A0A061I7P0_CRIGR Loading...

Inositol 1,4,5-trisphosphate receptor-interacting protein

Enhances Ca(2+)-mediated inhibition of inositol 1,4,5-triphosphate receptor (ITPR) Ca(2+) release.

AlphaFold DB , UniProt , Accession A0A061I7P0, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Itprip, Length 556 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	53.9	Low	54.1	Low	243 Å²	243	123.5 Å²	123.5	100%	1.197	67%	0.666	S	S	*	*				0	68.7	0	-70.4	-173	-75.7	0	0	111.2
2	A	43.6	Very low	54.4	Low	60 Å²	60	119.6 Å²	119.6	50%	0.496	65%	0.649	S	S	.	*			trans	-149.6	-4.6	165.8	0	0	0	0	0	112.6	G4 L5 F6	A2-G4 PolarHBondContact O-N 3.22Å; A2-G4 VanDerWaalsContact O-N 3.15Å; A2-L5 HydrophobicContact CB-CD1 4.33Å; A2-L5 PolarHBondContact O-N 3.35Å; A2-F6 PolarHBondContact O-N 3.49Å
3	L	50.9	Low	54.7	Low	155 Å²	155	116.7 Å²	116.7	81%	0.812	64%	0.637	S	S	*	*	H	α-helix	trans	-61.4	-13.7	163.9	-134.6	85.1	0	0	0	112.8
4	G	51.4	Low	54.8	Low	50 Å²	50	113.7 Å²	113.7	52%	0.515	63%	0.625	S	S	.	*	H	α-helix	trans	-85.5	-26.6	170.2	0	0	0	0	0	114.3	A2 V8	A2-G4 PolarHBondContact O-N 3.22Å; A2-G4 VanDerWaalsContact O-N 3.15Å; G4-V8 WeakPolarHBondContact O-CG2 3.36Å; G4-V8 PolarHBondContact O-N 3.32Å
5	L	55.6	Low	54.8	Low	121 Å²	121	110.7 Å²	110.7	63%	0.634	62%	0.621	S	S	*	*	H	α-helix	trans	-75	-36.1	179	-78.2	162.3	0	0	0	111.4	A2 R7 V8 C9	A2-L5 HydrophobicContact CB-CD1 4.33Å; A2-L5 PolarHBondContact O-N 3.35Å; L5-R7 PolarHBondContact O-N 3.19Å; L5-V8 PolarHBondContact O-N 3.21Å; L5-C9 PolarHBondContact O-N 2.71Å; L5-C9 VanDerWaalsContact O-N 3.1Å; L5-C9 PolarHBondContact O-SG 3.01Å
6	F	53.3	Low	54.8	Low	161 Å²	161	111.9 Å²	111.9	71%	0.706	62%	0.623	S	S	*	*	H	α-helix	trans	-70.4	-32.4	178.6	-143.9	-90.6	0	0	0	113	A2 C9 L10	A2-F6 PolarHBondContact O-N 3.49Å; F6-C9 PolarHBondContact O-N 3.12Å; F6-L10 PolarHBondContact O-N 3.01Å
7	R	55.5	Low	55	Low	196 Å²	196	112.8 Å²	112.8	74%	0.74	63%	0.625	S	S	*	*	H	α-helix	trans	-71.9	-30	173.5	-76.6	-169.1	176.2	-162	-0.3	112.7	L5 V11	L5-R7 PolarHBondContact O-N 3.19Å; R7-V11 WeakPolarHBondContact O-CG2 3.42Å; R7-V11 PolarHBondContact O-N 3.38Å
8	V	57	Low	54.6	Low	90 Å²	90	113.6 Å²	113.6	55%	0.545	63%	0.628	S	S	.	*	H	α-helix	trans	-70.6	-39.7	173	173.7	0	0	0	0	111	G4 L5 L10 V11 V12	G4-V8 WeakPolarHBondContact O-CG2 3.36Å; G4-V8 PolarHBondContact O-N 3.32Å; L5-V8 PolarHBondContact O-N 3.21Å; V8-L10 PolarHBondContact O-N 2.72Å; V8-V11 PolarHBondContact O-N 2.66Å; V8-V12 HydrophobicContact CG1-CG2 4.48Å; V8-V12 VanDerWaalsContact O-CG2 3.28Å; V8-V12 WeakPolarHBondContact O-CG2 3.04Å; V8-V12 PolarHBondContact O-N 3.08Å
9	C	55.4	Low	53.8	Low	79 Å²	79	116.8 Å²	116.8	53%	0.534	64%	0.638	S	S	.	*	H	α-helix	trans	-64.3	-36.5	176.2	-69.4	0	0	0	0	113.4	L5 F6 V12 V13	L5-C9 PolarHBondContact O-N 2.71Å; L5-C9 VanDerWaalsContact O-N 3.1Å; L5-C9 PolarHBondContact O-SG 3.01Å; F6-C9 PolarHBondContact O-N 3.12Å; C9-V12 PolarHBondContact O-N 3.48Å; C9-V13 WeakPolarHBondContact O-CG2 3.29Å; C9-V13 PolarHBondContact O-N 3.37Å
10	L	59.8	Low	53.4	Low	105 Å²	105	115.9 Å²	115.9	55%	0.55	64%	0.638	S	S	.	*	H	α-helix	trans	-73.1	-32.2	179	-128.5	145	0	0	0	112.7	F6 V8 T14	F6-L10 PolarHBondContact O-N 3.01Å; V8-L10 PolarHBondContact O-N 2.72Å; L10-T14 PolarHBondContact O-N 3.28Å; L10-T14 VanDerWaalsContact O-N 3.1Å; L10-T14 PolarHBondContact O-OG1 2.79Å
11	V	59	Low	52.5	Low	98 Å²	98	117.3 Å²	117.3	59%	0.594	64%	0.644	S	S	*	*	H	α-helix	trans	-71.1	-33.8	171.1	175.5	0	0	0	0	111.8	R7 V8 T14 A15	R7-V11 WeakPolarHBondContact O-CG2 3.42Å; R7-V11 PolarHBondContact O-N 3.38Å; V8-V11 PolarHBondContact O-N 2.66Å; V11-T14 WeakPolarHBondContact CA-OG1 3.19Å; V11-T14 PolarHBondContact O-OG1 2.99Å; V11-A15 WeakPolarHBondContact O-CB 3.29Å; V11-A15 PolarHBondContact O-N 3.08Å
12	V	57.7	Low	51.6	Low	77 Å²	77	111.8 Å²	111.8	47%	0.467	62%	0.618	S	S	.	*	H	α-helix	trans	-68.9	-40.6	174.4	171.9	0	0	0	0	111.5	V8 C9 A15 I16	V8-V12 HydrophobicContact CG1-CG2 4.48Å; V8-V12 VanDerWaalsContact O-CG2 3.28Å; V8-V12 WeakPolarHBondContact O-CG2 3.04Å; V8-V12 PolarHBondContact O-N 3.08Å; C9-V12 PolarHBondContact O-N 3.48Å; V12-A15 PolarHBondContact O-N 3.05Å; V12-I16 HydrophobicContact CG1-CD1 3.88Å; V12-I16 WeakPolarHBondContact O-CD1 3.31Å; V12-I16 VanDerWaalsContact O-CG1 3.23Å; V12-I16 WeakPolarHBondContact O-CG1 3.48Å; V12-I16 PolarHBondContact O-N 3.22Å
13	V	57.9	Low	51	Low	82 Å²	82	117.5 Å²	117.5	50%	0.497	63%	0.632	S	S	.	*	H	α-helix	trans	-67.2	-38.4	176.3	173.2	0	0	0	0	111.5	C9 I16 I17	C9-V13 WeakPolarHBondContact O-CG2 3.29Å; C9-V13 PolarHBondContact O-N 3.37Å; V13-I16 PolarHBondContact O-N 3.4Å; V13-I17 HydrophobicContact CG1-CD1 4.03Å; V13-I17 WeakPolarHBondContact O-CD1 3.49Å; V13-I17 VanDerWaalsContact O-CG1 3.31Å; V13-I17 WeakPolarHBondContact O-CG1 3.41Å; V13-I17 PolarHBondContact O-N 2.63Å
14	T	55.8	Low	50.5	Low	75 Å²	75	115.6 Å²	115.6	46%	0.46	63%	0.63	S	S	.	*	H	α-helix	trans	-75.5	-23.4	176.3	45.5	0	0	0	0	113.4	L10 V11 N18	L10-T14 PolarHBondContact O-N 3.28Å; L10-T14 VanDerWaalsContact O-N 3.1Å; L10-T14 PolarHBondContact O-OG1 2.79Å; V11-T14 WeakPolarHBondContact CA-OG1 3.19Å; V11-T14 PolarHBondContact O-OG1 2.99Å; T14-N18 WeakPolarHBondContact O-CB 3.5Å
15	A	54.9	Low	49.6	Very low	68 Å²	68	123.8 Å²	123.8	56%	0.562	65%	0.645	S	S	*	*	H	α-helix	trans	-77.5	-28.4	170.5	0	0	0	0	0	113.3	V11 V12	V11-A15 WeakPolarHBondContact O-CB 3.29Å; V11-A15 PolarHBondContact O-N 3.08Å; V12-A15 PolarHBondContact O-N 3.05Å
16	I	55.7	Low	48.5	Very low	130 Å²	130	126.9 Å²	126.9	67%	0.667	66%	0.656	S	S	*	*	H	α-helix	trans	-73.2	-30.4	174.1	-69.6	164.2	0	0	0	111.4	V12 V13 N18	V12-I16 HydrophobicContact CG1-CD1 3.88Å; V12-I16 WeakPolarHBondContact O-CD1 3.31Å; V12-I16 VanDerWaalsContact O-CG1 3.23Å; V12-I16 WeakPolarHBondContact O-CG1 3.48Å; V12-I16 PolarHBondContact O-N 3.22Å; V13-I16 PolarHBondContact O-N 3.4Å; I16-N18 VanDerWaalsContact C-N 3.34Å
17	I	57.3	Low	47.7	Very low	128 Å²	128	126.2 Å²	126.2	66%	0.656	66%	0.66	S	S	*	*	S	Bend	trans	-80.7	-15	-178.9	-66.9	168.1	0	0	0	112.1	V13	V13-I17 HydrophobicContact CG1-CD1 4.03Å; V13-I17 WeakPolarHBondContact O-CD1 3.49Å; V13-I17 VanDerWaalsContact O-CG1 3.31Å; V13-I17 WeakPolarHBondContact O-CG1 3.41Å; V13-I17 PolarHBondContact O-N 2.63Å
18	N	48.6	Very low	46.6	Very low	127 Å²	127	121.2 Å²	121.2	68%	0.679	66%	0.66	S	S	*	*	S	Bend	trans	-136.2	46.3	-161.8	-131.6	2.5	0	0	0	116.6	T14 I16	T14-N18 WeakPolarHBondContact O-CB 3.5Å; I16-N18 VanDerWaalsContact C-N 3.34Å
19	H	39.4	Very low	46	Very low	174 Å²	174	123.1 Å²	123.1	81%	0.806	67%	0.672	S	S	*	*			trans	-169.7	161.5	146.2	-108.8	-60.1	0	0	0	112.5
20	P	46	Very low	45.8	Very low	98 Å²	98	125.9 Å²	125.9	64%	0.636	69%	0.686	S	S	*	*			trans	-108.9	-179.3	-138.6	14.8	14	0	0	0	109.7
21	L	33.9	Very low	45.5	Very low	147 Å²	147	125.5 Å²	125.5	77%	0.77	69%	0.69	S	S	*	*			trans	129.3	98.9	158	-65.3	169.5	0	0	0	111
22	L	34.1	Very low	45	Very low	126 Å²	126	129.7 Å²	129.7	66%	0.66	70%	0.704	S	S	*	*				88.9	125.5	106.9	-68.6	175.9	0	0	0	111.2
23	F	31.2	Very low	45	Very low	180 Å²	180	131 Å²	131	79%	0.789	71%	0.708	S	S	*	*				-171.1	175.1	65.8	-84.5	-82.1	0	0	0	109.9
24	P	40.6	Very low	45.1	Very low	116 Å²	116	134.7 Å²	134.7	75%	0.753	72%	0.72	S	S	*	*			cis	-131.7	170.8	-12.1	22.4	2	0	0	0	114.4
25	R	32.6	Very low	45.7	Very low	222 Å²	222	139 Å²	139	84%	0.838	74%	0.735	S	S	*	*			trans	-63.9	135.5	167.3	-144.9	179.9	-173.8	177.7	0.4	110.7
26	E	33.4	Very low	46.3	Very low	186 Å²	186	140.6 Å²	140.6	87%	0.869	73%	0.731	S	S	*	*				-174.9	139.1	121.6	-100.9	165.6	-174.4	0	0	114
27	N	35.9	Very low	47.1	Very low	147 Å²	147	140 Å²	140	79%	0.786	73%	0.727	S	S	*	*			trans	-56.2	149.2	-167.7	-51.3	-47.8	0	0	0	117.9
28	A	33.4	Very low	48	Very low	91 Å²	91	138.1 Å²	138.1	75%	0.752	72%	0.718	S	S	*	*				163.1	116.6	105.8	0	0	0	0	0	114
29	T	44.2	Very low	49.5	Very low	130 Å²	130	138.9 Å²	138.9	80%	0.798	71%	0.711	S	S	*	*			trans	29.9	115.6	145.4	54.4	0	0	0	0	123.5
30	V	50.3	Low	51.4	Low	136 Å²	136	137 Å²	137	82%	0.824	70%	0.701	S	S	*	*				31.6	148.8	122.5	-179.7	0	0	0	0	119.7
31	P	53.9	Low	52.7	Low	98 Å²	98	138.2 Å²	138.2	64%	0.636	70%	0.699	S	S	*	*			cis	-141.7	174.2	17.3	19	9.5	0	0	0	120.9
32	E	47.8	Very low	55	Low	186 Å²	186	137 Å²	137	87%	0.869	69%	0.689	S	S	*	*			trans	70.1	108.8	134.7	-72.7	166.3	-174.8	0	0	124.8
33	N	57.5	Low	57.3	Low	105 Å²	105	136.8 Å²	136.8	56%	0.561	69%	0.685	S	S	*	*				176.7	86.4	116.7	-168.4	17.4	0	0	0	110.6
34	E	61.4	Low	59.6	Low	158 Å²	158	133.9 Å²	133.9	74%	0.738	67%	0.674	S	S	*	*			trans	-91.3	-26.3	-167.5	-68	-179.8	164.2	0	0	115	E36 I37 I38	E34-E36 PolarHBondContact O-N 2.93Å; E34-I37 PolarHBondContact O-N 3.45Å; E34-I38 WeakPolarHBondContact O-CG1 3.5Å; E34-I38 PolarHBondContact O-N 3.17Å
35	E	67.7	Low	61.6	Low	167 Å²	167	133.4 Å²	133.4	78%	0.78	66%	0.661	S	S	*	*	H	α-helix	trans	-70.7	-31.9	-170.1	-69.5	-178	162.4	0	0	113.4	I37 I38 R39	E35-I37 VanDerWaalsContact C-N 3.35Å; E35-I38 PolarHBondContact O-N 3.28Å; E35-R39 PolarHBondContact O-N 2.94Å
36	E	67.5	Low	64.2	Low	101 Å²	101	129.4 Å²	129.4	47%	0.472	65%	0.652	S	S	.	*	H	α-helix	trans	-76.2	-25.1	-178.4	-163.2	160.7	-163	0	0	112.9	E34	E34-E36 PolarHBondContact O-N 2.93Å
37	I	72.1	Confident	66.8	Low	116 Å²	116	126.8 Å²	126.8	60%	0.595	64%	0.638	S	S	*	*	H	α-helix	trans	-72.9	-43.1	174.4	-62.1	175.7	0	0	0	109.7	E34 E35 R39 K40 M41	E34-I37 PolarHBondContact O-N 3.45Å; E35-I37 VanDerWaalsContact C-N 3.35Å; I37-R39 PolarHBondContact O-N 3.27Å; I37-K40 PolarHBondContact O-N 3.18Å; I37-M41 WeakPolarHBondContact O-CB 3.41Å; I37-M41 PolarHBondContact O-N 3.15Å; I37-M41 VanDerWaalsContact O-N 3.07Å
38	I	76.3	Confident	69.1	Low	90 Å²	90	123.8 Å²	123.8	46%	0.462	62%	0.622	S	S	.	*	H	α-helix	trans	-62.3	-43.1	-177.2	-65.8	167.6	0	0	0	111.4	E34 E35 M41 Q42	E34-I38 WeakPolarHBondContact O-CG1 3.5Å; E34-I38 PolarHBondContact O-N 3.17Å; E35-I38 PolarHBondContact O-N 3.28Å; I38-M41 WeakPolarHBondContact O-CB 3.27Å; I38-M41 PolarHBondContact O-N 3.12Å; I38-Q42 PolarHBondContact O-N 3.1Å
39	R	79.3	Confident	71.6	Confident	143 Å²	143	124.4 Å²	124.4	54%	0.54	61%	0.609	S	S	.	*	H	α-helix	trans	-66.1	-43.6	-178.8	-171.9	-178.9	60.7	157.5	-2.5	112.9	E35 I37 M41 Q42 E43	E35-R39 PolarHBondContact O-N 2.94Å; I37-R39 PolarHBondContact O-N 3.27Å; R39-M41 PolarHBondContact O-N 3.27Å; R39-Q42 PolarHBondContact O-N 3.11Å; R39-E43 PolarHBondContact O-N 3.49Å; R39-E43 VanDerWaalsContact O-N 3.14Å
40	K	79.5	Confident	73.8	Confident	135 Å²	135	124.2 Å²	124.2	59%	0.587	60%	0.602	S	S	*	*	H	α-helix	trans	-64.2	-32.5	175.8	-75.6	-177	177.5	172.4	0	111.8	I37 H44	I37-K40 PolarHBondContact O-N 3.18Å; K40-H44 WeakPolarHBondContact O-CB 3.37Å; K40-H44 PolarHBondContact O-N 3.4Å; K40-H44 VanDerWaalsContact O-N 3.14Å
41	M	74.4	Confident	75.4	Confident	122 Å²	122	122.6 Å²	122.6	60%	0.601	59%	0.586	S	S	*	*	H	α-helix	trans	-68.2	-38.3	176.5	-150.4	173.8	75.5	0	0	111.7	I37 I38 R39 Q45	I37-M41 WeakPolarHBondContact O-CB 3.41Å; I37-M41 PolarHBondContact O-N 3.15Å; I37-M41 VanDerWaalsContact O-N 3.07Å; I38-M41 WeakPolarHBondContact O-CB 3.27Å; I38-M41 PolarHBondContact O-N 3.12Å; R39-M41 PolarHBondContact O-N 3.27Å; M41-Q45 WeakPolarHBondContact O-CB 3.48Å; M41-Q45 PolarHBondContact O-N 3.25Å
42	Q	82.4	Confident	76.7	Confident	121 Å²	121	124.4 Å²	124.4	57%	0.565	59%	0.586	S	S	*	*	H	α-helix	trans	-67.6	-47	175.7	-81.2	-178.8	-41	0	0	113.1	I38 R39 H44 Q45 E46	I38-Q42 PolarHBondContact O-N 3.1Å; R39-Q42 PolarHBondContact O-N 3.11Å; Q42-H44 VanDerWaalsContact C-N 3.26Å; Q42-H44 PolarHBondContact O-N 2.89Å; Q42-Q45 WeakPolarHBondContact O-CB 3.3Å; Q42-Q45 PolarHBondContact O-N 3.33Å; Q42-Q45 VanDerWaalsContact O-N 3.1Å; Q42-E46 PolarHBondContact O-N 2.83Å
43	E	82.4	Confident	78.7	Confident	123 Å²	123	120.8 Å²	120.8	58%	0.575	57%	0.572	S	S	*	*	H	α-helix	trans	-61.5	-37.1	177.2	-74.1	178.2	179.1	0	0	111.9	R39 Q45 K47	R39-E43 PolarHBondContact O-N 3.49Å; R39-E43 VanDerWaalsContact O-N 3.14Å; E43-Q45 VanDerWaalsContact C-N 3.35Å; E43-K47 WeakPolarHBondContact O-CB 3.05Å; E43-K47 PolarHBondContact O-N 2.75Å; E43-K47 VanDerWaalsContact O-N 3.16Å
44	H	79.1	Confident	80.2	Confident	118 Å²	118	123.8 Å²	123.8	55%	0.546	58%	0.575	S	S	.	*	H	α-helix	trans	-67.5	-37.1	175.6	-166.7	58.8	0	0	0	112.2	K40 Q42 K47 L48	K40-H44 WeakPolarHBondContact O-CB 3.37Å; K40-H44 PolarHBondContact O-N 3.4Å; K40-H44 VanDerWaalsContact O-N 3.14Å; Q42-H44 VanDerWaalsContact C-N 3.26Å; Q42-H44 PolarHBondContact O-N 2.89Å; H44-K47 PolarHBondContact O-N 3.49Å; H44-L48 WeakPolarHBondContact O-CB 3.18Å; H44-L48 WeakPolarHBondContact O-CG 3.39Å; H44-L48 PolarHBondContact O-N 2.97Å
45	Q	82.3	Confident	81.4	Confident	106 Å²	106	121.1 Å²	121.1	50%	0.495	57%	0.566	S	S	.	*	H	α-helix	trans	-67.7	-42.7	178.3	-173.1	173.6	-35.5	0	0	112.2	M41 Q42 E43 K47 L48 Q49	M41-Q45 WeakPolarHBondContact O-CB 3.48Å; M41-Q45 PolarHBondContact O-N 3.25Å; Q42-Q45 WeakPolarHBondContact O-CB 3.3Å; Q42-Q45 PolarHBondContact O-N 3.33Å; Q42-Q45 VanDerWaalsContact O-N 3.1Å; E43-Q45 VanDerWaalsContact C-N 3.35Å; Q45-K47 VanDerWaalsContact C-N 3.34Å; Q45-L48 PolarHBondContact O-N 3.42Å; Q45-Q49 WeakPolarHBondContact O-CG 3.16Å; Q45-Q49 PolarHBondContact O-N 3.28Å
46	E	87.6	Confident	82.3	Confident	138 Å²	138	119.6 Å²	119.6	65%	0.645	56%	0.559	S	S	*	*	H	α-helix	trans	-64.7	-40	176	-71.3	-175.7	172.6	0	0	111.7	Q42 L48 Q49 L50	Q42-E46 PolarHBondContact O-N 2.83Å; E46-L48 VanDerWaalsContact C-N 3.35Å; E46-L48 PolarHBondContact O-N 3.38Å; E46-Q49 PolarHBondContact O-N 3.23Å; E46-L50 PolarHBondContact O-N 2.91Å
47	K	88.6	Confident	83.3	Confident	132 Å²	132	120.7 Å²	120.7	57%	0.574	56%	0.563	S	S	*	*	H	α-helix	trans	-62.9	-41.9	176.1	-171.3	178.5	177.1	-175.2	0	112	E43 H44 Q45 L50 E51	E43-K47 WeakPolarHBondContact O-CB 3.05Å; E43-K47 PolarHBondContact O-N 2.75Å; E43-K47 VanDerWaalsContact O-N 3.16Å; H44-K47 PolarHBondContact O-N 3.49Å; Q45-K47 VanDerWaalsContact C-N 3.34Å; K47-L50 PolarHBondContact O-N 2.94Å; K47-E51 PolarHBondContact O-N 3.46Å; K47-E51 VanDerWaalsContact O-N 3.09Å
48	L	83.2	Confident	83.9	Confident	84 Å²	84	119.1 Å²	119.1	44%	0.44	55%	0.554	S	S	.	*	H	α-helix	trans	-64.7	-40	176	-78.3	167.3	0	0	0	112	H44 Q45 E46 L50 E51 Q52	H44-L48 WeakPolarHBondContact O-CB 3.18Å; H44-L48 WeakPolarHBondContact O-CG 3.39Å; H44-L48 PolarHBondContact O-N 2.97Å; Q45-L48 PolarHBondContact O-N 3.42Å; E46-L48 VanDerWaalsContact C-N 3.35Å; E46-L48 PolarHBondContact O-N 3.38Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-L50 PolarHBondContact O-N 3.22Å; L48-E51 PolarHBondContact O-N 3.17Å; L48-Q52 WeakPolarHBondContact O-CB 3.36Å; L48-Q52 PolarHBondContact O-N 3.13Å
49	Q	86.3	Confident	84.4	Confident	104 Å²	104	119 Å²	119	49%	0.486	56%	0.557	S	S	.	*	H	α-helix	trans	-64.7	-38.8	177.2	-75.7	-177.3	-22.6	0	0	112.1	Q45 E46 Q52 L53	Q45-Q49 WeakPolarHBondContact O-CG 3.16Å; Q45-Q49 PolarHBondContact O-N 3.28Å; E46-Q49 PolarHBondContact O-N 3.23Å; Q49-Q52 PolarHBondContact O-N 3.4Å; Q49-L53 WeakPolarHBondContact O-CG 3.25Å; Q49-L53 PolarHBondContact O-N 3.49Å; Q49-L53 VanDerWaalsContact O-N 3.07Å
50	L	89.3	Confident	84.6	Confident	126 Å²	126	115.3 Å²	115.3	66%	0.66	55%	0.553	S	S	*	*	H	α-helix	trans	-67.5	-42.3	177	-164.9	79.6	0	0	0	112.1	E46 K47 L48 Q52 L53 R54	E46-L50 PolarHBondContact O-N 2.91Å; K47-L50 PolarHBondContact O-N 2.94Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-L50 PolarHBondContact O-N 3.22Å; L50-Q52 VanDerWaalsContact C-N 3.33Å; L50-L53 PolarHBondContact O-N 3.36Å; L50-R54 PolarHBondContact O-N 3.16Å; L50-R54 VanDerWaalsContact O-N 3.1Å
51	E	85.3	Confident	84.9	Confident	102 Å²	102	114.9 Å²	114.9	48%	0.477	55%	0.553	S	S	.	*	H	α-helix	trans	-65.1	-36.9	174.9	-79.2	-176.3	-175	0	0	111.9	K47 L48 R54 L55	K47-E51 PolarHBondContact O-N 3.46Å; K47-E51 VanDerWaalsContact O-N 3.09Å; L48-E51 PolarHBondContact O-N 3.17Å; E51-R54 PolarHBondContact O-N 2.93Å; E51-L55 WeakPolarHBondContact O-CB 3.28Å; E51-L55 WeakPolarHBondContact O-CG 3.29Å; E51-L55 PolarHBondContact O-N 2.78Å
52	Q	81.6	Confident	85.3	Confident	136 Å²	136	113.9 Å²	113.9	64%	0.636	55%	0.55	S	S	*	.	H	α-helix	trans	-60.7	-48.5	174.2	-104	-171.6	-54.1	0	0	112.2	L48 Q49 L50 R54 L55 E56	L48-Q52 WeakPolarHBondContact O-CB 3.36Å; L48-Q52 PolarHBondContact O-N 3.13Å; Q49-Q52 PolarHBondContact O-N 3.4Å; L50-Q52 VanDerWaalsContact C-N 3.33Å; Q52-R54 VanDerWaalsContact C-N 3.3Å; Q52-R54 PolarHBondContact O-N 2.83Å; Q52-L55 PolarHBondContact O-N 2.83Å; Q52-E56 WeakPolarHBondContact O-CB 3.12Å; Q52-E56 PolarHBondContact O-N 3.07Å
53	L	89	Confident	85.5	Confident	110 Å²	110	111.4 Å²	111.4	58%	0.576	54%	0.543	S	S	*	.	H	α-helix	trans	-62.2	-40.1	179.6	-72.9	171.2	0	0	0	111.7	Q49 L50 E56 E57	Q49-L53 WeakPolarHBondContact O-CG 3.25Å; Q49-L53 PolarHBondContact O-N 3.49Å; Q49-L53 VanDerWaalsContact O-N 3.07Å; L50-L53 PolarHBondContact O-N 3.36Å; L53-E56 PolarHBondContact O-N 3.38Å; L53-E57 PolarHBondContact O-N 3.09Å; L53-E57 VanDerWaalsContact O-N 3.09Å
54	R	89.3	Confident	85.6	Confident	167 Å²	167	108.2 Å²	108.2	63%	0.63	54%	0.537	S	S	*	.	H	α-helix	trans	-64.1	-44.7	176.5	-177	-178.4	172.2	168	3.4	112.1	L50 E51 Q52 E56 E57 E58	L50-R54 PolarHBondContact O-N 3.16Å; L50-R54 VanDerWaalsContact O-N 3.1Å; E51-R54 PolarHBondContact O-N 2.93Å; Q52-R54 VanDerWaalsContact C-N 3.3Å; Q52-R54 PolarHBondContact O-N 2.83Å; R54-E56 VanDerWaalsContact C-N 3.31Å; R54-E56 PolarHBondContact O-N 3.47Å; R54-E57 PolarHBondContact O-N 2.91Å; R54-E58 IonicContact CZ-OE1 3.73Å; R54-E58 IonicContact NE-OE1 3.04Å; R54-E58 PolarHBondContact NE-OE1 3.32Å; R54-E58 IonicContact NH2-OE1 3.24Å; R54-E58 PolarHBondContact O-N 2.95Å
55	L	86.9	Confident	85.6	Confident	103 Å²	103	108.3 Å²	108.3	54%	0.539	54%	0.538	S	S	.	.	H	α-helix	trans	-65.4	-36.5	178.2	-76.1	167.2	0	0	0	111.6	E51 Q52 E57 E58 V59	E51-L55 WeakPolarHBondContact O-CB 3.28Å; E51-L55 WeakPolarHBondContact O-CG 3.29Å; E51-L55 PolarHBondContact O-N 2.78Å; Q52-L55 PolarHBondContact O-N 2.83Å; L55-E57 VanDerWaalsContact C-N 3.35Å; L55-E58 PolarHBondContact O-N 2.89Å; L55-V59 WeakPolarHBondContact O-CB 3.07Å; L55-V59 VanDerWaalsContact O-CG2 3.22Å; L55-V59 WeakPolarHBondContact O-CG2 3.32Å; L55-V59 PolarHBondContact O-N 3.09Å
56	E	86	Confident	85.4	Confident	135 Å²	135	110.1 Å²	110.1	63%	0.631	54%	0.544	S	S	*	.	H	α-helix	trans	-65.6	-39.1	177.4	-164.5	166.6	-163.5	0	0	111.6	Q52 L53 R54 S60	Q52-E56 WeakPolarHBondContact O-CB 3.12Å; Q52-E56 PolarHBondContact O-N 3.07Å; L53-E56 PolarHBondContact O-N 3.38Å; R54-E56 VanDerWaalsContact C-N 3.31Å; R54-E56 PolarHBondContact O-N 3.47Å; E56-S60 WeakPolarHBondContact O-CB 3.38Å; E56-S60 PolarHBondContact O-N 3.36Å
57	E	88.1	Confident	85	Confident	123 Å²	123	109 Å²	109	58%	0.575	54%	0.539	S	S	*	.	H	α-helix	trans	-66.1	-46.2	174	-167.1	172.4	-172	0	0	112	L53 R54 L55 V59 S60 Q61	L53-E57 PolarHBondContact O-N 3.09Å; L53-E57 VanDerWaalsContact O-N 3.09Å; R54-E57 PolarHBondContact O-N 2.91Å; L55-E57 VanDerWaalsContact C-N 3.35Å; E57-V59 VanDerWaalsContact C-N 3.33Å; E57-V59 PolarHBondContact O-N 3.45Å; E57-S60 PolarHBondContact O-N 3.16Å; E57-S60 PolarHBondContact O-OG 3.46Å; E57-Q61 PolarHBondContact O-N 3.02Å
58	E	85.9	Confident	84.4	Confident	84 Å²	84	105.6 Å²	105.6	39%	0.393	54%	0.535	S	S	.	.	H	α-helix	trans	-62.1	-38.6	176.9	-73.3	178	-167.6	0	0	111.9	R54 L55 L62	R54-E58 IonicContact CZ-OE1 3.73Å; R54-E58 IonicContact NE-OE1 3.04Å; R54-E58 PolarHBondContact NE-OE1 3.32Å; R54-E58 IonicContact NH2-OE1 3.24Å; R54-E58 PolarHBondContact O-N 2.95Å; L55-E58 PolarHBondContact O-N 2.89Å; E58-L62 WeakPolarHBondContact O-CG 3.39Å; E58-L62 PolarHBondContact O-N 3.44Å; E58-L62 VanDerWaalsContact O-N 3.16Å
59	V	87.1	Confident	83.8	Confident	86 Å²	86	106.5 Å²	106.5	52%	0.521	54%	0.54	S	S	.	.	H	α-helix	trans	-67.2	-41.9	175.1	170.1	0	0	0	0	111.2	L55 E57 Q61 L62 V63	L55-V59 WeakPolarHBondContact O-CB 3.07Å; L55-V59 VanDerWaalsContact O-CG2 3.22Å; L55-V59 WeakPolarHBondContact O-CG2 3.32Å; L55-V59 PolarHBondContact O-N 3.09Å; E57-V59 VanDerWaalsContact C-N 3.33Å; E57-V59 PolarHBondContact O-N 3.45Å; V59-Q61 VanDerWaalsContact C-N 3.33Å; V59-Q61 PolarHBondContact O-N 2.88Å; V59-L62 PolarHBondContact O-N 3.15Å; V59-V63 HydrophobicContact CG1-CG2 4.28Å; V59-V63 VanDerWaalsContact O-CG2 3.3Å; V59-V63 WeakPolarHBondContact O-CG2 3.5Å; V59-V63 PolarHBondContact O-N 3.33Å
60	S	83.4	Confident	83.1	Confident	67 Å²	67	107.2 Å²	107.2	47%	0.469	54%	0.544	S	S	.	.	H	α-helix	trans	-62.4	-39.2	179.1	74	0	0	0	0	112.5	E56 E57 V63 A64	E56-S60 WeakPolarHBondContact O-CB 3.38Å; E56-S60 PolarHBondContact O-N 3.36Å; E57-S60 PolarHBondContact O-N 3.16Å; E57-S60 PolarHBondContact O-OG 3.46Å; S60-V63 PolarHBondContact O-N 3.38Å; S60-A64 PolarHBondContact O-N 3.26Å; S60-A64 VanDerWaalsContact O-N 3.09Å
61	Q	84.9	Confident	82.1	Confident	125 Å²	125	107.5 Å²	107.5	58%	0.584	54%	0.542	S	S	*	.	H	α-helix	trans	-65.9	-43.7	175.3	-77.7	-177	1.9	0	0	112.1	E57 V59 V63 A64 E65	E57-Q61 PolarHBondContact O-N 3.02Å; V59-Q61 VanDerWaalsContact C-N 3.33Å; V59-Q61 PolarHBondContact O-N 2.88Å; Q61-V63 VanDerWaalsContact C-N 3.31Å; Q61-V63 PolarHBondContact O-N 3.18Å; Q61-A64 PolarHBondContact O-N 2.86Å; Q61-E65 WeakPolarHBondContact O-CB 3.21Å; Q61-E65 PolarHBondContact O-N 3.37Å
62	L	82.9	Confident	81.3	Confident	102 Å²	102	105.2 Å²	105.2	53%	0.534	54%	0.54	S	S	.	.	H	α-helix	trans	-67.2	-31.5	179	-73.2	172.1	0	0	0	112.9	E58 V59 K66	E58-L62 WeakPolarHBondContact O-CG 3.39Å; E58-L62 PolarHBondContact O-N 3.44Å; E58-L62 VanDerWaalsContact O-N 3.16Å; V59-L62 PolarHBondContact O-N 3.15Å; L62-K66 WeakPolarHBondContact O-CB 3.44Å; L62-K66 WeakPolarHBondContact O-CG 3.41Å; L62-K66 PolarHBondContact O-N 2.8Å; L62-K66 VanDerWaalsContact O-N 3.17Å
63	V	87	Confident	80.5	Confident	68 Å²	68	104.2 Å²	104.2	41%	0.412	54%	0.539	S	S	.	.	H	α-helix	trans	-69	-47.6	174	171.5	0	0	0	0	110	V59 S60 Q61 E65 K66 E67	V59-V63 HydrophobicContact CG1-CG2 4.28Å; V59-V63 VanDerWaalsContact O-CG2 3.3Å; V59-V63 WeakPolarHBondContact O-CG2 3.5Å; V59-V63 PolarHBondContact O-N 3.33Å; S60-V63 PolarHBondContact O-N 3.38Å; Q61-V63 VanDerWaalsContact C-N 3.31Å; Q61-V63 PolarHBondContact O-N 3.18Å; V63-E65 PolarHBondContact O-N 2.95Å; V63-K66 PolarHBondContact O-N 2.78Å; V63-E67 HydrophobicContact CG1-CG 4.4Å; V63-E67 WeakPolarHBondContact O-CG 3.49Å; V63-E67 PolarHBondContact O-N 3.37Å
64	A	83.3	Confident	79.3	Confident	56 Å²	56	104.5 Å²	104.5	46%	0.463	54%	0.537	S	S	.	.	H	α-helix	trans	-62.8	-39.2	178.7	0	0	0	0	0	112.8	S60 Q61 E67 A68	S60-A64 PolarHBondContact O-N 3.26Å; S60-A64 VanDerWaalsContact O-N 3.09Å; Q61-A64 PolarHBondContact O-N 2.86Å; A64-E67 PolarHBondContact O-N 3.38Å; A64-A68 WeakPolarHBondContact O-CB 3.26Å; A64-A68 PolarHBondContact O-N 2.7Å
65	E	80.6	Confident	77.9	Confident	120 Å²	120	102.8 Å²	102.8	56%	0.561	54%	0.537	S	S	*	.	H	α-helix	trans	-65.7	-38.8	176.2	-172.2	178.5	-176.3	0	0	111.8	Q61 V63 L69	Q61-E65 WeakPolarHBondContact O-CB 3.21Å; Q61-E65 PolarHBondContact O-N 3.37Å; V63-E65 PolarHBondContact O-N 2.95Å; E65-L69 HydrophobicContact CG-CD1 4.3Å; E65-L69 WeakPolarHBondContact O-CB 3.38Å; E65-L69 WeakPolarHBondContact O-CG 3.11Å; E65-L69 PolarHBondContact O-N 2.76Å; E65-L69 VanDerWaalsContact O-N 3.09Å
66	K	77.5	Confident	76.5	Confident	145 Å²	145	103.4 Å²	103.4	63%	0.63	54%	0.54	S	S	*	.	H	α-helix	trans	-70.1	-39.9	176	-80	-172.9	175.5	-173	0	113.1	L62 V63 L69 Q70	L62-K66 WeakPolarHBondContact O-CB 3.44Å; L62-K66 WeakPolarHBondContact O-CG 3.41Å; L62-K66 PolarHBondContact O-N 2.8Å; L62-K66 VanDerWaalsContact O-N 3.17Å; V63-K66 PolarHBondContact O-N 2.78Å; K66-L69 PolarHBondContact O-N 3.5Å; K66-Q70 WeakPolarHBondContact O-CG 3.29Å; K66-Q70 PolarHBondContact O-N 3.4Å
67	E	77.9	Confident	75	Confident	115 Å²	115	102.8 Å²	102.8	54%	0.537	54%	0.537	S	S	.	.	H	α-helix	trans	-63.5	-43.8	176.3	-74.5	176.8	171.3	0	0	110.6	V63 A64 L69 Q70 E71	V63-E67 HydrophobicContact CG1-CG 4.4Å; V63-E67 WeakPolarHBondContact O-CG 3.49Å; V63-E67 PolarHBondContact O-N 3.37Å; A64-E67 PolarHBondContact O-N 3.38Å; E67-L69 VanDerWaalsContact C-N 3.35Å; E67-L69 PolarHBondContact O-N 3.28Å; E67-Q70 PolarHBondContact O-N 3.46Å; E67-E71 PolarHBondContact O-N 2.82Å
68	A	76.6	Confident	73.5	Confident	59 Å²	59	103.5 Å²	103.5	49%	0.488	54%	0.541	S	S	.	.	H	α-helix	trans	-64.2	-36.1	176.2	0	0	0	0	0	113.3	A64 A72	A64-A68 WeakPolarHBondContact O-CB 3.26Å; A64-A68 PolarHBondContact O-N 2.7Å; A68-A72 WeakPolarHBondContact O-CB 3.19Å; A68-A72 PolarHBondContact O-N 3.19Å
69	L	71.9	Confident	72.1	Confident	104 Å²	104	105 Å²	105	55%	0.545	55%	0.548	S	S	.	.	H	α-helix	trans	-69.2	-37.2	174	-81.6	162.3	0	0	0	112.2	E65 K66 E67 D73	E65-L69 HydrophobicContact CG-CD1 4.3Å; E65-L69 WeakPolarHBondContact O-CB 3.38Å; E65-L69 WeakPolarHBondContact O-CG 3.11Å; E65-L69 PolarHBondContact O-N 2.76Å; E65-L69 VanDerWaalsContact O-N 3.09Å; K66-L69 PolarHBondContact O-N 3.5Å; E67-L69 VanDerWaalsContact C-N 3.35Å; E67-L69 PolarHBondContact O-N 3.28Å; L69-D73 PolarHBondContact O-N 3.41Å; L69-D73 VanDerWaalsContact O-N 3.11Å
70	Q	70.1	Confident	70.6	Confident	119 Å²	119	104.4 Å²	104.4	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-69.6	-41.7	176.1	-77.5	-173.5	-71.6	0	0	112.2	K66 E67 A72 D73 E74	K66-Q70 WeakPolarHBondContact O-CG 3.29Å; K66-Q70 PolarHBondContact O-N 3.4Å; E67-Q70 PolarHBondContact O-N 3.46Å; Q70-A72 VanDerWaalsContact C-N 3.31Å; Q70-A72 PolarHBondContact O-N 3.46Å; Q70-D73 PolarHBondContact O-N 2.99Å; Q70-E74 WeakPolarHBondContact O-CB 3.32Å; Q70-E74 WeakPolarHBondContact O-CG 3.45Å; Q70-E74 PolarHBondContact O-N 3.47Å
71	E	69.3	Low	69.4	Low	132 Å²	132	107 Å²	107	62%	0.617	55%	0.552	S	S	*	*	H	α-helix	trans	-62.5	-38.7	176.4	-74.7	-177	167	0	0	111.7	E67 E74 E75	E67-E71 PolarHBondContact O-N 2.82Å; E71-E74 PolarHBondContact O-N 2.89Å; E71-E75 WeakPolarHBondContact O-CB 3.25Å; E71-E75 WeakPolarHBondContact O-CG 3.21Å; E71-E75 PolarHBondContact O-N 3.39Å
72	A	67.9	Low	68.2	Low	54 Å²	54	103.2 Å²	103.2	45%	0.446	54%	0.542	S	S	.	.	H	α-helix	trans	-67.1	-42.3	176.2	0	0	0	0	0	113	A68 Q70 D76	A68-A72 WeakPolarHBondContact O-CB 3.19Å; A68-A72 PolarHBondContact O-N 3.19Å; Q70-A72 VanDerWaalsContact C-N 3.31Å; Q70-A72 PolarHBondContact O-N 3.46Å; A72-D76 PolarHBondContact O-N 2.96Å
73	D	65.8	Low	67.1	Low	114 Å²	114	104.7 Å²	104.7	61%	0.61	55%	0.546	S	S	*	.	H	α-helix	trans	-67	-38.4	175.8	-90.6	-13.1	0	0	0	111.5	L69 Q70 Q77	L69-D73 PolarHBondContact O-N 3.41Å; L69-D73 VanDerWaalsContact O-N 3.11Å; Q70-D73 PolarHBondContact O-N 2.99Å; D73-Q77 WeakPolarHBondContact O-CB 3.36Å; D73-Q77 PolarHBondContact O-N 3.07Å
74	E	63.1	Low	65.9	Low	117 Å²	117	104.9 Å²	104.9	55%	0.547	55%	0.548	S	S	.	.	H	α-helix	trans	-67.2	-41.5	177.2	-74.7	-179.4	-172.8	0	0	111.8	Q70 E71 Q77 Q78	Q70-E74 WeakPolarHBondContact O-CB 3.32Å; Q70-E74 WeakPolarHBondContact O-CG 3.45Å; Q70-E74 PolarHBondContact O-N 3.47Å; E71-E74 PolarHBondContact O-N 2.89Å; E74-Q77 PolarHBondContact O-N 3.28Å; E74-Q78 WeakPolarHBondContact O-CB 3.1Å; E74-Q78 PolarHBondContact O-N 3.04Å
75	E	59.4	Low	65.1	Low	131 Å²	131	104 Å²	104	61%	0.612	54%	0.54	S	S	*	.	H	α-helix	trans	-65.2	-42.9	176.9	-77.6	-170.7	165.9	0	0	112.9	E71 Q78 Q79	E71-E75 WeakPolarHBondContact O-CB 3.25Å; E71-E75 WeakPolarHBondContact O-CG 3.21Å; E71-E75 PolarHBondContact O-N 3.39Å; E75-Q78 PolarHBondContact O-N 3.41Å; E75-Q79 WeakPolarHBondContact O-CB 3.41Å; E75-Q79 WeakPolarHBondContact O-CG 3.45Å; E75-Q79 PolarHBondContact O-N 2.86Å
76	D	57.3	Low	64.3	Low	115 Å²	115	107.9 Å²	107.9	62%	0.615	55%	0.55	S	S	*	.	H	α-helix	trans	-67.3	-38.5	177.5	-103	-7.4	0	0	0	111.6	A72 S80	A72-D76 PolarHBondContact O-N 2.96Å; D76-S80 VanDerWaalsContact O-CB 3.26Å; D76-S80 WeakPolarHBondContact O-CB 3.43Å; D76-S80 PolarHBondContact O-N 3.18Å
77	Q	55.5	Low	63.9	Low	122 Å²	122	106.3 Å²	106.3	57%	0.57	55%	0.548	S	S	*	.	H	α-helix	trans	-69.9	-39.2	178.6	-159.2	157	25.3	0	0	111.3	D73 E74 S80 E81	D73-Q77 WeakPolarHBondContact O-CB 3.36Å; D73-Q77 PolarHBondContact O-N 3.07Å; E74-Q77 PolarHBondContact O-N 3.28Å; Q77-S80 PolarHBondContact O-N 2.9Å; Q77-E81 WeakPolarHBondContact O-CB 3.36Å; Q77-E81 WeakPolarHBondContact O-CG 3.47Å; Q77-E81 PolarHBondContact O-N 3.11Å
78	Q	56.7	Low	63.8	Low	138 Å²	138	105.9 Å²	105.9	65%	0.645	55%	0.549	S	S	*	.	H	α-helix	trans	-74	-33.3	-179.9	-152.2	156	23	0	0	112.7	E74 E75 A82	E74-Q78 WeakPolarHBondContact O-CB 3.1Å; E74-Q78 PolarHBondContact O-N 3.04Å; E75-Q78 PolarHBondContact O-N 3.41Å; Q78-A82 VanDerWaalsContact O-CB 3.28Å; Q78-A82 WeakPolarHBondContact O-CB 3.33Å; Q78-A82 PolarHBondContact O-N 3.21Å
79	Q	56.5	Low	63.6	Low	117 Å²	117	111.4 Å²	111.4	55%	0.547	56%	0.557	S	S	.	*	H	α-helix	trans	-69.7	-39.3	171.5	-75.2	-176.7	21.6	0	0	112.5	E75 A82 H83	E75-Q79 WeakPolarHBondContact O-CB 3.41Å; E75-Q79 WeakPolarHBondContact O-CG 3.45Å; E75-Q79 PolarHBondContact O-N 2.86Å; Q79-A82 PolarHBondContact O-N 3.25Å; Q79-H83 PolarHBondContact O-N 3.17Å; Q79-H83 PolarHBondContact O-ND1 3.33Å
80	S	54.8	Low	63.6	Low	72 Å²	72	109.7 Å²	109.7	50%	0.503	55%	0.554	S	S	.	*	H	α-helix	trans	-66.9	-43.3	176	-175.2	0	0	0	0	112.1	D76 Q77 H83 T84	D76-S80 VanDerWaalsContact O-CB 3.26Å; D76-S80 WeakPolarHBondContact O-CB 3.43Å; D76-S80 PolarHBondContact O-N 3.18Å; Q77-S80 PolarHBondContact O-N 2.9Å; S80-H83 PolarHBondContact O-N 2.89Å; S80-T84 WeakPolarHBondContact O-CB 3.22Å; S80-T84 WeakPolarHBondContact O-CG2 3.49Å; S80-T84 PolarHBondContact O-N 3.49Å; S80-T84 PolarHBondContact O-OG1 3.27Å
81	E	57.6	Low	64	Low	121 Å²	121	107.5 Å²	107.5	57%	0.565	55%	0.549	S	S	*	.	H	α-helix	trans	-65.2	-38.3	174.7	-76.2	-175.6	178.9	0	0	112.3	Q77 T84 A85	Q77-E81 WeakPolarHBondContact O-CB 3.36Å; Q77-E81 WeakPolarHBondContact O-CG 3.47Å; Q77-E81 PolarHBondContact O-N 3.11Å; E81-T84 WeakPolarHBondContact CA-OG1 3.21Å; E81-T84 PolarHBondContact O-OG1 3.46Å; E81-T84 VanDerWaalsContact O-OG1 3.11Å; E81-A85 WeakPolarHBondContact O-CB 3.46Å; E81-A85 PolarHBondContact O-N 3.43Å
82	A	59.9	Low	64.6	Low	46 Å²	46	105.7 Å²	105.7	38%	0.38	54%	0.543	S	S	.	.	H	α-helix	trans	-66.5	-44.4	175.7	0	0	0	0	0	112.2	Q78 Q79 A85 W86	Q78-A82 VanDerWaalsContact O-CB 3.28Å; Q78-A82 WeakPolarHBondContact O-CB 3.33Å; Q78-A82 PolarHBondContact O-N 3.21Å; Q79-A82 PolarHBondContact O-N 3.25Å; A82-A85 PolarHBondContact O-N 2.94Å; A82-W86 VanDerWaalsContact O-CD1 3.28Å; A82-W86 PolarHBondContact O-N 2.93Å
83	H	59.8	Low	65.1	Low	134 Å²	134	107 Å²	107	62%	0.62	55%	0.548	S	S	*	.	H	α-helix	trans	-66.3	-43.4	178.1	-80.5	62.3	0	0	0	111.7	Q79 S80 W86 D87	Q79-H83 PolarHBondContact O-N 3.17Å; Q79-H83 PolarHBondContact O-ND1 3.33Å; S80-H83 PolarHBondContact O-N 2.89Å; H83-W86 PolarHBondContact O-N 3.14Å; H83-D87 PolarHBondContact O-N 3.07Å
84	T	61.4	Low	65.7	Low	72 Å²	72	106.9 Å²	106.9	44%	0.442	55%	0.545	S	S	.	.	H	α-helix	trans	-66.8	-36.3	176.3	50.5	0	0	0	0	112.4	S80 E81 D87 L88	S80-T84 WeakPolarHBondContact O-CB 3.22Å; S80-T84 WeakPolarHBondContact O-CG2 3.49Å; S80-T84 PolarHBondContact O-N 3.49Å; S80-T84 PolarHBondContact O-OG1 3.27Å; E81-T84 WeakPolarHBondContact CA-OG1 3.21Å; E81-T84 PolarHBondContact O-OG1 3.46Å; E81-T84 VanDerWaalsContact O-OG1 3.11Å; T84-D87 PolarHBondContact O-N 2.58Å; T84-L88 VanDerWaalsContact O-CB 3.28Å; T84-L88 WeakPolarHBondContact O-CB 3.37Å; T84-L88 WeakPolarHBondContact O-CD1 3.48Å; T84-L88 WeakPolarHBondContact O-CG 3.38Å; T84-L88 PolarHBondContact O-N 2.83Å
85	A	67	Low	66.6	Low	36 Å²	36	105.2 Å²	105.2	30%	0.298	54%	0.542	S	S	.	.	H	α-helix	trans	-64.5	-44.2	173.1	0	0	0	0	0	111.9	E81 A82 D87 L88 W89	E81-A85 WeakPolarHBondContact O-CB 3.46Å; E81-A85 PolarHBondContact O-N 3.43Å; A82-A85 PolarHBondContact O-N 2.94Å; A85-D87 PolarHBondContact O-N 3.33Å; A85-L88 PolarHBondContact O-N 3.48Å; A85-W89 PolarHBondContact O-N 3.27Å
86	W	63.3	Low	67.8	Low	203 Å²	203	104 Å²	104	77%	0.769	54%	0.54	S	S	*	.	H	α-helix	trans	-61.1	-43.1	176	-92.7	92	0	0	0	112.5	A82 H83 W89 S90	A82-W86 VanDerWaalsContact O-CD1 3.28Å; A82-W86 PolarHBondContact O-N 2.93Å; H83-W86 PolarHBondContact O-N 3.14Å; W86-W89 PolarHBondContact O-N 2.91Å; W86-S90 VanDerWaalsContact O-CB 3.26Å; W86-S90 WeakPolarHBondContact O-CB 3.24Å; W86-S90 PolarHBondContact O-N 3.43Å
87	D	69.8	Low	68.9	Low	111 Å²	111	104.3 Å²	104.3	59%	0.594	54%	0.536	S	S	*	.	H	α-helix	trans	-67.8	-35.6	175.7	-79.1	-17.8	0	0	0	112	H83 T84 A85 S90 T91	H83-D87 PolarHBondContact O-N 3.07Å; T84-D87 PolarHBondContact O-N 2.58Å; A85-D87 PolarHBondContact O-N 3.33Å; D87-S90 PolarHBondContact O-N 2.87Å; D87-T91 WeakPolarHBondContact O-CB 3.34Å; D87-T91 VanDerWaalsContact O-CG2 3.23Å; D87-T91 WeakPolarHBondContact O-CG2 3.47Å; D87-T91 PolarHBondContact O-N 3.41Å; D87-T91 PolarHBondContact O-OG1 3.33Å
88	L	75.3	Confident	69.8	Low	107 Å²	107	103 Å²	103	56%	0.56	53%	0.532	S	S	*	.	H	α-helix	trans	-66.9	-41.6	173.6	-78.6	166.9	0	0	0	112.4	T84 A85 T91 L92	T84-L88 VanDerWaalsContact O-CB 3.28Å; T84-L88 WeakPolarHBondContact O-CB 3.37Å; T84-L88 WeakPolarHBondContact O-CD1 3.48Å; T84-L88 WeakPolarHBondContact O-CG 3.38Å; T84-L88 PolarHBondContact O-N 2.83Å; A85-L88 PolarHBondContact O-N 3.48Å; L88-T91 VanDerWaalsContact CA-OG1 3.3Å; L88-T91 WeakPolarHBondContact CA-OG1 3.35Å; L88-T91 PolarHBondContact O-OG1 3.03Å; L88-L92 WeakPolarHBondContact O-CB 3.28Å; L88-L92 WeakPolarHBondContact O-CD1 3.41Å; L88-L92 VanDerWaalsContact O-CG 3.3Å; L88-L92 WeakPolarHBondContact O-CG 3.48Å; L88-L92 PolarHBondContact O-N 3.31Å
89	W	72.4	Confident	70.7	Confident	174 Å²	174	99.5 Å²	99.5	66%	0.659	52%	0.52	S	S	*	.	H	α-helix	trans	-68.6	-39.3	174.8	-75.5	112.5	0	0	0	111.8	A85 W86 L92 C93	A85-W89 PolarHBondContact O-N 3.27Å; W86-W89 PolarHBondContact O-N 2.91Å; W89-L92 HydrophobicContact CE3-CD1 4.44Å; W89-L92 PolarHBondContact O-N 2.82Å; W89-C93 VanDerWaalsContact O-CB 3.31Å; W89-C93 WeakPolarHBondContact O-CB 3.48Å; W89-C93 PolarHBondContact O-N 3.43Å; W89-C93 PolarHBondContact O-SG 2.82Å
90	S	72.8	Confident	71.4	Confident	68 Å²	68	98.4 Å²	98.4	48%	0.476	52%	0.517	S	S	.	.	H	α-helix	trans	-63.6	-46.7	174.9	-174	0	0	0	0	111.4	W86 D87 C93 M94	W86-S90 VanDerWaalsContact O-CB 3.26Å; W86-S90 WeakPolarHBondContact O-CB 3.24Å; W86-S90 PolarHBondContact O-N 3.43Å; D87-S90 PolarHBondContact O-N 2.87Å; S90-C93 PolarHBondContact O-N 3.07Å; S90-M94 VanDerWaalsContact O-CG 3.29Å; S90-M94 WeakPolarHBondContact O-CG 3.49Å; S90-M94 PolarHBondContact O-N 3.24Å
91	T	77.7	Confident	72	Confident	74 Å²	74	97.1 Å²	97.1	45%	0.454	50%	0.503	S	S	.	.	H	α-helix	trans	-66.7	-38.8	175.7	51.6	0	0	0	0	112.2	D87 L88 M94 V95	D87-T91 WeakPolarHBondContact O-CB 3.34Å; D87-T91 VanDerWaalsContact O-CG2 3.23Å; D87-T91 WeakPolarHBondContact O-CG2 3.47Å; D87-T91 PolarHBondContact O-N 3.41Å; D87-T91 PolarHBondContact O-OG1 3.33Å; L88-T91 VanDerWaalsContact CA-OG1 3.3Å; L88-T91 WeakPolarHBondContact CA-OG1 3.35Å; L88-T91 PolarHBondContact O-OG1 3.03Å; T91-M94 PolarHBondContact O-N 2.89Å; T91-V95 WeakPolarHBondContact O-CB 3.08Å; T91-V95 WeakPolarHBondContact O-CG2 3.11Å; T91-V95 PolarHBondContact O-N 2.76Å
92	L	82.4	Confident	72.3	Confident	93 Å²	93	96.2 Å²	96.2	49%	0.487	50%	0.501	S	S	.	.	H	α-helix	trans	-61.7	-44.9	171.8	-85.3	163.4	0	0	0	111.5	L88 W89 M94 V95 L96	L88-L92 WeakPolarHBondContact O-CB 3.28Å; L88-L92 WeakPolarHBondContact O-CD1 3.41Å; L88-L92 VanDerWaalsContact O-CG 3.3Å; L88-L92 WeakPolarHBondContact O-CG 3.48Å; L88-L92 PolarHBondContact O-N 3.31Å; W89-L92 HydrophobicContact CE3-CD1 4.44Å; W89-L92 PolarHBondContact O-N 2.82Å; L92-M94 VanDerWaalsContact C-N 3.33Å; L92-M94 PolarHBondContact O-N 2.84Å; L92-V95 PolarHBondContact O-N 3.42Å; L92-L96 WeakPolarHBondContact O-CB 3.47Å; L92-L96 PolarHBondContact O-N 3.15Å
93	C	77.8	Confident	71.9	Confident	82 Å²	82	101.8 Å²	101.8	55%	0.554	51%	0.512	S	S	*	.	H	α-helix	trans	-61.5	-40.6	175.2	-75.1	0	0	0	0	111.8	W89 S90 L96 F97	W89-C93 VanDerWaalsContact O-CB 3.31Å; W89-C93 WeakPolarHBondContact O-CB 3.48Å; W89-C93 PolarHBondContact O-N 3.43Å; W89-C93 PolarHBondContact O-SG 2.82Å; S90-C93 PolarHBondContact O-N 3.07Å; C93-L96 PolarHBondContact O-N 3.44Å; C93-F97 VanDerWaalsContact O-CB 3.28Å; C93-F97 WeakPolarHBondContact O-CB 3.46Å; C93-F97 PolarHBondContact O-N 3.08Å
94	M	78.5	Confident	71.7	Confident	112 Å²	112	100.7 Å²	100.7	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-67.4	-41.2	175.2	-71.1	-61.2	-68.8	0	0	112.1	S90 T91 L92 F97 L98	S90-M94 VanDerWaalsContact O-CG 3.29Å; S90-M94 WeakPolarHBondContact O-CG 3.49Å; S90-M94 PolarHBondContact O-N 3.24Å; T91-M94 PolarHBondContact O-N 2.89Å; L92-M94 VanDerWaalsContact C-N 3.33Å; L92-M94 PolarHBondContact O-N 2.84Å; M94-F97 PolarHBondContact O-N 3.45Å; M94-L98 WeakPolarHBondContact O-CB 3.33Å; M94-L98 WeakPolarHBondContact O-CG 3.24Å; M94-L98 PolarHBondContact O-N 3.25Å
95	V	82.7	Confident	71.1	Confident	81 Å²	81	101.5 Å²	101.5	49%	0.491	50%	0.502	S	S	.	.	H	α-helix	trans	-65.6	-41	174.7	169.6	0	0	0	0	110.4	T91 L92 L98 V99	T91-V95 WeakPolarHBondContact O-CB 3.08Å; T91-V95 WeakPolarHBondContact O-CG2 3.11Å; T91-V95 PolarHBondContact O-N 2.76Å; L92-V95 PolarHBondContact O-N 3.42Å; V95-L98 CarbonylContact O-C 3.55Å; V95-L98 PolarHBondContact O-N 3.04Å; V95-V99 HydrophobicContact CG1-CG2 4.2Å; V95-V99 WeakPolarHBondContact O-CB 3.27Å; V95-V99 WeakPolarHBondContact O-CG2 3.49Å; V95-V99 PolarHBondContact O-N 2.94Å
96	L	84.7	Confident	69.7	Low	107 Å²	107	105.1 Å²	105.1	56%	0.56	52%	0.516	S	S	*	.	H	α-helix	trans	-68.5	-38.8	178.6	-151.3	153	0	0	0	110.4	L92 C93 V99 I100	L92-L96 WeakPolarHBondContact O-CB 3.47Å; L92-L96 PolarHBondContact O-N 3.15Å; C93-L96 PolarHBondContact O-N 3.44Å; L96-V99 PolarHBondContact O-N 2.81Å; L96-I100 HydrophobicContact CD2-CD1 3.54Å; L96-I100 HydrophobicContact CD2-CG1 4.18Å; L96-I100 WeakPolarHBondContact O-CB 3.39Å; L96-I100 WeakPolarHBondContact O-CG1 3.41Å; L96-I100 PolarHBondContact O-N 3.1Å
97	F	79.9	Confident	68.8	Low	120 Å²	120	102 Å²	102	53%	0.526	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-44.8	170.4	-172.4	-91.5	0	0	0	111.9	C93 M94 I100 E101	C93-F97 VanDerWaalsContact O-CB 3.28Å; C93-F97 WeakPolarHBondContact O-CB 3.46Å; C93-F97 PolarHBondContact O-N 3.08Å; M94-F97 PolarHBondContact O-N 3.45Å; F97-I100 PolarHBondContact O-N 3.26Å; F97-E101 HydrophobicContact CD1-CG 4.09Å; F97-E101 HydrophobicContact CE1-CG 3.71Å; F97-E101 HydrophobicContact CZ-CG 4.14Å; F97-E101 WeakPolarHBondContact O-CB 3.37Å; F97-E101 WeakPolarHBondContact O-CG 3.41Å; F97-E101 PolarHBondContact O-N 3.49Å
98	L	75.7	Confident	67.7	Low	95 Å²	95	100 Å²	100	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-65	-38.6	175.7	-74.1	169.5	0	0	0	111.9	M94 V95 E101 I102	M94-L98 WeakPolarHBondContact O-CB 3.33Å; M94-L98 WeakPolarHBondContact O-CG 3.24Å; M94-L98 PolarHBondContact O-N 3.25Å; V95-L98 CarbonylContact O-C 3.55Å; V95-L98 PolarHBondContact O-N 3.04Å; L98-E101 PolarHBondContact O-N 3.07Å; L98-I102 VanDerWaalsContact O-CB 3.26Å; L98-I102 WeakPolarHBondContact O-CB 3.44Å; L98-I102 WeakPolarHBondContact O-CD1 3.45Å; L98-I102 WeakPolarHBondContact O-CG1 3.49Å; L98-I102 PolarHBondContact O-N 3.02Å
99	V	74.1	Confident	66.2	Low	65 Å²	65	99.4 Å²	99.4	39%	0.394	49%	0.494	S	S	.	.	H	α-helix	trans	-67.6	-40.9	175.4	169.6	0	0	0	0	110.1	V95 L96 I102 W103	V95-V99 HydrophobicContact CG1-CG2 4.2Å; V95-V99 WeakPolarHBondContact O-CB 3.27Å; V95-V99 WeakPolarHBondContact O-CG2 3.49Å; V95-V99 PolarHBondContact O-N 2.94Å; L96-V99 PolarHBondContact O-N 2.81Å; V99-I102 PolarHBondContact O-N 3.16Å; V99-W103 WeakPolarHBondContact O-CB 3.37Å; V99-W103 PolarHBondContact O-N 3.43Å
100	I	71.9	Confident	64.2	Low	93 Å²	93	93 Å²	93	48%	0.477	48%	0.483	S	S	.	.	H	α-helix	trans	-62.5	-42.5	172.4	-71.4	167.5	0	0	0	110.5	L96 F97 W103 R104	L96-I100 HydrophobicContact CD2-CD1 3.54Å; L96-I100 HydrophobicContact CD2-CG1 4.18Å; L96-I100 WeakPolarHBondContact O-CB 3.39Å; L96-I100 WeakPolarHBondContact O-CG1 3.41Å; L96-I100 PolarHBondContact O-N 3.1Å; F97-I100 PolarHBondContact O-N 3.26Å; I100-W103 PolarHBondContact O-N 2.89Å; I100-R104 WeakPolarHBondContact O-CB 3.38Å; I100-R104 PolarHBondContact O-N 3.47Å
101	E	67.4	Low	62.6	Low	46 Å²	46	95.6 Å²	95.6	22%	0.215	50%	0.498	C	S	.	.	H	α-helix	trans	-68	-40.2	177.7	-80.8	-64	140.1	0	0	112.4	F97 L98 R104 Q105	F97-E101 HydrophobicContact CD1-CG 4.09Å; F97-E101 HydrophobicContact CE1-CG 3.71Å; F97-E101 HydrophobicContact CZ-CG 4.14Å; F97-E101 WeakPolarHBondContact O-CB 3.37Å; F97-E101 WeakPolarHBondContact O-CG 3.41Å; F97-E101 PolarHBondContact O-N 3.49Å; L98-E101 PolarHBondContact O-N 3.07Å; E101-R104 VanDerWaalsContact CD-CZ 3.43Å; E101-R104 WeakPolarHBondContact O-CB 3.49Å; E101-R104 PolarHBondContact O-N 3.49Å; E101-R104 IonicContact OE1-CZ 2.66Å; E101-R104 IonicContact OE1-NE 3.68Å; E101-R104 PolarHBondContact OE1-NE 2.85Å; E101-R104 VanDerWaalsContact OE1-NE 3.16Å; E101-R104 IonicContact OE1-NH1 2.84Å; E101-R104 PolarHBondContact OE1-NH1 3.05Å; E101-R104 IonicContact OE1-NH2 2.6Å; E101-R104 PolarHBondContact OE1-NH2 3.34Å; E101-R104 IonicContact OE2-CZ 3.85Å; E101-R104 IonicContact OE2-NE 3.83Å; E101-R104 PolarHBondContact OE2-NE 3.16Å; E101-R104 IonicContact OE2-NH1 3.77Å; E101-R104 IonicContact OE2-NH2 2.65Å; E101-R104 PolarHBondContact OE2-NH2 3.31Å; E101-Q105 WeakPolarHBondContact O-CB 3.49Å; E101-Q105 PolarHBondContact O-N 2.86Å
