A0A077ZKL5_TRITR Loading...

PCI domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZKL5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 467 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	31	Very low	241 Å²	241	148.5 Å²	148.5	100%	1.187	85%	0.849	S	S	*	*				0	127.9	0	-66.1	-177.7	-157.3	0	0	105.2
2	D	32.9	Very low	31.1	Very low	166 Å²	166	152.3 Å²	152.3	89%	0.888	85%	0.854	S	S	*	*			trans	81.3	62.9	-171.3	-63.4	-12.7	0	0	0	118.1
3	E	29.1	Very low	31.9	Very low	207 Å²	207	144.8 Å²	144.8	97%	0.967	83%	0.832	S	S	*	*			trans	-139	102.2	140.3	-78.2	-171.3	169.4	0	0	107.4
4	G	30.2	Very low	33.1	Very low	77 Å²	77	138.4 Å²	138.4	79%	0.794	80%	0.8	S	S	*	*			trans	162	50.2	178.6	0	0	0	0	0	115.4
5	N	29.8	Very low	33.9	Very low	148 Å²	148	138.3 Å²	138.3	79%	0.791	79%	0.789	S	S	*	*			trans	-163.6	54.9	162.4	-140.3	12.1	0	0	0	115.3
6	V	30.1	Very low	35.1	Very low	140 Å²	140	133.3 Å²	133.3	85%	0.848	77%	0.769	S	S	*	*	S	Bend	trans	-128.6	-4.6	178.1	-168.3	0	0	0	0	115.5
7	E	29.7	Very low	36.4	Very low	198 Å²	198	130.2 Å²	130.2	93%	0.925	75%	0.749	S	S	*	*	S	Bend	trans	-111.6	8.1	-177.1	-76.4	-169.3	156.8	0	0	116.9
8	A	30	Very low	37.7	Very low	92 Å²	92	124.2 Å²	124.2	76%	0.76	71%	0.714	S	S	*	*	S	Bend	trans	-99.9	5.5	180	0	0	0	0	0	115.2
9	A	27.1	Very low	39	Very low	86 Å²	86	119.5 Å²	119.5	71%	0.711	69%	0.689	S	S	*	*	S	Bend	trans	-124	70.6	-171.8	0	0	0	0	0	112.6
10	T	30.1	Very low	40.4	Very low	138 Å²	138	122.1 Å²	122.1	85%	0.847	69%	0.687	S	S	*	*	S	Bend	trans	-174.6	44.9	158.2	37.6	0	0	0	0	111.9
11	F	35.5	Very low	41.6	Very low	141 Å²	141	120.8 Å²	120.8	62%	0.618	68%	0.678	S	S	*	*			trans	-130.1	36.8	-178.3	-126.8	-89.7	0	0	0	114.4	V54 I55	F11-V54 HydrophobicContact CE1-CG1 4.41Å; F11-V54 HydrophobicContact CZ-CG1 3.86Å; F11-I55 HydrophobicContact CE1-CG1 3.88Å; F11-I55 HydrophobicContact CZ-CG1 4.14Å
12	E	32.2	Very low	42.9	Very low	194 Å²	194	109.4 Å²	109.4	91%	0.907	62%	0.622	S	S	*	*			trans	-128.4	42.9	167.1	-70.6	-173.1	163.7	0	0	110.6	S14	E12-S14 PolarHBondContact O-N 2.69Å
13	G	41.9	Very low	44.7	Very low	55 Å²	55	107.1 Å²	107.1	57%	0.567	61%	0.605	S	S	*	*			trans	-70.9	106	163.8	0	0	0	0	0	108.5
14	S	47.9	Very low	46.6	Very low	55 Å²	55	103.6 Å²	103.6	39%	0.385	59%	0.586	S	S	.	*			trans	-42.2	138.5	-167.5	74.1	0	0	0	0	114.7	E12 A16 D17	E12-S14 PolarHBondContact O-N 2.69Å; S14-A16 PolarHBondContact O-N 3.39Å; S14-D17 PolarHBondContact O-N 3.25Å; S14-D17 VanDerWaalsContact OG-CG 3.3Å; S14-D17 PolarHBondContact OG-N 2.97Å; S14-D17 PolarHBondContact OG-OD2 3.13Å
15	E	45.3	Very low	48.2	Very low	137 Å²	137	101.8 Å²	101.8	64%	0.64	56%	0.561	S	S	*	*	H	α-helix	trans	-47.2	-28.3	172.6	-68.3	-178.4	151.7	0	0	112.6	S19	E15-S19 PolarHBondContact O-N 3.14Å; E15-S19 VanDerWaalsContact O-N 3.14Å
16	A	53	Low	50	Low	57 Å²	57	96.1 Å²	96.1	47%	0.471	53%	0.53	S	S	.	.	H	α-helix	trans	-67.3	-35	177.4	0	0	0	0	0	114.2	S14 R20	S14-A16 PolarHBondContact O-N 3.39Å; A16-R20 WeakPolarHBondContact O-CG 3.37Å; A16-R20 PolarHBondContact O-N 3.38Å
17	D	58.3	Low	52.1	Low	81 Å²	81	94.9 Å²	94.9	43%	0.433	52%	0.515	S	S	.	.	H	α-helix	trans	-74.6	-37.2	-178.5	-69.4	-41.2	0	0	0	111.4	S14 R20 L21	S14-D17 PolarHBondContact O-N 3.25Å; S14-D17 VanDerWaalsContact OG-CG 3.3Å; S14-D17 PolarHBondContact OG-N 2.97Å; S14-D17 PolarHBondContact OG-OD2 3.13Å; D17-R20 PolarHBondContact O-N 2.87Å; D17-L21 WeakPolarHBondContact O-CG 3.46Å; D17-L21 PolarHBondContact O-N 2.98Å
18	I	59.8	Low	54	Low	22 Å²	22	89 Å²	89	11%	0.113	49%	0.49	C	S	.	.	H	α-helix	trans	-71.1	-39.3	176.4	-60.8	148.4	0	0	0	110.3	R20 L21 V22 I55	I18-R20 PolarHBondContact O-N 3.43Å; I18-L21 PolarHBondContact O-N 2.88Å; I18-L21 VanDerWaalsContact O-N 3.14Å; I18-V22 HydrophobicContact CG2-CG2 4.01Å; I18-V22 WeakPolarHBondContact O-CB 3.42Å; I18-V22 VanDerWaalsContact O-CG2 3.28Å; I18-V22 WeakPolarHBondContact O-CG2 3.03Å; I18-V22 PolarHBondContact O-N 3Å; I18-I55 HydrophobicContact CD1-CB 4.34Å; I18-I55 HydrophobicContact CD1-CD1 3.43Å; I18-I55 VanDerWaalsContact CD1-CD1 3.43Å; I18-I55 HydrophobicContact CD1-CG1 4.34Å; I18-I55 HydrophobicContact CD1-CG2 3.67Å; I18-I55 HydrophobicContact CG1-CD1 4.09Å
19	S	61.7	Low	55.7	Low	35 Å²	35	84.8 Å²	84.8	25%	0.245	46%	0.455	C	S	.	.	H	α-helix	trans	-57.9	-37.4	174.8	-168.6	0	0	0	0	112.2	E15 K23	E15-S19 PolarHBondContact O-N 3.14Å; E15-S19 VanDerWaalsContact O-N 3.14Å; S19-K23 VanDerWaalsContact O-CG 3.29Å; S19-K23 WeakPolarHBondContact O-CG 3.48Å; S19-K23 PolarHBondContact O-N 2.96Å
20	R	67	Low	57.6	Low	171 Å²	171	86.9 Å²	86.9	65%	0.645	45%	0.448	S	S	*	.	H	α-helix	trans	-70.1	-42.9	174.8	-72.4	176.2	177	174.4	-0.5	112.5	A16 D17 I18 V22 K23 K24	A16-R20 WeakPolarHBondContact O-CG 3.37Å; A16-R20 PolarHBondContact O-N 3.38Å; D17-R20 PolarHBondContact O-N 2.87Å; I18-R20 PolarHBondContact O-N 3.43Å; R20-V22 VanDerWaalsContact C-N 3.34Å; R20-K23 PolarHBondContact O-N 3.05Å; R20-K24 PolarHBondContact O-N 3.11Å
21	L	65.2	Low	59.7	Low	96 Å²	96	85.8 Å²	85.8	50%	0.503	43%	0.431	S	S	.	.	H	α-helix	trans	-63.4	-41.7	176.2	-71.7	170.1	0	0	0	111.5	D17 I18 K24 C25 M48	D17-L21 WeakPolarHBondContact O-CG 3.46Å; D17-L21 PolarHBondContact O-N 2.98Å; I18-L21 PolarHBondContact O-N 2.88Å; I18-L21 VanDerWaalsContact O-N 3.14Å; L21-K24 PolarHBondContact O-N 3.33Å; L21-C25 WeakPolarHBondContact O-CB 3.37Å; L21-C25 PolarHBondContact O-N 3.47Å; L21-C25 PolarHBondContact O-SG 3.26Å; L21-M48 HydrophobicContact CB-CE 4.3Å
22	V	64.4	Low	61.2	Low	2 Å²	2	80.4 Å²	80.4	1%	0.012	41%	0.409	C	S	.	.	H	α-helix	trans	-64.4	-42.4	176.9	167.9	0	0	0	0	111.1	I18 R20 K24 C25 L26 M48 L64	I18-V22 HydrophobicContact CG2-CG2 4.01Å; I18-V22 WeakPolarHBondContact O-CB 3.42Å; I18-V22 VanDerWaalsContact O-CG2 3.28Å; I18-V22 WeakPolarHBondContact O-CG2 3.03Å; I18-V22 PolarHBondContact O-N 3Å; R20-V22 VanDerWaalsContact C-N 3.34Å; V22-K24 PolarHBondContact O-N 3.1Å; V22-C25 PolarHBondContact O-N 3.29Å; V22-L26 HydrophobicContact CG1-CD1 4.03Å; V22-L26 HydrophobicContact CG1-CG 4.35Å; V22-L26 WeakPolarHBondContact O-CB 3.4Å; V22-L26 WeakPolarHBondContact O-CG 3.44Å; V22-L26 PolarHBondContact O-N 2.8Å; V22-M48 HydrophobicContact CG2-CE 4.29Å; V22-L64 HydrophobicContact CG1-CD1 3.97Å; V22-L64 HydrophobicContact CG1-CD2 3.84Å; V22-L64 HydrophobicContact CG1-CG 3.62Å; V22-L64 HydrophobicContact CG2-CD1 3.86Å; V22-L64 HydrophobicContact CG2-CG 4.45Å
23	K	70.2	Confident	62.7	Low	118 Å²	118	73.2 Å²	73.2	51%	0.513	38%	0.376	S	S	.	.	H	α-helix	trans	-61.5	-42.8	174.4	-75.4	174.3	-176.7	-179.3	0	112.7	S19 R20 L26 E27	S19-K23 VanDerWaalsContact O-CG 3.29Å; S19-K23 WeakPolarHBondContact O-CG 3.48Å; S19-K23 PolarHBondContact O-N 2.96Å; R20-K23 PolarHBondContact O-N 3.05Å; K23-L26 PolarHBondContact O-N 3.19Å; K23-E27 WeakPolarHBondContact O-CG 3.25Å; K23-E27 PolarHBondContact O-N 3.12Å
24	K	70.3	Confident	63.8	Low	133 Å²	133	77.5 Å²	77.5	58%	0.578	39%	0.386	S	S	*	.	H	α-helix	trans	-63	-45.7	174.4	-73.4	-176.4	177	-175.7	0	111.8	R20 L21 V22 L26 E27 D28	R20-K24 PolarHBondContact O-N 3.11Å; L21-K24 PolarHBondContact O-N 3.33Å; V22-K24 PolarHBondContact O-N 3.1Å; K24-L26 VanDerWaalsContact C-N 3.26Å; K24-L26 PolarHBondContact O-N 2.76Å; K24-E27 WeakPolarHBondContact O-CB 3.41Å; K24-E27 PolarHBondContact O-N 3.35Å; K24-E27 VanDerWaalsContact O-N 3.11Å; K24-D28 PolarHBondContact O-N 3.3Å
25	C	63.7	Low	64.9	Low	39 Å²	39	81.1 Å²	81.1	26%	0.264	40%	0.396	S	S	.	.	H	α-helix	trans	-61.9	-33.8	175.3	-69.8	0	0	0	0	112.6	L21 V22 A29 M48	L21-C25 WeakPolarHBondContact O-CB 3.37Å; L21-C25 PolarHBondContact O-N 3.47Å; L21-C25 PolarHBondContact O-SG 3.26Å; V22-C25 PolarHBondContact O-N 3.29Å; C25-A29 WeakPolarHBondContact O-CB 3.48Å; C25-A29 PolarHBondContact O-N 3.48Å; C25-M48 HydrophobicContact CB-CG 4.27Å
26	L	66.1	Low	65.9	Low	28 Å²	28	77 Å²	77	15%	0.147	39%	0.39	C	S	.	.	H	α-helix	trans	-69.9	-35.6	174	-73.2	172.6	0	0	0	112.2	V22 K23 K24 K30 L63 L64 A67	V22-L26 HydrophobicContact CG1-CD1 4.03Å; V22-L26 HydrophobicContact CG1-CG 4.35Å; V22-L26 WeakPolarHBondContact O-CB 3.4Å; V22-L26 WeakPolarHBondContact O-CG 3.44Å; V22-L26 PolarHBondContact O-N 2.8Å; K23-L26 PolarHBondContact O-N 3.19Å; K24-L26 VanDerWaalsContact C-N 3.26Å; K24-L26 PolarHBondContact O-N 2.76Å; L26-K30 WeakPolarHBondContact O-CB 3.23Å; L26-K30 VanDerWaalsContact O-CG 3.26Å; L26-K30 WeakPolarHBondContact O-CG 3.47Å; L26-K30 PolarHBondContact O-N 3.45Å; L26-L63 HydrophobicContact CD1-CB 4.45Å; L26-L64 HydrophobicContact CD2-CD2 4.05Å; L26-L64 HydrophobicContact CG-CD2 4.31Å; L26-A67 HydrophobicContact CD2-CB 3.22Å
27	E	74.3	Confident	66.8	Low	114 Å²	114	80.3 Å²	80.3	53%	0.533	39%	0.391	S	S	.	.	H	α-helix	trans	-68.2	-42.4	173.4	-73.5	174.2	-175.9	0	0	111.6	K23 K24 K30 K31	K23-E27 WeakPolarHBondContact O-CG 3.25Å; K23-E27 PolarHBondContact O-N 3.12Å; K24-E27 WeakPolarHBondContact O-CB 3.41Å; K24-E27 PolarHBondContact O-N 3.35Å; K24-E27 VanDerWaalsContact O-N 3.11Å; E27-K30 PolarHBondContact O-N 3.06Å; E27-K31 WeakPolarHBondContact O-CG 3.35Å; E27-K31 PolarHBondContact O-N 2.9Å
28	D	70.8	Confident	67.2	Low	76 Å²	76	78.9 Å²	78.9	41%	0.406	38%	0.382	S	S	.	.	H	α-helix	trans	-69.1	-38	177	-65.1	-26	0	0	0	111.4	K24 K30 K31 L32	K24-D28 PolarHBondContact O-N 3.3Å; D28-K30 PolarHBondContact O-N 3.42Å; D28-K31 PolarHBondContact O-N 3.24Å; D28-K31 IonicContact OD1-NZ 3.09Å; D28-L32 VanDerWaalsContact O-CG 3.3Å; D28-L32 WeakPolarHBondContact O-CG 3.42Å; D28-L32 PolarHBondContact O-N 3.44Å
29	A	64.7	Low	67.8	Low	2 Å²	2	81.2 Å²	81.2	2%	0.017	41%	0.405	C	S	.	.	H	α-helix	trans	-62.3	-41.3	172.3	0	0	0	0	0	111.8	C25 K31 L32 E33 M45	C25-A29 WeakPolarHBondContact O-CB 3.48Å; C25-A29 PolarHBondContact O-N 3.48Å; A29-K31 PolarHBondContact O-N 3.15Å; A29-L32 CarbonylContact O-C 3.6Å; A29-L32 PolarHBondContact O-N 3.47Å; A29-E33 WeakPolarHBondContact O-CG 3.27Å; A29-E33 PolarHBondContact O-N 3.46Å; A29-M45 HydrophobicContact CB-CE 4.07Å; A29-M45 HydrophobicContact CB-CG 3.94Å; A29-M45 HydrophobicContact CB-SD 3.96Å
30	K	68.5	Low	68.4	Low	130 Å²	130	83.3 Å²	83.3	57%	0.565	41%	0.411	S	S	*	.	H	α-helix	trans	-63.2	-40.5	174.8	-78.6	175.2	179.7	-176.5	0	112.8	L26 E27 D28 L32 E33 D34	L26-K30 WeakPolarHBondContact O-CB 3.23Å; L26-K30 VanDerWaalsContact O-CG 3.26Å; L26-K30 WeakPolarHBondContact O-CG 3.47Å; L26-K30 PolarHBondContact O-N 3.45Å; E27-K30 PolarHBondContact O-N 3.06Å; D28-K30 PolarHBondContact O-N 3.42Å; K30-L32 VanDerWaalsContact C-N 3.32Å; K30-L32 PolarHBondContact O-N 3.43Å; K30-E33 WeakPolarHBondContact O-CB 3.25Å; K30-E33 PolarHBondContact O-N 2.81Å; K30-D34 PolarHBondContact O-N 3.04Å
31	K	72.3	Confident	68.6	Low	115 Å²	115	75.2 Å²	75.2	50%	0.5	38%	0.38	S	S	.	.	H	α-helix	trans	-62.5	-42.1	174.4	-68.8	170.3	-170	162.3	0	111.3	E27 D28 A29 E33 D34 E35	E27-K31 WeakPolarHBondContact O-CG 3.35Å; E27-K31 PolarHBondContact O-N 2.9Å; D28-K31 PolarHBondContact O-N 3.24Å; D28-K31 IonicContact OD1-NZ 3.09Å; A29-K31 PolarHBondContact O-N 3.15Å; K31-E33 VanDerWaalsContact C-N 3.32Å; K31-E33 PolarHBondContact O-N 3.26Å; K31-D34 PolarHBondContact O-N 2.99Å; K31-E35 VanDerWaalsContact O-CG 3.31Å; K31-E35 WeakPolarHBondContact O-CG 3.2Å; K31-E35 PolarHBondContact O-N 3.31Å
32	L	68.3	Low	69.1	Low	29 Å²	29	71.5 Å²	71.5	15%	0.152	36%	0.361	C	S	.	.	H	α-helix	trans	-69.1	-30.1	176.8	-68.5	168.6	0	0	0	112.8	D28 A29 K30 E35 G36 R37 A41 L44	D28-L32 VanDerWaalsContact O-CG 3.3Å; D28-L32 WeakPolarHBondContact O-CG 3.42Å; D28-L32 PolarHBondContact O-N 3.44Å; A29-L32 CarbonylContact O-C 3.6Å; A29-L32 PolarHBondContact O-N 3.47Å; K30-L32 VanDerWaalsContact C-N 3.32Å; K30-L32 PolarHBondContact O-N 3.43Å; L32-E35 PolarHBondContact O-N 3.33Å; L32-G36 PolarHBondContact O-N 3.25Å; L32-R37 PolarHBondContact O-N 3.04Å; L32-A41 HydrophobicContact CB-CB 3.97Å; L32-L44 HydrophobicContact CD1-CD1 3.59Å
33	E	62.3	Low	69.9	Low	43 Å²	43	77.9 Å²	77.9	20%	0.201	39%	0.391	C	S	.	.	H	α-helix	trans	-64.8	-45.5	169.8	-77.2	170.9	-146.9	0	0	111	A29 K30 K31 E35 G36 A71	A29-E33 WeakPolarHBondContact O-CG 3.27Å; A29-E33 PolarHBondContact O-N 3.46Å; K30-E33 WeakPolarHBondContact O-CB 3.25Å; K30-E33 PolarHBondContact O-N 2.81Å; K31-E33 VanDerWaalsContact C-N 3.32Å; K31-E33 PolarHBondContact O-N 3.26Å; E33-E35 PolarHBondContact O-N 2.97Å; E33-G36 PolarHBondContact O-N 2.81Å; E33-A71 HydrophobicContact CG-CB 4.15Å; E33-A71 WeakPolarHBondContact OE1-CB 3.29Å
34	D	66.8	Low	70.2	Confident	145 Å²	145	76.8 Å²	76.8	78%	0.775	39%	0.39	S	S	*	.	H	α-helix	trans	-64.3	-30.4	176.7	-67.3	-27.6	0	0	0	112	K30 K31 G36	K30-D34 PolarHBondContact O-N 3.04Å; K31-D34 PolarHBondContact O-N 2.99Å; D34-G36 VanDerWaalsContact C-N 3.31Å
35	E	69.5	Low	70.5	Confident	131 Å²	131	70.5 Å²	70.5	61%	0.612	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-4.5	174.7	-70.1	172.9	-167.6	0	0	113.9	K31 L32 E33 R37	K31-E35 VanDerWaalsContact O-CG 3.31Å; K31-E35 WeakPolarHBondContact O-CG 3.2Å; K31-E35 PolarHBondContact O-N 3.31Å; L32-E35 PolarHBondContact O-N 3.33Å; E33-E35 PolarHBondContact O-N 2.97Å; E35-R37 VanDerWaalsContact C-N 3.33Å; E35-R37 PolarHBondContact O-N 3.19Å
36	G	67.4	Low	71.4	Confident	49 Å²	49	70.5 Å²	70.5	51%	0.505	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	6.1	178.2	0	0	0	0	0	115.7	L32 E33 D34 I38	L32-G36 PolarHBondContact O-N 3.25Å; E33-G36 PolarHBondContact O-N 2.81Å; D34-G36 VanDerWaalsContact C-N 3.31Å; G36-I38 VanDerWaalsContact C-N 3.3Å; G36-I38 PolarHBondContact O-N 3.07Å; G36-I38 VanDerWaalsContact O-N 3.14Å
37	R	71.3	Confident	72.2	Confident	128 Å²	128	72.8 Å²	72.8	48%	0.483	38%	0.375	S	S	.	.			trans	-89.8	63.7	177.9	-67.9	177.2	79.4	-177.2	8	111.4	L32 E35 A39 E40 A41	L32-R37 PolarHBondContact O-N 3.04Å; E35-R37 VanDerWaalsContact C-N 3.33Å; E35-R37 PolarHBondContact O-N 3.19Å; R37-A39 PolarHBondContact O-N 2.85Å; R37-E40 VanDerWaalsContact CZ-CD 3.41Å; R37-E40 IonicContact CZ-OE1 3.06Å; R37-E40 IonicContact CZ-OE2 2.8Å; R37-E40 VanDerWaalsContact NE-CD 3.33Å; R37-E40 IonicContact NE-OE1 3.93Å; R37-E40 PolarHBondContact NE-OE1 2.81Å; R37-E40 IonicContact NE-OE2 2.84Å; R37-E40 PolarHBondContact NE-OE2 3.22Å; R37-E40 VanDerWaalsContact NE-OE2 3.13Å; R37-E40 IonicContact NH1-OE2 3.63Å; R37-E40 IonicContact NH2-OE1 2.84Å; R37-E40 PolarHBondContact NH2-OE1 3.33Å; R37-E40 IonicContact NH2-OE2 2.64Å; R37-E40 PolarHBondContact NH2-OE2 3.49Å; R37-E40 PolarHBondContact O-N 3.38Å; R37-A41 PolarHBondContact O-N 3.33Å
38	I	66.3	Low	72.3	Confident	51 Å²	51	68.6 Å²	68.6	26%	0.262	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-39.1	-172.5	-62.1	144	0	0	0	112.6	G36 E40 A41 L42 A75	G36-I38 VanDerWaalsContact C-N 3.3Å; G36-I38 PolarHBondContact O-N 3.07Å; G36-I38 VanDerWaalsContact O-N 3.14Å; I38-E40 PolarHBondContact O-N 2.86Å; I38-A41 PolarHBondContact O-N 3.37Å; I38-L42 HydrophobicContact CG2-CD1 3.85Å; I38-L42 HydrophobicContact CG2-CG 4.27Å; I38-L42 WeakPolarHBondContact O-CB 3.28Å; I38-L42 VanDerWaalsContact O-CG 3.25Å; I38-L42 WeakPolarHBondContact O-CG 3.31Å; I38-L42 PolarHBondContact O-N 3.37Å; I38-A75 HydrophobicContact CB-CB 4.42Å; I38-A75 HydrophobicContact CD1-CB 3.39Å; I38-A75 HydrophobicContact CG1-CB 3.85Å; I38-A75 HydrophobicContact CG2-CB 3.8Å
39	A	73	Confident	72.7	Confident	71 Å²	71	65.1 Å²	65.1	59%	0.587	34%	0.337	S	S	*	.	H	α-helix	trans	-63.6	-41.3	-176.9	0	0	0	0	0	112.6	R37 L42 E43	R37-A39 PolarHBondContact O-N 2.85Å; A39-L42 PolarHBondContact O-N 3.32Å; A39-E43 PolarHBondContact O-N 3.19Å
40	E	73.8	Confident	73.5	Confident	78 Å²	78	71.3 Å²	71.3	36%	0.364	36%	0.364	S	S	.	.	H	α-helix	trans	-72.7	-37.6	179.8	-68.4	173.4	-148.1	0	0	111.8	R37 I38 L42 E43 L44	R37-E40 VanDerWaalsContact CZ-CD 3.41Å; R37-E40 IonicContact CZ-OE1 3.06Å; R37-E40 IonicContact CZ-OE2 2.8Å; R37-E40 VanDerWaalsContact NE-CD 3.33Å; R37-E40 IonicContact NE-OE1 3.93Å; R37-E40 PolarHBondContact NE-OE1 2.81Å; R37-E40 IonicContact NE-OE2 2.84Å; R37-E40 PolarHBondContact NE-OE2 3.22Å; R37-E40 VanDerWaalsContact NE-OE2 3.13Å; R37-E40 IonicContact NH1-OE2 3.63Å; R37-E40 IonicContact NH2-OE1 2.84Å; R37-E40 PolarHBondContact NH2-OE1 3.33Å; R37-E40 IonicContact NH2-OE2 2.64Å; R37-E40 PolarHBondContact NH2-OE2 3.49Å; R37-E40 PolarHBondContact O-N 3.38Å; I38-E40 PolarHBondContact O-N 2.86Å; E40-L42 VanDerWaalsContact C-N 3.29Å; E40-L42 PolarHBondContact O-N 3.49Å; E40-E43 PolarHBondContact O-N 2.8Å; E40-L44 WeakPolarHBondContact O-CB 3.11Å; E40-L44 WeakPolarHBondContact O-CG 3.31Å; E40-L44 PolarHBondContact O-N 2.97Å
41	A	72.5	Confident	73.9	Confident	1 Å²	1	71 Å²	71	1%	0.008	36%	0.362	C	S	.	.	H	α-helix	trans	-59.5	-42.5	171.4	0	0	0	0	0	111.1	L32 R37 I38 L44 M45	L32-A41 HydrophobicContact CB-CB 3.97Å; R37-A41 PolarHBondContact O-N 3.33Å; I38-A41 PolarHBondContact O-N 3.37Å; A41-L44 PolarHBondContact O-N 3.19Å; A41-M45 HydrophobicContact CB-CE 4.21Å; A41-M45 WeakPolarHBondContact O-CB 3.26Å; A41-M45 WeakPolarHBondContact O-CE 3.34Å; A41-M45 VanDerWaalsContact O-CG 3.31Å; A41-M45 WeakPolarHBondContact O-CG 3.28Å; A41-M45 PolarHBondContact O-N 3.04Å
42	L	74.7	Confident	74	Confident	19 Å²	19	65.6 Å²	65.6	10%	0.099	34%	0.339	C	S	.	.	H	α-helix	trans	-67.1	-38.4	177.2	-71.1	171.8	0	0	0	113	I38 A39 E40 M45 N46 I68 A71 C72	I38-L42 HydrophobicContact CG2-CD1 3.85Å; I38-L42 HydrophobicContact CG2-CG 4.27Å; I38-L42 WeakPolarHBondContact O-CB 3.28Å; I38-L42 VanDerWaalsContact O-CG 3.25Å; I38-L42 WeakPolarHBondContact O-CG 3.31Å; I38-L42 PolarHBondContact O-N 3.37Å; A39-L42 PolarHBondContact O-N 3.32Å; E40-L42 VanDerWaalsContact C-N 3.29Å; E40-L42 PolarHBondContact O-N 3.49Å; L42-M45 HydrophobicContact CD2-CE 4.18Å; L42-N46 VanDerWaalsContact O-CB 3.26Å; L42-N46 WeakPolarHBondContact O-CB 3.38Å; L42-N46 PolarHBondContact O-N 2.99Å; L42-N46 PolarHBondContact O-ND2 2.92Å; L42-I68 HydrophobicContact CD2-CG2 3.83Å; L42-A71 HydrophobicContact CD2-CB 4.45Å; L42-C72 VanDerWaalsContact CD2-SG 3.51Å
43	E	80.5	Confident	74.2	Confident	136 Å²	136	66.6 Å²	66.6	64%	0.636	34%	0.341	S	S	*	.	H	α-helix	trans	-66.1	-44.3	175.4	-76.3	-171.8	170.1	0	0	111.9	A39 E40 M45 N46 T47	A39-E43 PolarHBondContact O-N 3.19Å; E40-E43 PolarHBondContact O-N 2.8Å; E43-M45 PolarHBondContact O-N 3.18Å; E43-N46 PolarHBondContact O-N 2.85Å; E43-T47 WeakPolarHBondContact O-CB 3.4Å; E43-T47 PolarHBondContact O-N 3.46Å; E43-T47 PolarHBondContact O-OG1 3.24Å
44	L	78.3	Confident	75	Confident	94 Å²	94	69.3 Å²	69.3	49%	0.492	36%	0.36	S	S	.	.	H	α-helix	trans	-59.5	-47.3	175.2	-75.3	168.9	0	0	0	111.1	L32 E40 A41 T47 M48	L32-L44 HydrophobicContact CD1-CD1 3.59Å; E40-L44 WeakPolarHBondContact O-CB 3.11Å; E40-L44 WeakPolarHBondContact O-CG 3.31Å; E40-L44 PolarHBondContact O-N 2.97Å; A41-L44 PolarHBondContact O-N 3.19Å; L44-T47 PolarHBondContact O-N 3.31Å; L44-M48 WeakPolarHBondContact O-CG 3.48Å; L44-M48 PolarHBondContact O-N 3.47Å; L44-M48 VanDerWaalsContact O-N 3.09Å
45	M	76.6	Confident	75.5	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-64.3	-40.5	177.2	-73.4	-170.3	-84.4	0	0	112.5	A29 A41 L42 E43 T47 M48 E49 A67 I68 A71	A29-M45 HydrophobicContact CB-CE 4.07Å; A29-M45 HydrophobicContact CB-CG 3.94Å; A29-M45 HydrophobicContact CB-SD 3.96Å; A41-M45 HydrophobicContact CB-CE 4.21Å; A41-M45 WeakPolarHBondContact O-CB 3.26Å; A41-M45 WeakPolarHBondContact O-CE 3.34Å; A41-M45 VanDerWaalsContact O-CG 3.31Å; A41-M45 WeakPolarHBondContact O-CG 3.28Å; A41-M45 PolarHBondContact O-N 3.04Å; L42-M45 HydrophobicContact CD2-CE 4.18Å; E43-M45 PolarHBondContact O-N 3.18Å; M45-T47 VanDerWaalsContact C-N 3.35Å; M45-T47 PolarHBondContact O-N 3.01Å; M45-M48 PolarHBondContact O-N 2.85Å; M45-E49 WeakPolarHBondContact O-CB 3.47Å; M45-E49 PolarHBondContact O-N 3.09Å; M45-A67 HydrophobicContact SD-CB 4.04Å; M45-I68 HydrophobicContact CB-CD1 3.94Å; M45-I68 HydrophobicContact CB-CG1 3.54Å; M45-I68 HydrophobicContact CE-CG1 4.45Å; M45-I68 HydrophobicContact CG-CG1 4.33Å; M45-I68 HydrophobicContact SD-CG1 3.91Å; M45-A71 HydrophobicContact CE-CB 3.75Å
46	N	81.1	Confident	75.7	Confident	39 Å²	39	61.4 Å²	61.4	21%	0.209	33%	0.332	C	S	.	.	H	α-helix	trans	-65.7	-36.3	176.3	-88	-58.2	0	0	0	112.8	L42 E43 M48 E49 K50 K91	L42-N46 VanDerWaalsContact O-CB 3.26Å; L42-N46 WeakPolarHBondContact O-CB 3.38Å; L42-N46 PolarHBondContact O-N 2.99Å; L42-N46 PolarHBondContact O-ND2 2.92Å; E43-N46 PolarHBondContact O-N 2.85Å; N46-M48 VanDerWaalsContact C-N 3.35Å; N46-E49 PolarHBondContact O-N 2.97Å; N46-K50 PolarHBondContact O-N 2.97Å; N46-K91 PolarHBondContact OD1-NZ 3.28Å
47	T	82.9	Confident	76.1	Confident	76 Å²	76	59.6 Å²	59.6	47%	0.466	31%	0.311	S	S	.	.	H	α-helix	trans	-67.4	-41.1	178	-49.2	0	0	0	0	110.5	E43 L44 M45 K50 K51	E43-T47 WeakPolarHBondContact O-CB 3.4Å; E43-T47 PolarHBondContact O-N 3.46Å; E43-T47 PolarHBondContact O-OG1 3.24Å; L44-T47 PolarHBondContact O-N 3.31Å; M45-T47 VanDerWaalsContact C-N 3.35Å; M45-T47 PolarHBondContact O-N 3.01Å; T47-K50 PolarHBondContact O-N 3.5Å; T47-K51 PolarHBondContact O-N 3.45Å
48	M	76.9	Confident	76.2	Confident	27 Å²	27	54.5 Å²	54.5	13%	0.133	30%	0.296	C	S	.	.	H	α-helix	trans	-71.1	-36.5	175.1	-68.5	-58	-67.9	0	0	112.5	L21 V22 C25 L44 M45 N46 K50 K51 S52 L64	L21-M48 HydrophobicContact CB-CE 4.3Å; V22-M48 HydrophobicContact CG2-CE 4.29Å; C25-M48 HydrophobicContact CB-CG 4.27Å; L44-M48 WeakPolarHBondContact O-CG 3.48Å; L44-M48 PolarHBondContact O-N 3.47Å; L44-M48 VanDerWaalsContact O-N 3.09Å; M45-M48 PolarHBondContact O-N 2.85Å; N46-M48 VanDerWaalsContact C-N 3.35Å; M48-K50 VanDerWaalsContact C-N 3.32Å; M48-K50 PolarHBondContact O-N 2.91Å; M48-K51 PolarHBondContact O-N 2.72Å; M48-K51 VanDerWaalsContact O-N 3.16Å; M48-K51 HydrophobicContact SD-CD 4.06Å; M48-S52 PolarHBondContact O-N 3.43Å; M48-S52 PolarHBondContact O-OG 3.29Å; M48-L64 HydrophobicContact CB-CD1 4.11Å; M48-L64 HydrophobicContact CB-CD2 4.42Å
49	E	79.7	Confident	76.8	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.009	32%	0.317	C	S	.	.	H	α-helix	trans	-55.3	-48.4	171.7	-177.8	-83.7	139	0	0	110.5	M45 N46 K51 S52 R53 N61 Q65 L88 K91	M45-E49 WeakPolarHBondContact O-CB 3.47Å; M45-E49 PolarHBondContact O-N 3.09Å; N46-E49 PolarHBondContact O-N 2.97Å; E49-K51 VanDerWaalsContact C-N 3.31Å; E49-K51 PolarHBondContact O-N 3.36Å; E49-S52 WeakPolarHBondContact CA-OG 3.34Å; E49-S52 PolarHBondContact O-N 3.23Å; E49-S52 PolarHBondContact O-OG 3.41Å; E49-R53 WeakPolarHBondContact O-CB 3.22Å; E49-R53 PolarHBondContact O-N 3.35Å; E49-R53 IonicContact OE1-CZ 3.33Å; E49-R53 IonicContact OE1-NH1 2.61Å; E49-R53 PolarHBondContact OE1-NH1 3.04Å; E49-R53 IonicContact OE2-NH1 2.88Å; E49-R53 PolarHBondContact OE2-NH1 3.38Å; E49-N61 WeakPolarHBondContact CG-OD1 3.25Å; E49-Q65 HydrophobicContact CG-CG 4.42Å; E49-L88 HydrophobicContact CG-CD2 4.08Å; E49-K91 IonicContact OE2-NZ 2.69Å; E49-K91 PolarHBondContact OE2-NZ 3.2Å
50	K	80.2	Confident	77	Confident	133 Å²	133	56.4 Å²	56.4	58%	0.578	29%	0.29	S	S	*	.	H	α-helix	trans	-58.4	-43.2	177.7	-170.5	178.8	179.2	-177.5	0	111.6	N46 T47 M48 R53 V54	N46-K50 PolarHBondContact O-N 2.97Å; T47-K50 PolarHBondContact O-N 3.5Å; M48-K50 VanDerWaalsContact C-N 3.32Å; M48-K50 PolarHBondContact O-N 2.91Å; K50-R53 PolarHBondContact O-N 3.42Å; K50-V54 WeakPolarHBondContact O-CG2 3.28Å; K50-V54 PolarHBondContact O-N 3.03Å
51	K	77.3	Confident	77.3	Confident	123 Å²	123	52.8 Å²	52.8	54%	0.535	27%	0.273	S	S	.	.	H	α-helix	trans	-65.6	-47.4	176.9	-70.1	-179.6	-178.1	178.5	0	111.7	T47 M48 E49 R53 V54 I55	T47-K51 PolarHBondContact O-N 3.45Å; M48-K51 PolarHBondContact O-N 2.72Å; M48-K51 VanDerWaalsContact O-N 3.16Å; M48-K51 HydrophobicContact SD-CD 4.06Å; E49-K51 VanDerWaalsContact C-N 3.31Å; E49-K51 PolarHBondContact O-N 3.36Å; K51-R53 PolarHBondContact O-N 3.18Å; K51-V54 PolarHBondContact O-N 2.95Å; K51-I55 WeakPolarHBondContact O-CD1 3.39Å; K51-I55 VanDerWaalsContact O-CG1 3.31Å; K51-I55 WeakPolarHBondContact O-CG1 3.23Å; K51-I55 PolarHBondContact O-N 3.43Å
52	S	73.9	Confident	77.5	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.007	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-31.3	177.9	59.5	0	0	0	0	112.8	M48 E49 G56 D57	M48-S52 PolarHBondContact O-N 3.43Å; M48-S52 PolarHBondContact O-OG 3.29Å; E49-S52 WeakPolarHBondContact CA-OG 3.34Å; E49-S52 PolarHBondContact O-N 3.23Å; E49-S52 PolarHBondContact O-OG 3.41Å; S52-G56 PolarHBondContact O-N 2.89Å; S52-G56 VanDerWaalsContact O-N 3.08Å; S52-D57 PolarHBondContact O-N 3.06Å
53	R	74.3	Confident	77.8	Confident	51 Å²	51	56.7 Å²	56.7	19%	0.192	29%	0.294	C	S	.	.	H	α-helix	trans	-70.4	-41.9	177.7	-170.7	174.3	76.5	-125.2	3.2	112.7	E49 K50 K51 I55 G56 Q92 G93	E49-R53 WeakPolarHBondContact O-CB 3.22Å; E49-R53 PolarHBondContact O-N 3.35Å; E49-R53 IonicContact OE1-CZ 3.33Å; E49-R53 IonicContact OE1-NH1 2.61Å; E49-R53 PolarHBondContact OE1-NH1 3.04Å; E49-R53 IonicContact OE2-NH1 2.88Å; E49-R53 PolarHBondContact OE2-NH1 3.38Å; K50-R53 PolarHBondContact O-N 3.42Å; K51-R53 PolarHBondContact O-N 3.18Å; R53-I55 PolarHBondContact O-N 3.43Å; R53-G56 PolarHBondContact O-N 3.42Å; R53-Q92 PolarHBondContact NE-O 2.95Å; R53-G93 VanDerWaalsContact CD-O 3.25Å; R53-G93 WeakPolarHBondContact CD-O 3.32Å; R53-G93 VanDerWaalsContact CG-O 3.23Å; R53-G93 WeakPolarHBondContact CG-O 3.22Å
54	V	79	Confident	77.7	Confident	99 Å²	99	50.2 Å²	50.2	60%	0.6	26%	0.264	S	S	*	.	H	α-helix	trans	-64.7	-33.9	177.9	175.6	0	0	0	0	110.9	F11 K50 K51	F11-V54 HydrophobicContact CE1-CG1 4.41Å; F11-V54 HydrophobicContact CZ-CG1 3.86Å; K50-V54 WeakPolarHBondContact O-CG2 3.28Å; K50-V54 PolarHBondContact O-N 3.03Å; K51-V54 PolarHBondContact O-N 2.95Å
55	I	76.3	Confident	77.8	Confident	66 Å²	66	45.9 Å²	45.9	34%	0.338	24%	0.241	S	C	.	.	H	α-helix	trans	-80.4	-24.2	-178.7	-59.3	163.9	0	0	0	112	F11 I18 K51 R53	F11-I55 HydrophobicContact CE1-CG1 3.88Å; F11-I55 HydrophobicContact CZ-CG1 4.14Å; I18-I55 HydrophobicContact CD1-CB 4.34Å; I18-I55 HydrophobicContact CD1-CD1 3.43Å; I18-I55 VanDerWaalsContact CD1-CD1 3.43Å; I18-I55 HydrophobicContact CD1-CG1 4.34Å; I18-I55 HydrophobicContact CD1-CG2 3.67Å; I18-I55 HydrophobicContact CG1-CD1 4.09Å; K51-I55 WeakPolarHBondContact O-CD1 3.39Å; K51-I55 VanDerWaalsContact O-CG1 3.31Å; K51-I55 WeakPolarHBondContact O-CG1 3.23Å; K51-I55 PolarHBondContact O-N 3.43Å; R53-I55 PolarHBondContact O-N 3.43Å
56	G	72.8	Confident	78	Confident	45 Å²	45	47.5 Å²	47.5	46%	0.464	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	9.3	177.3	0	0	0	0	0	115.1	S52 R53 A58	S52-G56 PolarHBondContact O-N 2.89Å; S52-G56 VanDerWaalsContact O-N 3.08Å; R53-G56 PolarHBondContact O-N 3.42Å; G56-A58 PolarHBondContact O-N 2.54Å; G56-A58 VanDerWaalsContact O-N 3.07Å
57	D	76.2	Confident	77.9	Confident	10 Å²	10	46.4 Å²	46.4	5%	0.053	25%	0.247	C	C	.	.			trans	-72.2	102.5	176.3	-180	-1.9	0	0	0	110.9	S52 K59 S60 N61	S52-D57 PolarHBondContact O-N 3.06Å; D57-K59 PolarHBondContact O-N 3.38Å; D57-K59 PolarHBondContact OD1-N 3.02Å; D57-S60 PolarHBondContact OD1-N 3.13Å; D57-S60 WeakPolarHBondContact OD2-CB 3.01Å; D57-S60 PolarHBondContact OD2-OG 2.94Å; D57-N61 VanDerWaalsContact O-CB 3.24Å; D57-N61 WeakPolarHBondContact O-CB 3.26Å; D57-N61 PolarHBondContact O-N 3.48Å
58	A	74.6	Confident	77.7	Confident	22 Å²	22	42.8 Å²	42.8	18%	0.182	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-36.1	-178.2	0	0	0	0	0	113.4	G56 S62 I95	G56-A58 PolarHBondContact O-N 2.54Å; G56-A58 VanDerWaalsContact O-N 3.07Å; A58-S62 VanDerWaalsContact O-CB 3.29Å; A58-S62 WeakPolarHBondContact O-CB 3.4Å; A58-S62 PolarHBondContact O-N 3.12Å; A58-S62 PolarHBondContact O-OG 3.42Å; A58-I95 HydrophobicContact CB-CG2 3.65Å
59	K	78.3	Confident	77.7	Confident	160 Å²	160	41.6 Å²	41.6	70%	0.696	22%	0.219	S	C	*	.	H	α-helix	trans	-71.9	-51.2	-174.3	-70.2	177.7	-177.3	168.9	0	110.2	D57 N61 S62 L63	D57-K59 PolarHBondContact O-N 3.38Å; D57-K59 PolarHBondContact OD1-N 3.02Å; K59-N61 VanDerWaalsContact C-N 3.34Å; K59-N61 PolarHBondContact O-N 3.29Å; K59-S62 PolarHBondContact O-N 3.18Å; K59-S62 PolarHBondContact O-OG 2.99Å; K59-L63 WeakPolarHBondContact O-CG 3.49Å; K59-L63 PolarHBondContact O-N 3.2Å; K59-L63 VanDerWaalsContact O-N 3.13Å
60	S	76.4	Confident	77.7	Confident	2 Å²	2	44 Å²	44	1%	0.014	23%	0.232	C	C	.	.	H	α-helix	trans	-66.2	-38.2	-179.2	-58.2	0	0	0	0	111.8	D57 L63 L64	D57-S60 PolarHBondContact OD1-N 3.13Å; D57-S60 WeakPolarHBondContact OD2-CB 3.01Å; D57-S60 PolarHBondContact OD2-OG 2.94Å; S60-L63 PolarHBondContact O-N 2.83Å; S60-L64 WeakPolarHBondContact O-CG 3.49Å; S60-L64 PolarHBondContact O-N 3.43Å
61	N	80.2	Confident	77.4	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-65.4	-41.5	175.5	-167.4	16.4	0	0	0	112.1	E49 D57 K59 L63 L64 Q65 I95 A98	E49-N61 WeakPolarHBondContact CG-OD1 3.25Å; D57-N61 VanDerWaalsContact O-CB 3.24Å; D57-N61 WeakPolarHBondContact O-CB 3.26Å; D57-N61 PolarHBondContact O-N 3.48Å; K59-N61 VanDerWaalsContact C-N 3.34Å; K59-N61 PolarHBondContact O-N 3.29Å; N61-L63 VanDerWaalsContact C-N 3.32Å; N61-L63 PolarHBondContact O-N 3.47Å; N61-L64 PolarHBondContact O-N 3.23Å; N61-Q65 WeakPolarHBondContact O-CG 3.47Å; N61-Q65 PolarHBondContact O-N 2.97Å; N61-I95 HydrophobicContact CB-CD1 4.09Å; N61-A98 HydrophobicContact CB-CB 4.33Å
62	S	77.3	Confident	77.3	Confident	13 Å²	13	31.9 Å²	31.9	9%	0.091	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-40.3	176.9	74.8	0	0	0	0	112.5	A58 K59 Q65 V66	A58-S62 VanDerWaalsContact O-CB 3.29Å; A58-S62 WeakPolarHBondContact O-CB 3.4Å; A58-S62 PolarHBondContact O-N 3.12Å; A58-S62 PolarHBondContact O-OG 3.42Å; K59-S62 PolarHBondContact O-N 3.18Å; K59-S62 PolarHBondContact O-OG 2.99Å; S62-Q65 PolarHBondContact O-N 3.14Å; S62-V66 WeakPolarHBondContact O-CB 3.38Å; S62-V66 VanDerWaalsContact O-CG2 3.24Å; S62-V66 WeakPolarHBondContact O-CG2 3.4Å; S62-V66 PolarHBondContact O-N 3.15Å
63	L	80.5	Confident	77.1	Confident	90 Å²	90	33.9 Å²	33.9	47%	0.471	19%	0.188	S	C	.	.	H	α-helix	trans	-66.6	-41.9	177.2	-71.1	172	0	0	0	111.8	L26 K59 S60 N61 V66 A67	L26-L63 HydrophobicContact CD1-CB 4.45Å; K59-L63 WeakPolarHBondContact O-CG 3.49Å; K59-L63 PolarHBondContact O-N 3.2Å; K59-L63 VanDerWaalsContact O-N 3.13Å; S60-L63 PolarHBondContact O-N 2.83Å; N61-L63 VanDerWaalsContact C-N 3.32Å; N61-L63 PolarHBondContact O-N 3.47Å; L63-V66 PolarHBondContact O-N 2.68Å; L63-A67 VanDerWaalsContact O-CB 3.27Å; L63-A67 WeakPolarHBondContact O-CB 3.48Å; L63-A67 PolarHBondContact O-N 3.38Å
64	L	79.8	Confident	77	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-45.4	175.8	-76.1	168.8	0	0	0	111.7	V22 L26 M48 S60 N61 V66 A67 I68	V22-L64 HydrophobicContact CG1-CD1 3.97Å; V22-L64 HydrophobicContact CG1-CD2 3.84Å; V22-L64 HydrophobicContact CG1-CG 3.62Å; V22-L64 HydrophobicContact CG2-CD1 3.86Å; V22-L64 HydrophobicContact CG2-CG 4.45Å; L26-L64 HydrophobicContact CD2-CD2 4.05Å; L26-L64 HydrophobicContact CG-CD2 4.31Å; M48-L64 HydrophobicContact CB-CD1 4.11Å; M48-L64 HydrophobicContact CB-CD2 4.42Å; S60-L64 WeakPolarHBondContact O-CG 3.49Å; S60-L64 PolarHBondContact O-N 3.43Å; N61-L64 PolarHBondContact O-N 3.23Å; L64-V66 PolarHBondContact O-N 3.39Å; L64-A67 PolarHBondContact O-N 3.48Å; L64-I68 VanDerWaalsContact O-CG1 3.28Å; L64-I68 WeakPolarHBondContact O-CG1 3.48Å; L64-I68 PolarHBondContact O-N 3.01Å
65	Q	79.5	Confident	76.4	Confident	3 Å²	3	33.8 Å²	33.8	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-63.4	-42.3	178.2	-71.3	-177.6	-3	0	0	112	E49 N61 S62 A67 I68 V69 L88 A98 M102	E49-Q65 HydrophobicContact CG-CG 4.42Å; N61-Q65 WeakPolarHBondContact O-CG 3.47Å; N61-Q65 PolarHBondContact O-N 2.97Å; S62-Q65 PolarHBondContact O-N 3.14Å; Q65-A67 VanDerWaalsContact C-N 3.33Å; Q65-I68 PolarHBondContact O-N 3.33Å; Q65-V69 WeakPolarHBondContact O-CG2 2.82Å; Q65-V69 PolarHBondContact O-N 3.46Å; Q65-V69 VanDerWaalsContact O-N 3.11Å; Q65-L88 HydrophobicContact CG-CD2 4.48Å; Q65-A98 PolarHBondContact OE1-O 3.39Å; Q65-M102 HydrophobicContact CB-CB 4.15Å; Q65-M102 HydrophobicContact CB-CG 4.25Å; Q65-M102 HydrophobicContact CB-SD 4.22Å
66	V	81	Confident	75.9	Confident	35 Å²	35	33.2 Å²	33.2	21%	0.212	20%	0.203	C	C	.	.	H	α-helix	trans	-64.4	-40.1	174.6	172	0	0	0	0	110.8	S62 L63 L64 V69 N70 A105	S62-V66 WeakPolarHBondContact O-CB 3.38Å; S62-V66 VanDerWaalsContact O-CG2 3.24Å; S62-V66 WeakPolarHBondContact O-CG2 3.4Å; S62-V66 PolarHBondContact O-N 3.15Å; L63-V66 PolarHBondContact O-N 2.68Å; L64-V66 PolarHBondContact O-N 3.39Å; V66-V69 PolarHBondContact O-N 2.95Å; V66-N70 WeakPolarHBondContact O-CB 3.25Å; V66-N70 PolarHBondContact O-N 3.49Å; V66-N70 PolarHBondContact O-ND2 3Å; V66-N70 PolarHBondContact O-OD1 3.27Å; V66-A105 HydrophobicContact CG1-CB 4.09Å; V66-A105 HydrophobicContact CG2-CB 4.09Å
67	A	78.7	Confident	75.8	Confident	16 Å²	16	35.3 Å²	35.3	13%	0.132	20%	0.204	C	C	.	.	H	α-helix	trans	-64.8	-43.4	177.2	0	0	0	0	0	112.5	L26 M45 L63 L64 Q65 V69 N70 A71	L26-A67 HydrophobicContact CD2-CB 3.22Å; M45-A67 HydrophobicContact SD-CB 4.04Å; L63-A67 VanDerWaalsContact O-CB 3.27Å; L63-A67 WeakPolarHBondContact O-CB 3.48Å; L63-A67 PolarHBondContact O-N 3.38Å; L64-A67 PolarHBondContact O-N 3.48Å; Q65-A67 VanDerWaalsContact C-N 3.33Å; A67-V69 VanDerWaalsContact C-N 3.3Å; A67-V69 PolarHBondContact O-N 3.26Å; A67-N70 PolarHBondContact O-N 3.46Å; A67-A71 WeakPolarHBondContact O-CB 3.43Å; A67-A71 PolarHBondContact O-N 3.43Å
68	I	79.2	Confident	75.4	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57	-46.2	174.5	-70.9	165.4	0	0	0	110.5	L42 M45 L64 Q65 A71 C72 L88	L42-I68 HydrophobicContact CD2-CG2 3.83Å; M45-I68 HydrophobicContact CB-CD1 3.94Å; M45-I68 HydrophobicContact CB-CG1 3.54Å; M45-I68 HydrophobicContact CE-CG1 4.45Å; M45-I68 HydrophobicContact CG-CG1 4.33Å; M45-I68 HydrophobicContact SD-CG1 3.91Å; L64-I68 VanDerWaalsContact O-CG1 3.28Å; L64-I68 WeakPolarHBondContact O-CG1 3.48Å; L64-I68 PolarHBondContact O-N 3.01Å; Q65-I68 PolarHBondContact O-N 3.33Å; I68-A71 PolarHBondContact O-N 3.36Å; I68-C72 WeakPolarHBondContact O-CB 2.89Å; I68-C72 PolarHBondContact O-N 3.47Å; I68-C72 PolarHBondContact O-SG 3.32Å; I68-C72 VanDerWaalsContact O-SG 3.41Å; I68-L88 HydrophobicContact CD1-CD1 4.46Å; I68-L88 HydrophobicContact CG2-CD1 4.05Å
69	V	76.2	Confident	75.5	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-63.7	-42.8	177.8	168.2	0	0	0	0	111.3	Q65 V66 A67 C72 F73 L81 I85 M102 F109	Q65-V69 WeakPolarHBondContact O-CG2 2.82Å; Q65-V69 PolarHBondContact O-N 3.46Å; Q65-V69 VanDerWaalsContact O-N 3.11Å; V66-V69 PolarHBondContact O-N 2.95Å; A67-V69 VanDerWaalsContact C-N 3.3Å; A67-V69 PolarHBondContact O-N 3.26Å; V69-C72 PolarHBondContact O-N 3.47Å; V69-F73 WeakPolarHBondContact O-CB 3.4Å; V69-F73 PolarHBondContact O-N 2.84Å; V69-L81 HydrophobicContact CB-CD1 4.45Å; V69-L81 HydrophobicContact CG1-CD1 4.11Å; V69-I85 HydrophobicContact CG2-CG1 4.34Å; V69-M102 HydrophobicContact CG2-CG 3.69Å; V69-M102 HydrophobicContact CG2-SD 4.25Å; V69-F109 HydrophobicContact CG1-CD2 3.97Å; V69-F109 HydrophobicContact CG1-CE2 3.96Å
70	N	80.2	Confident	75.4	Confident	52 Å²	52	37.2 Å²	37.2	28%	0.278	22%	0.215	S	C	.	.	H	α-helix	trans	-64.5	-43.4	178.4	-66.1	-9.2	0	0	0	111.9	V66 A67 F73 N74 F109	V66-N70 WeakPolarHBondContact O-CB 3.25Å; V66-N70 PolarHBondContact O-N 3.49Å; V66-N70 PolarHBondContact O-ND2 3Å; V66-N70 PolarHBondContact O-OD1 3.27Å; A67-N70 PolarHBondContact O-N 3.46Å; N70-F73 PolarHBondContact O-N 2.93Å; N70-N74 WeakPolarHBondContact O-CB 3.41Å; N70-N74 VanDerWaalsContact O-CG 3.24Å; N70-N74 PolarHBondContact O-N 3.29Å; N70-N74 PolarHBondContact O-ND2 3.26Å; N70-F109 WeakPolarHBondContact OD1-CE2 3.35Å; N70-F109 WeakPolarHBondContact OD1-CZ 3.42Å
71	A	73.8	Confident	75.3	Confident	2 Å²	2	37.3 Å²	37.3	2%	0.017	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-48.4	177.5	0	0	0	0	0	111	E33 L42 M45 A67 I68 F73 N74 A75	E33-A71 HydrophobicContact CG-CB 4.15Å; E33-A71 WeakPolarHBondContact OE1-CB 3.29Å; L42-A71 HydrophobicContact CD2-CB 4.45Å; M45-A71 HydrophobicContact CE-CB 3.75Å; A67-A71 WeakPolarHBondContact O-CB 3.43Å; A67-A71 PolarHBondContact O-N 3.43Å; I68-A71 PolarHBondContact O-N 3.36Å; A71-F73 VanDerWaalsContact C-N 3.28Å; A71-F73 PolarHBondContact O-N 2.87Å; A71-N74 PolarHBondContact O-N 3.42Å; A71-A75 VanDerWaalsContact O-CB 3.31Å; A71-A75 WeakPolarHBondContact O-CB 3.2Å; A71-A75 PolarHBondContact O-N 3.17Å
72	C	74.1	Confident	75.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.8	-35.5	175.7	-77.5	0	0	0	0	112.5	L42 I68 V69 L81	L42-C72 VanDerWaalsContact CD2-SG 3.51Å; I68-C72 WeakPolarHBondContact O-CB 2.89Å; I68-C72 PolarHBondContact O-N 3.47Å; I68-C72 PolarHBondContact O-SG 3.32Å; I68-C72 VanDerWaalsContact O-SG 3.41Å; V69-C72 PolarHBondContact O-N 3.47Å; C72-L81 HydrophobicContact CB-CB 3.95Å; C72-L81 HydrophobicContact CB-CD1 3.48Å; C72-L81 VanDerWaalsContact CB-CD1 3.48Å; C72-L81 HydrophobicContact CB-CG 4.3Å
