A0A061IJW8_CRIGR Loading...

ubiquitinyl hydrolase 1

AlphaFold DB , UniProt , Accession A0A061IJW8, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 324 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	40.4	Very low	35.2	Very low	249 Å²	249	151.9 Å²	151.9	100%	1.227	83%	0.833	S	S	*	*				0	107.2	0	-80.4	163.1	164.5	0	0	107.7
2	A	37.8	Very low	35	Very low	96 Å²	96	149.3 Å²	149.3	79%	0.793	83%	0.825	S	S	*	*			trans	-72.7	177.1	160.9	0	0	0	0	0	109.1
3	P	44.1	Very low	35	Very low	118 Å²	118	151.7 Å²	151.7	77%	0.766	83%	0.834	S	S	*	*			cis	-130.4	176.1	8.8	33	-9.8	0	0	0	112.3
4	G	34.7	Very low	34.9	Very low	73 Å²	73	147.1 Å²	147.1	75%	0.753	83%	0.826	S	S	*	*			cis	92.5	81.6	26.6	0	0	0	0	0	110.9
5	V	36	Very low	34.9	Very low	131 Å²	131	146.1 Å²	146.1	79%	0.794	83%	0.831	S	S	*	*			trans	-136.9	108.7	166.9	-176.6	0	0	0	0	111	V7	V5-V7 HydrophobicContact CG1-CG1 4.36Å
6	R	32.4	Very low	35.4	Very low	201 Å²	201	147.5 Å²	147.5	76%	0.758	83%	0.834	S	S	*	*			trans	-80.2	140.9	156.9	169.7	-167.7	-81.5	-137.5	0.2	107.4	E8	R6-E8 HydrophobicContact CG-CG 4.31Å; R6-E8 IonicContact NH1-OE1 3.55Å; R6-E8 PolarHBondContact NH1-OE1 3.16Å
7	V	38.5	Very low	35.5	Very low	137 Å²	137	145.8 Å²	145.8	83%	0.83	83%	0.83	S	S	*	*			trans	-134	126.2	157.4	-87.4	0	0	0	0	109.7	V5	V5-V7 HydrophobicContact CG1-CG1 4.36Å
8	E	32.3	Very low	35.5	Very low	150 Å²	150	145.1 Å²	145.1	70%	0.701	83%	0.834	S	S	*	*			trans	-88.1	153	177.9	-66.5	177.9	165.8	0	0	110.3	R6	R6-E8 HydrophobicContact CG-CG 4.31Å; R6-E8 IonicContact NH1-OE1 3.55Å; R6-E8 PolarHBondContact NH1-OE1 3.16Å
9	G	29.1	Very low	35.7	Very low	66 Å²	66	142.3 Å²	142.3	68%	0.68	83%	0.83	S	S	*	*			trans	69.9	116.9	137	0	0	0	0	0	118.8
10	W	30.8	Very low	35.7	Very low	269 Å²	269	140.4 Å²	140.4	100%	1.019	83%	0.831	S	S	*	*				-134.1	128.9	129.5	-84.5	-24.6	0	0	0	111.2
11	E	31.6	Very low	35.8	Very low	181 Å²	181	144.8 Å²	144.8	85%	0.846	83%	0.834	S	S	*	*			trans	-72.4	140.4	178.5	-81.2	176.6	113.8	0	0	112.5
12	V	32.6	Very low	35.6	Very low	120 Å²	120	138.8 Å²	138.8	73%	0.727	81%	0.813	S	S	*	*				48.6	105.6	125.1	-164.9	0	0	0	0	117.5
13	L	34.3	Very low	35.6	Very low	181 Å²	181	139.1 Å²	139.1	95%	0.948	82%	0.816	S	S	*	*			trans	-112.3	113.3	146.6	-91	162.4	0	0	0	109.3	C15	L13-C15 PolarHBondContact O-N 3.17Å
14	A	33.7	Very low	35	Very low	87 Å²	87	145.1 Å²	145.1	72%	0.719	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-64.4	122.9	179.6	0	0	0	0	0	111.5
15	C	36	Very low	35.2	Very low	133 Å²	133	148 Å²	148	90%	0.899	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-89.3	124.3	160.7	-106	0	0	0	0	109	L13	L13-C15 PolarHBondContact O-N 3.17Å
16	L	41.8	Very low	35.3	Very low	168 Å²	168	147.7 Å²	147.7	88%	0.88	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-61.5	150.2	179	-79.6	149.5	0	0	0	112.3
17	P	36.7	Very low	35.2	Very low	118 Å²	118	141.7 Å²	141.7	77%	0.766	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-80.3	129.3	-170.6	26.9	-24.1	0	0	0	112.3	A19	P17-A19 PolarHBondContact O-N 2.93Å
18	C	35.8	Very low	35	Very low	133 Å²	133	143.5 Å²	143.5	90%	0.899	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-68.3	126.9	168.6	-160	0	0	0	0	109.4	A20	C18-A20 PolarHBondContact O-N 3.46Å
19	A	39.7	Very low	34.9	Very low	93 Å²	93	143.7 Å²	143.7	77%	0.769	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-62.7	122.5	-172.6	0	0	0	0	0	112.8	P17	P17-A19 PolarHBondContact O-N 2.93Å
20	A	36.5	Very low	35.2	Very low	103 Å²	103	145.6 Å²	145.6	85%	0.851	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-69	131.2	164.7	0	0	0	0	0	110.4	C18	C18-A20 PolarHBondContact O-N 3.46Å
21	R	36.8	Very low	35.3	Very low	233 Å²	233	138.6 Å²	138.6	88%	0.879	82%	0.817	S	S	*	*			trans	-106.9	147	162.6	-89.9	-175	173.8	-127.4	0.9	110
22	P	36.6	Very low	35.4	Very low	123 Å²	123	137.6 Å²	137.6	80%	0.799	81%	0.814	S	S	*	*			trans	-85.2	149.2	-152.1	32.5	-34.9	0	0	0	114.1
23	A	37.1	Very low	35.8	Very low	103 Å²	103	141.1 Å²	141.1	85%	0.851	82%	0.822	S	S	*	*			trans	-58.2	139.5	166.4	0	0	0	0	0	111.6
24	R	32	Very low	35.7	Very low	244 Å²	244	141.4 Å²	141.4	92%	0.921	82%	0.819	S	S	*	*			trans	-131.1	97.5	169.3	-151.7	-178	-159	-142.4	5.2	109.6
25	V	38.5	Very low	36.2	Very low	134 Å²	134	141.4 Å²	141.4	81%	0.812	82%	0.819	S	S	*	*			trans	-143.4	132.5	150	-129.6	0	0	0	0	104.8
26	P	38.8	Very low	35.9	Very low	125 Å²	125	142.6 Å²	142.6	81%	0.812	82%	0.816	S	S	*	*				-148.7	139.7	83.6	34.5	-15	0	0	0	114.4
27	G	31	Very low	35.7	Very low	75 Å²	75	140.9 Å²	140.9	77%	0.773	81%	0.811	S	S	*	*			trans	-130.6	71.3	161	0	0	0	0	0	108.4	L29	G27-L29 PolarHBondContact O-N 3.36Å
28	H	33.9	Very low	35.8	Very low	174 Å²	174	142.7 Å²	142.7	81%	0.806	81%	0.81	S	S	*	*			trans	-75.6	100.2	166.4	-115.9	64.3	0	0	0	106.9
29	L	29.6	Very low	36	Very low	154 Å²	154	145.3 Å²	145.3	81%	0.806	81%	0.809	S	S	*	*			trans	-94.4	93.4	158.9	-164.5	71.1	0	0	0	106.8	G27 V31	G27-L29 PolarHBondContact O-N 3.36Å; L29-V31 HydrophobicContact CD2-CG2 3.98Å; L29-V31 HydrophobicContact CG-CG2 3.93Å; L29-V31 PolarHBondContact O-N 3.24Å
30	V	35.9	Very low	36	Very low	107 Å²	107	143.2 Å²	143.2	65%	0.648	79%	0.785	S	S	*	*			trans	-67.4	107.6	161.6	-179.5	0	0	0	0	105.6	M32	V30-M32 HydrophobicContact CG1-CG 4.37Å
31	V	32.9	Very low	37.2	Very low	122 Å²	122	144.3 Å²	144.3	74%	0.739	78%	0.776	S	S	*	*			trans	-107.7	115.5	156.7	-174.7	0	0	0	0	106.1	L29	L29-V31 HydrophobicContact CD2-CG2 3.98Å; L29-V31 HydrophobicContact CG-CG2 3.93Å; L29-V31 PolarHBondContact O-N 3.24Å
32	M	32.5	Very low	38.7	Very low	160 Å²	160	138.3 Å²	138.3	79%	0.788	76%	0.762	S	S	*	*			trans	-56.6	137.8	-179.2	-69.4	165.3	54.9	0	0	110.6	V30 E34	V30-M32 HydrophobicContact CG1-CG 4.37Å; M32-E34 PolarHBondContact O-N 3.03Å; M32-E34 VanDerWaalsContact O-N 3.16Å
33	E	40.9	Very low	40.3	Very low	193 Å²	193	136.8 Å²	136.8	90%	0.902	74%	0.744	S	S	*	*			trans	-54.8	101.3	165.9	-173.5	166.4	-166.5	0	0	109.8
34	E	32.5	Very low	42.1	Very low	187 Å²	187	136.1 Å²	136.1	87%	0.874	72%	0.723	S	S	*	*			trans	-95.4	112.3	159.8	-95.1	-175.5	164.3	0	0	108.6	M32 L36	M32-E34 PolarHBondContact O-N 3.03Å; M32-E34 VanDerWaalsContact O-N 3.16Å; E34-L36 PolarHBondContact O-N 3.05Å; E34-L36 VanDerWaalsContact O-N 3.13Å
35	A	44.5	Very low	44.1	Very low	87 Å²	87	128.4 Å²	128.4	72%	0.719	70%	0.697	S	S	*	*			trans	-62.4	104.7	178.3	0	0	0	0	0	110.6
36	L	29.3	Very low	46.2	Very low	159 Å²	159	122.8 Å²	122.8	83%	0.832	66%	0.663	S	S	*	*			trans	-91.5	96.9	153.4	-83.3	160.7	0	0	0	106.9	E34 E38	E34-L36 PolarHBondContact O-N 3.05Å; E34-L36 VanDerWaalsContact O-N 3.13Å; L36-E38 PolarHBondContact O-N 3.19Å
37	V	38.7	Very low	48.1	Very low	131 Å²	131	120.4 Å²	120.4	79%	0.794	65%	0.646	S	S	*	*			trans	-65.4	84.5	162.7	-177.8	0	0	0	0	105.8	E39	V37-E39 PolarHBondContact O-N 2.75Å
38	E	38.2	Very low	50.5	Low	156 Å²	156	122.6 Å²	122.6	73%	0.729	63%	0.63	S	S	*	*			trans	-66.4	117.5	164.1	-75.2	-172.5	165	0	0	106.5	L36 L40	L36-E38 PolarHBondContact O-N 3.19Å; E38-L40 VanDerWaalsContact C-N 3.28Å; E38-L40 PolarHBondContact O-N 2.7Å
39	E	40.5	Very low	53	Low	188 Å²	188	120.6 Å²	120.6	88%	0.879	62%	0.616	S	S	*	*			trans	-57	98.5	165.4	-69.3	-166.9	156.6	0	0	107.5	V37	V37-E39 PolarHBondContact O-N 2.75Å
40	L	39.2	Very low	55.9	Low	50 Å²	50	114 Å²	114	26%	0.262	58%	0.581	S	S	.	*			trans	-61	134.5	174.8	-66.3	163.3	0	0	0	108	E38 D42 Q45	E38-L40 VanDerWaalsContact C-N 3.28Å; E38-L40 PolarHBondContact O-N 2.7Å; L40-D42 PolarHBondContact O-N 3.44Å; L40-Q45 HydrophobicContact CB-CG 3.51Å; L40-Q45 HydrophobicContact CD1-CG 4.2Å; L40-Q45 PolarHBondContact O-NE2 3.21Å
41	D	62	Low	58.3	Low	126 Å²	126	117.4 Å²	117.4	67%	0.674	58%	0.582	S	S	*	*			trans	-45	134.8	170.9	-117.7	-22.7	0	0	0	109.9	E43 E44 Q45	D41-E43 PolarHBondContact O-N 2.79Å; D41-E44 HydrophobicContact CB-CB 4.48Å; D41-E44 WeakPolarHBondContact O-CA 3.3Å; D41-E44 PolarHBondContact O-N 2.9Å; D41-Q45 PolarHBondContact O-N 3.32Å
42	D	67.8	Low	61	Low	107 Å²	107	118.2 Å²	118.2	57%	0.572	58%	0.576	S	S	*	*	H	α-helix	trans	-54.8	-29.6	-175.8	-71	-37.6	0	0	0	112.1	L40 L46 L101	L40-D42 PolarHBondContact O-N 3.44Å; D42-L46 WeakPolarHBondContact O-CB 3.17Å; D42-L46 PolarHBondContact O-N 3.04Å; D42-L101 HydrophobicContact CB-CD1 4.1Å
43	E	70.8	Confident	63.7	Low	90 Å²	90	113.7 Å²	113.7	42%	0.421	55%	0.553	S	S	.	*	H	α-helix	trans	-67.4	-41.3	173.6	-170.6	172	-171.8	0	0	112.6	D41 L46 V47 L101	D41-E43 PolarHBondContact O-N 2.79Å; E43-L46 PolarHBondContact O-N 3.26Å; E43-V47 VanDerWaalsContact O-CG2 3.28Å; E43-V47 WeakPolarHBondContact O-CG2 3.45Å; E43-V47 PolarHBondContact O-N 3.23Å; E43-L101 HydrophobicContact CB-CD2 3.61Å; E43-L101 HydrophobicContact CG-CD2 4Å