102	I	64.5	Low	60.6	Low	101 Å²	101	98.9 Å²	98.9	52%	0.518	51%	0.506	S	S	.	.	H	α-helix	trans	-65.8	-44.4	173.9	-71	162.9	0	0	0	110	L98 V99 Q105 D106	L98-I102 VanDerWaalsContact O-CB 3.26Å; L98-I102 WeakPolarHBondContact O-CB 3.44Å; L98-I102 WeakPolarHBondContact O-CD1 3.45Å; L98-I102 WeakPolarHBondContact O-CG1 3.49Å; L98-I102 PolarHBondContact O-N 3.02Å; V99-I102 PolarHBondContact O-N 3.16Å; I102-Q105 CarbonylContact O-C 3.58Å; I102-Q105 PolarHBondContact O-N 2.98Å; I102-Q105 VanDerWaalsContact O-N 3.13Å; I102-D106 WeakPolarHBondContact O-CB 3.37Å; I102-D106 PolarHBondContact O-N 2.84Å
103	W	50	Low	58.4	Low	163 Å²	163	99.4 Å²	99.4	62%	0.617	52%	0.515	S	S	*	.	H	α-helix	trans	-64.7	-37.9	173.9	-87.4	59.3	0	0	0	112	V99 I100 Q105 D106 H107	V99-W103 WeakPolarHBondContact O-CB 3.37Å; V99-W103 PolarHBondContact O-N 3.43Å; I100-W103 PolarHBondContact O-N 2.89Å; W103-Q105 PolarHBondContact O-N 3.36Å; W103-D106 PolarHBondContact O-N 3.28Å; W103-H107 AromaticContact CE3-CD2 3.98Å; W103-H107 WeakPolarHBondContact O-CB 3.28Å; W103-H107 PolarHBondContact O-N 2.82Å
104	R	56.9	Low	56.6	Low	111 Å²	111	104.4 Å²	104.4	42%	0.419	53%	0.53	S	S	.	.	H	α-helix	trans	-62.7	-30.9	173.5	-173.3	-177.3	81.1	149.6	6.1	111.2	I100 E101 Q108	I100-R104 WeakPolarHBondContact O-CB 3.38Å; I100-R104 PolarHBondContact O-N 3.47Å; E101-R104 VanDerWaalsContact CD-CZ 3.43Å; E101-R104 WeakPolarHBondContact O-CB 3.49Å; E101-R104 PolarHBondContact O-N 3.49Å; E101-R104 IonicContact OE1-CZ 2.66Å; E101-R104 IonicContact OE1-NE 3.68Å; E101-R104 PolarHBondContact OE1-NE 2.85Å; E101-R104 VanDerWaalsContact OE1-NE 3.16Å; E101-R104 IonicContact OE1-NH1 2.84Å; E101-R104 PolarHBondContact OE1-NH1 3.05Å; E101-R104 IonicContact OE1-NH2 2.6Å; E101-R104 PolarHBondContact OE1-NH2 3.34Å; E101-R104 IonicContact OE2-CZ 3.85Å; E101-R104 IonicContact OE2-NE 3.83Å; E101-R104 PolarHBondContact OE2-NE 3.16Å; E101-R104 IonicContact OE2-NH1 3.77Å; E101-R104 IonicContact OE2-NH2 2.65Å; E101-R104 PolarHBondContact OE2-NH2 3.31Å; R104-Q108 VanDerWaalsContact O-CD 3.28Å; R104-Q108 VanDerWaalsContact O-CG 3.24Å; R104-Q108 WeakPolarHBondContact O-CG 3.47Å; R104-Q108 PolarHBondContact O-NE2 3.31Å
105	Q	47.8	Very low	54.5	Low	89 Å²	89	110.2 Å²	110.2	42%	0.416	55%	0.548	S	S	.	.	H	α-helix	trans	-84.9	-35.7	178	-162.7	160.1	-4.8	0	0	112.1	E101 I102 W103 Q108	E101-Q105 WeakPolarHBondContact O-CB 3.49Å; E101-Q105 PolarHBondContact O-N 2.86Å; I102-Q105 CarbonylContact O-C 3.58Å; I102-Q105 PolarHBondContact O-N 2.98Å; I102-Q105 VanDerWaalsContact O-N 3.13Å; W103-Q105 PolarHBondContact O-N 3.36Å; Q105-Q108 WeakPolarHBondContact O-CB 3.31Å; Q105-Q108 PolarHBondContact O-N 2.93Å
106	D	37.6	Very low	52.5	Low	113 Å²	113	114.3 Å²	114.3	60%	0.604	57%	0.566	S	S	*	*	H	α-helix	trans	-81.4	-33.9	-178.3	-150.6	30.9	0	0	0	112.7	I102 W103 Q108 D109	I102-D106 WeakPolarHBondContact O-CB 3.37Å; I102-D106 PolarHBondContact O-N 2.84Å; W103-D106 PolarHBondContact O-N 3.28Å; D106-Q108 PolarHBondContact O-N 3.3Å; D106-D109 PolarHBondContact O-N 3.01Å
107	H	44.1	Very low	50.5	Low	138 Å²	138	113.2 Å²	113.2	64%	0.639	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-18.8	168	-101.3	-76.3	0	0	0	113.1	W103 D109	W103-H107 AromaticContact CE3-CD2 3.98Å; W103-H107 WeakPolarHBondContact O-CB 3.28Å; W103-H107 PolarHBondContact O-N 2.82Å; H107-D109 VanDerWaalsContact C-N 3.27Å
108	Q	47.7	Very low	48.1	Very low	69 Å²	69	110.5 Å²	110.5	32%	0.322	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.4	-16.2	172.9	-68.4	173.2	32.3	0	0	112	R104 Q105 D106 K487	R104-Q108 VanDerWaalsContact O-CD 3.28Å; R104-Q108 VanDerWaalsContact O-CG 3.24Å; R104-Q108 WeakPolarHBondContact O-CG 3.47Å; R104-Q108 PolarHBondContact O-NE2 3.31Å; Q105-Q108 WeakPolarHBondContact O-CB 3.31Å; Q105-Q108 PolarHBondContact O-N 2.93Å; D106-Q108 PolarHBondContact O-N 3.3Å; Q108-K487 WeakPolarHBondContact O-CE 3.35Å; Q108-K487 PolarHBondContact O-NZ 3.48Å
109	D	42.8	Very low	46.3	Very low	94 Å²	94	113.1 Å²	113.1	50%	0.503	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108	-5.2	-172.8	-76.5	-31.3	0	0	0	115.6	D106 H107 K487	D106-D109 PolarHBondContact O-N 3.01Å; H107-D109 VanDerWaalsContact C-N 3.27Å; D109-K487 WeakPolarHBondContact OD1-CE 3.46Å; D109-K487 IonicContact OD1-NZ 2.95Å
110	G	32.2	Very low	44.8	Very low	40 Å²	40	117.7 Å²	117.7	41%	0.412	62%	0.618	S	S	.	*	S	Bend	trans	-89.3	149.3	176.7	0	0	0	0	0	115.5
111	P	37.2	Very low	43.2	Very low	122 Å²	122	119.4 Å²	119.4	79%	0.792	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-66.2	130.9	160.7	-2.9	18.6	0	0	0	109.3	P113	P111-P113 VanDerWaalsContact O-CD 3.24Å; P111-P113 WeakPolarHBondContact O-CD 3.43Å
112	F	35.8	Very low	41.9	Very low	142 Å²	142	125.9 Å²	125.9	62%	0.623	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-49.1	117.3	-174.4	-61.4	-82.3	0	0	0	113.9
113	P	37.7	Very low	40.6	Very low	104 Å²	104	127 Å²	127	68%	0.675	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-87.3	131.1	165.9	-4.5	24.2	0	0	0	110.4	P111 Y115	P111-P113 VanDerWaalsContact O-CD 3.24Å; P111-P113 WeakPolarHBondContact O-CD 3.43Å; P113-Y115 PolarHBondContact O-N 3.34Å
114	E	39.8	Very low	40	Very low	188 Å²	188	124.9 Å²	124.9	88%	0.879	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-62.3	120.4	162.4	-67.8	174	148	0	0	109.2
115	Y	33.9	Very low	39	Very low	234 Å²	234	122.4 Å²	122.4	92%	0.918	68%	0.683	S	S	*	*			trans	-145.4	144.6	161.7	-106.3	-83.1	0	0	0	114.5	P113	P113-Y115 PolarHBondContact O-N 3.34Å
116	L	40.4	Very low	38.7	Very low	167 Å²	167	122.3 Å²	122.3	87%	0.874	69%	0.685	S	S	*	*			trans	-84.2	136	-168.5	-144.2	93.9	0	0	0	112
117	G	42.3	Very low	38.5	Very low	83 Å²	83	121.3 Å²	121.3	86%	0.856	70%	0.702	S	S	*	*			trans	50.5	118.8	140.2	0	0	0	0	0	121.4
118	G	31.3	Very low	38	Very low	64 Å²	64	117.5 Å²	117.5	66%	0.66	70%	0.7	S	S	*	*			trans	161.1	92.5	153.7	0	0	0	0	0	114.3
119	D	36.5	Very low	37.9	Very low	149 Å²	149	119.4 Å²	119.4	80%	0.797	72%	0.716	S	S	*	*				62.2	126.4	128.9	-68.3	2.7	0	0	0	119.7
120	E	42.5	Very low	38.3	Very low	162 Å²	162	118.9 Å²	118.9	76%	0.757	72%	0.718	S	S	*	*			cis	-156.9	153.4	9.7	-53	-172.9	132	0	0	111.6
121	D	38.9	Very low	39.5	Very low	128 Å²	128	117.3 Å²	117.3	68%	0.684	70%	0.7	S	S	*	*			trans	63.6	95.2	140.5	-68.8	-13.8	0	0	0	124.2
122	E	40.2	Very low	40.3	Very low	182 Å²	182	119.9 Å²	119.9	85%	0.85	69%	0.694	S	S	*	*	S	Bend		-168.2	17.3	121.8	-112.9	-164.9	167.8	0	0	115.5
123	L	37.6	Very low	41.1	Very low	125 Å²	125	116.3 Å²	116.3	65%	0.654	70%	0.697	S	S	*	*			trans	-148.8	64.2	174.1	-99.7	128.4	0	0	0	111.8	G125	L123-G125 PolarHBondContact O-N 2.95Å
124	S	36.6	Very low	42.2	Very low	118 Å²	118	113.7 Å²	113.7	83%	0.825	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	91.5	173.4	-65.7	0	0	0	0	110.6
125	G	36.2	Very low	43.5	Very low	59 Å²	59	109.6 Å²	109.6	61%	0.608	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	177	-13.3	175	0	0	0	0	0	116	L123	L123-G125 PolarHBondContact O-N 2.95Å
126	L	42	Very low	45.5	Very low	87 Å²	87	99.9 Å²	99.9	46%	0.455	63%	0.63	S	S	.	*			trans	-125.8	31	-177.9	-96.5	99.1	0	0	0	114.2	G128 Y525	L126-G128 VanDerWaalsContact C-N 3.31Å; L126-G128 PolarHBondContact O-N 3.26Å; L126-Y525 HydrophobicContact CD2-CE2 3.75Å; L126-Y525 WeakPolarHBondContact CD2-OH 3.42Å
127	G	33.2	Very low	47.3	Very low	92 Å²	92	92.7 Å²	92.7	95%	0.948	59%	0.594	S	S	*	*			trans	-76.6	79.6	167.9	0	0	0	0	0	111.1
128	G	33.1	Very low	49.1	Very low	58 Å²	58	96 Å²	96	60%	0.598	59%	0.587	S	S	*	*			trans	-139.5	153.7	175.1	0	0	0	0	0	111.2	L126	L126-G128 VanDerWaalsContact C-N 3.31Å; L126-G128 PolarHBondContact O-N 3.26Å
129	T	46	Very low	51.7	Low	110 Å²	110	96 Å²	96	68%	0.675	57%	0.569	S	S	*	*	S	Bend	trans	-42.5	149	167.9	32.3	0	0	0	0	112.7	L131	T129-L131 CarbonylContact O-C 3.59Å; T129-L131 PolarHBondContact O-N 2.81Å
130	P	50.3	Low	53.8	Low	82 Å²	82	92.3 Å²	92.3	53%	0.532	56%	0.559	S	S	.	*	S	Bend	trans	-49.8	130.3	177.1	-21.1	29.3	0	0	0	110.6
131	L	58.3	Low	55.9	Low	7 Å²	7	87.3 Å²	87.3	4%	0.037	54%	0.54	C	S	.	.	S	Bend	trans	56.3	112.4	-161.5	-60.8	163.1	0	0	0	111.1	T129 G133 Q463 F466 C467 E470 L528	T129-L131 CarbonylContact O-C 3.59Å; T129-L131 PolarHBondContact O-N 2.81Å; L131-G133 PolarHBondContact O-N 2.76Å; L131-Q463 HydrophobicContact CD1-CG 3.27Å; L131-F466 HydrophobicContact CD2-CB 4.11Å; L131-C467 WeakPolarHBondContact CD1-SG 3.14Å; L131-E470 PolarHBondContact N-OE1 3.11Å; L131-E470 PolarHBondContact N-OE2 3.33Å; L131-L528 HydrophobicContact CD2-CD1 3.47Å; L131-L528 VanDerWaalsContact CD2-CD1 3.47Å; L131-L528 HydrophobicContact CD2-CD2 4.28Å; L131-L528 HydrophobicContact CD2-CG 4.48Å
132	R	54.6	Low	58.1	Low	177 Å²	177	81.2 Å²	81.2	67%	0.668	51%	0.507	S	S	*	.	S	Bend	trans	-51.7	63.7	174.5	-164.8	-171.6	-158.8	178.6	8.3	114.7	L134	R132-L134 PolarHBondContact O-N 3.4Å
133	G	51.5	Low	60.2	Low	66 Å²	66	75.1 Å²	75.1	68%	0.68	48%	0.48	S	S	*	.	S	Bend	trans	47.7	25	-176.8	0	0	0	0	0	115.2	L131 P135	L131-G133 PolarHBondContact O-N 2.76Å; G133-P135 WeakPolarHBondContact O-CD 3.34Å
134	L	61.8	Low	62.5	Low	49 Å²	49	74.1 Å²	74.1	26%	0.257	47%	0.472	S	S	.	.			trans	-86.1	103.4	-177.3	-72.3	174.3	0	0	0	108.8	R132 L136 L528 K529	R132-L134 PolarHBondContact O-N 3.4Å; L134-L136 PolarHBondContact O-N 3.07Å; L134-L136 VanDerWaalsContact O-N 3.16Å; L134-L528 HydrophobicContact CD1-CB 3.67Å; L134-K529 HydrophobicContact CD1-CB 4.44Å; L134-K529 HydrophobicContact CD2-CB 4.49Å
135	P	65.3	Low	64.9	Low	103 Å²	103	68.5 Å²	68.5	67%	0.669	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-69.8	116.4	179.3	29.5	-33.3	0	0	0	108.9	G133	G133-P135 WeakPolarHBondContact O-CD 3.34Å
136	L	76.1	Confident	67.2	Low	29 Å²	29	67.9 Å²	67.9	15%	0.152	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-63.4	149.4	163.4	-72.5	164.2	0	0	0	109.1	L134 L462 Q463 F466	L134-L136 PolarHBondContact O-N 3.07Å; L134-L136 VanDerWaalsContact O-N 3.16Å; L136-L462 HydrophobicContact CD1-CG 4.39Å; L136-Q463 HydrophobicContact CD1-CB 3.77Å; L136-Q463 HydrophobicContact CD1-CG 4.03Å; L136-F466 HydrophobicContact CD1-CD2 3.84Å; L136-F466 HydrophobicContact CD1-CE2 4.33Å; L136-F466 HydrophobicContact CD2-CD2 4.11Å; L136-F466 HydrophobicContact CD2-CE2 3.96Å
137	P	79.1	Confident	69.2	Low	17 Å²	17	67.6 Å²	67.6	11%	0.11	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-55	145.7	177.7	-27.5	37.4	0	0	0	112.2	T141 L142 P532 I535	P137-T141 HydrophobicContact CB-CG2 4.22Å; P137-L142 HydrophobicContact CB-CD2 4.15Å; P137-L142 HydrophobicContact CB-CG 4.28Å; P137-L142 HydrophobicContact CG-CD2 4.42Å; P137-L142 WeakPolarHBondContact O-CD1 3.25Å; P137-P532 HydrophobicContact CG-CB 4.09Å; P137-P532 HydrophobicContact CG-CG 4.46Å; P137-I535 HydrophobicContact CB-CG2 4.46Å; P137-I535 HydrophobicContact CG-CB 4.24Å; P137-I535 HydrophobicContact CG-CD1 3.75Å; P137-I535 HydrophobicContact CG-CG2 4.19Å
138	Q	80.8	Confident	71.4	Confident	153 Å²	153	66.3 Å²	66.3	72%	0.715	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-58.9	153.1	175	-66.5	178.8	6	0	0	110.8	A140 T141 L142	Q138-A140 VanDerWaalsContact C-N 3.26Å; Q138-A140 PolarHBondContact O-N 3.31Å; Q138-A140 VanDerWaalsContact O-N 3.08Å; Q138-T141 PolarHBondContact O-N 3.48Å; Q138-L142 PolarHBondContact O-N 3.43Å
139	K	84.7	Confident	73.6	Confident	63 Å²	63	64.6 Å²	64.6	27%	0.274	36%	0.356	S	S	.	.	H	α-helix	trans	-43.9	-46.3	179.5	-167.9	-161.9	176.2	-120.4	0	114.4	T141 L142 D143 A455 L458 D459	K139-T141 VanDerWaalsContact C-N 3.28Å; K139-T141 PolarHBondContact O-N 3.48Å; K139-L142 WeakPolarHBondContact O-CB 3.45Å; K139-L142 PolarHBondContact O-N 2.88Å; K139-L142 VanDerWaalsContact O-N 3.08Å; K139-D143 WeakPolarHBondContact CE-OD2 3.27Å; K139-D143 IonicContact NZ-OD1 3.57Å; K139-D143 IonicContact NZ-OD2 3.31Å; K139-D143 PolarHBondContact NZ-OD2 3.05Å; K139-D143 WeakPolarHBondContact O-CB 3.39Å; K139-D143 PolarHBondContact O-N 3.3Å; K139-A455 WeakPolarHBondContact CE-O 3.28Å; K139-L458 HydrophobicContact CG-CB 4.46Å; K139-D459 HydrophobicContact CB-CB 4.35Å
140	A	81.9	Confident	75.3	Confident	71 Å²	71	59.3 Å²	59.3	59%	0.587	32%	0.324	S	S	*	.	H	α-helix	trans	-59.5	-38.2	-177	0	0	0	0	0	112.9	Q138 H144	Q138-A140 VanDerWaalsContact C-N 3.26Å; Q138-A140 PolarHBondContact O-N 3.31Å; Q138-A140 VanDerWaalsContact O-N 3.08Å; A140-H144 WeakPolarHBondContact O-CB 3.31Å; A140-H144 PolarHBondContact O-N 3.41Å; A140-H144 VanDerWaalsContact O-N 3.12Å
141	T	84.9	Confident	76.8	Confident	57 Å²	57	62.2 Å²	62.2	35%	0.35	33%	0.325	S	S	.	.	H	α-helix	trans	-71.1	-38.7	176.2	-49.9	0	0	0	0	111.1	P137 Q138 K139 F145 I535	P137-T141 HydrophobicContact CB-CG2 4.22Å; Q138-T141 PolarHBondContact O-N 3.48Å; K139-T141 VanDerWaalsContact C-N 3.28Å; K139-T141 PolarHBondContact O-N 3.48Å; T141-F145 VanDerWaalsContact O-CB 3.3Å; T141-F145 WeakPolarHBondContact O-CB 3.46Å; T141-F145 PolarHBondContact O-N 3.47Å; T141-I535 HydrophobicContact CG2-CG2 4.04Å
142	L	86.4	Confident	77.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66.7	-44.1	176.5	-65.3	176	0	0	0	112.2	P137 Q138 K139 H144 F145 Y146 I415 L458 D459 L462 I535	P137-L142 HydrophobicContact CB-CD2 4.15Å; P137-L142 HydrophobicContact CB-CG 4.28Å; P137-L142 HydrophobicContact CG-CD2 4.42Å; P137-L142 WeakPolarHBondContact O-CD1 3.25Å; Q138-L142 PolarHBondContact O-N 3.43Å; K139-L142 WeakPolarHBondContact O-CB 3.45Å; K139-L142 PolarHBondContact O-N 2.88Å; K139-L142 VanDerWaalsContact O-N 3.08Å; L142-H144 VanDerWaalsContact C-N 3.33Å; L142-H144 PolarHBondContact O-N 3.4Å; L142-F145 PolarHBondContact O-N 3.3Å; L142-Y146 VanDerWaalsContact O-CB 3.26Å; L142-Y146 WeakPolarHBondContact O-CB 3.43Å; L142-Y146 PolarHBondContact O-N 2.87Å; L142-I415 HydrophobicContact CD2-CD1 4.45Å; L142-L458 HydrophobicContact CB-CD2 3.78Å; L142-L458 HydrophobicContact CB-CG 4.43Å; L142-L458 HydrophobicContact CD1-CG 4.44Å; L142-D459 HydrophobicContact CD1-CB 3.91Å; L142-L462 HydrophobicContact CD1-CD2 4.08Å; L142-L462 HydrophobicContact CD2-CD2 4.13Å; L142-I535 HydrophobicContact CD2-CD1 3.76Å; L142-I535 HydrophobicContact CD2-CG2 4.28Å
143	D	84.7	Confident	78.4	Confident	55 Å²	55	57.5 Å²	57.5	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-59.8	-45.7	176.3	-75.7	-14.7	0	0	0	109.9	K139 Y146 E147 L458	K139-D143 WeakPolarHBondContact CE-OD2 3.27Å; K139-D143 IonicContact NZ-OD1 3.57Å; K139-D143 IonicContact NZ-OD2 3.31Å; K139-D143 PolarHBondContact NZ-OD2 3.05Å; K139-D143 WeakPolarHBondContact O-CB 3.39Å; K139-D143 PolarHBondContact O-N 3.3Å; D143-Y146 PolarHBondContact O-N 2.96Å; D143-E147 WeakPolarHBondContact O-CB 3.31Å; D143-E147 VanDerWaalsContact O-CG 3.31Å; D143-E147 WeakPolarHBondContact O-CG 3.31Å; D143-E147 PolarHBondContact O-N 2.97Å; D143-L458 VanDerWaalsContact OD1-CD2 3.29Å; D143-L458 WeakPolarHBondContact OD1-CD2 3.31Å
144	H	84.8	Confident	79.5	Confident	104 Å²	104	56 Å²	56	48%	0.481	30%	0.298	S	S	.	.	H	α-helix	trans	-64.6	-44.6	178.1	-174.2	69.2	0	0	0	112.5	A140 L142 Y146 H148	A140-H144 WeakPolarHBondContact O-CB 3.31Å; A140-H144 PolarHBondContact O-N 3.41Å; A140-H144 VanDerWaalsContact O-N 3.12Å; L142-H144 VanDerWaalsContact C-N 3.33Å; L142-H144 PolarHBondContact O-N 3.4Å; H144-Y146 VanDerWaalsContact C-N 3.35Å; H144-Y146 PolarHBondContact O-N 3.26Å; H144-H148 VanDerWaalsContact O-CB 3.27Å; H144-H148 WeakPolarHBondContact O-CB 3.17Å; H144-H148 PolarHBondContact O-N 3.19Å
145	F	86.4	Confident	80.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-58.9	-46.1	174.4	171	-104.3	0	0	0	111.9	T141 L142 H148 C149 I150 I415 F418 I535 S539	T141-F145 VanDerWaalsContact O-CB 3.3Å; T141-F145 WeakPolarHBondContact O-CB 3.46Å; T141-F145 PolarHBondContact O-N 3.47Å; L142-F145 PolarHBondContact O-N 3.3Å; F145-H148 PolarHBondContact O-N 3.16Å; F145-C149 HydrophobicContact CD2-CB 3.84Å; F145-C149 HydrophobicContact CE2-CB 3.56Å; F145-C149 HydrophobicContact CZ-CB 4.07Å; F145-C149 WeakPolarHBondContact O-CB 3.44Å; F145-C149 PolarHBondContact O-N 3.21Å; F145-I150 HydrophobicContact CD1-CD1 4.26Å; F145-I150 HydrophobicContact CE1-CD1 3.65Å; F145-I150 HydrophobicContact CE1-CG1 4.12Å; F145-I150 HydrophobicContact CZ-CD1 4.37Å; F145-I150 HydrophobicContact CZ-CG1 4.42Å; F145-I415 HydrophobicContact CD1-CG1 4.23Å; F145-I415 HydrophobicContact CE1-CG1 4.12Å; F145-I415 HydrophobicContact CE1-CG2 4.42Å; F145-F418 HydrophobicContact CE1-CD1 4.38Å; F145-F418 HydrophobicContact CE2-CD1 4.35Å; F145-F418 AromaticContact CE2-CE1 3.92Å; F145-F418 HydrophobicContact CE2-CE1 3.92Å; F145-F418 HydrophobicContact CE2-CZ 4.14Å; F145-F418 AromaticContact CZ-CD1 3.54Å; F145-F418 HydrophobicContact CZ-CD1 3.54Å; F145-F418 HydrophobicContact CZ-CD2 4.38Å; F145-F418 AromaticContact CZ-CE1 3.56Å; F145-F418 HydrophobicContact CZ-CE1 3.56Å; F145-F418 HydrophobicContact CZ-CE2 4.39Å; F145-F418 AromaticContact CZ-CG 3.95Å; F145-F418 HydrophobicContact CZ-CG 3.95Å; F145-F418 AromaticContact CZ-CZ 3.99Å; F145-F418 HydrophobicContact CZ-CZ 3.99Å; F145-I535 HydrophobicContact CB-CG2 3.79Å; F145-I535 HydrophobicContact CD1-CG2 4.41Å; F145-I535 HydrophobicContact CD2-CG2 4.25Å; F145-I535 HydrophobicContact CG-CG2 3.89Å; F145-S539 WeakPolarHBondContact CA-OG 3.44Å; F145-S539 WeakPolarHBondContact CB-OG 3.43Å
146	Y	85.3	Confident	81	Confident	46 Å²	46	55.3 Å²	55.3	18%	0.18	30%	0.303	C	S	.	.	I	π-helix	trans	-60	-51.2	-179.5	-178.4	-96.2	0	0	0	111.4	L142 D143 H144 H148 I150 R151 S411 Q414	L142-Y146 VanDerWaalsContact O-CB 3.26Å; L142-Y146 WeakPolarHBondContact O-CB 3.43Å; L142-Y146 PolarHBondContact O-N 2.87Å; D143-Y146 PolarHBondContact O-N 2.96Å; H144-Y146 VanDerWaalsContact C-N 3.35Å; H144-Y146 PolarHBondContact O-N 3.26Å; Y146-H148 VanDerWaalsContact C-N 3.32Å; Y146-H148 PolarHBondContact O-N 3Å; Y146-I150 HydrophobicContact CD2-CB 4.11Å; Y146-I150 HydrophobicContact CD2-CD1 3.79Å; Y146-I150 HydrophobicContact CD2-CG1 4.5Å; Y146-I150 HydrophobicContact CD2-CG2 4.22Å; Y146-I150 HydrophobicContact CE2-CB 4.26Å; Y146-I150 HydrophobicContact CE2-CD1 4.32Å; Y146-I150 HydrophobicContact CE2-CG2 3.88Å; Y146-I150 WeakPolarHBondContact O-CB 3.49Å; Y146-I150 PolarHBondContact O-N 3.24Å; Y146-I150 VanDerWaalsContact O-N 3.13Å; Y146-R151 PolarHBondContact O-N 2.89Å; Y146-S411 WeakPolarHBondContact CE2-OG 3.34Å; Y146-Q414 HydrophobicContact CE2-CB 4.36Å; Y146-Q414 PolarHBondContact OH-OE1 3.48Å
147	E	84.2	Confident	81.5	Confident	81 Å²	81	54.8 Å²	54.8	38%	0.379	30%	0.303	S	S	.	.	I	π-helix	trans	-60.5	-41.7	179.8	-77.2	-64.5	129.3	0	0	112.3	D143 R151	D143-E147 WeakPolarHBondContact O-CB 3.31Å; D143-E147 VanDerWaalsContact O-CG 3.31Å; D143-E147 WeakPolarHBondContact O-CG 3.31Å; D143-E147 PolarHBondContact O-N 2.97Å; E147-R151 WeakPolarHBondContact O-CB 3.39Å; E147-R151 IonicContact OE1-NE 2.9Å; E147-R151 PolarHBondContact OE1-NE 3.13Å; E147-R151 IonicContact OE2-CZ 3.38Å; E147-R151 IonicContact OE2-NE 3.95Å; E147-R151 PolarHBondContact OE2-NE 2.92Å; E147-R151 IonicContact OE2-NH2 2.72Å; E147-R151 PolarHBondContact OE2-NH2 3.3Å
148	H	79.6	Confident	82	Confident	64 Å²	64	57.7 Å²	57.7	30%	0.296	32%	0.32	S	S	.	.	I	π-helix	trans	-90	-40.3	-170.1	-163.1	-129.2	0	0	0	113.5	H144 F145 Y146 S152 S539 V542	H144-H148 VanDerWaalsContact O-CB 3.27Å; H144-H148 WeakPolarHBondContact O-CB 3.17Å; H144-H148 PolarHBondContact O-N 3.19Å; F145-H148 PolarHBondContact O-N 3.16Å; Y146-H148 VanDerWaalsContact C-N 3.32Å; Y146-H148 PolarHBondContact O-N 3Å; H148-S152 WeakPolarHBondContact O-CB 3.38Å; H148-S152 PolarHBondContact O-OG 2.78Å; H148-S539 PolarHBondContact ND1-O 3.16Å; H148-V542 WeakPolarHBondContact CE1-CB 3.44Å; H148-V542 WeakPolarHBondContact CE1-CG2 3.33Å; H148-V542 WeakPolarHBondContact ND1-CG2 3.42Å
149	C	79.6	Confident	82.4	Confident	22 Å²	22	59.6 Å²	59.6	15%	0.149	32%	0.321	C	S	.	.	I	π-helix	trans	-92.9	-46.9	-175.6	-166.6	0	0	0	0	112.1	F145 A153	F145-C149 HydrophobicContact CD2-CB 3.84Å; F145-C149 HydrophobicContact CE2-CB 3.56Å; F145-C149 HydrophobicContact CZ-CB 4.07Å; F145-C149 WeakPolarHBondContact O-CB 3.44Å; F145-C149 PolarHBondContact O-N 3.21Å; C149-A153 VanDerWaalsContact O-CB 3.29Å; C149-A153 WeakPolarHBondContact O-CB 3.35Å; C149-A153 PolarHBondContact O-N 2.94Å
150	I	81.7	Confident	82.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.313	C	S	.	.	I	π-helix	trans	-85.5	-54.3	-172.3	-62.1	172.9	0	0	0	110.5	F145 Y146 S152 A153 T154 V202 Q414 I415	F145-I150 HydrophobicContact CD1-CD1 4.26Å; F145-I150 HydrophobicContact CE1-CD1 3.65Å; F145-I150 HydrophobicContact CE1-CG1 4.12Å; F145-I150 HydrophobicContact CZ-CD1 4.37Å; F145-I150 HydrophobicContact CZ-CG1 4.42Å; Y146-I150 HydrophobicContact CD2-CB 4.11Å; Y146-I150 HydrophobicContact CD2-CD1 3.79Å; Y146-I150 HydrophobicContact CD2-CG1 4.5Å; Y146-I150 HydrophobicContact CD2-CG2 4.22Å; Y146-I150 HydrophobicContact CE2-CB 4.26Å; Y146-I150 HydrophobicContact CE2-CD1 4.32Å; Y146-I150 HydrophobicContact CE2-CG2 3.88Å; Y146-I150 WeakPolarHBondContact O-CB 3.49Å; Y146-I150 PolarHBondContact O-N 3.24Å; Y146-I150 VanDerWaalsContact O-N 3.13Å; I150-S152 VanDerWaalsContact C-N 3.33Å; I150-S152 PolarHBondContact O-N 3.49Å; I150-A153 WeakPolarHBondContact O-CB 3.38Å; I150-A153 PolarHBondContact O-N 2.95Å; I150-A153 VanDerWaalsContact O-N 3.07Å; I150-T154 PolarHBondContact O-N 3.31Å; I150-T154 VanDerWaalsContact O-N 3.14Å; I150-T154 PolarHBondContact O-OG1 3.42Å; I150-V202 HydrophobicContact CD1-CG1 4.4Å; I150-V202 HydrophobicContact CG1-CG1 3.92Å; I150-V202 HydrophobicContact CG2-CG1 4.28Å; I150-Q414 HydrophobicContact CD1-CB 4.05Å; I150-Q414 HydrophobicContact CG2-CB 4.02Å; I150-Q414 HydrophobicContact CG2-CG 4.34Å; I150-I415 HydrophobicContact CD1-CG1 3.71Å
151	R	82	Confident	83.1	Confident	143 Å²	143	57.2 Å²	57.2	54%	0.54	30%	0.297	S	S	.	.	I	π-helix	trans	-64.9	-35.9	-177.1	-163.9	171.5	71.2	105.5	-4.6	112.6	Y146 E147 A153 T154 G155	Y146-R151 PolarHBondContact O-N 2.89Å; E147-R151 WeakPolarHBondContact O-CB 3.39Å; E147-R151 IonicContact OE1-NE 2.9Å; E147-R151 PolarHBondContact OE1-NE 3.13Å; E147-R151 IonicContact OE2-CZ 3.38Å; E147-R151 IonicContact OE2-NE 3.95Å; E147-R151 PolarHBondContact OE2-NE 2.92Å; E147-R151 IonicContact OE2-NH2 2.72Å; E147-R151 PolarHBondContact OE2-NH2 3.3Å; R151-A153 VanDerWaalsContact C-N 3.34Å; R151-T154 PolarHBondContact O-N 3.04Å; R151-T154 PolarHBondContact O-OG1 3.24Å; R151-G155 PolarHBondContact O-N 3.35Å
152	S	74.6	Confident	83.5	Confident	67 Å²	67	60 Å²	60	47%	0.469	31%	0.306	S	S	.	.	H	α-helix	trans	-65.5	-36.4	172.6	-57.6	0	0	0	0	112.7	H148 I150 T154	H148-S152 WeakPolarHBondContact O-CB 3.38Å; H148-S152 PolarHBondContact O-OG 2.78Å; I150-S152 VanDerWaalsContact C-N 3.33Å; I150-S152 PolarHBondContact O-N 3.49Å; S152-T154 VanDerWaalsContact C-N 3.34Å
153	A	71.9	Confident	83.8	Confident	17 Å²	17	63.4 Å²	63.4	14%	0.14	32%	0.321	C	S	.	.	H	α-helix	trans	-68.7	-35	179.6	0	0	0	0	0	111.9	C149 I150 R151 R204	C149-A153 VanDerWaalsContact O-CB 3.29Å; C149-A153 WeakPolarHBondContact O-CB 3.35Å; C149-A153 PolarHBondContact O-N 2.94Å; I150-A153 WeakPolarHBondContact O-CB 3.38Å; I150-A153 PolarHBondContact O-N 2.95Å; I150-A153 VanDerWaalsContact O-N 3.07Å; R151-A153 VanDerWaalsContact C-N 3.34Å; A153-R204 PolarHBondContact O-NE 3.33Å; A153-R204 PolarHBondContact O-NH2 2.89Å
154	T	73.8	Confident	84.2	Confident	34 Å²	34	60.8 Å²	60.8	21%	0.209	31%	0.307	C	S	.	.	H	α-helix	trans	-90.8	-2.3	-177.9	57.9	0	0	0	0	114.8	I150 R151 S152 D156 A157 H201	I150-T154 PolarHBondContact O-N 3.31Å; I150-T154 VanDerWaalsContact O-N 3.14Å; I150-T154 PolarHBondContact O-OG1 3.42Å; R151-T154 PolarHBondContact O-N 3.04Å; R151-T154 PolarHBondContact O-OG1 3.24Å; S152-T154 VanDerWaalsContact C-N 3.34Å; T154-D156 PolarHBondContact O-N 3.49Å; T154-D156 VanDerWaalsContact O-N 3.11Å; T154-A157 WeakPolarHBondContact O-CB 3.49Å; T154-A157 PolarHBondContact O-N 3.4Å; T154-H201 WeakPolarHBondContact CG2-O 3.43Å
155	G	76.3	Confident	84.7	Confident	59 Å²	59	58.1 Å²	58.1	61%	0.608	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-27.3	-179	0	0	0	0	0	115	R151	R151-G155 PolarHBondContact O-N 3.35Å
156	D	82.8	Confident	85	Confident	80 Å²	80	59.7 Å²	59.7	43%	0.428	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-3.9	176.6	-64.4	-42.5	0	0	0	113.1	T154 T158 R159 T160 R204 L206	T154-D156 PolarHBondContact O-N 3.49Å; T154-D156 VanDerWaalsContact O-N 3.11Å; D156-T158 PolarHBondContact O-N 2.88Å; D156-R159 PolarHBondContact O-N 3.41Å; D156-T160 WeakPolarHBondContact O-CB 3.47Å; D156-T160 PolarHBondContact O-N 3.47Å; D156-T160 PolarHBondContact O-OG1 3.01Å; D156-R204 IonicContact OD2-NH2 3.59Å; D156-L206 HydrophobicContact CB-CD1 4.21Å
157	A	86.4	Confident	85.4	Confident	18 Å²	18	57.6 Å²	57.6	15%	0.149	30%	0.303	C	S	.	.	H	α-helix	trans	-60.7	-45.6	-169.5	0	0	0	0	0	113.4	T154 R159 T160 R161 M196 L206	T154-A157 WeakPolarHBondContact O-CB 3.49Å; T154-A157 PolarHBondContact O-N 3.4Å; A157-R159 PolarHBondContact O-N 3Å; A157-T160 PolarHBondContact O-N 3.49Å; A157-R161 WeakPolarHBondContact O-CB 3.4Å; A157-R161 PolarHBondContact O-N 2.65Å; A157-M196 HydrophobicContact CB-CE 3.86Å; A157-M196 HydrophobicContact CB-SD 4.3Å; A157-L206 HydrophobicContact CB-CD1 4.42Å; A157-L206 HydrophobicContact CB-CD2 4.44Å
158	T	88.5	Confident	85.9	Confident	78 Å²	78	53.8 Å²	53.8	48%	0.479	29%	0.285	S	S	.	.	H	α-helix	trans	-61.6	-46.4	179	-50.7	0	0	0	0	111.4	D156 T160 R161 E162	D156-T158 PolarHBondContact O-N 2.88Å; T158-T160 PolarHBondContact O-N 3.25Å; T158-R161 WeakPolarHBondContact O-CB 3.24Å; T158-R161 PolarHBondContact O-N 2.79Å; T158-E162 WeakPolarHBondContact O-CG 3.4Å; T158-E162 PolarHBondContact O-N 2.65Å
159	R	89.8	Confident	86.6	Confident	192 Å²	192	54.1 Å²	54.1	73%	0.725	29%	0.289	S	S	*	.	H	α-helix	trans	-65.4	-40.6	178.8	-176.2	-178.5	178.7	179.6	2.5	111.9	D156 A157 F163	D156-R159 PolarHBondContact O-N 3.41Å; A157-R159 PolarHBondContact O-N 3Å; R159-F163 WeakPolarHBondContact O-CB 3.23Å; R159-F163 PolarHBondContact O-N 2.69Å; R159-F163 VanDerWaalsContact O-N 3.08Å
160	T	89.7	Confident	87.3	Confident	18 Å²	18	55.3 Å²	55.3	11%	0.11	29%	0.294	C	S	.	.	H	α-helix	trans	-63.6	-43.1	175	-66.5	0	0	0	0	111	D156 A157 T158 F163 V164 L206 M348	D156-T160 WeakPolarHBondContact O-CB 3.47Å; D156-T160 PolarHBondContact O-N 3.47Å; D156-T160 PolarHBondContact O-OG1 3.01Å; A157-T160 PolarHBondContact O-N 3.49Å; T158-T160 PolarHBondContact O-N 3.25Å; T160-F163 PolarHBondContact O-N 2.89Å; T160-V164 HydrophobicContact CG2-CG2 4.4Å; T160-V164 VanDerWaalsContact O-CG2 3.31Å; T160-V164 WeakPolarHBondContact O-CG2 3.31Å; T160-V164 PolarHBondContact O-N 3.44Å; T160-L206 HydrophobicContact CG2-CB 4.09Å; T160-L206 HydrophobicContact CG2-CD1 4.16Å; T160-L206 WeakPolarHBondContact OG1-CD1 3.33Å; T160-M348 HydrophobicContact CG2-CE 4.25Å; T160-M348 HydrophobicContact CG2-CG 4.25Å; T160-M348 HydrophobicContact CG2-SD 3.8Å
161	R	91.8	Very high	87.8	Confident	67 Å²	67	55.3 Å²	55.3	25%	0.253	29%	0.294	S	S	.	.	H	α-helix	trans	-59.6	-55.1	176.6	-173.3	-172.3	66.8	-169.6	-1.8	111	A157 T158 F163 V164 E165 Y197	A157-R161 WeakPolarHBondContact O-CB 3.4Å; A157-R161 PolarHBondContact O-N 2.65Å; T158-R161 WeakPolarHBondContact O-CB 3.24Å; T158-R161 PolarHBondContact O-N 2.79Å; R161-F163 VanDerWaalsContact C-N 3.26Å; R161-F163 PolarHBondContact O-N 3.49Å; R161-V164 PolarHBondContact O-N 2.66Å; R161-V164 VanDerWaalsContact O-N 3.1Å; R161-E165 HydrophobicContact CG-CG 4.1Å; R161-E165 WeakPolarHBondContact CG-OE1 3.29Å; R161-E165 IonicContact NE-OE1 3.07Å; R161-E165 IonicContact NE-OE2 2.97Å; R161-E165 WeakPolarHBondContact O-CB 3.37Å; R161-E165 VanDerWaalsContact O-CG 3.28Å; R161-E165 WeakPolarHBondContact O-CG 3.3Å; R161-E165 PolarHBondContact O-N 3.05Å; R161-Y197 VanDerWaalsContact CD-CE1 3.48Å; R161-Y197 HydrophobicContact CG-CD1 4.48Å; R161-Y197 HydrophobicContact CG-CE1 3.69Å
162	E	92.9	Very high	88.3	Confident	114 Å²	114	48.5 Å²	48.5	53%	0.533	27%	0.268	S	S	.	.	H	α-helix	trans	-56.9	-40.1	-179.6	-72.2	169.2	-177.9	0	0	112.4	T158 G166	T158-E162 WeakPolarHBondContact O-CG 3.4Å; T158-E162 PolarHBondContact O-N 2.65Å; E162-G166 PolarHBondContact O-N 2.6Å
163	F	93.1	Very high	89.2	Confident	72 Å²	72	51.2 Å²	51.2	32%	0.316	27%	0.273	S	S	.	.	H	α-helix	trans	-67	-44	176.9	175.5	-97.2	0	0	0	112.6	R159 T160 R161 F167 F325 I340 F342 M348	R159-F163 WeakPolarHBondContact O-CB 3.23Å; R159-F163 PolarHBondContact O-N 2.69Å; R159-F163 VanDerWaalsContact O-N 3.08Å; T160-F163 PolarHBondContact O-N 2.89Å; R161-F163 VanDerWaalsContact C-N 3.26Å; R161-F163 PolarHBondContact O-N 3.49Å; F163-F167 WeakPolarHBondContact O-CB 3.39Å; F163-F167 PolarHBondContact O-N 3.4Å; F163-F167 VanDerWaalsContact O-N 3.08Å; F163-F325 HydrophobicContact CE2-CE1 4.28Å; F163-F325 HydrophobicContact CZ-CD1 4.27Å; F163-F325 AromaticContact CZ-CE1 3.64Å; F163-F325 HydrophobicContact CZ-CE1 3.64Å; F163-F325 HydrophobicContact CZ-CZ 4.24Å; F163-I340 HydrophobicContact CD1-CD1 4.48Å; F163-I340 HydrophobicContact CE1-CD1 3.7Å; F163-I340 HydrophobicContact CZ-CD1 4.49Å; F163-F342 HydrophobicContact CE1-CE1 4.37Å; F163-F342 AromaticContact CE1-CZ 3.8Å; F163-F342 HydrophobicContact CE1-CZ 3.8Å; F163-F342 AromaticContact CZ-CE1 3.98Å; F163-F342 HydrophobicContact CZ-CE1 3.98Å; F163-F342 AromaticContact CZ-CZ 3.88Å; F163-F342 HydrophobicContact CZ-CZ 3.88Å; F163-M348 HydrophobicContact CD1-CE 3.91Å; F163-M348 HydrophobicContact CD1-SD 3.59Å; F163-M348 VanDerWaalsContact CD1-SD 3.59Å; F163-M348 HydrophobicContact CE1-CE 4.18Å; F163-M348 HydrophobicContact CE1-SD 3.94Å
164	V	93.1	Very high	90.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-69	-42.3	178.7	173.9	0	0	0	0	110.8	T160 R161 F167 V168 C208 L210 M348 F350	T160-V164 HydrophobicContact CG2-CG2 4.4Å; T160-V164 VanDerWaalsContact O-CG2 3.31Å; T160-V164 WeakPolarHBondContact O-CG2 3.31Å; T160-V164 PolarHBondContact O-N 3.44Å; R161-V164 PolarHBondContact O-N 2.66Å; R161-V164 VanDerWaalsContact O-N 3.1Å; V164-F167 PolarHBondContact O-N 3.1Å; V164-V168 HydrophobicContact CG1-CG2 4.09Å; V164-V168 WeakPolarHBondContact O-CB 3.5Å; V164-V168 WeakPolarHBondContact O-CG2 3.41Å; V164-V168 PolarHBondContact O-N 3.3Å; V164-C208 HydrophobicContact CB-CB 4.46Å; V164-C208 HydrophobicContact CG1-CB 3.93Å; V164-L210 HydrophobicContact CG1-CD1 4.16Å; V164-M348 HydrophobicContact CG2-CG 4.3Å; V164-M348 HydrophobicContact CG2-SD 3.52Å; V164-M348 VanDerWaalsContact CG2-SD 3.52Å; V164-F350 HydrophobicContact CG1-CB 3.96Å; V164-F350 HydrophobicContact CG1-CD2 4.23Å; V164-F350 HydrophobicContact CG1-CG 4.1Å
165	E	94.5	Very high	90.7	Very high	48 Å²	48	49.4 Å²	49.4	22%	0.224	26%	0.261	C	S	.	.	H	α-helix	trans	-56.1	-54.9	175.4	-74.1	175	154.7	0	0	110.7	R161 F167 V168 D169 F190 Y197	R161-E165 HydrophobicContact CG-CG 4.1Å; R161-E165 WeakPolarHBondContact CG-OE1 3.29Å; R161-E165 IonicContact NE-OE1 3.07Å; R161-E165 IonicContact NE-OE2 2.97Å; R161-E165 WeakPolarHBondContact O-CB 3.37Å; R161-E165 VanDerWaalsContact O-CG 3.28Å; R161-E165 WeakPolarHBondContact O-CG 3.3Å; R161-E165 PolarHBondContact O-N 3.05Å; E165-F167 VanDerWaalsContact C-N 3.31Å; E165-F167 PolarHBondContact O-N 2.96Å; E165-V168 PolarHBondContact O-N 3.12Å; E165-V168 VanDerWaalsContact O-N 3.1Å; E165-D169 PolarHBondContact O-N 3.39Å; E165-F190 HydrophobicContact CB-CE2 4.23Å; E165-F190 HydrophobicContact CB-CZ 3.7Å; E165-F190 HydrophobicContact CG-CE2 3.8Å; E165-F190 HydrophobicContact CG-CZ 3.82Å; E165-F190 WeakPolarHBondContact O-CE1 3.5Å; E165-Y197 VanDerWaalsContact OE1-CE1 3.29Å; E165-Y197 WeakPolarHBondContact OE1-CE1 3.49Å
166	G	94.2	Very high	91.3	Very high	33 Å²	33	51.2 Å²	51.2	34%	0.34	25%	0.25	S	C	.	.	H	α-helix	trans	-62.4	-35.5	179.7	0	0	0	0	0	113.6	E162 D170	E162-G166 PolarHBondContact O-N 2.6Å; G166-D170 PolarHBondContact O-N 3.04Å
167	F	94.1	Very high	91.4	Very high	3 Å²	3	51 Å²	51	1%	0.013	26%	0.255	C	S	.	.	H	α-helix	trans	-68	-40.7	174	171.5	-114.4	0	0	0	112.6	F163 V164 E165 D170 L171 W316 I319 Y323 F325 L327 I340 F350	F163-F167 WeakPolarHBondContact O-CB 3.39Å; F163-F167 PolarHBondContact O-N 3.4Å; F163-F167 VanDerWaalsContact O-N 3.08Å; V164-F167 PolarHBondContact O-N 3.1Å; E165-F167 VanDerWaalsContact C-N 3.31Å; E165-F167 PolarHBondContact O-N 2.96Å; F167-D170 PolarHBondContact O-N 3.15Å; F167-L171 HydrophobicContact CE1-CD2 4.45Å; F167-L171 HydrophobicContact CZ-CD2 4.45Å; F167-L171 WeakPolarHBondContact O-CB 3.43Å; F167-L171 PolarHBondContact O-N 3.3Å; F167-W316 HydrophobicContact CE2-CE3 4.13Å; F167-W316 AromaticContact CE2-CZ3 3.76Å; F167-W316 HydrophobicContact CE2-CZ3 3.76Å; F167-W316 HydrophobicContact CZ-CE3 4.07Å; F167-W316 AromaticContact CZ-CZ3 3.99Å; F167-W316 HydrophobicContact CZ-CZ3 3.99Å; F167-I319 HydrophobicContact CE2-CD1 4.27Å; F167-Y323 HydrophobicContact CD2-CE1 4.14Å; F167-Y323 HydrophobicContact CD2-CE2 4.04Å; F167-Y323 AromaticContact CD2-CZ 3.8Å; F167-Y323 HydrophobicContact CE2-CD2 4.39Å; F167-Y323 HydrophobicContact CE2-CE2 4.2Å; F167-F325 HydrophobicContact CD2-CE2 4.03Å; F167-F325 AromaticContact CD2-CZ 3.67Å; F167-F325 HydrophobicContact CD2-CZ 3.67Å; F167-F325 AromaticContact CE2-CE2 3.72Å; F167-F325 HydrophobicContact CE2-CE2 3.72Å; F167-F325 AromaticContact CE2-CZ 3.85Å; F167-F325 HydrophobicContact CE2-CZ 3.85Å; F167-F325 HydrophobicContact CG-CZ 4.23Å; F167-F325 HydrophobicContact CZ-CE2 4.06Å; F167-L327 HydrophobicContact CE1-CD1 4.08Å; F167-L327 HydrophobicContact CZ-CD1 4.22Å; F167-L327 HydrophobicContact CZ-CD2 4.39Å; F167-I340 HydrophobicContact CD1-CD1 3.67Å; F167-I340 HydrophobicContact CD1-CG1 4.35Å; F167-I340 HydrophobicContact CE1-CD1 4.06Å; F167-I340 HydrophobicContact CE1-CG1 4.23Å; F167-I340 HydrophobicContact CG-CD1 4.26Å; F167-F350 HydrophobicContact CD1-CZ 4.2Å; F167-F350 HydrophobicContact CE1-CE1 4.22Å; F167-F350 AromaticContact CE1-CZ 3.74Å; F167-F350 HydrophobicContact CE1-CZ 3.74Å
168	V	94	Very high	90.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-71.6	-36.2	-179.7	174.3	0	0	0	0	110.7	V164 E165 L171 L172 F190 L210 F350 L352	V164-V168 HydrophobicContact CG1-CG2 4.09Å; V164-V168 WeakPolarHBondContact O-CB 3.5Å; V164-V168 WeakPolarHBondContact O-CG2 3.41Å; V164-V168 PolarHBondContact O-N 3.3Å; E165-V168 PolarHBondContact O-N 3.12Å; E165-V168 VanDerWaalsContact O-N 3.1Å; V168-L171 PolarHBondContact O-N 3.34Å; V168-L172 HydrophobicContact CG1-CD1 4.06Å; V168-L172 HydrophobicContact CG1-CG 4.11Å; V168-L172 WeakPolarHBondContact O-CB 3.49Å; V168-L172 WeakPolarHBondContact O-CG 3.08Å; V168-L172 PolarHBondContact O-N 2.97Å; V168-F190 HydrophobicContact CB-CD1 4.13Å; V168-F190 HydrophobicContact CB-CE1 4.06Å; V168-F190 HydrophobicContact CG1-CB 4.46Å; V168-F190 HydrophobicContact CG1-CD1 3.51Å; V168-F190 HydrophobicContact CG1-CE1 3.97Å; V168-F190 HydrophobicContact CG1-CG 4.15Å; V168-L210 HydrophobicContact CB-CD1 4.05Å; V168-L210 HydrophobicContact CG1-CD1 3.96Å; V168-L210 HydrophobicContact CG2-CD1 3.7Å; V168-F350 HydrophobicContact CG2-CD2 4.12Å; V168-F350 HydrophobicContact CG2-CE2 3.82Å; V168-L352 HydrophobicContact CG1-CD1 4.4Å; V168-L352 HydrophobicContact CG1-CD2 3.78Å; V168-L352 HydrophobicContact CG2-CD2 3.99Å
169	D	94.7	Very high	90.3	Very high	71 Å²	71	50.1 Å²	50.1	38%	0.38	25%	0.248	S	C	.	.	H	α-helix	trans	-55.8	-52.4	171.3	-80.6	-36.6	0	0	0	110.9	E165 L171 L172 E173 F190	E165-D169 PolarHBondContact O-N 3.39Å; D169-L171 VanDerWaalsContact C-N 3.27Å; D169-L171 PolarHBondContact O-N 3.22Å; D169-L172 PolarHBondContact O-N 3.36Å; D169-E173 WeakPolarHBondContact O-CB 3.08Å; D169-E173 PolarHBondContact O-N 2.87Å; D169-F190 HydrophobicContact CB-CE1 4.34Å; D169-F190 VanDerWaalsContact CG-CE1 3.44Å; D169-F190 WeakPolarHBondContact OD1-CE1 3.32Å
170	D	93.6	Very high	89.4	Confident	48 Å²	48	44.8 Å²	44.8	26%	0.257	23%	0.234	S	C	.	.	H	α-helix	trans	-58.2	-38.1	176.3	-90	19.1	0	0	0	112.6	G166 F167 A174 I319 Y323	G166-D170 PolarHBondContact O-N 3.04Å; F167-D170 PolarHBondContact O-N 3.15Å; D170-A174 VanDerWaalsContact O-CB 3.3Å; D170-A174 WeakPolarHBondContact O-CB 3.3Å; D170-A174 PolarHBondContact O-N 2.55Å; D170-I319 HydrophobicContact CB-CD1 4.47Å; D170-Y323 WeakPolarHBondContact CB-OH 3.35Å; D170-Y323 VanDerWaalsContact CG-OH 3.25Å; D170-Y323 PolarHBondContact OD2-OH 3.08Å
171	L	92.6	Very high	88.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-70.4	-42.9	179.3	-176.2	64.4	0	0	0	112	F167 V168 D169 L175 L312 A315 W316 I319 L352	F167-L171 HydrophobicContact CE1-CD2 4.45Å; F167-L171 HydrophobicContact CZ-CD2 4.45Å; F167-L171 WeakPolarHBondContact O-CB 3.43Å; F167-L171 PolarHBondContact O-N 3.3Å; V168-L171 PolarHBondContact O-N 3.34Å; D169-L171 VanDerWaalsContact C-N 3.27Å; D169-L171 PolarHBondContact O-N 3.22Å; L171-L175 WeakPolarHBondContact O-CB 3.49Å; L171-L175 PolarHBondContact O-N 3.36Å; L171-L312 HydrophobicContact CD2-CD2 3.77Å; L171-L312 HydrophobicContact CG-CD2 4.13Å; L171-A315 HydrophobicContact CD1-CB 3.73Å; L171-W316 HydrophobicContact CD1-CB 4.31Å; L171-I319 HydrophobicContact CB-CD1 4.06Å; L171-I319 HydrophobicContact CD1-CD1 3.86Å; L171-I319 HydrophobicContact CD1-CG1 4.49Å; L171-L352 HydrophobicContact CD2-CD1 4.25Å
172	L	92.3	Very high	86.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-70.7	-38	177.1	-68.3	-176.9	0	0	0	111.4	V168 D169 L175 R176 L187 F190 V212	V168-L172 HydrophobicContact CG1-CD1 4.06Å; V168-L172 HydrophobicContact CG1-CG 4.11Å; V168-L172 WeakPolarHBondContact O-CB 3.49Å; V168-L172 WeakPolarHBondContact O-CG 3.08Å; V168-L172 PolarHBondContact O-N 2.97Å; D169-L172 PolarHBondContact O-N 3.36Å; L172-L175 WeakPolarHBondContact O-CB 3.2Å; L172-L175 PolarHBondContact O-N 3.1Å; L172-L175 VanDerWaalsContact O-N 3.15Å; L172-R176 WeakPolarHBondContact O-CG 3.4Å; L172-R176 PolarHBondContact O-N 2.85Å; L172-L187 HydrophobicContact CD2-CD1 4.29Å; L172-F190 HydrophobicContact CD1-CB 4.08Å; L172-F190 HydrophobicContact CD1-CD1 3.93Å; L172-V212 HydrophobicContact CD1-CG1 4.17Å; L172-V212 HydrophobicContact CD1-CG2 4.37Å; L172-V212 HydrophobicContact CD2-CG1 3.93Å; L172-V212 HydrophobicContact CD2-CG2 4.46Å
173	E	92.3	Very high	85.6	Confident	123 Å²	123	54 Å²	54	58%	0.575	28%	0.281	S	S	*	.	H	α-helix	trans	-61.5	-46	173.2	-172.3	-176.8	-169.8	0	0	111	D169 L175 R176 S177	D169-E173 WeakPolarHBondContact O-CB 3.08Å; D169-E173 PolarHBondContact O-N 2.87Å; E173-L175 PolarHBondContact O-N 2.89Å; E173-R176 PolarHBondContact O-N 3.04Å; E173-S177 PolarHBondContact O-N 2.86Å
174	A	90.7	Very high	84.8	Confident	10 Å²	10	53.4 Å²	53.4	8%	0.083	28%	0.281	C	S	.	.	H	α-helix	trans	-59.9	-37.3	174.4	0	0	0	0	0	111.8	D170 S177 V178 A315 I319	D170-A174 VanDerWaalsContact O-CB 3.3Å; D170-A174 WeakPolarHBondContact O-CB 3.3Å; D170-A174 PolarHBondContact O-N 2.55Å; A174-S177 PolarHBondContact O-N 3.5Å; A174-S177 PolarHBondContact O-OG 2.75Å; A174-V178 WeakPolarHBondContact O-CG2 3.37Å; A174-V178 PolarHBondContact O-N 2.96Å; A174-A315 HydrophobicContact CB-CB 4.31Å; A174-I319 HydrophobicContact CB-CG2 3.46Å; A174-I319 VanDerWaalsContact CB-CG2 3.46Å
175	L	87.6	Confident	84.4	Confident	3 Å²	3	53.9 Å²	53.9	2%	0.016	28%	0.284	C	S	.	.	H	α-helix	trans	-67.6	-46.6	177.5	-174.2	46.9	0	0	0	112.1	L171 L172 E173 S177 V178 C179 L187 A311 L312 A315	L171-L175 WeakPolarHBondContact O-CB 3.49Å; L171-L175 PolarHBondContact O-N 3.36Å; L172-L175 WeakPolarHBondContact O-CB 3.2Å; L172-L175 PolarHBondContact O-N 3.1Å; L172-L175 VanDerWaalsContact O-N 3.15Å; E173-L175 PolarHBondContact O-N 2.89Å; L175-S177 PolarHBondContact O-N 3.26Å; L175-V178 WeakPolarHBondContact O-CB 3.24Å; L175-V178 PolarHBondContact O-N 3Å; L175-C179 PolarHBondContact O-N 3.48Å; L175-C179 PolarHBondContact O-SG 2.91Å; L175-L187 HydrophobicContact CD2-CD1 3.14Å; L175-L187 HydrophobicContact CG-CD1 3.67Å; L175-A311 HydrophobicContact CD1-CB 3.76Å; L175-A311 HydrophobicContact CD2-CB 4.06Å; L175-L312 HydrophobicContact CD2-CD2 4.34Å; L175-A315 HydrophobicContact CB-CB 3.84Å; L175-A315 HydrophobicContact CD1-CB 4.27Å