73	F	69.6	Low	75.3	Confident	42 Å²	42	40.6 Å²	40.6	18%	0.184	24%	0.236	C	C	.	.	H	α-helix	trans	-69.7	-45.5	176.4	-173.9	-95	0	0	0	111.9	V69 N70 A71 A75 G76 M78 F109 K112 I113	V69-F73 WeakPolarHBondContact O-CB 3.4Å; V69-F73 PolarHBondContact O-N 2.84Å; N70-F73 PolarHBondContact O-N 2.93Å; A71-F73 VanDerWaalsContact C-N 3.28Å; A71-F73 PolarHBondContact O-N 2.87Å; F73-A75 VanDerWaalsContact C-N 3.3Å; F73-A75 PolarHBondContact O-N 3.33Å; F73-G76 PolarHBondContact O-N 3.27Å; F73-G76 VanDerWaalsContact O-N 3.09Å; F73-M78 HydrophobicContact CD2-CE 4.33Å; F73-M78 HydrophobicContact CE2-CE 4.07Å; F73-F109 HydrophobicContact CB-CD1 4.39Å; F73-F109 AromaticContact CD1-CD1 3.65Å; F73-F109 HydrophobicContact CD1-CD1 3.65Å; F73-F109 AromaticContact CD1-CE1 3.86Å; F73-F109 HydrophobicContact CD1-CE1 3.86Å; F73-F109 HydrophobicContact CD2-CB 3.88Å; F73-F109 AromaticContact CD2-CD1 3.8Å; F73-F109 HydrophobicContact CD2-CD1 3.8Å; F73-F109 AromaticContact CD2-CG 3.92Å; F73-F109 HydrophobicContact CD2-CG 3.92Å; F73-F109 AromaticContact CE1-CD1 3.78Å; F73-F109 HydrophobicContact CE1-CD1 3.78Å; F73-F109 HydrophobicContact CE1-CE1 4.24Å; F73-F109 HydrophobicContact CE2-CB 3.84Å; F73-F109 AromaticContact CE2-CD1 3.92Å; F73-F109 HydrophobicContact CE2-CD1 3.92Å; F73-F109 HydrophobicContact CE2-CG 4.19Å; F73-F109 AromaticContact CG-CD1 3.66Å; F73-F109 HydrophobicContact CG-CD1 3.66Å; F73-F109 HydrophobicContact CG-CE1 4.09Å; F73-F109 HydrophobicContact CG-CG 4.1Å; F73-F109 HydrophobicContact CZ-CB 4.48Å; F73-F109 AromaticContact CZ-CD1 3.92Å; F73-F109 HydrophobicContact CZ-CD1 3.92Å; F73-K112 HydrophobicContact CZ-CB 4.3Å; F73-I113 HydrophobicContact CE2-CD1 4.1Å; F73-I113 HydrophobicContact CE2-CG1 3.71Å; F73-I113 HydrophobicContact CZ-CG1 4.41Å
74	N	72.8	Confident	75.2	Confident	117 Å²	117	37 Å²	37	63%	0.626	22%	0.219	S	C	*	.	H	α-helix	trans	-65.4	-34.2	179.4	-69	-17	0	0	0	112.2	N70 A71 G76	N70-N74 WeakPolarHBondContact O-CB 3.41Å; N70-N74 VanDerWaalsContact O-CG 3.24Å; N70-N74 PolarHBondContact O-N 3.29Å; N70-N74 PolarHBondContact O-ND2 3.26Å; A71-N74 PolarHBondContact O-N 3.42Å; N74-G76 PolarHBondContact O-N 3.47Å
75	A	66.6	Low	75.1	Confident	31 Å²	31	37.1 Å²	37.1	26%	0.256	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-15.6	173.5	0	0	0	0	0	114.2	I38 A71 F73 N77	I38-A75 HydrophobicContact CB-CB 4.42Å; I38-A75 HydrophobicContact CD1-CB 3.39Å; I38-A75 HydrophobicContact CG1-CB 3.85Å; I38-A75 HydrophobicContact CG2-CB 3.8Å; A71-A75 VanDerWaalsContact O-CB 3.31Å; A71-A75 WeakPolarHBondContact O-CB 3.2Å; A71-A75 PolarHBondContact O-N 3.17Å; F73-A75 VanDerWaalsContact C-N 3.3Å; F73-A75 PolarHBondContact O-N 3.33Å; A75-N77 PolarHBondContact O-N 2.81Å; A75-N77 VanDerWaalsContact O-N 3.07Å
76	G	66	Low	75.2	Confident	54 Å²	54	40.2 Å²	40.2	56%	0.557	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.1	1.3	-179.3	0	0	0	0	0	115	F73 N74 M78	F73-G76 PolarHBondContact O-N 3.27Å; F73-G76 VanDerWaalsContact O-N 3.09Å; N74-G76 PolarHBondContact O-N 3.47Å; G76-M78 PolarHBondContact O-N 3.26Å
77	N	71.1	Confident	75.3	Confident	90 Å²	90	43.4 Å²	43.4	48%	0.481	25%	0.246	S	C	.	.			trans	-95.3	89.2	-176.1	-150.2	-3.8	0	0	0	110.2	A75 E79 T80 L81	A75-N77 PolarHBondContact O-N 2.81Å; A75-N77 VanDerWaalsContact O-N 3.07Å; N77-E79 VanDerWaalsContact C-N 3.35Å; N77-E79 PolarHBondContact O-N 3.45Å; N77-T80 WeakPolarHBondContact CB-OG1 3.38Å; N77-T80 PolarHBondContact O-N 2.96Å; N77-T80 PolarHBondContact O-OG1 3.16Å; N77-L81 PolarHBondContact O-N 3.3Å
78	M	68.3	Low	75.2	Confident	43 Å²	43	42.8 Å²	42.8	21%	0.212	24%	0.241	C	C	.	.	H	α-helix	trans	-70.4	-26.7	-168.7	-67	-64.5	-162.4	0	0	113.9	F73 G76 L81 I82 I113 F118	F73-M78 HydrophobicContact CD2-CE 4.33Å; F73-M78 HydrophobicContact CE2-CE 4.07Å; G76-M78 PolarHBondContact O-N 3.26Å; M78-L81 WeakPolarHBondContact O-CB 3.26Å; M78-L81 PolarHBondContact O-N 3.2Å; M78-L81 HydrophobicContact SD-CD2 4.13Å; M78-I82 WeakPolarHBondContact O-CG1 3.43Å; M78-I82 PolarHBondContact O-N 3.1Å; M78-I113 HydrophobicContact CE-CD1 3.72Å; M78-I113 HydrophobicContact CE-CG1 3.68Å; M78-I113 HydrophobicContact CE-CG2 4.19Å; M78-I113 HydrophobicContact SD-CD1 4.35Å; M78-F118 HydrophobicContact CB-CD1 4.39Å
79	E	75.5	Confident	75	Confident	134 Å²	134	43.2 Å²	43.2	63%	0.626	24%	0.244	S	C	*	.	H	α-helix	trans	-70.8	-39.9	176.9	-67.2	-176.9	172	0	0	111.4	N77 L81 I82 S83	N77-E79 VanDerWaalsContact C-N 3.35Å; N77-E79 PolarHBondContact O-N 3.45Å; E79-L81 VanDerWaalsContact C-N 3.25Å; E79-L81 PolarHBondContact O-N 3.01Å; E79-I82 PolarHBondContact O-N 3.49Å; E79-S83 PolarHBondContact O-N 3.09Å
80	T	75.6	Confident	75.1	Confident	54 Å²	54	52.4 Å²	52.4	33%	0.331	28%	0.278	S	S	.	.	H	α-helix	trans	-65.6	-31.9	173.4	48.2	0	0	0	0	111.7	N77 S84	N77-T80 WeakPolarHBondContact CB-OG1 3.38Å; N77-T80 PolarHBondContact O-N 2.96Å; N77-T80 PolarHBondContact O-OG1 3.16Å; T80-S84 VanDerWaalsContact O-CB 3.23Å; T80-S84 WeakPolarHBondContact O-CB 3.31Å; T80-S84 PolarHBondContact O-N 3.39Å; T80-S84 PolarHBondContact O-OG 2.67Å
81	L	75.7	Confident	74.6	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-50.5	172.9	179	66	0	0	0	111.4	V69 C72 N77 M78 E79 S83 S84 I85	V69-L81 HydrophobicContact CB-CD1 4.45Å; V69-L81 HydrophobicContact CG1-CD1 4.11Å; C72-L81 HydrophobicContact CB-CB 3.95Å; C72-L81 HydrophobicContact CB-CD1 3.48Å; C72-L81 VanDerWaalsContact CB-CD1 3.48Å; C72-L81 HydrophobicContact CB-CG 4.3Å; N77-L81 PolarHBondContact O-N 3.3Å; M78-L81 WeakPolarHBondContact O-CB 3.26Å; M78-L81 PolarHBondContact O-N 3.2Å; M78-L81 HydrophobicContact SD-CD2 4.13Å; E79-L81 VanDerWaalsContact C-N 3.25Å; E79-L81 PolarHBondContact O-N 3.01Å; L81-S83 PolarHBondContact O-N 2.84Å; L81-S84 PolarHBondContact O-N 3.33Å; L81-I85 HydrophobicContact CD1-CD1 3.91Å; L81-I85 HydrophobicContact CD1-CG1 4.29Å; L81-I85 HydrophobicContact CG-CD1 3.86Å; L81-I85 VanDerWaalsContact O-CG1 3.28Å; L81-I85 WeakPolarHBondContact O-CG1 3.47Å; L81-I85 PolarHBondContact O-N 3.44Å
82	I	76.5	Confident	73.8	Confident	33 Å²	33	61.1 Å²	61.1	17%	0.169	32%	0.316	C	S	.	.	H	α-helix	trans	-55.9	-51.8	177.7	-77	168.3	0	0	0	110.3	M78 E79 S84 I85 E86 K121 L122 L125	M78-I82 WeakPolarHBondContact O-CG1 3.43Å; M78-I82 PolarHBondContact O-N 3.1Å; E79-I82 PolarHBondContact O-N 3.49Å; I82-S84 VanDerWaalsContact C-N 3.33Å; I82-S84 PolarHBondContact O-N 3.38Å; I82-I85 PolarHBondContact O-N 3Å; I82-E86 PolarHBondContact O-N 3.22Å; I82-K121 HydrophobicContact CD1-CB 4.43Å; I82-L122 HydrophobicContact CG1-CD1 4.17Å; I82-L125 HydrophobicContact CB-CD1 4Å; I82-L125 HydrophobicContact CG1-CD1 4.24Å; I82-L125 HydrophobicContact CG2-CD1 3.19Å
83	S	80.9	Confident	73.3	Confident	50 Å²	50	63.8 Å²	63.8	35%	0.35	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-41.8	179.3	-172.9	0	0	0	0	112.2	E79 L81 I85 E86 Q87	E79-S83 PolarHBondContact O-N 3.09Å; L81-S83 PolarHBondContact O-N 2.84Å; S83-I85 PolarHBondContact O-N 3.19Å; S83-E86 PolarHBondContact O-N 3.1Å; S83-Q87 WeakPolarHBondContact O-CB 3.39Å; S83-Q87 VanDerWaalsContact O-CG 3.31Å; S83-Q87 WeakPolarHBondContact O-CG 3.47Å; S83-Q87 PolarHBondContact O-N 3.15Å
84	S	77.5	Confident	73.1	Confident	16 Å²	16	64.8 Å²	64.8	11%	0.112	35%	0.351	C	S	.	.	H	α-helix	trans	-63.9	-40.4	178.1	-60.8	0	0	0	0	111.9	T80 L81 I82 Q87 L88	T80-S84 VanDerWaalsContact O-CB 3.23Å; T80-S84 WeakPolarHBondContact O-CB 3.31Å; T80-S84 PolarHBondContact O-N 3.39Å; T80-S84 PolarHBondContact O-OG 2.67Å; L81-S84 PolarHBondContact O-N 3.33Å; I82-S84 VanDerWaalsContact C-N 3.33Å; I82-S84 PolarHBondContact O-N 3.38Å; S84-Q87 PolarHBondContact O-N 2.92Å; S84-L88 WeakPolarHBondContact O-CB 3.25Å; S84-L88 VanDerWaalsContact O-CG 3.25Å; S84-L88 WeakPolarHBondContact O-CG 3.44Å; S84-L88 PolarHBondContact O-N 2.88Å
85	I	79.1	Confident	73.1	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-66.1	-43.5	177.3	-67.8	167.2	0	0	0	110.6	V69 L81 I82 S83 Q87 L88 A89 M102 L122 L125 L126 I129	V69-I85 HydrophobicContact CG2-CG1 4.34Å; L81-I85 HydrophobicContact CD1-CD1 3.91Å; L81-I85 HydrophobicContact CD1-CG1 4.29Å; L81-I85 HydrophobicContact CG-CD1 3.86Å; L81-I85 VanDerWaalsContact O-CG1 3.28Å; L81-I85 WeakPolarHBondContact O-CG1 3.47Å; L81-I85 PolarHBondContact O-N 3.44Å; I82-I85 PolarHBondContact O-N 3Å; S83-I85 PolarHBondContact O-N 3.19Å; I85-Q87 PolarHBondContact O-N 3.09Å; I85-L88 PolarHBondContact O-N 3.34Å; I85-A89 VanDerWaalsContact O-CB 3.22Å; I85-A89 WeakPolarHBondContact O-CB 3.14Å; I85-A89 PolarHBondContact O-N 3.4Å; I85-M102 HydrophobicContact CG2-CE 4.42Å; I85-L122 HydrophobicContact CD1-CD1 3.91Å; I85-L125 HydrophobicContact CB-CD2 4.27Å; I85-L125 HydrophobicContact CG2-CD2 3.71Å; I85-L126 HydrophobicContact CG2-CD2 4.23Å; I85-I129 HydrophobicContact CG2-CD1 3.64Å
86	E	80.8	Confident	73.7	Confident	68 Å²	68	65.9 Å²	65.9	32%	0.318	35%	0.345	S	S	.	.	H	α-helix	trans	-60.9	-45.3	176	-73.1	-178	158.4	0	0	112	I82 S83 A89 R90 L125	I82-E86 PolarHBondContact O-N 3.22Å; S83-E86 PolarHBondContact O-N 3.1Å; E86-A89 PolarHBondContact O-N 2.74Å; E86-R90 WeakPolarHBondContact O-CB 3.47Å; E86-R90 WeakPolarHBondContact O-CG 3.35Å; E86-R90 PolarHBondContact O-N 3.46Å; E86-L125 HydrophobicContact CG-CD1 3.6Å; E86-L125 HydrophobicContact CG-CD2 4.31Å; E86-L125 HydrophobicContact CG-CG 3.99Å; E86-L125 WeakPolarHBondContact OE1-CD1 3.11Å
87	Q	82.2	Confident	74.2	Confident	103 Å²	103	68.9 Å²	68.9	48%	0.481	35%	0.345	S	S	.	.	H	α-helix	trans	-61.7	-46.5	178	-73.8	-178.2	0.1	0	0	111.2	S83 S84 I85 A89 R90 K91	S83-Q87 WeakPolarHBondContact O-CB 3.39Å; S83-Q87 VanDerWaalsContact O-CG 3.31Å; S83-Q87 WeakPolarHBondContact O-CG 3.47Å; S83-Q87 PolarHBondContact O-N 3.15Å; S84-Q87 PolarHBondContact O-N 2.92Å; I85-Q87 PolarHBondContact O-N 3.09Å; Q87-A89 VanDerWaalsContact C-N 3.3Å; Q87-A89 PolarHBondContact O-N 3.28Å; Q87-R90 PolarHBondContact O-N 3.25Å; Q87-K91 WeakPolarHBondContact O-CD 3.47Å; Q87-K91 WeakPolarHBondContact O-CG 3.22Å; Q87-K91 PolarHBondContact O-N 2.92Å
88	L	77	Confident	74.5	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-64.1	-34.8	178	-71.4	171.8	0	0	0	112.3	E49 Q65 I68 S84 I85 K91 L94 M102	E49-L88 HydrophobicContact CG-CD2 4.08Å; Q65-L88 HydrophobicContact CG-CD2 4.48Å; I68-L88 HydrophobicContact CD1-CD1 4.46Å; I68-L88 HydrophobicContact CG2-CD1 4.05Å; S84-L88 WeakPolarHBondContact O-CB 3.25Å; S84-L88 VanDerWaalsContact O-CG 3.25Å; S84-L88 WeakPolarHBondContact O-CG 3.44Å; S84-L88 PolarHBondContact O-N 2.88Å; I85-L88 PolarHBondContact O-N 3.34Å; L88-K91 HydrophobicContact CD2-CD 4.47Å; L88-L94 VanDerWaalsContact O-CD2 3.25Å; L88-L94 WeakPolarHBondContact O-CD2 3.28Å; L88-M102 HydrophobicContact CB-CE 4.33Å; L88-M102 HydrophobicContact CB-SD 3.93Å; L88-M102 HydrophobicContact CD1-SD 3.75Å; L88-M102 HydrophobicContact CG-SD 4.49Å
89	A	75.8	Confident	75	Confident	9 Å²	9	62.6 Å²	62.6	7%	0.074	31%	0.312	C	S	.	.	H	α-helix	trans	-79.4	-24.6	-179	0	0	0	0	0	115.1	I85 E86 Q87 I129	I85-A89 VanDerWaalsContact O-CB 3.22Å; I85-A89 WeakPolarHBondContact O-CB 3.14Å; I85-A89 PolarHBondContact O-N 3.4Å; E86-A89 PolarHBondContact O-N 2.74Å; Q87-A89 VanDerWaalsContact C-N 3.3Å; Q87-A89 PolarHBondContact O-N 3.28Å; A89-I129 HydrophobicContact CB-CB 4.34Å; A89-I129 HydrophobicContact CB-CD1 3.62Å; A89-I129 HydrophobicContact CB-CG1 3.85Å; A89-I129 HydrophobicContact CB-CG2 3.55Å
90	R	77	Confident	75.3	Confident	194 Å²	194	56.6 Å²	56.6	73%	0.732	29%	0.286	S	S	*	.	H	α-helix	trans	-94.6	-11.6	-178.3	-70.1	-176.2	-175.8	-158.3	3.9	114.6	E86 Q87	E86-R90 WeakPolarHBondContact O-CB 3.47Å; E86-R90 WeakPolarHBondContact O-CG 3.35Å; E86-R90 PolarHBondContact O-N 3.46Å; Q87-R90 PolarHBondContact O-N 3.25Å
91	K	70.8	Confident	75.4	Confident	54 Å²	54	56 Å²	56	24%	0.235	28%	0.281	C	S	.	.	S	Bend	trans	-62.8	137.5	-176.6	-84	160	171.6	-173.7	0	112.5	N46 E49 Q87 L88 L94	N46-K91 PolarHBondContact OD1-NZ 3.28Å; E49-K91 IonicContact OE2-NZ 2.69Å; E49-K91 PolarHBondContact OE2-NZ 3.2Å; Q87-K91 WeakPolarHBondContact O-CD 3.47Å; Q87-K91 WeakPolarHBondContact O-CG 3.22Å; Q87-K91 PolarHBondContact O-N 2.92Å; L88-K91 HydrophobicContact CD2-CD 4.47Å; K91-L94 WeakPolarHBondContact O-CD1 3.24Å; K91-L94 WeakPolarHBondContact O-CG 3.37Å
92	Q	56.3	Low	75.6	Confident	184 Å²	184	55.9 Å²	55.9	86%	0.86	28%	0.28	S	S	*	.	S	Bend	trans	-68.6	138	174.1	-75	-177.8	-19.3	0	0	111.6	R53	R53-Q92 PolarHBondContact NE-O 2.95Å
93	G	63.4	Low	75.8	Confident	56 Å²	56	54.3 Å²	54.3	58%	0.577	27%	0.272	S	S	*	.	S	Bend	trans	88.9	35.1	-179.3	0	0	0	0	0	115	R53 I95	R53-G93 VanDerWaalsContact CD-O 3.25Å; R53-G93 WeakPolarHBondContact CD-O 3.32Å; R53-G93 VanDerWaalsContact CG-O 3.23Å; R53-G93 WeakPolarHBondContact CG-O 3.22Å; G93-I95 PolarHBondContact O-N 3.2Å
94	L	66.9	Low	75.8	Confident	62 Å²	62	57.7 Å²	57.7	33%	0.325	28%	0.277	S	S	.	.			trans	-65.8	128.3	-177.5	-64.2	120.2	0	0	0	112.3	L88 K91 K96 V99	L88-L94 VanDerWaalsContact O-CD2 3.25Å; L88-L94 WeakPolarHBondContact O-CD2 3.28Å; K91-L94 WeakPolarHBondContact O-CD1 3.24Å; K91-L94 WeakPolarHBondContact O-CG 3.37Å; L94-K96 PolarHBondContact O-N 3.37Å; L94-V99 HydrophobicContact CB-CG2 4.17Å; L94-V99 HydrophobicContact CD2-CG2 3.45Å; L94-V99 VanDerWaalsContact CD2-CG2 3.45Å; L94-V99 HydrophobicContact CG-CG2 4.42Å
95	I	73	Confident	75.9	Confident	28 Å²	28	57.7 Å²	57.7	14%	0.144	28%	0.278	C	S	.	.			trans	-76.7	113	164.1	-55.6	-178	0	0	0	107.6	A58 N61 G93 E97 A98 V99	A58-I95 HydrophobicContact CB-CG2 3.65Å; N61-I95 HydrophobicContact CB-CD1 4.09Å; G93-I95 PolarHBondContact O-N 3.2Å; I95-E97 VanDerWaalsContact C-N 3.28Å; I95-E97 HydrophobicContact CG2-CB 4.47Å; I95-E97 PolarHBondContact O-N 3.27Å; I95-A98 HydrophobicContact CB-CB 4.08Å; I95-A98 HydrophobicContact CG2-CB 4.3Å; I95-A98 PolarHBondContact O-N 3.01Å; I95-A98 VanDerWaalsContact O-N 3.16Å; I95-V99 PolarHBondContact O-N 2.93Å
96	K	77.3	Confident	75.8	Confident	144 Å²	144	57.8 Å²	57.8	63%	0.626	28%	0.279	S	S	*	.	H	α-helix	trans	-56.1	-40.8	-174.4	-63.6	179.3	-177.5	175.8	0	112.6	L94 G100 Y135	L94-K96 PolarHBondContact O-N 3.37Å; K96-G100 PolarHBondContact O-N 3Å; K96-Y135 HydrophobicContact CB-CD1 4.06Å; K96-Y135 HydrophobicContact CB-CE1 3.85Å; K96-Y135 HydrophobicContact CB-CE2 4.41Å; K96-Y135 HydrophobicContact CB-CG 4.42Å; K96-Y135 HydrophobicContact CD-CD1 4.16Å; K96-Y135 HydrophobicContact CD-CE1 4.07Å; K96-Y135 HydrophobicContact CG-CD1 4.24Å; K96-Y135 HydrophobicContact CG-CE1 3.79Å; K96-Y135 VanDerWaalsContact O-CE2 3.26Å; K96-Y135 WeakPolarHBondContact O-CE2 3.47Å
97	E	78.1	Confident	75.5	Confident	117 Å²	117	55.4 Å²	55.4	55%	0.547	27%	0.27	S	S	.	.	H	α-helix	trans	-65.9	-41.2	179.6	-169.9	179.1	175.8	0	0	112.6	I95 G100 N101	I95-E97 VanDerWaalsContact C-N 3.28Å; I95-E97 HydrophobicContact CG2-CB 4.47Å; I95-E97 PolarHBondContact O-N 3.27Å; E97-G100 PolarHBondContact O-N 3.47Å; E97-N101 PolarHBondContact O-N 2.99Å
98	A	77.7	Confident	75.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-45.6	178.9	0	0	0	0	0	111.4	N61 Q65 I95 G100 N101 M102	N61-A98 HydrophobicContact CB-CB 4.33Å; Q65-A98 PolarHBondContact OE1-O 3.39Å; I95-A98 HydrophobicContact CB-CB 4.08Å; I95-A98 HydrophobicContact CG2-CB 4.3Å; I95-A98 PolarHBondContact O-N 3.01Å; I95-A98 VanDerWaalsContact O-N 3.16Å; A98-G100 VanDerWaalsContact C-N 3.35Å; A98-G100 PolarHBondContact O-N 2.89Å; A98-N101 PolarHBondContact O-N 3.41Å; A98-M102 WeakPolarHBondContact O-CB 3.41Å; A98-M102 PolarHBondContact O-N 2.76Å
99	V	78.8	Confident	75	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-40	176.8	179.6	0	0	0	0	111.3	L94 I95 M102 I103 Y135	L94-V99 HydrophobicContact CB-CG2 4.17Å; L94-V99 HydrophobicContact CD2-CG2 3.45Å; L94-V99 VanDerWaalsContact CD2-CG2 3.45Å; L94-V99 HydrophobicContact CG-CG2 4.42Å; I95-V99 PolarHBondContact O-N 2.93Å; V99-M102 HydrophobicContact CG1-CE 4.39Å; V99-M102 PolarHBondContact O-N 3.26Å; V99-I103 HydrophobicContact CG1-CD1 3.77Å; V99-I103 HydrophobicContact CG1-CG1 4.42Å; V99-I103 WeakPolarHBondContact O-CD1 3.45Å; V99-I103 VanDerWaalsContact O-CG1 3.24Å; V99-I103 WeakPolarHBondContact O-CG1 3.39Å; V99-I103 PolarHBondContact O-N 2.97Å; V99-Y135 HydrophobicContact CB-CE2 4.39Å; V99-Y135 HydrophobicContact CG1-CE2 4.42Å
100	G	80.1	Confident	74.7	Confident	8 Å²	8	53.7 Å²	53.7	8%	0.082	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-43.8	175.3	0	0	0	0	0	112.8	K96 E97 A98 I103 R104	K96-G100 PolarHBondContact O-N 3Å; E97-G100 PolarHBondContact O-N 3.47Å; A98-G100 VanDerWaalsContact C-N 3.35Å; A98-G100 PolarHBondContact O-N 2.89Å; G100-I103 PolarHBondContact O-N 3.49Å; G100-R104 WeakPolarHBondContact O-CB 3.4Å; G100-R104 PolarHBondContact O-N 3.41Å
101	N	78.7	Confident	74.2	Confident	43 Å²	43	48.1 Å²	48.1	23%	0.23	26%	0.256	C	S	.	.	H	α-helix	trans	-68	-38.7	176.8	-71.5	-18	0	0	0	112.2	E97 A98 R104 A105	E97-N101 PolarHBondContact O-N 2.99Å; A98-N101 PolarHBondContact O-N 3.41Å; N101-R104 PolarHBondContact O-N 3.42Å; N101-R104 PolarHBondContact OD1-NH1 2.73Å; N101-A105 PolarHBondContact O-N 2.93Å
102	M	80.2	Confident	74.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.3	-49.2	172.7	-175.2	-172.3	70.5	0	0	111.2	Q65 V69 I85 L88 A98 V99 R104 A105 C106	Q65-M102 HydrophobicContact CB-CB 4.15Å; Q65-M102 HydrophobicContact CB-CG 4.25Å; Q65-M102 HydrophobicContact CB-SD 4.22Å; V69-M102 HydrophobicContact CG2-CG 3.69Å; V69-M102 HydrophobicContact CG2-SD 4.25Å; I85-M102 HydrophobicContact CG2-CE 4.42Å; L88-M102 HydrophobicContact CB-CE 4.33Å; L88-M102 HydrophobicContact CB-SD 3.93Å; L88-M102 HydrophobicContact CD1-SD 3.75Å; L88-M102 HydrophobicContact CG-SD 4.49Å; A98-M102 WeakPolarHBondContact O-CB 3.41Å; A98-M102 PolarHBondContact O-N 2.76Å; V99-M102 HydrophobicContact CG1-CE 4.39Å; V99-M102 PolarHBondContact O-N 3.26Å; M102-R104 VanDerWaalsContact C-N 3.32Å; M102-R104 PolarHBondContact O-N 3.17Å; M102-A105 WeakPolarHBondContact O-CB 3.49Å; M102-A105 PolarHBondContact O-N 3.31Å; M102-C106 PolarHBondContact O-N 2.94Å; M102-C106 PolarHBondContact O-SG 2.91Å
103	I	79.6	Confident	74.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.7	-41.3	178.5	-67.1	161.9	0	0	0	110.8	V99 G100 A105 C106 C107 I129 T130 A136 E139	V99-I103 HydrophobicContact CG1-CD1 3.77Å; V99-I103 HydrophobicContact CG1-CG1 4.42Å; V99-I103 WeakPolarHBondContact O-CD1 3.45Å; V99-I103 VanDerWaalsContact O-CG1 3.24Å; V99-I103 WeakPolarHBondContact O-CG1 3.39Å; V99-I103 PolarHBondContact O-N 2.97Å; G100-I103 PolarHBondContact O-N 3.49Å; I103-A105 VanDerWaalsContact C-N 3.33Å; I103-A105 PolarHBondContact O-N 2.92Å; I103-C106 CarbonylContact O-C 3.59Å; I103-C106 WeakPolarHBondContact O-CB 3.34Å; I103-C106 PolarHBondContact O-N 3.12Å; I103-C106 VanDerWaalsContact O-N 3.17Å; I103-C107 PolarHBondContact O-N 3.27Å; I103-C107 PolarHBondContact O-SG 3.16Å; I103-C107 VanDerWaalsContact O-SG 3.38Å; I103-I129 HydrophobicContact CD1-CG2 4.46Å; I103-T130 HydrophobicContact CD1-CG2 3.85Å; I103-T130 HydrophobicContact CG2-CG2 4.17Å; I103-A136 HydrophobicContact CD1-CB 4.04Å; I103-E139 HydrophobicContact CG2-CB 3.74Å; I103-E139 HydrophobicContact CG2-CG 4.09Å
104	R	82.5	Confident	74.9	Confident	122 Å²	122	47.9 Å²	47.9	46%	0.46	25%	0.249	S	C	.	.	H	α-helix	trans	-63.3	-39.7	177.1	-165.1	178.3	-59.1	116.8	2.2	112.1	G100 N101 M102 C107 S108 E139	G100-R104 WeakPolarHBondContact O-CB 3.4Å; G100-R104 PolarHBondContact O-N 3.41Å; N101-R104 PolarHBondContact O-N 3.42Å; N101-R104 PolarHBondContact OD1-NH1 2.73Å; M102-R104 VanDerWaalsContact C-N 3.32Å; M102-R104 PolarHBondContact O-N 3.17Å; R104-C107 PolarHBondContact O-N 3.08Å; R104-S108 PolarHBondContact O-N 2.86Å; R104-E139 IonicContact NE-OE1 2.79Å; R104-E139 PolarHBondContact NE-OE1 3.21Å
105	A	77.8	Confident	75	Confident	15 Å²	15	51.7 Å²	51.7	12%	0.124	26%	0.263	C	S	.	.	H	α-helix	trans	-61.5	-47.9	171.9	0	0	0	0	0	110.5	V66 N101 M102 I103 C107 S108 F109	V66-A105 HydrophobicContact CG1-CB 4.09Å; V66-A105 HydrophobicContact CG2-CB 4.09Å; N101-A105 PolarHBondContact O-N 2.93Å; M102-A105 WeakPolarHBondContact O-CB 3.49Å; M102-A105 PolarHBondContact O-N 3.31Å; I103-A105 VanDerWaalsContact C-N 3.33Å; I103-A105 PolarHBondContact O-N 2.92Å; A105-C107 PolarHBondContact O-N 2.82Å; A105-S108 WeakPolarHBondContact O-CB 3.46Å; A105-S108 PolarHBondContact O-N 3.22Å; A105-S108 PolarHBondContact O-OG 3.33Å; A105-F109 HydrophobicContact CB-CE2 4.23Å; A105-F109 WeakPolarHBondContact O-CD2 3.48Å; A105-F109 WeakPolarHBondContact O-CE2 3.43Å; A105-F109 PolarHBondContact O-N 3.39Å
106	C	77.8	Confident	74.8	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.02	28%	0.279	C	S	.	.	H	α-helix	trans	-54.8	-46.5	174.5	-65.4	0	0	0	0	112.3	M102 I103 S108 F109 V110 L126	M102-C106 PolarHBondContact O-N 2.94Å; M102-C106 PolarHBondContact O-SG 2.91Å; I103-C106 CarbonylContact O-C 3.59Å; I103-C106 WeakPolarHBondContact O-CB 3.34Å; I103-C106 PolarHBondContact O-N 3.12Å; I103-C106 VanDerWaalsContact O-N 3.17Å; C106-S108 PolarHBondContact O-N 3.42Å; C106-F109 WeakPolarHBondContact O-CB 3.28Å; C106-F109 PolarHBondContact O-N 3.16Å; C106-V110 WeakPolarHBondContact O-CG2 3.28Å; C106-V110 PolarHBondContact O-N 3.39Å; C106-L126 HydrophobicContact CB-CD1 4.03Å; C106-L126 HydrophobicContact CB-CD2 4.14Å
107	C	74.5	Confident	74.7	Confident	19 Å²	19	54.5 Å²	54.5	13%	0.128	28%	0.28	C	S	.	.	H	α-helix	trans	-55.4	-39.3	176.4	-72.1	0	0	0	0	112.5	I103 R104 A105 F109 V110 E139	I103-C107 PolarHBondContact O-N 3.27Å; I103-C107 PolarHBondContact O-SG 3.16Å; I103-C107 VanDerWaalsContact O-SG 3.38Å; R104-C107 PolarHBondContact O-N 3.08Å; A105-C107 PolarHBondContact O-N 2.82Å; C107-F109 VanDerWaalsContact C-N 3.3Å; C107-F109 PolarHBondContact O-N 2.88Å; C107-V110 PolarHBondContact O-N 3.02Å; C107-E139 PolarHBondContact SG-OE2 2.67Å
108	S	77.4	Confident	74.5	Confident	55 Å²	55	52 Å²	52	39%	0.385	27%	0.267	S	S	.	.	H	α-helix	trans	-70.1	-24.3	177.4	79.8	0	0	0	0	113.7	R104 A105 C106 S111	R104-S108 PolarHBondContact O-N 2.86Å; A105-S108 WeakPolarHBondContact O-CB 3.46Å; A105-S108 PolarHBondContact O-N 3.22Å; A105-S108 PolarHBondContact O-OG 3.33Å; C106-S108 PolarHBondContact O-N 3.42Å; S108-S111 PolarHBondContact O-OG 3.18Å
109	F	70.5	Confident	74.4	Confident	23 Å²	23	53.7 Å²	53.7	10%	0.101	27%	0.274	C	S	.	.	H	α-helix	trans	-81.5	-36	173.9	-67.4	-61	0	0	0	112.1	V69 N70 F73 A105 C106 C107 S111 K112 I113	V69-F109 HydrophobicContact CG1-CD2 3.97Å; V69-F109 HydrophobicContact CG1-CE2 3.96Å; N70-F109 WeakPolarHBondContact OD1-CE2 3.35Å; N70-F109 WeakPolarHBondContact OD1-CZ 3.42Å; F73-F109 HydrophobicContact CB-CD1 4.39Å; F73-F109 AromaticContact CD1-CD1 3.65Å; F73-F109 HydrophobicContact CD1-CD1 3.65Å; F73-F109 AromaticContact CD1-CE1 3.86Å; F73-F109 HydrophobicContact CD1-CE1 3.86Å; F73-F109 HydrophobicContact CD2-CB 3.88Å; F73-F109 AromaticContact CD2-CD1 3.8Å; F73-F109 HydrophobicContact CD2-CD1 3.8Å; F73-F109 AromaticContact CD2-CG 3.92Å; F73-F109 HydrophobicContact CD2-CG 3.92Å; F73-F109 AromaticContact CE1-CD1 3.78Å; F73-F109 HydrophobicContact CE1-CD1 3.78Å; F73-F109 HydrophobicContact CE1-CE1 4.24Å; F73-F109 HydrophobicContact CE2-CB 3.84Å; F73-F109 AromaticContact CE2-CD1 3.92Å; F73-F109 HydrophobicContact CE2-CD1 3.92Å; F73-F109 HydrophobicContact CE2-CG 4.19Å; F73-F109 AromaticContact CG-CD1 3.66Å; F73-F109 HydrophobicContact CG-CD1 3.66Å; F73-F109 HydrophobicContact CG-CE1 4.09Å; F73-F109 HydrophobicContact CG-CG 4.1Å; F73-F109 HydrophobicContact CZ-CB 4.48Å; F73-F109 AromaticContact CZ-CD1 3.92Å; F73-F109 HydrophobicContact CZ-CD1 3.92Å; A105-F109 HydrophobicContact CB-CE2 4.23Å; A105-F109 WeakPolarHBondContact O-CD2 3.48Å; A105-F109 WeakPolarHBondContact O-CE2 3.43Å; A105-F109 PolarHBondContact O-N 3.39Å; C106-F109 WeakPolarHBondContact O-CB 3.28Å; C106-F109 PolarHBondContact O-N 3.16Å; C107-F109 VanDerWaalsContact C-N 3.3Å; C107-F109 PolarHBondContact O-N 2.88Å; F109-S111 PolarHBondContact O-N 3.25Å; F109-S111 VanDerWaalsContact O-N 3.15Å; F109-K112 WeakPolarHBondContact O-CA 3.45Å; F109-K112 PolarHBondContact O-N 2.91Å; F109-I113 WeakPolarHBondContact O-CG1 3.36Å; F109-I113 PolarHBondContact O-N 2.91Å
110	V	69.6	Low	74.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-56.9	-32.5	178.2	179	0	0	0	0	111.5	C106 C107 K112 K119 L122 I123 L126 L143 M146	C106-V110 WeakPolarHBondContact O-CG2 3.28Å; C106-V110 PolarHBondContact O-N 3.39Å; C107-V110 PolarHBondContact O-N 3.02Å; V110-K112 VanDerWaalsContact C-N 3.32Å; V110-K112 PolarHBondContact O-N 3.47Å; V110-K119 HydrophobicContact CG1-CD 4.46Å; V110-K119 HydrophobicContact CG1-CG 3.84Å; V110-K119 WeakPolarHBondContact O-CE 3.42Å; V110-L122 HydrophobicContact CG2-CD2 3.77Å; V110-L122 HydrophobicContact CG2-CG 4.26Å; V110-I123 HydrophobicContact CG1-CD1 3.86Å; V110-I123 HydrophobicContact CG1-CG1 3.8Å; V110-L126 HydrophobicContact CG2-CD1 4.19Å; V110-L143 HydrophobicContact CG2-CD2 4.37Å; V110-M146 HydrophobicContact CB-SD 4.34Å; V110-M146 HydrophobicContact CG1-CE 4.33Å; V110-M146 HydrophobicContact CG1-SD 3.42Å; V110-M146 WeakPolarHBondContact CG1-SD 3.42Å
111	S	67.8	Low	74.6	Confident	77 Å²	77	59.9 Å²	59.9	54%	0.538	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-24	174.8	64	0	0	0	0	114.2	S108 F109	S108-S111 PolarHBondContact O-OG 3.18Å; F109-S111 PolarHBondContact O-N 3.25Å; F109-S111 VanDerWaalsContact O-N 3.15Å
112	K	72.2	Confident	74.6	Confident	139 Å²	139	58.1 Å²	58.1	60%	0.604	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-15.6	-179.3	-63.2	178.7	-178.3	176.2	0	113.7	F73 F109 V110 T114	F73-K112 HydrophobicContact CZ-CB 4.3Å; F109-K112 WeakPolarHBondContact O-CA 3.45Å; F109-K112 PolarHBondContact O-N 2.91Å; V110-K112 VanDerWaalsContact C-N 3.32Å; V110-K112 PolarHBondContact O-N 3.47Å; K112-T114 PolarHBondContact O-N 3.13Å
113	I	68.8	Low	74.7	Confident	16 Å²	16	58.1 Å²	58.1	8%	0.082	29%	0.291	C	S	.	.			trans	-76.9	122.2	-178.1	-63.5	168.8	0	0	0	110.4	F73 M78 F109 L122	F73-I113 HydrophobicContact CE2-CD1 4.1Å; F73-I113 HydrophobicContact CE2-CG1 3.71Å; F73-I113 HydrophobicContact CZ-CG1 4.41Å; M78-I113 HydrophobicContact CE-CD1 3.72Å; M78-I113 HydrophobicContact CE-CG1 3.68Å; M78-I113 HydrophobicContact CE-CG2 4.19Å; M78-I113 HydrophobicContact SD-CD1 4.35Å; F109-I113 WeakPolarHBondContact O-CG1 3.36Å; F109-I113 PolarHBondContact O-N 2.91Å; I113-L122 HydrophobicContact CD1-CD2 3.83Å
114	T	63.6	Low	74.9	Confident	135 Å²	135	62.4 Å²	62.4	83%	0.828	31%	0.311	S	S	*	.			trans	-85	-27.5	-179.9	37.1	0	0	0	0	114.4	K112 K116	K112-T114 PolarHBondContact O-N 3.13Å; T114-K116 PolarHBondContact O-N 2.87Å
115	K	68.2	Low	74.8	Confident	142 Å²	142	57.1 Å²	57.1	62%	0.617	29%	0.292	S	S	*	.			trans	-79.7	116.4	-179.2	-67.2	-174.5	179	177.4	0	111.5	F118 K119	K115-F118 HydrophobicContact CB-CD2 3.89Å; K115-F118 HydrophobicContact CD-CD2 3.92Å; K115-F118 HydrophobicContact CD-CE2 4.08Å; K115-K119 PolarHBondContact O-N 3.24Å
116	K	70.4	Confident	74.9	Confident	111 Å²	111	56.4 Å²	56.4	48%	0.483	29%	0.286	S	S	.	.	H	α-helix	trans	-62.3	-46.9	-173.5	-63.4	-163.8	-178.2	-156.4	0	113.8	T114 F118 K119 V120 E153	T114-K116 PolarHBondContact O-N 2.87Å; K116-F118 PolarHBondContact O-N 2.74Å; K116-K119 VanDerWaalsContact O-CB 3.32Å; K116-K119 WeakPolarHBondContact O-CB 3.29Å; K116-K119 PolarHBondContact O-N 2.92Å; K116-K119 VanDerWaalsContact O-N 3.15Å; K116-V120 PolarHBondContact O-N 2.97Å; K116-V120 VanDerWaalsContact O-N 3.11Å; K116-E153 IonicContact NZ-OE2 2.65Å; K116-E153 PolarHBondContact NZ-OE2 3.42Å
117	D	75.1	Confident	75	Confident	120 Å²	120	58 Å²	58	64%	0.642	29%	0.291	S	S	*	.	H	α-helix	trans	-64	-41	-175.4	-56.9	-23.6	0	0	0	112.9	K119 V120 K121	D117-K119 VanDerWaalsContact C-N 3.33Å; D117-V120 PolarHBondContact O-N 2.74Å; D117-K121 PolarHBondContact O-N 2.85Å
118	F	72.2	Confident	75.4	Confident	64 Å²	64	63.4 Å²	63.4	28%	0.281	32%	0.315	S	S	.	.	H	α-helix	trans	-70.3	-32.8	177.4	-68.6	-76.4	0	0	0	112	M78 K115 K116 V120 K121 L122	M78-F118 HydrophobicContact CB-CD1 4.39Å; K115-F118 HydrophobicContact CB-CD2 3.89Å; K115-F118 HydrophobicContact CD-CD2 3.92Å; K115-F118 HydrophobicContact CD-CE2 4.08Å; K116-F118 PolarHBondContact O-N 2.74Å; F118-V120 VanDerWaalsContact C-N 3.34Å; F118-K121 PolarHBondContact O-N 3.42Å; F118-L122 WeakPolarHBondContact O-CB 3.45Å; F118-L122 PolarHBondContact O-N 3.03Å
119	K	76.9	Confident	75.4	Confident	36 Å²	36	61.9 Å²	61.9	16%	0.157	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-42.8	174.9	-168.1	178.1	179.5	177.6	0	110.9	V110 K115 K116 D117 I123 M146 I150	V110-K119 HydrophobicContact CG1-CD 4.46Å; V110-K119 HydrophobicContact CG1-CG 3.84Å; V110-K119 WeakPolarHBondContact O-CE 3.42Å; K115-K119 PolarHBondContact O-N 3.24Å; K116-K119 VanDerWaalsContact O-CB 3.32Å; K116-K119 WeakPolarHBondContact O-CB 3.29Å; K116-K119 PolarHBondContact O-N 2.92Å; K116-K119 VanDerWaalsContact O-N 3.15Å; D117-K119 VanDerWaalsContact C-N 3.33Å; K119-I123 HydrophobicContact CG-CD1 3.94Å; K119-I123 WeakPolarHBondContact O-CB 3.42Å; K119-I123 WeakPolarHBondContact O-CD1 3.47Å; K119-I123 WeakPolarHBondContact O-CG1 3.34Å; K119-I123 PolarHBondContact O-N 3.01Å; K119-M146 VanDerWaalsContact CE-CE 3.43Å; K119-M146 VanDerWaalsContact NZ-CE 3.3Å; K119-I150 HydrophobicContact CD-CD1 3.76Å; K119-I150 HydrophobicContact CG-CD1 3.97Å
120	V	81.4	Confident	75.6	Confident	16 Å²	16	60.8 Å²	60.8	10%	0.097	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-50.4	176.4	175.8	0	0	0	0	111	K116 D117 F118 L122 I123 E124 L147 I150	K116-V120 PolarHBondContact O-N 2.97Å; K116-V120 VanDerWaalsContact O-N 3.11Å; D117-V120 PolarHBondContact O-N 2.74Å; F118-V120 VanDerWaalsContact C-N 3.34Å; V120-L122 VanDerWaalsContact C-N 3.32Å; V120-L122 PolarHBondContact O-N 3.31Å; V120-I123 PolarHBondContact O-N 3.32Å; V120-I123 VanDerWaalsContact O-N 3.1Å; V120-E124 HydrophobicContact CG1-CG 4.32Å; V120-E124 WeakPolarHBondContact O-CG 3.39Å; V120-E124 PolarHBondContact O-N 3.27Å; V120-L147 HydrophobicContact CG1-CD1 4.05Å; V120-L147 HydrophobicContact CG2-CD1 4.36Å; V120-I150 HydrophobicContact CG2-CD1 4.31Å; V120-I150 HydrophobicContact CG2-CG2 3.88Å
121	K	81.2	Confident	75.8	Confident	121 Å²	121	63.2 Å²	63.2	53%	0.526	32%	0.318	S	S	.	.	H	α-helix	trans	-57.2	-43.8	178.7	-70.4	-179.3	-179.7	-178.6	0	112.7	I82 D117 F118 E124 L125	I82-K121 HydrophobicContact CD1-CB 4.43Å; D117-K121 PolarHBondContact O-N 2.85Å; F118-K121 PolarHBondContact O-N 3.42Å; K121-E124 PolarHBondContact O-N 3.43Å; K121-L125 WeakPolarHBondContact O-CB 3.45Å; K121-L125 PolarHBondContact O-N 3.42Å; K121-L125 VanDerWaalsContact O-N 3.1Å
122	L	78.7	Confident	76.1	Confident	6 Å²	6	63.3 Å²	63.3	3%	0.031	33%	0.331	C	S	.	.	H	α-helix	trans	-66.2	-39.6	177.9	-177	61.5	0	0	0	111.6	I82 I85 V110 I113 F118 V120 L126	I82-L122 HydrophobicContact CG1-CD1 4.17Å; I85-L122 HydrophobicContact CD1-CD1 3.91Å; V110-L122 HydrophobicContact CG2-CD2 3.77Å; V110-L122 HydrophobicContact CG2-CG 4.26Å; I113-L122 HydrophobicContact CD1-CD2 3.83Å; F118-L122 WeakPolarHBondContact O-CB 3.45Å; F118-L122 PolarHBondContact O-N 3.03Å; V120-L122 VanDerWaalsContact C-N 3.32Å; V120-L122 PolarHBondContact O-N 3.31Å; L122-L126 HydrophobicContact CD1-CD1 4.35Å; L122-L126 HydrophobicContact CD1-CG 4.42Å; L122-L126 HydrophobicContact CG-CD1 4.1Å; L122-L126 WeakPolarHBondContact O-CB 3.3Å; L122-L126 WeakPolarHBondContact O-CG 3.47Å; L122-L126 PolarHBondContact O-N 3.03Å
123	I	82.9	Confident	76.2	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-66.3	-43.3	177.1	-69.7	164.7	0	0	0	111.2	V110 K119 V120 L126 R127 L143 M146 L147 I150	V110-I123 HydrophobicContact CG1-CD1 3.86Å; V110-I123 HydrophobicContact CG1-CG1 3.8Å; K119-I123 HydrophobicContact CG-CD1 3.94Å; K119-I123 WeakPolarHBondContact O-CB 3.42Å; K119-I123 WeakPolarHBondContact O-CD1 3.47Å; K119-I123 WeakPolarHBondContact O-CG1 3.34Å; K119-I123 PolarHBondContact O-N 3.01Å; V120-I123 PolarHBondContact O-N 3.32Å; V120-I123 VanDerWaalsContact O-N 3.1Å; I123-L126 PolarHBondContact O-N 2.92Å; I123-R127 HydrophobicContact CG2-CG 4.29Å; I123-R127 WeakPolarHBondContact O-CG 3.3Å; I123-R127 PolarHBondContact O-N 2.84Å; I123-L143 HydrophobicContact CG1-CD2 4.16Å; I123-L143 HydrophobicContact CG2-CB 4.18Å; I123-M146 HydrophobicContact CD1-CB 4.39Å; I123-M146 HydrophobicContact CD1-CG 4.35Å; I123-M146 HydrophobicContact CD1-SD 4.38Å; I123-L147 HydrophobicContact CG2-CB 3.92Å; I123-L147 HydrophobicContact CG2-CD1 4.32Å; I123-L147 HydrophobicContact CG2-CD2 4.34Å; I123-L147 HydrophobicContact CG2-CG 4.43Å; I123-I150 HydrophobicContact CD1-CD1 3.81Å
124	E	83.1	Confident	76.4	Confident	90 Å²	90	62.6 Å²	62.6	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-60.1	-48.2	177.9	-73.9	174.7	168.1	0	0	111.3	V120 K121 L126 R127 E128	V120-E124 HydrophobicContact CG1-CG 4.32Å; V120-E124 WeakPolarHBondContact O-CG 3.39Å; V120-E124 PolarHBondContact O-N 3.27Å; K121-E124 PolarHBondContact O-N 3.43Å; E124-L126 VanDerWaalsContact C-N 3.34Å; E124-L126 PolarHBondContact O-N 3.4Å; E124-R127 WeakPolarHBondContact O-CA 3.49Å; E124-R127 WeakPolarHBondContact O-CB 3.44Å; E124-R127 PolarHBondContact O-N 2.94Å; E124-E128 PolarHBondContact O-N 3.37Å
125	L	80.3	Confident	77.1	Confident	12 Å²	12	59.3 Å²	59.3	6%	0.063	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-42.7	175.8	-179.2	156.3	0	0	0	112.2	I82 I85 E86 K121 R127 E128 I129	I82-L125 HydrophobicContact CB-CD1 4Å; I82-L125 HydrophobicContact CG1-CD1 4.24Å; I82-L125 HydrophobicContact CG2-CD1 3.19Å; I85-L125 HydrophobicContact CB-CD2 4.27Å; I85-L125 HydrophobicContact CG2-CD2 3.71Å; E86-L125 HydrophobicContact CG-CD1 3.6Å; E86-L125 HydrophobicContact CG-CD2 4.31Å; E86-L125 HydrophobicContact CG-CG 3.99Å; E86-L125 WeakPolarHBondContact OE1-CD1 3.11Å; K121-L125 WeakPolarHBondContact O-CB 3.45Å; K121-L125 PolarHBondContact O-N 3.42Å; K121-L125 VanDerWaalsContact O-N 3.1Å; L125-R127 VanDerWaalsContact C-N 3.33Å; L125-R127 PolarHBondContact O-N 3.39Å; L125-E128 PolarHBondContact O-N 3.31Å; L125-I129 HydrophobicContact CD2-CD1 3.38Å; L125-I129 HydrophobicContact CD2-CG1 4.42Å; L125-I129 HydrophobicContact CG-CD1 4.17Å; L125-I129 WeakPolarHBondContact O-CB 3.45Å; L125-I129 VanDerWaalsContact O-CG1 3.3Å; L125-I129 WeakPolarHBondContact O-CG1 3.44Å; L125-I129 PolarHBondContact O-N 2.84Å
126	L	80.5	Confident	77.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-67	-34.1	175.4	-69.8	170.5	0	0	0	111.9	I85 C106 V110 L122 I123 E124 I129 T130 L143	I85-L126 HydrophobicContact CG2-CD2 4.23Å; C106-L126 HydrophobicContact CB-CD1 4.03Å; C106-L126 HydrophobicContact CB-CD2 4.14Å; V110-L126 HydrophobicContact CG2-CD1 4.19Å; L122-L126 HydrophobicContact CD1-CD1 4.35Å; L122-L126 HydrophobicContact CD1-CG 4.42Å; L122-L126 HydrophobicContact CG-CD1 4.1Å; L122-L126 WeakPolarHBondContact O-CB 3.3Å; L122-L126 WeakPolarHBondContact O-CG 3.47Å; L122-L126 PolarHBondContact O-N 3.03Å; I123-L126 PolarHBondContact O-N 2.92Å; E124-L126 VanDerWaalsContact C-N 3.34Å; E124-L126 PolarHBondContact O-N 3.4Å; L126-I129 PolarHBondContact O-N 3.45Å; L126-T130 WeakPolarHBondContact O-CB 3.31Å; L126-T130 WeakPolarHBondContact O-CG2 3.02Å; L126-T130 PolarHBondContact O-N 3.4Å; L126-T130 PolarHBondContact O-OG1 3.1Å; L126-L143 HydrophobicContact CB-CD1 3.5Å; L126-L143 VanDerWaalsContact CB-CD1 3.5Å; L126-L143 HydrophobicContact CD1-CD1 4.07Å; L126-L143 HydrophobicContact CD1-CD2 3.89Å; L126-L143 HydrophobicContact CG-CD1 4.38Å
127	R	79.4	Confident	77.8	Confident	35 Å²	35	50 Å²	50	13%	0.132	27%	0.269	C	S	.	.	H	α-helix	trans	-65.1	-41.2	173.9	-75.3	177.5	82.4	-144.5	-4.3	111.4	I123 E124 L125 T130 A131 T144 E166	I123-R127 HydrophobicContact CG2-CG 4.29Å; I123-R127 WeakPolarHBondContact O-CG 3.3Å; I123-R127 PolarHBondContact O-N 2.84Å; E124-R127 WeakPolarHBondContact O-CA 3.49Å; E124-R127 WeakPolarHBondContact O-CB 3.44Å; E124-R127 PolarHBondContact O-N 2.94Å; L125-R127 VanDerWaalsContact C-N 3.33Å; L125-R127 PolarHBondContact O-N 3.39Å; R127-T130 WeakPolarHBondContact CA-OG1 3.32Å; R127-T130 PolarHBondContact O-N 3.01Å; R127-T130 PolarHBondContact O-OG1 2.92Å; R127-A131 PolarHBondContact O-N 3.41Å; R127-A131 VanDerWaalsContact O-N 3.12Å; R127-T144 PolarHBondContact NE-OG1 3.21Å; R127-T144 VanDerWaalsContact NE-OG1 3.15Å; R127-E166 IonicContact CZ-OE2 3.91Å; R127-E166 IonicContact NH2-OE2 2.82Å; R127-E166 PolarHBondContact NH2-OE2 3.02Å
