CB 4.38Å; Y59-V86 HydrophobicContact CD2-CG2 3.87Å; Y59-V86 HydrophobicContact CE2-CB 3.93Å; Y59-V86 HydrophobicContact CE2-CG2 3.5Å; Y59-N87 PolarHBondContact OH-O 2.94Å
60	S	91.5	Very high	89.8	Confident	47 Å²	47	44.5 Å²	44.5	33%	0.329	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-67.7	-23.1	164.3	67.7	0	0	0	0	111.8	E57 Y58	E57-S60 VanDerWaalsContact O-CB 3.23Å; E57-S60 WeakPolarHBondContact O-CB 3.45Å; E57-S60 PolarHBondContact O-N 3.5Å; E57-S60 PolarHBondContact O-OG 3.42Å; Y58-S60 PolarHBondContact O-N 3.39Å
61	L	92.4	Very high	90	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.016	25%	0.245	C	C	.	.	S	Bend	trans	-95.8	153.3	169.2	-69.3	-178.9	0	0	0	110.7	L47 Y58 Y59 F63 L120 V121 R124 L169	L47-L61 HydrophobicContact CD1-CD1 3.61Å; L47-L61 HydrophobicContact CD1-CG 3.79Å; L47-L61 HydrophobicContact CD2-CD1 4.48Å; Y58-L61 PolarHBondContact O-N 2.81Å; Y59-L61 CarbonylContact C-O 3.53Å; Y59-L61 PolarHBondContact O-N 2.93Å; L61-F63 HydrophobicContact CB-CD2 3.87Å; L61-F63 HydrophobicContact CB-CE2 3.68Å; L61-F63 HydrophobicContact CB-CG 4.47Å; L61-F63 HydrophobicContact CB-CZ 4.13Å; L61-F63 HydrophobicContact CD1-CE2 3.88Å; L61-F63 HydrophobicContact CD1-CZ 3.84Å; L61-F63 HydrophobicContact CG-CE2 4.36Å; L61-F63 PolarHBondContact O-N 3.3Å; L61-L120 HydrophobicContact CD2-CD2 4.16Å; L61-L120 HydrophobicContact CD2-CG 4.02Å; L61-V121 HydrophobicContact CD2-CG2 4.02Å; L61-R124 HydrophobicContact CD1-CG 4.48Å; L61-R124 HydrophobicContact CD2-CG 3.91Å; L61-L169 HydrophobicContact CD1-CD1 3.93Å; L61-L169 HydrophobicContact CD1-CD2 3.52Å; L61-L169 HydrophobicContact CD1-CG 4.4Å
62	P	89.6	Confident	90	Very high	25 Å²	25	47.8 Å²	47.8	16%	0.162	25%	0.246	C	C	.	.			trans	-75.5	47	-176.7	34.9	-39.9	0	0	0	112.8	L113 Q117 V121	P62-L113 HydrophobicContact CB-CD2 3.79Å; P62-L113 HydrophobicContact CG-CD2 3.44Å; P62-L113 VanDerWaalsContact CG-CD2 3.44Å; P62-Q117 HydrophobicContact CB-CG 4.19Å; P62-Q117 HydrophobicContact CG-CB 4.12Å; P62-Q117 HydrophobicContact CG-CG 4.25Å; P62-V121 HydrophobicContact CG-CG2 3.97Å
63	F	90.7	Very high	89.6	Confident	18 Å²	18	52 Å²	52	8%	0.079	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-70.8	161.8	172.1	-64.4	-52.9	0	0	0	111.7	L47 Y58 L61 Q65 V131 L169 F250	L47-F63 HydrophobicContact CD2-CE2 4.46Å; Y58-F63 HydrophobicContact CD1-CD2 4.15Å; Y58-F63 AromaticContact CD2-CD2 3.94Å; Y58-F63 HydrophobicContact CD2-CD2 3.94Å; Y58-F63 AromaticContact CD2-CE2 3.92Å; Y58-F63 HydrophobicContact CD2-CE2 3.92Å; Y58-F63 HydrophobicContact CE1-CB 4.01Å; Y58-F63 AromaticContact CE1-CD2 3.84Å; Y58-F63 HydrophobicContact CE1-CD2 3.84Å; Y58-F63 HydrophobicContact CE1-CG 4.21Å; Y58-F63 AromaticContact CE2-CD2 3.61Å; Y58-F63 HydrophobicContact CE2-CD2 3.61Å; Y58-F63 AromaticContact CE2-CE2 3.66Å; Y58-F63 HydrophobicContact CE2-CE2 3.66Å; Y58-F63 HydrophobicContact CE2-CG 4.35Å; Y58-F63 HydrophobicContact CE2-CZ 4.43Å; Y58-F63 HydrophobicContact CG-CD2 4.2Å; Y58-F63 AromaticContact CZ-CD2 3.56Å; Y58-F63 AromaticContact CZ-CG 3.92Å; Y58-F63 VanDerWaalsContact O-CD2 3.3Å; Y58-F63 WeakPolarHBondContact O-CD2 3.13Å; L61-F63 HydrophobicContact CB-CD2 3.87Å; L61-F63 HydrophobicContact CB-CE2 3.68Å; L61-F63 HydrophobicContact CB-CG 4.47Å; L61-F63 HydrophobicContact CB-CZ 4.13Å; L61-F63 HydrophobicContact CD1-CE2 3.88Å; L61-F63 HydrophobicContact CD1-CZ 3.84Å; L61-F63 HydrophobicContact CG-CE2 4.36Å; L61-F63 PolarHBondContact O-N 3.3Å; F63-Q65 PolarHBondContact O-N 3.24Å; F63-V131 HydrophobicContact CZ-CG2 4.47Å; F63-L169 HydrophobicContact CE1-CD1 4.04Å; F63-L169 HydrophobicContact CZ-CD1 3.56Å; F63-F250 AromaticContact CD1-CE1 3.87Å; F63-F250 HydrophobicContact CD1-CE1 3.87Å; F63-F250 AromaticContact CD1-CZ 3.86Å; F63-F250 HydrophobicContact CD1-CZ 3.86Å; F63-F250 HydrophobicContact CE1-CE1 4.11Å; F63-F250 HydrophobicContact CE1-CZ 4.35Å
64	C	89.1	Confident	89.3	Confident	7 Å²	7	52.9 Å²	52.9	5%	0.047	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-58.1	123.9	173.4	-70.3	0	0	0	0	112.2	Y59 P89 L103 C104	Y59-C64 WeakPolarHBondContact CE1-O 3.15Å; C64-P89 HydrophobicContact CB-CG 3.86Å; C64-P89 WeakPolarHBondContact O-CD 3.3Å; C64-P89 WeakPolarHBondContact O-CG 3.25Å; C64-L103 HydrophobicContact CB-CB 4.03Å; C64-L103 VanDerWaalsContact SG-C 3.57Å; C64-C104 WeakPolarHBondContact CA-SG 3.4Å; C64-C104 HydrophobicContact CB-CB 4.21Å; C64-C104 WeakPolarHBondContact CB-SG 3.07Å; C64-C104 WeakPolarHBondContact SG-CB 3.38Å; C64-C104 PolarHBondContact SG-N 3.06Å; C64-C104 VanDerWaalsContact SG-N 3.44Å; C64-C104 CovalentContact SG-SG 2.02Å; C64-C104 PolarHBondContact SG-SG 3.44Å
65	Q	89.4	Confident	89.2	Confident	114 Å²	114	55.4 Å²	55.4	53%	0.533	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-99.8	143	179.1	-62.9	-178.2	0.1	0	0	111	Y59 F63 I69	Y59-Q65 HydrophobicContact CD1-CG 3.68Å; Y59-Q65 HydrophobicContact CE1-CB 4.39Å; Y59-Q65 HydrophobicContact CE1-CG 3.82Å; Y59-Q65 HydrophobicContact CG-CG 4.36Å; F63-Q65 PolarHBondContact O-N 3.24Å; Q65-I69 HydrophobicContact CG-CD1 4.35Å
66	P	88.9	Confident	88.9	Confident	23 Å²	23	55.8 Å²	55.8	15%	0.149	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-70.1	166.6	168.7	31.2	-34.8	0	0	0	110.7	Y59 K68 I69 N87	Y59-P66 WeakPolarHBondContact OH-CD 3.18Å; P66-K68 PolarHBondContact O-N 2.83Å; P66-K68 VanDerWaalsContact O-N 3.14Å; P66-I69 HydrophobicContact CG-CG1 4.31Å; P66-N87 WeakPolarHBondContact CG-ND2 3.27Å
67	S	86.1	Confident	88.6	Confident	128 Å²	128	55 Å²	55	90%	0.895	30%	0.296	S	S	*	.	S	Bend	trans	-56.4	-31.5	179	56	0	0	0	0	113.8
68	K	90.9	Very high	88.3	Confident	152 Å²	152	52.7 Å²	52.7	66%	0.661	29%	0.285	S	S	*	.	S	Bend	trans	-140	122.2	172.6	-174.9	178.1	-179.8	-179.5	0	109.3	P66 T70 N87	P66-K68 PolarHBondContact O-N 2.83Å; P66-K68 VanDerWaalsContact O-N 3.14Å; K68-T70 HydrophobicContact CD-CG2 4.38Å; K68-T70 HydrophobicContact CG-CG2 4.23Å; K68-T70 PolarHBondContact O-N 3.48Å; K68-N87 PolarHBondContact O-ND2 3.21Å
69	I	90.7	Very high	88.1	Confident	54 Å²	54	53 Å²	53	28%	0.277	29%	0.288	S	S	.	.			trans	-75.9	120.9	171.8	-59.3	172.4	0	0	0	108.1	Y59 Q65 P66 Y71 V86 N87	Y59-I69 HydrophobicContact CD2-CD1 3.85Å; Y59-I69 HydrophobicContact CD2-CG1 4.32Å; Y59-I69 HydrophobicContact CD2-CG2 4.19Å; Y59-I69 HydrophobicContact CE2-CD1 4.14Å; Y59-I69 HydrophobicContact CE2-CG1 4.13Å; Y59-I69 HydrophobicContact CE2-CG2 4.07Å; Y59-I69 HydrophobicContact CG-CD1 4.26Å; Q65-I69 HydrophobicContact CG-CD1 4.35Å; P66-I69 HydrophobicContact CG-CG1 4.31Å; I69-Y71 HydrophobicContact CG2-CD2 4.36Å; I69-Y71 HydrophobicContact CG2-CE2 3.85Å; I69-V86 HydrophobicContact CG2-CB 4.32Å; I69-V86 HydrophobicContact CG2-CG1 4.09Å; I69-N87 WeakPolarHBondContact CA-OD1 3.34Å
70	T	92.1	Very high	87.8	Confident	68 Å²	68	53.9 Å²	53.9	42%	0.417	30%	0.295	S	S	.	.			trans	-117.4	122.3	176.7	55.2	0	0	0	0	109.3	K68 N87	K68-T70 HydrophobicContact CD-CG2 4.38Å; K68-T70 HydrophobicContact CG-CG2 4.23Å; K68-T70 PolarHBondContact O-N 3.48Å; T70-N87 PolarHBondContact N-OD1 3.29Å; T70-N87 PolarHBondContact O-N 3.1Å; T70-N87 PolarHBondContact O-OD1 3Å; T70-N87 PolarHBondContact OG1-ND2 3.44Å; T70-N87 PolarHBondContact OG1-OD1 2.78Å
71	Y	88.7	Confident	87.5	Confident	123 Å²	123	56.3 Å²	56.3	48%	0.482	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-84.8	136	174.1	-69.5	-95.3	0	0	0	109.5	I69 I85 V86	I69-Y71 HydrophobicContact CG2-CD2 4.36Å; I69-Y71 HydrophobicContact CG2-CE2 3.85Å; Y71-I85 WeakPolarHBondContact CA-O 3.15Å; Y71-V86 HydrophobicContact CD1-CG1 3.38Å; Y71-V86 HydrophobicContact CD2-CG1 4.43Å; Y71-V86 HydrophobicContact CE1-CG1 3.22Å; Y71-V86 HydrophobicContact CE2-CG1 4.3Å; Y71-V86 HydrophobicContact CG-CG1 4Å
72	K	85.8	Confident	87.3	Confident	66 Å²	66	56.1 Å²	56.1	29%	0.287	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-77.7	145.2	170.6	-167.3	-176.7	177.2	-172.2	0	109	E74 I85	K72-E74 PolarHBondContact O-N 3.39Å; K72-I85 HydrophobicContact CB-CB 4.04Å; K72-I85 HydrophobicContact CB-CG2 3.96Å; K72-I85 HydrophobicContact CD-CD1 4.46Å; K72-I85 HydrophobicContact CD-CG2 4.27Å; K72-I85 PolarHBondContact N-O 2.89Å
73	A	77.6	Confident	87.2	Confident	92 Å²	92	55.6 Å²	55.6	76%	0.76	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-62	130.3	172.3	0	0	0	0	0	110.6
74	E	77.9	Confident	87.1	Confident	47 Å²	47	55.9 Å²	55.9	22%	0.22	29%	0.292	C	S	.	.			trans	-105.6	142.8	-178.6	-74.5	159.3	-168.2	0	0	110.5	K72 E78 V79 D83 R84 I85	K72-E74 PolarHBondContact O-N 3.39Å; E74-E78 VanDerWaalsContact CA-OE2 3.32Å; E74-E78 WeakPolarHBondContact CA-OE2 3.1Å; E74-E78 HydrophobicContact CB-CB 3.95Å; E74-E78 HydrophobicContact CG-CB 4.13Å; E74-V79 HydrophobicContact CB-CG2 3.64Å; E74-D83 VanDerWaalsContact OE2-O 3.05Å; E74-R84 WeakPolarHBondContact OE1-CA 3.22Å; E74-R84 IonicContact OE2-CZ 2.73Å; E74-R84 IonicContact OE2-NH1 3.56Å; E74-R84 PolarHBondContact OE2-NH1 3.12Å; E74-I85 PolarHBondContact OE1-N 3.17Å
75	N	86.1	Confident	87.2	Confident	54 Å²	54	55.6 Å²	55.6	29%	0.289	29%	0.29	S	S	.	.			trans	-77	164.1	166.5	67.3	66.7	0	0	0	111.3	G77 E78 V79 R375 G376 T380	N75-G77 PolarHBondContact O-N 3.38Å; N75-G77 VanDerWaalsContact O-N 3.1Å; N75-G77 WeakPolarHBondContact OD1-CA 3.4Å; N75-G77 PolarHBondContact OD1-N 3.4Å; N75-E78 PolarHBondContact N-OE2 3.26Å; N75-E78 VanDerWaalsContact ND2-CD 3.29Å; N75-E78 PolarHBondContact ND2-OE2 3.16Å; N75-E78 PolarHBondContact O-N 2.81Å; N75-E78 PolarHBondContact OD1-N 2.82Å; N75-V79 WeakPolarHBondContact O-CG2 3.16Å; N75-V79 PolarHBondContact O-N 2.9Å; N75-R375 PolarHBondContact ND2-O 2.88Å; N75-G376 WeakPolarHBondContact OD1-CA 3.24Å; N75-T380 PolarHBondContact OD1-OG1 3.4Å; N75-T380 VanDerWaalsContact OD1-OG1 3.06Å
76	L	86.2	Confident	87.4	Confident	30 Å²	30	50.4 Å²	50.4	16%	0.157	27%	0.266	C	S	.	.	H	α-helix	trans	-51.2	-40.5	-178	-179.1	66.1	0	0	0	112.5	V79 L80 T380 C383 T448 L452 M455	L76-V79 PolarHBondContact O-N 3.48Å; L76-L80 HydrophobicContact CD1-CD1 4.42Å; L76-L80 HydrophobicContact CD1-CG 4.47Å; L76-L80 HydrophobicContact CG-CD1 4.07Å; L76-L80 HydrophobicContact CG-CG 4.49Å; L76-L80 WeakPolarHBondContact O-CB 3.22Å; L76-L80 VanDerWaalsContact O-CG 3.24Å; L76-L80 WeakPolarHBondContact O-CG 3.35Å; L76-L80 PolarHBondContact O-N 3.42Å; L76-T380 HydrophobicContact CB-CG2 4.43Å; L76-C383 HydrophobicContact CD2-CB 4.26Å; L76-T448 HydrophobicContact CD1-CG2 3.91Å; L76-L452 HydrophobicContact CD1-CD2 4.27Å; L76-L452 HydrophobicContact CD2-CD2 4.45Å; L76-M455 HydrophobicContact CD1-CE 4.26Å; L76-M455 HydrophobicContact CD2-CE 3.82Å; L76-M455 HydrophobicContact CD2-SD 4.4Å
77	G	86.7	Confident	87.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-71.6	-34.1	-179.8	0	0	0	0	0	114.4	N75 R81 G376 T380	N75-G77 PolarHBondContact O-N 3.38Å; N75-G77 VanDerWaalsContact O-N 3.1Å; N75-G77 WeakPolarHBondContact OD1-CA 3.4Å; N75-G77 PolarHBondContact OD1-N 3.4Å; G77-R81 WeakPolarHBondContact O-CB 3.27Å; G77-R81 VanDerWaalsContact O-CG 3.3Å; G77-R81 WeakPolarHBondContact O-CG 3.29Å; G77-R81 PolarHBondContact O-N 2.8Å; G77-R81 VanDerWaalsContact O-N 3.12Å; G77-G376 WeakPolarHBondContact CA-O 3.12Å; G77-T380 WeakPolarHBondContact CA-OG1 3.43Å; G77-T380 PolarHBondContact N-OG1 3.31Å
78	E	87.5	Confident	88.1	Confident	16 Å²	16	45.8 Å²	45.8	8%	0.075	23%	0.231	C	C	.	.	H	α-helix	trans	-64.9	-44.4	170.7	-72.4	173	140.5	0	0	110.3	E74 N75 L80 R81 G82 D83 R375	E74-E78 VanDerWaalsContact CA-OE2 3.32Å; E74-E78 WeakPolarHBondContact CA-OE2 3.1Å; E74-E78 HydrophobicContact CB-CB 3.95Å; E74-E78 HydrophobicContact CG-CB 4.13Å; N75-E78 PolarHBondContact N-OE2 3.26Å; N75-E78 VanDerWaalsContact ND2-CD 3.29Å; N75-E78 PolarHBondContact ND2-OE2 3.16Å; N75-E78 PolarHBondContact O-N 2.81Å; N75-E78 PolarHBondContact OD1-N 2.82Å; E78-L80 PolarHBondContact O-N 3.49Å; E78-R81 PolarHBondContact O-N 2.77Å; E78-R81 VanDerWaalsContact O-N 3.15Å; E78-G82 PolarHBondContact O-N 3.12Å; E78-D83 HydrophobicContact CB-CB 4.25Å; E78-D83 PolarHBondContact O-N 3.42Å; E78-D83 VanDerWaalsContact O-N 3.09Å; E78-R375 HydrophobicContact CG-CB 4.21Å; E78-R375 WeakPolarHBondContact OE1-CB 3.47Å; E78-R375 IonicContact OE1-CZ 2.71Å; E78-R375 IonicContact OE1-NE 3.78Å
79	V	88.9	Confident	88.2	Confident	18 Å²	18	40.1 Å²	40.1	11%	0.109	21%	0.21	C	C	.	.	H	α-helix	trans	-61.2	-44.2	176.9	179.7	0	0	0	0	111.7	E74 N75 L76 R81 G82 P445 T448	E74-V79 HydrophobicContact CB-CG2 3.64Å; N75-V79 WeakPolarHBondContact O-CG2 3.16Å; N75-V79 PolarHBondContact O-N 2.9Å; L76-V79 PolarHBondContact O-N 3.48Å; V79-R81 VanDerWaalsContact C-N 3.26Å; V79-R81 PolarHBondContact O-N 2.86Å; V79-G82 PolarHBondContact O-N 3.24Å; V79-G82 VanDerWaalsContact O-N 3.13Å; V79-P445 HydrophobicContact CG1-CG 4.3Å; V79-T448 HydrophobicContact CG1-CG2 3.87Å
80	L	87	Confident	88.3	Confident	46 Å²	46	38.3 Å²	38.3	24%	0.241	20%	0.2	C	C	.	.	H	α-helix	trans	-68.1	-22.7	178.1	-74.2	176.3	0	0	0	113.5	L76 E78 G82 M379 V444 L452	L76-L80 HydrophobicContact CD1-CD1 4.42Å; L76-L80 HydrophobicContact CD1-CG 4.47Å; L76-L80 HydrophobicContact CG-CD1 4.07Å; L76-L80 HydrophobicContact CG-CG 4.49Å; L76-L80 WeakPolarHBondContact O-CB 3.22Å; L76-L80 VanDerWaalsContact O-CG 3.24Å; L76-L80 WeakPolarHBondContact O-CG 3.35Å; L76-L80 PolarHBondContact O-N 3.42Å; E78-L80 PolarHBondContact O-N 3.49Å; L80-G82 VanDerWaalsContact C-N 3.33Å; L80-M379 HydrophobicContact CB-CG 4.18Å; L80-M379 HydrophobicContact CD1-CG 3.89Å; L80-M379 HydrophobicContact CD1-SD 4.44Å; L80-V444 HydrophobicContact CD2-CG1 4.4Å; L80-V444 HydrophobicContact CD2-CG2 4.02Å; L80-L452 HydrophobicContact CD2-CD1 4.09Å
81	R	85.7	Confident	88.2	Confident	98 Å²	98	41 Å²	41	37%	0.37	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-4.6	173.3	-75.5	176.9	178.7	176.3	-0.7	113.3	K46 G77 E78 V79 D83	K46-R81 PolarHBondContact NZ-O 2.94Å; G77-R81 WeakPolarHBondContact O-CB 3.27Å; G77-R81 VanDerWaalsContact O-CG 3.3Å; G77-R81 WeakPolarHBondContact O-CG 3.29Å; G77-R81 PolarHBondContact O-N 2.8Å; G77-R81 VanDerWaalsContact O-N 3.12Å; E78-R81 PolarHBondContact O-N 2.77Å; E78-R81 VanDerWaalsContact O-N 3.15Å; V79-R81 VanDerWaalsContact C-N 3.26Å; V79-R81 PolarHBondContact O-N 2.86Å; R81-D83 VanDerWaalsContact C-N 3.26Å; R81-D83 PolarHBondContact O-N 3.16Å
82	G	86.7	Confident	88.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	70	22.4	-175.8	0	0	0	0	0	113.8	E78 V79 L80 S441	E78-G82 PolarHBondContact O-N 3.12Å; V79-G82 PolarHBondContact O-N 3.24Å; V79-G82 VanDerWaalsContact O-N 3.13Å; L80-G82 VanDerWaalsContact C-N 3.33Å; G82-S441 VanDerWaalsContact CA-O 3.3Å; G82-S441 WeakPolarHBondContact CA-O 3.41Å; G82-S441 PolarHBondContact O-OG 3.41Å; G82-S441 VanDerWaalsContact O-OG 3.05Å
83	D	88.1	Confident	88.9	Confident	14 Å²	14	35.2 Å²	35.2	8%	0.075	19%	0.188	C	C	.	.			trans	-69	132.2	171.4	-64.6	-13.5	0	0	0	107.6	V45 K46 E74 E78 R81	V45-D83 HydrophobicContact CG1-CB 3.85Å; K46-D83 WeakPolarHBondContact CD-OD1 3.4Å; K46-D83 VanDerWaalsContact CE-OD1 3.24Å; K46-D83 WeakPolarHBondContact CE-OD1 3.35Å; K46-D83 IonicContact NZ-OD1 2.9Å; K46-D83 PolarHBondContact NZ-OD1 3.41Å; E74-D83 VanDerWaalsContact OE2-O 3.05Å; E78-D83 HydrophobicContact CB-CB 4.25Å; E78-D83 PolarHBondContact O-N 3.42Å; E78-D83 VanDerWaalsContact O-N 3.09Å; R81-D83 VanDerWaalsContact C-N 3.26Å; R81-D83 PolarHBondContact O-N 3.16Å
84	R	89.5	Confident	89.5	Confident	23 Å²	23	30.9 Å²	30.9	9%	0.087	15%	0.152	C	C	.	.			trans	-131.5	80	178.8	-67.9	-64.1	176.5	-98.2	-12.4	109.7	V45 E57 E74 V86 S441	V45-R84 CarbonylContact O-C 3.52Å; V45-R84 VanDerWaalsContact O-C 3.31Å; V45-R84 PolarHBondContact O-N 3.39Å; V45-R84 VanDerWaalsContact O-N 3.07Å; E57-R84 HydrophobicContact CG-CB 4.12Å; E57-R84 HydrophobicContact CG-CG 4.06Å; E74-R84 WeakPolarHBondContact OE1-CA 3.22Å; E74-R84 IonicContact OE2-CZ 2.73Å; E74-R84 IonicContact OE2-NH1 3.56Å; E74-R84 PolarHBondContact OE2-NH1 3.12Å; R84-V86 PolarHBondContact O-N 2.81Å; R84-S441 PolarHBondContact NH2-O 3.43Å
85	I	90.9	Very high	90.1	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.154	C	C	.	.			trans	-76.4	117.9	-168.6	-55.2	161.4	0	0	0	110.4	K43 A44 V45 Y71 K72 E74 I134	K43-I85 HydrophobicContact CB-CG2 3.99Å; K43-I85 HydrophobicContact CD-CG2 4.11Å; A44-I85 CarbonylContact O-C 3.51Å; A44-I85 VanDerWaalsContact O-CA 3.32Å; A44-I85 WeakPolarHBondContact O-CA 3.44Å; V45-I85 HydrophobicContact CG1-CG1 4.35Å; V45-I85 HydrophobicContact CG2-CG1 4.38Å; Y71-I85 WeakPolarHBondContact CA-O 3.15Å; K72-I85 HydrophobicContact CB-CB 4.04Å; K72-I85 HydrophobicContact CB-CG2 3.96Å; K72-I85 HydrophobicContact CD-CD1 4.46Å; K72-I85 HydrophobicContact CD-CG2 4.27Å; K72-I85 PolarHBondContact N-O 2.89Å; E74-I85 PolarHBondContact OE1-N 3.17Å; I85-I134 HydrophobicContact CG2-CD1 3.9Å
86	V	93.9	Very high	90.4	Very high	5 Å²	5	30 Å²	30	3%	0.03	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	151.1	-177.6	-66.4	0	0	0	0	112.2	K43 A44 Y59 I69 Y71 R84	K43-V86 CarbonylContact C-O 3.54Å; K43-V86 WeakPolarHBondContact CA-O 3.2Å; K43-V86 WeakPolarHBondContact CB-O 3.27Å; A44-V86 HydrophobicContact CB-CG2 3.95Å; A44-V86 PolarHBondContact N-O 3.47Å; A44-V86 PolarHBondContact O-N 2.81Å; Y59-V86 HydrophobicContact CD2-CB 4.38Å; Y59-V86 HydrophobicContact CD2-CG2 3.87Å; Y59-V86 HydrophobicContact CE2-CB 3.93Å; Y59-V86 HydrophobicContact CE2-CG2 3.5Å; I69-V86 HydrophobicContact CG2-CB 4.32Å; I69-V86 HydrophobicContact CG2-CG1 4.09Å; Y71-V86 HydrophobicContact CD1-CG1 3.38Å; Y71-V86 HydrophobicContact CD2-CG1 4.43Å; Y71-V86 HydrophobicContact CE1-CG1 3.22Å; Y71-V86 HydrophobicContact CE2-CG1 4.3Å; Y71-V86 HydrophobicContact CG-CG1 4Å; R84-V86 PolarHBondContact O-N 2.81Å
87	N	94.7	Very high	90.7	Very high	38 Å²	38	34.7 Å²	34.7	20%	0.203	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	151.6	170.2	66	-34.4	0	0	0	111.5	Y59 P66 K68 I69 T70	Y59-N87 PolarHBondContact OH-O 2.94Å; P66-N87 WeakPolarHBondContact CG-ND2 3.27Å; K68-N87 PolarHBondContact O-ND2 3.21Å; I69-N87 WeakPolarHBondContact CA-OD1 3.34Å; T70-N87 PolarHBondContact N-OD1 3.29Å; T70-N87 PolarHBondContact O-N 3.1Å; T70-N87 PolarHBondContact O-OD1 3Å; T70-N87 PolarHBondContact OG1-ND2 3.44Å; T70-N87 PolarHBondContact OG1-OD1 2.78Å
88	T	94.2	Very high	90.9	Very high	16 Å²	16	36.4 Å²	36.4	10%	0.098	18%	0.18	C	C	.	.			trans	-120.3	163.1	177.4	70.1	0	0	0	0	110.6	I42 A44 F90	I42-T88 PolarHBondContact O-OG1 2.95Å; A44-T88 HydrophobicContact CB-CG2 3.75Å; T88-F90 VanDerWaalsContact C-N 3.26Å; T88-F90 HydrophobicContact CG2-CD2 4.2Å; T88-F90 HydrophobicContact CG2-CE2 4.39Å; T88-F90 PolarHBondContact O-N 3.41Å; T88-F90 WeakPolarHBondContact OG1-CD2 3.31Å
89	P	92.4	Very high	91.1	Very high	34 Å²	34	43.9 Å²	43.9	22%	0.221	21%	0.212	C	C	.	.	S	Bend	trans	-81.3	2.2	175.7	31.9	-33.2	0	0	0	114.1	C64 Q91 L103	C64-P89 HydrophobicContact CB-CG 3.86Å; C64-P89 WeakPolarHBondContact O-CD 3.3Å; C64-P89 WeakPolarHBondContact O-CG 3.25Å; P89-Q91 PolarHBondContact O-N 3.31Å; P89-L103 HydrophobicContact CB-CD2 4.32Å; P89-L103 HydrophobicContact CG-CD2 3.9Å
90	F	92.9	Very high	91.1	Very high	16 Å²	16	43.5 Å²	43.5	7%	0.07	21%	0.21	C	C	.	.			trans	-64.7	128.5	177.2	-61.4	-68.6	0	0	0	110.5	I42 T88 L103 L133 L183 F185 Y252	I42-F90 HydrophobicContact CB-CB 4.08Å; I42-F90 HydrophobicContact CB-CD2 4.14Å; I42-F90 HydrophobicContact CG1-CB 4.17Å; I42-F90 HydrophobicContact CG2-CD2 3.81Å; I42-F90 HydrophobicContact CG2-CE2 4.49Å; T88-F90 VanDerWaalsContact C-N 3.26Å; T88-F90 HydrophobicContact CG2-CD2 4.2Å; T88-F90 HydrophobicContact CG2-CE2 4.39Å; T88-F90 PolarHBondContact O-N 3.41Å; T88-F90 WeakPolarHBondContact OG1-CD2 3.31Å; F90-L103 HydrophobicContact CD1-CD1 3.94Å; F90-L103 HydrophobicContact CD1-CD2 3.54Å; F90-L103 HydrophobicContact CD1-CG 4.3Å; F90-L103 HydrophobicContact CE1-CD1 3.35Å; F90-L103 HydrophobicContact CE1-CD2 3.79Å; F90-L103 HydrophobicContact CE1-CG 4.18Å; F90-L103 HydrophobicContact CG-CD2 4.24Å; F90-L103 HydrophobicContact CZ-CD1 4.13Å; F90-L133 HydrophobicContact CE2-CD1 4.18Å; F90-L183 HydrophobicContact CE1-CD1 4.42Å; F90-L183 HydrophobicContact CZ-CD1 3.93Å; F90-F185 AromaticContact CD1-CE2 3.64Å; F90-F185 HydrophobicContact CD1-CE2 3.64Å; F90-F185 HydrophobicContact CD1-CZ 4.13Å; F90-F185 HydrophobicContact CD2-CE2 4.45Å; F90-F185 HydrophobicContact CD2-CZ 4.37Å; F90-F185 AromaticContact CE1-CE2 3.68Å; F90-F185 HydrophobicContact CE1-CE2 3.68Å; F90-F185 AromaticContact CE1-CZ 3.81Å; F90-F185 HydrophobicContact CE1-CZ 3.81Å; F90-F185 HydrophobicContact CE2-CZ 4.15Å; F90-F185 HydrophobicContact CG-CE2 4.07Å; F90-F185 HydrophobicContact CG-CZ 4.42Å; F90-F185 HydrophobicContact CZ-CE2 4.22Å; F90-F185 AromaticContact CZ-CZ 3.87Å; F90-F185 HydrophobicContact CZ-CZ 3.87Å; F90-Y252 AromaticContact CD1-CD1 3.93Å; F90-Y252 HydrophobicContact CD1-CD1 3.93Å; F90-Y252 HydrophobicContact CD1-CD2 4.03Å; F90-Y252 HydrophobicContact CD1-CE1 4.32Å; F90-Y252 HydrophobicContact CD1-CE2 4.4Å; F90-Y252 AromaticContact CD1-CG 3.77Å; F90-Y252 HydrophobicContact CD1-CG 3.77Å; F90-Y252 HydrophobicContact CE1-CD1 4.33Å; F90-Y252 HydrophobicContact CE1-CG 4.11Å
91	Q	91.4	Very high	91.3	Very high	125 Å²	125	43.2 Å²	43.2	58%	0.584	21%	0.207	S	C	*	.			trans	-107.8	94.4	177.1	-64.6	-177.4	9	0	0	109	P89 K98 Y252	P89-Q91 PolarHBondContact O-N 3.31Å; Q91-K98 VanDerWaalsContact O-CE 3.27Å; Q91-K98 WeakPolarHBondContact O-CE 3.26Å; Q91-K98 PolarHBondContact O-NZ 3.25Å; Q91-Y252 PolarHBondContact N-OH 3.21Å; Q91-Y252 VanDerWaalsContact N-OH 3.16Å; Q91-Y252 PolarHBondContact O-OH 3.2Å
92	V	93.4	Very high	91.4	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	124	177.8	-179.1	0	0	0	0	108.4	V40 I42 L187 V254 W256	V40-V92 HydrophobicContact CB-CB 4.47Å; V40-V92 HydrophobicContact CB-CG1 4.19Å; V40-V92 PolarHBondContact N-O 2.98Å; I42-V92 HydrophobicContact CD1-CG2 4.12Å; I42-V92 HydrophobicContact CG1-CB 4.29Å; I42-V92 HydrophobicContact CG1-CG2 3.61Å; V92-L187 HydrophobicContact CG1-CD1 4.14Å; V92-V254 HydrophobicContact CG1-CG1 3.95Å; V92-V254 HydrophobicContact CG2-CG2 3.95Å; V92-W256 HydrophobicContact CG1-CZ2 3.77Å
93	L	94.4	Very high	91.3	Very high	64 Å²	64	39.6 Å²	39.6	34%	0.335	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	141.4	174.9	-58.5	178.3	0	0	0	108.9	D38 P39 N95 S96 W256	D38-L93 CarbonylContact O-C 3.59Å; D38-L93 WeakPolarHBondContact O-CA 3.26Å; P39-L93 HydrophobicContact CB-CD2 4.48Å; L93-N95 PolarHBondContact O-N 3.32Å; L93-S96 PolarHBondContact O-N 3.22Å; L93-W256 PolarHBondContact O-NE1 3Å
94	M	92.1	Very high	90.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	127.4	-176.3	-167	63.9	-175.4	0	0	110.9	F34 H35 Q36 N37 D38 V40 S96 Y189 Y202 V204 W256	F34-M94 HydrophobicContact CB-CB 4.3Å; F34-M94 HydrophobicContact CB-CE 4.49Å; F34-M94 HydrophobicContact CB-CG 3.79Å; F34-M94 HydrophobicContact CB-SD 4.07Å; F34-M94 HydrophobicContact CG-SD 4.33Å; H35-M94 WeakPolarHBondContact O-CB 3.26Å; Q36-M94 PolarHBondContact NE2-O 3.4Å; N37-M94 PolarHBondContact N-O 2.83Å; D38-M94 HydrophobicContact CB-CB 4.42Å; D38-M94 WeakPolarHBondContact O-CB 3.15Å; D38-M94 PolarHBondContact O-N 2.98Å; V40-M94 HydrophobicContact CG2-CB 4.19Å; V40-M94 HydrophobicContact CG2-SD 3.77Å; M94-S96 PolarHBondContact O-N 3.45Å; M94-Y189 VanDerWaalsContact CE-CB 3.43Å; M94-Y189 HydrophobicContact CE-CG 4.13Å; M94-Y202 HydrophobicContact CE-CG 4.19Å; M94-Y202 HydrophobicContact CG-CD2 4.3Å; M94-Y202 HydrophobicContact CG-CG 4.46Å; M94-V204 HydrophobicContact CE-CG2 4.02Å; M94-V204 HydrophobicContact SD-CG2 4.09Å; M94-W256 HydrophobicContact CE-CE3 4.5Å; M94-W256 HydrophobicContact CE-CH2 4.06Å; M94-W256 HydrophobicContact CE-CZ3 3.79Å; M94-W256 HydrophobicContact SD-CH2 3.31Å; M94-W256 WeakPolarHBondContact SD-CH2 3.47Å; M94-W256 HydrophobicContact SD-CZ2 3.87Å; M94-W256 HydrophobicContact SD-CZ3 3.68Å
95	N	88.8	Confident	89.4	Confident	48 Å²	48	43 Å²	43	26%	0.257	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	37.7	179.1	-168.1	32.9	0	0	0	113.5	Q36 L93 Y189	Q36-N95 PolarHBondContact NE2-O 3.21Å; Q36-N95 PolarHBondContact OE1-ND2 2.9Å; L93-N95 PolarHBondContact O-N 3.32Å; N95-Y189 HydrophobicContact CB-CE1 4.45Å
96	S	92.9	Very high	87.9	Confident	35 Å²	35	51.6 Å²	51.6	25%	0.245	26%	0.264	C	S	.	.			trans	-125.6	111.5	176.5	-170.6	0	0	0	0	109.4	L93 M94 W256	L93-S96 PolarHBondContact O-N 3.22Å; M94-S96 PolarHBondContact O-N 3.45Å; S96-W256 PolarHBondContact O-NE1 3.3Å
97	E	93.1	Very high	86	Confident	129 Å²	129	55.2 Å²	55.2	60%	0.603	29%	0.289	S	S	*	.			trans	-74.6	140.6	-179.4	-65.4	-168.7	166.7	0	0	112.2	V254	E97-V254 WeakPolarHBondContact CA-O 3.37Å
98	K	91.5	Very high	84.5	Confident	35 Å²	35	56.3 Å²	56.3	15%	0.152	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	113.9	171.9	-67.8	-175.5	166.9	-165.2	0	109.1	Q91 E101 Y252 S253 V254	Q91-K98 VanDerWaalsContact O-CE 3.27Å; Q91-K98 WeakPolarHBondContact O-CE 3.26Å; Q91-K98 PolarHBondContact O-NZ 3.25Å; K98-E101 VanDerWaalsContact CD-OE2 3.29Å; K98-E101 WeakPolarHBondContact CD-OE2 3.17Å; K98-E101 VanDerWaalsContact CE-OE2 3.25Å; K98-E101 WeakPolarHBondContact CE-OE2 3.24Å; K98-E101 IonicContact NZ-OE1 3.52Å; K98-E101 IonicContact NZ-OE2 2.68Å; K98-E101 PolarHBondContact NZ-OE2 3.19Å; K98-Y252 HydrophobicContact CD-CE2 4.21Å; K98-Y252 PolarHBondContact NZ-OH 3.2Å; K98-S253 CarbonylContact O-C 3.6Å; K98-S253 VanDerWaalsContact O-CA 3.26Å; K98-S253 WeakPolarHBondContact O-CA 3.25Å; K98-S253 VanDerWaalsContact O-CB 3.32Å; K98-S253 WeakPolarHBondContact O-CB 3.33Å; K98-V254 HydrophobicContact CB-CB 4.04Å; K98-V254 HydrophobicContact CB-CG2 4.18Å; K98-V254 HydrophobicContact CD-CG2 4.32Å; K98-V254 PolarHBondContact N-O 3.34Å; K98-V254 PolarHBondContact O-N 2.92Å
99	K	90.1	Very high	83.6	Confident	174 Å²	174	62.9 Å²	62.9	76%	0.757	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	-48	-179.1	-69.4	-171.4	178.5	-173.8	0	112.8	S253	K99-S253 WeakPolarHBondContact O-CB 3.46Å
100	C	89.8	Confident	83.1	Confident	9 Å²	9	62.6 Å²	62.6	6%	0.061	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	127.5	176.5	-172.9	0	0	0	0	109	C227 L229 Y252	C100-C227 HydrophobicContact CB-CB 4.01Å; C100-C227 WeakPolarHBondContact CB-O 3.18Å; C100-C227 WeakPolarHBondContact CB-SG 3.29Å; C100-C227 PolarHBondContact O-N 2.97Å; C100-C227 WeakPolarHBondContact SG-CB 3.48Å; C100-C227 CovalentContact SG-SG 2.03Å; C100-C227 PolarHBondContact SG-SG 2.98Å; C100-L229 HydrophobicContact CB-CD1 4.25Å; C100-L229 HydrophobicContact CB-CD2 4.47Å; C100-L229 HydrophobicContact CB-CG 3.94Å; C100-Y252 CarbonylContact C-O 3.52Å; C100-Y252 WeakPolarHBondContact CA-O 3.33Å
101	E	90.3	Very high	82.8	Confident	40 Å²	40	63.4 Å²	63.4	19%	0.187	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	140.3	176	-170.5	177.2	127.7	0	0	110.8	K98 S225 C227 T251 Y252	K98-E101 VanDerWaalsContact CD-OE2 3.29Å; K98-E101 WeakPolarHBondContact CD-OE2 3.17Å; K98-E101 VanDerWaalsContact CE-OE2 3.25Å; K98-E101 WeakPolarHBondContact CE-OE2 3.24Å; K98-E101 IonicContact NZ-OE1 3.52Å; K98-E101 IonicContact NZ-OE2 2.68Å; K98-E101 PolarHBondContact NZ-OE2 3.19Å; E101-S225 CarbonylContact C-O 3.55Å; E101-S225 WeakPolarHBondContact CA-O 3.11Å; E101-C227 PolarHBondContact N-SG 3.36Å; E101-C227 VanDerWaalsContact N-SG 3.35Å; E101-T251 CarbonylContact O-C 3.53Å; E101-T251 WeakPolarHBondContact O-CA 3.41Å; E101-T251 WeakPolarHBondContact O-CB 3.44Å; E101-Y252 HydrophobicContact CB-CD1 4.14Å; E101-Y252 HydrophobicContact CB-CE1 3.64Å; E101-Y252 HydrophobicContact CG-CE1 3.87Å; E101-Y252 PolarHBondContact N-O 3.42Å; E101-Y252 WeakPolarHBondContact O-CD1 3.14Å; E101-Y252 PolarHBondContact O-N 2.89Å; E101-Y252 PolarHBondContact OE1-OH 3.39Å; E101-Y252 PolarHBondContact OE2-OH 3.25Å
102	V	88.5	Confident	82.6	Confident	8 Å²	8	60.4 Å²	60.4	5%	0.048	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	121.9	-178.9	-175.2	0	0	0	0	109.7	A221 S225 C227 Y249 T251	V102-A221 HydrophobicContact CG2-CB 3.87Å; V102-S225 PolarHBondContact N-O 2.83Å; V102-C227 HydrophobicContact CG2-CB 3.79Å; V102-Y249 HydrophobicContact CG1-CD1 3.77Å; V102-Y249 HydrophobicContact CG1-CE1 4.41Å; V102-Y249 HydrophobicContact CG1-CG 4.43Å; V102-T251 HydrophobicContact CB-CG2 4.42Å; V102-T251 HydrophobicContact CG2-CG2 3.99Å
103	L	85.4	Confident	82.5	Confident	15 Å²	15	60.2 Å²	60.2	8%	0.079	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	155.2	170.7	-65	142.5	0	0	0	109.2	C64 P89 F90 F250 Y252	C64-L103 HydrophobicContact CB-CB 4.03Å; C64-L103 VanDerWaalsContact SG-C 3.57Å; P89-L103 HydrophobicContact CB-CD2 4.32Å; P89-L103 HydrophobicContact CG-CD2 3.9Å; F90-L103 HydrophobicContact CD1-CD1 3.94Å; F90-L103 HydrophobicContact CD1-CD2 3.54Å; F90-L103 HydrophobicContact CD1-CG 4.3Å; F90-L103 HydrophobicContact CE1-CD1 3.35Å; F90-L103 HydrophobicContact CE1-CD2 3.79Å; F90-L103 HydrophobicContact CE1-CG 4.18Å; F90-L103 HydrophobicContact CG-CD2 4.24Å; F90-L103 HydrophobicContact CZ-CD1 4.13Å; L103-F250 HydrophobicContact CB-CB 4.06Å; L103-F250 WeakPolarHBondContact CB-O 3.49Å; L103-F250 HydrophobicContact CD1-CB 4.06Å; L103-F250 PolarHBondContact N-O 3.31Å; L103-Y252 HydrophobicContact CD1-CD1 3.76Å; L103-Y252 HydrophobicContact CD1-CG 4.44Å; L103-Y252 HydrophobicContact CD2-CD1 3.91Å; L103-Y252 HydrophobicContact CD2-CE1 3.89Å; L103-Y252 HydrophobicContact CG-CD1 3.64Å; L103-Y252 HydrophobicContact CG-CE1 3.96Å
104	C	78.6	Confident	82.4	Confident	56 Å²	56	60.1 Å²	60.1	38%	0.378	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	34.4	-173.5	-64.1	0	0	0	0	115	C64 Q106 V111	C64-C104 WeakPolarHBondContact CA-SG 3.4Å; C64-C104 HydrophobicContact CB-CB 4.21Å; C64-C104 WeakPolarHBondContact CB-SG 3.07Å; C64-C104 WeakPolarHBondContact SG-CB 3.38Å; C64-C104 PolarHBondContact SG-N 3.06Å; C64-C104 VanDerWaalsContact SG-N 3.44Å; C64-C104 CovalentContact SG-SG 2.02Å; C64-C104 PolarHBondContact SG-SG 3.44Å; C104-Q106 PolarHBondContact O-N 2.83Å; C104-V111 HydrophobicContact CB-CG2 4.17Å
105	S	58.5	Low	82.5	Confident	53 Å²	53	63.2 Å²	63.2	37%	0.371	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-49.7	-14.3	-176.6	169.2	0	0	0	0	117.7	S107 S225	S105-S107 PolarHBondContact O-N 3.49Å; S105-S225 VanDerWaalsContact CB-OG 3.27Å; S105-S225 WeakPolarHBondContact CB-OG 3.48Å; S105-S225 PolarHBondContact OG-OG 2.89Å
106	Q	58.6	Low	82.7	Confident	181 Å²	181	68.2 Å²	68.2	85%	0.846	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-59.8	-2.8	-168.6	-73.9	-172.3	-5.5	0	0	116.7	C104	C104-Q106 PolarHBondContact O-N 2.83Å
107	S	55.4	Low	82.8	Confident	81 Å²	81	69.8 Å²	69.8	57%	0.566	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-155.4	10.4	173.3	-68.4	0	0	0	0	117	S105 K109	S105-S107 PolarHBondContact O-N 3.49Å; S107-K109 WeakPolarHBondContact O-CG 3.04Å; S107-K109 PolarHBondContact O-N 3.2Å
108	N	62.4	Low	82.8	Confident	60 Å²	60	63.7 Å²	63.7	32%	0.321	33%	0.333	S	S	.	.	S	Bend	trans	49.5	14.6	-168	-67.2	-27.9	0	0	0	115	E223 Y249	N108-E223 WeakPolarHBondContact ND2-CA 3.35Å; N108-Y249 PolarHBondContact O-OH 3.02Å
109	K	74.8	Confident	82.9	Confident	155 Å²	155	69.6 Å²	69.6	67%	0.674	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-94.6	139.1	-178.1	-76	176.2	-175.9	-179.5	0	109	S107	S107-K109 WeakPolarHBondContact O-CG 3.04Å; S107-K109 PolarHBondContact O-N 3.2Å
110	P	82.3	Confident	83.1	Confident	27 Å²	27	63.7 Å²	63.7	18%	0.175	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-60.3	144.8	171.8	27.8	-33.4	0	0	0	109.3	T112 L216 Q247 Y249	P110-T112 PolarHBondContact O-N 2.94Å; P110-L216 HydrophobicContact CB-CD1 3.87Å; P110-L216 HydrophobicContact CB-CD2 4.42Å; P110-Q247 HydrophobicContact CB-CB 4.04Å; P110-Q247 HydrophobicContact CG-CB 4.1Å; P110-Q247 HydrophobicContact CG-CG 4.38Å; P110-Y249 HydrophobicContact CB-CD1 4.45Å; P110-Y249 HydrophobicContact CB-CE1 4.14Å; P110-Y249 HydrophobicContact CB-CE2 4.31Å
111	V	85.7	Confident	83.3	Confident	33 Å²	33	63.5 Å²	63.5	20%	0.2	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	120.4	172.9	-179.9	0	0	0	0	106.8	C104 L113 Q247 L248 F250	C104-V111 HydrophobicContact CB-CG2 4.17Å; V111-L113 HydrophobicContact CG1-CD2 4.11Å; V111-Q247 WeakPolarHBondContact O-CA 3.31Å; V111-L248 PolarHBondContact N-O 3.32Å; V111-L248 PolarHBondContact O-N 3.05Å; V111-L248 VanDerWaalsContact O-N 3.13Å; V111-F250 HydrophobicContact CG2-CD2 4.21Å
112	T	88.4	Confident	83.5	Confident	62 Å²	62	61.8 Å²	61.8	38%	0.38	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	110.4	176	-53.2	0	0	0	0	108.2	P110 E245 Q247	P110-T112 PolarHBondContact O-N 2.94Å; T112-E245 HydrophobicContact CG2-CB 4.32Å; T112-Q247 HydrophobicContact CG2-CG 4.17Å
113	L	90.3	Very high	83.7	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	123.8	173.3	-60.3	-174.5	0	0	0	109	P62 V111 Q117 S118 I240 E245 N246 L248	P62-L113 HydrophobicContact CB-CD2 3.79Å; P62-L113 HydrophobicContact CG-CD2 3.44Å; P62-L113 VanDerWaalsContact CG-CD2 3.44Å; V111-L113 HydrophobicContact CG1-CD2 4.11Å; L113-Q117 HydrophobicContact CB-CB 4.35Å; L113-S118 WeakPolarHBondContact CB-OG 3.46Å; L113-S118 PolarHBondContact O-OG 2.85Å; L113-I240 HydrophobicContact CD1-CD1 4.31Å; L113-E245 VanDerWaalsContact O-CA 3.3Å; L113-E245 WeakPolarHBondContact O-CA 3.35Å; L113-N246 PolarHBondContact N-O 3.29Å; L113-N246 PolarHBondContact O-N 2.92Å; L113-L248 HydrophobicContact CD1-CD2 3.73Å; L113-L248 HydrophobicContact CG-CD2 4.3Å
114	T	93.2	Very high	84.1	Confident	61 Å²	61	65.6 Å²	65.6	37%	0.374	34%	0.338	S	S	.	.			trans	-62.2	164.2	172.5	67.2	0	0	0	0	110.7	E116 Q117 S118	T114-E116 VanDerWaalsContact C-N 3.26Å; T114-E116 PolarHBondContact O-N 3.46Å; T114-Q117 VanDerWaalsContact N-OE1 3.08Å; T114-Q117 PolarHBondContact O-N 2.92Å; T114-Q117 WeakPolarHBondContact OG1-CB 3.48Å; T114-Q117 WeakPolarHBondContact OG1-CG 3.1Å; T114-Q117 PolarHBondContact OG1-N 3.35Å; T114-S118 WeakPolarHBondContact O-CB 3.2Å; T114-S118 PolarHBondContact O-N 2.78Å; T114-S118 PolarHBondContact O-OG 2.71Å
115	V	93.7	Very high	84.8	Confident	65 Å²	65	63 Å²	63	39%	0.394	32%	0.321	S	S	.	.	H	α-helix	trans	-57.4	-41.1	177.2	-179.3	0	0	0	0	111.4	S118 R119 E245	V115-S118 PolarHBondContact O-N 3.38Å; V115-R119 WeakPolarHBondContact O-CB 3.22Å; V115-R119 PolarHBondContact O-N 3.09Å; V115-E245 HydrophobicContact CG2-CG 4.14Å
116	E	93.7	Very high	86.4	Confident	153 Å²	153	63.6 Å²	63.6	72%	0.715	32%	0.322	S	S	*	.	H	α-helix	trans	-64.6	-42.9	177.2	-65.3	-172.1	163.4	0	0	112.7	T114 R119 L120	T114-E116 VanDerWaalsContact C-N 3.26Å; T114-E116 PolarHBondContact O-N 3.46Å; E116-R119 PolarHBondContact O-N 3.16Å; E116-L120 WeakPolarHBondContact O-CB 3.44Å; E116-L120 PolarHBondContact O-N 3.21Å
117	Q	93.8	Very high	87.9	Confident	69 Å²	69	56.1 Å²	56.1	32%	0.322	29%	0.287	S	S	.	.	H	α-helix	trans	-66.2	-41.9	176.3	-77.6	174.1	-15.9	0	0	111.8	P62 L113 T114 R119 L120 V121	P62-Q117 HydrophobicContact CB-CG 4.19Å; P62-Q117 HydrophobicContact CG-CB 4.12Å; P62-Q117 HydrophobicContact CG-CG 4.25Å; L113-Q117 HydrophobicContact CB-CB 4.35Å; T114-Q117 VanDerWaalsContact N-OE1 3.08Å; T114-Q117 PolarHBondContact O-N 2.92Å; T114-Q117 WeakPolarHBondContact OG1-CB 3.48Å; T114-Q117 WeakPolarHBondContact OG1-CG 3.1Å; T114-Q117 PolarHBondContact OG1-N 3.35Å; Q117-R119 VanDerWaalsContact C-N 3.33Å; Q117-L120 PolarHBondContact O-N 2.89Å; Q117-V121 WeakPolarHBondContact O-CG2 3.42Å; Q117-V121 PolarHBondContact O-N 2.69Å
118	S	93.7	Very high	89.6	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.7	-42.1	177	-60.5	0	0	0	0	110.8	L113 T114 V115 A122 K244 N246	L113-S118 WeakPolarHBondContact CB-OG 3.46Å; L113-S118 PolarHBondContact O-OG 2.85Å; T114-S118 WeakPolarHBondContact O-CB 3.2Å; T114-S118 PolarHBondContact O-N 2.78Å; T114-S118 PolarHBondContact O-OG 2.71Å; V115-S118 PolarHBondContact O-N 3.38Å; S118-A122 VanDerWaalsContact O-CB 3.23Å; S118-A122 WeakPolarHBondContact O-CB 3.46Å; S118-A122 PolarHBondContact O-N 3.33Å; S118-K244 PolarHBondContact OG-O 2.69Å; S118-N246 WeakPolarHBondContact CB-ND2 3.3Å; S118-N246 PolarHBondContact OG-ND2 3.35Å
119	R	94.3	Very high	91.1	Very high	160 Å²	160	52.3 Å²	52.3	60%	0.604	26%	0.26	S	S	*	.	H	α-helix	trans	-62.2	-45.4	173.3	-170.5	-176.8	72.9	164	1	112	V115 E116 Q117 A122 E123	V115-R119 WeakPolarHBondContact O-CB 3.22Å; V115-R119 PolarHBondContact O-N 3.09Å; E116-R119 PolarHBondContact O-N 3.16Å; Q117-R119 VanDerWaalsContact C-N 3.33Å; R119-A122 PolarHBondContact O-N 2.75Å; R119-E123 WeakPolarHBondContact O-CB 3.14Å; R119-E123 PolarHBondContact O-N 2.9Å
120	L	93.5	Very high	92	Very high	50 Å²	50	46.6 Å²	46.6	26%	0.262	24%	0.235	S	C	.	.	H	α-helix	trans	-63.1	-45.3	178.8	-179.6	64.7	0	0	0	111.6	L61 E116 Q117 A122 E123 R124	L61-L120 HydrophobicContact CD2-CD2 4.16Å; L61-L120 HydrophobicContact CD2-CG 4.02Å; E116-L120 WeakPolarHBondContact O-CB 3.44Å; E116-L120 PolarHBondContact O-N 3.21Å; Q117-L120 PolarHBondContact O-N 2.89Å; L120-A122 VanDerWaalsContact C-N 3.35Å; L120-E123 PolarHBondContact O-N 2.67Å; L120-R124 WeakPolarHBondContact O-CG 3.12Å; L120-R124 PolarHBondContact O-N 3.08Å
121	V	94.3	Very high	92.6	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.03	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-45.3	175.9	169.8	0	0	0	0	110.5	L61 P62 Q117 E123 R124 I125 L179 I240	L61-V121 HydrophobicContact CD2-CG2 4.02Å; P62-V121 HydrophobicContact CG-CG2 3.97Å; Q117-V121 WeakPolarHBondContact O-CG2 3.42Å; Q117-V121 PolarHBondContact O-N 2.69Å; V121-E123 VanDerWaalsContact C-N 3.35Å; V121-E123 PolarHBondContact O-N 2.89Å; V121-R124 PolarHBondContact O-N 3.45Å; V121-I125 HydrophobicContact CG1-CD1 3.73Å; V121-I125 HydrophobicContact CG1-CG1 4.42Å; V121-I125 VanDerWaalsContact O-CG1 3.3Å; V121-I125 WeakPolarHBondContact O-CG1 3.32Å; V121-I125 PolarHBondContact O-N 3.04Å; V121-L179 HydrophobicContact CG1-CD1 3.9Å; V121-I240 HydrophobicContact CG1-CG1 4.48Å
122	A	94.3	Very high	93	Very high	4 Å²	4	44.2 Å²	44.2	3%	0.033	22%	0.219	C	C	.	.	H	α-helix	trans	-60.9	-41.9	177.5	0	0	0	0	0	112.8	S118 R119 L120 I125 T126 I177 I240 P242	S118-A122 VanDerWaalsContact O-CB 3.23Å; S118-A122 WeakPolarHBondContact O-CB 3.46Å; S118-A122 PolarHBondContact O-N 3.33Å; R119-A122 PolarHBondContact O-N 2.75Å; L120-A122 VanDerWaalsContact C-N 3.35Å; A122-I125 PolarHBondContact O-N 3.49Å; A122-T126 WeakPolarHBondContact O-CB 3.43Å; A122-T126 PolarHBondContact O-N 3.03Å; A122-T126 PolarHBondContact O-OG1 2.98Å; A122-I177 HydrophobicContact CB-CD1 3.66Å; A122-I177 HydrophobicContact CB-CG2 4.42Å; A122-I240 HydrophobicContact CB-CG2 4.43Å; A122-P242 HydrophobicContact CB-CB 4.11Å
123	E	92.6	Very high	93.3	Very high	81 Å²	81	41.2 Å²	41.2	38%	0.379	20%	0.201	S	C	.	.	H	α-helix	trans	-60	-50.3	173.9	-174.4	176.4	-171.4	0	0	110.6	R119 L120 V121 I125 T126 E127	R119-E123 WeakPolarHBondContact O-CB 3.14Å; R119-E123 PolarHBondContact O-N 2.9Å; L120-E123 PolarHBondContact O-N 2.67Å; V121-E123 VanDerWaalsContact C-N 3.35Å; V121-E123 PolarHBondContact O-N 2.89Å; E123-I125 VanDerWaalsContact C-N 3.34Å; E123-I125 PolarHBondContact O-N 3.3Å; E123-T126 PolarHBondContact O-N 3.46Å; E123-T126 VanDerWaalsContact O-N 3.14Å; E123-E127 WeakPolarHBondContact O-CB 3.25Å; E123-E127 VanDerWaalsContact O-CG 3.27Å; E123-E127 WeakPolarHBondContact O-CG 3.31Å; E123-E127 PolarHBondContact O-N 2.98Å
124	R	93.5	Very high	93.5	Very high	21 Å²	21	41.8 Å²	41.8	8%	0.079	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-34.8	178.3	-64.7	-46.7	-179.5	-170.7	-0.7	114	Y56 L61 L120 V121 E127 D128 Y129 L169	Y56-R124 PolarHBondContact OH-NH2 3.44Å; L61-R124 HydrophobicContact CD1-CG 4.48Å; L61-R124 HydrophobicContact CD2-CG 3.91Å; L120-R124 WeakPolarHBondContact O-CG 3.12Å; L120-R124 PolarHBondContact O-N 3.08Å; V121-R124 PolarHBondContact O-N 3.45Å; R124-E127 WeakPolarHBondContact CD-OE2 3.38Å; R124-E127 IonicContact CZ-OE2 3.27Å; R124-E127 IonicContact NH1-OE2 2.75Å; R124-E127 PolarHBondContact NH1-OE2 3.47Å; R124-D128 PolarHBondContact O-N 3.3Å; R124-Y129 HydrophobicContact CB-CD2 4.03Å; R124-Y129 HydrophobicContact CB-CG 4.31Å; R124-Y129 HydrophobicContact CG-CD2 4.35Å; R124-Y129 PolarHBondContact NH1-OH 3.47Å; R124-Y129 WeakPolarHBondContact O-CB 3.2Å; R124-Y129 WeakPolarHBondContact O-CD2 3.41Å; R124-Y129 PolarHBondContact O-N 3.29Å; R124-Y129 VanDerWaalsContact O-N 3.11Å; R124-L169 HydrophobicContact CB-CD2 3.57Å
125	I	93.9	Very high	93.5	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.015	19%	0.186	C	C	.	.	H	α-helix	trans	-68.2	-43.1	174.9	-66.4	164.8	0	0	0	110.1	V121 A122 E123 E127 D128 L169 T172 I177 L179	V121-I125 HydrophobicContact CG1-CD1 3.73Å; V121-I125 HydrophobicContact CG1-CG1 4.42Å; V121-I125 VanDerWaalsContact O-CG1 3.3Å; V121-I125 WeakPolarHBondContact O-CG1 3.32Å; V121-I125 PolarHBondContact O-N 3.04Å; A122-I125 PolarHBondContact O-N 3.49Å; E123-I125 VanDerWaalsContact C-N 3.34Å; E123-I125 PolarHBondContact O-N 3.3Å; I125-E127 PolarHBondContact O-N 3.18Å; I125-D128 PolarHBondContact O-N 3.15Å; I125-D128 VanDerWaalsContact O-N 3.12Å; I125-L169 HydrophobicContact CG1-CB 4.25Å; I125-L169 HydrophobicContact CG1-CD2 3.81Å; I125-L169 HydrophobicContact CG1-CG 3.77Å; I125-T172 HydrophobicContact CG2-CG2 4.26Å; I125-I177 HydrophobicContact CB-CG2 3.73Å; I125-I177 HydrophobicContact CD1-CG2 3.7Å; I125-I177 HydrophobicContact CG1-CG2 4.32Å; I125-I177 HydrophobicContact CG2-CG2 3.59Å; I125-L179 HydrophobicContact CD1-CB 4.15Å; I125-L179 HydrophobicContact CD1-CD1 3.99Å
126	T	91.6	Very high	93.3	Very high	64 Å²	64	36.7 Å²	36.7	39%	0.393	17%	0.172	S	C	.	.	H	α-helix	trans	-66.2	-30	178.6	-53.6	0	0	0	0	112.2	R51 A122 E123 D128	R51-T126 PolarHBondContact NH1-O 2.89Å; A122-T126 WeakPolarHBondContact O-CB 3.43Å; A122-T126 PolarHBondContact O-N 3.03Å; A122-T126 PolarHBondContact O-OG1 2.98Å; E123-T126 PolarHBondContact O-N 3.46Å; E123-T126 VanDerWaalsContact O-N 3.14Å; T126-D128 VanDerWaalsContact C-N 3.26Å; T126-D128 PolarHBondContact O-N 3.25Å
127	E	90.6	Very high	92.9	Very high	25 Å²	25	30.2 Å²	30.2	12%	0.117	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	6.1	175.3	-70.6	178.1	150.1	0	0	113.7	S49 T52 E123 R124 I125 Y129	S49-E127 VanDerWaalsContact CB-O 3.27Å; S49-E127 WeakPolarHBondContact CB-O 3.41Å; S49-E127 PolarHBondContact OG-O 3.49Å; T52-E127 HydrophobicContact CG2-CB 3.93Å; T52-E127 HydrophobicContact CG2-CG 3.84Å; E123-E127 WeakPolarHBondContact O-CB 3.25Å; E123-E127 VanDerWaalsContact O-CG 3.27Å; E123-E127 WeakPolarHBondContact O-CG 3.31Å; E123-E127 PolarHBondContact O-N 2.98Å; R124-E127 WeakPolarHBondContact CD-OE2 3.38Å; R124-E127 IonicContact CZ-OE2 3.27Å; R124-E127 IonicContact NH1-OE2 2.75Å; R124-E127 PolarHBondContact NH1-OE2 3.47Å; I125-E127 PolarHBondContact O-N 3.18Å; E127-Y129 HydrophobicContact CB-CD2 3.67Å; E127-Y129 HydrophobicContact CB-CE2 3.69Å; E127-Y129 PolarHBondContact O-N 3.41Å; E127-Y129 WeakPolarHBondContact OE2-CE2 3.25Å
128	D	90.9	Very high	92.7	Very high	59 Å²	59	26.9 Å²	26.9	32%	0.316	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	47.3	-179.7	-66.9	-42.7	0	0	0	114	R51 R124 I125 T126 Y130	R51-D128 VanDerWaalsContact CD-OD2 3.26Å; R51-D128 WeakPolarHBondContact CD-OD2 3.39Å; R51-D128 HydrophobicContact CG-CB 4.37Å; R124-D128 PolarHBondContact O-N 3.3Å; I125-D128 PolarHBondContact O-N 3.15Å; I125-D128 VanDerWaalsContact O-N 3.12Å; T126-D128 VanDerWaalsContact C-N 3.26Å; T126-D128 PolarHBondContact O-N 3.25Å; D128-Y130 WeakPolarHBondContact O-CD2 3.26Å
129	Y	93.8	Very high	92.6	Very high	1 Å²	1	27.2 Å²	27.2	0%	0.004	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	131.3	174	-87.9	-90.9	0	0	0	113	L47 T48 T52 L54 Y56 R124 E127 L169	L47-Y129 HydrophobicContact CB-CD1 3.71Å; L47-Y129 HydrophobicContact CB-CE1 4.22Å; T48-Y129 CarbonylContact O-C 3.54Å; T48-Y129 WeakPolarHBondContact O-CA 3.46Å; T52-Y129 HydrophobicContact CG2-CE2 4.15Å; T52-Y129 VanDerWaalsContact OG1-CZ 3.28Å; T52-Y129 PolarHBondContact OG1-OH 3.47Å; L54-Y129 WeakPolarHBondContact O-CE1 3.44Å; L54-Y129 PolarHBondContact O-OH 3.2Å; Y56-Y129 AromaticContact CD2-CE1 3.77Å; Y56-Y129 HydrophobicContact CD2-CE1 3.77Å; Y56-Y129 AromaticContact CD2-CZ 3.73Å; Y56-Y129 VanDerWaalsContact CD2-OH 3.26Å; Y56-Y129 WeakPolarHBondContact CD2-OH 3.5Å; Y56-Y129 HydrophobicContact CE2-CE1 4.45Å; Y56-Y129 AromaticContact CE2-CZ 3.97Å; Y56-Y129 WeakPolarHBondContact CE2-OH 3.04Å; R124-Y129 HydrophobicContact CB-CD2 4.03Å; R124-Y129 HydrophobicContact CB-CG 4.31Å; R124-Y129 HydrophobicContact CG-CD2 4.35Å; R124-Y129 PolarHBondContact NH1-OH 3.47Å; R124-Y129 WeakPolarHBondContact O-CB 3.2Å; R124-Y129 WeakPolarHBondContact O-CD2 3.41Å; R124-Y129 PolarHBondContact O-N 3.29Å; R124-Y129 VanDerWaalsContact O-N 3.11Å; E127-Y129 HydrophobicContact CB-CD2 3.67Å; E127-Y129 HydrophobicContact CB-CE2 3.69Å; E127-Y129 PolarHBondContact O-N 3.41Å; E127-Y129 WeakPolarHBondContact OE2-CE2 3.25Å; Y129-L169 WeakPolarHBondContact O-CB 3.26Å; Y129-L169 PolarHBondContact O-N 3.22Å
130	Y	94	Very high	92.6	Very high	36 Å²	36	19.6 Å²	19.6	14%	0.141	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	140.8	169.4	-77.3	-107.1	0	0	0	110.6	L47 T48 D128 E164 Y167 R168	L47-Y130 CarbonylContact C-O 3.55Å; L47-Y130 VanDerWaalsContact CA-O 3.24Å; L47-Y130 WeakPolarHBondContact CA-O 3.36Å; T48-Y130 PolarHBondContact N-O 2.95Å; T48-Y130 PolarHBondContact O-N 2.93Å; D128-Y130 WeakPolarHBondContact O-CD2 3.26Å; Y130-E164 HydrophobicContact CE1-CB 4.38Å; Y130-E164 VanDerWaalsContact CE1-OE2 3.25Å; Y130-E164 WeakPolarHBondContact CE1-OE2 3.37Å; Y130-E164 VanDerWaalsContact OH-CD 3.3Å; Y130-E164 PolarHBondContact OH-OE1 3.4Å; Y130-E164 PolarHBondContact OH-OE2 3.09Å; Y130-Y167 CarbonylContact C-O 3.58Å; Y130-Y167 VanDerWaalsContact CA-O 3.29Å; Y130-Y167 WeakPolarHBondContact CA-O 3.41Å; Y130-R168 HydrophobicContact CD1-CG 4.25Å; Y130-R168 HydrophobicContact CE1-CG 3.65Å; Y130-R168 HydrophobicContact CE2-CG 3.95Å; Y130-R168 PolarHBondContact OH-NE 2.99Å; Y130-R168 PolarHBondContact OH-NH2 3.13Å
131	V	95.3	Very high	92.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.2	176.7	-172.8	0	0	0	0	109.7	L47 Y58 F63 L133 G166 Y167 L169	L47-V131 HydrophobicContact CD2-CB 4.03Å; L47-V131 HydrophobicContact CD2-CG1 4.01Å; L47-V131 HydrophobicContact CD2-CG2 3.61Å; Y58-V131 HydrophobicContact CD2-CG1 3.77Å; Y58-V131 HydrophobicContact CE2-CG1 3.58Å; F63-V131 HydrophobicContact CZ-CG2 4.47Å; V131-L133 HydrophobicContact CG1-CD2 4.34Å; V131-G166 WeakPolarHBondContact O-CA 3.3Å; V131-Y167 HydrophobicContact CB-CD1 3.99Å; V131-Y167 HydrophobicContact CB-CD2 4.34Å; V131-Y167 HydrophobicContact CB-CE1 3.5Å; V131-Y167 HydrophobicContact CB-CE2 3.87Å; V131-Y167 HydrophobicContact CB-CG 4.39Å; V131-Y167 VanDerWaalsContact CB-CZ 3.42Å; V131-Y167 HydrophobicContact CG1-CE1 3.66Å; V131-Y167 WeakPolarHBondContact CG1-OH 3.47Å; V131-Y167 HydrophobicContact CG2-CD2 4.34Å; V131-Y167 HydrophobicContact CG2-CE1 4.26Å; V131-Y167 HydrophobicContact CG2-CE2 3.69Å; V131-Y167 PolarHBondContact N-O 3.44Å; V131-Y167 PolarHBondContact O-N 3.46Å; V131-Y167 VanDerWaalsContact O-N 3.13Å; V131-L169 HydrophobicContact CG2-CB 4.36Å; V131-L169 HydrophobicContact CG2-CD1 4.11Å
132	H	94.1	Very high	92.4	Very high	9 Å²	9	18 Å²	18	4%	0.042	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	114.7	179.1	-63.2	-70.9	0	0	0	111.3	V45 K46 T48 H165	V45-H132 HydrophobicContact CB-CB 4.18Å; V45-H132 PolarHBondContact N-O 3.16Å; K46-H132 WeakPolarHBondContact O-CB 3.5Å; K46-H132 PolarHBondContact O-CD2 2.99Å; K46-H132 PolarHBondContact O-N 3.4Å; T48-H132 PolarHBondContact OG1-NE2 2.95Å; H132-H165 AromaticContact CE1-CD2 3.92Å; H132-H165 AromaticContact CE1-CE1 3.97Å; H132-H165 AromaticContact CE1-CG 3.78Å; H132-H165 AromaticContact CE1-ND1 3.82Å; H132-H165 PolarHBondContact CE1-O 3.48Å; H132-H165 AromaticContact ND1-CD2 3.4Å; H132-H165 PolarHBondContact ND1-CD2 3.42Å; H132-H165 AromaticContact ND1-CE1 3.64Å; H132-H165 AromaticContact ND1-CG 3.74Å; H132-H165 AromaticContact ND1-ND1 3.88Å; H132-H165 AromaticContact ND1-NE2 3.36Å; H132-H165 PolarHBondContact ND1-NE2 2.77Å
133	L	95.1	Very high	92	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	159.2	170.8	-54.5	178.3	0	0	0	110.2	I42 K43 A44 Y58 F90 V131 V140 Y167 F185 F207	I42-L133 HydrophobicContact CG2-CB 4.34Å; I42-L133 HydrophobicContact CG2-CD1 4.33Å; K43-L133 CarbonylContact O-C 3.52Å; K43-L133 VanDerWaalsContact O-CA 3.31Å; K43-L133 WeakPolarHBondContact O-CA 3.5Å; A44-L133 HydrophobicContact CB-CD2 3.66Å; Y58-L133 HydrophobicContact CD2-CD2 4.47Å; Y58-L133 HydrophobicContact CE2-CD2 4Å; F90-L133 HydrophobicContact CE2-CD1 4.18Å; V131-L133 HydrophobicContact CG1-CD2 4.34Å; L133-V140 HydrophobicContact CB-CB 4.04Å; L133-V140 HydrophobicContact CB-CG1 3.8Å; L133-V140 HydrophobicContact CG-CG1 4.38Å; L133-V140 PolarHBondContact O-N 2.9Å; L133-Y167 HydrophobicContact CD1-CE1 3.85Å; L133-Y167 HydrophobicContact CG-CE1 4.12Å; L133-F185 HydrophobicContact CD1-CE1 3.91Å; L133-F185 HydrophobicContact CD1-CZ 3.99Å; L133-F207 HydrophobicContact CB-CE1 4.18Å
134	I	93.3	Very high	91.4	Very high	11 Å²	11	21.2 Å²	21.2	6%	0.056	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.9	176.8	62.7	178.5	0	0	0	111.2	I42 K43 V45 I85 L138	I42-I134 WeakPolarHBondContact CA-O 3.43Å; K43-I134 HydrophobicContact CB-CD1 3.91Å; K43-I134 HydrophobicContact CB-CG1 3.62Å; K43-I134 PolarHBondContact N-O 3.05Å; K43-I134 PolarHBondContact O-N 3.19Å; V45-I134 HydrophobicContact CG2-CB 4.4Å; V45-I134 HydrophobicContact CG2-CD1 3.99Å; V45-I134 HydrophobicContact CG2-CG1 4.12Å; V45-I134 HydrophobicContact CG2-CG2 3.52Å; I85-I134 HydrophobicContact CG2-CD1 3.9Å; I134-L138 CarbonylContact C-O 3.58Å; I134-L138 WeakPolarHBondContact CA-O 3.25Å
135	A	92.8	Very high	90.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	126.5	171.1	0	0	0	0	0	108.5	V40 I42 N137 L138 L187 F207	V40-A135 HydrophobicContact CG1-CB 4.44Å; I42-A135 HydrophobicContact CD1-CB 3.56Å; A135-N137 PolarHBondContact O-N 3.43Å; A135-N137 VanDerWaalsContact O-N 3.11Å; A135-L138 PolarHBondContact N-O 3.38Å; A135-L138 WeakPolarHBondContact O-CA 3.31Å; A135-L138 WeakPolarHBondContact O-CB 3.31Å; A135-L138 PolarHBondContact O-N 3.42Å; A135-L187 HydrophobicContact CB-CD2 4.29Å; A135-F207 HydrophobicContact CB-CB 4.48Å; A135-F207 HydrophobicContact CB-CD1 3.55Å; A135-F207 HydrophobicContact CB-CE1 3.78Å; A135-F207 HydrophobicContact CB-CG 3.97Å; A135-F207 HydrophobicContact CB-CZ 4.37Å