176	R	87.9	Confident	83.9	Confident	97 Å²	97	55 Å²	55	37%	0.366	29%	0.289	S	S	.	.	H	α-helix	trans	-58	-31.6	174	-68.9	171.9	-168.8	149.5	7.3	112.4	L172 E173 V178 L187 E188 D189	L172-R176 WeakPolarHBondContact O-CG 3.4Å; L172-R176 PolarHBondContact O-N 2.85Å; E173-R176 PolarHBondContact O-N 3.04Å; R176-V178 VanDerWaalsContact C-N 3.27Å; R176-V178 PolarHBondContact O-N 3.46Å; R176-L187 PolarHBondContact NE-O 3.34Å; R176-L187 PolarHBondContact NH2-O 3.34Å; R176-E188 PolarHBondContact NH2-O 2.54Å; R176-D189 IonicContact CZ-OD1 3.16Å; R176-D189 VanDerWaalsContact CZ-OD1 3.24Å; R176-D189 IonicContact NH1-OD1 2.92Å; R176-D189 PolarHBondContact NH1-OD1 2.78Å; R176-D189 VanDerWaalsContact NH2-N 3.16Å; R176-D189 IonicContact NH2-OD1 2.94Å; R176-D189 PolarHBondContact NH2-OD1 2.88Å
177	S	84.8	Confident	83.6	Confident	76 Å²	76	54 Å²	54	53%	0.531	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-14.5	174.6	83.7	0	0	0	0	114.8	E173 A174 L175 R318	E173-S177 PolarHBondContact O-N 2.86Å; A174-S177 PolarHBondContact O-N 3.5Å; A174-S177 PolarHBondContact O-OG 2.75Å; L175-S177 PolarHBondContact O-N 3.26Å; S177-R318 PolarHBondContact O-NH1 2.88Å; S177-R318 VanDerWaalsContact O-NH1 3.15Å; S177-R318 PolarHBondContact OG-NH1 3.19Å
178	V	77.3	Confident	83.4	Confident	45 Å²	45	57 Å²	57	27%	0.273	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-37.5	179.3	-175.2	0	0	0	0	110.4	A174 L175 R176 R318	A174-V178 WeakPolarHBondContact O-CG2 3.37Å; A174-V178 PolarHBondContact O-N 2.96Å; L175-V178 WeakPolarHBondContact O-CB 3.24Å; L175-V178 PolarHBondContact O-N 3Å; R176-V178 VanDerWaalsContact C-N 3.27Å; R176-V178 PolarHBondContact O-N 3.46Å; V178-R318 VanDerWaalsContact CG2-NH1 3.28Å
179	C	74.9	Confident	83.3	Confident	32 Å²	32	61.9 Å²	61.9	22%	0.216	32%	0.316	C	S	.	.	S	Bend	trans	-68.9	134.7	-176.1	-66.8	0	0	0	0	111.4	L175 D184	L175-C179 PolarHBondContact O-N 3.48Å; L175-C179 PolarHBondContact O-SG 2.91Å; C179-D184 WeakPolarHBondContact CA-OD2 3.3Å; C179-D184 HydrophobicContact CB-CB 3.88Å
180	N	71.4	Confident	83.3	Confident	81 Å²	81	60 Å²	60	43%	0.433	30%	0.304	S	S	.	.			trans	-84.5	122.3	167.8	-177.5	22	0	0	0	109.1	D182 T183 D184	N180-D182 PolarHBondContact O-N 2.91Å; N180-D182 VanDerWaalsContact O-N 3.11Å; N180-T183 WeakPolarHBondContact CB-OG1 3.38Å; N180-T183 PolarHBondContact ND2-OG1 3.27Å; N180-T183 VanDerWaalsContact ND2-OG1 3.16Å; N180-T183 PolarHBondContact O-N 3.01Å; N180-T183 VanDerWaalsContact O-N 3.15Å; N180-D184 PolarHBondContact N-OD2 2.84Å; N180-D184 WeakPolarHBondContact O-CB 3.5Å; N180-D184 PolarHBondContact O-N 3.32Å
181	R	65.6	Low	83.3	Confident	179 Å²	179	59 Å²	59	68%	0.675	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-27.6	-172.1	-63.6	-165.9	68.8	-149.8	-3.7	114.1	E186	R181-E186 IonicContact CZ-OE1 3.54Å; R181-E186 IonicContact NE-OE1 2.69Å; R181-E186 PolarHBondContact NE-OE1 3.33Å; R181-E186 IonicContact NH2-OE1 3.53Å; R181-E186 PolarHBondContact NH2-OE1 2.91Å; R181-E186 IonicContact NH2-OE2 2.76Å
182	D	62.8	Low	83.3	Confident	125 Å²	125	59.2 Å²	59.2	67%	0.668	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-14.4	-175.3	-56.3	-32.2	0	0	0	113.1	N180	N180-D182 PolarHBondContact O-N 2.91Å; N180-D182 VanDerWaalsContact O-N 3.11Å
183	T	65.6	Low	83.1	Confident	88 Å²	88	59.3 Å²	59.3	54%	0.54	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130	-25.4	-171.3	60.8	0	0	0	0	114.4	N180	N180-T183 WeakPolarHBondContact CB-OG1 3.38Å; N180-T183 PolarHBondContact ND2-OG1 3.27Å; N180-T183 VanDerWaalsContact ND2-OG1 3.16Å; N180-T183 PolarHBondContact O-N 3.01Å; N180-T183 VanDerWaalsContact O-N 3.15Å
184	D	77.6	Confident	82.9	Confident	60 Å²	60	56.5 Å²	56.5	32%	0.321	29%	0.29	S	S	.	.	S	Bend	trans	-103.1	153.7	-178.1	-65.5	-46.9	0	0	0	111.2	C179 N180 E186	C179-D184 WeakPolarHBondContact CA-OD2 3.3Å; C179-D184 HydrophobicContact CB-CB 3.88Å; N180-D184 PolarHBondContact N-OD2 2.84Å; N180-D184 WeakPolarHBondContact O-CB 3.5Å; N180-D184 PolarHBondContact O-N 3.32Å; D184-E186 PolarHBondContact O-N 2.89Å
185	M	83.6	Confident	82.7	Confident	9 Å²	9	56.7 Å²	56.7	4%	0.044	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-59.9	133.7	173.1	-54.8	-79.1	170.1	0	0	110.3	F214 I215 P216 F222 L290 L291 W307	M185-F214 HydrophobicContact CB-CD2 4.43Å; M185-F214 HydrophobicContact SD-CD2 4.29Å; M185-F214 HydrophobicContact SD-CE2 4.44Å; M185-I215 WeakPolarHBondContact CA-O 3.33Å; M185-P216 VanDerWaalsContact SD-CA 3.58Å; M185-P216 HydrophobicContact SD-CB 4.1Å; M185-F222 HydrophobicContact SD-CZ 4.01Å; M185-L290 HydrophobicContact CE-CB 4.45Å; M185-L290 HydrophobicContact CE-CD2 3.85Å; M185-L291 HydrophobicContact CE-CD1 4.17Å; M185-L291 HydrophobicContact CE-CG 4.43Å; M185-W307 HydrophobicContact CB-CH2 3.65Å; M185-W307 HydrophobicContact CB-CZ2 3.54Å; M185-W307 HydrophobicContact CG-CH2 4.12Å; M185-W307 HydrophobicContact CG-CZ2 3.89Å
186	E	84.5	Confident	82.8	Confident	71 Å²	71	57 Å²	57	33%	0.332	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	133.8	175.4	-66.6	-164.2	150.7	0	0	109.9	R181 D184 F214 I215	R181-E186 IonicContact CZ-OE1 3.54Å; R181-E186 IonicContact NE-OE1 2.69Å; R181-E186 PolarHBondContact NE-OE1 3.33Å; R181-E186 IonicContact NH2-OE1 3.53Å; R181-E186 PolarHBondContact NH2-OE1 2.91Å; R181-E186 IonicContact NH2-OE2 2.76Å; D184-E186 PolarHBondContact O-N 2.89Å; E186-F214 CarbonylContact O-C 3.58Å; E186-F214 VanDerWaalsContact O-CA 3.24Å; E186-F214 WeakPolarHBondContact O-CA 3.46Å; E186-F214 WeakPolarHBondContact O-CB 3.4Å; E186-I215 PolarHBondContact N-O 3.02Å; E186-I215 PolarHBondContact O-N 2.99Å
187	L	87.6	Confident	82.9	Confident	14 Å²	14	53.4 Å²	53.4	7%	0.073	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128.1	178.1	-66.7	179.2	0	0	0	111	L172 L175 R176 V212 F214 W307 F308	L172-L187 HydrophobicContact CD2-CD1 4.29Å; L175-L187 HydrophobicContact CD2-CD1 3.14Å; L175-L187 HydrophobicContact CG-CD1 3.67Å; R176-L187 PolarHBondContact NE-O 3.34Å; R176-L187 PolarHBondContact NH2-O 3.34Å; L187-V212 HydrophobicContact CB-CG1 4.47Å; L187-V212 HydrophobicContact CD2-CG1 4.14Å; L187-F214 HydrophobicContact CD2-CB 3.51Å; L187-W307 HydrophobicContact CD2-CH2 3.8Å; L187-W307 HydrophobicContact CD2-CZ3 4.39Å; L187-W307 HydrophobicContact CG-CH2 4.4Å; L187-F308 HydrophobicContact CD1-CE2 4.26Å; L187-F308 HydrophobicContact CD2-CE2 4.32Å
188	E	90.1	Very high	83.2	Confident	66 Å²	66	50.1 Å²	50.1	31%	0.308	26%	0.255	S	S	.	.			trans	-81.7	178.2	172.8	-63.4	179.1	-151.6	0	0	111.9	R176 P213 I215 H357	R176-E188 PolarHBondContact NH2-O 2.54Å; E188-P213 HydrophobicContact CB-CB 3.96Å; E188-P213 HydrophobicContact CB-CG 4.24Å; E188-P213 HydrophobicContact CG-CB 4.25Å; E188-P213 PolarHBondContact N-O 3.09Å; E188-I215 HydrophobicContact CG-CD1 4.31Å; E188-I215 WeakPolarHBondContact OE1-CD1 3.41Å; E188-I215 WeakPolarHBondContact OE1-CG1 3.32Å; E188-H357 IonicContact OE1-CE1 3.77Å; E188-H357 IonicContact OE1-ND1 3.83Å
189	D	91.8	Very high	83.7	Confident	101 Å²	101	53.1 Å²	53.1	54%	0.54	27%	0.27	S	S	.	.			trans	-69.6	151.9	175.9	-67.6	-29.6	0	0	0	111.2	R176 P213	R176-D189 IonicContact CZ-OD1 3.16Å; R176-D189 VanDerWaalsContact CZ-OD1 3.24Å; R176-D189 IonicContact NH1-OD1 2.92Å; R176-D189 PolarHBondContact NH1-OD1 2.78Å; R176-D189 VanDerWaalsContact NH2-N 3.16Å; R176-D189 IonicContact NH2-OD1 2.94Å; R176-D189 PolarHBondContact NH2-OD1 2.88Å; D189-P213 WeakPolarHBondContact O-CD 3.12Å
190	F	93.7	Very high	84.4	Confident	32 Å²	32	52 Å²	52	14%	0.14	26%	0.261	C	S	.	.			trans	-75.3	157.5	-178	66	-103	0	0	0	112.3	E165 V168 D169 L172 L210 F211 V212	E165-F190 HydrophobicContact CB-CE2 4.23Å; E165-F190 HydrophobicContact CB-CZ 3.7Å; E165-F190 HydrophobicContact CG-CE2 3.8Å; E165-F190 HydrophobicContact CG-CZ 3.82Å; E165-F190 WeakPolarHBondContact O-CE1 3.5Å; V168-F190 HydrophobicContact CB-CD1 4.13Å; V168-F190 HydrophobicContact CB-CE1 4.06Å; V168-F190 HydrophobicContact CG1-CB 4.46Å; V168-F190 HydrophobicContact CG1-CD1 3.51Å; V168-F190 HydrophobicContact CG1-CE1 3.97Å; V168-F190 HydrophobicContact CG1-CG 4.15Å; D169-F190 HydrophobicContact CB-CE1 4.34Å; D169-F190 VanDerWaalsContact CG-CE1 3.44Å; D169-F190 WeakPolarHBondContact OD1-CE1 3.32Å; L172-F190 HydrophobicContact CD1-CB 4.08Å; L172-F190 HydrophobicContact CD1-CD1 3.93Å; F190-L210 HydrophobicContact CB-CB 4.39Å; F190-L210 HydrophobicContact CD2-CD1 4.32Å; F190-L210 HydrophobicContact CD2-CD2 3.6Å; F190-L210 HydrophobicContact CD2-CG 4.42Å; F190-L210 HydrophobicContact CE2-CD2 4.07Å; F190-L210 HydrophobicContact CG-CD1 4.43Å; F190-L210 HydrophobicContact CG-CD2 4.35Å; F190-F211 CarbonylContact C-O 3.58Å; F190-F211 WeakPolarHBondContact CA-O 3.12Å; F190-F211 WeakPolarHBondContact CB-O 3.34Å; F190-V212 HydrophobicContact CB-CG2 4.22Å
191	I	93.8	Very high	85.2	Confident	28 Å²	28	49 Å²	49	14%	0.144	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	116.8	176.7	-52.2	170.9	0	0	0	108.4	V193 L210 F211 P213 Y364 V390	I191-V193 HydrophobicContact CG2-CG1 4.29Å; I191-V193 PolarHBondContact O-N 3.26Å; I191-L210 WeakPolarHBondContact O-CA 3.32Å; I191-F211 HydrophobicContact CB-CB 4.32Å; I191-F211 PolarHBondContact N-O 3.48Å; I191-F211 PolarHBondContact O-N 3.01Å; I191-P213 HydrophobicContact CD1-CG 3.96Å; I191-Y364 HydrophobicContact CD1-CE1 4.04Å; I191-Y364 HydrophobicContact CD1-CE2 4.33Å; I191-Y364 WeakPolarHBondContact CD1-OH 3.49Å; I191-V390 HydrophobicContact CG2-CG2 3.88Å
192	G	92.5	Very high	86	Confident	4 Å²	4	41.2 Å²	41.2	4%	0.041	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	123.1	177.1	0	0	0	0	0	113.7	Y197 R393	G192-Y197 VanDerWaalsContact C-CD2 3.41Å; G192-Y197 WeakPolarHBondContact O-CB 3.45Å; G192-R393 PolarHBondContact O-NH1 3.2Å
193	V	89.9	Confident	86.6	Confident	1 Å²	1	38 Å²	38	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	170.3	-174.4	-65.8	0	0	0	0	111.6	I191 Y197 H209 F211 A389 V390	I191-V193 HydrophobicContact CG2-CG1 4.29Å; I191-V193 PolarHBondContact O-N 3.26Å; V193-Y197 VanDerWaalsContact O-CD2 3.24Å; V193-Y197 WeakPolarHBondContact O-CD2 3.3Å; V193-H209 HydrophobicContact CG2-CB 4.06Å; V193-H209 PolarHBondContact N-O 3.5Å; V193-F211 HydrophobicContact CB-CE2 4.49Å; V193-F211 HydrophobicContact CG1-CD2 3.78Å; V193-F211 HydrophobicContact CG1-CE2 3.96Å; V193-F211 HydrophobicContact CG1-CG 4.2Å; V193-F211 HydrophobicContact CG2-CD1 3.75Å; V193-F211 HydrophobicContact CG2-CD2 4.21Å; V193-F211 HydrophobicContact CG2-CE1 3.69Å; V193-F211 HydrophobicContact CG2-CE2 4.14Å; V193-F211 HydrophobicContact CG2-CG 4.03Å; V193-F211 HydrophobicContact CG2-CZ 3.88Å; V193-A389 HydrophobicContact CB-CB 3.95Å; V193-A389 HydrophobicContact CG1-CB 4.02Å; V193-V390 HydrophobicContact CG1-CG2 3.97Å
194	D	86.9	Confident	87.2	Confident	65 Å²	65	40.3 Å²	40.3	35%	0.348	20%	0.197	S	C	.	.	S	Bend	trans	72.9	-176.2	178.8	-154	-12.2	0	0	0	113.7	M196 Y197 E198 H209	D194-M196 PolarHBondContact O-N 3.3Å; D194-Y197 PolarHBondContact O-N 3.24Å; D194-E198 WeakPolarHBondContact O-CG 2.93Å; D194-E198 PolarHBondContact O-N 2.9Å; D194-H209 HydrophobicContact CB-CB 4.16Å
195	S	86.8	Confident	87.4	Confident	14 Å²	14	40.7 Å²	40.7	10%	0.098	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-32.5	-169	56.6	0	0	0	0	116.2	N199 W200 H201	S195-N199 PolarHBondContact O-N 2.96Å; S195-N199 VanDerWaalsContact O-N 3.16Å; S195-W200 PolarHBondContact O-N 2.76Å; S195-H201 PolarHBondContact O-N 2.88Å; S195-H201 VanDerWaalsContact O-N 3.07Å; S195-H201 PolarHBondContact OG-CD2 3.02Å
196	M	89.2	Confident	87.5	Confident	10 Å²	10	41.1 Å²	41.1	5%	0.049	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-37.2	175.6	-80	-65.1	-67	0	0	112.7	A157 D194 H201 L206 L207	A157-M196 HydrophobicContact CB-CE 3.86Å; A157-M196 HydrophobicContact CB-SD 4.3Å; D194-M196 PolarHBondContact O-N 3.3Å; M196-H201 HydrophobicContact CG-CB 4.24Å; M196-H201 HydrophobicContact SD-CB 3.76Å; M196-L206 HydrophobicContact CE-CB 4.22Å; M196-L206 HydrophobicContact CE-CD2 4.49Å; M196-L206 HydrophobicContact SD-CB 4.17Å; M196-L206 HydrophobicContact SD-CD2 3.91Å; M196-L207 WeakPolarHBondContact CG-O 3.25Å
197	Y	89.7	Confident	87.6	Confident	20 Å²	20	40.8 Å²	40.8	8%	0.078	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-17	-178.3	-68.9	-89.4	0	0	0	112.7	R161 E165 G192 V193 D194 C208 L210	R161-Y197 VanDerWaalsContact CD-CE1 3.48Å; R161-Y197 HydrophobicContact CG-CD1 4.48Å; R161-Y197 HydrophobicContact CG-CE1 3.69Å; E165-Y197 VanDerWaalsContact OE1-CE1 3.29Å; E165-Y197 WeakPolarHBondContact OE1-CE1 3.49Å; G192-Y197 VanDerWaalsContact C-CD2 3.41Å; G192-Y197 WeakPolarHBondContact O-CB 3.45Å; V193-Y197 VanDerWaalsContact O-CD2 3.24Å; V193-Y197 WeakPolarHBondContact O-CD2 3.3Å; D194-Y197 PolarHBondContact O-N 3.24Å; Y197-C208 HydrophobicContact CE2-CB 4.36Å; Y197-L210 HydrophobicContact CE1-CD2 4.45Å; Y197-L210 HydrophobicContact CE2-CD2 3.92Å; Y197-L210 WeakPolarHBondContact OH-CD2 3.43Å
198	E	90.9	Very high	87.7	Confident	7 Å²	7	40.1 Å²	40.1	3%	0.033	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	2	175.5	-64.7	177	170.4	0	0	113.3	D194 W200 R393 L396 K438	D194-E198 WeakPolarHBondContact O-CG 2.93Å; D194-E198 PolarHBondContact O-N 2.9Å; E198-W200 VanDerWaalsContact C-N 3.35Å; E198-W200 PolarHBondContact O-N 3.33Å; E198-W200 PolarHBondContact OE2-NE1 2.94Å; E198-R393 HydrophobicContact CG-CB 3.91Å; E198-R393 HydrophobicContact CG-CG 4.04Å; E198-R393 PolarHBondContact OE1-N 2.64Å; E198-L396 HydrophobicContact CB-CD1 4.15Å; E198-L396 HydrophobicContact CG-CD1 4.26Å; E198-K438 IonicContact OE1-NZ 2.68Å; E198-K438 PolarHBondContact OE1-NZ 3.27Å; E198-K438 WeakPolarHBondContact OE2-CE 3.4Å; E198-K438 IonicContact OE2-NZ 2.66Å; E198-K438 PolarHBondContact OE2-NZ 3.21Å
199	N	88.1	Confident	87.8	Confident	109 Å²	109	38.7 Å²	38.7	58%	0.583	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.1	28.9	176.3	-50.5	-61.9	0	0	0	115.5	S195 L410	S195-N199 PolarHBondContact O-N 2.96Å; S195-N199 VanDerWaalsContact O-N 3.16Å; N199-L410 HydrophobicContact CB-CD1 4.24Å
200	W	89.3	Confident	87.9	Confident	7 Å²	7	33.9 Å²	33.9	3%	0.027	17%	0.169	C	C	.	.			trans	-123.8	15.8	175.2	65.4	-92.1	0	0	0	114.1	S195 E198 V202 L410 L413 Q414 N434 K438	S195-W200 PolarHBondContact O-N 2.76Å; E198-W200 VanDerWaalsContact C-N 3.35Å; E198-W200 PolarHBondContact O-N 3.33Å; E198-W200 PolarHBondContact OE2-NE1 2.94Å; W200-V202 VanDerWaalsContact O-CG2 3.25Å; W200-V202 WeakPolarHBondContact O-CG2 3.35Å; W200-L410 HydrophobicContact CB-CD2 4.33Å; W200-L413 HydrophobicContact CB-CD2 4.08Å; W200-L413 HydrophobicContact CB-CG 4.46Å; W200-L413 HydrophobicContact CD2-CD2 3.47Å; W200-L413 VanDerWaalsContact CD2-CD2 3.47Å; W200-L413 HydrophobicContact CD2-CG 4.01Å; W200-L413 HydrophobicContact CE3-CD2 3.83Å; W200-L413 HydrophobicContact CE3-CG 3.86Å; W200-L413 HydrophobicContact CG-CD2 3.56Å; W200-L413 HydrophobicContact CG-CG 4.27Å; W200-Q414 HydrophobicContact CB-CG 3.83Å; W200-Q414 WeakPolarHBondContact O-CG 3.41Å; W200-N434 HydrophobicContact CH2-CB 3.92Å; W200-N434 HydrophobicContact CZ3-CB 4.04Å; W200-K438 HydrophobicContact CZ2-CD 4.07Å
201	H	88.3	Confident	87.9	Confident	19 Å²	19	32.6 Å²	32.6	9%	0.088	16%	0.163	C	C	.	.			trans	-59.5	146	173	-169.3	-92	0	0	0	112.1	T154 S195 M196 E203 L206 Q414	T154-H201 WeakPolarHBondContact CG2-O 3.43Å; S195-H201 PolarHBondContact O-N 2.88Å; S195-H201 VanDerWaalsContact O-N 3.07Å; S195-H201 PolarHBondContact OG-CD2 3.02Å; M196-H201 HydrophobicContact CG-CB 4.24Å; M196-H201 HydrophobicContact SD-CB 3.76Å; H201-E203 PolarHBondContact CE1-O 3.05Å; H201-E203 PolarHBondContact ND1-O 3.2Å; H201-L206 WeakPolarHBondContact ND1-CD2 3.38Å; H201-Q414 PolarHBondContact O-NE2 2.83Å
202	V	83.1	Confident	87.9	Confident	15 Å²	15	31.2 Å²	31.2	9%	0.091	16%	0.156	C	C	.	.			trans	-135.6	-31.2	-174.8	-161.9	0	0	0	0	114.3	I150 W200 Q414 F418	I150-V202 HydrophobicContact CD1-CG1 4.4Å; I150-V202 HydrophobicContact CG1-CG1 3.92Å; I150-V202 HydrophobicContact CG2-CG1 4.28Å; W200-V202 VanDerWaalsContact O-CG2 3.25Å; W200-V202 WeakPolarHBondContact O-CG2 3.35Å; V202-Q414 HydrophobicContact CG2-CB 3.7Å; V202-Q414 HydrophobicContact CG2-CG 3.85Å; V202-Q414 WeakPolarHBondContact CG2-O 3.5Å; V202-F418 HydrophobicContact CG1-CB 3.81Å; V202-F418 HydrophobicContact CG1-CD2 3.96Å; V202-F418 HydrophobicContact CG1-CG 4.37Å
203	E	75.4	Confident	87.9	Confident	59 Å²	59	31.1 Å²	31.1	28%	0.276	16%	0.155	S	C	.	.	S	Bend	trans	-86.1	174.7	-173.6	-74.1	-166	-131.4	0	0	113.5	H201 S421 R425	H201-E203 PolarHBondContact CE1-O 3.05Å; H201-E203 PolarHBondContact ND1-O 3.2Å; E203-S421 WeakPolarHBondContact OE1-CB 3.38Å; E203-S421 PolarHBondContact OE1-OG 3.24Å; E203-S421 PolarHBondContact OE2-OG 3.27Å; E203-S421 VanDerWaalsContact OE2-OG 3.09Å; E203-R425 IonicContact OE2-CZ 3.44Å; E203-R425 IonicContact OE2-NE 3.38Å; E203-R425 IonicContact OE2-NH2 3.95Å; E203-R425 PolarHBondContact OE2-NH2 3.09Å
204	R	78.3	Confident	87.9	Confident	136 Å²	136	31.1 Å²	31.1	51%	0.513	16%	0.155	S	C	.	.	S	Bend	trans	-124.2	145.9	162.2	-73.6	-174.4	173.6	-164.7	-5.5	108.6	A153 D156	A153-R204 PolarHBondContact O-NE 3.33Å; A153-R204 PolarHBondContact O-NH2 2.89Å; D156-R204 IonicContact OD2-NH2 3.59Å
205	P	81.3	Confident	88	Confident	68 Å²	68	31.1 Å²	31.1	44%	0.442	15%	0.154	S	C	.	.	S	Bend	cis	-72.3	154.7	1.4	31.3	-36.5	0	0	0	113.4	L207 F347 P349	P205-L207 PolarHBondContact O-N 2.94Å; P205-F347 HydrophobicContact CG-CE2 4.3Å; P205-P349 HydrophobicContact CB-CG 3.78Å; P205-P349 HydrophobicContact CG-CG 3.61Å
206	L	86.2	Confident	87.9	Confident	18 Å²	18	31 Å²	31	9%	0.094	15%	0.153	C	C	.	.			trans	-63.1	122	171.1	-60.4	173.2	0	0	0	108.8	D156 A157 T160 M196 H201	D156-L206 HydrophobicContact CB-CD1 4.21Å; A157-L206 HydrophobicContact CB-CD1 4.42Å; A157-L206 HydrophobicContact CB-CD2 4.44Å; T160-L206 HydrophobicContact CG2-CB 4.09Å; T160-L206 HydrophobicContact CG2-CD1 4.16Å; T160-L206 WeakPolarHBondContact OG1-CD1 3.33Å; M196-L206 HydrophobicContact CE-CB 4.22Å; M196-L206 HydrophobicContact CE-CD2 4.49Å; M196-L206 HydrophobicContact SD-CB 4.17Å; M196-L206 HydrophobicContact SD-CD2 3.91Å; H201-L206 WeakPolarHBondContact ND1-CD2 3.38Å
207	L	87.6	Confident	87.6	Confident	63 Å²	63	30.9 Å²	30.9	33%	0.33	15%	0.153	S	C	.	.			trans	-116.4	113.1	-175.4	-178.5	67.7	0	0	0	110.1	M196 P205 P349 I351	M196-L207 WeakPolarHBondContact CG-O 3.25Å; P205-L207 PolarHBondContact O-N 2.94Å; L207-P349 HydrophobicContact CD1-CB 3.78Å; L207-P349 HydrophobicContact CD1-CG 4.03Å; L207-I351 HydrophobicContact CD1-CD1 4.27Å; L207-I351 HydrophobicContact CD1-CG1 4.11Å; L207-I351 HydrophobicContact CD2-CD1 3.91Å; L207-I351 HydrophobicContact CG-CD1 4.36Å
208	C	89.8	Confident	86.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	124.4	174.4	-63.5	0	0	0	0	109.9	V164 Y197 F350 I351	V164-C208 HydrophobicContact CB-CB 4.46Å; V164-C208 HydrophobicContact CG1-CB 3.93Å; Y197-C208 HydrophobicContact CE2-CB 4.36Å; C208-F350 HydrophobicContact CB-CB 4.09Å; C208-F350 CarbonylContact O-C 3.51Å; C208-F350 VanDerWaalsContact O-CA 3.28Å; C208-F350 WeakPolarHBondContact O-CA 3.32Å; C208-I351 PolarHBondContact O-N 3.25Å
209	H	91.5	Very high	86	Confident	37 Å²	37	41.2 Å²	41.2	17%	0.171	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.4	170	-166.1	-177.9	0	0	0	109.2	V193 D194 F211 T353	V193-H209 HydrophobicContact CG2-CB 4.06Å; V193-H209 PolarHBondContact N-O 3.5Å; D194-H209 HydrophobicContact CB-CB 4.16Å; H209-F211 AromaticContact CE1-CE1 3.67Å; H209-F211 AromaticContact NE2-CD1 3.99Å; H209-F211 AromaticContact NE2-CE1 3.61Å; H209-T353 PolarHBondContact NE2-OG1 2.85Å
210	L	93.9	Very high	85.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	128.6	-177.2	-61.8	173.1	0	0	0	109.4	V164 V168 F190 I191 Y197 I351 L352 T353	V164-L210 HydrophobicContact CG1-CD1 4.16Å; V168-L210 HydrophobicContact CB-CD1 4.05Å; V168-L210 HydrophobicContact CG1-CD1 3.96Å; V168-L210 HydrophobicContact CG2-CD1 3.7Å; F190-L210 HydrophobicContact CB-CB 4.39Å; F190-L210 HydrophobicContact CD2-CD1 4.32Å; F190-L210 HydrophobicContact CD2-CD2 3.6Å; F190-L210 HydrophobicContact CD2-CG 4.42Å; F190-L210 HydrophobicContact CE2-CD2 4.07Å; F190-L210 HydrophobicContact CG-CD1 4.43Å; F190-L210 HydrophobicContact CG-CD2 4.35Å; I191-L210 WeakPolarHBondContact O-CA 3.32Å; Y197-L210 HydrophobicContact CE1-CD2 4.45Å; Y197-L210 HydrophobicContact CE2-CD2 3.92Å; Y197-L210 WeakPolarHBondContact OH-CD2 3.43Å; L210-I351 PolarHBondContact N-O 2.88Å; L210-L352 HydrophobicContact CB-CD2 3.68Å; L210-L352 HydrophobicContact CD1-CD2 3.66Å; L210-L352 HydrophobicContact CG-CD2 4.23Å; L210-L352 WeakPolarHBondContact O-CA 3.46Å; L210-T353 PolarHBondContact O-N 2.98Å
211	F	93.8	Very high	85.3	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.018	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	138.4	168.4	-72.8	-6.5	0	0	0	109.6	F190 I191 V193 H209 T353 V355 Y364 V366 S387 A389	F190-F211 CarbonylContact C-O 3.58Å; F190-F211 WeakPolarHBondContact CA-O 3.12Å; F190-F211 WeakPolarHBondContact CB-O 3.34Å; I191-F211 HydrophobicContact CB-CB 4.32Å; I191-F211 PolarHBondContact N-O 3.48Å; I191-F211 PolarHBondContact O-N 3.01Å; V193-F211 HydrophobicContact CB-CE2 4.49Å; V193-F211 HydrophobicContact CG1-CD2 3.78Å; V193-F211 HydrophobicContact CG1-CE2 3.96Å; V193-F211 HydrophobicContact CG1-CG 4.2Å; V193-F211 HydrophobicContact CG2-CD1 3.75Å; V193-F211 HydrophobicContact CG2-CD2 4.21Å; V193-F211 HydrophobicContact CG2-CE1 3.69Å; V193-F211 HydrophobicContact CG2-CE2 4.14Å; V193-F211 HydrophobicContact CG2-CG 4.03Å; V193-F211 HydrophobicContact CG2-CZ 3.88Å; H209-F211 AromaticContact CE1-CE1 3.67Å; H209-F211 AromaticContact NE2-CD1 3.99Å; H209-F211 AromaticContact NE2-CE1 3.61Å; F211-T353 CarbonylContact C-O 3.57Å; F211-T353 WeakPolarHBondContact CA-O 3.12Å; F211-V355 HydrophobicContact CB-CG1 4Å; F211-V355 HydrophobicContact CB-CG2 3.8Å; F211-V355 HydrophobicContact CD1-CG1 3.84Å; F211-V355 HydrophobicContact CD2-CG1 4.12Å; F211-V355 HydrophobicContact CE1-CG1 4.31Å; F211-V355 HydrophobicContact CG-CG1 3.73Å; F211-V355 HydrophobicContact CG-CG2 4.29Å; F211-Y364 HydrophobicContact CD2-CD2 4.47Å; F211-Y364 HydrophobicContact CD2-CG 4.37Å; F211-V366 HydrophobicContact CE1-CG2 4.12Å; F211-V366 HydrophobicContact CE2-CG2 4.27Å; F211-V366 HydrophobicContact CZ-CG2 3.76Å; F211-S387 WeakPolarHBondContact CZ-OG 3.26Å; F211-A389 HydrophobicContact CE2-CB 4.19Å; F211-A389 HydrophobicContact CZ-CB 4.4Å
212	V	93.6	Very high	85.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	98.8	176.7	-175.2	0	0	0	0	107.2	L172 L187 F190 F308 L352 T353 P354 V355	L172-V212 HydrophobicContact CD1-CG1 4.17Å; L172-V212 HydrophobicContact CD1-CG2 4.37Å; L172-V212 HydrophobicContact CD2-CG1 3.93Å; L172-V212 HydrophobicContact CD2-CG2 4.46Å; L187-V212 HydrophobicContact CB-CG1 4.47Å; L187-V212 HydrophobicContact CD2-CG1 4.14Å; F190-V212 HydrophobicContact CB-CG2 4.22Å; V212-F308 HydrophobicContact CB-CE2 4.45Å; V212-F308 HydrophobicContact CB-CZ 4.13Å; V212-F308 HydrophobicContact CG1-CE2 4.31Å; V212-F308 HydrophobicContact CG1-CZ 4.39Å; V212-F308 HydrophobicContact CG2-CZ 4.12Å; V212-L352 HydrophobicContact CG2-CD2 4.39Å; V212-T353 PolarHBondContact N-O 3.45Å; V212-P354 WeakPolarHBondContact O-CA 3.38Å; V212-V355 PolarHBondContact O-N 2.96Å
213	P	92.7	Very high	85.3	Confident	1 Å²	1	43 Å²	43	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	146.4	177.5	-14.7	28.6	0	0	0	111.3	E188 D189 I191 V355 Y364	E188-P213 HydrophobicContact CB-CB 3.96Å; E188-P213 HydrophobicContact CB-CG 4.24Å; E188-P213 HydrophobicContact CG-CB 4.25Å; E188-P213 PolarHBondContact N-O 3.09Å; D189-P213 WeakPolarHBondContact O-CD 3.12Å; I191-P213 HydrophobicContact CD1-CG 3.96Å; P213-V355 VanDerWaalsContact CA-O 3.26Å; P213-V355 WeakPolarHBondContact CA-O 3.43Å; P213-V355 HydrophobicContact CB-CG2 4.21Å; P213-V355 HydrophobicContact CG-CG2 4.06Å; P213-Y364 HydrophobicContact CG-CE1 4.13Å
214	F	90.3	Very high	85.7	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.009	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	149.8	176.6	73.1	-83.6	0	0	0	112.5	M185 E186 L187 F222 V304 P354 V355 I356 W384	M185-F214 HydrophobicContact CB-CD2 4.43Å; M185-F214 HydrophobicContact SD-CD2 4.29Å; M185-F214 HydrophobicContact SD-CE2 4.44Å; E186-F214 CarbonylContact O-C 3.58Å; E186-F214 VanDerWaalsContact O-CA 3.24Å; E186-F214 WeakPolarHBondContact O-CA 3.46Å; E186-F214 WeakPolarHBondContact O-CB 3.4Å; L187-F214 HydrophobicContact CD2-CB 3.51Å; F214-F222 AromaticContact CD2-CE2 3.8Å; F214-F222 HydrophobicContact CD2-CE2 3.8Å; F214-F222 HydrophobicContact CD2-CZ 4.09Å; F214-F222 AromaticContact CE2-CE2 3.56Å; F214-F222 HydrophobicContact CE2-CE2 3.56Å; F214-F222 AromaticContact CE2-CZ 3.64Å; F214-F222 HydrophobicContact CE2-CZ 3.64Å; F214-F222 HydrophobicContact CZ-CE2 4.29Å; F214-V304 HydrophobicContact CE1-CG1 3.91Å; F214-V304 HydrophobicContact CE2-CG1 4.41Å; F214-V304 HydrophobicContact CZ-CG1 3.59Å; F214-V304 HydrophobicContact CZ-CG2 4.2Å; F214-P354 HydrophobicContact CD1-CB 3.93Å; F214-P354 HydrophobicContact CE1-CB 3.88Å; F214-V355 WeakPolarHBondContact CD1-O 3.2Å; F214-V355 PolarHBondContact N-O 2.63Å; F214-V355 VanDerWaalsContact N-O 3.11Å; F214-I356 HydrophobicContact CD1-CG1 4.11Å; F214-I356 HydrophobicContact CE1-CD1 3.91Å; F214-I356 HydrophobicContact CE1-CG1 3.57Å; F214-I356 HydrophobicContact CE2-CD1 4.03Å; F214-I356 HydrophobicContact CE2-CG1 4.22Å; F214-I356 HydrophobicContact CZ-CD1 3.46Å; F214-I356 VanDerWaalsContact CZ-CD1 3.46Å; F214-I356 HydrophobicContact CZ-CG1 3.63Å; F214-W384 HydrophobicContact CZ-CH2 4.41Å
215	I	87.6	Confident	86	Confident	64 Å²	64	38.1 Å²	38.1	33%	0.328	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	142.2	-175	-60.1	174.4	0	0	0	108.4	M185 E186 E188	M185-I215 WeakPolarHBondContact CA-O 3.33Å; E186-I215 PolarHBondContact N-O 3.02Å; E186-I215 PolarHBondContact O-N 2.99Å; E188-I215 HydrophobicContact CG-CD1 4.31Å; E188-I215 WeakPolarHBondContact OE1-CD1 3.41Å; E188-I215 WeakPolarHBondContact OE1-CG1 3.32Å
216	P	85.5	Confident	85.9	Confident	13 Å²	13	35.8 Å²	35.8	8%	0.084	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-71.9	153.3	176.1	31.2	-31.9	0	0	0	112.1	M185 Y220 F222	M185-P216 VanDerWaalsContact SD-CA 3.58Å; M185-P216 HydrophobicContact SD-CB 4.1Å; P216-Y220 WeakPolarHBondContact CG-O 3.32Å; P216-F222 HydrophobicContact CB-CD1 4.1Å; P216-F222 HydrophobicContact CB-CE1 3.53Å; P216-F222 HydrophobicContact CB-CE2 4.33Å; P216-F222 HydrophobicContact CB-CZ 3.65Å; P216-F222 VanDerWaalsContact CD-CE2 3.44Å; P216-F222 HydrophobicContact CG-CD1 3.7Å; P216-F222 HydrophobicContact CG-CD2 4.15Å; P216-F222 HydrophobicContact CG-CE1 3.64Å; P216-F222 HydrophobicContact CG-CE2 4.11Å; P216-F222 HydrophobicContact CG-CG 3.95Å; P216-F222 HydrophobicContact CG-CZ 3.84Å
217	P	82	Confident	85.2	Confident	7 Å²	7	37.2 Å²	37.2	5%	0.045	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-64.7	151.2	173.9	28.1	-34.2	0	0	0	111.2	Y220 L290	P217-Y220 WeakPolarHBondContact O-CB 3.46Å; P217-Y220 PolarHBondContact O-N 3.16Å; P217-L290 HydrophobicContact CG-CD2 4.26Å
218	E	74.6	Confident	83.7	Confident	179 Å²	179	35 Å²	35	84%	0.836	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	139.4	171.8	-68.2	-172.5	179.6	0	0	110.3
219	P	73.3	Confident	81.8	Confident	65 Å²	65	38.1 Å²	38.1	42%	0.422	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	cis	-98.4	25	9.6	40.1	-37.7	0	0	0	113.5	L247 A248	P219-L247 HydrophobicContact CB-CG 4.26Å; P219-L247 HydrophobicContact CG-CD1 3.92Å; P219-L247 HydrophobicContact CG-CD2 4.35Å; P219-L247 HydrophobicContact CG-CG 3.94Å; P219-L247 CarbonylContact O-C 3.48Å; P219-L247 WeakPolarHBondContact O-CA 3.45Å; P219-A248 WeakPolarHBondContact O-CB 2.99Å; P219-A248 PolarHBondContact O-N 3.44Å
220	Y	79.6	Confident	79.7	Confident	49 Å²	49	41.3 Å²	41.3	19%	0.192	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	154.8	-176.8	-59.4	-83.9	0	0	0	112.1	P216 P217 V245 T246 L247 L290	P216-Y220 WeakPolarHBondContact CG-O 3.32Å; P217-Y220 WeakPolarHBondContact O-CB 3.46Å; P217-Y220 PolarHBondContact O-N 3.16Å; Y220-V245 HydrophobicContact CD1-CG1 4.12Å; Y220-T246 CarbonylContact C-O 3.57Å; Y220-T246 WeakPolarHBondContact CA-O 3.3Å; Y220-L247 HydrophobicContact CD1-CD1 4.05Å; Y220-L247 HydrophobicContact CE1-CD1 3.75Å; Y220-L290 HydrophobicContact CD1-CD1 3.6Å; Y220-L290 HydrophobicContact CD2-CD1 3.82Å; Y220-L290 HydrophobicContact CD2-CD2 4.36Å; Y220-L290 HydrophobicContact CE1-CD1 3.42Å; Y220-L290 VanDerWaalsContact CE1-CD1 3.42Å; Y220-L290 HydrophobicContact CE2-CD1 3.68Å; Y220-L290 HydrophobicContact CE2-CD2 4.48Å; Y220-L290 HydrophobicContact CG-CD1 3.79Å; Y220-L290 VanDerWaalsContact CZ-CD1 3.47Å
221	S	82	Confident	77.4	Confident	24 Å²	24	50.5 Å²	50.5	17%	0.168	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	142.9	176.5	56.9	0	0	0	0	111	H223 T246	S221-H223 PolarHBondContact OG-CD2 3.35Å; S221-H223 PolarHBondContact OG-NE2 2.68Å; S221-T246 PolarHBondContact N-O 3.39Å; S221-T246 PolarHBondContact O-N 3.06Å; S221-T246 PolarHBondContact OG-O 2.96Å; S221-T246 PolarHBondContact OG-OG1 3.19Å
222	F	86.5	Confident	75.2	Confident	28 Å²	28	55.3 Å²	55.3	12%	0.123	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	125.9	171.3	-64.5	-23.9	0	0	0	110.1	M185 F214 P216 P224 I243 V245 L299 I356	M185-F222 HydrophobicContact SD-CZ 4.01Å; F214-F222 AromaticContact CD2-CE2 3.8Å; F214-F222 HydrophobicContact CD2-CE2 3.8Å; F214-F222 HydrophobicContact CD2-CZ 4.09Å; F214-F222 AromaticContact CE2-CE2 3.56Å; F214-F222 HydrophobicContact CE2-CE2 3.56Å; F214-F222 AromaticContact CE2-CZ 3.64Å; F214-F222 HydrophobicContact CE2-CZ 3.64Å; F214-F222 HydrophobicContact CZ-CE2 4.29Å; P216-F222 HydrophobicContact CB-CD1 4.1Å; P216-F222 HydrophobicContact CB-CE1 3.53Å; P216-F222 HydrophobicContact CB-CE2 4.33Å; P216-F222 HydrophobicContact CB-CZ 3.65Å; P216-F222 VanDerWaalsContact CD-CE2 3.44Å; P216-F222 HydrophobicContact CG-CD1 3.7Å; P216-F222 HydrophobicContact CG-CD2 4.15Å; P216-F222 HydrophobicContact CG-CE1 3.64Å; P216-F222 HydrophobicContact CG-CE2 4.11Å; P216-F222 HydrophobicContact CG-CG 3.95Å; P216-F222 HydrophobicContact CG-CZ 3.84Å; F222-P224 VanDerWaalsContact O-CD 3.26Å; F222-P224 WeakPolarHBondContact O-CD 3.29Å; F222-I243 HydrophobicContact CB-CG2 3.88Å; F222-I243 HydrophobicContact CD1-CG2 4.42Å; F222-I243 HydrophobicContact CG-CG2 4.15Å; F222-V245 HydrophobicContact CD1-CG2 4.04Å; F222-V245 HydrophobicContact CE1-CG2 4.02Å; F222-L299 HydrophobicContact CD1-CD1 3.9Å; F222-L299 HydrophobicContact CD2-CD1 4.48Å; F222-L299 HydrophobicContact CE1-CD1 3.63Å; F222-L299 HydrophobicContact CE1-CD2 4.15Å; F222-L299 HydrophobicContact CE1-CG 4.27Å; F222-L299 HydrophobicContact CE2-CD1 4.24Å; F222-L299 HydrophobicContact CG-CD1 4.34Å; F222-L299 HydrophobicContact CZ-CD1 3.83Å; F222-I356 HydrophobicContact CB-CG2 4.36Å; F222-I356 HydrophobicContact CD2-CD1 3.59Å; F222-I356 HydrophobicContact CD2-CG1 3.84Å; F222-I356 HydrophobicContact CD2-CG2 3.86Å; F222-I356 HydrophobicContact CE2-CD1 3.59Å; F222-I356 HydrophobicContact CE2-CG1 3.89Å; F222-I356 HydrophobicContact CG-CD1 4.31Å; F222-I356 HydrophobicContact CZ-CD1 4.32Å
223	H	84.9	Confident	73.3	Confident	86 Å²	86	56.4 Å²	56.4	40%	0.398	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	92.9	172.4	-70.2	-78.6	0	0	0	108.9	S221 K244 T246	S221-H223 PolarHBondContact OG-CD2 3.35Å; S221-H223 PolarHBondContact OG-NE2 2.68Å; H223-K244 HydrophobicContact CB-CB 4.39Å; H223-K244 PolarHBondContact N-O 3.19Å; H223-K244 PolarHBondContact O-N 3.29Å; H223-T246 PolarHBondContact CD2-OG1 3.37Å; H223-T246 PolarHBondContact NE2-OG1 2.69Å
224	P	84.6	Confident	71.4	Confident	15 Å²	15	60 Å²	60	10%	0.097	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	127.8	177.3	28.3	-33	0	0	0	111	F222 Y358 F365	F222-P224 VanDerWaalsContact O-CD 3.26Å; F222-P224 WeakPolarHBondContact O-CD 3.29Å; P224-Y358 HydrophobicContact CB-CD2 3.84Å; P224-Y358 HydrophobicContact CB-CE2 4.35Å; P224-Y358 HydrophobicContact CG-CD2 3.56Å; P224-Y358 HydrophobicContact CG-CE2 4.06Å; P224-F365 HydrophobicContact CB-CD2 4.08Å; P224-F365 HydrophobicContact CB-CE1 4.35Å; P224-F365 HydrophobicContact CB-CE2 3.47Å; P224-F365 VanDerWaalsContact CB-CE2 3.47Å; P224-F365 HydrophobicContact CB-CZ 3.61Å; P224-F365 HydrophobicContact CG-CE2 4.39Å
225	E	84.2	Confident	69.7	Low	78 Å²	78	64.3 Å²	64.3	36%	0.364	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.5	179	-64.7	-177.1	-172.3	0	0	109.5	G241 Q242	E225-G241 CarbonylContact O-C 3.55Å; E225-G241 WeakPolarHBondContact O-CA 3.41Å; E225-Q242 PolarHBondContact N-O 2.81Å; E225-Q242 PolarHBondContact O-N 2.9Å
226	L	79.5	Confident	68.1	Low	18 Å²	18	64.4 Å²	64.4	9%	0.094	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	132.3	179.7	-69.4	167.6	0	0	0	110.8	C228 Y358 L363 F365 L386 V497	L226-C228 VanDerWaalsContact C-N 3.27Å; L226-C228 PolarHBondContact O-N 2.94Å; L226-Y358 HydrophobicContact CD1-CD1 4.33Å; L226-Y358 HydrophobicContact CD1-CD2 4.19Å; L226-Y358 HydrophobicContact CD1-CE1 3.75Å; L226-Y358 HydrophobicContact CD1-CE2 3.59Å; L226-Y358 HydrophobicContact CG-CD2 4.2Å; L226-Y358 HydrophobicContact CG-CE2 3.72Å; L226-L363 HydrophobicContact CD1-CD2 4.45Å; L226-L363 HydrophobicContact CD2-CD2 4.04Å; L226-F365 HydrophobicContact CD2-CE1 4.5Å; L226-F365 HydrophobicContact CD2-CE2 4.32Å; L226-F365 HydrophobicContact CD2-CZ 3.69Å; L226-F365 HydrophobicContact CG-CZ 4.28Å; L226-L386 HydrophobicContact CD2-CD1 3.5Å; L226-L386 HydrophobicContact CD2-CD2 3.4Å; L226-L386 VanDerWaalsContact CD2-CD2 3.4Å; L226-L386 HydrophobicContact CD2-CG 4.09Å; L226-V497 HydrophobicContact CB-CG1 4.34Å; L226-V497 HydrophobicContact CD1-CB 4.09Å; L226-V497 HydrophobicContact CD1-CG1 3.76Å
227	W	72.2	Confident	66.7	Low	48 Å²	48	64.6 Å²	64.6	18%	0.182	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	29.2	172.6	-60.9	-20.8	0	0	0	113.7	T233 C237 Y240 Q242 D383	W227-T233 HydrophobicContact CB-CG2 3.66Å; W227-T233 HydrophobicContact CD2-CG2 4.25Å; W227-T233 HydrophobicContact CE3-CG2 4.28Å; W227-T233 HydrophobicContact CG-CG2 4.09Å; W227-C237 HydrophobicContact CE3-CB 3.79Å; W227-C237 HydrophobicContact CZ3-CB 3.85Å; W227-Y240 VanDerWaalsContact CB-O 3.31Å; W227-Y240 WeakPolarHBondContact CB-O 3.35Å; W227-Y240 PolarHBondContact N-O 3.37Å; W227-Q242 HydrophobicContact CH2-CG 3.76Å; W227-Q242 HydrophobicContact CZ2-CB 4.45Å; W227-Q242 HydrophobicContact CZ2-CG 3.31Å; W227-Q242 VanDerWaalsContact CZ2-NE2 3.3Å; W227-D383 VanDerWaalsContact CH2-OD1 3.24Å; W227-D383 WeakPolarHBondContact CH2-OD1 2.94Å
228	C	56.7	Low	65.7	Low	17 Å²	17	66.4 Å²	66.4	12%	0.115	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-7.6	179.5	-63.9	0	0	0	0	114	L226 L386 A501	L226-C228 VanDerWaalsContact C-N 3.27Å; L226-C228 PolarHBondContact O-N 2.94Å; C228-L386 VanDerWaalsContact SG-CD1 3.56Å; C228-A501 HydrophobicContact CB-CB 3.86Å; C228-A501 VanDerWaalsContact O-CB 3.32Å; C228-A501 WeakPolarHBondContact O-CB 3.22Å
229	S	49.3	Very low	65.4	Low	65 Å²	65	58.5 Å²	58.5	46%	0.455	33%	0.326	S	S	.	.	S	Bend	trans	-128.6	-5.8	-165	-54.5	0	0	0	0	116.2	V497	S229-V497 WeakPolarHBondContact OG-CG1 3.36Å
230	N	46.6	Very low	65.6	Low	104 Å²	104	56.9 Å²	56.9	56%	0.556	31%	0.312	S	S	*	.			trans	-110.1	123.9	-174.9	-66.9	-12.4	0	0	0	111.5	S232 T233	N230-S232 PolarHBondContact O-N 2.85Å; N230-T233 PolarHBondContact O-N 3.45Å; N230-T233 VanDerWaalsContact O-N 3.11Å; N230-T233 PolarHBondContact O-OG1 2.83Å; N230-T233 VanDerWaalsContact O-OG1 3.12Å
231	L	45.5	Very low	65.8	Low	194 Å²	194	54.5 Å²	54.5	100%	1.016	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-10.9	174.2	-77.8	147	0	0	0	114.4
232	S	48	Very low	66	Low	104 Å²	104	54.8 Å²	54.8	73%	0.727	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-1.7	-179.5	50.5	0	0	0	0	114.6	N230	N230-S232 PolarHBondContact O-N 2.85Å
233	T	53.9	Low	66	Low	24 Å²	24	53.4 Å²	53.4	15%	0.147	30%	0.295	C	S	.	.	S	Bend	trans	-81	129.9	179.8	-46.9	0	0	0	0	109.9	W227 N230 L235 C237	W227-T233 HydrophobicContact CB-CG2 3.66Å; W227-T233 HydrophobicContact CD2-CG2 4.25Å; W227-T233 HydrophobicContact CE3-CG2 4.28Å; W227-T233 HydrophobicContact CG-CG2 4.09Å; N230-T233 PolarHBondContact O-N 3.45Å; N230-T233 VanDerWaalsContact O-N 3.11Å; N230-T233 PolarHBondContact O-OG1 2.83Å; N230-T233 VanDerWaalsContact O-OG1 3.12Å; T233-L235 PolarHBondContact O-N 3.09Å; T233-C237 HydrophobicContact CG2-CB 3.95Å
234	P	53.2	Low	66	Low	76 Å²	76	52.7 Å²	52.7	49%	0.494	29%	0.291	S	S	.	.			trans	-61.8	136	175.7	26.9	-33.9	0	0	0	110.3	N236 C237	P234-N236 WeakPolarHBondContact CB-OD1 3.3Å; P234-N236 PolarHBondContact O-N 2.78Å; P234-C237 HydrophobicContact CG-CB 4.24Å; P234-C237 WeakPolarHBondContact O-CB 3.39Å; P234-C237 PolarHBondContact O-N 3.49Å
235	L	54.2	Low	65.9	Low	92 Å²	92	52.1 Å²	52.1	48%	0.482	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-13.2	-167	-65.9	120.1	0	0	0	114.8	T233 C237 R508	T233-L235 PolarHBondContact O-N 3.09Å; L235-C237 VanDerWaalsContact C-N 3.34Å; L235-R508 VanDerWaalsContact CB-CZ 3.43Å
236	N	54.2	Low	65.7	Low	67 Å²	67	50.3 Å²	50.3	36%	0.358	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-12.2	172.8	62.1	-36.5	0	0	0	113.2	P234 G376	P234-N236 WeakPolarHBondContact CB-OD1 3.3Å; P234-N236 PolarHBondContact O-N 2.78Å; N236-G376 PolarHBondContact ND2-O 3.3Å
237	C	55.1	Low	65.4	Low	17 Å²	17	53.2 Å²	53.2	12%	0.115	30%	0.297	C	S	.	.	S	Bend	trans	-104.3	10.7	-179.7	-61.2	0	0	0	0	112.8	W227 T233 P234 L235 G239 Y240	W227-C237 HydrophobicContact CE3-CB 3.79Å; W227-C237 HydrophobicContact CZ3-CB 3.85Å; T233-C237 HydrophobicContact CG2-CB 3.95Å; P234-C237 HydrophobicContact CG-CB 4.24Å; P234-C237 WeakPolarHBondContact O-CB 3.39Å; P234-C237 PolarHBondContact O-N 3.49Å; L235-C237 VanDerWaalsContact C-N 3.34Å; C237-G239 PolarHBondContact O-N 2.93Å; C237-Y240 HydrophobicContact CB-CD2 4.45Å; C237-Y240 WeakPolarHBondContact O-CB 3.4Å; C237-Y240 WeakPolarHBondContact O-CD2 3.43Å; C237-Y240 PolarHBondContact O-N 2.85Å; C237-Y240 VanDerWaalsContact O-N 3.16Å
238	Q	61.9	Low	64.8	Low	45 Å²	45	54.3 Å²	54.3	21%	0.21	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	122.1	172.1	-70.2	-178.9	-8.6	0	0	109.9	I504	Q238-I504 HydrophobicContact CB-CD1 4.22Å; Q238-I504 HydrophobicContact CB-CG1 4.25Å; Q238-I504 HydrophobicContact CB-CG2 4.49Å
239	G	68.1	Low	64.7	Low	13 Å²	13	55.7 Å²	55.7	13%	0.134	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.7	4.1	-174.3	0	0	0	0	0	114.3	C237 L386	C237-G239 PolarHBondContact O-N 2.93Å; G239-L386 WeakPolarHBondContact O-CB 3.14Å; G239-L386 WeakPolarHBondContact O-CG 3.31Å; G239-L386 PolarHBondContact O-N 3.22Å
240	Y	77.6	Confident	64.6	Low	30 Å²	30	56.1 Å²	56.1	12%	0.118	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	169.9	170.3	-64.3	-90.3	0	0	0	111.3	W227 C237 Q368 D383 W384 L385	W227-Y240 VanDerWaalsContact CB-O 3.31Å; W227-Y240 WeakPolarHBondContact CB-O 3.35Å; W227-Y240 PolarHBondContact N-O 3.37Å; C237-Y240 HydrophobicContact CB-CD2 4.45Å; C237-Y240 WeakPolarHBondContact O-CB 3.4Å; C237-Y240 WeakPolarHBondContact O-CD2 3.43Å; C237-Y240 PolarHBondContact O-N 2.85Å; C237-Y240 VanDerWaalsContact O-N 3.16Å; Y240-Q368 HydrophobicContact CE1-CB 4.49Å; Y240-Q368 HydrophobicContact CE1-CG 4.47Å; Y240-Q368 PolarHBondContact OH-NE2 3.44Å; Y240-Q368 PolarHBondContact OH-OE1 3.07Å; Y240-D383 HydrophobicContact CD1-CB 4.39Å; Y240-W384 CarbonylContact C-O 3.6Å; Y240-W384 WeakPolarHBondContact CA-O 3.43Å; Y240-L385 HydrophobicContact CD1-CB 4.41Å; Y240-L385 HydrophobicContact CD1-CD1 4.24Å; Y240-L385 HydrophobicContact CE1-CB 4.22Å; Y240-L385 HydrophobicContact CE1-CD1 3.8Å; Y240-L385 HydrophobicContact CE2-CD1 4.49Å
241	G	83.2	Confident	64.4	Low	0 Å²	0	56 Å²	56	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	-176.3	163.5	0	0	0	0	0	110.9	E225 W384	E225-G241 CarbonylContact O-C 3.55Å; E225-G241 WeakPolarHBondContact O-CA 3.41Å; G241-W384 PolarHBondContact N-O 3.11Å; G241-W384 PolarHBondContact O-N 3.48Å
242	Q	85.7	Confident	64.4	Low	29 Å²	29	52.8 Å²	52.8	14%	0.136	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	157.3	-179.7	-69.3	-172.6	-30	0	0	110	E225 W227 Y298 D383	E225-Q242 PolarHBondContact N-O 2.81Å; E225-Q242 PolarHBondContact O-N 2.9Å; W227-Q242 HydrophobicContact CH2-CG 3.76Å; W227-Q242 HydrophobicContact CZ2-CB 4.45Å; W227-Q242 HydrophobicContact CZ2-CG 3.31Å; W227-Q242 VanDerWaalsContact CZ2-NE2 3.3Å; Q242-Y298 HydrophobicContact CB-CD1 3.78Å; Q242-Y298 HydrophobicContact CB-CE1 3.91Å; Q242-D383 PolarHBondContact NE2-OD1 2.83Å