44	E	73.9	Confident	66.1	Low	90 Å²	90	110 Å²	110	42%	0.421	53%	0.534	S	S	.	.	H	α-helix	trans	-71.1	-36.4	178.2	-161.7	-176.8	163.2	0	0	111.5	D41 R48	D41-E44 HydrophobicContact CB-CB 4.48Å; D41-E44 WeakPolarHBondContact O-CA 3.3Å; D41-E44 PolarHBondContact O-N 2.9Å; E44-R48 WeakPolarHBondContact O-CB 3.45Å; E44-R48 WeakPolarHBondContact O-CG 3.13Å; E44-R48 PolarHBondContact O-N 3.34Å; E44-R48 IonicContact OE1-CZ 2.7Å; E44-R48 VanDerWaalsContact OE1-CZ 3.3Å; E44-R48 IonicContact OE1-NE 3.8Å; E44-R48 PolarHBondContact OE1-NE 3.14Å; E44-R48 IonicContact OE1-NH2 3.05Å; E44-R48 PolarHBondContact OE1-NH2 2.76Å
45	Q	75.8	Confident	68.8	Low	81 Å²	81	107.1 Å²	107.1	38%	0.379	52%	0.518	S	S	.	.	H	α-helix	trans	-63.5	-42.1	173.6	-62.2	-166.9	30.4	0	0	111.8	L40 D41 R48 R49	L40-Q45 HydrophobicContact CB-CG 3.51Å; L40-Q45 HydrophobicContact CD1-CG 4.2Å; L40-Q45 PolarHBondContact O-NE2 3.21Å; D41-Q45 PolarHBondContact O-N 3.32Å; Q45-R48 PolarHBondContact O-N 3.47Å; Q45-R49 PolarHBondContact O-N 3.12Å
46	L	81.7	Confident	71	Confident	17 Å²	17	109.4 Å²	109.4	9%	0.089	51%	0.514	C	S	.	.	H	α-helix	trans	-65.5	-47.1	178.3	-171.5	63.5	0	0	0	111.7	D42 E43 R48 R49 H50 E97 L98 L101	D42-L46 WeakPolarHBondContact O-CB 3.17Å; D42-L46 PolarHBondContact O-N 3.04Å; E43-L46 PolarHBondContact O-N 3.26Å; L46-R48 VanDerWaalsContact C-N 3.3Å; L46-R48 PolarHBondContact O-N 3.09Å; L46-R49 WeakPolarHBondContact O-CA 3.4Å; L46-R49 WeakPolarHBondContact O-CB 3.2Å; L46-R49 PolarHBondContact O-N 3.33Å; L46-H50 PolarHBondContact O-N 2.87Å; L46-E97 HydrophobicContact CD1-CB 4.35Å; L46-E97 HydrophobicContact CD2-CB 4.21Å; L46-L98 HydrophobicContact CD2-CD2 4.15Å; L46-L101 HydrophobicContact CD2-CB 4.12Å; L46-L101 HydrophobicContact CD2-CD2 3.96Å; L46-L101 HydrophobicContact CD2-CG 4.46Å
47	V	79.4	Confident	74	Confident	75 Å²	75	102.9 Å²	102.9	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-63.4	-36.5	177.6	171.5	0	0	0	0	111.8	E43 R49 H50 R51 L98	E43-V47 VanDerWaalsContact O-CG2 3.28Å; E43-V47 WeakPolarHBondContact O-CG2 3.45Å; E43-V47 PolarHBondContact O-N 3.23Å; V47-R49 VanDerWaalsContact C-N 3.32Å; V47-H50 PolarHBondContact O-N 3.32Å; V47-R51 WeakPolarHBondContact O-CB 3.35Å; V47-R51 PolarHBondContact O-N 2.73Å; V47-L98 HydrophobicContact CG2-CD2 4.37Å
48	R	80.6	Confident	76.5	Confident	120 Å²	120	102 Å²	102	45%	0.453	47%	0.467	S	S	.	.	H	α-helix	trans	-64.2	-37.3	173.5	-76.1	173.1	179.8	-159.5	5	111.8	E44 Q45 L46 K52	E44-R48 WeakPolarHBondContact O-CB 3.45Å; E44-R48 WeakPolarHBondContact O-CG 3.13Å; E44-R48 PolarHBondContact O-N 3.34Å; E44-R48 IonicContact OE1-CZ 2.7Å; E44-R48 VanDerWaalsContact OE1-CZ 3.3Å; E44-R48 IonicContact OE1-NE 3.8Å; E44-R48 PolarHBondContact OE1-NE 3.14Å; E44-R48 IonicContact OE1-NH2 3.05Å; E44-R48 PolarHBondContact OE1-NH2 2.76Å; Q45-R48 PolarHBondContact O-N 3.47Å; L46-R48 VanDerWaalsContact C-N 3.3Å; L46-R48 PolarHBondContact O-N 3.09Å; R48-K52 PolarHBondContact O-N 3.11Å
49	R	86.6	Confident	79.1	Confident	133 Å²	133	97.8 Å²	97.8	50%	0.502	46%	0.459	S	S	.	.	H	α-helix	trans	-66.2	-49.7	174.7	-167.9	-174.6	-59.3	168.4	3	111.3	Q45 L46 V47 R51 K52 E53	Q45-R49 PolarHBondContact O-N 3.12Å; L46-R49 WeakPolarHBondContact O-CA 3.4Å; L46-R49 WeakPolarHBondContact O-CB 3.2Å; L46-R49 PolarHBondContact O-N 3.33Å; V47-R49 VanDerWaalsContact C-N 3.32Å; R49-R51 PolarHBondContact O-N 3.03Å; R49-K52 WeakPolarHBondContact O-CB 3.11Å; R49-K52 PolarHBondContact O-N 2.92Å; R49-E53 WeakPolarHBondContact CG-OE1 3.47Å; R49-E53 PolarHBondContact O-N 3.19Å
50	H	90.3	Very high	81.5	Confident	16 Å²	16	94.7 Å²	94.7	7%	0.074	44%	0.443	C	S	.	.	H	α-helix	trans	-54.7	-39.6	176.1	-68.2	177	0	0	0	112.5	L46 V47 K52 E53 K54 H94 E97	L46-H50 PolarHBondContact O-N 2.87Å; V47-H50 PolarHBondContact O-N 3.32Å; H50-K52 VanDerWaalsContact C-N 3.35Å; H50-K52 PolarHBondContact O-N 3.37Å; H50-E53 PolarHBondContact O-N 2.89Å; H50-K54 WeakPolarHBondContact O-CB 3.45Å; H50-K54 PolarHBondContact O-N 2.83Å; H50-H94 VanDerWaalsContact CA-CE1 3.5Å; H50-H94 WeakPolarHBondContact CA-CE1 3.48Å; H50-H94 AromaticContact CD2-CD2 3.27Å; H50-H94 PolarHBondContact CD2-CD2 3.16Å; H50-H94 AromaticContact CD2-CE1 3.91Å; H50-H94 AromaticContact CD2-CG 3.62Å; H50-H94 AromaticContact CD2-NE2 3.48Å; H50-H94 PolarHBondContact CD2-NE2 2.94Å; H50-H94 AromaticContact CE1-CG 3.88Å; H50-H94 PolarHBondContact CE1-O 3.12Å; H50-H94 AromaticContact CG-CD2 3.7Å; H50-H94 AromaticContact CG-CE1 3.81Å; H50-H94 AromaticContact CG-CG 3.56Å; H50-H94 AromaticContact CG-ND1 3.64Å; H50-H94 AromaticContact CG-NE2 3.86Å; H50-H94 AromaticContact ND1-CG 3.75Å; H50-H94 AromaticContact NE2-CD2 3.53Å; H50-H94 AromaticContact NE2-CG 3.82Å; H50-H94 PolarHBondContact O-CE1 3.1Å; H50-E97 IonicContact CD2-OE2 2.67Å; H50-E97 IonicContact CE1-OE2 3.71Å; H50-E97 IonicContact NE2-OE2 3.05Å; H50-E97 PolarHBondContact NE2-OE2 3.08Å
51	R	86.1	Confident	84	Confident	177 Å²	177	92.7 Å²	92.7	67%	0.668	43%	0.432	S	S	*	.	H	α-helix	trans	-66.5	-33.8	177.2	-169.7	177.4	-178.2	-166.2	0.8	113.1	V47 R49 K55	V47-R51 WeakPolarHBondContact O-CB 3.35Å; V47-R51 PolarHBondContact O-N 2.73Å; R49-R51 PolarHBondContact O-N 3.03Å; R51-K55 WeakPolarHBondContact O-CG 3.23Å; R51-K55 PolarHBondContact O-N 3.12Å
52	K	89.5	Confident	85.3	Confident	139 Å²	139	91.7 Å²	91.7	60%	0.604	42%	0.423	S	S	*	.	H	α-helix	trans	-71.1	-48.1	175.5	-70.9	178.1	-178.5	-179.8	0	110.3	R48 R49 H50 K54 K55 E56	R48-K52 PolarHBondContact O-N 3.11Å; R49-K52 WeakPolarHBondContact O-CB 3.11Å; R49-K52 PolarHBondContact O-N 2.92Å; H50-K52 VanDerWaalsContact C-N 3.35Å; H50-K52 PolarHBondContact O-N 3.37Å; K52-K54 VanDerWaalsContact C-N 3.3Å; K52-K54 PolarHBondContact O-N 3.38Å; K52-K55 WeakPolarHBondContact O-CB 3.3Å; K52-K55 PolarHBondContact O-N 3.38Å; K52-E56 PolarHBondContact O-N 2.89Å
53	E	89.8	Confident	86.4	Confident	66 Å²	66	88.5 Å²	88.5	31%	0.308	42%	0.416	S	S	.	.	H	α-helix	trans	-60.5	-38.8	179	-68.2	173.1	-173.5	0	0	112.3	R49 H50 K55 E56 L57 H94	R49-E53 WeakPolarHBondContact CG-OE1 3.47Å; R49-E53 PolarHBondContact O-N 3.19Å; H50-E53 PolarHBondContact O-N 2.89Å; E53-K55 VanDerWaalsContact C-N 3.33Å; E53-K55 PolarHBondContact O-N 2.76Å; E53-E56 PolarHBondContact O-N 2.82Å; E53-L57 WeakPolarHBondContact O-CB 3.31Å; E53-L57 PolarHBondContact O-N 3.02Å; E53-H94 IonicContact OE2-CD2 3.66Å; E53-H94 IonicContact OE2-CE1 2.78Å; E53-H94 IonicContact OE2-NE2 2.63Å; E53-H94 PolarHBondContact OE2-NE2 3.07Å
54	K	90.4	Very high	87.2	Confident	115 Å²	115	86.8 Å²	86.8	50%	0.5	41%	0.408	S	S	.	.	H	α-helix	trans	-63.5	-37.1	174.5	-173.8	166.5	-175.1	167.8	0	112.7	H50 K52 Q58 M90	H50-K54 WeakPolarHBondContact O-CB 3.45Å; H50-K54 PolarHBondContact O-N 2.83Å; K52-K54 VanDerWaalsContact C-N 3.3Å; K52-K54 PolarHBondContact O-N 3.38Å; K54-Q58 WeakPolarHBondContact O-CG 3.35Å; K54-Q58 PolarHBondContact O-N 2.82Å; K54-Q58 VanDerWaalsContact O-N 3.09Å; K54-M90 HydrophobicContact CB-CE 4.09Å; K54-M90 HydrophobicContact CB-SD 4.49Å; K54-M90 HydrophobicContact CD-CE 4.48Å; K54-M90 HydrophobicContact CG-CE 3.92Å
55	K	90.4	Very high	87.9	Confident	126 Å²	126	87 Å²	87	55%	0.548	41%	0.408	S	S	.	.	H	α-helix	trans	-69.2	-41.2	175.4	-73.4	176.5	176.8	-173.6	0	111.6	R51 K52 E53 L57 Q58 A59	R51-K55 WeakPolarHBondContact O-CG 3.23Å; R51-K55 PolarHBondContact O-N 3.12Å; K52-K55 WeakPolarHBondContact O-CB 3.3Å; K52-K55 PolarHBondContact O-N 3.38Å; E53-K55 VanDerWaalsContact C-N 3.33Å; E53-K55 PolarHBondContact O-N 2.76Å; K55-L57 VanDerWaalsContact C-N 3.35Å; K55-Q58 PolarHBondContact O-N 2.9Å; K55-A59 PolarHBondContact O-N 3.49Å
56	E	91.2	Very high	88.5	Confident	135 Å²	135	88.9 Å²	88.9	63%	0.631	42%	0.421	S	S	*	.	H	α-helix	trans	-64.1	-40.5	176.2	-70.8	172.4	-167.4	0	0	111.5	K52 E53 Q58 A59 K60	K52-E56 PolarHBondContact O-N 2.89Å; E53-E56 PolarHBondContact O-N 2.82Å; E56-Q58 PolarHBondContact O-N 3.09Å; E56-A59 PolarHBondContact O-N 2.93Å; E56-K60 PolarHBondContact O-N 2.85Å
57	L	91.8	Very high	88.8	Confident	23 Å²	23	91.9 Å²	91.9	12%	0.12	45%	0.448	C	S	.	.	H	α-helix	trans	-62.3	-43.4	174.2	-174	67.5	0	0	0	111.5	E53 K55 A59 K60 I61 L86 E87 M90	E53-L57 WeakPolarHBondContact O-CB 3.31Å; E53-L57 PolarHBondContact O-N 3.02Å; K55-L57 VanDerWaalsContact C-N 3.35Å; L57-A59 VanDerWaalsContact C-N 3.34Å; L57-A59 PolarHBondContact O-N 2.84Å; L57-K60 WeakPolarHBondContact O-CB 3.46Å; L57-K60 PolarHBondContact O-N 2.92Å; L57-I61 HydrophobicContact CD2-CD1 4.34Å; L57-I61 HydrophobicContact CG-CD1 3.92Å; L57-I61 HydrophobicContact CG-CG1 4.39Å; L57-I61 VanDerWaalsContact O-CG1 3.27Å; L57-I61 WeakPolarHBondContact O-CG1 3.5Å; L57-I61 PolarHBondContact O-N 3.35Å; L57-L86 HydrophobicContact CD1-CB 4.12Å; L57-E87 HydrophobicContact CD2-CG 4.08Å; L57-M90 HydrophobicContact CB-CE 4.34Å; L57-M90 HydrophobicContact CD2-CB 3.95Å; L57-M90 HydrophobicContact CD2-CE 3.29Å; L57-M90 HydrophobicContact CD2-CG 4.15Å; L57-M90 HydrophobicContact CG-CE 4.42Å