136	D	89.4	Confident	89	Confident	19 Å²	19	27.4 Å²	27.4	10%	0.102	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.8	40.6	-176.3	-170	33	0	0	0	114.9	I32 F34 L138 V204 R266	I32-D136 WeakPolarHBondContact CD1-OD1 3.17Å; F34-D136 HydrophobicContact CE2-CB 4.43Å; D136-L138 PolarHBondContact O-N 3.27Å; D136-L138 VanDerWaalsContact O-N 3.16Å; D136-V204 HydrophobicContact CB-CB 4.23Å; D136-R266 PolarHBondContact O-NH1 3.17Å; D136-R266 PolarHBondContact O-NH2 2.79Å; D136-R266 IonicContact OD2-CZ 2.87Å; D136-R266 IonicContact OD2-NH1 3.51Å; D136-R266 PolarHBondContact OD2-NH1 3.29Å; D136-R266 IonicContact OD2-NH2 3.88Å
137	N	86.7	Confident	87.4	Confident	17 Å²	17	31.6 Å²	31.6	9%	0.091	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	5	-172.2	-60.8	-50.9	0	0	0	116.2	G28 A135 W267 R375	G28-N137 PolarHBondContact N-ND2 3.05Å; A135-N137 PolarHBondContact O-N 3.43Å; A135-N137 VanDerWaalsContact O-N 3.11Å; N137-W267 WeakPolarHBondContact O-CZ2 3.35Å; N137-R375 PolarHBondContact OD1-NH2 3.42Å
138	L	89.9	Confident	85.4	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	135.2	167.9	-65.9	174	0	0	0	110.2	I134 A135 D136 V204 V205 F207 R266 W267 Y270	I134-L138 CarbonylContact C-O 3.58Å; I134-L138 WeakPolarHBondContact CA-O 3.25Å; A135-L138 PolarHBondContact N-O 3.38Å; A135-L138 WeakPolarHBondContact O-CA 3.31Å; A135-L138 WeakPolarHBondContact O-CB 3.31Å; A135-L138 PolarHBondContact O-N 3.42Å; D136-L138 PolarHBondContact O-N 3.27Å; D136-L138 VanDerWaalsContact O-N 3.16Å; L138-V204 HydrophobicContact CD1-CG1 4.19Å; L138-V205 VanDerWaalsContact CD1-C 3.47Å; L138-F207 HydrophobicContact CB-CB 4.42Å; L138-R266 HydrophobicContact CD2-CG 3.98Å; L138-W267 HydrophobicContact CD2-CZ2 4.44Å; L138-Y270 HydrophobicContact CD2-CE2 3.95Å
139	P	91.5	Very high	83.3	Confident	6 Å²	6	37.6 Å²	37.6	4%	0.039	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	145.7	171.1	30.6	-32.9	0	0	0	110.2	H165 W267 Y270 F530	P139-H165 VanDerWaalsContact CB-NE2 3.32Å; P139-H165 WeakPolarHBondContact CB-NE2 3.12Å; P139-W267 HydrophobicContact CG-CH2 3.98Å; P139-W267 HydrophobicContact CG-CZ3 4.16Å; P139-Y270 HydrophobicContact CG-CD1 4.08Å; P139-Y270 HydrophobicContact CG-CE1 4.07Å; P139-Y270 WeakPolarHBondContact O-CE1 3.42Å; P139-Y270 PolarHBondContact O-OH 3.15Å; P139-F530 HydrophobicContact CB-CZ 4.26Å; P139-F530 HydrophobicContact CG-CE2 4.23Å; P139-F530 HydrophobicContact CG-CZ 3.83Å
140	V	93.3	Very high	81.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-67.2	137	165.8	77.3	0	0	0	0	108.9	L133 G166 Y167 F207 V209	L133-V140 HydrophobicContact CB-CB 4.04Å; L133-V140 HydrophobicContact CB-CG1 3.8Å; L133-V140 HydrophobicContact CG-CG1 4.38Å; L133-V140 PolarHBondContact O-N 2.9Å; V140-G166 PolarHBondContact O-N 3.27Å; V140-Y167 HydrophobicContact CG1-CD1 4.46Å; V140-F207 HydrophobicContact CB-CD1 3.71Å; V140-F207 HydrophobicContact CB-CE1 3.51Å; V140-F207 HydrophobicContact CB-CG 4.38Å; V140-F207 HydrophobicContact CB-CZ 4.03Å; V140-F207 HydrophobicContact CG2-CD1 3.99Å; V140-F207 HydrophobicContact CG2-CD2 4.24Å; V140-F207 HydrophobicContact CG2-CE1 3.72Å; V140-F207 HydrophobicContact CG2-CE2 3.99Å; V140-F207 HydrophobicContact CG2-CG 4.25Å; V140-F207 HydrophobicContact CG2-CZ 3.72Å; V140-V209 HydrophobicContact CG2-CB 3.53Å; V140-V209 HydrophobicContact CG2-CG1 3.42Å; V140-V209 VanDerWaalsContact CG2-CG1 3.42Å
141	A	91.9	Very high	78.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.008	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.6	173.8	0	0	0	0	0	112.3	F163 E164 F207 E208 V209 Y270	A141-F163 HydrophobicContact CB-CB 4.04Å; A141-F163 HydrophobicContact CB-CD1 4.02Å; A141-F163 HydrophobicContact CB-CG 4.46Å; A141-E164 CarbonylContact C-O 3.52Å; A141-E164 WeakPolarHBondContact CA-O 3.31Å; A141-E164 WeakPolarHBondContact CB-O 3.41Å; A141-F207 PolarHBondContact N-O 3.42Å; A141-F207 VanDerWaalsContact N-O 3.11Å; A141-E208 CarbonylContact O-C 3.59Å; A141-E208 VanDerWaalsContact O-CA 3.27Å; A141-E208 WeakPolarHBondContact O-CA 3.45Å; A141-V209 PolarHBondContact O-N 3.36Å; A141-Y270 HydrophobicContact CB-CD1 3.9Å; A141-Y270 HydrophobicContact CB-CE1 3.57Å
142	T	91	Very high	76.2	Confident	20 Å²	20	57.4 Å²	57.4	12%	0.123	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	123.3	169.5	-55.3	0	0	0	0	108.5	L144 E164 G166 Y167	T142-L144 PolarHBondContact O-N 3.05Å; T142-E164 PolarHBondContact N-O 2.91Å; T142-E164 PolarHBondContact O-N 2.99Å; T142-G166 PolarHBondContact N-O 3.39Å; T142-G166 PolarHBondContact OG1-O 3.02Å; T142-Y167 WeakPolarHBondContact OG1-CA 3.38Å
143	R	87.5	Confident	74	Confident	100 Å²	100	64.9 Å²	64.9	38%	0.377	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	119.1	178.3	-175.4	179.1	166.8	-177.9	-6	110.2	E145 V161 F163	R143-E145 IonicContact CZ-OE1 3.76Å; R143-E145 IonicContact NE-OE1 2.74Å; R143-E145 IonicContact NH2-OE1 2.75Å; R143-E145 PolarHBondContact NH2-OE1 3.47Å; R143-V161 HydrophobicContact CG-CG1 3.52Å; R143-F163 HydrophobicContact CB-CD1 4.38Å; R143-F163 HydrophobicContact CB-CE1 4.13Å; R143-F163 HydrophobicContact CG-CE1 4.13Å
144	L	79.7	Confident	71.7	Confident	53 Å²	53	72 Å²	72	28%	0.277	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121.4	170.7	-64	-177.4	0	0	0	109.8	T142 V161 Q162 E164	T142-L144 PolarHBondContact O-N 3.05Å; L144-V161 WeakPolarHBondContact O-CA 3.5Å; L144-Q162 HydrophobicContact CB-CB 4.49Å; L144-Q162 PolarHBondContact N-O 2.97Å; L144-Q162 PolarHBondContact O-N 3.33Å; L144-E164 HydrophobicContact CD1-CG 3.54Å; L144-E164 WeakPolarHBondContact CD1-OE1 3.19Å; L144-E164 HydrophobicContact CG-CG 4.09Å
145	E	74.3	Confident	69.1	Low	72 Å²	72	81.2 Å²	81.2	34%	0.336	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	100.8	170	-58.5	-161.8	150.4	0	0	108.9	R143 K159	R143-E145 IonicContact CZ-OE1 3.76Å; R143-E145 IonicContact NE-OE1 2.74Å; R143-E145 IonicContact NH2-OE1 2.75Å; R143-E145 PolarHBondContact NH2-OE1 3.47Å; E145-K159 IonicContact OE1-NZ 3.23Å; E145-K159 IonicContact OE2-NZ 3.12Å; E145-K159 PolarHBondContact OE2-NZ 3.34Å
146	L	62	Low	66.7	Low	83 Å²	83	90.2 Å²	90.2	44%	0.435	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	120.7	173.8	-71.7	165.2	0	0	0	108.9	S148 D160 Q162	L146-S148 PolarHBondContact O-N 2.92Å; L146-D160 PolarHBondContact N-O 2.9Å; L146-D160 VanDerWaalsContact N-O 3.09Å; L146-D160 PolarHBondContact O-N 3.32Å; L146-Q162 HydrophobicContact CD1-CG 4.14Å; L146-Q162 VanDerWaalsContact CD1-OE1 3.25Å
147	Y	57.5	Low	64.5	Low	152 Å²	152	98.4 Å²	98.4	60%	0.596	48%	0.476	S	S	*	.			trans	-77.5	102.1	168.6	-65.9	-82.7	0	0	0	108.2	N149	Y147-N149 PolarHBondContact O-N 2.81Å
148	S	50.1	Low	62.6	Low	53 Å²	53	105.3 Å²	105.3	37%	0.371	51%	0.508	S	S	.	.			trans	-64.1	108	170.8	-168.3	0	0	0	0	108.7	L146 R150	L146-S148 PolarHBondContact O-N 2.92Å; S148-R150 PolarHBondContact O-N 3.43Å
149	N	46.4	Very low	61	Low	156 Å²	156	110 Å²	110	83%	0.834	53%	0.528	S	S	*	.			trans	-74.3	57.2	166.4	-88.6	-8.1	0	0	0	109.2	Y147 D151	Y147-N149 PolarHBondContact O-N 2.81Å; N149-D151 PolarHBondContact O-N 2.89Å
150	R	48	Very low	59.6	Low	190 Å²	190	113 Å²	113	72%	0.717	54%	0.544	S	S	*	.			trans	-80.9	103.6	165.1	-85	-178.2	177.9	175.6	2.1	107.6	S148 S152	S148-R150 PolarHBondContact O-N 3.43Å; R150-S152 PolarHBondContact O-N 3.49Å; R150-S152 PolarHBondContact O-OG 3.5Å
151	D	43.1	Very low	58.5	Low	167 Å²	167	115 Å²	115	89%	0.893	56%	0.557	S	S	*	*			trans	-44.3	96.1	167.5	-68.8	-43.6	0	0	0	110.6	N149	N149-D151 PolarHBondContact O-N 2.89Å
152	S	43.5	Very low	57.6	Low	96 Å²	96	118.7 Å²	118.7	67%	0.671	57%	0.573	S	S	*	*			trans	-161	109.7	164.2	17.7	0	0	0	0	108.4	R150 D154	R150-S152 PolarHBondContact O-N 3.49Å; R150-S152 PolarHBondContact O-OG 3.5Å; S152-D154 VanDerWaalsContact C-N 3.27Å; S152-D154 PolarHBondContact O-N 3.4Å
153	D	47.1	Very low	57.1	Low	166 Å²	166	119.3 Å²	119.3	89%	0.888	57%	0.574	S	S	*	*			trans	-50	92.4	158.4	-77.7	-48.8	0	0	0	108.8
154	D	47	Very low	56.9	Low	151 Å²	151	116.2 Å²	116.2	81%	0.807	56%	0.564	S	S	*	*	S	Bend	trans	180	148.8	143.6	-94.5	-37	0	0	0	111.8	S152 K156	S152-D154 VanDerWaalsContact C-N 3.27Å; S152-D154 PolarHBondContact O-N 3.4Å; D154-K156 PolarHBondContact O-N 2.94Å
155	K	39.3	Very low	57.3	Low	204 Å²	204	116.1 Å²	116.1	89%	0.887	56%	0.562	S	S	*	*	S	Bend	trans	-59.5	85.6	-169.3	-63.6	166	177.4	170.2	0	113.4
156	K	40.8	Very low	58.1	Low	189 Å²	189	112.7 Å²	112.7	82%	0.822	55%	0.546	S	S	*	.			trans	-175.5	89.3	148.3	-102.5	168.3	-176.1	-172.5	0	107.9	D154 E158	D154-K156 PolarHBondContact O-N 2.94Å; K156-E158 PolarHBondContact O-N 3.21Å
157	K	43.5	Very low	59.6	Low	190 Å²	190	108.9 Å²	108.9	83%	0.826	53%	0.526	S	S	*	.			trans	-67.2	86.9	162.4	-70.5	-173.8	178.6	-173.4	0	106.8	K159	K157-K159 PolarHBondContact O-N 2.85Å
158	E	48.3	Very low	61.3	Low	162 Å²	162	106.9 Å²	106.9	76%	0.757	52%	0.517	S	S	*	.			trans	-66	117.9	172.8	-151.6	160.8	-149.1	0	0	106.5	K156 D160	K156-E158 PolarHBondContact O-N 3.21Å; E158-D160 PolarHBondContact O-N 3.43Å
159	K	55.5	Low	63.4	Low	98 Å²	98	104.4 Å²	104.4	43%	0.426	50%	0.5	S	S	.	.			trans	-77.2	112.5	179.6	-67.7	-176.3	175.6	-166.6	0	106.9	E145 K157 V161	E145-K159 IonicContact OE1-NZ 3.23Å; E145-K159 IonicContact OE2-NZ 3.12Å; E145-K159 PolarHBondContact OE2-NZ 3.34Å; K157-K159 PolarHBondContact O-N 2.85Å; K159-V161 HydrophobicContact CB-CG2 4.49Å; K159-V161 PolarHBondContact O-N 3.25Å; K159-V161 VanDerWaalsContact O-N 3.09Å
160	D	61.9	Low	65.7	Low	69 Å²	69	97.2 Å²	97.2	37%	0.369	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	104.1	169.4	-75	-30.6	0	0	0	107.2	L146 E158	L146-D160 PolarHBondContact N-O 2.9Å; L146-D160 VanDerWaalsContact N-O 3.09Å; L146-D160 PolarHBondContact O-N 3.32Å; E158-D160 PolarHBondContact O-N 3.43Å
161	V	70	Confident	67.8	Low	44 Å²	44	91.6 Å²	91.6	27%	0.267	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	118.1	177	-178.1	0	0	0	0	108	R143 L144 K159 F163	R143-V161 HydrophobicContact CG-CG1 3.52Å; L144-V161 WeakPolarHBondContact O-CA 3.5Å; K159-V161 HydrophobicContact CB-CG2 4.49Å; K159-V161 PolarHBondContact O-N 3.25Å; K159-V161 VanDerWaalsContact O-N 3.09Å; V161-F163 HydrophobicContact CG1-CE1 4.47Å; V161-F163 HydrophobicContact CG1-CE2 3.87Å; V161-F163 HydrophobicContact CG1-CZ 3.86Å
162	Q	73.5	Confident	70.1	Confident	77 Å²	77	87.5 Å²	87.5	36%	0.36	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	145.3	172.3	-68.8	-173.1	-10.3	0	0	109.8	L144 L146	L144-Q162 HydrophobicContact CB-CB 4.49Å; L144-Q162 PolarHBondContact N-O 2.97Å; L144-Q162 PolarHBondContact O-N 3.33Å; L146-Q162 HydrophobicContact CD1-CG 4.14Å; L146-Q162 VanDerWaalsContact CD1-OE1 3.25Å
163	F	80.4	Confident	72.3	Confident	33 Å²	33	87.1 Å²	87.1	15%	0.145	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	113.4	178.5	-69.2	-81.6	0	0	0	109.5	A141 R143 V161 E208 T269	A141-F163 HydrophobicContact CB-CB 4.04Å; A141-F163 HydrophobicContact CB-CD1 4.02Å; A141-F163 HydrophobicContact CB-CG 4.46Å; R143-F163 HydrophobicContact CB-CD1 4.38Å; R143-F163 HydrophobicContact CB-CE1 4.13Å; R143-F163 HydrophobicContact CG-CE1 4.13Å; V161-F163 HydrophobicContact CG1-CE1 4.47Å; V161-F163 HydrophobicContact CG1-CE2 3.87Å; V161-F163 HydrophobicContact CG1-CZ 3.86Å; F163-E208 HydrophobicContact CE1-CG 4.28Å; F163-T269 HydrophobicContact CD2-CG2 4.17Å; F163-T269 WeakPolarHBondContact CD2-O 3.34Å; F163-T269 HydrophobicContact CE1-CG2 4.35Å; F163-T269 HydrophobicContact CE2-CG2 3.44Å; F163-T269 VanDerWaalsContact CE2-CG2 3.44Å; F163-T269 HydrophobicContact CZ-CG2 3.55Å
164	E	84.1	Confident	74.1	Confident	35 Å²	35	85.1 Å²	85.1	16%	0.164	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	134.1	168.9	-73	-169.9	166.6	0	0	109.5	Y130 A141 T142 L144 G166 R168	Y130-E164 HydrophobicContact CE1-CB 4.38Å; Y130-E164 VanDerWaalsContact CE1-OE2 3.25Å; Y130-E164 WeakPolarHBondContact CE1-OE2 3.37Å; Y130-E164 VanDerWaalsContact OH-CD 3.3Å; Y130-E164 PolarHBondContact OH-OE1 3.4Å; Y130-E164 PolarHBondContact OH-OE2 3.09Å; A141-E164 CarbonylContact C-O 3.52Å; A141-E164 WeakPolarHBondContact CA-O 3.31Å; A141-E164 WeakPolarHBondContact CB-O 3.41Å; T142-E164 PolarHBondContact N-O 2.91Å; T142-E164 PolarHBondContact O-N 2.99Å; L144-E164 HydrophobicContact CD1-CG 3.54Å; L144-E164 WeakPolarHBondContact CD1-OE1 3.19Å; L144-E164 HydrophobicContact CG-CG 4.09Å; E164-G166 PolarHBondContact O-N 3.36Å; E164-R168 IonicContact OE1-NH2 3.73Å; E164-R168 PolarHBondContact OE1-NH2 3.23Å; E164-R168 IonicContact OE2-NE 2.69Å; E164-R168 IonicContact OE2-NH2 3.89Å
165	H	86.1	Confident	75.8	Confident	51 Å²	51	86.2 Å²	86.2	24%	0.236	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	122.5	177	-176.3	-166.7	0	0	0	110.6	H132 P139 F530	H132-H165 AromaticContact CE1-CD2 3.92Å; H132-H165 AromaticContact CE1-CE1 3.97Å; H132-H165 AromaticContact CE1-CG 3.78Å; H132-H165 AromaticContact CE1-ND1 3.82Å; H132-H165 PolarHBondContact CE1-O 3.48Å; H132-H165 AromaticContact ND1-CD2 3.4Å; H132-H165 PolarHBondContact ND1-CD2 3.42Å; H132-H165 AromaticContact ND1-CE1 3.64Å; H132-H165 AromaticContact ND1-CG 3.74Å; H132-H165 AromaticContact ND1-ND1 3.88Å; H132-H165 AromaticContact ND1-NE2 3.36Å; H132-H165 PolarHBondContact ND1-NE2 2.77Å; P139-H165 VanDerWaalsContact CB-NE2 3.32Å; P139-H165 WeakPolarHBondContact CB-NE2 3.12Å; H165-F530 HydrophobicContact CB-CE2 3.99Å; H165-F530 HydrophobicContact CB-CZ 4.34Å; H165-F530 AromaticContact CD2-CZ 3.96Å; H165-F530 AromaticContact CE1-CZ 3.55Å; H165-F530 AromaticContact CG-CE2 3.83Å; H165-F530 AromaticContact CG-CZ 3.69Å; H165-F530 AromaticContact ND1-CE2 3.93Å; H165-F530 AromaticContact ND1-CZ 3.42Å; H165-F530 WeakPolarHBondContact ND1-CZ 3.2Å; H165-F530 AromaticContact NE2-CZ 3.86Å
166	G	91.4	Very high	78.3	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	83.9	-168.7	-174.3	0	0	0	0	0	112.6	V131 V140 T142 E164	V131-G166 WeakPolarHBondContact O-CA 3.3Å; V140-G166 PolarHBondContact O-N 3.27Å; T142-G166 PolarHBondContact N-O 3.39Å; T142-G166 PolarHBondContact OG1-O 3.02Å; E164-G166 PolarHBondContact O-N 3.36Å
167	Y	93.8	Very high	80.8	Confident	4 Å²	4	73 Å²	73	2%	0.016	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149	170.1	67.7	-89	0	0	0	110.6	Y130 V131 L133 V140 T142 L169 L183 V209 P211	Y130-Y167 CarbonylContact C-O 3.58Å; Y130-Y167 VanDerWaalsContact CA-O 3.29Å; Y130-Y167 WeakPolarHBondContact CA-O 3.41Å; V131-Y167 HydrophobicContact CB-CD1 3.99Å; V131-Y167 HydrophobicContact CB-CD2 4.34Å; V131-Y167 HydrophobicContact CB-CE1 3.5Å; V131-Y167 HydrophobicContact CB-CE2 3.87Å; V131-Y167 HydrophobicContact CB-CG 4.39Å; V131-Y167 VanDerWaalsContact CB-CZ 3.42Å; V131-Y167 HydrophobicContact CG1-CE1 3.66Å; V131-Y167 WeakPolarHBondContact CG1-OH 3.47Å; V131-Y167 HydrophobicContact CG2-CD2 4.34Å; V131-Y167 HydrophobicContact CG2-CE1 4.26Å; V131-Y167 HydrophobicContact CG2-CE2 3.69Å; V131-Y167 PolarHBondContact N-O 3.44Å; V131-Y167 PolarHBondContact O-N 3.46Å; V131-Y167 VanDerWaalsContact O-N 3.13Å; L133-Y167 HydrophobicContact CD1-CE1 3.85Å; L133-Y167 HydrophobicContact CG-CE1 4.12Å; V140-Y167 HydrophobicContact CG1-CD1 4.46Å; T142-Y167 WeakPolarHBondContact OG1-CA 3.38Å; Y167-L169 PolarHBondContact O-N 3.39Å; Y167-L183 HydrophobicContact CD2-CD2 3.91Å; Y167-L183 HydrophobicContact CE1-CD1 3.97Å; Y167-L183 HydrophobicContact CE1-CD2 4.22Å; Y167-L183 HydrophobicContact CE2-CD1 4.38Å; Y167-L183 HydrophobicContact CE2-CD2 3.6Å; Y167-L183 HydrophobicContact CG-CD2 4.38Å; Y167-L183 WeakPolarHBondContact OH-CD1 3.33Å; Y167-V209 HydrophobicContact CD1-CG1 4.08Å; Y167-V209 HydrophobicContact CG-CG1 4.21Å; Y167-P211 HydrophobicContact CD2-CB 4.14Å
168	R	94.5	Very high	83.2	Confident	109 Å²	109	65.2 Å²	65.2	41%	0.411	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	133.5	176.6	-62.2	-178.4	-172.4	-162.6	-0.7	109.8	Y130 E164 G170 H180	Y130-R168 HydrophobicContact CD1-CG 4.25Å; Y130-R168 HydrophobicContact CE1-CG 3.65Å; Y130-R168 HydrophobicContact CE2-CG 3.95Å; Y130-R168 PolarHBondContact OH-NE 2.99Å; Y130-R168 PolarHBondContact OH-NH2 3.13Å; E164-R168 IonicContact OE1-NH2 3.73Å; E164-R168 PolarHBondContact OE1-NH2 3.23Å; E164-R168 IonicContact OE2-NE 2.69Å; E164-R168 IonicContact OE2-NH2 3.89Å; R168-G170 PolarHBondContact O-N 3.05Å; R168-H180 PolarHBondContact O-ND1 2.97Å
169	L	94.3	Very high	85.4	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	29%	0.288	C	S	.	.	S	Bend	trans	-57.2	-33.6	177.8	-179.7	62.1	0	0	0	112.4	L61 F63 R124 I125 Y129 V131 Y167 L179 H180	L61-L169 HydrophobicContact CD1-CD1 3.93Å; L61-L169 HydrophobicContact CD1-CD2 3.52Å; L61-L169 HydrophobicContact CD1-CG 4.4Å; F63-L169 HydrophobicContact CE1-CD1 4.04Å; F63-L169 HydrophobicContact CZ-CD1 3.56Å; R124-L169 HydrophobicContact CB-CD2 3.57Å; I125-L169 HydrophobicContact CG1-CB 4.25Å; I125-L169 HydrophobicContact CG1-CD2 3.81Å; I125-L169 HydrophobicContact CG1-CG 3.77Å; Y129-L169 WeakPolarHBondContact O-CB 3.26Å; Y129-L169 PolarHBondContact O-N 3.22Å; V131-L169 HydrophobicContact CG2-CB 4.36Å; V131-L169 HydrophobicContact CG2-CD1 4.11Å; Y167-L169 PolarHBondContact O-N 3.39Å; L169-L179 HydrophobicContact CD1-CD1 3.84Å; L169-L179 HydrophobicContact CG-CD1 4.03Å; L169-L179 WeakPolarHBondContact O-CD1 3.21Å; L169-H180 PolarHBondContact O-N 2.83Å
170	G	93.4	Very high	87.3	Confident	5 Å²	5	54 Å²	54	5%	0.052	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	-164.4	-179.2	0	0	0	0	0	110.8	R168 Y178	R168-G170 PolarHBondContact O-N 3.05Å; G170-Y178 CarbonylContact C-O 3.54Å; G170-Y178 WeakPolarHBondContact CA-O 3.35Å
171	F	93.1	Very high	88.7	Confident	71 Å²	71	50.9 Å²	50.9	31%	0.311	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	162.4	173.4	61.5	-85.1	0	0	0	110.3	D173 Y178 H180 P237	F171-D173 HydrophobicContact CD2-CB 4.26Å; F171-D173 HydrophobicContact CE2-CB 4.25Å; F171-Y178 AromaticContact CD2-CD2 3.93Å; F171-Y178 HydrophobicContact CD2-CD2 3.93Å; F171-Y178 HydrophobicContact CD2-CG 4.46Å; F171-Y178 AromaticContact CE2-CD2 3.47Å; F171-Y178 HydrophobicContact CE2-CD2 3.47Å; F171-Y178 VanDerWaalsContact CE2-CD2 3.47Å; F171-Y178 HydrophobicContact CE2-CE2 4.29Å; F171-Y178 AromaticContact CE2-CG 3.85Å; F171-Y178 HydrophobicContact CE2-CG 3.85Å; F171-Y178 HydrophobicContact CZ-CD2 4.03Å; F171-Y178 AromaticContact CZ-CG 3.92Å; F171-Y178 HydrophobicContact CZ-CG 3.92Å; F171-Y178 PolarHBondContact N-O 3.23Å; F171-Y178 PolarHBondContact O-N 2.81Å; F171-H180 AromaticContact CD1-CE1 3.97Å; F171-H180 AromaticContact CD1-NE2 3.39Å; F171-H180 WeakPolarHBondContact CD1-NE2 3.11Å; F171-H180 AromaticContact CE1-NE2 3.72Å; F171-P237 HydrophobicContact CZ-CB 3.87Å; F171-P237 HydrophobicContact CZ-CG 4.38Å
172	T	91	Very high	89.9	Confident	81 Å²	81	48.8 Å²	48.8	50%	0.497	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.8	173.6	57.5	0	0	0	0	109.3	I125 K176 I177	I125-T172 HydrophobicContact CG2-CG2 4.26Å; T172-K176 VanDerWaalsContact CA-O 3.3Å; T172-K176 WeakPolarHBondContact CA-O 3.42Å; T172-I177 HydrophobicContact CG2-CG1 4.17Å
173	D	89.1	Confident	90.9	Very high	89 Å²	89	45.6 Å²	45.6	48%	0.476	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	134.2	175.9	-175.8	27.7	0	0	0	109.7	F171 N175 K176 Y178	F171-D173 HydrophobicContact CD2-CB 4.26Å; F171-D173 HydrophobicContact CE2-CB 4.25Å; D173-N175 VanDerWaalsContact C-N 3.3Å; D173-N175 PolarHBondContact O-N 2.96Å; D173-K176 PolarHBondContact N-O 3.41Å; D173-K176 WeakPolarHBondContact O-CA 3.19Å; D173-K176 WeakPolarHBondContact O-CB 3.49Å; D173-K176 PolarHBondContact O-N 3.46Å; D173-Y178 HydrophobicContact CB-CD2 4.28Å; D173-Y178 HydrophobicContact CB-CE2 3.93Å
174	V	85.5	Confident	91.6	Very high	124 Å²	124	44.6 Å²	44.6	75%	0.752	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	43.9	48.3	-178	-157.8	0	0	0	0	114.1	K176	V174-K176 PolarHBondContact O-N 3.14Å
175	N	82.8	Confident	92.2	Very high	173 Å²	173	43 Å²	43	93%	0.925	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.4	13.2	-176	-69.5	-15.3	0	0	0	116	D173	D173-N175 VanDerWaalsContact C-N 3.3Å; D173-N175 PolarHBondContact O-N 2.96Å
176	K	91.3	Very high	92.6	Very high	87 Å²	87	41.5 Å²	41.5	38%	0.378	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	151.8	172	-66.5	-179.5	163.7	-143.9	0	110.3	T172 D173 V174 Y178 E239	T172-K176 VanDerWaalsContact CA-O 3.3Å; T172-K176 WeakPolarHBondContact CA-O 3.42Å; D173-K176 PolarHBondContact N-O 3.41Å; D173-K176 WeakPolarHBondContact O-CA 3.19Å; D173-K176 WeakPolarHBondContact O-CB 3.49Å; D173-K176 PolarHBondContact O-N 3.46Å; V174-K176 PolarHBondContact O-N 3.14Å; K176-Y178 HydrophobicContact CB-CE2 3.65Å; K176-Y178 VanDerWaalsContact CD-OH 3.31Å; K176-Y178 WeakPolarHBondContact CD-OH 3.43Å; K176-E239 WeakPolarHBondContact CD-OE1 3.1Å; K176-E239 WeakPolarHBondContact CE-OE1 3.27Å; K176-E239 IonicContact NZ-OE1 3.76Å; K176-E239 PolarHBondContact NZ-OE1 3.1Å; K176-E239 IonicContact NZ-OE2 3.3Å; K176-E239 PolarHBondContact NZ-OE2 3.32Å
177	I	93.3	Very high	92.8	Very high	28 Å²	28	41.5 Å²	41.5	14%	0.144	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	124.6	-174.9	-54.8	173.8	0	0	0	107.9	A122 I125 T172 E239 I240	A122-I177 HydrophobicContact CB-CD1 3.66Å; A122-I177 HydrophobicContact CB-CG2 4.42Å; I125-I177 HydrophobicContact CB-CG2 3.73Å; I125-I177 HydrophobicContact CD1-CG2 3.7Å; I125-I177 HydrophobicContact CG1-CG2 4.32Å; I125-I177 HydrophobicContact CG2-CG2 3.59Å; T172-I177 HydrophobicContact CG2-CG1 4.17Å; I177-E239 CarbonylContact O-C 3.48Å; I177-E239 WeakPolarHBondContact O-CA 3.44Å; I177-I240 PolarHBondContact O-N 3.17Å
178	Y	94.3	Very high	92.9	Very high	27 Å²	27	42.3 Å²	42.3	11%	0.106	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.3	-176.2	-61.1	-75.2	0	0	0	110.6	G170 F171 D173 K176 P237 Q238 E239	G170-Y178 CarbonylContact C-O 3.54Å; G170-Y178 WeakPolarHBondContact CA-O 3.35Å; F171-Y178 AromaticContact CD2-CD2 3.93Å; F171-Y178 HydrophobicContact CD2-CD2 3.93Å; F171-Y178 HydrophobicContact CD2-CG 4.46Å; F171-Y178 AromaticContact CE2-CD2 3.47Å; F171-Y178 HydrophobicContact CE2-CD2 3.47Å; F171-Y178 VanDerWaalsContact CE2-CD2 3.47Å; F171-Y178 HydrophobicContact CE2-CE2 4.29Å; F171-Y178 AromaticContact CE2-CG 3.85Å; F171-Y178 HydrophobicContact CE2-CG 3.85Å; F171-Y178 HydrophobicContact CZ-CD2 4.03Å; F171-Y178 AromaticContact CZ-CG 3.92Å; F171-Y178 HydrophobicContact CZ-CG 3.92Å; F171-Y178 PolarHBondContact N-O 3.23Å; F171-Y178 PolarHBondContact O-N 2.81Å; D173-Y178 HydrophobicContact CB-CD2 4.28Å; D173-Y178 HydrophobicContact CB-CE2 3.93Å; K176-Y178 HydrophobicContact CB-CE2 3.65Å; K176-Y178 VanDerWaalsContact CD-OH 3.31Å; K176-Y178 WeakPolarHBondContact CD-OH 3.43Å; Y178-P237 HydrophobicContact CD1-CB 3.47Å; Y178-P237 VanDerWaalsContact CD1-CB 3.47Å; Y178-P237 HydrophobicContact CD1-CG 3.58Å; Y178-P237 HydrophobicContact CE1-CB 3.94Å; Y178-P237 HydrophobicContact CE1-CG 3.48Å; Y178-P237 VanDerWaalsContact CE1-CG 3.48Å; Y178-P237 HydrophobicContact CG-CB 3.91Å; Y178-P237 HydrophobicContact CG-CG 4.12Å; Y178-Q238 WeakPolarHBondContact CA-O 3.15Å; Y178-E239 HydrophobicContact CD1-CB 4.12Å; Y178-E239 HydrophobicContact CE1-CB 3.86Å; Y178-E239 HydrophobicContact CE1-CG 4.32Å
179	L	94.5	Very high	92.8	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	136.4	179.1	177.7	71.2	0	0	0	110.5	V121 I125 L169 N181 S213 Q238 I240 L248 F250	V121-L179 HydrophobicContact CG1-CD1 3.9Å; I125-L179 HydrophobicContact CD1-CB 4.15Å; I125-L179 HydrophobicContact CD1-CD1 3.99Å; L169-L179 HydrophobicContact CD1-CD1 3.84Å; L169-L179 HydrophobicContact CG-CD1 4.03Å; L169-L179 WeakPolarHBondContact O-CD1 3.21Å; L179-N181 HydrophobicContact CD2-CB 4.49Å; L179-N181 PolarHBondContact O-N 3.11Å; L179-S213 VanDerWaalsContact O-CB 3.23Å; L179-S213 WeakPolarHBondContact O-CB 3.36Å; L179-S213 PolarHBondContact O-OG 3.44Å; L179-Q238 PolarHBondContact N-O 3.27Å; L179-Q238 VanDerWaalsContact N-O 3.08Å; L179-I240 HydrophobicContact CB-CD1 4.04Å; L179-I240 HydrophobicContact CB-CG1 3.65Å; L179-I240 HydrophobicContact CD2-CD1 4.17Å; L179-L248 HydrophobicContact CD2-CD1 4.24Å; L179-L248 HydrophobicContact CD2-CD2 3.62Å; L179-F250 HydrophobicContact CD2-CE1 3.99Å; L179-F250 HydrophobicContact CD2-CZ 4.21Å
180	H	94.8	Very high	92.7	Very high	23 Å²	23	39.6 Å²	39.6	11%	0.106	21%	0.207	C	C	.	.			trans	-78	101.1	165.3	-65.9	140.2	0	0	0	109.7	R168 L169 F171 P211 Q212	R168-H180 PolarHBondContact O-ND1 2.97Å; L169-H180 PolarHBondContact O-N 2.83Å; F171-H180 AromaticContact CD1-CE1 3.97Å; F171-H180 AromaticContact CD1-NE2 3.39Å; F171-H180 WeakPolarHBondContact CD1-NE2 3.11Å; F171-H180 AromaticContact CE1-NE2 3.72Å; H180-P211 HydrophobicContact CB-CB 3.95Å; H180-Q212 CarbonylContact C-O 3.6Å; H180-Q212 WeakPolarHBondContact CA-O 3.07Å
181	N	92.7	Very high	92.6	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	22%	0.221	C	C	.	.			trans	-104.8	-11.5	-177.6	67.2	-40.6	0	0	0	113.6	L179 Q212 I214 L248 Y249 F250 T251	L179-N181 HydrophobicContact CD2-CB 4.49Å; L179-N181 PolarHBondContact O-N 3.11Å; N181-Q212 PolarHBondContact N-O 3.31Å; N181-Q212 VanDerWaalsContact N-O 3.14Å; N181-I214 PolarHBondContact ND2-O 2.96Å; N181-I214 PolarHBondContact OD1-N 3.48Å; N181-I214 PolarHBondContact OD1-O 3.35Å; N181-L248 HydrophobicContact CB-CD1 4.19Å; N181-Y249 WeakPolarHBondContact CB-O 3.39Å; N181-Y249 PolarHBondContact ND2-O 3.36Å; N181-F250 HydrophobicContact CB-CD1 4.36Å; N181-F250 WeakPolarHBondContact O-CA 3.26Å; N181-T251 PolarHBondContact O-N 3.47Å
182	H	93.3	Very high	92.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.7	170.5	-177.3	75.1	0	0	0	110.7	S184 Q212 I214 T251	H182-S184 PolarHBondContact CD2-OG 2.74Å; H182-S184 PolarHBondContact NE2-OG 3.47Å; H182-S184 VanDerWaalsContact NE2-OG 3.11Å; H182-Q212 HydrophobicContact CB-CB 4.18Å; H182-Q212 PolarHBondContact CD2-OE1 2.98Å; H182-Q212 VanDerWaalsContact CD2-OE1 3.26Å; H182-Q212 PolarHBondContact N-O 3.32Å; H182-Q212 PolarHBondContact O-N 2.7Å; H182-I214 HydrophobicContact CB-CD1 3.54Å; H182-I214 HydrophobicContact CB-CG1 4.03Å; H182-T251 WeakPolarHBondContact CA-O 3.26Å; H182-T251 PolarHBondContact ND1-OG1 3.23Å
183	L	95	Very high	91.1	Very high	10 Å²	10	45.8 Å²	45.8	5%	0.052	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	114.1	176.8	-57.6	178.9	0	0	0	110.2	F90 Y167 F185 V209 P211 T251 Y252 S253	F90-L183 HydrophobicContact CE1-CD1 4.42Å; F90-L183 HydrophobicContact CZ-CD1 3.93Å; Y167-L183 HydrophobicContact CD2-CD2 3.91Å; Y167-L183 HydrophobicContact CE1-CD1 3.97Å; Y167-L183 HydrophobicContact CE1-CD2 4.22Å; Y167-L183 HydrophobicContact CE2-CD1 4.38Å; Y167-L183 HydrophobicContact CE2-CD2 3.6Å; Y167-L183 HydrophobicContact CG-CD2 4.38Å; Y167-L183 WeakPolarHBondContact OH-CD1 3.33Å; L183-F185 HydrophobicContact CB-CE1 4.07Å; L183-F185 HydrophobicContact CB-CE2 4.41Å; L183-F185 HydrophobicContact CB-CZ 3.93Å; L183-F185 HydrophobicContact CD1-CE1 4.23Å; L183-F185 HydrophobicContact CD1-CZ 3.88Å; L183-V209 HydrophobicContact CB-CG2 4.09Å; L183-V209 HydrophobicContact CD2-CG2 4.19Å; L183-P211 HydrophobicContact CD2-CB 4.22Å; L183-T251 PolarHBondContact N-O 2.98Å; L183-Y252 CarbonylContact O-C 3.54Å; L183-Y252 WeakPolarHBondContact O-CA 3.37Å; L183-Y252 WeakPolarHBondContact O-CB 3.39Å; L183-S253 PolarHBondContact O-N 3Å
184	S	95	Very high	90	Very high	12 Å²	12	45.1 Å²	45.1	8%	0.084	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	105.3	172.2	-49.3	0	0	0	0	109.6	H182 V209 I210 S253	H182-S184 PolarHBondContact CD2-OG 2.74Å; H182-S184 PolarHBondContact NE2-OG 3.47Å; H182-S184 VanDerWaalsContact NE2-OG 3.11Å; S184-V209 WeakPolarHBondContact O-CA 3.22Å; S184-I210 PolarHBondContact N-O 3.01Å; S184-I210 PolarHBondContact O-N 3.48Å; S184-S253 VanDerWaalsContact CA-OG 3.24Å; S184-S253 WeakPolarHBondContact CA-OG 3.47Å; S184-S253 WeakPolarHBondContact CB-OG 3.27Å; S184-S253 PolarHBondContact OG-OG 3.16Å
185	F	96.5	Very high	89.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	129.4	176.9	-60.8	-53.9	0	0	0	110.3	F90 L133 L183 L187 F207 V209 Y252 S253 V254 H255	F90-F185 AromaticContact CD1-CE2 3.64Å; F90-F185 HydrophobicContact CD1-CE2 3.64Å; F90-F185 HydrophobicContact CD1-CZ 4.13Å; F90-F185 HydrophobicContact CD2-CE2 4.45Å; F90-F185 HydrophobicContact CD2-CZ 4.37Å; F90-F185 AromaticContact CE1-CE2 3.68Å; F90-F185 HydrophobicContact CE1-CE2 3.68Å; F90-F185 AromaticContact CE1-CZ 3.81Å; F90-F185 HydrophobicContact CE1-CZ 3.81Å; F90-F185 HydrophobicContact CE2-CZ 4.15Å; F90-F185 HydrophobicContact CG-CE2 4.07Å; F90-F185 HydrophobicContact CG-CZ 4.42Å; F90-F185 HydrophobicContact CZ-CE2 4.22Å; F90-F185 AromaticContact CZ-CZ 3.87Å; F90-F185 HydrophobicContact CZ-CZ 3.87Å; L133-F185 HydrophobicContact CD1-CE1 3.91Å; L133-F185 HydrophobicContact CD1-CZ 3.99Å; L183-F185 HydrophobicContact CB-CE1 4.07Å; L183-F185 HydrophobicContact CB-CE2 4.41Å; L183-F185 HydrophobicContact CB-CZ 3.93Å; L183-F185 HydrophobicContact CD1-CE1 4.23Å; L183-F185 HydrophobicContact CD1-CZ 3.88Å; F185-L187 HydrophobicContact CB-CD1 3.93Å; F185-F207 HydrophobicContact CB-CE2 4.12Å; F185-F207 AromaticContact CD1-CE2 3.5Å; F185-F207 HydrophobicContact CD1-CE2 3.5Å; F185-F207 VanDerWaalsContact CD1-CE2 3.5Å; F185-F207 AromaticContact CD1-CZ 3.83Å; F185-F207 HydrophobicContact CD1-CZ 3.83Å; F185-F207 HydrophobicContact CE1-CE2 4.15Å; F185-F207 AromaticContact CE1-CZ 4Å; F185-F207 HydrophobicContact CE1-CZ 4Å; F185-F207 AromaticContact CG-CE2 3.97Å; F185-F207 HydrophobicContact CG-CE2 3.97Å; F185-V209 HydrophobicContact CD1-CB 4.16Å; F185-V209 HydrophobicContact CD1-CG2 3.87Å; F185-V209 HydrophobicContact CE1-CB 4.43Å; F185-V209 HydrophobicContact CE1-CG2 3.9Å; F185-Y252 HydrophobicContact CD2-CD2 4.02Å; F185-Y252 HydrophobicContact CE2-CD2 4.03Å; F185-Y252 HydrophobicContact CE2-CG 4.31Å; F185-S253 PolarHBondContact N-O 3.43Å; F185-V254 HydrophobicContact CD2-CG2 4.49Å; F185-V254 WeakPolarHBondContact O-CA 3.17Å; F185-H255 PolarHBondContact O-N 3.39Å
186	I	95.5	Very high	88.1	Confident	21 Å²	21	48.3 Å²	48.3	11%	0.108	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	107.6	172.7	-50.9	172.3	0	0	0	106.6	Y188 E208 I210 H255 E257	I186-Y188 HydrophobicContact CB-CE2 4.45Å; I186-Y188 HydrophobicContact CG2-CD2 4.24Å; I186-Y188 HydrophobicContact CG2-CE2 3.55Å; I186-E208 HydrophobicContact CB-CB 4.25Å; I186-E208 PolarHBondContact N-O 3.04Å; I186-E208 PolarHBondContact O-N 3.48Å; I186-I210 HydrophobicContact CD1-CD1 3.64Å; I186-I210 HydrophobicContact CD1-CG1 4.09Å; I186-H255 WeakPolarHBondContact CA-O 3.27Å; I186-H255 HydrophobicContact CG1-CB 4.44Å; I186-E257 HydrophobicContact CG2-CG 4.42Å
187	L	95.3	Very high	86.7	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.8	177.8	-65.7	102.2	0	0	0	109.4	V40 V92 A135 F185 V204 R206 F207 V254 H255 W256 E257	V40-L187 HydrophobicContact CG1-CD2 4.37Å; V92-L187 HydrophobicContact CG1-CD1 4.14Å; A135-L187 HydrophobicContact CB-CD2 4.29Å; F185-L187 HydrophobicContact CB-CD1 3.93Å; L187-V204 HydrophobicContact CD2-CG1 4.35Å; L187-R206 WeakPolarHBondContact CA-O 3.4Å; L187-F207 HydrophobicContact CD1-CD2 4.48Å; L187-F207 HydrophobicContact CD2-CD2 4.09Å; L187-F207 HydrophobicContact CG-CD2 3.89Å; L187-F207 HydrophobicContact CG-CE2 4.36Å; L187-V254 HydrophobicContact CD1-CG1 3.95Å; L187-H255 PolarHBondContact N-O 2.83Å; L187-W256 HydrophobicContact CB-CD2 3.9Å; L187-W256 HydrophobicContact CB-CE3 3.37Å; L187-W256 HydrophobicContact CB-CH2 3.6Å; L187-W256 HydrophobicContact CB-CZ2 4.08Å; L187-W256 HydrophobicContact CB-CZ3 3.23Å; L187-W256 HydrophobicContact CD1-CH2 4.49Å; L187-W256 HydrophobicContact CD1-CZ2 4.28Å; L187-W256 HydrophobicContact CD2-CH2 3.68Å; L187-W256 HydrophobicContact CD2-CZ2 4.15Å; L187-W256 HydrophobicContact CD2-CZ3 4.14Å; L187-W256 HydrophobicContact CG-CH2 4.11Å; L187-W256 HydrophobicContact CG-CZ2 4.4Å; L187-W256 HydrophobicContact CG-CZ3 4.22Å; L187-W256 VanDerWaalsContact O-CA 3.3Å; L187-W256 WeakPolarHBondContact O-CA 3.38Å; L187-E257 PolarHBondContact O-N 3.49Å
188	Y	95	Very high	85.5	Confident	20 Å²	20	55.7 Å²	55.7	8%	0.078	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.5	175.3	-64.7	-106.1	0	0	0	110.1	I186 V205 R206 E208 E257	I186-Y188 HydrophobicContact CB-CE2 4.45Å; I186-Y188 HydrophobicContact CG2-CD2 4.24Å; I186-Y188 HydrophobicContact CG2-CE2 3.55Å; Y188-V205 PolarHBondContact O-N 3.28Å; Y188-R206 HydrophobicContact CD2-CB 3.66Å; Y188-R206 HydrophobicContact CD2-CG 4.12Å; Y188-R206 HydrophobicContact CG-CB 3.92Å; Y188-R206 PolarHBondContact N-O 3.24Å; Y188-R206 PolarHBondContact O-N 3.41Å; Y188-E208 HydrophobicContact CE2-CG 4.25Å; Y188-E257 CarbonylContact C-O 3.58Å; Y188-E257 WeakPolarHBondContact CA-O 3.49Å; Y188-E257 HydrophobicContact CD1-CB 3.56Å; Y188-E257 HydrophobicContact CE1-CB 3.46Å; Y188-E257 VanDerWaalsContact CE1-CB 3.46Å; Y188-E257 HydrophobicContact CE1-CG 4.2Å; Y188-E257 WeakPolarHBondContact CE1-OE2 3.37Å; Y188-E257 HydrophobicContact CG-CB 4.27Å; Y188-E257 PolarHBondContact OH-OE2 3.29Å
189	Y	93.8	Very high	84.3	Confident	23 Å²	23	61.6 Å²	61.6	9%	0.09	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147.9	175.3	69.7	-96.6	0	0	0	111.8	M94 N95 Y202 R203 W256 E257 E258 S259	M94-Y189 VanDerWaalsContact CE-CB 3.43Å; M94-Y189 HydrophobicContact CE-CG 4.13Å; N95-Y189 HydrophobicContact CB-CE1 4.45Å; Y189-Y202 AromaticContact CD2-CD1 3.55Å; Y189-Y202 HydrophobicContact CD2-CD1 3.55Å; Y189-Y202 HydrophobicContact CD2-CE1 4.27Å; Y189-Y202 HydrophobicContact CD2-CG 4.44Å; Y189-Y202 AromaticContact CE2-CD1 3.66Å; Y189-Y202 HydrophobicContact CE2-CD1 3.66Å; Y189-Y202 AromaticContact CE2-CE1 3.9Å; Y189-Y202 HydrophobicContact CE2-CE1 3.9Å; Y189-Y202 HydrophobicContact CG-CD1 4.32Å; Y189-R203 CarbonylContact C-O 3.52Å; Y189-R203 WeakPolarHBondContact CA-O 3.28Å; Y189-W256 HydrophobicContact CD1-CB 4.33Å; Y189-W256 AromaticContact CD1-CE3 3.82Å; Y189-W256 HydrophobicContact CD1-CE3 3.82Å; Y189-W256 HydrophobicContact CE1-CB 4.2Å; Y189-E257 PolarHBondContact N-O 3.18Å; Y189-E258 HydrophobicContact CD2-CG 4.44Å; Y189-E258 HydrophobicContact CE1-CB 4.45Å; Y189-E258 HydrophobicContact CE2-CB 3.93Å; Y189-E258 HydrophobicContact CE2-CG 3.8Å; Y189-S259 PolarHBondContact O-N 2.91Å
190	H	92.7	Very high	83.6	Confident	32 Å²	32	64.5 Å²	64.5	15%	0.148	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	129.2	166.5	-172.2	67.2	0	0	0	108.7	R203 V205 S259 I261	H190-R203 PolarHBondContact N-O 2.59Å; H190-R203 PolarHBondContact O-N 3.07Å; H190-V205 HydrophobicContact CB-CG1 3.78Å; H190-S259 PolarHBondContact ND1-O 3.33Å; H190-I261 WeakPolarHBondContact CB-O 3.31Å; H190-I261 PolarHBondContact ND1-O 2.87Å
191	R	89.8	Confident	83.2	Confident	91 Å²	91	63.9 Å²	63.9	34%	0.343	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	124.3	173.7	-174.7	178.6	-179.4	173.9	-3.6	108.7	H200 E258	R191-H200 HydrophobicContact CG-CB 4.18Å; R191-H200 PolarHBondContact NE-ND1 2.97Å; R191-H200 PolarHBondContact NH2-CD2 2.87Å; R191-H200 PolarHBondContact NH2-CE1 3.44Å; R191-H200 PolarHBondContact NH2-NE2 3.22Å; R191-E258 WeakPolarHBondContact CB-OE1 3.15Å
192	E	83.2	Confident	83.1	Confident	51 Å²	51	65.1 Å²	65.1	24%	0.238	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.1	170.9	-63	-148	138.9	0	0	110.3	M194 T201 R203	E192-M194 PolarHBondContact O-N 3.46Å; E192-T201 PolarHBondContact N-O 2.84Å; E192-R203 VanDerWaalsContact CD-NH1 3.3Å; E192-R203 IonicContact OE1-CZ 2.74Å; E192-R203 IonicContact OE1-NE 3.53Å; E192-R203 PolarHBondContact OE1-NE 3.28Å; E192-R203 IonicContact OE1-NH1 3.36Å; E192-R203 PolarHBondContact OE1-NH1 2.95Å; E192-R203 IonicContact OE1-NH2 3.08Å; E192-R203 PolarHBondContact OE1-NH2 3.4Å; E192-R203 IonicContact OE2-CZ 3.11Å; E192-R203 IonicContact OE2-NE 3.32Å; E192-R203 PolarHBondContact OE2-NE 3.28Å; E192-R203 IonicContact OE2-NH1 3.76Å; E192-R203 PolarHBondContact OE2-NH1 3.31Å; E192-R203 IonicContact OE2-NH2 3.65Å; E192-R203 PolarHBondContact OE2-NH2 3.22Å
193	D	69.5	Low	83.1	Confident	144 Å²	144	66.9 Å²	66.9	77%	0.77	32%	0.318	S	S	*	.			trans	-72.7	114	169.5	-65	-33	0	0	0	108.5
194	M	66.7	Low	82.9	Confident	76 Å²	76	66.4 Å²	66.4	37%	0.374	32%	0.315	S	S	.	.			trans	-105.4	159.6	171.7	-69.5	-138.1	58.4	0	0	109.7	E192 Q198	E192-M194 PolarHBondContact O-N 3.46Å; M194-Q198 HydrophobicContact CB-CB 4.01Å
195	E	67.8	Low	82.8	Confident	160 Å²	160	65.8 Å²	65.8	75%	0.748	31%	0.311	S	S	*	.			trans	-49.4	149.7	176.1	-65.8	177	171.9	0	0	111.1	D197 Q198	E195-D197 PolarHBondContact O-N 3.12Å; E195-Q198 PolarHBondContact O-N 3.1Å
196	E	60	Low	82.6	Confident	204 Å²	204	67.6 Å²	67.6	95%	0.953	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-2.5	-163.1	-69.8	-179.5	155.9	0	0	117.4
197	D	62.3	Low	82.5	Confident	165 Å²	165	66.6 Å²	66.6	88%	0.882	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	6.5	-178.4	-71.1	-37.4	0	0	0	115.2	E195	E195-D197 PolarHBondContact O-N 3.12Å
198	Q	67.2	Low	82.5	Confident	105 Å²	105	66.9 Å²	66.9	49%	0.491	31%	0.314	S	S	.	.	S	Bend	trans	-114	140.3	-179.7	-63.8	-173.2	25.1	0	0	112.9	M194 E195 H200	M194-Q198 HydrophobicContact CB-CB 4.01Å; E195-Q198 PolarHBondContact O-N 3.1Å; Q198-H200 PolarHBondContact O-N 3.45Å
199	E	70.8	Confident	82.5	Confident	150 Å²	150	66 Å²	66	70%	0.701	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-60.2	137	176	-73.7	-174.7	175.4	0	0	111.1	H35 T201	H35-E199 IonicContact ND1-OE2 3.82Å; E199-T201 PolarHBondContact O-N 3.43Å
200	H	78.4	Confident	82.5	Confident	64 Å²	64	68.8 Å²	68.8	30%	0.296	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-60.1	130.3	176.8	-64.8	-74.1	0	0	0	110.7	R191 Q198	R191-H200 HydrophobicContact CG-CB 4.18Å; R191-H200 PolarHBondContact NE-ND1 2.97Å; R191-H200 PolarHBondContact NH2-CD2 2.87Å; R191-H200 PolarHBondContact NH2-CE1 3.44Å; R191-H200 PolarHBondContact NH2-NE2 3.22Å; Q198-H200 PolarHBondContact O-N 3.45Å
201	T	87.6	Confident	82.6	Confident	9 Å²	9	68.5 Å²	68.5	6%	0.055	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	144.1	170.2	63.3	0	0	0	0	109.5	N33 E192 E199	N33-T201 HydrophobicContact CB-CG2 4.12Å; E192-T201 PolarHBondContact N-O 2.84Å; E199-T201 PolarHBondContact O-N 3.43Å
202	Y	90.3	Very high	82.7	Confident	30 Å²	30	67.8 Å²	67.8	12%	0.118	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.3	-179.3	-52.3	-82.3	0	0	0	109.8	F34 Q36 M94 Y189	F34-Y202 PolarHBondContact N-O 3.43Å; F34-Y202 PolarHBondContact O-N 2.78Å; Q36-Y202 HydrophobicContact CB-CE2 4.17Å; Q36-Y202 PolarHBondContact OE1-OH 3.05Å; M94-Y202 HydrophobicContact CE-CG 4.19Å; M94-Y202 HydrophobicContact CG-CD2 4.3Å; M94-Y202 HydrophobicContact CG-CG 4.46Å; Y189-Y202 AromaticContact CD2-CD1 3.55Å; Y189-Y202 HydrophobicContact CD2-CD1 3.55Å; Y189-Y202 HydrophobicContact CD2-CE1 4.27Å; Y189-Y202 HydrophobicContact CD2-CG 4.44Å; Y189-Y202 AromaticContact CE2-CD1 3.66Å; Y189-Y202 HydrophobicContact CE2-CD1 3.66Å; Y189-Y202 AromaticContact CE2-CE1 3.9Å; Y189-Y202 HydrophobicContact CE2-CE1 3.9Å; Y189-Y202 HydrophobicContact CG-CD1 4.32Å
203	R	91.9	Very high	83.1	Confident	37 Å²	37	66 Å²	66	14%	0.14	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	129.1	176.8	-68.3	-173.9	175.2	169.8	3.9	110.1	N33 Y189 H190 E192 V205 W263	N33-R203 VanDerWaalsContact OD1-CZ 3.28Å; N33-R203 PolarHBondContact OD1-NE 2.94Å; N33-R203 PolarHBondContact OD1-NH2 3.44Å; Y189-R203 CarbonylContact C-O 3.52Å; Y189-R203 WeakPolarHBondContact CA-O 3.28Å; H190-R203 PolarHBondContact N-O 2.59Å; H190-R203 PolarHBondContact O-N 3.07Å; E192-R203 VanDerWaalsContact CD-NH1 3.3Å; E192-R203 IonicContact OE1-CZ 2.74Å; E192-R203 IonicContact OE1-NE 3.53Å; E192-R203 PolarHBondContact OE1-NE 3.28Å; E192-R203 IonicContact OE1-NH1 3.36Å; E192-R203 PolarHBondContact OE1-NH1 2.95Å; E192-R203 IonicContact OE1-NH2 3.08Å; E192-R203 PolarHBondContact OE1-NH2 3.4Å; E192-R203 IonicContact OE2-CZ 3.11Å; E192-R203 IonicContact OE2-NE 3.32Å; E192-R203 PolarHBondContact OE2-NE 3.28Å; E192-R203 IonicContact OE2-NH1 3.76Å; E192-R203 PolarHBondContact OE2-NH1 3.31Å; E192-R203 IonicContact OE2-NH2 3.65Å; E192-R203 PolarHBondContact OE2-NH2 3.22Å; R203-V205 PolarHBondContact O-N 2.87Å; R203-W263 HydrophobicContact CB-CB 4.34Å
204	V	92.6	Very high	84.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	124	176.9	-174	0	0	0	0	109.5	F34 V40 M94 D136 L138 L187 W256 R266	F34-V204 HydrophobicContact CD2-CG2 4.2Å; F34-V204 HydrophobicContact CE2-CG2 4.03Å; V40-V204 HydrophobicContact CG1-CG2 4.42Å; M94-V204 HydrophobicContact CE-CG2 4.02Å; M94-V204 HydrophobicContact SD-CG2 4.09Å; D136-V204 HydrophobicContact CB-CB 4.23Å; L138-V204 HydrophobicContact CD1-CG1 4.19Å; L187-V204 HydrophobicContact CD2-CG1 4.35Å; V204-W256 HydrophobicContact CG2-CH2 4.1Å; V204-W256 HydrophobicContact CG2-CZ3 4.23Å; V204-R266 PolarHBondContact O-NH1 2.73Å
205	V	92.3	Very high	85.2	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	-15.2	-175.6	-62.3	0	0	0	0	113.7	L138 Y188 H190 R203 I261 R266	L138-V205 VanDerWaalsContact CD1-C 3.47Å; Y188-V205 PolarHBondContact O-N 3.28Å; H190-V205 HydrophobicContact CB-CG1 3.78Å; R203-V205 PolarHBondContact O-N 2.87Å; V205-I261 WeakPolarHBondContact CG1-O 3.41Å; V205-R266 HydrophobicContact CB-CB 3.98Å; V205-R266 HydrophobicContact CG1-CB 4.26Å; V205-R266 WeakPolarHBondContact O-CB 3.39Å
206	R	92.2	Very high	86	Confident	38 Å²	38	54.7 Å²	54.7	14%	0.143	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	149.9	173.8	-158.2	-174	-65.1	-178.9	-9.5	111.3	L187 Y188 E208 I261 T269 Y270	L187-R206 WeakPolarHBondContact CA-O 3.4Å; Y188-R206 HydrophobicContact CD2-CB 3.66Å; Y188-R206 HydrophobicContact CD2-CG 4.12Å; Y188-R206 HydrophobicContact CG-CB 3.92Å; Y188-R206 PolarHBondContact N-O 3.24Å; Y188-R206 PolarHBondContact O-N 3.41Å; R206-E208 WeakPolarHBondContact CD-OE1 3.38Å; R206-E208 HydrophobicContact CG-CG 4.07Å; R206-E208 IonicContact CZ-OE1 3.41Å; R206-E208 IonicContact NE-OE1 2.95Å; R206-E208 IonicContact NH1-OE1 3.38Å; R206-E208 PolarHBondContact NH1-OE1 2.89Å; R206-I261 VanDerWaalsContact NH2-CD1 3.29Å; R206-T269 PolarHBondContact NH2-OG1 3.14Å; R206-Y270 HydrophobicContact CG-CE2 4.32Å
207	F	94.2	Very high	87.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	103.6	177.6	-178	-152.8	0	0	0	109.6	I42 L133 A135 L138 V140 A141 F185 L187 Y270	I42-F207 HydrophobicContact CD1-CE1 4.33Å; I42-F207 HydrophobicContact CD1-CE2 4.31Å; I42-F207 HydrophobicContact CD1-CZ 3.88Å; I42-F207 HydrophobicContact CG2-CZ 4.28Å; L133-F207 HydrophobicContact CB-CE1 4.18Å; A135-F207 HydrophobicContact CB-CB 4.48Å; A135-F207 HydrophobicContact CB-CD1 3.55Å; A135-F207 HydrophobicContact CB-CE1 3.78Å; A135-F207 HydrophobicContact CB-CG 3.97Å; A135-F207 HydrophobicContact CB-CZ 4.37Å; L138-F207 HydrophobicContact CB-CB 4.42Å; V140-F207 HydrophobicContact CB-CD1 3.71Å; V140-F207 HydrophobicContact CB-CE1 3.51Å; V140-F207 HydrophobicContact CB-CG 4.38Å; V140-F207 HydrophobicContact CB-CZ 4.03Å; V140-F207 HydrophobicContact CG2-CD1 3.99Å; V140-F207 HydrophobicContact CG2-CD2 4.24Å; V140-F207 HydrophobicContact CG2-CE1 3.72Å; V140-F207 HydrophobicContact CG2-CE2 3.99Å; V140-F207 HydrophobicContact CG2-CG 4.25Å; V140-F207 HydrophobicContact CG2-CZ 3.72Å; A141-F207 PolarHBondContact N-O 3.42Å; A141-F207 VanDerWaalsContact N-O 3.11Å; F185-F207 HydrophobicContact CB-CE2 4.12Å; F185-F207 AromaticContact CD1-CE2 3.5Å; F185-F207 HydrophobicContact CD1-CE2 3.5Å; F185-F207 VanDerWaalsContact CD1-CE2 3.5Å; F185-F207 AromaticContact CD1-CZ 3.83Å; F185-F207 HydrophobicContact CD1-CZ 3.83Å; F185-F207 HydrophobicContact CE1-CE2 4.15Å; F185-F207 AromaticContact CE1-CZ 4Å; F185-F207 HydrophobicContact CE1-CZ 4Å; F185-F207 AromaticContact CG-CE2 3.97Å; F185-F207 HydrophobicContact CG-CE2 3.97Å; L187-F207 HydrophobicContact CD1-CD2 4.48Å; L187-F207 HydrophobicContact CD2-CD2 4.09Å; L187-F207 HydrophobicContact CG-CD2 3.89Å; L187-F207 HydrophobicContact CG-CE2 4.36Å; F207-Y270 WeakPolarHBondContact CA-OH 3.49Å; F207-Y270 PolarHBondContact N-OH 2.85Å; F207-Y270 PolarHBondContact O-OH 3.47Å; F207-Y270 VanDerWaalsContact O-OH 3.07Å
208	E	94.5	Very high	88	Confident	5 Å²	5	46.4 Å²	46.4	2%	0.023	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	155.2	177.5	-56.7	-176.9	-162.9	0	0	110.3	A141 F163 I186 Y188 R206	A141-E208 CarbonylContact O-C 3.59Å; A141-E208 VanDerWaalsContact O-CA 3.27Å; A141-E208 WeakPolarHBondContact O-CA 3.45Å; F163-E208 HydrophobicContact CE1-CG 4.28Å; I186-E208 HydrophobicContact CB-CB 4.25Å; I186-E208 PolarHBondContact N-O 3.04Å; I186-E208 PolarHBondContact O-N 3.48Å; Y188-E208 HydrophobicContact CE2-CG 4.25Å; R206-E208 WeakPolarHBondContact CD-OE1 3.38Å; R206-E208 HydrophobicContact CG-CG 4.07Å; R206-E208 IonicContact CZ-OE1 3.41Å; R206-E208 IonicContact NE-OE1 2.95Å; R206-E208 IonicContact NH1-OE1 3.38Å; R206-E208 PolarHBondContact NH1-OE1 2.89Å
209	V	94.9	Very high	88.7	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	137.8	172.5	66.5	0	0	0	0	110.7	V140 A141 Y167 L183 S184 F185	V140-V209 HydrophobicContact CG2-CB 3.53Å; V140-V209 HydrophobicContact CG2-CG1 3.42Å; V140-V209 VanDerWaalsContact CG2-CG1 3.42Å; A141-V209 PolarHBondContact O-N 3.36Å; Y167-V209 HydrophobicContact CD1-CG1 4.08Å; Y167-V209 HydrophobicContact CG-CG1 4.21Å; L183-V209 HydrophobicContact CB-CG2 4.09Å; L183-V209 HydrophobicContact CD2-CG2 4.19Å; S184-V209 WeakPolarHBondContact O-CA 3.22Å; F185-V209 HydrophobicContact CD1-CB 4.16Å; F185-V209 HydrophobicContact CD1-CG2 3.87Å; F185-V209 HydrophobicContact CE1-CB 4.43Å; F185-V209 HydrophobicContact CE1-CG2 3.9Å
210	I	94.5	Very high	89.1	Confident	82 Å²	82	42.2 Å²	42.2	42%	0.421	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	103	167.8	-55.8	178.7	0	0	0	106.9	S184 I186 Q212	S184-I210 PolarHBondContact N-O 3.01Å; S184-I210 PolarHBondContact O-N 3.48Å; I186-I210 HydrophobicContact CD1-CD1 3.64Å; I186-I210 HydrophobicContact CD1-CG1 4.09Å; I210-Q212 HydrophobicContact CG2-CG 4.36Å
211	P	93.8	Very high	89	Confident	26 Å²	26	40.9 Å²	40.9	17%	0.169	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	135.9	176.8	32.5	-35.1	0	0	0	110.1	Y167 H180 L183	Y167-P211 HydrophobicContact CD2-CB 4.14Å; H180-P211 HydrophobicContact CB-CB 3.95Å; L183-P211 HydrophobicContact CD2-CB 4.22Å
212	Q	92.1	Very high	88.3	Confident	77 Å²	77	44.8 Å²	44.8	36%	0.36	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.2	178.8	-65.5	-176.8	-26.7	0	0	110.7	H180 N181 H182 I210 I214	H180-Q212 CarbonylContact C-O 3.6Å; H180-Q212 WeakPolarHBondContact CA-O 3.07Å; N181-Q212 PolarHBondContact N-O 3.31Å; N181-Q212 VanDerWaalsContact N-O 3.14Å; H182-Q212 HydrophobicContact CB-CB 4.18Å; H182-Q212 PolarHBondContact CD2-OE1 2.98Å; H182-Q212 VanDerWaalsContact CD2-OE1 3.26Å; H182-Q212 PolarHBondContact N-O 3.32Å; H182-Q212 PolarHBondContact O-N 2.7Å; I210-Q212 HydrophobicContact CG2-CG 4.36Å; Q212-I214 HydrophobicContact CB-CG1 4.32Å
213	S	92.5	Very high	87.2	Confident	12 Å²	12	51.2 Å²	51.2	8%	0.084	25%	0.247	C	C	.	.			trans	-108.6	114.6	173.4	-168.5	0	0	0	0	108.6	L179 Q238	L179-S213 VanDerWaalsContact O-CB 3.23Å; L179-S213 WeakPolarHBondContact O-CB 3.36Å; L179-S213 PolarHBondContact O-OG 3.44Å; S213-Q238 PolarHBondContact OG-N 3.3Å
214	I	90.1	Very high	86.1	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.015	28%	0.277	C	S	.	.			trans	-126	118	-174.7	-53.7	-179.7	0	0	0	108.2	N181 H182 Q212 D218 L219 L229 P230	N181-I214 PolarHBondContact ND2-O 2.96Å; N181-I214 PolarHBondContact OD1-N 3.48Å; N181-I214 PolarHBondContact OD1-O 3.35Å; H182-I214 HydrophobicContact CB-CD1 3.54Å; H182-I214 HydrophobicContact CB-CG1 4.03Å; Q212-I214 HydrophobicContact CB-CG1 4.32Å; I214-D218 HydrophobicContact CG2-CB 4.24Å; I214-L219 HydrophobicContact CG2-CD1 4.38Å; I214-L229 HydrophobicContact CD1-CD2 3.42Å; I214-L229 VanDerWaalsContact CD1-CD2 3.42Å; I214-P230 HydrophobicContact CG2-CG 4.25Å
215	R	89.3	Confident	85.3	Confident	99 Å²	99	58.9 Å²	58.9	37%	0.374	28%	0.284	S	S	.	.			trans	-60.3	144.4	177.2	-175.2	174.9	180	171.4	-5.5	111.7	E217 D218 S236	R215-E217 IonicContact CZ-OE1 3.54Å; R215-E217 VanDerWaalsContact CZ-OE1 3.27Å; R215-E217 IonicContact CZ-OE2 3.83Å; R215-E217 IonicContact NE-OE1 2.65Å; R215-E217 PolarHBondContact NE-OE1 2.8Å; R215-E217 VanDerWaalsContact NE-OE1 3.08Å; R215-E217 IonicContact NE-OE2 3.46Å; R215-E217 IonicContact NH2-OE1 3.76Å; R215-E217 PolarHBondContact NH2-OE1 3.31Å; R215-E217 IonicContact NH2-OE2 3.8Å; R215-E217 PolarHBondContact O-N 2.83Å; R215-E217 VanDerWaalsContact O-N 3.16Å; R215-D218 PolarHBondContact O-N 3.33Å; R215-S236 WeakPolarHBondContact CB-O 3.45Å; R215-S236 WeakPolarHBondContact CB-OG 3.37Å; R215-S236 WeakPolarHBondContact CD-OG 3.19Å; R215-S236 PolarHBondContact N-O 3.18Å
216	L	85.5	Confident	84.9	Confident	42 Å²	42	61.3 Å²	61.3	22%	0.22	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-47.1	-43.6	178.3	-179.6	65.4	0	0	0	114	P110 D218 L219 Q247 Y249	P110-L216 HydrophobicContact CB-CD1 3.87Å; P110-L216 HydrophobicContact CB-CD2 4.42Å; L216-D218 VanDerWaalsContact C-N 3.29Å; L216-D218 PolarHBondContact O-N 3.47Å; L216-L219 PolarHBondContact O-N 2.94Å; L216-Q247 HydrophobicContact CD2-CB 3.94Å; L216-Y249 HydrophobicContact CD1-CD2 3.22Å; L216-Y249 HydrophobicContact CD1-CE2 3.32Å; L216-Y249 HydrophobicContact CD1-CG 4.15Å
217	E	82	Confident	84.5	Confident	137 Å²	137	60 Å²	60	64%	0.64	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-67	-28.5	-176.5	-67.3	164.7	-139.9	0	0	113.2	R215 L219	R215-E217 IonicContact CZ-OE1 3.54Å; R215-E217 VanDerWaalsContact CZ-OE1 3.27Å; R215-E217 IonicContact CZ-OE2 3.83Å; R215-E217 IonicContact NE-OE1 2.65Å; R215-E217 PolarHBondContact NE-OE1 2.8Å; R215-E217 VanDerWaalsContact NE-OE1 3.08Å; R215-E217 IonicContact NE-OE2 3.46Å; R215-E217 IonicContact NH2-OE1 3.76Å; R215-E217 PolarHBondContact NH2-OE1 3.31Å; R215-E217 IonicContact NH2-OE2 3.8Å; R215-E217 PolarHBondContact O-N 2.83Å; R215-E217 VanDerWaalsContact O-N 3.16Å; E217-L219 VanDerWaalsContact C-N 3.32Å