243	I	86.6	Confident	64.3	Low	0 Å²	0	55.2 Å²	55.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	111.3	-178.1	-50.8	174.3	0	0	0	107.9	F222 Y298 L299 I356 F365 W384	F222-I243 HydrophobicContact CB-CG2 3.88Å; F222-I243 HydrophobicContact CD1-CG2 4.42Å; F222-I243 HydrophobicContact CG-CG2 4.15Å; I243-Y298 CarbonylContact O-C 3.58Å; I243-Y298 VanDerWaalsContact O-CA 3.26Å; I243-Y298 WeakPolarHBondContact O-CA 3.37Å; I243-L299 HydrophobicContact CB-CB 4.34Å; I243-L299 HydrophobicContact CB-CD1 4.05Å; I243-L299 HydrophobicContact CB-CG 4.43Å; I243-L299 HydrophobicContact CD1-CD1 4.45Å; I243-L299 HydrophobicContact CG2-CD1 3.67Å; I243-L299 HydrophobicContact CG2-CG 4.32Å; I243-L299 PolarHBondContact O-N 3.38Å; I243-I356 HydrophobicContact CD1-CB 4.05Å; I243-I356 HydrophobicContact CD1-CD1 3.41Å; I243-I356 VanDerWaalsContact CD1-CD1 3.41Å; I243-I356 HydrophobicContact CD1-CG1 4.27Å; I243-I356 HydrophobicContact CD1-CG2 4.37Å; I243-I356 HydrophobicContact CG2-CD1 4.21Å; I243-F365 HydrophobicContact CD1-CB 3.75Å; I243-F365 HydrophobicContact CD1-CD1 4.18Å; I243-F365 HydrophobicContact CD1-CG 4.03Å; I243-F365 HydrophobicContact CG1-CD1 4.07Å; I243-F365 HydrophobicContact CG1-CG 4.31Å; I243-W384 HydrophobicContact CD1-CB 4.43Å; I243-W384 HydrophobicContact CD1-CD2 3.55Å; I243-W384 HydrophobicContact CD1-CE3 3.87Å; I243-W384 HydrophobicContact CD1-CG 3.78Å; I243-W384 HydrophobicContact CD1-CZ2 4.32Å; I243-W384 HydrophobicContact CD1-CZ3 4.36Å; I243-W384 HydrophobicContact CG1-CD2 4.37Å; I243-W384 HydrophobicContact CG1-CG 4.14Å
244	K	84.9	Confident	63.9	Low	70 Å²	70	56.2 Å²	56.2	30%	0.304	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	132.1	178.3	-169.2	178	-179.2	178	0	109.8	H223 T246 Y298	H223-K244 HydrophobicContact CB-CB 4.39Å; H223-K244 PolarHBondContact N-O 3.19Å; H223-K244 PolarHBondContact O-N 3.29Å; K244-T246 HydrophobicContact CD-CG2 4.09Å; K244-T246 HydrophobicContact CG-CG2 4.03Å; K244-Y298 HydrophobicContact CB-CD1 3.94Å; K244-Y298 HydrophobicContact CB-CE1 3.74Å; K244-Y298 HydrophobicContact CD-CE1 4.48Å; K244-Y298 HydrophobicContact CG-CD1 4.46Å; K244-Y298 HydrophobicContact CG-CE1 4.2Å
245	V	83.7	Confident	63.6	Low	3 Å²	3	54.8 Å²	54.8	2%	0.018	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	123.5	172.4	-171.8	0	0	0	0	108.3	Y220 F222 L290 C292 S297 L299	Y220-V245 HydrophobicContact CD1-CG1 4.12Å; F222-V245 HydrophobicContact CD1-CG2 4.04Å; F222-V245 HydrophobicContact CE1-CG2 4.02Å; V245-L290 HydrophobicContact CG1-CD1 4.48Å; V245-C292 VanDerWaalsContact CG2-SG 3.58Å; V245-S297 PolarHBondContact N-O 3.04Å; V245-L299 HydrophobicContact CG2-CD1 4.38Å; V245-L299 HydrophobicContact CG2-CD2 3.5Å; V245-L299 HydrophobicContact CG2-CG 3.57Å
246	T	78.9	Confident	63.3	Low	41 Å²	41	57.1 Å²	57.1	25%	0.252	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	167.3	173.9	68.7	0	0	0	0	111.1	Y220 S221 H223 K244	Y220-T246 CarbonylContact C-O 3.57Å; Y220-T246 WeakPolarHBondContact CA-O 3.3Å; S221-T246 PolarHBondContact N-O 3.39Å; S221-T246 PolarHBondContact O-N 3.06Å; S221-T246 PolarHBondContact OG-O 2.96Å; S221-T246 PolarHBondContact OG-OG1 3.19Å; H223-T246 PolarHBondContact CD2-OG1 3.37Å; H223-T246 PolarHBondContact NE2-OG1 2.69Å; K244-T246 HydrophobicContact CD-CG2 4.09Å; K244-T246 HydrophobicContact CG-CG2 4.03Å
247	L	74.1	Confident	63.2	Low	79 Å²	79	56.7 Å²	56.7	41%	0.414	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	129.2	167.7	-130.6	83.8	0	0	0	109.2	P219 Y220 G249	P219-L247 HydrophobicContact CB-CG 4.26Å; P219-L247 HydrophobicContact CG-CD1 3.92Å; P219-L247 HydrophobicContact CG-CD2 4.35Å; P219-L247 HydrophobicContact CG-CG 3.94Å; P219-L247 CarbonylContact O-C 3.48Å; P219-L247 WeakPolarHBondContact O-CA 3.45Å; Y220-L247 HydrophobicContact CD1-CD1 4.05Å; Y220-L247 HydrophobicContact CE1-CD1 3.75Å; L247-G249 CarbonylContact O-C 3.51Å; L247-G249 PolarHBondContact O-N 3.03Å; L247-G249 VanDerWaalsContact O-N 3.1Å
248	A	59.3	Low	62.8	Low	70 Å²	70	59.3 Å²	59.3	58%	0.579	39%	0.391	S	S	*	.	S	Bend	trans	-57.9	-20.7	177.5	0	0	0	0	0	113	P219	P219-A248 WeakPolarHBondContact O-CB 2.99Å; P219-A248 PolarHBondContact O-N 3.44Å
249	G	53.9	Low	62.3	Low	46 Å²	46	66.2 Å²	66.2	47%	0.474	42%	0.42	S	S	.	.	S	Bend	trans	-93.1	93.2	164	0	0	0	0	0	110.4	L247 D251	L247-G249 CarbonylContact O-C 3.51Å; L247-G249 PolarHBondContact O-N 3.03Å; L247-G249 VanDerWaalsContact O-N 3.1Å; G249-D251 PolarHBondContact O-N 3.49Å
250	G	47.3	Very low	61.1	Low	74 Å²	74	70.1 Å²	70.1	76%	0.763	44%	0.442	S	S	*	.	S	Bend	trans	-50.9	124.1	173.2	0	0	0	0	0	111.4
251	D	43	Very low	59.5	Low	103 Å²	103	79.2 Å²	79.2	55%	0.551	48%	0.482	S	S	*	.			trans	86.9	104.7	179	-153.8	3.7	0	0	0	115.8	G249 L253 G254	G249-D251 PolarHBondContact O-N 3.49Å; D251-L253 PolarHBondContact O-N 3.26Å; D251-L253 PolarHBondContact OD1-N 2.85Å; D251-G254 PolarHBondContact O-N 2.83Å
252	P	46.4	Very low	57.8	Low	125 Å²	125	85.1 Å²	85.1	81%	0.812	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-1.4	172.1	27.9	-32.8	0	0	0	113.5
253	L	45.9	Very low	55.8	Low	155 Å²	155	86.7 Å²	86.7	81%	0.812	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	0.2	179.6	-73.4	157.9	0	0	0	114.3	D251 C255	D251-L253 PolarHBondContact O-N 3.26Å; D251-L253 PolarHBondContact OD1-N 2.85Å; L253-C255 PolarHBondContact O-N 3.07Å
254	G	45.3	Very low	54	Low	46 Å²	46	96.5 Å²	96.5	47%	0.474	58%	0.583	S	S	.	*			trans	-95.6	87.9	-176.8	0	0	0	0	0	113.1	D251 I256	D251-G254 PolarHBondContact O-N 2.83Å; G254-I256 PolarHBondContact O-N 2.9Å
255	C	46.7	Very low	52.4	Low	46 Å²	46	100.9 Å²	100.9	31%	0.311	61%	0.61	S	S	.	*			trans	-57.5	133.9	170.8	-174.6	0	0	0	0	111.3	L253 C257 G258	L253-C255 PolarHBondContact O-N 3.07Å; C255-C257 HydrophobicContact CB-CB 3.78Å; C255-C257 WeakPolarHBondContact CB-SG 3.45Å; C255-C257 PolarHBondContact O-N 3.34Å; C255-C257 WeakPolarHBondContact SG-CB 3.49Å; C255-C257 PolarHBondContact SG-N 3.17Å; C255-C257 CovalentContact SG-SG 2.04Å; C255-C257 PolarHBondContact SG-SG 2.84Å; C255-G258 PolarHBondContact O-N 2.85Å
256	I	47.5	Very low	50.7	Low	140 Å²	140	107.5 Å²	107.5	72%	0.718	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-53.7	-18.8	172.1	-57.6	171.5	0	0	0	112.3	G254 G258 K259	G254-I256 PolarHBondContact O-N 2.9Å; I256-G258 PolarHBondContact O-N 3.4Å; I256-K259 PolarHBondContact O-N 3.43Å; I256-K259 VanDerWaalsContact O-N 3.11Å
257	C	51.8	Low	49.3	Very low	59 Å²	59	112.4 Å²	112.4	40%	0.399	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-41.8	-35.2	169	-50.3	0	0	0	0	115.2	C255 C268	C255-C257 HydrophobicContact CB-CB 3.78Å; C255-C257 WeakPolarHBondContact CB-SG 3.45Å; C255-C257 PolarHBondContact O-N 3.34Å; C255-C257 WeakPolarHBondContact SG-CB 3.49Å; C255-C257 PolarHBondContact SG-N 3.17Å; C255-C257 CovalentContact SG-SG 2.04Å; C255-C257 PolarHBondContact SG-SG 2.84Å; C257-C268 HydrophobicContact CB-CB 4.46Å; C257-C268 WeakPolarHBondContact SG-CB 3.13Å; C257-C268 PolarHBondContact SG-SG 2.98Å
258	G	47.4	Very low	48.3	Very low	72 Å²	72	110.5 Å²	110.5	74%	0.742	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-83	-5.6	-175.3	0	0	0	0	0	115.6	C255 I256	C255-G258 PolarHBondContact O-N 2.85Å; I256-G258 PolarHBondContact O-N 3.4Å
259	K	50	Low	47.8	Very low	189 Å²	189	115.6 Å²	115.6	82%	0.822	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-97.6	-9	-172.4	-67.1	-173.2	-180	175.9	0	114.6	I256	I256-K259 PolarHBondContact O-N 3.43Å; I256-K259 VanDerWaalsContact O-N 3.11Å
260	T	43.7	Very low	47.6	Very low	96 Å²	96	120.7 Å²	120.7	59%	0.589	69%	0.691	S	S	*	*	S	Bend	trans	-101.4	125.7	172.8	44.6	0	0	0	0	110.4	L262	T260-L262 PolarHBondContact O-N 3.24Å
261	K	45.1	Very low	47.6	Very low	220 Å²	220	123 Å²	123	96%	0.957	68%	0.682	S	S	*	*			trans	-67.4	60.3	174.7	-69.7	-175.5	175.8	-178.9	0	112.5
262	L	46	Very low	47.4	Very low	125 Å²	125	121.8 Å²	121.8	65%	0.654	69%	0.694	S	S	*	*	S	Bend	trans	-120.3	95.3	168	-90	110	0	0	0	108.1	T260 M266	T260-L262 PolarHBondContact O-N 3.24Å; L262-M266 HydrophobicContact CB-CE 4.25Å
263	G	44.8	Very low	47.2	Very low	62 Å²	62	125.1 Å²	125.1	64%	0.639	70%	0.695	S	S	*	*			trans	56.2	115.5	160.6	0	0	0	0	0	116.2	D265	G263-D265 PolarHBondContact O-N 3.25Å
264	E	47.4	Very low	46.7	Very low	206 Å²	206	124.3 Å²	124.3	96%	0.963	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	5.5	-179.8	-62.7	176.9	160.5	0	0	115.4
265	D	51	Low	46.5	Very low	161 Å²	161	127.8 Å²	127.8	86%	0.861	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.5	25.8	-172.3	-80	-29.6	0	0	0	115.1	G263	G263-D265 PolarHBondContact O-N 3.25Å
266	M	49.2	Very low	46	Very low	142 Å²	142	129.2 Å²	129.2	70%	0.7	73%	0.732	S	S	*	*			trans	-101.3	97.9	164	-82	-167.9	-74.2	0	0	111	L262 C268	L262-M266 HydrophobicContact CB-CE 4.25Å; M266-C268 PolarHBondContact O-N 2.8Å
267	L	48.9	Very low	45.1	Very low	145 Å²	145	128.3 Å²	128.3	76%	0.759	73%	0.732	S	S	*	*			trans	-63.1	121.7	170	-67.5	165.8	0	0	0	109.4	L269	L267-L269 PolarHBondContact O-N 2.97Å; L267-L269 VanDerWaalsContact O-N 3.11Å
268	C	53.1	Low	44.3	Very low	39 Å²	39	133.9 Å²	133.9	26%	0.264	75%	0.752	S	S	.	*			trans	-66.1	111.5	171.2	-177.2	0	0	0	0	109.1	C257 M266 L270 H271	C257-C268 HydrophobicContact CB-CB 4.46Å; C257-C268 WeakPolarHBondContact SG-CB 3.13Å; C257-C268 PolarHBondContact SG-SG 2.98Å; M266-C268 PolarHBondContact O-N 2.8Å; C268-L270 PolarHBondContact O-N 2.88Å; C268-H271 PolarHBondContact O-N 3.05Å
269	L	50.2	Low	43.6	Very low	177 Å²	177	136.7 Å²	136.7	93%	0.927	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-8.1	-179.8	-65.4	170.2	0	0	0	113.8	L267	L267-L269 PolarHBondContact O-N 2.97Å; L267-L269 VanDerWaalsContact O-N 3.11Å
270	L	49.2	Very low	42.5	Very low	153 Å²	153	132.7 Å²	132.7	80%	0.801	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-21.4	175.5	-64.4	168.7	0	0	0	113.5	C268	C268-L270 PolarHBondContact O-N 2.88Å
271	H	45.9	Very low	42	Very low	123 Å²	123	135.7 Å²	135.7	57%	0.569	77%	0.772	S	S	*	*	S	Bend	trans	-125.2	100.2	-179.8	-64.1	128.7	0	0	0	110.8	C268 K273	C268-H271 PolarHBondContact O-N 3.05Å; H271-K273 PolarHBondContact O-N 2.78Å
272	G	39	Very low	41.2	Very low	77 Å²	77	129 Å²	129	79%	0.794	77%	0.765	S	S	*	*			trans	-69.8	122.5	174	0	0	0	0	0	110.9	N274	G272-N274 VanDerWaalsContact C-N 3.34Å; G272-N274 PolarHBondContact O-N 3.37Å
273	K	43.7	Very low	40.7	Very low	194 Å²	194	125.8 Å²	125.8	84%	0.843	76%	0.763	S	S	*	*			trans	-64.4	92.2	171.7	-174	175.5	-177.3	174.7	0	109.1	H271	H271-K273 PolarHBondContact O-N 2.78Å
274	N	34.3	Very low	40.3	Very low	139 Å²	139	133.6 Å²	133.6	74%	0.743	77%	0.773	S	S	*	*			trans	-141.4	104	162.6	-116.2	3.3	0	0	0	110.2	G272 G276	G272-N274 VanDerWaalsContact C-N 3.34Å; G272-N274 PolarHBondContact O-N 3.37Å; N274-G276 PolarHBondContact O-N 3.22Å
275	S	41.7	Very low	40.2	Very low	118 Å²	118	129.8 Å²	129.8	83%	0.825	76%	0.759	S	S	*	*	S	Bend	trans	-49.9	125.9	157.9	45.2	0	0	0	0	110.3
276	G	35.5	Very low	40.1	Very low	77 Å²	77	128.4 Å²	128.4	79%	0.794	75%	0.747	S	S	*	*			trans	95.2	63.4	164.6	0	0	0	0	0	115.7	N274	N274-G276 PolarHBondContact O-N 3.22Å
277	V	30.1	Very low	39.9	Very low	121 Å²	121	124.8 Å²	124.8	73%	0.733	73%	0.729	S	S	*	*			trans	-133.2	115.1	155.3	-178.7	0	0	0	0	107.5
278	Q	34	Very low	39.9	Very low	176 Å²	176	122.6 Å²	122.6	82%	0.822	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-50.5	134.5	168.1	-80.5	-178.6	-23.3	0	0	109.3	S280	Q278-S280 PolarHBondContact O-N 3.11Å
279	P	33.4	Very low	40.3	Very low	130 Å²	130	127.1 Å²	127.1	84%	0.844	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-63.6	116.3	171.6	25.4	-28.2	0	0	0	107.5	T281	P279-T281 PolarHBondContact O-N 3.18Å
280	S	27.2	Very low	40.9	Very low	106 Å²	106	119.3 Å²	119.3	74%	0.741	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-58.5	128.5	172.9	-55.1	0	0	0	0	108.4	Q278 G282	Q278-S280 PolarHBondContact O-N 3.11Å; S280-G282 PolarHBondContact O-N 3.3Å
281	T	32.6	Very low	42.3	Very low	158 Å²	158	112.9 Å²	112.9	97%	0.969	66%	0.662	S	S	*	*	S	Bend	trans	-21.4	86.3	166.9	-38.2	0	0	0	0	115	P279	P279-T281 PolarHBondContact O-N 3.18Å
282	G	28.8	Very low	44	Very low	80 Å²	80	107.2 Å²	107.2	83%	0.825	64%	0.637	S	S	*	*			trans	-168	12.6	178.5	0	0	0	0	0	117	S280	S280-G282 PolarHBondContact O-N 3.3Å
283	G	35	Very low	45.9	Very low	58 Å²	58	105.3 Å²	105.3	60%	0.598	61%	0.611	S	S	*	*	S	Bend	trans	-141.2	22.2	-177.2	0	0	0	0	0	114.7
284	R	36.2	Very low	47	Very low	225 Å²	225	105.7 Å²	105.7	85%	0.849	61%	0.607	S	S	*	*	S	Bend	trans	-90.5	-23	176.3	-113	-178.1	177.4	-155.2	-3	113.2
285	D	44.7	Very low	48.4	Very low	127 Å²	127	108.2 Å²	108.2	68%	0.679	62%	0.615	S	S	*	*	H	α-helix	trans	-72.3	-38.2	-178.4	-89	-13	0	0	0	112.9	M287 E288 D289	D285-M287 VanDerWaalsContact C-N 3.28Å; D285-M287 PolarHBondContact O-N 2.78Å; D285-E288 PolarHBondContact O-N 2.81Å; D285-D289 PolarHBondContact O-N 2.89Å
286	E	49.8	Very low	49.9	Very low	132 Å²	132	104.6 Å²	104.6	62%	0.617	59%	0.589	S	S	*	*	H	α-helix	trans	-66.7	-26.2	-176	-67.1	-179.3	159.1	0	0	113.7
287	M	44.7	Very low	52	Low	65 Å²	65	102.7 Å²	102.7	32%	0.32	56%	0.564	S	S	.	*	H	α-helix	trans	-81.4	-29.2	177.3	-161.5	80.8	148.3	0	0	112.2	D285 D289 L290	D285-M287 VanDerWaalsContact C-N 3.28Å; D285-M287 PolarHBondContact O-N 2.78Å; M287-D289 PolarHBondContact O-N 2.82Å; M287-L290 PolarHBondContact O-N 3.05Å; M287-L290 HydrophobicContact SD-CD1 4.3Å
288	E	49.2	Very low	54.6	Low	99 Å²	99	99.5 Å²	99.5	46%	0.463	54%	0.539	S	S	.	.	H	α-helix	trans	-65.5	-25.9	173.7	-70.5	-157.2	166.5	0	0	111.3	D285	D285-E288 PolarHBondContact O-N 2.81Å
289	D	60.2	Low	57.1	Low	134 Å²	134	91.1 Å²	91.1	72%	0.717	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-11.5	176.9	-77.8	-22	0	0	0	114.3	D285 M287 L291	D285-D289 PolarHBondContact O-N 2.89Å; M287-D289 PolarHBondContact O-N 2.82Å; D289-L291 PolarHBondContact O-N 3.2Å
290	L	63.8	Low	59.6	Low	13 Å²	13	86 Å²	86	7%	0.068	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	21.7	-176.8	-68.1	172.8	0	0	0	114.9	M185 P217 Y220 V245 M287 C292 L299	M185-L290 HydrophobicContact CE-CB 4.45Å; M185-L290 HydrophobicContact CE-CD2 3.85Å; P217-L290 HydrophobicContact CG-CD2 4.26Å; Y220-L290 HydrophobicContact CD1-CD1 3.6Å; Y220-L290 HydrophobicContact CD2-CD1 3.82Å; Y220-L290 HydrophobicContact CD2-CD2 4.36Å; Y220-L290 HydrophobicContact CE1-CD1 3.42Å; Y220-L290 VanDerWaalsContact CE1-CD1 3.42Å; Y220-L290 HydrophobicContact CE2-CD1 3.68Å; Y220-L290 HydrophobicContact CE2-CD2 4.48Å; Y220-L290 HydrophobicContact CG-CD1 3.79Å; Y220-L290 VanDerWaalsContact CZ-CD1 3.47Å; V245-L290 HydrophobicContact CG1-CD1 4.48Å; M287-L290 PolarHBondContact O-N 3.05Å; M287-L290 HydrophobicContact SD-CD1 4.3Å; L290-C292 PolarHBondContact O-N 3.37Å; L290-L299 WeakPolarHBondContact O-CD2 3.35Å
291	L	78.7	Confident	62.4	Low	18 Å²	18	81.1 Å²	81.1	9%	0.094	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	17.4	175.2	-41.2	172.2	0	0	0	113.6	M185 D289 L299 D300 Q303 V304 W307	M185-L291 HydrophobicContact CE-CD1 4.17Å; M185-L291 HydrophobicContact CE-CG 4.43Å; D289-L291 PolarHBondContact O-N 3.2Å; L291-L299 HydrophobicContact CB-CD2 4.48Å; L291-D300 PolarHBondContact O-N 2.91Å; L291-Q303 HydrophobicContact CB-CB 4.07Å; L291-V304 HydrophobicContact CB-CG2 3.94Å; L291-V304 HydrophobicContact CD1-CG2 4.07Å; L291-W307 HydrophobicContact CD1-CB 3.76Å; L291-W307 HydrophobicContact CD1-CD2 3.72Å; L291-W307 HydrophobicContact CD1-CE3 3.87Å; L291-W307 HydrophobicContact CD1-CG 3.65Å; L291-W307 HydrophobicContact CD2-CB 3.47Å; L291-W307 VanDerWaalsContact CD2-CB 3.47Å; L291-W307 HydrophobicContact CD2-CG 3.93Å; L291-W307 HydrophobicContact CG-CB 4.28Å; L291-W307 HydrophobicContact CG-CG 4.43Å
292	C	82.3	Confident	64.8	Low	4 Å²	4	78.9 Å²	78.9	3%	0.027	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-78.6	153.1	176.3	-69.2	0	0	0	0	111.8	V245 L290 Y298 Q303	V245-C292 VanDerWaalsContact CG2-SG 3.58Å; L290-C292 PolarHBondContact O-N 3.37Å; C292-Y298 WeakPolarHBondContact CA-O 3.44Å; C292-Q303 PolarHBondContact O-NE2 3.23Å; C292-Q303 PolarHBondContact O-OE1 3.43Å
293	S	77.4	Confident	67.5	Low	37 Å²	37	77.7 Å²	77.7	26%	0.259	38%	0.384	S	S	.	.			trans	-59.5	144	169.7	179.8	0	0	0	0	111.3	E295 S296 Y298	S293-E295 PolarHBondContact O-N 3.11Å; S293-S296 PolarHBondContact O-N 2.97Å; S293-S296 VanDerWaalsContact O-N 3.11Å; S293-Y298 PolarHBondContact N-O 2.85Å
294	R	66.6	Low	70	Confident	203 Å²	203	74.9 Å²	74.9	77%	0.766	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-20.1	-173.9	-62.5	-179.9	75.1	-167.6	4.2	114.3
295	E	65.2	Low	72.3	Confident	192 Å²	192	64.3 Å²	64.3	90%	0.897	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	-1	-173.7	-64.1	173.5	-172.6	0	0	113.1	S293	S293-E295 PolarHBondContact O-N 3.11Å
296	S	72.6	Confident	74.2	Confident	42 Å²	42	65.3 Å²	65.3	29%	0.294	31%	0.314	S	S	.	.	S	Bend	trans	-145	162.6	-174.2	82.6	0	0	0	0	113.6	S293 Y298	S293-S296 PolarHBondContact O-N 2.97Å; S293-S296 VanDerWaalsContact O-N 3.11Å; S296-Y298 PolarHBondContact O-N 3.23Å; S296-Y298 PolarHBondContact OG-N 2.91Å
297	S	79.7	Confident	76	Confident	37 Å²	37	61.4 Å²	61.4	26%	0.259	29%	0.294	S	S	.	.	S	Bend	trans	-85.1	15.7	173.7	46.7	0	0	0	0	112.8	V245	V245-S297 PolarHBondContact N-O 3.04Å
298	Y	84.3	Confident	78.1	Confident	53 Å²	53	58.4 Å²	58.4	21%	0.208	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-98	141	180	-65.9	-81.5	0	0	0	111	Q242 I243 K244 C292 S293 S296 D300	Q242-Y298 HydrophobicContact CB-CD1 3.78Å; Q242-Y298 HydrophobicContact CB-CE1 3.91Å; I243-Y298 CarbonylContact O-C 3.58Å; I243-Y298 VanDerWaalsContact O-CA 3.26Å; I243-Y298 WeakPolarHBondContact O-CA 3.37Å; K244-Y298 HydrophobicContact CB-CD1 3.94Å; K244-Y298 HydrophobicContact CB-CE1 3.74Å; K244-Y298 HydrophobicContact CD-CE1 4.48Å; K244-Y298 HydrophobicContact CG-CD1 4.46Å; K244-Y298 HydrophobicContact CG-CE1 4.2Å; C292-Y298 WeakPolarHBondContact CA-O 3.44Å; S293-Y298 PolarHBondContact N-O 2.85Å; S296-Y298 PolarHBondContact O-N 3.23Å; S296-Y298 PolarHBondContact OG-N 2.91Å; Y298-D300 PolarHBondContact O-N 2.91Å
299	L	86.6	Confident	79.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-65.3	129.2	176.7	-73.2	178.2	0	0	0	111.1	F222 I243 V245 L290 L291 I356 T382 W384	F222-L299 HydrophobicContact CD1-CD1 3.9Å; F222-L299 HydrophobicContact CD2-CD1 4.48Å; F222-L299 HydrophobicContact CE1-CD1 3.63Å; F222-L299 HydrophobicContact CE1-CD2 4.15Å; F222-L299 HydrophobicContact CE1-CG 4.27Å; F222-L299 HydrophobicContact CE2-CD1 4.24Å; F222-L299 HydrophobicContact CG-CD1 4.34Å; F222-L299 HydrophobicContact CZ-CD1 3.83Å; I243-L299 HydrophobicContact CB-CB 4.34Å; I243-L299 HydrophobicContact CB-CD1 4.05Å; I243-L299 HydrophobicContact CB-CG 4.43Å; I243-L299 HydrophobicContact CD1-CD1 4.45Å; I243-L299 HydrophobicContact CG2-CD1 3.67Å; I243-L299 HydrophobicContact CG2-CG 4.32Å; I243-L299 PolarHBondContact O-N 3.38Å; V245-L299 HydrophobicContact CG2-CD1 4.38Å; V245-L299 HydrophobicContact CG2-CD2 3.5Å; V245-L299 HydrophobicContact CG2-CG 3.57Å; L290-L299 WeakPolarHBondContact O-CD2 3.35Å; L291-L299 HydrophobicContact CB-CD2 4.48Å; L299-I356 HydrophobicContact CD1-CD1 3.4Å; L299-I356 VanDerWaalsContact CD1-CD1 3.4Å; L299-T382 WeakPolarHBondContact O-CA 3.32Å; L299-W384 HydrophobicContact CB-CZ2 3.94Å; L299-W384 PolarHBondContact O-NE1 3.08Å
300	D	87.1	Confident	81.1	Confident	22 Å²	22	53.8 Å²	53.8	12%	0.118	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-92.2	120.1	174.7	-177.6	-81	0	0	0	110	L291 Y298 M302 Q303 V304 G381	L291-D300 PolarHBondContact O-N 2.91Å; Y298-D300 PolarHBondContact O-N 2.91Å; D300-M302 VanDerWaalsContact C-N 3.25Å; D300-M302 PolarHBondContact O-N 3.49Å; D300-M302 WeakPolarHBondContact OD1-CA 3.46Å; D300-M302 VanDerWaalsContact OD1-CB 3.27Å; D300-M302 WeakPolarHBondContact OD1-CB 3.48Å; D300-M302 PolarHBondContact OD1-N 2.92Å; D300-Q303 HydrophobicContact CB-CB 4.1Å; D300-Q303 HydrophobicContact CB-CG 3.96Å; D300-Q303 PolarHBondContact O-N 2.88Å; D300-Q303 PolarHBondContact OD1-N 3.28Å; D300-V304 WeakPolarHBondContact O-CG2 3.35Å; D300-V304 PolarHBondContact O-N 3.43Å; D300-G381 CarbonylContact C-O 3.45Å; D300-G381 WeakPolarHBondContact CA-O 3.36Å
301	A	85.3	Confident	82.3	Confident	4 Å²	4	53.6 Å²	53.6	3%	0.033	26%	0.259	C	S	.	.	H	α-helix	trans	-59.3	-35.5	-177.7	0	0	0	0	0	112.3	M305 P367 G381 W384	A301-M305 WeakPolarHBondContact O-CB 3.43Å; A301-M305 VanDerWaalsContact O-CG 3.24Å; A301-M305 WeakPolarHBondContact O-CG 3.38Å; A301-M305 PolarHBondContact O-N 3.23Å; A301-P367 HydrophobicContact CB-CB 3.75Å; A301-G381 WeakPolarHBondContact CB-O 3.3Å; A301-G381 PolarHBondContact N-O 2.67Å; A301-W384 HydrophobicContact CB-CZ2 4.24Å
302	M	83.3	Confident	82.8	Confident	111 Å²	111	52.9 Å²	52.9	55%	0.547	26%	0.255	S	S	.	.	H	α-helix	trans	-71.2	-39.8	179.1	-68.2	-63.9	-58.2	0	0	111.5	D300 M305 K306 L369	D300-M302 VanDerWaalsContact C-N 3.25Å; D300-M302 PolarHBondContact O-N 3.49Å; D300-M302 WeakPolarHBondContact OD1-CA 3.46Å; D300-M302 VanDerWaalsContact OD1-CB 3.27Å; D300-M302 WeakPolarHBondContact OD1-CB 3.48Å; D300-M302 PolarHBondContact OD1-N 2.92Å; M302-M305 PolarHBondContact O-N 3.37Å; M302-K306 WeakPolarHBondContact O-CB 3.45Å; M302-K306 PolarHBondContact O-N 2.94Å; M302-L369 HydrophobicContact SD-CD2 3.43Å; M302-L369 WeakPolarHBondContact SD-CD2 3.42Å
303	Q	84.3	Confident	83.1	Confident	55 Å²	55	54.7 Å²	54.7	26%	0.257	27%	0.266	S	S	.	.	H	α-helix	trans	-64.5	-44	174.6	-67.2	-172.5	52.6	0	0	111.6	L291 C292 D300 M305 K306 W307	L291-Q303 HydrophobicContact CB-CB 4.07Å; C292-Q303 PolarHBondContact O-NE2 3.23Å; C292-Q303 PolarHBondContact O-OE1 3.43Å; D300-Q303 HydrophobicContact CB-CB 4.1Å; D300-Q303 HydrophobicContact CB-CG 3.96Å; D300-Q303 PolarHBondContact O-N 2.88Å; D300-Q303 PolarHBondContact OD1-N 3.28Å; Q303-M305 VanDerWaalsContact C-N 3.34Å; Q303-M305 PolarHBondContact O-N 2.79Å; Q303-K306 PolarHBondContact O-N 3.36Å; Q303-W307 WeakPolarHBondContact O-CB 3.39Å; Q303-W307 PolarHBondContact O-N 2.88Å
304	V	87.5	Confident	83.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.3	-47.5	174.8	173.9	0	0	0	0	111.1	F214 L291 D300 K306 W307 F308 P354 W384	F214-V304 HydrophobicContact CE1-CG1 3.91Å; F214-V304 HydrophobicContact CE2-CG1 4.41Å; F214-V304 HydrophobicContact CZ-CG1 3.59Å; F214-V304 HydrophobicContact CZ-CG2 4.2Å; L291-V304 HydrophobicContact CB-CG2 3.94Å; L291-V304 HydrophobicContact CD1-CG2 4.07Å; D300-V304 WeakPolarHBondContact O-CG2 3.35Å; D300-V304 PolarHBondContact O-N 3.43Å; V304-K306 PolarHBondContact O-N 3.13Å; V304-W307 PolarHBondContact O-N 2.73Å; V304-F308 VanDerWaalsContact O-CB 3.32Å; V304-F308 WeakPolarHBondContact O-CB 3.39Å; V304-F308 PolarHBondContact O-N 3.34Å; V304-P354 HydrophobicContact CG1-CB 4.21Å; V304-P354 HydrophobicContact CG1-CG 3.98Å; V304-W384 HydrophobicContact CB-CH2 4.07Å; V304-W384 HydrophobicContact CB-CZ2 4.4Å; V304-W384 HydrophobicContact CG1-CH2 4.05Å; V304-W384 HydrophobicContact CG2-CH2 3.95Å; V304-W384 HydrophobicContact CG2-CZ2 3.96Å
305	M	85.8	Confident	84.8	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-39.7	178.5	-72.5	-55.5	-60.7	0	0	113.2	A301 M302 Q303 F308 Q309 P335 P354 P367 L369	A301-M305 WeakPolarHBondContact O-CB 3.43Å; A301-M305 VanDerWaalsContact O-CG 3.24Å; A301-M305 WeakPolarHBondContact O-CG 3.38Å; A301-M305 PolarHBondContact O-N 3.23Å; M302-M305 PolarHBondContact O-N 3.37Å; Q303-M305 VanDerWaalsContact C-N 3.34Å; Q303-M305 PolarHBondContact O-N 2.79Å; M305-F308 PolarHBondContact O-N 3.43Å; M305-Q309 WeakPolarHBondContact O-CB 3.3Å; M305-Q309 PolarHBondContact O-N 3.42Å; M305-P335 HydrophobicContact CB-CB 4.19Å; M305-P335 HydrophobicContact CB-CG 3.81Å; M305-P335 HydrophobicContact CE-CB 3.84Å; M305-P335 HydrophobicContact CE-CG 3.74Å; M305-P335 HydrophobicContact CG-CG 4.06Å; M305-P354 WeakPolarHBondContact SD-CD 3.34Å; M305-P354 HydrophobicContact SD-CG 3.41Å; M305-P354 WeakPolarHBondContact SD-CG 3.24Å; M305-P367 HydrophobicContact CG-CB 4.19Å; M305-P367 HydrophobicContact CG-CG 4.18Å; M305-P367 HydrophobicContact SD-CB 4.29Å; M305-P367 HydrophobicContact SD-CG 3.63Å; M305-L369 HydrophobicContact CB-CD2 4.37Å; M305-L369 HydrophobicContact CE-CD1 3.72Å; M305-L369 HydrophobicContact CG-CD1 3.53Å; M305-L369 HydrophobicContact CG-CD2 3.75Å; M305-L369 HydrophobicContact CG-CG 4.11Å; M305-L369 HydrophobicContact SD-CD1 3.74Å
306	K	84.9	Confident	86	Confident	149 Å²	149	41.1 Å²	41.1	65%	0.648	20%	0.204	S	C	*	.	H	α-helix	trans	-64.2	-45.9	177.2	-176.5	-176.8	177.5	-171.9	0	111.1	M302 Q303 V304 Q309 V310	M302-K306 WeakPolarHBondContact O-CB 3.45Å; M302-K306 PolarHBondContact O-N 2.94Å; Q303-K306 PolarHBondContact O-N 3.36Å; V304-K306 PolarHBondContact O-N 3.13Å; K306-Q309 PolarHBondContact O-N 2.87Å; K306-V310 WeakPolarHBondContact O-CG2 3.36Å; K306-V310 PolarHBondContact O-N 3.3Å
307	W	87.3	Confident	86.9	Confident	50 Å²	50	45.8 Å²	45.8	19%	0.189	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-50.8	174.1	162.9	84.2	0	0	0	110.8	M185 L187 L291 Q303 V304 Q309 V310 A311	M185-W307 HydrophobicContact CB-CH2 3.65Å; M185-W307 HydrophobicContact CB-CZ2 3.54Å; M185-W307 HydrophobicContact CG-CH2 4.12Å; M185-W307 HydrophobicContact CG-CZ2 3.89Å; L187-W307 HydrophobicContact CD2-CH2 3.8Å; L187-W307 HydrophobicContact CD2-CZ3 4.39Å; L187-W307 HydrophobicContact CG-CH2 4.4Å; L291-W307 HydrophobicContact CD1-CB 3.76Å; L291-W307 HydrophobicContact CD1-CD2 3.72Å; L291-W307 HydrophobicContact CD1-CE3 3.87Å; L291-W307 HydrophobicContact CD1-CG 3.65Å; L291-W307 HydrophobicContact CD2-CB 3.47Å; L291-W307 VanDerWaalsContact CD2-CB 3.47Å; L291-W307 HydrophobicContact CD2-CG 3.93Å; L291-W307 HydrophobicContact CG-CB 4.28Å; L291-W307 HydrophobicContact CG-CG 4.43Å; Q303-W307 WeakPolarHBondContact O-CB 3.39Å; Q303-W307 PolarHBondContact O-N 2.88Å; V304-W307 PolarHBondContact O-N 2.73Å; W307-Q309 VanDerWaalsContact C-N 3.32Å; W307-Q309 PolarHBondContact O-N 3.02Å; W307-V310 PolarHBondContact O-N 3.32Å; W307-V310 VanDerWaalsContact O-N 3.13Å; W307-A311 WeakPolarHBondContact O-CB 3.49Å; W307-A311 PolarHBondContact O-N 2.93Å
308	F	87.6	Confident	87.4	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-41.8	-178.8	-170.5	-117.5	0	0	0	111.8	L187 V212 V304 M305 A311 L312 L352 P354	L187-F308 HydrophobicContact CD1-CE2 4.26Å; L187-F308 HydrophobicContact CD2-CE2 4.32Å; V212-F308 HydrophobicContact CB-CE2 4.45Å; V212-F308 HydrophobicContact CB-CZ 4.13Å; V212-F308 HydrophobicContact CG1-CE2 4.31Å; V212-F308 HydrophobicContact CG1-CZ 4.39Å; V212-F308 HydrophobicContact CG2-CZ 4.12Å; V304-F308 VanDerWaalsContact O-CB 3.32Å; V304-F308 WeakPolarHBondContact O-CB 3.39Å; V304-F308 PolarHBondContact O-N 3.34Å; M305-F308 PolarHBondContact O-N 3.43Å; F308-A311 WeakPolarHBondContact O-CB 3.35Å; F308-A311 PolarHBondContact O-N 3.19Å; F308-L312 HydrophobicContact CD1-CD1 3.72Å; F308-L312 HydrophobicContact CD1-CG 4.38Å; F308-L312 HydrophobicContact CE1-CD1 3.48Å; F308-L312 VanDerWaalsContact CE1-CD1 3.48Å; F308-L312 HydrophobicContact CE1-CG 4.19Å; F308-L312 HydrophobicContact CE2-CD2 4.5Å; F308-L312 HydrophobicContact CE2-CG 4.42Å; F308-L312 HydrophobicContact CG-CD1 4.38Å; F308-L312 HydrophobicContact CZ-CD1 3.94Å; F308-L312 HydrophobicContact CZ-CD2 4.2Å; F308-L312 HydrophobicContact CZ-CG 4.2Å; F308-L312 WeakPolarHBondContact O-CB 3.28Å; F308-L312 VanDerWaalsContact O-CG 3.28Å; F308-L312 WeakPolarHBondContact O-CG 3.45Å; F308-L312 PolarHBondContact O-N 2.84Å; F308-L352 HydrophobicContact CE1-CB 3.83Å; F308-L352 HydrophobicContact CZ-CB 4.18Å; F308-P354 HydrophobicContact CB-CB 4.47Å; F308-P354 HydrophobicContact CB-CG 4.12Å; F308-P354 HydrophobicContact CD1-CB 4.23Å; F308-P354 HydrophobicContact CD1-CG 3.88Å; F308-P354 HydrophobicContact CD2-CB 4.12Å; F308-P354 HydrophobicContact CE1-CB 4.48Å; F308-P354 HydrophobicContact CE1-CG 4.4Å; F308-P354 HydrophobicContact CE2-CB 4.4Å; F308-P354 HydrophobicContact CG-CB 4.03Å; F308-P354 HydrophobicContact CG-CG 3.94Å
309	Q	86.8	Confident	87.8	Confident	62 Å²	62	47.6 Å²	47.6	29%	0.29	22%	0.222	S	C	.	.	H	α-helix	trans	-63	-43.1	175.8	-173.2	-179.9	6.1	0	0	112.5	M305 K306 W307 A311 T313 F329	M305-Q309 WeakPolarHBondContact O-CB 3.3Å; M305-Q309 PolarHBondContact O-N 3.42Å; K306-Q309 PolarHBondContact O-N 2.87Å; W307-Q309 VanDerWaalsContact C-N 3.32Å; W307-Q309 PolarHBondContact O-N 3.02Å; Q309-A311 VanDerWaalsContact C-N 3.32Å; Q309-T313 WeakPolarHBondContact O-CB 3.25Å; Q309-T313 PolarHBondContact O-N 2.86Å; Q309-T313 PolarHBondContact O-OG1 3.47Å; Q309-F329 HydrophobicContact CG-CD1 3.89Å; Q309-F329 HydrophobicContact CG-CE1 4.18Å
310	V	86.3	Confident	88	Confident	73 Å²	73	49.1 Å²	49.1	44%	0.442	24%	0.235	S	C	.	.	H	α-helix	trans	-63.8	-41.6	175.6	170.8	0	0	0	0	110.5	K306 W307 T313 K314	K306-V310 WeakPolarHBondContact O-CG2 3.36Å; K306-V310 PolarHBondContact O-N 3.3Å; W307-V310 PolarHBondContact O-N 3.32Å; W307-V310 VanDerWaalsContact O-N 3.13Å; V310-T313 WeakPolarHBondContact O-CB 3.4Å; V310-T313 PolarHBondContact O-N 3.15Å; V310-K314 HydrophobicContact CG1-CD 4.35Å; V310-K314 WeakPolarHBondContact O-CG 3.49Å; V310-K314 PolarHBondContact O-N 2.84Å
311	A	88	Confident	88.1	Confident	10 Å²	10	55.4 Å²	55.4	8%	0.083	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-51.6	178.6	0	0	0	0	0	111.1	L175 W307 F308 Q309 T313 K314 A315	L175-A311 HydrophobicContact CD1-CB 3.76Å; L175-A311 HydrophobicContact CD2-CB 4.06Å; W307-A311 WeakPolarHBondContact O-CB 3.49Å; W307-A311 PolarHBondContact O-N 2.93Å; F308-A311 WeakPolarHBondContact O-CB 3.35Å; F308-A311 PolarHBondContact O-N 3.19Å; Q309-A311 VanDerWaalsContact C-N 3.32Å; A311-T313 VanDerWaalsContact C-N 3.3Å; A311-T313 PolarHBondContact O-N 2.81Å; A311-K314 PolarHBondContact O-N 2.8Å; A311-K314 VanDerWaalsContact O-N 3.16Å; A311-A315 PolarHBondContact O-N 3.49Å
312	L	89.5	Confident	88.3	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-59.2	-39.3	174.8	-70.4	172.9	0	0	0	112.5	L171 L175 F308 A315 W316 F329 L338 L352	L171-L312 HydrophobicContact CD2-CD2 3.77Å; L171-L312 HydrophobicContact CG-CD2 4.13Å; L175-L312 HydrophobicContact CD2-CD2 4.34Å; F308-L312 HydrophobicContact CD1-CD1 3.72Å; F308-L312 HydrophobicContact CD1-CG 4.38Å; F308-L312 HydrophobicContact CE1-CD1 3.48Å; F308-L312 VanDerWaalsContact CE1-CD1 3.48Å; F308-L312 HydrophobicContact CE1-CG 4.19Å; F308-L312 HydrophobicContact CE2-CD2 4.5Å; F308-L312 HydrophobicContact CE2-CG 4.42Å; F308-L312 HydrophobicContact CG-CD1 4.38Å; F308-L312 HydrophobicContact CZ-CD1 3.94Å; F308-L312 HydrophobicContact CZ-CD2 4.2Å; F308-L312 HydrophobicContact CZ-CG 4.2Å; F308-L312 WeakPolarHBondContact O-CB 3.28Å; F308-L312 VanDerWaalsContact O-CG 3.28Å; F308-L312 WeakPolarHBondContact O-CG 3.45Å; F308-L312 PolarHBondContact O-N 2.84Å; L312-A315 PolarHBondContact O-N 2.78Å; L312-W316 WeakPolarHBondContact O-CB 3.34Å; L312-W316 PolarHBondContact O-N 3.25Å; L312-F329 HydrophobicContact CB-CE1 4.03Å; L312-F329 HydrophobicContact CB-CZ 4.35Å; L312-L338 HydrophobicContact CD1-CD1 4.17Å; L312-L352 HydrophobicContact CD1-CD1 4.12Å; L312-L352 HydrophobicContact CD2-CD1 3.82Å
313	T	89.1	Confident	88.7	Confident	42 Å²	42	58.4 Å²	58.4	26%	0.258	27%	0.271	S	S	.	.	H	α-helix	trans	-62.1	-46.3	176.4	-58.7	0	0	0	0	110.6	Q309 V310 A311 W316 H317 F329	Q309-T313 WeakPolarHBondContact O-CB 3.25Å; Q309-T313 PolarHBondContact O-N 2.86Å; Q309-T313 PolarHBondContact O-OG1 3.47Å; V310-T313 WeakPolarHBondContact O-CB 3.4Å; V310-T313 PolarHBondContact O-N 3.15Å; A311-T313 VanDerWaalsContact C-N 3.3Å; A311-T313 PolarHBondContact O-N 2.81Å; T313-W316 PolarHBondContact O-N 2.99Å; T313-H317 PolarHBondContact O-N 2.9Å; T313-H317 VanDerWaalsContact O-N 3.15Å; T313-H317 PolarHBondContact O-ND1 2.96Å; T313-F329 VanDerWaalsContact OG1-CZ 3.22Å; T313-F329 WeakPolarHBondContact OG1-CZ 3.46Å
314	K	88.5	Confident	88.8	Confident	124 Å²	124	63 Å²	63	54%	0.539	29%	0.293	S	S	.	.	H	α-helix	trans	-62.1	-43.4	176.9	-71.3	174	-179.7	177.9	0	111.9	V310 A311 H317 R318	V310-K314 HydrophobicContact CG1-CD 4.35Å; V310-K314 WeakPolarHBondContact O-CG 3.49Å; V310-K314 PolarHBondContact O-N 2.84Å; A311-K314 PolarHBondContact O-N 2.8Å; A311-K314 VanDerWaalsContact O-N 3.16Å; K314-H317 PolarHBondContact O-N 3.43Å; K314-R318 PolarHBondContact O-N 3.35Å
315	A	90.3	Very high	89	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-45.6	177.7	0	0	0	0	0	111.6	L171 A174 L175 A311 L312 H317 R318 I319	L171-A315 HydrophobicContact CD1-CB 3.73Å; A174-A315 HydrophobicContact CB-CB 4.31Å; L175-A315 HydrophobicContact CB-CB 3.84Å; L175-A315 HydrophobicContact CD1-CB 4.27Å; A311-A315 PolarHBondContact O-N 3.49Å; L312-A315 PolarHBondContact O-N 2.78Å; A315-H317 PolarHBondContact O-N 2.76Å; A315-R318 WeakPolarHBondContact O-CB 3.41Å; A315-R318 PolarHBondContact O-N 2.95Å; A315-I319 PolarHBondContact O-N 2.95Å
316	W	92.2	Very high	89.2	Confident	23 Å²	23	68.9 Å²	68.9	9%	0.087	32%	0.324	C	S	.	.	H	α-helix	trans	-57	-45.2	176.1	173.7	-116.1	0	0	0	112.3	F167 L171 L312 T313 R318 I319 A320 Y323 F325 L327	F167-W316 HydrophobicContact CE2-CE3 4.13Å; F167-W316 AromaticContact CE2-CZ3 3.76Å; F167-W316 HydrophobicContact CE2-CZ3 3.76Å; F167-W316 HydrophobicContact CZ-CE3 4.07Å; F167-W316 AromaticContact CZ-CZ3 3.99Å; F167-W316 HydrophobicContact CZ-CZ3 3.99Å; L171-W316 HydrophobicContact CD1-CB 4.31Å; L312-W316 WeakPolarHBondContact O-CB 3.34Å; L312-W316 PolarHBondContact O-N 3.25Å; T313-W316 PolarHBondContact O-N 2.99Å; W316-R318 PolarHBondContact O-N 3.46Å; W316-R318 VanDerWaalsContact O-N 3.11Å; W316-I319 HydrophobicContact CE3-CD1 4.4Å; W316-I319 HydrophobicContact CE3-CG1 4.02Å; W316-I319 HydrophobicContact CZ3-CG1 4.43Å; W316-I319 PolarHBondContact O-N 2.93Å; W316-I319 VanDerWaalsContact O-N 3.1Å; W316-A320 HydrophobicContact CD2-CB 4.15Å; W316-A320 HydrophobicContact CH2-CB 4.14Å; W316-A320 HydrophobicContact CZ2-CB 3.74Å; W316-A320 HydrophobicContact CZ3-CB 4.5Å; W316-A320 WeakPolarHBondContact O-CA 3.49Å; W316-A320 VanDerWaalsContact O-CB 3.26Å; W316-A320 WeakPolarHBondContact O-CB 3.25Å; W316-A320 PolarHBondContact O-N 3.1Å; W316-Y323 HydrophobicContact CZ3-CD2 4.19Å; W316-F325 AromaticContact CH2-CD2 3.96Å; W316-F325 HydrophobicContact CH2-CD2 3.96Å; W316-F325 AromaticContact CH2-CE2 3.91Å; W316-F325 HydrophobicContact CH2-CE2 3.91Å; W316-F325 VanDerWaalsContact CH2-O 3.28Å; W316-F325 WeakPolarHBondContact CH2-O 3.45Å; W316-F325 WeakPolarHBondContact CZ2-O 3.28Å; W316-F325 HydrophobicContact CZ3-CD2 4.5Å; W316-F325 AromaticContact CZ3-CE2 4Å; W316-F325 HydrophobicContact CZ3-CE2 4Å; W316-L327 HydrophobicContact CB-CD2 4.06Å; W316-L327 HydrophobicContact CD2-CB 3.6Å; W316-L327 HydrophobicContact CD2-CD2 4.11Å; W316-L327 HydrophobicContact CE3-CB 4.05Å; W316-L327 HydrophobicContact CE3-CD2 4.34Å; W316-L327 HydrophobicContact CG-CB 3.98Å; W316-L327 HydrophobicContact CG-CD2 3.97Å; W316-L327 HydrophobicContact CH2-CB 4.39Å; W316-L327 HydrophobicContact CZ2-CB 3.98Å; W316-L327 HydrophobicContact CZ3-CB 4.42Å
317	H	91.4	Very high	89.5	Confident	139 Å²	139	62.6 Å²	62.6	64%	0.644	30%	0.297	S	S	*	.	H	α-helix	trans	-58.6	-27.6	178	-75.6	88.7	0	0	0	113.4	T313 K314 A315	T313-H317 PolarHBondContact O-N 2.9Å; T313-H317 VanDerWaalsContact O-N 3.15Å; T313-H317 PolarHBondContact O-ND1 2.96Å; K314-H317 PolarHBondContact O-N 3.43Å; A315-H317 PolarHBondContact O-N 2.76Å
318	R	89.3	Confident	89.4	Confident	122 Å²	122	61 Å²	61	46%	0.46	29%	0.294	S	S	.	.	H	α-helix	trans	-76	-41.8	175.8	-68.8	-170.3	173	-172.4	3.4	112.3	S177 V178 K314 A315 W316 H321	S177-R318 PolarHBondContact O-NH1 2.88Å; S177-R318 VanDerWaalsContact O-NH1 3.15Å; S177-R318 PolarHBondContact OG-NH1 3.19Å; V178-R318 VanDerWaalsContact CG2-NH1 3.28Å; K314-R318 PolarHBondContact O-N 3.35Å; A315-R318 WeakPolarHBondContact O-CB 3.41Å; A315-R318 PolarHBondContact O-N 2.95Å; W316-R318 PolarHBondContact O-N 3.46Å; W316-R318 VanDerWaalsContact O-N 3.11Å; R318-H321 PolarHBondContact O-CE1 3.47Å; R318-H321 PolarHBondContact O-ND1 3.05Å
319	I	92.6	Very high	89.1	Confident	7 Å²	7	63.6 Å²	63.6	4%	0.036	31%	0.306	C	S	.	.	H	α-helix	trans	-97.6	-7.3	-174.3	64	171	0	0	0	114.5	F167 D170 L171 A174 A315 W316 H321 K322 Y323	F167-I319 HydrophobicContact CE2-CD1 4.27Å; D170-I319 HydrophobicContact CB-CD1 4.47Å; L171-I319 HydrophobicContact CB-CD1 4.06Å; L171-I319 HydrophobicContact CD1-CD1 3.86Å; L171-I319 HydrophobicContact CD1-CG1 4.49Å; A174-I319 HydrophobicContact CB-CG2 3.46Å; A174-I319 VanDerWaalsContact CB-CG2 3.46Å; A315-I319 PolarHBondContact O-N 2.95Å; W316-I319 HydrophobicContact CE3-CD1 4.4Å; W316-I319 HydrophobicContact CE3-CG1 4.02Å; W316-I319 HydrophobicContact CZ3-CG1 4.43Å; W316-I319 PolarHBondContact O-N 2.93Å; W316-I319 VanDerWaalsContact O-N 3.1Å; I319-H321 PolarHBondContact O-N 3.43Å; I319-K322 HydrophobicContact CB-CD 4.44Å; I319-K322 WeakPolarHBondContact O-CB 3.41Å; I319-K322 PolarHBondContact O-N 3.27Å; I319-Y323 HydrophobicContact CD1-CE2 4.17Å; I319-Y323 WeakPolarHBondContact O-CD2 3.26Å
320	A	90.1	Very high	88.2	Confident	32 Å²	32	61.9 Å²	61.9	26%	0.264	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-53.4	-33.9	-177.6	0	0	0	0	0	112.6	W316 K322 Y323	W316-A320 HydrophobicContact CD2-CB 4.15Å; W316-A320 HydrophobicContact CH2-CB 4.14Å; W316-A320 HydrophobicContact CZ2-CB 3.74Å; W316-A320 HydrophobicContact CZ3-CB 4.5Å; W316-A320 WeakPolarHBondContact O-CA 3.49Å; W316-A320 VanDerWaalsContact O-CB 3.26Å; W316-A320 WeakPolarHBondContact O-CB 3.25Å; W316-A320 PolarHBondContact O-N 3.1Å; A320-K322 PolarHBondContact O-N 3.11Å; A320-Y323 PolarHBondContact O-N 3.38Å
321	H	89.8	Confident	86.8	Confident	154 Å²	154	65.5 Å²	65.5	71%	0.713	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-67.6	-19.2	178.5	72.4	-86.8	0	0	0	114.4	R318 I319 Y323	R318-H321 PolarHBondContact O-CE1 3.47Å; R318-H321 PolarHBondContact O-ND1 3.05Å; I319-H321 PolarHBondContact O-N 3.43Å; H321-Y323 VanDerWaalsContact C-N 3.32Å
322	K	90.4	Very high	85	Confident	126 Å²	126	72.7 Å²	72.7	55%	0.548	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-78.9	-18	177.6	-62.3	-176.7	177.3	-179.5	0	112.6	I319 A320	I319-K322 HydrophobicContact CB-CD 4.44Å; I319-K322 WeakPolarHBondContact O-CB 3.41Å; I319-K322 PolarHBondContact O-N 3.27Å; A320-K322 PolarHBondContact O-N 3.11Å
323	Y	90.3	Very high	83.2	Confident	52 Å²	52	77.8 Å²	77.8	20%	0.204	38%	0.38	C	S	.	.			trans	-118.8	144.8	-168	-69.2	-76.8	0	0	0	111.7	F167 D170 W316 I319 A320 H321 F325	F167-Y323 HydrophobicContact CD2-CE1 4.14Å; F167-Y323 HydrophobicContact CD2-CE2 4.04Å; F167-Y323 AromaticContact CD2-CZ 3.8Å; F167-Y323 HydrophobicContact CE2-CD2 4.39Å; F167-Y323 HydrophobicContact CE2-CE2 4.2Å; D170-Y323 WeakPolarHBondContact CB-OH 3.35Å; D170-Y323 VanDerWaalsContact CG-OH 3.25Å; D170-Y323 PolarHBondContact OD2-OH 3.08Å; W316-Y323 HydrophobicContact CZ3-CD2 4.19Å; I319-Y323 HydrophobicContact CD1-CE2 4.17Å; I319-Y323 WeakPolarHBondContact O-CD2 3.26Å; A320-Y323 PolarHBondContact O-N 3.38Å; H321-Y323 VanDerWaalsContact C-N 3.32Å; Y323-F325 VanDerWaalsContact C-N 3.29Å; Y323-F325 HydrophobicContact CD1-CD1 4.2Å; Y323-F325 AromaticContact CD1-CE1 3.23Å; Y323-F325 HydrophobicContact CD1-CE1 3.23Å; Y323-F325 HydrophobicContact CD1-CE2 4.15Å; Y323-F325 AromaticContact CD1-CZ 3.21Å; Y323-F325 HydrophobicContact CD1-CZ 3.21Å; Y323-F325 HydrophobicContact CD2-CZ 4.34Å; Y323-F325 AromaticContact CE1-CE1 3.95Å; Y323-F325 HydrophobicContact CE1-CE1 3.95Å; Y323-F325 AromaticContact CE1-CZ 3.75Å; Y323-F325 HydrophobicContact CE1-CZ 3.75Å; Y323-F325 AromaticContact CG-CE1 3.84Å; Y323-F325 HydrophobicContact CG-CE1 3.84Å; Y323-F325 HydrophobicContact CG-CE2 4.01Å; Y323-F325 AromaticContact CG-CZ 3.53Å; Y323-F325 HydrophobicContact CG-CZ 3.53Å
324	E	87.9	Confident	81.9	Confident	152 Å²	152	77 Å²	77	71%	0.71	38%	0.375	S	S	*	.	S	Bend	trans	-90.1	9.2	177.8	-61.2	-168.8	159.4	0	0	113.6	R343	E324-R343 PolarHBondContact O-NE 3.46Å