58	Q	90.2	Very high	89.1	Confident	112 Å²	112	89.5 Å²	89.5	52%	0.523	43%	0.434	S	S	.	.	H	α-helix	trans	-62.3	-40.2	176.3	-75.6	180	-13	0	0	112.4	K54 K55 E56 K60 I61 Q62	K54-Q58 WeakPolarHBondContact O-CG 3.35Å; K54-Q58 PolarHBondContact O-N 2.82Å; K54-Q58 VanDerWaalsContact O-N 3.09Å; K55-Q58 PolarHBondContact O-N 2.9Å; E56-Q58 PolarHBondContact O-N 3.09Å; Q58-K60 VanDerWaalsContact C-N 3.34Å; Q58-I61 PolarHBondContact O-N 3.16Å; Q58-Q62 WeakPolarHBondContact O-CB 3.42Å; Q58-Q62 PolarHBondContact O-N 3.22Å
59	A	92.4	Very high	89.1	Confident	67 Å²	67	87.6 Å²	87.6	55%	0.554	44%	0.437	S	S	*	.	H	α-helix	trans	-62.5	-41.7	173.7	0	0	0	0	0	111.6	K55 E56 L57 Q62 G63	K55-A59 PolarHBondContact O-N 3.49Å; E56-A59 PolarHBondContact O-N 2.93Å; L57-A59 VanDerWaalsContact C-N 3.34Å; L57-A59 PolarHBondContact O-N 2.84Å; A59-Q62 PolarHBondContact O-N 3.34Å; A59-G63 PolarHBondContact O-N 2.87Å
60	K	91.8	Very high	88.7	Confident	124 Å²	124	90.1 Å²	90.1	54%	0.539	45%	0.452	S	S	.	.	H	α-helix	trans	-64.3	-44.4	175.7	-170.1	175.9	-178.2	179.4	0	112.4	E56 L57 Q58 Q62 G63 M64	E56-K60 PolarHBondContact O-N 2.85Å; L57-K60 WeakPolarHBondContact O-CB 3.46Å; L57-K60 PolarHBondContact O-N 2.92Å; Q58-K60 VanDerWaalsContact C-N 3.34Å; K60-Q62 VanDerWaalsContact C-N 3.29Å; K60-Q62 PolarHBondContact O-N 3.3Å; K60-G63 PolarHBondContact O-N 3.41Å; K60-M64 WeakPolarHBondContact O-CG 3.39Å; K60-M64 PolarHBondContact O-N 3.34Å
61	I	91.6	Very high	88.2	Confident	8 Å²	8	97 Å²	97	4%	0.041	49%	0.489	C	S	.	.	H	α-helix	trans	-59.2	-42.9	175.5	-70.2	165.6	0	0	0	110.3	L57 Q58 M64 K65 V83 E87	L57-I61 HydrophobicContact CD2-CD1 4.34Å; L57-I61 HydrophobicContact CG-CD1 3.92Å; L57-I61 HydrophobicContact CG-CG1 4.39Å; L57-I61 VanDerWaalsContact O-CG1 3.27Å; L57-I61 WeakPolarHBondContact O-CG1 3.5Å; L57-I61 PolarHBondContact O-N 3.35Å; Q58-I61 PolarHBondContact O-N 3.16Å; I61-M64 PolarHBondContact O-N 3.41Å; I61-K65 HydrophobicContact CG2-CD 3.99Å; I61-K65 HydrophobicContact CG2-CG 4.43Å; I61-K65 WeakPolarHBondContact O-CB 3.34Å; I61-K65 WeakPolarHBondContact O-CG 3.42Å; I61-K65 PolarHBondContact O-N 3.02Å; I61-V83 HydrophobicContact CD1-CG1 3.94Å; I61-V83 HydrophobicContact CG1-CG1 4.05Å; I61-V83 HydrophobicContact CG1-CG2 4.24Å; I61-V83 HydrophobicContact CG2-CG1 3.95Å; I61-V83 HydrophobicContact CG2-CG2 3.96Å; I61-E87 HydrophobicContact CD1-CG 3.82Å; I61-E87 WeakPolarHBondContact CD1-OE1 3.29Å
62	Q	89.5	Confident	88.1	Confident	104 Å²	104	91.4 Å²	91.4	49%	0.486	47%	0.472	S	S	.	.	H	α-helix	trans	-65.2	-40	177.6	-168.5	64.4	5.6	0	0	111.8	Q58 A59 K60 K65 N66	Q58-Q62 WeakPolarHBondContact O-CB 3.42Å; Q58-Q62 PolarHBondContact O-N 3.22Å; A59-Q62 PolarHBondContact O-N 3.34Å; K60-Q62 VanDerWaalsContact C-N 3.29Å; K60-Q62 PolarHBondContact O-N 3.3Å; Q62-K65 PolarHBondContact O-N 3.31Å; Q62-N66 PolarHBondContact O-N 3.41Å; Q62-N66 PolarHBondContact O-ND2 3.47Å
63	G	90.5	Very high	87.9	Confident	41 Å²	41	93.7 Å²	93.7	42%	0.423	48%	0.482	S	S	.	.	H	α-helix	trans	-59.4	-46.7	171.9	0	0	0	0	0	112.8	A59 K60 K65 N66 A67	A59-G63 PolarHBondContact O-N 2.87Å; K60-G63 PolarHBondContact O-N 3.41Å; G63-K65 VanDerWaalsContact C-N 3.34Å; G63-K65 PolarHBondContact O-N 2.86Å; G63-N66 PolarHBondContact O-N 3.29Å; G63-A67 PolarHBondContact O-N 3.46Å
64	M	87.9	Confident	87.8	Confident	53 Å²	53	99.3 Å²	99.3	26%	0.261	51%	0.506	S	S	.	.	H	α-helix	trans	-64.7	-36.7	177.6	-65.8	177.8	71.4	0	0	112.4	K60 I61 N66 A67 L79 D82 L86	K60-M64 WeakPolarHBondContact O-CG 3.39Å; K60-M64 PolarHBondContact O-N 3.34Å; I61-M64 PolarHBondContact O-N 3.41Å; M64-N66 VanDerWaalsContact C-N 3.34Å; M64-A67 PolarHBondContact O-N 3.3Å; M64-L79 HydrophobicContact CB-CD1 3.52Å; M64-L79 HydrophobicContact CE-CD1 4.02Å; M64-D82 HydrophobicContact CE-CB 4.29Å; M64-L86 HydrophobicContact CE-CD1 4.47Å; M64-L86 HydrophobicContact SD-CD1 3.99Å
65	K	88.4	Confident	87.5	Confident	94 Å²	94	101.6 Å²	101.6	41%	0.409	51%	0.511	S	S	.	.	H	α-helix	trans	-65.6	-35.1	173.9	-76.2	175.2	178.7	177	0	113.1	I61 Q62 G63 L79	I61-K65 HydrophobicContact CG2-CD 3.99Å; I61-K65 HydrophobicContact CG2-CG 4.43Å; I61-K65 WeakPolarHBondContact O-CB 3.34Å; I61-K65 WeakPolarHBondContact O-CG 3.42Å; I61-K65 PolarHBondContact O-N 3.02Å; Q62-K65 PolarHBondContact O-N 3.31Å; G63-K65 VanDerWaalsContact C-N 3.34Å; G63-K65 PolarHBondContact O-N 2.86Å; K65-L79 HydrophobicContact CB-CD2 4.49Å; K65-L79 HydrophobicContact CG-CD2 4.07Å
66	N	88.8	Confident	87.3	Confident	121 Å²	121	100.6 Å²	100.6	65%	0.647	50%	0.504	S	S	*	.	H	α-helix	trans	-76.3	-29.8	177.7	-68.7	-15.6	0	0	0	112.5	Q62 G63 M64 V68	Q62-N66 PolarHBondContact O-N 3.41Å; Q62-N66 PolarHBondContact O-ND2 3.47Å; G63-N66 PolarHBondContact O-N 3.29Å; M64-N66 VanDerWaalsContact C-N 3.34Å; N66-V68 VanDerWaalsContact C-N 3.29Å; N66-V68 PolarHBondContact O-N 2.91Å
67	A	87.1	Confident	87.2	Confident	81 Å²	81	100.9 Å²	100.9	67%	0.669	50%	0.503	S	S	*	.	H	α-helix	trans	-72.1	-18.8	178.5	0	0	0	0	0	113.9	G63 M64	G63-A67 PolarHBondContact O-N 3.46Å; M64-A67 PolarHBondContact O-N 3.3Å
68	V	86.7	Confident	87.1	Confident	25 Å²	25	104.5 Å²	104.5	15%	0.152	52%	0.519	C	S	.	.	S	Bend	trans	-104.8	113.5	-179.8	-177.2	0	0	0	0	110.6	N66 R75 R76 L79	N66-V68 VanDerWaalsContact C-N 3.29Å; N66-V68 PolarHBondContact O-N 2.91Å; V68-R75 HydrophobicContact CG1-CB 3.76Å; V68-R76 HydrophobicContact CG1-CG 3.73Å; V68-L79 HydrophobicContact CB-CD2 4.06Å; V68-L79 HydrophobicContact CG2-CB 4.41Å; V68-L79 HydrophobicContact CG2-CD2 4Å
69	P	81.1	Confident	87.1	Confident	80 Å²	80	99.7 Å²	99.7	52%	0.519	50%	0.497	S	S	.	.			trans	-58.4	145.9	177.4	-24.6	34.1	0	0	0	113	N71 D72	P69-N71 PolarHBondContact O-N 3.14Å; P69-N71 VanDerWaalsContact O-N 3.12Å; P69-D72 PolarHBondContact O-N 3.18Å
70	K	77.9	Confident	86.9	Confident	186 Å²	186	101 Å²	101	81%	0.809	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.1	-176	-65.7	-178.3	-178.8	177.8	0	114.2
71	N	79.5	Confident	87	Confident	160 Å²	160	99.7 Å²	99.7	86%	0.856	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-14.9	-175.3	-157.2	11.1	0	0	0	113.9	P69 K73	P69-N71 PolarHBondContact O-N 3.14Å; P69-N71 VanDerWaalsContact O-N 3.12Å; N71-K73 PolarHBondContact O-N 3.34Å
72	D	83.9	Confident	86.9	Confident	60 Å²	60	102 Å²	102	32%	0.321	51%	0.507	S	S	.	.			trans	-93.6	88.6	-175.1	-161.8	-26	0	0	0	112	P69 K74 R75 R76	P69-D72 PolarHBondContact O-N 3.18Å; D72-K74 VanDerWaalsContact C-N 3.31Å; D72-K74 PolarHBondContact O-N 3.22Å; D72-R75 HydrophobicContact CB-CB 4.34Å; D72-R75 PolarHBondContact O-N 3.05Å; D72-R75 VanDerWaalsContact OD2-CD 3.25Å; D72-R75 WeakPolarHBondContact OD2-CD 3.36Å; D72-R75 IonicContact OD2-NE 2.76Å; D72-R76 WeakPolarHBondContact O-CG 3.47Å; D72-R76 PolarHBondContact O-N 2.94Å
73	K	84.3	Confident	87	Confident	186 Å²	186	97.7 Å²	97.7	81%	0.809	49%	0.487	S	S	*	.	H	α-helix	trans	-59.3	-36.3	-173.9	-168.9	175.2	-177.3	177.9	0	113.3	N71 K77	N71-K73 PolarHBondContact O-N 3.34Å; K73-K77 PolarHBondContact O-N 2.92Å
74	K	87.9	Confident	87.1	Confident	184 Å²	184	97.5 Å²	97.5	80%	0.8	48%	0.482	S	S	*	.	H	α-helix	trans	-71.6	-45.6	-178	-172.5	176.2	178.8	179.9	0	111.1	D72 K77 Q78	D72-K74 VanDerWaalsContact C-N 3.31Å; D72-K74 PolarHBondContact O-N 3.22Å; K74-K77 PolarHBondContact O-N 3.08Å; K74-Q78 PolarHBondContact O-N 3.19Å
75	R	84.3	Confident	87.4	Confident	163 Å²	163	100.4 Å²	100.4	62%	0.615	49%	0.493	S	S	*	.	H	α-helix	trans	-68.8	-32.2	177.9	-67.2	-172.7	177.5	-177.8	-2.1	112.8	V68 D72 Q78 L79	V68-R75 HydrophobicContact CG1-CB 3.76Å; D72-R75 HydrophobicContact CB-CB 4.34Å; D72-R75 PolarHBondContact O-N 3.05Å; D72-R75 VanDerWaalsContact OD2-CD 3.25Å; D72-R75 WeakPolarHBondContact OD2-CD 3.36Å; D72-R75 IonicContact OD2-NE 2.76Å; R75-Q78 PolarHBondContact O-N 3.49Å; R75-L79 VanDerWaalsContact O-CB 3.29Å; R75-L79 WeakPolarHBondContact O-CB 3.28Å; R75-L79 PolarHBondContact O-N 3.02Å
76	R	86.9	Confident	87.5	Confident	105 Å²	105	98.1 Å²	98.1	40%	0.396	49%	0.485	S	S	.	.	H	α-helix	trans	-68.4	-35.4	173.9	-73.9	-162.9	122.5	-141.4	-4.4	113.5	V68 D72 T80	V68-R76 HydrophobicContact CG1-CG 3.73Å; D72-R76 WeakPolarHBondContact O-CG 3.47Å; D72-R76 PolarHBondContact O-N 2.94Å; R76-T80 PolarHBondContact O-N 3.47Å; R76-T80 PolarHBondContact O-OG1 3.5Å
77	K	89.6	Confident	87.6	Confident	141 Å²	141	96.5 Å²	96.5	61%	0.613	47%	0.474	S	S	*	.	H	α-helix	trans	-64.2	-48.5	173.7	-168.7	179.8	176.5	-173.2	0	110.7	K73 K74 L79 T80 E81	K73-K77 PolarHBondContact O-N 2.92Å; K74-K77 PolarHBondContact O-N 3.08Å; K77-L79 PolarHBondContact O-N 3.25Å; K77-T80 PolarHBondContact O-N 3.01Å; K77-T80 VanDerWaalsContact O-N 3.12Å; K77-E81 VanDerWaalsContact CE-OE1 3.3Å; K77-E81 WeakPolarHBondContact CE-OE1 3.38Å; K77-E81 PolarHBondContact O-N 2.88Å; K77-E81 VanDerWaalsContact O-N 3.09Å
78	Q	89.4	Confident	87.9	Confident	99 Å²	99	100 Å²	100	46%	0.463	47%	0.47	S	S	.	.	H	α-helix	trans	-58.6	-45.7	175.3	-171.5	62.2	53.6	0	0	112.1	K74 R75 T80 E81 D82	K74-Q78 PolarHBondContact O-N 3.19Å; R75-Q78 PolarHBondContact O-N 3.49Å; Q78-T80 VanDerWaalsContact C-N 3.26Å; Q78-T80 PolarHBondContact O-N 3.22Å; Q78-E81 PolarHBondContact O-N 3.42Å; Q78-D82 PolarHBondContact NE2-OD1 2.86Å; Q78-D82 WeakPolarHBondContact O-CB 3.49Å; Q78-D82 PolarHBondContact O-N 3Å