128	E	83.3	Confident	78	Confident	134 Å²	134	45.6 Å²	45.6	63%	0.626	25%	0.246	S	C	*	.	H	α-helix	trans	-64	-47.1	175.1	-71.1	-176.3	-179.3	0	0	111.5	E124 L125 T130 A131	E124-E128 PolarHBondContact O-N 3.37Å; L125-E128 PolarHBondContact O-N 3.31Å; E128-T130 VanDerWaalsContact C-N 3.25Å; E128-T130 PolarHBondContact O-N 3.32Å; E128-A131 WeakPolarHBondContact O-CB 3.47Å; E128-A131 PolarHBondContact O-N 3.34Å
129	I	77.7	Confident	78.4	Confident	22 Å²	22	43.1 Å²	43.1	11%	0.113	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-31.6	-179.2	-71.3	171.6	0	0	0	112.2	I85 A89 I103 L125 L126 K133	I85-I129 HydrophobicContact CG2-CD1 3.64Å; A89-I129 HydrophobicContact CB-CB 4.34Å; A89-I129 HydrophobicContact CB-CD1 3.62Å; A89-I129 HydrophobicContact CB-CG1 3.85Å; A89-I129 HydrophobicContact CB-CG2 3.55Å; I103-I129 HydrophobicContact CD1-CG2 4.46Å; L125-I129 HydrophobicContact CD2-CD1 3.38Å; L125-I129 HydrophobicContact CD2-CG1 4.42Å; L125-I129 HydrophobicContact CG-CD1 4.17Å; L125-I129 WeakPolarHBondContact O-CB 3.45Å; L125-I129 VanDerWaalsContact O-CG1 3.3Å; L125-I129 WeakPolarHBondContact O-CG1 3.44Å; L125-I129 PolarHBondContact O-N 2.84Å; L126-I129 PolarHBondContact O-N 3.45Å; I129-K133 VanDerWaalsContact O-CD 3.24Å; I129-K133 WeakPolarHBondContact O-CD 3.39Å; I129-K133 VanDerWaalsContact O-CE 3.27Å; I129-K133 WeakPolarHBondContact O-CE 3.45Å; I129-K133 PolarHBondContact O-NZ 3.18Å
130	T	75.4	Confident	78.6	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-86.9	-8	179.5	53.3	0	0	0	0	113.5	I103 L126 R127 E128 G132 K133 A136 R140	I103-T130 HydrophobicContact CD1-CG2 3.85Å; I103-T130 HydrophobicContact CG2-CG2 4.17Å; L126-T130 WeakPolarHBondContact O-CB 3.31Å; L126-T130 WeakPolarHBondContact O-CG2 3.02Å; L126-T130 PolarHBondContact O-N 3.4Å; L126-T130 PolarHBondContact O-OG1 3.1Å; R127-T130 WeakPolarHBondContact CA-OG1 3.32Å; R127-T130 PolarHBondContact O-N 3.01Å; R127-T130 PolarHBondContact O-OG1 2.92Å; E128-T130 VanDerWaalsContact C-N 3.25Å; E128-T130 PolarHBondContact O-N 3.32Å; T130-G132 PolarHBondContact O-N 3.4Å; T130-K133 PolarHBondContact O-N 2.93Å; T130-A136 HydrophobicContact CG2-CB 3.94Å; T130-R140 WeakPolarHBondContact OG1-CG 3.5Å
131	A	74	Confident	78.5	Confident	51 Å²	51	44.3 Å²	44.3	42%	0.421	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	126	176	0	0	0	0	0	111	R127 E128 K133	R127-A131 PolarHBondContact O-N 3.41Å; R127-A131 VanDerWaalsContact O-N 3.12Å; E128-A131 WeakPolarHBondContact O-CB 3.47Å; E128-A131 PolarHBondContact O-N 3.34Å; A131-K133 PolarHBondContact O-N 2.95Å
132	G	72.9	Confident	78.6	Confident	79 Å²	79	41.7 Å²	41.7	81%	0.814	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.6	4.4	177.8	0	0	0	0	0	116.2	T130	T130-G132 PolarHBondContact O-N 3.4Å
133	K	75	Confident	78.8	Confident	43 Å²	43	41.6 Å²	41.6	19%	0.187	23%	0.227	C	C	.	.			trans	-105.6	104.2	179.7	-68.5	172.4	-178.2	166.7	0	111.7	I129 T130 A131 Y135 A136 E137	I129-K133 VanDerWaalsContact O-CD 3.24Å; I129-K133 WeakPolarHBondContact O-CD 3.39Å; I129-K133 VanDerWaalsContact O-CE 3.27Å; I129-K133 WeakPolarHBondContact O-CE 3.45Å; I129-K133 PolarHBondContact O-NZ 3.18Å; T130-K133 PolarHBondContact O-N 2.93Å; A131-K133 PolarHBondContact O-N 2.95Å; K133-Y135 VanDerWaalsContact C-N 3.27Å; K133-Y135 HydrophobicContact CB-CD1 4.32Å; K133-Y135 HydrophobicContact CB-CE1 3.9Å; K133-Y135 HydrophobicContact CD-CE1 4.32Å; K133-Y135 WeakPolarHBondContact CD-OH 3.33Å; K133-Y135 HydrophobicContact CG-CE1 4.08Å; K133-Y135 PolarHBondContact O-N 3.23Å; K133-A136 HydrophobicContact CB-CB 4.39Å; K133-A136 PolarHBondContact O-N 2.62Å; K133-A136 VanDerWaalsContact O-N 3.09Å; K133-E137 PolarHBondContact O-N 2.91Å
134	T	73.2	Confident	79	Confident	96 Å²	96	41.6 Å²	41.6	59%	0.589	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-57.3	-33.5	-177.6	54.5	0	0	0	0	114.5	A136 E137	T134-A136 VanDerWaalsContact C-N 3.32Å; T134-A136 PolarHBondContact O-N 3.38Å; T134-E137 WeakPolarHBondContact CA-OE1 3.17Å
135	Y	77.1	Confident	79	Confident	67 Å²	67	38 Å²	38	26%	0.263	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-75.5	-16.8	-179.3	61.3	-93.5	0	0	0	114.2	K96 V99 K133	K96-Y135 HydrophobicContact CB-CD1 4.06Å; K96-Y135 HydrophobicContact CB-CE1 3.85Å; K96-Y135 HydrophobicContact CB-CE2 4.41Å; K96-Y135 HydrophobicContact CB-CG 4.42Å; K96-Y135 HydrophobicContact CD-CD1 4.16Å; K96-Y135 HydrophobicContact CD-CE1 4.07Å; K96-Y135 HydrophobicContact CG-CD1 4.24Å; K96-Y135 HydrophobicContact CG-CE1 3.79Å; K96-Y135 VanDerWaalsContact O-CE2 3.26Å; K96-Y135 WeakPolarHBondContact O-CE2 3.47Å; V99-Y135 HydrophobicContact CB-CE2 4.39Å; V99-Y135 HydrophobicContact CG1-CE2 4.42Å; K133-Y135 VanDerWaalsContact C-N 3.27Å; K133-Y135 HydrophobicContact CB-CD1 4.32Å; K133-Y135 HydrophobicContact CB-CE1 3.9Å; K133-Y135 HydrophobicContact CD-CE1 4.32Å; K133-Y135 WeakPolarHBondContact CD-OH 3.33Å; K133-Y135 HydrophobicContact CG-CE1 4.08Å; K133-Y135 PolarHBondContact O-N 3.23Å
136	A	76.2	Confident	79.2	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.008	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-111.9	10.7	-178.2	0	0	0	0	0	112.8	I103 T130 K133 T134 T138 E139 R140	I103-A136 HydrophobicContact CD1-CB 4.04Å; T130-A136 HydrophobicContact CG2-CB 3.94Å; K133-A136 HydrophobicContact CB-CB 4.39Å; K133-A136 PolarHBondContact O-N 2.62Å; K133-A136 VanDerWaalsContact O-N 3.09Å; T134-A136 VanDerWaalsContact C-N 3.32Å; T134-A136 PolarHBondContact O-N 3.38Å; A136-T138 PolarHBondContact O-N 3.27Å; A136-E139 PolarHBondContact O-N 3.39Å; A136-R140 PolarHBondContact O-N 3.44Å; A136-R140 VanDerWaalsContact O-N 3.07Å
137	E	77.2	Confident	79.4	Confident	56 Å²	56	39.4 Å²	39.4	26%	0.262	22%	0.219	S	C	.	.	H	α-helix	trans	-59.6	-44.5	-178.7	-72.9	178.7	-176.3	0	0	112.1	K133 T134 E139 R140 F141 C172	K133-E137 PolarHBondContact O-N 2.91Å; T134-E137 WeakPolarHBondContact CA-OE1 3.17Å; E137-E139 PolarHBondContact O-N 3.02Å; E137-R140 WeakPolarHBondContact O-CA 3.4Å; E137-R140 WeakPolarHBondContact O-CB 3.37Å; E137-R140 PolarHBondContact O-N 3.36Å; E137-F141 HydrophobicContact CB-CE2 4.4Å; E137-F141 WeakPolarHBondContact O-CD2 3.37Å; E137-F141 PolarHBondContact O-N 2.92Å; E137-C172 VanDerWaalsContact CB-SG 3.59Å; E137-C172 PolarHBondContact OE2-SG 3.46Å
138	T	80.1	Confident	79.6	Confident	27 Å²	27	37.7 Å²	37.7	17%	0.166	21%	0.213	C	C	.	.	H	α-helix	trans	-56.7	-37.1	-179.6	52.2	0	0	0	0	112.8	A136 Q142 N174	A136-T138 PolarHBondContact O-N 3.27Å; T138-Q142 WeakPolarHBondContact O-CG 3.35Å; T138-Q142 PolarHBondContact O-N 3.44Å; T138-Q142 PolarHBondContact O-NE2 3.44Å; T138-N174 HydrophobicContact CG2-CB 3.69Å; T138-N174 WeakPolarHBondContact CG2-O 2.99Å
139	E	79.8	Confident	79.8	Confident	13 Å²	13	38.7 Å²	38.7	6%	0.061	21%	0.211	C	C	.	.	H	α-helix	trans	-75.6	-38.1	176.9	-57	-54.2	156.3	0	0	111	I103 R104 C107 A136 E137 F141 Q142 L143	I103-E139 HydrophobicContact CG2-CB 3.74Å; I103-E139 HydrophobicContact CG2-CG 4.09Å; R104-E139 IonicContact NE-OE1 2.79Å; R104-E139 PolarHBondContact NE-OE1 3.21Å; C107-E139 PolarHBondContact SG-OE2 2.67Å; A136-E139 PolarHBondContact O-N 3.39Å; E137-E139 PolarHBondContact O-N 3.02Å; E139-F141 VanDerWaalsContact C-N 3.32Å; E139-F141 PolarHBondContact O-N 3.42Å; E139-Q142 PolarHBondContact O-N 2.97Å; E139-Q142 PolarHBondContact OE2-NE2 2.85Å; E139-L143 WeakPolarHBondContact O-CB 3.29Å; E139-L143 VanDerWaalsContact O-CG 3.28Å; E139-L143 WeakPolarHBondContact O-CG 3.4Å; E139-L143 PolarHBondContact O-N 3.25Å
140	R	81.5	Confident	80.2	Confident	66 Å²	66	38 Å²	38	25%	0.249	21%	0.207	C	C	.	.	H	α-helix	trans	-58.3	-42.6	173	-173	176.6	176.7	-169.3	-1.5	112.2	T130 A136 E137 L143 T144	T130-R140 WeakPolarHBondContact OG1-CG 3.5Å; A136-R140 PolarHBondContact O-N 3.44Å; A136-R140 VanDerWaalsContact O-N 3.07Å; E137-R140 WeakPolarHBondContact O-CA 3.4Å; E137-R140 WeakPolarHBondContact O-CB 3.37Å; E137-R140 PolarHBondContact O-N 3.36Å; R140-L143 PolarHBondContact O-N 2.97Å; R140-T144 WeakPolarHBondContact O-CB 3.38Å; R140-T144 PolarHBondContact O-N 3.07Å; R140-T144 PolarHBondContact O-OG1 3.41Å
141	F	79.4	Confident	80.7	Confident	11 Å²	11	40 Å²	40	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-62.2	-44.2	175.4	-81	-80.2	0	0	0	111.6	E137 E139 T144 A145 L167 V169 C172 L183	E137-F141 HydrophobicContact CB-CE2 4.4Å; E137-F141 WeakPolarHBondContact O-CD2 3.37Å; E137-F141 PolarHBondContact O-N 2.92Å; E139-F141 VanDerWaalsContact C-N 3.32Å; E139-F141 PolarHBondContact O-N 3.42Å; F141-T144 PolarHBondContact O-N 3.05Å; F141-A145 VanDerWaalsContact O-CB 3.3Å; F141-A145 WeakPolarHBondContact O-CB 3.26Å; F141-A145 PolarHBondContact O-N 2.94Å; F141-L167 HydrophobicContact CD1-CB 4.2Å; F141-L167 HydrophobicContact CD1-CD1 3.75Å; F141-L167 HydrophobicContact CE1-CB 3.65Å; F141-L167 HydrophobicContact CE1-CD1 3.99Å; F141-L167 HydrophobicContact CE1-CG 4.32Å; F141-L167 HydrophobicContact CG-CD1 4.34Å; F141-L167 HydrophobicContact CZ-CB 4.29Å; F141-V169 HydrophobicContact CD1-CG1 4.39Å; F141-V169 HydrophobicContact CE1-CB 4.16Å; F141-V169 HydrophobicContact CE1-CG1 4.12Å; F141-V169 HydrophobicContact CE1-CG2 4.07Å; F141-C172 HydrophobicContact CD2-CB 4.09Å; F141-C172 HydrophobicContact CE2-CB 3.34Å; F141-C172 WeakPolarHBondContact CE2-SG 3.31Å; F141-C172 HydrophobicContact CZ-CB 3.68Å; F141-L183 HydrophobicContact CB-CD1 4.03Å; F141-L183 HydrophobicContact CD1-CD1 3.93Å; F141-L183 HydrophobicContact CG-CD1 4.34Å
142	Q	82	Confident	81.3	Confident	66 Å²	66	39.6 Å²	39.6	31%	0.308	21%	0.205	S	C	.	.	H	α-helix	trans	-62.1	-46.6	177.2	-72.9	173.7	65.8	0	0	112.1	T138 E139 T144 A145 M146 R179	T138-Q142 WeakPolarHBondContact O-CG 3.35Å; T138-Q142 PolarHBondContact O-N 3.44Å; T138-Q142 PolarHBondContact O-NE2 3.44Å; E139-Q142 PolarHBondContact O-N 2.97Å; E139-Q142 PolarHBondContact OE2-NE2 2.85Å; Q142-T144 VanDerWaalsContact C-N 3.34Å; Q142-T144 PolarHBondContact O-N 3.28Å; Q142-A145 PolarHBondContact O-N 3.45Å; Q142-M146 WeakPolarHBondContact O-CB 3.15Å; Q142-M146 PolarHBondContact O-N 2.91Å; Q142-R179 VanDerWaalsContact CD-NH1 3.31Å; Q142-R179 VanDerWaalsContact NE2-NH1 3.11Å
143	L	84.6	Confident	81.9	Confident	4 Å²	4	42 Å²	42	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-62.6	-42.5	178.9	-72	167.8	0	0	0	111.7	V110 I123 L126 E139 R140 M146 L147	V110-L143 HydrophobicContact CG2-CD2 4.37Å; I123-L143 HydrophobicContact CG1-CD2 4.16Å; I123-L143 HydrophobicContact CG2-CB 4.18Å; L126-L143 HydrophobicContact CB-CD1 3.5Å; L126-L143 VanDerWaalsContact CB-CD1 3.5Å; L126-L143 HydrophobicContact CD1-CD1 4.07Å; L126-L143 HydrophobicContact CD1-CD2 3.89Å; L126-L143 HydrophobicContact CG-CD1 4.38Å; E139-L143 WeakPolarHBondContact O-CB 3.29Å; E139-L143 VanDerWaalsContact O-CG 3.28Å; E139-L143 WeakPolarHBondContact O-CG 3.4Å; E139-L143 PolarHBondContact O-N 3.25Å; R140-L143 PolarHBondContact O-N 2.97Å; L143-M146 WeakPolarHBondContact O-CB 3.23Å; L143-M146 PolarHBondContact O-N 2.9Å; L143-L147 PolarHBondContact O-N 3.46Å
144	T	85.6	Confident	82.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69.2	-38.1	179	-53.1	0	0	0	0	111.4	R127 R140 F141 Q142 M146 L147 S148 I163 L167	R127-T144 PolarHBondContact NE-OG1 3.21Å; R127-T144 VanDerWaalsContact NE-OG1 3.15Å; R140-T144 WeakPolarHBondContact O-CB 3.38Å; R140-T144 PolarHBondContact O-N 3.07Å; R140-T144 PolarHBondContact O-OG1 3.41Å; F141-T144 PolarHBondContact O-N 3.05Å; Q142-T144 VanDerWaalsContact C-N 3.34Å; Q142-T144 PolarHBondContact O-N 3.28Å; T144-M146 VanDerWaalsContact C-N 3.3Å; T144-M146 PolarHBondContact O-N 3.4Å; T144-L147 PolarHBondContact O-N 2.94Å; T144-S148 PolarHBondContact O-N 2.91Å; T144-I163 HydrophobicContact CG2-CG2 3.5Å; T144-I163 VanDerWaalsContact CG2-CG2 3.5Å; T144-I163 VanDerWaalsContact CG2-O 3.31Å; T144-I163 WeakPolarHBondContact CG2-O 3.21Å; T144-L167 HydrophobicContact CG2-CD1 3.45Å; T144-L167 VanDerWaalsContact CG2-CD1 3.45Å; T144-L167 HydrophobicContact CG2-CG 4.13Å; T144-L167 WeakPolarHBondContact OG1-CD1 3.31Å
145	A	84.1	Confident	83	Confident	15 Å²	15	41.9 Å²	41.9	12%	0.124	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-40.6	171.3	0	0	0	0	0	111.7	F141 Q142 S148 W149 L183 R186	F141-A145 VanDerWaalsContact O-CB 3.3Å; F141-A145 WeakPolarHBondContact O-CB 3.26Å; F141-A145 PolarHBondContact O-N 2.94Å; Q142-A145 PolarHBondContact O-N 3.45Å; A145-S148 PolarHBondContact O-N 3.29Å; A145-S148 PolarHBondContact O-OG 3.41Å; A145-W149 PolarHBondContact O-N 2.96Å; A145-W149 VanDerWaalsContact O-N 3.16Å; A145-L183 HydrophobicContact CB-CD2 3.5Å; A145-R186 PolarHBondContact O-NH1 3.48Å
146	M	83.9	Confident	83.6	Confident	39 Å²	39	42.9 Å²	42.9	19%	0.192	21%	0.213	C	C	.	.	H	α-helix	trans	-67.4	-41.5	177.1	-160.3	175	-147.5	0	0	112.2	V110 K119 I123 Q142 L143 T144 S148 W149 I150	V110-M146 HydrophobicContact CB-SD 4.34Å; V110-M146 HydrophobicContact CG1-CE 4.33Å; V110-M146 HydrophobicContact CG1-SD 3.42Å; V110-M146 WeakPolarHBondContact CG1-SD 3.42Å; K119-M146 VanDerWaalsContact CE-CE 3.43Å; K119-M146 VanDerWaalsContact NZ-CE 3.3Å; I123-M146 HydrophobicContact CD1-CB 4.39Å; I123-M146 HydrophobicContact CD1-CG 4.35Å; I123-M146 HydrophobicContact CD1-SD 4.38Å; Q142-M146 WeakPolarHBondContact O-CB 3.15Å; Q142-M146 PolarHBondContact O-N 2.91Å; L143-M146 WeakPolarHBondContact O-CB 3.23Å; L143-M146 PolarHBondContact O-N 2.9Å; T144-M146 VanDerWaalsContact C-N 3.3Å; T144-M146 PolarHBondContact O-N 3.4Å; M146-S148 VanDerWaalsContact C-N 3.28Å; M146-S148 PolarHBondContact O-N 2.99Å; M146-W149 WeakPolarHBondContact O-CB 3.41Å; M146-W149 PolarHBondContact O-N 3.43Å; M146-W149 VanDerWaalsContact O-N 3.14Å; M146-I150 WeakPolarHBondContact O-CG1 3.34Å; M146-I150 PolarHBondContact O-N 2.89Å; M146-I150 VanDerWaalsContact O-N 3.13Å
147	L	84.5	Confident	84.2	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-59	-42.2	174.6	-171.8	60.3	0	0	0	111.3	V120 I123 L143 T144 W149 I150 K151 I163	V120-L147 HydrophobicContact CG1-CD1 4.05Å; V120-L147 HydrophobicContact CG2-CD1 4.36Å; I123-L147 HydrophobicContact CG2-CB 3.92Å; I123-L147 HydrophobicContact CG2-CD1 4.32Å; I123-L147 HydrophobicContact CG2-CD2 4.34Å; I123-L147 HydrophobicContact CG2-CG 4.43Å; L143-L147 PolarHBondContact O-N 3.46Å; T144-L147 PolarHBondContact O-N 2.94Å; L147-W149 VanDerWaalsContact C-N 3.31Å; L147-W149 PolarHBondContact O-N 3.17Å; L147-I150 PolarHBondContact O-N 3.17Å; L147-K151 WeakPolarHBondContact O-CG 3.46Å; L147-K151 PolarHBondContact O-N 3.41Å; L147-I163 HydrophobicContact CD2-CD1 4.02Å; L147-I163 HydrophobicContact CD2-CG2 3.97Å; L147-I163 HydrophobicContact CG-CD1 4.23Å; L147-I163 HydrophobicContact CG-CG2 4.4Å
148	S	84.9	Confident	84.7	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.4	-33.1	177.2	75.8	0	0	0	0	113	T144 A145 M146 E152 L164 R186	T144-S148 PolarHBondContact O-N 2.91Å; A145-S148 PolarHBondContact O-N 3.29Å; A145-S148 PolarHBondContact O-OG 3.41Å; M146-S148 VanDerWaalsContact C-N 3.28Å; M146-S148 PolarHBondContact O-N 2.99Å; S148-E152 VanDerWaalsContact O-CB 3.23Å; S148-E152 WeakPolarHBondContact O-CB 3.3Å; S148-E152 PolarHBondContact O-N 3.35Å; S148-L164 VanDerWaalsContact CB-CD1 3.46Å; S148-L164 WeakPolarHBondContact OG-CD1 3.29Å; S148-R186 VanDerWaalsContact C-NH2 3.27Å; S148-R186 PolarHBondContact O-NH2 3.18Å; S148-R186 PolarHBondContact OG-NH1 3.42Å; S148-R186 PolarHBondContact OG-NH2 2.94Å; S148-R186 VanDerWaalsContact OG-NH2 3.17Å
149	W	86.6	Confident	85	Confident	155 Å²	155	50.5 Å²	50.5	59%	0.587	25%	0.254	S	S	*	.	H	α-helix	trans	-64.8	-44.2	171.2	-90.4	-31.8	0	0	0	111.8	A145 M146 L147 K151 E152 E153 R186	A145-W149 PolarHBondContact O-N 2.96Å; A145-W149 VanDerWaalsContact O-N 3.16Å; M146-W149 WeakPolarHBondContact O-CB 3.41Å; M146-W149 PolarHBondContact O-N 3.43Å; M146-W149 VanDerWaalsContact O-N 3.14Å; L147-W149 VanDerWaalsContact C-N 3.31Å; L147-W149 PolarHBondContact O-N 3.17Å; W149-K151 VanDerWaalsContact C-N 3.32Å; W149-K151 PolarHBondContact O-N 3.39Å; W149-E152 PolarHBondContact O-N 3.41Å; W149-E153 WeakPolarHBondContact O-CG 3.44Å; W149-E153 PolarHBondContact O-N 2.93Å; W149-R186 VanDerWaalsContact CE2-NH1 3.27Å; W149-R186 VanDerWaalsContact N-NH2 3.1Å; W149-R186 VanDerWaalsContact NE1-CZ 3.3Å
150	I	87.1	Confident	85.3	Confident	8 Å²	8	49.9 Å²	49.9	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-61.9	-44.8	179.3	-61.7	166.8	0	0	0	110.2	K119 V120 I123 M146 L147 E152 E153 E154	K119-I150 HydrophobicContact CD-CD1 3.76Å; K119-I150 HydrophobicContact CG-CD1 3.97Å; V120-I150 HydrophobicContact CG2-CD1 4.31Å; V120-I150 HydrophobicContact CG2-CG2 3.88Å; I123-I150 HydrophobicContact CD1-CD1 3.81Å; M146-I150 WeakPolarHBondContact O-CG1 3.34Å; M146-I150 PolarHBondContact O-N 2.89Å; M146-I150 VanDerWaalsContact O-N 3.13Å; L147-I150 PolarHBondContact O-N 3.17Å; I150-E152 VanDerWaalsContact C-N 3.31Å; I150-E152 PolarHBondContact O-N 3Å; I150-E153 WeakPolarHBondContact O-CB 3.42Å; I150-E153 PolarHBondContact O-N 3.27Å; I150-E154 WeakPolarHBondContact O-CG 3.38Å; I150-E154 PolarHBondContact O-N 3.48Å
151	K	85	Confident	85.5	Confident	43 Å²	43	47.2 Å²	47.2	19%	0.187	24%	0.242	C	C	.	.	H	α-helix	trans	-66.4	-32.8	178.2	-70	-73.4	160	-155.4	0	113.2	L147 W149 E154 G155 N156 A160 I163	L147-K151 WeakPolarHBondContact O-CG 3.46Å; L147-K151 PolarHBondContact O-N 3.41Å; W149-K151 VanDerWaalsContact C-N 3.32Å; W149-K151 PolarHBondContact O-N 3.39Å; K151-E154 WeakPolarHBondContact CD-OE2 3.49Å; K151-E154 IonicContact NZ-OE1 3.51Å; K151-E154 IonicContact NZ-OE2 3.13Å; K151-E154 PolarHBondContact NZ-OE2 3.26Å; K151-E154 PolarHBondContact O-N 3.44Å; K151-G155 PolarHBondContact O-N 3.46Å; K151-N156 PolarHBondContact O-N 2.94Å; K151-A160 HydrophobicContact CB-CB 3.95Å; K151-I163 HydrophobicContact CG-CD1 4.09Å
152	E	85.9	Confident	85.9	Confident	42 Å²	42	49.5 Å²	49.5	20%	0.196	26%	0.259	C	S	.	.	H	α-helix	trans	-69.7	-40.4	173.7	-176.2	173.6	-178.5	0	0	112	S148 W149 I150 E154 G155 L157 R186 R189	S148-E152 VanDerWaalsContact O-CB 3.23Å; S148-E152 WeakPolarHBondContact O-CB 3.3Å; S148-E152 PolarHBondContact O-N 3.35Å; W149-E152 PolarHBondContact O-N 3.41Å; I150-E152 VanDerWaalsContact C-N 3.31Å; I150-E152 PolarHBondContact O-N 3Å; E152-E154 PolarHBondContact O-N 2.87Å; E152-G155 PolarHBondContact O-N 2.72Å; E152-L157 HydrophobicContact CG-CD2 3.96Å; E152-R186 IonicContact OE2-CZ 2.75Å; E152-R186 IonicContact OE2-NE 3.9Å; E152-R186 IonicContact OE2-NH2 3.8Å; E152-R186 PolarHBondContact OE2-NH2 2.97Å; E152-R189 IonicContact OE1-CZ 3.91Å; E152-R189 IonicContact OE1-NH1 3.64Å; E152-R189 PolarHBondContact OE1-NH1 3.25Å; E152-R189 IonicContact OE1-NH2 2.81Å; E152-R189 PolarHBondContact OE1-NH2 3Å; E152-R189 IonicContact OE2-CZ 2.94Å; E152-R189 IonicContact OE2-NH2 2.56Å; E152-R189 PolarHBondContact OE2-NH2 3.44Å
153	E	87.1	Confident	86.1	Confident	130 Å²	130	47.3 Å²	47.3	61%	0.607	25%	0.249	S	C	*	.	H	α-helix	trans	-63	-31.3	171.8	-74.1	-179.6	-164.7	0	0	112.6	K116 W149 I150 G155	K116-E153 IonicContact NZ-OE2 2.65Å; K116-E153 PolarHBondContact NZ-OE2 3.42Å; W149-E153 WeakPolarHBondContact O-CG 3.44Å; W149-E153 PolarHBondContact O-N 2.93Å; I150-E153 WeakPolarHBondContact O-CB 3.42Å; I150-E153 PolarHBondContact O-N 3.27Å; E153-G155 PolarHBondContact O-N 3.41Å
154	E	86.5	Confident	86.1	Confident	81 Å²	81	47.4 Å²	47.4	38%	0.379	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-6.6	173.6	-71.5	170.5	-167.8	0	0	113	I150 K151 E152 N156	I150-E154 WeakPolarHBondContact O-CG 3.38Å; I150-E154 PolarHBondContact O-N 3.48Å; K151-E154 WeakPolarHBondContact CD-OE2 3.49Å; K151-E154 IonicContact NZ-OE1 3.51Å; K151-E154 IonicContact NZ-OE2 3.13Å; K151-E154 PolarHBondContact NZ-OE2 3.26Å; K151-E154 PolarHBondContact O-N 3.44Å; E152-E154 PolarHBondContact O-N 2.87Å; E154-N156 VanDerWaalsContact C-N 3.3Å; E154-N156 PolarHBondContact O-N 3.45Å
155	G	85	Confident	85.8	Confident	54 Å²	54	50 Å²	50	56%	0.557	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-0.5	-177.7	0	0	0	0	0	114.7	K151 E152 E153 L157	K151-G155 PolarHBondContact O-N 3.46Å; E152-G155 PolarHBondContact O-N 2.72Å; E153-G155 PolarHBondContact O-N 3.41Å; G155-L157 PolarHBondContact O-N 2.89Å; G155-L157 VanDerWaalsContact O-N 3.1Å
156	N	89.4	Confident	85.6	Confident	88 Å²	88	55.1 Å²	55.1	47%	0.471	29%	0.285	S	S	.	.			trans	-87.8	74.1	-178.8	-70.7	-40.3	0	0	0	111.3	K151 E154 E158 A159 A160	K151-N156 PolarHBondContact O-N 2.94Å; E154-N156 VanDerWaalsContact C-N 3.3Å; E154-N156 PolarHBondContact O-N 3.45Å; N156-E158 VanDerWaalsContact C-N 3.33Å; N156-E158 PolarHBondContact O-N 3.39Å; N156-A159 HydrophobicContact CB-CB 4.23Å; N156-A159 PolarHBondContact O-N 2.84Å; N156-A160 PolarHBondContact O-N 3.02Å; N156-A160 VanDerWaalsContact O-N 3.1Å
157	L	87.2	Confident	85.1	Confident	58 Å²	58	53.9 Å²	53.9	30%	0.304	28%	0.278	S	S	.	.	H	α-helix	trans	-61.6	-37.5	-177.8	-64.7	179.1	0	0	0	113.3	E152 G155 A160 K161 L190 L194	E152-L157 HydrophobicContact CG-CD2 3.96Å; G155-L157 PolarHBondContact O-N 2.89Å; G155-L157 VanDerWaalsContact O-N 3.1Å; L157-A160 PolarHBondContact O-N 3.44Å; L157-K161 WeakPolarHBondContact O-CB 3.35Å; L157-K161 PolarHBondContact O-N 3.29Å; L157-L190 HydrophobicContact CD2-CD2 4.22Å; L157-L194 HydrophobicContact CB-CD1 4.44Å; L157-L194 HydrophobicContact CB-CD2 3.85Å; L157-L194 HydrophobicContact CB-CG 4.22Å
158	E	88	Confident	84.4	Confident	151 Å²	151	58.8 Å²	58.8	71%	0.706	31%	0.305	S	S	*	.	H	α-helix	trans	-64.7	-45.7	-179.9	-67.1	-177.5	177.1	0	0	112.3	N156 K161 S162 L194	N156-E158 VanDerWaalsContact C-N 3.33Å; N156-E158 PolarHBondContact O-N 3.39Å; E158-K161 WeakPolarHBondContact O-CB 3.45Å; E158-K161 PolarHBondContact O-N 3.45Å; E158-S162 PolarHBondContact O-N 2.82Å; E158-L194 HydrophobicContact CG-CD1 4.23Å; E158-L194 HydrophobicContact CG-CD2 3.61Å
159	A	86.1	Confident	83.5	Confident	36 Å²	36	59 Å²	59	30%	0.298	31%	0.306	S	S	.	.	H	α-helix	trans	-65.9	-40	176.7	0	0	0	0	0	111.3	N156 K161 S162 I163	N156-A159 HydrophobicContact CB-CB 4.23Å; N156-A159 PolarHBondContact O-N 2.84Å; A159-K161 VanDerWaalsContact C-N 3.26Å; A159-K161 PolarHBondContact O-N 2.74Å; A159-S162 PolarHBondContact O-N 3.24Å; A159-S162 PolarHBondContact O-OG 2.98Å; A159-I163 WeakPolarHBondContact O-CB 3.47Å; A159-I163 VanDerWaalsContact O-CD1 3.32Å; A159-I163 WeakPolarHBondContact O-CD1 3.36Å; A159-I163 WeakPolarHBondContact O-CG1 3.44Å; A159-I163 PolarHBondContact O-N 2.9Å; A159-I163 VanDerWaalsContact O-N 3.13Å
160	A	87.4	Confident	82.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.3	-39.7	175.2	0	0	0	0	0	111.6	K151 N156 L157 L164 L190	K151-A160 HydrophobicContact CB-CB 3.95Å; N156-A160 PolarHBondContact O-N 3.02Å; N156-A160 VanDerWaalsContact O-N 3.1Å; L157-A160 PolarHBondContact O-N 3.44Å; A160-L164 PolarHBondContact O-N 3.25Å; A160-L190 HydrophobicContact CB-CD1 4.33Å
161	K	85.9	Confident	81.8	Confident	10 Å²	10	57.8 Å²	57.8	4%	0.043	32%	0.319	C	S	.	.	H	α-helix	trans	-66.4	-49.9	176.1	172.2	178.3	173.3	173.1	0	112.3	L157 E158 A159 I163 L164 L165 L190 C191 L194 D196	L157-K161 WeakPolarHBondContact O-CB 3.35Å; L157-K161 PolarHBondContact O-N 3.29Å; E158-K161 WeakPolarHBondContact O-CB 3.45Å; E158-K161 PolarHBondContact O-N 3.45Å; A159-K161 VanDerWaalsContact C-N 3.26Å; A159-K161 PolarHBondContact O-N 2.74Å; K161-I163 VanDerWaalsContact C-N 3.32Å; K161-I163 PolarHBondContact O-N 3.38Å; K161-L164 PolarHBondContact O-N 2.93Å; K161-L165 HydrophobicContact CD-CD1 4.18Å; K161-L165 VanDerWaalsContact CE-CD1 3.46Å; K161-L165 HydrophobicContact CG-CD1 3.63Å; K161-L165 HydrophobicContact CG-CG 4.09Å; K161-L165 WeakPolarHBondContact O-CB 3.35Å; K161-L165 WeakPolarHBondContact O-CG 3.34Å; K161-L165 PolarHBondContact O-N 3.1Å; K161-L190 HydrophobicContact CB-CB 4.4Å; K161-C191 WeakPolarHBondContact CE-SG 3.45Å; K161-L194 HydrophobicContact CB-CD1 3.79Å; K161-L194 HydrophobicContact CD-CD1 3.4Å; K161-L194 VanDerWaalsContact CD-CD1 3.4Å; K161-L194 HydrophobicContact CG-CD1 4.25Å; K161-D196 IonicContact NZ-OD2 3.02Å; K161-D196 PolarHBondContact NZ-OD2 3.2Å
162	S	87.1	Confident	80.9	Confident	59 Å²	59	55.9 Å²	55.9	41%	0.413	31%	0.311	S	S	.	.	H	α-helix	trans	-59.3	-46.2	-177.5	59.7	0	0	0	0	111.2	E158 A159 L164 L165 E166	E158-S162 PolarHBondContact O-N 2.82Å; A159-S162 PolarHBondContact O-N 3.24Å; A159-S162 PolarHBondContact O-OG 2.98Å; S162-L164 VanDerWaalsContact C-N 3.29Å; S162-L164 PolarHBondContact O-N 3.45Å; S162-L165 PolarHBondContact O-N 2.86Å; S162-L165 VanDerWaalsContact O-N 3.12Å; S162-E166 WeakPolarHBondContact O-CG 3.48Å; S162-E166 PolarHBondContact O-N 3.49Å
163	I	85.8	Confident	80.2	Confident	20 Å²	20	61.6 Å²	61.6	10%	0.103	34%	0.337	C	S	.	.	H	α-helix	trans	-57.9	-40.7	177.9	-70.4	167.9	0	0	0	111.9	T144 L147 K151 A159 K161	T144-I163 HydrophobicContact CG2-CG2 3.5Å; T144-I163 VanDerWaalsContact CG2-CG2 3.5Å; T144-I163 VanDerWaalsContact CG2-O 3.31Å; T144-I163 WeakPolarHBondContact CG2-O 3.21Å; L147-I163 HydrophobicContact CD2-CD1 4.02Å; L147-I163 HydrophobicContact CD2-CG2 3.97Å; L147-I163 HydrophobicContact CG-CD1 4.23Å; L147-I163 HydrophobicContact CG-CG2 4.4Å; K151-I163 HydrophobicContact CG-CD1 4.09Å; A159-I163 WeakPolarHBondContact O-CB 3.47Å; A159-I163 VanDerWaalsContact O-CD1 3.32Å; A159-I163 WeakPolarHBondContact O-CD1 3.36Å; A159-I163 WeakPolarHBondContact O-CG1 3.44Å; A159-I163 PolarHBondContact O-N 2.9Å; A159-I163 VanDerWaalsContact O-N 3.13Å; K161-I163 VanDerWaalsContact C-N 3.32Å; K161-I163 PolarHBondContact O-N 3.38Å
164	L	84.2	Confident	79.5	Confident	6 Å²	6	60.5 Å²	60.5	3%	0.031	34%	0.335	C	S	.	.	H	α-helix	trans	-74.8	-34.6	177.8	-89.4	167.2	0	0	0	112.8	S148 A160 K161 S162 L167 R186 Q187 L190	S148-L164 VanDerWaalsContact CB-CD1 3.46Å; S148-L164 WeakPolarHBondContact OG-CD1 3.29Å; A160-L164 PolarHBondContact O-N 3.25Å; K161-L164 PolarHBondContact O-N 2.93Å; S162-L164 VanDerWaalsContact C-N 3.29Å; S162-L164 PolarHBondContact O-N 3.45Å; L164-L167 PolarHBondContact O-N 2.89Å; L164-R186 HydrophobicContact CD1-CG 4.11Å; L164-Q187 HydrophobicContact CB-CG 4.12Å; L164-Q187 PolarHBondContact O-NE2 2.83Å; L164-L190 HydrophobicContact CD1-CD1 3.35Å
165	L	80.7	Confident	78.9	Confident	55 Å²	55	57.5 Å²	57.5	29%	0.288	32%	0.322	S	S	.	.	H	α-helix	trans	-75.9	-23	179.7	-71.9	-179.9	0	0	0	113.3	K161 S162 L167 I203	K161-L165 HydrophobicContact CD-CD1 4.18Å; K161-L165 VanDerWaalsContact CE-CD1 3.46Å; K161-L165 HydrophobicContact CG-CD1 3.63Å; K161-L165 HydrophobicContact CG-CG 4.09Å; K161-L165 WeakPolarHBondContact O-CB 3.35Å; K161-L165 WeakPolarHBondContact O-CG 3.34Å; K161-L165 PolarHBondContact O-N 3.1Å; S162-L165 PolarHBondContact O-N 2.86Å; S162-L165 VanDerWaalsContact O-N 3.12Å; L165-L167 PolarHBondContact O-N 3.15Å; L165-L167 VanDerWaalsContact O-N 3.08Å; L165-I203 HydrophobicContact CD2-CD1 3.85Å
166	E	80.1	Confident	78.6	Confident	122 Å²	122	58.1 Å²	58.1	57%	0.57	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-20.1	169.2	-77.1	170.5	-174.6	0	0	112.8	R127 S162	R127-E166 IonicContact CZ-OE2 3.91Å; R127-E166 IonicContact NH2-OE2 2.82Å; R127-E166 PolarHBondContact NH2-OE2 3.02Å; S162-E166 WeakPolarHBondContact O-CG 3.48Å; S162-E166 PolarHBondContact O-N 3.49Å
167	L	73.6	Confident	78.1	Confident	12 Å²	12	57.9 Å²	57.9	6%	0.063	32%	0.323	C	S	.	.	S	Bend	trans	-105.7	110.1	178.7	-64.3	-177.5	0	0	0	111.6	F141 T144 L164 L165 V169 Q187	F141-L167 HydrophobicContact CD1-CB 4.2Å; F141-L167 HydrophobicContact CD1-CD1 3.75Å; F141-L167 HydrophobicContact CE1-CB 3.65Å; F141-L167 HydrophobicContact CE1-CD1 3.99Å; F141-L167 HydrophobicContact CE1-CG 4.32Å; F141-L167 HydrophobicContact CG-CD1 4.34Å; F141-L167 HydrophobicContact CZ-CB 4.29Å; T144-L167 HydrophobicContact CG2-CD1 3.45Å; T144-L167 VanDerWaalsContact CG2-CD1 3.45Å; T144-L167 HydrophobicContact CG2-CG 4.13Å; T144-L167 WeakPolarHBondContact OG1-CD1 3.31Å; L164-L167 PolarHBondContact O-N 2.89Å; L165-L167 PolarHBondContact O-N 3.15Å; L165-L167 VanDerWaalsContact O-N 3.08Å; L167-V169 PolarHBondContact O-N 2.94Å; L167-Q187 PolarHBondContact O-NE2 3.2Å
168	D	69.3	Low	77.9	Confident	105 Å²	105	57.2 Å²	57.2	56%	0.561	33%	0.33	S	S	*	.			trans	-74.8	91.6	168.4	-72.5	-34.3	0	0	0	110.4	S170 T171	D168-S170 PolarHBondContact O-N 3.4Å; D168-T171 HydrophobicContact CB-CG2 3.91Å; D168-T171 PolarHBondContact O-N 3.17Å; D168-T171 PolarHBondContact O-OG1 3.29Å
169	V	66	Low	77.5	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.03	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.9	180	-156.7	0	0	0	0	112.2	F141 L167 T171 L175 K180 L183 I184	F141-V169 HydrophobicContact CD1-CG1 4.39Å; F141-V169 HydrophobicContact CE1-CB 4.16Å; F141-V169 HydrophobicContact CE1-CG1 4.12Å; F141-V169 HydrophobicContact CE1-CG2 4.07Å; L167-V169 PolarHBondContact O-N 2.94Å; V169-T171 VanDerWaalsContact C-N 3.31Å; V169-T171 PolarHBondContact O-N 3.19Å; V169-L175 HydrophobicContact CG1-CD2 4.15Å; V169-K180 HydrophobicContact CG1-CB 4.33Å; V169-K180 HydrophobicContact CG1-CG 3.82Å; V169-K180 WeakPolarHBondContact O-CE 3.47Å; V169-K180 PolarHBondContact O-NZ 2.97Å; V169-L183 HydrophobicContact CG1-CB 4.13Å; V169-L183 HydrophobicContact CG1-CD1 4.13Å; V169-L183 HydrophobicContact CG2-CB 4.14Å; V169-I184 HydrophobicContact CB-CG1 4.14Å; V169-I184 HydrophobicContact CG1-CG1 4.44Å; V169-I184 HydrophobicContact CG2-CG1 4.38Å
170	S	68.3	Low	77.3	Confident	56 Å²	56	56.9 Å²	56.9	39%	0.392	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-37.1	176.2	57.1	0	0	0	0	112.5	D168 C172 K180	D168-S170 PolarHBondContact O-N 3.4Å; S170-C172 VanDerWaalsContact C-N 3.33Å; S170-C172 PolarHBondContact O-N 3.46Å; S170-K180 PolarHBondContact O-NZ 3.43Å
171	T	69.5	Low	77.2	Confident	81 Å²	81	57.4 Å²	57.4	50%	0.497	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-20.9	-174.5	62.2	0	0	0	0	113.5	D168 V169 H173	D168-T171 HydrophobicContact CB-CG2 3.91Å; D168-T171 PolarHBondContact O-N 3.17Å; D168-T171 PolarHBondContact O-OG1 3.29Å; V169-T171 VanDerWaalsContact C-N 3.31Å; V169-T171 PolarHBondContact O-N 3.19Å; T171-H173 PolarHBondContact O-CE1 2.64Å; T171-H173 PolarHBondContact O-N 2.8Å; T171-H173 PolarHBondContact O-ND1 3.26Å
172	C	66.1	Low	77.1	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.014	33%	0.331	C	S	.	.			trans	-83.5	114.6	-174.3	-153.5	0	0	0	0	111.3	E137 F141 S170	E137-C172 VanDerWaalsContact CB-SG 3.59Å; E137-C172 PolarHBondContact OE2-SG 3.46Å; F141-C172 HydrophobicContact CD2-CB 4.09Å; F141-C172 HydrophobicContact CE2-CB 3.34Å; F141-C172 WeakPolarHBondContact CE2-SG 3.31Å; F141-C172 HydrophobicContact CZ-CB 3.68Å; S170-C172 VanDerWaalsContact C-N 3.33Å; S170-C172 PolarHBondContact O-N 3.46Å
173	H	70.8	Confident	77.1	Confident	163 Å²	163	56.9 Å²	56.9	76%	0.755	32%	0.317	S	S	*	.	S	Bend	trans	-86.2	-27.5	-176	-59.7	10.8	0	0	0	112.3	T171 L175	T171-H173 PolarHBondContact O-CE1 2.64Å; T171-H173 PolarHBondContact O-N 2.8Å; T171-H173 PolarHBondContact O-ND1 3.26Å; H173-L175 VanDerWaalsContact C-N 3.33Å; H173-L175 PolarHBondContact O-N 2.95Å
174	N	73.4	Confident	77.1	Confident	107 Å²	107	56.2 Å²	56.2	57%	0.572	31%	0.313	S	S	*	.	S	Bend	trans	-84.2	-4.7	-172.7	-66.1	-26.4	0	0	0	113.8	T138	T138-N174 HydrophobicContact CG2-CB 3.69Å; T138-N174 WeakPolarHBondContact CG2-O 2.99Å
175	L	73.3	Confident	77.3	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.094	31%	0.313	C	S	.	.	S	Bend	trans	-85.4	136.9	-178.3	-168.8	63.3	0	0	0	110.6	V169 H173 S177 R179 K180 L183	V169-L175 HydrophobicContact CG1-CD2 4.15Å; H173-L175 VanDerWaalsContact C-N 3.33Å; H173-L175 PolarHBondContact O-N 2.95Å; L175-S177 PolarHBondContact O-N 3.48Å; L175-R179 HydrophobicContact CD1-CB 3.73Å; L175-R179 HydrophobicContact CD2-CB 4.22Å; L175-R179 HydrophobicContact CG-CB 3.9Å; L175-K180 HydrophobicContact CD2-CB 3.89Å; L175-K180 HydrophobicContact CG-CB 4.32Å; L175-L183 HydrophobicContact CD2-CD1 3.89Å
176	S	78.7	Confident	77.7	Confident	66 Å²	66	54.7 Å²	54.7	46%	0.462	30%	0.303	S	S	.	.			trans	-59.5	140.6	173	61.9	0	0	0	0	110.7	G178 R179 K180	S176-G178 PolarHBondContact O-N 3.18Å; S176-G178 VanDerWaalsContact O-N 3.16Å; S176-R179 PolarHBondContact O-N 2.91Å; S176-R179 WeakPolarHBondContact OG-CG 3.39Å; S176-K180 PolarHBondContact O-N 2.99Å
177	S	79.3	Confident	78	Confident	84 Å²	84	49.6 Å²	49.6	59%	0.587	28%	0.28	S	S	*	.	H	α-helix	trans	-50.8	-41.9	-178.1	51.1	0	0	0	0	112.5	L175 K180 L181	L175-S177 PolarHBondContact O-N 3.48Å; S177-K180 PolarHBondContact O-N 3.38Å; S177-L181 WeakPolarHBondContact O-CB 3.4Å; S177-L181 PolarHBondContact O-N 3.48Å
178	G	81.7	Confident	78.7	Confident	44 Å²	44	49 Å²	49	45%	0.454	28%	0.277	S	S	.	.	H	α-helix	trans	-65	-42	177.4	0	0	0	0	0	114.2	S176 L181 A182	S176-G178 PolarHBondContact O-N 3.18Å; S176-G178 VanDerWaalsContact O-N 3.16Å; G178-L181 PolarHBondContact O-N 3.49Å; G178-A182 PolarHBondContact O-N 3.47Å
179	R	80.5	Confident	79.7	Confident	129 Å²	129	48.5 Å²	48.5	49%	0.487	27%	0.267	S	S	.	.	H	α-helix	trans	-69.3	-37.8	176.3	-76	-175.3	179.1	-169.9	-0.7	111.6	Q142 L175 S176 A182 L183	Q142-R179 VanDerWaalsContact CD-NH1 3.31Å; Q142-R179 VanDerWaalsContact NE2-NH1 3.11Å; L175-R179 HydrophobicContact CD1-CB 3.73Å; L175-R179 HydrophobicContact CD2-CB 4.22Å; L175-R179 HydrophobicContact CG-CB 3.9Å; S176-R179 PolarHBondContact O-N 2.91Å; S176-R179 WeakPolarHBondContact OG-CG 3.39Å; R179-A182 WeakPolarHBondContact O-CB 3.24Å; R179-A182 PolarHBondContact O-N 3.02Å; R179-L183 WeakPolarHBondContact O-CG 3.4Å; R179-L183 PolarHBondContact O-N 3.32Å; R179-L183 VanDerWaalsContact O-N 3.07Å
180	K	82.2	Confident	80.8	Confident	51 Å²	51	48.3 Å²	48.3	22%	0.222	27%	0.266	C	S	.	.	H	α-helix	trans	-58	-49.9	174	176.9	163.1	-175.5	165.7	0	110.6	V169 S170 L175 S176 S177 A182 L183 I184	V169-K180 HydrophobicContact CG1-CB 4.33Å; V169-K180 HydrophobicContact CG1-CG 3.82Å; V169-K180 WeakPolarHBondContact O-CE 3.47Å; V169-K180 PolarHBondContact O-NZ 2.97Å; S170-K180 PolarHBondContact O-NZ 3.43Å; L175-K180 HydrophobicContact CD2-CB 3.89Å; L175-K180 HydrophobicContact CG-CB 4.32Å; S176-K180 PolarHBondContact O-N 2.99Å; S177-K180 PolarHBondContact O-N 3.38Å; K180-A182 VanDerWaalsContact C-N 3.33Å; K180-A182 PolarHBondContact O-N 3.19Å; K180-L183 PolarHBondContact O-N 2.9Å; K180-I184 HydrophobicContact CG-CD1 3.93Å; K180-I184 VanDerWaalsContact O-CG1 3.32Å; K180-I184 WeakPolarHBondContact O-CG1 3.28Å; K180-I184 PolarHBondContact O-N 3.4Å; K180-I184 VanDerWaalsContact O-N 3.09Å
181	L	84	Confident	81.7	Confident	10 Å²	10	45.6 Å²	45.6	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-58.6	-44.4	175.8	-176.7	65.7	0	0	0	111.7	S177 G178 L183 I184 L185 I207 A211 F212 M222	S177-L181 WeakPolarHBondContact O-CB 3.4Å; S177-L181 PolarHBondContact O-N 3.48Å; G178-L181 PolarHBondContact O-N 3.49Å; L181-L183 VanDerWaalsContact C-N 3.32Å; L181-L183 PolarHBondContact O-N 3.33Å; L181-I184 PolarHBondContact O-N 3.46Å; L181-L185 HydrophobicContact CD1-CG 4.34Å; L181-L185 HydrophobicContact CG-CD1 4.24Å; L181-L185 HydrophobicContact CG-CG 4.37Å; L181-L185 WeakPolarHBondContact O-CG 3.44Å; L181-L185 PolarHBondContact O-N 3.2Å; L181-I207 HydrophobicContact CD1-CG2 3.99Å; L181-A211 HydrophobicContact CD1-CB 4.16Å; L181-A211 HydrophobicContact CD2-CB 4.42Å; L181-F212 HydrophobicContact CD1-CE1 3.95Å; L181-F212 HydrophobicContact CD1-CZ 3.84Å; L181-F212 HydrophobicContact CD2-CD1 3.85Å; L181-F212 HydrophobicContact CD2-CE1 3.51Å; L181-F212 HydrophobicContact CD2-CZ 4.26Å; L181-F212 HydrophobicContact CG-CE1 4.23Å; L181-M222 HydrophobicContact CD2-CB 4.2Å
182	A	85.7	Confident	82.6	Confident	37 Å²	37	42.8 Å²	42.8	31%	0.306	23%	0.229	S	C	.	.	H	α-helix	trans	-58.6	-41	178.7	0	0	0	0	0	113.9	G178 R179 K180 R186 M222	G178-A182 PolarHBondContact O-N 3.47Å; R179-A182 WeakPolarHBondContact O-CB 3.24Å; R179-A182 PolarHBondContact O-N 3.02Å; K180-A182 VanDerWaalsContact C-N 3.33Å; K180-A182 PolarHBondContact O-N 3.19Å; A182-R186 WeakPolarHBondContact O-CB 3.46Å; A182-R186 PolarHBondContact O-N 2.97Å; A182-M222 HydrophobicContact CB-CE 3.28Å