325	F	91.8	Very high	80.6	Confident	14 Å²	14	72 Å²	72	6%	0.061	36%	0.355	C	S	.	.	S	Bend	trans	-121.2	162.3	-178.8	57.8	-111.2	0	0	0	111.5	F163 F167 W316 Y323 I340 K341 F342	F163-F325 HydrophobicContact CE2-CE1 4.28Å; F163-F325 HydrophobicContact CZ-CD1 4.27Å; F163-F325 AromaticContact CZ-CE1 3.64Å; F163-F325 HydrophobicContact CZ-CE1 3.64Å; F163-F325 HydrophobicContact CZ-CZ 4.24Å; F167-F325 HydrophobicContact CD2-CE2 4.03Å; F167-F325 AromaticContact CD2-CZ 3.67Å; F167-F325 HydrophobicContact CD2-CZ 3.67Å; F167-F325 AromaticContact CE2-CE2 3.72Å; F167-F325 HydrophobicContact CE2-CE2 3.72Å; F167-F325 AromaticContact CE2-CZ 3.85Å; F167-F325 HydrophobicContact CE2-CZ 3.85Å; F167-F325 HydrophobicContact CG-CZ 4.23Å; F167-F325 HydrophobicContact CZ-CE2 4.06Å; W316-F325 AromaticContact CH2-CD2 3.96Å; W316-F325 HydrophobicContact CH2-CD2 3.96Å; W316-F325 AromaticContact CH2-CE2 3.91Å; W316-F325 HydrophobicContact CH2-CE2 3.91Å; W316-F325 VanDerWaalsContact CH2-O 3.28Å; W316-F325 WeakPolarHBondContact CH2-O 3.45Å; W316-F325 WeakPolarHBondContact CZ2-O 3.28Å; W316-F325 HydrophobicContact CZ3-CD2 4.5Å; W316-F325 AromaticContact CZ3-CE2 4Å; W316-F325 HydrophobicContact CZ3-CE2 4Å; Y323-F325 VanDerWaalsContact C-N 3.29Å; Y323-F325 HydrophobicContact CD1-CD1 4.2Å; Y323-F325 AromaticContact CD1-CE1 3.23Å; Y323-F325 HydrophobicContact CD1-CE1 3.23Å; Y323-F325 HydrophobicContact CD1-CE2 4.15Å; Y323-F325 AromaticContact CD1-CZ 3.21Å; Y323-F325 HydrophobicContact CD1-CZ 3.21Å; Y323-F325 HydrophobicContact CD2-CZ 4.34Å; Y323-F325 AromaticContact CE1-CE1 3.95Å; Y323-F325 HydrophobicContact CE1-CE1 3.95Å; Y323-F325 AromaticContact CE1-CZ 3.75Å; Y323-F325 HydrophobicContact CE1-CZ 3.75Å; Y323-F325 AromaticContact CG-CE1 3.84Å; Y323-F325 HydrophobicContact CG-CE1 3.84Å; Y323-F325 HydrophobicContact CG-CE2 4.01Å; Y323-F325 AromaticContact CG-CZ 3.53Å; Y323-F325 HydrophobicContact CG-CZ 3.53Å; F325-I340 HydrophobicContact CB-CG2 3.97Å; F325-I340 HydrophobicContact CD1-CG2 4.04Å; F325-I340 HydrophobicContact CD2-CG2 3.42Å; F325-I340 VanDerWaalsContact CD2-CG2 3.42Å; F325-I340 HydrophobicContact CE1-CG2 4.36Å; F325-I340 HydrophobicContact CE2-CG2 3.79Å; F325-I340 HydrophobicContact CG-CG2 3.55Å; F325-I340 HydrophobicContact CZ-CG2 4.23Å; F325-K341 WeakPolarHBondContact CA-O 3.33Å; F325-K341 VanDerWaalsContact CB-O 3.3Å; F325-K341 WeakPolarHBondContact CB-O 3.48Å; F325-F342 HydrophobicContact CB-CD1 4.07Å; F325-F342 HydrophobicContact CB-CE1 4.42Å; F325-F342 HydrophobicContact CD1-CD1 4.39Å; F325-F342 HydrophobicContact CD1-CE1 4Å; F325-F342 HydrophobicContact CG-CE1 4.49Å
326	D	89.7	Confident	79.9	Confident	111 Å²	111	72.2 Å²	72.2	59%	0.594	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	146.6	175.4	-65.7	-46.8	0	0	0	111.3	K341	D326-K341 HydrophobicContact CB-CB 4.35Å; D326-K341 PolarHBondContact N-O 3.06Å; D326-K341 PolarHBondContact O-N 3.43Å
327	L	90.4	Very high	79.6	Confident	17 Å²	17	72.1 Å²	72.1	9%	0.089	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	126.5	170.3	-172.7	66.1	0	0	0	110.3	F167 W316 F329 L338 I340 F350	F167-L327 HydrophobicContact CE1-CD1 4.08Å; F167-L327 HydrophobicContact CZ-CD1 4.22Å; F167-L327 HydrophobicContact CZ-CD2 4.39Å; W316-L327 HydrophobicContact CB-CD2 4.06Å; W316-L327 HydrophobicContact CD2-CB 3.6Å; W316-L327 HydrophobicContact CD2-CD2 4.11Å; W316-L327 HydrophobicContact CE3-CB 4.05Å; W316-L327 HydrophobicContact CE3-CD2 4.34Å; W316-L327 HydrophobicContact CG-CB 3.98Å; W316-L327 HydrophobicContact CG-CD2 3.97Å; W316-L327 HydrophobicContact CH2-CB 4.39Å; W316-L327 HydrophobicContact CZ2-CB 3.98Å; W316-L327 HydrophobicContact CZ3-CB 4.42Å; L327-F329 HydrophobicContact CD2-CE2 4.47Å; L327-F329 HydrophobicContact CD2-CZ 4.2Å; L327-L338 HydrophobicContact CD1-CB 4.29Å; L327-L338 HydrophobicContact CD1-CD2 4.45Å; L327-L338 HydrophobicContact CD2-CD2 4.4Å; L327-L338 HydrophobicContact CG-CD2 4.44Å; L327-I340 HydrophobicContact CD1-CG1 4.42Å; L327-F350 HydrophobicContact CD1-CE1 3.86Å; L327-F350 HydrophobicContact CD1-CZ 3.85Å
328	A	86.4	Confident	79.5	Confident	16 Å²	16	65.5 Å²	65.5	13%	0.132	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.1	173.3	0	0	0	0	0	111.1	R339 K341	A328-R339 HydrophobicContact CB-CB 4.49Å; A328-R339 PolarHBondContact N-O 2.98Å; A328-R339 PolarHBondContact O-N 2.97Å; A328-K341 HydrophobicContact CB-CD 3.83Å; A328-K341 HydrophobicContact CB-CG 4.23Å
329	F	80.9	Confident	79.5	Confident	56 Å²	56	64.2 Å²	64.2	25%	0.246	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	137.9	170.6	-61.6	-95.4	0	0	0	109.4	Q309 L312 T313 L327 L338	Q309-F329 HydrophobicContact CG-CD1 3.89Å; Q309-F329 HydrophobicContact CG-CE1 4.18Å; L312-F329 HydrophobicContact CB-CE1 4.03Å; L312-F329 HydrophobicContact CB-CZ 4.35Å; T313-F329 VanDerWaalsContact OG1-CZ 3.22Å; T313-F329 WeakPolarHBondContact OG1-CZ 3.46Å; L327-F329 HydrophobicContact CD2-CE2 4.47Å; L327-F329 HydrophobicContact CD2-CZ 4.2Å; F329-L338 HydrophobicContact CB-CD2 4.45Å; F329-L338 HydrophobicContact CD1-CD2 3.27Å; F329-L338 HydrophobicContact CE1-CD2 3.48Å; F329-L338 VanDerWaalsContact CE1-CD2 3.48Å; F329-L338 HydrophobicContact CG-CD2 3.91Å; F329-L338 HydrophobicContact CZ-CD2 4.24Å
330	G	66.3	Low	79.5	Confident	26 Å²	26	63.9 Å²	63.9	27%	0.268	32%	0.324	S	S	.	.			trans	-67.9	-178.2	-179.5	0	0	0	0	0	113	S337	G330-S337 WeakPolarHBondContact CA-O 3.06Å; G330-S337 PolarHBondContact N-O 2.73Å
331	Q	58.7	Low	79.5	Confident	150 Å²	150	67.5 Å²	67.5	70%	0.701	33%	0.333	S	S	*	.			trans	-59.6	152.2	178.4	-74.7	168.4	-19.3	0	0	111.6	D333 T334	Q331-D333 PolarHBondContact O-N 2.89Å; Q331-T334 CarbonylContact O-C 3.51Å; Q331-T334 PolarHBondContact O-N 3.41Å
332	L	50.5	Low	79.5	Confident	160 Å²	160	63 Å²	63	84%	0.838	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-28.5	178	-72	163.2	0	0	0	113.2	T334	L332-T334 VanDerWaalsContact C-N 3.29Å; L332-T334 PolarHBondContact O-N 2.93Å
333	D	51.1	Low	79.4	Confident	110 Å²	110	67 Å²	67	59%	0.588	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-13.7	-176.5	-49.3	-25.7	0	0	0	113.5	Q331	Q331-D333 PolarHBondContact O-N 2.89Å
334	T	62.3	Low	79.2	Confident	25 Å²	25	68.8 Å²	68.8	15%	0.153	34%	0.343	C	S	.	.			trans	-140.4	83.4	170.9	48.2	0	0	0	0	111	Q331 L332 G336 S337 K371	Q331-T334 CarbonylContact O-C 3.51Å; Q331-T334 PolarHBondContact O-N 3.41Å; L332-T334 VanDerWaalsContact C-N 3.29Å; L332-T334 PolarHBondContact O-N 2.93Å; T334-G336 PolarHBondContact O-N 3.33Å; T334-S337 WeakPolarHBondContact O-CB 3.5Å; T334-S337 PolarHBondContact O-N 3.15Å; T334-S337 WeakPolarHBondContact OG1-CB 3.03Å; T334-K371 HydrophobicContact CG2-CD 3.47Å; T334-K371 VanDerWaalsContact CG2-CD 3.47Å; T334-K371 HydrophobicContact CG2-CG 4.09Å
335	P	61	Low	78.9	Confident	19 Å²	19	64.8 Å²	64.8	12%	0.123	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.5	-172.2	17	-26.1	0	0	0	114.9	M305 L369	M305-P335 HydrophobicContact CB-CB 4.19Å; M305-P335 HydrophobicContact CB-CG 3.81Å; M305-P335 HydrophobicContact CE-CB 3.84Å; M305-P335 HydrophobicContact CE-CG 3.74Å; M305-P335 HydrophobicContact CG-CG 4.06Å; P335-L369 HydrophobicContact CG-CD1 3.78Å; P335-L369 HydrophobicContact CG-CD2 3.83Å; P335-L369 HydrophobicContact CG-CG 4.28Å
336	G	74.4	Confident	78.7	Confident	5 Å²	5	71.5 Å²	71.5	5%	0.052	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-6.2	173.5	0	0	0	0	0	115.1	T334 I351 L352	T334-G336 PolarHBondContact O-N 3.33Å; G336-I351 WeakPolarHBondContact O-CA 3.26Å; G336-L352 WeakPolarHBondContact CA-O 3.45Å; G336-L352 PolarHBondContact O-N 3.35Å
337	S	86.3	Confident	78.6	Confident	21 Å²	21	70.7 Å²	70.7	15%	0.147	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	125.2	-179.3	-172.4	0	0	0	0	110.7	G330 T334	G330-S337 WeakPolarHBondContact CA-O 3.06Å; G330-S337 PolarHBondContact N-O 2.73Å; T334-S337 WeakPolarHBondContact O-CB 3.5Å; T334-S337 PolarHBondContact O-N 3.15Å; T334-S337 WeakPolarHBondContact OG1-CB 3.03Å
338	L	88.9	Confident	78.5	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.005	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	151.2	-179.7	-67.8	170.6	0	0	0	110.2	L312 L327 F329 P349 F350 L352	L312-L338 HydrophobicContact CD1-CD1 4.17Å; L327-L338 HydrophobicContact CD1-CB 4.29Å; L327-L338 HydrophobicContact CD1-CD2 4.45Å; L327-L338 HydrophobicContact CD2-CD2 4.4Å; L327-L338 HydrophobicContact CG-CD2 4.44Å; F329-L338 HydrophobicContact CB-CD2 4.45Å; F329-L338 HydrophobicContact CD1-CD2 3.27Å; F329-L338 HydrophobicContact CE1-CD2 3.48Å; F329-L338 VanDerWaalsContact CE1-CD2 3.48Å; F329-L338 HydrophobicContact CG-CD2 3.91Å; F329-L338 HydrophobicContact CZ-CD2 4.24Å; L338-P349 WeakPolarHBondContact O-CA 3.33Å; L338-F350 CarbonylContact C-O 3.57Å; L338-F350 HydrophobicContact CB-CD1 3.94Å; L338-F350 HydrophobicContact CB-CD2 4.19Å; L338-F350 HydrophobicContact CB-CE1 3.41Å; L338-F350 VanDerWaalsContact CB-CE1 3.41Å; L338-F350 HydrophobicContact CB-CE2 3.74Å; L338-F350 HydrophobicContact CB-CG 4.28Å; L338-F350 HydrophobicContact CB-CZ 3.31Å; L338-F350 HydrophobicContact CD1-CD2 4.33Å; L338-F350 HydrophobicContact CD1-CE1 4.44Å; L338-F350 HydrophobicContact CD1-CE2 3.42Å; L338-F350 VanDerWaalsContact CD1-CE2 3.42Å; L338-F350 HydrophobicContact CD1-CZ 3.47Å; L338-F350 VanDerWaalsContact CD1-CZ 3.47Å; L338-F350 HydrophobicContact CG-CE2 4.22Å; L338-F350 HydrophobicContact CG-CZ 4.02Å; L338-F350 PolarHBondContact N-O 2.95Å; L338-F350 PolarHBondContact O-N 2.98Å; L338-L352 HydrophobicContact CD1-CB 4.3Å; L338-L352 HydrophobicContact CD1-CD1 3.62Å; L338-L352 HydrophobicContact CD1-CG 3.8Å
339	R	90.6	Very high	78.7	Confident	95 Å²	95	71.3 Å²	71.3	36%	0.358	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	119.1	-179.7	-59.2	177.2	75.8	166.5	-0.8	109.8	A328 F347 M348 P349	A328-R339 HydrophobicContact CB-CB 4.49Å; A328-R339 PolarHBondContact N-O 2.98Å; A328-R339 PolarHBondContact O-N 2.97Å; R339-F347 VanDerWaalsContact NH2-CE1 3.25Å; R339-M348 WeakPolarHBondContact CA-O 3.08Å; R339-P349 HydrophobicContact CG-CB 4.24Å
340	I	91.2	Very high	79.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	122.6	170.3	-55.5	177.9	0	0	0	107.6	F163 F167 F325 L327 F342 F347 M348 F350	F163-I340 HydrophobicContact CD1-CD1 4.48Å; F163-I340 HydrophobicContact CE1-CD1 3.7Å; F163-I340 HydrophobicContact CZ-CD1 4.49Å; F167-I340 HydrophobicContact CD1-CD1 3.67Å; F167-I340 HydrophobicContact CD1-CG1 4.35Å; F167-I340 HydrophobicContact CE1-CD1 4.06Å; F167-I340 HydrophobicContact CE1-CG1 4.23Å; F167-I340 HydrophobicContact CG-CD1 4.26Å; F325-I340 HydrophobicContact CB-CG2 3.97Å; F325-I340 HydrophobicContact CD1-CG2 4.04Å; F325-I340 HydrophobicContact CD2-CG2 3.42Å; F325-I340 VanDerWaalsContact CD2-CG2 3.42Å; F325-I340 HydrophobicContact CE1-CG2 4.36Å; F325-I340 HydrophobicContact CE2-CG2 3.79Å; F325-I340 HydrophobicContact CG-CG2 3.55Å; F325-I340 HydrophobicContact CZ-CG2 4.23Å; L327-I340 HydrophobicContact CD1-CG1 4.42Å; I340-F342 HydrophobicContact CB-CE2 4.47Å; I340-F342 HydrophobicContact CG2-CE1 4.16Å; I340-F342 HydrophobicContact CG2-CE2 3.97Å; I340-F342 HydrophobicContact CG2-CZ 3.78Å; I340-F347 CarbonylContact O-C 3.37Å; I340-F347 WeakPolarHBondContact O-CA 3.41Å; I340-M348 HydrophobicContact CB-CB 4.29Å; I340-M348 PolarHBondContact N-O 3.1Å; I340-M348 PolarHBondContact O-N 2.67Å; I340-F350 HydrophobicContact CD1-CD1 4.38Å; I340-F350 HydrophobicContact CD1-CE1 4.08Å; I340-F350 HydrophobicContact CG1-CD1 4.1Å; I340-F350 HydrophobicContact CG1-CE1 3.59Å
341	K	91.4	Very high	80.3	Confident	107 Å²	107	69.3 Å²	69.3	47%	0.465	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	112.2	179.1	-71	179.9	176.4	170.5	0	109.8	F325 D326 A328	F325-K341 WeakPolarHBondContact CA-O 3.33Å; F325-K341 VanDerWaalsContact CB-O 3.3Å; F325-K341 WeakPolarHBondContact CB-O 3.48Å; D326-K341 HydrophobicContact CB-CB 4.35Å; D326-K341 PolarHBondContact N-O 3.06Å; D326-K341 PolarHBondContact O-N 3.43Å; A328-K341 HydrophobicContact CB-CD 3.83Å; A328-K341 HydrophobicContact CB-CG 4.23Å
342	F	89.7	Confident	81.9	Confident	59 Å²	59	62.1 Å²	62.1	26%	0.259	32%	0.316	S	S	.	.			trans	-84	153.5	175.8	-60.8	-83.1	0	0	0	110.7	F163 F325 I340 S344 G345 K346 M348	F163-F342 HydrophobicContact CE1-CE1 4.37Å; F163-F342 AromaticContact CE1-CZ 3.8Å; F163-F342 HydrophobicContact CE1-CZ 3.8Å; F163-F342 AromaticContact CZ-CE1 3.98Å; F163-F342 HydrophobicContact CZ-CE1 3.98Å; F163-F342 AromaticContact CZ-CZ 3.88Å; F163-F342 HydrophobicContact CZ-CZ 3.88Å; F325-F342 HydrophobicContact CB-CD1 4.07Å; F325-F342 HydrophobicContact CB-CE1 4.42Å; F325-F342 HydrophobicContact CD1-CD1 4.39Å; F325-F342 HydrophobicContact CD1-CE1 4Å; F325-F342 HydrophobicContact CG-CE1 4.49Å; I340-F342 HydrophobicContact CB-CE2 4.47Å; I340-F342 HydrophobicContact CG2-CE1 4.16Å; I340-F342 HydrophobicContact CG2-CE2 3.97Å; I340-F342 HydrophobicContact CG2-CZ 3.78Å; F342-S344 WeakPolarHBondContact CB-OG 3.33Å; F342-S344 PolarHBondContact O-N 3.03Å; F342-G345 PolarHBondContact O-N 3.46Å; F342-K346 HydrophobicContact CD2-CB 4.46Å; F342-K346 WeakPolarHBondContact CD2-O 3.21Å; F342-K346 PolarHBondContact N-O 2.94Å; F342-M348 HydrophobicContact CE2-CB 4.01Å; F342-M348 HydrophobicContact CE2-CE 4.17Å; F342-M348 HydrophobicContact CZ-CE 4.15Å
343	R	86.8	Confident	83.8	Confident	212 Å²	212	55.1 Å²	55.1	80%	0.8	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-22.3	173.2	-63.6	-176.8	-178.2	-169.9	-1.8	113.7	E324 G345	E324-R343 PolarHBondContact O-NE 3.46Å; R343-G345 PolarHBondContact O-N 3.5Å
344	S	86	Confident	85.8	Confident	89 Å²	89	49.9 Å²	49.9	62%	0.622	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-5.3	174.4	61.8	0	0	0	0	114.1	F342 K346	F342-S344 WeakPolarHBondContact CB-OG 3.33Å; F342-S344 PolarHBondContact O-N 3.03Å; S344-K346 PolarHBondContact O-N 3.01Å
345	G	82.9	Confident	87.2	Confident	67 Å²	67	48.7 Å²	48.7	69%	0.691	24%	0.244	S	C	*	.	S	Bend	trans	80.5	-7.4	-173.6	0	0	0	0	0	113.8	F342 R343	F342-G345 PolarHBondContact O-N 3.46Å; R343-G345 PolarHBondContact O-N 3.5Å
346	K	87	Confident	88.6	Confident	156 Å²	156	48 Å²	48	68%	0.678	24%	0.24	S	C	*	.			trans	-71	148.9	170.8	-64.2	-173.9	178.4	-176.6	0	110	F342 S344	F342-K346 HydrophobicContact CD2-CB 4.46Å; F342-K346 WeakPolarHBondContact CD2-O 3.21Å; F342-K346 PolarHBondContact N-O 2.94Å; S344-K346 PolarHBondContact O-N 3.01Å
347	F	87.1	Confident	89.3	Confident	94 Å²	94	50 Å²	50	41%	0.412	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	152.2	172.9	65.2	-93	0	0	0	110.9	P205 R339 I340 P349	P205-F347 HydrophobicContact CG-CE2 4.3Å; R339-F347 VanDerWaalsContact NH2-CE1 3.25Å; I340-F347 CarbonylContact O-C 3.37Å; I340-F347 WeakPolarHBondContact O-CA 3.41Å; F347-P349 HydrophobicContact CE2-CG 4.48Å
348	M	89.3	Confident	89.3	Confident	33 Å²	33	50.4 Å²	50.4	16%	0.163	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	111.3	174.6	-175.5	-179.1	-62.1	0	0	108.8	T160 F163 V164 R339 I340 F342	T160-M348 HydrophobicContact CG2-CE 4.25Å; T160-M348 HydrophobicContact CG2-CG 4.25Å; T160-M348 HydrophobicContact CG2-SD 3.8Å; F163-M348 HydrophobicContact CD1-CE 3.91Å; F163-M348 HydrophobicContact CD1-SD 3.59Å; F163-M348 VanDerWaalsContact CD1-SD 3.59Å; F163-M348 HydrophobicContact CE1-CE 4.18Å; F163-M348 HydrophobicContact CE1-SD 3.94Å; V164-M348 HydrophobicContact CG2-CG 4.3Å; V164-M348 HydrophobicContact CG2-SD 3.52Å; V164-M348 VanDerWaalsContact CG2-SD 3.52Å; R339-M348 WeakPolarHBondContact CA-O 3.08Å; I340-M348 HydrophobicContact CB-CB 4.29Å; I340-M348 PolarHBondContact N-O 3.1Å; I340-M348 PolarHBondContact O-N 2.67Å; F342-M348 HydrophobicContact CE2-CB 4.01Å; F342-M348 HydrophobicContact CE2-CE 4.17Å; F342-M348 HydrophobicContact CZ-CE 4.15Å
349	P	89.9	Confident	88.9	Confident	13 Å²	13	55.1 Å²	55.1	8%	0.084	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	145	-179.5	35	-32.6	0	0	0	111.2	P205 L207 L338 R339 F347	P205-P349 HydrophobicContact CB-CG 3.78Å; P205-P349 HydrophobicContact CG-CG 3.61Å; L207-P349 HydrophobicContact CD1-CB 3.78Å; L207-P349 HydrophobicContact CD1-CG 4.03Å; L338-P349 WeakPolarHBondContact O-CA 3.33Å; R339-P349 HydrophobicContact CG-CB 4.24Å; F347-P349 HydrophobicContact CE2-CG 4.48Å
350	F	91.1	Very high	88.3	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	162.2	170.3	67	-74.5	0	0	0	109.1	V164 F167 V168 C208 L327 L338 I340 L352	V164-F350 HydrophobicContact CG1-CB 3.96Å; V164-F350 HydrophobicContact CG1-CD2 4.23Å; V164-F350 HydrophobicContact CG1-CG 4.1Å; F167-F350 HydrophobicContact CD1-CZ 4.2Å; F167-F350 HydrophobicContact CE1-CE1 4.22Å; F167-F350 AromaticContact CE1-CZ 3.74Å; F167-F350 HydrophobicContact CE1-CZ 3.74Å; V168-F350 HydrophobicContact CG2-CD2 4.12Å; V168-F350 HydrophobicContact CG2-CE2 3.82Å; C208-F350 HydrophobicContact CB-CB 4.09Å; C208-F350 CarbonylContact O-C 3.51Å; C208-F350 VanDerWaalsContact O-CA 3.28Å; C208-F350 WeakPolarHBondContact O-CA 3.32Å; L327-F350 HydrophobicContact CD1-CE1 3.86Å; L327-F350 HydrophobicContact CD1-CZ 3.85Å; L338-F350 CarbonylContact C-O 3.57Å; L338-F350 HydrophobicContact CB-CD1 3.94Å; L338-F350 HydrophobicContact CB-CD2 4.19Å; L338-F350 HydrophobicContact CB-CE1 3.41Å; L338-F350 VanDerWaalsContact CB-CE1 3.41Å; L338-F350 HydrophobicContact CB-CE2 3.74Å; L338-F350 HydrophobicContact CB-CG 4.28Å; L338-F350 HydrophobicContact CB-CZ 3.31Å; L338-F350 HydrophobicContact CD1-CD2 4.33Å; L338-F350 HydrophobicContact CD1-CE1 4.44Å; L338-F350 HydrophobicContact CD1-CE2 3.42Å; L338-F350 VanDerWaalsContact CD1-CE2 3.42Å; L338-F350 HydrophobicContact CD1-CZ 3.47Å; L338-F350 VanDerWaalsContact CD1-CZ 3.47Å; L338-F350 HydrophobicContact CG-CE2 4.22Å; L338-F350 HydrophobicContact CG-CZ 4.02Å; L338-F350 PolarHBondContact N-O 2.95Å; L338-F350 PolarHBondContact O-N 2.98Å; I340-F350 HydrophobicContact CD1-CD1 4.38Å; I340-F350 HydrophobicContact CD1-CE1 4.08Å; I340-F350 HydrophobicContact CG1-CD1 4.1Å; I340-F350 HydrophobicContact CG1-CE1 3.59Å; F350-L352 HydrophobicContact CD2-CD2 4.06Å; F350-L352 HydrophobicContact CD2-CG 4.03Å; F350-L352 HydrophobicContact CE2-CD1 4Å; F350-L352 HydrophobicContact CE2-CD2 4.09Å; F350-L352 HydrophobicContact CE2-CG 3.75Å
351	I	90.8	Very high	88.1	Confident	39 Å²	39	59 Å²	59	20%	0.2	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.1	-179.8	-63	172.1	0	0	0	107.7	L207 C208 L210 G336 T353	L207-I351 HydrophobicContact CD1-CD1 4.27Å; L207-I351 HydrophobicContact CD1-CG1 4.11Å; L207-I351 HydrophobicContact CD2-CD1 3.91Å; L207-I351 HydrophobicContact CG-CD1 4.36Å; C208-I351 PolarHBondContact O-N 3.25Å; L210-I351 PolarHBondContact N-O 2.88Å; G336-I351 WeakPolarHBondContact O-CA 3.26Å; I351-T353 WeakPolarHBondContact CG2-OG1 3.05Å
352	L	91.6	Very high	88	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	126.4	166.3	-62	-175.1	0	0	0	108.2	V168 L171 L210 V212 F308 L312 G336 L338 F350	V168-L352 HydrophobicContact CG1-CD1 4.4Å; V168-L352 HydrophobicContact CG1-CD2 3.78Å; V168-L352 HydrophobicContact CG2-CD2 3.99Å; L171-L352 HydrophobicContact CD2-CD1 4.25Å; L210-L352 HydrophobicContact CB-CD2 3.68Å; L210-L352 HydrophobicContact CD1-CD2 3.66Å; L210-L352 HydrophobicContact CG-CD2 4.23Å; L210-L352 WeakPolarHBondContact O-CA 3.46Å; V212-L352 HydrophobicContact CG2-CD2 4.39Å; F308-L352 HydrophobicContact CE1-CB 3.83Å; F308-L352 HydrophobicContact CZ-CB 4.18Å; L312-L352 HydrophobicContact CD1-CD1 4.12Å; L312-L352 HydrophobicContact CD2-CD1 3.82Å; G336-L352 WeakPolarHBondContact CA-O 3.45Å; G336-L352 PolarHBondContact O-N 3.35Å; L338-L352 HydrophobicContact CD1-CB 4.3Å; L338-L352 HydrophobicContact CD1-CD1 3.62Å; L338-L352 HydrophobicContact CD1-CG 3.8Å; F350-L352 HydrophobicContact CD2-CD2 4.06Å; F350-L352 HydrophobicContact CD2-CG 4.03Å; F350-L352 HydrophobicContact CE2-CD1 4Å; F350-L352 HydrophobicContact CE2-CD2 4.09Å; F350-L352 HydrophobicContact CE2-CG 3.75Å
353	T	91.2	Very high	88	Confident	12 Å²	12	55.4 Å²	55.4	7%	0.074	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	118.3	179	-55.1	0	0	0	0	109.2	H209 L210 F211 V212 I351 V355 V366 P367	H209-T353 PolarHBondContact NE2-OG1 2.85Å; L210-T353 PolarHBondContact O-N 2.98Å; F211-T353 CarbonylContact C-O 3.57Å; F211-T353 WeakPolarHBondContact CA-O 3.12Å; V212-T353 PolarHBondContact N-O 3.45Å; I351-T353 WeakPolarHBondContact CG2-OG1 3.05Å; T353-V355 HydrophobicContact CG2-CG1 4.19Å; T353-V355 PolarHBondContact O-N 3.19Å; T353-V366 HydrophobicContact CG2-CG1 3.83Å; T353-P367 HydrophobicContact CG2-CG 4.04Å
354	P	91.4	Very high	88.3	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	131.7	172.7	30.4	-32	0	0	0	108.4	V212 F214 V304 M305 F308 P367	V212-P354 WeakPolarHBondContact O-CA 3.38Å; F214-P354 HydrophobicContact CD1-CB 3.93Å; F214-P354 HydrophobicContact CE1-CB 3.88Å; V304-P354 HydrophobicContact CG1-CB 4.21Å; V304-P354 HydrophobicContact CG1-CG 3.98Å; M305-P354 WeakPolarHBondContact SD-CD 3.34Å; M305-P354 HydrophobicContact SD-CG 3.41Å; M305-P354 WeakPolarHBondContact SD-CG 3.24Å; F308-P354 HydrophobicContact CB-CB 4.47Å; F308-P354 HydrophobicContact CB-CG 4.12Å; F308-P354 HydrophobicContact CD1-CB 4.23Å; F308-P354 HydrophobicContact CD1-CG 3.88Å; F308-P354 HydrophobicContact CD2-CB 4.12Å; F308-P354 HydrophobicContact CE1-CB 4.48Å; F308-P354 HydrophobicContact CE1-CG 4.4Å; F308-P354 HydrophobicContact CE2-CB 4.4Å; F308-P354 HydrophobicContact CG-CB 4.03Å; F308-P354 HydrophobicContact CG-CG 3.94Å; P354-P367 HydrophobicContact CG-CG 4.44Å; P354-P367 WeakPolarHBondContact O-CD 3.44Å
355	V	92.3	Very high	88.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	161	-177.3	-60.2	0	0	0	0	111.3	F211 V212 P213 F214 T353 Y364 F365 V366	F211-V355 HydrophobicContact CB-CG1 4Å; F211-V355 HydrophobicContact CB-CG2 3.8Å; F211-V355 HydrophobicContact CD1-CG1 3.84Å; F211-V355 HydrophobicContact CD2-CG1 4.12Å; F211-V355 HydrophobicContact CE1-CG1 4.31Å; F211-V355 HydrophobicContact CG-CG1 3.73Å; F211-V355 HydrophobicContact CG-CG2 4.29Å; V212-V355 PolarHBondContact O-N 2.96Å; P213-V355 VanDerWaalsContact CA-O 3.26Å; P213-V355 WeakPolarHBondContact CA-O 3.43Å; P213-V355 HydrophobicContact CB-CG2 4.21Å; P213-V355 HydrophobicContact CG-CG2 4.06Å; F214-V355 WeakPolarHBondContact CD1-O 3.2Å; F214-V355 PolarHBondContact N-O 2.63Å; F214-V355 VanDerWaalsContact N-O 3.11Å; T353-V355 HydrophobicContact CG2-CG1 4.19Å; T353-V355 PolarHBondContact O-N 3.19Å; V355-Y364 HydrophobicContact CB-CD1 4.14Å; V355-Y364 HydrophobicContact CG2-CD1 3.54Å; V355-Y364 HydrophobicContact CG2-CE1 4.16Å; V355-Y364 HydrophobicContact CG2-CG 4.27Å; V355-F365 WeakPolarHBondContact CA-O 3.45Å; V355-F365 WeakPolarHBondContact CB-O 3.24Å; V355-V366 HydrophobicContact CG1-CG2 3.86Å
356	I	90.8	Very high	88.7	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.026	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.1	173.9	-66.9	165.3	0	0	0	107.9	F214 F222 I243 L299 Y364 F365 W384	F214-I356 HydrophobicContact CD1-CG1 4.11Å; F214-I356 HydrophobicContact CE1-CD1 3.91Å; F214-I356 HydrophobicContact CE1-CG1 3.57Å; F214-I356 HydrophobicContact CE2-CD1 4.03Å; F214-I356 HydrophobicContact CE2-CG1 4.22Å; F214-I356 HydrophobicContact CZ-CD1 3.46Å; F214-I356 VanDerWaalsContact CZ-CD1 3.46Å; F214-I356 HydrophobicContact CZ-CG1 3.63Å; F222-I356 HydrophobicContact CB-CG2 4.36Å; F222-I356 HydrophobicContact CD2-CD1 3.59Å; F222-I356 HydrophobicContact CD2-CG1 3.84Å; F222-I356 HydrophobicContact CD2-CG2 3.86Å; F222-I356 HydrophobicContact CE2-CD1 3.59Å; F222-I356 HydrophobicContact CE2-CG1 3.89Å; F222-I356 HydrophobicContact CG-CD1 4.31Å; F222-I356 HydrophobicContact CZ-CD1 4.32Å; I243-I356 HydrophobicContact CD1-CB 4.05Å; I243-I356 HydrophobicContact CD1-CD1 3.41Å; I243-I356 VanDerWaalsContact CD1-CD1 3.41Å; I243-I356 HydrophobicContact CD1-CG1 4.27Å; I243-I356 HydrophobicContact CD1-CG2 4.37Å; I243-I356 HydrophobicContact CG2-CD1 4.21Å; L299-I356 HydrophobicContact CD1-CD1 3.4Å; L299-I356 VanDerWaalsContact CD1-CD1 3.4Å; I356-Y364 CarbonylContact O-C 3.47Å; I356-Y364 WeakPolarHBondContact O-CA 3.43Å; I356-F365 HydrophobicContact CB-CB 4.43Å; I356-F365 PolarHBondContact N-O 3.44Å; I356-F365 PolarHBondContact O-N 3.14Å; I356-W384 HydrophobicContact CD1-CH2 4.36Å
357	H	89.3	Confident	88.6	Confident	46 Å²	46	32.4 Å²	32.4	21%	0.213	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	149.5	177.2	63.7	-103.9	0	0	0	110.8	E188 D360 L363 Y364	E188-H357 IonicContact OE1-CE1 3.77Å; E188-H357 IonicContact OE1-ND1 3.83Å; H357-D360 IonicContact NE2-OD1 3.51Å; H357-L363 CarbonylContact C-O 3.48Å; H357-Y364 HydrophobicContact CB-CD1 4.06Å; H357-Y364 HydrophobicContact CB-CE1 3.75Å
358	Y	86.3	Confident	87.9	Confident	30 Å²	30	30.8 Å²	30.8	12%	0.118	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	110.6	177.4	-178.7	-104.2	0	0	0	110.7	P224 L226 D360 S361 L363 F365 P495	P224-Y358 HydrophobicContact CB-CD2 3.84Å; P224-Y358 HydrophobicContact CB-CE2 4.35Å; P224-Y358 HydrophobicContact CG-CD2 3.56Å; P224-Y358 HydrophobicContact CG-CE2 4.06Å; L226-Y358 HydrophobicContact CD1-CD1 4.33Å; L226-Y358 HydrophobicContact CD1-CD2 4.19Å; L226-Y358 HydrophobicContact CD1-CE1 3.75Å; L226-Y358 HydrophobicContact CD1-CE2 3.59Å; L226-Y358 HydrophobicContact CG-CD2 4.2Å; L226-Y358 HydrophobicContact CG-CE2 3.72Å; Y358-D360 PolarHBondContact O-N 3.45Å; Y358-S361 WeakPolarHBondContact O-CA 3.43Å; Y358-S361 VanDerWaalsContact O-CB 3.29Å; Y358-S361 WeakPolarHBondContact O-CB 3.43Å; Y358-S361 PolarHBondContact O-N 2.98Å; Y358-S361 PolarHBondContact O-OG 3.22Å; Y358-L363 WeakPolarHBondContact CB-O 3.38Å; Y358-L363 HydrophobicContact CD1-CD2 4.12Å; Y358-L363 HydrophobicContact CG-CD2 4.12Å; Y358-L363 PolarHBondContact N-O 2.97Å; Y358-F365 AromaticContact CD2-CE2 3.75Å; Y358-F365 HydrophobicContact CD2-CE2 3.75Å; Y358-F365 HydrophobicContact CD2-CZ 4.2Å; Y358-F365 HydrophobicContact CG-CE2 4.24Å; Y358-P495 HydrophobicContact CD1-CB 4.37Å; Y358-P495 HydrophobicContact CD1-CG 3.99Å; Y358-P495 HydrophobicContact CE1-CB 4.08Å; Y358-P495 HydrophobicContact CE1-CG 4.22Å
359	N	79.6	Confident	86.4	Confident	100 Å²	100	30.9 Å²	30.9	54%	0.535	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.2	54.6	169.3	-63.5	-20.6	0	0	0	113.8	S361	N359-S361 PolarHBondContact O-N 3.17Å; N359-S361 VanDerWaalsContact O-N 3.1Å
360	D	78.4	Confident	84.4	Confident	155 Å²	155	35.1 Å²	35.1	83%	0.829	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	19.9	-178.4	-51.7	-44.9	0	0	0	115.8	H357 Y358	H357-D360 IonicContact NE2-OD1 3.51Å; Y358-D360 PolarHBondContact O-N 3.45Å
361	S	87.3	Confident	82.2	Confident	22 Å²	22	42.6 Å²	42.6	15%	0.154	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	161.2	175.5	77.1	0	0	0	0	112	Y358 N359 L363	Y358-S361 WeakPolarHBondContact O-CA 3.43Å; Y358-S361 VanDerWaalsContact O-CB 3.29Å; Y358-S361 WeakPolarHBondContact O-CB 3.43Å; Y358-S361 PolarHBondContact O-N 2.98Å; Y358-S361 PolarHBondContact O-OG 3.22Å; N359-S361 PolarHBondContact O-N 3.17Å; N359-S361 VanDerWaalsContact O-N 3.1Å; S361-L363 PolarHBondContact O-N 3.39Å
362	E	89.2	Confident	79.6	Confident	91 Å²	91	47.5 Å²	47.5	43%	0.425	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	20.2	178.2	-55.9	-67.6	163.1	0	0	113.4	Y364 V390 Y391	E362-Y364 WeakPolarHBondContact O-CD2 2.93Å; E362-Y364 WeakPolarHBondContact O-CE2 3.41Å; E362-Y364 PolarHBondContact OE2-OH 2.76Å; E362-V390 HydrophobicContact CB-CB 4.34Å; E362-V390 HydrophobicContact CB-CG1 4.07Å; E362-V390 HydrophobicContact CG-CG1 4.39Å; E362-V390 VanDerWaalsContact OE2-CG1 3.3Å; E362-V390 WeakPolarHBondContact OE2-CG1 3.27Å; E362-Y391 HydrophobicContact CB-CD1 4.44Å; E362-Y391 HydrophobicContact CB-CD2 4.33Å; E362-Y391 HydrophobicContact CB-CE1 3.99Å; E362-Y391 HydrophobicContact CB-CE2 3.87Å; E362-Y391 PolarHBondContact N-OH 3.17Å; E362-Y391 WeakPolarHBondContact O-CD2 3.3Å; E362-Y391 VanDerWaalsContact O-CE2 3.26Å; E362-Y391 WeakPolarHBondContact O-CE2 3.34Å
363	L	90.6	Very high	76.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127.9	176	177.2	62.5	0	0	0	108.7	L226 H357 Y358 S361 L386 F388 Y391 P495 V498	L226-L363 HydrophobicContact CD1-CD2 4.45Å; L226-L363 HydrophobicContact CD2-CD2 4.04Å; H357-L363 CarbonylContact C-O 3.48Å; Y358-L363 WeakPolarHBondContact CB-O 3.38Å; Y358-L363 HydrophobicContact CD1-CD2 4.12Å; Y358-L363 HydrophobicContact CG-CD2 4.12Å; Y358-L363 PolarHBondContact N-O 2.97Å; S361-L363 PolarHBondContact O-N 3.39Å; L363-L386 HydrophobicContact CD1-CB 4.41Å; L363-F388 HydrophobicContact CD1-CD1 3.82Å; L363-F388 HydrophobicContact CD1-CD2 4.43Å; L363-F388 HydrophobicContact CD1-CE1 3.47Å; L363-F388 VanDerWaalsContact CD1-CE1 3.47Å; L363-F388 HydrophobicContact CD1-CE2 4.15Å; L363-F388 HydrophobicContact CD1-CG 4.28Å; L363-F388 HydrophobicContact CD1-CZ 3.66Å; L363-Y391 HydrophobicContact CB-CE2 3.94Å; L363-P495 HydrophobicContact CD2-CG 4.42Å; L363-V498 HydrophobicContact CD2-CG2 4Å
364	Y	91.7	Very high	74.2	Confident	14 Å²	14	55 Å²	55	6%	0.055	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	142.3	-174.2	-65.3	-85.7	0	0	0	112.3	I191 F211 P213 V355 I356 H357 E362 S387 V390	I191-Y364 HydrophobicContact CD1-CE1 4.04Å; I191-Y364 HydrophobicContact CD1-CE2 4.33Å; I191-Y364 WeakPolarHBondContact CD1-OH 3.49Å; F211-Y364 HydrophobicContact CD2-CD2 4.47Å; F211-Y364 HydrophobicContact CD2-CG 4.37Å; P213-Y364 HydrophobicContact CG-CE1 4.13Å; V355-Y364 HydrophobicContact CB-CD1 4.14Å; V355-Y364 HydrophobicContact CG2-CD1 3.54Å; V355-Y364 HydrophobicContact CG2-CE1 4.16Å; V355-Y364 HydrophobicContact CG2-CG 4.27Å; I356-Y364 CarbonylContact O-C 3.47Å; I356-Y364 WeakPolarHBondContact O-CA 3.43Å; H357-Y364 HydrophobicContact CB-CD1 4.06Å; H357-Y364 HydrophobicContact CB-CE1 3.75Å; E362-Y364 WeakPolarHBondContact O-CD2 2.93Å; E362-Y364 WeakPolarHBondContact O-CE2 3.41Å; E362-Y364 PolarHBondContact OE2-OH 2.76Å; Y364-S387 PolarHBondContact N-O 3.46Å; Y364-S387 PolarHBondContact O-N 3.48Å; Y364-V390 HydrophobicContact CD2-CB 4.48Å; Y364-V390 HydrophobicContact CD2-CG2 3.9Å; Y364-V390 HydrophobicContact CE2-CB 4.02Å; Y364-V390 HydrophobicContact CE2-CG2 3.5Å; Y364-V390 VanDerWaalsContact CE2-CG2 3.5Å
365	F	90	Very high	71.9	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	123.9	168.3	-72.7	-104.3	0	0	0	109.2	P224 L226 I243 V355 I356 Y358 W384 L386	P224-F365 HydrophobicContact CB-CD2 4.08Å; P224-F365 HydrophobicContact CB-CE1 4.35Å; P224-F365 HydrophobicContact CB-CE2 3.47Å; P224-F365 VanDerWaalsContact CB-CE2 3.47Å; P224-F365 HydrophobicContact CB-CZ 3.61Å; P224-F365 HydrophobicContact CG-CE2 4.39Å; L226-F365 HydrophobicContact CD2-CE1 4.5Å; L226-F365 HydrophobicContact CD2-CE2 4.32Å; L226-F365 HydrophobicContact CD2-CZ 3.69Å; L226-F365 HydrophobicContact CG-CZ 4.28Å; I243-F365 HydrophobicContact CD1-CB 3.75Å; I243-F365 HydrophobicContact CD1-CD1 4.18Å; I243-F365 HydrophobicContact CD1-CG 4.03Å; I243-F365 HydrophobicContact CG1-CD1 4.07Å; I243-F365 HydrophobicContact CG1-CG 4.31Å; V355-F365 WeakPolarHBondContact CA-O 3.45Å; V355-F365 WeakPolarHBondContact CB-O 3.24Å; I356-F365 HydrophobicContact CB-CB 4.43Å; I356-F365 PolarHBondContact N-O 3.44Å; I356-F365 PolarHBondContact O-N 3.14Å; Y358-F365 AromaticContact CD2-CE2 3.75Å; Y358-F365 HydrophobicContact CD2-CE2 3.75Å; Y358-F365 HydrophobicContact CD2-CZ 4.2Å; Y358-F365 HydrophobicContact CG-CE2 4.24Å; F365-W384 HydrophobicContact CB-CB 4.14Å; F365-W384 HydrophobicContact CB-CE3 4.1Å; F365-W384 HydrophobicContact CD1-CB 3.73Å; F365-W384 HydrophobicContact CG-CB 4.44Å; F365-L386 HydrophobicContact CD1-CD2 3.8Å; F365-L386 HydrophobicContact CD2-CD2 4.23Å; F365-L386 HydrophobicContact CE1-CD2 3.45Å; F365-L386 VanDerWaalsContact CE1-CD2 3.45Å; F365-L386 HydrophobicContact CE2-CD2 3.85Å; F365-L386 HydrophobicContact CG-CD2 4.2Å; F365-L386 HydrophobicContact CZ-CD2 3.46Å; F365-L386 VanDerWaalsContact CZ-CD2 3.46Å
366	V	88.9	Confident	69.3	Low	20 Å²	20	67.1 Å²	67.1	12%	0.121	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.3	-176	175.2	0	0	0	0	109.2	F211 T353 V355 Q368 L385 S387	F211-V366 HydrophobicContact CE1-CG2 4.12Å; F211-V366 HydrophobicContact CE2-CG2 4.27Å; F211-V366 HydrophobicContact CZ-CG2 3.76Å; T353-V366 HydrophobicContact CG2-CG1 3.83Å; V355-V366 HydrophobicContact CG1-CG2 3.86Å; V366-Q368 PolarHBondContact O-N 2.77Å; V366-L385 PolarHBondContact N-O 2.95Å; V366-L385 PolarHBondContact O-N 3.34Å; V366-S387 VanDerWaalsContact CG2-CB 3.48Å
367	P	84.1	Confident	66.9	Low	7 Å²	7	72.1 Å²	72.1	5%	0.045	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	124.1	177.7	24.3	-30.8	0	0	0	110	A301 M305 T353 P354 L369 W384	A301-P367 HydrophobicContact CB-CB 3.75Å; M305-P367 HydrophobicContact CG-CB 4.19Å; M305-P367 HydrophobicContact CG-CG 4.18Å; M305-P367 HydrophobicContact SD-CB 4.29Å; M305-P367 HydrophobicContact SD-CG 3.63Å; T353-P367 HydrophobicContact CG2-CG 4.04Å; P354-P367 HydrophobicContact CG-CG 4.44Å; P354-P367 WeakPolarHBondContact O-CD 3.44Å; P367-L369 HydrophobicContact CB-CD1 4.35Å; P367-L369 HydrophobicContact CB-CG 4.42Å; P367-L369 HydrophobicContact CG-CD1 4.32Å; P367-L369 PolarHBondContact O-N 2.82Å; P367-W384 HydrophobicContact CB-CE3 4.32Å; P367-W384 HydrophobicContact CB-CH2 4.41Å; P367-W384 HydrophobicContact CB-CZ3 4.04Å; P367-W384 HydrophobicContact CG-CZ3 4.26Å
368	Q	71.4	Confident	64.9	Low	60 Å²	60	75.8 Å²	75.8	28%	0.28	41%	0.409	S	S	.	.			trans	-79.8	104.5	175.1	-171.6	-173.6	9.3	0	0	109.7	Y240 V366	Y240-Q368 HydrophobicContact CE1-CB 4.49Å; Y240-Q368 HydrophobicContact CE1-CG 4.47Å; Y240-Q368 PolarHBondContact OH-NE2 3.44Å; Y240-Q368 PolarHBondContact OH-OE1 3.07Å; V366-Q368 PolarHBondContact O-N 2.77Å
369	L	58.7	Low	63.5	Low	35 Å²	35	76.4 Å²	76.4	18%	0.183	42%	0.42	C	S	.	.			trans	-110.6	99.4	177	-58.1	149.5	0	0	0	106.3	M302 M305 P335 P367 K371	M302-L369 HydrophobicContact SD-CD2 3.43Å; M302-L369 WeakPolarHBondContact SD-CD2 3.42Å; M305-L369 HydrophobicContact CB-CD2 4.37Å; M305-L369 HydrophobicContact CE-CD1 3.72Å; M305-L369 HydrophobicContact CG-CD1 3.53Å; M305-L369 HydrophobicContact CG-CD2 3.75Å; M305-L369 HydrophobicContact CG-CG 4.11Å; M305-L369 HydrophobicContact SD-CD1 3.74Å; P335-L369 HydrophobicContact CG-CD1 3.78Å; P335-L369 HydrophobicContact CG-CD2 3.83Å; P335-L369 HydrophobicContact CG-CG 4.28Å; P367-L369 HydrophobicContact CB-CD1 4.35Å; P367-L369 HydrophobicContact CB-CG 4.42Å; P367-L369 HydrophobicContact CG-CD1 4.32Å; P367-L369 PolarHBondContact O-N 2.82Å; L369-K371 PolarHBondContact O-N 2.82Å
370	S	48.7	Very low	62.9	Low	101 Å²	101	73.9 Å²	73.9	71%	0.706	41%	0.41	S	S	*	.	S	Bend	trans	-31.5	100.7	-171.9	166.1	0	0	0	0	114.1
371	K	43.6	Very low	62.6	Low	158 Å²	158	68.2 Å²	68.2	69%	0.687	39%	0.388	S	S	*	.			trans	-123.6	-4.7	164.3	-125.8	-174.9	-173	170.6	0	114.2	T334 L369	T334-K371 HydrophobicContact CG2-CD 3.47Å; T334-K371 VanDerWaalsContact CG2-CD 3.47Å; T334-K371 HydrophobicContact CG2-CG 4.09Å; L369-K371 PolarHBondContact O-N 2.82Å
372	E	36.4	Very low	62.4	Low	142 Å²	142	67.9 Å²	67.9	66%	0.664	39%	0.385	S	S	*	.	S	Bend	trans	-136.8	134.9	-175.5	-138.4	151	-153.9	0	0	111.4	C374	E372-C374 PolarHBondContact O-N 2.83Å
373	P	32.6	Very low	62.1	Low	87 Å²	87	64.1 Å²	64.1	57%	0.565	37%	0.368	S	S	*	.			trans	-81.5	68.3	-172.4	35.3	-34.4	0	0	0	110.2	R375	P373-R375 HydrophobicContact CB-CG 3.98Å; P373-R375 PolarHBondContact O-N 3.32Å
374	C	37.5	Very low	62	Low	82 Å²	82	64.1 Å²	64.1	55%	0.554	37%	0.368	S	S	*	.			trans	-70.3	71.3	145.8	-91	0	0	0	0	107	E372 G376	E372-C374 PolarHBondContact O-N 2.83Å; C374-G376 PolarHBondContact O-N 2.82Å
375	R	42.5	Very low	61.7	Low	220 Å²	220	66.7 Å²	66.7	83%	0.83	38%	0.382	S	S	*	.			trans	-70.8	70.8	172.2	-78.2	-173.7	178.1	-156	1.5	108.5	P373	P373-R375 HydrophobicContact CB-CG 3.98Å; P373-R375 PolarHBondContact O-N 3.32Å
376	G	38.7	Very low	61.7	Low	35 Å²	35	67.2 Å²	67.2	36%	0.361	39%	0.385	S	S	.	.	S	Bend	trans	-152.5	80.4	177.3	0	0	0	0	0	108.2	N236 C374	N236-G376 PolarHBondContact ND2-O 3.3Å; C374-G376 PolarHBondContact O-N 2.82Å
377	T	40.3	Very low	61.7	Low	109 Å²	109	67.3 Å²	67.3	67%	0.669	39%	0.387	S	S	*	.	S	Bend	trans	67.8	130.9	-178.4	-35.5	0	0	0	0	113	A379	T377-A379 PolarHBondContact O-N 3.24Å; T377-A379 VanDerWaalsContact O-N 3.07Å
378	P	46.6	Very low	62.1	Low	123 Å²	123	67.2 Å²	67.2	80%	0.799	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-58.9	119.9	174	23.7	-31.3	0	0	0	108.3	S380	P378-S380 PolarHBondContact O-N 2.68Å
379	A	56.6	Low	63.1	Low	43 Å²	43	64.9 Å²	64.9	36%	0.355	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-51.4	131.2	165.3	0	0	0	0	0	107.1	T377 D383	T377-A379 PolarHBondContact O-N 3.24Å; T377-A379 VanDerWaalsContact O-N 3.07Å; A379-D383 WeakPolarHBondContact CA-OD2 3.43Å; A379-D383 HydrophobicContact CB-CB 4.09Å
380	S	66.5	Low	64.8	Low	48 Å²	48	63.5 Å²	63.5	34%	0.336	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-58.9	152.7	176.9	84.1	0	0	0	0	108.5	P378 T382 D383	P378-S380 PolarHBondContact O-N 2.68Å; S380-T382 PolarHBondContact O-N 3.44Å; S380-T382 PolarHBondContact OG-N 3.38Å; S380-T382 PolarHBondContact OG-OG1 2.94Å; S380-D383 PolarHBondContact N-OD2 3.42Å; S380-D383 PolarHBondContact O-N 3.16Å; S380-D383 PolarHBondContact OG-N 3.39Å; S380-D383 PolarHBondContact OG-OD1 3.22Å; S380-D383 PolarHBondContact OG-OD2 2.89Å
381	G	73.8	Confident	66.9	Low	35 Å²	35	59 Å²	59	36%	0.361	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-15	175.5	0	0	0	0	0	113.3	D300 A301	D300-G381 CarbonylContact C-O 3.45Å; D300-G381 WeakPolarHBondContact CA-O 3.36Å; A301-G381 WeakPolarHBondContact CB-O 3.3Å; A301-G381 PolarHBondContact N-O 2.67Å
382	T	81.8	Confident	69.4	Low	15 Å²	15	51.8 Å²	51.8	9%	0.092	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	2.3	178.4	53.2	0	0	0	0	114.4	L299 S380	L299-T382 WeakPolarHBondContact O-CA 3.32Å; S380-T382 PolarHBondContact O-N 3.44Å; S380-T382 PolarHBondContact OG-N 3.38Å; S380-T382 PolarHBondContact OG-OG1 2.94Å
383	D	83.9	Confident	72.1	Confident	12 Å²	12	48.5 Å²	48.5	6%	0.064	29%	0.287	C	S	.	.			trans	-89.6	124.8	178.4	-60.1	-12	0	0	0	110.3	W227 Y240 Q242 A379 S380	W227-D383 VanDerWaalsContact CH2-OD1 3.24Å; W227-D383 WeakPolarHBondContact CH2-OD1 2.94Å; Y240-D383 HydrophobicContact CD1-CB 4.39Å; Q242-D383 PolarHBondContact NE2-OD1 2.83Å; A379-D383 WeakPolarHBondContact CA-OD2 3.43Å; A379-D383 HydrophobicContact CB-CB 4.09Å; S380-D383 PolarHBondContact N-OD2 3.42Å; S380-D383 PolarHBondContact O-N 3.16Å; S380-D383 PolarHBondContact OG-N 3.39Å; S380-D383 PolarHBondContact OG-OD1 3.22Å; S380-D383 PolarHBondContact OG-OD2 2.89Å
384	W	87.2	Confident	75	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.6	-178.1	-69.3	74.3	0	0	0	109.9	F214 Y240 G241 I243 L299 A301 V304 I356 F365 P367	F214-W384 HydrophobicContact CZ-CH2 4.41Å; Y240-W384 CarbonylContact C-O 3.6Å; Y240-W384 WeakPolarHBondContact CA-O 3.43Å; G241-W384 PolarHBondContact N-O 3.11Å; G241-W384 PolarHBondContact O-N 3.48Å; I243-W384 HydrophobicContact CD1-CB 4.43Å; I243-W384 HydrophobicContact CD1-CD2 3.55Å; I243-W384 HydrophobicContact CD1-CE3 3.87Å; I243-W384 HydrophobicContact CD1-CG 3.78Å; I243-W384 HydrophobicContact CD1-CZ2 4.32Å; I243-W384 HydrophobicContact CD1-CZ3 4.36Å; I243-W384 HydrophobicContact CG1-CD2 4.37Å; I243-W384 HydrophobicContact CG1-CG 4.14Å; L299-W384 HydrophobicContact CB-CZ2 3.94Å; L299-W384 PolarHBondContact O-NE1 3.08Å; A301-W384 HydrophobicContact CB-CZ2 4.24Å; V304-W384 HydrophobicContact CB-CH2 4.07Å; V304-W384 HydrophobicContact CB-CZ2 4.4Å; V304-W384 HydrophobicContact CG1-CH2 4.05Å; V304-W384 HydrophobicContact CG2-CH2 3.95Å; V304-W384 HydrophobicContact CG2-CZ2 3.96Å; I356-W384 HydrophobicContact CD1-CH2 4.36Å; F365-W384 HydrophobicContact CB-CB 4.14Å; F365-W384 HydrophobicContact CB-CE3 4.1Å; F365-W384 HydrophobicContact CD1-CB 3.73Å; F365-W384 HydrophobicContact CG-CB 4.44Å; P367-W384 HydrophobicContact CB-CE3 4.32Å; P367-W384 HydrophobicContact CB-CH2 4.41Å; P367-W384 HydrophobicContact CB-CZ3 4.04Å; P367-W384 HydrophobicContact CG-CZ3 4.26Å
385	L	86.8	Confident	77.7	Confident	68 Å²	68	44.9 Å²	44.9	36%	0.356	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	137.7	179.3	-175.9	70.1	0	0	0	110.3	Y240 V366	Y240-L385 HydrophobicContact CD1-CB 4.41Å; Y240-L385 HydrophobicContact CD1-CD1 4.24Å; Y240-L385 HydrophobicContact CE1-CB 4.22Å; Y240-L385 HydrophobicContact CE1-CD1 3.8Å; Y240-L385 HydrophobicContact CE2-CD1 4.49Å; V366-L385 PolarHBondContact N-O 2.95Å; V366-L385 PolarHBondContact O-N 3.34Å
386	L	88.4	Confident	80.2	Confident	12 Å²	12	34.8 Å²	34.8	6%	0.063	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	126	172.2	-58.4	175.1	0	0	0	110.5	L226 C228 G239 L363 F365 F388	L226-L386 HydrophobicContact CD2-CD1 3.5Å; L226-L386 HydrophobicContact CD2-CD2 3.4Å; L226-L386 VanDerWaalsContact CD2-CD2 3.4Å; L226-L386 HydrophobicContact CD2-CG 4.09Å; C228-L386 VanDerWaalsContact SG-CD1 3.56Å; G239-L386 WeakPolarHBondContact O-CB 3.14Å; G239-L386 WeakPolarHBondContact O-CG 3.31Å; G239-L386 PolarHBondContact O-N 3.22Å; L363-L386 HydrophobicContact CD1-CB 4.41Å; F365-L386 HydrophobicContact CD1-CD2 3.8Å; F365-L386 HydrophobicContact CD2-CD2 4.23Å; F365-L386 HydrophobicContact CE1-CD2 3.45Å; F365-L386 VanDerWaalsContact CE1-CD2 3.45Å; F365-L386 HydrophobicContact CE2-CD2 3.85Å; F365-L386 HydrophobicContact CG-CD2 4.2Å; F365-L386 HydrophobicContact CZ-CD2 3.46Å; F365-L386 VanDerWaalsContact CZ-CD2 3.46Å; L386-F388 HydrophobicContact CB-CE2 4.11Å