218	D	82.4	Confident	84	Confident	57 Å²	57	64 Å²	64	31%	0.305	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-83.2	-13.7	-178.2	-63.3	-29.7	0	0	0	111.6	I214 R215 L216 P230 S236	I214-D218 HydrophobicContact CG2-CB 4.24Å; R215-D218 PolarHBondContact O-N 3.33Å; L216-D218 VanDerWaalsContact C-N 3.29Å; L216-D218 PolarHBondContact O-N 3.47Å; D218-P230 HydrophobicContact CB-CB 4.49Å; D218-P230 HydrophobicContact CB-CG 4.28Å; D218-S236 PolarHBondContact OD2-N 3.31Å; D218-S236 PolarHBondContact OD2-OG 3.13Å
219	L	81.8	Confident	83.3	Confident	10 Å²	10	66.5 Å²	66.5	5%	0.052	34%	0.335	C	S	.	.			trans	-100.1	111.8	-178	-163.2	102.6	0	0	0	111.4	I214 L216 E217 C227 L229 Y249 T251	I214-L219 HydrophobicContact CG2-CD1 4.38Å; L216-L219 PolarHBondContact O-N 2.94Å; E217-L219 VanDerWaalsContact C-N 3.32Å; L219-C227 HydrophobicContact CD1-CB 4.33Å; L219-C227 HydrophobicContact CD2-CB 4.19Å; L219-C227 HydrophobicContact CG-CB 4.18Å; L219-L229 HydrophobicContact CD1-CD2 4.23Å; L219-Y249 HydrophobicContact CD2-CD2 3.65Å; L219-Y249 HydrophobicContact CD2-CG 3.87Å; L219-T251 HydrophobicContact CD1-CG2 3.96Å; L219-T251 HydrophobicContact CD2-CG2 3.47Å; L219-T251 VanDerWaalsContact CD2-CG2 3.47Å; L219-T251 HydrophobicContact CG-CG2 4.35Å
220	K	78.4	Confident	82.5	Confident	158 Å²	158	68.5 Å²	68.5	69%	0.687	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	107.8	171.8	-57.3	174.5	-178	172.9	0	109.6	C227 T228	K220-C227 CarbonylContact O-C 3.58Å; K220-C227 VanDerWaalsContact O-CA 3.29Å; K220-C227 WeakPolarHBondContact O-CA 3.29Å; K220-T228 WeakPolarHBondContact CB-OG1 3.25Å; K220-T228 PolarHBondContact O-N 2.99Å
221	A	76	Confident	81.1	Confident	35 Å²	35	74.2 Å²	74.2	29%	0.289	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	130.2	172.4	0	0	0	0	0	110.5	V102 Y249	V102-A221 HydrophobicContact CG2-CB 3.87Å; A221-Y249 HydrophobicContact CB-CE2 4.45Å
222	D	73.6	Confident	79.5	Confident	91 Å²	91	75.5 Å²	75.5	49%	0.487	39%	0.391	S	S	.	.			trans	-94.3	162	175.2	-169.3	22.1	0	0	0	111	K224 S225 S226	D222-K224 PolarHBondContact O-N 2.95Å; D222-S225 PolarHBondContact O-N 2.71Å; D222-S225 VanDerWaalsContact O-N 3.13Å; D222-S226 WeakPolarHBondContact CB-O 3.42Å; D222-S226 PolarHBondContact N-O 2.95Å
223	E	66.4	Low	77.8	Confident	165 Å²	165	78.7 Å²	78.7	77%	0.771	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-19.2	-174.2	-68.7	-172.1	166.5	0	0	114.3	N108 S225	N108-E223 WeakPolarHBondContact ND2-CA 3.35Å; E223-S225 VanDerWaalsContact C-N 3.35Å
224	K	68.7	Low	76.1	Confident	177 Å²	177	85.2 Å²	85.2	77%	0.77	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	16.6	-179.6	-65.6	-179.4	-179.7	174.9	0	113.9	D222 S226	D222-K224 PolarHBondContact O-N 2.95Å; K224-S226 PolarHBondContact O-N 3.3Å
225	S	76.7	Confident	75	Confident	22 Å²	22	86.8 Å²	86.8	15%	0.154	46%	0.461	C	S	.	.	S	Bend	trans	69.1	0.4	-174.2	-26.3	0	0	0	0	115.2	E101 V102 S105 D222 E223	E101-S225 CarbonylContact C-O 3.55Å; E101-S225 WeakPolarHBondContact CA-O 3.11Å; V102-S225 PolarHBondContact N-O 2.83Å; S105-S225 VanDerWaalsContact CB-OG 3.27Å; S105-S225 WeakPolarHBondContact CB-OG 3.48Å; S105-S225 PolarHBondContact OG-OG 2.89Å; D222-S225 PolarHBondContact O-N 2.71Å; D222-S225 VanDerWaalsContact O-N 3.13Å; E223-S225 VanDerWaalsContact C-N 3.35Å
226	S	82.3	Confident	74.6	Confident	50 Å²	50	84 Å²	84	35%	0.35	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-75	146.6	171.1	47.7	0	0	0	0	110.4	D222 K224	D222-S226 WeakPolarHBondContact CB-O 3.42Å; D222-S226 PolarHBondContact N-O 2.95Å; K224-S226 PolarHBondContact O-N 3.3Å
227	C	84.4	Confident	74.7	Confident	12 Å²	12	84.2 Å²	84.2	8%	0.081	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	164.7	171.9	40.2	0	0	0	0	111.9	C100 E101 V102 L219 K220	C100-C227 HydrophobicContact CB-CB 4.01Å; C100-C227 WeakPolarHBondContact CB-O 3.18Å; C100-C227 WeakPolarHBondContact CB-SG 3.29Å; C100-C227 PolarHBondContact O-N 2.97Å; C100-C227 WeakPolarHBondContact SG-CB 3.48Å; C100-C227 CovalentContact SG-SG 2.03Å; C100-C227 PolarHBondContact SG-SG 2.98Å; E101-C227 PolarHBondContact N-SG 3.36Å; E101-C227 VanDerWaalsContact N-SG 3.35Å; V102-C227 HydrophobicContact CG2-CB 3.79Å; L219-C227 HydrophobicContact CD1-CB 4.33Å; L219-C227 HydrophobicContact CD2-CB 4.19Å; L219-C227 HydrophobicContact CG-CB 4.18Å; K220-C227 CarbonylContact O-C 3.58Å; K220-C227 VanDerWaalsContact O-CA 3.29Å; K220-C227 WeakPolarHBondContact O-CA 3.29Å
228	T	83.3	Confident	75.1	Confident	84 Å²	84	78.4 Å²	78.4	52%	0.515	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.1	167.9	51.1	0	0	0	0	108.6	K220	K220-T228 WeakPolarHBondContact CB-OG1 3.25Å; K220-T228 PolarHBondContact O-N 2.99Å
229	L	81.6	Confident	75.6	Confident	56 Å²	56	79 Å²	79	29%	0.293	44%	0.435	S	S	.	.			trans	-79.2	146.7	175.1	-65.5	168.2	0	0	0	109.2	C100 I214 L219 E231	C100-L229 HydrophobicContact CB-CD1 4.25Å; C100-L229 HydrophobicContact CB-CD2 4.47Å; C100-L229 HydrophobicContact CB-CG 3.94Å; I214-L229 HydrophobicContact CD1-CD2 3.42Å; I214-L229 VanDerWaalsContact CD1-CD2 3.42Å; L219-L229 HydrophobicContact CD1-CD2 4.23Å; L229-E231 PolarHBondContact O-N 3.22Å
230	P	76.8	Confident	76.1	Confident	43 Å²	43	78.6 Å²	78.6	28%	0.279	43%	0.433	S	S	.	.			trans	-62.8	132.6	174.9	24.1	-31	0	0	0	110.6	I214 D218 G232	I214-P230 HydrophobicContact CG2-CG 4.25Å; D218-P230 HydrophobicContact CB-CB 4.49Å; D218-P230 HydrophobicContact CB-CG 4.28Å; P230-G232 PolarHBondContact O-N 3.46Å; P230-G232 VanDerWaalsContact O-N 3.12Å
231	E	64.6	Low	76.7	Confident	203 Å²	203	72.9 Å²	72.9	95%	0.949	41%	0.409	S	S	*	.	S	Bend	trans	-73.7	101.1	175.7	-68.7	-177.1	169.4	0	0	109.8	L229	L229-E231 PolarHBondContact O-N 3.22Å
232	G	60.7	Low	77.4	Confident	52 Å²	52	73.6 Å²	73.6	54%	0.536	41%	0.411	S	S	.	.	S	Bend	trans	115.5	171.3	171.1	0	0	0	0	0	115.4	P230 N234	P230-G232 PolarHBondContact O-N 3.46Å; P230-G232 VanDerWaalsContact O-N 3.12Å; G232-N234 PolarHBondContact O-N 2.98Å
233	T	56.8	Low	78.2	Confident	144 Å²	144	74 Å²	74	88%	0.883	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	14	-178.7	38.6	0	0	0	0	115.3
234	N	55.9	Low	79.5	Confident	150 Å²	150	71.9 Å²	71.9	80%	0.802	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	10.2	-170.9	-67.9	-14.3	0	0	0	114.2	G232 S236	G232-N234 PolarHBondContact O-N 2.98Å; N234-S236 PolarHBondContact O-N 3.1Å
235	S	68.7	Low	80.5	Confident	35 Å²	35	69.6 Å²	69.6	25%	0.245	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-70.5	128.1	173.2	63.2	0	0	0	0	110.1
236	S	80.3	Confident	81.2	Confident	42 Å²	42	69.3 Å²	69.3	29%	0.294	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-70.1	138.5	170.9	56.7	0	0	0	0	109.2	R215 D218 N234	R215-S236 WeakPolarHBondContact CB-O 3.45Å; R215-S236 WeakPolarHBondContact CB-OG 3.37Å; R215-S236 WeakPolarHBondContact CD-OG 3.19Å; R215-S236 PolarHBondContact N-O 3.18Å; D218-S236 PolarHBondContact OD2-N 3.31Å; D218-S236 PolarHBondContact OD2-OG 3.13Å; N234-S236 PolarHBondContact O-N 3.1Å
237	P	88.2	Confident	81.6	Confident	45 Å²	45	71.5 Å²	71.5	29%	0.292	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-69.1	148.3	-179.8	26.8	-33.4	0	0	0	111.3	F171 Y178 E239	F171-P237 HydrophobicContact CZ-CB 3.87Å; F171-P237 HydrophobicContact CZ-CG 4.38Å; Y178-P237 HydrophobicContact CD1-CB 3.47Å; Y178-P237 VanDerWaalsContact CD1-CB 3.47Å; Y178-P237 HydrophobicContact CD1-CG 3.58Å; Y178-P237 HydrophobicContact CE1-CB 3.94Å; Y178-P237 HydrophobicContact CE1-CG 3.48Å; Y178-P237 VanDerWaalsContact CE1-CG 3.48Å; Y178-P237 HydrophobicContact CG-CB 3.91Å; Y178-P237 HydrophobicContact CG-CG 4.12Å; P237-E239 PolarHBondContact O-N 3.48Å; P237-E239 VanDerWaalsContact O-N 3.12Å
238	Q	89.6	Confident	81.9	Confident	16 Å²	16	71 Å²	71	8%	0.075	40%	0.395	C	S	.	.			trans	-74.2	100.4	179.2	-179.9	59.4	58.4	0	0	110.4	Y178 L179 S213 L248	Y178-Q238 WeakPolarHBondContact CA-O 3.15Å; L179-Q238 PolarHBondContact N-O 3.27Å; L179-Q238 VanDerWaalsContact N-O 3.08Å; S213-Q238 PolarHBondContact OG-N 3.3Å; Q238-L248 HydrophobicContact CG-CB 4.09Å
239	E	92.2	Very high	82.2	Confident	69 Å²	69	68.5 Å²	68.5	32%	0.322	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-69.5	140	174.8	-170.1	172.2	171.7	0	0	110.6	K176 I177 Y178 P237	K176-E239 WeakPolarHBondContact CD-OE1 3.1Å; K176-E239 WeakPolarHBondContact CE-OE1 3.27Å; K176-E239 IonicContact NZ-OE1 3.76Å; K176-E239 PolarHBondContact NZ-OE1 3.1Å; K176-E239 IonicContact NZ-OE2 3.3Å; K176-E239 PolarHBondContact NZ-OE2 3.32Å; I177-E239 CarbonylContact O-C 3.48Å; I177-E239 WeakPolarHBondContact O-CA 3.44Å; Y178-E239 HydrophobicContact CD1-CB 4.12Å; Y178-E239 HydrophobicContact CE1-CB 3.86Å; Y178-E239 HydrophobicContact CE1-CG 4.32Å; P237-E239 PolarHBondContact O-N 3.48Å; P237-E239 VanDerWaalsContact O-N 3.12Å
240	I	92.7	Very high	82.6	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.01	37%	0.366	C	S	.	.			trans	-112.3	105.4	170.2	-59.2	-60.7	0	0	0	107.9	L113 V121 A122 I177 L179 P242 N246 L248	L113-I240 HydrophobicContact CD1-CD1 4.31Å; V121-I240 HydrophobicContact CG1-CG1 4.48Å; A122-I240 HydrophobicContact CB-CG2 4.43Å; I177-I240 PolarHBondContact O-N 3.17Å; L179-I240 HydrophobicContact CB-CD1 4.04Å; L179-I240 HydrophobicContact CB-CG1 3.65Å; L179-I240 HydrophobicContact CD2-CD1 4.17Å; I240-P242 WeakPolarHBondContact O-CD 3.42Å; I240-N246 HydrophobicContact CD1-CB 4.21Å; I240-L248 HydrophobicContact CD1-CD2 3.66Å
241	D	91.5	Very high	83.4	Confident	37 Å²	37	64.6 Å²	64.6	20%	0.198	35%	0.353	C	S	.	.			trans	-83.9	114.7	173.8	-176.5	-15.2	0	0	0	109.2	T243 K244 N246	D241-T243 VanDerWaalsContact CG-OG1 3.29Å; D241-T243 PolarHBondContact O-N 3.08Å; D241-T243 VanDerWaalsContact O-N 3.1Å; D241-T243 WeakPolarHBondContact OD1-CB 3.42Å; D241-T243 PolarHBondContact OD1-N 3.14Å; D241-T243 PolarHBondContact OD1-OG1 3.13Å; D241-T243 PolarHBondContact OD2-OG1 2.86Å; D241-K244 PolarHBondContact O-N 3.46Å; D241-K244 IonicContact OD2-NZ 3.04Å; D241-K244 PolarHBondContact OD2-NZ 2.93Å; D241-N246 PolarHBondContact N-ND2 3.46Å; D241-N246 PolarHBondContact N-OD1 2.86Å; D241-N246 PolarHBondContact O-ND2 3.38Å
242	P	90.5	Very high	84.8	Confident	51 Å²	51	55 Å²	55	33%	0.331	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-10.5	-178.1	29.4	-35.8	0	0	0	113.5	A122 I240	A122-P242 HydrophobicContact CB-CB 4.11Å; I240-P242 WeakPolarHBondContact O-CD 3.42Å
243	T	91.4	Very high	86.4	Confident	99 Å²	99	52.5 Å²	52.5	61%	0.607	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-9.8	-177.8	68.1	0	0	0	0	114.2	D241	D241-T243 VanDerWaalsContact CG-OG1 3.29Å; D241-T243 PolarHBondContact O-N 3.08Å; D241-T243 VanDerWaalsContact O-N 3.1Å; D241-T243 WeakPolarHBondContact OD1-CB 3.42Å; D241-T243 PolarHBondContact OD1-N 3.14Å; D241-T243 PolarHBondContact OD1-OG1 3.13Å; D241-T243 PolarHBondContact OD2-OG1 2.86Å
244	K	91.9	Very high	88.2	Confident	121 Å²	121	45.7 Å²	45.7	53%	0.526	24%	0.241	S	C	.	.	S	Bend	trans	-131.4	167.5	-175	-62.1	-174.4	-164.2	105	0	111.3	S118 D241 N246	S118-K244 PolarHBondContact OG-O 2.69Å; D241-K244 PolarHBondContact O-N 3.46Å; D241-K244 IonicContact OD2-NZ 3.04Å; D241-K244 PolarHBondContact OD2-NZ 2.93Å; K244-N246 PolarHBondContact O-ND2 3.06Å
245	E	91.4	Very high	90.1	Very high	128 Å²	128	41.6 Å²	41.6	60%	0.598	22%	0.217	S	C	*	.			trans	-72.3	133	166.2	-63.4	-176.6	172.2	0	0	109.2	T112 L113 V115	T112-E245 HydrophobicContact CG2-CB 4.32Å; L113-E245 VanDerWaalsContact O-CA 3.3Å; L113-E245 WeakPolarHBondContact O-CA 3.35Å; V115-E245 HydrophobicContact CG2-CG 4.14Å
246	N	90.8	Very high	91.4	Very high	16 Å²	16	40.7 Å²	40.7	9%	0.086	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	135.6	178.9	-63.4	-82.2	0	0	0	109.2	L113 S118 I240 D241 K244	L113-N246 PolarHBondContact N-O 3.29Å; L113-N246 PolarHBondContact O-N 2.92Å; S118-N246 WeakPolarHBondContact CB-ND2 3.3Å; S118-N246 PolarHBondContact OG-ND2 3.35Å; I240-N246 HydrophobicContact CD1-CB 4.21Å; D241-N246 PolarHBondContact N-ND2 3.46Å; D241-N246 PolarHBondContact N-OD1 2.86Å; D241-N246 PolarHBondContact O-ND2 3.38Å; K244-N246 PolarHBondContact O-ND2 3.06Å
247	Q	90.1	Very high	92	Very high	97 Å²	97	42.9 Å²	42.9	45%	0.453	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.4	174.8	-71.3	-174.2	-3.5	0	0	109.5	P110 V111 T112 L216	P110-Q247 HydrophobicContact CB-CB 4.04Å; P110-Q247 HydrophobicContact CG-CB 4.1Å; P110-Q247 HydrophobicContact CG-CG 4.38Å; V111-Q247 WeakPolarHBondContact O-CA 3.31Å; T112-Q247 HydrophobicContact CG2-CG 4.17Å; L216-Q247 HydrophobicContact CD2-CB 3.94Å
248	L	90.4	Very high	92.3	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	159.4	179	64.4	95.5	0	0	0	111.7	V111 L113 L179 N181 Q238 I240 F250	V111-L248 PolarHBondContact N-O 3.32Å; V111-L248 PolarHBondContact O-N 3.05Å; V111-L248 VanDerWaalsContact O-N 3.13Å; L113-L248 HydrophobicContact CD1-CD2 3.73Å; L113-L248 HydrophobicContact CG-CD2 4.3Å; L179-L248 HydrophobicContact CD2-CD1 4.24Å; L179-L248 HydrophobicContact CD2-CD2 3.62Å; N181-L248 HydrophobicContact CB-CD1 4.19Å; Q238-L248 HydrophobicContact CG-CB 4.09Å; I240-L248 HydrophobicContact CD1-CD2 3.66Å; L248-F250 HydrophobicContact CD1-CD1 4.04Å; L248-F250 HydrophobicContact CD1-CD2 3.85Å; L248-F250 HydrophobicContact CD1-CE1 3.85Å; L248-F250 HydrophobicContact CD1-CE2 3.65Å; L248-F250 HydrophobicContact CD1-CG 4.05Å; L248-F250 HydrophobicContact CD1-CZ 3.65Å
249	Y	89.2	Confident	92.4	Very high	33 Å²	33	46 Å²	46	13%	0.129	23%	0.226	C	C	.	.			trans	-102.6	134.8	166.5	-71.3	-66.7	0	0	0	109.7	V102 N108 P110 N181 L216 L219 A221	V102-Y249 HydrophobicContact CG1-CD1 3.77Å; V102-Y249 HydrophobicContact CG1-CE1 4.41Å; V102-Y249 HydrophobicContact CG1-CG 4.43Å; N108-Y249 PolarHBondContact O-OH 3.02Å; P110-Y249 HydrophobicContact CB-CD1 4.45Å; P110-Y249 HydrophobicContact CB-CE1 4.14Å; P110-Y249 HydrophobicContact CB-CE2 4.31Å; N181-Y249 WeakPolarHBondContact CB-O 3.39Å; N181-Y249 PolarHBondContact ND2-O 3.36Å; L216-Y249 HydrophobicContact CD1-CD2 3.22Å; L216-Y249 HydrophobicContact CD1-CE2 3.32Å; L216-Y249 HydrophobicContact CD1-CG 4.15Å; L219-Y249 HydrophobicContact CD2-CD2 3.65Å; L219-Y249 HydrophobicContact CD2-CG 3.87Å; A221-Y249 HydrophobicContact CB-CE2 4.45Å
250	F	91.2	Very high	92.3	Very high	16 Å²	16	50.2 Å²	50.2	7%	0.07	25%	0.251	C	S	.	.			trans	-87.6	125.1	162.6	-70	-71.1	0	0	0	108.2	F63 L103 V111 L179 N181 L248	F63-F250 AromaticContact CD1-CE1 3.87Å; F63-F250 HydrophobicContact CD1-CE1 3.87Å; F63-F250 AromaticContact CD1-CZ 3.86Å; F63-F250 HydrophobicContact CD1-CZ 3.86Å; F63-F250 HydrophobicContact CE1-CE1 4.11Å; F63-F250 HydrophobicContact CE1-CZ 4.35Å; L103-F250 HydrophobicContact CB-CB 4.06Å; L103-F250 WeakPolarHBondContact CB-O 3.49Å; L103-F250 HydrophobicContact CD1-CB 4.06Å; L103-F250 PolarHBondContact N-O 3.31Å; V111-F250 HydrophobicContact CG2-CD2 4.21Å; L179-F250 HydrophobicContact CD2-CE1 3.99Å; L179-F250 HydrophobicContact CD2-CZ 4.21Å; N181-F250 HydrophobicContact CB-CD1 4.36Å; N181-F250 WeakPolarHBondContact O-CA 3.26Å; L248-F250 HydrophobicContact CD1-CD1 4.04Å; L248-F250 HydrophobicContact CD1-CD2 3.85Å; L248-F250 HydrophobicContact CD1-CE1 3.85Å; L248-F250 HydrophobicContact CD1-CE2 3.65Å; L248-F250 HydrophobicContact CD1-CG 4.05Å; L248-F250 HydrophobicContact CD1-CZ 3.65Å
251	T	92.5	Very high	92	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	160.7	-179.2	59.8	0	0	0	0	111.2	E101 V102 N181 H182 L183 L219	E101-T251 CarbonylContact O-C 3.53Å; E101-T251 WeakPolarHBondContact O-CA 3.41Å; E101-T251 WeakPolarHBondContact O-CB 3.44Å; V102-T251 HydrophobicContact CB-CG2 4.42Å; V102-T251 HydrophobicContact CG2-CG2 3.99Å; N181-T251 PolarHBondContact O-N 3.47Å; H182-T251 WeakPolarHBondContact CA-O 3.26Å; H182-T251 PolarHBondContact ND1-OG1 3.23Å; L183-T251 PolarHBondContact N-O 2.98Å; L219-T251 HydrophobicContact CD1-CG2 3.96Å; L219-T251 HydrophobicContact CD2-CG2 3.47Å; L219-T251 VanDerWaalsContact CD2-CG2 3.47Å; L219-T251 HydrophobicContact CG-CG2 4.35Å
252	Y	94.2	Very high	91.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	154	175.6	71.7	-71.3	0	0	0	111.7	F90 Q91 K98 C100 E101 L103 L183 F185 V254	F90-Y252 AromaticContact CD1-CD1 3.93Å; F90-Y252 HydrophobicContact CD1-CD1 3.93Å; F90-Y252 HydrophobicContact CD1-CD2 4.03Å; F90-Y252 HydrophobicContact CD1-CE1 4.32Å; F90-Y252 HydrophobicContact CD1-CE2 4.4Å; F90-Y252 AromaticContact CD1-CG 3.77Å; F90-Y252 HydrophobicContact CD1-CG 3.77Å; F90-Y252 HydrophobicContact CE1-CD1 4.33Å; F90-Y252 HydrophobicContact CE1-CG 4.11Å; Q91-Y252 PolarHBondContact N-OH 3.21Å; Q91-Y252 VanDerWaalsContact N-OH 3.16Å; Q91-Y252 PolarHBondContact O-OH 3.2Å; K98-Y252 HydrophobicContact CD-CE2 4.21Å; K98-Y252 PolarHBondContact NZ-OH 3.2Å; C100-Y252 CarbonylContact C-O 3.52Å; C100-Y252 WeakPolarHBondContact CA-O 3.33Å; E101-Y252 HydrophobicContact CB-CD1 4.14Å; E101-Y252 HydrophobicContact CB-CE1 3.64Å; E101-Y252 HydrophobicContact CG-CE1 3.87Å; E101-Y252 PolarHBondContact N-O 3.42Å; E101-Y252 WeakPolarHBondContact O-CD1 3.14Å; E101-Y252 PolarHBondContact O-N 2.89Å; E101-Y252 PolarHBondContact OE1-OH 3.39Å; E101-Y252 PolarHBondContact OE2-OH 3.25Å; L103-Y252 HydrophobicContact CD1-CD1 3.76Å; L103-Y252 HydrophobicContact CD1-CG 4.44Å; L103-Y252 HydrophobicContact CD2-CD1 3.91Å; L103-Y252 HydrophobicContact CD2-CE1 3.89Å; L103-Y252 HydrophobicContact CG-CD1 3.64Å; L103-Y252 HydrophobicContact CG-CE1 3.96Å; L183-Y252 CarbonylContact O-C 3.54Å; L183-Y252 WeakPolarHBondContact O-CA 3.37Å; L183-Y252 WeakPolarHBondContact O-CB 3.39Å; F185-Y252 HydrophobicContact CD2-CD2 4.02Å; F185-Y252 HydrophobicContact CE2-CD2 4.03Å; F185-Y252 HydrophobicContact CE2-CG 4.31Å; Y252-V254 HydrophobicContact CD2-CG2 3.81Å; Y252-V254 HydrophobicContact CE2-CG2 3.78Å
253	S	94.5	Very high	91.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	157.7	166.9	72.3	0	0	0	0	109.8	K98 K99 L183 S184 F185 H255	K98-S253 CarbonylContact O-C 3.6Å; K98-S253 VanDerWaalsContact O-CA 3.26Å; K98-S253 WeakPolarHBondContact O-CA 3.25Å; K98-S253 VanDerWaalsContact O-CB 3.32Å; K98-S253 WeakPolarHBondContact O-CB 3.33Å; K99-S253 WeakPolarHBondContact O-CB 3.46Å; L183-S253 PolarHBondContact O-N 3Å; S184-S253 VanDerWaalsContact CA-OG 3.24Å; S184-S253 WeakPolarHBondContact CA-OG 3.47Å; S184-S253 WeakPolarHBondContact CB-OG 3.27Å; S184-S253 PolarHBondContact OG-OG 3.16Å; F185-S253 PolarHBondContact N-O 3.43Å; S253-H255 PolarHBondContact OG-NE2 3.39Å
254	V	95.4	Very high	91.2	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	120	178.7	-177.5	0	0	0	0	108.1	V92 E97 K98 F185 L187 Y252	V92-V254 HydrophobicContact CG1-CG1 3.95Å; V92-V254 HydrophobicContact CG2-CG2 3.95Å; E97-V254 WeakPolarHBondContact CA-O 3.37Å; K98-V254 HydrophobicContact CB-CB 4.04Å; K98-V254 HydrophobicContact CB-CG2 4.18Å; K98-V254 HydrophobicContact CD-CG2 4.32Å; K98-V254 PolarHBondContact N-O 3.34Å; K98-V254 PolarHBondContact O-N 2.92Å; F185-V254 HydrophobicContact CD2-CG2 4.49Å; F185-V254 WeakPolarHBondContact O-CA 3.17Å; L187-V254 HydrophobicContact CD1-CG1 3.95Å; Y252-V254 HydrophobicContact CD2-CG2 3.81Å; Y252-V254 HydrophobicContact CE2-CG2 3.78Å
255	H	95.9	Very high	90.9	Very high	65 Å²	65	52.1 Å²	52.1	30%	0.301	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	137.9	173.3	-59.5	-71.1	0	0	0	108.7	F185 I186 L187 S253	F185-H255 PolarHBondContact O-N 3.39Å; I186-H255 WeakPolarHBondContact CA-O 3.27Å; I186-H255 HydrophobicContact CG1-CB 4.44Å; L187-H255 PolarHBondContact N-O 2.83Å; S253-H255 PolarHBondContact OG-NE2 3.39Å
256	W	95.1	Very high	90.6	Very high	15 Å²	15	46.2 Å²	46.2	6%	0.057	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	131.7	178.2	-75.6	101.3	0	0	0	109.6	V40 V92 L93 M94 S96 L187 Y189 V204	V40-W256 HydrophobicContact CG2-CH2 4.06Å; V40-W256 HydrophobicContact CG2-CZ2 4.18Å; V92-W256 HydrophobicContact CG1-CZ2 3.77Å; L93-W256 PolarHBondContact O-NE1 3Å; M94-W256 HydrophobicContact CE-CE3 4.5Å; M94-W256 HydrophobicContact CE-CH2 4.06Å; M94-W256 HydrophobicContact CE-CZ3 3.79Å; M94-W256 HydrophobicContact SD-CH2 3.31Å; M94-W256 WeakPolarHBondContact SD-CH2 3.47Å; M94-W256 HydrophobicContact SD-CZ2 3.87Å; M94-W256 HydrophobicContact SD-CZ3 3.68Å; S96-W256 PolarHBondContact O-NE1 3.3Å; L187-W256 HydrophobicContact CB-CD2 3.9Å; L187-W256 HydrophobicContact CB-CE3 3.37Å; L187-W256 HydrophobicContact CB-CH2 3.6Å; L187-W256 HydrophobicContact CB-CZ2 4.08Å; L187-W256 HydrophobicContact CB-CZ3 3.23Å; L187-W256 HydrophobicContact CD1-CH2 4.49Å; L187-W256 HydrophobicContact CD1-CZ2 4.28Å; L187-W256 HydrophobicContact CD2-CH2 3.68Å; L187-W256 HydrophobicContact CD2-CZ2 4.15Å; L187-W256 HydrophobicContact CD2-CZ3 4.14Å; L187-W256 HydrophobicContact CG-CH2 4.11Å; L187-W256 HydrophobicContact CG-CZ2 4.4Å; L187-W256 HydrophobicContact CG-CZ3 4.22Å; L187-W256 VanDerWaalsContact O-CA 3.3Å; L187-W256 WeakPolarHBondContact O-CA 3.38Å; Y189-W256 HydrophobicContact CD1-CB 4.33Å; Y189-W256 AromaticContact CD1-CE3 3.82Å; Y189-W256 HydrophobicContact CD1-CE3 3.82Å; Y189-W256 HydrophobicContact CE1-CB 4.2Å; V204-W256 HydrophobicContact CG2-CH2 4.1Å; V204-W256 HydrophobicContact CG2-CZ3 4.23Å
257	E	94.3	Very high	90.3	Very high	88 Å²	88	46.6 Å²	46.6	41%	0.411	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.5	176.9	-70.3	-173.9	-168	0	0	110.4	I186 L187 Y188 Y189	I186-E257 HydrophobicContact CG2-CG 4.42Å; L187-E257 PolarHBondContact O-N 3.49Å; Y188-E257 CarbonylContact C-O 3.58Å; Y188-E257 WeakPolarHBondContact CA-O 3.49Å; Y188-E257 HydrophobicContact CD1-CB 3.56Å; Y188-E257 HydrophobicContact CE1-CB 3.46Å; Y188-E257 VanDerWaalsContact CE1-CB 3.46Å; Y188-E257 HydrophobicContact CE1-CG 4.2Å; Y188-E257 WeakPolarHBondContact CE1-OE2 3.37Å; Y188-E257 HydrophobicContact CG-CB 4.27Å; Y188-E257 PolarHBondContact OH-OE2 3.29Å; Y189-E257 PolarHBondContact N-O 3.18Å
258	E	93.3	Very high	89.8	Confident	111 Å²	111	45.7 Å²	45.7	52%	0.519	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	139.2	173.9	-170.8	164	-169.8	0	0	110.3	Y189 R191	Y189-E258 HydrophobicContact CD2-CG 4.44Å; Y189-E258 HydrophobicContact CE1-CB 4.45Å; Y189-E258 HydrophobicContact CE2-CB 3.93Å; Y189-E258 HydrophobicContact CE2-CG 3.8Å; R191-E258 WeakPolarHBondContact CB-OE1 3.15Å
259	S	91.9	Very high	89.1	Confident	16 Å²	16	46.4 Å²	46.4	11%	0.112	24%	0.241	C	C	.	.			trans	-134.1	138.2	-176.5	-174.2	0	0	0	0	112	Y189 H190 I261	Y189-S259 PolarHBondContact O-N 2.91Å; H190-S259 PolarHBondContact ND1-O 3.33Å; S259-I261 PolarHBondContact O-N 3.39Å; S259-I261 WeakPolarHBondContact OG-CG1 3.41Å; S259-I261 PolarHBondContact OG-N 3.43Å
260	D	90.2	Very high	88.6	Confident	158 Å²	158	45.5 Å²	45.5	85%	0.845	24%	0.237	S	C	*	.			trans	-73.5	-6.6	175	-60.5	-37.7	0	0	0	113.2	K262	D260-K262 PolarHBondContact O-N 3.45Å
261	I	87.5	Confident	87.8	Confident	41 Å²	41	45.5 Å²	45.5	21%	0.21	24%	0.238	C	C	.	.			trans	-71.7	121.2	-178.7	-61.5	174.9	0	0	0	109.4	H190 V205 R206 S259	H190-I261 WeakPolarHBondContact CB-O 3.31Å; H190-I261 PolarHBondContact ND1-O 2.87Å; V205-I261 WeakPolarHBondContact CG1-O 3.41Å; R206-I261 VanDerWaalsContact NH2-CD1 3.29Å; S259-I261 PolarHBondContact O-N 3.39Å; S259-I261 WeakPolarHBondContact OG-CG1 3.41Å; S259-I261 PolarHBondContact OG-N 3.43Å
262	K	87.6	Confident	86.5	Confident	143 Å²	143	49.7 Å²	49.7	62%	0.622	26%	0.264	S	S	*	.			trans	-68.6	151.2	174.9	-63.5	-173.7	178.3	-174.4	0	111.2	D260 A264 S265 R266	D260-K262 PolarHBondContact O-N 3.45Å; K262-A264 PolarHBondContact O-N 2.87Å; K262-A264 VanDerWaalsContact O-N 3.12Å; K262-S265 PolarHBondContact O-N 3.47Å; K262-S265 PolarHBondContact O-OG 3.14Å; K262-R266 PolarHBondContact O-N 3.07Å
263	W	85.6	Confident	85	Confident	36 Å²	36	52.5 Å²	52.5	14%	0.136	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-54.4	-36.1	179.1	-177.1	91.3	0	0	0	113.4	P31 R203 S265 R266	P31-W263 HydrophobicContact CB-CD2 3.67Å; P31-W263 HydrophobicContact CB-CE3 4.09Å; P31-W263 HydrophobicContact CB-CG 4Å; P31-W263 HydrophobicContact CB-CH2 4.47Å; P31-W263 HydrophobicContact CB-CZ2 4.07Å; P31-W263 HydrophobicContact CB-CZ3 4.47Å; P31-W263 HydrophobicContact CG-CD2 4.5Å; P31-W263 HydrophobicContact CG-CE3 4.45Å; R203-W263 HydrophobicContact CB-CB 4.34Å; W263-S265 VanDerWaalsContact C-N 3.28Å; W263-S265 PolarHBondContact O-N 2.98Å; W263-R266 WeakPolarHBondContact O-CB 3.16Å; W263-R266 WeakPolarHBondContact O-CD 3.45Å; W263-R266 WeakPolarHBondContact O-CG 3.23Å; W263-R266 PolarHBondContact O-N 3.41Å
264	A	82.8	Confident	83.3	Confident	93 Å²	93	55.8 Å²	55.8	77%	0.769	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-63.6	-29.7	179.2	0	0	0	0	0	113.9	K262	K262-A264 PolarHBondContact O-N 2.87Å; K262-A264 VanDerWaalsContact O-N 3.12Å
265	S	84.3	Confident	82	Confident	37 Å²	37	58.5 Å²	58.5	26%	0.259	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-102	10	-179.4	52.6	0	0	0	0	113	K262 W263 W267 D268	K262-S265 PolarHBondContact O-N 3.47Å; K262-S265 PolarHBondContact O-OG 3.14Å; W263-S265 VanDerWaalsContact C-N 3.28Å; W263-S265 PolarHBondContact O-N 2.98Å; S265-W267 PolarHBondContact O-N 2.87Å; S265-D268 WeakPolarHBondContact CB-OD2 3.36Å; S265-D268 WeakPolarHBondContact O-CB 3.3Å; S265-D268 PolarHBondContact O-N 2.93Å
266	R	86.8	Confident	80.8	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.015	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-31.9	-173.2	71.2	-175.7	-172.2	157.5	1.2	114.1	D136 L138 V204 V205 K262 W263 D268	D136-R266 PolarHBondContact O-NH1 3.17Å; D136-R266 PolarHBondContact O-NH2 2.79Å; D136-R266 IonicContact OD2-CZ 2.87Å; D136-R266 IonicContact OD2-NH1 3.51Å; D136-R266 PolarHBondContact OD2-NH1 3.29Å; D136-R266 IonicContact OD2-NH2 3.88Å; L138-R266 HydrophobicContact CD2-CG 3.98Å; V204-R266 PolarHBondContact O-NH1 2.73Å; V205-R266 HydrophobicContact CB-CB 3.98Å; V205-R266 HydrophobicContact CG1-CB 4.26Å; V205-R266 WeakPolarHBondContact O-CB 3.39Å; K262-R266 PolarHBondContact O-N 3.07Å; W263-R266 WeakPolarHBondContact O-CB 3.16Å; W263-R266 WeakPolarHBondContact O-CD 3.45Å; W263-R266 WeakPolarHBondContact O-CG 3.23Å; W263-R266 PolarHBondContact O-N 3.41Å; R266-D268 VanDerWaalsContact C-N 3.33Å
267	W	83	Confident	80	Confident	24 Å²	24	64.6 Å²	64.6	9%	0.091	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-23.4	178.2	-84.3	87.6	0	0	0	113.1	N137 L138 P139 S265 T269 Y270 L271 P372 S373 F530	N137-W267 WeakPolarHBondContact O-CZ2 3.35Å; L138-W267 HydrophobicContact CD2-CZ2 4.44Å; P139-W267 HydrophobicContact CG-CH2 3.98Å; P139-W267 HydrophobicContact CG-CZ3 4.16Å; S265-W267 PolarHBondContact O-N 2.87Å; W267-T269 PolarHBondContact O-N 3.48Å; W267-T269 VanDerWaalsContact O-N 3.1Å; W267-Y270 PolarHBondContact O-N 3.32Å; W267-L271 HydrophobicContact CB-CD1 3.82Å; W267-L271 HydrophobicContact CE3-CD1 4.48Å; W267-L271 HydrophobicContact CE3-CD2 4.48Å; W267-L271 HydrophobicContact CE3-CG 4.46Å; W267-L271 WeakPolarHBondContact O-CD1 3.48Å; W267-L271 WeakPolarHBondContact O-CG 3.49Å; W267-L271 PolarHBondContact O-N 3.19Å; W267-L271 VanDerWaalsContact O-N 3.17Å; W267-P372 HydrophobicContact CE3-CB 4.48Å; W267-P372 HydrophobicContact CH2-CB 4.45Å; W267-P372 HydrophobicContact CZ3-CB 3.95Å; W267-S373 VanDerWaalsContact NE1-CB 3.33Å; W267-S373 PolarHBondContact NE1-OG 3.49Å; W267-F530 HydrophobicContact CZ3-CE1 4.25Å; W267-F530 HydrophobicContact CZ3-CZ 4.36Å
268	D	79.8	Confident	79.2	Confident	78 Å²	78	64.1 Å²	64.1	42%	0.417	35%	0.348	S	S	.	.	H	α-helix	trans	-57.4	-34.1	-175.5	-64.1	-12.5	0	0	0	111.3	S265 R266 Y270 L271 T272	S265-D268 WeakPolarHBondContact CB-OD2 3.36Å; S265-D268 WeakPolarHBondContact O-CB 3.3Å; S265-D268 PolarHBondContact O-N 2.93Å; R266-D268 VanDerWaalsContact C-N 3.33Å; D268-Y270 PolarHBondContact O-N 2.87Å; D268-L271 CarbonylContact O-C 3.55Å; D268-L271 PolarHBondContact O-N 2.83Å; D268-T272 WeakPolarHBondContact O-CG2 3.42Å; D268-T272 PolarHBondContact O-N 2.98Å
269	T	77	Confident	78.4	Confident	14 Å²	14	58.9 Å²	58.9	9%	0.086	32%	0.323	C	S	.	.	H	α-helix	trans	-56.5	-49.9	175.3	-53.7	0	0	0	0	111.7	F163 R206 W267 L271 T272	F163-T269 HydrophobicContact CD2-CG2 4.17Å; F163-T269 WeakPolarHBondContact CD2-O 3.34Å; F163-T269 HydrophobicContact CE1-CG2 4.35Å; F163-T269 HydrophobicContact CE2-CG2 3.44Å; F163-T269 VanDerWaalsContact CE2-CG2 3.44Å; F163-T269 HydrophobicContact CZ-CG2 3.55Å; R206-T269 PolarHBondContact NH2-OG1 3.14Å; W267-T269 PolarHBondContact O-N 3.48Å; W267-T269 VanDerWaalsContact O-N 3.1Å; T269-L271 PolarHBondContact O-N 3.21Å; T269-T272 PolarHBondContact O-OG1 3.33Å
270	Y	77.6	Confident	77.8	Confident	14 Å²	14	64.6 Å²	64.6	6%	0.055	34%	0.343	C	S	.	.	H	α-helix	trans	-72.4	-20.2	-178.2	-63.4	-87.4	0	0	0	113.2	L138 P139 A141 R206 F207 W267 D268	L138-Y270 HydrophobicContact CD2-CE2 3.95Å; P139-Y270 HydrophobicContact CG-CD1 4.08Å; P139-Y270 HydrophobicContact CG-CE1 4.07Å; P139-Y270 WeakPolarHBondContact O-CE1 3.42Å; P139-Y270 PolarHBondContact O-OH 3.15Å; A141-Y270 HydrophobicContact CB-CD1 3.9Å; A141-Y270 HydrophobicContact CB-CE1 3.57Å; R206-Y270 HydrophobicContact CG-CE2 4.32Å; F207-Y270 WeakPolarHBondContact CA-OH 3.49Å; F207-Y270 PolarHBondContact N-OH 2.85Å; F207-Y270 PolarHBondContact O-OH 3.47Å; F207-Y270 VanDerWaalsContact O-OH 3.07Å; W267-Y270 PolarHBondContact O-N 3.32Å; D268-Y270 PolarHBondContact O-N 2.87Å
271	L	74.4	Confident	77.5	Confident	17 Å²	17	64.3 Å²	64.3	9%	0.089	33%	0.334	C	S	.	.	H	α-helix	trans	-102.1	-0.2	-173.6	-60.1	170.9	0	0	0	112.4	W267 D268 T269 M273 P372 F530 Y532	W267-L271 HydrophobicContact CB-CD1 3.82Å; W267-L271 HydrophobicContact CE3-CD1 4.48Å; W267-L271 HydrophobicContact CE3-CD2 4.48Å; W267-L271 HydrophobicContact CE3-CG 4.46Å; W267-L271 WeakPolarHBondContact O-CD1 3.48Å; W267-L271 WeakPolarHBondContact O-CG 3.49Å; W267-L271 PolarHBondContact O-N 3.19Å; W267-L271 VanDerWaalsContact O-N 3.17Å; D268-L271 CarbonylContact O-C 3.55Å; D268-L271 PolarHBondContact O-N 2.83Å; T269-L271 PolarHBondContact O-N 3.21Å; L271-M273 PolarHBondContact O-N 3.1Å; L271-P372 HydrophobicContact CD2-CG 4.44Å; L271-F530 HydrophobicContact CD2-CB 3.8Å; L271-F530 HydrophobicContact CD2-CG 4.26Å; L271-Y532 HydrophobicContact CB-CD1 4.03Å; L271-Y532 HydrophobicContact CB-CG 4.01Å; L271-Y532 HydrophobicContact CD1-CD1 4.03Å; L271-Y532 HydrophobicContact CD1-CD2 3.32Å; L271-Y532 HydrophobicContact CD1-CE1 4.14Å; L271-Y532 HydrophobicContact CD1-CE2 3.43Å; L271-Y532 VanDerWaalsContact CD1-CE2 3.43Å; L271-Y532 HydrophobicContact CD1-CG 3.62Å; L271-Y532 HydrophobicContact CD2-CD2 4.13Å; L271-Y532 HydrophobicContact CD2-CG 4.04Å; L271-Y532 HydrophobicContact CG-CD2 4.17Å; L271-Y532 HydrophobicContact CG-CG 4.07Å
272	T	65.6	Low	77.1	Confident	88 Å²	88	62.7 Å²	62.7	54%	0.54	33%	0.326	S	S	.	.			trans	-64.1	104.8	174.1	53.6	0	0	0	0	109.7	D268 T269	D268-T272 WeakPolarHBondContact O-CG2 3.42Å; D268-T272 PolarHBondContact O-N 2.98Å; T269-T272 PolarHBondContact O-OG1 3.33Å
273	M	61.7	Low	76.8	Confident	59 Å²	59	56.2 Å²	56.2	29%	0.291	30%	0.298	S	S	.	.			trans	-101.8	132.6	172.3	-72	-177.7	155.2	0	0	109.4	L271 D275 F530 L533	L271-M273 PolarHBondContact O-N 3.1Å; M273-D275 PolarHBondContact O-N 3.41Å; M273-D275 VanDerWaalsContact O-N 3.16Å; M273-F530 WeakPolarHBondContact CE-O 3.48Å; M273-L533 HydrophobicContact SD-CD1 4.47Å
274	S	59	Low	76.8	Confident	69 Å²	69	59.2 Å²	59.2	48%	0.483	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.3	173.1	50.2	0	0	0	0	113.1
275	D	69	Low	76.9	Confident	59 Å²	59	58.9 Å²	58.9	32%	0.316	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	12.3	-162.4	-62.6	-10	0	0	0	114.1	M273 Q277 I278 H279 F520	M273-D275 PolarHBondContact O-N 3.41Å; M273-D275 VanDerWaalsContact O-N 3.16Å; D275-Q277 PolarHBondContact O-N 3.38Å; D275-Q277 VanDerWaalsContact O-N 3.08Å; D275-I278 HydrophobicContact CB-CD1 4.02Å; D275-I278 HydrophobicContact CB-CG1 4.4Å; D275-I278 WeakPolarHBondContact O-CA 3.46Å; D275-I278 WeakPolarHBondContact O-CB 3.48Å; D275-I278 PolarHBondContact O-N 3.45Å; D275-H279 PolarHBondContact O-CD2 3.26Å; D275-H279 PolarHBondContact O-N 3.48Å; D275-F520 HydrophobicContact CB-CE1 4.05Å; D275-F520 HydrophobicContact CB-CZ 4.02Å
276	V	71.5	Confident	76.8	Confident	58 Å²	58	57.4 Å²	57.4	35%	0.352	29%	0.291	S	S	.	.	H	α-helix	trans	-54.3	-33.5	179	177.3	0	0	0	0	112.2	I278 H279 W280	V276-I278 VanDerWaalsContact C-N 3.32Å; V276-I278 PolarHBondContact O-N 3.47Å; V276-H279 PolarHBondContact O-N 2.77Å; V276-W280 PolarHBondContact O-N 2.88Å
277	Q	78.3	Confident	76.7	Confident	150 Å²	150	60.7 Å²	60.7	70%	0.701	31%	0.311	S	S	*	.	H	α-helix	trans	-63.3	-36.9	175.9	-65.3	-176.5	-11.9	0	0	112.5	D275 W280 F281	D275-Q277 PolarHBondContact O-N 3.38Å; D275-Q277 VanDerWaalsContact O-N 3.08Å; Q277-W280 PolarHBondContact O-N 3.21Å; Q277-F281 WeakPolarHBondContact O-CB 3.45Å; Q277-F281 PolarHBondContact O-N 3.48Å
278	I	77.3	Confident	76.8	Confident	77 Å²	77	63.8 Å²	63.8	40%	0.395	33%	0.333	S	S	.	.	H	α-helix	trans	-67.7	-40.7	179.8	-57.2	179.7	0	0	0	110	D275 V276 F281 S282 I516 F520	D275-I278 HydrophobicContact CB-CD1 4.02Å; D275-I278 HydrophobicContact CB-CG1 4.4Å; D275-I278 WeakPolarHBondContact O-CA 3.46Å; D275-I278 WeakPolarHBondContact O-CB 3.48Å; D275-I278 PolarHBondContact O-N 3.45Å; V276-I278 VanDerWaalsContact C-N 3.32Å; V276-I278 PolarHBondContact O-N 3.47Å; I278-F281 PolarHBondContact O-N 3.04Å; I278-S282 WeakPolarHBondContact O-CB 3.39Å; I278-S282 PolarHBondContact O-N 3.49Å; I278-I516 HydrophobicContact CG2-CG2 4.21Å; I278-F520 HydrophobicContact CB-CZ 4.38Å; I278-F520 HydrophobicContact CG2-CE2 4.24Å; I278-F520 HydrophobicContact CG2-CZ 4.15Å
279	H	75.4	Confident	76.9	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-48.5	175.3	-72.6	-84.8	0	0	0	112.2	D275 V276 F281 S282 I283 E517 F520 L533 F536	D275-H279 PolarHBondContact O-CD2 3.26Å; D275-H279 PolarHBondContact O-N 3.48Å; V276-H279 PolarHBondContact O-N 2.77Å; H279-F281 PolarHBondContact O-N 3.25Å; H279-S282 WeakPolarHBondContact O-CB 3.32Å; H279-S282 PolarHBondContact O-N 2.89Å; H279-I283 WeakPolarHBondContact O-CG1 3.42Å; H279-I283 PolarHBondContact O-N 3.11Å; H279-E517 IonicContact CE1-OE1 2.59Å; H279-E517 IonicContact CE1-OE2 3.44Å; H279-E517 IonicContact CG-OE1 2.93Å; H279-E517 IonicContact ND1-OE1 3.42Å; H279-E517 PolarHBondContact ND1-OE1 3.13Å; H279-E517 IonicContact ND1-OE2 3.32Å; H279-E517 PolarHBondContact ND1-OE2 3.36Å; H279-F520 AromaticContact CD2-CE2 3.87Å; H279-F520 AromaticContact CE1-CD2 3.05Å; H279-F520 WeakPolarHBondContact CE1-CD2 3.47Å; H279-F520 AromaticContact CE1-CE2 3.35Å; H279-F520 WeakPolarHBondContact CE1-CE2 3.44Å; H279-F520 AromaticContact CE1-CG 3.47Å; H279-F520 VanDerWaalsContact CE1-CG 3.47Å; H279-F520 WeakPolarHBondContact CE1-CG 3.32Å; H279-F520 AromaticContact ND1-CD2 3.75Å; H279-F520 AromaticContact ND1-CE2 3.82Å; H279-F520 AromaticContact NE2-CD1 3.84Å; H279-F520 AromaticContact NE2-CD2 3.46Å; H279-F520 WeakPolarHBondContact NE2-CD2 3.36Å; H279-F520 AromaticContact NE2-CE1 3.78Å; H279-F520 AromaticContact NE2-CE2 3.37Å; H279-F520 WeakPolarHBondContact NE2-CE2 3.39Å; H279-F520 AromaticContact NE2-CG 3.69Å; H279-F520 AromaticContact NE2-CZ 3.54Å; H279-L533 WeakPolarHBondContact CD2-CD1 3.43Å; H279-L533 VanDerWaalsContact NE2-CD1 3.28Å; H279-L533 WeakPolarHBondContact NE2-CD1 3.48Å; H279-F536 HydrophobicContact CB-CD2 3.6Å; H279-F536 HydrophobicContact CB-CE2 3.69Å; H279-F536 HydrophobicContact CB-CG 4.23Å; H279-F536 HydrophobicContact CB-CZ 4.29Å; H279-F536 AromaticContact CG-CD2 3.94Å
280	W	80	Confident	77.2	Confident	137 Å²	137	62.7 Å²	62.7	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-61.7	-43.8	177.2	-88.8	112.5	0	0	0	112.5	V276 Q277 S282 I283 I284 F536	V276-W280 PolarHBondContact O-N 2.88Å; Q277-W280 PolarHBondContact O-N 3.21Å; W280-S282 VanDerWaalsContact C-N 3.35Å; W280-S282 PolarHBondContact O-N 3.2Å; W280-I283 PolarHBondContact O-N 2.77Å; W280-I284 HydrophobicContact CE3-CD1 4.39Å; W280-I284 HydrophobicContact CE3-CG1 4.47Å; W280-I284 WeakPolarHBondContact O-CB 3.12Å; W280-I284 VanDerWaalsContact O-CG1 3.25Å; W280-I284 WeakPolarHBondContact O-CG1 3.26Å; W280-I284 PolarHBondContact O-N 3.31Å; W280-F536 AromaticContact CD1-CZ 3.68Å; W280-F536 AromaticContact CD2-CE1 3.92Å; W280-F536 HydrophobicContact CD2-CE1 3.92Å; W280-F536 HydrophobicContact CD2-CZ 4.14Å; W280-F536 AromaticContact CE2-CE1 3.67Å; W280-F536 AromaticContact CE2-CZ 3.71Å; W280-F536 HydrophobicContact CE3-CE1 4.42Å; W280-F536 HydrophobicContact CG-CE1 4.29Å; W280-F536 HydrophobicContact CG-CZ 4.14Å; W280-F536 HydrophobicContact CH2-CE1 4.45Å; W280-F536 AromaticContact CZ2-CE1 3.96Å; W280-F536 HydrophobicContact CZ2-CE1 3.96Å; W280-F536 HydrophobicContact CZ2-CZ 4.27Å; W280-F536 AromaticContact NE1-CE1 3.91Å; W280-F536 AromaticContact NE1-CZ 3.44Å
281	F	83.6	Confident	77.6	Confident	152 Å²	152	69.9 Å²	69.9	67%	0.667	36%	0.36	S	S	*	.	H	α-helix	trans	-59.9	-46.1	177.2	-179.3	-98.7	0	0	0	111.6	Q277 I278 H279 N285	Q277-F281 WeakPolarHBondContact O-CB 3.45Å; Q277-F281 PolarHBondContact O-N 3.48Å; I278-F281 PolarHBondContact O-N 3.04Å; H279-F281 PolarHBondContact O-N 3.25Å; F281-N285 VanDerWaalsContact O-CB 3.31Å; F281-N285 WeakPolarHBondContact O-CB 3.35Å; F281-N285 PolarHBondContact O-N 2.95Å
282	S	79.5	Confident	78.1	Confident	7 Å²	7	75.5 Å²	75.5	5%	0.049	39%	0.385	C	S	.	.	H	α-helix	trans	-58.5	-48.8	176.3	175.4	0	0	0	0	112.2	I278 H279 W280 N285 S286 I516	I278-S282 WeakPolarHBondContact O-CB 3.39Å; I278-S282 PolarHBondContact O-N 3.49Å; H279-S282 WeakPolarHBondContact O-CB 3.32Å; H279-S282 PolarHBondContact O-N 2.89Å; W280-S282 VanDerWaalsContact C-N 3.35Å; W280-S282 PolarHBondContact O-N 3.2Å; S282-N285 PolarHBondContact O-N 2.9Å; S282-S286 WeakPolarHBondContact O-CB 3.44Å; S282-S286 PolarHBondContact O-N 3.44Å; S282-S286 PolarHBondContact O-OG 3.38Å; S282-I516 VanDerWaalsContact OG-CB 3.23Å; S282-I516 WeakPolarHBondContact OG-CB 3.48Å; S282-I516 WeakPolarHBondContact OG-CG1 3.42Å
283	I	80.8	Confident	78.9	Confident	7 Å²	7	73.8 Å²	73.8	4%	0.036	37%	0.372	C	S	.	.	H	α-helix	trans	-66.4	-44.6	-177.4	-72.3	169.6	0	0	0	111.2	H279 W280 N285 S286 V287 F536 L539 V540	H279-I283 WeakPolarHBondContact O-CG1 3.42Å; H279-I283 PolarHBondContact O-N 3.11Å; W280-I283 PolarHBondContact O-N 2.77Å; I283-N285 VanDerWaalsContact C-N 3.31Å; I283-N285 PolarHBondContact O-N 2.92Å; I283-S286 PolarHBondContact O-N 2.78Å; I283-V287 HydrophobicContact CG2-CG2 4.12Å; I283-V287 WeakPolarHBondContact O-CB 3.32Å; I283-V287 VanDerWaalsContact O-CG2 3.22Å; I283-V287 WeakPolarHBondContact O-CG2 3.4Å; I283-V287 PolarHBondContact O-N 2.88Å; I283-F536 HydrophobicContact CD1-CB 3.6Å; I283-F536 HydrophobicContact CD1-CD1 3.08Å; I283-F536 HydrophobicContact CD1-CE1 3.91Å; I283-F536 HydrophobicContact CD1-CG 3.56Å; I283-L539 HydrophobicContact CG2-CD1 4.43Å; I283-V540 HydrophobicContact CD1-CG2 4.34Å; I283-V540 HydrophobicContact CG1-CG2 3.89Å
284	I	86.5	Confident	80	Confident	98 Å²	98	72.7 Å²	72.7	50%	0.503	37%	0.37	S	S	.	.	H	α-helix	trans	-59.5	-46.8	177	-68.3	167.2	0	0	0	109.6	W280 S286 V287 V288	W280-I284 HydrophobicContact CE3-CD1 4.39Å; W280-I284 HydrophobicContact CE3-CG1 4.47Å; W280-I284 WeakPolarHBondContact O-CB 3.12Å; W280-I284 VanDerWaalsContact O-CG1 3.25Å; W280-I284 WeakPolarHBondContact O-CG1 3.26Å; W280-I284 PolarHBondContact O-N 3.31Å; I284-S286 PolarHBondContact O-N 2.93Å; I284-V287 PolarHBondContact O-N 3.08Å; I284-V288 HydrophobicContact CG2-CG2 4.38Å; I284-V288 WeakPolarHBondContact O-CB 3.4Å; I284-V288 WeakPolarHBondContact O-CG2 3.28Å; I284-V288 PolarHBondContact O-N 2.83Å
285	N	83.7	Confident	81.1	Confident	87 Å²	87	71.3 Å²	71.3	47%	0.465	37%	0.367	S	S	.	.	H	α-helix	trans	-60.3	-47.8	177.5	-174.6	46.3	0	0	0	111.9	F281 S282 I283 V287 V288 V289	F281-N285 VanDerWaalsContact O-CB 3.31Å; F281-N285 WeakPolarHBondContact O-CB 3.35Å; F281-N285 PolarHBondContact O-N 2.95Å; S282-N285 PolarHBondContact O-N 2.9Å; I283-N285 VanDerWaalsContact C-N 3.31Å; I283-N285 PolarHBondContact O-N 2.92Å; N285-V287 PolarHBondContact O-N 3.34Å; N285-V288 PolarHBondContact O-N 3.38Å; N285-V289 WeakPolarHBondContact O-CB 3.46Å; N285-V289 VanDerWaalsContact O-CG2 3.25Å; N285-V289 WeakPolarHBondContact O-CG2 3.49Å; N285-V289 PolarHBondContact O-N 3.35Å
286	S	82.9	Confident	81.8	Confident	6 Å²	6	71.8 Å²	71.8	4%	0.042	37%	0.369	C	S	.	.	H	α-helix	trans	-64.2	-40.4	178.7	-71.2	0	0	0	0	112.7	S282 I283 I284 V289 V290 A513	S282-S286 WeakPolarHBondContact O-CB 3.44Å; S282-S286 PolarHBondContact O-N 3.44Å; S282-S286 PolarHBondContact O-OG 3.38Å; I283-S286 PolarHBondContact O-N 2.78Å; I284-S286 PolarHBondContact O-N 2.93Å; S286-V289 PolarHBondContact O-N 3.41Å; S286-V290 WeakPolarHBondContact O-CB 3.46Å; S286-V290 VanDerWaalsContact O-CG2 3.31Å; S286-V290 WeakPolarHBondContact O-CG2 3.33Å; S286-V290 PolarHBondContact O-N 2.89Å; S286-A513 PolarHBondContact OG-O 3.12Å
287	V	84.6	Confident	82.3	Confident	72 Å²	72	70.7 Å²	70.7	44%	0.436	36%	0.36	S	S	.	.	H	α-helix	trans	-64.2	-45	175.4	170.3	0	0	0	0	110.5	I283 I284 N285 V290 F291 I543	I283-V287 HydrophobicContact CG2-CG2 4.12Å; I283-V287 WeakPolarHBondContact O-CB 3.32Å; I283-V287 VanDerWaalsContact O-CG2 3.22Å; I283-V287 WeakPolarHBondContact O-CG2 3.4Å; I283-V287 PolarHBondContact O-N 2.88Å; I284-V287 PolarHBondContact O-N 3.08Å; N285-V287 PolarHBondContact O-N 3.34Å; V287-V290 PolarHBondContact O-N 3.48Å; V287-F291 WeakPolarHBondContact O-CB 3.35Å; V287-F291 PolarHBondContact O-N 3.47Å; V287-I543 HydrophobicContact CG2-CD1 3.57Å; V287-I543 HydrophobicContact CG2-CG1 4.25Å
288	V	85.5	Confident	82.4	Confident	89 Å²	89	66 Å²	66	54%	0.539	34%	0.344	S	S	.	.	H	α-helix	trans	-61	-47.4	177.6	169.7	0	0	0	0	110.5	I284 N285 F291 F292	I284-V288 HydrophobicContact CG2-CG2 4.38Å; I284-V288 WeakPolarHBondContact O-CB 3.4Å; I284-V288 WeakPolarHBondContact O-CG2 3.28Å; I284-V288 PolarHBondContact O-N 2.83Å; N285-V288 PolarHBondContact O-N 3.38Å; V288-F291 PolarHBondContact O-N 3.41Å; V288-F292 VanDerWaalsContact O-CB 3.24Å; V288-F292 WeakPolarHBondContact O-CB 3.31Å; V288-F292 PolarHBondContact O-N 2.97Å
289	V	82	Confident	82.6	Confident	60 Å²	60	68.1 Å²	68.1	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-60.5	-49.6	177.8	169.1	0	0	0	0	111	N285 S286 F292 L293	N285-V289 WeakPolarHBondContact O-CB 3.46Å; N285-V289 VanDerWaalsContact O-CG2 3.25Å; N285-V289 WeakPolarHBondContact O-CG2 3.49Å; N285-V289 PolarHBondContact O-N 3.35Å; S286-V289 PolarHBondContact O-N 3.41Å; V289-F292 PolarHBondContact O-N 2.92Å; V289-L293 HydrophobicContact CG1-CD1 3.51Å; V289-L293 HydrophobicContact CG1-CG 4.41Å; V289-L293 VanDerWaalsContact O-CB 3.29Å; V289-L293 WeakPolarHBondContact O-CB 3.39Å; V289-L293 WeakPolarHBondContact O-CD1 3.45Å; V289-L293 WeakPolarHBondContact O-CG 3.17Å; V289-L293 PolarHBondContact O-N 2.95Å
290	V	83.1	Confident	82.9	Confident	10 Å²	10	72.1 Å²	72.1	6%	0.061	38%	0.375	C	S	.	.	H	α-helix	trans	-68.5	-37.5	-178.7	171.6	0	0	0	0	112.1	S286 V287 S294 I543 V546 S547	S286-V290 WeakPolarHBondContact O-CB 3.46Å; S286-V290 VanDerWaalsContact O-CG2 3.31Å; S286-V290 WeakPolarHBondContact O-CG2 3.33Å; S286-V290 PolarHBondContact O-N 2.89Å; V287-V290 PolarHBondContact O-N 3.48Å; V290-S294 WeakPolarHBondContact O-CA 3.21Å; V290-S294 WeakPolarHBondContact O-CB 3.2Å; V290-S294 PolarHBondContact O-N 2.93Å; V290-I543 HydrophobicContact CB-CG2 4.39Å; V290-I543 HydrophobicContact CG2-CG2 3.64Å; V290-V546 HydrophobicContact CG1-CB 4.25Å; V290-V546 HydrophobicContact CG1-CG1 3.63Å; V290-S547 WeakPolarHBondContact CG2-OG 3.41Å
291	F	85.5	Confident	83	Confident	164 Å²	164	66.7 Å²	66.7	72%	0.719	36%	0.356	S	S	*	.	H	α-helix	trans	-65.9	-45.4	175.7	-175.7	-96.4	0	0	0	111.4	V287 V288 S294 G295	V287-F291 WeakPolarHBondContact O-CB 3.35Å; V287-F291 PolarHBondContact O-N 3.47Å; V288-F291 PolarHBondContact O-N 3.41Å; F291-S294 WeakPolarHBondContact O-CB 3.42Å; F291-S294 PolarHBondContact O-N 3.25Å; F291-G295 PolarHBondContact O-N 2.65Å
292	F	84.3	Confident	82.9	Confident	136 Å²	136	63.6 Å²	63.6	60%	0.596	35%	0.345	S	S	*	.	H	α-helix	trans	-63.9	-45.2	178.7	-168.4	-107.6	0	0	0	111.5	V288 V289 G295 I296	V288-F292 VanDerWaalsContact O-CB 3.24Å; V288-F292 WeakPolarHBondContact O-CB 3.31Å; V288-F292 PolarHBondContact O-N 2.97Å; V289-F292 PolarHBondContact O-N 2.92Å; F292-G295 PolarHBondContact O-N 3Å; F292-I296 HydrophobicContact CD1-CD1 3.6Å; F292-I296 HydrophobicContact CD2-CD1 4.5Å; F292-I296 HydrophobicContact CE1-CD1 3.19Å; F292-I296 HydrophobicContact CE1-CG1 4.42Å; F292-I296 HydrophobicContact CE2-CD1 4.16Å; F292-I296 HydrophobicContact CG-CD1 4.25Å; F292-I296 HydrophobicContact CZ-CD1 3.52Å; F292-I296 WeakPolarHBondContact O-CG1 3.31Å; F292-I296 PolarHBondContact O-N 3.35Å
293	L	82.9	Confident	83	Confident	51 Å²	51	72 Å²	72	27%	0.267	38%	0.376	S	S	.	.	H	α-helix	trans	-66.6	-40.8	175.6	-68.1	168.9	0	0	0	111.6	V289 G295 I296 L297 L509	V289-L293 HydrophobicContact CG1-CD1 3.51Å; V289-L293 HydrophobicContact CG1-CG 4.41Å; V289-L293 VanDerWaalsContact O-CB 3.29Å; V289-L293 WeakPolarHBondContact O-CB 3.39Å; V289-L293 WeakPolarHBondContact O-CD1 3.45Å; V289-L293 WeakPolarHBondContact O-CG 3.17Å; V289-L293 PolarHBondContact O-N 2.95Å; L293-G295 VanDerWaalsContact C-N 3.33Å; L293-G295 PolarHBondContact O-N 2.87Å; L293-I296 PolarHBondContact O-N 3.31Å; L293-L297 WeakPolarHBondContact O-CB 3.49Å; L293-L297 WeakPolarHBondContact O-CD1 3.49Å; L293-L297 WeakPolarHBondContact O-CG 3.23Å; L293-L297 PolarHBondContact O-N 3.47Å; L293-L509 HydrophobicContact CD1-CD1 3.47Å; L293-L509 VanDerWaalsContact CD1-CD1 3.47Å; L293-L509 HydrophobicContact CD1-CD2 4.34Å; L293-L509 HydrophobicContact CD1-CG 3.82Å
294	S	84.1	Confident	83	Confident	36 Å²	36	73.9 Å²	73.9	25%	0.252	39%	0.388	S	S	.	.	H	α-helix	trans	-55.7	-49.3	172.2	-165	0	0	0	0	111.4	V290 F291 S298 Q550	V290-S294 WeakPolarHBondContact O-CA 3.21Å; V290-S294 WeakPolarHBondContact O-CB 3.2Å; V290-S294 PolarHBondContact O-N 2.93Å; F291-S294 WeakPolarHBondContact O-CB 3.42Å; F291-S294 PolarHBondContact O-N 3.25Å; S294-S298 WeakPolarHBondContact O-CB 3.26Å; S294-S298 PolarHBondContact O-N 3.15Å; S294-S298 PolarHBondContact O-OG 3Å; S294-Q550 PolarHBondContact OG-NE2 2.62Å
295	G	83.4	Confident	82.8	Confident	41 Å²	41	70.1 Å²	70.1	42%	0.423	37%	0.369	S	S	.	.	H	α-helix	trans	-63.2	-50.1	-177.4	0	0	0	0	0	111.4	F291 F292 L293 M299	F291-G295 PolarHBondContact O-N 2.65Å; F292-G295 PolarHBondContact O-N 3Å; L293-G295 VanDerWaalsContact C-N 3.33Å; L293-G295 PolarHBondContact O-N 2.87Å; G295-M299 WeakPolarHBondContact O-CB 3.41Å; G295-M299 PolarHBondContact O-N 3.38Å
296	I	83.6	Confident	82.8	Confident	69 Å²	69	74.8 Å²	74.8	35%	0.354	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-49.4	178.7	-69.2	174.5	0	0	0	111.1	F292 L293 S298 M299 I300	F292-I296 HydrophobicContact CD1-CD1 3.6Å; F292-I296 HydrophobicContact CD2-CD1 4.5Å; F292-I296 HydrophobicContact CE1-CD1 3.19Å; F292-I296 HydrophobicContact CE1-CG1 4.42Å; F292-I296 HydrophobicContact CE2-CD1 4.16Å; F292-I296 HydrophobicContact CG-CD1 4.25Å; F292-I296 HydrophobicContact CZ-CD1 3.52Å; F292-I296 WeakPolarHBondContact O-CG1 3.31Å; F292-I296 PolarHBondContact O-N 3.35Å; L293-I296 PolarHBondContact O-N 3.31Å; I296-S298 PolarHBondContact O-N 3.36Å; I296-M299 PolarHBondContact O-N 3.39Å; I296-I300 HydrophobicContact CG2-CD1 3.59Å; I296-I300 HydrophobicContact CG2-CG1 4.27Å; I296-I300 WeakPolarHBondContact O-CB 3.3Å; I296-I300 VanDerWaalsContact O-CG1 3.25Å; I296-I300 WeakPolarHBondContact O-CG1 3.44Å; I296-I300 PolarHBondContact O-N 2.81Å
297	L	81.1	Confident	82.9	Confident	34 Å²	34	81 Å²	81	18%	0.178	41%	0.406	C	S	.	.	H	α-helix	trans	-64.2	-43.7	-178.7	-69.2	172.7	0	0	0	111.2	L293 M299 I300 I301 Q550 V554	L293-L297 WeakPolarHBondContact O-CB 3.49Å; L293-L297 WeakPolarHBondContact O-CD1 3.49Å; L293-L297 WeakPolarHBondContact O-CG 3.23Å; L293-L297 PolarHBondContact O-N 3.47Å; L297-M299 VanDerWaalsContact C-N 3.35Å; L297-I300 PolarHBondContact O-N 2.96Å; L297-I301 VanDerWaalsContact O-CB 3.23Å; L297-I301 WeakPolarHBondContact O-CB 3.26Å; L297-I301 WeakPolarHBondContact O-CG1 3.37Å; L297-I301 PolarHBondContact O-N 2.84Å; L297-Q550 HydrophobicContact CD1-CB 4.21Å; L297-V554 HydrophobicContact CB-CG2 4.25Å; L297-V554 HydrophobicContact CD1-CG2 3.83Å; L297-V554 HydrophobicContact CD2-CG1 4.36Å; L297-V554 HydrophobicContact CD2-CG2 3.52Å; L297-V554 HydrophobicContact CG-CG2 4.05Å
298	S	80	Confident	82.7	Confident	52 Å²	52	79.1 Å²	79.1	36%	0.364	39%	0.393	S	S	.	.	H	α-helix	trans	-63.4	-41.7	175.4	-59.8	0	0	0	0	111.1	S294 I296 I302	S294-S298 WeakPolarHBondContact O-CB 3.26Å; S294-S298 PolarHBondContact O-N 3.15Å; S294-S298 PolarHBondContact O-OG 3Å; I296-S298 PolarHBondContact O-N 3.36Å; S298-I302 WeakPolarHBondContact O-CB 3.32Å; S298-I302 WeakPolarHBondContact O-CD1 3.45Å; S298-I302 WeakPolarHBondContact O-CG1 3.38Å; S298-I302 PolarHBondContact O-N 3.34Å
299	M	82.9	Confident	82.4	Confident	122 Å²	122	76.7 Å²	76.7	60%	0.601	38%	0.377	S	S	*	.	H	α-helix	trans	-63.6	-46.5	176.6	-177.2	-176.3	-179.2	0	0	111.6	G295 I296 L297 R303	G295-M299 WeakPolarHBondContact O-CB 3.41Å; G295-M299 PolarHBondContact O-N 3.38Å; I296-M299 PolarHBondContact O-N 3.39Å; L297-M299 VanDerWaalsContact C-N 3.35Å; M299-R303 WeakPolarHBondContact O-CB 3.3Å; M299-R303 PolarHBondContact O-N 3.13Å
300	I	81.3	Confident	82.4	Confident	85 Å²	85	76.6 Å²	76.6	44%	0.436	38%	0.382	S	S	.	.	H	α-helix	trans	-60.1	-56.5	176.9	-69.2	169.4	0	0	0	108.9	I296 L297 I302 R303 T304	I296-I300 HydrophobicContact CG2-CD1 3.59Å; I296-I300 HydrophobicContact CG2-CG1 4.27Å; I296-I300 WeakPolarHBondContact O-CB 3.3Å; I296-I300 VanDerWaalsContact O-CG1 3.25Å; I296-I300 WeakPolarHBondContact O-CG1 3.44Å; I296-I300 PolarHBondContact O-N 2.81Å; L297-I300 PolarHBondContact O-N 2.96Å; I300-I302 PolarHBondContact O-N 3.44Å; I300-R303 PolarHBondContact O-N 2.94Å; I300-R303 VanDerWaalsContact O-N 3.16Å; I300-T304 PolarHBondContact O-N 3.27Å; I300-T304 PolarHBondContact O-OG1 2.92Å