79	L	90.3	Very high	88.1	Confident	12 Å²	12	102.8 Å²	102.8	6%	0.063	48%	0.481	C	S	.	.	H	α-helix	trans	-57.4	-39.6	176.1	173.1	68.4	0	0	0	112.4	M64 K65 V68 R75 K77 D82 V83	M64-L79 HydrophobicContact CB-CD1 3.52Å; M64-L79 HydrophobicContact CE-CD1 4.02Å; K65-L79 HydrophobicContact CB-CD2 4.49Å; K65-L79 HydrophobicContact CG-CD2 4.07Å; V68-L79 HydrophobicContact CB-CD2 4.06Å; V68-L79 HydrophobicContact CG2-CB 4.41Å; V68-L79 HydrophobicContact CG2-CD2 4Å; R75-L79 VanDerWaalsContact O-CB 3.29Å; R75-L79 WeakPolarHBondContact O-CB 3.28Å; R75-L79 PolarHBondContact O-N 3.02Å; K77-L79 PolarHBondContact O-N 3.25Å; L79-D82 PolarHBondContact O-N 2.89Å; L79-V83 HydrophobicContact CD1-CG2 4.15Å; L79-V83 HydrophobicContact CG-CG2 4.47Å; L79-V83 WeakPolarHBondContact O-CB 3.43Å; L79-V83 WeakPolarHBondContact O-CG2 3.5Å; L79-V83 PolarHBondContact O-N 2.91Å
80	T	88.2	Confident	88.7	Confident	95 Å²	95	100.5 Å²	100.5	58%	0.583	46%	0.464	S	S	*	.	H	α-helix	trans	-68.8	-40.4	-179.7	-54	0	0	0	0	110.9	R76 K77 Q78 A84	R76-T80 PolarHBondContact O-N 3.47Å; R76-T80 PolarHBondContact O-OG1 3.5Å; K77-T80 PolarHBondContact O-N 3.01Å; K77-T80 VanDerWaalsContact O-N 3.12Å; Q78-T80 VanDerWaalsContact C-N 3.26Å; Q78-T80 PolarHBondContact O-N 3.22Å; T80-A84 WeakPolarHBondContact O-CB 3.2Å; T80-A84 PolarHBondContact O-N 3.4Å
81	E	92.3	Very high	89.2	Confident	95 Å²	95	97 Å²	97	44%	0.444	45%	0.451	S	S	.	.	H	α-helix	trans	-65.6	-41.8	174.9	-69.4	171.1	-164.9	0	0	111.6	K77 Q78 A84 K85	K77-E81 VanDerWaalsContact CE-OE1 3.3Å; K77-E81 WeakPolarHBondContact CE-OE1 3.38Å; K77-E81 PolarHBondContact O-N 2.88Å; K77-E81 VanDerWaalsContact O-N 3.09Å; Q78-E81 PolarHBondContact O-N 3.42Å; E81-A84 PolarHBondContact O-N 2.83Å; E81-K85 WeakPolarHBondContact O-CB 3.28Å; E81-K85 PolarHBondContact O-N 2.79Å
82	D	89.6	Confident	89.7	Confident	58 Å²	58	94.8 Å²	94.8	31%	0.31	44%	0.435	S	S	.	.	H	α-helix	trans	-66	-41.4	177.4	-66.1	-17.8	0	0	0	111.8	M64 Q78 L79 K85 L86	M64-D82 HydrophobicContact CE-CB 4.29Å; Q78-D82 PolarHBondContact NE2-OD1 2.86Å; Q78-D82 WeakPolarHBondContact O-CB 3.49Å; Q78-D82 PolarHBondContact O-N 3Å; L79-D82 PolarHBondContact O-N 2.89Å; D82-K85 PolarHBondContact O-N 2.96Å; D82-L86 VanDerWaalsContact O-CG 3.31Å; D82-L86 WeakPolarHBondContact O-CG 3.4Å; D82-L86 PolarHBondContact O-N 2.89Å
83	V	92.5	Very high	90.1	Very high	12 Å²	12	97.8 Å²	97.8	7%	0.073	45%	0.445	C	S	.	.	H	α-helix	trans	-62.2	-47	174.3	168.3	0	0	0	0	110.5	I61 L79 K85 L86 E87	I61-V83 HydrophobicContact CD1-CG1 3.94Å; I61-V83 HydrophobicContact CG1-CG1 4.05Å; I61-V83 HydrophobicContact CG1-CG2 4.24Å; I61-V83 HydrophobicContact CG2-CG1 3.95Å; I61-V83 HydrophobicContact CG2-CG2 3.96Å; L79-V83 HydrophobicContact CD1-CG2 4.15Å; L79-V83 HydrophobicContact CG-CG2 4.47Å; L79-V83 WeakPolarHBondContact O-CB 3.43Å; L79-V83 WeakPolarHBondContact O-CG2 3.5Å; L79-V83 PolarHBondContact O-N 2.91Å; V83-K85 VanDerWaalsContact C-N 3.25Å; V83-K85 PolarHBondContact O-N 3.42Å; V83-L86 PolarHBondContact O-N 3.02Å; V83-E87 HydrophobicContact CG1-CG 4.41Å; V83-E87 WeakPolarHBondContact O-CG 3.28Å; V83-E87 PolarHBondContact O-N 2.81Å
84	A	92.4	Very high	90.5	Very high	38 Å²	38	89.9 Å²	89.9	31%	0.314	41%	0.411	S	S	.	.	H	α-helix	trans	-64.4	-30.3	178.5	0	0	0	0	0	112.7	T80 E81 R88	T80-A84 WeakPolarHBondContact O-CB 3.2Å; T80-A84 PolarHBondContact O-N 3.4Å; E81-A84 PolarHBondContact O-N 2.83Å; A84-R88 WeakPolarHBondContact O-CB 3.46Å; A84-R88 PolarHBondContact O-N 3.24Å; A84-R88 PolarHBondContact O-NE 3.13Å
85	K	93.8	Very high	90.5	Very high	113 Å²	113	87.6 Å²	87.6	49%	0.491	40%	0.397	S	S	.	.	H	α-helix	trans	-70.7	-48.7	173.7	-176	179.4	173	-177.3	0	111.2	E81 D82 V83 E87 R88 E89	E81-K85 WeakPolarHBondContact O-CB 3.28Å; E81-K85 PolarHBondContact O-N 2.79Å; D82-K85 PolarHBondContact O-N 2.96Å; V83-K85 VanDerWaalsContact C-N 3.25Å; V83-K85 PolarHBondContact O-N 3.42Å; K85-E87 VanDerWaalsContact C-N 3.35Å; K85-E87 PolarHBondContact O-N 2.84Å; K85-R88 PolarHBondContact O-N 2.93Å; K85-E89 WeakPolarHBondContact CE-OE1 3.43Å; K85-E89 IonicContact NZ-OE1 3.51Å; K85-E89 WeakPolarHBondContact O-CG 3.22Å; K85-E89 PolarHBondContact O-N 3.44Å
86	L	91.4	Very high	90.7	Very high	46 Å²	46	83.8 Å²	83.8	24%	0.241	39%	0.386	C	S	.	.	H	α-helix	trans	-63.2	-38.2	179.7	-71.9	171.5	0	0	0	112.9	L57 M64 D82 V83 M90	L57-L86 HydrophobicContact CD1-CB 4.12Å; M64-L86 HydrophobicContact CE-CD1 4.47Å; M64-L86 HydrophobicContact SD-CD1 3.99Å; D82-L86 VanDerWaalsContact O-CG 3.31Å; D82-L86 WeakPolarHBondContact O-CG 3.4Å; D82-L86 PolarHBondContact O-N 2.89Å; V83-L86 PolarHBondContact O-N 3.02Å; L86-M90 WeakPolarHBondContact O-CB 3.28Å; L86-M90 PolarHBondContact O-N 3.23Å; L86-M90 VanDerWaalsContact O-N 3.15Å
87	E	91.4	Very high	90.8	Very high	87 Å²	87	81.6 Å²	81.6	41%	0.407	38%	0.381	S	S	.	.	H	α-helix	trans	-66.3	-43.3	175.9	-72.5	178.7	154	0	0	111.7	L57 I61 V83 K85 M90 E91	L57-E87 HydrophobicContact CD2-CG 4.08Å; I61-E87 HydrophobicContact CD1-CG 3.82Å; I61-E87 WeakPolarHBondContact CD1-OE1 3.29Å; V83-E87 HydrophobicContact CG1-CG 4.41Å; V83-E87 WeakPolarHBondContact O-CG 3.28Å; V83-E87 PolarHBondContact O-N 2.81Å; K85-E87 VanDerWaalsContact C-N 3.35Å; K85-E87 PolarHBondContact O-N 2.84Å; E87-M90 PolarHBondContact O-N 3.44Å; E87-E91 WeakPolarHBondContact O-CB 3.38Å; E87-E91 PolarHBondContact O-N 2.63Å
88	R	92.5	Very high	90.5	Very high	155 Å²	155	77.1 Å²	77.1	59%	0.585	36%	0.363	S	S	*	.	H	α-helix	trans	-64	-45.2	176	-91.9	-177.3	-72	121.9	-3.2	112.9	A84 K85 M90 E91 Q92	A84-R88 WeakPolarHBondContact O-CB 3.46Å; A84-R88 PolarHBondContact O-N 3.24Å; A84-R88 PolarHBondContact O-NE 3.13Å; K85-R88 PolarHBondContact O-N 2.93Å; R88-M90 VanDerWaalsContact C-N 3.28Å; R88-M90 PolarHBondContact O-N 3.45Å; R88-E91 PolarHBondContact O-N 2.97Å; R88-Q92 VanDerWaalsContact O-CB 3.29Å; R88-Q92 WeakPolarHBondContact O-CB 3.42Å; R88-Q92 PolarHBondContact O-N 2.67Å
89	E	91.7	Very high	90.2	Very high	83 Å²	83	77.4 Å²	77.4	39%	0.388	37%	0.365	S	S	.	.	H	α-helix	trans	-62	-38.3	179	-74.6	175.9	-177.2	0	0	111.7	K85 K93	K85-E89 WeakPolarHBondContact CE-OE1 3.43Å; K85-E89 IonicContact NZ-OE1 3.51Å; K85-E89 WeakPolarHBondContact O-CG 3.22Å; K85-E89 PolarHBondContact O-N 3.44Å; E89-K93 VanDerWaalsContact O-CG 3.3Å; E89-K93 WeakPolarHBondContact O-CG 3.27Å; E89-K93 PolarHBondContact O-N 2.82Å; E89-K93 VanDerWaalsContact O-N 3.12Å
90	M	92.6	Very high	90	Very high	33 Å²	33	82.6 Å²	82.6	16%	0.163	39%	0.389	C	S	.	.	H	α-helix	trans	-70.4	-44.2	177.7	-175.7	-93.6	-69.1	0	0	111.9	K54 L57 L86 E87 R88 Q92 K93 H94	K54-M90 HydrophobicContact CB-CE 4.09Å; K54-M90 HydrophobicContact CB-SD 4.49Å; K54-M90 HydrophobicContact CD-CE 4.48Å; K54-M90 HydrophobicContact CG-CE 3.92Å; L57-M90 HydrophobicContact CB-CE 4.34Å; L57-M90 HydrophobicContact CD2-CB 3.95Å; L57-M90 HydrophobicContact CD2-CE 3.29Å; L57-M90 HydrophobicContact CD2-CG 4.15Å; L57-M90 HydrophobicContact CG-CE 4.42Å; L86-M90 WeakPolarHBondContact O-CB 3.28Å; L86-M90 PolarHBondContact O-N 3.23Å; L86-M90 VanDerWaalsContact O-N 3.15Å; E87-M90 PolarHBondContact O-N 3.44Å; R88-M90 VanDerWaalsContact C-N 3.28Å; R88-M90 PolarHBondContact O-N 3.45Å; M90-Q92 VanDerWaalsContact C-N 3.33Å; M90-Q92 PolarHBondContact O-N 3.2Å; M90-K93 PolarHBondContact O-N 3.31Å; M90-H94 PolarHBondContact O-N 2.98Å; M90-H94 PolarHBondContact SD-CE1 3.45Å; M90-H94 PolarHBondContact SD-ND1 3.36Å; M90-H94 VanDerWaalsContact SD-ND1 3.38Å
91	E	88.1	Confident	89.6	Confident	113 Å²	113	79.6 Å²	79.6	53%	0.528	37%	0.369	S	S	.	.	H	α-helix	trans	-65.5	-36.5	177.1	-175.1	170.9	-171.2	0	0	112.6	E87 R88 R95	E87-E91 WeakPolarHBondContact O-CB 3.38Å; E87-E91 PolarHBondContact O-N 2.63Å; R88-E91 PolarHBondContact O-N 2.97Å; E91-R95 WeakPolarHBondContact O-CB 3.28Å; E91-R95 PolarHBondContact O-N 2.78Å; E91-R95 IonicContact OE1-NH2 2.93Å
92	Q	91.1	Very high	89	Confident	112 Å²	112	80.4 Å²	80.4	52%	0.523	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-47.1	174.8	-178.2	174.1	-8.7	0	0	111.3	R88 M90 H94 R95 E96	R88-Q92 VanDerWaalsContact O-CB 3.29Å; R88-Q92 WeakPolarHBondContact O-CB 3.42Å; R88-Q92 PolarHBondContact O-N 2.67Å; M90-Q92 VanDerWaalsContact C-N 3.33Å; M90-Q92 PolarHBondContact O-N 3.2Å; Q92-H94 PolarHBondContact O-N 3.37Å; Q92-R95 WeakPolarHBondContact O-CB 3.5Å; Q92-R95 PolarHBondContact O-N 3.03Å; Q92-E96 HydrophobicContact CG-CG 4.5Å; Q92-E96 VanDerWaalsContact CG-OE1 3.27Å; Q92-E96 WeakPolarHBondContact CG-OE1 3.41Å; Q92-E96 PolarHBondContact NE2-OE1 3.4Å; Q92-E96 WeakPolarHBondContact O-CG 3.17Å; Q92-E96 PolarHBondContact O-N 3.49Å