183	L	85.6	Confident	83.6	Confident	21 Å²	21	45.7 Å²	45.7	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-69.4	-40	177.2	-66.7	174.5	0	0	0	111.8	F141 A145 V169 L175 R179 K180 L181 R186 Q187	F141-L183 HydrophobicContact CB-CD1 4.03Å; F141-L183 HydrophobicContact CD1-CD1 3.93Å; F141-L183 HydrophobicContact CG-CD1 4.34Å; A145-L183 HydrophobicContact CB-CD2 3.5Å; V169-L183 HydrophobicContact CG1-CB 4.13Å; V169-L183 HydrophobicContact CG1-CD1 4.13Å; V169-L183 HydrophobicContact CG2-CB 4.14Å; L175-L183 HydrophobicContact CD2-CD1 3.89Å; R179-L183 WeakPolarHBondContact O-CG 3.4Å; R179-L183 PolarHBondContact O-N 3.32Å; R179-L183 VanDerWaalsContact O-N 3.07Å; K180-L183 PolarHBondContact O-N 2.9Å; L181-L183 VanDerWaalsContact C-N 3.32Å; L181-L183 PolarHBondContact O-N 3.33Å; L183-R186 WeakPolarHBondContact O-CB 3.34Å; L183-R186 PolarHBondContact O-N 3.41Å; L183-Q187 WeakPolarHBondContact O-CG 3.37Å; L183-Q187 PolarHBondContact O-N 2.91Å
184	I	87.3	Confident	84.4	Confident	6 Å²	6	40.5 Å²	40.5	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-65.1	-46.2	177.7	-64.7	166.2	0	0	0	110.7	V169 K180 L181 R186 Q187 L188 I203 I207	V169-I184 HydrophobicContact CB-CG1 4.14Å; V169-I184 HydrophobicContact CG1-CG1 4.44Å; V169-I184 HydrophobicContact CG2-CG1 4.38Å; K180-I184 HydrophobicContact CG-CD1 3.93Å; K180-I184 VanDerWaalsContact O-CG1 3.32Å; K180-I184 WeakPolarHBondContact O-CG1 3.28Å; K180-I184 PolarHBondContact O-N 3.4Å; K180-I184 VanDerWaalsContact O-N 3.09Å; L181-I184 PolarHBondContact O-N 3.46Å; I184-R186 PolarHBondContact O-N 3.41Å; I184-Q187 WeakPolarHBondContact O-CB 3.22Å; I184-Q187 PolarHBondContact O-N 2.94Å; I184-L188 PolarHBondContact O-N 2.95Å; I184-I203 HydrophobicContact CG2-CG2 3.7Å; I184-I207 HydrophobicContact CG2-CD1 3.95Å; I184-I207 HydrophobicContact CG2-CG1 3.57Å
185	L	88.4	Confident	84.9	Confident	4 Å²	4	37.2 Å²	37.2	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-36.6	175.5	-67.8	-176.9	0	0	0	111.8	L181 L188 R189 I207 M222 Y226 L229	L181-L185 HydrophobicContact CD1-CG 4.34Å; L181-L185 HydrophobicContact CG-CD1 4.24Å; L181-L185 HydrophobicContact CG-CG 4.37Å; L181-L185 WeakPolarHBondContact O-CG 3.44Å; L181-L185 PolarHBondContact O-N 3.2Å; L185-L188 WeakPolarHBondContact O-CB 3.37Å; L185-L188 PolarHBondContact O-N 2.92Å; L185-R189 PolarHBondContact O-N 3.15Å; L185-I207 HydrophobicContact CD2-CD1 4.39Å; L185-M222 HydrophobicContact CD1-CB 3.96Å; L185-M222 HydrophobicContact CD1-CE 3.91Å; L185-M222 VanDerWaalsContact CD1-O 3.31Å; L185-M222 WeakPolarHBondContact CD1-O 3.44Å; L185-M222 HydrophobicContact CD1-SD 4.36Å; L185-Y226 HydrophobicContact CD2-CD2 3.59Å; L185-Y226 HydrophobicContact CD2-CG 4.08Å; L185-L229 WeakPolarHBondContact O-CD1 3.4Å
186	R	87.6	Confident	85.5	Confident	25 Å²	25	39 Å²	39	9%	0.094	23%	0.231	C	C	.	.	H	α-helix	trans	-67.3	-44.5	175.4	-177.2	172	-176	170.1	2.7	112.8	A145 S148 W149 E152 L164 A182 L183 I184 L188 R189 L190	A145-R186 PolarHBondContact O-NH1 3.48Å; S148-R186 VanDerWaalsContact C-NH2 3.27Å; S148-R186 PolarHBondContact O-NH2 3.18Å; S148-R186 PolarHBondContact OG-NH1 3.42Å; S148-R186 PolarHBondContact OG-NH2 2.94Å; S148-R186 VanDerWaalsContact OG-NH2 3.17Å; W149-R186 VanDerWaalsContact CE2-NH1 3.27Å; W149-R186 VanDerWaalsContact N-NH2 3.1Å; W149-R186 VanDerWaalsContact NE1-CZ 3.3Å; E152-R186 IonicContact OE2-CZ 2.75Å; E152-R186 IonicContact OE2-NE 3.9Å; E152-R186 IonicContact OE2-NH2 3.8Å; E152-R186 PolarHBondContact OE2-NH2 2.97Å; L164-R186 HydrophobicContact CD1-CG 4.11Å; A182-R186 WeakPolarHBondContact O-CB 3.46Å; A182-R186 PolarHBondContact O-N 2.97Å; L183-R186 WeakPolarHBondContact O-CB 3.34Å; L183-R186 PolarHBondContact O-N 3.41Å; I184-R186 PolarHBondContact O-N 3.41Å; R186-L188 PolarHBondContact O-N 3.27Å; R186-R189 PolarHBondContact O-N 3.09Å; R186-L190 HydrophobicContact CG-CD1 4.43Å; R186-L190 PolarHBondContact O-N 2.95Å
187	Q	88.1	Confident	85.7	Confident	16 Å²	16	39.2 Å²	39.2	8%	0.075	22%	0.224	C	C	.	.	H	α-helix	trans	-56.2	-45	173.6	-75.4	174.4	-21.2	0	0	110.3	L164 L167 L183 I184 R189 L190 C191 I203	L164-Q187 HydrophobicContact CB-CG 4.12Å; L164-Q187 PolarHBondContact O-NE2 2.83Å; L167-Q187 PolarHBondContact O-NE2 3.2Å; L183-Q187 WeakPolarHBondContact O-CG 3.37Å; L183-Q187 PolarHBondContact O-N 2.91Å; I184-Q187 WeakPolarHBondContact O-CB 3.22Å; I184-Q187 PolarHBondContact O-N 2.94Å; Q187-R189 PolarHBondContact O-N 3.25Å; Q187-L190 PolarHBondContact O-N 3.27Å; Q187-C191 PolarHBondContact O-N 3.4Å; Q187-C191 PolarHBondContact O-SG 3.36Å; Q187-C191 VanDerWaalsContact O-SG 3.32Å; Q187-I203 HydrophobicContact CB-CD1 4.29Å; Q187-I203 HydrophobicContact CB-CG2 4.36Å
188	L	87.9	Confident	86	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.2	-47.6	176.8	-169.9	71.4	0	0	0	111.7	I184 L185 R186 L190 C191 I192 A200 L229 M230 L233	I184-L188 PolarHBondContact O-N 2.95Å; L185-L188 WeakPolarHBondContact O-CB 3.37Å; L185-L188 PolarHBondContact O-N 2.92Å; R186-L188 PolarHBondContact O-N 3.27Å; L188-L190 PolarHBondContact O-N 3.15Å; L188-C191 PolarHBondContact O-N 3.5Å; L188-I192 HydrophobicContact CD1-CD1 4.43Å; L188-I192 HydrophobicContact CD2-CD1 4.49Å; L188-I192 HydrophobicContact CG-CD1 3.9Å; L188-I192 WeakPolarHBondContact O-CG1 3.41Å; L188-I192 PolarHBondContact O-N 3.21Å; L188-A200 HydrophobicContact CD1-CB 3.72Å; L188-A200 WeakPolarHBondContact CD1-O 3.3Å; L188-L229 HydrophobicContact CB-CD1 4.33Å; L188-L229 HydrophobicContact CD2-CB 3.78Å; L188-L229 HydrophobicContact CD2-CD1 4.04Å; L188-L229 HydrophobicContact CG-CB 4.39Å; L188-L229 HydrophobicContact CG-CD1 4.39Å; L188-M230 HydrophobicContact CD2-SD 4.22Å; L188-L233 HydrophobicContact CD1-CD1 4.42Å
189	R	90.6	Very high	86.1	Confident	93 Å²	93	44.5 Å²	44.5	35%	0.351	23%	0.229	S	C	.	.	H	α-helix	trans	-58	-46	178.1	-174.6	-179.2	68	92.1	5.3	112.7	E152 L185 R186 Q187 I192 A193 L229	E152-R189 IonicContact OE1-CZ 3.91Å; E152-R189 IonicContact OE1-NH1 3.64Å; E152-R189 PolarHBondContact OE1-NH1 3.25Å; E152-R189 IonicContact OE1-NH2 2.81Å; E152-R189 PolarHBondContact OE1-NH2 3Å; E152-R189 IonicContact OE2-CZ 2.94Å; E152-R189 IonicContact OE2-NH2 2.56Å; E152-R189 PolarHBondContact OE2-NH2 3.44Å; L185-R189 PolarHBondContact O-N 3.15Å; R186-R189 PolarHBondContact O-N 3.09Å; Q187-R189 PolarHBondContact O-N 3.25Å; R189-I192 PolarHBondContact O-N 3.21Å; R189-A193 WeakPolarHBondContact O-CB 3.35Å; R189-A193 PolarHBondContact O-N 3.33Å; R189-L229 HydrophobicContact CB-CD1 4.05Å; R189-L229 HydrophobicContact CB-CD2 3.8Å; R189-L229 HydrophobicContact CG-CD2 3.9Å
190	L	88.5	Confident	86.3	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-68.2	-37.3	179.4	-69.6	173	0	0	0	111.9	L157 A160 K161 L164 R186 Q187 L188 A193 L194	L157-L190 HydrophobicContact CD2-CD2 4.22Å; A160-L190 HydrophobicContact CB-CD1 4.33Å; K161-L190 HydrophobicContact CB-CB 4.4Å; L164-L190 HydrophobicContact CD1-CD1 3.35Å; R186-L190 HydrophobicContact CG-CD1 4.43Å; R186-L190 PolarHBondContact O-N 2.95Å; Q187-L190 PolarHBondContact O-N 3.27Å; L188-L190 PolarHBondContact O-N 3.15Å; L190-A193 PolarHBondContact O-N 3.05Å; L190-L194 PolarHBondContact O-N 3.3Å
191	C	87.7	Confident	86.4	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.7	-43.8	173.7	-73.9	0	0	0	0	112.1	K161 Q187 L188 L194 G195 D196 A200	K161-C191 WeakPolarHBondContact CE-SG 3.45Å; Q187-C191 PolarHBondContact O-N 3.4Å; Q187-C191 PolarHBondContact O-SG 3.36Å; Q187-C191 VanDerWaalsContact O-SG 3.32Å; L188-C191 PolarHBondContact O-N 3.5Å; C191-L194 PolarHBondContact O-N 3.41Å; C191-G195 PolarHBondContact O-N 3.09Å; C191-D196 PolarHBondContact O-N 3.41Å; C191-A200 HydrophobicContact CB-CB 4.11Å
192	I	87	Confident	86.5	Confident	22 Å²	22	46.7 Å²	46.7	11%	0.113	24%	0.243	C	C	.	.	H	α-helix	trans	-66.2	-42.1	178.1	-68.1	164.4	0	0	0	110.9	L188 R189 L194 G195 A200 L229 K232 L233	L188-I192 HydrophobicContact CD1-CD1 4.43Å; L188-I192 HydrophobicContact CD2-CD1 4.49Å; L188-I192 HydrophobicContact CG-CD1 3.9Å; L188-I192 WeakPolarHBondContact O-CG1 3.41Å; L188-I192 PolarHBondContact O-N 3.21Å; R189-I192 PolarHBondContact O-N 3.21Å; I192-L194 PolarHBondContact O-N 3.23Å; I192-G195 PolarHBondContact O-N 2.9Å; I192-A200 HydrophobicContact CG1-CB 4.33Å; I192-L229 HydrophobicContact CD1-CB 3.82Å; I192-L229 HydrophobicContact CD1-CD2 4.05Å; I192-L229 HydrophobicContact CD1-CG 4.49Å; I192-L229 VanDerWaalsContact CD1-O 3.3Å; I192-L229 WeakPolarHBondContact CD1-O 3.5Å; I192-K232 HydrophobicContact CG2-CB 3.94Å; I192-K232 HydrophobicContact CG2-CD 4.48Å; I192-L233 HydrophobicContact CD1-CB 4.35Å
193	A	87.3	Confident	86.4	Confident	63 Å²	63	45.5 Å²	45.5	52%	0.521	23%	0.231	S	C	.	.	H	α-helix	trans	-60.7	-30.6	178.6	0	0	0	0	0	113	R189 L190	R189-A193 WeakPolarHBondContact O-CB 3.35Å; R189-A193 PolarHBondContact O-N 3.33Å; L190-A193 PolarHBondContact O-N 3.05Å
194	L	86.9	Confident	86.2	Confident	54 Å²	54	47.1 Å²	47.1	28%	0.283	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.1	176.7	-70.5	166.7	0	0	0	113.8	L157 E158 K161 L190 C191 I192	L157-L194 HydrophobicContact CB-CD1 4.44Å; L157-L194 HydrophobicContact CB-CD2 3.85Å; L157-L194 HydrophobicContact CB-CG 4.22Å; E158-L194 HydrophobicContact CG-CD1 4.23Å; E158-L194 HydrophobicContact CG-CD2 3.61Å; K161-L194 HydrophobicContact CB-CD1 3.79Å; K161-L194 HydrophobicContact CD-CD1 3.4Å; K161-L194 VanDerWaalsContact CD-CD1 3.4Å; K161-L194 HydrophobicContact CG-CD1 4.25Å; L190-L194 PolarHBondContact O-N 3.3Å; C191-L194 PolarHBondContact O-N 3.41Å; I192-L194 PolarHBondContact O-N 3.23Å
195	G	83.9	Confident	85.9	Confident	37 Å²	37	55.3 Å²	55.3	38%	0.381	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	11.4	-179.7	0	0	0	0	0	115.6	C191 I192 F197	C191-G195 PolarHBondContact O-N 3.09Å; I192-G195 PolarHBondContact O-N 2.9Å; G195-F197 VanDerWaalsContact O-CD2 3.23Å; G195-F197 WeakPolarHBondContact O-CD2 3.34Å; G195-F197 WeakPolarHBondContact O-CE2 3.45Å; G195-F197 PolarHBondContact O-N 3.02Å; G195-F197 VanDerWaalsContact O-N 3.08Å
196	D	86.1	Confident	85.4	Confident	56 Å²	56	59.2 Å²	59.2	30%	0.299	29%	0.294	S	S	.	.			trans	-85.7	74.3	179.6	-92.3	3.2	0	0	0	111	K161 C191 T198 R199 A200	K161-D196 IonicContact NZ-OD2 3.02Å; K161-D196 PolarHBondContact NZ-OD2 3.2Å; C191-D196 PolarHBondContact O-N 3.41Å; D196-T198 PolarHBondContact O-N 3.37Å; D196-R199 IonicContact OD2-CZ 2.65Å; D196-R199 IonicContact OD2-NH1 3.16Å; D196-R199 PolarHBondContact OD2-NH1 3.13Å; D196-A200 PolarHBondContact O-N 3.38Å
197	F	84.6	Confident	85.1	Confident	70 Å²	70	58.9 Å²	58.9	31%	0.307	29%	0.294	S	S	.	.	H	α-helix	trans	-66.7	-33.4	-176.1	-58	-70.3	0	0	0	114	G195 A200 R201	G195-F197 VanDerWaalsContact O-CD2 3.23Å; G195-F197 WeakPolarHBondContact O-CD2 3.34Å; G195-F197 WeakPolarHBondContact O-CE2 3.45Å; G195-F197 PolarHBondContact O-N 3.02Å; G195-F197 VanDerWaalsContact O-N 3.08Å; F197-A200 WeakPolarHBondContact O-CB 3.47Å; F197-A200 PolarHBondContact O-N 3.23Å; F197-R201 PolarHBondContact O-N 3.42Å; F197-R201 VanDerWaalsContact O-N 3.09Å
198	T	85.3	Confident	84.4	Confident	109 Å²	109	61.7 Å²	61.7	67%	0.669	31%	0.314	S	S	*	.	H	α-helix	trans	-63.5	-45.8	-179.9	52.9	0	0	0	0	112.2	D196 A200 R201 I202	D196-T198 PolarHBondContact O-N 3.37Å; T198-A200 VanDerWaalsContact C-N 3.34Å; T198-R201 PolarHBondContact O-N 3.37Å; T198-I202 WeakPolarHBondContact O-CG1 3.26Å; T198-I202 PolarHBondContact O-N 3.26Å
199	R	83.1	Confident	83.5	Confident	130 Å²	130	71 Å²	71	49%	0.491	36%	0.355	S	S	.	.	H	α-helix	trans	-67.5	-36.7	175.8	-72.1	177.3	173	157.5	-9.8	111.6	D196 R201 I202 I203	D196-R199 IonicContact OD2-CZ 2.65Å; D196-R199 IonicContact OD2-NH1 3.16Å; D196-R199 PolarHBondContact OD2-NH1 3.13Å; R199-R201 VanDerWaalsContact C-N 3.33Å; R199-R201 PolarHBondContact O-N 3.49Å; R199-I202 PolarHBondContact O-N 3.15Å; R199-I202 VanDerWaalsContact O-N 3.13Å; R199-I203 WeakPolarHBondContact O-CG1 3.47Å; R199-I203 PolarHBondContact O-N 3Å; R199-I203 VanDerWaalsContact O-N 3.07Å
200	A	84.6	Confident	82.6	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-58.8	-43.9	176.7	0	0	0	0	0	111.6	L188 C191 I192 D196 F197 T198 I202 I203 E204 L233	L188-A200 HydrophobicContact CD1-CB 3.72Å; L188-A200 WeakPolarHBondContact CD1-O 3.3Å; C191-A200 HydrophobicContact CB-CB 4.11Å; I192-A200 HydrophobicContact CG1-CB 4.33Å; D196-A200 PolarHBondContact O-N 3.38Å; F197-A200 WeakPolarHBondContact O-CB 3.47Å; F197-A200 PolarHBondContact O-N 3.23Å; T198-A200 VanDerWaalsContact C-N 3.34Å; A200-I202 VanDerWaalsContact C-N 3.32Å; A200-I202 PolarHBondContact O-N 3.07Å; A200-I203 PolarHBondContact O-N 2.94Å; A200-E204 PolarHBondContact O-N 2.9Å; A200-L233 HydrophobicContact CB-CD1 3.49Å; A200-L233 VanDerWaalsContact CB-CD1 3.49Å
201	R	84.6	Confident	81.4	Confident	127 Å²	127	73.1 Å²	73.1	48%	0.479	38%	0.376	S	S	.	.	H	α-helix	trans	-62	-33.5	173.5	-81.6	-165.9	170.6	-169.9	-1.4	114.3	F197 T198 R199 K205 L233 E237	F197-R201 PolarHBondContact O-N 3.42Å; F197-R201 VanDerWaalsContact O-N 3.09Å; T198-R201 PolarHBondContact O-N 3.37Å; R199-R201 VanDerWaalsContact C-N 3.33Å; R199-R201 PolarHBondContact O-N 3.49Å; R201-K205 PolarHBondContact O-N 3.25Å; R201-L233 HydrophobicContact CG-CD1 4.36Å; R201-L233 HydrophobicContact CG-CD2 4.06Å; R201-E237 WeakPolarHBondContact CD-OE1 3.37Å; R201-E237 IonicContact CZ-OE1 3.43Å; R201-E237 IonicContact CZ-OE2 3.13Å; R201-E237 IonicContact NE-OE1 3.63Å; R201-E237 PolarHBondContact NE-OE1 2.98Å; R201-E237 IonicContact NE-OE2 3.14Å; R201-E237 PolarHBondContact NE-OE2 3.19Å; R201-E237 IonicContact NH2-OE1 2.92Å; R201-E237 PolarHBondContact NH2-OE1 3.15Å; R201-E237 IonicContact NH2-OE2 2.69Å; R201-E237 PolarHBondContact NH2-OE2 3.06Å
202	I	85.8	Confident	80.4	Confident	109 Å²	109	74.7 Å²	74.7	56%	0.559	38%	0.383	S	S	*	.	H	α-helix	trans	-68.4	-43	177.1	-63.2	168.2	0	0	0	109.8	T198 R199 A200 K205	T198-I202 WeakPolarHBondContact O-CG1 3.26Å; T198-I202 PolarHBondContact O-N 3.26Å; R199-I202 PolarHBondContact O-N 3.15Å; R199-I202 VanDerWaalsContact O-N 3.13Å; A200-I202 VanDerWaalsContact C-N 3.32Å; A200-I202 PolarHBondContact O-N 3.07Å; I202-K205 PolarHBondContact O-N 3.04Å
203	I	82.9	Confident	79.4	Confident	13 Å²	13	78.9 Å²	78.9	7%	0.067	41%	0.405	C	S	.	.	H	α-helix	trans	-66.3	-39.7	179.1	-64.5	162	0	0	0	110.9	L165 I184 Q187 R199 A200 K205 N206	L165-I203 HydrophobicContact CD2-CD1 3.85Å; I184-I203 HydrophobicContact CG2-CG2 3.7Å; Q187-I203 HydrophobicContact CB-CD1 4.29Å; Q187-I203 HydrophobicContact CB-CG2 4.36Å; R199-I203 WeakPolarHBondContact O-CG1 3.47Å; R199-I203 PolarHBondContact O-N 3Å; R199-I203 VanDerWaalsContact O-N 3.07Å; A200-I203 PolarHBondContact O-N 2.94Å; I203-K205 VanDerWaalsContact C-N 3.33Å; I203-K205 PolarHBondContact O-N 3.21Å; I203-N206 WeakPolarHBondContact O-CB 3.3Å; I203-N206 PolarHBondContact O-N 2.92Å; I203-N206 VanDerWaalsContact O-N 3.08Å
204	E	82.4	Confident	78.3	Confident	54 Å²	54	80.3 Å²	80.3	25%	0.252	40%	0.404	S	S	.	.	H	α-helix	trans	-54	-47.3	175.2	-178	-156.1	155.8	0	0	112	A200 N206 I207 M230	A200-E204 PolarHBondContact O-N 2.9Å; E204-N206 PolarHBondContact O-N 2.92Å; E204-I207 WeakPolarHBondContact O-CB 3.31Å; E204-I207 PolarHBondContact O-N 3.45Å; E204-M230 HydrophobicContact CG-CE 3.45Å; E204-M230 VanDerWaalsContact CG-CE 3.45Å; E204-M230 HydrophobicContact CG-SD 3.83Å; E204-M230 WeakPolarHBondContact OE1-CE 3.38Å
205	K	81.6	Confident	77.1	Confident	178 Å²	178	84.8 Å²	84.8	77%	0.774	43%	0.428	S	S	*	.	H	α-helix	trans	-61	-19.6	179.7	-71.6	-178.5	179.9	-175.9	0	113.8	R201 I202 I203 I207	R201-K205 PolarHBondContact O-N 3.25Å; I202-K205 PolarHBondContact O-N 3.04Å; I203-K205 VanDerWaalsContact C-N 3.33Å; I203-K205 PolarHBondContact O-N 3.21Å; K205-I207 VanDerWaalsContact C-N 3.29Å
206	N	78	Confident	76.8	Confident	86 Å²	86	86.1 Å²	86.1	46%	0.46	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-7.1	178.2	-64.8	-27.1	0	0	0	113.1	I203 E204 P208	I203-N206 WeakPolarHBondContact O-CB 3.3Å; I203-N206 PolarHBondContact O-N 2.92Å; I203-N206 VanDerWaalsContact O-N 3.08Å; E204-N206 PolarHBondContact O-N 2.92Å; N206-P208 WeakPolarHBondContact O-CD 3.45Å
207	I	80	Confident	76.3	Confident	18 Å²	18	88.4 Å²	88.4	9%	0.092	44%	0.442	C	S	.	.	S	Bend	trans	-80	121.2	176.3	-59.6	169.7	0	0	0	108.6	L181 I184 L185 E204 K205 A211 F212 Y226	L181-I207 HydrophobicContact CD1-CG2 3.99Å; I184-I207 HydrophobicContact CG2-CD1 3.95Å; I184-I207 HydrophobicContact CG2-CG1 3.57Å; L185-I207 HydrophobicContact CD2-CD1 4.39Å; E204-I207 WeakPolarHBondContact O-CB 3.31Å; E204-I207 PolarHBondContact O-N 3.45Å; K205-I207 VanDerWaalsContact C-N 3.29Å; I207-A211 HydrophobicContact CG2-CB 4.14Å; I207-F212 HydrophobicContact CG2-CE2 4Å; I207-F212 HydrophobicContact CG2-CZ 4.24Å; I207-Y226 HydrophobicContact CD1-CD2 3.85Å; I207-Y226 HydrophobicContact CD1-CE2 3.49Å; I207-Y226 VanDerWaalsContact CD1-CE2 3.49Å
208	P	72.8	Confident	76	Confident	76 Å²	76	90.2 Å²	90.2	49%	0.494	46%	0.455	S	S	.	.			trans	-68.4	137.5	176.1	24.6	-26.9	0	0	0	109.9	N206 N210 A211	N206-P208 WeakPolarHBondContact O-CD 3.45Å; P208-N210 PolarHBondContact O-N 3.44Å; P208-N210 VanDerWaalsContact O-N 3.07Å; P208-A211 HydrophobicContact CG-CB 4.05Å; P208-A211 WeakPolarHBondContact O-CB 3.43Å; P208-A211 PolarHBondContact O-N 2.92Å
209	K	70.4	Confident	75.6	Confident	196 Å²	196	85.8 Å²	85.8	85%	0.852	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-55.7	-29.8	-178.1	-64.5	-175.6	179.1	-177	0	113.3	A211	K209-A211 VanDerWaalsContact C-N 3.31Å; K209-A211 PolarHBondContact O-N 3.48Å
210	N	70.1	Confident	75.4	Confident	118 Å²	118	80.8 Å²	80.8	63%	0.631	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-89.8	9.1	-178.2	-55.4	8.8	0	0	0	112.7	P208 F212 D213	P208-N210 PolarHBondContact O-N 3.44Å; P208-N210 VanDerWaalsContact O-N 3.07Å; N210-F212 PolarHBondContact O-N 3.09Å; N210-D213 WeakPolarHBondContact CA-OD2 3.34Å; N210-D213 VanDerWaalsContact CB-OD2 3.29Å; N210-D213 WeakPolarHBondContact CB-OD2 3.49Å
211	A	63.8	Low	75.4	Confident	20 Å²	20	87.9 Å²	87.9	17%	0.165	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-61.2	-25.8	-176.7	0	0	0	0	0	113	L181 I207 P208 K209	L181-A211 HydrophobicContact CD1-CB 4.16Å; L181-A211 HydrophobicContact CD2-CB 4.42Å; I207-A211 HydrophobicContact CG2-CB 4.14Å; P208-A211 HydrophobicContact CG-CB 4.05Å; P208-A211 WeakPolarHBondContact O-CB 3.43Å; P208-A211 PolarHBondContact O-N 2.92Å; K209-A211 VanDerWaalsContact C-N 3.31Å; K209-A211 PolarHBondContact O-N 3.48Å
212	F	66.4	Low	75.4	Confident	33 Å²	33	83.7 Å²	83.7	15%	0.145	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-106.6	-1	-169.1	-53.9	-77.2	0	0	0	114.1	L181 I207 N210 N214 H223 Y226	L181-F212 HydrophobicContact CD1-CE1 3.95Å; L181-F212 HydrophobicContact CD1-CZ 3.84Å; L181-F212 HydrophobicContact CD2-CD1 3.85Å; L181-F212 HydrophobicContact CD2-CE1 3.51Å; L181-F212 HydrophobicContact CD2-CZ 4.26Å; L181-F212 HydrophobicContact CG-CE1 4.23Å; I207-F212 HydrophobicContact CG2-CE2 4Å; I207-F212 HydrophobicContact CG2-CZ 4.24Å; N210-F212 PolarHBondContact O-N 3.09Å; F212-N214 PolarHBondContact O-N 3.49Å; F212-H223 HydrophobicContact CD1-CB 3.68Å; F212-H223 AromaticContact CD1-CD2 3.37Å; F212-H223 WeakPolarHBondContact CD1-CD2 3.5Å; F212-H223 AromaticContact CD1-CG 3.85Å; F212-H223 AromaticContact CD2-CD2 3.49Å; F212-H223 VanDerWaalsContact CD2-CD2 3.49Å; F212-H223 WeakPolarHBondContact CD2-CD2 3.37Å; F212-H223 AromaticContact CD2-NE2 3.96Å; F212-H223 HydrophobicContact CE1-CB 4.11Å; F212-H223 AromaticContact CE1-CD2 3.73Å; F212-H223 AromaticContact CE2-CD2 3.88Å; F212-H223 HydrophobicContact CG-CB 4.28Å; F212-H223 AromaticContact CG-CD2 3.21Å; F212-H223 WeakPolarHBondContact CG-CD2 3.48Å; F212-H223 AromaticContact CG-CG 3.98Å; F212-H223 AromaticContact CG-NE2 3.96Å; F212-H223 AromaticContact CZ-CD2 3.98Å; F212-Y226 HydrophobicContact CE2-CD1 4.18Å; F212-Y226 HydrophobicContact CE2-CE1 4.4Å; F212-Y226 HydrophobicContact CE2-CG 4.47Å; F212-Y226 AromaticContact CZ-CD1 3.94Å; F212-Y226 HydrophobicContact CZ-CD1 3.94Å; F212-Y226 HydrophobicContact CZ-CD2 4.36Å; F212-Y226 AromaticContact CZ-CG 3.82Å; F212-Y226 HydrophobicContact CZ-CG 3.82Å
213	D	66	Low	75.4	Confident	109 Å²	109	80.4 Å²	80.4	58%	0.583	41%	0.406	S	S	*	.			trans	-64.8	-14.8	-175.3	-64.2	-17.3	0	0	0	113.3	N210 L215	N210-D213 WeakPolarHBondContact CA-OD2 3.34Å; N210-D213 VanDerWaalsContact CB-OD2 3.29Å; N210-D213 WeakPolarHBondContact CB-OD2 3.49Å; D213-L215 PolarHBondContact O-N 3.09Å
214	N	64.7	Low	75.6	Confident	94 Å²	94	80.9 Å²	80.9	50%	0.503	41%	0.409	S	S	.	.			trans	-74.6	117.6	176.5	-63.7	-48.2	0	0	0	110.4	F212 S216 S219	F212-N214 PolarHBondContact O-N 3.49Å; N214-S216 PolarHBondContact O-N 2.97Å; N214-S219 WeakPolarHBondContact O-CB 3.35Å; N214-S219 PolarHBondContact O-OG 3.33Å; N214-S219 VanDerWaalsContact O-OG 3.11Å
215	L	62.6	Low	75.8	Confident	148 Å²	148	82.8 Å²	82.8	78%	0.775	42%	0.417	S	S	*	.			trans	-66.6	4.8	-179.7	-76.5	104	0	0	0	115.6	D213 Q220	D213-L215 PolarHBondContact O-N 3.09Å; L215-Q220 PolarHBondContact O-NE2 3.44Å
216	S	76.4	Confident	76.2	Confident	65 Å²	65	75.7 Å²	75.7	46%	0.455	39%	0.386	S	S	.	.			trans	-60.1	141.8	178.4	179.4	0	0	0	0	111.5	N214 D218 S219 Q220	N214-S216 PolarHBondContact O-N 2.97Å; S216-D218 PolarHBondContact O-N 2.93Å; S216-S219 WeakPolarHBondContact O-CB 3.3Å; S216-S219 PolarHBondContact O-N 2.99Å; S216-Q220 PolarHBondContact O-N 3.44Å
217	I	76.8	Confident	76.7	Confident	104 Å²	104	71.7 Å²	71.7	53%	0.533	36%	0.364	S	S	.	.	H	α-helix	trans	-55.4	-39	178.4	-60.1	171.6	0	0	0	110.7	Q220 R221	I217-Q220 PolarHBondContact O-N 3.28Å; I217-R221 WeakPolarHBondContact O-CG 3.47Å; I217-R221 PolarHBondContact O-N 3.35Å
218	D	77.1	Confident	77.2	Confident	107 Å²	107	75 Å²	75	57%	0.572	38%	0.38	S	S	*	.	H	α-helix	trans	-65.5	-41.9	177.6	-66.3	-33.4	0	0	0	111.4	S216 Q220 R221 M222	S216-D218 PolarHBondContact O-N 2.93Å; D218-Q220 VanDerWaalsContact C-N 3.31Å; D218-Q220 PolarHBondContact O-N 3.22Å; D218-R221 PolarHBondContact O-N 3.17Å; D218-M222 WeakPolarHBondContact O-CG 3.4Å; D218-M222 PolarHBondContact O-N 3.23Å
219	S	78.3	Confident	78	Confident	17 Å²	17	72 Å²	72	12%	0.119	36%	0.359	C	S	.	.	H	α-helix	trans	-60.7	-42	176	-171.9	0	0	0	0	111.2	N214 S216 M222 H223	N214-S219 WeakPolarHBondContact O-CB 3.35Å; N214-S219 PolarHBondContact O-OG 3.33Å; N214-S219 VanDerWaalsContact O-OG 3.11Å; S216-S219 WeakPolarHBondContact O-CB 3.3Å; S216-S219 PolarHBondContact O-N 2.99Å; S219-M222 PolarHBondContact O-N 2.68Å; S219-H223 WeakPolarHBondContact O-CB 3.45Å; S219-H223 PolarHBondContact O-N 2.92Å
220	Q	79	Confident	78.8	Confident	25 Å²	25	62.9 Å²	62.9	12%	0.117	32%	0.32	C	S	.	.	H	α-helix	trans	-65.1	-41.1	176.9	-63.9	-177.1	36.7	0	0	112.2	L215 S216 I217 D218 M222 H223 I224 I253 V255	L215-Q220 PolarHBondContact O-NE2 3.44Å; S216-Q220 PolarHBondContact O-N 3.44Å; I217-Q220 PolarHBondContact O-N 3.28Å; D218-Q220 VanDerWaalsContact C-N 3.31Å; D218-Q220 PolarHBondContact O-N 3.22Å; Q220-M222 VanDerWaalsContact C-N 3.32Å; Q220-M222 PolarHBondContact O-N 2.89Å; Q220-H223 WeakPolarHBondContact O-CB 3.34Å; Q220-H223 PolarHBondContact O-N 3.4Å; Q220-I224 WeakPolarHBondContact O-CG1 3.22Å; Q220-I224 PolarHBondContact O-N 3.24Å; Q220-I253 HydrophobicContact CB-CG2 4Å; Q220-I253 HydrophobicContact CG-CG2 4.31Å; Q220-V255 HydrophobicContact CB-CG2 3.98Å
221	R	84.2	Confident	79.7	Confident	149 Å²	149	58 Å²	58	56%	0.562	29%	0.293	S	S	*	.	H	α-helix	trans	-62.1	-40.2	173.5	-74.5	176.7	172.5	-176.8	-3	112	I217 D218 H223 I224 Q225	I217-R221 WeakPolarHBondContact O-CG 3.47Å; I217-R221 PolarHBondContact O-N 3.35Å; D218-R221 PolarHBondContact O-N 3.17Å; R221-H223 VanDerWaalsContact C-N 3.32Å; R221-I224 PolarHBondContact O-N 3.46Å; R221-Q225 WeakPolarHBondContact O-CG 3.42Å; R221-Q225 PolarHBondContact O-N 2.84Å
222	M	83.8	Confident	80.7	Confident	38 Å²	38	62.9 Å²	62.9	19%	0.187	31%	0.311	C	S	.	.	H	α-helix	trans	-67.9	-34.8	176	-63.1	-57.5	-92.9	0	0	111.8	L181 A182 L185 D218 S219 Q220 Q225 Y226	L181-M222 HydrophobicContact CD2-CB 4.2Å; A182-M222 HydrophobicContact CB-CE 3.28Å; L185-M222 HydrophobicContact CD1-CB 3.96Å; L185-M222 HydrophobicContact CD1-CE 3.91Å; L185-M222 VanDerWaalsContact CD1-O 3.31Å; L185-M222 WeakPolarHBondContact CD1-O 3.44Å; L185-M222 HydrophobicContact CD1-SD 4.36Å; D218-M222 WeakPolarHBondContact O-CG 3.4Å; D218-M222 PolarHBondContact O-N 3.23Å; S219-M222 PolarHBondContact O-N 2.68Å; Q220-M222 VanDerWaalsContact C-N 3.32Å; Q220-M222 PolarHBondContact O-N 2.89Å; M222-Q225 PolarHBondContact O-N 2.64Å; M222-Y226 WeakPolarHBondContact O-CB 3.42Å; M222-Y226 PolarHBondContact O-N 2.95Å
223	H	85.4	Confident	81.7	Confident	41 Å²	41	61.4 Å²	61.4	19%	0.19	31%	0.305	C	S	.	.	H	α-helix	trans	-65.1	-40.5	173.6	-164.7	-126.9	0	0	0	112	F212 S219 Q220 R221 Y226 H227 I253	F212-H223 HydrophobicContact CD1-CB 3.68Å; F212-H223 AromaticContact CD1-CD2 3.37Å; F212-H223 WeakPolarHBondContact CD1-CD2 3.5Å; F212-H223 AromaticContact CD1-CG 3.85Å; F212-H223 AromaticContact CD2-CD2 3.49Å; F212-H223 VanDerWaalsContact CD2-CD2 3.49Å; F212-H223 WeakPolarHBondContact CD2-CD2 3.37Å; F212-H223 AromaticContact CD2-NE2 3.96Å; F212-H223 HydrophobicContact CE1-CB 4.11Å; F212-H223 AromaticContact CE1-CD2 3.73Å; F212-H223 AromaticContact CE2-CD2 3.88Å; F212-H223 HydrophobicContact CG-CB 4.28Å; F212-H223 AromaticContact CG-CD2 3.21Å; F212-H223 WeakPolarHBondContact CG-CD2 3.48Å; F212-H223 AromaticContact CG-CG 3.98Å; F212-H223 AromaticContact CG-NE2 3.96Å; F212-H223 AromaticContact CZ-CD2 3.98Å; S219-H223 WeakPolarHBondContact O-CB 3.45Å; S219-H223 PolarHBondContact O-N 2.92Å; Q220-H223 WeakPolarHBondContact O-CB 3.34Å; Q220-H223 PolarHBondContact O-N 3.4Å; R221-H223 VanDerWaalsContact C-N 3.32Å; H223-Y226 WeakPolarHBondContact O-CB 3.21Å; H223-Y226 PolarHBondContact O-N 3.28Å; H223-H227 AromaticContact CD2-NE2 3.74Å; H223-H227 AromaticContact CE1-CD2 3.74Å; H223-H227 AromaticContact CE1-NE2 3.06Å; H223-H227 PolarHBondContact CE1-NE2 3.24Å; H223-H227 AromaticContact ND1-CD2 3.91Å; H223-H227 AromaticContact ND1-NE2 3.7Å; H223-H227 AromaticContact NE2-CD2 3.94Å; H223-H227 AromaticContact NE2-NE2 3.12Å; H223-H227 PolarHBondContact NE2-NE2 3.06Å; H223-H227 VanDerWaalsContact NE2-NE2 3.12Å; H223-H227 PolarHBondContact O-CD2 3.08Å; H223-H227 PolarHBondContact O-N 3.3Å; H223-I253 HydrophobicContact CB-CD1 4.27Å; H223-I253 WeakPolarHBondContact ND1-CD1 3.21Å; H223-I253 WeakPolarHBondContact ND1-CG1 3.45Å
224	I	86.7	Confident	82.5	Confident	23 Å²	23	56.5 Å²	56.5	12%	0.118	28%	0.279	C	S	.	.	H	α-helix	trans	-60.6	-51.5	172.8	-70.6	167.5	0	0	0	110.7	Q220 R221 Y226 H227 E228 M250 I253 V255 I256	Q220-I224 WeakPolarHBondContact O-CG1 3.22Å; Q220-I224 PolarHBondContact O-N 3.24Å; R221-I224 PolarHBondContact O-N 3.46Å; I224-Y226 PolarHBondContact O-N 3.24Å; I224-H227 PolarHBondContact O-N 3.23Å; I224-H227 VanDerWaalsContact O-N 3.15Å; I224-E228 HydrophobicContact CG2-CG 4.49Å; I224-E228 WeakPolarHBondContact O-CG 3.4Å; I224-E228 PolarHBondContact O-N 2.84Å; I224-M250 HydrophobicContact CB-CE 4.46Å; I224-M250 HydrophobicContact CG1-CE 4.48Å; I224-M250 HydrophobicContact CG2-CE 3.63Å; I224-I253 HydrophobicContact CD1-CG2 4.43Å; I224-I253 HydrophobicContact CG1-CD1 3.73Å; I224-I253 HydrophobicContact CG1-CG2 4.36Å; I224-V255 HydrophobicContact CD1-CB 4.27Å; I224-V255 HydrophobicContact CD1-CG1 3.92Å; I224-I256 HydrophobicContact CD1-CD1 3.76Å; I224-I256 HydrophobicContact CD1-CG1 3.84Å; I224-I256 HydrophobicContact CG1-CD1 3.76Å; I224-I256 HydrophobicContact CG1-CG1 4.39Å
225	Q	87.6	Confident	83.3	Confident	93 Å²	93	54.7 Å²	54.7	44%	0.435	27%	0.267	S	S	.	.	H	α-helix	trans	-58.6	-37.8	177.7	-72.4	179.4	4	0	0	112	R221 M222 L229	R221-Q225 WeakPolarHBondContact O-CG 3.42Å; R221-Q225 PolarHBondContact O-N 2.84Å; M222-Q225 PolarHBondContact O-N 2.64Å; Q225-L229 VanDerWaalsContact O-CG 3.24Å; Q225-L229 WeakPolarHBondContact O-CG 3.35Å; Q225-L229 PolarHBondContact O-N 3.31Å; Q225-L229 VanDerWaalsContact O-N 3.11Å
226	Y	90.1	Very high	83.9	Confident	30 Å²	30	49.8 Å²	49.8	12%	0.118	25%	0.252	C	S	.	.	H	α-helix	trans	-58	-56.1	173.7	172.7	-110.5	0	0	0	111	L185 I207 F212 M222 H223 I224 E228 L229 M230	L185-Y226 HydrophobicContact CD2-CD2 3.59Å; L185-Y226 HydrophobicContact CD2-CG 4.08Å; I207-Y226 HydrophobicContact CD1-CD2 3.85Å; I207-Y226 HydrophobicContact CD1-CE2 3.49Å; I207-Y226 VanDerWaalsContact CD1-CE2 3.49Å; F212-Y226 HydrophobicContact CE2-CD1 4.18Å; F212-Y226 HydrophobicContact CE2-CE1 4.4Å; F212-Y226 HydrophobicContact CE2-CG 4.47Å; F212-Y226 AromaticContact CZ-CD1 3.94Å; F212-Y226 HydrophobicContact CZ-CD1 3.94Å; F212-Y226 HydrophobicContact CZ-CD2 4.36Å; F212-Y226 AromaticContact CZ-CG 3.82Å; F212-Y226 HydrophobicContact CZ-CG 3.82Å; M222-Y226 WeakPolarHBondContact O-CB 3.42Å; M222-Y226 PolarHBondContact O-N 2.95Å; H223-Y226 WeakPolarHBondContact O-CB 3.21Å; H223-Y226 PolarHBondContact O-N 3.28Å; I224-Y226 PolarHBondContact O-N 3.24Å; Y226-E228 VanDerWaalsContact C-N 3.31Å; Y226-E228 PolarHBondContact O-N 3.02Å; Y226-L229 WeakPolarHBondContact O-CB 3.41Å; Y226-L229 PolarHBondContact O-N 3.29Å; Y226-L229 VanDerWaalsContact O-N 3.07Å; Y226-M230 HydrophobicContact CD1-CG 4.23Å; Y226-M230 HydrophobicContact CD2-CG 3.9Å; Y226-M230 HydrophobicContact CD2-SD 4.36Å; Y226-M230 HydrophobicContact CE1-CG 3.92Å; Y226-M230 HydrophobicContact CE2-CE 4.24Å; Y226-M230 HydrophobicContact CE2-CG 3.55Å; Y226-M230 HydrophobicContact CE2-SD 3.62Å; Y226-M230 HydrophobicContact CG-CG 4.25Å; Y226-M230 WeakPolarHBondContact O-CG 3.3Å; Y226-M230 PolarHBondContact O-N 2.69Å; Y226-M230 WeakPolarHBondContact OH-CE 3.09Å
227	H	89.1	Confident	83.8	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-38.6	-179.6	-72.2	-60.9	0	0	0	113	H223 I224 L229 M230 I231 H246 E249	H223-H227 AromaticContact CD2-NE2 3.74Å; H223-H227 AromaticContact CE1-CD2 3.74Å; H223-H227 AromaticContact CE1-NE2 3.06Å; H223-H227 PolarHBondContact CE1-NE2 3.24Å; H223-H227 AromaticContact ND1-CD2 3.91Å; H223-H227 AromaticContact ND1-NE2 3.7Å; H223-H227 AromaticContact NE2-CD2 3.94Å; H223-H227 AromaticContact NE2-NE2 3.12Å; H223-H227 PolarHBondContact NE2-NE2 3.06Å; H223-H227 VanDerWaalsContact NE2-NE2 3.12Å; H223-H227 PolarHBondContact O-CD2 3.08Å; H223-H227 PolarHBondContact O-N 3.3Å; I224-H227 PolarHBondContact O-N 3.23Å; I224-H227 VanDerWaalsContact O-N 3.15Å; H227-L229 VanDerWaalsContact C-N 3.3Å; H227-L229 PolarHBondContact O-N 3.46Å; H227-M230 PolarHBondContact O-N 2.95Å; H227-I231 WeakPolarHBondContact O-CB 3.42Å; H227-I231 WeakPolarHBondContact O-CD1 3.42Å; H227-I231 WeakPolarHBondContact O-CG1 3.37Å; H227-I231 PolarHBondContact O-N 3.37Å; H227-H246 AromaticContact ND1-CG 3.99Å; H227-H246 AromaticContact ND1-ND1 3.57Å; H227-E249 IonicContact CE1-OE2 3.76Å; H227-E249 PolarHBondContact CE1-OE2 3.43Å; H227-E249 IonicContact ND1-OE2 3.59Å
228	E	89.8	Confident	83.6	Confident	88 Å²	88	47.4 Å²	47.4	41%	0.411	24%	0.243	S	C	.	.	H	α-helix	trans	-59	-40.8	174.5	-72	176.6	179.7	0	0	112.7	I224 Y226 K232 M250	I224-E228 HydrophobicContact CG2-CG 4.49Å; I224-E228 WeakPolarHBondContact O-CG 3.4Å; I224-E228 PolarHBondContact O-N 2.84Å; Y226-E228 VanDerWaalsContact C-N 3.31Å; Y226-E228 PolarHBondContact O-N 3.02Å; E228-K232 WeakPolarHBondContact O-CG 3.49Å; E228-K232 PolarHBondContact O-N 3.11Å; E228-M250 HydrophobicContact CG-CE 4.43Å
229	L	89.5	Confident	83.8	Confident	13 Å²	13	43.6 Å²	43.6	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-69.1	-40.6	175.6	-66.8	173.8	0	0	0	111.3	L185 L188 R189 I192 Q225 Y226 H227 I231 K232 L233	L185-L229 WeakPolarHBondContact O-CD1 3.4Å; L188-L229 HydrophobicContact CB-CD1 4.33Å; L188-L229 HydrophobicContact CD2-CB 3.78Å; L188-L229 HydrophobicContact CD2-CD1 4.04Å; L188-L229 HydrophobicContact CG-CB 4.39Å; L188-L229 HydrophobicContact CG-CD1 4.39Å; R189-L229 HydrophobicContact CB-CD1 4.05Å; R189-L229 HydrophobicContact CB-CD2 3.8Å; R189-L229 HydrophobicContact CG-CD2 3.9Å; I192-L229 HydrophobicContact CD1-CB 3.82Å; I192-L229 HydrophobicContact CD1-CD2 4.05Å; I192-L229 HydrophobicContact CD1-CG 4.49Å; I192-L229 VanDerWaalsContact CD1-O 3.3Å; I192-L229 WeakPolarHBondContact CD1-O 3.5Å; Q225-L229 VanDerWaalsContact O-CG 3.24Å; Q225-L229 WeakPolarHBondContact O-CG 3.35Å; Q225-L229 PolarHBondContact O-N 3.31Å; Q225-L229 VanDerWaalsContact O-N 3.11Å; Y226-L229 WeakPolarHBondContact O-CB 3.41Å; Y226-L229 PolarHBondContact O-N 3.29Å; Y226-L229 VanDerWaalsContact O-N 3.07Å; H227-L229 VanDerWaalsContact C-N 3.3Å; H227-L229 PolarHBondContact O-N 3.46Å; L229-I231 VanDerWaalsContact C-N 3.33Å; L229-I231 PolarHBondContact O-N 2.86Å; L229-K232 PolarHBondContact O-N 3.46Å; L229-L233 PolarHBondContact O-N 2.84Å
230	M	87.8	Confident	84.2	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.015	23%	0.231	C	C	.	.	H	α-helix	trans	-65.1	-36.3	178	-65	-59.3	-80.1	0	0	112.5	L188 E204 Y226 H227 L233 S234	L188-M230 HydrophobicContact CD2-SD 4.22Å; E204-M230 HydrophobicContact CG-CE 3.45Å; E204-M230 VanDerWaalsContact CG-CE 3.45Å; E204-M230 HydrophobicContact CG-SD 3.83Å; E204-M230 WeakPolarHBondContact OE1-CE 3.38Å; Y226-M230 HydrophobicContact CD1-CG 4.23Å; Y226-M230 HydrophobicContact CD2-CG 3.9Å; Y226-M230 HydrophobicContact CD2-SD 4.36Å; Y226-M230 HydrophobicContact CE1-CG 3.92Å; Y226-M230 HydrophobicContact CE2-CE 4.24Å; Y226-M230 HydrophobicContact CE2-CG 3.55Å; Y226-M230 HydrophobicContact CE2-SD 3.62Å; Y226-M230 HydrophobicContact CG-CG 4.25Å; Y226-M230 WeakPolarHBondContact O-CG 3.3Å; Y226-M230 PolarHBondContact O-N 2.69Å; Y226-M230 WeakPolarHBondContact OH-CE 3.09Å; H227-M230 PolarHBondContact O-N 2.95Å; M230-L233 PolarHBondContact O-N 3.17Å; M230-S234 WeakPolarHBondContact O-CB 3.43Å; M230-S234 PolarHBondContact O-N 2.92Å; M230-S234 PolarHBondContact O-OG 3.07Å
231	I	87.9	Confident	84.6	Confident	16 Å²	16	45.2 Å²	45.2	8%	0.082	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-46.7	172.6	-70.6	157.2	0	0	0	110.2	H227 L229 L233 S234 H235 V243 H246 Y247	H227-I231 WeakPolarHBondContact O-CB 3.42Å; H227-I231 WeakPolarHBondContact O-CD1 3.42Å; H227-I231 WeakPolarHBondContact O-CG1 3.37Å; H227-I231 PolarHBondContact O-N 3.37Å; L229-I231 VanDerWaalsContact C-N 3.33Å; L229-I231 PolarHBondContact O-N 2.86Å; I231-L233 VanDerWaalsContact C-N 3.3Å; I231-L233 PolarHBondContact O-N 2.61Å; I231-S234 PolarHBondContact O-N 3.36Å; I231-H235 WeakPolarHBondContact O-CB 3.44Å; I231-H235 PolarHBondContact O-N 3.32Å; I231-V243 HydrophobicContact CG1-CG1 4.43Å; I231-V243 HydrophobicContact CG2-CG1 4.05Å; I231-H246 HydrophobicContact CG1-CB 4.01Å; I231-Y247 HydrophobicContact CD1-CD1 3.82Å; I231-Y247 HydrophobicContact CD1-CD2 4.25Å; I231-Y247 HydrophobicContact CD1-CE1 3.43Å; I231-Y247 VanDerWaalsContact CD1-CE1 3.43Å; I231-Y247 HydrophobicContact CD1-CE2 3.89Å; I231-Y247 HydrophobicContact CD1-CG 4.22Å; I231-Y247 VanDerWaalsContact CD1-CZ 3.47Å; I231-Y247 HydrophobicContact CG1-CE2 4.18Å; I231-Y247 HydrophobicContact CG2-CE2 4.22Å
232	K	85.9	Confident	84.7	Confident	122 Å²	122	39.9 Å²	39.9	53%	0.53	22%	0.222	S	C	.	.	H	α-helix	trans	-61.4	-39.5	177.1	-70.8	173.3	-176.4	174	0	112.2	I192 E228 L229 G236	I192-K232 HydrophobicContact CG2-CB 3.94Å; I192-K232 HydrophobicContact CG2-CD 4.48Å; E228-K232 WeakPolarHBondContact O-CG 3.49Å; E228-K232 PolarHBondContact O-N 3.11Å; L229-K232 PolarHBondContact O-N 3.46Å; K232-G236 PolarHBondContact O-N 3.01Å
233	L	86.2	Confident	84.9	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-64.7	-49.3	175.9	-172.6	152.2	0	0	0	111.1	L188 I192 A200 R201 L229 M230 I231 H235 G236 E237	L188-L233 HydrophobicContact CD1-CD1 4.42Å; I192-L233 HydrophobicContact CD1-CB 4.35Å; A200-L233 HydrophobicContact CB-CD1 3.49Å; A200-L233 VanDerWaalsContact CB-CD1 3.49Å; R201-L233 HydrophobicContact CG-CD1 4.36Å; R201-L233 HydrophobicContact CG-CD2 4.06Å; L229-L233 PolarHBondContact O-N 2.84Å; M230-L233 PolarHBondContact O-N 3.17Å; I231-L233 VanDerWaalsContact C-N 3.3Å; I231-L233 PolarHBondContact O-N 2.61Å; L233-H235 VanDerWaalsContact C-N 3.26Å; L233-H235 PolarHBondContact O-N 3.16Å; L233-G236 PolarHBondContact O-N 3.28Å; L233-E237 PolarHBondContact O-N 3.32Å
234	S	83.5	Confident	85	Confident	5 Å²	5	36.1 Å²	36.1	4%	0.035	20%	0.204	C	C	.	.	H	α-helix	trans	-64.4	-31.9	-179	-61	0	0	0	0	112.4	M230 I231 G236 E237 G238 G239 V243	M230-S234 WeakPolarHBondContact O-CB 3.43Å; M230-S234 PolarHBondContact O-N 2.92Å; M230-S234 PolarHBondContact O-OG 3.07Å; I231-S234 PolarHBondContact O-N 3.36Å; S234-G236 VanDerWaalsContact C-N 3.35Å; S234-E237 PolarHBondContact O-N 2.89Å; S234-G238 PolarHBondContact O-N 3.09Å; S234-G238 VanDerWaalsContact O-N 3.15Å; S234-G239 PolarHBondContact O-N 3.37Å; S234-V243 VanDerWaalsContact CB-CG2 3.48Å