301	I	81	Confident	82.2	Confident	23 Å²	23	79.3 Å²	79.3	12%	0.118	40%	0.397	C	S	.	.	H	α-helix	trans	-59.2	-46.8	-177.6	-71.2	168.6	0	0	0	111	L297 R303 T304 L305 I553 V554 F631	L297-I301 VanDerWaalsContact O-CB 3.23Å; L297-I301 WeakPolarHBondContact O-CB 3.26Å; L297-I301 WeakPolarHBondContact O-CG1 3.37Å; L297-I301 PolarHBondContact O-N 2.84Å; I301-R303 VanDerWaalsContact C-N 3.34Å; I301-R303 PolarHBondContact O-N 3.4Å; I301-T304 PolarHBondContact O-OG1 3.45Å; I301-L305 HydrophobicContact CG2-CD1 3.35Å; I301-L305 HydrophobicContact CG2-CG 3.96Å; I301-L305 WeakPolarHBondContact O-CA 3.49Å; I301-L305 WeakPolarHBondContact O-CB 2.88Å; I301-L305 WeakPolarHBondContact O-CG 3.05Å; I301-L305 PolarHBondContact O-N 3.42Å; I301-I553 HydrophobicContact CD1-CG2 3.86Å; I301-V554 HydrophobicContact CD1-CG2 3.93Å; I301-F631 HydrophobicContact CG2-CE2 4.09Å; I301-F631 HydrophobicContact CG2-CZ 4.48Å
302	I	81.8	Confident	81.7	Confident	87 Å²	87	72.4 Å²	72.4	45%	0.446	37%	0.366	S	S	.	.	H	α-helix	trans	-64.7	-41.9	179.1	-69.1	167	0	0	0	110.1	S298 I300 R306	S298-I302 WeakPolarHBondContact O-CB 3.32Å; S298-I302 WeakPolarHBondContact O-CD1 3.45Å; S298-I302 WeakPolarHBondContact O-CG1 3.38Å; S298-I302 PolarHBondContact O-N 3.34Å; I300-I302 PolarHBondContact O-N 3.44Å; I302-R306 HydrophobicContact CG2-CG 4.2Å; I302-R306 WeakPolarHBondContact O-CB 3.34Å; I302-R306 WeakPolarHBondContact O-CG 3.43Å; I302-R306 PolarHBondContact O-N 3.48Å
303	R	82.8	Confident	81.3	Confident	183 Å²	183	68.2 Å²	68.2	69%	0.691	35%	0.35	S	S	*	.	H	α-helix	trans	-69.2	-46.1	-178.9	-173.3	177.4	179.4	178.3	0.2	111.8	M299 I300 I301 K307	M299-R303 WeakPolarHBondContact O-CB 3.3Å; M299-R303 PolarHBondContact O-N 3.13Å; I300-R303 PolarHBondContact O-N 2.94Å; I300-R303 VanDerWaalsContact O-N 3.16Å; I301-R303 VanDerWaalsContact C-N 3.34Å; I301-R303 PolarHBondContact O-N 3.4Å; R303-K307 VanDerWaalsContact O-CB 3.32Å; R303-K307 WeakPolarHBondContact O-CB 3.46Å; R303-K307 PolarHBondContact O-N 3.38Å; R303-K307 VanDerWaalsContact O-N 3.13Å
304	T	81.1	Confident	80.9	Confident	47 Å²	47	72.7 Å²	72.7	29%	0.288	37%	0.367	S	S	.	.	H	α-helix	trans	-69.4	-47.2	176.3	47.2	0	0	0	0	111	I300 I301 R306 K307 D308 Y557	I300-T304 PolarHBondContact O-N 3.27Å; I300-T304 PolarHBondContact O-OG1 2.92Å; I301-T304 PolarHBondContact O-OG1 3.45Å; T304-R306 PolarHBondContact O-N 2.84Å; T304-K307 CarbonylContact O-C 3.55Å; T304-K307 WeakPolarHBondContact O-CB 3.45Å; T304-K307 PolarHBondContact O-N 2.99Å; T304-K307 VanDerWaalsContact O-N 3.14Å; T304-D308 WeakPolarHBondContact O-CB 3.21Å; T304-D308 PolarHBondContact O-N 3.42Å; T304-Y557 PolarHBondContact OG1-OH 2.84Å
305	L	81.9	Confident	79.9	Confident	19 Å²	19	74.6 Å²	74.6	10%	0.099	37%	0.372	C	S	.	.	H	α-helix	trans	-62.3	-41.7	177.7	-72.6	177.3	0	0	0	112.7	I301 K307 D308 I309 W327 Y557 F631 I635	I301-L305 HydrophobicContact CG2-CD1 3.35Å; I301-L305 HydrophobicContact CG2-CG 3.96Å; I301-L305 WeakPolarHBondContact O-CA 3.49Å; I301-L305 WeakPolarHBondContact O-CB 2.88Å; I301-L305 WeakPolarHBondContact O-CG 3.05Å; I301-L305 PolarHBondContact O-N 3.42Å; L305-K307 VanDerWaalsContact C-N 3.29Å; L305-K307 PolarHBondContact O-N 3.05Å; L305-D308 PolarHBondContact O-N 3.46Å; L305-I309 HydrophobicContact CB-CD1 4.41Å; L305-I309 VanDerWaalsContact O-CB 3.24Å; L305-I309 WeakPolarHBondContact O-CB 3.37Å; L305-I309 WeakPolarHBondContact O-CD1 3.47Å; L305-I309 WeakPolarHBondContact O-CG1 3.35Å; L305-I309 PolarHBondContact O-N 3.31Å; L305-W327 HydrophobicContact CD2-CZ2 3.93Å; L305-Y557 HydrophobicContact CD2-CD2 4.03Å; L305-Y557 HydrophobicContact CD2-CE2 3.42Å; L305-Y557 VanDerWaalsContact CD2-CE2 3.42Å; L305-Y557 HydrophobicContact CG-CE2 4.2Å; L305-F631 HydrophobicContact CD1-CE2 3.78Å; L305-F631 HydrophobicContact CD1-CZ 4.01Å; L305-I635 HydrophobicContact CD1-CG2 3.92Å; L305-I635 HydrophobicContact CD2-CG2 4.16Å
306	R	83.1	Confident	78.9	Confident	185 Å²	185	76.5 Å²	76.5	70%	0.698	37%	0.372	S	S	*	.	H	α-helix	trans	-63.1	-39.8	176.1	-77.5	-179.7	-178.1	-145.4	3.6	111.1	I302 T304 A310	I302-R306 HydrophobicContact CG2-CG 4.2Å; I302-R306 WeakPolarHBondContact O-CB 3.34Å; I302-R306 WeakPolarHBondContact O-CG 3.43Å; I302-R306 PolarHBondContact O-N 3.48Å; T304-R306 PolarHBondContact O-N 2.84Å; R306-A310 WeakPolarHBondContact O-CB 3.28Å; R306-A310 PolarHBondContact O-N 2.82Å
307	K	84.3	Confident	77.8	Confident	137 Å²	137	79.8 Å²	79.8	60%	0.596	39%	0.391	S	S	*	.	H	α-helix	trans	-65.6	-48.3	176.1	-170.9	-175.4	175.6	-172.9	0	111.1	R303 T304 L305 A310 N311	R303-K307 VanDerWaalsContact O-CB 3.32Å; R303-K307 WeakPolarHBondContact O-CB 3.46Å; R303-K307 PolarHBondContact O-N 3.38Å; R303-K307 VanDerWaalsContact O-N 3.13Å; T304-K307 CarbonylContact O-C 3.55Å; T304-K307 WeakPolarHBondContact O-CB 3.45Å; T304-K307 PolarHBondContact O-N 2.99Å; T304-K307 VanDerWaalsContact O-N 3.14Å; L305-K307 VanDerWaalsContact C-N 3.29Å; L305-K307 PolarHBondContact O-N 3.05Å; K307-A310 PolarHBondContact O-N 2.72Å; K307-N311 WeakPolarHBondContact O-CB 3.49Å; K307-N311 PolarHBondContact O-N 3.28Å; K307-N311 PolarHBondContact O-OD1 2.92Å
308	D	80.8	Confident	76.9	Confident	32 Å²	32	82.5 Å²	82.5	17%	0.171	40%	0.404	C	S	.	.	H	α-helix	trans	-61.3	-50	179	-67	-4	0	0	0	111	T304 L305 A310 N311 Y312 W327 Y557	T304-D308 WeakPolarHBondContact O-CB 3.21Å; T304-D308 PolarHBondContact O-N 3.42Å; L305-D308 PolarHBondContact O-N 3.46Å; D308-A310 PolarHBondContact O-N 2.99Å; D308-N311 PolarHBondContact O-N 3Å; D308-Y312 HydrophobicContact CB-CD2 4.36Å; D308-Y312 HydrophobicContact CB-CE2 3.86Å; D308-Y312 WeakPolarHBondContact O-CB 3.49Å; D308-Y312 WeakPolarHBondContact O-CD2 3.46Å; D308-Y312 PolarHBondContact O-N 3.27Å; D308-W327 HydrophobicContact CB-CZ2 4.22Å; D308-W327 PolarHBondContact OD2-NE1 3.45Å; D308-W327 VanDerWaalsContact OD2-NE1 3.07Å; D308-Y557 PolarHBondContact OD2-OH 3.34Å
309	I	79.2	Confident	75.8	Confident	38 Å²	38	89.7 Å²	89.7	20%	0.195	43%	0.432	C	S	.	.	H	α-helix	trans	-63.2	-41.6	178.8	-67.2	166.6	0	0	0	110.8	L305 N313 W327 A638 V639	L305-I309 HydrophobicContact CB-CD1 4.41Å; L305-I309 VanDerWaalsContact O-CB 3.24Å; L305-I309 WeakPolarHBondContact O-CB 3.37Å; L305-I309 WeakPolarHBondContact O-CD1 3.47Å; L305-I309 WeakPolarHBondContact O-CG1 3.35Å; L305-I309 PolarHBondContact O-N 3.31Å; I309-N313 WeakPolarHBondContact CG2-ND2 3.34Å; I309-N313 VanDerWaalsContact O-CB 3.3Å; I309-N313 WeakPolarHBondContact O-CB 3.24Å; I309-N313 VanDerWaalsContact O-CG 3.28Å; I309-N313 PolarHBondContact O-N 2.94Å; I309-N313 PolarHBondContact O-ND2 3.01Å; I309-W327 HydrophobicContact CG1-CH2 4.08Å; I309-W327 HydrophobicContact CG1-CZ2 4.08Å; I309-A638 HydrophobicContact CD1-CB 4.25Å; I309-V639 HydrophobicContact CG1-CG2 4.49Å
310	A	81.2	Confident	74.3	Confident	57 Å²	57	89.3 Å²	89.3	47%	0.471	43%	0.433	S	S	.	.	H	α-helix	trans	-66.2	-38	177.2	0	0	0	0	0	112.2	R306 K307 D308 K314	R306-A310 WeakPolarHBondContact O-CB 3.28Å; R306-A310 PolarHBondContact O-N 2.82Å; K307-A310 PolarHBondContact O-N 2.72Å; D308-A310 PolarHBondContact O-N 2.99Å; A310-K314 VanDerWaalsContact O-CB 3.27Å; A310-K314 WeakPolarHBondContact O-CB 3.34Å; A310-K314 PolarHBondContact O-N 2.88Å
311	N	79.7	Confident	73	Confident	68 Å²	68	92.3 Å²	92.3	36%	0.364	46%	0.455	S	S	.	.	H	α-helix	trans	-65.8	-51	175.1	-73.1	-4.4	0	0	0	110.7	K307 D308 N313 K314 E315	K307-N311 WeakPolarHBondContact O-CB 3.49Å; K307-N311 PolarHBondContact O-N 3.28Å; K307-N311 PolarHBondContact O-OD1 2.92Å; D308-N311 PolarHBondContact O-N 3Å; N311-N313 PolarHBondContact O-N 3.49Å; N311-K314 PolarHBondContact O-N 3.44Å; N311-K314 VanDerWaalsContact O-N 3.14Å; N311-E315 WeakPolarHBondContact O-CG 3.17Å; N311-E315 PolarHBondContact O-N 3.18Å
312	Y	74.5	Confident	71.6	Confident	18 Å²	18	98 Å²	98	7%	0.071	48%	0.483	C	S	.	.	H	α-helix	trans	-62.8	-41.2	-178.9	-64.4	-34.1	0	0	0	113.5	D308 K314 E315 D316 S325 W327 K328	D308-Y312 HydrophobicContact CB-CD2 4.36Å; D308-Y312 HydrophobicContact CB-CE2 3.86Å; D308-Y312 WeakPolarHBondContact O-CB 3.49Å; D308-Y312 WeakPolarHBondContact O-CD2 3.46Å; D308-Y312 PolarHBondContact O-N 3.27Å; Y312-K314 VanDerWaalsContact C-N 3.27Å; Y312-K314 PolarHBondContact O-N 2.83Å; Y312-E315 PolarHBondContact O-N 3.16Å; Y312-D316 PolarHBondContact O-N 3.36Å; Y312-S325 PolarHBondContact OH-O 3.2Å; Y312-S325 VanDerWaalsContact OH-O 3.06Å; Y312-W327 HydrophobicContact CD2-CZ2 4.21Å; Y312-W327 HydrophobicContact CE2-CD2 4.42Å; Y312-W327 AromaticContact CE2-CE2 3.76Å; Y312-W327 AromaticContact CE2-CZ2 3.87Å; Y312-W327 HydrophobicContact CE2-CZ2 3.87Å; Y312-W327 AromaticContact CE2-NE1 3.82Å; Y312-K328 HydrophobicContact CD1-CB 4.33Å; Y312-K328 HydrophobicContact CD1-CD 3.79Å; Y312-K328 HydrophobicContact CD2-CB 3.86Å; Y312-K328 HydrophobicContact CD2-CD 3.89Å; Y312-K328 HydrophobicContact CD2-CG 4.44Å; Y312-K328 HydrophobicContact CE1-CB 4.2Å; Y312-K328 HydrophobicContact CE1-CD 4.47Å; Y312-K328 HydrophobicContact CE2-CB 3.72Å; Y312-K328 HydrophobicContact CG-CB 4.2Å; Y312-K328 HydrophobicContact CG-CD 3.48Å; Y312-K328 VanDerWaalsContact CG-CD 3.48Å; Y312-K328 HydrophobicContact CG-CG 4.44Å; Y312-K328 PolarHBondContact O-NZ 3.34Å
313	N	75.9	Confident	70.5	Confident	49 Å²	49	102.2 Å²	102.2	26%	0.262	50%	0.501	S	S	.	.	H	α-helix	trans	-72.2	-21.3	177.9	-72.5	-19	0	0	0	112.8	I309 N311	I309-N313 WeakPolarHBondContact CG2-ND2 3.34Å; I309-N313 VanDerWaalsContact O-CB 3.3Å; I309-N313 WeakPolarHBondContact O-CB 3.24Å; I309-N313 VanDerWaalsContact O-CG 3.28Å; I309-N313 PolarHBondContact O-N 2.94Å; I309-N313 PolarHBondContact O-ND2 3.01Å; N311-N313 PolarHBondContact O-N 3.49Å
314	K	74.9	Confident	69.7	Low	145 Å²	145	96.6 Å²	96.6	63%	0.63	48%	0.482	S	S	*	.	H	α-helix	trans	-82.6	-35	175	-175.3	-176.4	177	-171.2	0	111.3	A310 N311 Y312 D317	A310-K314 VanDerWaalsContact O-CB 3.27Å; A310-K314 WeakPolarHBondContact O-CB 3.34Å; A310-K314 PolarHBondContact O-N 2.88Å; N311-K314 PolarHBondContact O-N 3.44Å; N311-K314 VanDerWaalsContact O-N 3.14Å; Y312-K314 VanDerWaalsContact C-N 3.27Å; Y312-K314 PolarHBondContact O-N 2.83Å; K314-D317 PolarHBondContact O-N 3.06Å
315	E	64.4	Low	69.1	Low	76 Å²	76	97.5 Å²	97.5	36%	0.355	49%	0.491	S	S	.	.	H	α-helix	trans	-69.9	-33	177.9	-73.5	165.7	-170	0	0	111.7	N311 Y312 D317 I318	N311-E315 WeakPolarHBondContact O-CG 3.17Å; N311-E315 PolarHBondContact O-N 3.18Å; Y312-E315 PolarHBondContact O-N 3.16Å; E315-D317 PolarHBondContact O-N 3.08Å; E315-I318 PolarHBondContact O-N 3.36Å
316	D	60.8	Low	69.1	Low	81 Å²	81	97.3 Å²	97.3	43%	0.433	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.9	175	-68	-29	0	0	0	113.5	Y312 I318 K328	Y312-D316 PolarHBondContact O-N 3.36Å; D316-I318 VanDerWaalsContact C-N 3.33Å; D316-K328 IonicContact OD1-NZ 2.77Å; D316-K328 PolarHBondContact OD1-NZ 2.85Å; D316-K328 IonicContact OD2-NZ 3.87Å; D316-K328 PolarHBondContact OD2-NZ 3.12Å
317	D	61.6	Low	69.2	Low	138 Å²	138	88.6 Å²	88.6	74%	0.738	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-9.2	175	-73	-25.3	0	0	0	112.8	K314 E315	K314-D317 PolarHBondContact O-N 3.06Å; E315-D317 PolarHBondContact O-N 3.08Å
318	I	61.4	Low	69.2	Low	91 Å²	91	82.3 Å²	82.3	47%	0.467	43%	0.433	S	S	.	.	S	Bend	trans	-111.8	107.4	-179.4	-53.4	173.8	0	0	0	107.1	E315 D316 D320	E315-I318 PolarHBondContact O-N 3.36Å; D316-I318 VanDerWaalsContact C-N 3.33Å; I318-D320 HydrophobicContact CG2-CB 4.01Å; I318-D320 PolarHBondContact O-N 2.96Å
319	E	56.2	Low	69.4	Low	203 Å²	203	81.7 Å²	81.7	95%	0.949	43%	0.43	S	S	*	.			trans	-58.3	17	179.7	-92.3	-176.7	153.1	0	0	115.7
320	D	51.5	Low	69.9	Low	114 Å²	114	80 Å²	80	61%	0.61	42%	0.421	S	S	*	.	S	Bend	trans	-107.9	97.5	-170.5	-70.3	-38.8	0	0	0	113.2	I318 M322	I318-D320 HydrophobicContact CG2-CB 4.01Å; I318-D320 PolarHBondContact O-N 2.96Å; D320-M322 PolarHBondContact O-N 3.36Å
321	T	54.8	Low	70.2	Confident	147 Å²	147	78.9 Å²	78.9	90%	0.902	41%	0.406	S	S	*	.			trans	44.9	3.6	134.8	49.8	0	0	0	0	122.6
322	M	51.1	Low	70.6	Confident	143 Å²	143	75.8 Å²	75.8	70%	0.704	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-80.6	122.3	173.8	-86.1	-177.3	57	0	0	111.1	D320 E324	D320-M322 PolarHBondContact O-N 3.36Å; M322-E324 PolarHBondContact O-N 3.33Å
323	E	59.1	Low	71.4	Confident	176 Å²	176	75.1 Å²	75.1	82%	0.822	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-56.9	122.7	172.3	-62	-178.8	170.4	0	0	109.2	S325	E323-S325 PolarHBondContact O-N 3.12Å
324	E	65.4	Low	72.2	Confident	65 Å²	65	72.8 Å²	72.8	30%	0.304	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-53.2	135.9	176.2	-22.6	173.8	117.4	0	0	108.1	M322 K328 L329 H331	M322-E324 PolarHBondContact O-N 3.33Å; E324-K328 HydrophobicContact CB-CG 4.43Å; E324-L329 HydrophobicContact CB-CB 4.31Å; E324-L329 HydrophobicContact CB-CD1 3.91Å; E324-L329 HydrophobicContact CG-CD1 4.35Å; E324-L329 WeakPolarHBondContact O-CB 3.31Å; E324-L329 WeakPolarHBondContact O-CD1 3.27Å; E324-L329 WeakPolarHBondContact O-CD2 3.48Å; E324-L329 VanDerWaalsContact O-CG 3.25Å; E324-L329 WeakPolarHBondContact O-CG 3.13Å; E324-H331 IonicContact OE1-CE1 3.78Å; E324-H331 IonicContact OE2-CE1 2.69Å; E324-H331 PolarHBondContact OE2-CE1 2.93Å; E324-H331 VanDerWaalsContact OE2-CE1 3.24Å; E324-H331 IonicContact OE2-ND1 2.67Å; E324-H331 PolarHBondContact OE2-ND1 2.73Å
325	S	69.8	Low	73.1	Confident	66 Å²	66	66.1 Å²	66.1	46%	0.462	35%	0.346	S	S	.	.			trans	-118.8	156.2	-175.4	63.9	0	0	0	0	112	Y312 E323	Y312-S325 PolarHBondContact OH-O 3.2Å; Y312-S325 VanDerWaalsContact OH-O 3.06Å; E323-S325 PolarHBondContact O-N 3.12Å
326	G	80.9	Confident	74.5	Confident	15 Å²	15	65.2 Å²	65.2	16%	0.155	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	-137.1	174.1	0	0	0	0	0	113.7	K328 L329	G326-K328 PolarHBondContact O-N 3.39Å; G326-L329 WeakPolarHBondContact O-CB 3.1Å; G326-L329 PolarHBondContact O-N 2.86Å
327	W	85.6	Confident	76	Confident	1 Å²	1	63.4 Å²	63.4	0%	0.004	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-22.7	-171.9	65.3	-91.2	0	0	0	113.8	L305 D308 I309 Y312 L329 V330 Y557 L560 I635 Y636 V639	L305-W327 HydrophobicContact CD2-CZ2 3.93Å; D308-W327 HydrophobicContact CB-CZ2 4.22Å; D308-W327 PolarHBondContact OD2-NE1 3.45Å; D308-W327 VanDerWaalsContact OD2-NE1 3.07Å; I309-W327 HydrophobicContact CG1-CH2 4.08Å; I309-W327 HydrophobicContact CG1-CZ2 4.08Å; Y312-W327 HydrophobicContact CD2-CZ2 4.21Å; Y312-W327 HydrophobicContact CE2-CD2 4.42Å; Y312-W327 AromaticContact CE2-CE2 3.76Å; Y312-W327 AromaticContact CE2-CZ2 3.87Å; Y312-W327 HydrophobicContact CE2-CZ2 3.87Å; Y312-W327 AromaticContact CE2-NE1 3.82Å; W327-L329 VanDerWaalsContact C-N 3.31Å; W327-L329 PolarHBondContact O-N 3.37Å; W327-V330 WeakPolarHBondContact O-CG2 3.22Å; W327-Y557 AromaticContact CD1-CE2 3.92Å; W327-Y557 AromaticContact NE1-CE2 3.92Å; W327-L560 WeakPolarHBondContact CA-O 3.37Å; W327-L560 HydrophobicContact CB-CB 3.73Å; W327-I635 HydrophobicContact CE3-CD1 4.02Å; W327-I635 HydrophobicContact CE3-CG1 4.46Å; W327-I635 HydrophobicContact CH2-CB 4.2Å; W327-I635 HydrophobicContact CZ3-CB 4.04Å; W327-I635 HydrophobicContact CZ3-CD1 4.19Å; W327-I635 HydrophobicContact CZ3-CG1 4.15Å; W327-Y636 HydrophobicContact CE3-CE1 4.15Å; W327-Y636 HydrophobicContact CZ3-CE1 4.45Å; W327-Y636 PolarHBondContact O-OH 3.3Å; W327-V639 HydrophobicContact CH2-CG2 3.44Å; W327-V639 VanDerWaalsContact CH2-CG2 3.44Å; W327-V639 HydrophobicContact CZ3-CG2 3.73Å
328	K	84.8	Confident	77.6	Confident	5 Å²	5	57.7 Å²	57.7	2%	0.022	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-65.8	-37.6	174.7	177.3	170.3	171.7	-177.4	0	111.3	Y312 D316 E324 G326 V330 H331 V639	Y312-K328 HydrophobicContact CD1-CB 4.33Å; Y312-K328 HydrophobicContact CD1-CD 3.79Å; Y312-K328 HydrophobicContact CD2-CB 3.86Å; Y312-K328 HydrophobicContact CD2-CD 3.89Å; Y312-K328 HydrophobicContact CD2-CG 4.44Å; Y312-K328 HydrophobicContact CE1-CB 4.2Å; Y312-K328 HydrophobicContact CE1-CD 4.47Å; Y312-K328 HydrophobicContact CE2-CB 3.72Å; Y312-K328 HydrophobicContact CG-CB 4.2Å; Y312-K328 HydrophobicContact CG-CD 3.48Å; Y312-K328 VanDerWaalsContact CG-CD 3.48Å; Y312-K328 HydrophobicContact CG-CG 4.44Å; Y312-K328 PolarHBondContact O-NZ 3.34Å; D316-K328 IonicContact OD1-NZ 2.77Å; D316-K328 PolarHBondContact OD1-NZ 2.85Å; D316-K328 IonicContact OD2-NZ 3.87Å; D316-K328 PolarHBondContact OD2-NZ 3.12Å; E324-K328 HydrophobicContact CB-CG 4.43Å; G326-K328 PolarHBondContact O-N 3.39Å; K328-V330 PolarHBondContact O-N 3.49Å; K328-V330 VanDerWaalsContact O-N 3.14Å; K328-H331 VanDerWaalsContact O-CB 3.23Å; K328-H331 WeakPolarHBondContact O-CB 3.35Å; K328-H331 PolarHBondContact O-N 3.31Å; K328-H331 PolarHBondContact O-ND1 3.19Å; K328-V639 HydrophobicContact CD-CG1 4.04Å; K328-V639 HydrophobicContact CG-CG1 4.42Å
329	L	85.4	Confident	79.1	Confident	20 Å²	20	60.8 Å²	60.8	11%	0.105	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-61.8	-24	-176.7	-173.2	55.1	0	0	0	114.9	E324 G326 W327 R488 E563	E324-L329 HydrophobicContact CB-CB 4.31Å; E324-L329 HydrophobicContact CB-CD1 3.91Å; E324-L329 HydrophobicContact CG-CD1 4.35Å; E324-L329 WeakPolarHBondContact O-CB 3.31Å; E324-L329 WeakPolarHBondContact O-CD1 3.27Å; E324-L329 WeakPolarHBondContact O-CD2 3.48Å; E324-L329 VanDerWaalsContact O-CG 3.25Å; E324-L329 WeakPolarHBondContact O-CG 3.13Å; G326-L329 WeakPolarHBondContact O-CB 3.1Å; G326-L329 PolarHBondContact O-N 2.86Å; W327-L329 VanDerWaalsContact C-N 3.31Å; W327-L329 PolarHBondContact O-N 3.37Å; L329-R488 VanDerWaalsContact CD1-CZ 3.46Å; L329-E563 HydrophobicContact CD2-CG 4.34Å
330	V	89.6	Confident	80.9	Confident	1 Å²	1	59 Å²	59	1%	0.006	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-98.3	14.2	179.6	-60.5	0	0	0	0	113.2	W327 K328 G332 D333 V334 L560 E563 Y636	W327-V330 WeakPolarHBondContact O-CG2 3.22Å; K328-V330 PolarHBondContact O-N 3.49Å; K328-V330 VanDerWaalsContact O-N 3.14Å; V330-G332 PolarHBondContact O-N 2.86Å; V330-D333 PolarHBondContact O-N 2.89Å; V330-V334 PolarHBondContact O-N 3.22Å; V330-L560 HydrophobicContact CG2-CD2 4.15Å; V330-E563 HydrophobicContact CG1-CB 4.02Å; V330-Y636 WeakPolarHBondContact CG2-OH 3.47Å
331	H	87.9	Confident	83	Confident	35 Å²	35	55.2 Å²	55.2	16%	0.162	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-39.9	178.8	71.5	-92.4	0	0	0	112.8	E324 K328 D333 V481 Y636 I641	E324-H331 IonicContact OE1-CE1 3.78Å; E324-H331 IonicContact OE2-CE1 2.69Å; E324-H331 PolarHBondContact OE2-CE1 2.93Å; E324-H331 VanDerWaalsContact OE2-CE1 3.24Å; E324-H331 IonicContact OE2-ND1 2.67Å; E324-H331 PolarHBondContact OE2-ND1 2.73Å; K328-H331 VanDerWaalsContact O-CB 3.23Å; K328-H331 WeakPolarHBondContact O-CB 3.35Å; K328-H331 PolarHBondContact O-N 3.31Å; K328-H331 PolarHBondContact O-ND1 3.19Å; H331-D333 VanDerWaalsContact C-N 3.25Å; H331-D333 PolarHBondContact O-N 3.45Å; H331-V481 HydrophobicContact CB-CG1 4.02Å; H331-V481 VanDerWaalsContact O-CG1 3.25Å; H331-V481 WeakPolarHBondContact O-CG1 3.34Å; H331-Y636 VanDerWaalsContact CA-CE1 3.47Å; H331-Y636 HydrophobicContact CB-CD1 3.91Å; H331-Y636 HydrophobicContact CB-CE1 3.71Å; H331-I641 HydrophobicContact CB-CD1 3.61Å; H331-I641 VanDerWaalsContact CD2-CG2 3.46Å; H331-I641 WeakPolarHBondContact CD2-CG2 3.38Å
332	G	86.8	Confident	85	Confident	2 Å²	2	51 Å²	51	2%	0.021	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-7.1	179.9	0	0	0	0	0	115	V330 T483 N484	V330-G332 PolarHBondContact O-N 2.86Å; G332-T483 CarbonylContact O-C 3.59Å; G332-T483 WeakPolarHBondContact O-CA 3.47Å; G332-N484 PolarHBondContact O-N 3.38Å
333	D	91.9	Very high	87.2	Confident	4 Å²	4	47.3 Å²	47.3	2%	0.021	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.4	-15.7	-176.8	-81.2	-51.9	0	0	0	114.3	V330 H331 F335 R336 R488 Y565	V330-D333 PolarHBondContact O-N 2.89Å; H331-D333 VanDerWaalsContact C-N 3.25Å; H331-D333 PolarHBondContact O-N 3.45Å; D333-F335 VanDerWaalsContact C-N 3.26Å; D333-F335 PolarHBondContact O-N 3.21Å; D333-R336 WeakPolarHBondContact O-CB 3.42Å; D333-R336 PolarHBondContact O-N 2.9Å; D333-R336 IonicContact OD1-CZ 3.3Å; D333-R336 VanDerWaalsContact OD1-CZ 3.23Å; D333-R336 IonicContact OD1-NE 2.81Å; D333-R336 PolarHBondContact OD1-NE 2.89Å; D333-R336 IonicContact OD1-NH2 3.24Å; D333-R336 PolarHBondContact OD1-NH2 3.47Å; D333-R488 VanDerWaalsContact OD2-CB 3.27Å; D333-R488 WeakPolarHBondContact OD2-CB 3.44Å; D333-R488 PolarHBondContact OD2-N 2.97Å; D333-Y565 HydrophobicContact CB-CD1 3.73Å; D333-Y565 HydrophobicContact CB-CD2 3.81Å; D333-Y565 HydrophobicContact CB-CE1 4.09Å; D333-Y565 HydrophobicContact CB-CE2 4.18Å; D333-Y565 HydrophobicContact CB-CG 3.58Å; D333-Y565 WeakPolarHBondContact O-CD2 3.5Å
334	V	92.6	Very high	89	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-31.3	-174.6	73.1	0	0	0	0	114.4	V330 L560 W567 W568 V632 Y636	V330-V334 PolarHBondContact O-N 3.22Å; V334-L560 HydrophobicContact CG2-CD1 4.45Å; V334-L560 HydrophobicContact CG2-CD2 3.75Å; V334-W567 PolarHBondContact O-NE1 3.38Å; V334-W568 PolarHBondContact O-NE1 3.24Å; V334-V632 HydrophobicContact CG2-CG1 3.69Å; V334-Y636 HydrophobicContact CB-CE2 4Å; V334-Y636 HydrophobicContact CG1-CD1 4.36Å; V334-Y636 HydrophobicContact CG1-CD2 3.9Å; V334-Y636 HydrophobicContact CG1-CE1 4.12Å; V334-Y636 HydrophobicContact CG1-CE2 3.7Å; V334-Y636 HydrophobicContact CG1-CG 4.25Å; V334-Y636 HydrophobicContact CG2-CD2 4.41Å; V334-Y636 HydrophobicContact CG2-CE2 3.65Å
335	F	93.7	Very high	90.5	Very high	5 Å²	5	35.8 Å²	35.8	2%	0.022	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	11	177.7	-64.5	-68.1	0	0	0	113.6	D333 N479 P480 V481 T483 W568 Y629 V632 R633 Y636	D333-F335 VanDerWaalsContact C-N 3.26Å; D333-F335 PolarHBondContact O-N 3.21Å; F335-N479 HydrophobicContact CB-CB 4.09Å; F335-N479 HydrophobicContact CD1-CB 4Å; F335-N479 WeakPolarHBondContact CD1-OD1 3.44Å; F335-N479 HydrophobicContact CD2-CB 3.95Å; F335-N479 HydrophobicContact CE1-CB 4.48Å; F335-N479 HydrophobicContact CE2-CB 4.45Å; F335-N479 HydrophobicContact CG-CB 3.73Å; F335-P480 HydrophobicContact CE2-CG 3.68Å; F335-P480 HydrophobicContact CZ-CG 3.86Å; F335-V481 HydrophobicContact CD2-CB 4.43Å; F335-T483 HydrophobicContact CB-CG2 4.13Å; F335-W568 HydrophobicContact CD1-CZ2 4.43Å; F335-Y629 HydrophobicContact CE1-CE2 4.46Å; F335-V632 HydrophobicContact CE1-CG1 3.94Å; F335-V632 HydrophobicContact CZ-CG1 3.86Å; F335-R633 HydrophobicContact CE1-CG 3.77Å; F335-R633 HydrophobicContact CZ-CG 4.05Å; F335-Y636 HydrophobicContact CE2-CD2 4.32Å; F335-Y636 HydrophobicContact CE2-CG 4.3Å; F335-Y636 HydrophobicContact CZ-CD2 4.39Å
336	R	93.4	Very high	91.8	Very high	58 Å²	58	32.7 Å²	32.7	22%	0.219	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-61	131.6	175.6	-175.8	177.8	-69.6	-87	-3.2	109.8	D333 N484 Q485 I486 W568	D333-R336 WeakPolarHBondContact O-CB 3.42Å; D333-R336 PolarHBondContact O-N 2.9Å; D333-R336 IonicContact OD1-CZ 3.3Å; D333-R336 VanDerWaalsContact OD1-CZ 3.23Å; D333-R336 IonicContact OD1-NE 2.81Å; D333-R336 PolarHBondContact OD1-NE 2.89Å; D333-R336 IonicContact OD1-NH2 3.24Å; D333-R336 PolarHBondContact OD1-NH2 3.47Å; R336-N484 PolarHBondContact NH2-O 2.93Å; R336-Q485 PolarHBondContact NH1-O 3.36Å; R336-I486 PolarHBondContact NH2-O 2.79Å; R336-W568 PolarHBondContact O-NE1 2.95Å
337	P	93.1	Very high	92.6	Very high	42 Å²	42	32.9 Å²	32.9	27%	0.273	16%	0.157	S	C	.	.	P	Polyproline II helix	trans	-55.7	134.2	176.6	-26.4	34.5	0	0	0	111.7	K405	P337-K405 HydrophobicContact CG-CB 4.47Å; P337-K405 HydrophobicContact CG-CD 4.08Å; P337-K405 HydrophobicContact CG-CG 4.18Å
338	P	94.4	Very high	93.2	Very high	19 Å²	19	32.9 Å²	32.9	12%	0.123	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-72.7	167.1	179.5	30.4	-33.8	0	0	0	111.6	P341 L344 L404 W568	P338-P341 HydrophobicContact CG-CB 4.48Å; P338-P341 WeakPolarHBondContact O-CD 3.31Å; P338-L344 HydrophobicContact CB-CD2 4.5Å; P338-L344 HydrophobicContact CG-CD2 3.7Å; P338-L404 HydrophobicContact CG-CD1 4.22Å; P338-W568 HydrophobicContact CB-CB 3.75Å; P338-W568 HydrophobicContact CB-CG 3.97Å; P338-W568 HydrophobicContact CG-CB 3.86Å; P338-W568 HydrophobicContact CG-CD2 4.36Å; P338-W568 HydrophobicContact CG-CG 3.9Å
339	Q	92.5	Very high	93.8	Very high	156 Å²	156	32.6 Å²	32.6	73%	0.729	16%	0.156	S	C	*	.	S	Bend	trans	-59.3	142.2	166.8	-65.7	179.5	-15.2	0	0	109.7	W569	Q339-W569 PolarHBondContact O-NE1 3.27Å
340	Y	94.8	Very high	94.3	Very high	166 Å²	166	31.7 Å²	31.7	65%	0.651	15%	0.151	S	C	*	.	S	Bend	trans	50.9	53.6	179.9	-48.3	-72.7	0	0	0	115.5	M342 I343 L344	Y340-M342 PolarHBondContact O-N 3.43Å; Y340-M342 VanDerWaalsContact O-N 3.13Å; Y340-I343 PolarHBondContact O-N 3.29Å; Y340-L344 PolarHBondContact O-N 3.43Å
341	P	95.4	Very high	94.7	Very high	33 Å²	33	31.6 Å²	31.6	21%	0.214	15%	0.151	C	C	.	.	H	α-helix	trans	-62.8	-27	-174.8	27.2	-34.2	0	0	0	113	P338 S345 Y401 L404	P338-P341 HydrophobicContact CG-CB 4.48Å; P338-P341 WeakPolarHBondContact O-CD 3.31Å; P341-S345 WeakPolarHBondContact O-CB 3.46Å; P341-S345 PolarHBondContact O-N 3.39Å; P341-S345 PolarHBondContact O-OG 2.72Å; P341-S345 VanDerWaalsContact O-OG 3.08Å; P341-Y401 HydrophobicContact CG-CE2 4.45Å; P341-L404 HydrophobicContact CB-CB 3.87Å; P341-L404 HydrophobicContact CB-CD1 3.82Å; P341-L404 HydrophobicContact CB-CG 4.49Å
342	M	96.2	Very high	95.2	Very high	59 Å²	59	31.4 Å²	31.4	29%	0.291	15%	0.15	S	C	.	.	H	α-helix	trans	-61.3	-51.8	176.1	-172.2	178.4	73	0	0	111.2	Y340 L344 S345 S346 Y401 K411 C415	Y340-M342 PolarHBondContact O-N 3.43Å; Y340-M342 VanDerWaalsContact O-N 3.13Å; M342-L344 PolarHBondContact O-N 3.02Å; M342-S345 PolarHBondContact O-N 2.93Å; M342-S345 PolarHBondContact O-OG 3.47Å; M342-S346 WeakPolarHBondContact O-CB 3.47Å; M342-S346 PolarHBondContact O-N 2.86Å; M342-S346 PolarHBondContact O-OG 3.21Å; M342-S346 VanDerWaalsContact O-OG 3.11Å; M342-Y401 HydrophobicContact CB-CD2 4.37Å; M342-Y401 HydrophobicContact CB-CE2 3.7Å; M342-Y401 HydrophobicContact CG-CE2 4.24Å; M342-K411 HydrophobicContact SD-CB 4.13Å; M342-C415 HydrophobicContact CE-CB 4.5Å
343	I	96.8	Very high	95.7	Very high	65 Å²	65	31.3 Å²	31.3	33%	0.333	15%	0.15	S	C	.	.	H	α-helix	trans	-64.1	-45	-178.3	-57.6	177.7	0	0	0	109.9	Y340 S345 S346 L347 L419 W569	Y340-I343 PolarHBondContact O-N 3.29Å; I343-S345 PolarHBondContact O-N 3.18Å; I343-S346 PolarHBondContact O-N 3.19Å; I343-L347 HydrophobicContact CG2-CD1 3.91Å; I343-L347 HydrophobicContact CG2-CG 4.22Å; I343-L347 WeakPolarHBondContact O-CG 3.22Å; I343-L347 PolarHBondContact O-N 3.32Å; I343-L419 HydrophobicContact CG2-CD2 4.26Å; I343-W569 HydrophobicContact CB-CH2 4.27Å; I343-W569 HydrophobicContact CB-CZ2 4.43Å; I343-W569 HydrophobicContact CG2-CH2 4.02Å
344	L	97.1	Very high	95.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.9	-50.2	176.5	-177	61.3	0	0	0	111.3	P338 Y340 M342 S346 L347 L348 W568 W569 F572 F625	P338-L344 HydrophobicContact CB-CD2 4.5Å; P338-L344 HydrophobicContact CG-CD2 3.7Å; Y340-L344 PolarHBondContact O-N 3.43Å; M342-L344 PolarHBondContact O-N 3.02Å; L344-S346 VanDerWaalsContact C-N 3.28Å; L344-S346 PolarHBondContact O-N 2.92Å; L344-L347 PolarHBondContact O-N 2.93Å; L344-L348 HydrophobicContact CD1-CD1 3.92Å; L344-L348 HydrophobicContact CD1-CG 4.25Å; L344-L348 HydrophobicContact CG-CD1 3.81Å; L344-L348 WeakPolarHBondContact O-CB 3.34Å; L344-L348 VanDerWaalsContact O-CG 3.25Å; L344-L348 WeakPolarHBondContact O-CG 3.28Å; L344-L348 PolarHBondContact O-N 2.95Å; L344-W568 HydrophobicContact CD2-CB 4.01Å; L344-W569 HydrophobicContact CB-CD2 4.49Å; L344-W569 HydrophobicContact CB-CH2 3.82Å; L344-W569 HydrophobicContact CB-CZ2 3.51Å; L344-W569 HydrophobicContact CB-CZ3 4.41Å; L344-W569 HydrophobicContact CD1-CD2 3.99Å; L344-W569 HydrophobicContact CD1-CE3 3.79Å; L344-W569 HydrophobicContact CD1-CH2 4.15Å; L344-W569 HydrophobicContact CD1-CZ2 4.34Å; L344-W569 HydrophobicContact CD1-CZ3 3.86Å; L344-W569 HydrophobicContact CG-CZ2 4.42Å; L344-F572 HydrophobicContact CD1-CB 4.32Å; L344-F572 HydrophobicContact CD1-CD1 4.36Å; L344-F572 HydrophobicContact CD1-CG 4.26Å; L344-F625 HydrophobicContact CD2-CE2 4.19Å
345	S	96.9	Very high	96.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-35.8	179.5	66.3	0	0	0	0	112.7	P341 M342 I343 G349 A397	P341-S345 WeakPolarHBondContact O-CB 3.46Å; P341-S345 PolarHBondContact O-N 3.39Å; P341-S345 PolarHBondContact O-OG 2.72Å; P341-S345 VanDerWaalsContact O-OG 3.08Å; M342-S345 PolarHBondContact O-N 2.93Å; M342-S345 PolarHBondContact O-OG 3.47Å; I343-S345 PolarHBondContact O-N 3.18Å; S345-G349 PolarHBondContact O-N 2.85Å; S345-A397 WeakPolarHBondContact O-CB 3.37Å
346	S	97.3	Very high	96.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-69.6	-45	177.1	-68.4	0	0	0	0	112.3	M342 I343 L344 G349 S350 G412 T416	M342-S346 WeakPolarHBondContact O-CB 3.47Å; M342-S346 PolarHBondContact O-N 2.86Å; M342-S346 PolarHBondContact O-OG 3.21Å; M342-S346 VanDerWaalsContact O-OG 3.11Å; I343-S346 PolarHBondContact O-N 3.19Å; L344-S346 VanDerWaalsContact C-N 3.28Å; L344-S346 PolarHBondContact O-N 2.92Å; S346-G349 PolarHBondContact O-N 2.83Å; S346-S350 PolarHBondContact O-N 2.85Å; S346-S350 PolarHBondContact O-OG 3.47Å; S346-G412 PolarHBondContact OG-O 2.93Å; S346-T416 WeakPolarHBondContact CA-OG1 3.38Å; S346-T416 WeakPolarHBondContact CB-OG1 3.43Å; S346-T416 PolarHBondContact OG-N 2.97Å; S346-T416 PolarHBondContact OG-OG1 2.68Å
347	L	97.8	Very high	96.5	Very high	20 Å²	20	33.3 Å²	33.3	11%	0.105	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-44	176.3	-67.9	170.5	0	0	0	111.5	I343 L344 G349 S350 G351 L419 W569 F572 W617 L618	I343-L347 HydrophobicContact CG2-CD1 3.91Å; I343-L347 HydrophobicContact CG2-CG 4.22Å; I343-L347 WeakPolarHBondContact O-CG 3.22Å; I343-L347 PolarHBondContact O-N 3.32Å; L344-L347 PolarHBondContact O-N 2.93Å; L347-G349 VanDerWaalsContact C-N 3.33Å; L347-S350 PolarHBondContact O-N 2.92Å; L347-G351 PolarHBondContact O-N 3.24Å; L347-L419 HydrophobicContact CD2-CD2 3.61Å; L347-L419 HydrophobicContact CD2-CG 4.43Å; L347-L419 HydrophobicContact CG-CD2 4.01Å; L347-W569 HydrophobicContact CD1-CH2 3.94Å; L347-W569 HydrophobicContact CD1-CZ3 3.88Å; L347-F572 HydrophobicContact CB-CZ 4.08Å; L347-F572 HydrophobicContact CD1-CE1 4.1Å; L347-F572 HydrophobicContact CD1-CZ 4.43Å; L347-W617 HydrophobicContact CD1-CH2 4.39Å; L347-L618 HydrophobicContact CB-CD2 4.13Å; L347-L618 HydrophobicContact CD2-CD2 3.74Å; L347-L618 HydrophobicContact CG-CD2 4.48Å
348	L	97.8	Very high	96.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-66.2	-35.8	176.2	-67.8	168.8	0	0	0	112.1	L344 G351 I352 L400 F572 T622 F625 Y626	L344-L348 HydrophobicContact CD1-CD1 3.92Å; L344-L348 HydrophobicContact CD1-CG 4.25Å; L344-L348 HydrophobicContact CG-CD1 3.81Å; L344-L348 WeakPolarHBondContact O-CB 3.34Å; L344-L348 VanDerWaalsContact O-CG 3.25Å; L344-L348 WeakPolarHBondContact O-CG 3.28Å; L344-L348 PolarHBondContact O-N 2.95Å; L348-G351 PolarHBondContact O-N 3.44Å; L348-I352 WeakPolarHBondContact O-CG1 3.45Å; L348-I352 PolarHBondContact O-N 3.01Å; L348-L400 HydrophobicContact CB-CD2 4.42Å; L348-L400 HydrophobicContact CD1-CD2 3.34Å; L348-F572 HydrophobicContact CD2-CD2 3.59Å; L348-F572 HydrophobicContact CD2-CE2 3.82Å; L348-F572 HydrophobicContact CG-CD2 4.46Å; L348-T622 HydrophobicContact CD2-CG2 4.05Å; L348-F625 HydrophobicContact CD1-CD1 3.47Å; L348-F625 VanDerWaalsContact CD1-CD1 3.47Å; L348-F625 HydrophobicContact CD1-CD2 4.02Å; L348-F625 HydrophobicContact CD1-CE1 3.32Å; L348-F625 HydrophobicContact CD1-CE2 3.85Å; L348-F625 HydrophobicContact CD1-CG 3.82Å; L348-F625 HydrophobicContact CD1-CZ 3.49Å; L348-F625 VanDerWaalsContact CD1-CZ 3.49Å; L348-F625 HydrophobicContact CD2-CB 3.61Å; L348-F625 HydrophobicContact CD2-CD1 3.63Å; L348-F625 HydrophobicContact CD2-CD2 4.22Å; L348-F625 HydrophobicContact CD2-CE1 4.36Å; L348-F625 HydrophobicContact CD2-CG 3.54Å; L348-F625 HydrophobicContact CG-CD1 4.19Å; L348-F625 HydrophobicContact CG-CE1 4.46Å; L348-F625 HydrophobicContact CG-CG 4.35Å; L348-Y626 HydrophobicContact CB-CE2 4.45Å
349	G	97.6	Very high	96.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.6	-49.7	171	0	0	0	0	0	112.4	S345 S346 L347 G351 I352 Q353 G393	S345-G349 PolarHBondContact O-N 2.85Å; S346-G349 PolarHBondContact O-N 2.83Å; L347-G349 VanDerWaalsContact C-N 3.33Å; G349-G351 VanDerWaalsContact C-N 3.29Å; G349-G351 PolarHBondContact O-N 2.94Å; G349-I352 PolarHBondContact O-N 3.37Å; G349-Q353 PolarHBondContact O-N 3.45Å; G349-G393 VanDerWaalsContact CA-O 3.32Å; G349-G393 WeakPolarHBondContact CA-O 3.35Å; G349-G393 WeakPolarHBondContact O-CA 3.45Å
350	S	97.3	Very high	96.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.8	-37.2	174.8	-58.2	0	0	0	0	112	S346 L347 Q353 L354	S346-S350 PolarHBondContact O-N 2.85Å; S346-S350 PolarHBondContact O-OG 3.47Å; L347-S350 PolarHBondContact O-N 2.92Å; S350-Q353 WeakPolarHBondContact O-CB 3.1Å; S350-Q353 PolarHBondContact O-N 3.32Å; S350-L354 WeakPolarHBondContact O-CB 3.15Å; S350-L354 WeakPolarHBondContact O-CG 3.17Å; S350-L354 PolarHBondContact O-N 2.99Å
351	G	97.6	Very high	96.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.2	-37.2	175.4	0	0	0	0	0	113.9	L347 L348 G349 L354 F355 T622	L347-G351 PolarHBondContact O-N 3.24Å; L348-G351 PolarHBondContact O-N 3.44Å; G349-G351 VanDerWaalsContact C-N 3.29Å; G349-G351 PolarHBondContact O-N 2.94Å; G351-L354 PolarHBondContact O-N 3.29Å; G351-F355 VanDerWaalsContact O-CB 3.3Å; G351-F355 WeakPolarHBondContact O-CB 3.5Å; G351-F355 PolarHBondContact O-N 3.47Å; G351-T622 WeakPolarHBondContact CA-OG1 3.26Å
352	I	97.8	Very high	96.5	Very high	30 Å²	30	22.5 Å²	22.5	15%	0.154	12%	0.116	C	C	.	.	H	α-helix	trans	-66.7	-42	171.9	-69.6	-62.6	0	0	0	110.9	L348 G349 L354 F355 C356 F392 T622 Y626	L348-I352 WeakPolarHBondContact O-CG1 3.45Å; L348-I352 PolarHBondContact O-N 3.01Å; G349-I352 PolarHBondContact O-N 3.37Å; I352-L354 VanDerWaalsContact C-N 3.33Å; I352-L354 PolarHBondContact O-N 3.47Å; I352-F355 PolarHBondContact O-N 3.48Å; I352-C356 PolarHBondContact O-N 2.82Å; I352-C356 PolarHBondContact O-SG 2.89Å; I352-C356 VanDerWaalsContact O-SG 3.4Å; I352-F392 HydrophobicContact CG2-CB 4.35Å; I352-T622 HydrophobicContact CD1-CG2 3.87Å; I352-T622 HydrophobicContact CG1-CG2 3.9Å; I352-Y626 HydrophobicContact CD1-CD2 3.79Å; I352-Y626 HydrophobicContact CD1-CE2 3.57Å; I352-Y626 HydrophobicContact CG1-CD2 4.29Å; I352-Y626 HydrophobicContact CG1-CE2 3.57Å
353	Q	97.4	Very high	96.3	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-58.6	-45.1	175	177.9	174.1	-4.2	0	0	111.4	G349 S350 M357 F386 M389	G349-Q353 PolarHBondContact O-N 3.45Å; S350-Q353 WeakPolarHBondContact O-CB 3.1Å; S350-Q353 PolarHBondContact O-N 3.32Å; Q353-M357 WeakPolarHBondContact O-CB 3.2Å; Q353-M357 PolarHBondContact O-N 2.8Å; Q353-M357 VanDerWaalsContact O-N 3.07Å; Q353-F386 HydrophobicContact CG-CD2 4.02Å; Q353-F386 HydrophobicContact CG-CE2 3.8Å; Q353-F386 HydrophobicContact CG-CZ 4.33Å; Q353-F386 VanDerWaalsContact NE2-CZ 3.27Å; Q353-F386 PolarHBondContact NE2-O 3.43Å; Q353-M389 HydrophobicContact CG-CB 4.06Å
354	L	97.1	Very high	95.9	Very high	5 Å²	5	22.8 Å²	22.8	3%	0.026	12%	0.116	C	C	.	.	H	α-helix	trans	-64.4	-44.6	174.3	-73.5	172.3	0	0	0	112.3	S350 G351 I352 M357 I358 F386 Y420 L618	S350-L354 WeakPolarHBondContact O-CB 3.15Å; S350-L354 WeakPolarHBondContact O-CG 3.17Å; S350-L354 PolarHBondContact O-N 2.99Å; G351-L354 PolarHBondContact O-N 3.29Å; I352-L354 VanDerWaalsContact C-N 3.33Å; I352-L354 PolarHBondContact O-N 3.47Å; L354-M357 HydrophobicContact CD2-CE 4.06Å; L354-M357 PolarHBondContact O-N 3.04Å; L354-I358 WeakPolarHBondContact O-CB 3.32Å; L354-I358 VanDerWaalsContact O-CG1 3.28Å; L354-I358 WeakPolarHBondContact O-CG1 3.5Å; L354-I358 PolarHBondContact O-N 3.24Å; L354-F386 HydrophobicContact CD2-CD2 4.12Å; L354-F386 HydrophobicContact CD2-CE2 3.83Å; L354-F386 HydrophobicContact CG-CE2 4.33Å; L354-Y420 HydrophobicContact CD1-CE1 4.09Å; L354-Y420 HydrophobicContact CD1-CE2 4.19Å; L354-Y420 HydrophobicContact CD2-CE1 3.86Å; L354-Y420 HydrophobicContact CG-CE1 4.19Å; L354-L618 HydrophobicContact CD1-CB 4.06Å; L354-L618 HydrophobicContact CD1-CD1 4.18Å
355	F	97.7	Very high	95.4	Very high	50 Å²	50	23 Å²	23	22%	0.219	12%	0.117	C	C	.	.	H	α-helix	trans	-58.3	-50.6	178.6	176.1	-94.8	0	0	0	111.8	G351 I352 M357 I358 L359 F541 V545 L619 I623	G351-F355 VanDerWaalsContact O-CB 3.3Å; G351-F355 WeakPolarHBondContact O-CB 3.5Å; G351-F355 PolarHBondContact O-N 3.47Å; I352-F355 PolarHBondContact O-N 3.48Å; F355-M357 PolarHBondContact O-N 2.89Å; F355-I358 PolarHBondContact O-N 3.4Å; F355-L359 HydrophobicContact CE1-CD2 4.14Å; F355-L359 HydrophobicContact CZ-CD2 4.4Å; F355-L359 VanDerWaalsContact O-CB 3.24Å; F355-L359 WeakPolarHBondContact O-CB 3.19Å; F355-L359 PolarHBondContact O-N 3.49Å; F355-F541 AromaticContact CD2-CZ 3.85Å; F355-F541 HydrophobicContact CD2-CZ 3.85Å; F355-F541 HydrophobicContact CE2-CE1 4.03Å; F355-F541 AromaticContact CE2-CZ 3.71Å; F355-F541 HydrophobicContact CE2-CZ 3.71Å; F355-V545 HydrophobicContact CE2-CG2 3.77Å; F355-L619 HydrophobicContact CB-CD1 3.79Å; F355-L619 HydrophobicContact CD2-CD1 3.98Å; F355-L619 HydrophobicContact CG-CD1 4.4Å; F355-I623 HydrophobicContact CD2-CD1 4.02Å; F355-I623 HydrophobicContact CD2-CG1 3.91Å; F355-I623 HydrophobicContact CE2-CD1 4.29Å; F355-I623 HydrophobicContact CE2-CG1 4.22Å
356	C	97.3	Very high	94.8	Very high	27 Å²	27	26.2 Å²	26.2	18%	0.182	13%	0.133	C	C	.	.	H	α-helix	trans	-63.5	-41.7	178.8	-67.7	0	0	0	0	111.8	I352 I360 M389	I352-C356 PolarHBondContact O-N 2.82Å; I352-C356 PolarHBondContact O-SG 2.89Å; I352-C356 VanDerWaalsContact O-SG 3.4Å; C356-I360 WeakPolarHBondContact O-CD1 3.41Å; C356-I360 VanDerWaalsContact O-CG1 3.24Å; C356-I360 WeakPolarHBondContact O-CG1 3.23Å; C356-I360 PolarHBondContact O-N 3.13Å; C356-I360 VanDerWaalsContact O-N 3.09Å; C356-M389 HydrophobicContact CB-CB 4.22Å; C356-M389 HydrophobicContact CB-CG 3.78Å; C356-M389 HydrophobicContact CB-SD 3.62Å
357	M	96.2	Very high	94.2	Very high	27 Å²	27	31.2 Å²	31.2	13%	0.133	16%	0.16	C	C	.	.	H	α-helix	trans	-60.3	-53.6	176.3	178.8	-156.4	70.1	0	0	111	Q353 L354 F355 L359 I360 V361 L385 F386 M389	Q353-M357 WeakPolarHBondContact O-CB 3.2Å; Q353-M357 PolarHBondContact O-N 2.8Å; Q353-M357 VanDerWaalsContact O-N 3.07Å; L354-M357 HydrophobicContact CD2-CE 4.06Å; L354-M357 PolarHBondContact O-N 3.04Å; F355-M357 PolarHBondContact O-N 2.89Å; M357-L359 PolarHBondContact O-N 3.49Å; M357-I360 PolarHBondContact O-N 3.41Å; M357-V361 HydrophobicContact CG-CG2 4.26Å; M357-V361 WeakPolarHBondContact O-CB 3.46Å; M357-V361 VanDerWaalsContact O-CG2 3.23Å; M357-V361 WeakPolarHBondContact O-CG2 3.49Å; M357-V361 PolarHBondContact O-N 2.84Å; M357-L385 HydrophobicContact CG-CB 4.01Å; M357-F386 HydrophobicContact CG-CB 4.29Å; M357-F386 HydrophobicContact SD-CB 3.59Å; M357-F386 VanDerWaalsContact SD-CB 3.59Å; M357-F386 HydrophobicContact SD-CD2 3.84Å; M357-F386 HydrophobicContact SD-CG 4.16Å; M357-M389 HydrophobicContact CB-CG 4.39Å
358	I	95.2	Very high	93.1	Very high	41 Å²	41	32 Å²	32	21%	0.21	17%	0.173	C	C	.	.	H	α-helix	trans	-62.1	-44.7	-177.6	-69.2	170.7	0	0	0	110.7	L354 F355 I360 V361 I362 F541 L619	L354-I358 WeakPolarHBondContact O-CB 3.32Å; L354-I358 VanDerWaalsContact O-CG1 3.28Å; L354-I358 WeakPolarHBondContact O-CG1 3.5Å; L354-I358 PolarHBondContact O-N 3.24Å; F355-I358 PolarHBondContact O-N 3.4Å; I358-I360 PolarHBondContact O-N 3.42Å; I358-V361 PolarHBondContact O-N 2.82Å; I358-I362 HydrophobicContact CG2-CD1 3.41Å; I358-I362 VanDerWaalsContact CG2-CD1 3.41Å; I358-I362 HydrophobicContact CG2-CG1 4.1Å; I358-I362 WeakPolarHBondContact O-CB 3.28Å; I358-I362 VanDerWaalsContact O-CG1 3.26Å; I358-I362 WeakPolarHBondContact O-CG1 3.26Å; I358-I362 PolarHBondContact O-N 2.88Å; I358-F541 HydrophobicContact CB-CE2 4.38Å; I358-F541 HydrophobicContact CG2-CD2 3.96Å; I358-F541 HydrophobicContact CG2-CE2 3.54Å; I358-F541 HydrophobicContact CG2-CZ 4.05Å; I358-L619 HydrophobicContact CD1-CD1 4.33Å; I358-L619 HydrophobicContact CD1-CD2 3.82Å
359	L	95.6	Very high	92	Very high	61 Å²	61	38 Å²	38	32%	0.319	20%	0.202	S	C	.	.	H	α-helix	trans	-57.5	-48	178.2	176.7	65.3	0	0	0	111.5	F355 M357 F363 F538 F541	F355-L359 HydrophobicContact CE1-CD2 4.14Å; F355-L359 HydrophobicContact CZ-CD2 4.4Å; F355-L359 VanDerWaalsContact O-CB 3.24Å; F355-L359 WeakPolarHBondContact O-CB 3.19Å; F355-L359 PolarHBondContact O-N 3.49Å; M357-L359 PolarHBondContact O-N 3.49Å; L359-F363 WeakPolarHBondContact O-CB 3.43Å; L359-F363 PolarHBondContact O-N 3.47Å; L359-F538 HydrophobicContact CD1-CE2 3.98Å; L359-F541 HydrophobicContact CB-CE1 4.08Å; L359-F541 HydrophobicContact CB-CZ 4.44Å; L359-F541 HydrophobicContact CD1-CD1 4.3Å; L359-F541 HydrophobicContact CD1-CE1 3.85Å
360	I	94.5	Very high	91.1	Very high	58 Å²	58	38.4 Å²	38.4	30%	0.297	21%	0.205	S	C	.	.	H	α-helix	trans	-69.3	-43.8	-179.6	-63.6	167.2	0	0	0	110.6	C356 M357 I358 I362 F363 V364 L385 M389	C356-I360 WeakPolarHBondContact O-CD1 3.41Å; C356-I360 VanDerWaalsContact O-CG1 3.24Å; C356-I360 WeakPolarHBondContact O-CG1 3.23Å; C356-I360 PolarHBondContact O-N 3.13Å; C356-I360 VanDerWaalsContact O-N 3.09Å; M357-I360 PolarHBondContact O-N 3.41Å; I358-I360 PolarHBondContact O-N 3.42Å; I360-I362 PolarHBondContact O-N 2.86Å; I360-F363 PolarHBondContact O-N 3.34Å; I360-V364 HydrophobicContact CG2-CG2 4.09Å; I360-V364 WeakPolarHBondContact O-CB 3.28Å; I360-V364 VanDerWaalsContact O-CG2 3.25Å; I360-V364 WeakPolarHBondContact O-CG2 3.4Å; I360-V364 PolarHBondContact O-N 3.39Å; I360-L385 HydrophobicContact CB-CD1 4.08Å; I360-L385 HydrophobicContact CD1-CD2 4.5Å; I360-L385 HydrophobicContact CG2-CD1 3.61Å; I360-L385 HydrophobicContact CG2-CD2 3.93Å; I360-L385 HydrophobicContact CG2-CG 4.45Å; I360-M389 HydrophobicContact CD1-CE 3.62Å; I360-M389 HydrophobicContact CD1-SD 3.84Å
361	V	93.1	Very high	90	Very high	15 Å²	15	39.7 Å²	39.7	9%	0.091	21%	0.213	C	C	.	.	H	α-helix	trans	-58.6	-50.3	178.2	169.1	0	0	0	0	110.7	M357 I358 F363 V364 A365 L370 A382 L385	M357-V361 HydrophobicContact CG-CG2 4.26Å; M357-V361 WeakPolarHBondContact O-CB 3.46Å; M357-V361 VanDerWaalsContact O-CG2 3.23Å; M357-V361 WeakPolarHBondContact O-CG2 3.49Å; M357-V361 PolarHBondContact O-N 2.84Å; I358-V361 PolarHBondContact O-N 2.82Å; V361-F363 VanDerWaalsContact C-N 3.35Å; V361-F363 PolarHBondContact O-N 3.39Å; V361-V364 PolarHBondContact O-N 3.01Å; V361-A365 WeakPolarHBondContact O-CB 3.34Å; V361-A365 PolarHBondContact O-N 3.27Å; V361-L370 HydrophobicContact CG1-CD1 4.32Å; V361-A382 HydrophobicContact CG2-CB 4.07Å; V361-L385 HydrophobicContact CG2-CD1 3.57Å
362	I	91.9	Very high	88.8	Confident	14 Å²	14	41 Å²	41	7%	0.072	22%	0.222	C	C	.	.	H	α-helix	trans	-65.6	-40.8	-179.4	-62.8	172.4	0	0	0	110.4	I358 I360 A365 M366 L537 F538 F541	I358-I362 HydrophobicContact CG2-CD1 3.41Å; I358-I362 VanDerWaalsContact CG2-CD1 3.41Å; I358-I362 HydrophobicContact CG2-CG1 4.1Å; I358-I362 WeakPolarHBondContact O-CB 3.28Å; I358-I362 VanDerWaalsContact O-CG1 3.26Å; I358-I362 WeakPolarHBondContact O-CG1 3.26Å; I358-I362 PolarHBondContact O-N 2.88Å; I360-I362 PolarHBondContact O-N 2.86Å; I362-A365 PolarHBondContact O-N 2.87Å; I362-M366 WeakPolarHBondContact O-CB 2.88Å; I362-M366 PolarHBondContact O-N 3.33Å; I362-L537 HydrophobicContact CD1-CD2 4.28Å; I362-L537 HydrophobicContact CD1-CG 4.13Å; I362-L537 HydrophobicContact CG1-CD2 4.15Å; I362-L537 HydrophobicContact CG1-CG 4.41Å; I362-L537 HydrophobicContact CG2-CB 4.48Å; I362-L537 HydrophobicContact CG2-CG 4.31Å; I362-F538 HydrophobicContact CB-CD2 4.41Å; I362-F538 HydrophobicContact CG2-CB 3.61Å; I362-F538 HydrophobicContact CG2-CD2 3.78Å; I362-F538 HydrophobicContact CG2-CG 4.19Å; I362-F541 HydrophobicContact CD1-CB 4.08Å; I362-F541 HydrophobicContact CD1-CD2 4.09Å; I362-F541 HydrophobicContact CD1-CG 4.04Å
363	F	91.4	Very high	87.7	Confident	96 Å²	96	40.2 Å²	40.2	42%	0.421	22%	0.219	S	C	.	.	H	α-helix	trans	-61.7	-47.4	177.6	-179.8	-98.5	0	0	0	112.3	L359 I360 V361 A365 M366 L367 F538	L359-F363 WeakPolarHBondContact O-CB 3.43Å; L359-F363 PolarHBondContact O-N 3.47Å; I360-F363 PolarHBondContact O-N 3.34Å; V361-F363 VanDerWaalsContact C-N 3.35Å; V361-F363 PolarHBondContact O-N 3.39Å; F363-A365 VanDerWaalsContact C-N 3.32Å; F363-A365 PolarHBondContact O-N 3.07Å; F363-M366 HydrophobicContact CD2-CE 3.46Å; F363-M366 VanDerWaalsContact CD2-CE 3.46Å; F363-M366 HydrophobicContact CE2-CE 3.77Å; F363-M366 HydrophobicContact CG-CE 4.34Å; F363-M366 WeakPolarHBondContact O-CB 3.42Å; F363-M366 PolarHBondContact O-N 2.93Å; F363-L367 HydrophobicContact CD1-CD1 4.24Å; F363-L367 HydrophobicContact CE1-CD1 3.71Å; F363-L367 HydrophobicContact CE1-CG 4.43Å; F363-L367 HydrophobicContact CZ-CD1 4.17Å; F363-L367 WeakPolarHBondContact O-CG 3.35Å; F363-L367 PolarHBondContact O-N 3.23Å; F363-F538 HydrophobicContact CB-CE2 4.26Å; F363-F538 HydrophobicContact CD2-CE2 4.26Å; F363-F538 HydrophobicContact CD2-CZ 4.2Å
364	V	89.6	Confident	86.8	Confident	34 Å²	34	41.3 Å²	41.3	21%	0.206	23%	0.227	C	C	.	.	H	α-helix	trans	-68.3	-33.7	178.1	179.4	0	0	0	0	111.2	I360 V361 L367 M369 L370	I360-V364 HydrophobicContact CG2-CG2 4.09Å; I360-V364 WeakPolarHBondContact O-CB 3.28Å; I360-V364 VanDerWaalsContact O-CG2 3.25Å; I360-V364 WeakPolarHBondContact O-CG2 3.4Å; I360-V364 PolarHBondContact O-N 3.39Å; V361-V364 PolarHBondContact O-N 3.01Å; V364-L367 PolarHBondContact O-N 3.1Å; V364-M369 HydrophobicContact CG1-CB 3.81Å; V364-M369 HydrophobicContact CG1-CG 4.48Å; V364-M369 HydrophobicContact CG1-SD 4.1Å; V364-M369 PolarHBondContact O-N 3.33Å; V364-L370 HydrophobicContact CB-CD1 4.05Å; V364-L370 HydrophobicContact CB-CG 4.47Å; V364-L370 HydrophobicContact CG1-CD1 3.95Å; V364-L370 HydrophobicContact CG1-CG 3.88Å
365	A	86.7	Confident	86	Confident	3 Å²	3	42.6 Å²	42.6	3%	0.025	23%	0.231	C	C	.	.	H	α-helix	trans	-67.5	-38.9	173.7	0	0	0	0	0	112.5	V361 I362 F363 L367 G368 L370 F534	V361-A365 WeakPolarHBondContact O-CB 3.34Å; V361-A365 PolarHBondContact O-N 3.27Å; I362-A365 PolarHBondContact O-N 2.87Å; F363-A365 VanDerWaalsContact C-N 3.32Å; F363-A365 PolarHBondContact O-N 3.07Å; A365-L367 VanDerWaalsContact C-N 3.27Å; A365-L367 PolarHBondContact O-N 3.47Å; A365-G368 WeakPolarHBondContact O-CA 3.21Å; A365-G368 PolarHBondContact O-N 3.09Å; A365-L370 HydrophobicContact CB-CB 4.01Å; A365-L370 HydrophobicContact CB-CD1 4.29Å; A365-F534 HydrophobicContact CB-CB 3.99Å; A365-F534 HydrophobicContact CB-CD1 3.55Å; A365-F534 HydrophobicContact CB-CD2 4.05Å; A365-F534 HydrophobicContact CB-CE1 3.98Å; A365-F534 HydrophobicContact CB-CE2 4.43Å; A365-F534 HydrophobicContact CB-CG 3.59Å; A365-F534 HydrophobicContact CB-CZ 4.4Å
366	M	84.8	Confident	85.3	Confident	68 Å²	68	40.2 Å²	40.2	34%	0.335	22%	0.221	S	C	.	.	H	α-helix	trans	-61.9	-33.2	173.6	173.7	-175.3	61.2	0	0	112.2	I362 F363 G368 F538	I362-M366 WeakPolarHBondContact O-CB 2.88Å; I362-M366 PolarHBondContact O-N 3.33Å; F363-M366 HydrophobicContact CD2-CE 3.46Å; F363-M366 VanDerWaalsContact CD2-CE 3.46Å; F363-M366 HydrophobicContact CE2-CE 3.77Å; F363-M366 HydrophobicContact CG-CE 4.34Å; F363-M366 WeakPolarHBondContact O-CB 3.42Å; F363-M366 PolarHBondContact O-N 2.93Å; M366-G368 PolarHBondContact O-N 3.4Å; M366-F538 HydrophobicContact CE-CD1 3.86Å; M366-F538 HydrophobicContact CE-CD2 4.47Å; M366-F538 HydrophobicContact CE-CE1 3.96Å; M366-F538 HydrophobicContact CE-CG 4.12Å; M366-F538 HydrophobicContact CE-CZ 4.32Å; M366-F538 HydrophobicContact SD-CB 3.94Å; M366-F538 HydrophobicContact SD-CD1 3.53Å; M366-F538 VanDerWaalsContact SD-CD1 3.53Å; M366-F538 HydrophobicContact SD-CE1 4.18Å; M366-F538 HydrophobicContact SD-CG 3.8Å
367	L	83.5	Confident	84.8	Confident	105 Å²	105	40 Å²	40	55%	0.55	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	0.1	172.5	-63.9	177.4	0	0	0	113.6	F363 V364 A365 M369	F363-L367 HydrophobicContact CD1-CD1 4.24Å; F363-L367 HydrophobicContact CE1-CD1 3.71Å; F363-L367 HydrophobicContact CE1-CG 4.43Å; F363-L367 HydrophobicContact CZ-CD1 4.17Å; F363-L367 WeakPolarHBondContact O-CG 3.35Å; F363-L367 PolarHBondContact O-N 3.23Å; V364-L367 PolarHBondContact O-N 3.1Å; A365-L367 VanDerWaalsContact C-N 3.27Å; A365-L367 PolarHBondContact O-N 3.47Å; L367-M369 VanDerWaalsContact C-N 3.27Å; L367-M369 HydrophobicContact CB-CG 4.38Å; L367-M369 PolarHBondContact O-N 2.83Å
368	G	75.9	Confident	84.4	Confident	37 Å²	37	41 Å²	41	38%	0.381	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	-3.8	178.9	0	0	0	0	0	114.9	A365 M366 L370 S371	A365-G368 WeakPolarHBondContact O-CA 3.21Å; A365-G368 PolarHBondContact O-N 3.09Å; M366-G368 PolarHBondContact O-N 3.4Å; G368-L370 VanDerWaalsContact C-N 3.32Å; G368-L370 PolarHBondContact O-N 3.37Å; G368-S371 WeakPolarHBondContact O-CB 3.44Å; G368-S371 PolarHBondContact O-N 3.49Å; G368-S371 PolarHBondContact O-OG 2.89Å
369	M	74.9	Confident	84.1	Confident	126 Å²	126	42.5 Å²	42.5	62%	0.621	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-26.1	-176.4	-63.2	179.8	68.9	0	0	113.3	V364 L367	V364-M369 HydrophobicContact CG1-CB 3.81Å; V364-M369 HydrophobicContact CG1-CG 4.48Å; V364-M369 HydrophobicContact CG1-SD 4.1Å; V364-M369 PolarHBondContact O-N 3.33Å; L367-M369 VanDerWaalsContact C-N 3.27Å; L367-M369 HydrophobicContact CB-CG 4.38Å; L367-M369 PolarHBondContact O-N 2.83Å
370	L	77.5	Confident	83.9	Confident	9 Å²	9	40.6 Å²	40.6	5%	0.047	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	33.9	176.5	-56.6	171.9	0	0	0	111.9	V361 V364 A365 G368 A377 L378 T381	V361-L370 HydrophobicContact CG1-CD1 4.32Å; V364-L370 HydrophobicContact CB-CD1 4.05Å; V364-L370 HydrophobicContact CB-CG 4.47Å; V364-L370 HydrophobicContact CG1-CD1 3.95Å; V364-L370 HydrophobicContact CG1-CG 3.88Å; A365-L370 HydrophobicContact CB-CB 4.01Å; A365-L370 HydrophobicContact CB-CD1 4.29Å; G368-L370 VanDerWaalsContact C-N 3.32Å; G368-L370 PolarHBondContact O-N 3.37Å; L370-A377 HydrophobicContact CD2-CB 4.22Å; L370-L378 HydrophobicContact CB-CB 4.44Å; L370-T381 HydrophobicContact CD1-CG2 3.98Å; L370-T381 HydrophobicContact CD2-CG2 4.11Å; L370-T381 WeakPolarHBondContact CD2-OG1 3.25Å
371	S	73.3	Confident	83.7	Confident	26 Å²	26	39.8 Å²	39.8	18%	0.182	22%	0.223	C	C	.	.			trans	-64.2	157.4	176.6	60.7	0	0	0	0	111.9	G368 S373 S374	G368-S371 WeakPolarHBondContact O-CB 3.44Å; G368-S371 PolarHBondContact O-N 3.49Å; G368-S371 PolarHBondContact O-OG 2.89Å; S371-S373 PolarHBondContact O-N 2.88Å; S371-S374 PolarHBondContact O-N 2.87Å