93	K	92.4	Very high	88.5	Confident	123 Å²	123	82.5 Å²	82.5	54%	0.535	38%	0.381	S	S	.	.	H	α-helix	trans	-59.4	-45.4	176.2	-73.8	177	-176.7	-174.8	0	112.4	E89 M90 R95 E96 E97	E89-K93 VanDerWaalsContact O-CG 3.3Å; E89-K93 WeakPolarHBondContact O-CG 3.27Å; E89-K93 PolarHBondContact O-N 2.82Å; E89-K93 VanDerWaalsContact O-N 3.12Å; M90-K93 PolarHBondContact O-N 3.31Å; K93-R95 VanDerWaalsContact C-N 3.27Å; K93-R95 PolarHBondContact O-N 3.05Å; K93-E96 PolarHBondContact O-N 2.84Å; K93-E97 WeakPolarHBondContact O-CB 3.21Å; K93-E97 WeakPolarHBondContact O-CG 3.35Å; K93-E97 PolarHBondContact O-N 2.66Å
94	H	91.9	Very high	87.7	Confident	21 Å²	21	85.4 Å²	85.4	10%	0.097	40%	0.399	C	S	.	.	H	α-helix	trans	-63.1	-36.1	178.9	-69.8	-177.2	0	0	0	112.2	H50 E53 M90 Q92 L98	H50-H94 VanDerWaalsContact CA-CE1 3.5Å; H50-H94 WeakPolarHBondContact CA-CE1 3.48Å; H50-H94 AromaticContact CD2-CD2 3.27Å; H50-H94 PolarHBondContact CD2-CD2 3.16Å; H50-H94 AromaticContact CD2-CE1 3.91Å; H50-H94 AromaticContact CD2-CG 3.62Å; H50-H94 AromaticContact CD2-NE2 3.48Å; H50-H94 PolarHBondContact CD2-NE2 2.94Å; H50-H94 AromaticContact CE1-CG 3.88Å; H50-H94 PolarHBondContact CE1-O 3.12Å; H50-H94 AromaticContact CG-CD2 3.7Å; H50-H94 AromaticContact CG-CE1 3.81Å; H50-H94 AromaticContact CG-CG 3.56Å; H50-H94 AromaticContact CG-ND1 3.64Å; H50-H94 AromaticContact CG-NE2 3.86Å; H50-H94 AromaticContact ND1-CG 3.75Å; H50-H94 AromaticContact NE2-CD2 3.53Å; H50-H94 AromaticContact NE2-CG 3.82Å; H50-H94 PolarHBondContact O-CE1 3.1Å; E53-H94 IonicContact OE2-CD2 3.66Å; E53-H94 IonicContact OE2-CE1 2.78Å; E53-H94 IonicContact OE2-NE2 2.63Å; E53-H94 PolarHBondContact OE2-NE2 3.07Å; M90-H94 PolarHBondContact O-N 2.98Å; M90-H94 PolarHBondContact SD-CE1 3.45Å; M90-H94 PolarHBondContact SD-ND1 3.36Å; M90-H94 VanDerWaalsContact SD-ND1 3.38Å; Q92-H94 PolarHBondContact O-N 3.37Å; H94-L98 VanDerWaalsContact O-CG 3.31Å; H94-L98 WeakPolarHBondContact O-CG 3.33Å; H94-L98 PolarHBondContact O-N 3.49Å; H94-L98 VanDerWaalsContact O-N 3.09Å
95	R	87.4	Confident	86.7	Confident	136 Å²	136	87.4 Å²	87.4	51%	0.513	40%	0.404	S	S	.	.	H	α-helix	trans	-66.4	-47.8	174.9	-173.7	-173.9	-53.4	-97.4	-6.1	111.8	E91 Q92 K93 E97 L98 E99	E91-R95 WeakPolarHBondContact O-CB 3.28Å; E91-R95 PolarHBondContact O-N 2.78Å; E91-R95 IonicContact OE1-NH2 2.93Å; Q92-R95 WeakPolarHBondContact O-CB 3.5Å; Q92-R95 PolarHBondContact O-N 3.03Å; K93-R95 VanDerWaalsContact C-N 3.27Å; K93-R95 PolarHBondContact O-N 3.05Å; R95-E97 VanDerWaalsContact C-N 3.34Å; R95-E97 PolarHBondContact O-N 2.95Å; R95-L98 PolarHBondContact O-N 3.41Å; R95-E99 WeakPolarHBondContact O-CG 3.35Å; R95-E99 PolarHBondContact O-N 3.48Å
96	E	89.3	Confident	85.4	Confident	82 Å²	82	88.4 Å²	88.4	38%	0.383	41%	0.409	S	S	.	.	H	α-helix	trans	-61.5	-41.5	178.3	-72	170.1	-172.2	0	0	111.4	Q92 K93 E99 Q100	Q92-E96 HydrophobicContact CG-CG 4.5Å; Q92-E96 VanDerWaalsContact CG-OE1 3.27Å; Q92-E96 WeakPolarHBondContact CG-OE1 3.41Å; Q92-E96 PolarHBondContact NE2-OE1 3.4Å; Q92-E96 WeakPolarHBondContact O-CG 3.17Å; Q92-E96 PolarHBondContact O-N 3.49Å; K93-E96 PolarHBondContact O-N 2.84Å; E96-E99 PolarHBondContact O-N 3.45Å; E96-Q100 WeakPolarHBondContact O-CB 3.37Å; E96-Q100 VanDerWaalsContact O-CG 3.28Å; E96-Q100 WeakPolarHBondContact O-CG 3.47Å; E96-Q100 PolarHBondContact O-N 2.91Å
97	E	89.1	Confident	83.8	Confident	59 Å²	59	92.4 Å²	92.4	28%	0.276	43%	0.426	S	S	.	.	H	α-helix	trans	-65.3	-39.2	176.5	-72.6	176	-173.3	0	0	112.5	L46 H50 K93 R95 L101	L46-E97 HydrophobicContact CD1-CB 4.35Å; L46-E97 HydrophobicContact CD2-CB 4.21Å; H50-E97 IonicContact CD2-OE2 2.67Å; H50-E97 IonicContact CE1-OE2 3.71Å; H50-E97 IonicContact NE2-OE2 3.05Å; H50-E97 PolarHBondContact NE2-OE2 3.08Å; K93-E97 WeakPolarHBondContact O-CB 3.21Å; K93-E97 WeakPolarHBondContact O-CG 3.35Å; K93-E97 PolarHBondContact O-N 2.66Å; R95-E97 VanDerWaalsContact C-N 3.34Å; R95-E97 PolarHBondContact O-N 2.95Å; E97-L101 WeakPolarHBondContact O-CB 3.43Å; E97-L101 PolarHBondContact O-N 3.31Å
98	L	83.1	Confident	82.1	Confident	48 Å²	48	91.6 Å²	91.6	25%	0.251	43%	0.43	S	S	.	.	H	α-helix	trans	-68.1	-36.2	174.2	-74.8	168.9	0	0	0	112.2	L46 V47 H94 R95 K102	L46-L98 HydrophobicContact CD2-CD2 4.15Å; V47-L98 HydrophobicContact CG2-CD2 4.37Å; H94-L98 VanDerWaalsContact O-CG 3.31Å; H94-L98 WeakPolarHBondContact O-CG 3.33Å; H94-L98 PolarHBondContact O-N 3.49Å; H94-L98 VanDerWaalsContact O-N 3.09Å; R95-L98 PolarHBondContact O-N 3.41Å; L98-K102 WeakPolarHBondContact O-CB 3.46Å; L98-K102 VanDerWaalsContact O-CG 3.23Å; L98-K102 WeakPolarHBondContact O-CG 3.29Å; L98-K102 PolarHBondContact O-N 2.9Å
99	E	82.4	Confident	80.2	Confident	105 Å²	105	91.7 Å²	91.7	49%	0.491	44%	0.435	S	S	.	.	H	α-helix	trans	-69.9	-41.8	176	-76.2	177.4	-174.2	0	0	111.6	R95 E96 L101 K102 L103	R95-E99 WeakPolarHBondContact O-CG 3.35Å; R95-E99 PolarHBondContact O-N 3.48Å; E96-E99 PolarHBondContact O-N 3.45Å; E99-L101 PolarHBondContact O-N 2.99Å; E99-K102 PolarHBondContact O-N 3.04Å; E99-L103 WeakPolarHBondContact O-CG 3.47Å; E99-L103 PolarHBondContact O-N 3.31Å
100	Q	86.4	Confident	78.1	Confident	121 Å²	121	93.9 Å²	93.9	57%	0.565	45%	0.448	S	S	*	.	H	α-helix	trans	-60.4	-44.7	173.1	-74.7	173.4	17.2	0	0	111.3	E96 K102 L103 T104	E96-Q100 WeakPolarHBondContact O-CB 3.37Å; E96-Q100 VanDerWaalsContact O-CG 3.28Å; E96-Q100 WeakPolarHBondContact O-CG 3.47Å; E96-Q100 PolarHBondContact O-N 2.91Å; Q100-K102 VanDerWaalsContact C-N 3.31Å; Q100-K102 PolarHBondContact O-N 3.29Å; Q100-L103 PolarHBondContact O-N 3.37Å; Q100-L103 VanDerWaalsContact O-N 3.12Å; Q100-T104 WeakPolarHBondContact O-CG2 3.37Å; Q100-T104 PolarHBondContact O-N 2.91Å; Q100-T104 PolarHBondContact O-OG1 3.38Å
101	L	80.9	Confident	75.7	Confident	31 Å²	31	99.5 Å²	99.5	16%	0.162	48%	0.478	C	S	.	.	H	α-helix	trans	-63.1	-37.6	176.3	-164	81.3	0	0	0	112.1	D42 E43 L46 E97 E99 L103 T104 L105	D42-L101 HydrophobicContact CB-CD1 4.1Å; E43-L101 HydrophobicContact CB-CD2 3.61Å; E43-L101 HydrophobicContact CG-CD2 4Å; L46-L101 HydrophobicContact CD2-CB 4.12Å; L46-L101 HydrophobicContact CD2-CD2 3.96Å; L46-L101 HydrophobicContact CD2-CG 4.46Å; E97-L101 WeakPolarHBondContact O-CB 3.43Å; E97-L101 PolarHBondContact O-N 3.31Å; E99-L101 PolarHBondContact O-N 2.99Å; L101-L103 VanDerWaalsContact C-N 3.31Å; L101-L103 PolarHBondContact O-N 2.89Å; L101-T104 WeakPolarHBondContact CA-OG1 3.32Å; L101-T104 PolarHBondContact O-OG1 3.24Å; L101-L105 HydrophobicContact CG-CD1 4.34Å; L101-L105 VanDerWaalsContact O-CB 3.32Å; L101-L105 WeakPolarHBondContact O-CB 3.47Å; L101-L105 WeakPolarHBondContact O-CG 3.35Å; L101-L105 PolarHBondContact O-N 3.44Å
102	K	79.8	Confident	73.4	Confident	112 Å²	112	98.4 Å²	98.4	49%	0.487	48%	0.483	S	S	.	.	H	α-helix	trans	-67.7	-30.3	174.5	-76.3	170.2	-177.1	176.5	0	113	L98 E99 Q100 K106	L98-K102 WeakPolarHBondContact O-CB 3.46Å; L98-K102 VanDerWaalsContact O-CG 3.23Å; L98-K102 WeakPolarHBondContact O-CG 3.29Å; L98-K102 PolarHBondContact O-N 2.9Å; E99-K102 PolarHBondContact O-N 3.04Å; Q100-K102 VanDerWaalsContact C-N 3.31Å; Q100-K102 PolarHBondContact O-N 3.29Å; K102-K106 WeakPolarHBondContact O-CD 3.18Å; K102-K106 VanDerWaalsContact O-CG 3.23Å; K102-K106 WeakPolarHBondContact O-CG 3.15Å; K102-K106 PolarHBondContact O-N 3.1Å
103	L	78.9	Confident	71	Confident	102 Å²	102	99.1 Å²	99.1	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-76.2	-43.8	175.8	-70.6	171.7	0	0	0	111	E99 Q100 L101 L105 K106 E107	E99-L103 WeakPolarHBondContact O-CG 3.47Å; E99-L103 PolarHBondContact O-N 3.31Å; Q100-L103 PolarHBondContact O-N 3.37Å; Q100-L103 VanDerWaalsContact O-N 3.12Å; L101-L103 VanDerWaalsContact C-N 3.31Å; L101-L103 PolarHBondContact O-N 2.89Å; L103-L105 VanDerWaalsContact C-N 3.31Å; L103-L105 PolarHBondContact O-N 3.43Å; L103-K106 WeakPolarHBondContact O-CA 3.45Å; L103-K106 WeakPolarHBondContact O-CB 3.47Å; L103-K106 PolarHBondContact O-N 2.89Å; L103-E107 PolarHBondContact O-N 2.86Å
104	T	75.4	Confident	68.6	Low	74 Å²	74	97.3 Å²	97.3	45%	0.454	50%	0.503	S	S	.	.	H	α-helix	trans	-63.3	-37.2	175.4	54.4	0	0	0	0	112.1	Q100 L101 K106 E107 S108	Q100-T104 WeakPolarHBondContact O-CG2 3.37Å; Q100-T104 PolarHBondContact O-N 2.91Å; Q100-T104 PolarHBondContact O-OG1 3.38Å; L101-T104 WeakPolarHBondContact CA-OG1 3.32Å; L101-T104 PolarHBondContact O-OG1 3.24Å; T104-K106 VanDerWaalsContact C-N 3.27Å; T104-K106 PolarHBondContact O-N 3.21Å; T104-E107 PolarHBondContact O-N 3.35Å; T104-S108 WeakPolarHBondContact O-CB 3.2Å; T104-S108 PolarHBondContact O-N 3Å; T104-S108 PolarHBondContact O-OG 3.09Å
105	L	70.2	Confident	65.8	Low	79 Å²	79	102.7 Å²	102.7	41%	0.414	54%	0.537	S	S	.	.	H	α-helix	trans	-68	-22.5	171.9	-74.3	171.2	0	0	0	113.7	L101 L103 S108 K109	L101-L105 HydrophobicContact CG-CD1 4.34Å; L101-L105 VanDerWaalsContact O-CB 3.32Å; L101-L105 WeakPolarHBondContact O-CB 3.47Å; L101-L105 WeakPolarHBondContact O-CG 3.35Å; L101-L105 PolarHBondContact O-N 3.44Å; L103-L105 VanDerWaalsContact C-N 3.31Å; L103-L105 PolarHBondContact O-N 3.43Å; L105-S108 WeakPolarHBondContact CA-OG 3.27Å; L105-S108 PolarHBondContact O-OG 3.47Å; L105-K109 WeakPolarHBondContact O-CB 3.24Å