235	H	81.6	Confident	85	Confident	57 Å²	57	38.7 Å²	38.7	26%	0.264	21%	0.214	S	C	.	.	H	α-helix	trans	-66.5	-36.7	173.9	-159.5	86	0	0	0	112.1	I231 L233 E237 G238 L348 H352	I231-H235 WeakPolarHBondContact O-CB 3.44Å; I231-H235 PolarHBondContact O-N 3.32Å; L233-H235 VanDerWaalsContact C-N 3.26Å; L233-H235 PolarHBondContact O-N 3.16Å; H235-E237 PolarHBondContact O-N 2.87Å; H235-G238 PolarHBondContact O-N 3.35Å; H235-L348 WeakPolarHBondContact NE2-CD1 3.42Å; H235-L348 WeakPolarHBondContact NE2-CD2 3.36Å; H235-H352 AromaticContact CE1-CE1 3.75Å; H235-H352 AromaticContact CE1-NE2 3.56Å
236	G	74.9	Confident	85.1	Confident	45 Å²	45	35.5 Å²	35.5	46%	0.464	20%	0.199	S	C	.	.	H	α-helix	trans	-62.4	-23.3	173.5	0	0	0	0	0	113.7	K232 L233 S234	K232-G236 PolarHBondContact O-N 3.01Å; L233-G236 PolarHBondContact O-N 3.28Å; S234-G236 VanDerWaalsContact C-N 3.35Å
237	E	73.9	Confident	85	Confident	77 Å²	77	35.4 Å²	35.4	36%	0.36	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-6.4	-178.6	-62.8	171.3	163.5	0	0	113.3	R201 L233 S234 H235 G239	R201-E237 WeakPolarHBondContact CD-OE1 3.37Å; R201-E237 IonicContact CZ-OE1 3.43Å; R201-E237 IonicContact CZ-OE2 3.13Å; R201-E237 IonicContact NE-OE1 3.63Å; R201-E237 PolarHBondContact NE-OE1 2.98Å; R201-E237 IonicContact NE-OE2 3.14Å; R201-E237 PolarHBondContact NE-OE2 3.19Å; R201-E237 IonicContact NH2-OE1 2.92Å; R201-E237 PolarHBondContact NH2-OE1 3.15Å; R201-E237 IonicContact NH2-OE2 2.69Å; R201-E237 PolarHBondContact NH2-OE2 3.06Å; L233-E237 PolarHBondContact O-N 3.32Å; S234-E237 PolarHBondContact O-N 2.89Å; H235-E237 PolarHBondContact O-N 2.87Å; E237-G239 VanDerWaalsContact C-N 3.28Å; E237-G239 PolarHBondContact O-N 3.43Å
238	G	73.2	Confident	84.8	Confident	42 Å²	42	36.5 Å²	36.5	43%	0.433	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	73	15.4	-175.9	0	0	0	0	0	114.5	S234 H235 Y240	S234-G238 PolarHBondContact O-N 3.09Å; S234-G238 VanDerWaalsContact O-N 3.15Å; H235-G238 PolarHBondContact O-N 3.35Å; G238-Y240 PolarHBondContact O-N 3.27Å; G238-Y240 VanDerWaalsContact O-N 3.09Å
239	G	82.4	Confident	84.6	Confident	27 Å²	27	36.3 Å²	36.3	28%	0.278	20%	0.203	S	C	.	.			trans	-83	73.8	-176.2	0	0	0	0	0	113.9	S234 E237 L241 A242 V243	S234-G239 PolarHBondContact O-N 3.37Å; E237-G239 VanDerWaalsContact C-N 3.28Å; E237-G239 PolarHBondContact O-N 3.43Å; G239-L241 VanDerWaalsContact C-N 3.28Å; G239-L241 PolarHBondContact O-N 3.25Å; G239-A242 PolarHBondContact O-N 3.47Å; G239-A242 VanDerWaalsContact O-N 3.13Å; G239-V243 PolarHBondContact O-N 3.25Å
240	Y	86.5	Confident	84.4	Confident	42 Å²	42	36.4 Å²	36.4	17%	0.165	20%	0.203	C	C	.	.	H	α-helix	trans	-58.1	-34.4	-177.9	-59.7	-57.3	0	0	0	114.4	G238 V243 S244 Y273 L276 H352 T355	G238-Y240 PolarHBondContact O-N 3.27Å; G238-Y240 VanDerWaalsContact O-N 3.09Å; Y240-V243 WeakPolarHBondContact O-CB 3.24Å; Y240-V243 PolarHBondContact O-N 2.96Å; Y240-S244 PolarHBondContact O-N 2.95Å; Y240-Y273 AromaticContact CD1-CD1 3.98Å; Y240-Y273 HydrophobicContact CD1-CD1 3.98Å; Y240-Y273 HydrophobicContact CD1-CE1 4.31Å; Y240-L276 HydrophobicContact CD1-CB 4.41Å; Y240-L276 HydrophobicContact CD2-CB 4.28Å; Y240-L276 HydrophobicContact CG-CB 4.09Å; Y240-H352 AromaticContact CE1-CE1 3.5Å; Y240-H352 AromaticContact CE1-ND1 3.73Å; Y240-H352 AromaticContact CZ-CE1 3.91Å; Y240-H352 AromaticContact CZ-ND1 3.85Å; Y240-H352 PolarHBondContact OH-CE1 2.94Å; Y240-H352 PolarHBondContact OH-ND1 2.73Å; Y240-T355 HydrophobicContact CE2-CG2 4.18Å
241	L	86.3	Confident	84.2	Confident	33 Å²	33	36.6 Å²	36.6	17%	0.173	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-40.8	177.7	-175.3	68.3	0	0	0	111.9	G239 S244 K245 A277 E282 K283	G239-L241 VanDerWaalsContact C-N 3.28Å; G239-L241 PolarHBondContact O-N 3.25Å; L241-S244 PolarHBondContact O-N 3.22Å; L241-K245 WeakPolarHBondContact O-CG 3.33Å; L241-K245 PolarHBondContact O-N 3.06Å; L241-A277 HydrophobicContact CB-CB 4.03Å; L241-A277 HydrophobicContact CD1-CB 4.33Å; L241-E282 HydrophobicContact CD2-CB 3.91Å; L241-E282 WeakPolarHBondContact CD2-OE2 3.45Å; L241-K283 HydrophobicContact CD1-CB 4.42Å
242	A	87	Confident	83.9	Confident	37 Å²	37	43.9 Å²	43.9	31%	0.306	23%	0.232	S	C	.	.	H	α-helix	trans	-66.5	-41.5	177.7	0	0	0	0	0	110.9	G239 S244 K245 H246	G239-A242 PolarHBondContact O-N 3.47Å; G239-A242 VanDerWaalsContact O-N 3.13Å; A242-S244 VanDerWaalsContact C-N 3.33Å; A242-S244 PolarHBondContact O-N 2.86Å; A242-K245 PolarHBondContact O-N 3.22Å; A242-H246 PolarHBondContact O-CD2 3.1Å; A242-H246 PolarHBondContact O-N 3.03Å
243	V	88.4	Confident	83.7	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-56.4	-47.7	173.7	175	0	0	0	0	111.1	I231 S234 G239 Y240 H246 Y247 Y273	I231-V243 HydrophobicContact CG1-CG1 4.43Å; I231-V243 HydrophobicContact CG2-CG1 4.05Å; S234-V243 VanDerWaalsContact CB-CG2 3.48Å; G239-V243 PolarHBondContact O-N 3.25Å; Y240-V243 WeakPolarHBondContact O-CB 3.24Å; Y240-V243 PolarHBondContact O-N 2.96Å; V243-H246 PolarHBondContact O-N 3.02Å; V243-Y247 HydrophobicContact CG1-CD2 3.72Å; V243-Y247 HydrophobicContact CG1-CE2 3.42Å; V243-Y247 VanDerWaalsContact CG1-CE2 3.42Å; V243-Y247 VanDerWaalsContact O-CD2 3.22Å; V243-Y247 WeakPolarHBondContact O-CD2 3.37Å; V243-Y247 PolarHBondContact O-N 3.02Å; V243-Y247 VanDerWaalsContact O-N 3.07Å; V243-Y273 HydrophobicContact CB-CD1 4.33Å; V243-Y273 HydrophobicContact CB-CG 4.3Å; V243-Y273 HydrophobicContact CG1-CD1 3.77Å; V243-Y273 HydrophobicContact CG1-CD2 3.62Å; V243-Y273 HydrophobicContact CG1-CE1 4.05Å; V243-Y273 HydrophobicContact CG1-CE2 3.94Å; V243-Y273 HydrophobicContact CG1-CG 3.54Å
244	S	86.8	Confident	83.4	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-44	178.5	-177.6	0	0	0	0	112.3	Y240 L241 A242 H246 Y247 E248 C270 A274 L286	Y240-S244 PolarHBondContact O-N 2.95Å; L241-S244 PolarHBondContact O-N 3.22Å; A242-S244 VanDerWaalsContact C-N 3.33Å; A242-S244 PolarHBondContact O-N 2.86Å; S244-H246 VanDerWaalsContact C-N 3.32Å; S244-H246 PolarHBondContact O-N 3.49Å; S244-Y247 PolarHBondContact O-N 3.38Å; S244-Y247 VanDerWaalsContact O-N 3.15Å; S244-E248 PolarHBondContact O-N 3.12Å; S244-C270 PolarHBondContact O-SG 2.96Å; S244-C270 VanDerWaalsContact O-SG 3.38Å; S244-C270 PolarHBondContact OG-O 3.43Å; S244-A274 WeakPolarHBondContact OG-CB 3.41Å; S244-L286 WeakPolarHBondContact OG-CD2 3.47Å
245	K	87.5	Confident	83.2	Confident	76 Å²	76	43.5 Å²	43.5	33%	0.33	24%	0.24	S	C	.	.	H	α-helix	trans	-57.7	-42.4	174.7	-71.8	175.2	-177	174.6	0	111.9	L241 A242 Y247 E248 E249 E282 L286	L241-K245 WeakPolarHBondContact O-CG 3.33Å; L241-K245 PolarHBondContact O-N 3.06Å; A242-K245 PolarHBondContact O-N 3.22Å; K245-Y247 PolarHBondContact O-N 3.08Å; K245-E248 WeakPolarHBondContact O-CB 3.47Å; K245-E248 PolarHBondContact O-N 3.33Å; K245-E249 WeakPolarHBondContact O-CG 3.22Å; K245-E249 PolarHBondContact O-N 3Å; K245-E282 IonicContact NZ-OE2 3.25Å; K245-E282 PolarHBondContact NZ-OE2 2.94Å; K245-L286 HydrophobicContact CG-CD1 3.56Å
246	H	88.3	Confident	82.9	Confident	26 Å²	26	41.3 Å²	41.3	12%	0.12	23%	0.23	C	C	.	.	H	α-helix	trans	-66.4	-36.1	176.9	-68.5	-43.6	0	0	0	113.2	H227 I231 A242 V243 S244 E248 E249 M250	H227-H246 AromaticContact ND1-CG 3.99Å; H227-H246 AromaticContact ND1-ND1 3.57Å; I231-H246 HydrophobicContact CG1-CB 4.01Å; A242-H246 PolarHBondContact O-CD2 3.1Å; A242-H246 PolarHBondContact O-N 3.03Å; V243-H246 PolarHBondContact O-N 3.02Å; S244-H246 VanDerWaalsContact C-N 3.32Å; S244-H246 PolarHBondContact O-N 3.49Å; H246-E248 VanDerWaalsContact C-N 3.34Å; H246-E249 IonicContact ND1-OE2 3.17Å; H246-E249 PolarHBondContact ND1-OE2 3.4Å; H246-M250 VanDerWaalsContact O-CB 3.22Å; H246-M250 WeakPolarHBondContact O-CB 3.42Å; H246-M250 PolarHBondContact O-N 3.03Å
247	Y	88	Confident	82.8	Confident	28 Å²	28	41.8 Å²	41.8	11%	0.11	23%	0.226	C	C	.	.	H	α-helix	trans	-68.4	-33.8	172.5	-76.3	-62.5	0	0	0	112.6	I231 V243 S244 K245 M250 S251 V266 L269 Y273	I231-Y247 HydrophobicContact CD1-CD1 3.82Å; I231-Y247 HydrophobicContact CD1-CD2 4.25Å; I231-Y247 HydrophobicContact CD1-CE1 3.43Å; I231-Y247 VanDerWaalsContact CD1-CE1 3.43Å; I231-Y247 HydrophobicContact CD1-CE2 3.89Å; I231-Y247 HydrophobicContact CD1-CG 4.22Å; I231-Y247 VanDerWaalsContact CD1-CZ 3.47Å; I231-Y247 HydrophobicContact CG1-CE2 4.18Å; I231-Y247 HydrophobicContact CG2-CE2 4.22Å; V243-Y247 HydrophobicContact CG1-CD2 3.72Å; V243-Y247 HydrophobicContact CG1-CE2 3.42Å; V243-Y247 VanDerWaalsContact CG1-CE2 3.42Å; V243-Y247 VanDerWaalsContact O-CD2 3.22Å; V243-Y247 WeakPolarHBondContact O-CD2 3.37Å; V243-Y247 PolarHBondContact O-N 3.02Å; V243-Y247 VanDerWaalsContact O-N 3.07Å; S244-Y247 PolarHBondContact O-N 3.38Å; S244-Y247 VanDerWaalsContact O-N 3.15Å; K245-Y247 PolarHBondContact O-N 3.08Å; Y247-M250 HydrophobicContact CD1-SD 4.28Å; Y247-M250 PolarHBondContact O-N 3.39Å; Y247-S251 PolarHBondContact O-N 3.44Å; Y247-V266 HydrophobicContact CD1-CG1 4.15Å; Y247-V266 WeakPolarHBondContact O-CG1 3.3Å; Y247-L269 HydrophobicContact CD1-CB 4.16Å; Y247-L269 HydrophobicContact CD2-CB 4.26Å; Y247-L269 HydrophobicContact CE1-CB 4.05Å; Y247-L269 HydrophobicContact CE1-CD1 3.81Å; Y247-L269 HydrophobicContact CE2-CB 4.17Å; Y247-L269 HydrophobicContact CG-CB 4.26Å; Y247-Y273 AromaticContact CD2-CD2 3.85Å; Y247-Y273 HydrophobicContact CD2-CD2 3.85Å; Y247-Y273 HydrophobicContact CD2-CE2 4.35Å; Y247-Y273 AromaticContact CE2-CD2 3.46Å; Y247-Y273 HydrophobicContact CE2-CD2 3.46Å; Y247-Y273 VanDerWaalsContact CE2-CD2 3.46Å; Y247-Y273 AromaticContact CE2-CE2 3.51Å; Y247-Y273 HydrophobicContact CE2-CE2 3.51Å; Y247-Y273 HydrophobicContact CE2-CG 4.5Å
248	E	85.7	Confident	83	Confident	26 Å²	26	44.6 Å²	44.6	12%	0.121	24%	0.244	C	C	.	.	H	α-helix	trans	-64.7	-46	174.1	-164.5	-100.8	143.2	0	0	111.2	S244 K245 H246 M250 S251 R252	S244-E248 PolarHBondContact O-N 3.12Å; K245-E248 WeakPolarHBondContact O-CB 3.47Å; K245-E248 PolarHBondContact O-N 3.33Å; H246-E248 VanDerWaalsContact C-N 3.34Å; E248-M250 VanDerWaalsContact C-N 3.31Å; E248-M250 PolarHBondContact O-N 3.39Å; E248-S251 PolarHBondContact O-N 3.24Å; E248-S251 PolarHBondContact O-OG 3.44Å; E248-R252 PolarHBondContact O-N 2.86Å; E248-R252 IonicContact OE1-CZ 3.94Å; E248-R252 IonicContact OE1-NE 2.76Å; E248-R252 PolarHBondContact OE1-NE 2.96Å; E248-R252 IonicContact OE1-NH2 2.74Å; E248-R252 PolarHBondContact OE1-NH2 3.39Å; E248-R252 IonicContact OE2-NH2 2.81Å
249	E	85	Confident	83.4	Confident	83 Å²	83	46.4 Å²	46.4	39%	0.388	24%	0.244	S	C	.	.	H	α-helix	trans	-61.8	-40.5	173.2	-69.7	171.2	158.3	0	0	111.4	H227 K245 H246 S251 R252	H227-E249 IonicContact CE1-OE2 3.76Å; H227-E249 PolarHBondContact CE1-OE2 3.43Å; H227-E249 IonicContact ND1-OE2 3.59Å; K245-E249 WeakPolarHBondContact O-CG 3.22Å; K245-E249 PolarHBondContact O-N 3Å; H246-E249 IonicContact ND1-OE2 3.17Å; H246-E249 PolarHBondContact ND1-OE2 3.4Å; E249-S251 VanDerWaalsContact C-N 3.35Å; E249-S251 PolarHBondContact O-N 3.23Å; E249-R252 WeakPolarHBondContact O-CB 3.43Å; E249-R252 PolarHBondContact O-N 3.01Å; E249-R252 VanDerWaalsContact O-N 3.17Å
250	M	85.5	Confident	83.2	Confident	15 Å²	15	51 Å²	51	7%	0.074	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-37.8	177	-172.6	172.1	-170.7	0	0	112.6	I224 E228 H246 Y247 E248 R252 I253 I256 V266	I224-M250 HydrophobicContact CB-CE 4.46Å; I224-M250 HydrophobicContact CG1-CE 4.48Å; I224-M250 HydrophobicContact CG2-CE 3.63Å; E228-M250 HydrophobicContact CG-CE 4.43Å; H246-M250 VanDerWaalsContact O-CB 3.22Å; H246-M250 WeakPolarHBondContact O-CB 3.42Å; H246-M250 PolarHBondContact O-N 3.03Å; Y247-M250 HydrophobicContact CD1-SD 4.28Å; Y247-M250 PolarHBondContact O-N 3.39Å; E248-M250 VanDerWaalsContact C-N 3.31Å; E248-M250 PolarHBondContact O-N 3.39Å; M250-R252 PolarHBondContact O-N 2.89Å; M250-I253 HydrophobicContact CG-CD1 4.37Å; M250-I253 WeakPolarHBondContact O-CB 3.4Å; M250-I253 WeakPolarHBondContact O-CG1 3.49Å; M250-I253 PolarHBondContact O-N 3.26Å; M250-I256 HydrophobicContact CE-CD1 3.47Å; M250-I256 VanDerWaalsContact CE-CD1 3.47Å; M250-I256 HydrophobicContact CG-CD1 3.4Å; M250-I256 VanDerWaalsContact CG-CD1 3.4Å; M250-I256 HydrophobicContact SD-CD1 4.26Å; M250-V266 HydrophobicContact CB-CG1 4.2Å; M250-V266 HydrophobicContact CG-CG1 4.16Å; M250-V266 HydrophobicContact SD-CG1 4.45Å; M250-V266 HydrophobicContact SD-CG2 4.41Å
251	S	83.1	Confident	82.9	Confident	7 Å²	7	52.1 Å²	52.1	5%	0.049	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-24.5	175.9	64.4	0	0	0	0	113.9	Y247 E248 E249 I253 H263	Y247-S251 PolarHBondContact O-N 3.44Å; E248-S251 PolarHBondContact O-N 3.24Å; E248-S251 PolarHBondContact O-OG 3.44Å; E249-S251 VanDerWaalsContact C-N 3.35Å; E249-S251 PolarHBondContact O-N 3.23Å; S251-I253 VanDerWaalsContact C-N 3.26Å; S251-I253 PolarHBondContact O-N 3.37Å; S251-H263 PolarHBondContact O-NE2 3.25Å
252	R	82.2	Confident	82.5	Confident	170 Å²	170	52.4 Å²	52.4	64%	0.642	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-13.7	177.9	-64.3	174.4	-178.3	-160.9	2.1	112.9	E248 E249 M250	E248-R252 PolarHBondContact O-N 2.86Å; E248-R252 IonicContact OE1-CZ 3.94Å; E248-R252 IonicContact OE1-NE 2.76Å; E248-R252 PolarHBondContact OE1-NE 2.96Å; E248-R252 IonicContact OE1-NH2 2.74Å; E248-R252 PolarHBondContact OE1-NH2 3.39Å; E248-R252 IonicContact OE2-NH2 2.81Å; E249-R252 WeakPolarHBondContact O-CB 3.43Å; E249-R252 PolarHBondContact O-N 3.01Å; E249-R252 VanDerWaalsContact O-N 3.17Å; M250-R252 PolarHBondContact O-N 2.89Å
253	I	82	Confident	82.1	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.036	27%	0.272	C	S	.	.	S	Bend	trans	-71.6	128.4	-175.5	-57	173.4	0	0	0	110.1	Q220 H223 I224 M250 S251 V255 I256 S257	Q220-I253 HydrophobicContact CB-CG2 4Å; Q220-I253 HydrophobicContact CG-CG2 4.31Å; H223-I253 HydrophobicContact CB-CD1 4.27Å; H223-I253 WeakPolarHBondContact ND1-CD1 3.21Å; H223-I253 WeakPolarHBondContact ND1-CG1 3.45Å; I224-I253 HydrophobicContact CD1-CG2 4.43Å; I224-I253 HydrophobicContact CG1-CD1 3.73Å; I224-I253 HydrophobicContact CG1-CG2 4.36Å; M250-I253 HydrophobicContact CG-CD1 4.37Å; M250-I253 WeakPolarHBondContact O-CB 3.4Å; M250-I253 WeakPolarHBondContact O-CG1 3.49Å; M250-I253 PolarHBondContact O-N 3.26Å; S251-I253 VanDerWaalsContact C-N 3.26Å; S251-I253 PolarHBondContact O-N 3.37Å; I253-V255 VanDerWaalsContact C-N 3.34Å; I253-V255 HydrophobicContact CG2-CB 4.47Å; I253-V255 PolarHBondContact O-N 3Å; I253-I256 PolarHBondContact O-N 3.25Å; I253-I256 VanDerWaalsContact O-N 3.08Å; I253-S257 WeakPolarHBondContact O-CB 3.33Å; I253-S257 PolarHBondContact O-N 3.46Å
254	P	79.8	Confident	81.8	Confident	58 Å²	58	53.8 Å²	53.8	38%	0.377	28%	0.283	S	S	.	.	H	α-helix	trans	-57.3	-38.9	-175.2	-25	31.9	0	0	0	114.8	I256 S257 N258	P254-I256 VanDerWaalsContact C-N 3.26Å; P254-I256 PolarHBondContact O-N 3.23Å; P254-S257 PolarHBondContact O-N 3.04Å; P254-N258 WeakPolarHBondContact O-CB 3.37Å; P254-N258 PolarHBondContact O-N 3.23Å; P254-N258 PolarHBondContact O-ND2 2.96Å
255	V	78.3	Confident	81.5	Confident	56 Å²	56	57.1 Å²	57.1	34%	0.339	30%	0.299	S	S	.	.	H	α-helix	trans	-56.3	-39.1	177.1	162.7	0	0	0	0	112.6	Q220 I224 I253	Q220-V255 HydrophobicContact CB-CG2 3.98Å; I224-V255 HydrophobicContact CD1-CB 4.27Å; I224-V255 HydrophobicContact CD1-CG1 3.92Å; I253-V255 VanDerWaalsContact C-N 3.34Å; I253-V255 HydrophobicContact CG2-CB 4.47Å; I253-V255 PolarHBondContact O-N 3Å
256	I	75.5	Confident	81.3	Confident	11 Å²	11	54.1 Å²	54.1	6%	0.056	29%	0.287	C	S	.	.	H	α-helix	trans	-84.5	-41.7	179.1	-64.7	171.6	0	0	0	109.8	I224 M250 I253 P254 N258 D259 H263 V266	I224-I256 HydrophobicContact CD1-CD1 3.76Å; I224-I256 HydrophobicContact CD1-CG1 3.84Å; I224-I256 HydrophobicContact CG1-CD1 3.76Å; I224-I256 HydrophobicContact CG1-CG1 4.39Å; M250-I256 HydrophobicContact CE-CD1 3.47Å; M250-I256 VanDerWaalsContact CE-CD1 3.47Å; M250-I256 HydrophobicContact CG-CD1 3.4Å; M250-I256 VanDerWaalsContact CG-CD1 3.4Å; M250-I256 HydrophobicContact SD-CD1 4.26Å; I253-I256 PolarHBondContact O-N 3.25Å; I253-I256 VanDerWaalsContact O-N 3.08Å; P254-I256 VanDerWaalsContact C-N 3.26Å; P254-I256 PolarHBondContact O-N 3.23Å; I256-N258 PolarHBondContact O-N 2.86Å; I256-D259 PolarHBondContact O-N 2.81Å; I256-H263 HydrophobicContact CG2-CB 4.35Å; I256-V266 HydrophobicContact CG2-CG2 4.2Å
257	S	74.5	Confident	81	Confident	55 Å²	55	53 Å²	53	39%	0.385	28%	0.283	S	S	.	.	H	α-helix	trans	-58.1	-33.4	-179.5	-172.5	0	0	0	0	113	I253 P254 D259	I253-S257 WeakPolarHBondContact O-CB 3.33Å; I253-S257 PolarHBondContact O-N 3.46Å; P254-S257 PolarHBondContact O-N 3.04Å; S257-D259 VanDerWaalsContact C-N 3.35Å
258	N	77.1	Confident	80.7	Confident	136 Å²	136	51.8 Å²	51.8	73%	0.727	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-22.7	177.8	-70.4	-18.3	0	0	0	114.1	P254 I256	P254-N258 WeakPolarHBondContact O-CB 3.37Å; P254-N258 PolarHBondContact O-N 3.23Å; P254-N258 PolarHBondContact O-ND2 2.96Å; I256-N258 PolarHBondContact O-N 2.86Å
259	D	81.7	Confident	80.6	Confident	81 Å²	81	51.6 Å²	51.6	43%	0.433	28%	0.277	S	S	.	.			trans	-103.1	106.2	177	172.8	31.5	0	0	0	110.3	I256 S257 A261 S262 H263	I256-D259 PolarHBondContact O-N 2.81Å; S257-D259 VanDerWaalsContact C-N 3.35Å; D259-A261 PolarHBondContact O-N 3.05Å; D259-A261 PolarHBondContact OD1-N 3.25Å; D259-S262 WeakPolarHBondContact CB-OG 3.46Å; D259-S262 VanDerWaalsContact CG-OG 3.23Å; D259-S262 PolarHBondContact O-N 3.49Å; D259-S262 PolarHBondContact O-OG 3.09Å; D259-S262 WeakPolarHBondContact OD2-CB 3.23Å; D259-S262 PolarHBondContact OD2-N 2.69Å; D259-S262 PolarHBondContact OD2-OG 3.42Å; D259-H263 VanDerWaalsContact O-CB 3.26Å; D259-H263 WeakPolarHBondContact O-CB 3.49Å; D259-H263 PolarHBondContact O-N 3.27Å
260	I	78.2	Confident	80.6	Confident	123 Å²	123	47.7 Å²	47.7	63%	0.631	26%	0.259	S	S	*	.	H	α-helix	trans	-57.7	-38.9	-172.7	-59.7	166.4	0	0	0	111.4	Q264	I260-Q264 WeakPolarHBondContact O-CB 3.23Å; I260-Q264 VanDerWaalsContact O-CG 3.28Å; I260-Q264 WeakPolarHBondContact O-CG 3.33Å; I260-Q264 PolarHBondContact O-N 2.65Å
261	A	80.2	Confident	80.6	Confident	66 Å²	66	47 Å²	47	55%	0.545	26%	0.256	S	S	.	.	H	α-helix	trans	-70.6	-48.6	-175.6	0	0	0	0	0	112	D259 H263 Q264 M265	D259-A261 PolarHBondContact O-N 3.05Å; D259-A261 PolarHBondContact OD1-N 3.25Å; A261-H263 VanDerWaalsContact C-N 3.34Å; A261-Q264 PolarHBondContact O-N 3.42Å; A261-M265 PolarHBondContact O-N 3.38Å
262	S	78.1	Confident	80.7	Confident	39 Å²	39	46.8 Å²	46.8	27%	0.273	25%	0.254	S	S	.	.	H	α-helix	trans	-68.2	-35.1	176.5	57.3	0	0	0	0	111.9	D259 M265 V266	D259-S262 WeakPolarHBondContact CB-OG 3.46Å; D259-S262 VanDerWaalsContact CG-OG 3.23Å; D259-S262 PolarHBondContact O-N 3.49Å; D259-S262 PolarHBondContact O-OG 3.09Å; D259-S262 WeakPolarHBondContact OD2-CB 3.23Å; D259-S262 PolarHBondContact OD2-N 2.69Å; D259-S262 PolarHBondContact OD2-OG 3.42Å; S262-M265 WeakPolarHBondContact O-CB 3.44Å; S262-M265 PolarHBondContact O-N 2.91Å; S262-V266 WeakPolarHBondContact O-CG2 3.47Å; S262-V266 PolarHBondContact O-N 3.17Å
263	H	79.2	Confident	80.9	Confident	17 Å²	17	39.7 Å²	39.7	8%	0.079	23%	0.228	C	C	.	.	H	α-helix	trans	-61.2	-47.2	174.4	-164.3	175.4	0	0	0	111.8	S251 I256 D259 A261 M265 V266 F267 L295	S251-H263 PolarHBondContact O-NE2 3.25Å; I256-H263 HydrophobicContact CG2-CB 4.35Å; D259-H263 VanDerWaalsContact O-CB 3.26Å; D259-H263 WeakPolarHBondContact O-CB 3.49Å; D259-H263 PolarHBondContact O-N 3.27Å; A261-H263 VanDerWaalsContact C-N 3.34Å; H263-M265 VanDerWaalsContact C-N 3.34Å; H263-M265 PolarHBondContact O-N 3.41Å; H263-V266 PolarHBondContact O-N 3.34Å; H263-F267 VanDerWaalsContact O-CB 3.31Å; H263-F267 WeakPolarHBondContact O-CB 3.49Å; H263-F267 PolarHBondContact O-N 3.1Å; H263-L295 WeakPolarHBondContact CE1-CD1 3.16Å; H263-L295 WeakPolarHBondContact NE2-CD1 3.29Å
264	Q	80.9	Confident	81.1	Confident	50 Å²	50	39.4 Å²	39.4	23%	0.234	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-42.3	175.2	-76.8	178.9	-11.7	0	0	111.8	I260 A261 F267 K268 L299	I260-Q264 WeakPolarHBondContact O-CB 3.23Å; I260-Q264 VanDerWaalsContact O-CG 3.28Å; I260-Q264 WeakPolarHBondContact O-CG 3.33Å; I260-Q264 PolarHBondContact O-N 2.65Å; A261-Q264 PolarHBondContact O-N 3.42Å; Q264-F267 PolarHBondContact O-N 3.43Å; Q264-K268 WeakPolarHBondContact O-CG 3.01Å; Q264-K268 PolarHBondContact O-N 2.96Å; Q264-L299 HydrophobicContact CB-CD1 4.3Å; Q264-L299 HydrophobicContact CG-CD1 4.31Å
265	M	81	Confident	81.4	Confident	69 Å²	69	37 Å²	37	34%	0.34	21%	0.21	S	C	.	.	H	α-helix	trans	-60.4	-49.9	177.4	-169.9	96.7	178.8	0	0	111.8	A261 S262 H263 F267 K268 L269	A261-M265 PolarHBondContact O-N 3.38Å; S262-M265 WeakPolarHBondContact O-CB 3.44Å; S262-M265 PolarHBondContact O-N 2.91Å; H263-M265 VanDerWaalsContact C-N 3.34Å; H263-M265 PolarHBondContact O-N 3.41Å; M265-F267 VanDerWaalsContact C-N 3.29Å; M265-F267 PolarHBondContact O-N 3.11Å; M265-K268 PolarHBondContact O-N 2.94Å; M265-L269 WeakPolarHBondContact O-CG 3.31Å; M265-L269 PolarHBondContact O-N 3.03Å
266	V	83.3	Confident	81.8	Confident	13 Å²	13	34.4 Å²	34.4	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-39.3	178.6	170.4	0	0	0	0	110.9	Y247 M250 I256 S262 H263 L269 C270	Y247-V266 HydrophobicContact CD1-CG1 4.15Å; Y247-V266 WeakPolarHBondContact O-CG1 3.3Å; M250-V266 HydrophobicContact CB-CG1 4.2Å; M250-V266 HydrophobicContact CG-CG1 4.16Å; M250-V266 HydrophobicContact SD-CG1 4.45Å; M250-V266 HydrophobicContact SD-CG2 4.41Å; I256-V266 HydrophobicContact CG2-CG2 4.2Å; S262-V266 WeakPolarHBondContact O-CG2 3.47Å; S262-V266 PolarHBondContact O-N 3.17Å; H263-V266 PolarHBondContact O-N 3.34Å; V266-L269 WeakPolarHBondContact O-CB 3.4Å; V266-L269 PolarHBondContact O-N 2.94Å; V266-C270 PolarHBondContact O-N 2.75Å
267	F	81.4	Confident	82.3	Confident	4 Å²	4	34 Å²	34	2%	0.018	19%	0.193	C	C	.	.	H	α-helix	trans	-67.5	-42.5	178.3	-161.4	-108.8	0	0	0	112.1	H263 Q264 M265 L269 C270 I271 I290 N293 L295 L299	H263-F267 VanDerWaalsContact O-CB 3.31Å; H263-F267 WeakPolarHBondContact O-CB 3.49Å; H263-F267 PolarHBondContact O-N 3.1Å; Q264-F267 PolarHBondContact O-N 3.43Å; M265-F267 VanDerWaalsContact C-N 3.29Å; M265-F267 PolarHBondContact O-N 3.11Å; F267-L269 VanDerWaalsContact C-N 3.3Å; F267-L269 PolarHBondContact O-N 2.56Å; F267-C270 VanDerWaalsContact O-CB 3.31Å; F267-C270 WeakPolarHBondContact O-CB 3.4Å; F267-C270 PolarHBondContact O-N 3.39Å; F267-I271 HydrophobicContact CD1-CD1 3.69Å; F267-I271 HydrophobicContact CD1-CG1 4.45Å; F267-I271 HydrophobicContact CE1-CD1 3.6Å; F267-I271 HydrophobicContact CE1-CG1 4.4Å; F267-I271 HydrophobicContact CZ-CD1 4.41Å; F267-I271 WeakPolarHBondContact O-CG1 3.46Å; F267-I271 PolarHBondContact O-N 3.42Å; F267-I290 HydrophobicContact CE1-CG2 4.14Å; F267-I290 HydrophobicContact CE2-CG2 4.01Å; F267-I290 HydrophobicContact CZ-CG2 3.47Å; F267-I290 VanDerWaalsContact CZ-CG2 3.47Å; F267-N293 HydrophobicContact CZ-CB 4.36Å; F267-L295 HydrophobicContact CD1-CB 4.39Å; F267-L295 HydrophobicContact CD2-CD1 4.28Å; F267-L295 HydrophobicContact CE1-CB 4.17Å; F267-L295 HydrophobicContact CE2-CB 4.38Å; F267-L295 HydrophobicContact CE2-CD1 4.35Å; F267-L295 HydrophobicContact CZ-CB 4.17Å; F267-L299 HydrophobicContact CD1-CD1 4.46Å
268	K	81.9	Confident	82.7	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.009	19%	0.186	C	C	.	.	H	α-helix	trans	-59.3	-41.9	172.7	-68.5	171.3	-165.4	178.3	0	111.8	Q264 M265 I271 S272 L299 Y302 C336 T339	Q264-K268 WeakPolarHBondContact O-CG 3.01Å; Q264-K268 PolarHBondContact O-N 2.96Å; M265-K268 PolarHBondContact O-N 2.94Å; K268-I271 PolarHBondContact O-N 2.97Å; K268-S272 WeakPolarHBondContact O-CB 3.37Å; K268-S272 PolarHBondContact O-N 3.26Å; K268-S272 PolarHBondContact O-OG 3.17Å; K268-L299 HydrophobicContact CD-CD1 4.32Å; K268-L299 VanDerWaalsContact CE-CD2 3.47Å; K268-L299 HydrophobicContact CG-CD1 3.72Å; K268-Y302 HydrophobicContact CB-CE1 4.23Å; K268-Y302 HydrophobicContact CB-CE2 4.37Å; K268-Y302 HydrophobicContact CD-CE2 3.78Å; K268-Y302 HydrophobicContact CG-CD2 4.04Å; K268-Y302 HydrophobicContact CG-CE1 4.26Å; K268-Y302 HydrophobicContact CG-CE2 3.58Å; K268-C336 WeakPolarHBondContact CE-SG 2.94Å; K268-C336 PolarHBondContact NZ-SG 3.1Å; K268-T339 HydrophobicContact CB-CG2 3.52Å; K268-T339 HydrophobicContact CD-CG2 4.37Å
269	L	83.7	Confident	82.6	Confident	22 Å²	22	27.2 Å²	27.2	12%	0.115	16%	0.158	C	C	.	.	H	α-helix	trans	-60.5	-48.3	174.5	-71.2	168.9	0	0	0	110.8	Y247 M265 V266 F267 I271 S272 Y273 T339 V341	Y247-L269 HydrophobicContact CD1-CB 4.16Å; Y247-L269 HydrophobicContact CD2-CB 4.26Å; Y247-L269 HydrophobicContact CE1-CB 4.05Å; Y247-L269 HydrophobicContact CE1-CD1 3.81Å; Y247-L269 HydrophobicContact CE2-CB 4.17Å; Y247-L269 HydrophobicContact CG-CB 4.26Å; M265-L269 WeakPolarHBondContact O-CG 3.31Å; M265-L269 PolarHBondContact O-N 3.03Å; V266-L269 WeakPolarHBondContact O-CB 3.4Å; V266-L269 PolarHBondContact O-N 2.94Å; F267-L269 VanDerWaalsContact C-N 3.3Å; F267-L269 PolarHBondContact O-N 2.56Å; L269-I271 VanDerWaalsContact C-N 3.31Å; L269-I271 PolarHBondContact O-N 3.37Å; L269-S272 WeakPolarHBondContact CA-OG 3.19Å; L269-S272 PolarHBondContact O-N 3.41Å; L269-S272 PolarHBondContact O-OG 2.97Å; L269-Y273 HydrophobicContact CD2-CE2 4.34Å; L269-Y273 VanDerWaalsContact O-CD2 3.24Å; L269-Y273 WeakPolarHBondContact O-CD2 3.11Å; L269-Y273 PolarHBondContact O-N 3.38Å; L269-T339 HydrophobicContact CD2-CG2 3.95Å; L269-T339 HydrophobicContact CG-CG2 3.99Å; L269-V341 HydrophobicContact CD2-CG2 3.33Å
270	C	85.8	Confident	82.4	Confident	1 Å²	1	27 Å²	27	1%	0.007	16%	0.156	C	C	.	.	H	α-helix	trans	-52.3	-49	176.7	-175.3	0	0	0	0	112.1	S244 V266 F267 A274	S244-C270 PolarHBondContact O-SG 2.96Å; S244-C270 VanDerWaalsContact O-SG 3.38Å; S244-C270 PolarHBondContact OG-O 3.43Å; V266-C270 PolarHBondContact O-N 2.75Å; F267-C270 VanDerWaalsContact O-CB 3.31Å; F267-C270 WeakPolarHBondContact O-CB 3.4Å; F267-C270 PolarHBondContact O-N 3.39Å; C270-A274 WeakPolarHBondContact O-CB 3.38Å; C270-A274 PolarHBondContact O-N 3.47Å
271	I	84.2	Confident	82.5	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-49.1	179.8	-63.9	172.2	0	0	0	110.7	F267 K268 L269 Y273 A274 L275 I290 Y302 I306	F267-I271 HydrophobicContact CD1-CD1 3.69Å; F267-I271 HydrophobicContact CD1-CG1 4.45Å; F267-I271 HydrophobicContact CE1-CD1 3.6Å; F267-I271 HydrophobicContact CE1-CG1 4.4Å; F267-I271 HydrophobicContact CZ-CD1 4.41Å; F267-I271 WeakPolarHBondContact O-CG1 3.46Å; F267-I271 PolarHBondContact O-N 3.42Å; K268-I271 PolarHBondContact O-N 2.97Å; L269-I271 VanDerWaalsContact C-N 3.31Å; L269-I271 PolarHBondContact O-N 3.37Å; I271-Y273 VanDerWaalsContact C-N 3.31Å; I271-Y273 PolarHBondContact O-N 3.25Å; I271-A274 WeakPolarHBondContact O-CB 3.41Å; I271-A274 PolarHBondContact O-N 3.13Å; I271-A274 VanDerWaalsContact O-N 3.1Å; I271-L275 HydrophobicContact CG2-CD1 3.69Å; I271-L275 HydrophobicContact CG2-CG 4.38Å; I271-L275 VanDerWaalsContact O-CD1 3.29Å; I271-L275 WeakPolarHBondContact O-CD1 3.5Å; I271-L275 VanDerWaalsContact O-CG 3.23Å; I271-L275 WeakPolarHBondContact O-CG 3.47Å; I271-L275 PolarHBondContact O-N 3.4Å; I271-I290 HydrophobicContact CD1-CG2 4.27Å; I271-I290 HydrophobicContact CG1-CG2 3.92Å; I271-Y302 HydrophobicContact CB-CD1 4.36Å; I271-Y302 HydrophobicContact CD1-CD1 4.44Å; I271-Y302 HydrophobicContact CD1-CG 4.39Å; I271-Y302 HydrophobicContact CG2-CD1 4.01Å; I271-I306 HydrophobicContact CD1-CD1 3.79Å; I271-I306 HydrophobicContact CG1-CD1 3.94Å; I271-I306 HydrophobicContact CG2-CD1 4.12Å; I271-I306 HydrophobicContact CG2-CG1 3.93Å
272	S	86.6	Confident	82.5	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.014	15%	0.149	C	C	.	.	H	α-helix	trans	-56.7	-43.7	-179.8	66.2	0	0	0	0	112.5	K268 L269 L275 L276	K268-S272 WeakPolarHBondContact O-CB 3.37Å; K268-S272 PolarHBondContact O-N 3.26Å; K268-S272 PolarHBondContact O-OG 3.17Å; L269-S272 WeakPolarHBondContact CA-OG 3.19Å; L269-S272 PolarHBondContact O-N 3.41Å; L269-S272 PolarHBondContact O-OG 2.97Å; S272-L275 PolarHBondContact O-N 3.14Å; S272-L276 VanDerWaalsContact O-CG 3.31Å; S272-L276 WeakPolarHBondContact O-CG 3.47Å; S272-L276 PolarHBondContact O-N 3.23Å
273	Y	86.2	Confident	82.9	Confident	21 Å²	21	27.1 Å²	27.1	8%	0.082	14%	0.139	C	C	.	.	H	α-helix	trans	-73.7	-31.8	176.9	-75.6	-69.4	0	0	0	113.2	Y240 V243 Y247 L269 I271 L275 L276 A277 V341	Y240-Y273 AromaticContact CD1-CD1 3.98Å; Y240-Y273 HydrophobicContact CD1-CD1 3.98Å; Y240-Y273 HydrophobicContact CD1-CE1 4.31Å; V243-Y273 HydrophobicContact CB-CD1 4.33Å; V243-Y273 HydrophobicContact CB-CG 4.3Å; V243-Y273 HydrophobicContact CG1-CD1 3.77Å; V243-Y273 HydrophobicContact CG1-CD2 3.62Å; V243-Y273 HydrophobicContact CG1-CE1 4.05Å; V243-Y273 HydrophobicContact CG1-CE2 3.94Å; V243-Y273 HydrophobicContact CG1-CG 3.54Å; Y247-Y273 AromaticContact CD2-CD2 3.85Å; Y247-Y273 HydrophobicContact CD2-CD2 3.85Å; Y247-Y273 HydrophobicContact CD2-CE2 4.35Å; Y247-Y273 AromaticContact CE2-CD2 3.46Å; Y247-Y273 HydrophobicContact CE2-CD2 3.46Å; Y247-Y273 VanDerWaalsContact CE2-CD2 3.46Å; Y247-Y273 AromaticContact CE2-CE2 3.51Å; Y247-Y273 HydrophobicContact CE2-CE2 3.51Å; Y247-Y273 HydrophobicContact CE2-CG 4.5Å; L269-Y273 HydrophobicContact CD2-CE2 4.34Å; L269-Y273 VanDerWaalsContact O-CD2 3.24Å; L269-Y273 WeakPolarHBondContact O-CD2 3.11Å; L269-Y273 PolarHBondContact O-N 3.38Å; I271-Y273 VanDerWaalsContact C-N 3.31Å; I271-Y273 PolarHBondContact O-N 3.25Å; Y273-L275 VanDerWaalsContact C-N 3.26Å; Y273-L275 PolarHBondContact O-N 3.17Å; Y273-L276 HydrophobicContact CD1-CD1 4.15Å; Y273-L276 PolarHBondContact O-N 3.16Å; Y273-A277 PolarHBondContact O-N 3.39Å; Y273-V341 HydrophobicContact CE1-CG1 4.4Å; Y273-V341 HydrophobicContact CE2-CG1 4.47Å; Y273-V341 HydrophobicContact CE2-CG2 3.95Å
274	A	86.4	Confident	83	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61	-39.1	173.6	0	0	0	0	0	111.4	S244 C270 I271 A277 K283 L286 L287 I290	S244-A274 WeakPolarHBondContact OG-CB 3.41Å; C270-A274 WeakPolarHBondContact O-CB 3.38Å; C270-A274 PolarHBondContact O-N 3.47Å; I271-A274 WeakPolarHBondContact O-CB 3.41Å; I271-A274 PolarHBondContact O-N 3.13Å; I271-A274 VanDerWaalsContact O-N 3.1Å; A274-A277 WeakPolarHBondContact O-CB 3.45Å; A274-A277 PolarHBondContact O-N 2.65Å; A274-K283 WeakPolarHBondContact O-CE 3.36Å; A274-L286 HydrophobicContact CB-CD2 3.53Å; A274-L287 HydrophobicContact CB-CD2 3.76Å; A274-I290 HydrophobicContact CB-CD1 4.39Å
275	L	85.1	Confident	83.2	Confident	9 Å²	9	32.9 Å²	32.9	5%	0.047	17%	0.166	C	C	.	.	H	α-helix	trans	-72	-37.6	-178.8	-65.1	157.2	0	0	0	112.3	I271 S272 Y273 A277 K283 L305 F309 L356	I271-L275 HydrophobicContact CG2-CD1 3.69Å; I271-L275 HydrophobicContact CG2-CG 4.38Å; I271-L275 VanDerWaalsContact O-CD1 3.29Å; I271-L275 WeakPolarHBondContact O-CD1 3.5Å; I271-L275 VanDerWaalsContact O-CG 3.23Å; I271-L275 WeakPolarHBondContact O-CG 3.47Å; I271-L275 PolarHBondContact O-N 3.4Å; S272-L275 PolarHBondContact O-N 3.14Å; Y273-L275 VanDerWaalsContact C-N 3.26Å; Y273-L275 PolarHBondContact O-N 3.17Å; L275-A277 VanDerWaalsContact C-N 3.25Å; L275-A277 PolarHBondContact O-N 3.31Å; L275-K283 PolarHBondContact O-NZ 3.44Å; L275-L305 HydrophobicContact CD1-CD2 3.08Å; L275-L305 HydrophobicContact CD2-CD2 3.59Å; L275-L305 HydrophobicContact CG-CD2 3.94Å; L275-F309 HydrophobicContact CD2-CB 4.35Å; L275-F309 HydrophobicContact CD2-CD2 3.36Å; L275-F309 HydrophobicContact CD2-CE2 3.66Å; L275-F309 HydrophobicContact CD2-CG 3.88Å; L275-F309 HydrophobicContact CD2-CZ 4.37Å; L275-L356 HydrophobicContact CB-CD1 4.16Å
276	L	86.3	Confident	83.3	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67.2	-23.8	176.3	-70.4	168.1	0	0	0	113.3	Y240 S272 Y273 V341 F342 H352 T355 L356 R359	Y240-L276 HydrophobicContact CD1-CB 4.41Å; Y240-L276 HydrophobicContact CD2-CB 4.28Å; Y240-L276 HydrophobicContact CG-CB 4.09Å; S272-L276 VanDerWaalsContact O-CG 3.31Å; S272-L276 WeakPolarHBondContact O-CG 3.47Å; S272-L276 PolarHBondContact O-N 3.23Å; Y273-L276 HydrophobicContact CD1-CD1 4.15Å; Y273-L276 PolarHBondContact O-N 3.16Å; L276-V341 HydrophobicContact CD1-CG1 4.21Å; L276-F342 HydrophobicContact CD1-CE1 4.37Å; L276-F342 HydrophobicContact CD1-CZ 4.23Å; L276-F342 HydrophobicContact CD2-CE1 4.09Å; L276-F342 HydrophobicContact CD2-CZ 4.37Å; L276-F342 HydrophobicContact CG-CZ 4.36Å; L276-H352 HydrophobicContact CD1-CB 4.03Å; L276-H352 HydrophobicContact CD2-CB 4.09Å; L276-H352 WeakPolarHBondContact CD2-O 3.41Å; L276-T355 HydrophobicContact CD2-CG2 4.07Å; L276-L356 HydrophobicContact CD2-CB 4.13Å; L276-R359 PolarHBondContact O-NE 3.46Å
277	A	86	Confident	83.3	Confident	4 Å²	4	29.8 Å²	29.8	3%	0.033	15%	0.15	C	C	.	.	S	Bend	trans	-63.2	148.7	176.9	0	0	0	0	0	112.2	L241 Y273 A274 L275 K283	L241-A277 HydrophobicContact CB-CB 4.03Å; L241-A277 HydrophobicContact CD1-CB 4.33Å; Y273-A277 PolarHBondContact O-N 3.39Å; A274-A277 WeakPolarHBondContact O-CB 3.45Å; A274-A277 PolarHBondContact O-N 2.65Å; L275-A277 VanDerWaalsContact C-N 3.25Å; L275-A277 PolarHBondContact O-N 3.31Å; A277-K283 HydrophobicContact CB-CD 4.32Å; A277-K283 WeakPolarHBondContact O-CD 3.43Å; A277-K283 PolarHBondContact O-NZ 2.86Å
278	A	83.2	Confident	83.5	Confident	29 Å²	29	36 Å²	36	24%	0.24	17%	0.173	C	C	.	.			trans	-59.9	156.8	175	0	0	0	0	0	112.4	N280 K283 R359	A278-N280 VanDerWaalsContact C-N 3.27Å; A278-N280 PolarHBondContact O-N 3.36Å; A278-K283 VanDerWaalsContact O-CD 3.28Å; A278-K283 WeakPolarHBondContact O-CD 3.46Å; A278-R359 VanDerWaalsContact CA-CZ 3.43Å
279	S	74.4	Confident	83.6	Confident	18 Å²	18	41.9 Å²	41.9	13%	0.126	20%	0.199	C	C	.	.	S	Bend	trans	-77	77.5	-174.2	-165.1	0	0	0	0	111.7	L366 E403	S279-L366 WeakPolarHBondContact OG-CD1 3.41Å; S279-E403 PolarHBondContact N-OE1 3.18Å
280	N	77.3	Confident	83.5	Confident	76 Å²	76	40.8 Å²	40.8	41%	0.406	19%	0.193	S	C	.	.			trans	-104.9	156.5	174.3	-73.9	-37.3	0	0	0	111.5	A278 E282 K283 K284	A278-N280 VanDerWaalsContact C-N 3.27Å; A278-N280 PolarHBondContact O-N 3.36Å; N280-E282 PolarHBondContact O-N 3.32Å; N280-K283 WeakPolarHBondContact O-CB 3.48Å; N280-K283 PolarHBondContact O-N 2.92Å; N280-K284 PolarHBondContact O-N 3.48Å; N280-K284 VanDerWaalsContact O-N 3.17Å
281	E	80.3	Confident	83.3	Confident	113 Å²	113	43.1 Å²	43.1	53%	0.528	21%	0.209	S	C	.	.	H	α-helix	trans	-56.6	-33.1	171.3	-71	-55.5	131.1	0	0	111.8	K283 K284 M285	E281-K283 VanDerWaalsContact C-N 3.35Å; E281-K283 PolarHBondContact O-N 3.37Å; E281-K284 PolarHBondContact O-N 2.9Å; E281-K284 IonicContact OE1-NZ 3.16Å; E281-K284 PolarHBondContact OE1-NZ 3.27Å; E281-M285 WeakPolarHBondContact O-CG 3.32Å; E281-M285 PolarHBondContact O-N 3.38Å
282	E	82.1	Confident	83	Confident	107 Å²	107	50.7 Å²	50.7	50%	0.5	25%	0.247	S	C	.	.	H	α-helix	trans	-61.7	-38.9	172.9	-66.5	-166.8	-165.3	0	0	113.4	L241 K245 N280 M285 L286	L241-E282 HydrophobicContact CD2-CB 3.91Å; L241-E282 WeakPolarHBondContact CD2-OE2 3.45Å; K245-E282 IonicContact NZ-OE2 3.25Å; K245-E282 PolarHBondContact NZ-OE2 2.94Å; N280-E282 PolarHBondContact O-N 3.32Å; E282-M285 PolarHBondContact O-N 3.23Å; E282-L286 WeakPolarHBondContact O-CB 3.46Å; E282-L286 PolarHBondContact O-N 3.07Å
283	K	84.9	Confident	82.6	Confident	12 Å²	12	53.4 Å²	53.4	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-47.2	175.6	172.9	-175.7	174.9	173.6	0	109.8	L241 A274 L275 A277 A278 N280 E281 M285 L286 L287	L241-K283 HydrophobicContact CD1-CB 4.42Å; A274-K283 WeakPolarHBondContact O-CE 3.36Å; L275-K283 PolarHBondContact O-NZ 3.44Å; A277-K283 HydrophobicContact CB-CD 4.32Å; A277-K283 WeakPolarHBondContact O-CD 3.43Å; A277-K283 PolarHBondContact O-NZ 2.86Å; A278-K283 VanDerWaalsContact O-CD 3.28Å; A278-K283 WeakPolarHBondContact O-CD 3.46Å; N280-K283 WeakPolarHBondContact O-CB 3.48Å; N280-K283 PolarHBondContact O-N 2.92Å; E281-K283 VanDerWaalsContact C-N 3.35Å; E281-K283 PolarHBondContact O-N 3.37Å; K283-M285 VanDerWaalsContact C-N 3.31Å; K283-M285 PolarHBondContact O-N 3.13Å; K283-L286 PolarHBondContact O-N 3.44Å; K283-L286 VanDerWaalsContact O-N 3.15Å; K283-L287 HydrophobicContact CG-CD1 3.92Å; K283-L287 HydrophobicContact CG-CG 4.3Å; K283-L287 WeakPolarHBondContact O-CB 3.33Å; K283-L287 WeakPolarHBondContact O-CG 3.35Å; K283-L287 PolarHBondContact O-N 3.37Å
284	K	81.4	Confident	81.8	Confident	79 Å²	79	61.2 Å²	61.2	34%	0.343	30%	0.295	S	S	.	.	H	α-helix	trans	-59.2	-43.2	177.5	-65.4	179.5	-171.6	163.8	0	111.4	N280 E281 L287 R288	N280-K284 PolarHBondContact O-N 3.48Å; N280-K284 VanDerWaalsContact O-N 3.17Å; E281-K284 PolarHBondContact O-N 2.9Å; E281-K284 IonicContact OE1-NZ 3.16Å; E281-K284 PolarHBondContact OE1-NZ 3.27Å; K284-L287 PolarHBondContact O-N 2.89Å; K284-R288 WeakPolarHBondContact O-CB 3.33Å; K284-R288 VanDerWaalsContact O-CG 3.3Å; K284-R288 WeakPolarHBondContact O-CG 3.49Å; K284-R288 PolarHBondContact O-N 3.36Å