372	P	73.8	Confident	83.7	Confident	27 Å²	27	40 Å²	40	18%	0.175	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-21.7	174.5	-27.4	36.3	0	0	0	114.5	W267 L271 S374 F530	W267-P372 HydrophobicContact CE3-CB 4.48Å; W267-P372 HydrophobicContact CH2-CB 4.45Å; W267-P372 HydrophobicContact CZ3-CB 3.95Å; L271-P372 HydrophobicContact CD2-CG 4.44Å; P372-S374 VanDerWaalsContact C-N 3.26Å; P372-S374 PolarHBondContact O-N 3.44Å; P372-F530 HydrophobicContact CB-CD1 4.02Å; P372-F530 HydrophobicContact CB-CE1 4.37Å; P372-F530 HydrophobicContact CG-CD1 4.43Å
373	S	74.7	Confident	83.7	Confident	15 Å²	15	40.8 Å²	40.8	11%	0.105	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-39.6	172.1	-172.2	0	0	0	0	113.2	W267 S371 R375	W267-S373 VanDerWaalsContact NE1-CB 3.33Å; W267-S373 PolarHBondContact NE1-OG 3.49Å; S371-S373 PolarHBondContact O-N 2.88Å; S373-R375 PolarHBondContact O-N 3.36Å
374	S	77.6	Confident	83.8	Confident	23 Å²	23	40.2 Å²	40.2	16%	0.161	23%	0.23	C	C	.	.	S	Bend	trans	-90.1	81.8	176.7	-62.4	0	0	0	0	109.8	S371 P372 G376 A377	S371-S374 PolarHBondContact O-N 2.87Å; P372-S374 VanDerWaalsContact C-N 3.26Å; P372-S374 PolarHBondContact O-N 3.44Å; S374-G376 PolarHBondContact O-N 3.32Å; S374-A377 WeakPolarHBondContact O-CB 3.2Å; S374-A377 PolarHBondContact O-N 2.98Å
375	R	80.1	Confident	84	Confident	32 Å²	32	40 Å²	40	12%	0.121	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	131.8	-176.2	-66.3	-176.7	-68.2	158.9	-6.6	112.2	N75 E78 N137 S373 A377	N75-R375 PolarHBondContact ND2-O 2.88Å; E78-R375 HydrophobicContact CG-CB 4.21Å; E78-R375 WeakPolarHBondContact OE1-CB 3.47Å; E78-R375 IonicContact OE1-CZ 2.71Å; E78-R375 IonicContact OE1-NE 3.78Å; N137-R375 PolarHBondContact OD1-NH2 3.42Å; S373-R375 PolarHBondContact O-N 3.36Å; R375-A377 PolarHBondContact O-N 3.25Å
376	G	84.3	Confident	84.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	-7.2	-177.5	0	0	0	0	0	116.3	N75 G77 S374 L378 M379 T380	N75-G376 WeakPolarHBondContact OD1-CA 3.24Å; G77-G376 WeakPolarHBondContact CA-O 3.12Å; S374-G376 PolarHBondContact O-N 3.32Å; G376-L378 PolarHBondContact O-N 3.09Å; G376-M379 PolarHBondContact O-N 3.4Å; G376-T380 WeakPolarHBondContact O-CB 3.47Å; G376-T380 PolarHBondContact O-N 2.77Å; G376-T380 PolarHBondContact O-OG1 3.09Å
377	A	86.7	Confident	84.8	Confident	24 Å²	24	38.9 Å²	38.9	20%	0.198	22%	0.221	C	C	.	.	H	α-helix	trans	-63.3	-40.8	-175.9	0	0	0	0	0	112.6	L370 S374 R375 M379 T380 T381	L370-A377 HydrophobicContact CD2-CB 4.22Å; S374-A377 WeakPolarHBondContact O-CB 3.2Å; S374-A377 PolarHBondContact O-N 2.98Å; R375-A377 PolarHBondContact O-N 3.25Å; A377-M379 PolarHBondContact O-N 3.36Å; A377-T380 PolarHBondContact O-N 3.24Å; A377-T381 WeakPolarHBondContact O-CB 3.49Å; A377-T381 PolarHBondContact O-N 2.89Å; A377-T381 PolarHBondContact O-OG1 3Å
378	L	87.8	Confident	85.4	Confident	47 Å²	47	39.2 Å²	39.2	25%	0.246	22%	0.218	C	C	.	.	H	α-helix	trans	-58.5	-48.8	177.9	-173.4	155.8	0	0	0	111.7	L370 G376 A382 F534	L370-L378 HydrophobicContact CB-CB 4.44Å; G376-L378 PolarHBondContact O-N 3.09Å; L378-A382 VanDerWaalsContact O-CB 3.3Å; L378-A382 WeakPolarHBondContact O-CB 3.39Å; L378-A382 PolarHBondContact O-N 3.17Å; L378-F534 HydrophobicContact CD1-CE1 3.8Å; L378-F534 HydrophobicContact CD1-CZ 3.77Å
379	M	88.6	Confident	86.4	Confident	72 Å²	72	38.4 Å²	38.4	36%	0.355	20%	0.204	S	C	.	.	H	α-helix	trans	-66.6	-45.5	-180	-177.9	63.8	76.1	0	0	111.2	L80 G376 A377 T381 A382 C383	L80-M379 HydrophobicContact CB-CG 4.18Å; L80-M379 HydrophobicContact CD1-CG 3.89Å; L80-M379 HydrophobicContact CD1-SD 4.44Å; G376-M379 PolarHBondContact O-N 3.4Å; A377-M379 PolarHBondContact O-N 3.36Å; M379-T381 PolarHBondContact O-N 3.22Å; M379-A382 PolarHBondContact O-N 3.3Å; M379-C383 PolarHBondContact O-N 3.48Å; M379-C383 PolarHBondContact O-SG 2.98Å; M379-C383 VanDerWaalsContact O-SG 3.39Å
380	T	90.7	Very high	87.4	Confident	22 Å²	22	32.4 Å²	32.4	14%	0.135	18%	0.175	C	C	.	.	H	α-helix	trans	-57.4	-51.6	177.2	-58.5	0	0	0	0	110.9	N75 L76 G77 G376 A377 A382 C383 F384	N75-T380 PolarHBondContact OD1-OG1 3.4Å; N75-T380 VanDerWaalsContact OD1-OG1 3.06Å; L76-T380 HydrophobicContact CB-CG2 4.43Å; G77-T380 WeakPolarHBondContact CA-OG1 3.43Å; G77-T380 PolarHBondContact N-OG1 3.31Å; G376-T380 WeakPolarHBondContact O-CB 3.47Å; G376-T380 PolarHBondContact O-N 2.77Å; G376-T380 PolarHBondContact O-OG1 3.09Å; A377-T380 PolarHBondContact O-N 3.24Å; T380-A382 PolarHBondContact O-N 3.48Å; T380-C383 PolarHBondContact O-N 3.46Å; T380-F384 HydrophobicContact CG2-CD2 3.68Å; T380-F384 HydrophobicContact CG2-CE2 3.54Å; T380-F384 WeakPolarHBondContact O-CD2 3.43Å; T380-F384 PolarHBondContact O-N 2.84Å
381	T	91	Very high	88.3	Confident	41 Å²	41	34 Å²	34	25%	0.252	19%	0.185	S	C	.	.	H	α-helix	trans	-60.9	-42.1	178.2	-63.6	0	0	0	0	111.7	L370 A377 M379 F384 L385	L370-T381 HydrophobicContact CD1-CG2 3.98Å; L370-T381 HydrophobicContact CD2-CG2 4.11Å; L370-T381 WeakPolarHBondContact CD2-OG1 3.25Å; A377-T381 WeakPolarHBondContact O-CB 3.49Å; A377-T381 PolarHBondContact O-N 2.89Å; A377-T381 PolarHBondContact O-OG1 3Å; M379-T381 PolarHBondContact O-N 3.22Å; T381-F384 PolarHBondContact O-N 3.44Å; T381-L385 HydrophobicContact CG2-CD1 3.57Å; T381-L385 HydrophobicContact CG2-CG 4.11Å; T381-L385 VanDerWaalsContact O-CB 3.27Å; T381-L385 WeakPolarHBondContact O-CB 3.49Å; T381-L385 VanDerWaalsContact O-CG 3.26Å; T381-L385 WeakPolarHBondContact O-CG 3.49Å; T381-L385 PolarHBondContact O-N 3.13Å
382	A	92.9	Very high	89.4	Confident	18 Å²	18	38 Å²	38	15%	0.149	20%	0.199	C	C	.	.	H	α-helix	trans	-60.9	-45.3	175.7	0	0	0	0	0	112	V361 L378 M379 T380 F386	V361-A382 HydrophobicContact CG2-CB 4.07Å; L378-A382 VanDerWaalsContact O-CB 3.3Å; L378-A382 WeakPolarHBondContact O-CB 3.39Å; L378-A382 PolarHBondContact O-N 3.17Å; M379-A382 PolarHBondContact O-N 3.3Å; T380-A382 PolarHBondContact O-N 3.48Å; A382-F386 WeakPolarHBondContact O-CB 3.41Å; A382-F386 PolarHBondContact O-N 3.31Å
383	C	92.4	Very high	90.5	Very high	32 Å²	32	36.7 Å²	36.7	22%	0.216	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-47.7	176.1	-69.9	0	0	0	0	112.2	L76 M379 T380 F386 M387	L76-C383 HydrophobicContact CD2-CB 4.26Å; M379-C383 PolarHBondContact O-N 3.48Å; M379-C383 PolarHBondContact O-SG 2.98Å; M379-C383 VanDerWaalsContact O-SG 3.39Å; T380-C383 PolarHBondContact O-N 3.46Å; C383-F386 WeakPolarHBondContact O-CB 3.45Å; C383-F386 PolarHBondContact O-N 3.01Å; C383-M387 WeakPolarHBondContact O-CG 3.15Å; C383-M387 PolarHBondContact O-N 3.38Å; C383-M387 VanDerWaalsContact O-N 3.15Å
384	F	92.7	Very high	91.6	Very high	84 Å²	84	36 Å²	36	37%	0.368	19%	0.186	S	C	.	.	H	α-helix	trans	-64.5	-46.7	178.6	-79.2	-70.4	0	0	0	112.3	T380 T381 F386 M387 F388 M455	T380-F384 HydrophobicContact CG2-CD2 3.68Å; T380-F384 HydrophobicContact CG2-CE2 3.54Å; T380-F384 WeakPolarHBondContact O-CD2 3.43Å; T380-F384 PolarHBondContact O-N 2.84Å; T381-F384 PolarHBondContact O-N 3.44Å; F384-F386 VanDerWaalsContact C-N 3.3Å; F384-F386 PolarHBondContact O-N 3.45Å; F384-M387 HydrophobicContact CB-CE 4.36Å; F384-M387 HydrophobicContact CD1-CE 3.27Å; F384-M387 HydrophobicContact CE1-CE 3.67Å; F384-M387 HydrophobicContact CG-CE 3.96Å; F384-M387 WeakPolarHBondContact O-CB 3.49Å; F384-M387 PolarHBondContact O-N 3.13Å; F384-M387 VanDerWaalsContact O-N 3.12Å; F384-F388 HydrophobicContact CB-CE2 4.38Å; F384-F388 HydrophobicContact CD1-CE2 4.35Å; F384-F388 WeakPolarHBondContact O-CD2 3.45Å; F384-F388 PolarHBondContact O-N 2.88Å; F384-M455 HydrophobicContact CE1-SD 4.44Å
385	L	94.4	Very high	92.6	Very high	30 Å²	30	38.1 Å²	38.1	16%	0.157	19%	0.192	C	C	.	.	H	α-helix	trans	-60.6	-41.3	176.3	-73.3	173	0	0	0	111.1	M357 I360 V361 T381 M387 F388 M389	M357-L385 HydrophobicContact CG-CB 4.01Å; I360-L385 HydrophobicContact CB-CD1 4.08Å; I360-L385 HydrophobicContact CD1-CD2 4.5Å; I360-L385 HydrophobicContact CG2-CD1 3.61Å; I360-L385 HydrophobicContact CG2-CD2 3.93Å; I360-L385 HydrophobicContact CG2-CG 4.45Å; V361-L385 HydrophobicContact CG2-CD1 3.57Å; T381-L385 HydrophobicContact CG2-CD1 3.57Å; T381-L385 HydrophobicContact CG2-CG 4.11Å; T381-L385 VanDerWaalsContact O-CB 3.27Å; T381-L385 WeakPolarHBondContact O-CB 3.49Å; T381-L385 VanDerWaalsContact O-CG 3.26Å; T381-L385 WeakPolarHBondContact O-CG 3.49Å; T381-L385 PolarHBondContact O-N 3.13Å; L385-M387 VanDerWaalsContact C-N 3.28Å; L385-M387 PolarHBondContact O-N 3.25Å; L385-F388 PolarHBondContact O-N 2.91Å; L385-M389 HydrophobicContact CD2-CE 4.2Å; L385-M389 VanDerWaalsContact O-CB 3.28Å; L385-M389 WeakPolarHBondContact O-CB 3.24Å; L385-M389 WeakPolarHBondContact O-CG 3.27Å; L385-M389 PolarHBondContact O-N 3.33Å
386	F	94.7	Very high	93.3	Very high	34 Å²	34	37.4 Å²	37.4	15%	0.149	19%	0.192	C	C	.	.	H	α-helix	trans	-55.5	-45.1	174.5	-174.6	-102.8	0	0	0	111.8	Q353 L354 M357 A382 C383 F384 G390 Y420 P421	Q353-F386 HydrophobicContact CG-CD2 4.02Å; Q353-F386 HydrophobicContact CG-CE2 3.8Å; Q353-F386 HydrophobicContact CG-CZ 4.33Å; Q353-F386 VanDerWaalsContact NE2-CZ 3.27Å; Q353-F386 PolarHBondContact NE2-O 3.43Å; L354-F386 HydrophobicContact CD2-CD2 4.12Å; L354-F386 HydrophobicContact CD2-CE2 3.83Å; L354-F386 HydrophobicContact CG-CE2 4.33Å; M357-F386 HydrophobicContact CG-CB 4.29Å; M357-F386 HydrophobicContact SD-CB 3.59Å; M357-F386 VanDerWaalsContact SD-CB 3.59Å; M357-F386 HydrophobicContact SD-CD2 3.84Å; M357-F386 HydrophobicContact SD-CG 4.16Å; A382-F386 WeakPolarHBondContact O-CB 3.41Å; A382-F386 PolarHBondContact O-N 3.31Å; C383-F386 WeakPolarHBondContact O-CB 3.45Å; C383-F386 PolarHBondContact O-N 3.01Å; F384-F386 VanDerWaalsContact C-N 3.3Å; F384-F386 PolarHBondContact O-N 3.45Å; F386-G390 PolarHBondContact O-N 3.05Å; F386-Y420 HydrophobicContact CE2-CD1 4.15Å; F386-Y420 AromaticContact CE2-CE1 3.73Å; F386-Y420 HydrophobicContact CE2-CE1 3.73Å; F386-Y420 AromaticContact CZ-CD1 3.79Å; F386-Y420 HydrophobicContact CZ-CD1 3.79Å; F386-Y420 AromaticContact CZ-CE1 3.69Å; F386-Y420 HydrophobicContact CZ-CE1 3.69Å; F386-P421 HydrophobicContact CE1-CG 4.15Å; F386-P421 HydrophobicContact CZ-CG 4.15Å
387	M	94.2	Very high	94	Very high	13 Å²	13	37.4 Å²	37.4	6%	0.064	19%	0.192	C	C	.	.	H	α-helix	trans	-62.8	-48.3	178.7	-66.6	-172.1	-76.6	0	0	112.1	C383 F384 L385 G390 M455 I459	C383-M387 WeakPolarHBondContact O-CG 3.15Å; C383-M387 PolarHBondContact O-N 3.38Å; C383-M387 VanDerWaalsContact O-N 3.15Å; F384-M387 HydrophobicContact CB-CE 4.36Å; F384-M387 HydrophobicContact CD1-CE 3.27Å; F384-M387 HydrophobicContact CE1-CE 3.67Å; F384-M387 HydrophobicContact CG-CE 3.96Å; F384-M387 WeakPolarHBondContact O-CB 3.49Å; F384-M387 PolarHBondContact O-N 3.13Å; F384-M387 VanDerWaalsContact O-N 3.12Å; L385-M387 VanDerWaalsContact C-N 3.28Å; L385-M387 PolarHBondContact O-N 3.25Å; M387-G390 PolarHBondContact O-N 3.22Å; M387-M455 HydrophobicContact CE-CB 4.44Å; M387-M455 HydrophobicContact CE-CG 4.31Å; M387-M455 HydrophobicContact CE-SD 3.73Å; M387-M455 HydrophobicContact SD-CB 3.59Å; M387-M455 VanDerWaalsContact SD-CB 3.59Å; M387-M455 HydrophobicContact SD-CG 4.02Å; M387-M455 HydrophobicContact SD-SD 4.15Å; M387-I459 HydrophobicContact CB-CG2 4.4Å; M387-I459 HydrophobicContact SD-CB 4.37Å
388	F	94.9	Very high	94.5	Very high	112 Å²	112	36.3 Å²	36.3	49%	0.491	18%	0.183	S	C	.	.	H	α-helix	trans	-68.8	-37.4	-178.8	-71	-64.4	0	0	0	113	F384 L385 G390 V391 L463	F384-F388 HydrophobicContact CB-CE2 4.38Å; F384-F388 HydrophobicContact CD1-CE2 4.35Å; F384-F388 WeakPolarHBondContact O-CD2 3.45Å; F384-F388 PolarHBondContact O-N 2.88Å; L385-F388 PolarHBondContact O-N 2.91Å; F388-G390 PolarHBondContact O-N 2.82Å; F388-G390 VanDerWaalsContact O-N 3.08Å; F388-V391 PolarHBondContact O-N 2.83Å; F388-L463 HydrophobicContact CD1-CD1 3.94Å
389	M	96.1	Very high	94.9	Very high	20 Å²	20	36.7 Å²	36.7	10%	0.099	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-8	175.7	-64.6	-51	121.8	0	0	112.9	Q353 C356 M357 I360 L385 V391 F392 G393	Q353-M389 HydrophobicContact CG-CB 4.06Å; C356-M389 HydrophobicContact CB-CB 4.22Å; C356-M389 HydrophobicContact CB-CG 3.78Å; C356-M389 HydrophobicContact CB-SD 3.62Å; M357-M389 HydrophobicContact CB-CG 4.39Å; I360-M389 HydrophobicContact CD1-CE 3.62Å; I360-M389 HydrophobicContact CD1-SD 3.84Å; L385-M389 HydrophobicContact CD2-CE 4.2Å; L385-M389 VanDerWaalsContact O-CB 3.28Å; L385-M389 WeakPolarHBondContact O-CB 3.24Å; L385-M389 WeakPolarHBondContact O-CG 3.27Å; L385-M389 PolarHBondContact O-N 3.33Å; M389-V391 PolarHBondContact O-N 3.32Å; M389-F392 HydrophobicContact CE-CE2 4.46Å; M389-F392 PolarHBondContact O-N 2.88Å; M389-F392 VanDerWaalsContact O-N 3.1Å; M389-F392 HydrophobicContact SD-CD2 3.66Å; M389-F392 HydrophobicContact SD-CE2 3.93Å; M389-G393 PolarHBondContact O-N 2.67Å
390	G	95.9	Very high	95.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-53.8	-32.2	168.4	0	0	0	0	0	113.3	F386 M387 F388 G393 G394 V464	F386-G390 PolarHBondContact O-N 3.05Å; M387-G390 PolarHBondContact O-N 3.22Å; F388-G390 PolarHBondContact O-N 2.82Å; F388-G390 VanDerWaalsContact O-N 3.08Å; G390-G393 PolarHBondContact O-N 3.48Å; G390-G394 PolarHBondContact O-N 3.06Å; G390-V464 WeakPolarHBondContact O-CA 3.45Å
391	V	97.2	Very high	95.5	Very high	42 Å²	42	33.1 Å²	33.1	26%	0.255	16%	0.161	S	C	.	.	H	α-helix	trans	-61.6	-46.2	175.1	-178.8	0	0	0	0	111.4	F388 M389 F395 L463 L466 G467	F388-V391 PolarHBondContact O-N 2.83Å; M389-V391 PolarHBondContact O-N 3.32Å; V391-F395 VanDerWaalsContact O-CB 3.28Å; V391-F395 WeakPolarHBondContact O-CB 3.26Å; V391-F395 PolarHBondContact O-N 3.26Å; V391-L463 HydrophobicContact CG2-CB 3.82Å; V391-L463 HydrophobicContact CG2-CD2 3.72Å; V391-L463 HydrophobicContact CG2-CG 4.22Å; V391-L466 HydrophobicContact CG1-CD2 4.32Å; V391-L466 HydrophobicContact CG2-CD2 4.43Å; V391-G467 VanDerWaalsContact O-CA 3.32Å; V391-G467 WeakPolarHBondContact O-CA 3.4Å
392	F	96.9	Very high	95.7	Very high	110 Å²	110	35.4 Å²	35.4	48%	0.482	17%	0.165	S	C	.	.	H	α-helix	trans	-70.8	-39.2	-179.9	-66.8	-78.8	0	0	0	112.1	I352 M389 F395 S396	I352-F392 HydrophobicContact CG2-CB 4.35Å; M389-F392 HydrophobicContact CE-CE2 4.46Å; M389-F392 PolarHBondContact O-N 2.88Å; M389-F392 VanDerWaalsContact O-N 3.1Å; M389-F392 HydrophobicContact SD-CD2 3.66Å; M389-F392 HydrophobicContact SD-CE2 3.93Å; F392-F395 PolarHBondContact O-N 3.07Å; F392-S396 WeakPolarHBondContact O-CB 3.49Å; F392-S396 PolarHBondContact O-N 2.94Å; F392-S396 PolarHBondContact O-OG 3.07Å
393	G	97.2	Very high	95.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-47.4	173.9	0	0	0	0	0	112.2	G349 M389 G390 S396 A397	G349-G393 VanDerWaalsContact CA-O 3.32Å; G349-G393 WeakPolarHBondContact CA-O 3.35Å; G349-G393 WeakPolarHBondContact O-CA 3.45Å; M389-G393 PolarHBondContact O-N 2.67Å; G390-G393 PolarHBondContact O-N 3.48Å; G393-S396 PolarHBondContact O-N 2.79Å; G393-A397 WeakPolarHBondContact O-CB 3.48Å; G393-A397 PolarHBondContact O-N 2.97Å
394	G	97.5	Very high	95.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.2	-49.2	174.3	0	0	0	0	0	112.3	G390 S396 A397 G398 G467 Y468	G390-G394 PolarHBondContact O-N 3.06Å; G394-S396 PolarHBondContact O-N 3.45Å; G394-A397 PolarHBondContact O-N 3.27Å; G394-G398 PolarHBondContact O-N 3.41Å; G394-G467 VanDerWaalsContact C-C 3.47Å; G394-Y468 VanDerWaalsContact C-CA 3.5Å; G394-Y468 VanDerWaalsContact C-N 3.29Å; G394-Y468 WeakPolarHBondContact O-CA 3.46Å; G394-Y468 PolarHBondContact O-N 3.46Å
395	F	97.7	Very high	95.9	Very high	67 Å²	67	36 Å²	36	29%	0.294	16%	0.162	S	C	.	.	H	α-helix	trans	-57.6	-47	179	177.8	-90.5	0	0	0	112.4	V391 F392 G398 R399 G467 F470 G471	V391-F395 VanDerWaalsContact O-CB 3.28Å; V391-F395 WeakPolarHBondContact O-CB 3.26Å; V391-F395 PolarHBondContact O-N 3.26Å; F392-F395 PolarHBondContact O-N 3.07Å; F395-G398 PolarHBondContact O-N 3.43Å; F395-R399 WeakPolarHBondContact O-CB 3.42Å; F395-R399 PolarHBondContact O-N 3.37Å; F395-G467 WeakPolarHBondContact CA-O 3.33Å; F395-G467 PolarHBondContact N-O 3.47Å; F395-F470 HydrophobicContact CD2-CB 4.27Å; F395-G471 VanDerWaalsContact CD2-CA 3.47Å; F395-G471 WeakPolarHBondContact O-CA 3.38Å
396	S	96.5	Very high	95.8	Very high	18 Å²	18	35 Å²	35	13%	0.126	16%	0.158	C	C	.	.	H	α-helix	trans	-66.1	-44.4	-178.9	-57.7	0	0	0	0	111.6	F392 G393 G394 L400	F392-S396 WeakPolarHBondContact O-CB 3.49Å; F392-S396 PolarHBondContact O-N 2.94Å; F392-S396 PolarHBondContact O-OG 3.07Å; G393-S396 PolarHBondContact O-N 2.79Å; G394-S396 PolarHBondContact O-N 3.45Å; S396-L400 WeakPolarHBondContact O-CB 3.41Å; S396-L400 PolarHBondContact O-N 2.74Å
397	A	97.6	Very high	95.7	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-48	174.9	0	0	0	0	0	112.3	S345 G393 G394 R399 L400 Y401 T416 Y468	S345-A397 WeakPolarHBondContact O-CB 3.37Å; G393-A397 WeakPolarHBondContact O-CB 3.48Å; G393-A397 PolarHBondContact O-N 2.97Å; G394-A397 PolarHBondContact O-N 3.27Å; A397-R399 PolarHBondContact O-N 3.3Å; A397-L400 PolarHBondContact O-N 3.22Å; A397-Y401 VanDerWaalsContact O-CB 3.26Å; A397-Y401 WeakPolarHBondContact O-CB 3.33Å; A397-Y401 PolarHBondContact O-N 2.78Å; A397-T416 HydrophobicContact CB-CG2 3.85Å; A397-Y468 HydrophobicContact CB-CD2 3.96Å; A397-Y468 HydrophobicContact CB-CE2 3.73Å
398	G	97.2	Very high	95.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-42.5	-178.1	0	0	0	0	0	112.8	G394 F395 R402 Y468 F472	G394-G398 PolarHBondContact O-N 3.41Å; F395-G398 PolarHBondContact O-N 3.43Å; G398-R402 PolarHBondContact O-N 3.25Å; G398-R402 VanDerWaalsContact O-N 3.15Å; G398-Y468 VanDerWaalsContact CA-CE1 3.5Å; G398-F472 WeakPolarHBondContact O-CD2 3.35Å
399	R	96.6	Very high	95.6	Very high	56 Å²	56	46.5 Å²	46.5	21%	0.211	20%	0.204	C	C	.	.	H	α-helix	trans	-67.7	-44.9	177.2	-169.3	174.6	179.7	-169.3	-3.8	111.8	F395 A397 R402 T403 G471 Q475 Y477	F395-R399 WeakPolarHBondContact O-CB 3.42Å; F395-R399 PolarHBondContact O-N 3.37Å; A397-R399 PolarHBondContact O-N 3.3Å; R399-R402 PolarHBondContact O-N 3.47Å; R399-T403 PolarHBondContact O-N 2.92Å; R399-T403 PolarHBondContact O-OG1 3.3Å; R399-G471 VanDerWaalsContact CA-O 3.3Å; R399-G471 WeakPolarHBondContact CA-O 3.35Å; R399-G471 WeakPolarHBondContact CB-O 3.45Å; R399-Q475 PolarHBondContact NE-O 2.74Å; R399-Y477 HydrophobicContact CB-CE2 4.36Å; R399-Y477 HydrophobicContact CG-CD2 4.29Å; R399-Y477 HydrophobicContact CG-CE2 3.77Å
400	L	96	Very high	95.6	Very high	0 Å²	0	52 Å²	52	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.6	-44.2	177.9	-178.1	60.9	0	0	0	111.7	L348 S396 A397 R402 T403 L404 W568 F625	L348-L400 HydrophobicContact CB-CD2 4.42Å; L348-L400 HydrophobicContact CD1-CD2 3.34Å; S396-L400 WeakPolarHBondContact O-CB 3.41Å; S396-L400 PolarHBondContact O-N 2.74Å; A397-L400 PolarHBondContact O-N 3.22Å; L400-R402 VanDerWaalsContact C-N 3.27Å; L400-R402 PolarHBondContact O-N 2.91Å; L400-T403 WeakPolarHBondContact O-CA 3.16Å; L400-T403 WeakPolarHBondContact O-CB 3.35Å; L400-T403 PolarHBondContact O-N 3.38Å; L400-L404 HydrophobicContact CD1-CD1 4.39Å; L400-L404 HydrophobicContact CD1-CG 4.32Å; L400-L404 HydrophobicContact CG-CD1 4.17Å; L400-L404 HydrophobicContact CG-CG 4.46Å; L400-L404 WeakPolarHBondContact O-CG 3.3Å; L400-L404 PolarHBondContact O-N 2.86Å; L400-W568 HydrophobicContact CD1-CZ3 4.33Å; L400-F625 HydrophobicContact CD2-CE1 3.87Å; L400-F625 HydrophobicContact CD2-CZ 4.09Å
401	Y	96.7	Very high	95.6	Very high	19 Å²	19	58 Å²	58	8%	0.075	25%	0.253	C	S	.	.	H	α-helix	trans	-60	-38.3	178	-174.3	-121	0	0	0	112.2	P341 M342 A397 L404 G406 Y468 F472	P341-Y401 HydrophobicContact CG-CE2 4.45Å; M342-Y401 HydrophobicContact CB-CD2 4.37Å; M342-Y401 HydrophobicContact CB-CE2 3.7Å; M342-Y401 HydrophobicContact CG-CE2 4.24Å; A397-Y401 VanDerWaalsContact O-CB 3.26Å; A397-Y401 WeakPolarHBondContact O-CB 3.33Å; A397-Y401 PolarHBondContact O-N 2.78Å; Y401-L404 CarbonylContact O-C 3.51Å; Y401-L404 PolarHBondContact O-N 2.83Å; Y401-G406 VanDerWaalsContact CZ-CA 3.5Å; Y401-G406 WeakPolarHBondContact O-CA 3.15Å; Y401-G406 PolarHBondContact O-N 3.4Å; Y401-Y468 VanDerWaalsContact CB-OH 3.31Å; Y401-Y468 WeakPolarHBondContact CB-OH 3.32Å; Y401-Y468 WeakPolarHBondContact CD1-OH 3.31Å; Y401-Y468 VanDerWaalsContact CG-OH 3.32Å; Y401-F472 HydrophobicContact CD1-CD2 4.37Å; Y401-F472 AromaticContact CD1-CE2 3.95Å; Y401-F472 HydrophobicContact CD1-CE2 3.95Å
402	R	95.4	Very high	95.6	Very high	89 Å²	89	56 Å²	56	34%	0.336	24%	0.241	S	C	.	.	H	α-helix	trans	-65	-42.5	172.7	-175.9	170.5	172.4	-174.1	-0.7	112.1	G398 R399 L400 L404 K405 F472 R473 K474 P476	G398-R402 PolarHBondContact O-N 3.25Å; G398-R402 VanDerWaalsContact O-N 3.15Å; R399-R402 PolarHBondContact O-N 3.47Å; L400-R402 VanDerWaalsContact C-N 3.27Å; L400-R402 PolarHBondContact O-N 2.91Å; R402-L404 PolarHBondContact O-N 2.92Å; R402-K405 PolarHBondContact O-N 3.36Å; R402-K405 VanDerWaalsContact O-N 3.1Å; R402-F472 HydrophobicContact CB-CD2 3.81Å; R402-F472 HydrophobicContact CB-CE2 3.82Å; R402-F472 HydrophobicContact CB-CG 4.47Å; R402-F472 HydrophobicContact CB-CZ 4.49Å; R402-F472 WeakPolarHBondContact CD-O 3.11Å; R402-F472 HydrophobicContact CG-CE2 4.34Å; R402-F472 PolarHBondContact NH1-O 3.38Å; R402-R473 PolarHBondContact NH1-O 2.87Å; R402-K474 PolarHBondContact NH1-O 3.01Å; R402-P476 HydrophobicContact CG-CG 4.11Å
403	T	94.3	Very high	95.6	Very high	13 Å²	13	50.8 Å²	50.8	8%	0.08	22%	0.218	C	C	.	.	H	α-helix	trans	-58.8	-35.6	173.2	-70.5	0	0	0	0	112.4	R399 L400 K405 P476 Y477	R399-T403 PolarHBondContact O-N 2.92Å; R399-T403 PolarHBondContact O-OG1 3.3Å; L400-T403 WeakPolarHBondContact O-CA 3.16Å; L400-T403 WeakPolarHBondContact O-CB 3.35Å; L400-T403 PolarHBondContact O-N 3.38Å; T403-K405 PolarHBondContact O-N 3.34Å; T403-P476 WeakPolarHBondContact OG1-CA 3.37Å; T403-Y477 HydrophobicContact CG2-CD2 4.45Å; T403-Y477 WeakPolarHBondContact OG1-CD2 3.34Å; T403-Y477 PolarHBondContact OG1-N 3.31Å
404	L	94	Very high	95.6	Very high	5 Å²	5	56 Å²	56	3%	0.026	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	21.3	176.8	-60.1	179	0	0	0	113.7	P338 P341 L400 Y401 R402 G406 W568	P338-L404 HydrophobicContact CG-CD1 4.22Å; P341-L404 HydrophobicContact CB-CB 3.87Å; P341-L404 HydrophobicContact CB-CD1 3.82Å; P341-L404 HydrophobicContact CB-CG 4.49Å; L400-L404 HydrophobicContact CD1-CD1 4.39Å; L400-L404 HydrophobicContact CD1-CG 4.32Å; L400-L404 HydrophobicContact CG-CD1 4.17Å; L400-L404 HydrophobicContact CG-CG 4.46Å; L400-L404 WeakPolarHBondContact O-CG 3.3Å; L400-L404 PolarHBondContact O-N 2.86Å; Y401-L404 CarbonylContact O-C 3.51Å; Y401-L404 PolarHBondContact O-N 2.83Å; R402-L404 PolarHBondContact O-N 2.92Å; L404-G406 PolarHBondContact O-N 3.02Å; L404-W568 HydrophobicContact CD2-CD2 4.48Å; L404-W568 HydrophobicContact CD2-CE3 4.26Å; L404-W568 HydrophobicContact CD2-CH2 3.74Å; L404-W568 HydrophobicContact CD2-CZ2 3.96Å; L404-W568 HydrophobicContact CD2-CZ3 3.91Å
405	K	92.7	Very high	95.6	Very high	128 Å²	128	57 Å²	57	56%	0.557	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	27.8	179.4	-52.6	-178.8	-175.7	175.4	0	113.8	P337 R402 T403 H407 T483	P337-K405 HydrophobicContact CG-CB 4.47Å; P337-K405 HydrophobicContact CG-CD 4.08Å; P337-K405 HydrophobicContact CG-CG 4.18Å; R402-K405 PolarHBondContact O-N 3.36Å; R402-K405 VanDerWaalsContact O-N 3.1Å; T403-K405 PolarHBondContact O-N 3.34Å; K405-H407 PolarHBondContact O-CD2 2.86Å; K405-T483 PolarHBondContact NZ-OG1 3.11Å
406	G	92.7	Very high	95.5	Very high	8 Å²	8	53.8 Å²	53.8	8%	0.082	23%	0.234	C	C	.	.			trans	-75.4	127.8	176.4	0	0	0	0	0	112.9	Y401 L404 F472	Y401-G406 VanDerWaalsContact CZ-CA 3.5Å; Y401-G406 WeakPolarHBondContact O-CA 3.15Å; Y401-G406 PolarHBondContact O-N 3.4Å; L404-G406 PolarHBondContact O-N 3.02Å; G406-F472 VanDerWaalsContact O-CE2 3.26Å; G406-F472 WeakPolarHBondContact O-CE2 3.28Å; G406-F472 VanDerWaalsContact O-CZ 3.28Å; G406-F472 WeakPolarHBondContact O-CZ 3.27Å
407	H	92.5	Very high	95.6	Very high	161 Å²	161	53 Å²	53	75%	0.745	23%	0.228	S	C	*	.			trans	-99.2	-32.3	-179	-62.9	-72	0	0	0	114.1	K405 W409	K405-H407 PolarHBondContact O-CD2 2.86Å; H407-W409 VanDerWaalsContact C-N 3.33Å; H407-W409 PolarHBondContact O-N 3.28Å
408	R	94	Very high	95.5	Very high	168 Å²	168	54.4 Å²	54.4	63%	0.634	24%	0.237	S	C	*	.			trans	-86.5	65.6	-172.3	-62.2	-178.9	-176.2	167.7	-2	112.1	K410 K411 G412	R408-K410 VanDerWaalsContact C-N 3.34Å; R408-K410 PolarHBondContact O-N 3.38Å; R408-K411 HydrophobicContact CB-CB 4.35Å; R408-K411 PolarHBondContact O-N 3.33Å; R408-G412 PolarHBondContact O-N 3.2Å
409	W	94	Very high	95.4	Very high	73 Å²	73	57.3 Å²	57.3	28%	0.277	25%	0.252	S	S	.	.	H	α-helix	trans	-59.5	-38.5	-172.2	72.4	-92.8	0	0	0	113.9	H407 K411 G412 A413 Y468 Y469 F472	H407-W409 VanDerWaalsContact C-N 3.33Å; H407-W409 PolarHBondContact O-N 3.28Å; W409-K411 VanDerWaalsContact C-N 3.32Å; W409-K411 PolarHBondContact O-N 2.82Å; W409-G412 PolarHBondContact O-N 2.79Å; W409-A413 PolarHBondContact O-N 2.71Å; W409-Y468 HydrophobicContact CB-CE1 4.03Å; W409-Y468 HydrophobicContact CE3-CD1 4.47Å; W409-Y468 WeakPolarHBondContact O-CE1 3.27Å; W409-Y469 HydrophobicContact CH2-CD2 4.13Å; W409-Y469 HydrophobicContact CZ3-CD2 4.38Å; W409-F472 HydrophobicContact CB-CD1 3.81Å; W409-F472 HydrophobicContact CB-CD2 3.68Å; W409-F472 HydrophobicContact CB-CE1 3.87Å; W409-F472 HydrophobicContact CB-CE2 3.75Å; W409-F472 HydrophobicContact CB-CG 3.73Å; W409-F472 HydrophobicContact CB-CZ 3.84Å; W409-F472 HydrophobicContact CG-CD1 4.13Å; W409-F472 HydrophobicContact CG-CE1 4.22Å; W409-F472 HydrophobicContact CG-CG 4.42Å
410	K	96	Very high	95.4	Very high	134 Å²	134	55.8 Å²	55.8	58%	0.583	25%	0.246	S	C	*	.	H	α-helix	trans	-60.6	-39.5	178.1	-65.1	-174.2	-179.1	-178.2	0	112.7	R408 F414 Y465	R408-K410 VanDerWaalsContact C-N 3.34Å; R408-K410 PolarHBondContact O-N 3.38Å; K410-F414 PolarHBondContact O-N 2.81Å; K410-Y465 PolarHBondContact O-OH 3.46Å
411	K	95.9	Very high	95.3	Very high	128 Å²	128	56.3 Å²	56.3	56%	0.557	25%	0.25	S	S	*	.	H	α-helix	trans	-70.1	-38.2	177	-67.5	-166.1	178.1	-169.9	0	111.3	M342 R408 W409 F414 C415	M342-K411 HydrophobicContact SD-CB 4.13Å; R408-K411 HydrophobicContact CB-CB 4.35Å; R408-K411 PolarHBondContact O-N 3.33Å; W409-K411 VanDerWaalsContact C-N 3.32Å; W409-K411 PolarHBondContact O-N 2.82Å; K411-F414 PolarHBondContact O-N 3.23Å; K411-C415 WeakPolarHBondContact O-CB 3.38Å; K411-C415 PolarHBondContact O-N 3.08Å
412	G	95.9	Very high	95.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.5	-39.4	174.6	0	0	0	0	0	113.1	S346 R408 W409 C415 T416 Y468	S346-G412 PolarHBondContact OG-O 2.93Å; R408-G412 PolarHBondContact O-N 3.2Å; W409-G412 PolarHBondContact O-N 2.79Å; G412-C415 PolarHBondContact O-N 3.5Å; G412-T416 WeakPolarHBondContact O-CB 3.48Å; G412-T416 PolarHBondContact O-N 3.1Å; G412-T416 PolarHBondContact O-OG1 2.73Å; G412-Y468 VanDerWaalsContact C-CE2 3.44Å; G412-Y468 WeakPolarHBondContact CA-OH 3.5Å
413	A	97.2	Very high	95.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-47.7	173.2	0	0	0	0	0	111.5	W409 C415 T416 A417 Y465 Y468	W409-A413 PolarHBondContact O-N 2.71Å; A413-C415 PolarHBondContact O-N 3.03Å; A413-T416 PolarHBondContact O-N 3.34Å; A413-A417 WeakPolarHBondContact O-CB 3.49Å; A413-A417 PolarHBondContact O-N 3.41Å; A413-Y465 HydrophobicContact CB-CD1 3.86Å; A413-Y465 HydrophobicContact CB-CD2 4.16Å; A413-Y465 HydrophobicContact CB-CE1 3.81Å; A413-Y465 HydrophobicContact CB-CE2 4.12Å; A413-Y465 HydrophobicContact CB-CG 4.05Å; A413-Y468 HydrophobicContact CB-CD1 3.92Å; A413-Y468 HydrophobicContact CB-CD2 3.99Å; A413-Y468 HydrophobicContact CB-CE1 4.44Å; A413-Y468 HydrophobicContact CB-CE2 4.48Å; A413-Y468 HydrophobicContact CB-CG 3.67Å
414	F	97.4	Very high	95.4	Very high	108 Å²	108	56.6 Å²	56.6	47%	0.474	27%	0.269	S	S	.	.	H	α-helix	trans	-57.9	-47.7	175.1	-172	-103.8	0	0	0	112.1	K410 K411 T416 A417 T418 Y465	K410-F414 PolarHBondContact O-N 2.81Å; K411-F414 PolarHBondContact O-N 3.23Å; F414-T416 VanDerWaalsContact C-N 3.34Å; F414-T416 PolarHBondContact O-N 3.25Å; F414-A417 PolarHBondContact O-N 3.37Å; F414-T418 HydrophobicContact CD2-CG2 4.22Å; F414-T418 HydrophobicContact CE1-CG2 4.2Å; F414-T418 HydrophobicContact CE2-CG2 3.86Å; F414-T418 HydrophobicContact CZ-CG2 3.85Å; F414-T418 WeakPolarHBondContact O-CB 3.35Å; F414-T418 WeakPolarHBondContact O-CG2 3.47Å; F414-T418 PolarHBondContact O-N 3.36Å; F414-T418 PolarHBondContact O-OG1 3.03Å; F414-Y465 WeakPolarHBondContact CB-OH 3.21Å
415	C	97.1	Very high	95.4	Very high	22 Å²	22	59.2 Å²	59.2	15%	0.149	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-43.5	179	-172.4	0	0	0	0	111.4	M342 K411 G412 A413 A417 T418 L419	M342-C415 HydrophobicContact CE-CB 4.5Å; K411-C415 WeakPolarHBondContact O-CB 3.38Å; K411-C415 PolarHBondContact O-N 3.08Å; G412-C415 PolarHBondContact O-N 3.5Å; A413-C415 PolarHBondContact O-N 3.03Å; C415-A417 PolarHBondContact O-N 3.19Å; C415-T418 PolarHBondContact O-N 3.17Å; C415-L419 WeakPolarHBondContact O-CB 3.32Å; C415-L419 PolarHBondContact O-N 3.44Å
416	T	96.9	Very high	95.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-40	177.7	-49.3	0	0	0	0	112.1	S346 A397 G412 A413 F414 T418 V464	S346-T416 WeakPolarHBondContact CA-OG1 3.38Å; S346-T416 WeakPolarHBondContact CB-OG1 3.43Å; S346-T416 PolarHBondContact OG-N 2.97Å; S346-T416 PolarHBondContact OG-OG1 2.68Å; A397-T416 HydrophobicContact CB-CG2 3.85Å; G412-T416 WeakPolarHBondContact O-CB 3.48Å; G412-T416 PolarHBondContact O-N 3.1Å; G412-T416 PolarHBondContact O-OG1 2.73Å; A413-T416 PolarHBondContact O-N 3.34Å; F414-T416 VanDerWaalsContact C-N 3.34Å; F414-T416 PolarHBondContact O-N 3.25Å; T416-T418 VanDerWaalsContact C-N 3.33Å; T416-T418 PolarHBondContact O-N 2.96Å; T416-V464 HydrophobicContact CG2-CG1 3.97Å
417	A	96.7	Very high	95.6	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-74.5	-20.6	-179	0	0	0	0	0	114	A413 F414 C415 W456 L461 V464	A413-A417 WeakPolarHBondContact O-CB 3.49Å; A413-A417 PolarHBondContact O-N 3.41Å; F414-A417 PolarHBondContact O-N 3.37Å; C415-A417 PolarHBondContact O-N 3.19Å; A417-W456 PolarHBondContact O-NE1 3.4Å; A417-W456 VanDerWaalsContact O-NE1 3.07Å; A417-L461 HydrophobicContact CB-CB 4.29Å; A417-L461 HydrophobicContact CB-CD1 4.41Å; A417-L461 HydrophobicContact CB-CG 3.91Å; A417-V464 HydrophobicContact CB-CB 4.01Å; A417-V464 HydrophobicContact CB-CG1 3.86Å; A417-V464 HydrophobicContact CB-CG2 4.46Å
418	T	96.3	Very high	95.7	Very high	30 Å²	30	51.2 Å²	51.2	18%	0.184	26%	0.257	C	S	.	.	H	α-helix	trans	-118.2	-26.8	-170.5	56.8	0	0	0	0	115	F414 C415 T416 G422	F414-T418 HydrophobicContact CD2-CG2 4.22Å; F414-T418 HydrophobicContact CE1-CG2 4.2Å; F414-T418 HydrophobicContact CE2-CG2 3.86Å; F414-T418 HydrophobicContact CZ-CG2 3.85Å; F414-T418 WeakPolarHBondContact O-CB 3.35Å; F414-T418 WeakPolarHBondContact O-CG2 3.47Å; F414-T418 PolarHBondContact O-N 3.36Å; F414-T418 PolarHBondContact O-OG1 3.03Å; C415-T418 PolarHBondContact O-N 3.17Å; T416-T418 VanDerWaalsContact C-N 3.33Å; T416-T418 PolarHBondContact O-N 2.96Å; T418-G422 VanDerWaalsContact O-CA 3.24Å; T418-G422 WeakPolarHBondContact O-CA 3.41Å; T418-G422 PolarHBondContact O-N 2.9Å
419	L	95.8	Very high	95.7	Very high	61 Å²	61	47.8 Å²	47.8	32%	0.319	25%	0.247	S	C	.	.	H	α-helix	trans	-63.3	-59.4	-171.2	-178.2	63.9	0	0	0	112.5	I343 L347 C415 V423	I343-L419 HydrophobicContact CG2-CD2 4.26Å; L347-L419 HydrophobicContact CD2-CD2 3.61Å; L347-L419 HydrophobicContact CD2-CG 4.43Å; L347-L419 HydrophobicContact CG-CD2 4.01Å; C415-L419 WeakPolarHBondContact O-CB 3.32Å; C415-L419 PolarHBondContact O-N 3.44Å; L419-V423 WeakPolarHBondContact O-CG2 3.36Å; L419-V423 PolarHBondContact O-N 3.42Å
420	Y	96	Very high	95.7	Very high	23 Å²	23	48 Å²	48	9%	0.09	26%	0.256	C	S	.	.	H	α-helix	trans	-72.9	-50.7	179.3	169.4	-102.8	0	0	0	112.5	L354 F386 G422 V423 V424 S615 L618	L354-Y420 HydrophobicContact CD1-CE1 4.09Å; L354-Y420 HydrophobicContact CD1-CE2 4.19Å; L354-Y420 HydrophobicContact CD2-CE1 3.86Å; L354-Y420 HydrophobicContact CG-CE1 4.19Å; F386-Y420 HydrophobicContact CE2-CD1 4.15Å; F386-Y420 AromaticContact CE2-CE1 3.73Å; F386-Y420 HydrophobicContact CE2-CE1 3.73Å; F386-Y420 AromaticContact CZ-CD1 3.79Å; F386-Y420 HydrophobicContact CZ-CD1 3.79Å; F386-Y420 AromaticContact CZ-CE1 3.69Å; F386-Y420 HydrophobicContact CZ-CE1 3.69Å; Y420-G422 PolarHBondContact O-N 3.43Å; Y420-V423 PolarHBondContact O-N 2.94Å; Y420-V423 VanDerWaalsContact O-N 3.13Å; Y420-V424 HydrophobicContact CD1-CG2 4.44Å; Y420-V424 HydrophobicContact CD2-CG2 4.15Å; Y420-V424 HydrophobicContact CE1-CG2 3.96Å; Y420-V424 HydrophobicContact CE2-CG2 3.67Å; Y420-V424 WeakPolarHBondContact O-CG2 3.38Å; Y420-V424 PolarHBondContact O-N 3.13Å; Y420-S615 PolarHBondContact OH-OG 3.36Å; Y420-L618 HydrophobicContact CD2-CD1 3.21Å; Y420-L618 HydrophobicContact CE2-CD1 3.66Å; Y420-L618 HydrophobicContact CG-CD1 3.88Å
421	P	94.9	Very high	95.6	Very high	12 Å²	12	41.8 Å²	41.8	8%	0.078	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-33.2	177.5	-27.7	38	0	0	0	113.7	F386 V424 F425 W456	F386-P421 HydrophobicContact CE1-CG 4.15Å; F386-P421 HydrophobicContact CZ-CG 4.15Å; P421-V424 PolarHBondContact O-N 3.18Å; P421-F425 VanDerWaalsContact O-CB 3.27Å; P421-F425 WeakPolarHBondContact O-CB 3.21Å; P421-F425 PolarHBondContact O-N 3.11Å; P421-W456 HydrophobicContact CB-CD2 4.24Å; P421-W456 HydrophobicContact CB-CH2 4.49Å; P421-W456 HydrophobicContact CB-CZ2 3.66Å
422	G	95.7	Very high	95.5	Very high	27 Å²	27	36.5 Å²	36.5	28%	0.278	21%	0.207	S	C	.	.	H	α-helix	trans	-69.7	-36.1	177	0	0	0	0	0	113.6	T418 Y420 G426 W456	T418-G422 VanDerWaalsContact O-CA 3.24Å; T418-G422 WeakPolarHBondContact O-CA 3.41Å; T418-G422 PolarHBondContact O-N 2.9Å; Y420-G422 PolarHBondContact O-N 3.43Å; G422-G426 PolarHBondContact O-N 3.21Å; G422-W456 VanDerWaalsContact CA-CH2 3.46Å
423	V	96.1	Very high	95.4	Very high	61 Å²	61	39.5 Å²	39.5	37%	0.37	23%	0.227	S	C	.	.	H	α-helix	trans	-66.4	-45.3	171.8	172.9	0	0	0	0	110.6	L419 Y420 G426 I427 L614	L419-V423 WeakPolarHBondContact O-CG2 3.36Å; L419-V423 PolarHBondContact O-N 3.42Å; Y420-V423 PolarHBondContact O-N 2.94Å; Y420-V423 VanDerWaalsContact O-N 3.13Å; V423-G426 PolarHBondContact O-N 3.21Å; V423-I427 HydrophobicContact CG1-CD1 3.87Å; V423-I427 WeakPolarHBondContact O-CG1 3.04Å; V423-I427 PolarHBondContact O-N 3.37Å; V423-L614 HydrophobicContact CB-CD2 4.41Å; V423-L614 HydrophobicContact CG1-CD2 3.57Å
424	V	95.3	Very high	95.2	Very high	39 Å²	39	43.2 Å²	43.2	24%	0.236	24%	0.244	C	C	.	.	H	α-helix	trans	-59.8	-51.4	177.2	176.8	0	0	0	0	110.8	Y420 P421 G426 I427 C428 L611	Y420-V424 HydrophobicContact CD1-CG2 4.44Å; Y420-V424 HydrophobicContact CD2-CG2 4.15Å; Y420-V424 HydrophobicContact CE1-CG2 3.96Å; Y420-V424 HydrophobicContact CE2-CG2 3.67Å; Y420-V424 WeakPolarHBondContact O-CG2 3.38Å; Y420-V424 PolarHBondContact O-N 3.13Å; P421-V424 PolarHBondContact O-N 3.18Å; V424-G426 PolarHBondContact O-N 2.9Å; V424-I427 PolarHBondContact O-N 3.24Å; V424-C428 VanDerWaalsContact O-CB 3.32Å; V424-C428 WeakPolarHBondContact O-CB 3.38Å; V424-C428 PolarHBondContact O-N 3.45Å; V424-C428 PolarHBondContact O-SG 3.17Å; V424-L611 HydrophobicContact CB-CD2 4.38Å; V424-L611 HydrophobicContact CG2-CD2 4.14Å
425	F	94.1	Very high	94.9	Very high	59 Å²	59	38.3 Å²	38.3	26%	0.259	22%	0.223	S	C	.	.	H	α-helix	trans	-61.7	-43.3	178.8	-177.9	-93.6	0	0	0	111.7	P421 C428 F429 L453 W456	P421-F425 VanDerWaalsContact O-CB 3.27Å; P421-F425 WeakPolarHBondContact O-CB 3.21Å; P421-F425 PolarHBondContact O-N 3.11Å; F425-C428 PolarHBondContact O-N 3.11Å; F425-F429 HydrophobicContact CE1-CB 4.31Å; F425-F429 HydrophobicContact CE1-CD2 4.23Å; F425-F429 HydrophobicContact CZ-CD2 4.15Å; F425-F429 WeakPolarHBondContact O-CB 2.86Å; F425-F429 PolarHBondContact O-N 3.49Å; F425-L453 HydrophobicContact CD2-CD2 4.2Å; F425-L453 HydrophobicContact CE1-CD2 4.11Å; F425-L453 HydrophobicContact CE2-CD1 4.39Å; F425-L453 HydrophobicContact CE2-CD2 3.64Å; F425-L453 HydrophobicContact CE2-CG 3.84Å; F425-L453 HydrophobicContact CZ-CD1 4.02Å; F425-L453 HydrophobicContact CZ-CD2 3.6Å; F425-L453 HydrophobicContact CZ-CG 3.91Å; F425-W456 HydrophobicContact CB-CE3 4.35Å; F425-W456 HydrophobicContact CB-CH2 4.33Å; F425-W456 HydrophobicContact CB-CZ3 3.7Å; F425-W456 HydrophobicContact CD1-CZ3 4.14Å; F425-W456 HydrophobicContact CD2-CZ3 4.35Å; F425-W456 HydrophobicContact CG-CE3 4.37Å; F425-W456 AromaticContact CG-CZ3 3.8Å; F425-W456 HydrophobicContact CG-CZ3 3.8Å
426	G	94.8	Very high	94.7	Very high	32 Å²	32	46.3 Å²	46.3	33%	0.33	25%	0.25	S	C	.	.	H	α-helix	trans	-60.9	-46.5	179.1	0	0	0	0	0	112.9	G422 V423 V424 V430	G422-G426 PolarHBondContact O-N 3.21Å; V423-G426 PolarHBondContact O-N 3.21Å; V424-G426 PolarHBondContact O-N 2.9Å; G426-V430 WeakPolarHBondContact O-CG2 3.32Å; G426-V430 PolarHBondContact O-N 2.78Å; G426-V430 VanDerWaalsContact O-N 3.13Å
427	I	95.5	Very high	94.4	Very high	50 Å²	50	49 Å²	49	26%	0.256	28%	0.278	S	S	.	.	H	α-helix	trans	-65.8	-50.9	176.8	-67	168.6	0	0	0	110.1	V423 V424 F429 V430 L431 L611	V423-I427 HydrophobicContact CG1-CD1 3.87Å; V423-I427 WeakPolarHBondContact O-CG1 3.04Å; V423-I427 PolarHBondContact O-N 3.37Å; V424-I427 PolarHBondContact O-N 3.24Å; I427-F429 VanDerWaalsContact C-N 3.27Å; I427-F429 PolarHBondContact O-N 2.88Å; I427-V430 PolarHBondContact O-N 2.84Å; I427-L431 HydrophobicContact CG2-CD1 3.95Å; I427-L431 HydrophobicContact CG2-CG 4.23Å; I427-L431 WeakPolarHBondContact O-CG 3.1Å; I427-L431 PolarHBondContact O-N 3.3Å; I427-L611 HydrophobicContact CB-CD1 4.31Å; I427-L611 HydrophobicContact CB-CD2 4.05Å; I427-L611 HydrophobicContact CB-CG 4.3Å; I427-L611 HydrophobicContact CD1-CD2 3.59Å; I427-L611 HydrophobicContact CD1-CG 4.2Å; I427-L611 HydrophobicContact CG1-CD2 4.37Å; I427-L611 HydrophobicContact CG2-CD1 3.9Å; I427-L611 HydrophobicContact CG2-CD2 4.24Å; I427-L611 HydrophobicContact CG2-CG 3.94Å
428	C	93.7	Very high	94.1	Very high	48 Å²	48	52.1 Å²	52.1	32%	0.324	29%	0.291	S	S	.	.	H	α-helix	trans	-59	-37.5	179	-71	0	0	0	0	112.4	V424 F425 N432	V424-C428 VanDerWaalsContact O-CB 3.32Å; V424-C428 WeakPolarHBondContact O-CB 3.38Å; V424-C428 PolarHBondContact O-N 3.45Å; V424-C428 PolarHBondContact O-SG 3.17Å; F425-C428 PolarHBondContact O-N 3.11Å; C428-N432 WeakPolarHBondContact O-CB 3.33Å; C428-N432 PolarHBondContact O-N 2.7Å
429	F	93.7	Very high	93.8	Very high	95 Å²	95	58.4 Å²	58.4	42%	0.417	32%	0.318	S	S	.	.	H	α-helix	trans	-62.8	-49.3	176.7	-180	-89.9	0	0	0	111.4	F425 I427 N432 C433 M449	F425-F429 HydrophobicContact CE1-CB 4.31Å; F425-F429 HydrophobicContact CE1-CD2 4.23Å; F425-F429 HydrophobicContact CZ-CD2 4.15Å; F425-F429 WeakPolarHBondContact O-CB 2.86Å; F425-F429 PolarHBondContact O-N 3.49Å; I427-F429 VanDerWaalsContact C-N 3.27Å; I427-F429 PolarHBondContact O-N 2.88Å; F429-N432 PolarHBondContact O-N 3.29Å; F429-C433 PolarHBondContact O-N 2.54Å; F429-C433 PolarHBondContact O-SG 2.85Å; F429-C433 VanDerWaalsContact O-SG 3.34Å; F429-M449 HydrophobicContact CD2-CE 3.29Å; F429-M449 HydrophobicContact CE2-CE 3.52Å; F429-M449 HydrophobicContact CG-CE 4.46Å
430	V	94.5	Very high	93.5	Very high	78 Å²	78	55.9 Å²	55.9	47%	0.473	31%	0.305	S	S	.	.	H	α-helix	trans	-61	-47.6	177.8	171.9	0	0	0	0	110.6	G426 I427 N432 C433 F434	G426-V430 WeakPolarHBondContact O-CG2 3.32Å; G426-V430 PolarHBondContact O-N 2.78Å; G426-V430 VanDerWaalsContact O-N 3.13Å; I427-V430 PolarHBondContact O-N 2.84Å; V430-N432 VanDerWaalsContact C-N 3.31Å; V430-N432 PolarHBondContact O-N 3.46Å; V430-C433 WeakPolarHBondContact O-CB 3.19Å; V430-C433 PolarHBondContact O-N 2.93Å; V430-F434 HydrophobicContact CG1-CD2 4.26Å; V430-F434 HydrophobicContact CG1-CE2 3.83Å; V430-F434 WeakPolarHBondContact O-CD2 3.27Å; V430-F434 PolarHBondContact O-N 3.46Å
431	L	94.1	Very high	93.2	Very high	4 Å²	4	55 Å²	55	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-44.3	176.3	-64.6	-179.2	0	0	0	111.1	I427 C433 F434 I435 L603 L604 Y608	I427-L431 HydrophobicContact CG2-CD1 3.95Å; I427-L431 HydrophobicContact CG2-CG 4.23Å; I427-L431 WeakPolarHBondContact O-CG 3.1Å; I427-L431 PolarHBondContact O-N 3.3Å; L431-C433 VanDerWaalsContact C-N 3.27Å; L431-C433 PolarHBondContact O-N 3.47Å; L431-F434 PolarHBondContact O-N 3.36Å; L431-I435 WeakPolarHBondContact O-CG1 3.38Å; L431-I435 PolarHBondContact O-N 2.9Å; L431-L603 HydrophobicContact CD2-CG 4.01Å; L431-L604 HydrophobicContact CB-CD2 3.96Å; L431-L604 HydrophobicContact CD1-CD2 4.5Å; L431-L604 HydrophobicContact CD2-CD2 4.18Å; L431-L604 HydrophobicContact CG-CD2 4.42Å; L431-Y608 HydrophobicContact CD1-CD1 4.09Å; L431-Y608 HydrophobicContact CD1-CE1 3.98Å; L431-Y608 HydrophobicContact CD1-CE2 4.47Å; L431-Y608 HydrophobicContact CD1-CG 4.38Å
432	N	93.7	Very high	92.9	Very high	17 Å²	17	55 Å²	55	9%	0.091	30%	0.304	C	S	.	.	H	α-helix	trans	-60.2	-34.8	178.9	-162.9	58.9	0	0	0	112.8	C428 F429 V430 F434 I435 W436 A443 V444 M449	C428-N432 WeakPolarHBondContact O-CB 3.33Å; C428-N432 PolarHBondContact O-N 2.7Å; F429-N432 PolarHBondContact O-N 3.29Å; V430-N432 VanDerWaalsContact C-N 3.31Å; V430-N432 PolarHBondContact O-N 3.46Å; N432-F434 VanDerWaalsContact C-N 3.34Å; N432-F434 PolarHBondContact O-N 3.39Å; N432-I435 PolarHBondContact O-N 2.7Å; N432-W436 VanDerWaalsContact O-CB 3.23Å; N432-W436 WeakPolarHBondContact O-CB 3.3Å; N432-W436 PolarHBondContact O-N 3.39Å; N432-A443 WeakPolarHBondContact OD1-CA 3.46Å; N432-V444 PolarHBondContact ND2-O 3.01Å; N432-V444 PolarHBondContact OD1-N 3.47Å; N432-M449 PolarHBondContact ND2-SD 3.12Å
433	C	93.4	Very high	92.7	Very high	62 Å²	62	54.2 Å²	54.2	42%	0.419	30%	0.296	S	S	.	.	H	α-helix	trans	-61	-40.9	173.5	-66.7	0	0	0	0	112.4	F429 V430 L431 G437	F429-C433 PolarHBondContact O-N 2.54Å; F429-C433 PolarHBondContact O-SG 2.85Å; F429-C433 VanDerWaalsContact O-SG 3.34Å; V430-C433 WeakPolarHBondContact O-CB 3.19Å; V430-C433 PolarHBondContact O-N 2.93Å; L431-C433 VanDerWaalsContact C-N 3.27Å; L431-C433 PolarHBondContact O-N 3.47Å; C433-G437 PolarHBondContact O-N 2.98Å
434	F	93.5	Very high	92.5	Very high	78 Å²	78	52.6 Å²	52.6	34%	0.342	29%	0.286	S	S	.	.	H	α-helix	trans	-70.1	-40.7	176.6	-72	-78.7	0	0	0	112.3	V430 L431 N432 W436 G437 K438 I600 L603	V430-F434 HydrophobicContact CG1-CD2 4.26Å; V430-F434 HydrophobicContact CG1-CE2 3.83Å; V430-F434 WeakPolarHBondContact O-CD2 3.27Å; V430-F434 PolarHBondContact O-N 3.46Å; L431-F434 PolarHBondContact O-N 3.36Å; N432-F434 VanDerWaalsContact C-N 3.34Å; N432-F434 PolarHBondContact O-N 3.39Å; F434-W436 VanDerWaalsContact C-N 3.33Å; F434-G437 PolarHBondContact O-N 2.94Å; F434-K438 PolarHBondContact O-N 3.27Å; F434-I600 HydrophobicContact CB-CG2 4.26Å; F434-I600 HydrophobicContact CD1-CD1 4.45Å; F434-I600 HydrophobicContact CD1-CG1 4.45Å; F434-L603 HydrophobicContact CD1-CD2 4.15Å; F434-L603 HydrophobicContact CD2-CD2 3.43Å; F434-L603 VanDerWaalsContact CD2-CD2 3.43Å; F434-L603 HydrophobicContact CE1-CD2 4.2Å; F434-L603 HydrophobicContact CE2-CD2 3.5Å; F434-L603 VanDerWaalsContact CE2-CD2 3.5Å; F434-L603 HydrophobicContact CG-CD2 3.79Å; F434-L603 HydrophobicContact CZ-CD2 3.89Å
435	I	91.9	Very high	92.2	Very high	6 Å²	6	53 Å²	53	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-44	176.7	-57.8	169.3	0	0	0	110.2	L54 L431 N432 G437 K438 H439 S440 A443 L604	L54-I435 HydrophobicContact CD2-CG2 4.38Å; L431-I435 WeakPolarHBondContact O-CG1 3.38Å; L431-I435 PolarHBondContact O-N 2.9Å; N432-I435 PolarHBondContact O-N 2.7Å; I435-G437 VanDerWaalsContact C-N 3.35Å; I435-G437 PolarHBondContact O-N 3.27Å; I435-K438 PolarHBondContact O-N 3.05Å; I435-K438 VanDerWaalsContact O-N 3.14Å; I435-H439 PolarHBondContact O-N 3.38Å; I435-S440 VanDerWaalsContact CG2-CB 3.49Å; I435-S440 WeakPolarHBondContact CG2-OG 3.38Å; I435-S440 PolarHBondContact O-N 2.75Å; I435-A443 HydrophobicContact CB-CB 4.42Å; I435-A443 HydrophobicContact CG2-CB 3.94Å; I435-A443 VanDerWaalsContact CG2-N 3.3Å; I435-L604 HydrophobicContact CD1-CD2 3.63Å; I435-L604 HydrophobicContact CG1-CD1 4.03Å; I435-L604 HydrophobicContact CG1-CD2 3.56Å; I435-L604 HydrophobicContact CG1-CG 4.4Å
436	W	91.7	Very high	92	Very high	189 Å²	189	57.7 Å²	57.7	72%	0.716	31%	0.31	S	S	*	.	H	α-helix	trans	-62.6	-40.9	177.6	-173.8	54.1	0	0	0	112.1	N432 F434 K438 H439 A443	N432-W436 VanDerWaalsContact O-CB 3.23Å; N432-W436 WeakPolarHBondContact O-CB 3.3Å; N432-W436 PolarHBondContact O-N 3.39Å; F434-W436 VanDerWaalsContact C-N 3.33Å; W436-K438 PolarHBondContact O-N 3.07Å; W436-H439 PolarHBondContact O-N 3.48Å; W436-A443 HydrophobicContact CB-CB 4.13Å
437	G	91.1	Very high	91.8	Very high	57 Å²	57	60.7 Å²	60.7	59%	0.588	32%	0.323	S	S	*	.	H	α-helix	trans	-62.4	-22.7	174.7	0	0	0	0	0	114.6	C433 F434 I435	C433-G437 PolarHBondContact O-N 2.98Å; F434-G437 PolarHBondContact O-N 2.94Å; I435-G437 VanDerWaalsContact C-N 3.35Å; I435-G437 PolarHBondContact O-N 3.27Å
438	K	90.1	Very high	91.6	Very high	67 Å²	67	59.3 Å²	59.3	29%	0.291	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	5.8	174.4	-82.4	-79.5	-169.3	156.4	0	113.6	L54 Y56 F434 I435 W436 S440 E598 I600	L54-K438 HydrophobicContact CD1-CB 4.41Å; L54-K438 HydrophobicContact CD1-CG 4.31Å; Y56-K438 VanDerWaalsContact CE1-O 3.28Å; Y56-K438 WeakPolarHBondContact CE1-O 3.44Å; Y56-K438 PolarHBondContact OH-O 3.17Å; Y56-K438 VanDerWaalsContact OH-O 3.09Å; F434-K438 PolarHBondContact O-N 3.27Å; I435-K438 PolarHBondContact O-N 3.05Å; I435-K438 VanDerWaalsContact O-N 3.14Å; W436-K438 PolarHBondContact O-N 3.07Å; K438-S440 PolarHBondContact O-N 2.77Å; K438-S440 VanDerWaalsContact O-N 3.17Å; K438-E598 IonicContact NZ-OE1 2.69Å; K438-E598 PolarHBondContact NZ-OE1 2.81Å; K438-E598 IonicContact NZ-OE2 3.99Å; K438-E598 PolarHBondContact NZ-OE2 2.83Å; K438-E598 VanDerWaalsContact NZ-OE2 3.11Å; K438-I600 HydrophobicContact CD-CD1 4.15Å; K438-I600 HydrophobicContact CG-CD1 3.5Å; K438-I600 HydrophobicContact CG-CG2 4.41Å
439	H	90.1	Very high	91.5	Very high	162 Å²	162	58.4 Å²	58.4	75%	0.75	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	32.6	-175.3	-58.9	-70.9	0	0	0	113.7	Y56 I435 W436	Y56-H439 WeakPolarHBondContact CE1-O 3.15Å; I435-H439 PolarHBondContact O-N 3.38Å; W436-H439 PolarHBondContact O-N 3.48Å
440	S	90.5	Very high	91.4	Very high	7 Å²	7	56.8 Å²	56.8	5%	0.049	31%	0.307	C	S	.	.			trans	-77	143.9	179.4	151.1	0	0	0	0	111.1	P55 I435 K438 G442 A443	P55-S440 CarbonylContact O-C 3.44Å; P55-S440 WeakPolarHBondContact O-CA 3.46Å; P55-S440 WeakPolarHBondContact O-CB 3.3Å; P55-S440 PolarHBondContact O-OG 2.87Å; I435-S440 VanDerWaalsContact CG2-CB 3.49Å; I435-S440 WeakPolarHBondContact CG2-OG 3.38Å; I435-S440 PolarHBondContact O-N 2.75Å; K438-S440 PolarHBondContact O-N 2.77Å; K438-S440 VanDerWaalsContact O-N 3.17Å; S440-G442 PolarHBondContact O-N 3.4Å; S440-G442 PolarHBondContact OG-N 2.97Å; S440-G442 VanDerWaalsContact OG-N 3.1Å; S440-A443 WeakPolarHBondContact O-CB 3.46Å; S440-A443 PolarHBondContact O-N 3.41Å; S440-A443 VanDerWaalsContact O-N 3.12Å
441	S	88.9	Confident	91.3	Very high	5 Å²	5	55 Å²	55	4%	0.035	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.4	176.3	72	0	0	0	0	112.4	P55 G82 R84 A443	P55-S441 PolarHBondContact O-N 3.21Å; P55-S441 PolarHBondContact O-OG 3.34Å; G82-S441 VanDerWaalsContact CA-O 3.3Å; G82-S441 WeakPolarHBondContact CA-O 3.41Å; G82-S441 PolarHBondContact O-OG 3.41Å; G82-S441 VanDerWaalsContact O-OG 3.05Å; R84-S441 PolarHBondContact NH2-O 3.43Å; S441-A443 PolarHBondContact O-N 2.95Å
442	G	87.6	Confident	91.2	Very high	11 Å²	11	57 Å²	57	11%	0.113	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-9.4	173.9	0	0	0	0	0	113.7	S440 V444	S440-G442 PolarHBondContact O-N 3.4Å; S440-G442 PolarHBondContact OG-N 2.97Å; S440-G442 VanDerWaalsContact OG-N 3.1Å; G442-V444 PolarHBondContact O-N 3.28Å
443	A	92	Very high	91.1	Very high	12 Å²	12	58.9 Å²	58.9	10%	0.099	32%	0.32	C	S	.	.	S	Bend	trans	-65.8	121.4	173.7	0	0	0	0	0	109.2	N432 I435 W436 S440 S441 P445	N432-A443 WeakPolarHBondContact OD1-CA 3.46Å; I435-A443 HydrophobicContact CB-CB 4.42Å; I435-A443 HydrophobicContact CG2-CB 3.94Å; I435-A443 VanDerWaalsContact CG2-N 3.3Å; W436-A443 HydrophobicContact CB-CB 4.13Å; S440-A443 WeakPolarHBondContact O-CB 3.46Å; S440-A443 PolarHBondContact O-N 3.41Å; S440-A443 VanDerWaalsContact O-N 3.12Å; S441-A443 PolarHBondContact O-N 2.95Å; A443-P445 VanDerWaalsContact O-CD 3.25Å; A443-P445 WeakPolarHBondContact O-CD 3.26Å
444	V	91.3	Very high	91.2	Very high	27 Å²	27	59.7 Å²	59.7	16%	0.164	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-64.8	118.7	173.7	-177.1	0	0	0	0	107.8	L80 N432 G442 T448 M449 L452	L80-V444 HydrophobicContact CD2-CG1 4.4Å; L80-V444 HydrophobicContact CD2-CG2 4.02Å; N432-V444 PolarHBondContact ND2-O 3.01Å; N432-V444 PolarHBondContact OD1-N 3.47Å; G442-V444 PolarHBondContact O-N 3.28Å; V444-T448 HydrophobicContact CG1-CG2 3.81Å; V444-M449 HydrophobicContact CB-CG 4.2Å; V444-M449 HydrophobicContact CG1-CG 3.76Å; V444-L452 HydrophobicContact CG1-CD1 4.46Å
445	P	90.3	Very high	91.1	Very high	48 Å²	48	57.5 Å²	57.5	31%	0.312	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-60.3	147.5	-179.8	-24.3	34.7	0	0	0	111.6	V79 A443 P447 T448 M449	V79-P445 HydrophobicContact CG1-CG 4.3Å; A443-P445 VanDerWaalsContact O-CD 3.25Å; A443-P445 WeakPolarHBondContact O-CD 3.26Å; P445-P447 VanDerWaalsContact C-CD 3.47Å; P445-P447 VanDerWaalsContact C-N 3.35Å; P445-T448 WeakPolarHBondContact O-CA 3.44Å; P445-T448 WeakPolarHBondContact O-CB 3.25Å; P445-T448 PolarHBondContact O-N 3.48Å; P445-M449 PolarHBondContact O-N 3.33Å
446	F	90	Very high	91.3	Very high	157 Å²	157	58.8 Å²	58.8	69%	0.689	32%	0.322	S	S	*	.	H	α-helix	trans	-51.9	-43.8	179.3	178.5	-97.9	0	0	0	113.8	T448 M449 V450	F446-T448 VanDerWaalsContact C-N 3.28Å; F446-T448 PolarHBondContact O-N 2.91Å; F446-M449 WeakPolarHBondContact O-CB 3.42Å; F446-M449 PolarHBondContact O-N 3.39Å; F446-M449 VanDerWaalsContact O-N 3.16Å; F446-V450 HydrophobicContact CD1-CG2 4.26Å; F446-V450 HydrophobicContact CE1-CG2 3.8Å; F446-V450 HydrophobicContact CE2-CG2 4.22Å; F446-V450 HydrophobicContact CZ-CG2 3.78Å; F446-V450 WeakPolarHBondContact O-CG2 3.41Å; F446-V450 PolarHBondContact O-N 3Å