387	S	90.6	Very high	82.8	Confident	22 Å²	22	40.7 Å²	40.7	15%	0.154	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.7	175.3	-173	0	0	0	0	111.5	F211 Y364 V366 A389	F211-S387 WeakPolarHBondContact CZ-OG 3.26Å; Y364-S387 PolarHBondContact N-O 3.46Å; Y364-S387 PolarHBondContact O-N 3.48Å; V366-S387 VanDerWaalsContact CG2-CB 3.48Å; S387-A389 PolarHBondContact OG-N 2.8Å
388	F	92.4	Very high	85.3	Confident	5 Å²	5	38.6 Å²	38.6	2%	0.022	22%	0.215	C	C	.	.			trans	-98.9	11.7	174.7	-64.3	-88.3	0	0	0	112.4	L363 L386 V390 Y391 E392 H480 F482 V483 L494 V498	L363-F388 HydrophobicContact CD1-CD1 3.82Å; L363-F388 HydrophobicContact CD1-CD2 4.43Å; L363-F388 HydrophobicContact CD1-CE1 3.47Å; L363-F388 VanDerWaalsContact CD1-CE1 3.47Å; L363-F388 HydrophobicContact CD1-CE2 4.15Å; L363-F388 HydrophobicContact CD1-CG 4.28Å; L363-F388 HydrophobicContact CD1-CZ 3.66Å; L386-F388 HydrophobicContact CB-CE2 4.11Å; F388-V390 PolarHBondContact O-N 2.8Å; F388-V390 VanDerWaalsContact O-N 3.09Å; F388-Y391 AromaticContact CD1-CD2 3.98Å; F388-Y391 HydrophobicContact CD1-CD2 3.98Å; F388-Y391 CarbonylContact O-C 3.58Å; F388-Y391 WeakPolarHBondContact O-CA 3.28Å; F388-Y391 WeakPolarHBondContact O-CB 3.39Å; F388-Y391 PolarHBondContact O-N 2.99Å; F388-E392 HydrophobicContact CB-CG 4.49Å; F388-E392 WeakPolarHBondContact O-CG 3.32Å; F388-E392 PolarHBondContact O-N 3.15Å; F388-H480 AromaticContact CD2-CE1 3.3Å; F388-H480 WeakPolarHBondContact CD2-CE1 3.49Å; F388-H480 AromaticContact CD2-NE2 3.43Å; F388-H480 WeakPolarHBondContact CD2-NE2 3.41Å; F388-H480 AromaticContact CE2-CE1 3.81Å; F388-H480 AromaticContact CE2-NE2 3.91Å; F388-H480 AromaticContact CG-CE1 3.79Å; F388-F482 HydrophobicContact CB-CD2 3.7Å; F388-F482 HydrophobicContact CB-CE2 4.26Å; F388-F482 HydrophobicContact CD1-CB 3.88Å; F388-F482 HydrophobicContact CD1-CD2 4.18Å; F388-F482 HydrophobicContact CD1-CG 4.21Å; F388-F482 HydrophobicContact CE1-CB 4.18Å; F388-F482 HydrophobicContact CG-CB 4.31Å; F388-F482 HydrophobicContact CG-CD2 4.08Å; F388-V483 HydrophobicContact CE1-CG2 4.48Å; F388-V483 HydrophobicContact CE2-CG2 3.68Å; F388-V483 HydrophobicContact CZ-CG2 3.61Å; F388-L494 HydrophobicContact CD1-CD2 4.5Å; F388-V498 HydrophobicContact CE1-CG1 3.73Å; F388-V498 HydrophobicContact CE1-CG2 4.27Å; F388-V498 HydrophobicContact CZ-CG1 3.88Å; F388-V498 HydrophobicContact CZ-CG2 4.29Å
389	A	92.4	Very high	87.5	Confident	10 Å²	10	33.8 Å²	33.8	8%	0.083	18%	0.184	C	C	.	.	H	α-helix	trans	-56.1	-34.4	-171.1	0	0	0	0	0	113.6	V193 F211 S387 E392 R393	V193-A389 HydrophobicContact CB-CB 3.95Å; V193-A389 HydrophobicContact CG1-CB 4.02Å; F211-A389 HydrophobicContact CE2-CB 4.19Å; F211-A389 HydrophobicContact CZ-CB 4.4Å; S387-A389 PolarHBondContact OG-N 2.8Å; A389-E392 PolarHBondContact O-N 3.44Å; A389-R393 WeakPolarHBondContact O-CB 3.11Å; A389-R393 PolarHBondContact O-N 3.43Å
390	V	93.2	Very high	89.2	Confident	6 Å²	6	33.9 Å²	33.9	4%	0.036	19%	0.185	C	C	.	.	H	α-helix	trans	-71.3	-40.7	176.4	-175.5	0	0	0	0	111.7	I191 V193 E362 Y364 F388 R393 Q394	I191-V390 HydrophobicContact CG2-CG2 3.88Å; V193-V390 HydrophobicContact CG1-CG2 3.97Å; E362-V390 HydrophobicContact CB-CB 4.34Å; E362-V390 HydrophobicContact CB-CG1 4.07Å; E362-V390 HydrophobicContact CG-CG1 4.39Å; E362-V390 VanDerWaalsContact OE2-CG1 3.3Å; E362-V390 WeakPolarHBondContact OE2-CG1 3.27Å; Y364-V390 HydrophobicContact CD2-CB 4.48Å; Y364-V390 HydrophobicContact CD2-CG2 3.9Å; Y364-V390 HydrophobicContact CE2-CB 4.02Å; Y364-V390 HydrophobicContact CE2-CG2 3.5Å; Y364-V390 VanDerWaalsContact CE2-CG2 3.5Å; F388-V390 PolarHBondContact O-N 2.8Å; F388-V390 VanDerWaalsContact O-N 3.09Å; V390-R393 PolarHBondContact O-N 2.87Å; V390-Q394 WeakPolarHBondContact O-CB 3.26Å; V390-Q394 PolarHBondContact O-N 3.38Å
391	Y	94	Very high	90.4	Very high	6 Å²	6	39 Å²	39	2%	0.024	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-39.4	170.9	-71.5	-71.1	0	0	0	112.3	E362 L363 F388 Q394 F395 M492 L494	E362-Y391 HydrophobicContact CB-CD1 4.44Å; E362-Y391 HydrophobicContact CB-CD2 4.33Å; E362-Y391 HydrophobicContact CB-CE1 3.99Å; E362-Y391 HydrophobicContact CB-CE2 3.87Å; E362-Y391 PolarHBondContact N-OH 3.17Å; E362-Y391 WeakPolarHBondContact O-CD2 3.3Å; E362-Y391 VanDerWaalsContact O-CE2 3.26Å; E362-Y391 WeakPolarHBondContact O-CE2 3.34Å; L363-Y391 HydrophobicContact CB-CE2 3.94Å; F388-Y391 AromaticContact CD1-CD2 3.98Å; F388-Y391 HydrophobicContact CD1-CD2 3.98Å; F388-Y391 CarbonylContact O-C 3.58Å; F388-Y391 WeakPolarHBondContact O-CA 3.28Å; F388-Y391 WeakPolarHBondContact O-CB 3.39Å; F388-Y391 PolarHBondContact O-N 2.99Å; Y391-Q394 PolarHBondContact O-N 3.38Å; Y391-F395 VanDerWaalsContact O-CB 3.3Å; Y391-F395 WeakPolarHBondContact O-CB 3.16Å; Y391-F395 PolarHBondContact O-N 3.31Å; Y391-M492 HydrophobicContact CD1-CE 4.25Å; Y391-M492 VanDerWaalsContact CE1-O 3.29Å; Y391-M492 WeakPolarHBondContact CE1-O 3.35Å; Y391-M492 VanDerWaalsContact O-CE 3.32Å; Y391-M492 WeakPolarHBondContact O-CE 3.41Å; Y391-L494 HydrophobicContact CD1-CD2 3.64Å; Y391-L494 HydrophobicContact CD1-CG 4.26Å; Y391-L494 HydrophobicContact CD2-CD2 3.86Å; Y391-L494 HydrophobicContact CE1-CD2 3.71Å; Y391-L494 HydrophobicContact CE1-CG 4.19Å; Y391-L494 HydrophobicContact CE2-CD2 3.92Å; Y391-L494 HydrophobicContact CG-CD2 3.72Å
392	E	94.9	Very high	91.3	Very high	7 Å²	7	40.9 Å²	40.9	3%	0.033	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-50.6	176.9	-67.9	163.5	-167	0	0	110.9	F388 A389 Q394 F395 L396 Y435 K438 L442 F482	F388-E392 HydrophobicContact CB-CG 4.49Å; F388-E392 WeakPolarHBondContact O-CG 3.32Å; F388-E392 PolarHBondContact O-N 3.15Å; A389-E392 PolarHBondContact O-N 3.44Å; E392-Q394 VanDerWaalsContact C-N 3.32Å; E392-Q394 PolarHBondContact O-N 2.96Å; E392-F395 PolarHBondContact O-N 2.96Å; E392-L396 WeakPolarHBondContact O-CB 3.29Å; E392-L396 WeakPolarHBondContact O-CG 3.41Å; E392-L396 PolarHBondContact O-N 3.34Å; E392-Y435 WeakPolarHBondContact OE1-CE2 3.35Å; E392-Y435 PolarHBondContact OE1-OH 2.91Å; E392-Y435 VanDerWaalsContact OE1-OH 3.07Å; E392-K438 WeakPolarHBondContact OE2-CE 3.17Å; E392-K438 IonicContact OE2-NZ 2.71Å; E392-K438 PolarHBondContact OE2-NZ 3.11Å; E392-L442 HydrophobicContact CG-CD1 4.36Å; E392-F482 HydrophobicContact CB-CE2 4.35Å; E392-F482 HydrophobicContact CG-CD2 4.3Å; E392-F482 HydrophobicContact CG-CE2 3.52Å; E392-F482 HydrophobicContact CG-CZ 4.43Å
393	R	93.8	Very high	92	Very high	73 Å²	73	41.1 Å²	41.1	28%	0.275	21%	0.214	S	C	.	.	H	α-helix	trans	-58.2	-44.5	175.2	-177.2	-179.8	65.5	165.9	3.2	111.5	G192 E198 A389 V390 L396 R397	G192-R393 PolarHBondContact O-NH1 3.2Å; E198-R393 HydrophobicContact CG-CB 3.91Å; E198-R393 HydrophobicContact CG-CG 4.04Å; E198-R393 PolarHBondContact OE1-N 2.64Å; A389-R393 WeakPolarHBondContact O-CB 3.11Å; A389-R393 PolarHBondContact O-N 3.43Å; V390-R393 PolarHBondContact O-N 2.87Å; R393-L396 PolarHBondContact O-N 3.28Å; R393-R397 VanDerWaalsContact O-CB 3.24Å; R393-R397 WeakPolarHBondContact O-CB 3.47Å; R393-R397 PolarHBondContact O-N 3.43Å
394	Q	93.5	Very high	92.4	Very high	82 Å²	82	42.5 Å²	42.5	38%	0.383	22%	0.223	S	C	.	.	H	α-helix	trans	-66.4	-38.9	179	-178.1	58	20.5	0	0	112.1	V390 Y391 E392 R397 T398 M492	V390-Q394 WeakPolarHBondContact O-CB 3.26Å; V390-Q394 PolarHBondContact O-N 3.38Å; Y391-Q394 PolarHBondContact O-N 3.38Å; E392-Q394 VanDerWaalsContact C-N 3.32Å; E392-Q394 PolarHBondContact O-N 2.96Å; Q394-R397 PolarHBondContact O-N 3.16Å; Q394-T398 PolarHBondContact NE2-OG1 3.34Å; Q394-T398 WeakPolarHBondContact O-CB 3.41Å; Q394-T398 PolarHBondContact O-N 3.28Å; Q394-T398 PolarHBondContact O-OG1 2.97Å; Q394-M492 HydrophobicContact CB-CE 4.14Å; Q394-M492 HydrophobicContact CG-CE 4.11Å; Q394-M492 HydrophobicContact CG-SD 4.37Å
395	F	94.5	Very high	92.5	Very high	11 Å²	11	52.1 Å²	52.1	5%	0.048	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-49.6	175.9	178.2	-90	0	0	0	110.7	Y391 E392 R397 T398 T399 L442 L445 F481 F482 M492	Y391-F395 VanDerWaalsContact O-CB 3.3Å; Y391-F395 WeakPolarHBondContact O-CB 3.16Å; Y391-F395 PolarHBondContact O-N 3.31Å; E392-F395 PolarHBondContact O-N 2.96Å; F395-R397 VanDerWaalsContact C-N 3.33Å; F395-R397 PolarHBondContact O-N 2.89Å; F395-T398 PolarHBondContact O-N 3.06Å; F395-T399 WeakPolarHBondContact CE1-OG1 3.33Å; F395-T399 VanDerWaalsContact O-CB 3.27Å; F395-T399 WeakPolarHBondContact O-CB 3.46Å; F395-T399 PolarHBondContact O-N 3.32Å; F395-T399 PolarHBondContact O-OG1 2.88Å; F395-L442 HydrophobicContact CD1-CD2 3.39Å; F395-L442 HydrophobicContact CE1-CD2 3.65Å; F395-L442 HydrophobicContact CG-CD2 4.47Å; F395-L445 HydrophobicContact CE1-CB 4.23Å; F395-L445 HydrophobicContact CE1-CD1 4.42Å; F395-F481 HydrophobicContact CD1-CE1 4.16Å; F395-F481 HydrophobicContact CD1-CZ 4.36Å; F395-F481 AromaticContact CD2-CE1 3.86Å; F395-F481 HydrophobicContact CD2-CE1 3.86Å; F395-F481 HydrophobicContact CD2-CZ 4.11Å; F395-F481 HydrophobicContact CE1-CE1 4.14Å; F395-F481 AromaticContact CE1-CZ 3.86Å; F395-F481 HydrophobicContact CE1-CZ 3.86Å; F395-F481 AromaticContact CE2-CE1 3.85Å; F395-F481 HydrophobicContact CE2-CE1 3.85Å; F395-F481 AromaticContact CE2-CZ 3.6Å; F395-F481 HydrophobicContact CE2-CZ 3.6Å; F395-F481 HydrophobicContact CG-CE1 4.01Å; F395-F481 HydrophobicContact CG-CZ 4.46Å; F395-F481 AromaticContact CZ-CE1 3.99Å; F395-F481 HydrophobicContact CZ-CE1 3.99Å; F395-F481 HydrophobicContact CZ-CE2 4.44Å; F395-F481 AromaticContact CZ-CZ 3.46Å; F395-F481 HydrophobicContact CZ-CZ 3.46Å; F395-F481 VanDerWaalsContact CZ-CZ 3.46Å; F395-F482 HydrophobicContact CB-CZ 4.07Å; F395-M492 HydrophobicContact CB-CE 3.76Å; F395-M492 HydrophobicContact CB-SD 4.4Å
396	L	94.4	Very high	92.5	Very high	9 Å²	9	51.5 Å²	51.5	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-44.1	176.9	-73.1	173	0	0	0	111.3	E198 E392 R393 T398 T399 A400 L442 L445	E198-L396 HydrophobicContact CB-CD1 4.15Å; E198-L396 HydrophobicContact CG-CD1 4.26Å; E392-L396 WeakPolarHBondContact O-CB 3.29Å; E392-L396 WeakPolarHBondContact O-CG 3.41Å; E392-L396 PolarHBondContact O-N 3.34Å; R393-L396 PolarHBondContact O-N 3.28Å; L396-T398 PolarHBondContact O-N 3.22Å; L396-T399 PolarHBondContact O-N 3.19Å; L396-A400 WeakPolarHBondContact O-CB 3.2Å; L396-A400 PolarHBondContact O-N 3.02Å; L396-L442 HydrophobicContact CD2-CD2 3.72Å; L396-L442 HydrophobicContact CG-CD2 4Å; L396-L445 HydrophobicContact CD2-CD1 3.94Å
397	R	93	Very high	92.8	Very high	159 Å²	159	51.7 Å²	51.7	60%	0.6	28%	0.282	S	S	*	.	H	α-helix	trans	-62.3	-42.9	177.1	-174.8	-179.2	-175.8	-174	2.4	112.3	R393 Q394 F395 K401	R393-R397 VanDerWaalsContact O-CB 3.24Å; R393-R397 WeakPolarHBondContact O-CB 3.47Å; R393-R397 PolarHBondContact O-N 3.43Å; Q394-R397 PolarHBondContact O-N 3.16Å; F395-R397 VanDerWaalsContact C-N 3.33Å; F395-R397 PolarHBondContact O-N 2.89Å; R397-K401 WeakPolarHBondContact O-CG 3.46Å; R397-K401 PolarHBondContact O-N 3.48Å
398	T	93.1	Very high	93	Very high	64 Å²	64	50.8 Å²	50.8	39%	0.393	28%	0.275	S	S	.	.	H	α-helix	trans	-69.8	-41.8	179.8	-57.3	0	0	0	0	110.7	Q394 F395 L396 K401 A402	Q394-T398 PolarHBondContact NE2-OG1 3.34Å; Q394-T398 WeakPolarHBondContact O-CB 3.41Å; Q394-T398 PolarHBondContact O-N 3.28Å; Q394-T398 PolarHBondContact O-OG1 2.97Å; F395-T398 PolarHBondContact O-N 3.06Å; L396-T398 PolarHBondContact O-N 3.22Å; T398-K401 PolarHBondContact O-N 3.19Å; T398-A402 PolarHBondContact O-N 2.82Å
399	T	92.7	Very high	93.1	Very high	23 Å²	23	51.1 Å²	51.1	14%	0.141	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-47.1	177	-56.4	0	0	0	0	110.7	F395 L396 K401 A402 L403 L445	F395-T399 WeakPolarHBondContact CE1-OG1 3.33Å; F395-T399 VanDerWaalsContact O-CB 3.27Å; F395-T399 WeakPolarHBondContact O-CB 3.46Å; F395-T399 PolarHBondContact O-N 3.32Å; F395-T399 PolarHBondContact O-OG1 2.88Å; L396-T399 PolarHBondContact O-N 3.19Å; T399-K401 PolarHBondContact O-N 2.9Å; T399-K401 VanDerWaalsContact O-N 3.15Å; T399-A402 CarbonylContact O-C 3.59Å; T399-A402 WeakPolarHBondContact O-CA 3.39Å; T399-A402 WeakPolarHBondContact O-CB 3.34Å; T399-A402 PolarHBondContact O-N 2.73Å; T399-L403 HydrophobicContact CG2-CD1 4.16Å; T399-L403 HydrophobicContact CG2-CD2 4.45Å; T399-L403 HydrophobicContact CG2-CG 4.12Å; T399-L403 WeakPolarHBondContact O-CG 3.44Å; T399-L403 PolarHBondContact O-N 2.74Å; T399-L445 HydrophobicContact CG2-CB 4.34Å; T399-L445 HydrophobicContact CG2-CD1 4.33Å; T399-L445 HydrophobicContact CG2-CD2 3.9Å; T399-L445 HydrophobicContact CG2-CG 4.43Å
400	A	92.3	Very high	93.2	Very high	45 Å²	45	52 Å²	52	37%	0.372	28%	0.28	S	S	.	.	H	α-helix	trans	-57.2	-32.3	178.6	0	0	0	0	0	113.2	L396 A402	L396-A400 WeakPolarHBondContact O-CB 3.2Å; L396-A400 PolarHBondContact O-N 3.02Å; A400-A402 VanDerWaalsContact C-N 3.33Å
401	K	92.8	Very high	93.2	Very high	155 Å²	155	52.7 Å²	52.7	67%	0.674	29%	0.285	S	S	*	.	H	α-helix	trans	-70.2	-27.6	173.8	-69.1	173.1	-178.7	-180	0	113.5	R397 T398 T399	R397-K401 WeakPolarHBondContact O-CG 3.46Å; R397-K401 PolarHBondContact O-N 3.48Å; T398-K401 PolarHBondContact O-N 3.19Å; T399-K401 PolarHBondContact O-N 2.9Å; T399-K401 VanDerWaalsContact O-N 3.15Å
402	A	92.5	Very high	93.3	Very high	74 Å²	74	52.4 Å²	52.4	61%	0.612	28%	0.284	S	S	*	.	H	α-helix	trans	-88.6	-17.3	178.6	0	0	0	0	0	112.9	T398 T399 A400 A450	T398-A402 PolarHBondContact O-N 2.82Å; T399-A402 CarbonylContact O-C 3.59Å; T399-A402 WeakPolarHBondContact O-CA 3.39Å; T399-A402 WeakPolarHBondContact O-CB 3.34Å; T399-A402 PolarHBondContact O-N 2.73Å; A400-A402 VanDerWaalsContact C-N 3.33Å; A402-A450 WeakPolarHBondContact O-CB 3.49Å
403	L	94.9	Very high	93.3	Very high	20 Å²	20	52 Å²	52	11%	0.105	28%	0.282	C	S	.	.	S	Bend	trans	-79.2	156.9	179.5	-67.9	-176.7	0	0	0	112.3	T399 A407 H409 L445 A450 W453	T399-L403 HydrophobicContact CG2-CD1 4.16Å; T399-L403 HydrophobicContact CG2-CD2 4.45Å; T399-L403 HydrophobicContact CG2-CG 4.12Å; T399-L403 WeakPolarHBondContact O-CG 3.44Å; T399-L403 PolarHBondContact O-N 2.74Å; L403-A407 HydrophobicContact CB-CB 3.73Å; L403-A407 HydrophobicContact CD1-CB 3.9Å; L403-A407 HydrophobicContact CG-CB 4.41Å; L403-H409 HydrophobicContact CD1-CB 4.19Å; L403-L445 HydrophobicContact CD1-CD2 4.12Å; L403-A450 HydrophobicContact CD2-CB 3.86Å; L403-W453 HydrophobicContact CD1-CB 4.28Å; L403-W453 HydrophobicContact CD1-CG 4.44Å; L403-W453 HydrophobicContact CD2-CB 3.9Å; L403-W453 HydrophobicContact CD2-CG 3.92Å
404	P	92.6	Very high	93.3	Very high	42 Å²	42	48.9 Å²	48.9	27%	0.273	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-58.1	153.4	172.1	-23.1	33.4	0	0	0	112.7	G406 A407 A450 K454	P404-G406 PolarHBondContact O-N 3.01Å; P404-A407 VanDerWaalsContact O-CB 3.28Å; P404-A407 WeakPolarHBondContact O-CB 3.48Å; P404-A407 PolarHBondContact O-N 3.39Å; P404-A407 VanDerWaalsContact O-N 3.12Å; P404-A450 WeakPolarHBondContact CD-O 3.32Å; P404-K454 HydrophobicContact CB-CG 4.32Å; P404-K454 HydrophobicContact CG-CG 4.11Å
405	E	89.7	Confident	93.3	Very high	201 Å²	201	45 Å²	45	94%	0.939	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	134	173.3	-167.1	174.3	-172.5	0	0	110.8
406	G	87.8	Confident	93.4	Very high	55 Å²	55	44.4 Å²	44.4	57%	0.567	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	25.5	-175.1	0	0	0	0	0	114.6	P404 C408 A455	P404-G406 PolarHBondContact O-N 3.01Å; G406-C408 PolarHBondContact O-N 2.83Å; G406-A455 WeakPolarHBondContact O-CA 3.43Å; G406-A455 VanDerWaalsContact O-CB 3.29Å; G406-A455 WeakPolarHBondContact O-CB 3.24Å; G406-A455 PolarHBondContact O-N 2.89Å
407	A	94.1	Very high	93.3	Very high	16 Å²	16	44.2 Å²	44.2	13%	0.132	25%	0.249	C	C	.	.			trans	-58.3	137.4	-179.1	0	0	0	0	0	113.9	L403 P404 H409 W453	L403-A407 HydrophobicContact CB-CB 3.73Å; L403-A407 HydrophobicContact CD1-CB 3.9Å; L403-A407 HydrophobicContact CG-CB 4.41Å; P404-A407 VanDerWaalsContact O-CB 3.28Å; P404-A407 WeakPolarHBondContact O-CB 3.48Å; P404-A407 PolarHBondContact O-N 3.39Å; P404-A407 VanDerWaalsContact O-N 3.12Å; A407-H409 VanDerWaalsContact C-N 3.34Å; A407-H409 PolarHBondContact O-N 2.93Å; A407-H409 PolarHBondContact O-ND1 2.88Å; A407-W453 CarbonylContact C-O 3.43Å; A407-W453 WeakPolarHBondContact CA-O 3.34Å; A407-W453 HydrophobicContact CB-CB 4.3Å; A407-W453 VanDerWaalsContact CB-O 3.29Å; A407-W453 WeakPolarHBondContact CB-O 3.13Å
408	C	94.2	Very high	93.3	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.02	22%	0.223	C	C	.	.	S	Bend	trans	-81.8	-3.6	-170.4	67.6	0	0	0	0	115.2	G406 L410 S411 C412 W453 L458	G406-C408 PolarHBondContact O-N 2.83Å; C408-L410 PolarHBondContact O-N 3Å; C408-S411 WeakPolarHBondContact O-CA 3.26Å; C408-S411 WeakPolarHBondContact O-CB 3.17Å; C408-S411 PolarHBondContact O-N 3.29Å; C408-C412 PolarHBondContact O-N 2.83Å; C408-C412 PolarHBondContact O-SG 3.35Å; C408-W453 PolarHBondContact N-O 2.63Å; C408-L458 HydrophobicContact CB-CB 4.06Å; C408-L458 HydrophobicContact CB-CD1 3.86Å
409	H	95	Very high	93.3	Very high	12 Å²	12	34.1 Å²	34.1	6%	0.056	20%	0.204	C	C	.	.	H	α-helix	trans	-51.3	-51.6	-174.5	64.3	-55.9	0	0	0	114.9	L403 A407 C412 L413 L441 L445 W453	L403-H409 HydrophobicContact CD1-CB 4.19Å; A407-H409 VanDerWaalsContact C-N 3.34Å; A407-H409 PolarHBondContact O-N 2.93Å; A407-H409 PolarHBondContact O-ND1 2.88Å; H409-C412 WeakPolarHBondContact O-CB 3.49Å; H409-C412 PolarHBondContact O-N 3.35Å; H409-L413 PolarHBondContact O-N 3.1Å; H409-L441 HydrophobicContact CB-CD1 4.5Å; H409-L445 HydrophobicContact CB-CD2 3.94Å; H409-W453 HydrophobicContact CB-CD2 4.2Å; H409-W453 HydrophobicContact CB-CE3 3.51Å; H409-W453 HydrophobicContact CB-CZ3 3.78Å
410	L	94.3	Very high	93.3	Very high	30 Å²	30	33.5 Å²	33.5	16%	0.157	20%	0.2	C	C	.	.	H	α-helix	trans	-68.9	-35.5	177.1	-61.7	-176.6	0	0	0	111.5	N199 W200 C408 C412 L413 Q414	N199-L410 HydrophobicContact CB-CD1 4.24Å; W200-L410 HydrophobicContact CB-CD2 4.33Å; C408-L410 PolarHBondContact O-N 3Å; L410-C412 VanDerWaalsContact C-N 3.31Å; L410-C412 PolarHBondContact O-N 3.48Å; L410-L413 PolarHBondContact O-N 3.15Å; L410-Q414 WeakPolarHBondContact O-CB 3.24Å; L410-Q414 WeakPolarHBondContact O-CG 3.39Å; L410-Q414 PolarHBondContact O-N 3.02Å; L410-Q414 PolarHBondContact O-OE1 3.44Å
411	S	93.6	Very high	93.2	Very high	19 Å²	19	31.8 Å²	31.8	13%	0.133	19%	0.185	C	C	.	.	H	α-helix	trans	-60.4	-40.6	175	-50	0	0	0	0	111.8	Y146 C408 Q414 I415	Y146-S411 WeakPolarHBondContact CE2-OG 3.34Å; C408-S411 WeakPolarHBondContact O-CA 3.26Å; C408-S411 WeakPolarHBondContact O-CB 3.17Å; C408-S411 PolarHBondContact O-N 3.29Å; S411-Q414 PolarHBondContact O-N 3.5Å; S411-I415 WeakPolarHBondContact O-CD1 3.46Å; S411-I415 VanDerWaalsContact O-CG1 3.24Å; S411-I415 WeakPolarHBondContact O-CG1 3.32Å; S411-I415 PolarHBondContact O-N 3.35Å
412	C	94.9	Very high	93.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.9	-47.7	173.7	-63.1	0	0	0	0	111.5	C408 H409 L410 I415 A416 R461 L462 L465	C408-C412 PolarHBondContact O-N 2.83Å; C408-C412 PolarHBondContact O-SG 3.35Å; H409-C412 WeakPolarHBondContact O-CB 3.49Å; H409-C412 PolarHBondContact O-N 3.35Å; L410-C412 VanDerWaalsContact C-N 3.31Å; L410-C412 PolarHBondContact O-N 3.48Å; C412-I415 PolarHBondContact O-N 3.29Å; C412-A416 WeakPolarHBondContact O-CB 3.35Å; C412-A416 PolarHBondContact O-N 3.4Å; C412-R461 VanDerWaalsContact SG-CB 3.59Å; C412-L462 HydrophobicContact CB-CD1 4.39Å; C412-L462 WeakPolarHBondContact O-CD1 3.41Å; C412-L465 HydrophobicContact CB-CD2 4.49Å
413	L	95.6	Very high	93	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.5	-42.9	177.9	-178.6	58.7	0	0	0	111.8	W200 H409 L410 I415 A416 S417 L437 K438 L441	W200-L413 HydrophobicContact CB-CD2 4.08Å; W200-L413 HydrophobicContact CB-CG 4.46Å; W200-L413 HydrophobicContact CD2-CD2 3.47Å; W200-L413 VanDerWaalsContact CD2-CD2 3.47Å; W200-L413 HydrophobicContact CD2-CG 4.01Å; W200-L413 HydrophobicContact CE3-CD2 3.83Å; W200-L413 HydrophobicContact CE3-CG 3.86Å; W200-L413 HydrophobicContact CG-CD2 3.56Å; W200-L413 HydrophobicContact CG-CG 4.27Å; H409-L413 PolarHBondContact O-N 3.1Å; L410-L413 PolarHBondContact O-N 3.15Å; L413-I415 PolarHBondContact O-N 2.75Å; L413-A416 PolarHBondContact O-N 2.89Å; L413-S417 VanDerWaalsContact O-CB 3.31Å; L413-S417 WeakPolarHBondContact O-CB 3.41Å; L413-S417 PolarHBondContact O-N 2.81Å; L413-S417 PolarHBondContact O-OG 2.74Å; L413-L437 HydrophobicContact CD1-CB 3.8Å; L413-K438 HydrophobicContact CD1-CB 4.43Å; L413-K438 HydrophobicContact CD2-CB 4.41Å; L413-K438 HydrophobicContact CD2-CG 4.46Å; L413-L441 HydrophobicContact CB-CD2 3.82Å; L413-L441 HydrophobicContact CD2-CD2 4.03Å; L413-L441 HydrophobicContact CG-CD2 4.45Å
414	Q	94.4	Very high	92.7	Very high	6 Å²	6	23.8 Å²	23.8	3%	0.028	14%	0.14	C	C	.	.	H	α-helix	trans	-62.5	-44.4	179.2	-72	174.8	-60.9	0	0	111.8	Y146 I150 W200 H201 V202 L410 S411 F418	Y146-Q414 HydrophobicContact CE2-CB 4.36Å; Y146-Q414 PolarHBondContact OH-OE1 3.48Å; I150-Q414 HydrophobicContact CD1-CB 4.05Å; I150-Q414 HydrophobicContact CG2-CB 4.02Å; I150-Q414 HydrophobicContact CG2-CG 4.34Å; W200-Q414 HydrophobicContact CB-CG 3.83Å; W200-Q414 WeakPolarHBondContact O-CG 3.41Å; H201-Q414 PolarHBondContact O-NE2 2.83Å; V202-Q414 HydrophobicContact CG2-CB 3.7Å; V202-Q414 HydrophobicContact CG2-CG 3.85Å; V202-Q414 WeakPolarHBondContact CG2-O 3.5Å; L410-Q414 WeakPolarHBondContact O-CB 3.24Å; L410-Q414 WeakPolarHBondContact O-CG 3.39Å; L410-Q414 PolarHBondContact O-N 3.02Å; L410-Q414 PolarHBondContact O-OE1 3.44Å; S411-Q414 PolarHBondContact O-N 3.5Å; Q414-F418 WeakPolarHBondContact O-CB 3.13Å; Q414-F418 PolarHBondContact O-N 3.44Å
415	I	93.8	Very high	92.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-45.6	176.4	-65.3	164.6	0	0	0	110.4	L142 F145 I150 S411 C412 L413 F418 L419 L458 L462	L142-I415 HydrophobicContact CD2-CD1 4.45Å; F145-I415 HydrophobicContact CD1-CG1 4.23Å; F145-I415 HydrophobicContact CE1-CG1 4.12Å; F145-I415 HydrophobicContact CE1-CG2 4.42Å; I150-I415 HydrophobicContact CD1-CG1 3.71Å; S411-I415 WeakPolarHBondContact O-CD1 3.46Å; S411-I415 VanDerWaalsContact O-CG1 3.24Å; S411-I415 WeakPolarHBondContact O-CG1 3.32Å; S411-I415 PolarHBondContact O-N 3.35Å; C412-I415 PolarHBondContact O-N 3.29Å; L413-I415 PolarHBondContact O-N 2.75Å; I415-F418 WeakPolarHBondContact O-CB 3.41Å; I415-F418 PolarHBondContact O-N 2.92Å; I415-L419 HydrophobicContact CG2-CD1 4.02Å; I415-L419 VanDerWaalsContact O-CG 3.31Å; I415-L419 WeakPolarHBondContact O-CG 3.18Å; I415-L419 PolarHBondContact O-N 2.98Å; I415-L458 HydrophobicContact CD1-CD1 4.16Å; I415-L458 HydrophobicContact CD1-CD2 4.34Å; I415-L462 HydrophobicContact CB-CD1 4.29Å; I415-L462 HydrophobicContact CB-CD2 4.38Å; I415-L462 HydrophobicContact CD1-CD2 4.46Å; I415-L462 HydrophobicContact CG2-CD1 4.22Å; I415-L462 HydrophobicContact CG2-CD2 3.72Å
416	A	94.7	Very high	92.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.9	-44.1	179	0	0	0	0	0	112.4	C412 L413 L419 L420 L437 L462 L465 F466	C412-A416 WeakPolarHBondContact O-CB 3.35Å; C412-A416 PolarHBondContact O-N 3.4Å; L413-A416 PolarHBondContact O-N 2.89Å; A416-L419 PolarHBondContact O-N 3.19Å; A416-L420 WeakPolarHBondContact O-CB 3.27Å; A416-L420 PolarHBondContact O-N 3.39Å; A416-L437 HydrophobicContact CB-CD1 3.93Å; A416-L437 HydrophobicContact CB-CD2 4.25Å; A416-L462 HydrophobicContact CB-CD1 4.38Å; A416-L465 HydrophobicContact CB-CD2 3.79Å; A416-F466 HydrophobicContact CB-CE1 3.89Å; A416-F466 HydrophobicContact CB-CZ 3.92Å
417	S	93.8	Very high	92.3	Very high	4 Å²	4	26.5 Å²	26.5	3%	0.028	14%	0.135	C	C	.	.	H	α-helix	trans	-64	-39.3	176.2	-76.1	0	0	0	0	112.4	L413 S421 N434	L413-S417 VanDerWaalsContact O-CB 3.31Å; L413-S417 WeakPolarHBondContact O-CB 3.41Å; L413-S417 PolarHBondContact O-N 2.81Å; L413-S417 PolarHBondContact O-OG 2.74Å; S417-S421 WeakPolarHBondContact O-CB 3.46Å; S417-S421 PolarHBondContact O-N 2.88Å; S417-N434 VanDerWaalsContact CB-OD1 3.27Å; S417-N434 WeakPolarHBondContact CB-OD1 3.28Å; S417-N434 PolarHBondContact OG-OD1 2.84Å
418	F	92.6	Very high	91.9	Very high	12 Å²	12	27 Å²	27	5%	0.053	14%	0.142	C	C	.	.	H	α-helix	trans	-59.3	-50.1	172.9	-180	-93.1	0	0	0	111.5	F145 V202 Q414 I415 L420 S421 K422 Y538	F145-F418 HydrophobicContact CE1-CD1 4.38Å; F145-F418 HydrophobicContact CE2-CD1 4.35Å; F145-F418 AromaticContact CE2-CE1 3.92Å; F145-F418 HydrophobicContact CE2-CE1 3.92Å; F145-F418 HydrophobicContact CE2-CZ 4.14Å; F145-F418 AromaticContact CZ-CD1 3.54Å; F145-F418 HydrophobicContact CZ-CD1 3.54Å; F145-F418 HydrophobicContact CZ-CD2 4.38Å; F145-F418 AromaticContact CZ-CE1 3.56Å; F145-F418 HydrophobicContact CZ-CE1 3.56Å; F145-F418 HydrophobicContact CZ-CE2 4.39Å; F145-F418 AromaticContact CZ-CG 3.95Å; F145-F418 HydrophobicContact CZ-CG 3.95Å; F145-F418 AromaticContact CZ-CZ 3.99Å; F145-F418 HydrophobicContact CZ-CZ 3.99Å; V202-F418 HydrophobicContact CG1-CB 3.81Å; V202-F418 HydrophobicContact CG1-CD2 3.96Å; V202-F418 HydrophobicContact CG1-CG 4.37Å; Q414-F418 WeakPolarHBondContact O-CB 3.13Å; Q414-F418 PolarHBondContact O-N 3.44Å; I415-F418 WeakPolarHBondContact O-CB 3.41Å; I415-F418 PolarHBondContact O-N 2.92Å; F418-L420 PolarHBondContact O-N 3.36Å; F418-S421 WeakPolarHBondContact O-CB 3.32Å; F418-S421 PolarHBondContact O-N 3.18Å; F418-K422 HydrophobicContact CD1-CG 4.06Å; F418-K422 HydrophobicContact CE1-CG 3.72Å; F418-K422 VanDerWaalsContact CE2-CE 3.44Å; F418-K422 HydrophobicContact CE2-CG 4.3Å; F418-K422 HydrophobicContact CG-CG 4.5Å; F418-K422 HydrophobicContact CZ-CD 4.25Å; F418-K422 VanDerWaalsContact CZ-CE 3.41Å; F418-K422 HydrophobicContact CZ-CG 3.87Å; F418-K422 WeakPolarHBondContact O-CG 3.33Å; F418-K422 PolarHBondContact O-N 3.43Å; F418-Y538 HydrophobicContact CE1-CD2 4.46Å; F418-Y538 HydrophobicContact CE1-CG 4.4Å; F418-Y538 AromaticContact CZ-CD1 3.76Å; F418-Y538 HydrophobicContact CZ-CD1 3.76Å; F418-Y538 HydrophobicContact CZ-CD2 4.19Å; F418-Y538 HydrophobicContact CZ-CE1 4.03Å; F418-Y538 HydrophobicContact CZ-CE2 4.45Å; F418-Y538 AromaticContact CZ-CG 3.83Å; F418-Y538 HydrophobicContact CZ-CG 3.83Å
419	L	92.5	Very high	91.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.7	-45.2	-178.7	-70.7	171.2	0	0	0	111.3	I415 A416 S421 K422 Q423 F466 M527 A531 L534 I535	I415-L419 HydrophobicContact CG2-CD1 4.02Å; I415-L419 VanDerWaalsContact O-CG 3.31Å; I415-L419 WeakPolarHBondContact O-CG 3.18Å; I415-L419 PolarHBondContact O-N 2.98Å; A416-L419 PolarHBondContact O-N 3.19Å; L419-S421 VanDerWaalsContact C-N 3.33Å; L419-S421 PolarHBondContact O-N 2.87Å; L419-K422 PolarHBondContact O-N 3.16Å; L419-Q423 WeakPolarHBondContact O-CB 3.38Å; L419-Q423 PolarHBondContact O-N 3.32Å; L419-F466 HydrophobicContact CD1-CE2 4.37Å; L419-F466 HydrophobicContact CD1-CZ 3.91Å; L419-M527 HydrophobicContact CB-CG 3.95Å; L419-M527 HydrophobicContact CB-SD 3.92Å; L419-A531 HydrophobicContact CD1-CB 3.84Å; L419-A531 HydrophobicContact CD2-CB 3.89Å; L419-L534 HydrophobicContact CD2-CB 4.22Å; L419-L534 HydrophobicContact CD2-CD1 4.17Å; L419-I535 HydrophobicContact CD1-CD1 4.38Å; L419-I535 HydrophobicContact CD2-CD1 4.5Å; L419-I535 HydrophobicContact CD2-CG1 4.29Å
420	L	92.9	Very high	90.9	Very high	9 Å²	9	33.3 Å²	33.3	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-42.7	177.5	179.9	63	0	0	0	111.8	A416 F418 Q423 S424 L432 L437 M527	A416-L420 WeakPolarHBondContact O-CB 3.27Å; A416-L420 PolarHBondContact O-N 3.39Å; F418-L420 PolarHBondContact O-N 3.36Å; L420-Q423 PolarHBondContact O-N 2.85Å; L420-S424 WeakPolarHBondContact O-CB 3.22Å; L420-S424 PolarHBondContact O-N 3.13Å; L420-S424 PolarHBondContact O-OG 3.05Å; L420-L432 HydrophobicContact CD1-CB 3.93Å; L420-L432 HydrophobicContact CD2-CB 4.33Å; L420-L437 HydrophobicContact CB-CD1 4.03Å; L420-L437 HydrophobicContact CD2-CD1 3.68Å; L420-L437 HydrophobicContact CD2-CG 4.14Å; L420-M527 VanDerWaalsContact CA-SD 3.6Å; L420-M527 HydrophobicContact CB-SD 4.07Å; L420-M527 HydrophobicContact CD1-SD 4.42Å; L420-M527 PolarHBondContact N-SD 3.04Å
421	S	91	Very high	90.5	Very high	10 Å²	10	32.8 Å²	32.8	7%	0.07	19%	0.186	C	C	.	.	H	α-helix	trans	-61.1	-48.2	175.7	176.9	0	0	0	0	112.7	E203 S417 F418 L419 Q423 S424 R425	E203-S421 WeakPolarHBondContact OE1-CB 3.38Å; E203-S421 PolarHBondContact OE1-OG 3.24Å; E203-S421 PolarHBondContact OE2-OG 3.27Å; E203-S421 VanDerWaalsContact OE2-OG 3.09Å; S417-S421 WeakPolarHBondContact O-CB 3.46Å; S417-S421 PolarHBondContact O-N 2.88Å; F418-S421 WeakPolarHBondContact O-CB 3.32Å; F418-S421 PolarHBondContact O-N 3.18Å; L419-S421 VanDerWaalsContact C-N 3.33Å; L419-S421 PolarHBondContact O-N 2.87Å; S421-Q423 VanDerWaalsContact C-N 3.35Å; S421-S424 PolarHBondContact O-N 3.43Å; S421-R425 WeakPolarHBondContact O-CG 3.33Å; S421-R425 PolarHBondContact O-N 2.8Å
422	K	90.5	Very high	90.4	Very high	46 Å²	46	32.4 Å²	32.4	20%	0.2	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-43	179.6	-67	-60.6	-179.7	170.8	0	111	F418 L419 S424 R425 L426 L534 Y538	F418-K422 HydrophobicContact CD1-CG 4.06Å; F418-K422 HydrophobicContact CE1-CG 3.72Å; F418-K422 VanDerWaalsContact CE2-CE 3.44Å; F418-K422 HydrophobicContact CE2-CG 4.3Å; F418-K422 HydrophobicContact CG-CG 4.5Å; F418-K422 HydrophobicContact CZ-CD 4.25Å; F418-K422 VanDerWaalsContact CZ-CE 3.41Å; F418-K422 HydrophobicContact CZ-CG 3.87Å; F418-K422 WeakPolarHBondContact O-CG 3.33Å; F418-K422 PolarHBondContact O-N 3.43Å; L419-K422 PolarHBondContact O-N 3.16Å; K422-S424 VanDerWaalsContact C-N 3.35Å; K422-S424 PolarHBondContact O-N 3.4Å; K422-R425 PolarHBondContact O-N 2.87Å; K422-L426 VanDerWaalsContact O-CG 3.31Å; K422-L426 WeakPolarHBondContact O-CG 3.21Å; K422-L426 PolarHBondContact O-N 2.89Å; K422-L426 VanDerWaalsContact O-N 3.13Å; K422-L534 HydrophobicContact CB-CD1 4.28Å; K422-Y538 PolarHBondContact NZ-OH 3.37Å
423	Q	90.3	Very high	90.2	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-60.3	-45.9	174	-173.5	67.6	23.1	0	0	111.2	L419 L420 S421 R425 L426 T427 E526 M527 N530	L419-Q423 WeakPolarHBondContact O-CB 3.38Å; L419-Q423 PolarHBondContact O-N 3.32Å; L420-Q423 PolarHBondContact O-N 2.85Å; S421-Q423 VanDerWaalsContact C-N 3.35Å; Q423-R425 PolarHBondContact O-N 3.48Å; Q423-L426 PolarHBondContact O-N 3.43Å; Q423-T427 PolarHBondContact NE2-OG1 3.1Å; Q423-T427 PolarHBondContact O-N 3.26Å; Q423-T427 PolarHBondContact O-OG1 3.48Å; Q423-T427 VanDerWaalsContact O-OG1 3.09Å; Q423-E526 PolarHBondContact NE2-OE2 2.94Å; Q423-M527 HydrophobicContact CB-CB 3.97Å; Q423-M527 HydrophobicContact CB-CG 4.04Å; Q423-M527 HydrophobicContact CG-CB 3.87Å; Q423-M527 HydrophobicContact CG-CG 4.49Å; Q423-N530 PolarHBondContact OE1-ND2 3.45Å
424	S	88.8	Confident	90.1	Very high	34 Å²	34	36.2 Å²	36.2	24%	0.238	21%	0.205	C	C	.	.	H	α-helix	trans	-61.7	-29.5	179.7	-59.5	0	0	0	0	112.9	L420 S421 K422 G428	L420-S424 WeakPolarHBondContact O-CB 3.22Å; L420-S424 PolarHBondContact O-N 3.13Å; L420-S424 PolarHBondContact O-OG 3.05Å; S421-S424 PolarHBondContact O-N 3.43Å; K422-S424 VanDerWaalsContact C-N 3.35Å; K422-S424 PolarHBondContact O-N 3.4Å; S424-G428 WeakPolarHBondContact CA-O 3.35Å; S424-G428 CarbonylContact O-C 3.47Å; S424-G428 WeakPolarHBondContact O-CA 3.38Å; S424-G428 PolarHBondContact O-N 2.98Å; S424-G428 VanDerWaalsContact O-O 3.14Å
425	R	89.1	Confident	89.9	Confident	166 Å²	166	39.4 Å²	39.4	63%	0.626	22%	0.217	S	C	*	.	H	α-helix	trans	-76	-27.5	173.3	-69.7	171.3	-176	-103.9	3.2	113.2	E203 S421 K422 Q423	E203-R425 IonicContact OE2-CZ 3.44Å; E203-R425 IonicContact OE2-NE 3.38Å; E203-R425 IonicContact OE2-NH2 3.95Å; E203-R425 PolarHBondContact OE2-NH2 3.09Å; S421-R425 WeakPolarHBondContact O-CG 3.33Å; S421-R425 PolarHBondContact O-N 2.8Å; K422-R425 PolarHBondContact O-N 2.87Å; Q423-R425 PolarHBondContact O-N 3.48Å
426	L	87.4	Confident	90	Very high	116 Å²	116	40.5 Å²	40.5	61%	0.607	22%	0.223	S	C	*	.	H	α-helix	trans	-83.9	-45.7	-179.6	-69.2	170.7	0	0	0	112.1	K422 Q423	K422-L426 VanDerWaalsContact O-CG 3.31Å; K422-L426 WeakPolarHBondContact O-CG 3.21Å; K422-L426 PolarHBondContact O-N 2.89Å; K422-L426 VanDerWaalsContact O-N 3.13Å; Q423-L426 PolarHBondContact O-N 3.43Å
427	T	85.7	Confident	90.1	Very high	72 Å²	72	40.6 Å²	40.6	44%	0.442	22%	0.223	S	C	.	.	H	α-helix	trans	-108.8	-2.2	-173	56.6	0	0	0	0	114.1	Q423 E526	Q423-T427 PolarHBondContact NE2-OG1 3.1Å; Q423-T427 PolarHBondContact O-N 3.26Å; Q423-T427 PolarHBondContact O-OG1 3.48Å; Q423-T427 VanDerWaalsContact O-OG1 3.09Å; T427-E526 WeakPolarHBondContact CG2-OE2 3.07Å
428	G	84.9	Confident	90.2	Very high	26 Å²	26	40.7 Å²	40.7	27%	0.268	22%	0.223	S	C	.	.			trans	89.1	176	-171.9	0	0	0	0	0	112.7	S424 S430	S424-G428 WeakPolarHBondContact CA-O 3.35Å; S424-G428 CarbonylContact O-C 3.47Å; S424-G428 WeakPolarHBondContact O-CA 3.38Å; S424-G428 PolarHBondContact O-N 2.98Å; S424-G428 VanDerWaalsContact O-O 3.14Å; G428-S430 PolarHBondContact O-N 2.79Å
429	P	82.1	Confident	90.4	Very high	126 Å²	126	40.1 Å²	40.1	82%	0.818	22%	0.22	S	C	*	.			trans	-63.2	129.8	-175.8	26.6	-33.9	0	0	0	111.1
430	S	85.5	Confident	90.6	Very high	22 Å²	22	40.1 Å²	40.1	15%	0.154	22%	0.22	C	C	.	.			trans	-92.8	169.1	171.5	81.1	0	0	0	0	110.8	G428 L432	G428-S430 PolarHBondContact O-N 2.79Å; S430-L432 PolarHBondContact O-N 3.28Å; S430-L432 WeakPolarHBondContact OG-CB 3.4Å; S430-L432 PolarHBondContact OG-N 3.24Å; S430-L432 PolarHBondContact OG-O 3.38Å
431	G	85.9	Confident	90.8	Very high	19 Å²	19	39.7 Å²	39.7	20%	0.196	22%	0.218	C	C	.	.	S	Bend	trans	-71.9	-8.1	168.2	0	0	0	0	0	114	H436 T520	G431-H436 PolarHBondContact O-CE1 3.29Å; G431-T520 VanDerWaalsContact CA-OG1 3.28Å; G431-T520 WeakPolarHBondContact CA-OG1 3.44Å; G431-T520 PolarHBondContact N-OG1 3.3Å
432	L	91.8	Very high	91.1	Very high	11 Å²	11	39.3 Å²	39.3	6%	0.058	22%	0.215	C	C	.	.			trans	-86.8	145.8	173.2	-71.1	172.3	0	0	0	111	L420 S430 H436 L469 L473 F507 T520 F524	L420-L432 HydrophobicContact CD1-CB 3.93Å; L420-L432 HydrophobicContact CD2-CB 4.33Å; S430-L432 PolarHBondContact O-N 3.28Å; S430-L432 WeakPolarHBondContact OG-CB 3.4Å; S430-L432 PolarHBondContact OG-N 3.24Å; S430-L432 PolarHBondContact OG-O 3.38Å; L432-H436 HydrophobicContact CD2-CB 4.17Å; L432-L469 HydrophobicContact CD1-CD2 3.97Å; L432-L469 HydrophobicContact CD2-CD1 4.11Å; L432-L469 HydrophobicContact CD2-CD2 4.23Å; L432-L469 HydrophobicContact CD2-CG 4.44Å; L432-L473 HydrophobicContact CD1-CD1 4.27Å; L432-L473 HydrophobicContact CD2-CD2 4.19Å; L432-F507 HydrophobicContact CD2-CE1 4Å; L432-F507 HydrophobicContact CD2-CZ 3.74Å; L432-T520 HydrophobicContact CB-CG2 4.4Å; L432-T520 HydrophobicContact CD1-CG2 4.19Å; L432-T520 HydrophobicContact CD2-CG2 4.44Å; L432-T520 HydrophobicContact CG-CG2 3.61Å; L432-F524 HydrophobicContact CD1-CB 4.05Å; L432-F524 HydrophobicContact CD1-CD2 3.9Å; L432-F524 HydrophobicContact CD1-CG 4.32Å
433	S	91.5	Very high	91.4	Very high	25 Å²	25	38.7 Å²	38.7	18%	0.175	21%	0.213	C	C	.	.			trans	-136.4	165.7	-179.2	73.8	0	0	0	0	109.2	Y435 H436 L437	S433-Y435 PolarHBondContact O-N 3.46Å; S433-Y435 PolarHBondContact OG-N 2.99Å; S433-H436 PolarHBondContact N-ND1 3.43Å; S433-H436 VanDerWaalsContact N-ND1 3.11Å; S433-H436 WeakPolarHBondContact O-CB 3.28Å; S433-H436 PolarHBondContact O-N 2.84Å; S433-H436 VanDerWaalsContact O-N 3.07Å; S433-H436 PolarHBondContact OG-ND1 3.37Å; S433-L437 PolarHBondContact O-N 2.89Å
434	N	91.9	Very high	91.6	Very high	56 Å²	56	39 Å²	39	30%	0.299	22%	0.215	S	C	.	.	H	α-helix	trans	-59.8	-28.4	174.8	-71	-38.2	0	0	0	112.1	W200 S417 H436 L437 K438	W200-N434 HydrophobicContact CH2-CB 3.92Å; W200-N434 HydrophobicContact CZ3-CB 4.04Å; S417-N434 VanDerWaalsContact CB-OD1 3.27Å; S417-N434 WeakPolarHBondContact CB-OD1 3.28Å; S417-N434 PolarHBondContact OG-OD1 2.84Å; N434-H436 VanDerWaalsContact C-N 3.34Å; N434-H436 PolarHBondContact O-N 3.34Å; N434-L437 PolarHBondContact O-N 3.46Å; N434-K438 WeakPolarHBondContact O-CB 3.21Å; N434-K438 PolarHBondContact O-N 2.83Å
435	Y	92.2	Very high	92	Very high	72 Å²	72	38 Å²	38	28%	0.282	21%	0.207	S	C	.	.	H	α-helix	trans	-65.2	-37.1	175.6	-169.2	-110.1	0	0	0	112.4	E392 S433 K438 T439 H480 L506	E392-Y435 WeakPolarHBondContact OE1-CE2 3.35Å; E392-Y435 PolarHBondContact OE1-OH 2.91Å; E392-Y435 VanDerWaalsContact OE1-OH 3.07Å; S433-Y435 PolarHBondContact O-N 3.46Å; S433-Y435 PolarHBondContact OG-N 2.99Å; Y435-K438 PolarHBondContact O-N 3.31Å; Y435-T439 WeakPolarHBondContact O-CB 3.49Å; Y435-T439 PolarHBondContact O-N 3.15Å; Y435-T439 PolarHBondContact O-OG1 2.78Å; Y435-H480 AromaticContact CZ-NE2 3.99Å; Y435-H480 PolarHBondContact OH-CD2 3.11Å; Y435-H480 PolarHBondContact OH-CE1 2.92Å; Y435-H480 PolarHBondContact OH-NE2 2.76Å; Y435-L506 HydrophobicContact CD1-CD1 4.18Å; Y435-L506 HydrophobicContact CE1-CD1 3.91Å; Y435-L506 HydrophobicContact CE1-CD2 4.34Å
436	H	94.8	Very high	92.2	Very high	24 Å²	24	32.3 Å²	32.3	11%	0.111	19%	0.189	C	C	.	.	H	α-helix	trans	-65.6	-43.2	174.5	-60.9	130.3	0	0	0	111.8	G431 L432 S433 N434 T439 A440 L478 F507	G431-H436 PolarHBondContact O-CE1 3.29Å; L432-H436 HydrophobicContact CD2-CB 4.17Å; S433-H436 PolarHBondContact N-ND1 3.43Å; S433-H436 VanDerWaalsContact N-ND1 3.11Å; S433-H436 WeakPolarHBondContact O-CB 3.28Å; S433-H436 PolarHBondContact O-N 2.84Å; S433-H436 VanDerWaalsContact O-N 3.07Å; S433-H436 PolarHBondContact OG-ND1 3.37Å; N434-H436 VanDerWaalsContact C-N 3.34Å; N434-H436 PolarHBondContact O-N 3.34Å; H436-T439 PolarHBondContact O-N 2.91Å; H436-A440 WeakPolarHBondContact O-CB 3.4Å; H436-A440 PolarHBondContact O-N 2.8Å; H436-L478 HydrophobicContact CB-CD2 4.04Å; H436-F507 HydrophobicContact CB-CE1 4.23Å; H436-F507 AromaticContact CD2-CE1 3.6Å; H436-F507 AromaticContact CG-CE1 3.76Å; H436-F507 AromaticContact NE2-CE1 3.91Å
437	L	96	Very high	92.5	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-44.9	175.4	-65.5	178	0	0	0	111.8	L413 A416 L420 S433 N434 A440 L441 L469	L413-L437 HydrophobicContact CD1-CB 3.8Å; A416-L437 HydrophobicContact CB-CD1 3.93Å; A416-L437 HydrophobicContact CB-CD2 4.25Å; L420-L437 HydrophobicContact CB-CD1 4.03Å; L420-L437 HydrophobicContact CD2-CD1 3.68Å; L420-L437 HydrophobicContact CD2-CG 4.14Å; S433-L437 PolarHBondContact O-N 2.89Å; N434-L437 PolarHBondContact O-N 3.46Å; L437-A440 PolarHBondContact O-N 2.97Å; L437-L441 PolarHBondContact O-N 2.77Å; L437-L469 HydrophobicContact CD2-CD2 3.62Å
438	K	96.3	Very high	92.8	Very high	5 Å²	5	30.1 Å²	30.1	2%	0.022	18%	0.175	C	C	.	.	H	α-helix	trans	-60.1	-47.9	175.7	-177.3	-177.6	179.2	-178.9	0	110.9	E198 W200 E392 L413 N434 Y435 A440 L441 L442	E198-K438 IonicContact OE1-NZ 2.68Å; E198-K438 PolarHBondContact OE1-NZ 3.27Å; E198-K438 WeakPolarHBondContact OE2-CE 3.4Å; E198-K438 IonicContact OE2-NZ 2.66Å; E198-K438 PolarHBondContact OE2-NZ 3.21Å; W200-K438 HydrophobicContact CZ2-CD 4.07Å; E392-K438 WeakPolarHBondContact OE2-CE 3.17Å; E392-K438 IonicContact OE2-NZ 2.71Å; E392-K438 PolarHBondContact OE2-NZ 3.11Å; L413-K438 HydrophobicContact CD1-CB 4.43Å; L413-K438 HydrophobicContact CD2-CB 4.41Å; L413-K438 HydrophobicContact CD2-CG 4.46Å; N434-K438 WeakPolarHBondContact O-CB 3.21Å; N434-K438 PolarHBondContact O-N 2.83Å; Y435-K438 PolarHBondContact O-N 3.31Å; K438-A440 VanDerWaalsContact C-N 3.32Å; K438-A440 PolarHBondContact O-N 3.44Å; K438-L441 WeakPolarHBondContact O-CB 3.46Å; K438-L441 PolarHBondContact O-N 2.81Å; K438-L441 VanDerWaalsContact O-N 3.12Å; K438-L442 HydrophobicContact CG-CD1 4.27Å; K438-L442 HydrophobicContact CG-CG 4.44Å; K438-L442 VanDerWaalsContact O-CG 3.3Å; K438-L442 WeakPolarHBondContact O-CG 3.21Å; K438-L442 PolarHBondContact O-N 2.95Å
439	T	96.4	Very high	93.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.9	-43.8	178.4	-60.4	0	0	0	0	111.6	Y435 H436 L442 H443 L478 H479 F481 L506	Y435-T439 WeakPolarHBondContact O-CB 3.49Å; Y435-T439 PolarHBondContact O-N 3.15Å; Y435-T439 PolarHBondContact O-OG1 2.78Å; H436-T439 PolarHBondContact O-N 2.91Å; T439-L442 PolarHBondContact O-N 3.11Å; T439-H443 PolarHBondContact O-CD2 3.02Å; T439-H443 PolarHBondContact O-N 2.91Å; T439-H443 VanDerWaalsContact O-N 3.1Å; T439-L478 HydrophobicContact CG2-CD1 4.12Å; T439-L478 HydrophobicContact CG2-CD2 4.41Å; T439-L478 HydrophobicContact CG2-CG 4.18Å; T439-H479 WeakPolarHBondContact CG2-O 3.45Å; T439-F481 HydrophobicContact CG2-CB 4.42Å; T439-L506 HydrophobicContact CG2-CD1 3.93Å
440	A	97.4	Very high	93.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.5	-44.2	174.4	0	0	0	0	0	112.2	H436 L437 K438 L442 H443 L444 L465 F468	H436-A440 WeakPolarHBondContact O-CB 3.4Å; H436-A440 PolarHBondContact O-N 2.8Å; L437-A440 PolarHBondContact O-N 2.97Å; K438-A440 VanDerWaalsContact C-N 3.32Å; K438-A440 PolarHBondContact O-N 3.44Å; A440-L442 PolarHBondContact O-N 3.16Å; A440-H443 PolarHBondContact O-N 2.87Å; A440-L444 WeakPolarHBondContact O-CG 3.33Å; A440-L444 PolarHBondContact O-N 2.99Å; A440-L465 HydrophobicContact CB-CD1 3.74Å; A440-F468 HydrophobicContact CB-CD1 3.56Å; A440-F468 HydrophobicContact CB-CE1 3.9Å