285	M	85	Confident	80.9	Confident	109 Å²	109	63.8 Å²	63.8	54%	0.537	31%	0.309	S	S	.	.	H	α-helix	trans	-63.1	-42.2	175.2	-71.6	-160.9	-143.8	0	0	112.3	E281 E282 K283 R288 K289	E281-M285 WeakPolarHBondContact O-CG 3.32Å; E281-M285 PolarHBondContact O-N 3.38Å; E282-M285 PolarHBondContact O-N 3.23Å; K283-M285 VanDerWaalsContact C-N 3.31Å; K283-M285 PolarHBondContact O-N 3.13Å; M285-R288 PolarHBondContact O-N 3.39Å; M285-K289 VanDerWaalsContact O-CG 3.3Å; M285-K289 WeakPolarHBondContact O-CG 3.49Å; M285-K289 PolarHBondContact O-N 3.06Å
286	L	83.2	Confident	79.7	Confident	12 Å²	12	63.6 Å²	63.6	6%	0.063	31%	0.308	C	S	.	.	H	α-helix	trans	-65.3	-44.9	178.1	-176.4	129.3	0	0	0	111.3	S244 K245 A274 E282 K283 R288 K289 I290	S244-L286 WeakPolarHBondContact OG-CD2 3.47Å; K245-L286 HydrophobicContact CG-CD1 3.56Å; A274-L286 HydrophobicContact CB-CD2 3.53Å; E282-L286 WeakPolarHBondContact O-CB 3.46Å; E282-L286 PolarHBondContact O-N 3.07Å; K283-L286 PolarHBondContact O-N 3.44Å; K283-L286 VanDerWaalsContact O-N 3.15Å; L286-R288 PolarHBondContact O-N 3.07Å; L286-K289 WeakPolarHBondContact O-CB 3.48Å; L286-K289 PolarHBondContact O-N 3.18Å; L286-I290 HydrophobicContact CD2-CD1 3.48Å; L286-I290 VanDerWaalsContact CD2-CD1 3.48Å; L286-I290 HydrophobicContact CG-CD1 4.03Å; L286-I290 VanDerWaalsContact O-CG1 3.26Å; L286-I290 WeakPolarHBondContact O-CG1 3.42Å; L286-I290 PolarHBondContact O-N 3.3Å
287	L	84.4	Confident	78.8	Confident	4 Å²	4	70.1 Å²	70.1	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-61.4	-42.3	175.4	-70.3	174.4	0	0	0	112.2	A274 K283 K284 K289 I290 S291 I306 L310	A274-L287 HydrophobicContact CB-CD2 3.76Å; K283-L287 HydrophobicContact CG-CD1 3.92Å; K283-L287 HydrophobicContact CG-CG 4.3Å; K283-L287 WeakPolarHBondContact O-CB 3.33Å; K283-L287 WeakPolarHBondContact O-CG 3.35Å; K283-L287 PolarHBondContact O-N 3.37Å; K284-L287 PolarHBondContact O-N 2.89Å; L287-K289 VanDerWaalsContact C-N 3.34Å; L287-K289 PolarHBondContact O-N 3.09Å; L287-I290 PolarHBondContact O-N 3.18Å; L287-S291 PolarHBondContact O-N 3.08Å; L287-S291 PolarHBondContact O-OG 3.39Å; L287-I306 HydrophobicContact CB-CG2 4.21Å; L287-I306 HydrophobicContact CD2-CG1 4.34Å; L287-I306 HydrophobicContact CD2-CG2 4.28Å; L287-L310 HydrophobicContact CB-CD1 4.05Å
288	R	85.1	Confident	78.1	Confident	134 Å²	134	72.5 Å²	72.5	51%	0.506	36%	0.36	S	S	.	.	H	α-helix	trans	-60.8	-40.7	173.5	-74.5	178.3	-172.1	174.2	3.6	112.5	K284 M285 L286 S291 M292 L310	K284-R288 WeakPolarHBondContact O-CB 3.33Å; K284-R288 VanDerWaalsContact O-CG 3.3Å; K284-R288 WeakPolarHBondContact O-CG 3.49Å; K284-R288 PolarHBondContact O-N 3.36Å; M285-R288 PolarHBondContact O-N 3.39Å; L286-R288 PolarHBondContact O-N 3.07Å; R288-S291 PolarHBondContact O-OG 3.34Å; R288-M292 WeakPolarHBondContact O-CG 3.36Å; R288-M292 PolarHBondContact O-N 3.26Å; R288-L310 HydrophobicContact CB-CD1 4.44Å; R288-L310 HydrophobicContact CG-CD1 3.7Å; R288-L310 HydrophobicContact CG-CD2 4.16Å; R288-L310 HydrophobicContact CG-CG 4.25Å
289	K	83.7	Confident	77.7	Confident	126 Å²	126	71.6 Å²	71.6	55%	0.548	35%	0.351	S	S	.	.	H	α-helix	trans	-64.8	-42.7	176.1	-74.4	174.1	-177.3	-178.3	0	111.3	M285 L286 L287 M292	M285-K289 VanDerWaalsContact O-CG 3.3Å; M285-K289 WeakPolarHBondContact O-CG 3.49Å; M285-K289 PolarHBondContact O-N 3.06Å; L286-K289 WeakPolarHBondContact O-CB 3.48Å; L286-K289 PolarHBondContact O-N 3.18Å; L287-K289 VanDerWaalsContact C-N 3.34Å; L287-K289 PolarHBondContact O-N 3.09Å; K289-M292 PolarHBondContact O-N 2.98Å
290	I	82	Confident	77.8	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-65	-44.4	178.2	-67.3	170.1	0	0	0	110.3	F267 I271 A274 L286 L287 M292 N293 C296 I306	F267-I290 HydrophobicContact CE1-CG2 4.14Å; F267-I290 HydrophobicContact CE2-CG2 4.01Å; F267-I290 HydrophobicContact CZ-CG2 3.47Å; F267-I290 VanDerWaalsContact CZ-CG2 3.47Å; I271-I290 HydrophobicContact CD1-CG2 4.27Å; I271-I290 HydrophobicContact CG1-CG2 3.92Å; A274-I290 HydrophobicContact CB-CD1 4.39Å; L286-I290 HydrophobicContact CD2-CD1 3.48Å; L286-I290 VanDerWaalsContact CD2-CD1 3.48Å; L286-I290 HydrophobicContact CG-CD1 4.03Å; L286-I290 VanDerWaalsContact O-CG1 3.26Å; L286-I290 WeakPolarHBondContact O-CG1 3.42Å; L286-I290 PolarHBondContact O-N 3.3Å; L287-I290 PolarHBondContact O-N 3.18Å; I290-M292 PolarHBondContact O-N 3.29Å; I290-N293 WeakPolarHBondContact O-CB 3.44Å; I290-N293 PolarHBondContact O-N 3.42Å; I290-C296 PolarHBondContact O-SG 2.98Å; I290-I306 HydrophobicContact CB-CD1 4.47Å; I290-I306 HydrophobicContact CG2-CD1 3.6Å
291	S	80.8	Confident	77.8	Confident	49 Å²	49	74.7 Å²	74.7	34%	0.343	37%	0.368	S	S	.	.	H	α-helix	trans	-63.7	-28.5	179.9	69.4	0	0	0	0	113.1	L287 R288 N293	L287-S291 PolarHBondContact O-N 3.08Å; L287-S291 PolarHBondContact O-OG 3.39Å; R288-S291 PolarHBondContact O-OG 3.34Å; S291-N293 VanDerWaalsContact C-N 3.31Å
292	M	79.6	Confident	77.6	Confident	160 Å²	160	69.5 Å²	69.5	79%	0.788	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-13.6	175.4	-73	-177.7	166.3	0	0	114	R288 K289 I290	R288-M292 WeakPolarHBondContact O-CG 3.36Å; R288-M292 PolarHBondContact O-N 3.26Å; K289-M292 PolarHBondContact O-N 2.98Å; I290-M292 PolarHBondContact O-N 3.29Å
293	N	77.1	Confident	77.3	Confident	60 Å²	60	65.7 Å²	65.7	32%	0.321	33%	0.329	S	S	.	.	S	Bend	trans	-76.2	132.7	179.3	-77.2	-34.3	0	0	0	110.9	F267 I290 S291 L295 C296	F267-N293 HydrophobicContact CZ-CB 4.36Å; I290-N293 WeakPolarHBondContact O-CB 3.44Å; I290-N293 PolarHBondContact O-N 3.42Å; S291-N293 VanDerWaalsContact C-N 3.31Å; N293-L295 PolarHBondContact O-N 2.97Å; N293-C296 WeakPolarHBondContact O-CB 3.39Å; N293-C296 PolarHBondContact O-N 3.45Å
294	K	70.5	Confident	77.1	Confident	184 Å²	184	71.1 Å²	71.1	80%	0.8	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-15.8	177.1	-61.1	-176.2	178.6	-176.9	0	114.8	C296 D297	K294-C296 VanDerWaalsContact C-N 3.3Å; K294-D297 WeakPolarHBondContact O-CB 3.32Å; K294-D297 PolarHBondContact O-N 3.04Å
295	L	65.8	Low	77.1	Confident	54 Å²	54	67.7 Å²	67.7	28%	0.283	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-23.6	177.6	-64	161.4	0	0	0	112.4	H263 F267 N293 D297 S298	H263-L295 WeakPolarHBondContact CE1-CD1 3.16Å; H263-L295 WeakPolarHBondContact NE2-CD1 3.29Å; F267-L295 HydrophobicContact CD1-CB 4.39Å; F267-L295 HydrophobicContact CD2-CD1 4.28Å; F267-L295 HydrophobicContact CE1-CB 4.17Å; F267-L295 HydrophobicContact CE2-CB 4.38Å; F267-L295 HydrophobicContact CE2-CD1 4.35Å; F267-L295 HydrophobicContact CZ-CB 4.17Å; N293-L295 PolarHBondContact O-N 2.97Å; L295-D297 PolarHBondContact O-N 3.16Å; L295-S298 WeakPolarHBondContact O-CB 3.32Å; L295-S298 PolarHBondContact O-N 2.94Å; L295-S298 VanDerWaalsContact O-N 3.09Å; L295-S298 PolarHBondContact O-OG 3.07Å
296	C	60.8	Low	76.9	Confident	6 Å²	6	62.5 Å²	62.5	4%	0.041	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-59.9	-33.8	172.6	-76.3	0	0	0	0	111.4	I290 N293 K294 S298 L299	I290-C296 PolarHBondContact O-SG 2.98Å; N293-C296 WeakPolarHBondContact O-CB 3.39Å; N293-C296 PolarHBondContact O-N 3.45Å; K294-C296 VanDerWaalsContact C-N 3.3Å; C296-S298 PolarHBondContact O-N 3.47Å; C296-L299 CarbonylContact O-C 3.54Å; C296-L299 VanDerWaalsContact O-C 3.27Å; C296-L299 PolarHBondContact O-N 2.99Å
297	D	68.3	Low	77	Confident	136 Å²	136	66.2 Å²	66.2	73%	0.727	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-62	-27.4	177.4	-55.3	-25.7	0	0	0	112.2	K294 L295 L299	K294-D297 WeakPolarHBondContact O-CB 3.32Å; K294-D297 PolarHBondContact O-N 3.04Å; L295-D297 PolarHBondContact O-N 3.16Å; D297-L299 VanDerWaalsContact C-N 3.32Å
298	S	70.7	Confident	77	Confident	55 Å²	55	66.7 Å²	66.7	39%	0.385	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-78.9	-14.5	177.6	75.4	0	0	0	0	113.8	L295 C296	L295-S298 WeakPolarHBondContact O-CB 3.32Å; L295-S298 PolarHBondContact O-N 2.94Å; L295-S298 VanDerWaalsContact O-N 3.09Å; L295-S298 PolarHBondContact O-OG 3.07Å; C296-S298 PolarHBondContact O-N 3.47Å
299	L	73.5	Confident	76.9	Confident	10 Å²	10	61.1 Å²	61.1	5%	0.052	31%	0.309	C	S	.	.			trans	-136.5	72.8	-176.1	-68.1	173.5	0	0	0	110.3	Q264 F267 K268 C296 D297 E301 Y302 S303	Q264-L299 HydrophobicContact CB-CD1 4.3Å; Q264-L299 HydrophobicContact CG-CD1 4.31Å; F267-L299 HydrophobicContact CD1-CD1 4.46Å; K268-L299 HydrophobicContact CD-CD1 4.32Å; K268-L299 VanDerWaalsContact CE-CD2 3.47Å; K268-L299 HydrophobicContact CG-CD1 3.72Å; C296-L299 CarbonylContact O-C 3.54Å; C296-L299 VanDerWaalsContact O-C 3.27Å; C296-L299 PolarHBondContact O-N 2.99Å; D297-L299 VanDerWaalsContact C-N 3.32Å; L299-E301 PolarHBondContact O-N 3.17Å; L299-Y302 HydrophobicContact CB-CD2 4.28Å; L299-Y302 PolarHBondContact O-N 3.39Å; L299-Y302 VanDerWaalsContact O-N 3.15Å; L299-S303 PolarHBondContact O-N 3.23Å; L299-S303 VanDerWaalsContact O-N 3.1Å
300	P	77.2	Confident	76.9	Confident	85 Å²	85	58.3 Å²	58.3	55%	0.552	30%	0.3	S	S	*	.	H	α-helix	trans	-62	-29	-173.7	24.7	-34.7	0	0	0	113.3	Y302 S303 Y304	P300-Y302 PolarHBondContact O-N 3.39Å; P300-S303 WeakPolarHBondContact CA-OG 3.19Å; P300-S303 PolarHBondContact O-N 3.11Å; P300-S303 PolarHBondContact O-OG 3.15Å; P300-Y304 PolarHBondContact O-N 3.13Å
301	E	76.6	Confident	77	Confident	74 Å²	74	62.5 Å²	62.5	35%	0.346	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-42.7	178.4	-61.8	170	156.4	0	0	111.7	L299 L305 Y325 L328	L299-E301 PolarHBondContact O-N 3.17Å; E301-L305 PolarHBondContact O-N 3.41Å; E301-Y325 HydrophobicContact CB-CE1 4.37Å; E301-Y325 VanDerWaalsContact O-CE1 3.25Å; E301-Y325 WeakPolarHBondContact O-CE1 3.42Å; E301-Y325 PolarHBondContact O-OH 3.47Å; E301-L328 HydrophobicContact CB-CD2 3.74Å; E301-L328 HydrophobicContact CG-CD2 4.34Å; E301-L328 WeakPolarHBondContact OE2-CD1 3.41Å; E301-L328 WeakPolarHBondContact OE2-CD2 3.33Å
302	Y	76	Confident	77	Confident	4 Å²	4	63.3 Å²	63.3	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-78	-29.9	178	-73	-89	0	0	0	111.9	K268 I271 L299 P300 L305 I306 L328 L329	K268-Y302 HydrophobicContact CB-CE1 4.23Å; K268-Y302 HydrophobicContact CB-CE2 4.37Å; K268-Y302 HydrophobicContact CD-CE2 3.78Å; K268-Y302 HydrophobicContact CG-CD2 4.04Å; K268-Y302 HydrophobicContact CG-CE1 4.26Å; K268-Y302 HydrophobicContact CG-CE2 3.58Å; I271-Y302 HydrophobicContact CB-CD1 4.36Å; I271-Y302 HydrophobicContact CD1-CD1 4.44Å; I271-Y302 HydrophobicContact CD1-CG 4.39Å; I271-Y302 HydrophobicContact CG2-CD1 4.01Å; L299-Y302 HydrophobicContact CB-CD2 4.28Å; L299-Y302 PolarHBondContact O-N 3.39Å; L299-Y302 VanDerWaalsContact O-N 3.15Å; P300-Y302 PolarHBondContact O-N 3.39Å; Y302-L305 PolarHBondContact O-N 3.12Å; Y302-I306 WeakPolarHBondContact O-CG1 3.4Å; Y302-I306 PolarHBondContact O-N 2.9Å; Y302-L328 HydrophobicContact CE2-CD2 4.31Å; Y302-L329 HydrophobicContact CE1-CD2 4.06Å
303	S	77.1	Confident	77.2	Confident	27 Å²	27	60.5 Å²	60.5	19%	0.189	31%	0.311	C	S	.	.	H	α-helix	trans	-65.2	-46.7	175.6	80.7	0	0	0	0	111.1	L299 P300 L305 I306 E307	L299-S303 PolarHBondContact O-N 3.23Å; L299-S303 VanDerWaalsContact O-N 3.1Å; P300-S303 WeakPolarHBondContact CA-OG 3.19Å; P300-S303 PolarHBondContact O-N 3.11Å; P300-S303 PolarHBondContact O-OG 3.15Å; S303-L305 PolarHBondContact O-N 3.4Å; S303-I306 WeakPolarHBondContact O-CB 3.33Å; S303-I306 PolarHBondContact O-N 3.01Å; S303-I306 VanDerWaalsContact O-N 3.1Å; S303-E307 WeakPolarHBondContact O-CG 3.4Å; S303-E307 PolarHBondContact O-N 3.34Å
304	Y	80.3	Confident	77.5	Confident	125 Å²	125	60.5 Å²	60.5	49%	0.49	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-38.3	176.1	-174.5	-102.3	0	0	0	111.3	P300 I306 E307 L308 Y325	P300-Y304 PolarHBondContact O-N 3.13Å; Y304-I306 VanDerWaalsContact C-N 3.34Å; Y304-I306 PolarHBondContact O-N 2.88Å; Y304-E307 WeakPolarHBondContact O-CB 3.41Å; Y304-E307 PolarHBondContact O-N 3.31Å; Y304-L308 HydrophobicContact CD1-CD1 3.81Å; Y304-L308 HydrophobicContact CD1-CG 4.03Å; Y304-L308 HydrophobicContact CE1-CD1 3.59Å; Y304-L308 HydrophobicContact CE1-CD2 3.92Å; Y304-L308 HydrophobicContact CE1-CG 3.76Å; Y304-L308 WeakPolarHBondContact O-CG 3.43Å; Y304-L308 PolarHBondContact O-N 2.95Å; Y304-Y325 HydrophobicContact CD1-CE2 4.43Å; Y304-Y325 VanDerWaalsContact CD1-OH 3.26Å; Y304-Y325 WeakPolarHBondContact CD1-OH 3.33Å
305	L	81.1	Confident	78.1	Confident	7 Å²	7	51.8 Å²	51.8	4%	0.037	27%	0.273	C	S	.	.	H	α-helix	trans	-64.7	-39.2	176.9	-163.2	148	0	0	0	111.7	L275 E301 Y302 S303 F309 Y325	L275-L305 HydrophobicContact CD1-CD2 3.08Å; L275-L305 HydrophobicContact CD2-CD2 3.59Å; L275-L305 HydrophobicContact CG-CD2 3.94Å; E301-L305 PolarHBondContact O-N 3.41Å; Y302-L305 PolarHBondContact O-N 3.12Å; S303-L305 PolarHBondContact O-N 3.4Å; L305-F309 HydrophobicContact CD2-CD2 4.12Å; L305-F309 HydrophobicContact CD2-CE2 3.96Å; L305-F309 WeakPolarHBondContact O-CD2 3.37Å; L305-F309 PolarHBondContact O-N 3.2Å; L305-Y325 HydrophobicContact CB-CE1 4.15Å; L305-Y325 HydrophobicContact CB-CE2 4.48Å; L305-Y325 HydrophobicContact CD1-CD1 3.62Å; L305-Y325 HydrophobicContact CD1-CD2 3.87Å; L305-Y325 HydrophobicContact CD1-CE1 3.78Å; L305-Y325 HydrophobicContact CD1-CE2 4.04Å; L305-Y325 HydrophobicContact CD1-CG 3.65Å
306	I	82.3	Confident	78.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-45.6	171.7	-65.9	165.5	0	0	0	110.7	I271 L287 I290 Y302 S303 Y304 L308 F309 L310	I271-I306 HydrophobicContact CD1-CD1 3.79Å; I271-I306 HydrophobicContact CG1-CD1 3.94Å; I271-I306 HydrophobicContact CG2-CD1 4.12Å; I271-I306 HydrophobicContact CG2-CG1 3.93Å; L287-I306 HydrophobicContact CB-CG2 4.21Å; L287-I306 HydrophobicContact CD2-CG1 4.34Å; L287-I306 HydrophobicContact CD2-CG2 4.28Å; I290-I306 HydrophobicContact CB-CD1 4.47Å; I290-I306 HydrophobicContact CG2-CD1 3.6Å; Y302-I306 WeakPolarHBondContact O-CG1 3.4Å; Y302-I306 PolarHBondContact O-N 2.9Å; S303-I306 WeakPolarHBondContact O-CB 3.33Å; S303-I306 PolarHBondContact O-N 3.01Å; S303-I306 VanDerWaalsContact O-N 3.1Å; Y304-I306 VanDerWaalsContact C-N 3.34Å; Y304-I306 PolarHBondContact O-N 2.88Å; I306-L308 VanDerWaalsContact C-N 3.3Å; I306-L308 PolarHBondContact O-N 3.22Å; I306-F309 PolarHBondContact O-N 2.98Å; I306-F309 VanDerWaalsContact O-N 3.16Å; I306-L310 HydrophobicContact CG2-CD1 4.18Å; I306-L310 WeakPolarHBondContact O-CB 3.45Å; I306-L310 PolarHBondContact O-N 2.91Å
307	E	84.5	Confident	79.5	Confident	90 Å²	90	52.9 Å²	52.9	42%	0.421	28%	0.277	S	S	.	.	H	α-helix	trans	-58.4	-41.3	-179.5	-74	174.5	-169.4	0	0	112.1	S303 Y304 F309 L310 Q311	S303-E307 WeakPolarHBondContact O-CG 3.4Å; S303-E307 PolarHBondContact O-N 3.34Å; Y304-E307 WeakPolarHBondContact O-CB 3.41Å; Y304-E307 PolarHBondContact O-N 3.31Å; E307-F309 VanDerWaalsContact C-N 3.34Å; E307-F309 PolarHBondContact O-N 3.44Å; E307-L310 PolarHBondContact O-N 2.93Å; E307-L310 VanDerWaalsContact O-N 3.09Å; E307-Q311 WeakPolarHBondContact O-CB 3.15Å; E307-Q311 WeakPolarHBondContact O-CG 3.42Å; E307-Q311 PolarHBondContact O-N 3.43Å
308	L	83.8	Confident	79.8	Confident	15 Å²	15	53.8 Å²	53.8	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-55.6	-45.9	174.9	-74.8	172.3	0	0	0	112.3	Y304 I306 L310 I315 Y325	Y304-L308 HydrophobicContact CD1-CD1 3.81Å; Y304-L308 HydrophobicContact CD1-CG 4.03Å; Y304-L308 HydrophobicContact CE1-CD1 3.59Å; Y304-L308 HydrophobicContact CE1-CD2 3.92Å; Y304-L308 HydrophobicContact CE1-CG 3.76Å; Y304-L308 WeakPolarHBondContact O-CG 3.43Å; Y304-L308 PolarHBondContact O-N 2.95Å; I306-L308 VanDerWaalsContact C-N 3.3Å; I306-L308 PolarHBondContact O-N 3.22Å; L308-L310 VanDerWaalsContact C-N 3.33Å; L308-I315 HydrophobicContact CB-CD1 4.3Å; L308-Y325 HydrophobicContact CD1-CE2 4.43Å
309	F	82.8	Confident	79.8	Confident	16 Å²	16	58.4 Å²	58.4	7%	0.07	28%	0.283	C	S	.	.	H	α-helix	trans	-78.3	-16.3	178.4	-77.2	-85.2	0	0	0	113.7	L275 L305 I306 E307 I315 I321 L356 T360 H363	L275-F309 HydrophobicContact CD2-CB 4.35Å; L275-F309 HydrophobicContact CD2-CD2 3.36Å; L275-F309 HydrophobicContact CD2-CE2 3.66Å; L275-F309 HydrophobicContact CD2-CG 3.88Å; L275-F309 HydrophobicContact CD2-CZ 4.37Å; L305-F309 HydrophobicContact CD2-CD2 4.12Å; L305-F309 HydrophobicContact CD2-CE2 3.96Å; L305-F309 WeakPolarHBondContact O-CD2 3.37Å; L305-F309 PolarHBondContact O-N 3.2Å; I306-F309 PolarHBondContact O-N 2.98Å; I306-F309 VanDerWaalsContact O-N 3.16Å; E307-F309 VanDerWaalsContact C-N 3.34Å; E307-F309 PolarHBondContact O-N 3.44Å; F309-I315 HydrophobicContact CD1-CD1 4.15Å; F309-I315 HydrophobicContact CE1-CD1 4.29Å; F309-I315 HydrophobicContact CG-CD1 4.31Å; F309-I321 HydrophobicContact CZ-CD1 4.42Å; F309-L356 HydrophobicContact CZ-CD1 4.45Å; F309-T360 HydrophobicContact CE1-CG2 3.75Å; F309-T360 HydrophobicContact CZ-CG2 3.42Å; F309-T360 VanDerWaalsContact CZ-CG2 3.42Å; F309-H363 HydrophobicContact CD1-CB 4.39Å; F309-H363 PolarHBondContact O-CE1 3.31Å
310	L	84.1	Confident	79.6	Confident	68 Å²	68	60.6 Å²	60.6	36%	0.356	29%	0.293	S	S	.	.	H	α-helix	trans	-88.2	-31.7	179.3	-148.3	128.1	0	0	0	111.7	L287 R288 I306 E307 L308	L287-L310 HydrophobicContact CB-CD1 4.05Å; R288-L310 HydrophobicContact CB-CD1 4.44Å; R288-L310 HydrophobicContact CG-CD1 3.7Å; R288-L310 HydrophobicContact CG-CD2 4.16Å; R288-L310 HydrophobicContact CG-CG 4.25Å; I306-L310 HydrophobicContact CG2-CD1 4.18Å; I306-L310 WeakPolarHBondContact O-CB 3.45Å; I306-L310 PolarHBondContact O-N 2.91Å; E307-L310 PolarHBondContact O-N 2.93Å; E307-L310 VanDerWaalsContact O-N 3.09Å; L308-L310 VanDerWaalsContact C-N 3.33Å
311	Q	83.8	Confident	79.2	Confident	87 Å²	87	56.8 Å²	56.8	41%	0.407	27%	0.268	S	S	.	.	S	Bend	trans	-74.8	137	174.7	-70.4	177.9	-0	0	0	110.2	E307 L313 H363	E307-Q311 WeakPolarHBondContact O-CB 3.15Å; E307-Q311 WeakPolarHBondContact O-CG 3.42Å; E307-Q311 PolarHBondContact O-N 3.43Å; Q311-L313 HydrophobicContact CB-CD1 4.12Å; Q311-L313 HydrophobicContact CB-CG 4.22Å; Q311-L313 PolarHBondContact O-N 3.47Å; Q311-L313 VanDerWaalsContact OE1-CD1 3.28Å; Q311-H363 PolarHBondContact O-CE1 3.41Å; Q311-H363 PolarHBondContact O-NE2 3.36Å
312	P	81	Confident	78.8	Confident	67 Å²	67	57.1 Å²	57.1	44%	0.435	27%	0.272	S	S	.	.	S	Bend	trans	-77.9	59.1	174	35.1	-36.2	0	0	0	109.8	T367 Y371	P312-T367 VanDerWaalsContact C-CG2 3.41Å; P312-T367 VanDerWaalsContact O-CG2 3.24Å; P312-T367 WeakPolarHBondContact O-CG2 3.49Å; P312-Y371 HydrophobicContact CB-CE2 4.12Å; P312-Y371 VanDerWaalsContact CG-OH 3.28Å; P312-Y371 WeakPolarHBondContact CG-OH 3.49Å; P312-Y371 WeakPolarHBondContact O-CE2 3.31Å
313	L	85	Confident	78.5	Confident	100 Å²	100	64.1 Å²	64.1	52%	0.524	31%	0.305	S	S	.	.			trans	-118.1	150.7	177.7	-67.9	172.3	0	0	0	110	Q311 H363	Q311-L313 HydrophobicContact CB-CD1 4.12Å; Q311-L313 HydrophobicContact CB-CG 4.22Å; Q311-L313 PolarHBondContact O-N 3.47Å; Q311-L313 VanDerWaalsContact OE1-CD1 3.28Å; L313-H363 PolarHBondContact O-NE2 3.06Å
314	L	82.6	Confident	78	Confident	60 Å²	60	66.2 Å²	66.2	31%	0.314	32%	0.318	S	S	.	.			trans	-70.8	127.6	174.9	-72.7	165.6	0	0	0	109.8	N364 I368 L383	L314-N364 HydrophobicContact CD2-CB 4.02Å; L314-I368 HydrophobicContact CD2-CD1 3.86Å; L314-I368 HydrophobicContact CD2-CG1 3.68Å; L314-L383 HydrophobicContact CD1-CD2 4.27Å
315	I	82	Confident	77.3	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.01	30%	0.298	C	S	.	.			trans	-102.5	115.5	179.8	-56.3	173.5	0	0	0	109.2	L308 F309 W317 E320 I321 N364	L308-I315 HydrophobicContact CB-CD1 4.3Å; F309-I315 HydrophobicContact CD1-CD1 4.15Å; F309-I315 HydrophobicContact CE1-CD1 4.29Å; F309-I315 HydrophobicContact CG-CD1 4.31Å; I315-W317 PolarHBondContact O-N 2.82Å; I315-E320 WeakPolarHBondContact CA-OE2 3.42Å; I315-E320 HydrophobicContact CG2-CB 4.24Å; I315-E320 WeakPolarHBondContact CG2-OE2 3.46Å; I315-I321 HydrophobicContact CG2-CD1 3.71Å; I315-I321 HydrophobicContact CG2-CG1 4.06Å; I315-N364 PolarHBondContact N-OD1 3.36Å; I315-N364 PolarHBondContact O-ND2 3.14Å
316	N	80.8	Confident	76.3	Confident	60 Å²	60	61.1 Å²	61.1	32%	0.321	30%	0.299	S	S	.	.			trans	-79.8	105.8	174.1	-71.9	-61.6	0	0	0	110.4	R318 K319 E320	N316-R318 VanDerWaalsContact C-N 3.29Å; N316-R318 PolarHBondContact O-N 3.22Å; N316-R318 VanDerWaalsContact O-N 3.14Å; N316-K319 HydrophobicContact CB-CB 4.2Å; N316-K319 PolarHBondContact O-N 3.15Å; N316-K319 VanDerWaalsContact O-N 3.13Å; N316-E320 PolarHBondContact N-OE2 2.97Å; N316-E320 WeakPolarHBondContact O-CB 3.3Å; N316-E320 PolarHBondContact O-N 3.21Å
317	W	77.1	Confident	75.3	Confident	23 Å²	23	66.5 Å²	66.5	9%	0.087	33%	0.327	C	S	.	.	I	π-helix	trans	-48.5	-47.9	-175.7	174	-101.6	0	0	0	113.2	I315 I321 L322 W353 L356 K357 T360	I315-W317 PolarHBondContact O-N 2.82Å; W317-I321 HydrophobicContact CE3-CB 4.14Å; W317-I321 HydrophobicContact CE3-CD1 3.79Å; W317-I321 HydrophobicContact CE3-CG2 4.11Å; W317-I321 HydrophobicContact CH2-CG2 4.16Å; W317-I321 HydrophobicContact CZ3-CB 4.33Å; W317-I321 HydrophobicContact CZ3-CD1 4Å; W317-I321 HydrophobicContact CZ3-CG2 3.8Å; W317-I321 PolarHBondContact O-N 3.22Å; W317-L322 PolarHBondContact O-N 3.44Å; W317-W353 HydrophobicContact CH2-CZ2 4.15Å; W317-W353 AromaticContact CZ2-CE2 3.9Å; W317-W353 AromaticContact CZ2-CZ2 3.91Å; W317-W353 HydrophobicContact CZ2-CZ2 3.91Å; W317-W353 AromaticContact CZ2-NE1 3.84Å; W317-L356 HydrophobicContact CH2-CB 4.34Å; W317-L356 HydrophobicContact CH2-CD2 4.19Å; W317-L356 HydrophobicContact CH2-CG 4.19Å; W317-L356 HydrophobicContact CZ3-CD2 4.33Å; W317-L356 HydrophobicContact CZ3-CG 4.06Å; W317-K357 HydrophobicContact CD2-CB 4.4Å; W317-K357 HydrophobicContact CD2-CG 4.03Å; W317-K357 HydrophobicContact CE3-CB 4.36Å; W317-K357 HydrophobicContact CE3-CG 4.34Å; W317-K357 HydrophobicContact CG-CG 4.49Å; W317-K357 HydrophobicContact CH2-CB 3.76Å; W317-K357 HydrophobicContact CH2-CG 4.42Å; W317-K357 HydrophobicContact CZ2-CB 3.79Å; W317-K357 HydrophobicContact CZ2-CG 4.11Å; W317-K357 VanDerWaalsContact CZ3-CA 3.49Å; W317-K357 HydrophobicContact CZ3-CB 4.05Å; W317-T360 HydrophobicContact CE3-CG2 3.8Å; W317-T360 HydrophobicContact CZ3-CG2 3.82Å
318	R	72.7	Confident	74.1	Confident	154 Å²	154	62.5 Å²	62.5	58%	0.581	31%	0.309	S	S	*	.	I	π-helix	trans	-70.7	-37.1	-175.3	-62	-176.1	-161.8	-163.5	4.1	113.3	N316 L322	N316-R318 VanDerWaalsContact C-N 3.29Å; N316-R318 PolarHBondContact O-N 3.22Å; N316-R318 VanDerWaalsContact O-N 3.14Å; R318-L322 WeakPolarHBondContact O-CB 3.41Å
319	K	71.7	Confident	72.9	Confident	153 Å²	153	62.2 Å²	62.2	67%	0.665	31%	0.307	S	S	*	.	I	π-helix	trans	-89.2	-43.1	-172.4	-69.1	-176.1	180	176.1	0	111.8	N316 P324	N316-K319 HydrophobicContact CB-CB 4.2Å; N316-K319 PolarHBondContact O-N 3.15Å; N316-K319 VanDerWaalsContact O-N 3.13Å; K319-P324 WeakPolarHBondContact O-CD 3.49Å
320	E	68.4	Low	71.7	Confident	56 Å²	56	64 Å²	64	26%	0.262	32%	0.317	S	S	.	.	I	π-helix	trans	-96	-23.4	-168.8	-69.3	167	-149.7	0	0	113.1	I315 N316 P324 Y325	I315-E320 WeakPolarHBondContact CA-OE2 3.42Å; I315-E320 HydrophobicContact CG2-CB 4.24Å; I315-E320 WeakPolarHBondContact CG2-OE2 3.46Å; N316-E320 PolarHBondContact N-OE2 2.97Å; N316-E320 WeakPolarHBondContact O-CB 3.3Å; N316-E320 PolarHBondContact O-N 3.21Å; E320-P324 WeakPolarHBondContact O-CG 3.1Å; E320-Y325 WeakPolarHBondContact O-CD2 3.21Å
321	I	69.8	Low	70.3	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.021	33%	0.331	C	S	.	.	I	π-helix	trans	-112.2	-53.9	-179	-61.5	175.2	0	0	0	111	F309 I315 W317 Q323 Y325 G326 T360	F309-I321 HydrophobicContact CZ-CD1 4.42Å; I315-I321 HydrophobicContact CG2-CD1 3.71Å; I315-I321 HydrophobicContact CG2-CG1 4.06Å; W317-I321 HydrophobicContact CE3-CB 4.14Å; W317-I321 HydrophobicContact CE3-CD1 3.79Å; W317-I321 HydrophobicContact CE3-CG2 4.11Å; W317-I321 HydrophobicContact CH2-CG2 4.16Å; W317-I321 HydrophobicContact CZ3-CB 4.33Å; W317-I321 HydrophobicContact CZ3-CD1 4Å; W317-I321 HydrophobicContact CZ3-CG2 3.8Å; W317-I321 PolarHBondContact O-N 3.22Å; I321-Q323 PolarHBondContact O-N 2.99Å; I321-Y325 CarbonylContact O-C 3.27Å; I321-Y325 WeakPolarHBondContact O-CA 3.45Å; I321-Y325 VanDerWaalsContact O-CB 3.31Å; I321-Y325 WeakPolarHBondContact O-CB 3.39Å; I321-Y325 PolarHBondContact O-N 2.89Å; I321-G326 PolarHBondContact O-N 3.34Å; I321-T360 HydrophobicContact CD1-CG2 3.24Å
322	L	67.5	Low	68.9	Low	82 Å²	82	62.4 Å²	62.4	43%	0.429	32%	0.318	S	S	.	.	I	π-helix	trans	-62.9	-43.6	-172.1	-165.2	81.1	0	0	0	112.7	W317 R318 G326 W353	W317-L322 PolarHBondContact O-N 3.44Å; R318-L322 WeakPolarHBondContact O-CB 3.41Å; L322-G326 WeakPolarHBondContact O-CA 3.32Å; L322-G326 PolarHBondContact O-N 3.41Å; L322-W353 HydrophobicContact CD1-CZ2 4.08Å
323	Q	69.2	Low	67.4	Low	151 Å²	151	61.5 Å²	61.5	71%	0.706	31%	0.312	S	S	*	.	H	α-helix	trans	-72.6	-56.3	-177.8	-77	-160.8	-6.9	0	0	113.8	I321	I321-Q323 PolarHBondContact O-N 2.99Å
324	P	68.4	Low	65.5	Low	71 Å²	71	65 Å²	65	46%	0.461	33%	0.331	S	S	.	.	H	α-helix	trans	-78.8	-39.6	-176.1	28.4	-33.5	0	0	0	112.6	K319 E320	K319-P324 WeakPolarHBondContact O-CD 3.49Å; E320-P324 WeakPolarHBondContact O-CG 3.1Å
325	Y	64.5	Low	63.7	Low	17 Å²	17	70.5 Å²	70.5	7%	0.067	36%	0.355	C	S	.	.	H	α-helix	trans	-99.7	-15.5	-171.1	-66	-72.8	0	0	0	114.3	E301 Y304 L305 L308 E320 I321 I327 L328 L329	E301-Y325 HydrophobicContact CB-CE1 4.37Å; E301-Y325 VanDerWaalsContact O-CE1 3.25Å; E301-Y325 WeakPolarHBondContact O-CE1 3.42Å; E301-Y325 PolarHBondContact O-OH 3.47Å; Y304-Y325 HydrophobicContact CD1-CE2 4.43Å; Y304-Y325 VanDerWaalsContact CD1-OH 3.26Å; Y304-Y325 WeakPolarHBondContact CD1-OH 3.33Å; L305-Y325 HydrophobicContact CB-CE1 4.15Å; L305-Y325 HydrophobicContact CB-CE2 4.48Å; L305-Y325 HydrophobicContact CD1-CD1 3.62Å; L305-Y325 HydrophobicContact CD1-CD2 3.87Å; L305-Y325 HydrophobicContact CD1-CE1 3.78Å; L305-Y325 HydrophobicContact CD1-CE2 4.04Å; L305-Y325 HydrophobicContact CD1-CG 3.65Å; L308-Y325 HydrophobicContact CD1-CE2 4.43Å; E320-Y325 WeakPolarHBondContact O-CD2 3.21Å; I321-Y325 CarbonylContact O-C 3.27Å; I321-Y325 WeakPolarHBondContact O-CA 3.45Å; I321-Y325 VanDerWaalsContact O-CB 3.31Å; I321-Y325 WeakPolarHBondContact O-CB 3.39Å; I321-Y325 PolarHBondContact O-N 2.89Å; Y325-I327 VanDerWaalsContact C-N 3.34Å; Y325-I327 PolarHBondContact O-N 2.9Å; Y325-L328 HydrophobicContact CD1-CD2 3.8Å; Y325-L328 HydrophobicContact CE1-CD2 4.09Å; Y325-L328 PolarHBondContact O-N 3.3Å; Y325-L329 VanDerWaalsContact O-CB 3.28Å; Y325-L329 WeakPolarHBondContact O-CB 3.45Å; Y325-L329 WeakPolarHBondContact O-CG 3.38Å; Y325-L329 PolarHBondContact O-N 3.17Å
326	G	60.1	Low	62.2	Low	7 Å²	7	70.5 Å²	70.5	7%	0.072	36%	0.355	C	S	.	.	H	α-helix	trans	-55.1	-50.4	174.4	0	0	0	0	0	111.4	I321 L322 L330	I321-G326 PolarHBondContact O-N 3.34Å; L322-G326 WeakPolarHBondContact O-CA 3.32Å; L322-G326 PolarHBondContact O-N 3.41Å; G326-L330 WeakPolarHBondContact O-CB 3.49Å; G326-L330 VanDerWaalsContact O-CD1 3.27Å; G326-L330 WeakPolarHBondContact O-CD1 3.48Å; G326-L330 WeakPolarHBondContact O-CG 3.43Å; G326-L330 PolarHBondContact O-N 2.91Å
327	I	60.9	Low	60.9	Low	113 Å²	113	71.2 Å²	71.2	58%	0.579	36%	0.363	S	S	*	.	H	α-helix	trans	-68	-43.4	179.7	-59.1	168.5	0	0	0	110.7	Y325 L329 V331 G332	Y325-I327 VanDerWaalsContact C-N 3.34Å; Y325-I327 PolarHBondContact O-N 2.9Å; I327-L329 PolarHBondContact O-N 3.05Å; I327-V331 WeakPolarHBondContact O-CB 3.37Å; I327-V331 PolarHBondContact O-N 2.98Å; I327-G332 PolarHBondContact O-N 3.42Å
328	L	59.6	Low	59.9	Low	7 Å²	7	71.7 Å²	71.7	4%	0.037	37%	0.372	C	S	.	.	H	α-helix	trans	-62.4	-45.3	-178.3	-169.4	77.5	0	0	0	112.8	E301 Y302 Y325 G332 T333 C336	E301-L328 HydrophobicContact CB-CD2 3.74Å; E301-L328 HydrophobicContact CG-CD2 4.34Å; E301-L328 WeakPolarHBondContact OE2-CD1 3.41Å; E301-L328 WeakPolarHBondContact OE2-CD2 3.33Å; Y302-L328 HydrophobicContact CE2-CD2 4.31Å; Y325-L328 HydrophobicContact CD1-CD2 3.8Å; Y325-L328 HydrophobicContact CE1-CD2 4.09Å; Y325-L328 PolarHBondContact O-N 3.3Å; L328-G332 VanDerWaalsContact O-CA 3.28Å; L328-G332 WeakPolarHBondContact O-CA 3.28Å; L328-G332 PolarHBondContact O-N 3.49Å; L328-T333 HydrophobicContact CD1-CG2 3.74Å; L328-T333 VanDerWaalsContact CD1-OG1 3.23Å; L328-T333 WeakPolarHBondContact CD1-OG1 3.27Å; L328-C336 HydrophobicContact CD1-CB 4.18Å
329	L	59.7	Low	59.3	Low	8 Å²	8	65.1 Å²	65.1	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-82.7	-31.8	-174.8	-65.9	172.8	0	0	0	112.8	Y302 Y325 I327 F342 W353 L356	Y302-L329 HydrophobicContact CE1-CD2 4.06Å; Y325-L329 VanDerWaalsContact O-CB 3.28Å; Y325-L329 WeakPolarHBondContact O-CB 3.45Å; Y325-L329 WeakPolarHBondContact O-CG 3.38Å; Y325-L329 PolarHBondContact O-N 3.17Å; I327-L329 PolarHBondContact O-N 3.05Å; L329-F342 HydrophobicContact CB-CD2 3.99Å; L329-F342 HydrophobicContact CD1-CE2 4.44Å; L329-F342 HydrophobicContact CD2-CD2 4.25Å; L329-F342 HydrophobicContact CD2-CE2 4.14Å; L329-W353 HydrophobicContact CB-CZ3 4.26Å; L329-W353 HydrophobicContact CD1-CZ3 4.11Å; L329-L356 HydrophobicContact CD1-CD2 4.48Å
330	L	57.4	Low	58.6	Low	54 Å²	54	59.4 Å²	59.4	28%	0.283	33%	0.333	S	S	.	.	H	α-helix	trans	-89.8	-34	-176.5	-66	162.7	0	0	0	113.5	G326 F342 P344 W353	G326-L330 WeakPolarHBondContact O-CB 3.49Å; G326-L330 VanDerWaalsContact O-CD1 3.27Å; G326-L330 WeakPolarHBondContact O-CD1 3.48Å; G326-L330 WeakPolarHBondContact O-CG 3.43Å; G326-L330 PolarHBondContact O-N 2.91Å; L330-F342 HydrophobicContact CD2-CB 4.23Å; L330-F342 VanDerWaalsContact CD2-O 3.25Å; L330-F342 WeakPolarHBondContact CD2-O 3.32Å; L330-P344 HydrophobicContact CD2-CG 4.49Å; L330-W353 HydrophobicContact CD2-CE3 4.43Å; L330-W353 HydrophobicContact CG-CZ3 4.48Å
331	V	55	Low	58.2	Low	108 Å²	108	57.1 Å²	57.1	66%	0.655	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-29.8	-174	-174.9	0	0	0	0	111.3	I327	I327-V331 WeakPolarHBondContact O-CB 3.37Å; I327-V331 PolarHBondContact O-N 2.98Å
332	G	52.8	Low	57.7	Low	13 Å²	13	57.1 Å²	57.1	13%	0.134	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.8	147.4	-167.3	0	0	0	0	0	110.8	I327 L328 C336	I327-G332 PolarHBondContact O-N 3.42Å; L328-G332 VanDerWaalsContact O-CA 3.28Å; L328-G332 WeakPolarHBondContact O-CA 3.28Å; L328-G332 PolarHBondContact O-N 3.49Å; G332-C336 CarbonylContact C-O 3.13Å; G332-C336 VanDerWaalsContact CA-O 3.26Å; G332-C336 WeakPolarHBondContact CA-O 3.45Å
333	T	49.4	Very low	57.4	Low	49 Å²	49	55.9 Å²	55.9	30%	0.301	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	161.6	170.7	46.1	0	0	0	0	109.7	L328 H335 C336	L328-T333 HydrophobicContact CD1-CG2 3.74Å; L328-T333 VanDerWaalsContact CD1-OG1 3.23Å; L328-T333 WeakPolarHBondContact CD1-OG1 3.27Å; T333-H335 PolarHBondContact O-N 2.98Å; T333-C336 PolarHBondContact N-O 3.35Å; T333-C336 CarbonylContact O-C 3.54Å; T333-C336 WeakPolarHBondContact O-CA 3.46Å; T333-C336 PolarHBondContact O-N 3.33Å; T333-C336 WeakPolarHBondContact OG1-CB 3.14Å
334	D	45.9	Very low	57.1	Low	172 Å²	172	51.9 Å²	51.9	92%	0.92	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.4	179.8	-68.6	-32.1	0	0	0	113.3
335	H	44.5	Very low	56.6	Low	176 Å²	176	54 Å²	54	82%	0.815	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-10.5	176.3	-57.6	-31.7	0	0	0	113.4	T333	T333-H335 PolarHBondContact O-N 2.98Å
336	C	49.9	Very low	56.8	Low	3 Å²	3	56.3 Å²	56.3	2%	0.02	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	86.9	-168.9	-132.1	0	0	0	0	110.1	K268 L328 G332 T333 A338	K268-C336 WeakPolarHBondContact CE-SG 2.94Å; K268-C336 PolarHBondContact NZ-SG 3.1Å; L328-C336 HydrophobicContact CD1-CB 4.18Å; G332-C336 CarbonylContact C-O 3.13Å; G332-C336 VanDerWaalsContact CA-O 3.26Å; G332-C336 WeakPolarHBondContact CA-O 3.45Å; T333-C336 PolarHBondContact N-O 3.35Å; T333-C336 CarbonylContact O-C 3.54Å; T333-C336 WeakPolarHBondContact O-CA 3.46Å; T333-C336 PolarHBondContact O-N 3.33Å; T333-C336 WeakPolarHBondContact OG1-CB 3.14Å; C336-A338 PolarHBondContact O-N 3.47Å
337	P	55.2	Low	57.5	Low	75 Å²	75	61.8 Å²	61.8	49%	0.487	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	140.3	-179.5	22.7	-32.9	0	0	0	111.1	T339	P337-T339 PolarHBondContact O-N 3.46Å
338	A	56.2	Low	58.2	Low	33 Å²	33	60.2 Å²	60.2	27%	0.273	36%	0.355	S	S	.	.			trans	-58.2	133.7	178	0	0	0	0	0	110.4	C336 G340	C336-A338 PolarHBondContact O-N 3.47Å; A338-G340 PolarHBondContact O-N 3.1Å
339	T	58.2	Low	58.8	Low	15 Å²	15	60 Å²	60	9%	0.092	35%	0.354	C	S	.	.			trans	-74.9	-5.2	179.3	42.6	0	0	0	0	113.3	K268 L269 P337 V341	K268-T339 HydrophobicContact CB-CG2 3.52Å; K268-T339 HydrophobicContact CD-CG2 4.37Å; L269-T339 HydrophobicContact CD2-CG2 3.95Å; L269-T339 HydrophobicContact CG-CG2 3.99Å; P337-T339 PolarHBondContact O-N 3.46Å; T339-V341 PolarHBondContact O-N 2.88Å; T339-V341 VanDerWaalsContact O-N 3.13Å
340	G	57.9	Low	59.7	Low	33 Å²	33	66.3 Å²	66.3	34%	0.34	38%	0.377	S	S	.	.	S	Bend	trans	71.4	-4.4	-176	0	0	0	0	0	114.5	A338 F342 D343	A338-G340 PolarHBondContact O-N 3.1Å; G340-F342 VanDerWaalsContact C-N 3.34Å; G340-F342 PolarHBondContact O-N 2.81Å; G340-D343 WeakPolarHBondContact CA-OD2 3.07Å
341	V	59.9	Low	61	Low	9 Å²	9	69.8 Å²	69.8	6%	0.055	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-33.2	-177	179	0	0	0	0	111.4	L269 Y273 L276 T339 G349 H352	L269-V341 HydrophobicContact CD2-CG2 3.33Å; Y273-V341 HydrophobicContact CE1-CG1 4.4Å; Y273-V341 HydrophobicContact CE2-CG1 4.47Å; Y273-V341 HydrophobicContact CE2-CG2 3.95Å; L276-V341 HydrophobicContact CD1-CG1 4.21Å; T339-V341 PolarHBondContact O-N 2.88Å; T339-V341 VanDerWaalsContact O-N 3.13Å; V341-G349 WeakPolarHBondContact O-CA 3.42Å; V341-H352 PolarHBondContact O-CD2 2.84Å; V341-H352 VanDerWaalsContact O-CD2 3.24Å
342	F	58.8	Low	62.3	Low	3 Å²	3	64.8 Å²	64.8	1%	0.013	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	13.2	-178.4	-63.6	-73.8	0	0	0	113.4	L276 L329 L330 G340 P344 H352 W353 L356	L276-F342 HydrophobicContact CD1-CE1 4.37Å; L276-F342 HydrophobicContact CD1-CZ 4.23Å; L276-F342 HydrophobicContact CD2-CE1 4.09Å; L276-F342 HydrophobicContact CD2-CZ 4.37Å; L276-F342 HydrophobicContact CG-CZ 4.36Å; L329-F342 HydrophobicContact CB-CD2 3.99Å; L329-F342 HydrophobicContact CD1-CE2 4.44Å; L329-F342 HydrophobicContact CD2-CD2 4.25Å; L329-F342 HydrophobicContact CD2-CE2 4.14Å; L330-F342 HydrophobicContact CD2-CB 4.23Å; L330-F342 VanDerWaalsContact CD2-O 3.25Å; L330-F342 WeakPolarHBondContact CD2-O 3.32Å; G340-F342 VanDerWaalsContact C-N 3.34Å; G340-F342 PolarHBondContact O-N 2.81Å; F342-P344 WeakPolarHBondContact O-CD 3.46Å; F342-P344 VanDerWaalsContact O-N 3.09Å; F342-H352 HydrophobicContact CD1-CB 3.92Å; F342-H352 HydrophobicContact CE1-CB 3.88Å; F342-W353 HydrophobicContact CB-CE3 4.35Å; F342-W353 AromaticContact CD1-CE3 3.77Å; F342-W353 HydrophobicContact CD1-CE3 3.77Å; F342-W353 HydrophobicContact CD1-CZ3 4.45Å; F342-W353 HydrophobicContact CE1-CE3 4.32Å; F342-W353 HydrophobicContact CG-CE3 4.18Å; F342-L356 HydrophobicContact CE1-CB 4.46Å; F342-L356 HydrophobicContact CE1-CD2 4.29Å; F342-L356 HydrophobicContact CZ-CD2 4.34Å
343	D	62.3	Low	63.6	Low	56 Å²	56	66.4 Å²	66.4	30%	0.299	36%	0.362	S	S	.	.			trans	-56	118.9	-174.6	-78.1	-9.6	0	0	0	111.4	G340 C345 T346	G340-D343 WeakPolarHBondContact CA-OD2 3.07Å; D343-C345 PolarHBondContact O-N 3.18Å; D343-C345 VanDerWaalsContact O-N 3.13Å; D343-T346 PolarHBondContact O-N 3.09Å
344	P	61.5	Low	65.3	Low	67 Å²	67	70.1 Å²	70.1	44%	0.435	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.6	-175.3	24.9	-32.7	0	0	0	112.5	L330 F342 T346 R350	L330-P344 HydrophobicContact CD2-CG 4.49Å; F342-P344 WeakPolarHBondContact O-CD 3.46Å; F342-P344 VanDerWaalsContact O-N 3.09Å; P344-T346 VanDerWaalsContact C-N 3.28Å; P344-R350 PolarHBondContact O-NE 3.07Å; P344-R350 PolarHBondContact O-NH2 3.38Å
345	C	59.7	Low	67.3	Low	115 Å²	115	63.2 Å²	63.2	78%	0.777	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-26	175.4	-62.2	0	0	0	0	112.5	D343	D343-C345 PolarHBondContact O-N 3.18Å; D343-C345 VanDerWaalsContact O-N 3.13Å
346	T	67.8	Low	69.3	Low	66 Å²	66	55.1 Å²	55.1	41%	0.405	30%	0.303	S	S	.	.	S	Bend	trans	-97.7	131.9	-176.9	-50.4	0	0	0	0	109.6	D343 P344 L348 G349 R350	D343-T346 PolarHBondContact O-N 3.09Å; P344-T346 VanDerWaalsContact C-N 3.28Å; T346-L348 HydrophobicContact CG2-CB 4.11Å; T346-L348 PolarHBondContact O-N 2.99Å; T346-L348 VanDerWaalsContact O-N 3.12Å; T346-G349 PolarHBondContact O-N 2.83Å; T346-R350 PolarHBondContact O-N 3.29Å
347	N	74.4	Confident	71.1	Confident	123 Å²	123	59.3 Å²	59.3	66%	0.658	32%	0.32	S	S	*	.	H	α-helix	trans	-55.2	-33.3	177.4	-70	-28.5	0	0	0	112.5	K351	N347-K351 WeakPolarHBondContact O-CG 2.99Å; N347-K351 PolarHBondContact O-N 3.15Å