106	K	66.6	Low	63.4	Low	134 Å²	134	103.4 Å²	103.4	58%	0.583	55%	0.551	S	S	*	*	H	α-helix	trans	-85.7	-39.2	174.8	-78.3	173.3	-178.1	-178.7	0	111.6	K102 L103 T104 K109 I110	K102-K106 WeakPolarHBondContact O-CD 3.18Å; K102-K106 VanDerWaalsContact O-CG 3.23Å; K102-K106 WeakPolarHBondContact O-CG 3.15Å; K102-K106 PolarHBondContact O-N 3.1Å; L103-K106 WeakPolarHBondContact O-CA 3.45Å; L103-K106 WeakPolarHBondContact O-CB 3.47Å; L103-K106 PolarHBondContact O-N 2.89Å; T104-K106 VanDerWaalsContact C-N 3.27Å; T104-K106 PolarHBondContact O-N 3.21Å; K106-K109 PolarHBondContact O-N 2.99Å; K106-I110 VanDerWaalsContact O-CG1 3.31Å; K106-I110 WeakPolarHBondContact O-CG1 3.4Å; K106-I110 PolarHBondContact O-N 3.2Å; K106-I110 VanDerWaalsContact O-N 3.15Å
107	E	58.4	Low	61.2	Low	131 Å²	131	107.2 Å²	107.2	61%	0.612	57%	0.572	S	S	*	*	H	α-helix	trans	-64.5	-44.2	174.5	-73.9	178.1	163.4	0	0	111.2	L103 T104 K109 I110 D111	L103-E107 PolarHBondContact O-N 2.86Å; T104-E107 PolarHBondContact O-N 3.35Å; E107-K109 PolarHBondContact O-N 3.27Å; E107-I110 PolarHBondContact O-N 2.89Å; E107-I110 VanDerWaalsContact O-N 3.11Å; E107-D111 PolarHBondContact O-N 3.47Å
108	S	55.7	Low	58.6	Low	70 Å²	70	109.5 Å²	109.5	49%	0.49	60%	0.595	S	S	.	*	H	α-helix	trans	-65.4	-24.8	174.5	63	0	0	0	0	113.7	T104 L105	T104-S108 WeakPolarHBondContact O-CB 3.2Å; T104-S108 PolarHBondContact O-N 3Å; T104-S108 PolarHBondContact O-OG 3.09Å; L105-S108 WeakPolarHBondContact CA-OG 3.27Å; L105-S108 PolarHBondContact O-OG 3.47Å
109	K	52.3	Low	56.2	Low	157 Å²	157	113.9 Å²	113.9	68%	0.683	62%	0.619	S	S	*	*	H	α-helix	trans	-80.7	-21.3	175.2	-145.2	170.8	-164.3	174.5	0	113.2	L105 K106 E107 V113	L105-K109 WeakPolarHBondContact O-CB 3.24Å; K106-K109 PolarHBondContact O-N 2.99Å; E107-K109 PolarHBondContact O-N 3.27Å; K109-V113 VanDerWaalsContact O-CG2 3.31Å; K109-V113 WeakPolarHBondContact O-CG2 3.2Å
110	I	47.8	Very low	53.8	Low	129 Å²	129	114.9 Å²	114.9	66%	0.662	63%	0.627	S	S	*	*	H	α-helix	trans	-79.4	-32.3	175.8	-68.4	163.7	0	0	0	110.7	K106 E107 S112	K106-I110 VanDerWaalsContact O-CG1 3.31Å; K106-I110 WeakPolarHBondContact O-CG1 3.4Å; K106-I110 PolarHBondContact O-N 3.2Å; K106-I110 VanDerWaalsContact O-N 3.15Å; E107-I110 PolarHBondContact O-N 2.89Å; E107-I110 VanDerWaalsContact O-N 3.11Å; I110-S112 VanDerWaalsContact C-N 3.3Å; I110-S112 PolarHBondContact O-N 3.48Å
111	D	42.2	Very low	51.8	Low	150 Å²	150	115.6 Å²	115.6	80%	0.802	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-13.1	175	-80.5	-18.7	0	0	0	114.4	E107	E107-D111 PolarHBondContact O-N 3.47Å
112	S	40.7	Very low	49.6	Very low	91 Å²	91	121.1 Å²	121.1	64%	0.636	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-1.8	-177.5	-174.3	0	0	0	0	114.7	I110 A114	I110-S112 VanDerWaalsContact C-N 3.3Å; I110-S112 PolarHBondContact O-N 3.48Å; S112-A114 PolarHBondContact O-N 3.48Å; S112-A114 VanDerWaalsContact O-N 3.14Å
113	V	40.8	Very low	47.4	Very low	126 Å²	126	123 Å²	123	76%	0.764	68%	0.679	S	S	*	*			trans	-86.5	36.7	-179.1	-161.7	0	0	0	0	112.6	K109	K109-V113 VanDerWaalsContact O-CG2 3.31Å; K109-V113 WeakPolarHBondContact O-CG2 3.2Å
114	A	40.4	Very low	45.6	Very low	86 Å²	86	126.6 Å²	126.6	71%	0.711	70%	0.698	S	S	*	*	S	Bend	trans	-141.3	84.2	162.3	0	0	0	0	0	108.1	S112	S112-A114 PolarHBondContact O-N 3.48Å; S112-A114 VanDerWaalsContact O-N 3.14Å
115	V	34.9	Very low	44	Very low	133 Å²	133	130 Å²	130	81%	0.806	71%	0.709	S	S	*	*	S	Bend	trans	170.4	118.2	138.3	158.7	0	0	0	0	109.7
116	N	35.6	Very low	42.5	Very low	152 Å²	152	131.7 Å²	131.7	81%	0.813	73%	0.725	S	S	*	*			trans	53.2	107.6	155.8	-89.6	-29.2	0	0	0	121.5
117	I	43.7	Very low	42	Very low	161 Å²	161	130.8 Å²	130.8	83%	0.826	73%	0.733	S	S	*	*			trans	-53.8	122.3	135.6	-64.4	162	0	0	0	108.9
118	S	33.9	Very low	41.9	Very low	108 Å²	108	136.1 Å²	136.1	76%	0.755	75%	0.747	S	S	*	*			trans	-177.4	125.9	135.2	-101	0	0	0	0	112.1
119	D	32.7	Very low	41.9	Very low	140 Å²	140	137.3 Å²	137.3	75%	0.749	75%	0.747	S	S	*	*			trans	100.9	131.6	134.7	-126.4	9.9	0	0	0	121.4
120	L	32.5	Very low	42.8	Very low	125 Å²	125	133 Å²	133	65%	0.654	74%	0.737	S	S	*	*			trans	75.7	96.4	150.7	-67.8	149.1	0	0	0	120.3	L122	L120-L122 PolarHBondContact O-N 3.01Å
121	V	44.4	Very low	43.8	Very low	136 Å²	136	135.5 Å²	135.5	82%	0.824	74%	0.743	S	S	*	*				6.2	111.7	117.4	-179.7	0	0	0	0	114.4
122	L	35.1	Very low	45.4	Very low	147 Å²	147	131 Å²	131	77%	0.77	73%	0.726	S	S	*	*			trans	-155.9	108.9	158	-107.7	142	0	0	0	111.4	L120	L120-L122 PolarHBondContact O-N 3.01Å
123	E	34.2	Very low	47.2	Very low	152 Å²	152	131.3 Å²	131.3	71%	0.71	72%	0.718	S	S	*	*			trans	50.4	111.9	148.8	-66.8	-176.4	160.4	0	0	121	Q125	E123-Q125 PolarHBondContact O-N 2.84Å
124	N	40.5	Very low	49	Very low	177 Å²	177	132.3 Å²	132.3	95%	0.947	71%	0.712	S	S	*	*			trans	-56.3	91.2	156.6	-77.4	-34.1	0	0	0	111.3
125	Q	41.1	Very low	50.9	Low	146 Å²	146	137.7 Å²	137.7	68%	0.682	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-96.1	132.3	155.7	-69.2	-163.8	23.1	0	0	109.4	E123	E123-Q125 PolarHBondContact O-N 2.84Å
126	P	40.3	Very low	53.3	Low	114 Å²	114	140.8 Å²	140.8	74%	0.74	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-61.2	134.4	179.7	24.5	-31.6	0	0	0	109.5	R128	P126-R128 PolarHBondContact O-N 3.14Å
127	P	55.3	Low	55.6	Low	116 Å²	116	137.6 Å²	137.6	75%	0.753	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-56.3	130.5	-176.9	20.6	-31.2	0	0	0	110	I129	P127-I129 PolarHBondContact O-N 3Å
128	R	55.3	Low	57.7	Low	242 Å²	242	137.6 Å²	137.6	91%	0.913	69%	0.685	S	S	*	*			trans	-62.9	98.4	177.7	-74.3	-177.8	168	179.7	-2.2	108.8	P126 S130	P126-R128 PolarHBondContact O-N 3.14Å; R128-S130 PolarHBondContact O-N 3.17Å; R128-S130 VanDerWaalsContact O-N 3.09Å
129	I	56	Low	60.3	Low	96 Å²	96	139.6 Å²	139.6	49%	0.492	68%	0.68	S	S	.	*			trans	-55.1	117.4	-179.8	-58.8	170.1	0	0	0	108.9	P127 Q133 K134	P127-I129 PolarHBondContact O-N 3Å; I129-Q133 HydrophobicContact CG2-CB 3.9Å; I129-Q133 HydrophobicContact CG2-CG 3.88Å; I129-K134 HydrophobicContact CG2-CB 4.22Å
130	S	71.7	Confident	63	Low	67 Å²	67	135.5 Å²	135.5	47%	0.469	67%	0.666	S	S	.	*			trans	-58.8	145.4	178.6	170.3	0	0	0	0	111.1	R128 A132 Q133 K134	R128-S130 PolarHBondContact O-N 3.17Å; R128-S130 VanDerWaalsContact O-N 3.09Å; S130-A132 PolarHBondContact O-N 3.17Å; S130-A132 PolarHBondContact OG-N 2.86Å; S130-Q133 WeakPolarHBondContact O-CA 3.23Å; S130-Q133 WeakPolarHBondContact O-CB 3.34Å; S130-Q133 PolarHBondContact O-N 3.02Å; S130-K134 PolarHBondContact O-N 3.4Å
131	K	69.2	Low	65.6	Low	181 Å²	181	132.4 Å²	132.4	79%	0.787	66%	0.658	S	S	*	*	H	α-helix	trans	-54.1	-28.7	174.4	-72.5	-179.6	178.9	171.8	0	112.4	R135	K131-R135 WeakPolarHBondContact O-CG 3.48Å; K131-R135 PolarHBondContact O-N 2.82Å
132	A	74.7	Confident	67.7	Low	55 Å²	55	131.4 Å²	131.4	46%	0.455	65%	0.648	S	S	.	*	H	α-helix	trans	-75.8	-38.5	175.3	0	0	0	0	0	112.5	S130 R135 R136	S130-A132 PolarHBondContact O-N 3.17Å; S130-A132 PolarHBondContact OG-N 2.86Å; A132-R135 PolarHBondContact O-N 3.33Å; A132-R136 PolarHBondContact O-N 3.31Å; A132-R136 VanDerWaalsContact O-N 3.1Å
133	Q	78.4	Confident	70.1	Confident	97 Å²	97	129.3 Å²	129.3	45%	0.453	63%	0.634	S	S	.	*	H	α-helix	trans	-66.8	-44.3	175.5	-175.3	173.9	-14	0	0	110.8	I129 S130 R135 R136 E137	I129-Q133 HydrophobicContact CG2-CB 3.9Å; I129-Q133 HydrophobicContact CG2-CG 3.88Å; S130-Q133 WeakPolarHBondContact O-CA 3.23Å; S130-Q133 WeakPolarHBondContact O-CB 3.34Å; S130-Q133 PolarHBondContact O-N 3.02Å; Q133-R135 PolarHBondContact O-N 3.33Å; Q133-R136 PolarHBondContact O-N 2.99Å; Q133-E137 HydrophobicContact CG-CG 4.39Å; Q133-E137 VanDerWaalsContact CG-OE1 3.24Å; Q133-E137 WeakPolarHBondContact CG-OE1 3.25Å; Q133-E137 PolarHBondContact NE2-OE1 2.78Å; Q133-E137 WeakPolarHBondContact O-CB 3.31Å; Q133-E137 WeakPolarHBondContact O-CG 3.22Å; Q133-E137 PolarHBondContact O-N 3.49Å
134	K	79.8	Confident	72.7	Confident	148 Å²	148	127.8 Å²	127.8	64%	0.643	63%	0.625	S	S	*	*	H	α-helix	trans	-58	-32.3	173	-168.4	172	-174.8	172	0	113.3	I129 S130 K138	I129-K134 HydrophobicContact CG2-CB 4.22Å; S130-K134 PolarHBondContact O-N 3.4Å; K134-K138 VanDerWaalsContact O-CB 3.27Å; K134-K138 WeakPolarHBondContact O-CB 3.33Å; K134-K138 PolarHBondContact O-N 3.22Å
135	R	79.1	Confident	75	Confident	198 Å²	198	123.9 Å²	123.9	75%	0.747	60%	0.601	S	S	*	*	H	α-helix	trans	-74	-38.5	174.6	-75.2	175	-177.6	-169.8	1.2	112.7	K131 A132 Q133 K139	K131-R135 WeakPolarHBondContact O-CG 3.48Å; K131-R135 PolarHBondContact O-N 2.82Å; A132-R135 PolarHBondContact O-N 3.33Å; Q133-R135 PolarHBondContact O-N 3.33Å; R135-K139 PolarHBondContact O-N 2.83Å