441	L	97.4	Very high	94.1	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-61.5	-43.6	175.3	179	67.8	0	0	0	111.8	H409 L413 L437 K438 H443 L444 L445 W453 L465	H409-L441 HydrophobicContact CB-CD1 4.5Å; L413-L441 HydrophobicContact CB-CD2 3.82Å; L413-L441 HydrophobicContact CD2-CD2 4.03Å; L413-L441 HydrophobicContact CG-CD2 4.45Å; L437-L441 PolarHBondContact O-N 2.77Å; K438-L441 WeakPolarHBondContact O-CB 3.46Å; K438-L441 PolarHBondContact O-N 2.81Å; K438-L441 VanDerWaalsContact O-N 3.12Å; L441-H443 VanDerWaalsContact C-N 3.33Å; L441-H443 PolarHBondContact O-N 3Å; L441-L444 PolarHBondContact O-N 3.12Å; L441-L444 VanDerWaalsContact O-N 3.15Å; L441-L445 HydrophobicContact CD1-CD1 4.41Å; L441-L445 HydrophobicContact CD1-CG 4.26Å; L441-L445 HydrophobicContact CD2-CD1 4.24Å; L441-L445 HydrophobicContact CG-CD1 3.91Å; L441-L445 HydrophobicContact CG-CG 4.22Å; L441-L445 WeakPolarHBondContact O-CG 3.42Å; L441-L445 PolarHBondContact O-N 3.01Å; L441-W453 HydrophobicContact CD1-CH2 3.5Å; L441-W453 VanDerWaalsContact CD1-CH2 3.5Å; L441-W453 HydrophobicContact CD1-CZ3 3.71Å; L441-L465 HydrophobicContact CB-CD1 4.19Å
442	L	97.1	Very high	94.5	Very high	1 Å²	1	32 Å²	32	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-43.2	179.7	-66.4	173.7	0	0	0	111.4	E392 F395 L396 K438 T439 A440 L444 L445 L446 F481	E392-L442 HydrophobicContact CG-CD1 4.36Å; F395-L442 HydrophobicContact CD1-CD2 3.39Å; F395-L442 HydrophobicContact CE1-CD2 3.65Å; F395-L442 HydrophobicContact CG-CD2 4.47Å; L396-L442 HydrophobicContact CD2-CD2 3.72Å; L396-L442 HydrophobicContact CG-CD2 4Å; K438-L442 HydrophobicContact CG-CD1 4.27Å; K438-L442 HydrophobicContact CG-CG 4.44Å; K438-L442 VanDerWaalsContact O-CG 3.3Å; K438-L442 WeakPolarHBondContact O-CG 3.21Å; K438-L442 PolarHBondContact O-N 2.95Å; T439-L442 PolarHBondContact O-N 3.11Å; A440-L442 PolarHBondContact O-N 3.16Å; L442-L444 PolarHBondContact O-N 3.2Å; L442-L445 PolarHBondContact O-N 2.8Å; L442-L446 WeakPolarHBondContact O-CB 3.48Å; L442-L446 PolarHBondContact O-N 3.27Å; L442-F481 HydrophobicContact CB-CB 4.25Å; L442-F481 HydrophobicContact CB-CD1 4.04Å; L442-F481 HydrophobicContact CB-CD2 3.43Å; L442-F481 VanDerWaalsContact CB-CD2 3.43Å; L442-F481 HydrophobicContact CB-CE1 4.25Å; L442-F481 HydrophobicContact CB-CE2 3.69Å; L442-F481 HydrophobicContact CB-CG 3.62Å; L442-F481 HydrophobicContact CB-CZ 4.09Å; L442-F481 HydrophobicContact CD1-CB 4.01Å; L442-F481 HydrophobicContact CD1-CD1 3.95Å; L442-F481 HydrophobicContact CD1-CG 3.92Å; L442-F481 HydrophobicContact CG-CD1 4.49Å; L442-F481 HydrophobicContact CG-CG 4.39Å; L442-F481 VanDerWaalsContact O-CE2 3.23Å; L442-F481 WeakPolarHBondContact O-CE2 3.34Å
443	H	96.4	Very high	94.7	Very high	33 Å²	33	31.5 Å²	31.5	15%	0.153	18%	0.181	C	C	.	.	H	α-helix	trans	-63.3	-38.4	173.8	-76	-63.2	0	0	0	112.8	T439 A440 L441 L446 S447 F468 H479 F481	T439-H443 PolarHBondContact O-CD2 3.02Å; T439-H443 PolarHBondContact O-N 2.91Å; T439-H443 VanDerWaalsContact O-N 3.1Å; A440-H443 PolarHBondContact O-N 2.87Å; L441-H443 VanDerWaalsContact C-N 3.33Å; L441-H443 PolarHBondContact O-N 3Å; H443-L446 PolarHBondContact O-N 3.2Å; H443-S447 WeakPolarHBondContact O-CB 3.31Å; H443-S447 PolarHBondContact O-N 3.44Å; H443-S447 PolarHBondContact O-OG 2.92Å; H443-F468 HydrophobicContact CB-CE1 4.33Å; H443-F468 HydrophobicContact CB-CE2 4.14Å; H443-F468 HydrophobicContact CB-CZ 3.67Å; H443-H479 PolarHBondContact NE2-O 3.19Å; H443-F481 AromaticContact CE1-CD2 3.86Å; H443-F481 AromaticContact ND1-CD2 3.76Å
444	L	95.9	Very high	94.8	Very high	7 Å²	7	35.3 Å²	35.3	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-66.5	-40.8	174.3	-74	174.3	0	0	0	112.4	A440 L441 L442 L446 S447 R448 W453 L465 F468	A440-L444 WeakPolarHBondContact O-CG 3.33Å; A440-L444 PolarHBondContact O-N 2.99Å; L441-L444 PolarHBondContact O-N 3.12Å; L441-L444 VanDerWaalsContact O-N 3.15Å; L442-L444 PolarHBondContact O-N 3.2Å; L444-L446 VanDerWaalsContact C-N 3.27Å; L444-L446 PolarHBondContact O-N 2.87Å; L444-S447 WeakPolarHBondContact CA-OG 3.47Å; L444-S447 PolarHBondContact O-N 3.06Å; L444-S447 PolarHBondContact O-OG 3.41Å; L444-R448 WeakPolarHBondContact O-CB 3.45Å; L444-R448 PolarHBondContact O-N 2.97Å; L444-W453 HydrophobicContact CB-CH2 4.03Å; L444-W453 HydrophobicContact CB-CZ2 4.03Å; L444-L465 HydrophobicContact CD1-CB 4.12Å; L444-L465 HydrophobicContact CD1-CD1 4.02Å; L444-F468 HydrophobicContact CD1-CB 4.18Å; L444-F468 HydrophobicContact CD2-CB 4.3Å; L444-F468 HydrophobicContact CD2-CD2 3.94Å; L444-F468 HydrophobicContact CD2-CG 4.35Å; L444-F468 HydrophobicContact CG-CB 4.37Å; L444-F468 HydrophobicContact CG-CD2 4.22Å; L444-F468 HydrophobicContact CG-CG 4.3Å
445	L	95.9	Very high	94.8	Very high	13 Å²	13	34.9 Å²	34.9	7%	0.068	20%	0.198	C	C	.	.	H	α-helix	trans	-63.4	-35.6	176.2	-75.3	168.8	0	0	0	111.8	F395 L396 T399 L403 H409 L441 L442 W453	F395-L445 HydrophobicContact CE1-CB 4.23Å; F395-L445 HydrophobicContact CE1-CD1 4.42Å; L396-L445 HydrophobicContact CD2-CD1 3.94Å; T399-L445 HydrophobicContact CG2-CB 4.34Å; T399-L445 HydrophobicContact CG2-CD1 4.33Å; T399-L445 HydrophobicContact CG2-CD2 3.9Å; T399-L445 HydrophobicContact CG2-CG 4.43Å; L403-L445 HydrophobicContact CD1-CD2 4.12Å; H409-L445 HydrophobicContact CB-CD2 3.94Å; L441-L445 HydrophobicContact CD1-CD1 4.41Å; L441-L445 HydrophobicContact CD1-CG 4.26Å; L441-L445 HydrophobicContact CD2-CD1 4.24Å; L441-L445 HydrophobicContact CG-CD1 3.91Å; L441-L445 HydrophobicContact CG-CG 4.22Å; L441-L445 WeakPolarHBondContact O-CG 3.42Å; L441-L445 PolarHBondContact O-N 3.01Å; L442-L445 PolarHBondContact O-N 2.8Å; L445-W453 HydrophobicContact CD2-CD2 3.9Å; L445-W453 HydrophobicContact CD2-CE3 4.32Å; L445-W453 HydrophobicContact CD2-CG 4.44Å; L445-W453 HydrophobicContact CD2-CH2 4.08Å; L445-W453 HydrophobicContact CD2-CZ2 3.63Å; L445-W453 HydrophobicContact CD2-CZ3 4.4Å; L445-W453 HydrophobicContact CG-CH2 4.28Å; L445-W453 HydrophobicContact CG-CZ2 3.97Å
446	L	94.4	Very high	94.8	Very high	48 Å²	48	34.6 Å²	34.6	25%	0.251	21%	0.207	S	C	.	.	H	α-helix	trans	-74.3	-33.9	177.6	-172.3	62.7	0	0	0	113	L442 H443 L444 F481 K487 V488	L442-L446 WeakPolarHBondContact O-CB 3.48Å; L442-L446 PolarHBondContact O-N 3.27Å; H443-L446 PolarHBondContact O-N 3.2Å; L444-L446 VanDerWaalsContact C-N 3.27Å; L444-L446 PolarHBondContact O-N 2.87Å; L446-F481 HydrophobicContact CB-CE2 3.96Å; L446-F481 HydrophobicContact CB-CZ 4.24Å; L446-F481 HydrophobicContact CD2-CE2 3.78Å; L446-F481 HydrophobicContact CD2-CZ 4.03Å; L446-F481 HydrophobicContact CG-CE2 4.48Å; L446-K487 HydrophobicContact CD2-CB 3.73Å; L446-K487 HydrophobicContact CG-CB 4.36Å; L446-V488 HydrophobicContact CD2-CG2 4.48Å
447	S	92.8	Very high	94.6	Very high	71 Å²	71	36.7 Å²	36.7	50%	0.497	22%	0.217	S	C	.	.	H	α-helix	trans	-88.3	-18.7	-175.1	54.6	0	0	0	0	114.5	H443 L444	H443-S447 WeakPolarHBondContact O-CB 3.31Å; H443-S447 PolarHBondContact O-N 3.44Å; H443-S447 PolarHBondContact O-OG 2.92Å; L444-S447 WeakPolarHBondContact CA-OG 3.47Å; L444-S447 PolarHBondContact O-N 3.06Å; L444-S447 PolarHBondContact O-OG 3.41Å
448	R	93.3	Very high	94.5	Very high	70 Å²	70	36.8 Å²	36.8	26%	0.264	22%	0.217	S	C	.	.	S	Bend	trans	-111.7	147.1	-175	-65	-162.3	175.2	-158.9	7.9	113.1	L444 D464	L444-R448 WeakPolarHBondContact O-CB 3.45Å; L444-R448 PolarHBondContact O-N 2.97Å; R448-D464 VanDerWaalsContact CZ-CG 3.47Å; R448-D464 IonicContact CZ-OD1 2.98Å; R448-D464 IonicContact CZ-OD2 2.98Å; R448-D464 VanDerWaalsContact NH1-CG 3.28Å; R448-D464 IonicContact NH1-OD1 3.56Å; R448-D464 IonicContact NH1-OD2 3.9Å; R448-D464 PolarHBondContact NH1-OD2 3.25Å; R448-D464 IonicContact NH2-OD1 3.96Å; R448-D464 PolarHBondContact NH2-OD1 2.73Å; R448-D464 IonicContact NH2-OD2 3.39Å; R448-D464 PolarHBondContact NH2-OD2 2.69Å
449	P	92.8	Very high	94.3	Very high	80 Å²	80	38.8 Å²	38.8	52%	0.519	23%	0.228	S	C	.	.			trans	-67.2	154.7	178.6	29	-34.8	0	0	0	111.6	A451 D452	P449-A451 PolarHBondContact O-N 2.9Å; P449-D452 HydrophobicContact CG-CB 4.18Å; P449-D452 WeakPolarHBondContact O-CB 3.4Å; P449-D452 PolarHBondContact O-N 3.43Å
450	A	93.1	Very high	94.1	Very high	39 Å²	39	41.1 Å²	41.1	32%	0.322	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-58.9	-33.5	-179.8	0	0	0	0	0	113.5	A402 L403 P404 D452 W453	A402-A450 WeakPolarHBondContact O-CB 3.49Å; L403-A450 HydrophobicContact CD2-CB 3.86Å; P404-A450 WeakPolarHBondContact CD-O 3.32Å; A450-D452 PolarHBondContact O-N 3.32Å; A450-D452 VanDerWaalsContact O-N 3.11Å; A450-W453 PolarHBondContact O-N 2.8Å
451	A	92.5	Very high	93.9	Very high	56 Å²	56	42 Å²	42	46%	0.463	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-63.2	-17.9	-178.4	0	0	0	0	0	114.2	P449 W453 K454	P449-A451 PolarHBondContact O-N 2.9Å; A451-W453 VanDerWaalsContact C-N 3.31Å; A451-K454 WeakPolarHBondContact O-CE 3.48Å; A451-K454 WeakPolarHBondContact O-CG 3.36Å
452	D	94.2	Very high	93.8	Very high	57 Å²	57	42 Å²	42	31%	0.305	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-82.1	-8.1	-177	-94.1	31.6	0	0	0	113.9	P449 A450 R461	P449-D452 HydrophobicContact CG-CB 4.18Å; P449-D452 WeakPolarHBondContact O-CB 3.4Å; P449-D452 PolarHBondContact O-N 3.43Å; A450-D452 PolarHBondContact O-N 3.32Å; A450-D452 VanDerWaalsContact O-N 3.11Å; D452-R461 VanDerWaalsContact CG-NH1 3.33Å; D452-R461 WeakPolarHBondContact O-CD 3.44Å; D452-R461 PolarHBondContact O-NH1 3.44Å; D452-R461 VanDerWaalsContact O-NH1 3.1Å; D452-R461 IonicContact OD2-NH1 3.03Å; D452-R461 PolarHBondContact OD2-NH1 3Å
453	W	95.8	Very high	93.6	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.008	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-104.1	16.7	-173.7	-66.4	96	0	0	0	113.9	L403 A407 C408 H409 L441 L444 L445 A450 A451 R461	L403-W453 HydrophobicContact CD1-CB 4.28Å; L403-W453 HydrophobicContact CD1-CG 4.44Å; L403-W453 HydrophobicContact CD2-CB 3.9Å; L403-W453 HydrophobicContact CD2-CG 3.92Å; A407-W453 CarbonylContact C-O 3.43Å; A407-W453 WeakPolarHBondContact CA-O 3.34Å; A407-W453 HydrophobicContact CB-CB 4.3Å; A407-W453 VanDerWaalsContact CB-O 3.29Å; A407-W453 WeakPolarHBondContact CB-O 3.13Å; C408-W453 PolarHBondContact N-O 2.63Å; H409-W453 HydrophobicContact CB-CD2 4.2Å; H409-W453 HydrophobicContact CB-CE3 3.51Å; H409-W453 HydrophobicContact CB-CZ3 3.78Å; L441-W453 HydrophobicContact CD1-CH2 3.5Å; L441-W453 VanDerWaalsContact CD1-CH2 3.5Å; L441-W453 HydrophobicContact CD1-CZ3 3.71Å; L444-W453 HydrophobicContact CB-CH2 4.03Å; L444-W453 HydrophobicContact CB-CZ2 4.03Å; L445-W453 HydrophobicContact CD2-CD2 3.9Å; L445-W453 HydrophobicContact CD2-CE3 4.32Å; L445-W453 HydrophobicContact CD2-CG 4.44Å; L445-W453 HydrophobicContact CD2-CH2 4.08Å; L445-W453 HydrophobicContact CD2-CZ2 3.63Å; L445-W453 HydrophobicContact CD2-CZ3 4.4Å; L445-W453 HydrophobicContact CG-CH2 4.28Å; L445-W453 HydrophobicContact CG-CZ2 3.97Å; A450-W453 PolarHBondContact O-N 2.8Å; A451-W453 VanDerWaalsContact C-N 3.31Å; W453-R461 HydrophobicContact CE3-CB 4.4Å; W453-R461 HydrophobicContact CE3-CG 4.04Å; W453-R461 HydrophobicContact CZ3-CB 4.17Å; W453-R461 HydrophobicContact CZ3-CG 4.23Å
454	K	94.3	Very high	93.5	Very high	104 Å²	104	45.8 Å²	45.8	45%	0.452	26%	0.264	S	S	.	.			trans	-57.5	150.9	178	-66.7	171.4	-174.4	177.1	0	111.4	P404 A451 S456 Q457	P404-K454 HydrophobicContact CB-CG 4.32Å; P404-K454 HydrophobicContact CG-CG 4.11Å; A451-K454 WeakPolarHBondContact O-CE 3.48Å; A451-K454 WeakPolarHBondContact O-CG 3.36Å; K454-S456 PolarHBondContact O-N 3.07Å; K454-Q457 HydrophobicContact CB-CG 4.5Å; K454-Q457 WeakPolarHBondContact O-CB 3.22Å; K454-Q457 PolarHBondContact O-N 3Å
455	A	92.2	Very high	93.4	Very high	47 Å²	47	45.5 Å²	45.5	39%	0.388	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-48.9	-34.6	173.9	0	0	0	0	0	113.5	K139 G406 Q457 L458	K139-A455 WeakPolarHBondContact CE-O 3.28Å; G406-A455 WeakPolarHBondContact O-CA 3.43Å; G406-A455 VanDerWaalsContact O-CB 3.29Å; G406-A455 WeakPolarHBondContact O-CB 3.24Å; G406-A455 PolarHBondContact O-N 2.89Å; A455-Q457 PolarHBondContact O-N 2.95Å; A455-L458 PolarHBondContact O-N 3.31Å
456	S	91.1	Very high	93.4	Very high	66 Å²	66	44.9 Å²	44.9	46%	0.462	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-65.3	-15.7	179.7	65.3	0	0	0	0	114.5	K454	K454-S456 PolarHBondContact O-N 3.07Å
457	Q	92.4	Very high	93.3	Very high	68 Å²	68	43.6 Å²	43.6	32%	0.318	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-103.2	12.5	-174.1	-61.5	-67.4	-18.8	0	0	112.9	K454 A455 D459 V460 R461	K454-Q457 HydrophobicContact CB-CG 4.5Å; K454-Q457 WeakPolarHBondContact O-CB 3.22Å; K454-Q457 PolarHBondContact O-N 3Å; A455-Q457 PolarHBondContact O-N 2.95Å; Q457-D459 VanDerWaalsContact C-N 3.33Å; Q457-D459 PolarHBondContact O-N 3.04Å; Q457-V460 PolarHBondContact O-N 3.36Å; Q457-R461 HydrophobicContact CB-CG 4.01Å; Q457-R461 WeakPolarHBondContact O-CB 3.33Å; Q457-R461 WeakPolarHBondContact O-CG 3.48Å; Q457-R461 PolarHBondContact O-N 3.34Å
458	L	92.6	Very high	93.5	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-52.8	-46.4	-173.5	175.4	64.9	0	0	0	113.5	K139 L142 D143 C408 I415 A455 L462	K139-L458 HydrophobicContact CG-CB 4.46Å; L142-L458 HydrophobicContact CB-CD2 3.78Å; L142-L458 HydrophobicContact CB-CG 4.43Å; L142-L458 HydrophobicContact CD1-CG 4.44Å; D143-L458 VanDerWaalsContact OD1-CD2 3.29Å; D143-L458 WeakPolarHBondContact OD1-CD2 3.31Å; C408-L458 HydrophobicContact CB-CB 4.06Å; C408-L458 HydrophobicContact CB-CD1 3.86Å; I415-L458 HydrophobicContact CD1-CD1 4.16Å; I415-L458 HydrophobicContact CD1-CD2 4.34Å; A455-L458 PolarHBondContact O-N 3.31Å; L458-L462 WeakPolarHBondContact O-CB 3.2Å; L458-L462 PolarHBondContact O-N 2.9Å
459	D	91.4	Very high	93.6	Very high	47 Å²	47	38.9 Å²	38.9	25%	0.251	23%	0.227	S	C	.	.	H	α-helix	trans	-63.9	-49.4	178.9	52.2	-16.3	0	0	0	111.9	K139 L142 Q457 L462 Q463	K139-D459 HydrophobicContact CB-CB 4.35Å; L142-D459 HydrophobicContact CD1-CB 3.91Å; Q457-D459 VanDerWaalsContact C-N 3.33Å; Q457-D459 PolarHBondContact O-N 3.04Å; D459-L462 PolarHBondContact O-N 3Å; D459-Q463 WeakPolarHBondContact O-CB 3.26Å; D459-Q463 PolarHBondContact O-N 3Å
460	V	92.3	Very high	93.6	Very high	50 Å²	50	35.5 Å²	35.5	30%	0.303	20%	0.204	S	C	.	.	H	α-helix	trans	-64.3	-43.5	178.9	-170.4	0	0	0	0	111.1	Q457 Q463 D464	Q457-V460 PolarHBondContact O-N 3.36Å; V460-Q463 WeakPolarHBondContact O-CB 3.2Å; V460-Q463 PolarHBondContact O-N 2.82Å; V460-D464 PolarHBondContact O-N 3.5Å
461	R	94.4	Very high	93.6	Very high	19 Å²	19	38.5 Å²	38.5	7%	0.072	21%	0.207	C	C	.	.	H	α-helix	trans	-68.9	-35.2	179.4	-67.6	-53.1	87.8	126.1	1.2	112.9	C412 D452 W453 Q457 Q463 D464 L465	C412-R461 VanDerWaalsContact SG-CB 3.59Å; D452-R461 VanDerWaalsContact CG-NH1 3.33Å; D452-R461 WeakPolarHBondContact O-CD 3.44Å; D452-R461 PolarHBondContact O-NH1 3.44Å; D452-R461 VanDerWaalsContact O-NH1 3.1Å; D452-R461 IonicContact OD2-NH1 3.03Å; D452-R461 PolarHBondContact OD2-NH1 3Å; W453-R461 HydrophobicContact CE3-CB 4.4Å; W453-R461 HydrophobicContact CE3-CG 4.04Å; W453-R461 HydrophobicContact CZ3-CB 4.17Å; W453-R461 HydrophobicContact CZ3-CG 4.23Å; Q457-R461 HydrophobicContact CB-CG 4.01Å; Q457-R461 WeakPolarHBondContact O-CB 3.33Å; Q457-R461 WeakPolarHBondContact O-CG 3.48Å; Q457-R461 PolarHBondContact O-N 3.34Å; R461-Q463 VanDerWaalsContact C-N 3.33Å; R461-D464 IonicContact CZ-OD2 2.67Å; R461-D464 IonicContact NE-OD2 2.94Å; R461-D464 PolarHBondContact NE-OD2 2.87Å; R461-D464 IonicContact NH2-OD2 3.38Å; R461-D464 PolarHBondContact NH2-OD2 3.42Å; R461-D464 PolarHBondContact O-N 3.1Å; R461-L465 PolarHBondContact O-N 2.74Å
462	L	94.3	Very high	93.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.3	-40.9	172	-178.3	64.5	0	0	0	110.8	L136 L142 C412 I415 A416 L458 D459 L465 F466	L136-L462 HydrophobicContact CD1-CG 4.39Å; L142-L462 HydrophobicContact CD1-CD2 4.08Å; L142-L462 HydrophobicContact CD2-CD2 4.13Å; C412-L462 HydrophobicContact CB-CD1 4.39Å; C412-L462 WeakPolarHBondContact O-CD1 3.41Å; I415-L462 HydrophobicContact CB-CD1 4.29Å; I415-L462 HydrophobicContact CB-CD2 4.38Å; I415-L462 HydrophobicContact CD1-CD2 4.46Å; I415-L462 HydrophobicContact CG2-CD1 4.22Å; I415-L462 HydrophobicContact CG2-CD2 3.72Å; A416-L462 HydrophobicContact CB-CD1 4.38Å; L458-L462 WeakPolarHBondContact O-CB 3.2Å; L458-L462 PolarHBondContact O-N 2.9Å; D459-L462 PolarHBondContact O-N 3Å; L462-L465 WeakPolarHBondContact O-CB 3.29Å; L462-L465 PolarHBondContact O-N 3.26Å; L462-F466 HydrophobicContact CD1-CD2 4.25Å; L462-F466 HydrophobicContact CD1-CE2 3.57Å; L462-F466 HydrophobicContact CD1-CZ 3.94Å; L462-F466 HydrophobicContact CD2-CE2 4.19Å; L462-F466 HydrophobicContact CG-CD2 4.1Å; L462-F466 HydrophobicContact CG-CE2 3.63Å; L462-F466 HydrophobicContact CG-CZ 4.48Å; L462-F466 VanDerWaalsContact O-CD2 3.28Å; L462-F466 WeakPolarHBondContact O-CD2 3.3Å; L462-F466 PolarHBondContact O-N 2.88Å; L462-F466 VanDerWaalsContact O-N 3.17Å
463	Q	93	Very high	93.8	Very high	83 Å²	83	33.8 Å²	33.8	39%	0.388	18%	0.175	S	C	.	.	H	α-helix	trans	-60.8	-46.5	173.7	-164.3	178.6	-0.1	0	0	111.6	L131 L136 D459 V460 R461 L465 F466 C467	L131-Q463 HydrophobicContact CD1-CG 3.27Å; L136-Q463 HydrophobicContact CD1-CB 3.77Å; L136-Q463 HydrophobicContact CD1-CG 4.03Å; D459-Q463 WeakPolarHBondContact O-CB 3.26Å; D459-Q463 PolarHBondContact O-N 3Å; V460-Q463 WeakPolarHBondContact O-CB 3.2Å; V460-Q463 PolarHBondContact O-N 2.82Å; R461-Q463 VanDerWaalsContact C-N 3.33Å; Q463-L465 VanDerWaalsContact C-N 3.28Å; Q463-L465 PolarHBondContact O-N 2.85Å; Q463-F466 PolarHBondContact O-N 2.83Å; Q463-F466 VanDerWaalsContact O-N 3.16Å; Q463-C467 WeakPolarHBondContact O-CB 3.31Å; Q463-C467 PolarHBondContact O-N 3.34Å; Q463-C467 PolarHBondContact O-SG 3.49Å
464	D	93.9	Very high	93.6	Very high	31 Å²	31	37.9 Å²	37.9	17%	0.166	20%	0.196	C	C	.	.	H	α-helix	trans	-58	-39.8	177	-70.4	-52.1	0	0	0	112.2	R448 V460 R461 C467 F468	R448-D464 VanDerWaalsContact CZ-CG 3.47Å; R448-D464 IonicContact CZ-OD1 2.98Å; R448-D464 IonicContact CZ-OD2 2.98Å; R448-D464 VanDerWaalsContact NH1-CG 3.28Å; R448-D464 IonicContact NH1-OD1 3.56Å; R448-D464 IonicContact NH1-OD2 3.9Å; R448-D464 PolarHBondContact NH1-OD2 3.25Å; R448-D464 IonicContact NH2-OD1 3.96Å; R448-D464 PolarHBondContact NH2-OD1 2.73Å; R448-D464 IonicContact NH2-OD2 3.39Å; R448-D464 PolarHBondContact NH2-OD2 2.69Å; V460-D464 PolarHBondContact O-N 3.5Å; R461-D464 IonicContact CZ-OD2 2.67Å; R461-D464 IonicContact NE-OD2 2.94Å; R461-D464 PolarHBondContact NE-OD2 2.87Å; R461-D464 IonicContact NH2-OD2 3.38Å; R461-D464 PolarHBondContact NH2-OD2 3.42Å; R461-D464 PolarHBondContact O-N 3.1Å; D464-C467 PolarHBondContact O-N 3.2Å; D464-F468 VanDerWaalsContact O-CB 3.31Å; D464-F468 WeakPolarHBondContact O-CB 3.48Å; D464-F468 PolarHBondContact O-N 3.45Å
465	L	95.8	Very high	93.6	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-46.9	175.2	-179.4	63.1	0	0	0	112	C412 A416 A440 L441 L444 R461 L462 Q463 F468 L469	C412-L465 HydrophobicContact CB-CD2 4.49Å; A416-L465 HydrophobicContact CB-CD2 3.79Å; A440-L465 HydrophobicContact CB-CD1 3.74Å; L441-L465 HydrophobicContact CB-CD1 4.19Å; L444-L465 HydrophobicContact CD1-CB 4.12Å; L444-L465 HydrophobicContact CD1-CD1 4.02Å; R461-L465 PolarHBondContact O-N 2.74Å; L462-L465 WeakPolarHBondContact O-CB 3.29Å; L462-L465 PolarHBondContact O-N 3.26Å; Q463-L465 VanDerWaalsContact C-N 3.28Å; Q463-L465 PolarHBondContact O-N 2.85Å; L465-F468 PolarHBondContact O-N 3.47Å; L465-L469 PolarHBondContact O-N 3.49Å
466	F	94.8	Very high	93.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-70.2	-39	178.3	-67.2	-50.5	0	0	0	112.7	L131 L136 A416 L419 L462 Q463 F468 L469 E470 F524 M527 L528	L131-F466 HydrophobicContact CD2-CB 4.11Å; L136-F466 HydrophobicContact CD1-CD2 3.84Å; L136-F466 HydrophobicContact CD1-CE2 4.33Å; L136-F466 HydrophobicContact CD2-CD2 4.11Å; L136-F466 HydrophobicContact CD2-CE2 3.96Å; A416-F466 HydrophobicContact CB-CE1 3.89Å; A416-F466 HydrophobicContact CB-CZ 3.92Å; L419-F466 HydrophobicContact CD1-CE2 4.37Å; L419-F466 HydrophobicContact CD1-CZ 3.91Å; L462-F466 HydrophobicContact CD1-CD2 4.25Å; L462-F466 HydrophobicContact CD1-CE2 3.57Å; L462-F466 HydrophobicContact CD1-CZ 3.94Å; L462-F466 HydrophobicContact CD2-CE2 4.19Å; L462-F466 HydrophobicContact CG-CD2 4.1Å; L462-F466 HydrophobicContact CG-CE2 3.63Å; L462-F466 HydrophobicContact CG-CZ 4.48Å; L462-F466 VanDerWaalsContact O-CD2 3.28Å; L462-F466 WeakPolarHBondContact O-CD2 3.3Å; L462-F466 PolarHBondContact O-N 2.88Å; L462-F466 VanDerWaalsContact O-N 3.17Å; Q463-F466 PolarHBondContact O-N 2.83Å; Q463-F466 VanDerWaalsContact O-N 3.16Å; F466-F468 VanDerWaalsContact C-N 3.32Å; F466-F468 PolarHBondContact O-N 3.39Å; F466-L469 PolarHBondContact O-N 2.97Å; F466-E470 VanDerWaalsContact O-CB 3.31Å; F466-E470 WeakPolarHBondContact O-CB 3.45Å; F466-E470 PolarHBondContact O-N 3.38Å; F466-F524 HydrophobicContact CB-CZ 4.4Å; F466-F524 HydrophobicContact CD1-CE2 4.07Å; F466-M527 HydrophobicContact CD1-CE 4.17Å; F466-M527 HydrophobicContact CE1-CE 3.65Å; F466-M527 HydrophobicContact CZ-CE 4.34Å; F466-L528 HydrophobicContact CB-CD2 4.03Å; F466-L528 HydrophobicContact CD1-CD2 3.94Å; F466-L528 HydrophobicContact CD2-CD2 3.82Å; F466-L528 HydrophobicContact CE1-CD2 4.33Å; F466-L528 HydrophobicContact CE2-CD2 4.2Å; F466-L528 HydrophobicContact CG-CD2 3.67Å; F466-L528 HydrophobicContact CZ-CD2 4.44Å
467	C	93.4	Very high	93.8	Very high	21 Å²	21	39.8 Å²	39.8	14%	0.142	19%	0.19	C	C	.	.	H	α-helix	trans	-60.1	-42.7	172.7	-71.8	0	0	0	0	111.6	L131 Q463 D464 L469 E470 R471	L131-C467 WeakPolarHBondContact CD1-SG 3.14Å; Q463-C467 WeakPolarHBondContact O-CB 3.31Å; Q463-C467 PolarHBondContact O-N 3.34Å; Q463-C467 PolarHBondContact O-SG 3.49Å; D464-C467 PolarHBondContact O-N 3.2Å; C467-L469 VanDerWaalsContact C-N 3.34Å; C467-E470 PolarHBondContact O-N 3.26Å; C467-R471 WeakPolarHBondContact O-CB 3.46Å; C467-R471 VanDerWaalsContact O-CG 3.3Å; C467-R471 WeakPolarHBondContact O-CG 3.39Å; C467-R471 PolarHBondContact O-N 3.28Å
468	F	95.1	Very high	93.9	Very high	42 Å²	42	36.7 Å²	36.7	18%	0.184	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-44.6	176.6	-175.5	-82.1	0	0	0	111	A440 H443 L444 D464 L465 F466 S472 L478	A440-F468 HydrophobicContact CB-CD1 3.56Å; A440-F468 HydrophobicContact CB-CE1 3.9Å; H443-F468 HydrophobicContact CB-CE1 4.33Å; H443-F468 HydrophobicContact CB-CE2 4.14Å; H443-F468 HydrophobicContact CB-CZ 3.67Å; L444-F468 HydrophobicContact CD1-CB 4.18Å; L444-F468 HydrophobicContact CD2-CB 4.3Å; L444-F468 HydrophobicContact CD2-CD2 3.94Å; L444-F468 HydrophobicContact CD2-CG 4.35Å; L444-F468 HydrophobicContact CG-CB 4.37Å; L444-F468 HydrophobicContact CG-CD2 4.22Å; L444-F468 HydrophobicContact CG-CG 4.3Å; D464-F468 VanDerWaalsContact O-CB 3.31Å; D464-F468 WeakPolarHBondContact O-CB 3.48Å; D464-F468 PolarHBondContact O-N 3.45Å; L465-F468 PolarHBondContact O-N 3.47Å; F466-F468 VanDerWaalsContact C-N 3.32Å; F466-F468 PolarHBondContact O-N 3.39Å; F468-S472 WeakPolarHBondContact CE1-OG 3.45Å; F468-S472 WeakPolarHBondContact O-CB 3.41Å; F468-S472 PolarHBondContact O-N 3.22Å; F468-S472 PolarHBondContact O-OG 2.74Å; F468-L478 HydrophobicContact CE1-CD1 3.85Å
469	L	95.2	Very high	93.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.5	-42.2	179	-167.3	67.5	0	0	0	112.3	L432 L437 L465 F466 C467 S472 L473 F507 F524	L432-L469 HydrophobicContact CD1-CD2 3.97Å; L432-L469 HydrophobicContact CD2-CD1 4.11Å; L432-L469 HydrophobicContact CD2-CD2 4.23Å; L432-L469 HydrophobicContact CD2-CG 4.44Å; L437-L469 HydrophobicContact CD2-CD2 3.62Å; L465-L469 PolarHBondContact O-N 3.49Å; F466-L469 PolarHBondContact O-N 2.97Å; C467-L469 VanDerWaalsContact C-N 3.34Å; L469-S472 WeakPolarHBondContact O-CB 3.33Å; L469-S472 PolarHBondContact O-N 3.1Å; L469-L473 HydrophobicContact CG-CD1 4.37Å; L469-L473 WeakPolarHBondContact O-CB 3.26Å; L469-L473 WeakPolarHBondContact O-CG 3.24Å; L469-L473 PolarHBondContact O-N 3.44Å; L469-F507 HydrophobicContact CD1-CE2 4.49Å; L469-F507 HydrophobicContact CD1-CZ 3.95Å; L469-F524 HydrophobicContact CB-CE2 4.39Å; L469-F524 HydrophobicContact CB-CZ 4.48Å; L469-F524 HydrophobicContact CD2-CD2 4.01Å; L469-F524 HydrophobicContact CD2-CE2 3.66Å; L469-F524 HydrophobicContact CG-CE2 4.27Å
470	E	94.1	Very high	94	Very high	9 Å²	9	37.1 Å²	37.1	4%	0.042	18%	0.175	C	C	.	.	H	α-helix	trans	-57.8	-50.3	175.7	-175.3	-176	-132.6	0	0	110.8	L131 F466 C467 S472 L473 L474 F524 Y525	L131-E470 PolarHBondContact N-OE1 3.11Å; L131-E470 PolarHBondContact N-OE2 3.33Å; F466-E470 VanDerWaalsContact O-CB 3.31Å; F466-E470 WeakPolarHBondContact O-CB 3.45Å; F466-E470 PolarHBondContact O-N 3.38Å; C467-E470 PolarHBondContact O-N 3.26Å; E470-S472 VanDerWaalsContact C-N 3.33Å; E470-S472 PolarHBondContact O-N 3.3Å; E470-L473 WeakPolarHBondContact O-CB 3.46Å; E470-L473 PolarHBondContact O-N 2.87Å; E470-L473 VanDerWaalsContact O-N 3.17Å; E470-L474 HydrophobicContact CG-CD1 4.27Å; E470-L474 WeakPolarHBondContact O-CG 3.43Å; E470-L474 PolarHBondContact O-N 2.73Å; E470-F524 HydrophobicContact CB-CE1 3.73Å; E470-F524 HydrophobicContact CB-CZ 4.07Å; E470-F524 HydrophobicContact CG-CE1 4.08Å; E470-Y525 HydrophobicContact CG-CE1 4.46Å; E470-Y525 WeakPolarHBondContact OE1-CE1 3.44Å; E470-Y525 PolarHBondContact OE1-OH 3.05Å; E470-Y525 VanDerWaalsContact OE1-OH 3.07Å
471	R	93.8	Very high	94.1	Very high	102 Å²	102	34.8 Å²	34.8	39%	0.385	16%	0.161	S	C	.	.	H	α-helix	trans	-57.9	-46.3	174.8	-72.4	175.6	61	-176.2	-2.2	111.7	C467 L473 L474 E475	C467-R471 WeakPolarHBondContact O-CB 3.46Å; C467-R471 VanDerWaalsContact O-CG 3.3Å; C467-R471 WeakPolarHBondContact O-CG 3.39Å; C467-R471 PolarHBondContact O-N 3.28Å; R471-L473 VanDerWaalsContact C-N 3.28Å; R471-L473 PolarHBondContact O-N 2.74Å; R471-L474 PolarHBondContact O-N 3.42Å; R471-E475 WeakPolarHBondContact O-CB 3.23Å; R471-E475 WeakPolarHBondContact O-CG 3.39Å; R471-E475 PolarHBondContact O-N 3.11Å
472	S	95.4	Very high	94.1	Very high	9 Å²	9	33.9 Å²	33.9	6%	0.063	16%	0.158	C	C	.	.	H	α-helix	trans	-60.1	-38.1	177.8	-58.1	0	0	0	0	111.9	F468 L469 E470 K476 K477 F507	F468-S472 WeakPolarHBondContact CE1-OG 3.45Å; F468-S472 WeakPolarHBondContact O-CB 3.41Å; F468-S472 PolarHBondContact O-N 3.22Å; F468-S472 PolarHBondContact O-OG 2.74Å; L469-S472 WeakPolarHBondContact O-CB 3.33Å; L469-S472 PolarHBondContact O-N 3.1Å; E470-S472 VanDerWaalsContact C-N 3.33Å; E470-S472 PolarHBondContact O-N 3.3Å; S472-K476 CarbonylContact O-C 3.13Å; S472-K476 WeakPolarHBondContact O-CA 3.36Å; S472-K476 PolarHBondContact O-N 3.01Å; S472-K477 WeakPolarHBondContact CA-O 3.23Å; S472-K477 VanDerWaalsContact CB-O 3.3Å; S472-K477 WeakPolarHBondContact CB-O 3.3Å; S472-K477 PolarHBondContact O-N 3.18Å; S472-F507 WeakPolarHBondContact O-CD2 3.27Å
473	L	94.3	Very high	93.8	Very high	4 Å²	4	34 Å²	34	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-67.5	-48.5	175.7	-75.7	166.6	0	0	0	111.3	L432 L469 E470 R471 E475 K476 F507 F510 Y517 T520 V521 F524	L432-L473 HydrophobicContact CD1-CD1 4.27Å; L432-L473 HydrophobicContact CD2-CD2 4.19Å; L469-L473 HydrophobicContact CG-CD1 4.37Å; L469-L473 WeakPolarHBondContact O-CB 3.26Å; L469-L473 WeakPolarHBondContact O-CG 3.24Å; L469-L473 PolarHBondContact O-N 3.44Å; E470-L473 WeakPolarHBondContact O-CB 3.46Å; E470-L473 PolarHBondContact O-N 2.87Å; E470-L473 VanDerWaalsContact O-N 3.17Å; R471-L473 VanDerWaalsContact C-N 3.28Å; R471-L473 PolarHBondContact O-N 2.74Å; L473-E475 VanDerWaalsContact C-N 3.3Å; L473-E475 PolarHBondContact O-N 2.94Å; L473-K476 WeakPolarHBondContact O-CA 3.2Å; L473-K476 WeakPolarHBondContact O-CG 3.39Å; L473-K476 PolarHBondContact O-N 3.34Å; L473-F507 HydrophobicContact CD2-CD2 4.42Å; L473-F507 HydrophobicContact CD2-CE2 3.8Å; L473-F507 HydrophobicContact CD2-CZ 4.01Å; L473-F507 HydrophobicContact CG-CE2 3.98Å; L473-F507 HydrophobicContact CG-CZ 4.38Å; L473-F510 HydrophobicContact CD2-CD2 4.09Å; L473-F510 HydrophobicContact CD2-CE2 3.68Å; L473-Y517 VanDerWaalsContact O-CE2 3.25Å; L473-Y517 WeakPolarHBondContact O-CE2 3.45Å; L473-T520 HydrophobicContact CD2-CG2 4.24Å; L473-V521 HydrophobicContact CB-CG2 4.49Å; L473-F524 HydrophobicContact CD1-CB 4.04Å; L473-F524 HydrophobicContact CD1-CD1 3.78Å; L473-F524 HydrophobicContact CD1-CD2 4.2Å; L473-F524 HydrophobicContact CD1-CE1 4.28Å; L473-F524 HydrophobicContact CD1-CG 3.72Å
474	L	92.8	Very high	93.5	Very high	88 Å²	88	30.6 Å²	30.6	46%	0.461	15%	0.145	S	C	.	.	H	α-helix	trans	-59.9	-41.6	179	-67.9	173.4	0	0	0	111.6	E470 R471 K476	E470-L474 HydrophobicContact CG-CD1 4.27Å; E470-L474 WeakPolarHBondContact O-CG 3.43Å; E470-L474 PolarHBondContact O-N 2.73Å; R471-L474 PolarHBondContact O-N 3.42Å; L474-K476 PolarHBondContact O-N 3.02Å
475	E	93.7	Very high	93.4	Very high	118 Å²	118	30.2 Å²	30.2	55%	0.551	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-8.8	174.9	-65.9	174.3	-158.2	0	0	112.9	R471 L473 K477	R471-E475 WeakPolarHBondContact O-CB 3.23Å; R471-E475 WeakPolarHBondContact O-CG 3.39Å; R471-E475 PolarHBondContact O-N 3.11Å; L473-E475 VanDerWaalsContact C-N 3.3Å; L473-E475 PolarHBondContact O-N 2.94Å; E475-K477 HydrophobicContact CB-CB 4.12Å; E475-K477 PolarHBondContact O-N 2.99Å
476	K	93.9	Very high	92.9	Very high	71 Å²	71	38.4 Å²	38.4	31%	0.309	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	35.6	-172.1	-57.9	173.1	-174.7	169.5	0	112.6	S472 L473 L474 N505 F507 V511 Y517	S472-K476 CarbonylContact O-C 3.13Å; S472-K476 WeakPolarHBondContact O-CA 3.36Å; S472-K476 PolarHBondContact O-N 3.01Å; L473-K476 WeakPolarHBondContact O-CA 3.2Å; L473-K476 WeakPolarHBondContact O-CG 3.39Å; L473-K476 PolarHBondContact O-N 3.34Å; L474-K476 PolarHBondContact O-N 3.02Å; K476-N505 PolarHBondContact O-ND2 3.44Å; K476-F507 WeakPolarHBondContact O-CB 3.46Å; K476-V511 HydrophobicContact CB-CG2 3.85Å; K476-V511 HydrophobicContact CD-CG2 4.44Å; K476-Y517 HydrophobicContact CD-CD2 4.45Å; K476-Y517 HydrophobicContact CD-CE2 4.34Å; K476-Y517 VanDerWaalsContact CE-CE1 3.47Å; K476-Y517 HydrophobicContact CG-CD2 4.08Å; K476-Y517 HydrophobicContact CG-CE2 3.74Å
477	K	93.5	Very high	92.7	Very high	69 Å²	69	43.2 Å²	43.2	30%	0.3	20%	0.195	S	C	.	.			trans	-139.3	113.3	-169.6	-169.1	177.1	178.2	-176.5	0	110.6	S472 E475 H479 N505	S472-K477 WeakPolarHBondContact CA-O 3.23Å; S472-K477 VanDerWaalsContact CB-O 3.3Å; S472-K477 WeakPolarHBondContact CB-O 3.3Å; S472-K477 PolarHBondContact O-N 3.18Å; E475-K477 HydrophobicContact CB-CB 4.12Å; E475-K477 PolarHBondContact O-N 2.99Å; K477-H479 WeakPolarHBondContact CE-CE1 3.2Å; K477-H479 WeakPolarHBondContact CE-NE2 3.28Å; K477-N505 WeakPolarHBondContact CA-OD1 3.2Å
478	L	94.9	Very high	92.5	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.016	19%	0.19	C	C	.	.			trans	-137.1	104.8	169.2	178	62.5	0	0	0	107.7	H436 T439 F468 N505 L506 F507	H436-L478 HydrophobicContact CB-CD2 4.04Å; T439-L478 HydrophobicContact CG2-CD1 4.12Å; T439-L478 HydrophobicContact CG2-CD2 4.41Å; T439-L478 HydrophobicContact CG2-CG 4.18Å; F468-L478 HydrophobicContact CE1-CD1 3.85Å; L478-N505 PolarHBondContact N-OD1 3.42Å; L478-N505 CarbonylContact O-C 3.55Å; L478-N505 PolarHBondContact O-OD1 3.02Å; L478-L506 HydrophobicContact CD2-CD1 4.3Å; L478-L506 HydrophobicContact CG-CD1 4.37Å; L478-L506 WeakPolarHBondContact O-CB 3.32Å; L478-L506 PolarHBondContact O-N 3.25Å; L478-F507 HydrophobicContact CB-CB 4.45Å; L478-F507 HydrophobicContact CB-CD1 3.99Å; L478-F507 HydrophobicContact CB-CD2 3.6Å; L478-F507 HydrophobicContact CB-CE1 4.13Å; L478-F507 HydrophobicContact CB-CE2 3.75Å; L478-F507 HydrophobicContact CB-CG 3.74Å; L478-F507 HydrophobicContact CB-CZ 4.01Å; L478-F507 HydrophobicContact CD2-CD1 4.3Å; L478-F507 HydrophobicContact CD2-CE1 3.71Å; L478-F507 HydrophobicContact CD2-CE2 4.21Å; L478-F507 HydrophobicContact CD2-CZ 3.66Å; L478-F507 HydrophobicContact CG-CZ 4.48Å
479	H	93	Very high	92.2	Very high	45 Å²	45	43.7 Å²	43.7	21%	0.208	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-73.3	141.6	179	-64.4	152.3	0	0	0	111.6	T439 H443 K477 F481 P503 I504	T439-H479 WeakPolarHBondContact CG2-O 3.45Å; H443-H479 PolarHBondContact NE2-O 3.19Å; K477-H479 WeakPolarHBondContact CE-CE1 3.2Å; K477-H479 WeakPolarHBondContact CE-NE2 3.28Å; H479-F481 PolarHBondContact O-N 3.36Å; H479-P503 HydrophobicContact CB-CB 4.48Å; H479-I504 CarbonylContact C-O 3.43Å; H479-I504 VanDerWaalsContact CA-O 3.27Å; H479-I504 WeakPolarHBondContact CA-O 3.26Å
480	H	93	Very high	91.8	Very high	14 Å²	14	51 Å²	51	7%	0.065	24%	0.236	C	C	.	.			trans	-54.7	137.6	167.9	-169.9	-66.9	0	0	0	109.7	F388 Y435 F482 V483 I504 L506	F388-H480 AromaticContact CD2-CE1 3.3Å; F388-H480 WeakPolarHBondContact CD2-CE1 3.49Å; F388-H480 AromaticContact CD2-NE2 3.43Å; F388-H480 WeakPolarHBondContact CD2-NE2 3.41Å; F388-H480 AromaticContact CE2-CE1 3.81Å; F388-H480 AromaticContact CE2-NE2 3.91Å; F388-H480 AromaticContact CG-CE1 3.79Å; Y435-H480 AromaticContact CZ-NE2 3.99Å; Y435-H480 PolarHBondContact OH-CD2 3.11Å; Y435-H480 PolarHBondContact OH-CE1 2.92Å; Y435-H480 PolarHBondContact OH-NE2 2.76Å; H480-F482 PolarHBondContact ND1-N 2.92Å; H480-F482 VanDerWaalsContact ND1-N 3.19Å; H480-F482 PolarHBondContact O-N 3.19Å; H480-V483 HydrophobicContact CB-CB 4.38Å; H480-V483 HydrophobicContact CB-CG2 4.43Å; H480-I504 HydrophobicContact CB-CB 4.16Å; H480-I504 PolarHBondContact N-O 3.21Å; H480-L506 HydrophobicContact CB-CD2 4.22Å; H480-L506 HydrophobicContact CB-CG 4.42Å
481	F	94.8	Very high	91.5	Very high	1 Å²	1	55.4 Å²	55.4	0%	0.004	28%	0.275	C	S	.	.	S	Bend	trans	-64.1	-41.4	-171.5	-177.5	-106.4	0	0	0	113.9	F395 T439 L442 H443 L446 H479 N485 V488	F395-F481 HydrophobicContact CD1-CE1 4.16Å; F395-F481 HydrophobicContact CD1-CZ 4.36Å; F395-F481 AromaticContact CD2-CE1 3.86Å; F395-F481 HydrophobicContact CD2-CE1 3.86Å; F395-F481 HydrophobicContact CD2-CZ 4.11Å; F395-F481 HydrophobicContact CE1-CE1 4.14Å; F395-F481 AromaticContact CE1-CZ 3.86Å; F395-F481 HydrophobicContact CE1-CZ 3.86Å; F395-F481 AromaticContact CE2-CE1 3.85Å; F395-F481 HydrophobicContact CE2-CE1 3.85Å; F395-F481 AromaticContact CE2-CZ 3.6Å; F395-F481 HydrophobicContact CE2-CZ 3.6Å; F395-F481 HydrophobicContact CG-CE1 4.01Å; F395-F481 HydrophobicContact CG-CZ 4.46Å; F395-F481 AromaticContact CZ-CE1 3.99Å; F395-F481 HydrophobicContact CZ-CE1 3.99Å; F395-F481 HydrophobicContact CZ-CE2 4.44Å; F395-F481 AromaticContact CZ-CZ 3.46Å; F395-F481 HydrophobicContact CZ-CZ 3.46Å; F395-F481 VanDerWaalsContact CZ-CZ 3.46Å; T439-F481 HydrophobicContact CG2-CB 4.42Å; L442-F481 HydrophobicContact CB-CB 4.25Å; L442-F481 HydrophobicContact CB-CD1 4.04Å; L442-F481 HydrophobicContact CB-CD2 3.43Å; L442-F481 VanDerWaalsContact CB-CD2 3.43Å; L442-F481 HydrophobicContact CB-CE1 4.25Å; L442-F481 HydrophobicContact CB-CE2 3.69Å; L442-F481 HydrophobicContact CB-CG 3.62Å; L442-F481 HydrophobicContact CB-CZ 4.09Å; L442-F481 HydrophobicContact CD1-CB 4.01Å; L442-F481 HydrophobicContact CD1-CD1 3.95Å; L442-F481 HydrophobicContact CD1-CG 3.92Å; L442-F481 HydrophobicContact CG-CD1 4.49Å; L442-F481 HydrophobicContact CG-CG 4.39Å; L442-F481 VanDerWaalsContact O-CE2 3.23Å; L442-F481 WeakPolarHBondContact O-CE2 3.34Å; H443-F481 AromaticContact CE1-CD2 3.86Å; H443-F481 AromaticContact ND1-CD2 3.76Å; L446-F481 HydrophobicContact CB-CE2 3.96Å; L446-F481 HydrophobicContact CB-CZ 4.24Å; L446-F481 HydrophobicContact CD2-CE2 3.78Å; L446-F481 HydrophobicContact CD2-CZ 4.03Å; L446-F481 HydrophobicContact CG-CE2 4.48Å; H479-F481 PolarHBondContact O-N 3.36Å; F481-N485 WeakPolarHBondContact O-CB 3.26Å; F481-N485 PolarHBondContact O-ND2 2.04Å; F481-V488 HydrophobicContact CE1-CG2 4.02Å; F481-V488 HydrophobicContact CZ-CG2 4.14Å
482	F	92.5	Very high	91.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	-92.8	-32.1	-176.4	-67.4	-67.3	0	0	0	116.5	F388 E392 F395 H480 G484 V488 M492 L494	F388-F482 HydrophobicContact CB-CD2 3.7Å; F388-F482 HydrophobicContact CB-CE2 4.26Å; F388-F482 HydrophobicContact CD1-CB 3.88Å; F388-F482 HydrophobicContact CD1-CD2 4.18Å; F388-F482 HydrophobicContact CD1-CG 4.21Å; F388-F482 HydrophobicContact CE1-CB 4.18Å; F388-F482 HydrophobicContact CG-CB 4.31Å; F388-F482 HydrophobicContact CG-CD2 4.08Å; E392-F482 HydrophobicContact CB-CE2 4.35Å; E392-F482 HydrophobicContact CG-CD2 4.3Å; E392-F482 HydrophobicContact CG-CE2 3.52Å; E392-F482 HydrophobicContact CG-CZ 4.43Å; F395-F482 HydrophobicContact CB-CZ 4.07Å; H480-F482 PolarHBondContact ND1-N 2.92Å; H480-F482 VanDerWaalsContact ND1-N 3.19Å; H480-F482 PolarHBondContact O-N 3.19Å; F482-G484 PolarHBondContact O-N 3.26Å; F482-V488 HydrophobicContact CD1-CG1 4.11Å; F482-V488 HydrophobicContact CD1-CG2 4.26Å; F482-V488 HydrophobicContact CE1-CG1 4.02Å; F482-M492 HydrophobicContact CE1-CE 4.29Å; F482-L494 HydrophobicContact CB-CD2 4.34Å; F482-L494 HydrophobicContact CD1-CD1 3.61Å; F482-L494 HydrophobicContact CD1-CD2 3.94Å; F482-L494 HydrophobicContact CD1-CG 4.36Å; F482-L494 HydrophobicContact CE1-CD1 4.29Å; F482-L494 HydrophobicContact CG-CD1 4.48Å; F482-L494 HydrophobicContact CG-CD2 4.27Å
483	V	89.9	Confident	90.9	Very high	3 Å²	3	53.7 Å²	53.7	2%	0.018	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	120.3	-170.7	-172.5	0	0	0	0	110	F388 H480 N485 V498 A501 I504	F388-V483 HydrophobicContact CE1-CG2 4.48Å; F388-V483 HydrophobicContact CE2-CG2 3.68Å; F388-V483 HydrophobicContact CZ-CG2 3.61Å; H480-V483 HydrophobicContact CB-CB 4.38Å; H480-V483 HydrophobicContact CB-CG2 4.43Å; V483-N485 PolarHBondContact O-N 3.43Å; V483-V498 HydrophobicContact CB-CG1 4.41Å; V483-V498 HydrophobicContact CG2-CG1 4.1Å; V483-A501 HydrophobicContact CG1-CB 3.69Å; V483-I504 HydrophobicContact CB-CD1 4.12Å; V483-I504 HydrophobicContact CB-CG1 4.19Å; V483-I504 HydrophobicContact CG1-CD1 3.71Å; V483-I504 HydrophobicContact CG1-CG1 3.77Å; V483-I504 HydrophobicContact CG2-CD1 4.12Å
484	G	86.4	Confident	90.7	Very high	11 Å²	11	53.8 Å²	53.8	11%	0.113	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	6.8	-177.8	0	0	0	0	0	115.2	F482 R486 V498 A501	F482-G484 PolarHBondContact O-N 3.26Å; G484-R486 PolarHBondContact O-N 3.31Å; G484-V498 PolarHBondContact N-O 3.17Å; G484-A501 WeakPolarHBondContact CA-O 3.47Å
485	N	90.2	Very high	90.5	Very high	24 Å²	24	50.5 Å²	50.5	13%	0.128	27%	0.268	C	S	.	.			trans	-90.7	101.9	-180	-173.2	-2.8	0	0	0	111.4	F481 V483 K487 V488	F481-N485 WeakPolarHBondContact O-CB 3.26Å; F481-N485 PolarHBondContact O-ND2 2.04Å; V483-N485 PolarHBondContact O-N 3.43Å; N485-K487 PolarHBondContact O-N 2.97Å; N485-K487 WeakPolarHBondContact OD1-CB 3.36Å; N485-K487 PolarHBondContact OD1-N 3.01Å; N485-V488 HydrophobicContact CB-CG2 4.01Å
486	R	86.8	Confident	90.2	Very high	173 Å²	173	48.9 Å²	48.9	65%	0.653	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-12.2	-179.1	-60.7	-178.9	-178.4	179.7	-0.6	114.1	G484	G484-R486 PolarHBondContact O-N 3.31Å
487	K	89.2	Confident	89.8	Confident	101 Å²	101	48 Å²	48	44%	0.439	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-14.4	180	-61	-176.5	-174.8	-177.9	0	112.8	Q108 D109 L446 N485	Q108-K487 WeakPolarHBondContact O-CE 3.35Å; Q108-K487 PolarHBondContact O-NZ 3.48Å; D109-K487 WeakPolarHBondContact OD1-CE 3.46Å; D109-K487 IonicContact OD1-NZ 2.95Å; L446-K487 HydrophobicContact CD2-CB 3.73Å; L446-K487 HydrophobicContact CG-CB 4.36Å; N485-K487 PolarHBondContact O-N 2.97Å; N485-K487 WeakPolarHBondContact OD1-CB 3.36Å; N485-K487 PolarHBondContact OD1-N 3.01Å
488	V	90.5	Very high	89.5	Confident	5 Å²	5	44.7 Å²	44.7	3%	0.03	25%	0.246	C	C	.	.	S	Bend	trans	-67.5	130.6	176.8	-178	0	0	0	0	109.4	L446 F481 F482 N485 E490 M492 L494	L446-V488 HydrophobicContact CD2-CG2 4.48Å; F481-V488 HydrophobicContact CE1-CG2 4.02Å; F481-V488 HydrophobicContact CZ-CG2 4.14Å; F482-V488 HydrophobicContact CD1-CG1 4.11Å; F482-V488 HydrophobicContact CD1-CG2 4.26Å; F482-V488 HydrophobicContact CE1-CG1 4.02Å; N485-V488 HydrophobicContact CB-CG2 4.01Å; V488-E490 PolarHBondContact O-N 2.9Å; V488-M492 HydrophobicContact CG1-CB 4.34Å; V488-M492 HydrophobicContact CG1-CG 3.97Å; V488-L494 HydrophobicContact CB-CD1 4.22Å; V488-L494 HydrophobicContact CG1-CD1 3.72Å
489	P	87.9	Confident	89.2	Confident	67 Å²	67	46.4 Å²	46.4	44%	0.435	25%	0.252	S	S	.	.			trans	-57.2	135.3	-177.8	-26.3	34.3	0	0	0	113.3	A491 M492	P489-A491 PolarHBondContact O-N 3.44Å; P489-A491 VanDerWaalsContact O-N 3.16Å; P489-M492 VanDerWaalsContact O-CB 3.3Å; P489-M492 WeakPolarHBondContact O-CB 3.31Å; P489-M492 WeakPolarHBondContact O-CG 3.32Å; P489-M492 PolarHBondContact O-N 3.06Å