348	L	75	Confident	72.7	Confident	79 Å²	79	58.3 Å²	58.3	41%	0.414	31%	0.313	S	S	.	.	H	α-helix	trans	-67.5	-41.5	174.8	-66	170.9	0	0	0	112	H235 T346 R350 K351 H352	H235-L348 WeakPolarHBondContact NE2-CD1 3.42Å; H235-L348 WeakPolarHBondContact NE2-CD2 3.36Å; T346-L348 HydrophobicContact CG2-CB 4.11Å; T346-L348 PolarHBondContact O-N 2.99Å; T346-L348 VanDerWaalsContact O-N 3.12Å; L348-R350 VanDerWaalsContact C-N 3.35Å; L348-R350 PolarHBondContact O-N 2.89Å; L348-K351 WeakPolarHBondContact O-CB 3.5Å; L348-K351 PolarHBondContact O-N 2.74Å; L348-K351 VanDerWaalsContact O-N 3.16Å; L348-H352 PolarHBondContact O-CD2 2.96Å; L348-H352 PolarHBondContact O-N 3.08Å
349	G	73.7	Confident	74.1	Confident	2 Å²	2	58.9 Å²	58.9	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-39.9	178.7	0	0	0	0	0	112.8	V341 T346 H352 W353	V341-G349 WeakPolarHBondContact O-CA 3.42Å; T346-G349 PolarHBondContact O-N 2.83Å; G349-H352 PolarHBondContact O-N 3.43Å; G349-W353 PolarHBondContact O-N 3.32Å
350	R	77.8	Confident	75.5	Confident	141 Å²	141	58.3 Å²	58.3	53%	0.532	31%	0.305	S	S	.	.	H	α-helix	trans	-63.2	-44.6	172.5	-64.1	-171.5	-153.1	169.8	8.9	112.3	P344 T346 L348 H352 W353 E354	P344-R350 PolarHBondContact O-NE 3.07Å; P344-R350 PolarHBondContact O-NH2 3.38Å; T346-R350 PolarHBondContact O-N 3.29Å; L348-R350 VanDerWaalsContact C-N 3.35Å; L348-R350 PolarHBondContact O-N 2.89Å; R350-H352 VanDerWaalsContact C-N 3.29Å; R350-H352 PolarHBondContact O-N 3.19Å; R350-W353 PolarHBondContact O-N 2.96Å; R350-E354 WeakPolarHBondContact O-CG 3.5Å; R350-E354 PolarHBondContact O-N 3.39Å
351	K	84.1	Confident	77	Confident	127 Å²	127	56.9 Å²	56.9	55%	0.552	29%	0.29	S	S	*	.	H	α-helix	trans	-60.5	-40.5	174.9	-74.8	-176.2	176.3	-172.2	0	111.7	N347 L348 W353 E354 T355	N347-K351 WeakPolarHBondContact O-CG 2.99Å; N347-K351 PolarHBondContact O-N 3.15Å; L348-K351 WeakPolarHBondContact O-CB 3.5Å; L348-K351 PolarHBondContact O-N 2.74Å; L348-K351 VanDerWaalsContact O-N 3.16Å; K351-W353 VanDerWaalsContact C-N 3.34Å; K351-E354 PolarHBondContact O-N 3.3Å; K351-T355 VanDerWaalsContact O-CB 3.3Å; K351-T355 WeakPolarHBondContact O-CB 3.47Å; K351-T355 PolarHBondContact O-N 3.45Å; K351-T355 PolarHBondContact O-OG1 3.02Å
352	H	82.3	Confident	78.3	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.019	29%	0.29	C	S	.	.	H	α-helix	trans	-64.8	-40.3	176.3	-65.1	-32.3	0	0	0	111.3	H235 Y240 L276 V341 F342 L348 G349 R350 T355 L356	H235-H352 AromaticContact CE1-CE1 3.75Å; H235-H352 AromaticContact CE1-NE2 3.56Å; Y240-H352 AromaticContact CE1-CE1 3.5Å; Y240-H352 AromaticContact CE1-ND1 3.73Å; Y240-H352 AromaticContact CZ-CE1 3.91Å; Y240-H352 AromaticContact CZ-ND1 3.85Å; Y240-H352 PolarHBondContact OH-CE1 2.94Å; Y240-H352 PolarHBondContact OH-ND1 2.73Å; L276-H352 HydrophobicContact CD1-CB 4.03Å; L276-H352 HydrophobicContact CD2-CB 4.09Å; L276-H352 WeakPolarHBondContact CD2-O 3.41Å; V341-H352 PolarHBondContact O-CD2 2.84Å; V341-H352 VanDerWaalsContact O-CD2 3.24Å; F342-H352 HydrophobicContact CD1-CB 3.92Å; F342-H352 HydrophobicContact CE1-CB 3.88Å; L348-H352 PolarHBondContact O-CD2 2.96Å; L348-H352 PolarHBondContact O-N 3.08Å; G349-H352 PolarHBondContact O-N 3.43Å; R350-H352 VanDerWaalsContact C-N 3.29Å; R350-H352 PolarHBondContact O-N 3.19Å; H352-T355 PolarHBondContact O-N 3.07Å; H352-L356 WeakPolarHBondContact O-CB 3.4Å; H352-L356 PolarHBondContact O-N 3.4Å
353	W	81.6	Confident	79.7	Confident	47 Å²	47	58 Å²	58	18%	0.178	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-44.9	176.2	-166.1	-104.8	0	0	0	112.9	W317 L322 L329 L330 F342 G349 R350 K351 T355 L356 K357	W317-W353 HydrophobicContact CH2-CZ2 4.15Å; W317-W353 AromaticContact CZ2-CE2 3.9Å; W317-W353 AromaticContact CZ2-CZ2 3.91Å; W317-W353 HydrophobicContact CZ2-CZ2 3.91Å; W317-W353 AromaticContact CZ2-NE1 3.84Å; L322-W353 HydrophobicContact CD1-CZ2 4.08Å; L329-W353 HydrophobicContact CB-CZ3 4.26Å; L329-W353 HydrophobicContact CD1-CZ3 4.11Å; L330-W353 HydrophobicContact CD2-CE3 4.43Å; L330-W353 HydrophobicContact CG-CZ3 4.48Å; F342-W353 HydrophobicContact CB-CE3 4.35Å; F342-W353 AromaticContact CD1-CE3 3.77Å; F342-W353 HydrophobicContact CD1-CE3 3.77Å; F342-W353 HydrophobicContact CD1-CZ3 4.45Å; F342-W353 HydrophobicContact CE1-CE3 4.32Å; F342-W353 HydrophobicContact CG-CE3 4.18Å; G349-W353 PolarHBondContact O-N 3.32Å; R350-W353 PolarHBondContact O-N 2.96Å; K351-W353 VanDerWaalsContact C-N 3.34Å; W353-T355 VanDerWaalsContact C-N 3.34Å; W353-L356 HydrophobicContact CE3-CD2 4.33Å; W353-L356 HydrophobicContact CZ3-CD2 4.11Å; W353-L356 PolarHBondContact O-N 3.36Å; W353-K357 PolarHBondContact O-N 3.25Å; W353-K357 VanDerWaalsContact O-N 3.12Å
354	E	85.3	Confident	81	Confident	127 Å²	127	55.5 Å²	55.5	59%	0.593	28%	0.281	S	S	*	.	H	α-helix	trans	-61.6	-43.9	173.8	-72.1	172.4	179.1	0	0	111.2	R350 K351 L356 K357 T358	R350-E354 WeakPolarHBondContact O-CG 3.5Å; R350-E354 PolarHBondContact O-N 3.39Å; K351-E354 PolarHBondContact O-N 3.3Å; E354-L356 VanDerWaalsContact C-N 3.3Å; E354-L356 PolarHBondContact O-N 3.38Å; E354-K357 WeakPolarHBondContact O-CB 3.28Å; E354-K357 PolarHBondContact O-N 2.94Å; E354-K357 VanDerWaalsContact O-N 3.16Å; E354-T358 PolarHBondContact O-N 3.05Å; E354-T358 PolarHBondContact O-OG1 3.17Å
355	T	87.3	Confident	82.3	Confident	27 Å²	27	52.3 Å²	52.3	17%	0.166	26%	0.26	C	S	.	.	H	α-helix	trans	-59.7	-43	176.8	-56.9	0	0	0	0	110.7	Y240 L276 K351 H352 W353 K357 T358 R359	Y240-T355 HydrophobicContact CE2-CG2 4.18Å; L276-T355 HydrophobicContact CD2-CG2 4.07Å; K351-T355 VanDerWaalsContact O-CB 3.3Å; K351-T355 WeakPolarHBondContact O-CB 3.47Å; K351-T355 PolarHBondContact O-N 3.45Å; K351-T355 PolarHBondContact O-OG1 3.02Å; H352-T355 PolarHBondContact O-N 3.07Å; W353-T355 VanDerWaalsContact C-N 3.34Å; T355-K357 VanDerWaalsContact C-N 3.32Å; T355-K357 PolarHBondContact O-N 3.16Å; T355-T358 WeakPolarHBondContact O-CB 3.42Å; T355-T358 PolarHBondContact O-N 3.22Å; T355-R359 HydrophobicContact CG2-CG 4.31Å; T355-R359 VanDerWaalsContact O-CG 3.32Å; T355-R359 WeakPolarHBondContact O-CG 3.22Å; T355-R359 PolarHBondContact O-N 3.01Å
356	L	86.6	Confident	83.6	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-42.4	177.7	-173.1	68.1	0	0	0	111.3	L275 L276 F309 W317 L329 F342 H352 W353 E354 R359 T360	L275-L356 HydrophobicContact CB-CD1 4.16Å; L276-L356 HydrophobicContact CD2-CB 4.13Å; F309-L356 HydrophobicContact CZ-CD1 4.45Å; W317-L356 HydrophobicContact CH2-CB 4.34Å; W317-L356 HydrophobicContact CH2-CD2 4.19Å; W317-L356 HydrophobicContact CH2-CG 4.19Å; W317-L356 HydrophobicContact CZ3-CD2 4.33Å; W317-L356 HydrophobicContact CZ3-CG 4.06Å; L329-L356 HydrophobicContact CD1-CD2 4.48Å; F342-L356 HydrophobicContact CE1-CB 4.46Å; F342-L356 HydrophobicContact CE1-CD2 4.29Å; F342-L356 HydrophobicContact CZ-CD2 4.34Å; H352-L356 WeakPolarHBondContact O-CB 3.4Å; H352-L356 PolarHBondContact O-N 3.4Å; W353-L356 HydrophobicContact CE3-CD2 4.33Å; W353-L356 HydrophobicContact CZ3-CD2 4.11Å; W353-L356 PolarHBondContact O-N 3.36Å; E354-L356 VanDerWaalsContact C-N 3.3Å; E354-L356 PolarHBondContact O-N 3.38Å; L356-R359 PolarHBondContact O-N 2.7Å; L356-T360 WeakPolarHBondContact O-CG2 3.31Å; L356-T360 PolarHBondContact O-N 3.05Å; L356-T360 PolarHBondContact O-OG1 3.04Å
357	K	86.6	Confident	84.6	Confident	91 Å²	91	45.9 Å²	45.9	40%	0.396	22%	0.216	S	C	.	.	H	α-helix	trans	-59.8	-46.3	174.4	-172.4	-174.6	176.7	-167.8	0	111.4	W317 W353 E354 T355 R359 T360 A361	W317-K357 HydrophobicContact CD2-CB 4.4Å; W317-K357 HydrophobicContact CD2-CG 4.03Å; W317-K357 HydrophobicContact CE3-CB 4.36Å; W317-K357 HydrophobicContact CE3-CG 4.34Å; W317-K357 HydrophobicContact CG-CG 4.49Å; W317-K357 HydrophobicContact CH2-CB 3.76Å; W317-K357 HydrophobicContact CH2-CG 4.42Å; W317-K357 HydrophobicContact CZ2-CB 3.79Å; W317-K357 HydrophobicContact CZ2-CG 4.11Å; W317-K357 VanDerWaalsContact CZ3-CA 3.49Å; W317-K357 HydrophobicContact CZ3-CB 4.05Å; W353-K357 PolarHBondContact O-N 3.25Å; W353-K357 VanDerWaalsContact O-N 3.12Å; E354-K357 WeakPolarHBondContact O-CB 3.28Å; E354-K357 PolarHBondContact O-N 2.94Å; E354-K357 VanDerWaalsContact O-N 3.16Å; T355-K357 VanDerWaalsContact C-N 3.32Å; T355-K357 PolarHBondContact O-N 3.16Å; K357-R359 PolarHBondContact O-N 2.67Å; K357-T360 PolarHBondContact O-N 3.21Å; K357-T360 PolarHBondContact O-OG1 3.2Å; K357-A361 PolarHBondContact O-N 3.28Å; K357-A361 VanDerWaalsContact O-N 3.14Å
358	T	88.7	Confident	85.3	Confident	55 Å²	55	40.1 Å²	40.1	34%	0.337	19%	0.185	S	C	.	.	H	α-helix	trans	-59.3	-45.4	175	-53.7	0	0	0	0	111.2	E354 T355 T360 A361 E362 M394	E354-T358 PolarHBondContact O-N 3.05Å; E354-T358 PolarHBondContact O-OG1 3.17Å; T355-T358 WeakPolarHBondContact O-CB 3.42Å; T355-T358 PolarHBondContact O-N 3.22Å; T358-T360 VanDerWaalsContact C-N 3.34Å; T358-T360 PolarHBondContact O-N 2.95Å; T358-A361 WeakPolarHBondContact O-CB 3.3Å; T358-A361 PolarHBondContact O-N 3.16Å; T358-A361 VanDerWaalsContact O-N 3.15Å; T358-E362 WeakPolarHBondContact O-CG 3.49Å; T358-E362 PolarHBondContact O-N 3.44Å; T358-M394 HydrophobicContact CG2-SD 3.83Å
359	R	87.4	Confident	86	Confident	44 Å²	44	37.7 Å²	37.7	17%	0.166	18%	0.176	C	C	.	.	H	α-helix	trans	-62.7	-36.3	178.8	-65	-43.3	177.2	-160.8	-10.1	113.4	L276 A278 T355 L356 K357 A361 E362 H363	L276-R359 PolarHBondContact O-NE 3.46Å; A278-R359 VanDerWaalsContact CA-CZ 3.43Å; T355-R359 HydrophobicContact CG2-CG 4.31Å; T355-R359 VanDerWaalsContact O-CG 3.32Å; T355-R359 WeakPolarHBondContact O-CG 3.22Å; T355-R359 PolarHBondContact O-N 3.01Å; L356-R359 PolarHBondContact O-N 2.7Å; K357-R359 PolarHBondContact O-N 2.67Å; R359-A361 VanDerWaalsContact C-N 3.32Å; R359-E362 WeakPolarHBondContact CD-OE2 3.33Å; R359-E362 IonicContact CZ-OE1 2.73Å; R359-E362 IonicContact CZ-OE2 3.76Å; R359-E362 IonicContact NE-OE2 2.86Å; R359-E362 IonicContact NH1-OE1 3.92Å; R359-E362 PolarHBondContact NH1-OE1 3.44Å; R359-E362 IonicContact NH1-OE2 2.86Å; R359-E362 PolarHBondContact NH1-OE2 3.45Å; R359-H363 PolarHBondContact O-N 2.9Å
360	T	87.6	Confident	86.6	Confident	4 Å²	4	41.2 Å²	41.2	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-67.2	-38	175.9	52.4	0	0	0	0	112	F309 W317 I321 L356 K357 T358 H363 N364	F309-T360 HydrophobicContact CE1-CG2 3.75Å; F309-T360 HydrophobicContact CZ-CG2 3.42Å; F309-T360 VanDerWaalsContact CZ-CG2 3.42Å; W317-T360 HydrophobicContact CE3-CG2 3.8Å; W317-T360 HydrophobicContact CZ3-CG2 3.82Å; I321-T360 HydrophobicContact CD1-CG2 3.24Å; L356-T360 WeakPolarHBondContact O-CG2 3.31Å; L356-T360 PolarHBondContact O-N 3.05Å; L356-T360 PolarHBondContact O-OG1 3.04Å; K357-T360 PolarHBondContact O-N 3.21Å; K357-T360 PolarHBondContact O-OG1 3.2Å; T358-T360 VanDerWaalsContact C-N 3.34Å; T358-T360 PolarHBondContact O-N 2.95Å; T360-H363 PolarHBondContact O-N 3.2Å; T360-N364 PolarHBondContact O-N 3.28Å; T360-N364 PolarHBondContact O-OD1 3.43Å
361	A	88.2	Confident	87.1	Confident	2 Å²	2	41.8 Å²	41.8	2%	0.017	21%	0.209	C	C	.	.	H	α-helix	trans	-69.4	-41	177.4	0	0	0	0	0	111.7	K357 T358 R359 H363 N364 I365 I384 I386 M394	K357-A361 PolarHBondContact O-N 3.28Å; K357-A361 VanDerWaalsContact O-N 3.14Å; T358-A361 WeakPolarHBondContact O-CB 3.3Å; T358-A361 PolarHBondContact O-N 3.16Å; T358-A361 VanDerWaalsContact O-N 3.15Å; R359-A361 VanDerWaalsContact C-N 3.32Å; A361-H363 VanDerWaalsContact C-N 3.34Å; A361-H363 PolarHBondContact O-N 2.89Å; A361-N364 PolarHBondContact O-N 3.31Å; A361-I365 VanDerWaalsContact O-CG1 3.31Å; A361-I365 WeakPolarHBondContact O-CG1 3.06Å; A361-I365 PolarHBondContact O-N 3.27Å; A361-I384 HydrophobicContact CB-CG2 3.44Å; A361-I384 VanDerWaalsContact CB-CG2 3.44Å; A361-I386 HydrophobicContact CB-CD1 3.76Å; A361-M394 HydrophobicContact CB-CE 3.23Å; A361-M394 HydrophobicContact CB-SD 4.07Å
362	E	88.3	Confident	87.3	Confident	15 Å²	15	40.8 Å²	40.8	7%	0.07	20%	0.202	C	C	.	.	H	α-helix	trans	-58.1	-44.5	171.5	-70.4	170.8	178.6	0	0	111.9	T358 R359 N364 I365 L366 M394 M398	T358-E362 WeakPolarHBondContact O-CG 3.49Å; T358-E362 PolarHBondContact O-N 3.44Å; R359-E362 WeakPolarHBondContact CD-OE2 3.33Å; R359-E362 IonicContact CZ-OE1 2.73Å; R359-E362 IonicContact CZ-OE2 3.76Å; R359-E362 IonicContact NE-OE2 2.86Å; R359-E362 IonicContact NH1-OE1 3.92Å; R359-E362 PolarHBondContact NH1-OE1 3.44Å; R359-E362 IonicContact NH1-OE2 2.86Å; R359-E362 PolarHBondContact NH1-OE2 3.45Å; E362-N364 PolarHBondContact O-N 2.93Å; E362-I365 PolarHBondContact O-N 2.69Å; E362-L366 WeakPolarHBondContact O-CG 3.33Å; E362-L366 PolarHBondContact O-N 3.25Å; E362-M394 HydrophobicContact CG-SD 4.39Å; E362-M398 HydrophobicContact CB-CE 3.79Å; E362-M398 HydrophobicContact CB-SD 4.01Å; E362-M398 HydrophobicContact CG-CE 4.08Å; E362-M398 HydrophobicContact CG-CG 4.22Å; E362-M398 HydrophobicContact CG-SD 3.8Å
363	H	87.8	Confident	87.6	Confident	21 Å²	21	44.1 Å²	44.1	10%	0.097	23%	0.226	C	C	.	.	H	α-helix	trans	-60.3	-43.9	176	178.8	80.7	0	0	0	112.2	F309 Q311 L313 R359 T360 A361 I365 L366 T367	F309-H363 HydrophobicContact CD1-CB 4.39Å; F309-H363 PolarHBondContact O-CE1 3.31Å; Q311-H363 PolarHBondContact O-CE1 3.41Å; Q311-H363 PolarHBondContact O-NE2 3.36Å; L313-H363 PolarHBondContact O-NE2 3.06Å; R359-H363 PolarHBondContact O-N 2.9Å; T360-H363 PolarHBondContact O-N 3.2Å; A361-H363 VanDerWaalsContact C-N 3.34Å; A361-H363 PolarHBondContact O-N 2.89Å; H363-I365 PolarHBondContact O-N 2.93Å; H363-L366 PolarHBondContact O-N 3.39Å; H363-T367 WeakPolarHBondContact O-CB 3.4Å; H363-T367 PolarHBondContact O-N 3.4Å; H363-T367 PolarHBondContact O-OG1 2.97Å
364	N	89.8	Confident	87.9	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-43.6	176.2	-72.2	-4.3	0	0	0	111.2	L314 I315 T360 A361 E362 L366 T367 I368 I384	L314-N364 HydrophobicContact CD2-CB 4.02Å; I315-N364 PolarHBondContact N-OD1 3.36Å; I315-N364 PolarHBondContact O-ND2 3.14Å; T360-N364 PolarHBondContact O-N 3.28Å; T360-N364 PolarHBondContact O-OD1 3.43Å; A361-N364 PolarHBondContact O-N 3.31Å; E362-N364 PolarHBondContact O-N 2.93Å; N364-L366 PolarHBondContact O-N 3.07Å; N364-T367 PolarHBondContact O-N 3.4Å; N364-I368 WeakPolarHBondContact O-CG1 3.46Å; N364-I368 PolarHBondContact O-N 3.49Å; N364-I384 HydrophobicContact CB-CG1 4.41Å
365	I	88.9	Confident	88.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-45	177	-67.5	165.8	0	0	0	111	A361 E362 H363 T367 I368 A369 I384 M394 L395 M398 L404	A361-I365 VanDerWaalsContact O-CG1 3.31Å; A361-I365 WeakPolarHBondContact O-CG1 3.06Å; A361-I365 PolarHBondContact O-N 3.27Å; E362-I365 PolarHBondContact O-N 2.69Å; H363-I365 PolarHBondContact O-N 2.93Å; I365-T367 VanDerWaalsContact C-N 3.31Å; I365-T367 PolarHBondContact O-N 3.31Å; I365-I368 PolarHBondContact O-N 2.68Å; I365-A369 WeakPolarHBondContact O-CB 3.34Å; I365-A369 PolarHBondContact O-N 3.15Å; I365-I384 HydrophobicContact CD1-CD1 3.91Å; I365-I384 HydrophobicContact CG1-CD1 3.41Å; I365-I384 VanDerWaalsContact CG1-CD1 3.41Å; I365-I384 HydrophobicContact CG1-CG1 4.28Å; I365-M394 HydrophobicContact CD1-CE 3.98Å; I365-M394 HydrophobicContact CD1-CG 4.19Å; I365-L395 HydrophobicContact CD1-CD2 4.41Å; I365-L395 HydrophobicContact CG2-CD2 3.59Å; I365-M398 HydrophobicContact CB-CE 4.46Å; I365-M398 HydrophobicContact CB-SD 4.02Å; I365-M398 HydrophobicContact CD1-SD 3.73Å; I365-M398 HydrophobicContact CG1-SD 4.49Å; I365-M398 HydrophobicContact CG2-CE 4.42Å; I365-M398 HydrophobicContact CG2-SD 3.97Å; I365-L404 HydrophobicContact CG2-CD1 3.48Å; I365-L404 VanDerWaalsContact CG2-CD1 3.48Å; I365-L404 HydrophobicContact CG2-CD2 4.24Å; I365-L404 HydrophobicContact CG2-CG 4.44Å
366	L	87.1	Confident	88.5	Confident	36 Å²	36	41.9 Å²	41.9	19%	0.188	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-39.5	177.7	-72.5	167.6	0	0	0	112.1	S279 E362 H363 N364 A369 A370 M398 L404	S279-L366 WeakPolarHBondContact OG-CD1 3.41Å; E362-L366 WeakPolarHBondContact O-CG 3.33Å; E362-L366 PolarHBondContact O-N 3.25Å; H363-L366 PolarHBondContact O-N 3.39Å; N364-L366 PolarHBondContact O-N 3.07Å; L366-A369 PolarHBondContact O-N 3.43Å; L366-A370 PolarHBondContact O-N 3Å; L366-A370 VanDerWaalsContact O-N 3.1Å; L366-M398 HydrophobicContact CD1-CE 4.15Å; L366-M398 HydrophobicContact CD2-CE 4.09Å; L366-M398 HydrophobicContact CG-CE 3.75Å; L366-L404 HydrophobicContact CD2-CD2 3.72Å; L366-L404 HydrophobicContact CD2-CG 4.15Å
367	T	88.1	Confident	88.5	Confident	10 Å²	10	42 Å²	42	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-46.1	176.1	-57.1	0	0	0	0	110.3	P312 H363 N364 I365 A369 A370 Y371	P312-T367 VanDerWaalsContact C-CG2 3.41Å; P312-T367 VanDerWaalsContact O-CG2 3.24Å; P312-T367 WeakPolarHBondContact O-CG2 3.49Å; H363-T367 WeakPolarHBondContact O-CB 3.4Å; H363-T367 PolarHBondContact O-N 3.4Å; H363-T367 PolarHBondContact O-OG1 2.97Å; N364-T367 PolarHBondContact O-N 3.4Å; I365-T367 VanDerWaalsContact C-N 3.31Å; I365-T367 PolarHBondContact O-N 3.31Å; T367-A369 VanDerWaalsContact C-N 3.33Å; T367-A369 PolarHBondContact O-N 3.47Å; T367-A370 WeakPolarHBondContact O-CB 3.45Å; T367-A370 PolarHBondContact O-N 3.36Å; T367-A370 VanDerWaalsContact O-N 3.17Å; T367-Y371 HydrophobicContact CG2-CD2 3.98Å; T367-Y371 HydrophobicContact CG2-CE2 3.81Å; T367-Y371 WeakPolarHBondContact O-CD2 3.24Å; T367-Y371 PolarHBondContact O-N 3.49Å
368	I	90	Very high	88.7	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-60.9	-43.4	176	-67.4	167.6	0	0	0	110.6	L314 N364 I365 A370 Y371 Y372 I375 L380 L383 F418	L314-I368 HydrophobicContact CD2-CD1 3.86Å; L314-I368 HydrophobicContact CD2-CG1 3.68Å; N364-I368 WeakPolarHBondContact O-CG1 3.46Å; N364-I368 PolarHBondContact O-N 3.49Å; I365-I368 PolarHBondContact O-N 2.68Å; I368-A370 PolarHBondContact O-N 2.98Å; I368-Y371 PolarHBondContact O-N 3.12Å; I368-Y372 HydrophobicContact CB-CD2 4.32Å; I368-Y372 HydrophobicContact CG2-CD2 3.73Å; I368-Y372 HydrophobicContact CG2-CE2 4.47Å; I368-Y372 HydrophobicContact CG2-CG 4.11Å; I368-Y372 WeakPolarHBondContact O-CB 3.31Å; I368-Y372 WeakPolarHBondContact O-CD2 3.34Å; I368-Y372 PolarHBondContact O-N 3.05Å; I368-I375 HydrophobicContact CG2-CD1 3.91Å; I368-L380 HydrophobicContact CD1-CD1 3.47Å; I368-L380 VanDerWaalsContact CD1-CD1 3.47Å; I368-L380 HydrophobicContact CG2-CD1 4.17Å; I368-L383 HydrophobicContact CD1-CB 4.09Å; I368-L383 HydrophobicContact CD1-CD1 3.85Å; I368-L383 HydrophobicContact CG1-CD1 4.45Å; I368-F418 HydrophobicContact CG2-CE2 3.75Å; I368-F418 HydrophobicContact CG2-CZ 4.11Å
369	A	88.2	Confident	88.8	Confident	27 Å²	27	46 Å²	46	22%	0.223	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-28.9	178.8	0	0	0	0	0	113.1	I365 L366 T367 L404 F418	I365-A369 WeakPolarHBondContact O-CB 3.34Å; I365-A369 PolarHBondContact O-N 3.15Å; L366-A369 PolarHBondContact O-N 3.43Å; T367-A369 VanDerWaalsContact C-N 3.33Å; T367-A369 PolarHBondContact O-N 3.47Å; A369-L404 HydrophobicContact CB-CD2 3.63Å; A369-F418 HydrophobicContact CB-CB 4.27Å; A369-F418 HydrophobicContact CB-CD1 3.52Å; A369-F418 HydrophobicContact CB-CE1 3.9Å; A369-F418 HydrophobicContact CB-CG 3.87Å
370	A	86.8	Confident	88.9	Confident	77 Å²	77	43.9 Å²	43.9	64%	0.636	23%	0.229	S	C	*	.	H	α-helix	trans	-73.7	-35.2	176.8	0	0	0	0	0	113	L366 T367 I368	L366-A370 PolarHBondContact O-N 3Å; L366-A370 VanDerWaalsContact O-N 3.1Å; T367-A370 WeakPolarHBondContact O-CB 3.45Å; T367-A370 PolarHBondContact O-N 3.36Å; T367-A370 VanDerWaalsContact O-N 3.17Å; I368-A370 PolarHBondContact O-N 2.98Å
371	Y	88.4	Confident	89	Confident	152 Å²	152	44 Å²	44	60%	0.596	23%	0.231	S	C	*	.	H	α-helix	trans	-100.8	-30.1	-174.5	-65.2	-69.8	0	0	0	114.4	P312 T367 I368	P312-Y371 HydrophobicContact CB-CE2 4.12Å; P312-Y371 VanDerWaalsContact CG-OH 3.28Å; P312-Y371 WeakPolarHBondContact CG-OH 3.49Å; P312-Y371 WeakPolarHBondContact O-CE2 3.31Å; T367-Y371 HydrophobicContact CG2-CD2 3.98Å; T367-Y371 HydrophobicContact CG2-CE2 3.81Å; T367-Y371 WeakPolarHBondContact O-CD2 3.24Å; T367-Y371 PolarHBondContact O-N 3.49Å; I368-Y371 PolarHBondContact O-N 3.12Å
372	Y	89.3	Confident	89.1	Confident	107 Å²	107	49.7 Å²	49.7	42%	0.42	26%	0.257	S	S	.	.			trans	-102.5	131.7	-175.1	-69.4	-96.3	0	0	0	111.4	I368 F418	I368-Y372 HydrophobicContact CB-CD2 4.32Å; I368-Y372 HydrophobicContact CG2-CD2 3.73Å; I368-Y372 HydrophobicContact CG2-CE2 4.47Å; I368-Y372 HydrophobicContact CG2-CG 4.11Å; I368-Y372 WeakPolarHBondContact O-CB 3.31Å; I368-Y372 WeakPolarHBondContact O-CD2 3.34Å; I368-Y372 PolarHBondContact O-N 3.05Å; Y372-F418 WeakPolarHBondContact O-CD2 3.29Å
373	S	86.7	Confident	89.1	Confident	73 Å²	73	50.2 Å²	50.2	51%	0.51	26%	0.26	S	S	.	.	S	Bend	trans	-78	-41.8	170.6	56.2	0	0	0	0	111.9	F418	S373-F418 PolarHBondContact O-N 3.48Å
374	Q	89	Confident	89	Confident	89 Å²	89	49.5 Å²	49.5	42%	0.416	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	140.4	179	-175.7	174.1	-21.2	0	0	110	Y415 V416 K417	Q374-Y415 HydrophobicContact CG-CD2 3.96Å; Q374-Y415 HydrophobicContact CG-CG 4.26Å; Q374-V416 VanDerWaalsContact CA-O 3.25Å; Q374-V416 WeakPolarHBondContact CA-O 3.49Å; Q374-K417 HydrophobicContact CB-CG 4.29Å; Q374-K417 HydrophobicContact CG-CG 4.01Å
375	I	91.9	Very high	88.7	Confident	12 Å²	12	51.9 Å²	51.9	6%	0.062	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	149.4	177	-163	168.6	0	0	0	110.6	I368 R379 L380 L383 Y415 V416 F418	I368-I375 HydrophobicContact CG2-CD1 3.91Å; I375-R379 HydrophobicContact CD1-CG 4.34Å; I375-R379 HydrophobicContact CG1-CB 4.34Å; I375-R379 HydrophobicContact CG1-CG 4.44Å; I375-L380 HydrophobicContact CD1-CB 4.41Å; I375-L380 HydrophobicContact CD1-CD1 4.47Å; I375-L380 HydrophobicContact CG2-CB 4.28Å; I375-L380 HydrophobicContact CG2-CD1 4.5Å; I375-L383 HydrophobicContact CD1-CD1 3.98Å; I375-Y415 CarbonylContact O-C 3.55Å; I375-Y415 VanDerWaalsContact O-CA 3.26Å; I375-Y415 WeakPolarHBondContact O-CA 3.27Å; I375-Y415 WeakPolarHBondContact O-CB 3.37Å; I375-V416 HydrophobicContact CG2-CB 4.21Å; I375-V416 PolarHBondContact N-O 3.49Å; I375-V416 PolarHBondContact O-N 3.46Å; I375-F418 HydrophobicContact CB-CE2 4.46Å; I375-F418 HydrophobicContact CG2-CE2 3.57Å; I375-F418 HydrophobicContact CG2-CZ 4.15Å
376	S	92.3	Very high	88.6	Confident	54 Å²	54	53.4 Å²	53.4	38%	0.378	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	147.6	169.6	61.8	0	0	0	0	111.1	D378 R379 L380 G414	S376-D378 VanDerWaalsContact C-N 3.33Å; S376-D378 PolarHBondContact O-N 3.36Å; S376-R379 PolarHBondContact O-N 3.47Å; S376-R379 VanDerWaalsContact OG-CB 3.23Å; S376-R379 WeakPolarHBondContact OG-CB 3.49Å; S376-R379 PolarHBondContact OG-N 3.41Å; S376-L380 WeakPolarHBondContact O-CB 3.44Å; S376-L380 PolarHBondContact O-N 3.47Å; S376-G414 CarbonylContact C-O 3.59Å; S376-G414 WeakPolarHBondContact CA-O 3.41Å
377	M	88.1	Confident	88.7	Confident	6 Å²	6	55.8 Å²	55.8	3%	0.03	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-39.4	179.1	-80.9	-59.2	-56.9	0	0	112.2	R379 L380 A381 A391 E392 L395 G414 V416	M377-R379 VanDerWaalsContact C-N 3.33Å; M377-R379 PolarHBondContact O-N 3.24Å; M377-L380 WeakPolarHBondContact O-CB 3.44Å; M377-L380 PolarHBondContact O-N 3.03Å; M377-L380 HydrophobicContact SD-CD2 4.15Å; M377-A381 WeakPolarHBondContact O-CB 3.26Å; M377-A381 PolarHBondContact O-N 3.11Å; M377-A391 HydrophobicContact CE-CB 4.28Å; M377-E392 HydrophobicContact CE-CB 4.28Å; M377-E392 HydrophobicContact CE-CG 3.27Å; M377-E392 HydrophobicContact SD-CG 4.36Å; M377-L395 HydrophobicContact CE-CD1 4.3Å; M377-L395 HydrophobicContact SD-CD1 3.97Å; M377-G414 PolarHBondContact N-O 3.06Å; M377-V416 HydrophobicContact CG-CG2 4.09Å; M377-V416 HydrophobicContact SD-CG2 3.2Å; M377-V416 WeakPolarHBondContact SD-CG2 3.22Å
378	D	90.2	Very high	88.6	Confident	119 Å²	119	58.1 Å²	58.1	64%	0.636	31%	0.305	S	S	*	.	H	α-helix	trans	-62.7	-42.1	178.4	-58.3	-35.6	0	0	0	111.6	S376 A381 E382	S376-D378 VanDerWaalsContact C-N 3.33Å; S376-D378 PolarHBondContact O-N 3.36Å; D378-A381 PolarHBondContact O-N 3.46Å; D378-E382 PolarHBondContact O-N 3.28Å
379	R	90.4	Very high	88.6	Confident	112 Å²	112	65 Å²	65	42%	0.423	34%	0.337	S	S	.	.	H	α-helix	trans	-70	-37.3	178.3	-174.8	57.6	178.9	174.4	5.9	111.4	I375 S376 M377 E382 L383	I375-R379 HydrophobicContact CD1-CG 4.34Å; I375-R379 HydrophobicContact CG1-CB 4.34Å; I375-R379 HydrophobicContact CG1-CG 4.44Å; S376-R379 PolarHBondContact O-N 3.47Å; S376-R379 VanDerWaalsContact OG-CB 3.23Å; S376-R379 WeakPolarHBondContact OG-CB 3.49Å; S376-R379 PolarHBondContact OG-N 3.41Å; M377-R379 VanDerWaalsContact C-N 3.33Å; M377-R379 PolarHBondContact O-N 3.24Å; R379-E382 IonicContact CZ-OE2 3.36Å; R379-E382 IonicContact NH1-OE1 3.69Å; R379-E382 PolarHBondContact NH1-OE1 2.82Å; R379-E382 IonicContact NH1-OE2 3.09Å; R379-E382 PolarHBondContact NH1-OE2 3.5Å; R379-E382 PolarHBondContact O-N 3.5Å; R379-L383 HydrophobicContact CG-CD1 4.41Å; R379-L383 VanDerWaalsContact O-CG 3.31Å; R379-L383 WeakPolarHBondContact O-CG 3.24Å; R379-L383 PolarHBondContact O-N 3.31Å; R379-L383 VanDerWaalsContact O-N 3.07Å
380	L	90.3	Very high	88.7	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.7	-46.1	175.2	-177.9	65.4	0	0	0	111.2	I368 I375 S376 M377 E382 L383 I384 L395 V416	I368-L380 HydrophobicContact CD1-CD1 3.47Å; I368-L380 VanDerWaalsContact CD1-CD1 3.47Å; I368-L380 HydrophobicContact CG2-CD1 4.17Å; I375-L380 HydrophobicContact CD1-CB 4.41Å; I375-L380 HydrophobicContact CD1-CD1 4.47Å; I375-L380 HydrophobicContact CG2-CB 4.28Å; I375-L380 HydrophobicContact CG2-CD1 4.5Å; S376-L380 WeakPolarHBondContact O-CB 3.44Å; S376-L380 PolarHBondContact O-N 3.47Å; M377-L380 WeakPolarHBondContact O-CB 3.44Å; M377-L380 PolarHBondContact O-N 3.03Å; M377-L380 HydrophobicContact SD-CD2 4.15Å; L380-E382 VanDerWaalsContact C-N 3.33Å; L380-E382 PolarHBondContact O-N 2.95Å; L380-L383 PolarHBondContact O-N 3.39Å; L380-I384 HydrophobicContact CD1-CD1 3.67Å; L380-I384 HydrophobicContact CD1-CG1 4.36Å; L380-I384 HydrophobicContact CD2-CD1 4.45Å; L380-I384 HydrophobicContact CG-CD1 3.68Å; L380-I384 WeakPolarHBondContact O-CD1 3.46Å; L380-I384 VanDerWaalsContact O-CG1 3.25Å; L380-I384 WeakPolarHBondContact O-CG1 3.39Å; L380-I384 PolarHBondContact O-N 3.35Å; L380-I384 VanDerWaalsContact O-N 3.15Å; L380-L395 HydrophobicContact CD2-CD1 3.54Å; L380-L395 HydrophobicContact CD2-CD2 4.42Å; L380-L395 HydrophobicContact CD2-CG 4.24Å; L380-V416 HydrophobicContact CD2-CG2 4.41Å
381	A	90.2	Very high	88.7	Confident	6 Å²	6	62.9 Å²	62.9	5%	0.05	31%	0.313	C	S	.	.	H	α-helix	trans	-59.5	-42.9	177.2	0	0	0	0	0	111.9	M377 D378 L383 I384 D385 I386 T388	M377-A381 WeakPolarHBondContact O-CB 3.26Å; M377-A381 PolarHBondContact O-N 3.11Å; D378-A381 PolarHBondContact O-N 3.46Å; A381-L383 PolarHBondContact O-N 3.28Å; A381-I384 PolarHBondContact O-N 3.01Å; A381-D385 PolarHBondContact O-N 3.05Å; A381-D385 VanDerWaalsContact O-N 3.12Å; A381-I386 CarbonylContact C-O 3.52Å; A381-I386 WeakPolarHBondContact CB-O 3.47Å; A381-I386 PolarHBondContact O-N 3.5Å; A381-T388 HydrophobicContact CB-CG2 3.76Å
382	E	90.2	Very high	88.8	Confident	121 Å²	121	57.1 Å²	57.1	57%	0.565	29%	0.292	S	S	*	.	H	α-helix	trans	-61	-43.4	175.4	-167	-169.5	159	0	0	112.4	D378 R379 L380 I384 D385	D378-E382 PolarHBondContact O-N 3.28Å; R379-E382 IonicContact CZ-OE2 3.36Å; R379-E382 IonicContact NH1-OE1 3.69Å; R379-E382 PolarHBondContact NH1-OE1 2.82Å; R379-E382 IonicContact NH1-OE2 3.09Å; R379-E382 PolarHBondContact NH1-OE2 3.5Å; R379-E382 PolarHBondContact O-N 3.5Å; L380-E382 VanDerWaalsContact C-N 3.33Å; L380-E382 PolarHBondContact O-N 2.95Å; E382-I384 VanDerWaalsContact C-N 3.27Å; E382-I384 PolarHBondContact O-N 3.26Å; E382-D385 PolarHBondContact O-N 3.48Å
383	L	88	Confident	88.8	Confident	26 Å²	26	56.3 Å²	56.3	14%	0.136	30%	0.295	C	S	.	.	H	α-helix	trans	-69.4	-24.6	-179.8	-69	174.4	0	0	0	113.5	L314 I368 I375 R379 L380 A381	L314-L383 HydrophobicContact CD1-CD2 4.27Å; I368-L383 HydrophobicContact CD1-CB 4.09Å; I368-L383 HydrophobicContact CD1-CD1 3.85Å; I368-L383 HydrophobicContact CG1-CD1 4.45Å; I375-L383 HydrophobicContact CD1-CD1 3.98Å; R379-L383 HydrophobicContact CG-CD1 4.41Å; R379-L383 VanDerWaalsContact O-CG 3.31Å; R379-L383 WeakPolarHBondContact O-CG 3.24Å; R379-L383 PolarHBondContact O-N 3.31Å; R379-L383 VanDerWaalsContact O-N 3.07Å; L380-L383 PolarHBondContact O-N 3.39Å; A381-L383 PolarHBondContact O-N 3.28Å
384	I	84.8	Confident	88.8	Confident	7 Å²	7	53.6 Å²	53.6	4%	0.036	27%	0.274	C	S	.	.	H	α-helix	trans	-93.6	-10.2	-179.1	-59	166.1	0	0	0	111.3	A361 N364 I365 L380 A381 E382 I386 M394	A361-I384 HydrophobicContact CB-CG2 3.44Å; A361-I384 VanDerWaalsContact CB-CG2 3.44Å; N364-I384 HydrophobicContact CB-CG1 4.41Å; I365-I384 HydrophobicContact CD1-CD1 3.91Å; I365-I384 HydrophobicContact CG1-CD1 3.41Å; I365-I384 VanDerWaalsContact CG1-CD1 3.41Å; I365-I384 HydrophobicContact CG1-CG1 4.28Å; L380-I384 HydrophobicContact CD1-CD1 3.67Å; L380-I384 HydrophobicContact CD1-CG1 4.36Å; L380-I384 HydrophobicContact CD2-CD1 4.45Å; L380-I384 HydrophobicContact CG-CD1 3.68Å; L380-I384 WeakPolarHBondContact O-CD1 3.46Å; L380-I384 VanDerWaalsContact O-CG1 3.25Å; L380-I384 WeakPolarHBondContact O-CG1 3.39Å; L380-I384 PolarHBondContact O-N 3.35Å; L380-I384 VanDerWaalsContact O-N 3.15Å; A381-I384 PolarHBondContact O-N 3.01Å; E382-I384 VanDerWaalsContact C-N 3.27Å; E382-I384 PolarHBondContact O-N 3.26Å; I384-I386 VanDerWaalsContact C-N 3.3Å; I384-I386 HydrophobicContact CG2-CB 4.12Å; I384-I386 HydrophobicContact CG2-CD1 3.56Å; I384-I386 HydrophobicContact CG2-CG1 3.84Å; I384-M394 HydrophobicContact CG2-CE 4.33Å
385	D	84.5	Confident	88.8	Confident	53 Å²	53	49.4 Å²	49.4	28%	0.283	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	34.6	-171.3	-76.3	-37.3	0	0	0	113.3	A381 E382	A381-D385 PolarHBondContact O-N 3.05Å; A381-D385 VanDerWaalsContact O-N 3.12Å; E382-D385 PolarHBondContact O-N 3.48Å
386	I	85.4	Confident	88.6	Confident	33 Å²	33	51.3 Å²	51.3	17%	0.169	27%	0.268	C	S	.	.	S	Bend	trans	-130.1	157.2	-175.9	-66.2	-178.6	0	0	0	110.1	A361 A381 I384 T390 M394	A361-I386 HydrophobicContact CB-CD1 3.76Å; A381-I386 CarbonylContact C-O 3.52Å; A381-I386 WeakPolarHBondContact CB-O 3.47Å; A381-I386 PolarHBondContact O-N 3.5Å; I384-I386 VanDerWaalsContact C-N 3.3Å; I384-I386 HydrophobicContact CG2-CB 4.12Å; I384-I386 HydrophobicContact CG2-CD1 3.56Å; I384-I386 HydrophobicContact CG2-CG1 3.84Å; I386-T390 WeakPolarHBondContact CG2-OG1 3.22Å; I386-M394 HydrophobicContact CD1-CE 3.79Å
387	D	89.4	Confident	88.4	Confident	86 Å²	86	54.6 Å²	54.6	46%	0.46	28%	0.278	S	S	.	.			trans	-67.8	158.3	173.9	56.5	-82.3	0	0	0	112.7	E389 T390 A391	D387-E389 PolarHBondContact O-N 3.34Å; D387-T390 PolarHBondContact O-OG1 3.22Å; D387-T390 PolarHBondContact OD1-OG1 3Å; D387-T390 WeakPolarHBondContact OD2-CB 3.39Å; D387-T390 VanDerWaalsContact OD2-CG2 3.25Å; D387-T390 WeakPolarHBondContact OD2-CG2 3.49Å; D387-T390 PolarHBondContact OD2-N 3.17Å; D387-T390 PolarHBondContact OD2-OG1 2.87Å; D387-A391 VanDerWaalsContact O-CB 3.29Å; D387-A391 WeakPolarHBondContact O-CB 3.23Å; D387-A391 PolarHBondContact O-N 3.41Å
388	T	87.4	Confident	88.3	Confident	58 Å²	58	54.4 Å²	54.4	36%	0.356	28%	0.277	S	S	.	.	H	α-helix	trans	-63.8	-39	-175.3	47.6	0	0	0	0	112.5	A381 A391 E392	A381-T388 HydrophobicContact CB-CG2 3.76Å; T388-A391 PolarHBondContact O-N 3.35Å; T388-E392 WeakPolarHBondContact O-CG 3.35Å; T388-E392 PolarHBondContact O-N 2.92Å
389	E	89.5	Confident	88.1	Confident	147 Å²	147	51.1 Å²	51.1	69%	0.687	26%	0.261	S	S	*	.	H	α-helix	trans	-65.9	-50.1	-179	-65.5	-174.7	173.1	0	0	111.9	D387 A391 E392 D393	D387-E389 PolarHBondContact O-N 3.34Å; E389-A391 VanDerWaalsContact C-N 3.3Å; E389-A391 PolarHBondContact O-N 3Å; E389-E392 WeakPolarHBondContact O-CB 3.25Å; E389-E392 PolarHBondContact O-N 2.83Å; E389-D393 PolarHBondContact O-N 3.41Å
390	T	89	Confident	87.9	Confident	59 Å²	59	52.5 Å²	52.5	36%	0.362	28%	0.277	S	S	.	.	H	α-helix	trans	-70.3	-27.4	178.3	54.5	0	0	0	0	112.6	I386 D387 D393 M394	I386-T390 WeakPolarHBondContact CG2-OG1 3.22Å; D387-T390 PolarHBondContact O-OG1 3.22Å; D387-T390 PolarHBondContact OD1-OG1 3Å; D387-T390 WeakPolarHBondContact OD2-CB 3.39Å; D387-T390 VanDerWaalsContact OD2-CG2 3.25Å; D387-T390 WeakPolarHBondContact OD2-CG2 3.49Å; D387-T390 PolarHBondContact OD2-N 3.17Å; D387-T390 PolarHBondContact OD2-OG1 2.87Å; T390-D393 PolarHBondContact O-N 2.9Å; T390-M394 WeakPolarHBondContact O-CB 3.31Å; T390-M394 PolarHBondContact O-N 3.44Å
391	A	88.5	Confident	87.4	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.2	-40.5	170.1	0	0	0	0	0	111.8	M377 D387 T388 E389 M394 L395	M377-A391 HydrophobicContact CE-CB 4.28Å; D387-A391 VanDerWaalsContact O-CB 3.29Å; D387-A391 WeakPolarHBondContact O-CB 3.23Å; D387-A391 PolarHBondContact O-N 3.41Å; T388-A391 PolarHBondContact O-N 3.35Å; E389-A391 VanDerWaalsContact C-N 3.3Å; E389-A391 PolarHBondContact O-N 3Å; A391-M394 PolarHBondContact O-N 3.14Å; A391-L395 WeakPolarHBondContact O-CG 3.42Å; A391-L395 PolarHBondContact O-N 3.48Å
392	E	88.8	Confident	86.9	Confident	32 Å²	32	57.6 Å²	57.6	15%	0.15	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-46.8	172.7	-70.9	-172.4	174.5	0	0	111.8	M377 T388 E389 M394 L395 C396 R411	M377-E392 HydrophobicContact CE-CB 4.28Å; M377-E392 HydrophobicContact CE-CG 3.27Å; M377-E392 HydrophobicContact SD-CG 4.36Å; T388-E392 WeakPolarHBondContact O-CG 3.35Å; T388-E392 PolarHBondContact O-N 2.92Å; E389-E392 WeakPolarHBondContact O-CB 3.25Å; E389-E392 PolarHBondContact O-N 2.83Å; E392-M394 VanDerWaalsContact C-N 3.31Å; E392-M394 PolarHBondContact O-N 2.78Å; E392-L395 PolarHBondContact O-N 3.43Å; E392-C396 PolarHBondContact O-N 3.38Å; E392-C396 PolarHBondContact O-SG 2.89Å; E392-R411 IonicContact OE1-NE 3.89Å; E392-R411 IonicContact OE2-CZ 3.27Å; E392-R411 IonicContact OE2-NE 2.73Å; E392-R411 PolarHBondContact OE2-NE 3.41Å; E392-R411 IonicContact OE2-NH2 3.91Å; E392-R411 PolarHBondContact OE2-NH2 3.35Å
393	D	89.9	Confident	86.1	Confident	90 Å²	90	53.8 Å²	53.8	48%	0.481	30%	0.3	S	S	.	.	H	α-helix	trans	-60.6	-41.8	179.6	-75.9	-19.6	0	0	0	111.6	E389 T390 C396 Q397	E389-D393 PolarHBondContact O-N 3.41Å; T390-D393 PolarHBondContact O-N 2.9Å; D393-C396 WeakPolarHBondContact O-CB 3.25Å; D393-C396 PolarHBondContact O-N 3.48Å; D393-Q397 WeakPolarHBondContact O-CG 3.24Å; D393-Q397 PolarHBondContact O-N 3.09Å
394	M	86.8	Confident	85.5	Confident	15 Å²	15	53 Å²	53	7%	0.074	30%	0.296	C	S	.	.	H	α-helix	trans	-68.6	-40.9	178.5	-166.5	150.5	59.5	0	0	112.1	T358 A361 E362 I365 I384 I386 T390 A391 E392 C396 Q397 M398	T358-M394 HydrophobicContact CG2-SD 3.83Å; A361-M394 HydrophobicContact CB-CE 3.23Å; A361-M394 HydrophobicContact CB-SD 4.07Å; E362-M394 HydrophobicContact CG-SD 4.39Å; I365-M394 HydrophobicContact CD1-CE 3.98Å; I365-M394 HydrophobicContact CD1-CG 4.19Å; I384-M394 HydrophobicContact CG2-CE 4.33Å; I386-M394 HydrophobicContact CD1-CE 3.79Å; T390-M394 WeakPolarHBondContact O-CB 3.31Å; T390-M394 PolarHBondContact O-N 3.44Å; A391-M394 PolarHBondContact O-N 3.14Å; E392-M394 VanDerWaalsContact C-N 3.31Å; E392-M394 PolarHBondContact O-N 2.78Å; M394-C396 VanDerWaalsContact C-N 3.28Å; M394-C396 PolarHBondContact O-N 3.34Å; M394-Q397 PolarHBondContact O-N 2.79Å; M394-M398 HydrophobicContact CG-SD 4.5Å; M394-M398 WeakPolarHBondContact O-CB 3.49Å; M394-M398 VanDerWaalsContact O-CG 3.3Å; M394-M398 WeakPolarHBondContact O-CG 3.41Å; M394-M398 PolarHBondContact O-N 2.96Å
395	L	88.2	Confident	84.8	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-58.9	-41.3	171.3	-80	172.3	0	0	0	111.9	I365 M377 L380 A391 E392 M398 T399 L404 I409 V416 F418	I365-L395 HydrophobicContact CD1-CD2 4.41Å; I365-L395 HydrophobicContact CG2-CD2 3.59Å; M377-L395 HydrophobicContact CE-CD1 4.3Å; M377-L395 HydrophobicContact SD-CD1 3.97Å; L380-L395 HydrophobicContact CD2-CD1 3.54Å; L380-L395 HydrophobicContact CD2-CD2 4.42Å; L380-L395 HydrophobicContact CD2-CG 4.24Å; A391-L395 WeakPolarHBondContact O-CG 3.42Å; A391-L395 PolarHBondContact O-N 3.48Å; E392-L395 PolarHBondContact O-N 3.43Å; L395-M398 PolarHBondContact O-N 3.46Å; L395-T399 WeakPolarHBondContact O-CB 3.3Å; L395-T399 PolarHBondContact O-N 3.39Å; L395-T399 PolarHBondContact O-OG1 3.01Å; L395-L404 HydrophobicContact CD2-CD1 3.97Å; L395-I409 HydrophobicContact CB-CD1 3.85Å; L395-I409 HydrophobicContact CD1-CD1 4.1Å; L395-I409 HydrophobicContact CD1-CG1 4.42Å; L395-V416 HydrophobicContact CD1-CG1 4.49Å; L395-V416 HydrophobicContact CD1-CG2 3.89Å; L395-F418 HydrophobicContact CD2-CE1 4.29Å