136	R	85.1	Confident	77.1	Confident	199 Å²	199	125 Å²	125	75%	0.751	60%	0.599	S	S	*	*	H	α-helix	trans	-67.2	-45.4	174.9	-71.4	179.1	-178.4	173.8	0.5	110.9	A132 Q133 K138 K139 A140	A132-R136 PolarHBondContact O-N 3.31Å; A132-R136 VanDerWaalsContact O-N 3.1Å; Q133-R136 PolarHBondContact O-N 2.99Å; R136-K138 PolarHBondContact O-N 2.87Å; R136-K139 PolarHBondContact O-N 3.31Å; R136-A140 WeakPolarHBondContact O-CB 3.35Å; R136-A140 PolarHBondContact O-N 3Å
137	E	85.9	Confident	79.2	Confident	84 Å²	84	125 Å²	125	39%	0.393	59%	0.589	S	S	.	*	H	α-helix	trans	-61.9	-42.1	175.8	-70.9	167.5	-179	0	0	111.4	Q133 K139 A140 A141	Q133-E137 HydrophobicContact CG-CG 4.39Å; Q133-E137 VanDerWaalsContact CG-OE1 3.24Å; Q133-E137 WeakPolarHBondContact CG-OE1 3.25Å; Q133-E137 PolarHBondContact NE2-OE1 2.78Å; Q133-E137 WeakPolarHBondContact O-CB 3.31Å; Q133-E137 WeakPolarHBondContact O-CG 3.22Å; Q133-E137 PolarHBondContact O-N 3.49Å; E137-K139 PolarHBondContact O-N 3.49Å; E137-A140 PolarHBondContact O-N 3.17Å; E137-A141 VanDerWaalsContact O-CB 3.22Å; E137-A141 WeakPolarHBondContact O-CB 3.39Å; E137-A141 PolarHBondContact O-N 3.28Å
138	K	87.1	Confident	80.7	Confident	162 Å²	162	124 Å²	124	70%	0.704	58%	0.575	S	S	*	*	H	α-helix	trans	-63	-38.5	173.6	-174.6	175.4	-179.6	179	0	112.9	K134 R136 L142	K134-K138 VanDerWaalsContact O-CB 3.27Å; K134-K138 WeakPolarHBondContact O-CB 3.33Å; K134-K138 PolarHBondContact O-N 3.22Å; R136-K138 PolarHBondContact O-N 2.87Å; K138-L142 WeakPolarHBondContact O-CB 3.42Å; K138-L142 PolarHBondContact O-N 2.67Å; K138-L142 VanDerWaalsContact O-N 3.09Å
139	K	88.4	Confident	82	Confident	149 Å²	149	120 Å²	120	65%	0.648	56%	0.56	S	S	*	*	H	α-helix	trans	-69	-45.4	176.2	-174.8	-176.7	174	-168.7	0	111.2	R135 R136 E137 A141 L142 E143	R135-K139 PolarHBondContact O-N 2.83Å; R136-K139 PolarHBondContact O-N 3.31Å; E137-K139 PolarHBondContact O-N 3.49Å; K139-A141 VanDerWaalsContact C-N 3.31Å; K139-A141 PolarHBondContact O-N 3.03Å; K139-L142 PolarHBondContact O-N 3.48Å; K139-E143 WeakPolarHBondContact O-CB 3.35Å; K139-E143 PolarHBondContact O-N 2.87Å
140	A	88.6	Confident	83	Confident	55 Å²	55	118.6 Å²	118.6	46%	0.455	55%	0.552	S	S	.	*	H	α-helix	trans	-63.3	-38.5	177.4	0	0	0	0	0	111.6	R136 E137 E143 K144	R136-A140 WeakPolarHBondContact O-CB 3.35Å; R136-A140 PolarHBondContact O-N 3Å; E137-A140 PolarHBondContact O-N 3.17Å; A140-E143 PolarHBondContact O-N 2.82Å; A140-K144 VanDerWaalsContact O-CB 3.23Å; A140-K144 WeakPolarHBondContact O-CB 3.48Å; A140-K144 PolarHBondContact O-N 2.71Å
141	A	87.8	Confident	83.3	Confident	59 Å²	59	117.5 Å²	117.5	49%	0.488	55%	0.547	S	S	.	.	H	α-helix	trans	-64.3	-41.9	173.7	0	0	0	0	0	112.1	E137 K139 E145	E137-A141 VanDerWaalsContact O-CB 3.22Å; E137-A141 WeakPolarHBondContact O-CB 3.39Å; E137-A141 PolarHBondContact O-N 3.28Å; K139-A141 VanDerWaalsContact C-N 3.31Å; K139-A141 PolarHBondContact O-N 3.03Å; A141-E145 WeakPolarHBondContact O-CB 3.39Å; A141-E145 PolarHBondContact O-N 2.84Å
142	L	87.2	Confident	83.8	Confident	115 Å²	115	114.8 Å²	114.8	60%	0.602	54%	0.537	S	S	*	.	H	α-helix	trans	-67.5	-38.3	176.8	-167.8	97.4	0	0	0	112.3	K138 K139 R146	K138-L142 WeakPolarHBondContact O-CB 3.42Å; K138-L142 PolarHBondContact O-N 2.67Å; K138-L142 VanDerWaalsContact O-N 3.09Å; K139-L142 PolarHBondContact O-N 3.48Å; L142-R146 WeakPolarHBondContact O-CB 3.4Å; L142-R146 PolarHBondContact O-N 2.94Å
143	E	86.3	Confident	83.8	Confident	104 Å²	104	114 Å²	114	49%	0.486	53%	0.531	S	S	.	.	H	α-helix	trans	-67.8	-44.1	176.6	-173.7	161.7	-147.4	0	0	110.9	K139 A140 R146 E147	K139-E143 WeakPolarHBondContact O-CB 3.35Å; K139-E143 PolarHBondContact O-N 2.87Å; A140-E143 PolarHBondContact O-N 2.82Å; E143-R146 WeakPolarHBondContact O-CB 3.31Å; E143-R146 PolarHBondContact O-N 2.71Å; E143-E147 WeakPolarHBondContact O-CG 3.26Å; E143-E147 PolarHBondContact O-N 2.8Å
144	K	88.1	Confident	83.6	Confident	120 Å²	120	115.2 Å²	115.2	52%	0.522	54%	0.537	S	S	.	.	H	α-helix	trans	-62.1	-44.3	172.7	-176.6	175.4	168.1	179	0	112.3	A140 R146 E147 E148	A140-K144 VanDerWaalsContact O-CB 3.23Å; A140-K144 WeakPolarHBondContact O-CB 3.48Å; A140-K144 PolarHBondContact O-N 2.71Å; K144-R146 VanDerWaalsContact C-N 3.26Å; K144-R146 PolarHBondContact O-N 3.17Å; K144-E147 PolarHBondContact O-N 3.41Å; K144-E148 WeakPolarHBondContact CE-OE1 3.39Å; K144-E148 HydrophobicContact CG-CG 4.33Å; K144-E148 IonicContact NZ-OE1 3.18Å; K144-E148 WeakPolarHBondContact O-CB 3.14Å; K144-E148 VanDerWaalsContact O-CG 3.31Å; K144-E148 WeakPolarHBondContact O-CG 3.49Å; K144-E148 PolarHBondContact O-N 2.92Å
145	E	89.3	Confident	83.2	Confident	95 Å²	95	113.7 Å²	113.7	44%	0.444	54%	0.535	S	S	.	.	H	α-helix	trans	-61.1	-38.1	174.6	-172.1	-163.8	150	0	0	111.2	A141 R149	A141-E145 WeakPolarHBondContact O-CB 3.39Å; A141-E145 PolarHBondContact O-N 2.84Å; E145-R149 VanDerWaalsContact O-CB 3.32Å; E145-R149 WeakPolarHBondContact O-CB 3.49Å; E145-R149 PolarHBondContact O-N 3.09Å; E145-R149 IonicContact OE1-NH2 3.3Å; E145-R149 PolarHBondContact OE1-NH2 3.24Å
146	R	84.8	Confident	82.8	Confident	169 Å²	169	111.3 Å²	111.3	64%	0.638	53%	0.532	S	S	*	.	H	α-helix	trans	-66.2	-43.5	175.3	-176.4	179.1	-179.2	-83.6	-4.5	111.4	L142 E143 K144 R149 I150	L142-R146 WeakPolarHBondContact O-CB 3.4Å; L142-R146 PolarHBondContact O-N 2.94Å; E143-R146 WeakPolarHBondContact O-CB 3.31Å; E143-R146 PolarHBondContact O-N 2.71Å; K144-R146 VanDerWaalsContact C-N 3.26Å; K144-R146 PolarHBondContact O-N 3.17Å; R146-R149 PolarHBondContact O-N 3.03Å; R146-I150 HydrophobicContact CG-CD1 4.07Å; R146-I150 WeakPolarHBondContact O-CD1 3.4Å; R146-I150 WeakPolarHBondContact O-CG1 2.8Å; R146-I150 PolarHBondContact O-N 2.93Å
147	E	85.4	Confident	82.1	Confident	115 Å²	115	106.7 Å²	106.7	54%	0.537	52%	0.522	S	S	.	.	H	α-helix	trans	-65.4	-43.3	176.5	-73.8	173.9	178.6	0	0	111.8	E143 K144 R149 I150 A151	E143-E147 WeakPolarHBondContact O-CG 3.26Å; E143-E147 PolarHBondContact O-N 2.8Å; K144-E147 PolarHBondContact O-N 3.41Å; E147-R149 PolarHBondContact O-N 2.85Å; E147-I150 PolarHBondContact O-N 3.23Å; E147-A151 WeakPolarHBondContact O-CB 3.37Å; E147-A151 PolarHBondContact O-N 3.17Å
148	E	86.4	Confident	81.2	Confident	95 Å²	95	107.8 Å²	107.8	44%	0.444	53%	0.53	S	S	.	.	H	α-helix	trans	-61.1	-44.5	175.1	-74.7	173.7	165.9	0	0	110.8	K144 I150 A151 E152	K144-E148 WeakPolarHBondContact CE-OE1 3.39Å; K144-E148 HydrophobicContact CG-CG 4.33Å; K144-E148 IonicContact NZ-OE1 3.18Å; K144-E148 WeakPolarHBondContact O-CB 3.14Å; K144-E148 VanDerWaalsContact O-CG 3.31Å; K144-E148 WeakPolarHBondContact O-CG 3.49Å; K144-E148 PolarHBondContact O-N 2.92Å; E148-I150 VanDerWaalsContact C-N 3.31Å; E148-I150 PolarHBondContact O-N 2.9Å; E148-A151 PolarHBondContact O-N 2.9Å; E148-E152 WeakPolarHBondContact O-CB 3.46Å; E148-E152 WeakPolarHBondContact O-CG 3.39Å; E148-E152 PolarHBondContact O-N 3.34Å
149	R	82.6	Confident	80.5	Confident	158 Å²	158	104.7 Å²	104.7	60%	0.596	53%	0.529	S	S	*	.	H	α-helix	trans	-63	-35.9	174.8	-168.6	-175	-60.7	-177.3	2.8	112.7	E145 R146 E147 A153	E145-R149 VanDerWaalsContact O-CB 3.32Å; E145-R149 WeakPolarHBondContact O-CB 3.49Å; E145-R149 PolarHBondContact O-N 3.09Å; E145-R149 IonicContact OE1-NH2 3.3Å; E145-R149 PolarHBondContact OE1-NH2 3.24Å; R146-R149 PolarHBondContact O-N 3.03Å; E147-R149 PolarHBondContact O-N 2.85Å; R149-A153 WeakPolarHBondContact O-CB 3.34Å; R149-A153 PolarHBondContact O-N 2.9Å; R149-A153 VanDerWaalsContact O-N 3.11Å
150	I	77.4	Confident	80.3	Confident	66 Å²	66	98.6 Å²	98.6	34%	0.338	51%	0.508	S	S	.	.	H	α-helix	trans	-67.6	-46.3	175	-70.1	162.6	0	0	0	109.8	R146 E147 E148 E152 A153 E154	R146-I150 HydrophobicContact CG-CD1 4.07Å; R146-I150 WeakPolarHBondContact O-CD1 3.4Å; R146-I150 WeakPolarHBondContact O-CG1 2.8Å; R146-I150 PolarHBondContact O-N 2.93Å; E147-I150 PolarHBondContact O-N 3.23Å; E148-I150 VanDerWaalsContact C-N 3.31Å; E148-I150 PolarHBondContact O-N 2.9Å; I150-E152 PolarHBondContact O-N 3.2Å; I150-A153 PolarHBondContact O-N 2.88Å; I150-E154 HydrophobicContact CG2-CG 4.44Å; I150-E154 WeakPolarHBondContact O-CG 3.48Å; I150-E154 PolarHBondContact O-N 3.12Å
151	A	78.1	Confident	80.1	Confident	44 Å²	44	98.6 Å²	98.6	36%	0.364	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-41.8	179.4	0	0	0	0	0	112.1	E147 E148 E154 I155	E147-A151 WeakPolarHBondContact O-CB 3.37Å; E147-A151 PolarHBondContact O-N 3.17Å; E148-A151 PolarHBondContact O-N 2.9Å; A151-E154 PolarHBondContact O-N 3.21Å; A151-I155 VanDerWaalsContact O-CG1 3.25Å; A151-I155 WeakPolarHBondContact O-CG1 3.44Å; A151-I155 PolarHBondContact O-N 2.89Å
152	E	79.8	Confident	80.1	Confident	123 Å²	123	101.5 Å²	101.5	58%	0.575	51%	0.506	S	S	*	.	H	α-helix	trans	-60.2	-46.6	173.4	-75	174.6	178	0	0	111.3	E148 I150 E154 I155 E156	E148-E152 WeakPolarHBondContact O-CB 3.46Å; E148-E152 WeakPolarHBondContact O-CG 3.39Å; E148-E152 PolarHBondContact O-N 3.34Å; I150-E152 PolarHBondContact O-N 3.2Å; E152-E154 VanDerWaalsContact C-N 3.32Å; E152-E154 PolarHBondContact O-N 3.18Å; E152-I155 PolarHBondContact O-N 3.1Å; E152-E156 PolarHBondContact O-N 3.4Å