490	E	86.5	Confident	88.8	Confident	153 Å²	153	53.2 Å²	53.2	72%	0.715	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-59.5	-28.1	177.9	-64.7	-174.5	164	0	0	113.1	V488 M492 G493	V488-E490 PolarHBondContact O-N 2.9Å; E490-M492 PolarHBondContact O-N 3.01Å; E490-G493 PolarHBondContact O-N 3.49Å
491	A	87.9	Confident	88.5	Confident	103 Å²	103	53 Å²	53	85%	0.851	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-57.9	-14.9	174.8	0	0	0	0	0	113.8	P489 G493	P489-A491 PolarHBondContact O-N 3.44Å; P489-A491 VanDerWaalsContact O-N 3.16Å; A491-G493 PolarHBondContact O-N 3.47Å
492	M	87.4	Confident	88	Confident	26 Å²	26	58.1 Å²	58.1	13%	0.128	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-71.7	-14.5	173.3	-70.3	-65.7	-62.2	0	0	113.5	Y391 Q394 F395 F482 V488 P489 E490 L494	Y391-M492 HydrophobicContact CD1-CE 4.25Å; Y391-M492 VanDerWaalsContact CE1-O 3.29Å; Y391-M492 WeakPolarHBondContact CE1-O 3.35Å; Y391-M492 VanDerWaalsContact O-CE 3.32Å; Y391-M492 WeakPolarHBondContact O-CE 3.41Å; Q394-M492 HydrophobicContact CB-CE 4.14Å; Q394-M492 HydrophobicContact CG-CE 4.11Å; Q394-M492 HydrophobicContact CG-SD 4.37Å; F395-M492 HydrophobicContact CB-CE 3.76Å; F395-M492 HydrophobicContact CB-SD 4.4Å; F482-M492 HydrophobicContact CE1-CE 4.29Å; V488-M492 HydrophobicContact CG1-CB 4.34Å; V488-M492 HydrophobicContact CG1-CG 3.97Å; P489-M492 VanDerWaalsContact O-CB 3.3Å; P489-M492 WeakPolarHBondContact O-CB 3.31Å; P489-M492 WeakPolarHBondContact O-CG 3.32Å; P489-M492 PolarHBondContact O-N 3.06Å; E490-M492 PolarHBondContact O-N 3.01Å; M492-L494 VanDerWaalsContact C-N 3.32Å; M492-L494 HydrophobicContact CB-CD1 4.47Å; M492-L494 HydrophobicContact CB-CG 4.34Å; M492-L494 PolarHBondContact O-N 2.93Å
493	G	88.9	Confident	87.7	Confident	48 Å²	48	59.8 Å²	59.8	50%	0.495	31%	0.311	S	S	.	.			trans	71.6	20.2	175.6	0	0	0	0	0	115.2	E490 A491	E490-G493 PolarHBondContact O-N 3.49Å; A491-G493 PolarHBondContact O-N 3.47Å
494	L	90.4	Very high	87.6	Confident	7 Å²	7	60.5 Å²	60.5	4%	0.037	32%	0.315	C	S	.	.			trans	-61.9	137.5	180	-70.2	162.2	0	0	0	111.6	F388 Y391 F482 V488 M492 E496 R499	F388-L494 HydrophobicContact CD1-CD2 4.5Å; Y391-L494 HydrophobicContact CD1-CD2 3.64Å; Y391-L494 HydrophobicContact CD1-CG 4.26Å; Y391-L494 HydrophobicContact CD2-CD2 3.86Å; Y391-L494 HydrophobicContact CE1-CD2 3.71Å; Y391-L494 HydrophobicContact CE1-CG 4.19Å; Y391-L494 HydrophobicContact CE2-CD2 3.92Å; Y391-L494 HydrophobicContact CG-CD2 3.72Å; F482-L494 HydrophobicContact CB-CD2 4.34Å; F482-L494 HydrophobicContact CD1-CD1 3.61Å; F482-L494 HydrophobicContact CD1-CD2 3.94Å; F482-L494 HydrophobicContact CD1-CG 4.36Å; F482-L494 HydrophobicContact CE1-CD1 4.29Å; F482-L494 HydrophobicContact CG-CD1 4.48Å; F482-L494 HydrophobicContact CG-CD2 4.27Å; V488-L494 HydrophobicContact CB-CD1 4.22Å; V488-L494 HydrophobicContact CG1-CD1 3.72Å; M492-L494 VanDerWaalsContact C-N 3.32Å; M492-L494 HydrophobicContact CB-CD1 4.47Å; M492-L494 HydrophobicContact CB-CG 4.34Å; M492-L494 PolarHBondContact O-N 2.93Å; L494-E496 PolarHBondContact O-N 3.04Å; L494-R499 PolarHBondContact O-NH2 2.77Å
495	P	90.1	Very high	87.7	Confident	19 Å²	19	61.6 Å²	61.6	12%	0.123	32%	0.318	C	S	.	.			trans	-55.5	138.1	175.7	-25.7	33.9	0	0	0	112.5	Y358 L363 V497 V498 R499	Y358-P495 HydrophobicContact CD1-CB 4.37Å; Y358-P495 HydrophobicContact CD1-CG 3.99Å; Y358-P495 HydrophobicContact CE1-CB 4.08Å; Y358-P495 HydrophobicContact CE1-CG 4.22Å; L363-P495 HydrophobicContact CD2-CG 4.42Å; P495-V497 PolarHBondContact O-N 3.33Å; P495-V497 VanDerWaalsContact O-N 3.17Å; P495-V498 HydrophobicContact CB-CG2 4.31Å; P495-V498 WeakPolarHBondContact O-CB 3.32Å; P495-V498 PolarHBondContact O-N 3.11Å; P495-R499 PolarHBondContact O-N 3.43Å; P495-R499 VanDerWaalsContact O-N 3.14Å
496	E	87.1	Confident	87.7	Confident	83 Å²	83	62.1 Å²	62.1	39%	0.388	32%	0.321	S	S	.	.	H	α-helix	trans	-55.6	-36.2	-179.7	-75.7	-62.6	127.1	0	0	112.8	L494 V498 R499 R500	L494-E496 PolarHBondContact O-N 3.04Å; E496-V498 VanDerWaalsContact C-N 3.26Å; E496-V498 PolarHBondContact O-N 3.01Å; E496-R499 PolarHBondContact O-N 2.95Å; E496-R499 IonicContact OE1-CZ 3.07Å; E496-R499 VanDerWaalsContact OE1-CZ 3.31Å; E496-R499 IonicContact OE1-NH1 2.78Å; E496-R499 PolarHBondContact OE1-NH1 3.49Å; E496-R499 IonicContact OE1-NH2 2.8Å; E496-R500 WeakPolarHBondContact O-CB 3.15Å; E496-R500 WeakPolarHBondContact O-CG 3.38Å; E496-R500 PolarHBondContact O-N 3.11Å; E496-R500 IonicContact OE2-CZ 3.33Å; E496-R500 IonicContact OE2-NE 2.7Å; E496-R500 PolarHBondContact OE2-NE 3.43Å; E496-R500 IonicContact OE2-NH2 3.38Å; E496-R500 PolarHBondContact OE2-NH2 3.36Å
497	V	85.7	Confident	87.9	Confident	53 Å²	53	53.9 Å²	53.9	32%	0.321	29%	0.29	S	S	.	.	H	α-helix	trans	-57.3	-40.5	177	-177.1	0	0	0	0	111.1	L226 S229 P495 A501	L226-V497 HydrophobicContact CB-CG1 4.34Å; L226-V497 HydrophobicContact CD1-CB 4.09Å; L226-V497 HydrophobicContact CD1-CG1 3.76Å; S229-V497 WeakPolarHBondContact OG-CG1 3.36Å; P495-V497 PolarHBondContact O-N 3.33Å; P495-V497 VanDerWaalsContact O-N 3.17Å; V497-A501 WeakPolarHBondContact O-CB 3.44Å; V497-A501 PolarHBondContact O-N 3.35Å
498	V	87.4	Confident	87.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-75.3	-40.9	178.6	175.9	0	0	0	0	111.4	L363 F388 V483 G484 P495 E496 R500 A501	L363-V498 HydrophobicContact CD2-CG2 4Å; F388-V498 HydrophobicContact CE1-CG1 3.73Å; F388-V498 HydrophobicContact CE1-CG2 4.27Å; F388-V498 HydrophobicContact CZ-CG1 3.88Å; F388-V498 HydrophobicContact CZ-CG2 4.29Å; V483-V498 HydrophobicContact CB-CG1 4.41Å; V483-V498 HydrophobicContact CG2-CG1 4.1Å; G484-V498 PolarHBondContact N-O 3.17Å; P495-V498 HydrophobicContact CB-CG2 4.31Å; P495-V498 WeakPolarHBondContact O-CB 3.32Å; P495-V498 PolarHBondContact O-N 3.11Å; E496-V498 VanDerWaalsContact C-N 3.26Å; E496-V498 PolarHBondContact O-N 3.01Å; V498-R500 VanDerWaalsContact C-N 3.31Å; V498-R500 PolarHBondContact O-N 2.89Å; V498-A501 WeakPolarHBondContact O-CB 3.16Å; V498-A501 PolarHBondContact O-N 2.98Å
499	R	87.1	Confident	87.6	Confident	39 Å²	39	54.3 Å²	54.3	15%	0.147	29%	0.293	C	S	.	.	H	α-helix	trans	-66.8	-33.9	-179	-165.3	-178.3	-56.1	140.9	16.2	112.3	L494 P495 E496	L494-R499 PolarHBondContact O-NH2 2.77Å; P495-R499 PolarHBondContact O-N 3.43Å; P495-R499 VanDerWaalsContact O-N 3.14Å; E496-R499 PolarHBondContact O-N 2.95Å; E496-R499 IonicContact OE1-CZ 3.07Å; E496-R499 VanDerWaalsContact OE1-CZ 3.31Å; E496-R499 IonicContact OE1-NH1 2.78Å; E496-R499 PolarHBondContact OE1-NH1 3.49Å; E496-R499 IonicContact OE1-NH2 2.8Å
500	R	85.8	Confident	87.7	Confident	188 Å²	188	51.4 Å²	51.4	71%	0.709	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-7.6	180	-62.6	179.9	-167.1	-164	1.4	114	E496 V498	E496-R500 WeakPolarHBondContact O-CB 3.15Å; E496-R500 WeakPolarHBondContact O-CG 3.38Å; E496-R500 PolarHBondContact O-N 3.11Å; E496-R500 IonicContact OE2-CZ 3.33Å; E496-R500 IonicContact OE2-NE 2.7Å; E496-R500 PolarHBondContact OE2-NE 3.43Å; E496-R500 IonicContact OE2-NH2 3.38Å; E496-R500 PolarHBondContact OE2-NH2 3.36Å; V498-R500 VanDerWaalsContact C-N 3.31Å; V498-R500 PolarHBondContact O-N 2.89Å
501	A	85.6	Confident	87.7	Confident	9 Å²	9	48.4 Å²	48.4	7%	0.074	27%	0.265	C	S	.	.	S	Bend	trans	-61.5	159.6	178.1	0	0	0	0	0	112.2	C228 V483 G484 V497 V498	C228-A501 HydrophobicContact CB-CB 3.86Å; C228-A501 VanDerWaalsContact O-CB 3.32Å; C228-A501 WeakPolarHBondContact O-CB 3.22Å; V483-A501 HydrophobicContact CG1-CB 3.69Å; G484-A501 WeakPolarHBondContact CA-O 3.47Å; V497-A501 WeakPolarHBondContact O-CB 3.44Å; V497-A501 PolarHBondContact O-N 3.35Å; V498-A501 WeakPolarHBondContact O-CB 3.16Å; V498-A501 PolarHBondContact O-N 2.98Å
502	E	84.1	Confident	87.5	Confident	109 Å²	109	49.2 Å²	49.2	51%	0.509	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-66.3	137.2	168.4	-170.2	179.2	-175.4	0	0	109.8	I504	E502-I504 PolarHBondContact O-N 2.91Å
503	P	87.4	Confident	87.5	Confident	34 Å²	34	50.8 Å²	50.8	22%	0.221	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-56.8	123.7	176.7	-25.9	34.6	0	0	0	112.5	H479	H479-P503 HydrophobicContact CB-CB 4.48Å
504	I	86.4	Confident	87.5	Confident	19 Å²	19	57.1 Å²	57.1	10%	0.097	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-82.3	122.6	179.7	-62.7	179.7	0	0	0	109.5	Q238 H479 H480 V483 E502	Q238-I504 HydrophobicContact CB-CD1 4.22Å; Q238-I504 HydrophobicContact CB-CG1 4.25Å; Q238-I504 HydrophobicContact CB-CG2 4.49Å; H479-I504 CarbonylContact C-O 3.43Å; H479-I504 VanDerWaalsContact CA-O 3.27Å; H479-I504 WeakPolarHBondContact CA-O 3.26Å; H480-I504 HydrophobicContact CB-CB 4.16Å; H480-I504 PolarHBondContact N-O 3.21Å; V483-I504 HydrophobicContact CB-CD1 4.12Å; V483-I504 HydrophobicContact CB-CG1 4.19Å; V483-I504 HydrophobicContact CG1-CD1 3.71Å; V483-I504 HydrophobicContact CG1-CG1 3.77Å; V483-I504 HydrophobicContact CG2-CD1 4.12Å; E502-I504 PolarHBondContact O-N 2.91Å
505	N	89.6	Confident	87.4	Confident	34 Å²	34	62.3 Å²	62.3	18%	0.182	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-86.1	110.5	173.8	-177.7	13.9	0	0	0	111.6	K476 K477 L478 F507 R508	K476-N505 PolarHBondContact O-ND2 3.44Å; K477-N505 WeakPolarHBondContact CA-OD1 3.2Å; L478-N505 PolarHBondContact N-OD1 3.42Å; L478-N505 CarbonylContact O-C 3.55Å; L478-N505 PolarHBondContact O-OD1 3.02Å; N505-F507 PolarHBondContact O-N 3.37Å; N505-F507 PolarHBondContact OD1-N 3.17Å; N505-R508 VanDerWaalsContact O-CB 3.27Å; N505-R508 WeakPolarHBondContact O-CB 3.2Å; N505-R508 PolarHBondContact O-N 2.94Å
506	L	89.7	Confident	87.4	Confident	34 Å²	34	63.6 Å²	63.6	18%	0.178	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-27.5	175.4	-58.6	-179	0	0	0	112.6	Y435 T439 L478 H480 R508 P509	Y435-L506 HydrophobicContact CD1-CD1 4.18Å; Y435-L506 HydrophobicContact CE1-CD1 3.91Å; Y435-L506 HydrophobicContact CE1-CD2 4.34Å; T439-L506 HydrophobicContact CG2-CD1 3.93Å; L478-L506 HydrophobicContact CD2-CD1 4.3Å; L478-L506 HydrophobicContact CG-CD1 4.37Å; L478-L506 WeakPolarHBondContact O-CB 3.32Å; L478-L506 PolarHBondContact O-N 3.25Å; H480-L506 HydrophobicContact CB-CD2 4.22Å; H480-L506 HydrophobicContact CB-CG 4.42Å; L506-R508 VanDerWaalsContact C-N 3.28Å; L506-R508 PolarHBondContact O-N 3.09Å; L506-P509 VanDerWaalsContact O-CD 3.24Å; L506-P509 WeakPolarHBondContact O-CD 3.28Å
507	F	92.1	Very high	87.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	11.3	178.2	-72.4	-5.4	0	0	0	113.7	L432 H436 L469 S472 L473 K476 L478 N505 P509 F510 V511	L432-F507 HydrophobicContact CD2-CE1 4Å; L432-F507 HydrophobicContact CD2-CZ 3.74Å; H436-F507 HydrophobicContact CB-CE1 4.23Å; H436-F507 AromaticContact CD2-CE1 3.6Å; H436-F507 AromaticContact CG-CE1 3.76Å; H436-F507 AromaticContact NE2-CE1 3.91Å; L469-F507 HydrophobicContact CD1-CE2 4.49Å; L469-F507 HydrophobicContact CD1-CZ 3.95Å; S472-F507 WeakPolarHBondContact O-CD2 3.27Å; L473-F507 HydrophobicContact CD2-CD2 4.42Å; L473-F507 HydrophobicContact CD2-CE2 3.8Å; L473-F507 HydrophobicContact CD2-CZ 4.01Å; L473-F507 HydrophobicContact CG-CE2 3.98Å; L473-F507 HydrophobicContact CG-CZ 4.38Å; K476-F507 WeakPolarHBondContact O-CB 3.46Å; L478-F507 HydrophobicContact CB-CB 4.45Å; L478-F507 HydrophobicContact CB-CD1 3.99Å; L478-F507 HydrophobicContact CB-CD2 3.6Å; L478-F507 HydrophobicContact CB-CE1 4.13Å; L478-F507 HydrophobicContact CB-CE2 3.75Å; L478-F507 HydrophobicContact CB-CG 3.74Å; L478-F507 HydrophobicContact CB-CZ 4.01Å; L478-F507 HydrophobicContact CD2-CD1 4.3Å; L478-F507 HydrophobicContact CD2-CE1 3.71Å; L478-F507 HydrophobicContact CD2-CE2 4.21Å; L478-F507 HydrophobicContact CD2-CZ 3.66Å; L478-F507 HydrophobicContact CG-CZ 4.48Å; N505-F507 PolarHBondContact O-N 3.37Å; N505-F507 PolarHBondContact OD1-N 3.17Å; F507-P509 VanDerWaalsContact C-N 3.27Å; F507-F510 HydrophobicContact CB-CD2 3.68Å; F507-F510 HydrophobicContact CB-CE2 4.19Å; F507-F510 HydrophobicContact CB-CG 4.43Å; F507-F510 AromaticContact CD1-CD2 3.76Å; F507-F510 HydrophobicContact CD1-CD2 3.76Å; F507-F510 AromaticContact CD1-CE2 3.31Å; F507-F510 HydrophobicContact CD1-CE2 3.31Å; F507-F510 HydrophobicContact CD1-CZ 4.13Å; F507-F510 AromaticContact CD2-CD2 3.98Å; F507-F510 HydrophobicContact CD2-CD2 3.98Å; F507-F510 HydrophobicContact CD2-CE2 4.04Å; F507-F510 HydrophobicContact CE1-CD2 4.35Å; F507-F510 AromaticContact CE1-CE2 3.53Å; F507-F510 HydrophobicContact CE1-CE2 3.53Å; F507-F510 HydrophobicContact CE1-CZ 4.25Å; F507-F510 HydrophobicContact CE2-CE2 4.22Å; F507-F510 AromaticContact CG-CD2 3.55Å; F507-F510 HydrophobicContact CG-CD2 3.55Å; F507-F510 AromaticContact CG-CE2 3.59Å; F507-F510 HydrophobicContact CG-CE2 3.59Å; F507-F510 AromaticContact CZ-CE2 3.99Å; F507-F510 HydrophobicContact CZ-CE2 3.99Å; F507-F510 VanDerWaalsContact O-CB 3.31Å; F507-F510 WeakPolarHBondContact O-CB 3.49Å; F507-F510 PolarHBondContact O-N 3.42Å; F507-V511 PolarHBondContact O-N 2.87Å
508	R	87	Confident	88	Confident	81 Å²	81	61 Å²	61	31%	0.306	29%	0.292	S	S	.	.	H	α-helix	trans	-50.7	-39.9	171.7	-172.9	179.6	-171.8	94	12.6	113.5	L235 N505 L506 F510 V511 L512	L235-R508 VanDerWaalsContact CB-CZ 3.43Å; N505-R508 VanDerWaalsContact O-CB 3.27Å; N505-R508 WeakPolarHBondContact O-CB 3.2Å; N505-R508 PolarHBondContact O-N 2.94Å; L506-R508 VanDerWaalsContact C-N 3.28Å; L506-R508 PolarHBondContact O-N 3.09Å; R508-F510 PolarHBondContact O-N 2.9Å; R508-V511 WeakPolarHBondContact O-CB 3.46Å; R508-V511 PolarHBondContact O-N 3.42Å; R508-L512 HydrophobicContact CG-CD1 4.26Å; R508-L512 PolarHBondContact O-N 3.2Å
509	P	86.1	Confident	88.2	Confident	35 Å²	35	64.2 Å²	64.2	23%	0.227	31%	0.314	C	S	.	.	H	α-helix	trans	-56.7	-31.4	174.6	-26.9	37	0	0	0	113.7	L506 F507 V511 L512 Q513 L516	L506-P509 VanDerWaalsContact O-CD 3.24Å; L506-P509 WeakPolarHBondContact O-CD 3.28Å; F507-P509 VanDerWaalsContact C-N 3.27Å; P509-V511 VanDerWaalsContact C-N 3.33Å; P509-L512 PolarHBondContact O-N 2.91Å; P509-Q513 WeakPolarHBondContact O-CB 3.38Å; P509-Q513 PolarHBondContact O-N 3.21Å; P509-L516 HydrophobicContact CB-CD2 4.08Å
510	F	88.5	Confident	88.5	Confident	6 Å²	6	62.4 Å²	62.4	3%	0.026	31%	0.307	C	S	.	.	H	α-helix	trans	-74.5	-23.8	177.9	-57.4	-21	0	0	0	113.3	L473 F507 R508 L516 Y517 T520	L473-F510 HydrophobicContact CD2-CD2 4.09Å; L473-F510 HydrophobicContact CD2-CE2 3.68Å; F507-F510 HydrophobicContact CB-CD2 3.68Å; F507-F510 HydrophobicContact CB-CE2 4.19Å; F507-F510 HydrophobicContact CB-CG 4.43Å; F507-F510 AromaticContact CD1-CD2 3.76Å; F507-F510 HydrophobicContact CD1-CD2 3.76Å; F507-F510 AromaticContact CD1-CE2 3.31Å; F507-F510 HydrophobicContact CD1-CE2 3.31Å; F507-F510 HydrophobicContact CD1-CZ 4.13Å; F507-F510 AromaticContact CD2-CD2 3.98Å; F507-F510 HydrophobicContact CD2-CD2 3.98Å; F507-F510 HydrophobicContact CD2-CE2 4.04Å; F507-F510 HydrophobicContact CE1-CD2 4.35Å; F507-F510 AromaticContact CE1-CE2 3.53Å; F507-F510 HydrophobicContact CE1-CE2 3.53Å; F507-F510 HydrophobicContact CE1-CZ 4.25Å; F507-F510 HydrophobicContact CE2-CE2 4.22Å; F507-F510 AromaticContact CG-CD2 3.55Å; F507-F510 HydrophobicContact CG-CD2 3.55Å; F507-F510 AromaticContact CG-CE2 3.59Å; F507-F510 HydrophobicContact CG-CE2 3.59Å; F507-F510 AromaticContact CZ-CE2 3.99Å; F507-F510 HydrophobicContact CZ-CE2 3.99Å; F507-F510 VanDerWaalsContact O-CB 3.31Å; F507-F510 WeakPolarHBondContact O-CB 3.49Å; F507-F510 PolarHBondContact O-N 3.42Å; R508-F510 PolarHBondContact O-N 2.9Å; F510-L516 HydrophobicContact CD1-CD2 4.04Å; F510-L516 HydrophobicContact CD1-CG 4.03Å; F510-L516 HydrophobicContact CE1-CD2 4.02Å; F510-L516 HydrophobicContact CE1-CG 3.96Å; F510-Y517 HydrophobicContact CB-CD2 3.8Å; F510-Y517 HydrophobicContact CB-CG 4.27Å; F510-Y517 HydrophobicContact CD2-CD2 4.46Å; F510-Y517 HydrophobicContact CG-CD2 4.2Å; F510-T520 HydrophobicContact CE1-CG2 4.31Å; F510-T520 HydrophobicContact CE2-CG2 4.31Å; F510-T520 HydrophobicContact CZ-CG2 3.81Å
511	V	87.3	Confident	88.9	Confident	89 Å²	89	54.2 Å²	54.2	54%	0.539	28%	0.278	S	S	.	.	H	α-helix	trans	-72.2	-41.7	170.6	-176.9	0	0	0	0	110.1	K476 F507 R508 P509	K476-V511 HydrophobicContact CB-CG2 3.85Å; K476-V511 HydrophobicContact CD-CG2 4.44Å; F507-V511 PolarHBondContact O-N 2.87Å; R508-V511 WeakPolarHBondContact O-CB 3.46Å; R508-V511 PolarHBondContact O-N 3.42Å; P509-V511 VanDerWaalsContact C-N 3.33Å
512	L	84.2	Confident	89.2	Confident	120 Å²	120	58.3 Å²	58.3	63%	0.628	30%	0.299	S	S	*	.	H	α-helix	trans	-81.5	-33.1	-175.5	-60.3	176.4	0	0	0	113.3	R508 P509	R508-L512 HydrophobicContact CG-CD1 4.26Å; R508-L512 PolarHBondContact O-N 3.2Å; P509-L512 PolarHBondContact O-N 2.91Å
513	Q	86.2	Confident	89.6	Confident	60 Å²	60	53.5 Å²	53.5	28%	0.28	28%	0.277	S	S	.	.			trans	-120.3	95.6	-171.7	-59.2	-179.1	19.9	0	0	111.1	P509 T515 L516 Y517	P509-Q513 WeakPolarHBondContact O-CB 3.38Å; P509-Q513 PolarHBondContact O-N 3.21Å; Q513-T515 VanDerWaalsContact C-N 3.34Å; Q513-T515 PolarHBondContact O-N 3.03Å; Q513-L516 HydrophobicContact CB-CB 3.86Å; Q513-L516 HydrophobicContact CB-CD2 4.49Å; Q513-L516 PolarHBondContact O-N 3.49Å; Q513-Y517 PolarHBondContact O-N 2.94Å
514	R	88.9	Confident	89.9	Confident	180 Å²	180	52 Å²	52	68%	0.679	27%	0.268	S	S	*	.	H	α-helix	trans	-60	-39.2	-177.9	-176.1	169.2	-179.7	152.9	5.1	113.1	Y517 H518	R514-Y517 PolarHBondContact O-N 3.43Å; R514-H518 PolarHBondContact O-CD2 3Å; R514-H518 PolarHBondContact O-N 3.28Å
515	T	89.9	Confident	90.2	Very high	116 Å²	116	52.7 Å²	52.7	71%	0.712	27%	0.269	S	S	*	.	H	α-helix	trans	-67.8	-43.4	-179.9	50	0	0	0	0	112.3	Q513 Y517 H518 S519	Q513-T515 VanDerWaalsContact C-N 3.34Å; Q513-T515 PolarHBondContact O-N 3.03Å; T515-Y517 VanDerWaalsContact C-N 3.32Å; T515-Y517 PolarHBondContact O-N 2.96Å; T515-H518 PolarHBondContact O-N 3.16Å; T515-S519 WeakPolarHBondContact O-CB 3.44Å; T515-S519 PolarHBondContact O-N 3.33Å
516	L	89.8	Confident	90.2	Very high	46 Å²	46	55.3 Å²	55.3	24%	0.241	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-44.8	175	178.5	64.3	0	0	0	110.7	P509 F510 Q513 T520	P509-L516 HydrophobicContact CB-CD2 4.08Å; F510-L516 HydrophobicContact CD1-CD2 4.04Å; F510-L516 HydrophobicContact CD1-CG 4.03Å; F510-L516 HydrophobicContact CE1-CD2 4.02Å; F510-L516 HydrophobicContact CE1-CG 3.96Å; Q513-L516 HydrophobicContact CB-CB 3.86Å; Q513-L516 HydrophobicContact CB-CD2 4.49Å; Q513-L516 PolarHBondContact O-N 3.49Å; L516-T520 VanDerWaalsContact O-CB 3.25Å; L516-T520 WeakPolarHBondContact O-CB 3.32Å; L516-T520 PolarHBondContact O-N 3.43Å; L516-T520 PolarHBondContact O-OG1 2.96Å
517	Y	93.1	Very high	90.4	Very high	18 Å²	18	53.9 Å²	53.9	7%	0.071	27%	0.272	C	S	.	.	H	α-helix	trans	-58	-55.5	176.4	171.9	-111.6	0	0	0	112.1	L473 K476 F510 Q513 R514 T515 S519 T520 V521	L473-Y517 VanDerWaalsContact O-CE2 3.25Å; L473-Y517 WeakPolarHBondContact O-CE2 3.45Å; K476-Y517 HydrophobicContact CD-CD2 4.45Å; K476-Y517 HydrophobicContact CD-CE2 4.34Å; K476-Y517 VanDerWaalsContact CE-CE1 3.47Å; K476-Y517 HydrophobicContact CG-CD2 4.08Å; K476-Y517 HydrophobicContact CG-CE2 3.74Å; F510-Y517 HydrophobicContact CB-CD2 3.8Å; F510-Y517 HydrophobicContact CB-CG 4.27Å; F510-Y517 HydrophobicContact CD2-CD2 4.46Å; F510-Y517 HydrophobicContact CG-CD2 4.2Å; Q513-Y517 PolarHBondContact O-N 2.94Å; R514-Y517 PolarHBondContact O-N 3.43Å; T515-Y517 VanDerWaalsContact C-N 3.32Å; T515-Y517 PolarHBondContact O-N 2.96Å; Y517-S519 PolarHBondContact O-N 3.46Å; Y517-T520 PolarHBondContact O-N 3.21Å; Y517-T520 VanDerWaalsContact O-N 3.11Å; Y517-V521 HydrophobicContact CD2-CG2 3.84Å; Y517-V521 HydrophobicContact CE1-CG2 4.29Å; Y517-V521 HydrophobicContact CE2-CG2 3.36Å; Y517-V521 HydrophobicContact CG-CG2 4.49Å; Y517-V521 WeakPolarHBondContact O-CG2 3.44Å; Y517-V521 PolarHBondContact O-N 3.27Å
518	H	91.3	Very high	90.4	Very high	64 Å²	64	54.1 Å²	54.1	30%	0.296	27%	0.274	S	S	.	.	H	α-helix	trans	-58.8	-48.3	-179.1	-78.3	-64.2	0	0	0	111.9	R514 T515 T520 V521 D522	R514-H518 PolarHBondContact O-CD2 3Å; R514-H518 PolarHBondContact O-N 3.28Å; T515-H518 PolarHBondContact O-N 3.16Å; H518-T520 PolarHBondContact O-N 2.96Å; H518-V521 PolarHBondContact O-N 3.42Å; H518-D522 WeakPolarHBondContact O-CB 3.49Å; H518-D522 PolarHBondContact O-N 2.93Å
519	S	92.4	Very high	90.5	Very high	68 Å²	68	57.3 Å²	57.3	48%	0.476	29%	0.29	S	S	.	.	H	α-helix	trans	-60.2	-33.7	177.6	-179.2	0	0	0	0	112.8	T515 Y517 S523	T515-S519 WeakPolarHBondContact O-CB 3.44Å; T515-S519 PolarHBondContact O-N 3.33Å; Y517-S519 PolarHBondContact O-N 3.46Å; S519-S523 VanDerWaalsContact O-CB 3.26Å; S519-S523 WeakPolarHBondContact O-CB 3.36Å; S519-S523 PolarHBondContact O-N 3.4Å; S519-S523 VanDerWaalsContact O-N 3.08Å
520	T	93.6	Very high	90.7	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-74.3	-42.5	178.9	-59.9	0	0	0	0	111.7	G431 L432 L473 F510 L516 Y517 H518 S523 F524	G431-T520 VanDerWaalsContact CA-OG1 3.28Å; G431-T520 WeakPolarHBondContact CA-OG1 3.44Å; G431-T520 PolarHBondContact N-OG1 3.3Å; L432-T520 HydrophobicContact CB-CG2 4.4Å; L432-T520 HydrophobicContact CD1-CG2 4.19Å; L432-T520 HydrophobicContact CD2-CG2 4.44Å; L432-T520 HydrophobicContact CG-CG2 3.61Å; L473-T520 HydrophobicContact CD2-CG2 4.24Å; F510-T520 HydrophobicContact CE1-CG2 4.31Å; F510-T520 HydrophobicContact CE2-CG2 4.31Å; F510-T520 HydrophobicContact CZ-CG2 3.81Å; L516-T520 VanDerWaalsContact O-CB 3.25Å; L516-T520 WeakPolarHBondContact O-CB 3.32Å; L516-T520 PolarHBondContact O-N 3.43Å; L516-T520 PolarHBondContact O-OG1 2.96Å; Y517-T520 PolarHBondContact O-N 3.21Å; Y517-T520 VanDerWaalsContact O-N 3.11Å; H518-T520 PolarHBondContact O-N 2.96Å; T520-S523 PolarHBondContact O-N 3.09Å; T520-F524 WeakPolarHBondContact O-CB 3.43Å; T520-F524 PolarHBondContact O-N 3.07Å
521	V	93.4	Very high	90.7	Very high	17 Å²	17	58 Å²	58	10%	0.103	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-45.2	176.4	171.9	0	0	0	0	110.8	L473 Y517 H518 F524 Y525	L473-V521 HydrophobicContact CB-CG2 4.49Å; Y517-V521 HydrophobicContact CD2-CG2 3.84Å; Y517-V521 HydrophobicContact CE1-CG2 4.29Å; Y517-V521 HydrophobicContact CE2-CG2 3.36Å; Y517-V521 HydrophobicContact CG-CG2 4.49Å; Y517-V521 WeakPolarHBondContact O-CG2 3.44Å; Y517-V521 PolarHBondContact O-N 3.27Å; H518-V521 PolarHBondContact O-N 3.42Å; V521-F524 WeakPolarHBondContact O-CB 3.3Å; V521-F524 PolarHBondContact O-N 3.41Å; V521-Y525 HydrophobicContact CG1-CD2 3.67Å; V521-Y525 HydrophobicContact CG1-CE2 3.53Å; V521-Y525 VanDerWaalsContact O-CD2 3.25Å; V521-Y525 WeakPolarHBondContact O-CD2 3.38Å; V521-Y525 PolarHBondContact O-N 2.71Å
522	D	91.8	Very high	90.8	Very high	95 Å²	95	56 Å²	56	51%	0.508	28%	0.281	S	S	.	.	H	α-helix	trans	-59.9	-48.8	176.2	-70.5	-23.4	0	0	0	110.8	H518 F524 Y525 E526	H518-D522 WeakPolarHBondContact O-CB 3.49Å; H518-D522 PolarHBondContact O-N 2.93Å; D522-F524 VanDerWaalsContact C-N 3.29Å; D522-F524 PolarHBondContact O-N 2.92Å; D522-Y525 PolarHBondContact O-N 3.37Å; D522-E526 WeakPolarHBondContact O-CB 3.48Å; D522-E526 WeakPolarHBondContact O-CG 3.36Å; D522-E526 PolarHBondContact O-N 3.09Å
523	S	92.8	Very high	90.9	Very high	8 Å²	8	54.6 Å²	54.6	6%	0.056	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-38.2	177	-171.8	0	0	0	0	112.6	S519 T520 M527	S519-S523 VanDerWaalsContact O-CB 3.26Å; S519-S523 WeakPolarHBondContact O-CB 3.36Å; S519-S523 PolarHBondContact O-N 3.4Å; S519-S523 VanDerWaalsContact O-N 3.08Å; T520-S523 PolarHBondContact O-N 3.09Å; S523-M527 WeakPolarHBondContact O-CB 3.46Å; S523-M527 PolarHBondContact O-N 3.49Å
524	F	93.6	Very high	90.9	Very high	3 Å²	3	52.5 Å²	52.5	1%	0.013	27%	0.268	C	S	.	.	H	α-helix	trans	-65	-47.8	176.3	174.3	-104.7	0	0	0	112.3	L432 F466 L469 E470 L473 T520 V521 D522 E526 M527 L528	L432-F524 HydrophobicContact CD1-CB 4.05Å; L432-F524 HydrophobicContact CD1-CD2 3.9Å; L432-F524 HydrophobicContact CD1-CG 4.32Å; F466-F524 HydrophobicContact CB-CZ 4.4Å; F466-F524 HydrophobicContact CD1-CE2 4.07Å; L469-F524 HydrophobicContact CB-CE2 4.39Å; L469-F524 HydrophobicContact CB-CZ 4.48Å; L469-F524 HydrophobicContact CD2-CD2 4.01Å; L469-F524 HydrophobicContact CD2-CE2 3.66Å; L469-F524 HydrophobicContact CG-CE2 4.27Å; E470-F524 HydrophobicContact CB-CE1 3.73Å; E470-F524 HydrophobicContact CB-CZ 4.07Å; E470-F524 HydrophobicContact CG-CE1 4.08Å; L473-F524 HydrophobicContact CD1-CB 4.04Å; L473-F524 HydrophobicContact CD1-CD1 3.78Å; L473-F524 HydrophobicContact CD1-CD2 4.2Å; L473-F524 HydrophobicContact CD1-CE1 4.28Å; L473-F524 HydrophobicContact CD1-CG 3.72Å; T520-F524 WeakPolarHBondContact O-CB 3.43Å; T520-F524 PolarHBondContact O-N 3.07Å; V521-F524 WeakPolarHBondContact O-CB 3.3Å; V521-F524 PolarHBondContact O-N 3.41Å; D522-F524 VanDerWaalsContact C-N 3.29Å; D522-F524 PolarHBondContact O-N 2.92Å; F524-E526 VanDerWaalsContact C-N 3.35Å; F524-E526 PolarHBondContact O-N 3.43Å; F524-M527 HydrophobicContact CD2-CE 3.75Å; F524-M527 HydrophobicContact CE2-CE 3.87Å; F524-M527 WeakPolarHBondContact O-CB 3.22Å; F524-M527 PolarHBondContact O-N 3.04Å; F524-L528 HydrophobicContact CD1-CD1 4.1Å; F524-L528 HydrophobicContact CE1-CD1 3.48Å; F524-L528 VanDerWaalsContact CE1-CD1 3.48Å; F524-L528 HydrophobicContact CE1-CG 4.36Å; F524-L528 HydrophobicContact CE2-CD1 4.21Å; F524-L528 HydrophobicContact CE2-CG 4.33Å; F524-L528 HydrophobicContact CZ-CD1 3.56Å; F524-L528 HydrophobicContact CZ-CD2 4.44Å; F524-L528 HydrophobicContact CZ-CG 4.15Å; F524-L528 WeakPolarHBondContact O-CG 3.41Å; F524-L528 PolarHBondContact O-N 3.04Å
525	Y	92.4	Very high	90.8	Very high	32 Å²	32	43.9 Å²	43.9	13%	0.125	24%	0.235	C	C	.	.	H	α-helix	trans	-68.1	-34.7	177.5	-77.7	-66.3	0	0	0	112.7	L126 E470 V521 D522 L528 K529	L126-Y525 HydrophobicContact CD2-CE2 3.75Å; L126-Y525 WeakPolarHBondContact CD2-OH 3.42Å; E470-Y525 HydrophobicContact CG-CE1 4.46Å; E470-Y525 WeakPolarHBondContact OE1-CE1 3.44Å; E470-Y525 PolarHBondContact OE1-OH 3.05Å; E470-Y525 VanDerWaalsContact OE1-OH 3.07Å; V521-Y525 HydrophobicContact CG1-CD2 3.67Å; V521-Y525 HydrophobicContact CG1-CE2 3.53Å; V521-Y525 VanDerWaalsContact O-CD2 3.25Å; V521-Y525 WeakPolarHBondContact O-CD2 3.38Å; V521-Y525 PolarHBondContact O-N 2.71Å; D522-Y525 PolarHBondContact O-N 3.37Å; Y525-L528 HydrophobicContact CD1-CD1 4.39Å; Y525-L528 PolarHBondContact O-N 3.42Å; Y525-K529 WeakPolarHBondContact O-CB 3.43Å; Y525-K529 PolarHBondContact O-N 3.41Å
526	E	91.4	Very high	90.6	Very high	90 Å²	90	40.8 Å²	40.8	42%	0.421	22%	0.218	S	C	.	.	H	α-helix	trans	-63.5	-43.7	171.8	-75.1	-176.6	165.9	0	0	111.8	Q423 T427 D522 F524 L528 K529 N530	Q423-E526 PolarHBondContact NE2-OE2 2.94Å; T427-E526 WeakPolarHBondContact CG2-OE2 3.07Å; D522-E526 WeakPolarHBondContact O-CB 3.48Å; D522-E526 WeakPolarHBondContact O-CG 3.36Å; D522-E526 PolarHBondContact O-N 3.09Å; F524-E526 VanDerWaalsContact C-N 3.35Å; F524-E526 PolarHBondContact O-N 3.43Å; E526-L528 VanDerWaalsContact C-N 3.32Å; E526-L528 PolarHBondContact O-N 3.09Å; E526-K529 PolarHBondContact O-N 3.47Å; E526-N530 WeakPolarHBondContact O-CB 3.34Å; E526-N530 PolarHBondContact O-N 3.34Å; E526-N530 PolarHBondContact O-ND2 3.01Å; E526-N530 VanDerWaalsContact O-ND2 3.16Å
527	M	93	Very high	90.3	Very high	3 Å²	3	43 Å²	43	2%	0.015	23%	0.228	C	C	.	.	H	α-helix	trans	-55.7	-48.3	173.8	-178.1	-169.7	69	0	0	111	L419 L420 Q423 F466 S523 F524 K529 N530 A531	L419-M527 HydrophobicContact CB-CG 3.95Å; L419-M527 HydrophobicContact CB-SD 3.92Å; L420-M527 VanDerWaalsContact CA-SD 3.6Å; L420-M527 HydrophobicContact CB-SD 4.07Å; L420-M527 HydrophobicContact CD1-SD 4.42Å; L420-M527 PolarHBondContact N-SD 3.04Å; Q423-M527 HydrophobicContact CB-CB 3.97Å; Q423-M527 HydrophobicContact CB-CG 4.04Å; Q423-M527 HydrophobicContact CG-CB 3.87Å; Q423-M527 HydrophobicContact CG-CG 4.49Å; F466-M527 HydrophobicContact CD1-CE 4.17Å; F466-M527 HydrophobicContact CE1-CE 3.65Å; F466-M527 HydrophobicContact CZ-CE 4.34Å; S523-M527 WeakPolarHBondContact O-CB 3.46Å; S523-M527 PolarHBondContact O-N 3.49Å; F524-M527 HydrophobicContact CD2-CE 3.75Å; F524-M527 HydrophobicContact CE2-CE 3.87Å; F524-M527 WeakPolarHBondContact O-CB 3.22Å; F524-M527 PolarHBondContact O-N 3.04Å; M527-K529 VanDerWaalsContact C-N 3.35Å; M527-K529 PolarHBondContact O-N 2.92Å; M527-N530 PolarHBondContact O-N 3.39Å; M527-A531 WeakPolarHBondContact O-CB 3.44Å; M527-A531 PolarHBondContact O-N 3.41Å
528	L	91.4	Very high	89.7	Confident	5 Å²	5	45.5 Å²	45.5	3%	0.026	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-40.2	178.8	-68.3	176.7	0	0	0	112.2	L131 L134 F466 F524 Y525 E526 N530 A531	L131-L528 HydrophobicContact CD2-CD1 3.47Å; L131-L528 VanDerWaalsContact CD2-CD1 3.47Å; L131-L528 HydrophobicContact CD2-CD2 4.28Å; L131-L528 HydrophobicContact CD2-CG 4.48Å; L134-L528 HydrophobicContact CD1-CB 3.67Å; F466-L528 HydrophobicContact CB-CD2 4.03Å; F466-L528 HydrophobicContact CD1-CD2 3.94Å; F466-L528 HydrophobicContact CD2-CD2 3.82Å; F466-L528 HydrophobicContact CE1-CD2 4.33Å; F466-L528 HydrophobicContact CE2-CD2 4.2Å; F466-L528 HydrophobicContact CG-CD2 3.67Å; F466-L528 HydrophobicContact CZ-CD2 4.44Å; F524-L528 HydrophobicContact CD1-CD1 4.1Å; F524-L528 HydrophobicContact CE1-CD1 3.48Å; F524-L528 VanDerWaalsContact CE1-CD1 3.48Å; F524-L528 HydrophobicContact CE1-CG 4.36Å; F524-L528 HydrophobicContact CE2-CD1 4.21Å; F524-L528 HydrophobicContact CE2-CG 4.33Å; F524-L528 HydrophobicContact CZ-CD1 3.56Å; F524-L528 HydrophobicContact CZ-CD2 4.44Å; F524-L528 HydrophobicContact CZ-CG 4.15Å; F524-L528 WeakPolarHBondContact O-CG 3.41Å; F524-L528 PolarHBondContact O-N 3.04Å; Y525-L528 HydrophobicContact CD1-CD1 4.39Å; Y525-L528 PolarHBondContact O-N 3.42Å; E526-L528 VanDerWaalsContact C-N 3.32Å; E526-L528 PolarHBondContact O-N 3.09Å; L528-N530 VanDerWaalsContact C-N 3.33Å; L528-A531 PolarHBondContact O-N 3.5Å
529	K	90.1	Very high	89.1	Confident	148 Å²	148	42.8 Å²	42.8	64%	0.643	23%	0.225	S	C	*	.	H	α-helix	trans	-65.1	-37.6	176.4	-175.3	-177.3	176.7	-173.7	0	111.9	L134 Y525 E526 M527	L134-K529 HydrophobicContact CD1-CB 4.44Å; L134-K529 HydrophobicContact CD2-CB 4.49Å; Y525-K529 WeakPolarHBondContact O-CB 3.43Å; Y525-K529 PolarHBondContact O-N 3.41Å; E526-K529 PolarHBondContact O-N 3.47Å; M527-K529 VanDerWaalsContact C-N 3.35Å; M527-K529 PolarHBondContact O-N 2.92Å
530	N	89.6	Confident	87.7	Confident	57 Å²	57	46.4 Å²	46.4	31%	0.305	24%	0.239	S	C	.	.	H	α-helix	trans	-81.8	-20	-179.2	-66.5	-25.2	0	0	0	112.9	Q423 E526 M527 L528 T533 L534	Q423-N530 PolarHBondContact OE1-ND2 3.45Å; E526-N530 WeakPolarHBondContact O-CB 3.34Å; E526-N530 PolarHBondContact O-N 3.34Å; E526-N530 PolarHBondContact O-ND2 3.01Å; E526-N530 VanDerWaalsContact O-ND2 3.16Å; M527-N530 PolarHBondContact O-N 3.39Å; L528-N530 VanDerWaalsContact C-N 3.33Å; N530-T533 PolarHBondContact O-N 3.29Å; N530-T533 VanDerWaalsContact O-N 3.16Å; N530-L534 HydrophobicContact CB-CD1 4.03Å; N530-L534 HydrophobicContact CB-CG 4.4Å; N530-L534 WeakPolarHBondContact O-CG 3.41Å; N530-L534 PolarHBondContact O-N 3.01Å
531	A	89.8	Confident	85.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-54.5	-46.3	-172.3	0	0	0	0	0	114.2	L419 M527 L528 T533 L534 I535	L419-A531 HydrophobicContact CD1-CB 3.84Å; L419-A531 HydrophobicContact CD2-CB 3.89Å; M527-A531 WeakPolarHBondContact O-CB 3.44Å; M527-A531 PolarHBondContact O-N 3.41Å; L528-A531 PolarHBondContact O-N 3.5Å; A531-T533 VanDerWaalsContact C-N 3.32Å; A531-T533 PolarHBondContact O-N 3.02Å; A531-L534 PolarHBondContact O-N 2.98Å; A531-I535 HydrophobicContact CB-CD1 4.41Å; A531-I535 WeakPolarHBondContact O-CB 3.35Å; A531-I535 WeakPolarHBondContact O-CD1 3.49Å; A531-I535 WeakPolarHBondContact O-CG1 3.48Å; A531-I535 PolarHBondContact O-N 3.03Å
532	P	87.8	Confident	83.5	Confident	47 Å²	47	56.5 Å²	56.5	31%	0.305	29%	0.29	S	S	.	.	H	α-helix	trans	-62	-39.3	179.5	-22.7	34.3	0	0	0	113.4	P137 S536	P137-P532 HydrophobicContact CG-CB 4.09Å; P137-P532 HydrophobicContact CG-CG 4.46Å; P532-S536 WeakPolarHBondContact O-CB 3.38Å; P532-S536 PolarHBondContact O-N 3.1Å; P532-S536 VanDerWaalsContact O-N 3.09Å; P532-S536 PolarHBondContact O-OG 3.14Å
533	T	87.3	Confident	81.1	Confident	89 Å²	89	57.1 Å²	57.1	55%	0.546	30%	0.302	S	S	.	.	H	α-helix	trans	-68.5	-46.8	177.5	-50.9	0	0	0	0	110.9	N530 A531 I535 S536 E537	N530-T533 PolarHBondContact O-N 3.29Å; N530-T533 VanDerWaalsContact O-N 3.16Å; A531-T533 VanDerWaalsContact C-N 3.32Å; A531-T533 PolarHBondContact O-N 3.02Å; T533-I535 PolarHBondContact O-N 3.1Å; T533-S536 PolarHBondContact O-N 3.43Å; T533-S536 PolarHBondContact O-OG 3.44Å; T533-E537 WeakPolarHBondContact O-CB 3.35Å; T533-E537 PolarHBondContact O-N 3.07Å
534	L	86.4	Confident	78.4	Confident	16 Å²	16	62 Å²	62	8%	0.084	34%	0.336	C	S	.	.	H	α-helix	trans	-61.9	-44.2	178.2	-71.5	172.8	0	0	0	111.7	L419 K422 N530 A531 S536 Y538	L419-L534 HydrophobicContact CD2-CB 4.22Å; L419-L534 HydrophobicContact CD2-CD1 4.17Å; K422-L534 HydrophobicContact CB-CD1 4.28Å; N530-L534 HydrophobicContact CB-CD1 4.03Å; N530-L534 HydrophobicContact CB-CG 4.4Å; N530-L534 WeakPolarHBondContact O-CG 3.41Å; N530-L534 PolarHBondContact O-N 3.01Å; A531-L534 PolarHBondContact O-N 2.98Å; L534-S536 VanDerWaalsContact C-N 3.34Å; L534-S536 PolarHBondContact O-N 3.47Å; L534-Y538 HydrophobicContact CD2-CE2 4.16Å; L534-Y538 WeakPolarHBondContact O-CB 3.38Å; L534-Y538 VanDerWaalsContact O-CD2 3.25Å; L534-Y538 WeakPolarHBondContact O-CD2 3.43Å; L534-Y538 PolarHBondContact O-N 3.42Å; L534-Y538 VanDerWaalsContact O-N 3.09Å
535	I	87	Confident	75.5	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-43.1	179.5	-71	164.4	0	0	0	110.5	P137 T141 L142 F145 L419 A531 T533 S539	P137-I535 HydrophobicContact CB-CG2 4.46Å; P137-I535 HydrophobicContact CG-CB 4.24Å; P137-I535 HydrophobicContact CG-CD1 3.75Å; P137-I535 HydrophobicContact CG-CG2 4.19Å; T141-I535 HydrophobicContact CG2-CG2 4.04Å; L142-I535 HydrophobicContact CD2-CD1 3.76Å; L142-I535 HydrophobicContact CD2-CG2 4.28Å; F145-I535 HydrophobicContact CB-CG2 3.79Å; F145-I535 HydrophobicContact CD1-CG2 4.41Å; F145-I535 HydrophobicContact CD2-CG2 4.25Å; F145-I535 HydrophobicContact CG-CG2 3.89Å; L419-I535 HydrophobicContact CD1-CD1 4.38Å; L419-I535 HydrophobicContact CD2-CD1 4.5Å; L419-I535 HydrophobicContact CD2-CG1 4.29Å; A531-I535 HydrophobicContact CB-CD1 4.41Å; A531-I535 WeakPolarHBondContact O-CB 3.35Å; A531-I535 WeakPolarHBondContact O-CD1 3.49Å; A531-I535 WeakPolarHBondContact O-CG1 3.48Å; A531-I535 PolarHBondContact O-N 3.03Å; T533-I535 PolarHBondContact O-N 3.1Å; I535-S539 VanDerWaalsContact O-CB 3.25Å; I535-S539 WeakPolarHBondContact O-CB 3.48Å; I535-S539 PolarHBondContact O-N 3.39Å; I535-S539 VanDerWaalsContact O-N 3.07Å; I535-S539 PolarHBondContact O-OG 3.34Å
536	S	84.3	Confident	73.1	Confident	50 Å²	50	79 Å²	79	35%	0.35	41%	0.412	S	S	.	.	H	α-helix	trans	-70.7	-41.8	179.5	55.3	0	0	0	0	113.2	P532 T533 L534 S539 L540	P532-S536 WeakPolarHBondContact O-CB 3.38Å; P532-S536 PolarHBondContact O-N 3.1Å; P532-S536 VanDerWaalsContact O-N 3.09Å; P532-S536 PolarHBondContact O-OG 3.14Å; T533-S536 PolarHBondContact O-N 3.43Å; T533-S536 PolarHBondContact O-OG 3.44Å; L534-S536 VanDerWaalsContact C-N 3.34Å; L534-S536 PolarHBondContact O-N 3.47Å; S536-S539 WeakPolarHBondContact O-CB 3.42Å; S536-S539 PolarHBondContact O-N 3.07Å; S536-L540 WeakPolarHBondContact O-CG 3.48Å; S536-L540 PolarHBondContact O-N 3.14Å; S536-L540 VanDerWaalsContact O-N 3.15Å
537	E	84.5	Confident	70.1	Confident	94 Å²	94	79.3 Å²	79.3	44%	0.439	43%	0.43	S	S	.	.	H	α-helix	trans	-62.1	-48.5	178.6	-173.8	-174.7	173.4	0	0	111.8	T533 S539 L540 H541	T533-E537 WeakPolarHBondContact O-CB 3.35Å; T533-E537 PolarHBondContact O-N 3.07Å; E537-S539 VanDerWaalsContact C-N 3.25Å; E537-S539 PolarHBondContact O-N 3.39Å; E537-L540 PolarHBondContact O-N 3.24Å; E537-H541 PolarHBondContact O-N 3.05Å
538	Y	81	Confident	67.2	Low	69 Å²	69	84.1 Å²	84.1	27%	0.271	46%	0.464	S	S	.	.	H	α-helix	trans	-75.4	-15.2	179.7	-78.4	-95.6	0	0	0	113.3	F418 K422 L534	F418-Y538 HydrophobicContact CE1-CD2 4.46Å; F418-Y538 HydrophobicContact CE1-CG 4.4Å; F418-Y538 AromaticContact CZ-CD1 3.76Å; F418-Y538 HydrophobicContact CZ-CD1 3.76Å; F418-Y538 HydrophobicContact CZ-CD2 4.19Å; F418-Y538 HydrophobicContact CZ-CE1 4.03Å; F418-Y538 HydrophobicContact CZ-CE2 4.45Å; F418-Y538 AromaticContact CZ-CG 3.83Å; F418-Y538 HydrophobicContact CZ-CG 3.83Å; K422-Y538 PolarHBondContact NZ-OH 3.37Å; L534-Y538 HydrophobicContact CD2-CE2 4.16Å; L534-Y538 WeakPolarHBondContact O-CB 3.38Å; L534-Y538 VanDerWaalsContact O-CD2 3.25Å; L534-Y538 WeakPolarHBondContact O-CD2 3.43Å; L534-Y538 PolarHBondContact O-N 3.42Å; L534-Y538 VanDerWaalsContact O-N 3.09Å
539	S	76.7	Confident	64.5	Low	7 Å²	7	89.4 Å²	89.4	5%	0.049	50%	0.499	C	S	.	.	H	α-helix	trans	-72.1	-39.5	167.1	-68.8	0	0	0	0	111.8	F145 H148 I535 S536 E537	F145-S539 WeakPolarHBondContact CA-OG 3.44Å; F145-S539 WeakPolarHBondContact CB-OG 3.43Å; H148-S539 PolarHBondContact ND1-O 3.16Å; I535-S539 VanDerWaalsContact O-CB 3.25Å; I535-S539 WeakPolarHBondContact O-CB 3.48Å; I535-S539 PolarHBondContact O-N 3.39Å; I535-S539 VanDerWaalsContact O-N 3.07Å; I535-S539 PolarHBondContact O-OG 3.34Å; S536-S539 WeakPolarHBondContact O-CB 3.42Å; S536-S539 PolarHBondContact O-N 3.07Å; E537-S539 VanDerWaalsContact C-N 3.25Å; E537-S539 PolarHBondContact O-N 3.39Å
540	L	63.5	Low	61.9	Low	145 Å²	145	87.7 Å²	87.7	76%	0.759	50%	0.503	S	S	*	.	H	α-helix	trans	-83.6	-33.9	-176.4	-66.2	170.4	0	0	0	113.2	S536 E537 V542	S536-L540 WeakPolarHBondContact O-CG 3.48Å; S536-L540 PolarHBondContact O-N 3.14Å; S536-L540 VanDerWaalsContact O-N 3.15Å; E537-L540 PolarHBondContact O-N 3.24Å; L540-V542 PolarHBondContact O-N 3.38Å
541	H	54.1	Low	59.4	Low	143 Å²	143	90.9 Å²	90.9	66%	0.662	53%	0.527	S	S	*	.			trans	-94.3	90.6	-179.9	-82.6	-49.3	0	0	0	112.5	E537	E537-H541 PolarHBondContact O-N 3.05Å
542	V	44.4	Very low	56.8	Low	85 Å²	85	100.5 Å²	100.5	52%	0.515	57%	0.568	S	S	.	*			trans	-126.6	99.7	149.1	177.6	0	0	0	0	109.2	H148 L540	H148-V542 WeakPolarHBondContact CE1-CB 3.44Å; H148-V542 WeakPolarHBondContact CE1-CG2 3.33Å; H148-V542 WeakPolarHBondContact ND1-CG2 3.42Å; L540-V542 PolarHBondContact O-N 3.38Å
543	S	41.6	Very low	54.4	Low	109 Å²	109	102.7 Å²	102.7	76%	0.762	59%	0.59	S	S	*	*			trans	-178.6	110.4	134.6	-170.8	0	0	0	0	109.1
544	S	36.6	Very low	52.3	Low	110 Å²	110	106.3 Å²	106.3	77%	0.769	61%	0.605	S	S	*	*	S	Bend	trans	-178.2	66.6	142.6	-177.2	0	0	0	0	110.2
545	D	33.7	Very low	50.2	Low	162 Å²	162	111.9 Å²	111.9	87%	0.866	64%	0.64	S	S	*	*	S	Bend	trans	-143.4	15.5	154.7	-118	-2.5	0	0	0	112.9
546	R	40.2	Very low	47.9	Very low	230 Å²	230	123.1 Å²	123.1	87%	0.868	70%	0.698	S	S	*	*			trans	-120.6	78.4	165.9	-79.5	-166.9	175.9	-172.7	1.8	109.6
547	A	30.3	Very low	46.1	Very low	97 Å²	97	126.8 Å²	126.8	80%	0.802	72%	0.716	S	S	*	*			trans	-106.7	80.3	155.8	0	0	0	0	0	108.2
548	S	31.3	Very low	44.1	Very low	104 Å²	104	128.5 Å²	128.5	73%	0.727	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-66.4	126.5	152.2	44.9	0	0	0	0	107.3
549	P	35.4	Very low	42	Very low	115 Å²	115	131.8 Å²	131.8	75%	0.747	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-64.5	145.3	176.8	26.3	-31.8	0	0	0	109.9
550	P	35.2	Very low	40	Very low	112 Å²	112	139.1 Å²	139.1	73%	0.727	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-64.2	150.9	-179.6	26.6	-33.3	0	0	0	111	K552	P550-K552 PolarHBondContact O-N 3.41Å
551	P	35.7	Very low	38.5	Very low	125 Å²	125	138.8 Å²	138.8	81%	0.812	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-63.7	129.3	178.8	27.2	-31.8	0	0	0	109.2	A553	P551-A553 PolarHBondContact O-N 3.24Å
552	K	36.8	Very low	37.4	Very low	201 Å²	201	138.5 Å²	138.5	87%	0.874	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-58.2	121	171.9	-73	179.9	177.8	178.6	0	108.3	P550 I554	P550-K552 PolarHBondContact O-N 3.41Å; K552-I554 PolarHBondContact O-N 3.47Å
553	A	36	Very low	36.9	Very low	93 Å²	93	142.3 Å²	142.3	77%	0.769	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-60.4	120.3	166.8	0	0	0	0	0	108.2	P551 T555	P551-A553 PolarHBondContact O-N 3.24Å; A553-T555 PolarHBondContact O-N 3.38Å
554	I	43.6	Very low	36.6	Very low	165 Å²	165	144.8 Å²	144.8	85%	0.846	84%	0.835	S	S	*	*			trans	-77.7	105.9	167.2	-62.7	169.7	0	0	0	105.5	K552	K552-I554 PolarHBondContact O-N 3.47Å
555	T	42.4	Very low	36.6	Very low	133 Å²	133	147.8 Å²	147.8	82%	0.816	84%	0.841	S	S	*	*			trans	-79.4	120.6	163.7	-10.5	0	0	0	0	107.6	A553	A553-T555 PolarHBondContact O-N 3.38Å
556	L	38.5	Very low	36.9	Very low	236 Å²	236	146.5 Å²	146.5	100%	1.236	84%	0.838	S	S	*	*			trans	-60.7	0	166.9	-85.1	158.6	0	0	0	111.6

Retrieved 556 of 556 residues in 547.8 ms (Link to these results)

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