396	C	87.6	Confident	84.3	Confident	52 Å²	52	60.6 Å²	60.6	35%	0.351	34%	0.335	S	S	.	.	H	α-helix	trans	-63.5	-44.5	177.3	-68.9	0	0	0	0	111.2	E392 D393 M394 T399 N400	E392-C396 PolarHBondContact O-N 3.38Å; E392-C396 PolarHBondContact O-SG 2.89Å; D393-C396 WeakPolarHBondContact O-CB 3.25Å; D393-C396 PolarHBondContact O-N 3.48Å; M394-C396 VanDerWaalsContact C-N 3.28Å; M394-C396 PolarHBondContact O-N 3.34Å; C396-T399 PolarHBondContact O-N 2.96Å; C396-N400 WeakPolarHBondContact O-CB 3.31Å; C396-N400 PolarHBondContact O-N 3.42Å; C396-N400 PolarHBondContact O-ND2 3.38Å
397	Q	88.8	Confident	84.2	Confident	124 Å²	124	59.7 Å²	59.7	58%	0.579	33%	0.333	S	S	*	.	H	α-helix	trans	-61.7	-46.1	175.9	-71.5	175.4	24.2	0	0	111.9	D393 M394 T399 N400 S401	D393-Q397 WeakPolarHBondContact O-CG 3.24Å; D393-Q397 PolarHBondContact O-N 3.09Å; M394-Q397 PolarHBondContact O-N 2.79Å; Q397-T399 VanDerWaalsContact C-N 3.35Å; Q397-T399 PolarHBondContact O-N 3.44Å; Q397-N400 PolarHBondContact O-N 3.36Å; Q397-S401 WeakPolarHBondContact O-CB 3.27Å; Q397-S401 PolarHBondContact O-N 2.67Å; Q397-S401 PolarHBondContact O-OG 2.95Å
398	M	85.5	Confident	84	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-65	-38.3	178.7	-69.6	-176.1	80.2	0	0	112.3	E362 I365 L366 M394 L395 S401 G402 E403 L404	E362-M398 HydrophobicContact CB-CE 3.79Å; E362-M398 HydrophobicContact CB-SD 4.01Å; E362-M398 HydrophobicContact CG-CE 4.08Å; E362-M398 HydrophobicContact CG-CG 4.22Å; E362-M398 HydrophobicContact CG-SD 3.8Å; I365-M398 HydrophobicContact CB-CE 4.46Å; I365-M398 HydrophobicContact CB-SD 4.02Å; I365-M398 HydrophobicContact CD1-SD 3.73Å; I365-M398 HydrophobicContact CG1-SD 4.49Å; I365-M398 HydrophobicContact CG2-CE 4.42Å; I365-M398 HydrophobicContact CG2-SD 3.97Å; L366-M398 HydrophobicContact CD1-CE 4.15Å; L366-M398 HydrophobicContact CD2-CE 4.09Å; L366-M398 HydrophobicContact CG-CE 3.75Å; M394-M398 HydrophobicContact CG-SD 4.5Å; M394-M398 WeakPolarHBondContact O-CB 3.49Å; M394-M398 VanDerWaalsContact O-CG 3.3Å; M394-M398 WeakPolarHBondContact O-CG 3.41Å; M394-M398 PolarHBondContact O-N 2.96Å; L395-M398 PolarHBondContact O-N 3.46Å; M398-S401 WeakPolarHBondContact CA-OG 3.4Å; M398-S401 PolarHBondContact O-N 3.49Å; M398-S401 PolarHBondContact O-OG 3.23Å; M398-G402 PolarHBondContact O-N 2.94Å; M398-E403 PolarHBondContact O-N 3.45Å; M398-L404 HydrophobicContact CB-CD1 3.51Å; M398-L404 HydrophobicContact CB-CG 4.11Å; M398-L404 HydrophobicContact CE-CD1 3.98Å; M398-L404 HydrophobicContact CE-CG 4.15Å; M398-L404 HydrophobicContact CG-CD1 4.33Å; M398-L404 HydrophobicContact SD-CD1 3.89Å
399	T	86.4	Confident	84	Confident	49 Å²	49	61.6 Å²	61.6	30%	0.301	33%	0.334	S	S	.	.	H	α-helix	trans	-65.4	-42.5	175	-53.3	0	0	0	0	110.9	L395 C396 Q397 S401 G402	L395-T399 WeakPolarHBondContact O-CB 3.3Å; L395-T399 PolarHBondContact O-N 3.39Å; L395-T399 PolarHBondContact O-OG1 3.01Å; C396-T399 PolarHBondContact O-N 2.96Å; Q397-T399 VanDerWaalsContact C-N 3.35Å; Q397-T399 PolarHBondContact O-N 3.44Å; T399-S401 PolarHBondContact O-N 3.45Å; T399-G402 PolarHBondContact O-N 3.34Å
400	N	86	Confident	83.9	Confident	142 Å²	142	57.8 Å²	57.8	76%	0.759	32%	0.318	S	S	*	.	H	α-helix	trans	-66.2	-36.1	176.9	-70.6	-20	0	0	0	112.7	C396 Q397 G402	C396-N400 WeakPolarHBondContact O-CB 3.31Å; C396-N400 PolarHBondContact O-N 3.42Å; C396-N400 PolarHBondContact O-ND2 3.38Å; Q397-N400 PolarHBondContact O-N 3.36Å; N400-G402 PolarHBondContact O-N 2.91Å
401	S	80.5	Confident	83.6	Confident	74 Å²	74	63 Å²	63	52%	0.517	33%	0.331	S	S	.	.	H	α-helix	trans	-70.5	-16	176.6	72.8	0	0	0	0	113.4	Q397 M398 T399 E403	Q397-S401 WeakPolarHBondContact O-CB 3.27Å; Q397-S401 PolarHBondContact O-N 2.67Å; Q397-S401 PolarHBondContact O-OG 2.95Å; M398-S401 WeakPolarHBondContact CA-OG 3.4Å; M398-S401 PolarHBondContact O-N 3.49Å; M398-S401 PolarHBondContact O-OG 3.23Å; T399-S401 PolarHBondContact O-N 3.45Å; S401-E403 VanDerWaalsContact C-N 3.33Å; S401-E403 WeakPolarHBondContact OG-CG 3.15Å
402	G	79.4	Confident	83.4	Confident	38 Å²	38	69 Å²	69	39%	0.392	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	4.3	-178.5	0	0	0	0	0	114.8	M398 T399 N400	M398-G402 PolarHBondContact O-N 2.94Å; T399-G402 PolarHBondContact O-N 3.34Å; N400-G402 PolarHBondContact O-N 2.91Å
403	E	74.1	Confident	83	Confident	42 Å²	42	73.7 Å²	73.7	20%	0.196	39%	0.392	C	S	.	.	S	Bend	trans	-67	-38.1	174.9	-69.7	-176.6	-178.6	0	0	111.6	S279 M398 S401	S279-E403 PolarHBondContact N-OE1 3.18Å; M398-E403 PolarHBondContact O-N 3.45Å; S401-E403 VanDerWaalsContact C-N 3.33Å; S401-E403 WeakPolarHBondContact OG-CG 3.15Å
404	L	74.8	Confident	82.8	Confident	10 Å²	10	70.6 Å²	70.6	5%	0.052	38%	0.381	C	S	.	.	S	Bend	trans	-104	94.1	175.9	-73	167.4	0	0	0	110.9	I365 L366 A369 L395 M398 G406 A407	I365-L404 HydrophobicContact CG2-CD1 3.48Å; I365-L404 VanDerWaalsContact CG2-CD1 3.48Å; I365-L404 HydrophobicContact CG2-CD2 4.24Å; I365-L404 HydrophobicContact CG2-CG 4.44Å; L366-L404 HydrophobicContact CD2-CD2 3.72Å; L366-L404 HydrophobicContact CD2-CG 4.15Å; A369-L404 HydrophobicContact CB-CD2 3.63Å; L395-L404 HydrophobicContact CD2-CD1 3.97Å; M398-L404 HydrophobicContact CB-CD1 3.51Å; M398-L404 HydrophobicContact CB-CG 4.11Å; M398-L404 HydrophobicContact CE-CD1 3.98Å; M398-L404 HydrophobicContact CE-CG 4.15Å; M398-L404 HydrophobicContact CG-CD1 4.33Å; M398-L404 HydrophobicContact SD-CD1 3.89Å; L404-G406 PolarHBondContact O-N 3.13Å; L404-A407 HydrophobicContact CB-CB 4.26Å
405	K	70.6	Confident	82.9	Confident	188 Å²	188	71.8 Å²	71.8	82%	0.817	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	118.6	176.7	-66.4	-177.1	-178.7	177.1	0	110.7
406	G	74	Confident	82.9	Confident	31 Å²	31	71.8 Å²	71.8	32%	0.32	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	-0.2	169.8	0	0	0	0	0	115.8	L404 K408	L404-G406 PolarHBondContact O-N 3.13Å; G406-K408 PolarHBondContact O-N 3.28Å
407	A	84.1	Confident	83	Confident	14 Å²	14	73.2 Å²	73.2	12%	0.116	39%	0.385	C	S	.	.			trans	-63.2	128.3	175.5	0	0	0	0	0	111.2	L404 K417 F418	L404-A407 HydrophobicContact CB-CB 4.26Å; A407-K417 CarbonylContact C-O 3.54Å; A407-K417 WeakPolarHBondContact CA-O 3.42Å; A407-F418 HydrophobicContact CB-CD1 4.14Å
408	K	85.3	Confident	82.8	Confident	136 Å²	136	68 Å²	68	59%	0.591	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.5	125	176.2	-68.8	-176.3	-179.4	-179.4	0	110	G406 V416 K417	G406-K408 PolarHBondContact O-N 3.28Å; K408-V416 WeakPolarHBondContact O-CA 3.26Å; K408-K417 PolarHBondContact N-O 3.4Å; K408-K417 PolarHBondContact O-N 2.97Å
409	I	87.1	Confident	82.4	Confident	48 Å²	48	74.3 Å²	74.3	25%	0.246	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	123.1	178.7	-53.4	174.7	0	0	0	108.5	L395 R411 V416	L395-I409 HydrophobicContact CB-CD1 3.85Å; L395-I409 HydrophobicContact CD1-CD1 4.1Å; L395-I409 HydrophobicContact CD1-CG1 4.42Å; I409-R411 HydrophobicContact CG2-CG 4.42Å; I409-V416 HydrophobicContact CG1-CG2 4.35Å
410	N	86.8	Confident	81.6	Confident	66 Å²	66	75 Å²	75	35%	0.353	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	91.8	167.9	-95.5	-15.3	0	0	0	109.2	E413 G414 Y415	N410-E413 PolarHBondContact O-N 3.31Å; N410-G414 PolarHBondContact O-N 2.83Å; N410-Y415 HydrophobicContact CB-CD2 4.2Å; N410-Y415 HydrophobicContact CB-CE1 4.47Å; N410-Y415 HydrophobicContact CB-CE2 3.86Å; N410-Y415 PolarHBondContact N-O 3.45Å; N410-Y415 WeakPolarHBondContact ND2-CE2 3.43Å; N410-Y415 VanDerWaalsContact ND2-CZ 3.32Å; N410-Y415 PolarHBondContact ND2-OH 2.87Å; N410-Y415 PolarHBondContact O-N 3.49Å
411	R	82.8	Confident	80.8	Confident	168 Å²	168	77.4 Å²	77.4	63%	0.634	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-46	178.5	-93.8	-176	170.5	175.1	-0.4	114.6	E392 I409 E413 G414	E392-R411 IonicContact OE1-NE 3.89Å; E392-R411 IonicContact OE2-CZ 3.27Å; E392-R411 IonicContact OE2-NE 2.73Å; E392-R411 PolarHBondContact OE2-NE 3.41Å; E392-R411 IonicContact OE2-NH2 3.91Å; E392-R411 PolarHBondContact OE2-NH2 3.35Å; I409-R411 HydrophobicContact CG2-CG 4.42Å; R411-E413 VanDerWaalsContact C-N 3.33Å; R411-E413 PolarHBondContact O-N 2.95Å; R411-G414 PolarHBondContact O-N 2.88Å
412	P	83.4	Confident	80.1	Confident	127 Å²	127	78.1 Å²	78.1	83%	0.825	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-34.8	-175.4	-19.9	31.5	0	0	0	113.5
413	E	81.6	Confident	80.1	Confident	131 Å²	131	81 Å²	81	61%	0.612	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-5	-178.1	-63.4	-178	136.8	0	0	112.4	N410 R411 Y415	N410-E413 PolarHBondContact O-N 3.31Å; R411-E413 VanDerWaalsContact C-N 3.33Å; R411-E413 PolarHBondContact O-N 2.95Å; E413-Y415 HydrophobicContact CB-CD1 3.54Å; E413-Y415 HydrophobicContact CB-CE1 3.32Å; E413-Y415 HydrophobicContact CG-CE1 4.05Å; E413-Y415 PolarHBondContact O-N 3.25Å; E413-Y415 WeakPolarHBondContact OE2-CE1 3.28Å; E413-Y415 PolarHBondContact OE2-OH 2.99Å
414	G	85.6	Confident	80.5	Confident	25 Å²	25	83.5 Å²	83.5	26%	0.258	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	30.5	174.6	0	0	0	0	0	114.9	S376 M377 N410 R411	S376-G414 CarbonylContact C-O 3.59Å; S376-G414 WeakPolarHBondContact CA-O 3.41Å; M377-G414 PolarHBondContact N-O 3.06Å; N410-G414 PolarHBondContact O-N 2.83Å; R411-G414 PolarHBondContact O-N 2.88Å
415	Y	88.2	Confident	81	Confident	40 Å²	40	89.9 Å²	89.9	16%	0.157	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	154.6	176.6	66.9	-106.1	0	0	0	114.1	Q374 I375 N410 E413 K417	Q374-Y415 HydrophobicContact CG-CD2 3.96Å; Q374-Y415 HydrophobicContact CG-CG 4.26Å; I375-Y415 CarbonylContact O-C 3.55Å; I375-Y415 VanDerWaalsContact O-CA 3.26Å; I375-Y415 WeakPolarHBondContact O-CA 3.27Å; I375-Y415 WeakPolarHBondContact O-CB 3.37Å; N410-Y415 HydrophobicContact CB-CD2 4.2Å; N410-Y415 HydrophobicContact CB-CE1 4.47Å; N410-Y415 HydrophobicContact CB-CE2 3.86Å; N410-Y415 PolarHBondContact N-O 3.45Å; N410-Y415 WeakPolarHBondContact ND2-CE2 3.43Å; N410-Y415 VanDerWaalsContact ND2-CZ 3.32Å; N410-Y415 PolarHBondContact ND2-OH 2.87Å; N410-Y415 PolarHBondContact O-N 3.49Å; E413-Y415 HydrophobicContact CB-CD1 3.54Å; E413-Y415 HydrophobicContact CB-CE1 3.32Å; E413-Y415 HydrophobicContact CG-CE1 4.05Å; E413-Y415 PolarHBondContact O-N 3.25Å; E413-Y415 WeakPolarHBondContact OE2-CE1 3.28Å; E413-Y415 PolarHBondContact OE2-OH 2.99Å; Y415-K417 HydrophobicContact CD2-CD 4.47Å; Y415-K417 HydrophobicContact CD2-CG 4.07Å; Y415-K417 HydrophobicContact CE2-CD 3.86Å; Y415-K417 VanDerWaalsContact CE2-CE 3.42Å; Y415-K417 HydrophobicContact CE2-CG 3.96Å; Y415-K417 PolarHBondContact OH-NZ 3Å
416	V	88.8	Confident	81.7	Confident	0 Å²	0	85.9 Å²	85.9	0%	0	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	130	175.7	-174.1	0	0	0	0	108.9	Q374 I375 M377 L380 L395 K408 I409 F418	Q374-V416 VanDerWaalsContact CA-O 3.25Å; Q374-V416 WeakPolarHBondContact CA-O 3.49Å; I375-V416 HydrophobicContact CG2-CB 4.21Å; I375-V416 PolarHBondContact N-O 3.49Å; I375-V416 PolarHBondContact O-N 3.46Å; M377-V416 HydrophobicContact CG-CG2 4.09Å; M377-V416 HydrophobicContact SD-CG2 3.2Å; M377-V416 WeakPolarHBondContact SD-CG2 3.22Å; L380-V416 HydrophobicContact CD2-CG2 4.41Å; L395-V416 HydrophobicContact CD1-CG1 4.49Å; L395-V416 HydrophobicContact CD1-CG2 3.89Å; K408-V416 WeakPolarHBondContact O-CA 3.26Å; I409-V416 HydrophobicContact CG1-CG2 4.35Å; V416-F418 HydrophobicContact CB-CZ 4.38Å; V416-F418 HydrophobicContact CG1-CD1 4.24Å; V416-F418 HydrophobicContact CG1-CE1 3.83Å; V416-F418 HydrophobicContact CG1-CE2 4.25Å; V416-F418 HydrophobicContact CG1-CZ 3.84Å
417	K	89.2	Confident	82.3	Confident	82 Å²	82	88.3 Å²	88.3	36%	0.357	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.1	170.6	-75.5	175.5	174.8	164.1	0	108.8	Q374 A407 K408 Y415	Q374-K417 HydrophobicContact CB-CG 4.29Å; Q374-K417 HydrophobicContact CG-CG 4.01Å; A407-K417 CarbonylContact C-O 3.54Å; A407-K417 WeakPolarHBondContact CA-O 3.42Å; K408-K417 PolarHBondContact N-O 3.4Å; K408-K417 PolarHBondContact O-N 2.97Å; Y415-K417 HydrophobicContact CD2-CD 4.47Å; Y415-K417 HydrophobicContact CD2-CG 4.07Å; Y415-K417 HydrophobicContact CE2-CD 3.86Å; Y415-K417 VanDerWaalsContact CE2-CE 3.42Å; Y415-K417 HydrophobicContact CE2-CG 3.96Å; Y415-K417 PolarHBondContact OH-NZ 3Å
418	F	85.6	Confident	82.5	Confident	14 Å²	14	93.5 Å²	93.5	6%	0.061	47%	0.468	C	S	.	.			trans	-94.1	-31.6	179.2	-65.2	-72	0	0	0	112.9	I368 A369 Y372 S373 I375 L395 A407 V416 A420	I368-F418 HydrophobicContact CG2-CE2 3.75Å; I368-F418 HydrophobicContact CG2-CZ 4.11Å; A369-F418 HydrophobicContact CB-CB 4.27Å; A369-F418 HydrophobicContact CB-CD1 3.52Å; A369-F418 HydrophobicContact CB-CE1 3.9Å; A369-F418 HydrophobicContact CB-CG 3.87Å; Y372-F418 WeakPolarHBondContact O-CD2 3.29Å; S373-F418 PolarHBondContact O-N 3.48Å; I375-F418 HydrophobicContact CB-CE2 4.46Å; I375-F418 HydrophobicContact CG2-CE2 3.57Å; I375-F418 HydrophobicContact CG2-CZ 4.15Å; L395-F418 HydrophobicContact CD2-CE1 4.29Å; A407-F418 HydrophobicContact CB-CD1 4.14Å; V416-F418 HydrophobicContact CB-CZ 4.38Å; V416-F418 HydrophobicContact CG1-CD1 4.24Å; V416-F418 HydrophobicContact CG1-CE1 3.83Å; V416-F418 HydrophobicContact CG1-CE2 4.25Å; V416-F418 HydrophobicContact CG1-CZ 3.84Å; F418-A420 PolarHBondContact O-N 2.93Å
419	K	76.6	Confident	82.8	Confident	136 Å²	136	90.7 Å²	90.7	59%	0.591	46%	0.463	S	S	*	.	S	Bend	trans	-71.5	130.1	176	-77.9	-165.3	169.8	-159.1	0	111.1	E422	K419-E422 IonicContact NZ-OE1 3.1Å
420	A	70	Confident	82.9	Confident	63 Å²	63	92.4 Å²	92.4	52%	0.521	47%	0.472	S	S	.	.			trans	-60.1	154.3	165.5	0	0	0	0	0	109.9	F418 E422	F418-A420 PolarHBondContact O-N 2.93Å; A420-E422 PolarHBondContact O-N 3.48Å
421	K	68.2	Low	83.1	Confident	193 Å²	193	94 Å²	94	84%	0.839	48%	0.48	S	S	*	.			trans	-65.1	107.4	168.4	-84.2	-174.1	173.1	-175.3	0	107	N423	K421-N423 PolarHBondContact O-N 3.25Å
422	E	66.9	Low	83.6	Confident	88 Å²	88	90.4 Å²	90.4	41%	0.411	47%	0.473	S	S	.	.			trans	-59.3	129.7	173.2	-68.9	173.5	-168	0	0	108.2	K419 A420	K419-E422 IonicContact NZ-OE1 3.1Å; A420-E422 PolarHBondContact O-N 3.48Å
423	N	78.6	Confident	84.1	Confident	98 Å²	98	87.9 Å²	87.9	52%	0.524	45%	0.453	S	S	.	.			trans	-66.9	141	171.4	-91.4	-29.7	0	0	0	108.2	K421 E425 E426 L427	K421-N423 PolarHBondContact O-N 3.25Å; N423-E425 PolarHBondContact O-N 3.28Å; N423-E425 VanDerWaalsContact O-N 3.09Å; N423-E426 HydrophobicContact CB-CG 4.22Å; N423-E426 PolarHBondContact O-N 3.45Å; N423-L427 PolarHBondContact O-N 3.28Å; N423-L427 VanDerWaalsContact O-N 3.09Å
424	P	83.4	Confident	84.7	Confident	95 Å²	95	85.9 Å²	85.9	62%	0.617	45%	0.446	S	S	*	.	H	α-helix	trans	-57.3	-29.8	179.6	23.2	-32.7	0	0	0	112	L427 L428	P424-L427 PolarHBondContact O-N 3.19Å; P424-L428 VanDerWaalsContact O-CG 3.3Å; P424-L428 WeakPolarHBondContact O-CG 3.47Å; P424-L428 PolarHBondContact O-N 3.17Å
425	E	85.1	Confident	85.2	Confident	144 Å²	144	88.5 Å²	88.5	67%	0.673	46%	0.457	S	S	*	.	H	α-helix	trans	-66.1	-42.7	174.2	-62.9	179.8	176.2	0	0	112.9	N423 L427 L428 T429	N423-E425 PolarHBondContact O-N 3.28Å; N423-E425 VanDerWaalsContact O-N 3.09Å; E425-L427 VanDerWaalsContact C-N 3.31Å; E425-L427 PolarHBondContact O-N 2.88Å; E425-L428 PolarHBondContact O-N 3.33Å; E425-T429 WeakPolarHBondContact O-CB 3.48Å; E425-T429 PolarHBondContact O-N 3.26Å; E425-T429 PolarHBondContact O-OG1 3.29Å
426	E	84.9	Confident	85.5	Confident	105 Å²	105	90.4 Å²	90.4	49%	0.491	47%	0.47	S	S	.	.	H	α-helix	trans	-65.5	-39.2	176.3	-70.6	177	166	0	0	110.8	N423 T429 N430	N423-E426 HydrophobicContact CB-CG 4.22Å; N423-E426 PolarHBondContact O-N 3.45Å; E426-T429 PolarHBondContact O-N 3.04Å; E426-N430 WeakPolarHBondContact O-CB 3.22Å; E426-N430 PolarHBondContact O-N 3.04Å; E426-N430 PolarHBondContact O-ND2 3.13Å
427	L	86.3	Confident	85.8	Confident	82 Å²	82	96.1 Å²	96.1	43%	0.429	50%	0.497	S	S	.	.	H	α-helix	trans	-64.8	-43.6	177.9	-145.1	161.9	0	0	0	110.9	N423 P424 E425 T429 N430 L431	N423-L427 PolarHBondContact O-N 3.28Å; N423-L427 VanDerWaalsContact O-N 3.09Å; P424-L427 PolarHBondContact O-N 3.19Å; E425-L427 VanDerWaalsContact C-N 3.31Å; E425-L427 PolarHBondContact O-N 2.88Å; L427-T429 VanDerWaalsContact C-N 3.33Å; L427-T429 PolarHBondContact O-N 3.11Å; L427-N430 PolarHBondContact O-N 2.97Å; L427-L431 VanDerWaalsContact O-CB 3.31Å; L427-L431 WeakPolarHBondContact O-CB 3.4Å; L427-L431 PolarHBondContact O-N 2.75Å
428	L	88.2	Confident	86.1	Confident	123 Å²	123	98.3 Å²	98.3	64%	0.644	51%	0.51	S	S	*	.	H	α-helix	trans	-63	-39.2	172.9	-73.8	170.1	0	0	0	112.2	P424 E425 L431 N432	P424-L428 VanDerWaalsContact O-CG 3.3Å; P424-L428 WeakPolarHBondContact O-CG 3.47Å; P424-L428 PolarHBondContact O-N 3.17Å; E425-L428 PolarHBondContact O-N 3.33Å; L428-L431 PolarHBondContact O-N 3.37Å; L428-N432 WeakPolarHBondContact O-CB 3.29Å; L428-N432 PolarHBondContact O-N 2.83Å
429	T	91.1	Very high	86.5	Confident	77 Å²	77	100.4 Å²	100.4	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-66.6	-45	178.6	-51.4	0	0	0	0	111.2	E425 E426 L427 L431 N432 N433	E425-T429 WeakPolarHBondContact O-CB 3.48Å; E425-T429 PolarHBondContact O-N 3.26Å; E425-T429 PolarHBondContact O-OG1 3.29Å; E426-T429 PolarHBondContact O-N 3.04Å; L427-T429 VanDerWaalsContact C-N 3.33Å; L427-T429 PolarHBondContact O-N 3.11Å; T429-L431 VanDerWaalsContact C-N 3.33Å; T429-L431 PolarHBondContact O-N 3.3Å; T429-N432 PolarHBondContact O-N 2.65Å; T429-N433 VanDerWaalsContact O-CG 3.22Å; T429-N433 PolarHBondContact O-N 2.79Å; T429-N433 PolarHBondContact O-ND2 3.33Å
430	N	89.7	Confident	87.4	Confident	83 Å²	83	99.2 Å²	99.2	44%	0.444	53%	0.527	S	S	.	.	H	α-helix	trans	-61.2	-44	175.7	-69.6	-20	0	0	0	111.1	E426 L427 N432 N433 D434	E426-N430 WeakPolarHBondContact O-CB 3.22Å; E426-N430 PolarHBondContact O-N 3.04Å; E426-N430 PolarHBondContact O-ND2 3.13Å; L427-N430 PolarHBondContact O-N 2.97Å; N430-N432 VanDerWaalsContact C-N 3.3Å; N430-N432 PolarHBondContact O-N 3.4Å; N430-N433 WeakPolarHBondContact O-CB 3.35Å; N430-N433 PolarHBondContact O-N 3.39Å; N430-D434 VanDerWaalsContact O-CG 3.3Å; N430-D434 PolarHBondContact O-N 3.42Å
431	L	91.9	Very high	88.6	Confident	100 Å²	100	101.3 Å²	101.3	52%	0.524	53%	0.529	S	S	.	.	H	α-helix	trans	-65.1	-36	178.8	-157	145.2	0	0	0	111.6	L427 L428 T429 D434 V435	L427-L431 VanDerWaalsContact O-CB 3.31Å; L427-L431 WeakPolarHBondContact O-CB 3.4Å; L427-L431 PolarHBondContact O-N 2.75Å; L428-L431 PolarHBondContact O-N 3.37Å; T429-L431 VanDerWaalsContact C-N 3.33Å; T429-L431 PolarHBondContact O-N 3.3Å; L431-D434 PolarHBondContact O-N 3.4Å; L431-V435 HydrophobicContact CD2-CG2 4.39Å; L431-V435 VanDerWaalsContact O-CG2 3.3Å; L431-V435 WeakPolarHBondContact O-CG2 3.44Å; L431-V435 PolarHBondContact O-N 2.99Å; L431-V435 VanDerWaalsContact O-N 3.09Å
432	N	92.9	Very high	90	Very high	92 Å²	92	97.3 Å²	97.3	49%	0.492	52%	0.516	S	S	.	.	H	α-helix	trans	-66.5	-43.7	173.4	-158.8	77.4	0	0	0	111.7	L428 T429 N430 D434 V435 D436	L428-N432 WeakPolarHBondContact O-CB 3.29Å; L428-N432 PolarHBondContact O-N 2.83Å; T429-N432 PolarHBondContact O-N 2.65Å; N430-N432 VanDerWaalsContact C-N 3.3Å; N430-N432 PolarHBondContact O-N 3.4Å; N432-D434 VanDerWaalsContact C-N 3.3Å; N432-D434 PolarHBondContact O-N 3.48Å; N432-V435 PolarHBondContact O-N 3.01Å; N432-D436 PolarHBondContact ND2-OD2 3.02Å; N432-D436 PolarHBondContact O-N 2.98Å
433	N	94.4	Very high	91.3	Very high	74 Å²	74	98 Å²	98	40%	0.396	52%	0.523	S	S	.	.	H	α-helix	trans	-61.2	-38.8	175.9	-65.9	-26	0	0	0	112	T429 N430 D436 Q437	T429-N433 VanDerWaalsContact O-CG 3.22Å; T429-N433 PolarHBondContact O-N 2.79Å; T429-N433 PolarHBondContact O-ND2 3.33Å; N430-N433 WeakPolarHBondContact O-CB 3.35Å; N430-N433 PolarHBondContact O-N 3.39Å; N433-D436 PolarHBondContact O-N 2.98Å; N433-Q437 WeakPolarHBondContact O-CG 3.38Å; N433-Q437 PolarHBondContact O-N 3.33Å
434	D	93.9	Very high	92.1	Very high	89 Å²	89	98 Å²	98	48%	0.476	52%	0.519	S	S	.	.	H	α-helix	trans	-66.2	-38.9	176.9	-69.3	-16.2	0	0	0	111.3	N430 L431 N432 Q437 M438	N430-D434 VanDerWaalsContact O-CG 3.3Å; N430-D434 PolarHBondContact O-N 3.42Å; L431-D434 PolarHBondContact O-N 3.4Å; N432-D434 VanDerWaalsContact C-N 3.3Å; N432-D434 PolarHBondContact O-N 3.48Å; D434-Q437 PolarHBondContact O-N 2.68Å; D434-M438 WeakPolarHBondContact O-CB 3.48Å; D434-M438 WeakPolarHBondContact O-CG 3.26Å; D434-M438 PolarHBondContact O-N 2.9Å
435	V	95.4	Very high	92.6	Very high	80 Å²	80	96.5 Å²	96.5	49%	0.485	51%	0.509	S	S	.	.	H	α-helix	trans	-65.7	-42.7	175.3	170.8	0	0	0	0	111.2	L431 N432 M438 S439	L431-V435 HydrophobicContact CD2-CG2 4.39Å; L431-V435 VanDerWaalsContact O-CG2 3.3Å; L431-V435 WeakPolarHBondContact O-CG2 3.44Å; L431-V435 PolarHBondContact O-N 2.99Å; L431-V435 VanDerWaalsContact O-N 3.09Å; N432-V435 PolarHBondContact O-N 3.01Å; V435-M438 PolarHBondContact O-N 3.3Å; V435-S439 PolarHBondContact O-N 3.29Å
436	D	94.4	Very high	93.1	Very high	81 Å²	81	93.1 Å²	93.1	43%	0.433	50%	0.498	S	S	.	.	H	α-helix	trans	-62	-46.2	176.2	-67.6	-28	0	0	0	110.6	N432 N433 M438 S439 D440	N432-D436 PolarHBondContact ND2-OD2 3.02Å; N432-D436 PolarHBondContact O-N 2.98Å; N433-D436 PolarHBondContact O-N 2.98Å; D436-M438 VanDerWaalsContact C-N 3.34Å; D436-M438 PolarHBondContact O-N 2.91Å; D436-S439 WeakPolarHBondContact O-CB 3.25Å; D436-S439 PolarHBondContact O-N 2.86Å; D436-S439 VanDerWaalsContact O-N 3.15Å; D436-D440 PolarHBondContact O-N 2.84Å
437	Q	95.3	Very high	93.4	Very high	119 Å²	119	95.7 Å²	95.7	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-61.4	-39.3	175	-74.9	179	12.1	0	0	112.9	N433 D434 S439 D440 L441	N433-Q437 WeakPolarHBondContact O-CG 3.38Å; N433-Q437 PolarHBondContact O-N 3.33Å; D434-Q437 PolarHBondContact O-N 2.68Å; Q437-S439 VanDerWaalsContact C-N 3.33Å; Q437-D440 PolarHBondContact O-N 3.48Å; Q437-L441 WeakPolarHBondContact O-CB 2.96Å; Q437-L441 VanDerWaalsContact O-CG 3.3Å; Q437-L441 WeakPolarHBondContact O-CG 3.47Å; Q437-L441 PolarHBondContact O-N 3.09Å
438	M	95.2	Very high	93.8	Very high	128 Å²	128	96.8 Å²	96.8	63%	0.631	51%	0.508	S	S	*	.	H	α-helix	trans	-64.7	-38.5	175.2	-79.2	-172.8	178.3	0	0	111.8	D434 V435 D436 L442	D434-M438 WeakPolarHBondContact O-CB 3.48Å; D434-M438 WeakPolarHBondContact O-CG 3.26Å; D434-M438 PolarHBondContact O-N 2.9Å; V435-M438 PolarHBondContact O-N 3.3Å; D436-M438 VanDerWaalsContact C-N 3.34Å; D436-M438 PolarHBondContact O-N 2.91Å; M438-L442 WeakPolarHBondContact O-CB 3.45Å; M438-L442 WeakPolarHBondContact O-CG 3.41Å; M438-L442 PolarHBondContact O-N 3.38Å
439	S	94.1	Very high	94	Very high	59 Å²	59	95.3 Å²	95.3	41%	0.413	50%	0.5	S	S	.	.	H	α-helix	trans	-64.8	-46.4	175.8	-164.4	0	0	0	0	111.3	V435 D436 Q437 L441 L442 D443	V435-S439 PolarHBondContact O-N 3.29Å; D436-S439 WeakPolarHBondContact O-CB 3.25Å; D436-S439 PolarHBondContact O-N 2.86Å; D436-S439 VanDerWaalsContact O-N 3.15Å; Q437-S439 VanDerWaalsContact C-N 3.33Å; S439-L441 VanDerWaalsContact C-N 3.34Å; S439-L441 PolarHBondContact O-N 2.82Å; S439-L442 WeakPolarHBondContact O-CB 3.14Å; S439-L442 PolarHBondContact O-N 3.16Å; S439-D443 PolarHBondContact O-N 3.4Å
440	D	95.3	Very high	94.1	Very high	111 Å²	111	96 Å²	96	59%	0.594	50%	0.5	S	S	*	.	H	α-helix	trans	-60.2	-43.7	177.7	-73.1	-19.4	0	0	0	111.6	D436 Q437 D443 E444	D436-D440 PolarHBondContact O-N 2.84Å; Q437-D440 PolarHBondContact O-N 3.48Å; D440-D443 PolarHBondContact O-N 3.06Å; D440-E444 WeakPolarHBondContact O-CB 3.5Å; D440-E444 PolarHBondContact O-N 3.42Å
441	L	96.3	Very high	94.1	Very high	107 Å²	107	93.5 Å²	93.5	56%	0.56	49%	0.494	S	S	*	.	H	α-helix	trans	-64.5	-39.6	176	-75.1	168.9	0	0	0	111.9	Q437 S439 E444 T445	Q437-L441 WeakPolarHBondContact O-CB 2.96Å; Q437-L441 VanDerWaalsContact O-CG 3.3Å; Q437-L441 WeakPolarHBondContact O-CG 3.47Å; Q437-L441 PolarHBondContact O-N 3.09Å; S439-L441 VanDerWaalsContact C-N 3.34Å; S439-L441 PolarHBondContact O-N 2.82Å; L441-E444 PolarHBondContact O-N 3.34Å; L441-T445 VanDerWaalsContact O-CG2 3.28Å; L441-T445 WeakPolarHBondContact O-CG2 3.46Å; L441-T445 PolarHBondContact O-N 3.48Å; L441-T445 PolarHBondContact O-OG1 3.31Å
442	L	96.3	Very high	93.9	Very high	108 Å²	108	95.1 Å²	95.1	57%	0.565	50%	0.499	S	S	*	.	H	α-helix	trans	-62.4	-47.7	175.4	-87.7	162.3	0	0	0	111.2	M438 S439 E444 T445 V446	M438-L442 WeakPolarHBondContact O-CB 3.45Å; M438-L442 WeakPolarHBondContact O-CG 3.41Å; M438-L442 PolarHBondContact O-N 3.38Å; S439-L442 WeakPolarHBondContact O-CB 3.14Å; S439-L442 PolarHBondContact O-N 3.16Å; L442-E444 VanDerWaalsContact C-N 3.3Å; L442-E444 PolarHBondContact O-N 3.29Å; L442-T445 WeakPolarHBondContact CA-OG1 3.42Å; L442-T445 PolarHBondContact O-N 3.2Å; L442-T445 PolarHBondContact O-OG1 3.05Å; L442-V446 WeakPolarHBondContact O-CG2 3.39Å; L442-V446 PolarHBondContact O-N 3.26Å
443	D	94.4	Very high	93.6	Very high	104 Å²	104	96.5 Å²	96.5	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-61.2	-40.3	177.6	-75.2	-17.7	0	0	0	111.7	S439 D440 V446 R447	S439-D443 PolarHBondContact O-N 3.4Å; D440-D443 PolarHBondContact O-N 3.06Å; D443-V446 PolarHBondContact O-N 3.39Å; D443-R447 WeakPolarHBondContact O-CB 3.37Å; D443-R447 PolarHBondContact O-N 2.78Å
444	E	95.1	Very high	93	Very high	96 Å²	96	96.5 Å²	96.5	45%	0.449	51%	0.508	S	S	.	.	H	α-helix	trans	-64.3	-43.2	174.9	-175.7	157.8	-140.5	0	0	112.1	D440 L441 L442 R447 L448	D440-E444 WeakPolarHBondContact O-CB 3.5Å; D440-E444 PolarHBondContact O-N 3.42Å; L441-E444 PolarHBondContact O-N 3.34Å; L442-E444 VanDerWaalsContact C-N 3.3Å; L442-E444 PolarHBondContact O-N 3.29Å; E444-R447 PolarHBondContact O-N 3.31Å; E444-R447 IonicContact OE1-NH2 3.96Å; E444-R447 PolarHBondContact OE1-NH2 2.86Å; E444-R447 VanDerWaalsContact OE1-NH2 3.17Å; E444-L448 HydrophobicContact CG-CD1 4.37Å; E444-L448 WeakPolarHBondContact O-CG 3.24Å; E444-L448 PolarHBondContact O-N 3.05Å
445	T	94.7	Very high	92.3	Very high	65 Å²	65	96.9 Å²	96.9	40%	0.399	51%	0.51	S	S	.	.	H	α-helix	trans	-64.9	-40.8	176.3	58.9	0	0	0	0	112.5	L441 L442 R447 L448 I449	L441-T445 VanDerWaalsContact O-CG2 3.28Å; L441-T445 WeakPolarHBondContact O-CG2 3.46Å; L441-T445 PolarHBondContact O-N 3.48Å; L441-T445 PolarHBondContact O-OG1 3.31Å; L442-T445 WeakPolarHBondContact CA-OG1 3.42Å; L442-T445 PolarHBondContact O-N 3.2Å; L442-T445 PolarHBondContact O-OG1 3.05Å; T445-R447 VanDerWaalsContact C-N 3.33Å; T445-R447 PolarHBondContact O-N 3.47Å; T445-L448 PolarHBondContact O-N 3.49Å; T445-I449 VanDerWaalsContact O-CG1 3.29Å; T445-I449 WeakPolarHBondContact O-CG1 3.11Å; T445-I449 PolarHBondContact O-N 3.36Å
446	V	94.6	Very high	91.3	Very high	73 Å²	73	101 Å²	101	44%	0.442	52%	0.517	S	S	.	.	H	α-helix	trans	-61.3	-44.4	175.8	169.9	0	0	0	0	110.4	L442 D443 L448 I449 I450	L442-V446 WeakPolarHBondContact O-CG2 3.39Å; L442-V446 PolarHBondContact O-N 3.26Å; D443-V446 PolarHBondContact O-N 3.39Å; V446-L448 VanDerWaalsContact C-N 3.32Å; V446-L448 PolarHBondContact O-N 3.14Å; V446-I449 PolarHBondContact O-N 3.26Å; V446-I450 HydrophobicContact CG1-CD1 3.83Å; V446-I450 HydrophobicContact CG1-CG1 4.48Å; V446-I450 WeakPolarHBondContact O-CG1 3.28Å; V446-I450 PolarHBondContact O-N 3.04Å
447	R	92	Very high	90.3	Very high	158 Å²	158	100.8 Å²	100.8	60%	0.596	52%	0.518	S	S	*	.	H	α-helix	trans	-60.1	-41.4	175.8	-174.2	-174.7	63.2	141.9	-3.4	112.1	D443 E444 T445 G451	D443-R447 WeakPolarHBondContact O-CB 3.37Å; D443-R447 PolarHBondContact O-N 2.78Å; E444-R447 PolarHBondContact O-N 3.31Å; E444-R447 IonicContact OE1-NH2 3.96Å; E444-R447 PolarHBondContact OE1-NH2 2.86Å; E444-R447 VanDerWaalsContact OE1-NH2 3.17Å; T445-R447 VanDerWaalsContact C-N 3.33Å; T445-R447 PolarHBondContact O-N 3.47Å; R447-G451 PolarHBondContact O-N 3.24Å
448	L	94.6	Very high	88.9	Confident	105 Å²	105	101.3 Å²	101.3	55%	0.55	52%	0.519	S	S	.	.	H	α-helix	trans	-65.3	-41.5	176.5	-71.7	170.4	0	0	0	112	E444 T445 V446 G451 E452	E444-L448 HydrophobicContact CG-CD1 4.37Å; E444-L448 WeakPolarHBondContact O-CG 3.24Å; E444-L448 PolarHBondContact O-N 3.05Å; T445-L448 PolarHBondContact O-N 3.49Å; V446-L448 VanDerWaalsContact C-N 3.32Å; V446-L448 PolarHBondContact O-N 3.14Å; L448-G451 PolarHBondContact O-N 3.02Å; L448-E452 PolarHBondContact O-N 3.33Å
449	I	93.3	Very high	87.3	Confident	93 Å²	93	100.5 Å²	100.5	48%	0.477	52%	0.517	S	S	.	.	H	α-helix	trans	-62.5	-47.5	177.2	-68	163.9	0	0	0	110.7	T445 V446 G451 E452 E453	T445-I449 VanDerWaalsContact O-CG1 3.29Å; T445-I449 WeakPolarHBondContact O-CG1 3.11Å; T445-I449 PolarHBondContact O-N 3.36Å; V446-I449 PolarHBondContact O-N 3.26Å; I449-G451 VanDerWaalsContact C-N 3.27Å; I449-G451 PolarHBondContact O-N 3.07Å; I449-E452 PolarHBondContact O-N 3.04Å; I449-E453 HydrophobicContact CG2-CG 4.45Å; I449-E453 WeakPolarHBondContact O-CG 3.25Å; I449-E453 PolarHBondContact O-N 3.21Å
450	I	92	Very high	85.8	Confident	90 Å²	90	102.1 Å²	102.1	46%	0.462	52%	0.517	S	S	.	.	H	α-helix	trans	-60.9	-40.2	177.2	-66	167.6	0	0	0	110.4	V446 E453 C454	V446-I450 HydrophobicContact CG1-CD1 3.83Å; V446-I450 HydrophobicContact CG1-CG1 4.48Å; V446-I450 WeakPolarHBondContact O-CG1 3.28Å; V446-I450 PolarHBondContact O-N 3.04Å; I450-E453 PolarHBondContact O-N 3.16Å; I450-C454 WeakPolarHBondContact O-CB 3.49Å; I450-C454 PolarHBondContact O-N 3.31Å; I450-C454 PolarHBondContact O-SG 2.56Å; I450-C454 VanDerWaalsContact O-SG 3.41Å
451	G	90	Very high	84.1	Confident	32 Å²	32	100.5 Å²	100.5	33%	0.33	51%	0.514	S	S	.	.	H	α-helix	trans	-60.5	-44.7	175.3	0	0	0	0	0	113.1	R447 L448 I449 C454 N455	R447-G451 PolarHBondContact O-N 3.24Å; L448-G451 PolarHBondContact O-N 3.02Å; I449-G451 VanDerWaalsContact C-N 3.27Å; I449-G451 PolarHBondContact O-N 3.07Å; G451-C454 PolarHBondContact O-N 3.48Å; G451-N455 PolarHBondContact O-N 3.48Å
452	E	88.5	Confident	82.2	Confident	133 Å²	133	102.2 Å²	102.2	62%	0.621	51%	0.514	S	S	*	.	H	α-helix	trans	-65.4	-42.3	175.5	-78.3	-69.4	149.3	0	0	112.2	L448 I449 C454 N455 R456	L448-E452 PolarHBondContact O-N 3.33Å; I449-E452 PolarHBondContact O-N 3.04Å; E452-C454 PolarHBondContact O-N 3.43Å; E452-N455 PolarHBondContact O-N 2.88Å; E452-R456 WeakPolarHBondContact O-CB 3.37Å; E452-R456 PolarHBondContact O-N 2.85Å
453	E	85.6	Confident	80.3	Confident	121 Å²	121	102.8 Å²	102.8	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-63.1	-40.1	176	-74.2	-177.9	168.5	0	0	112.1	I449 I450 R456 T457	I449-E453 HydrophobicContact CG2-CG 4.45Å; I449-E453 WeakPolarHBondContact O-CG 3.25Å; I449-E453 PolarHBondContact O-N 3.21Å; I450-E453 PolarHBondContact O-N 3.16Å; E453-R456 PolarHBondContact O-N 3.25Å; E453-T457 WeakPolarHBondContact O-CG2 3.37Å; E453-T457 PolarHBondContact O-N 3.24Å; E453-T457 PolarHBondContact O-OG1 3.36Å
454	C	82	Confident	78.4	Confident	74 Å²	74	103.4 Å²	103.4	50%	0.5	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-41.8	173.5	-76.1	0	0	0	0	112	I450 G451 E452 T457 F458	I450-C454 WeakPolarHBondContact O-CB 3.49Å; I450-C454 PolarHBondContact O-N 3.31Å; I450-C454 PolarHBondContact O-SG 2.56Å; I450-C454 VanDerWaalsContact O-SG 3.41Å; G451-C454 PolarHBondContact O-N 3.48Å; E452-C454 PolarHBondContact O-N 3.43Å; C454-T457 WeakPolarHBondContact CA-OG1 3.23Å; C454-T457 PolarHBondContact O-OG1 3.43Å; C454-F458 WeakPolarHBondContact O-CB 3.39Å; C454-F458 PolarHBondContact O-N 2.86Å
455	N	80	Confident	76.4	Confident	97 Å²	97	105.4 Å²	105.4	52%	0.519	54%	0.535	S	S	.	.	H	α-helix	trans	-66.3	-41.2	177.2	-77.7	-18.1	0	0	0	111.7	G451 E452 F458 L459	G451-N455 PolarHBondContact O-N 3.48Å; E452-N455 PolarHBondContact O-N 2.88Å; N455-F458 PolarHBondContact O-N 3.25Å; N455-L459 WeakPolarHBondContact O-CG 3.39Å; N455-L459 PolarHBondContact O-N 3.08Å
456	R	74.6	Confident	74.3	Confident	168 Å²	168	109.4 Å²	109.4	63%	0.634	55%	0.554	S	S	*	*	H	α-helix	trans	-64.3	-45	178.1	-174.9	179.5	175.3	167	6.1	111.9	E452 E453 F458 L459 E460	E452-R456 WeakPolarHBondContact O-CB 3.37Å; E452-R456 PolarHBondContact O-N 2.85Å; E453-R456 PolarHBondContact O-N 3.25Å; R456-F458 VanDerWaalsContact C-N 3.28Å; R456-F458 PolarHBondContact O-N 3.31Å; R456-L459 PolarHBondContact O-N 3.34Å; R456-E460 IonicContact CZ-OE1 3.72Å; R456-E460 IonicContact NE-OE1 2.87Å; R456-E460 PolarHBondContact NE-OE1 3.2Å; R456-E460 VanDerWaalsContact NE-OE1 3.1Å; R456-E460 IonicContact NH2-OE1 2.69Å; R456-E460 WeakPolarHBondContact O-CG 3.31Å; R456-E460 PolarHBondContact O-N 2.89Å
457	T	72.4	Confident	71.7	Confident	75 Å²	75	117 Å²	117	46%	0.46	59%	0.585	S	S	.	*	H	α-helix	trans	-65.2	-33.8	176.2	47.9	0	0	0	0	111.8	E453 C454 C461	E453-T457 WeakPolarHBondContact O-CG2 3.37Å; E453-T457 PolarHBondContact O-N 3.24Å; E453-T457 PolarHBondContact O-OG1 3.36Å; C454-T457 WeakPolarHBondContact CA-OG1 3.23Å; C454-T457 PolarHBondContact O-OG1 3.43Å; T457-C461 PolarHBondContact O-N 3.44Å; T457-C461 VanDerWaalsContact O-N 3.09Å; T457-C461 PolarHBondContact O-SG 2.86Å
458	F	67.1	Low	70.7	Confident	131 Å²	131	115 Å²	115	58%	0.575	58%	0.584	S	S	*	*	H	α-helix	trans	-67.2	-39.1	173.9	-164.1	-94.1	0	0	0	113.1	C454 N455 R456 C461 Y462	C454-F458 WeakPolarHBondContact O-CB 3.39Å; C454-F458 PolarHBondContact O-N 2.86Å; N455-F458 PolarHBondContact O-N 3.25Å; R456-F458 VanDerWaalsContact C-N 3.28Å; R456-F458 PolarHBondContact O-N 3.31Å; F458-C461 PolarHBondContact O-N 3.44Å; F458-Y462 HydrophobicContact CD1-CD2 4.03Å; F458-Y462 HydrophobicContact CD1-CE2 4.12Å; F458-Y462 AromaticContact CE1-CD2 3.72Å; F458-Y462 HydrophobicContact CE1-CD2 3.72Å; F458-Y462 AromaticContact CE1-CE2 3.34Å; F458-Y462 HydrophobicContact CE1-CE2 3.34Å; F458-Y462 HydrophobicContact CZ-CD2 4.28Å; F458-Y462 AromaticContact CZ-CE2 3.6Å; F458-Y462 HydrophobicContact CZ-CE2 3.6Å; F458-Y462 PolarHBondContact O-N 3.47Å
459	L	61	Low	69.5	Low	111 Å²	111	115.5 Å²	115.5	58%	0.581	59%	0.586	S	S	*	*	H	α-helix	trans	-67.2	-42.3	173.9	-76.2	160.6	0	0	0	111.9	N455 R456 C461 Y462 D463	N455-L459 WeakPolarHBondContact O-CG 3.39Å; N455-L459 PolarHBondContact O-N 3.08Å; R456-L459 PolarHBondContact O-N 3.34Å; L459-C461 PolarHBondContact O-N 3.41Å; L459-Y462 PolarHBondContact O-N 3.14Å; L459-Y462 VanDerWaalsContact O-N 3.11Å; L459-D463 PolarHBondContact O-N 2.9Å
460	E	62.1	Low	68.1	Low	92 Å²	92	116.8 Å²	116.8	43%	0.43	59%	0.592	S	S	.	*	H	α-helix	trans	-63.7	-28.5	175.7	-72.5	173.6	-171.9	0	0	112.2	R456 N464	R456-E460 IonicContact CZ-OE1 3.72Å; R456-E460 IonicContact NE-OE1 2.87Å; R456-E460 PolarHBondContact NE-OE1 3.2Å; R456-E460 VanDerWaalsContact NE-OE1 3.1Å; R456-E460 IonicContact NH2-OE1 2.69Å; R456-E460 WeakPolarHBondContact O-CG 3.31Å; R456-E460 PolarHBondContact O-N 2.89Å; E460-N464 PolarHBondContact O-ND2 2.8Å
461	C	59	Low	66.7	Low	78 Å²	78	118.4 Å²	118.4	53%	0.527	60%	0.6	S	S	.	*	H	α-helix	trans	-73.4	-35.2	171.6	-69.9	0	0	0	0	113.1	T457 F458 L459 N464	T457-C461 PolarHBondContact O-N 3.44Å; T457-C461 VanDerWaalsContact O-N 3.09Å; T457-C461 PolarHBondContact O-SG 2.86Å; F458-C461 PolarHBondContact O-N 3.44Å; L459-C461 PolarHBondContact O-N 3.41Å; C461-N464 PolarHBondContact O-N 3.31Å
462	Y	58.2	Low	65.3	Low	142 Å²	142	123.8 Å²	123.8	56%	0.557	62%	0.617	S	S	*	*	H	α-helix	trans	-70.7	-38.3	177.3	-100.4	-93.3	0	0	0	112.7	F458 L459 N464 D465	F458-Y462 HydrophobicContact CD1-CD2 4.03Å; F458-Y462 HydrophobicContact CD1-CE2 4.12Å; F458-Y462 AromaticContact CE1-CD2 3.72Å; F458-Y462 HydrophobicContact CE1-CD2 3.72Å; F458-Y462 AromaticContact CE1-CE2 3.34Å; F458-Y462 HydrophobicContact CE1-CE2 3.34Å; F458-Y462 HydrophobicContact CZ-CD2 4.28Å; F458-Y462 AromaticContact CZ-CE2 3.6Å; F458-Y462 HydrophobicContact CZ-CE2 3.6Å; F458-Y462 PolarHBondContact O-N 3.47Å; L459-Y462 PolarHBondContact O-N 3.14Å; L459-Y462 VanDerWaalsContact O-N 3.11Å; Y462-N464 PolarHBondContact O-N 3.26Å; Y462-D465 PolarHBondContact O-N 3.2Å
463	D	55	Low	63.7	Low	120 Å²	120	123.1 Å²	123.1	64%	0.642	62%	0.616	S	S	*	*	H	α-helix	trans	-67.2	-21.3	177.4	-75	-23.9	0	0	0	112.8	L459	L459-D463 PolarHBondContact O-N 2.9Å
464	N	55.5	Low	62.2	Low	117 Å²	117	123.3 Å²	123.3	63%	0.626	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-13.4	177.1	-77.2	-58.4	0	0	0	114	E460 C461 Y462	E460-N464 PolarHBondContact O-ND2 2.8Å; C461-N464 PolarHBondContact O-N 3.31Å; Y462-N464 PolarHBondContact O-N 3.26Å
465	D	53.2	Low	60.6	Low	138 Å²	138	127.1 Å²	127.1	74%	0.738	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-8.7	178.6	-78.8	-28.4	0	0	0	112.8	Y462	Y462-D465 PolarHBondContact O-N 3.2Å
466	D	50.6	Low	59	Low	150 Å²	150	129.6 Å²	129.6	80%	0.802	64%	0.638	S	S	*	*			trans	-102.2	3.3	178.5	-86.6	-29	0	0	0	114.5
467	E	39.9	Very low	57.6	Low	233 Å²	233	126.1 Å²	126.1	100%	1.089	64%	0.639	S	S	*	*			trans	-100.8	0	166.1	-79.1	-166.8	163.1	0	0	112.1

Retrieved 467 of 467 residues in 148.5 ms (Link to these results)

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