447	P	90.9	Very high	91.4	Very high	94 Å²	94	54.7 Å²	54.7	61%	0.61	31%	0.309	S	S	*	.	H	α-helix	trans	-58.9	-38.1	175.8	-24.6	35.2	0	0	0	113.2	P445 V450 A451	P445-P447 VanDerWaalsContact C-CD 3.47Å; P445-P447 VanDerWaalsContact C-N 3.35Å; P447-V450 PolarHBondContact O-N 3.24Å; P447-A451 WeakPolarHBondContact O-CB 3.38Å; P447-A451 PolarHBondContact O-N 3.46Å
448	T	90.7	Very high	91.6	Very high	22 Å²	22	54.4 Å²	54.4	14%	0.135	31%	0.306	C	S	.	.	H	α-helix	trans	-69	-38.6	177.8	-50.5	0	0	0	0	111.2	L76 V79 V444 P445 F446 V450 A451 L452	L76-T448 HydrophobicContact CD1-CG2 3.91Å; V79-T448 HydrophobicContact CG1-CG2 3.87Å; V444-T448 HydrophobicContact CG1-CG2 3.81Å; P445-T448 WeakPolarHBondContact O-CA 3.44Å; P445-T448 WeakPolarHBondContact O-CB 3.25Å; P445-T448 PolarHBondContact O-N 3.48Å; F446-T448 VanDerWaalsContact C-N 3.28Å; F446-T448 PolarHBondContact O-N 2.91Å; T448-V450 VanDerWaalsContact C-N 3.34Å; T448-V450 PolarHBondContact O-N 3.44Å; T448-A451 WeakPolarHBondContact O-CB 3.46Å; T448-A451 PolarHBondContact O-N 2.9Å; T448-L452 HydrophobicContact CG2-CD1 4.48Å; T448-L452 VanDerWaalsContact O-CG 3.3Å; T448-L452 WeakPolarHBondContact O-CG 3.47Å; T448-L452 PolarHBondContact O-N 2.85Å
449	M	91.1	Very high	91.7	Very high	29 Å²	29	54.4 Å²	54.4	14%	0.143	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-43.1	173.2	-64.7	178.6	62.6	0	0	111.8	F429 N432 V444 P445 F446 A451 L452 L453	F429-M449 HydrophobicContact CD2-CE 3.29Å; F429-M449 HydrophobicContact CE2-CE 3.52Å; F429-M449 HydrophobicContact CG-CE 4.46Å; N432-M449 PolarHBondContact ND2-SD 3.12Å; V444-M449 HydrophobicContact CB-CG 4.2Å; V444-M449 HydrophobicContact CG1-CG 3.76Å; P445-M449 PolarHBondContact O-N 3.33Å; F446-M449 WeakPolarHBondContact O-CB 3.42Å; F446-M449 PolarHBondContact O-N 3.39Å; F446-M449 VanDerWaalsContact O-N 3.16Å; M449-A451 VanDerWaalsContact C-N 3.35Å; M449-L452 PolarHBondContact O-N 2.83Å; M449-L453 WeakPolarHBondContact O-CG 3.21Å; M449-L453 PolarHBondContact O-N 3.41Å
450	V	92.7	Very high	92	Very high	61 Å²	61	46.8 Å²	46.8	37%	0.37	27%	0.274	S	S	.	.	H	α-helix	trans	-63.4	-42.3	174.4	175.9	0	0	0	0	110.6	F446 P447 T448 L452 L453 C454	F446-V450 HydrophobicContact CD1-CG2 4.26Å; F446-V450 HydrophobicContact CE1-CG2 3.8Å; F446-V450 HydrophobicContact CE2-CG2 4.22Å; F446-V450 HydrophobicContact CZ-CG2 3.78Å; F446-V450 WeakPolarHBondContact O-CG2 3.41Å; F446-V450 PolarHBondContact O-N 3Å; P447-V450 PolarHBondContact O-N 3.24Å; T448-V450 VanDerWaalsContact C-N 3.34Å; T448-V450 PolarHBondContact O-N 3.44Å; V450-L452 PolarHBondContact O-N 3.12Å; V450-L453 WeakPolarHBondContact O-CB 3.26Å; V450-L453 PolarHBondContact O-N 3.04Å; V450-C454 WeakPolarHBondContact O-CB 3.1Å; V450-C454 PolarHBondContact O-N 3.36Å; V450-C454 PolarHBondContact O-SG 3.03Å; V450-C454 VanDerWaalsContact O-SG 3.33Å
451	A	91.7	Very high	92.2	Very high	41 Å²	41	47.9 Å²	47.9	34%	0.339	28%	0.278	S	S	.	.	H	α-helix	trans	-60.8	-42	175.7	0	0	0	0	0	112.4	P447 T448 M449 C454 M455	P447-A451 WeakPolarHBondContact O-CB 3.38Å; P447-A451 PolarHBondContact O-N 3.46Å; T448-A451 WeakPolarHBondContact O-CB 3.46Å; T448-A451 PolarHBondContact O-N 2.9Å; M449-A451 VanDerWaalsContact C-N 3.35Å; A451-C454 PolarHBondContact O-N 3.38Å; A451-M455 HydrophobicContact CB-CE 4.46Å; A451-M455 WeakPolarHBondContact O-CB 3.41Å; A451-M455 WeakPolarHBondContact O-CG 3.18Å; A451-M455 PolarHBondContact O-N 2.99Å
452	L	91.7	Very high	92.6	Very high	46 Å²	46	50.4 Å²	50.4	24%	0.241	30%	0.295	C	S	.	.	H	α-helix	trans	-62.9	-40.5	174.3	-69.8	167	0	0	0	112.2	L76 L80 V444 T448 M449 V450 M455 W456	L76-L452 HydrophobicContact CD1-CD2 4.27Å; L76-L452 HydrophobicContact CD2-CD2 4.45Å; L80-L452 HydrophobicContact CD2-CD1 4.09Å; V444-L452 HydrophobicContact CG1-CD1 4.46Å; T448-L452 HydrophobicContact CG2-CD1 4.48Å; T448-L452 VanDerWaalsContact O-CG 3.3Å; T448-L452 WeakPolarHBondContact O-CG 3.47Å; T448-L452 PolarHBondContact O-N 2.85Å; M449-L452 PolarHBondContact O-N 2.83Å; V450-L452 PolarHBondContact O-N 3.12Å; L452-M455 HydrophobicContact CD2-CE 3.85Å; L452-M455 HydrophobicContact CG-CE 4.36Å; L452-M455 PolarHBondContact O-N 3.15Å; L452-W456 WeakPolarHBondContact O-CB 3.16Å; L452-W456 PolarHBondContact O-N 3.01Å
453	L	92.9	Very high	93	Very high	55 Å²	55	51.8 Å²	51.8	29%	0.288	30%	0.299	S	S	.	.	H	α-helix	trans	-64.6	-44.9	173.7	-74.9	171	0	0	0	111.7	F425 M449 V450 M455 W456 F457	F425-L453 HydrophobicContact CD2-CD2 4.2Å; F425-L453 HydrophobicContact CE1-CD2 4.11Å; F425-L453 HydrophobicContact CE2-CD1 4.39Å; F425-L453 HydrophobicContact CE2-CD2 3.64Å; F425-L453 HydrophobicContact CE2-CG 3.84Å; F425-L453 HydrophobicContact CZ-CD1 4.02Å; F425-L453 HydrophobicContact CZ-CD2 3.6Å; F425-L453 HydrophobicContact CZ-CG 3.91Å; M449-L453 WeakPolarHBondContact O-CG 3.21Å; M449-L453 PolarHBondContact O-N 3.41Å; V450-L453 WeakPolarHBondContact O-CB 3.26Å; V450-L453 PolarHBondContact O-N 3.04Å; L453-M455 VanDerWaalsContact C-N 3.31Å; L453-M455 PolarHBondContact O-N 2.91Å; L453-W456 HydrophobicContact CD2-CE3 4.05Å; L453-W456 HydrophobicContact CD2-CZ3 4.3Å; L453-W456 PolarHBondContact O-N 2.92Å; L453-F457 HydrophobicContact CD2-CD2 4.35Å; L453-F457 HydrophobicContact CD2-CE2 3.96Å; L453-F457 WeakPolarHBondContact O-CD2 2.89Å; L453-F457 PolarHBondContact O-N 2.88Å
454	C	94.2	Very high	93.3	Very high	80 Å²	80	51.2 Å²	51.2	54%	0.541	30%	0.295	S	S	.	.	H	α-helix	trans	-61.6	-39.8	175.2	-71.4	0	0	0	0	111.8	V450 A451 G458	V450-C454 WeakPolarHBondContact O-CB 3.1Å; V450-C454 PolarHBondContact O-N 3.36Å; V450-C454 PolarHBondContact O-SG 3.03Å; V450-C454 VanDerWaalsContact O-SG 3.33Å; A451-C454 PolarHBondContact O-N 3.38Å; C454-G458 WeakPolarHBondContact O-CA 3.43Å; C454-G458 PolarHBondContact O-N 3.02Å
455	M	92.4	Very high	93.6	Very high	31 Å²	31	53 Å²	53	15%	0.153	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-42	174.3	-84.7	-170.1	-72.8	0	0	112.1	L76 F384 M387 A451 L452 L453 I459 S460	L76-M455 HydrophobicContact CD1-CE 4.26Å; L76-M455 HydrophobicContact CD2-CE 3.82Å; L76-M455 HydrophobicContact CD2-SD 4.4Å; F384-M455 HydrophobicContact CE1-SD 4.44Å; M387-M455 HydrophobicContact CE-CB 4.44Å; M387-M455 HydrophobicContact CE-CG 4.31Å; M387-M455 HydrophobicContact CE-SD 3.73Å; M387-M455 HydrophobicContact SD-CB 3.59Å; M387-M455 VanDerWaalsContact SD-CB 3.59Å; M387-M455 HydrophobicContact SD-CG 4.02Å; M387-M455 HydrophobicContact SD-SD 4.15Å; A451-M455 HydrophobicContact CB-CE 4.46Å; A451-M455 WeakPolarHBondContact O-CB 3.41Å; A451-M455 WeakPolarHBondContact O-CG 3.18Å; A451-M455 PolarHBondContact O-N 2.99Å; L452-M455 HydrophobicContact CD2-CE 3.85Å; L452-M455 HydrophobicContact CG-CE 4.36Å; L452-M455 PolarHBondContact O-N 3.15Å; L453-M455 VanDerWaalsContact C-N 3.31Å; L453-M455 PolarHBondContact O-N 2.91Å; M455-I459 HydrophobicContact CG-CD1 4.43Å; M455-I459 WeakPolarHBondContact O-CB 3.09Å; M455-I459 PolarHBondContact O-N 3.39Å; M455-S460 PolarHBondContact O-N 3.34Å
456	W	94.7	Very high	93.9	Very high	34 Å²	34	54.8 Å²	54.8	13%	0.129	31%	0.306	C	S	.	.	I	π-helix	trans	-66.7	-53.7	177.5	179.3	16.8	0	0	0	112.3	A417 P421 G422 F425 L452 L453 S460 L461	A417-W456 PolarHBondContact O-NE1 3.4Å; A417-W456 VanDerWaalsContact O-NE1 3.07Å; P421-W456 HydrophobicContact CB-CD2 4.24Å; P421-W456 HydrophobicContact CB-CH2 4.49Å; P421-W456 HydrophobicContact CB-CZ2 3.66Å; G422-W456 VanDerWaalsContact CA-CH2 3.46Å; F425-W456 HydrophobicContact CB-CE3 4.35Å; F425-W456 HydrophobicContact CB-CH2 4.33Å; F425-W456 HydrophobicContact CB-CZ3 3.7Å; F425-W456 HydrophobicContact CD1-CZ3 4.14Å; F425-W456 HydrophobicContact CD2-CZ3 4.35Å; F425-W456 HydrophobicContact CG-CE3 4.37Å; F425-W456 AromaticContact CG-CZ3 3.8Å; F425-W456 HydrophobicContact CG-CZ3 3.8Å; L452-W456 WeakPolarHBondContact O-CB 3.16Å; L452-W456 PolarHBondContact O-N 3.01Å; L453-W456 HydrophobicContact CD2-CE3 4.05Å; L453-W456 HydrophobicContact CD2-CZ3 4.3Å; L453-W456 PolarHBondContact O-N 2.92Å; W456-S460 WeakPolarHBondContact O-CB 3.19Å; W456-S460 PolarHBondContact O-N 3.01Å; W456-L461 WeakPolarHBondContact O-CB 3.47Å; W456-L461 PolarHBondContact O-N 3.04Å
457	F	95.1	Very high	94.3	Very high	103 Å²	103	47.4 Å²	47.4	45%	0.452	27%	0.273	S	S	.	.	I	π-helix	trans	-79.3	-28.3	-177.5	-73.4	-78.1	0	0	0	113.7	L453 L461 P462	L453-F457 HydrophobicContact CD2-CD2 4.35Å; L453-F457 HydrophobicContact CD2-CE2 3.96Å; L453-F457 WeakPolarHBondContact O-CD2 2.89Å; L453-F457 PolarHBondContact O-N 2.88Å; F457-L461 HydrophobicContact CD1-CD1 3.82Å; F457-L461 HydrophobicContact CE1-CD1 4.14Å; F457-P462 VanDerWaalsContact O-CD 3.28Å; F457-P462 WeakPolarHBondContact O-CD 3.4Å
458	G	94	Very high	94.6	Very high	51 Å²	51	42.9 Å²	42.9	53%	0.526	24%	0.244	S	C	.	.	I	π-helix	trans	-91.6	-27.7	-176.4	0	0	0	0	0	114.7	C454	C454-G458 WeakPolarHBondContact O-CA 3.43Å; C454-G458 PolarHBondContact O-N 3.02Å
459	I	94.2	Very high	94.9	Very high	66 Å²	66	45.8 Å²	45.8	34%	0.338	25%	0.253	S	S	.	.	I	π-helix	trans	-118.6	-60.9	-179	-55.5	175.5	0	0	0	110.6	M387 M455 L461 P462 L463	M387-I459 HydrophobicContact CB-CG2 4.4Å; M387-I459 HydrophobicContact SD-CB 4.37Å; M455-I459 HydrophobicContact CG-CD1 4.43Å; M455-I459 WeakPolarHBondContact O-CB 3.09Å; M455-I459 PolarHBondContact O-N 3.39Å; I459-L461 PolarHBondContact O-N 3.32Å; I459-P462 WeakPolarHBondContact O-CD 3.43Å; I459-L463 HydrophobicContact CG2-CD1 3.75Å; I459-L463 HydrophobicContact CG2-CG 4.44Å; I459-L463 WeakPolarHBondContact O-CB 3.35Å; I459-L463 VanDerWaalsContact O-CG 3.26Å; I459-L463 WeakPolarHBondContact O-CG 3.33Å; I459-L463 PolarHBondContact O-N 3.19Å; I459-L463 VanDerWaalsContact O-N 3.07Å
460	S	94.5	Very high	95.2	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.021	27%	0.27	C	S	.	.	I	π-helix	trans	-63.5	-48.2	-171.2	-173.8	0	0	0	0	112.8	M455 W456 L463 V464	M455-S460 PolarHBondContact O-N 3.34Å; W456-S460 WeakPolarHBondContact O-CB 3.19Å; W456-S460 PolarHBondContact O-N 3.01Å; S460-L463 PolarHBondContact O-N 3.28Å; S460-V464 WeakPolarHBondContact O-CG2 3.47Å; S460-V464 PolarHBondContact O-N 3.12Å
461	L	95.9	Very high	95.3	Very high	29 Å²	29	46.9 Å²	46.9	15%	0.152	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-49.9	-179.5	-179.3	160	0	0	0	111.9	A417 W456 F457 I459 L463 V464 Y465	A417-L461 HydrophobicContact CB-CB 4.29Å; A417-L461 HydrophobicContact CB-CD1 4.41Å; A417-L461 HydrophobicContact CB-CG 3.91Å; W456-L461 WeakPolarHBondContact O-CB 3.47Å; W456-L461 PolarHBondContact O-N 3.04Å; F457-L461 HydrophobicContact CD1-CD1 3.82Å; F457-L461 HydrophobicContact CE1-CD1 4.14Å; I459-L461 PolarHBondContact O-N 3.32Å; L461-L463 VanDerWaalsContact C-N 3.33Å; L461-L463 PolarHBondContact O-N 3.38Å; L461-V464 PolarHBondContact O-N 3.27Å; L461-Y465 HydrophobicContact CD2-CD2 3.64Å; L461-Y465 HydrophobicContact CD2-CE2 3.7Å; L461-Y465 HydrophobicContact CG-CD2 4.11Å; L461-Y465 HydrophobicContact CG-CE2 4.09Å; L461-Y465 WeakPolarHBondContact O-CD2 3.4Å; L461-Y465 PolarHBondContact O-N 3.01Å
462	P	96.8	Very high	95.5	Very high	59 Å²	59	46.7 Å²	46.7	38%	0.383	24%	0.244	S	C	.	.	H	α-helix	trans	-57.3	-41.3	173.9	-29.9	37.1	0	0	0	113.8	F457 I459 Y465 L466	F457-P462 VanDerWaalsContact O-CD 3.28Å; F457-P462 WeakPolarHBondContact O-CD 3.4Å; I459-P462 WeakPolarHBondContact O-CD 3.43Å; P462-Y465 WeakPolarHBondContact O-CB 3.34Å; P462-Y465 PolarHBondContact O-N 3.41Å; P462-L466 WeakPolarHBondContact O-CB 3.46Å; P462-L466 PolarHBondContact O-N 3.26Å
463	L	96.9	Very high	95.6	Very high	39 Å²	39	52.2 Å²	52.2	20%	0.204	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-40.5	177.7	-72.5	179	0	0	0	112.3	F388 V391 I459 S460 L461 L466 G467	F388-L463 HydrophobicContact CD1-CD1 3.94Å; V391-L463 HydrophobicContact CG2-CB 3.82Å; V391-L463 HydrophobicContact CG2-CD2 3.72Å; V391-L463 HydrophobicContact CG2-CG 4.22Å; I459-L463 HydrophobicContact CG2-CD1 3.75Å; I459-L463 HydrophobicContact CG2-CG 4.44Å; I459-L463 WeakPolarHBondContact O-CB 3.35Å; I459-L463 VanDerWaalsContact O-CG 3.26Å; I459-L463 WeakPolarHBondContact O-CG 3.33Å; I459-L463 PolarHBondContact O-N 3.19Å; I459-L463 VanDerWaalsContact O-N 3.07Å; S460-L463 PolarHBondContact O-N 3.28Å; L461-L463 VanDerWaalsContact C-N 3.33Å; L461-L463 PolarHBondContact O-N 3.38Å; L463-L466 PolarHBondContact O-N 3Å; L463-G467 PolarHBondContact O-N 3.33Å
464	V	97.6	Very high	95.7	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-44.7	172.5	174.2	0	0	0	0	110.6	G390 T416 A417 S460 L461 L466 G467 Y468	G390-V464 WeakPolarHBondContact O-CA 3.45Å; T416-V464 HydrophobicContact CG2-CG1 3.97Å; A417-V464 HydrophobicContact CB-CB 4.01Å; A417-V464 HydrophobicContact CB-CG1 3.86Å; A417-V464 HydrophobicContact CB-CG2 4.46Å; S460-V464 WeakPolarHBondContact O-CG2 3.47Å; S460-V464 PolarHBondContact O-N 3.12Å; L461-V464 PolarHBondContact O-N 3.27Å; V464-L466 PolarHBondContact O-N 3.35Å; V464-G467 PolarHBondContact O-N 3.47Å; V464-Y468 WeakPolarHBondContact O-CB 3.47Å; V464-Y468 PolarHBondContact O-N 3.05Å
465	Y	97.5	Very high	95.6	Very high	65 Å²	65	57.7 Å²	57.7	26%	0.255	28%	0.276	S	S	.	.	H	α-helix	trans	-61.1	-42.6	176.4	-96.5	-102.4	0	0	0	112.8	K410 A413 F414 L461 P462 Y468 Y469	K410-Y465 PolarHBondContact O-OH 3.46Å; A413-Y465 HydrophobicContact CB-CD1 3.86Å; A413-Y465 HydrophobicContact CB-CD2 4.16Å; A413-Y465 HydrophobicContact CB-CE1 3.81Å; A413-Y465 HydrophobicContact CB-CE2 4.12Å; A413-Y465 HydrophobicContact CB-CG 4.05Å; F414-Y465 WeakPolarHBondContact CB-OH 3.21Å; L461-Y465 HydrophobicContact CD2-CD2 3.64Å; L461-Y465 HydrophobicContact CD2-CE2 3.7Å; L461-Y465 HydrophobicContact CG-CD2 4.11Å; L461-Y465 HydrophobicContact CG-CE2 4.09Å; L461-Y465 WeakPolarHBondContact O-CD2 3.4Å; L461-Y465 PolarHBondContact O-N 3.01Å; P462-Y465 WeakPolarHBondContact O-CB 3.34Å; P462-Y465 PolarHBondContact O-N 3.41Å; Y465-Y468 PolarHBondContact O-N 3.28Å; Y465-Y469 VanDerWaalsContact O-CB 3.31Å; Y465-Y469 WeakPolarHBondContact O-CB 3.41Å; Y465-Y469 PolarHBondContact O-N 3.34Å
466	L	97.3	Very high	95.5	Very high	85 Å²	85	58.3 Å²	58.3	45%	0.445	28%	0.282	S	S	.	.	H	α-helix	trans	-62.4	-51	177.3	-178.4	123.4	0	0	0	110.8	V391 P462 L463 V464 Y468 Y469 F470	V391-L466 HydrophobicContact CG1-CD2 4.32Å; V391-L466 HydrophobicContact CG2-CD2 4.43Å; P462-L466 WeakPolarHBondContact O-CB 3.46Å; P462-L466 PolarHBondContact O-N 3.26Å; L463-L466 PolarHBondContact O-N 3Å; V464-L466 PolarHBondContact O-N 3.35Å; L466-Y468 VanDerWaalsContact C-N 3.33Å; L466-Y468 PolarHBondContact O-N 3.05Å; L466-Y469 PolarHBondContact O-N 3.24Å; L466-F470 HydrophobicContact CD1-CE2 4.18Å; L466-F470 HydrophobicContact CD2-CD2 4.15Å; L466-F470 HydrophobicContact CD2-CE2 3.94Å; L466-F470 HydrophobicContact CG-CD2 4.05Å; L466-F470 HydrophobicContact CG-CE2 3.73Å; L466-F470 WeakPolarHBondContact O-CD2 3.31Å; L466-F470 PolarHBondContact O-N 3.01Å; L466-F470 VanDerWaalsContact O-N 3.13Å
467	G	97.4	Very high	95.3	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-55.4	-49.1	173.6	0	0	0	0	0	111.7	V391 G394 F395 L463 V464 Y469 F470 G471	V391-G467 VanDerWaalsContact O-CA 3.32Å; V391-G467 WeakPolarHBondContact O-CA 3.4Å; G394-G467 VanDerWaalsContact C-C 3.47Å; F395-G467 WeakPolarHBondContact CA-O 3.33Å; F395-G467 PolarHBondContact N-O 3.47Å; L463-G467 PolarHBondContact O-N 3.33Å; V464-G467 PolarHBondContact O-N 3.47Å; G467-Y469 VanDerWaalsContact C-N 3.34Å; G467-Y469 PolarHBondContact O-N 3.04Å; G467-F470 PolarHBondContact O-N 2.97Å; G467-G471 PolarHBondContact O-N 3.27Å
468	Y	97.8	Very high	94.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.7	-41.4	-179.6	-157	-72	0	0	0	112.5	G394 A397 G398 Y401 W409 G412 A413 V464 Y465 L466 G471 F472	G394-Y468 VanDerWaalsContact C-CA 3.5Å; G394-Y468 VanDerWaalsContact C-N 3.29Å; G394-Y468 WeakPolarHBondContact O-CA 3.46Å; G394-Y468 PolarHBondContact O-N 3.46Å; A397-Y468 HydrophobicContact CB-CD2 3.96Å; A397-Y468 HydrophobicContact CB-CE2 3.73Å; G398-Y468 VanDerWaalsContact CA-CE1 3.5Å; Y401-Y468 VanDerWaalsContact CB-OH 3.31Å; Y401-Y468 WeakPolarHBondContact CB-OH 3.32Å; Y401-Y468 WeakPolarHBondContact CD1-OH 3.31Å; Y401-Y468 VanDerWaalsContact CG-OH 3.32Å; W409-Y468 HydrophobicContact CB-CE1 4.03Å; W409-Y468 HydrophobicContact CE3-CD1 4.47Å; W409-Y468 WeakPolarHBondContact O-CE1 3.27Å; G412-Y468 VanDerWaalsContact C-CE2 3.44Å; G412-Y468 WeakPolarHBondContact CA-OH 3.5Å; A413-Y468 HydrophobicContact CB-CD1 3.92Å; A413-Y468 HydrophobicContact CB-CD2 3.99Å; A413-Y468 HydrophobicContact CB-CE1 4.44Å; A413-Y468 HydrophobicContact CB-CE2 4.48Å; A413-Y468 HydrophobicContact CB-CG 3.67Å; V464-Y468 WeakPolarHBondContact O-CB 3.47Å; V464-Y468 PolarHBondContact O-N 3.05Å; Y465-Y468 PolarHBondContact O-N 3.28Å; L466-Y468 VanDerWaalsContact C-N 3.33Å; L466-Y468 PolarHBondContact O-N 3.05Å; Y468-G471 PolarHBondContact O-N 3.34Å; Y468-F472 HydrophobicContact CD1-CB 4.33Å; Y468-F472 HydrophobicContact CE1-CB 4.45Å; Y468-F472 HydrophobicContact CE1-CD2 4.2Å; Y468-F472 WeakPolarHBondContact O-CB 3.46Å; Y468-F472 PolarHBondContact O-N 3.28Å
469	Y	97	Very high	94.6	Very high	82 Å²	82	59.3 Å²	59.3	32%	0.322	28%	0.28	S	S	.	.	H	α-helix	trans	-61.1	-47.3	176.2	172.5	-101.2	0	0	0	112	W409 Y465 L466 G467 F472 R473	W409-Y469 HydrophobicContact CH2-CD2 4.13Å; W409-Y469 HydrophobicContact CZ3-CD2 4.38Å; Y465-Y469 VanDerWaalsContact O-CB 3.31Å; Y465-Y469 WeakPolarHBondContact O-CB 3.41Å; Y465-Y469 PolarHBondContact O-N 3.34Å; L466-Y469 PolarHBondContact O-N 3.24Å; G467-Y469 VanDerWaalsContact C-N 3.34Å; G467-Y469 PolarHBondContact O-N 3.04Å; Y469-F472 PolarHBondContact O-N 3.09Å; Y469-R473 WeakPolarHBondContact O-CB 3.33Å; Y469-R473 WeakPolarHBondContact O-CG 3.22Å; Y469-R473 PolarHBondContact O-N 3.32Å; Y469-R473 PolarHBondContact OH-NE 2.83Å; Y469-R473 PolarHBondContact OH-NH1 2.79Å; Y469-R473 PolarHBondContact OH-NH2 3.14Å
470	F	96.8	Very high	94.3	Very high	113 Å²	113	59 Å²	59	50%	0.496	28%	0.282	S	S	.	.	H	α-helix	trans	-66.3	-41.4	176.5	-72.9	-62.2	0	0	0	112.2	F395 L466 G467 R473 K474	F395-F470 HydrophobicContact CD2-CB 4.27Å; L466-F470 HydrophobicContact CD1-CE2 4.18Å; L466-F470 HydrophobicContact CD2-CD2 4.15Å; L466-F470 HydrophobicContact CD2-CE2 3.94Å; L466-F470 HydrophobicContact CG-CD2 4.05Å; L466-F470 HydrophobicContact CG-CE2 3.73Å; L466-F470 WeakPolarHBondContact O-CD2 3.31Å; L466-F470 PolarHBondContact O-N 3.01Å; L466-F470 VanDerWaalsContact O-N 3.13Å; G467-F470 PolarHBondContact O-N 2.97Å; F470-R473 PolarHBondContact O-N 3.44Å; F470-K474 PolarHBondContact O-N 3.38Å
471	G	96.1	Very high	93.9	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.7	-44.8	176	0	0	0	0	0	112.4	F395 R399 G467 Y468 R473 K474	F395-G471 VanDerWaalsContact CD2-CA 3.47Å; F395-G471 WeakPolarHBondContact O-CA 3.38Å; R399-G471 VanDerWaalsContact CA-O 3.3Å; R399-G471 WeakPolarHBondContact CA-O 3.35Å; R399-G471 WeakPolarHBondContact CB-O 3.45Å; G467-G471 PolarHBondContact O-N 3.27Å; Y468-G471 PolarHBondContact O-N 3.34Å; G471-R473 VanDerWaalsContact C-N 3.32Å; G471-R473 PolarHBondContact O-N 3.43Å; G471-K474 WeakPolarHBondContact O-CB 3.17Å; G471-K474 PolarHBondContact O-N 2.83Å
472	F	95.1	Very high	93.4	Very high	37 Å²	37	69.2 Å²	69.2	16%	0.162	32%	0.32	C	S	.	.	H	α-helix	trans	-69.5	-27.5	177.8	-163.5	-93.3	0	0	0	112.2	G398 Y401 R402 G406 W409 Y468 Y469	G398-F472 WeakPolarHBondContact O-CD2 3.35Å; Y401-F472 HydrophobicContact CD1-CD2 4.37Å; Y401-F472 AromaticContact CD1-CE2 3.95Å; Y401-F472 HydrophobicContact CD1-CE2 3.95Å; R402-F472 HydrophobicContact CB-CD2 3.81Å; R402-F472 HydrophobicContact CB-CE2 3.82Å; R402-F472 HydrophobicContact CB-CG 4.47Å; R402-F472 HydrophobicContact CB-CZ 4.49Å; R402-F472 WeakPolarHBondContact CD-O 3.11Å; R402-F472 HydrophobicContact CG-CE2 4.34Å; R402-F472 PolarHBondContact NH1-O 3.38Å; G406-F472 VanDerWaalsContact O-CE2 3.26Å; G406-F472 WeakPolarHBondContact O-CE2 3.28Å; G406-F472 VanDerWaalsContact O-CZ 3.28Å; G406-F472 WeakPolarHBondContact O-CZ 3.27Å; W409-F472 HydrophobicContact CB-CD1 3.81Å; W409-F472 HydrophobicContact CB-CD2 3.68Å; W409-F472 HydrophobicContact CB-CE1 3.87Å; W409-F472 HydrophobicContact CB-CE2 3.75Å; W409-F472 HydrophobicContact CB-CG 3.73Å; W409-F472 HydrophobicContact CB-CZ 3.84Å; W409-F472 HydrophobicContact CG-CD1 4.13Å; W409-F472 HydrophobicContact CG-CE1 4.22Å; W409-F472 HydrophobicContact CG-CG 4.42Å; Y468-F472 HydrophobicContact CD1-CB 4.33Å; Y468-F472 HydrophobicContact CE1-CB 4.45Å; Y468-F472 HydrophobicContact CE1-CD2 4.2Å; Y468-F472 WeakPolarHBondContact O-CB 3.46Å; Y468-F472 PolarHBondContact O-N 3.28Å; Y469-F472 PolarHBondContact O-N 3.09Å
473	R	94.5	Very high	93	Very high	163 Å²	163	68.5 Å²	68.5	62%	0.615	32%	0.315	S	S	*	.	H	α-helix	trans	-80.1	-26.7	174.2	-79.3	-175.9	165.5	-157.2	-2	113.7	R402 Y469 F470 G471	R402-R473 PolarHBondContact NH1-O 2.87Å; Y469-R473 WeakPolarHBondContact O-CB 3.33Å; Y469-R473 WeakPolarHBondContact O-CG 3.22Å; Y469-R473 PolarHBondContact O-N 3.32Å; Y469-R473 PolarHBondContact OH-NE 2.83Å; Y469-R473 PolarHBondContact OH-NH1 2.79Å; Y469-R473 PolarHBondContact OH-NH2 3.14Å; F470-R473 PolarHBondContact O-N 3.44Å; G471-R473 VanDerWaalsContact C-N 3.32Å; G471-R473 PolarHBondContact O-N 3.43Å
474	K	93.9	Very high	92.7	Very high	111 Å²	111	70.9 Å²	70.9	48%	0.483	33%	0.328	S	S	.	.	S	Bend	trans	-60.7	150.4	174.6	-165.7	64.6	176.1	-177.9	0	110.5	R402 F470 G471	R402-K474 PolarHBondContact NH1-O 3.01Å; F470-K474 PolarHBondContact O-N 3.38Å; G471-K474 WeakPolarHBondContact O-CB 3.17Å; G471-K474 PolarHBondContact O-N 2.83Å
475	Q	92.5	Very high	92.2	Very high	138 Å²	138	79.9 Å²	79.9	65%	0.645	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-54	136.8	173.9	-76.7	173.2	-25.6	0	0	110.2	R399	R399-Q475 PolarHBondContact NE-O 2.74Å
476	P	91.1	Very high	91.8	Very high	44 Å²	44	83.5 Å²	83.5	29%	0.286	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-51.1	151.3	169.5	-16.9	26.6	0	0	0	110	R402 T403 D478	R402-P476 HydrophobicContact CG-CG 4.11Å; T403-P476 WeakPolarHBondContact OG1-CA 3.37Å; P476-D478 PolarHBondContact O-N 2.9Å
477	Y	90	Very high	91.4	Very high	39 Å²	39	82.6 Å²	82.6	15%	0.153	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-57.3	127.5	163.5	-60.6	-72.8	0	0	0	109.7	R399 T403 N479 Y629	R399-Y477 HydrophobicContact CB-CE2 4.36Å; R399-Y477 HydrophobicContact CG-CD2 4.29Å; R399-Y477 HydrophobicContact CG-CE2 3.77Å; T403-Y477 HydrophobicContact CG2-CD2 4.45Å; T403-Y477 WeakPolarHBondContact OG1-CD2 3.34Å; T403-Y477 PolarHBondContact OG1-N 3.31Å; Y477-N479 PolarHBondContact O-N 3.17Å; Y477-Y629 WeakPolarHBondContact CB-OH 3.29Å; Y477-Y629 AromaticContact CD2-CE1 3.98Å; Y477-Y629 HydrophobicContact CD2-CE1 3.98Å; Y477-Y629 HydrophobicContact CE2-CE1 4.41Å; Y477-Y629 HydrophobicContact CG-CE1 4.06Å
478	D	86	Confident	91	Very high	121 Å²	121	87.2 Å²	87.2	65%	0.647	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-69	119.3	175	-57.4	-52.1	0	0	0	109	P476 R633	P476-D478 PolarHBondContact O-N 2.9Å; D478-R633 PolarHBondContact O-NE 2.87Å; D478-R633 PolarHBondContact O-NH2 2.97Å
479	N	87.9	Confident	90.6	Very high	50 Å²	50	95.9 Å²	95.9	27%	0.267	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-86.5	125.6	170.7	-66.1	-25.3	0	0	0	107	F335 Y477 V481	F335-N479 HydrophobicContact CB-CB 4.09Å; F335-N479 HydrophobicContact CD1-CB 4Å; F335-N479 WeakPolarHBondContact CD1-OD1 3.44Å; F335-N479 HydrophobicContact CD2-CB 3.95Å; F335-N479 HydrophobicContact CE1-CB 4.48Å; F335-N479 HydrophobicContact CE2-CB 4.45Å; F335-N479 HydrophobicContact CG-CB 3.73Å; Y477-N479 PolarHBondContact O-N 3.17Å; N479-V481 PolarHBondContact O-N 2.94Å; N479-V481 VanDerWaalsContact O-N 3.15Å
480	P	87.1	Confident	90.3	Very high	58 Å²	58	94 Å²	94	38%	0.377	44%	0.444	S	S	.	.	S	Bend	trans	-63.6	-21.5	-174.3	25	-35.3	0	0	0	113.5	F335 A637	F335-P480 HydrophobicContact CE2-CG 3.68Å; F335-P480 HydrophobicContact CZ-CG 3.86Å; P480-A637 HydrophobicContact CB-CB 3.91Å; P480-A637 HydrophobicContact CG-CB 4.3Å
481	V	86.5	Confident	89.9	Confident	17 Å²	17	91.2 Å²	91.2	10%	0.103	44%	0.437	C	S	.	.	S	Bend	trans	-127.7	144.2	-173.6	-174.9	0	0	0	0	110.4	H331 F335 N479 Y636 I641	H331-V481 HydrophobicContact CB-CG1 4.02Å; H331-V481 VanDerWaalsContact O-CG1 3.25Å; H331-V481 WeakPolarHBondContact O-CG1 3.34Å; F335-V481 HydrophobicContact CD2-CB 4.43Å; N479-V481 PolarHBondContact O-N 2.94Å; N479-V481 VanDerWaalsContact O-N 3.15Å; V481-Y636 HydrophobicContact CG2-CD1 4.31Å; V481-I641 HydrophobicContact CG1-CD1 4.49Å; V481-I641 HydrophobicContact CG1-CG2 4.37Å; V481-I641 HydrophobicContact CG2-CD1 3.54Å
482	R	86.4	Confident	89.5	Confident	231 Å²	231	100.6 Å²	100.6	87%	0.872	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-77.7	148.6	176.2	-68	-176	177.4	-176.1	2.6	111.2
483	T	88.7	Confident	89	Confident	43 Å²	43	101.1 Å²	101.1	26%	0.264	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-89.1	129.8	177.3	58.1	0	0	0	0	111.3	G332 F335 K405	G332-T483 CarbonylContact O-C 3.59Å; G332-T483 WeakPolarHBondContact O-CA 3.47Å; F335-T483 HydrophobicContact CB-CG2 4.13Å; K405-T483 PolarHBondContact NZ-OG1 3.11Å
484	N	88.8	Confident	88.6	Confident	89 Å²	89	101.7 Å²	101.7	48%	0.476	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-62.5	153.1	173.1	-73.8	-20.1	0	0	0	111.7	G332 R336	G332-N484 PolarHBondContact O-N 3.38Å; R336-N484 PolarHBondContact NH2-O 2.93Å
485	Q	88	Confident	88.3	Confident	191 Å²	191	105.1 Å²	105.1	89%	0.893	50%	0.496	S	S	*	.	S	Bend	trans	-68.5	-45.9	178.3	-67.3	-173.4	-2.4	0	0	111.3	R336	R336-Q485 PolarHBondContact NH1-O 3.36Å
486	I	89	Confident	87.7	Confident	141 Å²	141	102.9 Å²	102.9	72%	0.723	48%	0.483	S	S	*	.	S	Bend	trans	-95.7	128	-178.6	-58.2	173.4	0	0	0	108.9	R336	R336-I486 PolarHBondContact NH2-O 2.79Å
487	P	89.5	Confident	87.2	Confident	65 Å²	65	101.8 Å²	101.8	42%	0.422	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-69.9	135.1	174.9	27.8	-32.1	0	0	0	111.1	Y565	P487-Y565 WeakPolarHBondContact CB-OH 3Å
488	R	88.3	Confident	87	Confident	98 Å²	98	103.8 Å²	103.8	37%	0.37	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-63.1	146.2	171.8	-165.5	-167.4	178.6	97.7	5.3	111.2	L329 D333	L329-R488 VanDerWaalsContact CD1-CZ 3.46Å; D333-R488 VanDerWaalsContact OD2-CB 3.27Å; D333-R488 WeakPolarHBondContact OD2-CB 3.44Å; D333-R488 PolarHBondContact OD2-N 2.97Å
489	Q	89.9	Confident	87	Confident	182 Å²	182	105.1 Å²	105.1	85%	0.85	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-69.1	137.9	168.4	-66.3	-176.6	-4.3	0	0	110.3
490	I	89.4	Confident	87	Confident	42 Å²	42	110.6 Å²	110.6	22%	0.215	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-96.5	127.5	-178.3	-62.5	163.8	0	0	0	107.9	D564 Y565 R566	I490-D564 HydrophobicContact CG2-CB 3.91Å; I490-Y565 HydrophobicContact CD1-CD1 4.13Å; I490-Y565 HydrophobicContact CD1-CE1 3.7Å; I490-Y565 HydrophobicContact CG1-CD1 4.03Å; I490-Y565 HydrophobicContact CG1-CE1 3.68Å; I490-R566 HydrophobicContact CD1-CG 3.89Å
491	P	89.1	Confident	87.1	Confident	56 Å²	56	109.8 Å²	109.8	36%	0.364	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-65.1	159.9	178.9	28	-35.1	0	0	0	111.7	Q493 E563	P491-Q493 PolarHBondContact O-N 3.1Å; P491-Q493 PolarHBondContact O-NE2 3.24Å; P491-E563 HydrophobicContact CG-CB 3.84Å
492	E	87	Confident	87.2	Confident	197 Å²	197	109 Å²	109	92%	0.921	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-57.7	125.9	175.8	-67.5	-169.3	168.1	0	0	110.8
493	Q	85.6	Confident	87.4	Confident	48 Å²	48	99.6 Å²	99.6	22%	0.224	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-84.9	139.8	-176.9	-60.9	-64.1	-59.5	0	0	109.7	P491 M497 A562	P491-Q493 PolarHBondContact O-N 3.1Å; P491-Q493 PolarHBondContact O-NE2 3.24Å; Q493-M497 HydrophobicContact CB-CB 4.24Å; Q493-A562 PolarHBondContact NE2-O 2.84Å; Q493-A562 VanDerWaalsContact OE1-CB 3.31Å
494	R	86.3	Confident	87.6	Confident	174 Å²	174	101 Å²	101	66%	0.657	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-62.7	152.7	172.9	-64	176.7	-179.6	-175.9	-0	110.5	Y496 M497	R494-Y496 HydrophobicContact CB-CD1 3.99Å; R494-Y496 HydrophobicContact CB-CE1 3.61Å; R494-Y496 WeakPolarHBondContact CD-OH 3.38Å; R494-Y496 HydrophobicContact CG-CE1 4.23Å; R494-Y496 PolarHBondContact NH1-OH 2.87Å; R494-Y496 PolarHBondContact O-N 3.36Å; R494-Y496 VanDerWaalsContact O-N 3.08Å; R494-M497 WeakPolarHBondContact O-CA 3.23Å; R494-M497 WeakPolarHBondContact O-CB 3.46Å; R494-M497 PolarHBondContact O-N 3.28Å
495	W	86	Confident	87.6	Confident	183 Å²	183	102.6 Å²	102.6	69%	0.693	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-53.2	-36.8	-174.3	72.4	-92	0	0	0	114.2	M497 N498 V501	W495-M497 VanDerWaalsContact C-N 3.28Å; W495-M497 PolarHBondContact O-N 3.25Å; W495-N498 VanDerWaalsContact O-CB 3.22Å; W495-N498 WeakPolarHBondContact O-CB 3.07Å; W495-N498 VanDerWaalsContact O-CG 3.25Å; W495-N498 PolarHBondContact O-N 3.35Å; W495-N498 PolarHBondContact O-ND2 3.45Å; W495-N498 VanDerWaalsContact O-ND2 3.12Å; W495-V501 HydrophobicContact CZ3-CG1 4.32Å
496	Y	80.8	Confident	87.6	Confident	92 Å²	92	93.7 Å²	93.7	36%	0.361	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-76.2	-14.3	-179.5	61.2	-97.2	0	0	0	113.5	R494 N498	R494-Y496 HydrophobicContact CB-CD1 3.99Å; R494-Y496 HydrophobicContact CB-CE1 3.61Å; R494-Y496 WeakPolarHBondContact CD-OH 3.38Å; R494-Y496 HydrophobicContact CG-CE1 4.23Å; R494-Y496 PolarHBondContact NH1-OH 2.87Å; R494-Y496 PolarHBondContact O-N 3.36Å; R494-Y496 VanDerWaalsContact O-N 3.08Å; Y496-N498 VanDerWaalsContact C-N 3.3Å
497	M	81	Confident	87.6	Confident	21 Å²	21	87 Å²	87	10%	0.103	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-87.3	-0.7	172.4	-66.2	-58.6	-169.7	0	0	112.8	Q493 R494 W495 F558 R570	Q493-M497 HydrophobicContact CB-CB 4.24Å; R494-M497 WeakPolarHBondContact O-CA 3.23Å; R494-M497 WeakPolarHBondContact O-CB 3.46Å; R494-M497 PolarHBondContact O-N 3.28Å; W495-M497 VanDerWaalsContact C-N 3.28Å; W495-M497 PolarHBondContact O-N 3.25Å; M497-F558 HydrophobicContact CE-CB 3.68Å; M497-F558 HydrophobicContact CE-CG 4.37Å; M497-R570 PolarHBondContact O-NH2 3.12Å; M497-R570 VanDerWaalsContact O-NH2 3.16Å
498	N	85.2	Confident	87.7	Confident	80 Å²	80	87.9 Å²	87.9	43%	0.428	40%	0.397	S	S	.	.	S	Bend	trans	-59.1	143.2	174.7	-76.7	-26.3	0	0	0	110.9	W495 Y496 F500 V501 G502	W495-N498 VanDerWaalsContact O-CB 3.22Å; W495-N498 WeakPolarHBondContact O-CB 3.07Å; W495-N498 VanDerWaalsContact O-CG 3.25Å; W495-N498 PolarHBondContact O-N 3.35Å; W495-N498 PolarHBondContact O-ND2 3.45Å; W495-N498 VanDerWaalsContact O-ND2 3.12Å; Y496-N498 VanDerWaalsContact C-N 3.3Å; N498-F500 VanDerWaalsContact C-N 3.29Å; N498-F500 PolarHBondContact O-N 2.99Å; N498-V501 HydrophobicContact CB-CG2 4.23Å; N498-V501 PolarHBondContact O-N 2.85Å; N498-V501 VanDerWaalsContact O-N 3.16Å; N498-G502 PolarHBondContact O-N 2.87Å
499	R	85.7	Confident	87.6	Confident	150 Å²	150	85.1 Å²	85.1	57%	0.566	39%	0.39	S	S	*	.	H	α-helix	trans	-51	-47.3	-176.2	-175.4	-177.2	-62.7	174.2	1.7	112.6	G502 I503	R499-G502 PolarHBondContact O-N 3.45Å; R499-I503 HydrophobicContact CG-CD1 3.98Å; R499-I503 WeakPolarHBondContact O-CD1 3.38Å; R499-I503 WeakPolarHBondContact O-CG1 3.3Å; R499-I503 PolarHBondContact O-N 3.22Å
500	F	88.3	Confident	87.6	Confident	165 Å²	165	76.6 Å²	76.6	72%	0.724	35%	0.35	S	S	*	.	H	α-helix	trans	-66.7	-44.6	-178.1	-65.5	-73.8	0	0	0	112.6	N498 G502 I503 L504	N498-F500 VanDerWaalsContact C-N 3.29Å; N498-F500 PolarHBondContact O-N 2.99Å; F500-G502 VanDerWaalsContact C-N 3.32Å; F500-G502 PolarHBondContact O-N 3.24Å; F500-I503 PolarHBondContact O-N 2.88Å; F500-L504 WeakPolarHBondContact O-CG 3.26Å; F500-L504 PolarHBondContact O-N 2.75Å; F500-L504 VanDerWaalsContact O-N 3.08Å
501	V	90	Very high	87.8	Confident	41 Å²	41	76 Å²	76	25%	0.248	35%	0.346	C	S	.	.	H	α-helix	trans	-63.4	-42.3	177.7	-177.3	0	0	0	0	110.2	W495 N498 I503 L504 M505	W495-V501 HydrophobicContact CZ3-CG1 4.32Å; N498-V501 HydrophobicContact CB-CG2 4.23Å; N498-V501 PolarHBondContact O-N 2.85Å; N498-V501 VanDerWaalsContact O-N 3.16Å; V501-I503 PolarHBondContact O-N 3.33Å; V501-L504 PolarHBondContact O-N 2.77Å; V501-M505 HydrophobicContact CG1-CG 4.11Å; V501-M505 WeakPolarHBondContact O-CB 3.43Å; V501-M505 VanDerWaalsContact O-CG 3.29Å; V501-M505 WeakPolarHBondContact O-CG 3.36Å; V501-M505 PolarHBondContact O-N 2.87Å
502	G	88.2	Confident	87.7	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-60.9	-41.5	176.3	0	0	0	0	0	113.4	N498 R499 F500 A506	N498-G502 PolarHBondContact O-N 2.87Å; R499-G502 PolarHBondContact O-N 3.45Å; F500-G502 VanDerWaalsContact C-N 3.32Å; F500-G502 PolarHBondContact O-N 3.24Å; G502-A506 WeakPolarHBondContact O-CB 3.34Å; G502-A506 PolarHBondContact O-N 2.86Å
503	I	91.2	Very high	87.7	Confident	32 Å²	32	66.5 Å²	66.5	16%	0.164	31%	0.31	C	S	.	.	H	α-helix	trans	-62.5	-46.4	176.3	-68.7	164.2	0	0	0	110.7	R499 F500 V501 G507 L573 V574	R499-I503 HydrophobicContact CG-CD1 3.98Å; R499-I503 WeakPolarHBondContact O-CD1 3.38Å; R499-I503 WeakPolarHBondContact O-CG1 3.3Å; R499-I503 PolarHBondContact O-N 3.22Å; F500-I503 PolarHBondContact O-N 2.88Å; V501-I503 PolarHBondContact O-N 3.33Å; I503-G507 PolarHBondContact O-N 3.4Å; I503-L573 HydrophobicContact CD1-CB 4.11Å; I503-L573 HydrophobicContact CG1-CB 4.32Å; I503-V574 HydrophobicContact CG1-CG2 4.09Å
504	L	92	Very high	87.9	Confident	73 Å²	73	65.1 Å²	65.1	38%	0.382	30%	0.304	S	S	.	.	H	α-helix	trans	-64.7	-49.4	179.4	-68.1	176.9	0	0	0	111.5	F500 V501 A506 G507 I508 F580 Y581	F500-L504 WeakPolarHBondContact O-CG 3.26Å; F500-L504 PolarHBondContact O-N 2.75Å; F500-L504 VanDerWaalsContact O-N 3.08Å; V501-L504 PolarHBondContact O-N 2.77Å; L504-A506 PolarHBondContact O-N 2.8Å; L504-G507 PolarHBondContact O-N 3.19Å; L504-I508 WeakPolarHBondContact O-CG1 3.32Å; L504-F580 HydrophobicContact CD2-CD1 3.53Å; L504-F580 HydrophobicContact CD2-CE1 3.5Å; L504-F580 HydrophobicContact CD2-CG 4.31Å; L504-F580 HydrophobicContact CD2-CZ 4.25Å; L504-Y581 VanDerWaalsContact O-CE2 3.31Å; L504-Y581 WeakPolarHBondContact O-CE2 3.43Å; L504-Y581 PolarHBondContact O-OH 2.91Å
505	M	88.7	Confident	88.1	Confident	123 Å²	123	60.4 Å²	60.4	61%	0.606	29%	0.288	S	S	*	.	H	α-helix	trans	-61.9	-42	-178.2	-72.1	-62.6	-63.6	0	0	112.4	V501 G507	V501-M505 HydrophobicContact CG1-CG 4.11Å; V501-M505 WeakPolarHBondContact O-CB 3.43Å; V501-M505 VanDerWaalsContact O-CG 3.29Å; V501-M505 WeakPolarHBondContact O-CG 3.36Å; V501-M505 PolarHBondContact O-N 2.87Å; M505-G507 VanDerWaalsContact C-N 3.32Å; M505-G507 PolarHBondContact O-N 3.5Å
506	A	88.1	Confident	88.1	Confident	3 Å²	3	54 Å²	54	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-70.7	-28.2	-178.8	0	0	0	0	0	113.5	G502 L504 P510 I551 M555 V574	G502-A506 WeakPolarHBondContact O-CB 3.34Å; G502-A506 PolarHBondContact O-N 2.86Å; L504-A506 PolarHBondContact O-N 2.8Å; A506-P510 WeakPolarHBondContact O-CD 3.3Å; A506-I551 HydrophobicContact CB-CG2 3.45Å; A506-I551 VanDerWaalsContact CB-CG2 3.45Å; A506-I551 VanDerWaalsContact O-CD1 3.25Å; A506-I551 WeakPolarHBondContact O-CD1 3.5Å; A506-M555 HydrophobicContact CB-CG 4.32Å; A506-V574 HydrophobicContact CB-CB 4.47Å; A506-V574 HydrophobicContact CB-CG1 3.28Å; A506-V574 WeakPolarHBondContact CB-O 3.14Å
507	G	90.1	Very high	88.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-77.4	-21.5	-177.3	0	0	0	0	0	115.3	I503 L504 M505 P510 F511 Y581	I503-G507 PolarHBondContact O-N 3.4Å; L504-G507 PolarHBondContact O-N 3.19Å; M505-G507 VanDerWaalsContact C-N 3.32Å; M505-G507 PolarHBondContact O-N 3.5Å; G507-P510 WeakPolarHBondContact O-CD 3.28Å; G507-F511 WeakPolarHBondContact O-CB 3.39Å; G507-F511 PolarHBondContact O-N 2.95Å; G507-Y581 VanDerWaalsContact C-CE2 3.43Å
508	I	90.6	Very high	88.8	Confident	85 Å²	85	49.3 Å²	49.3	44%	0.436	25%	0.249	S	C	.	.	H	α-helix	trans	-63.8	-48.6	-172.2	-64.9	170.4	0	0	0	111.7	L504 F511 G512 Y581	L504-I508 WeakPolarHBondContact O-CG1 3.32Å; I508-F511 PolarHBondContact O-N 3.46Å; I508-G512 PolarHBondContact O-N 3.25Å; I508-Y581 HydrophobicContact CG1-CE1 3.93Å; I508-Y581 HydrophobicContact CG1-CE2 3.91Å; I508-Y581 WeakPolarHBondContact CG1-OH 3.32Å
509	L	86.5	Confident	88.9	Confident	40 Å²	40	48.5 Å²	48.5	21%	0.209	24%	0.242	C	C	.	.	H	α-helix	trans	-70	-48	-172.2	178.6	-176.6	0	0	0	112	L293 F511 G512 A513 I551	L293-L509 HydrophobicContact CD1-CD1 3.47Å; L293-L509 VanDerWaalsContact CD1-CD1 3.47Å; L293-L509 HydrophobicContact CD1-CD2 4.34Å; L293-L509 HydrophobicContact CD1-CG 3.82Å; L509-F511 VanDerWaalsContact C-N 3.26Å; L509-F511 PolarHBondContact O-N 3.09Å; L509-G512 PolarHBondContact O-N 3.39Å; L509-A513 PolarHBondContact O-N 2.75Å; L509-I551 HydrophobicContact CB-CD1 3.64Å; L509-I551 HydrophobicContact CD1-CD1 3.69Å; L509-I551 HydrophobicContact CD1-CG1 3.89Å; L509-I551 HydrophobicContact CD2-CD1 4.05Å; L509-I551 HydrophobicContact CG-CD1 4Å
510	P	90.6	Very high	88.9	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.013	22%	0.219	C	C	.	.	H	α-helix	trans	-65.7	-32.9	177.5	-18.8	34.3	0	0	0	111.5	A506 G507 M514 L544 I551	A506-P510 WeakPolarHBondContact O-CD 3.3Å; G507-P510 WeakPolarHBondContact O-CD 3.28Å; P510-M514 WeakPolarHBondContact O-CG 3.24Å; P510-L544 HydrophobicContact CB-CD1 3.95Å; P510-I551 HydrophobicContact CG-CD1 3.42Å; P510-I551 VanDerWaalsContact CG-CD1 3.42Å
511	F	92	Very high	88.9	Confident	31 Å²	31	36.7 Å²	36.7	14%	0.136	20%	0.196	C	C	.	.	H	α-helix	trans	-64.7	-49	172.2	172.7	-104.8	0	0	0	111.9	G507 I508 L509 A513 M514 F515 L518 Y581 V582 Y585	G507-F511 WeakPolarHBondContact O-CB 3.39Å; G507-F511 PolarHBondContact O-N 2.95Å; I508-F511 PolarHBondContact O-N 3.46Å; L509-F511 VanDerWaalsContact C-N 3.26Å; L509-F511 PolarHBondContact O-N 3.09Å; F511-A513 VanDerWaalsContact C-N 3.27Å; F511-A513 PolarHBondContact O-N 2.89Å; F511-M514 VanDerWaalsContact O-CG 3.27Å; F511-M514 WeakPolarHBondContact O-CG 3.29Å; F511-M514 PolarHBondContact O-N 2.69Å; F511-M514 VanDerWaalsContact O-N 3.11Å; F511-F515 AromaticContact CE1-CD2 3.93Å; F511-F515 HydrophobicContact CE1-CD2 3.93Å; F511-F515 HydrophobicContact CE2-CD2 4.21Å; F511-F515 AromaticContact CZ-CD2 3.53Å; F511-F515 HydrophobicContact CZ-CD2 3.53Å; F511-F515 HydrophobicContact CZ-CE2 4.09Å; F511-F515 PolarHBondContact O-N 3.13Å; F511-L518 HydrophobicContact CE2-CD2 3.94Å; F511-Y581 HydrophobicContact CB-CD2 4.4Å; F511-Y581 HydrophobicContact CB-CG 4.22Å; F511-Y581 HydrophobicContact CD1-CD1 4.34Å; F511-Y581 HydrophobicContact CD1-CG 4.11Å; F511-Y581 VanDerWaalsContact CD2-CB 3.4Å; F511-Y581 HydrophobicContact CG-CG 4.05Å; F511-V582 HydrophobicContact CD2-CG2 4.16Å; F511-V582 HydrophobicContact CE2-CG2 4.48Å; F511-Y585 HydrophobicContact CZ-CG 4.5Å
512	G	88.3	Confident	88.9	Confident	46 Å²	46	34.9 Å²	34.9	47%	0.474	18%	0.184	S	C	.	.	H	α-helix	trans	-58.4	-38.8	178.4	0	0	0	0	0	112.7	I508 L509 M514	I508-G512 PolarHBondContact O-N 3.25Å; L509-G512 PolarHBondContact O-N 3.39Å; G512-M514 VanDerWaalsContact C-N 3.26Å; G512-M514 PolarHBondContact O-N 3.15Å
513	A	86.5	Confident	88.7	Confident	7 Å²	7	35.4 Å²	35.4	6%	0.058	19%	0.188	C	C	.	.	H	α-helix	trans	-65.7	-24.8	178.7	0	0	0	0	0	114.1	S286 L509 F511 I543	S286-A513 PolarHBondContact OG-O 3.12Å; L509-A513 PolarHBondContact O-N 2.75Å; F511-A513 VanDerWaalsContact C-N 3.27Å; F511-A513 PolarHBondContact O-N 2.89Å; A513-I543 HydrophobicContact CB-CG2 3.92Å
514	M	89.6	Confident	88.4	Confident	18 Å²	18	34.8 Å²	34.8	9%	0.089	19%	0.188	C	C	.	.	H	α-helix	trans	-111.4	-3.8	-177.3	70.1	175.3	-75.7	0	0	114.3	P510 F511 G512 I516 E517 L518 V540 L544 F616	P510-M514 WeakPolarHBondContact O-CG 3.24Å; F511-M514 VanDerWaalsContact O-CG 3.27Å; F511-M514 WeakPolarHBondContact O-CG 3.29Å; F511-M514 PolarHBondContact O-N 2.69Å; F511-M514 VanDerWaalsContact O-N 3.11Å; G512-M514 VanDerWaalsContact C-N 3.26Å; G512-M514 PolarHBondContact O-N 3.15Å; M514-I516 VanDerWaalsContact C-N 3.32Å; M514-I516 PolarHBondContact O-N 2.95Å; M514-E517 PolarHBondContact O-N 2.93Å; M514-L518 HydrophobicContact CE-CB 4.29Å; M514-L518 HydrophobicContact CE-CD1 3.98Å; M514-L518 PolarHBondContact O-N 3.03Å; M514-V540 HydrophobicContact CB-CG1 3.92Å; M514-L544 HydrophobicContact SD-CD1 4.06Å; M514-F616 HydrophobicContact CE-CD2 4.49Å; M514-F616 HydrophobicContact CE-CE2 3.7Å; M514-F616 HydrophobicContact CE-CZ 3.84Å; M514-F616 HydrophobicContact SD-CE1 4.05Å; M514-F616 HydrophobicContact SD-CE2 3.57Å; M514-F616 VanDerWaalsContact SD-CE2 3.57Å; M514-F616 HydrophobicContact SD-CZ 3.15Å; M514-F616 WeakPolarHBondContact SD-CZ 3.24Å
515	F	89.9	Confident	88.1	Confident	75 Å²	75	35 Å²	35	33%	0.329	19%	0.189	S	C	.	.	H	α-helix	trans	-54.8	-43.4	-168.7	173.6	-103.5	0	0	0	113.6	F511 L518 F519 Y585	F511-F515 AromaticContact CE1-CD2 3.93Å; F511-F515 HydrophobicContact CE1-CD2 3.93Å; F511-F515 HydrophobicContact CE2-CD2 4.21Å; F511-F515 AromaticContact CZ-CD2 3.53Å; F511-F515 HydrophobicContact CZ-CD2 3.53Å; F511-F515 HydrophobicContact CZ-CE2 4.09Å; F511-F515 PolarHBondContact O-N 3.13Å; F515-L518 WeakPolarHBondContact O-CB 3.43Å; F515-L518 PolarHBondContact O-N 3.43Å; F515-F519 PolarHBondContact O-N 3.43Å; F515-Y585 HydrophobicContact CD2-CD2 4.39Å; F515-Y585 HydrophobicContact CD2-CE2 4.49Å; F515-Y585 AromaticContact CE2-CD2 3.52Å; F515-Y585 HydrophobicContact CE2-CD2 3.52Å; F515-Y585 AromaticContact CE2-CE2 3.49Å; F515-Y585 HydrophobicContact CE2-CE2 3.49Å; F515-Y585 VanDerWaalsContact CE2-CE2 3.49Å; F515-Y585 HydrophobicContact CE2-CG 4.28Å; F515-Y585 HydrophobicContact CZ-CD2 4.31Å; F515-Y585 AromaticContact CZ-CE2 3.91Å; F515-Y585 HydrophobicContact CZ-CE2 3.91Å
516	I	86.5	Confident	88	Confident	49 Å²	49	29.8 Å²	29.8	25%	0.251	16%	0.162	S	C	.	.	H	α-helix	trans	-67.4	-45	-178.9	-61.1	-64.1	0	0	0	111.3	I278 S282 M514 L518 F519 F520	I278-I516 HydrophobicContact CG2-CG2 4.21Å; S282-I516 VanDerWaalsContact OG-CB 3.23Å; S282-I516 WeakPolarHBondContact OG-CB 3.48Å; S282-I516 WeakPolarHBondContact OG-CG1 3.42Å; M514-I516 VanDerWaalsContact C-N 3.32Å; M514-I516 PolarHBondContact O-N 2.95Å; I516-L518 VanDerWaalsContact C-N 3.26Å; I516-L518 PolarHBondContact O-N 2.84Å; I516-F519 WeakPolarHBondContact O-CB 3.17Å; I516-F519 PolarHBondContact O-N 2.86Å; I516-F519 VanDerWaalsContact O-N 3.13Å; I516-F520 HydrophobicContact CG2-CD2 3.92Å; I516-F520 HydrophobicContact CG2-CE2 3.52Å; I516-F520 WeakPolarHBondContact O-CD2 3.24Å; I516-F520 PolarHBondContact O-N 3.05Å
517	E	86.8	Confident	87.5	Confident	3 Å²	3	33 Å²	33	1%	0.014	18%	0.177	C	C	.	.	H	α-helix	trans	-65.4	-34.3	175.9	-64.8	-54.5	148.3	0	0	111.5	H279 M514 F519 F520 I521 Y531 V540	H279-E517 IonicContact CE1-OE1 2.59Å; H279-E517 IonicContact CE1-OE2 3.44Å; H279-E517 IonicContact CG-OE1 2.93Å; H279-E517 IonicContact ND1-OE1 3.42Å; H279-E517 PolarHBondContact ND1-OE1 3.13Å; H279-E517 IonicContact ND1-OE2 3.32Å; H279-E517 PolarHBondContact ND1-OE2 3.36Å; M514-E517 PolarHBondContact O-N 2.93Å; E517-F519 VanDerWaalsContact C-N 3.31Å; E517-F519 PolarHBondContact O-N 3.06Å; E517-F520 PolarHBondContact O-N 2.93Å; E517-I521 WeakPolarHBondContact O-CB 3.41Å; E517-I521 WeakPolarHBondContact O-CD1 3.37Å; E517-I521 WeakPolarHBondContact O-CG1 3.34Å; E517-I521 PolarHBondContact O-N 3.11Å; E517-Y531 PolarHBondContact OE2-OH 3.36Å; E517-V540 HydrophobicContact CB-CG1 4.32Å; E517-V540 HydrophobicContact CG-CB 3.96Å; E517-V540 HydrophobicContact CG-CG1 3.99Å; E517-V540 HydrophobicContact CG-CG2 3.56Å
518	L	89.6	Confident	86.7	Confident	11 Å²	11	35.6 Å²	35.6	6%	0.058	19%	0.191	C	C	.	.	H	α-helix	trans	-60.2	-41.2	172.9	-170.8	67.2	0	0	0	111.5	F511 M514 F515 I516 I521 F522 V582 Y585	F511-L518 HydrophobicContact CE2-CD2 3.94Å; M514-L518 HydrophobicContact CE-CB 4.29Å; M514-L518 HydrophobicContact CE-CD1 3.98Å; M514-L518 PolarHBondContact O-N 3.03Å; F515-L518 WeakPolarHBondContact O-CB 3.43Å; F515-L518 PolarHBondContact O-N 3.43Å; I516-L518 VanDerWaalsContact C-N 3.26Å; I516-L518 PolarHBondContact O-N 2.84Å; L518-I521 PolarHBondContact O-N 3.03Å; L518-F522 HydrophobicContact CD1-CD2 3.8Å; L518-F522 HydrophobicContact CD1-CE2 3.48Å; L518-F522 VanDerWaalsContact CD1-CE2 3.48Å; L518-F522 HydrophobicContact CG-CD2 3.95Å; L518-F522 HydrophobicContact CG-CE2 3.9Å; L518-F522 WeakPolarHBondContact O-CB 3.13Å; L518-F522 VanDerWaalsContact O-CD2 3.23Å; L518-F522 WeakPolarHBondContact O-CD2 3.21Å; L518-F522 PolarHBondContact O-N 2.99Å; L518-V582 HydrophobicContact CD1-CG1 4.37Å; L518-V582 HydrophobicContact CD2-CB 4.46Å; L518-V582 HydrophobicContact CD2-CG1 4.23Å; L518-V582 HydrophobicContact CD2-CG2 4.05Å; L518-Y585 HydrophobicContact CD2-CD1 3.6Å; L518-Y585 HydrophobicContact CD2-CE1 4.14Å; L518-Y585 HydrophobicContact CD2-CG 4.33Å; L518-Y585 HydrophobicContact CG-CD1 4.07Å; L518-Y585 HydrophobicContact CG-CE1 4.14Å
519	F	88.4	Confident	85.9	Confident	64 Å²	64	35.7 Å²	35.7	28%	0.281	19%	0.189	S	C	.	.	H	α-helix	trans	-59	-47.6	174.8	169.8	-89.5	0	0	0	111.8	F515 I516 E517 F522 S523 Y585	F515-F519 PolarHBondContact O-N 3.43Å; I516-F519 WeakPolarHBondContact O-CB 3.17Å; I516-F519 PolarHBondContact O-N 2.86Å; I516-F519 VanDerWaalsContact O-N 3.13Å; E517-F519 VanDerWaalsContact C-N 3.31Å; E517-F519 PolarHBondContact O-N 3.06Å; F519-F522 PolarHBondContact O-N 3.06Å; F519-S523 PolarHBondContact O-N 3.1Å; F519-S523 PolarHBondContact O-OG 2.9Å; F519-Y585 VanDerWaalsContact CD2-OH 3.26Å; F519-Y585 WeakPolarHBondContact CD2-OH 3.14Å
520	F	85	Confident	85.2	Confident	19 Å²	19	35.5 Å²	35.5	8%	0.083	19%	0.187	C	C	.	.	H	α-helix	trans	-67.9	-36.8	179	-69.9	-67.2	0	0	0	112.8	D275 I278 H279 I516 E517 S523 A524 Y531	D275-F520 HydrophobicContact CB-CE1 4.05Å; D275-F520 HydrophobicContact CB-CZ 4.02Å; I278-F520 HydrophobicContact CB-CZ 4.38Å; I278-F520 HydrophobicContact CG2-CE2 4.24Å; I278-F520 HydrophobicContact CG2-CZ 4.15Å; H279-F520 AromaticContact CD2-CE2 3.87Å; H279-F520 AromaticContact CE1-CD2 3.05Å; H279-F520 WeakPolarHBondContact CE1-CD2 3.47Å; H279-F520 AromaticContact CE1-CE2 3.35Å; H279-F520 WeakPolarHBondContact CE1-CE2 3.44Å; H279-F520 AromaticContact CE1-CG 3.47Å; H279-F520 VanDerWaalsContact CE1-CG 3.47Å; H279-F520 WeakPolarHBondContact CE1-CG 3.32Å; H279-F520 AromaticContact ND1-CD2 3.75Å; H279-F520 AromaticContact ND1-CE2 3.82Å; H279-F520 AromaticContact NE2-CD1 3.84Å; H279-F520 AromaticContact NE2-CD2 3.46Å; H279-F520 WeakPolarHBondContact NE2-CD2 3.36Å; H279-F520 AromaticContact NE2-CE1 3.78Å; H279-F520 AromaticContact NE2-CE2 3.37Å; H279-F520 WeakPolarHBondContact NE2-CE2 3.39Å; H279-F520 AromaticContact NE2-CG 3.69Å; H279-F520 AromaticContact NE2-CZ 3.54Å; I516-F520 HydrophobicContact CG2-CD2 3.92Å; I516-F520 HydrophobicContact CG2-CE2 3.52Å; I516-F520 WeakPolarHBondContact O-CD2 3.24Å; I516-F520 PolarHBondContact O-N 3.05Å; E517-F520 PolarHBondContact O-N 2.93Å; F520-S523 PolarHBondContact O-N 2.86Å; F520-A524 VanDerWaalsContact O-CB 3.32Å; F520-A524 WeakPolarHBondContact O-CB 3.44Å; F520-A524 PolarHBondContact O-N 2.98Å; F520-Y531 HydrophobicContact CB-CD2 4.34Å; F520-Y531 HydrophobicContact CB-CE2 4Å
521	I	88.5	Confident	84.4	Confident	47 Å²	47	36.9 Å²	36.9	24%	0.241	19%	0.192	C	C	.	.	H	α-helix	trans	-62.8	-45.2	173.8	-70.1	165.1	0	0	0	110.7	E517 L518 A524 I525 Y531 L537	E517-I521 WeakPolarHBondContact O-CB 3.41Å; E517-I521 WeakPolarHBondContact O-CD1 3.37Å; E517-I521 WeakPolarHBondContact O-CG1 3.34Å; E517-I521 PolarHBondContact O-N 3.11Å; L518-I521 PolarHBondContact O-N 3.03Å; I521-A524 PolarHBondContact O-N 2.87Å; I521-I525 HydrophobicContact CG2-CD1 3.7Å; I521-I525 HydrophobicContact CG2-CG1 4.48Å; I521-I525 VanDerWaalsContact O-CG1 3.28Å; I521-I525 WeakPolarHBondContact O-CG1 3.27Å; I521-I525 PolarHBondContact O-N 3.03Å; I521-Y531 HydrophobicContact CG1-CE2 4.18Å; I521-L537 HydrophobicContact CD1-CD1 3.89Å
522	F	89.5	Confident	83.5	Confident	3 Å²	3	39.8 Å²	39.8	1%	0.013	20%	0.202	C	C	.	.	H	α-helix	trans	-63.5	-43.7	178	-90.9	-112.8	0	0	0	111.4	L518 F519 A524 I525 W526 Y585 A586 Y589 Y605 M612	L518-F522 HydrophobicContact CD1-CD2 3.8Å; L518-F522 HydrophobicContact CD1-CE2 3.48Å; L518-F522 VanDerWaalsContact CD1-CE2 3.48Å; L518-F522 HydrophobicContact CG-CD2 3.95Å; L518-F522 HydrophobicContact CG-CE2 3.9Å; L518-F522 WeakPolarHBondContact O-CB 3.13Å; L518-F522 VanDerWaalsContact O-CD2 3.23Å; L518-F522 WeakPolarHBondContact O-CD2 3.21Å; L518-F522 PolarHBondContact O-N 2.99Å; F519-F522 PolarHBondContact O-N 3.06Å; F522-A524 VanDerWaalsContact C-N 3.35Å; F522-A524 PolarHBondContact O-N 2.83Å; F522-I525 PolarHBondContact O-N 3.22Å; F522-W526 AromaticContact CD1-CD1 3.91Å; F522-W526 AromaticContact CD1-NE1 3.86Å; F522-W526 VanDerWaalsContact O-CD1 3.22Å; F522-W526 PolarHBondContact O-N 2.92Å; F522-Y585 HydrophobicContact CD2-CE1 4.42Å; F522-Y585 HydrophobicContact CG-CE1 4.31Å; F522-A586 HydrophobicContact CE1-CB 3.73Å; F522-A586 HydrophobicContact CZ-CB 3.9Å; F522-Y589 HydrophobicContact CB-CD1 4.42Å; F522-Y589 HydrophobicContact CB-CD2 4.36Å; F522-Y589 HydrophobicContact CB-CE1 4.15Å; F522-Y589 HydrophobicContact CB-CE2 4.14Å; F522-Y589 AromaticContact CD1-CD1 3.79Å; F522-Y589 HydrophobicContact CD1-CD1 3.79Å; F522-Y589 HydrophobicContact CD1-CE1 4.21Å; F522-Y589 HydrophobicContact CD1-CG 4.02Å; F522-Y605 WeakPolarHBondContact CE1-OH 3.36Å; F522-M612 HydrophobicContact CZ-CE 4.09Å
523	S	85.4	Confident	83	Confident	12 Å²	12	39 Å²	39	8%	0.084	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-40.7	177.3	-49.1	0	0	0	0	111.3	F519 F520 I525 E527 Y589	F519-S523 PolarHBondContact O-N 3.1Å; F519-S523 PolarHBondContact O-OG 2.9Å; F520-S523 PolarHBondContact O-N 2.86Å; S523-I525 PolarHBondContact O-N 3.07Å; S523-E527 WeakPolarHBondContact O-CA 3.47Å; S523-E527 WeakPolarHBondContact O-CB 3.36Å; S523-E527 PolarHBondContact O-N 2.78Å; S523-Y589 WeakPolarHBondContact CA-OH 3.18Å
524	A	84	Confident	82.8	Confident	20 Å²	20	39.8 Å²	39.8	17%	0.165	19%	0.189	C	C	.	.	H	α-helix	trans	-64.6	-39.1	175.6	0	0	0	0	0	113.6	F520 I521 F522 Q529 Y531	F520-A524 VanDerWaalsContact O-CB 3.32Å; F520-A524 WeakPolarHBondContact O-CB 3.44Å; F520-A524 PolarHBondContact O-N 2.98Å; I521-A524 PolarHBondContact O-N 2.87Å; F522-A524 VanDerWaalsContact C-N 3.35Å; F522-A524 PolarHBondContact O-N 2.83Å; A524-Q529 WeakPolarHBondContact CA-O 3.48Å; A524-Q529 WeakPolarHBondContact CB-O 3.46Å; A524-Y531 HydrophobicContact CB-CD2 4.4Å
525	I	86	Confident	82.5	Confident	78 Å²	78	40.4 Å²	40.4	40%	0.4	20%	0.2	S	C	.	.	H	α-helix	trans	-74.3	-44.3	-178.7	-67.7	169.3	0	0	0	111.5	I521 F522 S523 M612	I521-I525 HydrophobicContact CG2-CD1 3.7Å; I521-I525 HydrophobicContact CG2-CG1 4.48Å; I521-I525 VanDerWaalsContact O-CG1 3.28Å; I521-I525 WeakPolarHBondContact O-CG1 3.27Å; I521-I525 PolarHBondContact O-N 3.03Å; F522-I525 PolarHBondContact O-N 3.22Å; S523-I525 PolarHBondContact O-N 3.07Å; I525-M612 HydrophobicContact CD1-SD 4.16Å
526	W	85.9	Confident	82.3	Confident	13 Å²	13	37.8 Å²	37.8	5%	0.049	19%	0.189	C	C	.	.	H	α-helix	trans	-100.7	-25.7	-169.8	-58	112.4	0	0	0	113.9	Q53 F522 Y589 L594 Y605 Y608 M612	Q53-W526 HydrophobicContact CG-CE3 4.16Å; Q53-W526 HydrophobicContact CG-CZ3 4.49Å; Q53-W526 PolarHBondContact NE2-O 2.99Å; Q53-W526 PolarHBondContact OE1-O 3.1Å; F522-W526 AromaticContact CD1-CD1 3.91Å; F522-W526 AromaticContact CD1-NE1 3.86Å; F522-W526 VanDerWaalsContact O-CD1 3.22Å; F522-W526 PolarHBondContact O-N 2.92Å; W526-Y589 HydrophobicContact CB-CE1 4.27Å; W526-Y589 AromaticContact CD1-CE1 3.98Å; W526-Y589 HydrophobicContact CG-CE1 4.42Å; W526-L594 HydrophobicContact CB-CD1 4.37Å; W526-L594 HydrophobicContact CB-CD2 3.85Å; W526-L594 HydrophobicContact CG-CD1 4.31Å; W526-Y605 AromaticContact CD1-CE2 3.9Å; W526-Y605 AromaticContact CD2-CD2 3.72Å; W526-Y605 HydrophobicContact CD2-CD2 3.72Å; W526-Y605 AromaticContact CD2-CE2 3.92Å; W526-Y605 HydrophobicContact CD2-CE2 3.92Å; W526-Y605 AromaticContact CE2-CD2 3.41Å; W526-Y605 VanDerWaalsContact CE2-CD2 3.41Å; W526-Y605 AromaticContact CE2-CE2 3.45Å; W526-Y605 VanDerWaalsContact CE2-CE2 3.45Å; W526-Y605 HydrophobicContact CE3-CD2 4Å; W526-Y605 HydrophobicContact CG-CD2 4.4Å; W526-Y605 HydrophobicContact CG-CE2 4.19Å; W526-Y605 AromaticContact CH2-CD2 3.78Å; W526-Y605 HydrophobicContact CH2-CD2 3.78Å; W526-Y605 HydrophobicContact CH2-CG 4.37Å; W526-Y605 AromaticContact CZ2-CD2 3.45Å; W526-Y605 HydrophobicContact CZ2-CD2 3.45Å; W526-Y605 VanDerWaalsContact CZ2-CD2 3.45Å; W526-Y605 AromaticContact CZ2-CE2 3.83Å; W526-Y605 HydrophobicContact CZ2-CE2 3.83Å; W526-Y605 HydrophobicContact CZ2-CG 4.27Å; W526-Y605 HydrophobicContact CZ3-CD2 4.03Å; W526-Y605 AromaticContact NE1-CD2 3.92Å; W526-Y605 AromaticContact NE1-CE2 3.43Å; W526-Y608 HydrophobicContact CH2-CD2 4.15Å; W526-M612 HydrophobicContact CZ2-CE 4.4Å
527	E	78.7	Confident	82.3	Confident	71 Å²	71	37 Å²	37	33%	0.332	19%	0.185	S	C	.	.	S	Bend	trans	-100.2	10	177.7	-57.2	174.4	-164.9	0	0	112.6	S523 Q529 Y589	S523-E527 WeakPolarHBondContact O-CA 3.47Å; S523-E527 WeakPolarHBondContact O-CB 3.36Å; S523-E527 PolarHBondContact O-N 2.78Å; E527-Q529 HydrophobicContact CB-CG 4.24Å; E527-Q529 PolarHBondContact O-N 2.81Å; E527-Y589 PolarHBondContact OE1-OH 3.16Å
528	N	72.6	Confident	82.5	Confident	54 Å²	54	38.6 Å²	38.6	29%	0.289	19%	0.192	S	C	.	.			trans	57.4	27.1	179.3	-62.4	-56.8	0	0	0	115
529	Q	73.1	Confident	82.6	Confident	86 Å²	86	41.6 Å²	41.6	40%	0.402	21%	0.208	S	C	.	.			trans	-81.9	149.7	177	-62.9	-66.7	-25.5	0	0	112.1	A524 E527 Y531	A524-Q529 WeakPolarHBondContact CA-O 3.48Å; A524-Q529 WeakPolarHBondContact CB-O 3.46Å; E527-Q529 HydrophobicContact CB-CG 4.24Å; E527-Q529 PolarHBondContact O-N 2.81Å; Q529-Y531 PolarHBondContact O-N 3.08Å
530	F	71.8	Confident	82.7	Confident	37 Å²	37	38.9 Å²	38.9	16%	0.162	20%	0.197	C	C	.	.			trans	-78.8	111.1	177.8	-70.9	-66	0	0	0	112.1	P139 H165 W267 L271 M273 P372 Y532	P139-F530 HydrophobicContact CB-CZ 4.26Å; P139-F530 HydrophobicContact CG-CE2 4.23Å; P139-F530 HydrophobicContact CG-CZ 3.83Å; H165-F530 HydrophobicContact CB-CE2 3.99Å; H165-F530 HydrophobicContact CB-CZ 4.34Å; H165-F530 AromaticContact CD2-CZ 3.96Å; H165-F530 AromaticContact CE1-CZ 3.55Å; H165-F530 AromaticContact CG-CE2 3.83Å; H165-F530 AromaticContact CG-CZ 3.69Å; H165-F530 AromaticContact ND1-CE2 3.93Å; H165-F530 AromaticContact ND1-CZ 3.42Å; H165-F530 WeakPolarHBondContact ND1-CZ 3.2Å; H165-F530 AromaticContact NE2-CZ 3.86Å; W267-F530 HydrophobicContact CZ3-CE1 4.25Å; W267-F530 HydrophobicContact CZ3-CZ 4.36Å; L271-F530 HydrophobicContact CD2-CB 3.8Å; L271-F530 HydrophobicContact CD2-CG 4.26Å; M273-F530 WeakPolarHBondContact CE-O 3.48Å; P372-F530 HydrophobicContact CB-CD1 4.02Å; P372-F530 HydrophobicContact CB-CE1 4.37Å; P372-F530 HydrophobicContact CG-CD1 4.43Å; F530-Y532 PolarHBondContact O-N 3.07Å
531	Y	74.6	Confident	83.1	Confident	30 Å²	30	38.7 Å²	38.7	12%	0.118	20%	0.196	C	C	.	.			trans	-80.2	112.6	168.2	-168	-85	0	0	0	111	E517 F520 I521 A524 Q529 L533 F534 L537	E517-Y531 PolarHBondContact OE2-OH 3.36Å; F520-Y531 HydrophobicContact CB-CD2 4.34Å; F520-Y531 HydrophobicContact CB-CE2 4Å; I521-Y531 HydrophobicContact CG1-CE2 4.18Å; A524-Y531 HydrophobicContact CB-CD2 4.4Å; Q529-Y531 PolarHBondContact O-N 3.08Å; Y531-L533 HydrophobicContact CE1-CB 4.49Å; Y531-L533 PolarHBondContact OH-O 2.66Å; Y531-F534 HydrophobicContact CD1-CD1 4.39Å; Y531-F534 HydrophobicContact CD1-CE1 4.17Å; Y531-F534 HydrophobicContact CD1-CZ 4.45Å; Y531-F534 HydrophobicContact CE1-CD1 4.33Å; Y531-L537 HydrophobicContact CE1-CB 4.26Å; Y531-L537 HydrophobicContact CE1-CD2 4.28Å
532	Y	72.5	Confident	83.3	Confident	92 Å²	92	40 Å²	40	36%	0.361	20%	0.203	S	C	.	.			trans	-111.4	-14.4	-179.6	-177.3	-117.1	0	0	0	114.7	L271 F530 F534	L271-Y532 HydrophobicContact CB-CD1 4.03Å; L271-Y532 HydrophobicContact CB-CG 4.01Å; L271-Y532 HydrophobicContact CD1-CD1 4.03Å; L271-Y532 HydrophobicContact CD1-CD2 3.32Å; L271-Y532 HydrophobicContact CD1-CE1 4.14Å; L271-Y532 HydrophobicContact CD1-CE2 3.43Å; L271-Y532 VanDerWaalsContact CD1-CE2 3.43Å; L271-Y532 HydrophobicContact CD1-CG 3.62Å; L271-Y532 HydrophobicContact CD2-CD2 4.13Å; L271-Y532 HydrophobicContact CD2-CG 4.04Å; L271-Y532 HydrophobicContact CG-CD2 4.17Å; L271-Y532 HydrophobicContact CG-CG 4.07Å; F530-Y532 PolarHBondContact O-N 3.07Å; Y532-F534 VanDerWaalsContact C-N 3.25Å; Y532-F534 PolarHBondContact O-N 2.89Å
533	L	77.9	Confident	83.5	Confident	31 Å²	31	40.6 Å²	40.6	16%	0.162	21%	0.206	C	C	.	.			trans	-86.6	58.1	-168.3	-68.2	171.7	0	0	0	112.9	M273 H279 Y531 G535 F536 L537	M273-L533 HydrophobicContact SD-CD1 4.47Å; H279-L533 WeakPolarHBondContact CD2-CD1 3.43Å; H279-L533 VanDerWaalsContact NE2-CD1 3.28Å; H279-L533 WeakPolarHBondContact NE2-CD1 3.48Å; Y531-L533 HydrophobicContact CE1-CB 4.49Å; Y531-L533 PolarHBondContact OH-O 2.66Å; L533-G535 VanDerWaalsContact C-N 3.3Å; L533-G535 PolarHBondContact O-N 2.9Å; L533-F536 HydrophobicContact CB-CB 4.36Å; L533-F536 HydrophobicContact CB-CD2 3.7Å; L533-F536 HydrophobicContact CB-CE2 4.49Å; L533-F536 HydrophobicContact CB-CG 4.48Å; L533-F536 HydrophobicContact CD1-CD2 3.83Å; L533-F536 HydrophobicContact CD1-CE2 4.05Å; L533-F536 HydrophobicContact CD2-CD2 3.73Å; L533-F536 HydrophobicContact CD2-CE2 3.65Å; L533-F536 HydrophobicContact CG-CD2 3.93Å; L533-F536 HydrophobicContact CG-CE2 4.25Å; L533-F536 PolarHBondContact O-N 3.39Å; L533-L537 PolarHBondContact O-N 2.7Å; L533-L537 VanDerWaalsContact O-N 3.12Å
534	F	82.3	Confident	83.8	Confident	22 Å²	22	40.5 Å²	40.5	10%	0.096	20%	0.204	C	C	.	.	H	α-helix	trans	-66.5	-28.4	-179.6	-66.5	-69.2	0	0	0	113.6	A365 L378 Y531 Y532 L537 F538	A365-F534 HydrophobicContact CB-CB 3.99Å; A365-F534 HydrophobicContact CB-CD1 3.55Å; A365-F534 HydrophobicContact CB-CD2 4.05Å; A365-F534 HydrophobicContact CB-CE1 3.98Å; A365-F534 HydrophobicContact CB-CE2 4.43Å; A365-F534 HydrophobicContact CB-CG 3.59Å; A365-F534 HydrophobicContact CB-CZ 4.4Å; L378-F534 HydrophobicContact CD1-CE1 3.8Å; L378-F534 HydrophobicContact CD1-CZ 3.77Å; Y531-F534 HydrophobicContact CD1-CD1 4.39Å; Y531-F534 HydrophobicContact CD1-CE1 4.17Å; Y531-F534 HydrophobicContact CD1-CZ 4.45Å; Y531-F534 HydrophobicContact CE1-CD1 4.33Å; Y532-F534 VanDerWaalsContact C-N 3.25Å; Y532-F534 PolarHBondContact O-N 2.89Å; F534-L537 HydrophobicContact CD1-CD2 4.25Å; F534-L537 WeakPolarHBondContact O-CB 3.47Å; F534-L537 PolarHBondContact O-N 3.41Å; F534-F538 PolarHBondContact O-N 3.41Å
535	G	84.2	Confident	84.3	Confident	31 Å²	31	41.1 Å²	41.1	32%	0.32	21%	0.206	S	C	.	.	H	α-helix	trans	-63.3	-43.8	173.4	0	0	0	0	0	112.4	L533 F538 L539	L533-G535 VanDerWaalsContact C-N 3.3Å; L533-G535 PolarHBondContact O-N 2.9Å; G535-F538 PolarHBondContact O-N 3.03Å; G535-L539 PolarHBondContact O-N 2.89Å; G535-L539 VanDerWaalsContact O-N 3.14Å
536	F	84.3	Confident	84.6	Confident	21 Å²	21	40 Å²	40	9%	0.092	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-41.9	173.5	-68.4	-38.6	0	0	0	111.7	H279 W280 I283 L533 F538 L539 V540	H279-F536 HydrophobicContact CB-CD2 3.6Å; H279-F536 HydrophobicContact CB-CE2 3.69Å; H279-F536 HydrophobicContact CB-CG 4.23Å; H279-F536 HydrophobicContact CB-CZ 4.29Å; H279-F536 AromaticContact CG-CD2 3.94Å; W280-F536 AromaticContact CD1-CZ 3.68Å; W280-F536 AromaticContact CD2-CE1 3.92Å; W280-F536 HydrophobicContact CD2-CE1 3.92Å; W280-F536 HydrophobicContact CD2-CZ 4.14Å; W280-F536 AromaticContact CE2-CE1 3.67Å; W280-F536 AromaticContact CE2-CZ 3.71Å; W280-F536 HydrophobicContact CE3-CE1 4.42Å; W280-F536 HydrophobicContact CG-CE1 4.29Å; W280-F536 HydrophobicContact CG-CZ 4.14Å; W280-F536 HydrophobicContact CH2-CE1 4.45Å; W280-F536 AromaticContact CZ2-CE1 3.96Å; W280-F536 HydrophobicContact CZ2-CE1 3.96Å; W280-F536 HydrophobicContact CZ2-CZ 4.27Å; W280-F536 AromaticContact NE1-CE1 3.91Å; W280-F536 AromaticContact NE1-CZ 3.44Å; I283-F536 HydrophobicContact CD1-CB 3.6Å; I283-F536 HydrophobicContact CD1-CD1 3.08Å; I283-F536 HydrophobicContact CD1-CE1 3.91Å; I283-F536 HydrophobicContact CD1-CG 3.56Å; L533-F536 HydrophobicContact CB-CB 4.36Å; L533-F536 HydrophobicContact CB-CD2 3.7Å; L533-F536 HydrophobicContact CB-CE2 4.49Å; L533-F536 HydrophobicContact CB-CG 4.48Å; L533-F536 HydrophobicContact CD1-CD2 3.83Å; L533-F536 HydrophobicContact CD1-CE2 4.05Å; L533-F536 HydrophobicContact CD2-CD2 3.73Å; L533-F536 HydrophobicContact CD2-CE2 3.65Å; L533-F536 HydrophobicContact CG-CD2 3.93Å; L533-F536 HydrophobicContact CG-CE2 4.25Å; L533-F536 PolarHBondContact O-N 3.39Å; F536-F538 VanDerWaalsContact C-N 3.29Å; F536-F538 PolarHBondContact O-N 3.04Å; F536-L539 PolarHBondContact O-N 3.36Å; F536-V540 WeakPolarHBondContact O-CG2 2.96Å; F536-V540 PolarHBondContact O-N 2.84Å
537	L	88.1	Confident	84.9	Confident	33 Å²	33	39.4 Å²	39.4	17%	0.173	20%	0.2	C	C	.	.	H	α-helix	trans	-58.3	-40.3	174.6	-172.9	60.4	0	0	0	112.4	I362 I521 Y531 L533 F534 V540 F541	I362-L537 HydrophobicContact CD1-CD2 4.28Å; I362-L537 HydrophobicContact CD1-CG 4.13Å; I362-L537 HydrophobicContact CG1-CD2 4.15Å; I362-L537 HydrophobicContact CG1-CG 4.41Å; I362-L537 HydrophobicContact CG2-CB 4.48Å; I362-L537 HydrophobicContact CG2-CG 4.31Å; I521-L537 HydrophobicContact CD1-CD1 3.89Å; Y531-L537 HydrophobicContact CE1-CB 4.26Å; Y531-L537 HydrophobicContact CE1-CD2 4.28Å; L533-L537 PolarHBondContact O-N 2.7Å; L533-L537 VanDerWaalsContact O-N 3.12Å; F534-L537 HydrophobicContact CD1-CD2 4.25Å; F534-L537 WeakPolarHBondContact O-CB 3.47Å; F534-L537 PolarHBondContact O-N 3.41Å; L537-V540 PolarHBondContact O-N 2.98Å; L537-F541 WeakPolarHBondContact O-CB 3.44Å; L537-F541 PolarHBondContact O-N 2.83Å
538	F	90.8	Very high	85.6	Confident	36 Å²	36	36 Å²	36	16%	0.158	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-45.4	176.5	-173.5	-109.7	0	0	0	112.4	L359 I362 F363 M366 F534 G535 F536 F541 I542	L359-F538 HydrophobicContact CD1-CE2 3.98Å; I362-F538 HydrophobicContact CB-CD2 4.41Å; I362-F538 HydrophobicContact CG2-CB 3.61Å; I362-F538 HydrophobicContact CG2-CD2 3.78Å; I362-F538 HydrophobicContact CG2-CG 4.19Å; F363-F538 HydrophobicContact CB-CE2 4.26Å; F363-F538 HydrophobicContact CD2-CE2 4.26Å; F363-F538 HydrophobicContact CD2-CZ 4.2Å; M366-F538 HydrophobicContact CE-CD1 3.86Å; M366-F538 HydrophobicContact CE-CD2 4.47Å; M366-F538 HydrophobicContact CE-CE1 3.96Å; M366-F538 HydrophobicContact CE-CG 4.12Å; M366-F538 HydrophobicContact CE-CZ 4.32Å; M366-F538 HydrophobicContact SD-CB 3.94Å; M366-F538 HydrophobicContact SD-CD1 3.53Å; M366-F538 VanDerWaalsContact SD-CD1 3.53Å; M366-F538 HydrophobicContact SD-CE1 4.18Å; M366-F538 HydrophobicContact SD-CG 3.8Å; F534-F538 PolarHBondContact O-N 3.41Å; G535-F538 PolarHBondContact O-N 3.03Å; F536-F538 VanDerWaalsContact C-N 3.29Å; F536-F538 PolarHBondContact O-N 3.04Å; F538-F541 WeakPolarHBondContact O-CB 3.18Å; F538-F541 PolarHBondContact O-N 2.59Å; F538-I542 HydrophobicContact CD1-CD1 3.98Å; F538-I542 HydrophobicContact CE1-CD1 3.59Å; F538-I542 HydrophobicContact CZ-CD1 4.03Å; F538-I542 WeakPolarHBondContact O-CG1 3.49Å; F538-I542 PolarHBondContact O-N 2.63Å
539	L	90.6	Very high	86.7	Confident	74 Å²	74	34.8 Å²	34.8	39%	0.387	18%	0.18	S	C	.	.	H	α-helix	trans	-61.9	-45.8	176.3	-68.9	176.3	0	0	0	111.3	I283 G535 F536 F541 I542 I543	I283-L539 HydrophobicContact CG2-CD1 4.43Å; G535-L539 PolarHBondContact O-N 2.89Å; G535-L539 VanDerWaalsContact O-N 3.14Å; F536-L539 PolarHBondContact O-N 3.36Å; L539-F541 VanDerWaalsContact C-N 3.3Å; L539-F541 PolarHBondContact O-N 3.42Å; L539-I542 WeakPolarHBondContact O-CB 3.41Å; L539-I542 PolarHBondContact O-N 2.9Å; L539-I542 VanDerWaalsContact O-N 3.14Å; L539-I543 VanDerWaalsContact O-CG1 3.29Å; L539-I543 WeakPolarHBondContact O-CG1 3.41Å; L539-I543 PolarHBondContact O-N 3.24Å
540	V	91.3	Very high	87.5	Confident	7 Å²	7	31.6 Å²	31.6	4%	0.042	17%	0.165	C	C	.	.	H	α-helix	trans	-65.8	-33.8	177.8	173.6	0	0	0	0	111.9	I283 M514 E517 F536 L537 I542 I543 L544	I283-V540 HydrophobicContact CD1-CG2 4.34Å; I283-V540 HydrophobicContact CG1-CG2 3.89Å; M514-V540 HydrophobicContact CB-CG1 3.92Å; E517-V540 HydrophobicContact CB-CG1 4.32Å; E517-V540 HydrophobicContact CG-CB 3.96Å; E517-V540 HydrophobicContact CG-CG1 3.99Å; E517-V540 HydrophobicContact CG-CG2 3.56Å; F536-V540 WeakPolarHBondContact O-CG2 2.96Å; F536-V540 PolarHBondContact O-N 2.84Å; L537-V540 PolarHBondContact O-N 2.98Å; V540-I542 PolarHBondContact O-N 2.95Å; V540-I543 PolarHBondContact O-N 2.83Å; V540-L544 WeakPolarHBondContact O-CB 3.4Å; V540-L544 PolarHBondContact O-N 3.48Å
541	F	93.2	Very high	88.4	Confident	14 Å²	14	30.6 Å²	30.6	6%	0.061	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-42.3	171.3	-178.3	-103	0	0	0	112.2	F355 I358 L359 I362 L537 F538 L539 L544 V545 L619	F355-F541 AromaticContact CD2-CZ 3.85Å; F355-F541 HydrophobicContact CD2-CZ 3.85Å; F355-F541 HydrophobicContact CE2-CE1 4.03Å; F355-F541 AromaticContact CE2-CZ 3.71Å; F355-F541 HydrophobicContact CE2-CZ 3.71Å; I358-F541 HydrophobicContact CB-CE2 4.38Å; I358-F541 HydrophobicContact CG2-CD2 3.96Å; I358-F541 HydrophobicContact CG2-CE2 3.54Å; I358-F541 HydrophobicContact CG2-CZ 4.05Å; L359-F541 HydrophobicContact CB-CE1 4.08Å; L359-F541 HydrophobicContact CB-CZ 4.44Å; L359-F541 HydrophobicContact CD1-CD1 4.3Å; L359-F541 HydrophobicContact CD1-CE1 3.85Å; I362-F541 HydrophobicContact CD1-CB 4.08Å; I362-F541 HydrophobicContact CD1-CD2 4.09Å; I362-F541 HydrophobicContact CD1-CG 4.04Å; L537-F541 WeakPolarHBondContact O-CB 3.44Å; L537-F541 PolarHBondContact O-N 2.83Å; F538-F541 WeakPolarHBondContact O-CB 3.18Å; F538-F541 PolarHBondContact O-N 2.59Å; L539-F541 VanDerWaalsContact C-N 3.3Å; L539-F541 PolarHBondContact O-N 3.42Å; F541-L544 WeakPolarHBondContact O-CB 3.38Å; F541-L544 PolarHBondContact O-N 3.32Å; F541-V545 HydrophobicContact CD1-CG2 4.44Å; F541-V545 HydrophobicContact CE1-CG2 4.12Å; F541-V545 HydrophobicContact CZ-CG2 4.21Å; F541-V545 VanDerWaalsContact O-CG2 3.3Å; F541-V545 WeakPolarHBondContact O-CG2 3.38Å; F541-V545 PolarHBondContact O-N 3.44Å; F541-L619 HydrophobicContact CE2-CD2 4.23Å
542	I	93.4	Very high	89.3	Confident	76 Å²	76	29.2 Å²	29.2	39%	0.39	16%	0.156	S	C	.	.	H	α-helix	trans	-62.2	-46.7	174.3	-66.5	168.5	0	0	0	110.8	F538 L539 V540 L544 V545 V546	F538-I542 HydrophobicContact CD1-CD1 3.98Å; F538-I542 HydrophobicContact CE1-CD1 3.59Å; F538-I542 HydrophobicContact CZ-CD1 4.03Å; F538-I542 WeakPolarHBondContact O-CG1 3.49Å; F538-I542 PolarHBondContact O-N 2.63Å; L539-I542 WeakPolarHBondContact O-CB 3.41Å; L539-I542 PolarHBondContact O-N 2.9Å; L539-I542 VanDerWaalsContact O-N 3.14Å; V540-I542 PolarHBondContact O-N 2.95Å; I542-L544 VanDerWaalsContact C-N 3.28Å; I542-L544 PolarHBondContact O-N 2.75Å; I542-V545 PolarHBondContact O-N 3.03Å; I542-V546 WeakPolarHBondContact O-CG2 3.42Å; I542-V546 PolarHBondContact O-N 2.93Å
543	I	92.3	Very high	90.2	Very high	14 Å²	14	26.7 Å²	26.7	7%	0.072	15%	0.148	C	C	.	.	H	α-helix	trans	-58.6	-42.7	177.9	-66.6	169.6	0	0	0	110.4	V287 V290 A513 L539 V540 V546 S547	V287-I543 HydrophobicContact CG2-CD1 3.57Å; V287-I543 HydrophobicContact CG2-CG1 4.25Å; V290-I543 HydrophobicContact CB-CG2 4.39Å; V290-I543 HydrophobicContact CG2-CG2 3.64Å; A513-I543 HydrophobicContact CB-CG2 3.92Å; L539-I543 VanDerWaalsContact O-CG1 3.29Å; L539-I543 WeakPolarHBondContact O-CG1 3.41Å; L539-I543 PolarHBondContact O-N 3.24Å; V540-I543 PolarHBondContact O-N 2.83Å; I543-V546 PolarHBondContact O-N 3.14Å; I543-S547 VanDerWaalsContact O-CB 3.27Å; I543-S547 WeakPolarHBondContact O-CB 3.43Å; I543-S547 PolarHBondContact O-N 3.03Å; I543-S547 PolarHBondContact O-OG 2.88Å
544	L	93.1	Very high	90.8	Very high	10 Å²	10	26 Å²	26	5%	0.052	15%	0.146	C	C	.	.	H	α-helix	trans	-61.2	-45.6	176.2	178.7	69.2	0	0	0	111.6	P510 M514 V540 F541 I542 V546 S547 C548 F616 T620	P510-L544 HydrophobicContact CB-CD1 3.95Å; M514-L544 HydrophobicContact SD-CD1 4.06Å; V540-L544 WeakPolarHBondContact O-CB 3.4Å; V540-L544 PolarHBondContact O-N 3.48Å; F541-L544 WeakPolarHBondContact O-CB 3.38Å; F541-L544 PolarHBondContact O-N 3.32Å; I542-L544 VanDerWaalsContact C-N 3.28Å; I542-L544 PolarHBondContact O-N 2.75Å; L544-V546 PolarHBondContact O-N 3.36Å; L544-S547 PolarHBondContact O-N 2.88Å; L544-C548 WeakPolarHBondContact O-CB 3.23Å; L544-C548 PolarHBondContact O-N 3.27Å; L544-C548 PolarHBondContact O-SG 2.97Å; L544-F616 HydrophobicContact CD1-CE2 4.44Å; L544-F616 HydrophobicContact CD1-CZ 4.01Å; L544-F616 HydrophobicContact CD2-CE2 3.67Å; L544-F616 HydrophobicContact CD2-CZ 4.08Å; L544-T620 HydrophobicContact CD1-CG2 4.31Å; L544-T620 HydrophobicContact CD2-CG2 4.36Å
545	V	94.3	Very high	91.2	Very high	33 Å²	33	26.4 Å²	26.4	20%	0.2	15%	0.148	C	C	.	.	H	α-helix	trans	-60.1	-46.1	178.4	171.1	0	0	0	0	111.1	F355 F541 I542 S549 I623	F355-V545 HydrophobicContact CE2-CG2 3.77Å; F541-V545 HydrophobicContact CD1-CG2 4.44Å; F541-V545 HydrophobicContact CE1-CG2 4.12Å; F541-V545 HydrophobicContact CZ-CG2 4.21Å; F541-V545 VanDerWaalsContact O-CG2 3.3Å; F541-V545 WeakPolarHBondContact O-CG2 3.38Å; F541-V545 PolarHBondContact O-N 3.44Å; I542-V545 PolarHBondContact O-N 3.03Å; V545-S549 VanDerWaalsContact O-CB 3.28Å; V545-S549 WeakPolarHBondContact O-CB 3.46Å; V545-S549 PolarHBondContact O-N 3.17Å; V545-S549 PolarHBondContact O-OG 3.45Å; V545-I623 HydrophobicContact CG1-CG2 4.08Å; V545-I623 HydrophobicContact CG2-CD1 3.92Å
546	V	92.8	Very high	91.6	Very high	55 Å²	55	25 Å²	25	33%	0.333	13%	0.133	S	C	.	.	H	α-helix	trans	-64.5	-46.7	178.3	173.7	0	0	0	0	110.8	V290 I542 I543 L544 S549 Q550	V290-V546 HydrophobicContact CG1-CB 4.25Å; V290-V546 HydrophobicContact CG1-CG1 3.63Å; I542-V546 WeakPolarHBondContact O-CG2 3.42Å; I542-V546 PolarHBondContact O-N 2.93Å; I543-V546 PolarHBondContact O-N 3.14Å; L544-V546 PolarHBondContact O-N 3.36Å; V546-S549 WeakPolarHBondContact O-CB 3.42Å; V546-S549 PolarHBondContact O-N 2.85Å; V546-Q550 HydrophobicContact CG1-CG 4.35Å; V546-Q550 VanDerWaalsContact CG1-NE2 3.27Å; V546-Q550 VanDerWaalsContact O-CG 3.31Å; V546-Q550 WeakPolarHBondContact O-CG 3.5Å; V546-Q550 PolarHBondContact O-N 3.12Å
547	S	91.7	Very high	91.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.1	-48.4	-179.7	-60.6	0	0	0	0	112.3	V290 I543 L544 S549 Q550 I551	V290-S547 WeakPolarHBondContact CG2-OG 3.41Å; I543-S547 VanDerWaalsContact O-CB 3.27Å; I543-S547 WeakPolarHBondContact O-CB 3.43Å; I543-S547 PolarHBondContact O-N 3.03Å; I543-S547 PolarHBondContact O-OG 2.88Å; L544-S547 PolarHBondContact O-N 2.88Å; S547-S549 VanDerWaalsContact C-N 3.3Å; S547-S549 PolarHBondContact O-N 3.46Å; S547-Q550 PolarHBondContact O-N 3.35Å; S547-I551 WeakPolarHBondContact O-CG1 3.4Å; S547-I551 PolarHBondContact O-N 3.05Å; S547-I551 VanDerWaalsContact O-N 3.16Å
548	C	93.8	Very high	91.9	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-61.8	-41.2	176.9	-65.6	0	0	0	0	111	L544 S552 I623	L544-C548 WeakPolarHBondContact O-CB 3.23Å; L544-C548 PolarHBondContact O-N 3.27Å; L544-C548 PolarHBondContact O-SG 2.97Å; C548-S552 WeakPolarHBondContact O-CB 3.35Å; C548-S552 PolarHBondContact O-N 3.05Å; C548-S552 VanDerWaalsContact O-N 3.09Å; C548-I623 HydrophobicContact CB-CB 4.43Å; C548-I623 HydrophobicContact CB-CG2 3.94Å
549	S	93.8	Very high	91.9	Very high	27 Å²	27	26.1 Å²	26.1	19%	0.189	14%	0.136	C	C	.	.	H	α-helix	trans	-63.7	-45.3	178.7	-61.1	0	0	0	0	112.2	V545 V546 S547 I553	V545-S549 VanDerWaalsContact O-CB 3.28Å; V545-S549 WeakPolarHBondContact O-CB 3.46Å; V545-S549 PolarHBondContact O-N 3.17Å; V545-S549 PolarHBondContact O-OG 3.45Å; V546-S549 WeakPolarHBondContact O-CB 3.42Å; V546-S549 PolarHBondContact O-N 2.85Å; S547-S549 VanDerWaalsContact C-N 3.3Å; S547-S549 PolarHBondContact O-N 3.46Å; S549-I553 VanDerWaalsContact O-CG1 3.25Å; S549-I553 WeakPolarHBondContact O-CG1 3.28Å; S549-I553 PolarHBondContact O-N 3.03Å
550	Q	90.6	Very high	91.9	Very high	19 Å²	19	22.6 Å²	22.6	9%	0.089	12%	0.118	C	C	.	.	H	α-helix	trans	-63.3	-52.1	-179	-75.7	167.6	-6.9	0	0	112.3	S294 L297 V546 S547 S552 I553 V554	S294-Q550 PolarHBondContact OG-NE2 2.62Å; L297-Q550 HydrophobicContact CD1-CB 4.21Å; V546-Q550 HydrophobicContact CG1-CG 4.35Å; V546-Q550 VanDerWaalsContact CG1-NE2 3.27Å; V546-Q550 VanDerWaalsContact O-CG 3.31Å; V546-Q550 WeakPolarHBondContact O-CG 3.5Å; V546-Q550 PolarHBondContact O-N 3.12Å; S547-Q550 PolarHBondContact O-N 3.35Å; Q550-S552 VanDerWaalsContact C-N 3.28Å; Q550-S552 PolarHBondContact O-N 3.32Å; Q550-I553 PolarHBondContact O-N 3.08Å; Q550-V554 VanDerWaalsContact O-CG2 3.3Å; Q550-V554 WeakPolarHBondContact O-CG2 3.47Å; Q550-V554 PolarHBondContact O-N 2.96Å
551	I	90.6	Very high	91.8	Very high	17 Å²	17	24.3 Å²	24.3	9%	0.087	13%	0.13	C	C	.	.	H	α-helix	trans	-63.1	-41.5	-178.3	-64.6	173	0	0	0	110.6	A506 L509 P510 S547 I553 V554 M555	A506-I551 HydrophobicContact CB-CG2 3.45Å; A506-I551 VanDerWaalsContact CB-CG2 3.45Å; A506-I551 VanDerWaalsContact O-CD1 3.25Å; A506-I551 WeakPolarHBondContact O-CD1 3.5Å; L509-I551 HydrophobicContact CB-CD1 3.64Å; L509-I551 HydrophobicContact CD1-CD1 3.69Å; L509-I551 HydrophobicContact CD1-CG1 3.89Å; L509-I551 HydrophobicContact CD2-CD1 4.05Å; L509-I551 HydrophobicContact CG-CD1 4Å; P510-I551 HydrophobicContact CG-CD1 3.42Å; P510-I551 VanDerWaalsContact CG-CD1 3.42Å; S547-I551 WeakPolarHBondContact O-CG1 3.4Å; S547-I551 PolarHBondContact O-N 3.05Å; S547-I551 VanDerWaalsContact O-N 3.16Å; I551-I553 VanDerWaalsContact C-N 3.34Å; I551-I553 PolarHBondContact O-N 3.35Å; I551-V554 PolarHBondContact O-N 3.49Å; I551-M555 HydrophobicContact CG2-CG 3.93Å; I551-M555 WeakPolarHBondContact O-CB 3.42Å; I551-M555 WeakPolarHBondContact O-CG 3.37Å; I551-M555 PolarHBondContact O-N 3.01Å
552	S	93.3	Very high	91.5	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-55.4	-48.7	174.6	176.4	0	0	0	0	111.9	C548 Q550 V554 M555 V556 N571 G624 A628	C548-S552 WeakPolarHBondContact O-CB 3.35Å; C548-S552 PolarHBondContact O-N 3.05Å; C548-S552 VanDerWaalsContact O-N 3.09Å; Q550-S552 VanDerWaalsContact C-N 3.28Å; Q550-S552 PolarHBondContact O-N 3.32Å; S552-V554 PolarHBondContact O-N 3.36Å; S552-M555 PolarHBondContact O-N 3.16Å; S552-V556 WeakPolarHBondContact O-CG1 3.35Å; S552-V556 PolarHBondContact O-N 3.23Å; S552-N571 PolarHBondContact O-OD1 3.35Å; S552-N571 PolarHBondContact OG-ND2 2.87Å; S552-N571 PolarHBondContact OG-OD1 2.9Å; S552-G624 WeakPolarHBondContact OG-CA 3.45Å; S552-G624 PolarHBondContact OG-O 2.92Å; S552-A628 WeakPolarHBondContact OG-CB 3.4Å
553	I	92.3	Very high	91.4	Very high	39 Å²	39	23.5 Å²	23.5	20%	0.2	13%	0.129	C	C	.	.	H	α-helix	trans	-60.7	-44.3	177.2	-70.3	168	0	0	0	111.7	I301 S549 Q550 I551 V556 Y557 A627 F631	I301-I553 HydrophobicContact CD1-CG2 3.86Å; S549-I553 VanDerWaalsContact O-CG1 3.25Å; S549-I553 WeakPolarHBondContact O-CG1 3.28Å; S549-I553 PolarHBondContact O-N 3.03Å; Q550-I553 PolarHBondContact O-N 3.08Å; I551-I553 VanDerWaalsContact C-N 3.34Å; I551-I553 PolarHBondContact O-N 3.35Å; I553-V556 VanDerWaalsContact O-CG1 3.26Å; I553-V556 WeakPolarHBondContact O-CG1 3.47Å; I553-Y557 VanDerWaalsContact O-CB 3.31Å; I553-Y557 WeakPolarHBondContact O-CB 3.23Å; I553-Y557 PolarHBondContact O-N 3.31Å; I553-A627 HydrophobicContact CD1-CB 4.44Å; I553-A627 HydrophobicContact CG1-CB 4.41Å; I553-F631 HydrophobicContact CB-CG 4.48Å; I553-F631 HydrophobicContact CD1-CB 4.4Å; I553-F631 HydrophobicContact CG1-CB 3.93Å; I553-F631 HydrophobicContact CG1-CG 4.24Å; I553-F631 HydrophobicContact CG2-CB 4.33Å; I553-F631 HydrophobicContact CG2-CD1 4.01Å; I553-F631 HydrophobicContact CG2-CD2 3.6Å; I553-F631 HydrophobicContact CG2-CE1 4.18Å; I553-F631 HydrophobicContact CG2-CE2 3.78Å; I553-F631 HydrophobicContact CG2-CG 3.71Å; I553-F631 HydrophobicContact CG2-CZ 4.07Å
554	V	89.8	Confident	91.3	Very high	18 Å²	18	23.2 Å²	23.2	11%	0.109	13%	0.128	C	C	.	.	H	α-helix	trans	-64.5	-46.7	179.7	172.8	0	0	0	0	111.2	L297 I301 Q550 I551 S552 Y557 F558	L297-V554 HydrophobicContact CB-CG2 4.25Å; L297-V554 HydrophobicContact CD1-CG2 3.83Å; L297-V554 HydrophobicContact CD2-CG1 4.36Å; L297-V554 HydrophobicContact CD2-CG2 3.52Å; L297-V554 HydrophobicContact CG-CG2 4.05Å; I301-V554 HydrophobicContact CD1-CG2 3.93Å; Q550-V554 VanDerWaalsContact O-CG2 3.3Å; Q550-V554 WeakPolarHBondContact O-CG2 3.47Å; Q550-V554 PolarHBondContact O-N 2.96Å; I551-V554 PolarHBondContact O-N 3.49Å; S552-V554 PolarHBondContact O-N 3.36Å; V554-Y557 PolarHBondContact O-N 2.87Å; V554-F558 HydrophobicContact CG1-CD2 3.61Å; V554-F558 HydrophobicContact CG1-CE2 3.46Å; V554-F558 VanDerWaalsContact CG1-CE2 3.46Å; V554-F558 VanDerWaalsContact O-CD2 3.27Å; V554-F558 WeakPolarHBondContact O-CD2 3.25Å; V554-F558 PolarHBondContact O-N 3.33Å
555	M	90.3	Very high	91.3	Very high	30 Å²	30	24 Å²	24	15%	0.148	13%	0.13	C	C	.	.	H	α-helix	trans	-67.1	-40.8	-178.2	-70	-62.3	-71.7	0	0	111.7	A506 I551 S552 Q559 V574	A506-M555 HydrophobicContact CB-CG 4.32Å; I551-M555 HydrophobicContact CG2-CG 3.93Å; I551-M555 WeakPolarHBondContact O-CB 3.42Å; I551-M555 WeakPolarHBondContact O-CG 3.37Å; I551-M555 PolarHBondContact O-N 3.01Å; S552-M555 PolarHBondContact O-N 3.16Å; M555-Q559 WeakPolarHBondContact O-CB 3.3Å; M555-Q559 PolarHBondContact O-N 2.93Å; M555-V574 HydrophobicContact CB-CG1 3.97Å; M555-V574 HydrophobicContact CE-CG1 4.04Å; M555-V574 HydrophobicContact CG-CG1 3.84Å
556	V	92.4	Very high	91.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67.3	-38.9	174.6	72.5	0	0	0	0	111.5	S552 I553 Q559 L560 W567 A628 F631 V632	S552-V556 WeakPolarHBondContact O-CG1 3.35Å; S552-V556 PolarHBondContact O-N 3.23Å; I553-V556 VanDerWaalsContact O-CG1 3.26Å; I553-V556 WeakPolarHBondContact O-CG1 3.47Å; V556-Q559 PolarHBondContact O-N 3.19Å; V556-L560 HydrophobicContact CG2-CD1 4.22Å; V556-L560 HydrophobicContact CG2-CG 4.3Å; V556-L560 VanDerWaalsContact O-CG 3.27Å; V556-L560 WeakPolarHBondContact O-CG 3.47Å; V556-L560 PolarHBondContact O-N 2.84Å; V556-W567 HydrophobicContact CG2-CB 3.71Å; V556-W567 HydrophobicContact CG2-CD2 4.09Å; V556-W567 HydrophobicContact CG2-CE3 4.11Å; V556-W567 HydrophobicContact CG2-CG 3.92Å; V556-A628 HydrophobicContact CB-CB 4.19Å; V556-A628 HydrophobicContact CG1-CB 3.81Å; V556-F631 HydrophobicContact CG1-CD1 3.8Å; V556-F631 HydrophobicContact CG1-CE1 4.19Å; V556-V632 HydrophobicContact CG1-CG2 4.35Å; V556-V632 HydrophobicContact CG2-CG2 3.8Å
557	Y	90.5	Very high	91.3	Very high	16 Å²	16	26.7 Å²	26.7	6%	0.063	13%	0.131	C	C	.	.	H	α-helix	trans	-62.1	-49.1	177.4	175.9	-110.5	0	0	0	111.5	T304 L305 D308 W327 I553 V554 Q559 L560 C561 F631	T304-Y557 PolarHBondContact OG1-OH 2.84Å; L305-Y557 HydrophobicContact CD2-CD2 4.03Å; L305-Y557 HydrophobicContact CD2-CE2 3.42Å; L305-Y557 VanDerWaalsContact CD2-CE2 3.42Å; L305-Y557 HydrophobicContact CG-CE2 4.2Å; D308-Y557 PolarHBondContact OD2-OH 3.34Å; W327-Y557 AromaticContact CD1-CE2 3.92Å; W327-Y557 AromaticContact NE1-CE2 3.92Å; I553-Y557 VanDerWaalsContact O-CB 3.31Å; I553-Y557 WeakPolarHBondContact O-CB 3.23Å; I553-Y557 PolarHBondContact O-N 3.31Å; V554-Y557 PolarHBondContact O-N 2.87Å; Y557-Q559 VanDerWaalsContact C-N 3.31Å; Y557-Q559 PolarHBondContact O-N 3.41Å; Y557-L560 PolarHBondContact O-N 2.67Å; Y557-C561 VanDerWaalsContact CZ-SG 3.59Å; Y557-C561 PolarHBondContact O-N 3.22Å; Y557-C561 PolarHBondContact O-SG 3.14Å; Y557-F631 HydrophobicContact CD2-CE1 4.34Å; Y557-F631 HydrophobicContact CD2-CZ 4.05Å; Y557-F631 HydrophobicContact CG-CZ 4.35Å
558	F	88.6	Confident	91.5	Very high	96 Å²	96	27 Å²	27	42%	0.421	13%	0.132	S	C	.	.	H	α-helix	trans	-63.2	-36.8	176.2	-79.6	-51.4	0	0	0	112.9	M497 V554 C561 A562	M497-F558 HydrophobicContact CE-CB 3.68Å; M497-F558 HydrophobicContact CE-CG 4.37Å; V554-F558 HydrophobicContact CG1-CD2 3.61Å; V554-F558 HydrophobicContact CG1-CE2 3.46Å; V554-F558 VanDerWaalsContact CG1-CE2 3.46Å; V554-F558 VanDerWaalsContact O-CD2 3.27Å; V554-F558 WeakPolarHBondContact O-CD2 3.25Å; V554-F558 PolarHBondContact O-N 3.33Å; F558-C561 PolarHBondContact O-N 3.46Å; F558-A562 PolarHBondContact O-N 2.99Å; F558-A562 VanDerWaalsContact O-N 3.09Å
559	Q	90.7	Very high	91.5	Very high	2 Å²	2	30 Å²	30	1%	0.009	14%	0.143	C	C	.	.	H	α-helix	trans	-61.7	-44.8	173.7	168.3	172.3	-1.9	0	0	111.7	M555 V556 Y557 A562 E563 D564 R566 W567	M555-Q559 WeakPolarHBondContact O-CB 3.3Å; M555-Q559 PolarHBondContact O-N 2.93Å; V556-Q559 PolarHBondContact O-N 3.19Å; Y557-Q559 VanDerWaalsContact C-N 3.31Å; Y557-Q559 PolarHBondContact O-N 3.41Å; Q559-A562 CarbonylContact O-C 3.58Å; Q559-A562 PolarHBondContact O-N 2.76Å; Q559-E563 PolarHBondContact O-N 3.07Å; Q559-D564 HydrophobicContact CG-CB 4.04Å; Q559-D564 WeakPolarHBondContact CG-O 3.49Å; Q559-D564 PolarHBondContact NE2-O 2.89Å; Q559-D564 PolarHBondContact NE2-OD2 2.86Å; Q559-D564 PolarHBondContact O-N 2.85Å; Q559-R566 PolarHBondContact NE2-O 3.03Å; Q559-W567 VanDerWaalsContact NE2-CA 3.28Å
560	L	91.3	Very high	91.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-69	-35.9	178.4	-67.6	175.7	0	0	0	112	W327 V330 V334 V556 Y557 A562 E563 V632 I635 Y636	W327-L560 WeakPolarHBondContact CA-O 3.37Å; W327-L560 HydrophobicContact CB-CB 3.73Å; V330-L560 HydrophobicContact CG2-CD2 4.15Å; V334-L560 HydrophobicContact CG2-CD1 4.45Å; V334-L560 HydrophobicContact CG2-CD2 3.75Å; V556-L560 HydrophobicContact CG2-CD1 4.22Å; V556-L560 HydrophobicContact CG2-CG 4.3Å; V556-L560 VanDerWaalsContact O-CG 3.27Å; V556-L560 WeakPolarHBondContact O-CG 3.47Å; V556-L560 PolarHBondContact O-N 2.84Å; Y557-L560 PolarHBondContact O-N 2.67Å; L560-A562 PolarHBondContact O-N 3.45Å; L560-E563 PolarHBondContact O-N 2.74Å; L560-V632 HydrophobicContact CD1-CG2 4.02Å; L560-I635 HydrophobicContact CD1-CD1 4.02Å; L560-Y636 HydrophobicContact CD1-CE2 4.09Å
561	C	88.6	Confident	91.7	Very high	44 Å²	44	28.6 Å²	28.6	30%	0.297	13%	0.133	S	C	.	.	H	α-helix	trans	-64.2	-26.7	172.7	-65.6	0	0	0	0	112.5	Y557 F558 E563	Y557-C561 VanDerWaalsContact CZ-SG 3.59Å; Y557-C561 PolarHBondContact O-N 3.22Å; Y557-C561 PolarHBondContact O-SG 3.14Å; F558-C561 PolarHBondContact O-N 3.46Å; C561-E563 PolarHBondContact O-N 3.03Å
562	A	88.1	Confident	92	Very high	27 Å²	27	27.8 Å²	27.8	22%	0.223	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	15.4	172.5	0	0	0	0	0	113	Q493 F558 Q559 L560 D564	Q493-A562 PolarHBondContact NE2-O 2.84Å; Q493-A562 VanDerWaalsContact OE1-CB 3.31Å; F558-A562 PolarHBondContact O-N 2.99Å; F558-A562 VanDerWaalsContact O-N 3.09Å; Q559-A562 CarbonylContact O-C 3.58Å; Q559-A562 PolarHBondContact O-N 2.76Å; L560-A562 PolarHBondContact O-N 3.45Å; A562-D564 PolarHBondContact O-N 3Å; A562-D564 VanDerWaalsContact O-N 3.1Å
563	E	89.8	Confident	92.1	Very high	46 Å²	46	29.8 Å²	29.8	22%	0.215	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	18.6	176.1	-56.4	175.2	-165.2	0	0	114.7	L329 V330 P491 Q559 L560 C561 Y565	L329-E563 HydrophobicContact CD2-CG 4.34Å; V330-E563 HydrophobicContact CG1-CB 4.02Å; P491-E563 HydrophobicContact CG-CB 3.84Å; Q559-E563 PolarHBondContact O-N 3.07Å; L560-E563 PolarHBondContact O-N 2.74Å; C561-E563 PolarHBondContact O-N 3.03Å; E563-Y565 PolarHBondContact O-N 3.26Å
564	D	91.7	Very high	92.1	Very high	7 Å²	7	28 Å²	28	4%	0.037	13%	0.131	C	C	.	.			trans	-95.1	91.5	175.4	-179.3	15.4	0	0	0	111	I490 Q559 A562 R566 R570	I490-D564 HydrophobicContact CG2-CB 3.91Å; Q559-D564 HydrophobicContact CG-CB 4.04Å; Q559-D564 WeakPolarHBondContact CG-O 3.49Å; Q559-D564 PolarHBondContact NE2-O 2.89Å; Q559-D564 PolarHBondContact NE2-OD2 2.86Å; Q559-D564 PolarHBondContact O-N 2.85Å; A562-D564 PolarHBondContact O-N 3Å; A562-D564 VanDerWaalsContact O-N 3.1Å; D564-R566 PolarHBondContact O-N 2.88Å; D564-R566 VanDerWaalsContact O-N 3.1Å; D564-R566 WeakPolarHBondContact OD1-CB 3.45Å; D564-R566 IonicContact OD1-CZ 3.73Å; D564-R566 PolarHBondContact OD1-N 3.05Å; D564-R566 IonicContact OD1-NE 2.7Å; D564-R566 PolarHBondContact OD1-NE 3.05Å; D564-R566 VanDerWaalsContact OD1-NE 3.12Å; D564-R566 IonicContact OD1-NH2 3.9Å; D564-R570 IonicContact OD2-NH1 3.92Å; D564-R570 PolarHBondContact OD2-NH1 3.12Å
565	Y	92.5	Very high	92.3	Very high	28 Å²	28	27.4 Å²	27.4	11%	0.11	13%	0.127	C	C	.	.			trans	-67.5	-6	179.7	67.2	-96.1	0	0	0	114.7	D333 P487 I490 E563 W567	D333-Y565 HydrophobicContact CB-CD1 3.73Å; D333-Y565 HydrophobicContact CB-CD2 3.81Å; D333-Y565 HydrophobicContact CB-CE1 4.09Å; D333-Y565 HydrophobicContact CB-CE2 4.18Å; D333-Y565 HydrophobicContact CB-CG 3.58Å; D333-Y565 WeakPolarHBondContact O-CD2 3.5Å; P487-Y565 WeakPolarHBondContact CB-OH 3Å; I490-Y565 HydrophobicContact CD1-CD1 4.13Å; I490-Y565 HydrophobicContact CD1-CE1 3.7Å; I490-Y565 HydrophobicContact CG1-CD1 4.03Å; I490-Y565 HydrophobicContact CG1-CE1 3.68Å; E563-Y565 PolarHBondContact O-N 3.26Å; Y565-W567 PolarHBondContact O-N 3.11Å
566	R	93.1	Very high	92.5	Very high	143 Å²	143	26 Å²	26	54%	0.54	12%	0.12	S	C	.	.			trans	-81.8	51.5	-175.3	-58.9	176.1	-63.4	-168.4	-6.5	112.7	I490 Q559 D564	I490-R566 HydrophobicContact CD1-CG 3.89Å; Q559-R566 PolarHBondContact NE2-O 3.03Å; D564-R566 PolarHBondContact O-N 2.88Å; D564-R566 VanDerWaalsContact O-N 3.1Å; D564-R566 WeakPolarHBondContact OD1-CB 3.45Å; D564-R566 IonicContact OD1-CZ 3.73Å; D564-R566 PolarHBondContact OD1-N 3.05Å; D564-R566 IonicContact OD1-NE 2.7Å; D564-R566 PolarHBondContact OD1-NE 3.05Å; D564-R566 VanDerWaalsContact OD1-NE 3.12Å; D564-R566 IonicContact OD1-NH2 3.9Å
567	W	94	Very high	92.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-80.6	-26	-171.3	69.3	-89.5	0	0	0	114	V334 V556 Q559 Y565 W569 R570 N571 F625 A628 Y629 V632	V334-W567 PolarHBondContact O-NE1 3.38Å; V556-W567 HydrophobicContact CG2-CB 3.71Å; V556-W567 HydrophobicContact CG2-CD2 4.09Å; V556-W567 HydrophobicContact CG2-CE3 4.11Å; V556-W567 HydrophobicContact CG2-CG 3.92Å; Q559-W567 VanDerWaalsContact NE2-CA 3.28Å; Y565-W567 PolarHBondContact O-N 3.11Å; W567-W569 PolarHBondContact O-N 2.92Å; W567-R570 PolarHBondContact O-N 2.88Å; W567-N571 HydrophobicContact CE3-CB 4.08Å; W567-N571 WeakPolarHBondContact O-CB 3.46Å; W567-N571 PolarHBondContact O-N 3.3Å; W567-F625 HydrophobicContact CH2-CE2 4.43Å; W567-F625 HydrophobicContact CZ3-CD2 4.39Å; W567-F625 HydrophobicContact CZ3-CE2 4.17Å; W567-A628 HydrophobicContact CE3-CB 4.42Å; W567-A628 HydrophobicContact CZ3-CB 4.2Å; W567-Y629 AromaticContact CH2-CD2 3.58Å; W567-Y629 HydrophobicContact CH2-CD2 3.58Å; W567-Y629 HydrophobicContact CH2-CG 4.15Å; W567-Y629 AromaticContact CZ2-CD2 3.94Å; W567-Y629 HydrophobicContact CZ2-CD2 3.94Å; W567-V632 HydrophobicContact CD2-CG2 4.41Å; W567-V632 HydrophobicContact CZ2-CB 4.5Å; W567-V632 HydrophobicContact CZ2-CG1 4.34Å
568	W	95	Very high	92.7	Very high	7 Å²	7	25.4 Å²	25.4	3%	0.027	12%	0.118	C	C	.	.	H	α-helix	trans	-47.9	-62.8	-173.7	-62.2	95.9	0	0	0	114.7	V334 F335 R336 P338 L344 L400 L404 F572 F625 Y629	V334-W568 PolarHBondContact O-NE1 3.24Å; F335-W568 HydrophobicContact CD1-CZ2 4.43Å; R336-W568 PolarHBondContact O-NE1 2.95Å; P338-W568 HydrophobicContact CB-CB 3.75Å; P338-W568 HydrophobicContact CB-CG 3.97Å; P338-W568 HydrophobicContact CG-CB 3.86Å; P338-W568 HydrophobicContact CG-CD2 4.36Å; P338-W568 HydrophobicContact CG-CG 3.9Å; L344-W568 HydrophobicContact CD2-CB 4.01Å; L400-W568 HydrophobicContact CD1-CZ3 4.33Å; L404-W568 HydrophobicContact CD2-CD2 4.48Å; L404-W568 HydrophobicContact CD2-CE3 4.26Å; L404-W568 HydrophobicContact CD2-CH2 3.74Å; L404-W568 HydrophobicContact CD2-CZ2 3.96Å; L404-W568 HydrophobicContact CD2-CZ3 3.91Å; W568-F572 PolarHBondContact O-N 3.37Å; W568-F625 AromaticContact CE3-CE2 3.66Å; W568-F625 HydrophobicContact CE3-CE2 3.66Å; W568-F625 AromaticContact CE3-CZ 3.47Å; W568-F625 HydrophobicContact CE3-CZ 3.47Å; W568-F625 VanDerWaalsContact CE3-CZ 3.47Å; W568-F625 HydrophobicContact CZ3-CE2 4.32Å; W568-F625 AromaticContact CZ3-CZ 3.69Å; W568-F625 HydrophobicContact CZ3-CZ 3.69Å; W568-Y629 AromaticContact CH2-CD2 3.93Å; W568-Y629 HydrophobicContact CH2-CD2 3.93Å; W568-Y629 AromaticContact CH2-CE2 3.53Å; W568-Y629 HydrophobicContact CH2-CE2 3.53Å; W568-Y629 AromaticContact CZ3-CD2 3.94Å; W568-Y629 HydrophobicContact CZ3-CD2 3.94Å; W568-Y629 AromaticContact CZ3-CE2 3.9Å; W568-Y629 HydrophobicContact CZ3-CE2 3.9Å
569	W	95.2	Very high	93.1	Very high	63 Å²	63	21 Å²	21	24%	0.239	10%	0.1	C	C	.	.	H	α-helix	trans	-74.3	-38.8	177.9	-80.4	108.4	0	0	0	112.5	Q339 I343 L344 L347 W567 N571 F572 L573	Q339-W569 PolarHBondContact O-NE1 3.27Å; I343-W569 HydrophobicContact CB-CH2 4.27Å; I343-W569 HydrophobicContact CB-CZ2 4.43Å; I343-W569 HydrophobicContact CG2-CH2 4.02Å; L344-W569 HydrophobicContact CB-CD2 4.49Å; L344-W569 HydrophobicContact CB-CH2 3.82Å; L344-W569 HydrophobicContact CB-CZ2 3.51Å; L344-W569 HydrophobicContact CB-CZ3 4.41Å; L344-W569 HydrophobicContact CD1-CD2 3.99Å; L344-W569 HydrophobicContact CD1-CE3 3.79Å; L344-W569 HydrophobicContact CD1-CH2 4.15Å; L344-W569 HydrophobicContact CD1-CZ2 4.34Å; L344-W569 HydrophobicContact CD1-CZ3 3.86Å; L344-W569 HydrophobicContact CG-CZ2 4.42Å; L347-W569 HydrophobicContact CD1-CH2 3.94Å; L347-W569 HydrophobicContact CD1-CZ3 3.88Å; W567-W569 PolarHBondContact O-N 2.92Å; W569-N571 VanDerWaalsContact C-N 3.31Å; W569-N571 PolarHBondContact O-N 2.83Å; W569-F572 HydrophobicContact CE3-CD1 4.16Å; W569-F572 HydrophobicContact CZ3-CD1 4.22Å; W569-F572 HydrophobicContact CZ3-CE1 4.41Å; W569-F572 PolarHBondContact O-N 2.82Å; W569-L573 WeakPolarHBondContact O-CB 3.36Å; W569-L573 VanDerWaalsContact O-CG 3.3Å; W569-L573 WeakPolarHBondContact O-CG 3.4Å; W569-L573 PolarHBondContact O-N 3.36Å
570	R	93.7	Very high	93.3	Very high	16 Å²	16	25.6 Å²	25.6	6%	0.06	12%	0.12	C	C	.	.	H	α-helix	trans	-59.8	-46.2	-177.2	178.1	164.8	158.8	-166.4	-0.9	110.1	M497 D564 W567 L573 V574	M497-R570 PolarHBondContact O-NH2 3.12Å; M497-R570 VanDerWaalsContact O-NH2 3.16Å; D564-R570 IonicContact OD2-NH1 3.92Å; D564-R570 PolarHBondContact OD2-NH1 3.12Å; W567-R570 PolarHBondContact O-N 2.88Å; R570-L573 PolarHBondContact O-N 3.36Å; R570-V574 HydrophobicContact CG-CG2 4.17Å; R570-V574 VanDerWaalsContact O-CB 3.26Å; R570-V574 WeakPolarHBondContact O-CB 3.15Å; R570-V574 WeakPolarHBondContact O-CG2 3.41Å; R570-V574 PolarHBondContact O-N 3.45Å
571	N	94.6	Very high	93.5	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-68.9	-39.4	-179.5	-167.3	74	0	0	0	113.1	S552 W567 W569 L573 V574 S575 G624 A628	S552-N571 PolarHBondContact O-OD1 3.35Å; S552-N571 PolarHBondContact OG-ND2 2.87Å; S552-N571 PolarHBondContact OG-OD1 2.9Å; W567-N571 HydrophobicContact CE3-CB 4.08Å; W567-N571 WeakPolarHBondContact O-CB 3.46Å; W567-N571 PolarHBondContact O-N 3.3Å; W569-N571 VanDerWaalsContact C-N 3.31Å; W569-N571 PolarHBondContact O-N 2.83Å; N571-L573 VanDerWaalsContact C-N 3.34Å; N571-L573 PolarHBondContact O-N 3.18Å; N571-V574 PolarHBondContact O-N 3.48Å; N571-S575 WeakPolarHBondContact O-CB 3.35Å; N571-S575 PolarHBondContact O-N 3.1Å; N571-G624 PolarHBondContact ND2-O 3.11Å; N571-A628 WeakPolarHBondContact ND2-CB 3.23Å
572	F	96.2	Very high	93.9	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.6	-45.6	172.2	175.8	-108.3	0	0	0	111.7	L344 L347 L348 W568 W569 G576 W617 L618 G621 F625	L344-F572 HydrophobicContact CD1-CB 4.32Å; L344-F572 HydrophobicContact CD1-CD1 4.36Å; L344-F572 HydrophobicContact CD1-CG 4.26Å; L347-F572 HydrophobicContact CB-CZ 4.08Å; L347-F572 HydrophobicContact CD1-CE1 4.1Å; L347-F572 HydrophobicContact CD1-CZ 4.43Å; L348-F572 HydrophobicContact CD2-CD2 3.59Å; L348-F572 HydrophobicContact CD2-CE2 3.82Å; L348-F572 HydrophobicContact CG-CD2 4.46Å; W568-F572 PolarHBondContact O-N 3.37Å; W569-F572 HydrophobicContact CE3-CD1 4.16Å; W569-F572 HydrophobicContact CZ3-CD1 4.22Å; W569-F572 HydrophobicContact CZ3-CE1 4.41Å; W569-F572 PolarHBondContact O-N 2.82Å; F572-G576 PolarHBondContact O-N 3.02Å; F572-G576 VanDerWaalsContact O-N 3.14Å; F572-W617 HydrophobicContact CD1-CH2 4.44Å; F572-W617 HydrophobicContact CD1-CZ2 4.13Å; F572-W617 AromaticContact CE1-CH2 3.4Å; F572-W617 HydrophobicContact CE1-CH2 3.4Å; F572-W617 AromaticContact CE1-CZ2 3.43Å; F572-W617 HydrophobicContact CE1-CZ2 3.43Å; F572-W617 VanDerWaalsContact CE1-CZ2 3.43Å; F572-W617 HydrophobicContact CE1-CZ3 4.08Å; F572-W617 AromaticContact CZ-CH2 3.92Å; F572-W617 HydrophobicContact CZ-CH2 3.92Å; F572-W617 HydrophobicContact CZ-CZ2 4.11Å; F572-W617 HydrophobicContact CZ-CZ3 4.14Å; F572-L618 HydrophobicContact CZ-CD2 4.1Å; F572-G621 VanDerWaalsContact CD2-C 3.44Å; F572-G621 WeakPolarHBondContact CD2-O 3.32Å; F572-G621 WeakPolarHBondContact O-CA 3.3Å; F572-F625 HydrophobicContact CB-CD2 4.25Å; F572-F625 HydrophobicContact CD2-CB 4.44Å
573	L	95.4	Very high	94.2	Very high	42 Å²	42	27.8 Å²	27.8	22%	0.22	12%	0.122	C	C	.	.	H	α-helix	trans	-68	-41.8	177.9	-69.8	168.3	0	0	0	113	I503 W569 R570 N571 G576 G577 W617	I503-L573 HydrophobicContact CD1-CB 4.11Å; I503-L573 HydrophobicContact CG1-CB 4.32Å; W569-L573 WeakPolarHBondContact O-CB 3.36Å; W569-L573 VanDerWaalsContact O-CG 3.3Å; W569-L573 WeakPolarHBondContact O-CG 3.4Å; W569-L573 PolarHBondContact O-N 3.36Å; R570-L573 PolarHBondContact O-N 3.36Å; N571-L573 VanDerWaalsContact C-N 3.34Å; N571-L573 PolarHBondContact O-N 3.18Å; L573-G576 PolarHBondContact O-N 3.35Å; L573-G577 PolarHBondContact O-N 2.94Å; L573-W617 HydrophobicContact CD2-CZ2 3.72Å
574	V	93.2	Very high	94.5	Very high	3 Å²	3	29 Å²	29	2%	0.018	13%	0.132	C	C	.	.	H	α-helix	trans	-65.8	-46.3	-178.7	166	0	0	0	0	110.8	I503 A506 M555 R570 N571 G576 G577	I503-V574 HydrophobicContact CG1-CG2 4.09Å; A506-V574 HydrophobicContact CB-CB 4.47Å; A506-V574 HydrophobicContact CB-CG1 3.28Å; A506-V574 WeakPolarHBondContact CB-O 3.14Å; M555-V574 HydrophobicContact CB-CG1 3.97Å; M555-V574 HydrophobicContact CE-CG1 4.04Å; M555-V574 HydrophobicContact CG-CG1 3.84Å; R570-V574 HydrophobicContact CG-CG2 4.17Å; R570-V574 VanDerWaalsContact O-CB 3.26Å; R570-V574 WeakPolarHBondContact O-CB 3.15Å; R570-V574 WeakPolarHBondContact O-CG2 3.41Å; R570-V574 PolarHBondContact O-N 3.45Å; N571-V574 PolarHBondContact O-N 3.48Å; V574-G576 VanDerWaalsContact C-N 3.27Å; V574-G576 PolarHBondContact O-N 3.2Å; V574-G577 PolarHBondContact O-N 3.02Å
575	S	92.7	Very high	94.7	Very high	5 Å²	5	29.3 Å²	29.3	4%	0.035	13%	0.133	C	C	.	.	H	α-helix	trans	-68.6	-27.6	176.4	-169.8	0	0	0	0	112.9	N571 G577 T620 G624	N571-S575 WeakPolarHBondContact O-CB 3.35Å; N571-S575 PolarHBondContact O-N 3.1Å; S575-G577 PolarHBondContact O-N 2.84Å; S575-T620 WeakPolarHBondContact O-CB 3.42Å; S575-T620 PolarHBondContact OG-O 2.98Å; S575-G624 WeakPolarHBondContact OG-CA 3.13Å; S575-G624 PolarHBondContact OG-N 2.9Å
576	G	94.6	Very high	94.8	Very high	1 Å²	1	28 Å²	28	1%	0.01	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-6.5	171	0	0	0	0	0	114.3	F572 L573 V574 S578 A579 T620	F572-G576 PolarHBondContact O-N 3.02Å; F572-G576 VanDerWaalsContact O-N 3.14Å; L573-G576 PolarHBondContact O-N 3.35Å; V574-G576 VanDerWaalsContact C-N 3.27Å; V574-G576 PolarHBondContact O-N 3.2Å; G576-S578 PolarHBondContact O-N 2.94Å; G576-S578 VanDerWaalsContact O-N 3.13Å; G576-A579 VanDerWaalsContact O-CB 3.31Å; G576-A579 WeakPolarHBondContact O-CB 3.48Å; G576-A579 PolarHBondContact O-N 2.9Å; G576-A579 VanDerWaalsContact O-N 3.08Å; G576-T620 WeakPolarHBondContact CA-OG1 3.34Å
577	G	94.4	Very high	94.9	Very high	2 Å²	2	25 Å²	25	2%	0.021	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.2	-172.6	0	0	0	0	0	114.8	L573 V574 S575 A579 F580	L573-G577 PolarHBondContact O-N 2.94Å; V574-G577 PolarHBondContact O-N 3.02Å; S575-G577 PolarHBondContact O-N 2.84Å; G577-A579 PolarHBondContact O-N 3.41Å; G577-F580 WeakPolarHBondContact O-CB 3.44Å; G577-F580 PolarHBondContact O-N 2.79Å; G577-F580 VanDerWaalsContact O-N 3.1Å
578	S	94.5	Very high	94.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.5	-28.1	175.1	52.2	0	0	0	0	112.7	G576 F580 Y581 V582 F616	G576-S578 PolarHBondContact O-N 2.94Å; G576-S578 VanDerWaalsContact O-N 3.13Å; S578-F580 PolarHBondContact O-N 3.38Å; S578-Y581 PolarHBondContact O-N 3.41Å; S578-Y581 VanDerWaalsContact O-N 3.13Å; S578-V582 PolarHBondContact O-N 3.04Å; S578-V582 VanDerWaalsContact O-N 3.14Å; S578-F616 VanDerWaalsContact OG-CE1 3.26Å; S578-F616 WeakPolarHBondContact OG-CE1 3.46Å
579	A	96.1	Very high	94.8	Very high	4 Å²	4	30 Å²	30	3%	0.033	14%	0.144	C	C	.	.	H	α-helix	trans	-63.4	-28.7	176	0	0	0	0	0	113.4	G576 G577 Y581 V582 L583 V613 F616 W617	G576-A579 VanDerWaalsContact O-CB 3.31Å; G576-A579 WeakPolarHBondContact O-CB 3.48Å; G576-A579 PolarHBondContact O-N 2.9Å; G576-A579 VanDerWaalsContact O-N 3.08Å; G577-A579 PolarHBondContact O-N 3.41Å; A579-Y581 VanDerWaalsContact C-N 3.34Å; A579-V582 PolarHBondContact O-N 2.69Å; A579-L583 PolarHBondContact O-N 3.36Å; A579-V613 HydrophobicContact CB-CG1 4.08Å; A579-F616 HydrophobicContact CB-CD1 3.91Å; A579-W617 HydrophobicContact CB-CB 3.58Å; A579-W617 HydrophobicContact CB-CG 4.41Å
580	F	95.2	Very high	94.7	Very high	98 Å²	98	28.7 Å²	28.7	43%	0.43	14%	0.14	S	C	.	.	H	α-helix	trans	-63.6	-42.2	173.6	175.2	-100	0	0	0	111.3	L504 G577 S578 L583 V584	L504-F580 HydrophobicContact CD2-CD1 3.53Å; L504-F580 HydrophobicContact CD2-CE1 3.5Å; L504-F580 HydrophobicContact CD2-CG 4.31Å; L504-F580 HydrophobicContact CD2-CZ 4.25Å; G577-F580 WeakPolarHBondContact O-CB 3.44Å; G577-F580 PolarHBondContact O-N 2.79Å; G577-F580 VanDerWaalsContact O-N 3.1Å; S578-F580 PolarHBondContact O-N 3.38Å; F580-L583 WeakPolarHBondContact O-CB 3.32Å; F580-L583 PolarHBondContact O-N 3.22Å; F580-V584 HydrophobicContact CD1-CG2 4.33Å; F580-V584 HydrophobicContact CE1-CG2 3.87Å; F580-V584 HydrophobicContact CE2-CG2 4.31Å; F580-V584 HydrophobicContact CZ-CG2 3.86Å; F580-V584 WeakPolarHBondContact O-CG2 3.19Å; F580-V584 PolarHBondContact O-N 2.75Å
581	Y	95.5	Very high	94.6	Very high	46 Å²	46	32.8 Å²	32.8	18%	0.18	17%	0.167	C	C	.	.	H	α-helix	trans	-68.6	-36.2	177.1	-65.2	-81.8	0	0	0	112.2	L504 G507 I508 F511 S578 A579 L583 V584 Y585	L504-Y581 VanDerWaalsContact O-CE2 3.31Å; L504-Y581 WeakPolarHBondContact O-CE2 3.43Å; L504-Y581 PolarHBondContact O-OH 2.91Å; G507-Y581 VanDerWaalsContact C-CE2 3.43Å; I508-Y581 HydrophobicContact CG1-CE1 3.93Å; I508-Y581 HydrophobicContact CG1-CE2 3.91Å; I508-Y581 WeakPolarHBondContact CG1-OH 3.32Å; F511-Y581 HydrophobicContact CB-CD2 4.4Å; F511-Y581 HydrophobicContact CB-CG 4.22Å; F511-Y581 HydrophobicContact CD1-CD1 4.34Å; F511-Y581 HydrophobicContact CD1-CG 4.11Å; F511-Y581 VanDerWaalsContact CD2-CB 3.4Å; F511-Y581 HydrophobicContact CG-CG 4.05Å; S578-Y581 PolarHBondContact O-N 3.41Å; S578-Y581 VanDerWaalsContact O-N 3.13Å; A579-Y581 VanDerWaalsContact C-N 3.34Å; Y581-L583 VanDerWaalsContact C-N 3.3Å; Y581-L583 PolarHBondContact O-N 2.83Å; Y581-V584 PolarHBondContact O-N 3.34Å; Y581-Y585 VanDerWaalsContact O-CB 3.3Å; Y581-Y585 WeakPolarHBondContact O-CB 3.24Å; Y581-Y585 PolarHBondContact O-N 3.31Å
582	V	95.9	Very high	94.5	Very high	6 Å²	6	37.3 Å²	37.3	4%	0.036	19%	0.191	C	C	.	.	H	α-helix	trans	-60	-41.7	170.9	177.3	0	0	0	0	110.9	F511 L518 S578 A579 Y585 A586 V613 F616	F511-V582 HydrophobicContact CD2-CG2 4.16Å; F511-V582 HydrophobicContact CE2-CG2 4.48Å; L518-V582 HydrophobicContact CD1-CG1 4.37Å; L518-V582 HydrophobicContact CD2-CB 4.46Å; L518-V582 HydrophobicContact CD2-CG1 4.23Å; L518-V582 HydrophobicContact CD2-CG2 4.05Å; S578-V582 PolarHBondContact O-N 3.04Å; S578-V582 VanDerWaalsContact O-N 3.14Å; A579-V582 PolarHBondContact O-N 2.69Å; V582-Y585 PolarHBondContact O-N 2.92Å; V582-A586 WeakPolarHBondContact O-CB 3.47Å; V582-A586 PolarHBondContact O-N 3.41Å; V582-V613 HydrophobicContact CB-CG2 4.47Å; V582-V613 HydrophobicContact CG1-CG2 4.02Å; V582-F616 HydrophobicContact CG2-CD1 3.89Å; V582-F616 HydrophobicContact CG2-CE1 3.8Å; V582-F616 HydrophobicContact CG2-CZ 4.49Å
583	L	96	Very high	94	Very high	65 Å²	65	42.7 Å²	42.7	34%	0.34	21%	0.214	S	C	.	.	H	α-helix	trans	-64.5	-46.3	176.3	180	65.1	0	0	0	112.3	A579 F580 Y581 Y585 A586 I587 V613	A579-L583 PolarHBondContact O-N 3.36Å; F580-L583 WeakPolarHBondContact O-CB 3.32Å; F580-L583 PolarHBondContact O-N 3.22Å; Y581-L583 VanDerWaalsContact C-N 3.3Å; Y581-L583 PolarHBondContact O-N 2.83Å; L583-Y585 VanDerWaalsContact C-N 3.32Å; L583-Y585 PolarHBondContact O-N 3.03Å; L583-A586 PolarHBondContact O-N 3.31Å; L583-I587 HydrophobicContact CG-CD1 4.41Å; L583-I587 WeakPolarHBondContact O-CG1 3.31Å; L583-I587 PolarHBondContact O-N 2.94Å; L583-V613 HydrophobicContact CB-CG1 4.2Å; L583-V613 HydrophobicContact CB-CG2 4.01Å; L583-V613 HydrophobicContact CD1-CG2 4.27Å
584	V	95.8	Very high	93.6	Very high	71 Å²	71	41.4 Å²	41.4	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-61.2	-43.6	176.9	172.5	0	0	0	0	110.7	F580 Y581 I587 F588	F580-V584 HydrophobicContact CD1-CG2 4.33Å; F580-V584 HydrophobicContact CE1-CG2 3.87Å; F580-V584 HydrophobicContact CE2-CG2 4.31Å; F580-V584 HydrophobicContact CZ-CG2 3.86Å; F580-V584 WeakPolarHBondContact O-CG2 3.19Å; F580-V584 PolarHBondContact O-N 2.75Å; Y581-V584 PolarHBondContact O-N 3.34Å; V584-I587 PolarHBondContact O-N 3.3Å; V584-F588 PolarHBondContact O-N 3.1Å
585	Y	95	Very high	93.2	Very high	14 Å²	14	47 Å²	47	6%	0.055	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-40.1	176.4	177.7	-105.7	0	0	0	112.3	F511 F515 L518 F519 F522 Y581 V582 L583 I587 F588 Y589	F511-Y585 HydrophobicContact CZ-CG 4.5Å; F515-Y585 HydrophobicContact CD2-CD2 4.39Å; F515-Y585 HydrophobicContact CD2-CE2 4.49Å; F515-Y585 AromaticContact CE2-CD2 3.52Å; F515-Y585 HydrophobicContact CE2-CD2 3.52Å; F515-Y585 AromaticContact CE2-CE2 3.49Å; F515-Y585 HydrophobicContact CE2-CE2 3.49Å; F515-Y585 VanDerWaalsContact CE2-CE2 3.49Å; F515-Y585 HydrophobicContact CE2-CG 4.28Å; F515-Y585 HydrophobicContact CZ-CD2 4.31Å; F515-Y585 AromaticContact CZ-CE2 3.91Å; F515-Y585 HydrophobicContact CZ-CE2 3.91Å; L518-Y585 HydrophobicContact CD2-CD1 3.6Å; L518-Y585 HydrophobicContact CD2-CE1 4.14Å; L518-Y585 HydrophobicContact CD2-CG 4.33Å; L518-Y585 HydrophobicContact CG-CD1 4.07Å; L518-Y585 HydrophobicContact CG-CE1 4.14Å; F519-Y585 VanDerWaalsContact CD2-OH 3.26Å; F519-Y585 WeakPolarHBondContact CD2-OH 3.14Å; F522-Y585 HydrophobicContact CD2-CE1 4.42Å; F522-Y585 HydrophobicContact CG-CE1 4.31Å; Y581-Y585 VanDerWaalsContact O-CB 3.3Å; Y581-Y585 WeakPolarHBondContact O-CB 3.24Å; Y581-Y585 PolarHBondContact O-N 3.31Å; V582-Y585 PolarHBondContact O-N 2.92Å; L583-Y585 VanDerWaalsContact C-N 3.32Å; L583-Y585 PolarHBondContact O-N 3.03Å; Y585-I587 PolarHBondContact O-N 3.45Å; Y585-F588 HydrophobicContact CD2-CD1 4.26Å; Y585-F588 HydrophobicContact CE2-CD1 4.22Å; Y585-F588 CarbonylContact O-C 3.6Å; Y585-F588 WeakPolarHBondContact O-CB 3.43Å; Y585-F588 PolarHBondContact O-N 3.43Å; Y585-Y589 WeakPolarHBondContact O-CB 3.47Å; Y585-Y589 PolarHBondContact O-N 2.8Å
586	A	95	Very high	92.7	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-42.5	175.2	0	0	0	0	0	111.7	F522 V582 L583 F588 Y589 F590 Y605 T609	F522-A586 HydrophobicContact CE1-CB 3.73Å; F522-A586 HydrophobicContact CZ-CB 3.9Å; V582-A586 WeakPolarHBondContact O-CB 3.47Å; V582-A586 PolarHBondContact O-N 3.41Å; L583-A586 PolarHBondContact O-N 3.31Å; A586-F588 VanDerWaalsContact C-N 3.33Å; A586-F588 PolarHBondContact O-N 3.45Å; A586-Y589 PolarHBondContact O-N 2.81Å; A586-F590 WeakPolarHBondContact O-CB 3.2Å; A586-F590 PolarHBondContact O-N 3.19Å; A586-Y605 WeakPolarHBondContact CA-OH 3.36Å; A586-Y605 PolarHBondContact O-OH 3.19Å; A586-T609 HydrophobicContact CB-CG2 3.39Å
587	I	95.1	Very high	91.9	Very high	80 Å²	80	52.9 Å²	52.9	41%	0.41	27%	0.272	S	S	.	.	H	α-helix	trans	-61.4	-44.2	173.8	-64.7	164.7	0	0	0	110.7	L583 V584 Y585 Y589 F590 V591 F606	L583-I587 HydrophobicContact CG-CD1 4.41Å; L583-I587 WeakPolarHBondContact O-CG1 3.31Å; L583-I587 PolarHBondContact O-N 2.94Å; V584-I587 PolarHBondContact O-N 3.3Å; Y585-I587 PolarHBondContact O-N 3.45Å; I587-Y589 VanDerWaalsContact C-N 3.34Å; I587-Y589 PolarHBondContact O-N 2.91Å; I587-F590 PolarHBondContact O-N 2.74Å; I587-V591 WeakPolarHBondContact O-CG2 3.48Å; I587-V591 PolarHBondContact O-N 3.08Å; I587-V591 VanDerWaalsContact O-N 3.1Å; I587-F606 HydrophobicContact CG1-CE1 4.23Å
588	F	94.5	Very high	91.4	Very high	110 Å²	110	55.1 Å²	55.1	48%	0.482	28%	0.282	S	S	.	.	H	α-helix	trans	-60.3	-43.4	175.7	172.1	-92.5	0	0	0	112.1	V584 Y585 A586 V591 N592	V584-F588 PolarHBondContact O-N 3.1Å; Y585-F588 HydrophobicContact CD2-CD1 4.26Å; Y585-F588 HydrophobicContact CE2-CD1 4.22Å; Y585-F588 CarbonylContact O-C 3.6Å; Y585-F588 WeakPolarHBondContact O-CB 3.43Å; Y585-F588 PolarHBondContact O-N 3.43Å; A586-F588 VanDerWaalsContact C-N 3.33Å; A586-F588 PolarHBondContact O-N 3.45Å; F588-V591 PolarHBondContact O-N 2.79Å; F588-N592 WeakPolarHBondContact CD2-ND2 3.36Å; F588-N592 HydrophobicContact CE1-CB 4.46Å; F588-N592 HydrophobicContact CE2-CB 4.35Å; F588-N592 WeakPolarHBondContact CE2-ND2 3.3Å; F588-N592 HydrophobicContact CZ-CB 4.18Å; F588-N592 WeakPolarHBondContact O-CB 3.36Å; F588-N592 PolarHBondContact O-N 3.48Å; F588-N592 PolarHBondContact O-ND2 3.21Å
589	Y	92.6	Very high	91.2	Very high	1 Å²	1	62.1 Å²	62.1	0%	0.004	31%	0.312	C	S	.	.	H	α-helix	trans	-64.8	-42.8	178.7	-171.4	-92.3	0	0	0	111	F522 S523 W526 E527 Y585 A586 I587 V591 K593 L594	F522-Y589 HydrophobicContact CB-CD1 4.42Å; F522-Y589 HydrophobicContact CB-CD2 4.36Å; F522-Y589 HydrophobicContact CB-CE1 4.15Å; F522-Y589 HydrophobicContact CB-CE2 4.14Å; F522-Y589 AromaticContact CD1-CD1 3.79Å; F522-Y589 HydrophobicContact CD1-CD1 3.79Å; F522-Y589 HydrophobicContact CD1-CE1 4.21Å; F522-Y589 HydrophobicContact CD1-CG 4.02Å; S523-Y589 WeakPolarHBondContact CA-OH 3.18Å; W526-Y589 HydrophobicContact CB-CE1 4.27Å; W526-Y589 AromaticContact CD1-CE1 3.98Å; W526-Y589 HydrophobicContact CG-CE1 4.42Å; E527-Y589 PolarHBondContact OE1-OH 3.16Å; Y585-Y589 WeakPolarHBondContact O-CB 3.47Å; Y585-Y589 PolarHBondContact O-N 2.8Å; A586-Y589 PolarHBondContact O-N 2.81Å; I587-Y589 VanDerWaalsContact C-N 3.34Å; I587-Y589 PolarHBondContact O-N 2.91Å; Y589-V591 VanDerWaalsContact C-N 3.34Å; Y589-V591 PolarHBondContact O-N 3.42Å; Y589-K593 HydrophobicContact CD1-CB 4.42Å; Y589-K593 HydrophobicContact CD2-CB 3.88Å; Y589-K593 HydrophobicContact CD2-CG 3.84Å; Y589-K593 HydrophobicContact CE1-CB 4.34Å; Y589-K593 HydrophobicContact CE2-CB 3.75Å; Y589-K593 HydrophobicContact CE2-CG 3.85Å; Y589-K593 HydrophobicContact CG-CB 4.2Å; Y589-K593 WeakPolarHBondContact O-CA 3.31Å; Y589-K593 WeakPolarHBondContact O-CB 3.39Å; Y589-K593 PolarHBondContact O-N 3.16Å; Y589-L594 HydrophobicContact CD1-CD1 3.77Å; Y589-L594 HydrophobicContact CD1-CG 3.91Å; Y589-L594 HydrophobicContact CE1-CD1 3.79Å; Y589-L594 HydrophobicContact CE1-CD2 3.88Å; Y589-L594 HydrophobicContact CE1-CG 3.7Å; Y589-L594 PolarHBondContact O-N 3.27Å
590	F	92.4	Very high	90.9	Very high	36 Å²	36	63.2 Å²	63.2	16%	0.158	32%	0.317	C	S	.	.	H	α-helix	trans	-57.1	-45.2	173.5	-178.4	-96.6	0	0	0	112.6	A586 I587 L594 I596 Y605 F606	A586-F590 WeakPolarHBondContact O-CB 3.2Å; A586-F590 PolarHBondContact O-N 3.19Å; I587-F590 PolarHBondContact O-N 2.74Å; F590-L594 HydrophobicContact CD2-CD1 4.46Å; F590-I596 HydrophobicContact CD2-CD1 4.35Å; F590-I596 HydrophobicContact CE2-CB 4.07Å; F590-I596 HydrophobicContact CE2-CD1 4.07Å; F590-I596 HydrophobicContact CE2-CG2 4.32Å; F590-Y605 HydrophobicContact CB-CD1 4.22Å; F590-Y605 HydrophobicContact CB-CE1 3.66Å; F590-Y605 AromaticContact CD2-CD1 3.56Å; F590-Y605 HydrophobicContact CD2-CD1 3.56Å; F590-Y605 HydrophobicContact CD2-CD2 4.43Å; F590-Y605 AromaticContact CD2-CE1 3.9Å; F590-Y605 HydrophobicContact CD2-CE1 3.9Å; F590-Y605 AromaticContact CD2-CG 3.87Å; F590-Y605 HydrophobicContact CD2-CG 3.87Å; F590-Y605 HydrophobicContact CE2-CD1 4.31Å; F590-Y605 HydrophobicContact CE2-CG 4.44Å; F590-Y605 HydrophobicContact CG-CD1 4.17Å; F590-Y605 HydrophobicContact CG-CE1 4.12Å; F590-F606 HydrophobicContact CD1-CE2 4.21Å; F590-F606 AromaticContact CD1-CZ 3.96Å; F590-F606 HydrophobicContact CD1-CZ 3.96Å; F590-F606 HydrophobicContact CD2-CE2 4.31Å; F590-F606 HydrophobicContact CD2-CZ 4.43Å; F590-F606 HydrophobicContact CE1-CE2 4.1Å; F590-F606 HydrophobicContact CE1-CZ 4.28Å; F590-F606 HydrophobicContact CE2-CE2 4.2Å; F590-F606 HydrophobicContact CG-CE2 4.32Å; F590-F606 HydrophobicContact CG-CZ 4.05Å; F590-F606 HydrophobicContact CZ-CE2 4.1Å
591	V	92.4	Very high	90.6	Very high	103 Å²	103	58.5 Å²	58.5	62%	0.624	30%	0.297	S	S	*	.	H	α-helix	trans	-76.8	-33.9	-175.9	174.8	0	0	0	0	113.2	I587 F588 Y589	I587-V591 WeakPolarHBondContact O-CG2 3.48Å; I587-V591 PolarHBondContact O-N 3.08Å; I587-V591 VanDerWaalsContact O-N 3.1Å; F588-V591 PolarHBondContact O-N 2.79Å; Y589-V591 VanDerWaalsContact C-N 3.34Å; Y589-V591 PolarHBondContact O-N 3.42Å
592	N	91.4	Very high	90.4	Very high	96 Å²	96	57.5 Å²	57.5	51%	0.513	30%	0.296	S	S	.	.	H	α-helix	trans	-108.5	-15.4	-169.4	-64.4	-83.9	0	0	0	114.8	F588	F588-N592 WeakPolarHBondContact CD2-ND2 3.36Å; F588-N592 HydrophobicContact CE1-CB 4.46Å; F588-N592 HydrophobicContact CE2-CB 4.35Å; F588-N592 WeakPolarHBondContact CE2-ND2 3.3Å; F588-N592 HydrophobicContact CZ-CB 4.18Å; F588-N592 WeakPolarHBondContact O-CB 3.36Å; F588-N592 PolarHBondContact O-N 3.48Å; F588-N592 PolarHBondContact O-ND2 3.21Å
593	K	86.8	Confident	90.3	Very high	113 Å²	113	59.6 Å²	59.6	49%	0.491	31%	0.307	S	S	.	.	H	α-helix	trans	-122.9	-24.5	-175.4	-67.7	-66.1	-171.8	174.2	0	114.1	Y589	Y589-K593 HydrophobicContact CD1-CB 4.42Å; Y589-K593 HydrophobicContact CD2-CB 3.88Å; Y589-K593 HydrophobicContact CD2-CG 3.84Å; Y589-K593 HydrophobicContact CE1-CB 4.34Å; Y589-K593 HydrophobicContact CE2-CB 3.75Å; Y589-K593 HydrophobicContact CE2-CG 3.85Å; Y589-K593 HydrophobicContact CG-CB 4.2Å; Y589-K593 WeakPolarHBondContact O-CA 3.31Å; Y589-K593 WeakPolarHBondContact O-CB 3.39Å; Y589-K593 PolarHBondContact O-N 3.16Å
594	L	86.2	Confident	90.1	Very high	14 Å²	14	56.8 Å²	56.8	7%	0.073	29%	0.293	C	S	.	.			trans	-106.9	121.6	-176.2	-65.3	176.6	0	0	0	111.3	W526 Y589 F590 I596 Y605	W526-L594 HydrophobicContact CB-CD1 4.37Å; W526-L594 HydrophobicContact CB-CD2 3.85Å; W526-L594 HydrophobicContact CG-CD1 4.31Å; Y589-L594 HydrophobicContact CD1-CD1 3.77Å; Y589-L594 HydrophobicContact CD1-CG 3.91Å; Y589-L594 HydrophobicContact CE1-CD1 3.79Å; Y589-L594 HydrophobicContact CE1-CD2 3.88Å; Y589-L594 HydrophobicContact CE1-CG 3.7Å; Y589-L594 PolarHBondContact O-N 3.27Å; F590-L594 HydrophobicContact CD2-CD1 4.46Å; L594-I596 HydrophobicContact CB-CD1 4.04Å; L594-I596 HydrophobicContact CB-CG1 4.1Å; L594-I596 HydrophobicContact CD1-CD1 3.94Å; L594-I596 HydrophobicContact CG-CD1 4.47Å; L594-I596 PolarHBondContact O-N 3.05Å; L594-I596 VanDerWaalsContact O-N 3.12Å; L594-Y605 HydrophobicContact CD1-CD2 3.63Å; L594-Y605 HydrophobicContact CD1-CE2 3.34Å
595	D	84.3	Confident	90	Very high	121 Å²	121	53.4 Å²	53.4	65%	0.647	27%	0.272	S	S	*	.			trans	-87.4	45.4	175.4	-69.3	-40.1	0	0	0	112.2	V597	D595-V597 PolarHBondContact O-N 3.31Å
596	I	82.8	Confident	90	Very high	17 Å²	17	56.9 Å²	56.9	9%	0.087	29%	0.287	C	S	.	.			trans	-80.6	115.1	-179.8	-63.3	170.3	0	0	0	109.7	R51 Q53 F590 L594 P601	R51-I596 WeakPolarHBondContact O-CA 3.16Å; R51-I596 WeakPolarHBondContact O-CG1 3.4Å; Q53-I596 HydrophobicContact CG-CD1 3.87Å; Q53-I596 HydrophobicContact CG-CG1 4.3Å; F590-I596 HydrophobicContact CD2-CD1 4.35Å; F590-I596 HydrophobicContact CE2-CB 4.07Å; F590-I596 HydrophobicContact CE2-CD1 4.07Å; F590-I596 HydrophobicContact CE2-CG2 4.32Å; L594-I596 HydrophobicContact CB-CD1 4.04Å; L594-I596 HydrophobicContact CB-CG1 4.1Å; L594-I596 HydrophobicContact CD1-CD1 3.94Å; L594-I596 HydrophobicContact CG-CD1 4.47Å; L594-I596 PolarHBondContact O-N 3.05Å; L594-I596 VanDerWaalsContact O-N 3.12Å; I596-P601 HydrophobicContact CG2-CB 3.56Å
597	V	77.5	Confident	90	Very high	113 Å²	113	57.3 Å²	57.3	69%	0.685	29%	0.292	S	S	*	.			trans	-101.4	-23.4	-177.2	-65.6	0	0	0	0	114.1	D595	D595-V597 PolarHBondContact O-N 3.31Å
598	E	84.2	Confident	89.9	Confident	48 Å²	48	57.7 Å²	57.7	22%	0.224	29%	0.289	C	S	.	.	S	Bend	trans	-91.9	153.3	-174.1	-69.9	-156.1	151.9	0	0	113.7	K438 P601 S602	K438-E598 IonicContact NZ-OE1 2.69Å; K438-E598 PolarHBondContact NZ-OE1 2.81Å; K438-E598 IonicContact NZ-OE2 3.99Å; K438-E598 PolarHBondContact NZ-OE2 2.83Å; K438-E598 VanDerWaalsContact NZ-OE2 3.11Å; E598-P601 VanDerWaalsContact CB-CD 3.41Å; E598-P601 HydrophobicContact CB-CG 3.76Å; E598-S602 WeakPolarHBondContact O-CB 3.38Å; E598-S602 PolarHBondContact O-N 3.3Å; E598-S602 PolarHBondContact O-OG 2.91Å
599	F	89.5	Confident	89.9	Confident	147 Å²	147	52.6 Å²	52.6	65%	0.645	27%	0.267	S	S	*	.	H	α-helix	trans	-64.7	-46.8	178	174.4	-103	0	0	0	113.7	S602 L603	F599-S602 WeakPolarHBondContact O-CB 3.36Å; F599-S602 PolarHBondContact O-N 2.78Å; F599-L603 HydrophobicContact CE1-CD2 4.37Å; F599-L603 WeakPolarHBondContact O-CB 3.33Å; F599-L603 PolarHBondContact O-N 3.38Å
600	I	90.2	Very high	90.1	Very high	27 Å²	27	54.7 Å²	54.7	14%	0.138	28%	0.284	C	S	.	.	H	α-helix	trans	-65.8	-47.5	-175.2	-68.2	-179.4	0	0	0	111.7	L54 F434 K438 S602 L603 L604	L54-I600 HydrophobicContact CD1-CG2 4.28Å; F434-I600 HydrophobicContact CB-CG2 4.26Å; F434-I600 HydrophobicContact CD1-CD1 4.45Å; F434-I600 HydrophobicContact CD1-CG1 4.45Å; K438-I600 HydrophobicContact CD-CD1 4.15Å; K438-I600 HydrophobicContact CG-CD1 3.5Å; K438-I600 HydrophobicContact CG-CG2 4.41Å; I600-S602 VanDerWaalsContact C-N 3.31Å; I600-S602 PolarHBondContact O-N 3.04Å; I600-L603 WeakPolarHBondContact O-CB 3.46Å; I600-L603 PolarHBondContact O-N 3.44Å; I600-L603 VanDerWaalsContact O-N 3.13Å; I600-L604 HydrophobicContact CG2-CD1 4.31Å; I600-L604 WeakPolarHBondContact O-CG 3.49Å; I600-L604 PolarHBondContact O-N 2.99Å
601	P	89.9	Confident	90.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.3	-40.8	172.1	-31.6	43	0	0	0	113.6	T52 L54 I596 E598 L603 L604 Y605	T52-P601 WeakPolarHBondContact O-CB 3.22Å; T52-P601 WeakPolarHBondContact O-CG 3.25Å; L54-P601 HydrophobicContact CD1-CG 4.06Å; L54-P601 HydrophobicContact CG-CG 4.35Å; I596-P601 HydrophobicContact CG2-CB 3.56Å; E598-P601 VanDerWaalsContact CB-CD 3.41Å; E598-P601 HydrophobicContact CB-CG 3.76Å; P601-L603 VanDerWaalsContact C-N 3.34Å; P601-L603 PolarHBondContact O-N 2.03Å; P601-L604 PolarHBondContact O-N 2.91Å; P601-Y605 WeakPolarHBondContact O-CB 3.3Å; P601-Y605 PolarHBondContact O-N 2.62Å
602	S	92	Very high	90.4	Very high	24 Å²	24	51.4 Å²	51.4	17%	0.168	26%	0.264	C	S	.	.	H	α-helix	trans	-60.8	-44.4	174	-59	0	0	0	0	111.3	E598 F599 I600 L604 Y605 F606	E598-S602 WeakPolarHBondContact O-CB 3.38Å; E598-S602 PolarHBondContact O-N 3.3Å; E598-S602 PolarHBondContact O-OG 2.91Å; F599-S602 WeakPolarHBondContact O-CB 3.36Å; F599-S602 PolarHBondContact O-N 2.78Å; I600-S602 VanDerWaalsContact C-N 3.31Å; I600-S602 PolarHBondContact O-N 3.04Å; S602-L604 VanDerWaalsContact C-N 3.34Å; S602-L604 PolarHBondContact O-N 2.91Å; S602-Y605 WeakPolarHBondContact O-CB 3.49Å; S602-Y605 PolarHBondContact O-N 3.25Å; S602-F606 WeakPolarHBondContact O-CD2 3.42Å; S602-F606 PolarHBondContact O-N 2.93Å
603	L	93	Very high	90.6	Very high	50 Å²	50	47.8 Å²	47.8	26%	0.262	25%	0.245	S	C	.	.	H	α-helix	trans	-61.8	-40.9	176	-179.4	66.7	0	0	0	112	L431 F434 F599 I600 P601 G607	L431-L603 HydrophobicContact CD2-CG 4.01Å; F434-L603 HydrophobicContact CD1-CD2 4.15Å; F434-L603 HydrophobicContact CD2-CD2 3.43Å; F434-L603 VanDerWaalsContact CD2-CD2 3.43Å; F434-L603 HydrophobicContact CE1-CD2 4.2Å; F434-L603 HydrophobicContact CE2-CD2 3.5Å; F434-L603 VanDerWaalsContact CE2-CD2 3.5Å; F434-L603 HydrophobicContact CG-CD2 3.79Å; F434-L603 HydrophobicContact CZ-CD2 3.89Å; F599-L603 HydrophobicContact CE1-CD2 4.37Å; F599-L603 WeakPolarHBondContact O-CB 3.33Å; F599-L603 PolarHBondContact O-N 3.38Å; I600-L603 WeakPolarHBondContact O-CB 3.46Å; I600-L603 PolarHBondContact O-N 3.44Å; I600-L603 VanDerWaalsContact O-N 3.13Å; P601-L603 VanDerWaalsContact C-N 3.34Å; P601-L603 PolarHBondContact O-N 2.03Å; L603-G607 PolarHBondContact O-N 2.86Å
604	L	92.2	Very high	91.1	Very high	7 Å²	7	44.8 Å²	44.8	4%	0.037	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-46.4	175.2	-68.7	173.1	0	0	0	111.4	L54 L431 I435 I600 P601 S602 G607 Y608	L54-L604 HydrophobicContact CD2-CD1 3.48Å; L54-L604 VanDerWaalsContact CD2-CD1 3.48Å; L54-L604 HydrophobicContact CG-CD1 4.22Å; L431-L604 HydrophobicContact CB-CD2 3.96Å; L431-L604 HydrophobicContact CD1-CD2 4.5Å; L431-L604 HydrophobicContact CD2-CD2 4.18Å; L431-L604 HydrophobicContact CG-CD2 4.42Å; I435-L604 HydrophobicContact CD1-CD2 3.63Å; I435-L604 HydrophobicContact CG1-CD1 4.03Å; I435-L604 HydrophobicContact CG1-CD2 3.56Å; I435-L604 HydrophobicContact CG1-CG 4.4Å; I600-L604 HydrophobicContact CG2-CD1 4.31Å; I600-L604 WeakPolarHBondContact O-CG 3.49Å; I600-L604 PolarHBondContact O-N 2.99Å; P601-L604 PolarHBondContact O-N 2.91Å; S602-L604 VanDerWaalsContact C-N 3.34Å; S602-L604 PolarHBondContact O-N 2.91Å; L604-G607 PolarHBondContact O-N 2.84Å; L604-Y608 HydrophobicContact CB-CD2 4.37Å; L604-Y608 HydrophobicContact CB-CE2 4.26Å; L604-Y608 HydrophobicContact CD2-CE2 4.07Å; L604-Y608 WeakPolarHBondContact O-CD2 3.47Å; L604-Y608 PolarHBondContact O-N 3.21Å
605	Y	93.2	Very high	91.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-55.1	-55.1	176.2	179.1	-90.8	0	0	0	111.5	F522 W526 A586 F590 L594 P601 S602 G607 T609	F522-Y605 WeakPolarHBondContact CE1-OH 3.36Å; W526-Y605 AromaticContact CD1-CE2 3.9Å; W526-Y605 AromaticContact CD2-CD2 3.72Å; W526-Y605 HydrophobicContact CD2-CD2 3.72Å; W526-Y605 AromaticContact CD2-CE2 3.92Å; W526-Y605 HydrophobicContact CD2-CE2 3.92Å; W526-Y605 AromaticContact CE2-CD2 3.41Å; W526-Y605 VanDerWaalsContact CE2-CD2 3.41Å; W526-Y605 AromaticContact CE2-CE2 3.45Å; W526-Y605 VanDerWaalsContact CE2-CE2 3.45Å; W526-Y605 HydrophobicContact CE3-CD2 4Å; W526-Y605 HydrophobicContact CG-CD2 4.4Å; W526-Y605 HydrophobicContact CG-CE2 4.19Å; W526-Y605 AromaticContact CH2-CD2 3.78Å; W526-Y605 HydrophobicContact CH2-CD2 3.78Å; W526-Y605 HydrophobicContact CH2-CG 4.37Å; W526-Y605 AromaticContact CZ2-CD2 3.45Å; W526-Y605 HydrophobicContact CZ2-CD2 3.45Å; W526-Y605 VanDerWaalsContact CZ2-CD2 3.45Å; W526-Y605 AromaticContact CZ2-CE2 3.83Å; W526-Y605 HydrophobicContact CZ2-CE2 3.83Å; W526-Y605 HydrophobicContact CZ2-CG 4.27Å; W526-Y605 HydrophobicContact CZ3-CD2 4.03Å; W526-Y605 AromaticContact NE1-CD2 3.92Å; W526-Y605 AromaticContact NE1-CE2 3.43Å; A586-Y605 WeakPolarHBondContact CA-OH 3.36Å; A586-Y605 PolarHBondContact O-OH 3.19Å; F590-Y605 HydrophobicContact CB-CD1 4.22Å; F590-Y605 HydrophobicContact CB-CE1 3.66Å; F590-Y605 AromaticContact CD2-CD1 3.56Å; F590-Y605 HydrophobicContact CD2-CD1 3.56Å; F590-Y605 HydrophobicContact CD2-CD2 4.43Å; F590-Y605 AromaticContact CD2-CE1 3.9Å; F590-Y605 HydrophobicContact CD2-CE1 3.9Å; F590-Y605 AromaticContact CD2-CG 3.87Å; F590-Y605 HydrophobicContact CD2-CG 3.87Å; F590-Y605 HydrophobicContact CE2-CD1 4.31Å; F590-Y605 HydrophobicContact CE2-CG 4.44Å; F590-Y605 HydrophobicContact CG-CD1 4.17Å; F590-Y605 HydrophobicContact CG-CE1 4.12Å; L594-Y605 HydrophobicContact CD1-CD2 3.63Å; L594-Y605 HydrophobicContact CD1-CE2 3.34Å; P601-Y605 WeakPolarHBondContact O-CB 3.3Å; P601-Y605 PolarHBondContact O-N 2.62Å; S602-Y605 WeakPolarHBondContact O-CB 3.49Å; S602-Y605 PolarHBondContact O-N 3.25Å; Y605-G607 VanDerWaalsContact C-N 3.34Å; Y605-G607 PolarHBondContact O-N 2.65Å; Y605-T609 WeakPolarHBondContact O-CB 3.37Å; Y605-T609 PolarHBondContact O-N 2.92Å; Y605-T609 PolarHBondContact O-OG1 3.29Å
606	F	94.7	Very high	92.2	Very high	86 Å²	86	40.9 Å²	40.9	38%	0.377	21%	0.214	S	C	.	.	H	α-helix	trans	-68	-33.8	-178.7	-75.9	-66.8	0	0	0	112.6	I587 F590 S602 A610	I587-F606 HydrophobicContact CG1-CE1 4.23Å; F590-F606 HydrophobicContact CD1-CE2 4.21Å; F590-F606 AromaticContact CD1-CZ 3.96Å; F590-F606 HydrophobicContact CD1-CZ 3.96Å; F590-F606 HydrophobicContact CD2-CE2 4.31Å; F590-F606 HydrophobicContact CD2-CZ 4.43Å; F590-F606 HydrophobicContact CE1-CE2 4.1Å; F590-F606 HydrophobicContact CE1-CZ 4.28Å; F590-F606 HydrophobicContact CE2-CE2 4.2Å; F590-F606 HydrophobicContact CG-CE2 4.32Å; F590-F606 HydrophobicContact CG-CZ 4.05Å; F590-F606 HydrophobicContact CZ-CE2 4.1Å; S602-F606 WeakPolarHBondContact O-CD2 3.42Å; S602-F606 PolarHBondContact O-N 2.93Å; F606-A610 VanDerWaalsContact O-CB 3.27Å; F606-A610 WeakPolarHBondContact O-CB 3.33Å; F606-A610 PolarHBondContact O-N 2.79Å
607	G	95.1	Very high	92.9	Very high	11 Å²	11	42.9 Å²	42.9	11%	0.113	22%	0.221	C	C	.	.	H	α-helix	trans	-66	-50.8	176.9	0	0	0	0	0	112.9	L603 L604 Y605 A610 L611	L603-G607 PolarHBondContact O-N 2.86Å; L604-G607 PolarHBondContact O-N 2.84Å; Y605-G607 VanDerWaalsContact C-N 3.34Å; Y605-G607 PolarHBondContact O-N 2.65Å; G607-A610 PolarHBondContact O-N 3.34Å; G607-L611 PolarHBondContact O-N 3Å
608	Y	93.3	Very high	93.8	Very high	88 Å²	88	37.6 Å²	37.6	35%	0.345	19%	0.189	S	C	.	.	H	α-helix	trans	-67.2	-37.2	175.6	-67.8	-52.9	0	0	0	112	L431 W526 L604 A610 L611 M612	L431-Y608 HydrophobicContact CD1-CD1 4.09Å; L431-Y608 HydrophobicContact CD1-CE1 3.98Å; L431-Y608 HydrophobicContact CD1-CE2 4.47Å; L431-Y608 HydrophobicContact CD1-CG 4.38Å; W526-Y608 HydrophobicContact CH2-CD2 4.15Å; L604-Y608 HydrophobicContact CB-CD2 4.37Å; L604-Y608 HydrophobicContact CB-CE2 4.26Å; L604-Y608 HydrophobicContact CD2-CE2 4.07Å; L604-Y608 WeakPolarHBondContact O-CD2 3.47Å; L604-Y608 PolarHBondContact O-N 3.21Å; Y608-A610 PolarHBondContact O-N 3.36Å; Y608-L611 HydrophobicContact CD1-CD1 4.44Å; Y608-L611 WeakPolarHBondContact O-CB 3.18Å; Y608-L611 PolarHBondContact O-N 2.81Å; Y608-M612 WeakPolarHBondContact O-CG 3.12Å; Y608-M612 PolarHBondContact O-N 3.05Å
609	T	94.5	Very high	94.4	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-61.9	-42.3	173.8	-63.8	0	0	0	0	112	A586 Y605 L611 M612 V613	A586-T609 HydrophobicContact CB-CG2 3.39Å; Y605-T609 WeakPolarHBondContact O-CB 3.37Å; Y605-T609 PolarHBondContact O-N 2.92Å; Y605-T609 PolarHBondContact O-OG1 3.29Å; T609-L611 VanDerWaalsContact C-N 3.28Å; T609-L611 PolarHBondContact O-N 3.48Å; T609-M612 PolarHBondContact O-N 3.01Å; T609-V613 HydrophobicContact CG2-CG2 4.22Å; T609-V613 WeakPolarHBondContact O-CB 3.1Å; T609-V613 VanDerWaalsContact O-CG2 3.31Å; T609-V613 WeakPolarHBondContact O-CG2 3.36Å; T609-V613 PolarHBondContact O-N 3.21Å
610	A	96.3	Very high	94.8	Very high	45 Å²	45	28.7 Å²	28.7	37%	0.372	15%	0.149	S	C	.	.	H	α-helix	trans	-60.4	-39.5	175.6	0	0	0	0	0	111.8	F606 G607 Y608 L614	F606-A610 VanDerWaalsContact O-CB 3.27Å; F606-A610 WeakPolarHBondContact O-CB 3.33Å; F606-A610 PolarHBondContact O-N 2.79Å; G607-A610 PolarHBondContact O-N 3.34Å; Y608-A610 PolarHBondContact O-N 3.36Å; A610-L614 VanDerWaalsContact O-CB 3.22Å; A610-L614 WeakPolarHBondContact O-CB 3.34Å; A610-L614 PolarHBondContact O-N 3.04Å
611	L	96.2	Very high	95.1	Very high	16 Å²	16	27.4 Å²	27.4	8%	0.084	14%	0.143	C	C	.	.	H	α-helix	trans	-65.5	-43.5	173.8	-68.9	176.1	0	0	0	112.3	V424 I427 G607 Y608 T609 L614 S615	V424-L611 HydrophobicContact CB-CD2 4.38Å; V424-L611 HydrophobicContact CG2-CD2 4.14Å; I427-L611 HydrophobicContact CB-CD1 4.31Å; I427-L611 HydrophobicContact CB-CD2 4.05Å; I427-L611 HydrophobicContact CB-CG 4.3Å; I427-L611 HydrophobicContact CD1-CD2 3.59Å; I427-L611 HydrophobicContact CD1-CG 4.2Å; I427-L611 HydrophobicContact CG1-CD2 4.37Å; I427-L611 HydrophobicContact CG2-CD1 3.9Å; I427-L611 HydrophobicContact CG2-CD2 4.24Å; I427-L611 HydrophobicContact CG2-CG 3.94Å; G607-L611 PolarHBondContact O-N 3Å; Y608-L611 HydrophobicContact CD1-CD1 4.44Å; Y608-L611 WeakPolarHBondContact O-CB 3.18Å; Y608-L611 PolarHBondContact O-N 2.81Å; T609-L611 VanDerWaalsContact C-N 3.28Å; T609-L611 PolarHBondContact O-N 3.48Å; L611-L614 PolarHBondContact O-N 3.36Å; L611-S615 VanDerWaalsContact O-CB 3.31Å; L611-S615 WeakPolarHBondContact O-CB 3.41Å; L611-S615 PolarHBondContact O-N 3.2Å; L611-S615 PolarHBondContact O-OG 2.87Å
612	M	94.8	Very high	95.5	Very high	55 Å²	55	27.5 Å²	27.5	27%	0.271	14%	0.143	S	C	.	.	H	α-helix	trans	-59.8	-49.6	175.7	-71.2	-170.2	-69	0	0	111.2	F522 I525 W526 Y608 T609 S615 F616	F522-M612 HydrophobicContact CZ-CE 4.09Å; I525-M612 HydrophobicContact CD1-SD 4.16Å; W526-M612 HydrophobicContact CZ2-CE 4.4Å; Y608-M612 WeakPolarHBondContact O-CG 3.12Å; Y608-M612 PolarHBondContact O-N 3.05Å; T609-M612 PolarHBondContact O-N 3.01Å; M612-S615 PolarHBondContact O-N 2.86Å; M612-F616 WeakPolarHBondContact O-CB 2.88Å; M612-F616 PolarHBondContact O-N 2.76Å
613	V	96.9	Very high	95.7	Very high	20 Å²	20	27.1 Å²	27.1	12%	0.121	14%	0.139	C	C	.	.	H	α-helix	trans	-62.4	-44.1	179.1	170.6	0	0	0	0	111.4	A579 V582 L583 T609 F616 W617	A579-V613 HydrophobicContact CB-CG1 4.08Å; V582-V613 HydrophobicContact CB-CG2 4.47Å; V582-V613 HydrophobicContact CG1-CG2 4.02Å; L583-V613 HydrophobicContact CB-CG1 4.2Å; L583-V613 HydrophobicContact CB-CG2 4.01Å; L583-V613 HydrophobicContact CD1-CG2 4.27Å; T609-V613 HydrophobicContact CG2-CG2 4.22Å; T609-V613 WeakPolarHBondContact O-CB 3.1Å; T609-V613 VanDerWaalsContact O-CG2 3.31Å; T609-V613 WeakPolarHBondContact O-CG2 3.36Å; T609-V613 PolarHBondContact O-N 3.21Å; V613-F616 PolarHBondContact O-N 2.82Å; V613-W617 WeakPolarHBondContact O-CB 3.32Å; V613-W617 PolarHBondContact O-N 2.98Å
614	L	96.9	Very high	95.9	Very high	50 Å²	50	24.7 Å²	24.7	26%	0.262	13%	0.127	S	C	.	.	H	α-helix	trans	-63	-45.8	177.7	178.3	65.5	0	0	0	111.8	V423 A610 L611 F616 W617 L618	V423-L614 HydrophobicContact CB-CD2 4.41Å; V423-L614 HydrophobicContact CG1-CD2 3.57Å; A610-L614 VanDerWaalsContact O-CB 3.22Å; A610-L614 WeakPolarHBondContact O-CB 3.34Å; A610-L614 PolarHBondContact O-N 3.04Å; L611-L614 PolarHBondContact O-N 3.36Å; L614-F616 VanDerWaalsContact C-N 3.31Å; L614-F616 PolarHBondContact O-N 3.36Å; L614-W617 HydrophobicContact CD1-CE3 4.01Å; L614-W617 HydrophobicContact CD1-CZ3 4.32Å; L614-W617 PolarHBondContact O-N 3.05Å; L614-L618 WeakPolarHBondContact O-CG 3.4Å; L614-L618 PolarHBondContact O-N 2.69Å
615	S	96.6	Very high	96.1	Very high	26 Å²	26	24.4 Å²	24.4	18%	0.182	13%	0.125	C	C	.	.	H	α-helix	trans	-62.9	-42.2	178.4	-54.6	0	0	0	0	110.8	Y420 L611 M612 L618 L619	Y420-S615 PolarHBondContact OH-OG 3.36Å; L611-S615 VanDerWaalsContact O-CB 3.31Å; L611-S615 WeakPolarHBondContact O-CB 3.41Å; L611-S615 PolarHBondContact O-N 3.2Å; L611-S615 PolarHBondContact O-OG 2.87Å; M612-S615 PolarHBondContact O-N 2.86Å; S615-L618 PolarHBondContact O-N 3.25Å; S615-L619 VanDerWaalsContact O-CB 3.31Å; S615-L619 WeakPolarHBondContact O-CB 3.18Å; S615-L619 PolarHBondContact O-N 3.1Å
616	F	96.2	Very high	96.3	Very high	27 Å²	27	26 Å²	26	12%	0.118	13%	0.131	C	C	.	.	H	α-helix	trans	-66.6	-40.3	177.8	-170.8	-101.5	0	0	0	112.2	M514 L544 S578 A579 V582 M612 V613 L614 L619 T620	M514-F616 HydrophobicContact CE-CD2 4.49Å; M514-F616 HydrophobicContact CE-CE2 3.7Å; M514-F616 HydrophobicContact CE-CZ 3.84Å; M514-F616 HydrophobicContact SD-CE1 4.05Å; M514-F616 HydrophobicContact SD-CE2 3.57Å; M514-F616 VanDerWaalsContact SD-CE2 3.57Å; M514-F616 HydrophobicContact SD-CZ 3.15Å; M514-F616 WeakPolarHBondContact SD-CZ 3.24Å; L544-F616 HydrophobicContact CD1-CE2 4.44Å; L544-F616 HydrophobicContact CD1-CZ 4.01Å; L544-F616 HydrophobicContact CD2-CE2 3.67Å; L544-F616 HydrophobicContact CD2-CZ 4.08Å; S578-F616 VanDerWaalsContact OG-CE1 3.26Å; S578-F616 WeakPolarHBondContact OG-CE1 3.46Å; A579-F616 HydrophobicContact CB-CD1 3.91Å; V582-F616 HydrophobicContact CG2-CD1 3.89Å; V582-F616 HydrophobicContact CG2-CE1 3.8Å; V582-F616 HydrophobicContact CG2-CZ 4.49Å; M612-F616 WeakPolarHBondContact O-CB 2.88Å; M612-F616 PolarHBondContact O-N 2.76Å; V613-F616 PolarHBondContact O-N 2.82Å; L614-F616 VanDerWaalsContact C-N 3.31Å; L614-F616 PolarHBondContact O-N 3.36Å; F616-L619 PolarHBondContact O-N 3.31Å; F616-T620 HydrophobicContact CD1-CG2 4.18Å; F616-T620 HydrophobicContact CD2-CG2 4.33Å; F616-T620 HydrophobicContact CE1-CG2 3.71Å; F616-T620 HydrophobicContact CE2-CG2 3.86Å; F616-T620 HydrophobicContact CG-CG2 4.45Å; F616-T620 HydrophobicContact CZ-CG2 3.49Å; F616-T620 VanDerWaalsContact CZ-CG2 3.49Å; F616-T620 WeakPolarHBondContact O-CB 3.08Å; F616-T620 WeakPolarHBondContact O-CG2 3.32Å; F616-T620 PolarHBondContact O-N 3.49Å; F616-T620 PolarHBondContact O-OG1 2.84Å
617	W	97.2	Very high	96.4	Very high	58 Å²	58	22.3 Å²	22.3	22%	0.22	12%	0.117	C	C	.	.	H	α-helix	trans	-61.7	-45.3	173.2	174.7	78.6	0	0	0	112.1	L347 F572 L573 A579 V613 L614 T620 G621	L347-W617 HydrophobicContact CD1-CH2 4.39Å; F572-W617 HydrophobicContact CD1-CH2 4.44Å; F572-W617 HydrophobicContact CD1-CZ2 4.13Å; F572-W617 AromaticContact CE1-CH2 3.4Å; F572-W617 HydrophobicContact CE1-CH2 3.4Å; F572-W617 AromaticContact CE1-CZ2 3.43Å; F572-W617 HydrophobicContact CE1-CZ2 3.43Å; F572-W617 VanDerWaalsContact CE1-CZ2 3.43Å; F572-W617 HydrophobicContact CE1-CZ3 4.08Å; F572-W617 AromaticContact CZ-CH2 3.92Å; F572-W617 HydrophobicContact CZ-CH2 3.92Å; F572-W617 HydrophobicContact CZ-CZ2 4.11Å; F572-W617 HydrophobicContact CZ-CZ3 4.14Å; L573-W617 HydrophobicContact CD2-CZ2 3.72Å; A579-W617 HydrophobicContact CB-CB 3.58Å; A579-W617 HydrophobicContact CB-CG 4.41Å; V613-W617 WeakPolarHBondContact O-CB 3.32Å; V613-W617 PolarHBondContact O-N 2.98Å; L614-W617 HydrophobicContact CD1-CE3 4.01Å; L614-W617 HydrophobicContact CD1-CZ3 4.32Å; L614-W617 PolarHBondContact O-N 3.05Å; W617-T620 PolarHBondContact O-OG1 2.02Å; W617-G621 WeakPolarHBondContact O-CA 3.26Å; W617-G621 PolarHBondContact O-N 3.28Å
618	L	97.3	Very high	96.4	Very high	3 Å²	3	21.8 Å²	21.8	2%	0.016	11%	0.111	C	C	.	.	H	α-helix	trans	-62.3	-44.9	176.2	-73.6	175.7	0	0	0	111.8	L347 L354 Y420 F572 L614 S615 T622	L347-L618 HydrophobicContact CB-CD2 4.13Å; L347-L618 HydrophobicContact CD2-CD2 3.74Å; L347-L618 HydrophobicContact CG-CD2 4.48Å; L354-L618 HydrophobicContact CD1-CB 4.06Å; L354-L618 HydrophobicContact CD1-CD1 4.18Å; Y420-L618 HydrophobicContact CD2-CD1 3.21Å; Y420-L618 HydrophobicContact CE2-CD1 3.66Å; Y420-L618 HydrophobicContact CG-CD1 3.88Å; F572-L618 HydrophobicContact CZ-CD2 4.1Å; L614-L618 WeakPolarHBondContact O-CG 3.4Å; L614-L618 PolarHBondContact O-N 2.69Å; S615-L618 PolarHBondContact O-N 3.25Å; L618-T622 WeakPolarHBondContact O-CB 3.39Å; L618-T622 PolarHBondContact O-N 3.13Å; L618-T622 PolarHBondContact O-OG1 2.81Å
619	L	97.1	Very high	96.5	Very high	7 Å²	7	17.8 Å²	17.8	4%	0.037	10%	0.096	C	C	.	.	H	α-helix	trans	-61.3	-58.4	179	176.4	69.5	0	0	0	111.3	F355 I358 F541 S615 F616 T622 I623	F355-L619 HydrophobicContact CB-CD1 3.79Å; F355-L619 HydrophobicContact CD2-CD1 3.98Å; F355-L619 HydrophobicContact CG-CD1 4.4Å; I358-L619 HydrophobicContact CD1-CD1 4.33Å; I358-L619 HydrophobicContact CD1-CD2 3.82Å; F541-L619 HydrophobicContact CE2-CD2 4.23Å; S615-L619 VanDerWaalsContact O-CB 3.31Å; S615-L619 WeakPolarHBondContact O-CB 3.18Å; S615-L619 PolarHBondContact O-N 3.1Å; F616-L619 PolarHBondContact O-N 3.31Å; L619-T622 PolarHBondContact O-N 3.22Å; L619-I623 HydrophobicContact CD1-CD1 4.04Å; L619-I623 HydrophobicContact CG-CD1 3.95Å; L619-I623 VanDerWaalsContact O-CG1 3.31Å; L619-I623 WeakPolarHBondContact O-CG1 3.36Å; L619-I623 PolarHBondContact O-N 3.29Å
620	T	96.8	Very high	96.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67.2	-38.5	-176.5	52.8	0	0	0	0	112.2	L544 S575 G576 F616 W617 T622 G624	L544-T620 HydrophobicContact CD1-CG2 4.31Å; L544-T620 HydrophobicContact CD2-CG2 4.36Å; S575-T620 WeakPolarHBondContact O-CB 3.42Å; S575-T620 PolarHBondContact OG-O 2.98Å; G576-T620 WeakPolarHBondContact CA-OG1 3.34Å; F616-T620 HydrophobicContact CD1-CG2 4.18Å; F616-T620 HydrophobicContact CD2-CG2 4.33Å; F616-T620 HydrophobicContact CE1-CG2 3.71Å; F616-T620 HydrophobicContact CE2-CG2 3.86Å; F616-T620 HydrophobicContact CG-CG2 4.45Å; F616-T620 HydrophobicContact CZ-CG2 3.49Å; F616-T620 VanDerWaalsContact CZ-CG2 3.49Å; F616-T620 WeakPolarHBondContact O-CB 3.08Å; F616-T620 WeakPolarHBondContact O-CG2 3.32Å; F616-T620 PolarHBondContact O-N 3.49Å; F616-T620 PolarHBondContact O-OG1 2.84Å; W617-T620 PolarHBondContact O-OG1 2.02Å; T620-T622 VanDerWaalsContact C-N 3.33Å; T620-T622 PolarHBondContact O-N 3.4Å; T620-G624 PolarHBondContact O-N 3.41Å; T620-G624 VanDerWaalsContact O-N 3.12Å
621	G	97	Very high	96.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.2	-41.5	172.3	0	0	0	0	0	112.4	F572 W617 F625	F572-G621 VanDerWaalsContact CD2-C 3.44Å; F572-G621 WeakPolarHBondContact CD2-O 3.32Å; F572-G621 WeakPolarHBondContact O-CA 3.3Å; W617-G621 WeakPolarHBondContact O-CA 3.26Å; W617-G621 PolarHBondContact O-N 3.28Å; G621-F625 VanDerWaalsContact O-CB 3.26Å; G621-F625 WeakPolarHBondContact O-CB 3.42Å; G621-F625 PolarHBondContact O-N 2.84Å
622	T	97.8	Very high	96.2	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.012	11%	0.106	C	C	.	.	H	α-helix	trans	-72.2	-43.5	-179.6	-60.4	0	0	0	0	112.5	L348 G351 I352 L618 L619 T620 G624 F625 Y626	L348-T622 HydrophobicContact CD2-CG2 4.05Å; G351-T622 WeakPolarHBondContact CA-OG1 3.26Å; I352-T622 HydrophobicContact CD1-CG2 3.87Å; I352-T622 HydrophobicContact CG1-CG2 3.9Å; L618-T622 WeakPolarHBondContact O-CB 3.39Å; L618-T622 PolarHBondContact O-N 3.13Å; L618-T622 PolarHBondContact O-OG1 2.81Å; L619-T622 PolarHBondContact O-N 3.22Å; T620-T622 VanDerWaalsContact C-N 3.33Å; T620-T622 PolarHBondContact O-N 3.4Å; T622-G624 VanDerWaalsContact C-N 3.34Å; T622-G624 PolarHBondContact O-N 2.8Å; T622-F625 PolarHBondContact O-N 3.01Å; T622-Y626 HydrophobicContact CG2-CD2 3.73Å; T622-Y626 HydrophobicContact CG2-CE2 3.76Å; T622-Y626 WeakPolarHBondContact O-CD2 2.89Å; T622-Y626 PolarHBondContact O-N 2.98Å
623	I	97.2	Very high	96.1	Very high	16 Å²	16	22.2 Å²	22.2	8%	0.082	11%	0.105	C	C	.	.	H	α-helix	trans	-55.3	-52.5	175.2	-69	160.6	0	0	0	109.8	F355 V545 C548 L619 F625 Y626 A627	F355-I623 HydrophobicContact CD2-CD1 4.02Å; F355-I623 HydrophobicContact CD2-CG1 3.91Å; F355-I623 HydrophobicContact CE2-CD1 4.29Å; F355-I623 HydrophobicContact CE2-CG1 4.22Å; V545-I623 HydrophobicContact CG1-CG2 4.08Å; V545-I623 HydrophobicContact CG2-CD1 3.92Å; C548-I623 HydrophobicContact CB-CB 4.43Å; C548-I623 HydrophobicContact CB-CG2 3.94Å; L619-I623 HydrophobicContact CD1-CD1 4.04Å; L619-I623 HydrophobicContact CG-CD1 3.95Å; L619-I623 VanDerWaalsContact O-CG1 3.31Å; L619-I623 WeakPolarHBondContact O-CG1 3.36Å; L619-I623 PolarHBondContact O-N 3.29Å; I623-F625 PolarHBondContact O-N 3.35Å; I623-Y626 PolarHBondContact O-N 3.44Å; I623-A627 PolarHBondContact O-N 3.38Å; I623-A627 VanDerWaalsContact O-N 3.1Å
624	G	96.3	Very high	95.7	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.7	-42.8	178.9	0	0	0	0	0	112.7	S552 N571 S575 T620 T622 Y626 A627 A628	S552-G624 WeakPolarHBondContact OG-CA 3.45Å; S552-G624 PolarHBondContact OG-O 2.92Å; N571-G624 PolarHBondContact ND2-O 3.11Å; S575-G624 WeakPolarHBondContact OG-CA 3.13Å; S575-G624 PolarHBondContact OG-N 2.9Å; T620-G624 PolarHBondContact O-N 3.41Å; T620-G624 VanDerWaalsContact O-N 3.12Å; T622-G624 VanDerWaalsContact C-N 3.34Å; T622-G624 PolarHBondContact O-N 2.8Å; G624-Y626 PolarHBondContact O-N 3.41Å; G624-A627 PolarHBondContact O-N 2.61Å; G624-A628 WeakPolarHBondContact O-CB 3.44Å; G624-A628 PolarHBondContact O-N 3.46Å
625	F	97.4	Very high	95.4	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-55.5	-49.1	178.4	177.7	-86.4	0	0	0	112.4	L344 L348 L400 W567 W568 F572 G621 T622 I623 A628 Y629	L344-F625 HydrophobicContact CD2-CE2 4.19Å; L348-F625 HydrophobicContact CD1-CD1 3.47Å; L348-F625 VanDerWaalsContact CD1-CD1 3.47Å; L348-F625 HydrophobicContact CD1-CD2 4.02Å; L348-F625 HydrophobicContact CD1-CE1 3.32Å; L348-F625 HydrophobicContact CD1-CE2 3.85Å; L348-F625 HydrophobicContact CD1-CG 3.82Å; L348-F625 HydrophobicContact CD1-CZ 3.49Å; L348-F625 VanDerWaalsContact CD1-CZ 3.49Å; L348-F625 HydrophobicContact CD2-CB 3.61Å; L348-F625 HydrophobicContact CD2-CD1 3.63Å; L348-F625 HydrophobicContact CD2-CD2 4.22Å; L348-F625 HydrophobicContact CD2-CE1 4.36Å; L348-F625 HydrophobicContact CD2-CG 3.54Å; L348-F625 HydrophobicContact CG-CD1 4.19Å; L348-F625 HydrophobicContact CG-CE1 4.46Å; L348-F625 HydrophobicContact CG-CG 4.35Å; L400-F625 HydrophobicContact CD2-CE1 3.87Å; L400-F625 HydrophobicContact CD2-CZ 4.09Å; W567-F625 HydrophobicContact CH2-CE2 4.43Å; W567-F625 HydrophobicContact CZ3-CD2 4.39Å; W567-F625 HydrophobicContact CZ3-CE2 4.17Å; W568-F625 AromaticContact CE3-CE2 3.66Å; W568-F625 HydrophobicContact CE3-CE2 3.66Å; W568-F625 AromaticContact CE3-CZ 3.47Å; W568-F625 HydrophobicContact CE3-CZ 3.47Å; W568-F625 VanDerWaalsContact CE3-CZ 3.47Å; W568-F625 HydrophobicContact CZ3-CE2 4.32Å; W568-F625 AromaticContact CZ3-CZ 3.69Å; W568-F625 HydrophobicContact CZ3-CZ 3.69Å; F572-F625 HydrophobicContact CB-CD2 4.25Å; F572-F625 HydrophobicContact CD2-CB 4.44Å; G621-F625 VanDerWaalsContact O-CB 3.26Å; G621-F625 WeakPolarHBondContact O-CB 3.42Å; G621-F625 PolarHBondContact O-N 2.84Å; T622-F625 PolarHBondContact O-N 3.01Å; I623-F625 PolarHBondContact O-N 3.35Å; F625-A628 PolarHBondContact O-N 2.76Å; F625-Y629 VanDerWaalsContact O-CB 3.27Å; F625-Y629 WeakPolarHBondContact O-CB 3.48Å; F625-Y629 PolarHBondContact O-N 3.22Å
626	Y	96.9	Very high	95	Very high	34 Å²	34	25.9 Å²	25.9	13%	0.133	12%	0.115	C	C	.	.	H	α-helix	trans	-68.4	-35.7	179.6	-82.3	-76.4	0	0	0	112.3	L348 I352 T622 I623 G624 Y629 M630	L348-Y626 HydrophobicContact CB-CE2 4.45Å; I352-Y626 HydrophobicContact CD1-CD2 3.79Å; I352-Y626 HydrophobicContact CD1-CE2 3.57Å; I352-Y626 HydrophobicContact CG1-CD2 4.29Å; I352-Y626 HydrophobicContact CG1-CE2 3.57Å; T622-Y626 HydrophobicContact CG2-CD2 3.73Å; T622-Y626 HydrophobicContact CG2-CE2 3.76Å; T622-Y626 WeakPolarHBondContact O-CD2 2.89Å; T622-Y626 PolarHBondContact O-N 2.98Å; I623-Y626 PolarHBondContact O-N 3.44Å; G624-Y626 PolarHBondContact O-N 3.41Å; Y626-Y629 PolarHBondContact O-N 3.16Å; Y626-M630 WeakPolarHBondContact O-CB 3.11Å; Y626-M630 WeakPolarHBondContact O-CE 3.33Å; Y626-M630 WeakPolarHBondContact O-CG 3.41Å; Y626-M630 PolarHBondContact O-N 3.4Å
627	A	95.7	Very high	94.6	Very high	9 Å²	9	27.9 Å²	27.9	7%	0.074	14%	0.136	C	C	.	.	H	α-helix	trans	-61.2	-48.9	173.3	0	0	0	0	0	112.1	I553 I623 G624 M630 F631	I553-A627 HydrophobicContact CD1-CB 4.44Å; I553-A627 HydrophobicContact CG1-CB 4.41Å; I623-A627 PolarHBondContact O-N 3.38Å; I623-A627 VanDerWaalsContact O-N 3.1Å; G624-A627 PolarHBondContact O-N 2.61Å; A627-M630 PolarHBondContact O-N 3.46Å; A627-F631 WeakPolarHBondContact O-CB 3.41Å; A627-F631 PolarHBondContact O-N 2.68Å
628	A	95.5	Very high	94	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.4	-42.8	175.7	0	0	0	0	0	111.7	S552 V556 W567 N571 G624 F625 M630 F631 V632	S552-A628 WeakPolarHBondContact OG-CB 3.4Å; V556-A628 HydrophobicContact CB-CB 4.19Å; V556-A628 HydrophobicContact CG1-CB 3.81Å; W567-A628 HydrophobicContact CE3-CB 4.42Å; W567-A628 HydrophobicContact CZ3-CB 4.2Å; N571-A628 WeakPolarHBondContact ND2-CB 3.23Å; G624-A628 WeakPolarHBondContact O-CB 3.44Å; G624-A628 PolarHBondContact O-N 3.46Å; F625-A628 PolarHBondContact O-N 2.76Å; A628-M630 VanDerWaalsContact C-N 3.34Å; A628-M630 PolarHBondContact O-N 2.7Å; A628-F631 WeakPolarHBondContact O-CB 3.16Å; A628-F631 PolarHBondContact O-N 3.32Å; A628-V632 WeakPolarHBondContact O-CB 3.47Å; A628-V632 VanDerWaalsContact O-CG2 3.26Å; A628-V632 WeakPolarHBondContact O-CG2 3.39Å; A628-V632 PolarHBondContact O-N 3.2Å
629	Y	95.5	Very high	93.1	Very high	4 Å²	4	28 Å²	28	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-42.2	179.5	-178.1	-125.5	0	0	0	112.3	F335 Y477 W567 W568 F625 Y626 R633	F335-Y629 HydrophobicContact CE1-CE2 4.46Å; Y477-Y629 WeakPolarHBondContact CB-OH 3.29Å; Y477-Y629 AromaticContact CD2-CE1 3.98Å; Y477-Y629 HydrophobicContact CD2-CE1 3.98Å; Y477-Y629 HydrophobicContact CE2-CE1 4.41Å; Y477-Y629 HydrophobicContact CG-CE1 4.06Å; W567-Y629 AromaticContact CH2-CD2 3.58Å; W567-Y629 HydrophobicContact CH2-CD2 3.58Å; W567-Y629 HydrophobicContact CH2-CG 4.15Å; W567-Y629 AromaticContact CZ2-CD2 3.94Å; W567-Y629 HydrophobicContact CZ2-CD2 3.94Å; W568-Y629 AromaticContact CH2-CD2 3.93Å; W568-Y629 HydrophobicContact CH2-CD2 3.93Å; W568-Y629 AromaticContact CH2-CE2 3.53Å; W568-Y629 HydrophobicContact CH2-CE2 3.53Å; W568-Y629 AromaticContact CZ3-CD2 3.94Å; W568-Y629 HydrophobicContact CZ3-CD2 3.94Å; W568-Y629 AromaticContact CZ3-CE2 3.9Å; W568-Y629 HydrophobicContact CZ3-CE2 3.9Å; F625-Y629 VanDerWaalsContact O-CB 3.27Å; F625-Y629 WeakPolarHBondContact O-CB 3.48Å; F625-Y629 PolarHBondContact O-N 3.22Å; Y626-Y629 PolarHBondContact O-N 3.16Å; Y629-R633 HydrophobicContact CD2-CG 4.35Å; Y629-R633 HydrophobicContact CE2-CG 4.06Å; Y629-R633 VanDerWaalsContact CZ-CD 3.49Å; Y629-R633 WeakPolarHBondContact O-CB 3.25Å; Y629-R633 WeakPolarHBondContact O-CG 3.29Å; Y629-R633 PolarHBondContact O-N 3.3Å
630	M	93.9	Very high	91.8	Very high	117 Å²	117	34.8 Å²	34.8	58%	0.576	18%	0.178	S	C	*	.	H	α-helix	trans	-63.8	-42.1	173.5	-73.4	-173.4	-73.4	0	0	111.8	Y626 A627 A628 K634	Y626-M630 WeakPolarHBondContact O-CB 3.11Å; Y626-M630 WeakPolarHBondContact O-CE 3.33Å; Y626-M630 WeakPolarHBondContact O-CG 3.41Å; Y626-M630 PolarHBondContact O-N 3.4Å; A627-M630 PolarHBondContact O-N 3.46Å; A628-M630 VanDerWaalsContact C-N 3.34Å; A628-M630 PolarHBondContact O-N 2.7Å; M630-K634 WeakPolarHBondContact O-CB 3.5Å; M630-K634 PolarHBondContact O-N 2.83Å
631	F	93	Very high	90.4	Very high	23 Å²	23	37 Å²	37	10%	0.101	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-51.2	176.4	172	-102.4	0	0	0	112.4	I301 L305 I553 V556 Y557 A627 A628 R633 K634 I635	I301-F631 HydrophobicContact CG2-CE2 4.09Å; I301-F631 HydrophobicContact CG2-CZ 4.48Å; L305-F631 HydrophobicContact CD1-CE2 3.78Å; L305-F631 HydrophobicContact CD1-CZ 4.01Å; I553-F631 HydrophobicContact CB-CG 4.48Å; I553-F631 HydrophobicContact CD1-CB 4.4Å; I553-F631 HydrophobicContact CG1-CB 3.93Å; I553-F631 HydrophobicContact CG1-CG 4.24Å; I553-F631 HydrophobicContact CG2-CB 4.33Å; I553-F631 HydrophobicContact CG2-CD1 4.01Å; I553-F631 HydrophobicContact CG2-CD2 3.6Å; I553-F631 HydrophobicContact CG2-CE1 4.18Å; I553-F631 HydrophobicContact CG2-CE2 3.78Å; I553-F631 HydrophobicContact CG2-CG 3.71Å; I553-F631 HydrophobicContact CG2-CZ 4.07Å; V556-F631 HydrophobicContact CG1-CD1 3.8Å; V556-F631 HydrophobicContact CG1-CE1 4.19Å; Y557-F631 HydrophobicContact CD2-CE1 4.34Å; Y557-F631 HydrophobicContact CD2-CZ 4.05Å; Y557-F631 HydrophobicContact CG-CZ 4.35Å; A627-F631 WeakPolarHBondContact O-CB 3.41Å; A627-F631 PolarHBondContact O-N 2.68Å; A628-F631 WeakPolarHBondContact O-CB 3.16Å; A628-F631 PolarHBondContact O-N 3.32Å; F631-R633 PolarHBondContact O-N 2.75Å; F631-K634 WeakPolarHBondContact O-CA 3.27Å; F631-K634 WeakPolarHBondContact O-CB 3.44Å; F631-K634 PolarHBondContact O-N 3.14Å; F631-I635 HydrophobicContact CD1-CD1 4.42Å; F631-I635 HydrophobicContact CD2-CG2 4.12Å; F631-I635 HydrophobicContact CE1-CD1 3.88Å; F631-I635 HydrophobicContact CE1-CG2 4.17Å; F631-I635 HydrophobicContact CE2-CG2 3.66Å; F631-I635 HydrophobicContact CZ-CD1 4.29Å; F631-I635 HydrophobicContact CZ-CG2 3.68Å; F631-I635 PolarHBondContact O-N 3.02Å
632	V	93.4	Very high	88.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.2	-48.3	178.5	172	0	0	0	0	110.2	V334 F335 V556 L560 W567 A628 K634 I635 Y636	V334-V632 HydrophobicContact CG2-CG1 3.69Å; F335-V632 HydrophobicContact CE1-CG1 3.94Å; F335-V632 HydrophobicContact CZ-CG1 3.86Å; V556-V632 HydrophobicContact CG1-CG2 4.35Å; V556-V632 HydrophobicContact CG2-CG2 3.8Å; L560-V632 HydrophobicContact CD1-CG2 4.02Å; W567-V632 HydrophobicContact CD2-CG2 4.41Å; W567-V632 HydrophobicContact CZ2-CB 4.5Å; W567-V632 HydrophobicContact CZ2-CG1 4.34Å; A628-V632 WeakPolarHBondContact O-CB 3.47Å; A628-V632 VanDerWaalsContact O-CG2 3.26Å; A628-V632 WeakPolarHBondContact O-CG2 3.39Å; A628-V632 PolarHBondContact O-N 3.2Å; V632-K634 VanDerWaalsContact C-N 3.26Å; V632-K634 PolarHBondContact O-N 2.72Å; V632-I635 VanDerWaalsContact O-CG1 3.26Å; V632-I635 WeakPolarHBondContact O-CG1 3.45Å; V632-I635 PolarHBondContact O-N 2.88Å; V632-Y636 HydrophobicContact CG1-CD2 3.84Å; V632-Y636 HydrophobicContact CG1-CE2 3.94Å; V632-Y636 VanDerWaalsContact O-CD2 3.26Å; V632-Y636 WeakPolarHBondContact O-CD2 3.27Å; V632-Y636 PolarHBondContact O-N 3.26Å
633	R	92.6	Very high	87.9	Confident	70 Å²	70	50.4 Å²	50.4	26%	0.264	26%	0.26	S	S	.	.	H	α-helix	trans	-58.9	-38	175.6	-73	179.4	69.2	-134	-1.1	112.7	F335 D478 Y629 F631 A637	F335-R633 HydrophobicContact CE1-CG 3.77Å; F335-R633 HydrophobicContact CZ-CG 4.05Å; D478-R633 PolarHBondContact O-NE 2.87Å; D478-R633 PolarHBondContact O-NH2 2.97Å; Y629-R633 HydrophobicContact CD2-CG 4.35Å; Y629-R633 HydrophobicContact CE2-CG 4.06Å; Y629-R633 VanDerWaalsContact CZ-CD 3.49Å; Y629-R633 WeakPolarHBondContact O-CB 3.25Å; Y629-R633 WeakPolarHBondContact O-CG 3.29Å; Y629-R633 PolarHBondContact O-N 3.3Å; F631-R633 PolarHBondContact O-N 2.75Å; R633-A637 WeakPolarHBondContact O-CB 3.46Å; R633-A637 PolarHBondContact O-N 2.63Å; R633-A637 VanDerWaalsContact O-N 3.09Å
634	K	90.4	Very high	87.4	Confident	163 Å²	163	52.2 Å²	52.2	71%	0.709	27%	0.27	S	S	*	.	H	α-helix	trans	-70.8	-41.9	-179.1	-169.4	174	-177.6	177.2	0	112.9	M630 F631 V632 A638	M630-K634 WeakPolarHBondContact O-CB 3.5Å; M630-K634 PolarHBondContact O-N 2.83Å; F631-K634 WeakPolarHBondContact O-CA 3.27Å; F631-K634 WeakPolarHBondContact O-CB 3.44Å; F631-K634 PolarHBondContact O-N 3.14Å; V632-K634 VanDerWaalsContact C-N 3.26Å; V632-K634 PolarHBondContact O-N 2.72Å; K634-A638 PolarHBondContact O-N 2.81Å
635	I	88.9	Confident	86.9	Confident	7 Å²	7	55.1 Å²	55.1	4%	0.036	29%	0.285	C	S	.	.	H	α-helix	trans	-68.9	-42.1	-179.8	63.5	175.5	0	0	0	111.7	L305 W327 L560 F631 V632 A638	L305-I635 HydrophobicContact CD1-CG2 3.92Å; L305-I635 HydrophobicContact CD2-CG2 4.16Å; W327-I635 HydrophobicContact CE3-CD1 4.02Å; W327-I635 HydrophobicContact CE3-CG1 4.46Å; W327-I635 HydrophobicContact CH2-CB 4.2Å; W327-I635 HydrophobicContact CZ3-CB 4.04Å; W327-I635 HydrophobicContact CZ3-CD1 4.19Å; W327-I635 HydrophobicContact CZ3-CG1 4.15Å; L560-I635 HydrophobicContact CD1-CD1 4.02Å; F631-I635 HydrophobicContact CD1-CD1 4.42Å; F631-I635 HydrophobicContact CD2-CG2 4.12Å; F631-I635 HydrophobicContact CE1-CD1 3.88Å; F631-I635 HydrophobicContact CE1-CG2 4.17Å; F631-I635 HydrophobicContact CE2-CG2 3.66Å; F631-I635 HydrophobicContact CZ-CD1 4.29Å; F631-I635 HydrophobicContact CZ-CG2 3.68Å; F631-I635 PolarHBondContact O-N 3.02Å; V632-I635 VanDerWaalsContact O-CG1 3.26Å; V632-I635 WeakPolarHBondContact O-CG1 3.45Å; V632-I635 PolarHBondContact O-N 2.88Å; I635-A638 PolarHBondContact O-N 3.13Å
636	Y	89.8	Confident	86.3	Confident	3 Å²	3	58.4 Å²	58.4	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-77.2	-20.6	179.3	-74	-79.2	0	0	0	113.3	W327 V330 H331 V334 F335 V481 L560 V632 A638 I641	W327-Y636 HydrophobicContact CE3-CE1 4.15Å; W327-Y636 HydrophobicContact CZ3-CE1 4.45Å; W327-Y636 PolarHBondContact O-OH 3.3Å; V330-Y636 WeakPolarHBondContact CG2-OH 3.47Å; H331-Y636 VanDerWaalsContact CA-CE1 3.47Å; H331-Y636 HydrophobicContact CB-CD1 3.91Å; H331-Y636 HydrophobicContact CB-CE1 3.71Å; V334-Y636 HydrophobicContact CB-CE2 4Å; V334-Y636 HydrophobicContact CG1-CD1 4.36Å; V334-Y636 HydrophobicContact CG1-CD2 3.9Å; V334-Y636 HydrophobicContact CG1-CE1 4.12Å; V334-Y636 HydrophobicContact CG1-CE2 3.7Å; V334-Y636 HydrophobicContact CG1-CG 4.25Å; V334-Y636 HydrophobicContact CG2-CD2 4.41Å; V334-Y636 HydrophobicContact CG2-CE2 3.65Å; F335-Y636 HydrophobicContact CE2-CD2 4.32Å; F335-Y636 HydrophobicContact CE2-CG 4.3Å; F335-Y636 HydrophobicContact CZ-CD2 4.39Å; V481-Y636 HydrophobicContact CG2-CD1 4.31Å; L560-Y636 HydrophobicContact CD1-CE2 4.09Å; V632-Y636 HydrophobicContact CG1-CD2 3.84Å; V632-Y636 HydrophobicContact CG1-CE2 3.94Å; V632-Y636 VanDerWaalsContact O-CD2 3.26Å; V632-Y636 WeakPolarHBondContact O-CD2 3.27Å; V632-Y636 PolarHBondContact O-N 3.26Å; Y636-A638 VanDerWaalsContact C-N 3.26Å; Y636-I641 HydrophobicContact CD1-CD1 4.29Å
637	A	87.2	Confident	85.6	Confident	70 Å²	70	59.9 Å²	59.9	58%	0.579	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-15.2	169.7	0	0	0	0	0	113.1	P480 R633	P480-A637 HydrophobicContact CB-CB 3.91Å; P480-A637 HydrophobicContact CG-CB 4.3Å; R633-A637 WeakPolarHBondContact O-CB 3.46Å; R633-A637 PolarHBondContact O-N 2.63Å; R633-A637 VanDerWaalsContact O-N 3.09Å
638	A	85.1	Confident	85	Confident	51 Å²	51	63.3 Å²	63.3	42%	0.421	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-16.5	-178.3	0	0	0	0	0	113.7	I309 K634 I635 Y636	I309-A638 HydrophobicContact CD1-CB 4.25Å; K634-A638 PolarHBondContact O-N 2.81Å; I635-A638 PolarHBondContact O-N 3.13Å; Y636-A638 VanDerWaalsContact C-N 3.26Å
639	V	77.2	Confident	84.2	Confident	11 Å²	11	67.8 Å²	67.8	7%	0.067	35%	0.351	C	S	.	.	S	Bend	trans	-92.1	134.9	176.7	-175	0	0	0	0	108.4	I309 W327 K328 I641	I309-V639 HydrophobicContact CG1-CG2 4.49Å; W327-V639 HydrophobicContact CH2-CG2 3.44Å; W327-V639 VanDerWaalsContact CH2-CG2 3.44Å; W327-V639 HydrophobicContact CZ3-CG2 3.73Å; K328-V639 HydrophobicContact CD-CG1 4.04Å; K328-V639 HydrophobicContact CG-CG1 4.42Å; V639-I641 HydrophobicContact CB-CD1 4.17Å; V639-I641 HydrophobicContact CB-CG1 4.18Å; V639-I641 HydrophobicContact CG1-CD1 4.17Å; V639-I641 HydrophobicContact CG1-CG1 3.8Å; V639-I641 PolarHBondContact O-N 2.73Å
640	K	70.3	Confident	83.3	Confident	151 Å²	151	72.7 Å²	72.7	66%	0.657	38%	0.377	S	S	*	.			trans	-73.7	117.9	169.4	-65.8	179.8	-176.9	175.2	0	107.6
641	I	67	Low	82.5	Confident	45 Å²	45	69 Å²	69	23%	0.231	36%	0.361	C	S	.	.			trans	-134.3	116.1	177.7	-58.9	164.2	0	0	0	104.5	H331 V481 Y636 V639	H331-I641 HydrophobicContact CB-CD1 3.61Å; H331-I641 VanDerWaalsContact CD2-CG2 3.46Å; H331-I641 WeakPolarHBondContact CD2-CG2 3.38Å; V481-I641 HydrophobicContact CG1-CD1 4.49Å; V481-I641 HydrophobicContact CG1-CG2 4.37Å; V481-I641 HydrophobicContact CG2-CD1 3.54Å; Y636-I641 HydrophobicContact CD1-CD1 4.29Å; V639-I641 HydrophobicContact CB-CD1 4.17Å; V639-I641 HydrophobicContact CB-CG1 4.18Å; V639-I641 HydrophobicContact CG1-CD1 4.17Å; V639-I641 HydrophobicContact CG1-CG1 3.8Å; V639-I641 PolarHBondContact O-N 2.73Å
642	D	54.5	Low	81.5	Confident	234 Å²	234	73.2 Å²	73.2	100%	1.251	38%	0.384	S	S	*	.			trans	-70.6	0	-177	-72	-26	0	0	0	113.7

Retrieved 642 of 642 residues in 277.1 ms (Link to these results)

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