153	A	74	Confident	80.1	Confident	40 Å²	40	99.9 Å²	99.9	33%	0.331	50%	0.496	S	S	.	.	H	α-helix	trans	-63.9	-35.8	176.4	0	0	0	0	0	112.4	R149 I150 N157	R149-A153 WeakPolarHBondContact O-CB 3.34Å; R149-A153 PolarHBondContact O-N 2.9Å; R149-A153 VanDerWaalsContact O-N 3.11Å; I150-A153 PolarHBondContact O-N 2.88Å; A153-N157 VanDerWaalsContact O-CB 3.31Å; A153-N157 WeakPolarHBondContact O-CB 3.32Å; A153-N157 VanDerWaalsContact O-CG 3.26Å; A153-N157 PolarHBondContact O-N 2.89Å; A153-N157 PolarHBondContact O-ND2 3.36Å
154	E	75.3	Confident	80.3	Confident	122 Å²	122	97.8 Å²	97.8	57%	0.57	49%	0.49	S	S	*	.	H	α-helix	trans	-65.4	-41.6	174	-76.3	176.2	179.8	0	0	111.6	I150 A151 E152 N157 L158	I150-E154 HydrophobicContact CG2-CG 4.44Å; I150-E154 WeakPolarHBondContact O-CG 3.48Å; I150-E154 PolarHBondContact O-N 3.12Å; A151-E154 PolarHBondContact O-N 3.21Å; E152-E154 VanDerWaalsContact C-N 3.32Å; E152-E154 PolarHBondContact O-N 3.18Å; E154-N157 WeakPolarHBondContact O-CB 3.43Å; E154-N157 PolarHBondContact O-N 2.97Å; E154-L158 WeakPolarHBondContact O-CG 3.4Å; E154-L158 PolarHBondContact O-N 3.22Å
155	I	71.4	Confident	80.5	Confident	116 Å²	116	92.5 Å²	92.5	60%	0.595	47%	0.467	S	S	*	.	H	α-helix	trans	-63.3	-44.9	175.8	-66.8	162.9	0	0	0	111	A151 E152 N157 L158	A151-I155 VanDerWaalsContact O-CG1 3.25Å; A151-I155 WeakPolarHBondContact O-CG1 3.44Å; A151-I155 PolarHBondContact O-N 2.89Å; E152-I155 PolarHBondContact O-N 3.1Å; I155-N157 VanDerWaalsContact C-N 3.3Å; I155-N157 PolarHBondContact O-N 3.01Å; I155-L158 PolarHBondContact O-N 3.42Å
156	E	69.9	Low	80.6	Confident	147 Å²	147	89.8 Å²	89.8	69%	0.687	46%	0.459	S	S	*	.	H	α-helix	trans	-61.1	-41.6	174.4	-73.1	-173.8	169	0	0	111.3	E152 L158 S159 G160	E152-E156 PolarHBondContact O-N 3.4Å; E156-L158 VanDerWaalsContact C-N 3.32Å; E156-L158 PolarHBondContact O-N 3.33Å; E156-S159 PolarHBondContact O-N 3.33Å; E156-S159 PolarHBondContact O-OG 3.22Å; E156-G160 PolarHBondContact O-N 3.39Å
157	N	70.5	Confident	80.9	Confident	102 Å²	102	86.9 Å²	86.9	55%	0.545	45%	0.452	S	S	.	.	H	α-helix	trans	-63.3	-32.6	178	-82.8	-54.7	0	0	0	113.2	A153 E154 I155 S159 G160 H163	A153-N157 VanDerWaalsContact O-CB 3.31Å; A153-N157 WeakPolarHBondContact O-CB 3.32Å; A153-N157 VanDerWaalsContact O-CG 3.26Å; A153-N157 PolarHBondContact O-N 2.89Å; A153-N157 PolarHBondContact O-ND2 3.36Å; E154-N157 WeakPolarHBondContact O-CB 3.43Å; E154-N157 PolarHBondContact O-N 2.97Å; I155-N157 VanDerWaalsContact C-N 3.3Å; I155-N157 PolarHBondContact O-N 3.01Å; N157-S159 VanDerWaalsContact C-N 3.28Å; N157-S159 PolarHBondContact O-N 3.43Å; N157-G160 PolarHBondContact O-N 3.02Å; N157-H163 WeakPolarHBondContact O-CB 3.34Å
158	L	67.4	Low	81.4	Confident	108 Å²	108	85.1 Å²	85.1	57%	0.565	44%	0.443	S	S	*	.	H	α-helix	trans	-60.9	-38.2	176	-71.7	169.8	0	0	0	112	E154 I155 E156 G160 H163	E154-L158 WeakPolarHBondContact O-CG 3.4Å; E154-L158 PolarHBondContact O-N 3.22Å; I155-L158 PolarHBondContact O-N 3.42Å; E156-L158 VanDerWaalsContact C-N 3.32Å; E156-L158 PolarHBondContact O-N 3.33Å; L158-G160 VanDerWaalsContact C-N 3.33Å; L158-H163 PolarHBondContact O-CD2 2.8Å
159	S	72.7	Confident	81.8	Confident	96 Å²	96	80.6 Å²	80.6	67%	0.671	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-2.2	174.3	67.6	0	0	0	0	113.7	E156 N157	E156-S159 PolarHBondContact O-N 3.33Å; E156-S159 PolarHBondContact O-OG 3.22Å; N157-S159 VanDerWaalsContact C-N 3.28Å; N157-S159 PolarHBondContact O-N 3.43Å
160	G	82.8	Confident	82.3	Confident	21 Å²	21	75.5 Å²	75.5	22%	0.216	41%	0.414	C	S	.	.	S	Bend	trans	-66.8	146.4	-174.8	0	0	0	0	0	112	E156 N157 L158 R162 H163 V164	E156-G160 PolarHBondContact O-N 3.39Å; N157-G160 PolarHBondContact O-N 3.02Å; L158-G160 VanDerWaalsContact C-N 3.33Å; G160-R162 PolarHBondContact O-N 3.5Å; G160-H163 PolarHBondContact O-N 3.27Å; G160-V164 PolarHBondContact O-N 3.19Å; G160-V164 VanDerWaalsContact O-N 3.14Å
161	A	85.1	Confident	83.1	Confident	55 Å²	55	78.2 Å²	78.2	46%	0.455	43%	0.425	S	S	.	.	H	α-helix	trans	-51.6	-35.4	178.8	0	0	0	0	0	112.9	E165 H301	A161-E165 WeakPolarHBondContact O-CB 3.19Å; A161-E165 PolarHBondContact O-N 3.46Å; A161-H301 HydrophobicContact CB-CB 4.37Å
162	R	87.3	Confident	83.9	Confident	120 Å²	120	78.7 Å²	78.7	45%	0.453	42%	0.421	S	S	.	.	H	α-helix	trans	-62.2	-46.1	174.9	-178.7	178.7	176.2	-170.8	5.6	113.2	G160 S166 H301 A302	G160-R162 PolarHBondContact O-N 3.5Å; R162-S166 WeakPolarHBondContact O-CB 3.45Å; R162-S166 PolarHBondContact O-N 3.24Å; R162-S166 PolarHBondContact O-OG 2.65Å; R162-H301 HydrophobicContact CB-CB 4.34Å; R162-H301 VanDerWaalsContact CB-O 3.27Å; R162-H301 WeakPolarHBondContact CB-O 3.31Å; R162-H301 VanDerWaalsContact CG-O 3.24Å; R162-H301 WeakPolarHBondContact CG-O 3.45Å; R162-A302 WeakPolarHBondContact CD-O 3.46Å; R162-A302 VanDerWaalsContact CZ-O 3.23Å; R162-A302 PolarHBondContact NE-O 3.06Å
163	H	87.1	Confident	84.7	Confident	81 Å²	81	72.9 Å²	72.9	38%	0.375	39%	0.394	S	S	.	.	H	α-helix	trans	-67.6	-46.6	-177.6	-175.2	80.3	0	0	0	110.2	N157 L158 G160 E165 S166 E167	N157-H163 WeakPolarHBondContact O-CB 3.34Å; L158-H163 PolarHBondContact O-CD2 2.8Å; G160-H163 PolarHBondContact O-N 3.27Å; H163-E165 VanDerWaalsContact C-N 3.34Å; H163-E165 PolarHBondContact O-N 2.82Å; H163-S166 PolarHBondContact O-N 3.5Å; H163-E167 WeakPolarHBondContact O-CB 3.46Å; H163-E167 PolarHBondContact O-N 3.04Å
164	V	90.4	Very high	85.6	Confident	60 Å²	60	73.7 Å²	73.7	36%	0.364	40%	0.4	S	S	.	.	H	α-helix	trans	-58.2	-45.2	175.6	177.9	0	0	0	0	111.4	G160 E167 K168	G160-V164 PolarHBondContact O-N 3.19Å; G160-V164 VanDerWaalsContact O-N 3.14Å; V164-E167 PolarHBondContact O-N 2.94Å; V164-K168 HydrophobicContact CG1-CD 4.47Å; V164-K168 WeakPolarHBondContact O-CG 3.34Å; V164-K168 PolarHBondContact O-N 2.94Å; V164-K168 VanDerWaalsContact O-N 3.09Å
165	E	92.6	Very high	86.5	Confident	9 Å²	9	72.1 Å²	72.1	4%	0.042	41%	0.408	C	S	.	.	H	α-helix	trans	-62.2	-44.2	176.2	-178.5	175	-113.7	0	0	111.9	A161 H163 K168 L169 A278 R300 H301	A161-E165 WeakPolarHBondContact O-CB 3.19Å; A161-E165 PolarHBondContact O-N 3.46Å; H163-E165 VanDerWaalsContact C-N 3.34Å; H163-E165 PolarHBondContact O-N 2.82Å; E165-K168 PolarHBondContact O-N 2.86Å; E165-L169 HydrophobicContact CG-CD1 4.06Å; E165-L169 WeakPolarHBondContact O-CB 3.45Å; E165-L169 WeakPolarHBondContact O-CG 3.33Å; E165-L169 PolarHBondContact O-N 3.05Å; E165-A278 HydrophobicContact CB-CB 4.35Å; E165-A278 HydrophobicContact CG-CB 3.67Å; E165-R300 VanDerWaalsContact CD-N 3.35Å; E165-R300 WeakPolarHBondContact OE1-CB 3.4Å; E165-R300 PolarHBondContact OE1-N 3.22Å; E165-R300 PolarHBondContact OE2-N 3.01Å; E165-H301 IonicContact OE1-ND1 2.71Å; E165-H301 WeakPolarHBondContact OE2-CA 3.32Å; E165-H301 PolarHBondContact OE2-N 3.4Å; E165-H301 IonicContact OE2-ND1 3.65Å
166	S	91.6	Very high	87.6	Confident	39 Å²	39	71.3 Å²	71.3	27%	0.273	40%	0.397	S	S	.	.	H	α-helix	trans	-65.1	-40.4	179.7	-57.2	0	0	0	0	112	R162 H163 L169 A170 M299	R162-S166 WeakPolarHBondContact O-CB 3.45Å; R162-S166 PolarHBondContact O-N 3.24Å; R162-S166 PolarHBondContact O-OG 2.65Å; H163-S166 PolarHBondContact O-N 3.5Å; S166-L169 PolarHBondContact O-N 3.49Å; S166-A170 VanDerWaalsContact O-CB 3.32Å; S166-A170 WeakPolarHBondContact O-CB 3.47Å; S166-A170 PolarHBondContact O-N 3.14Å; S166-M299 WeakPolarHBondContact OG-CE 3.28Å
167	E	92.1	Very high	88.8	Confident	107 Å²	107	71.2 Å²	71.2	50%	0.5	40%	0.397	S	S	.	.	H	α-helix	trans	-66.1	-45.4	178.2	-172.3	-179.9	-161.8	0	0	111.4	H163 V164 L169 A170 Q171	H163-E167 WeakPolarHBondContact O-CB 3.46Å; H163-E167 PolarHBondContact O-N 3.04Å; V164-E167 PolarHBondContact O-N 2.94Å; E167-L169 PolarHBondContact O-N 3.37Å; E167-A170 PolarHBondContact O-N 2.93Å; E167-Q171 WeakPolarHBondContact O-CG 3.45Å; E167-Q171 PolarHBondContact O-N 3.43Å
168	K	94.3	Very high	90	Very high	78 Å²	78	67.5 Å²	67.5	34%	0.339	38%	0.377	S	S	.	.	H	α-helix	trans	-59	-47.1	174.8	-72.9	178.3	-177	-173.3	0	111.8	V164 E165 A170 Q171 I172 A278 D279	V164-K168 HydrophobicContact CG1-CD 4.47Å; V164-K168 WeakPolarHBondContact O-CG 3.34Å; V164-K168 PolarHBondContact O-N 2.94Å; V164-K168 VanDerWaalsContact O-N 3.09Å; E165-K168 PolarHBondContact O-N 2.86Å; K168-A170 VanDerWaalsContact C-N 3.33Å; K168-A170 PolarHBondContact O-N 3.06Å; K168-Q171 WeakPolarHBondContact O-CB 3.21Å; K168-Q171 PolarHBondContact O-N 3.37Å; K168-I172 WeakPolarHBondContact O-CG1 3.35Å; K168-I172 PolarHBondContact O-N 3.14Å; K168-A278 HydrophobicContact CB-CB 4.02Å; K168-A278 HydrophobicContact CD-CB 4.15Å; K168-D279 IonicContact NZ-OD1 3.2Å; K168-D279 PolarHBondContact NZ-OD1 2.94Å
169	L	95	Very high	91.3	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-63.6	-40	177.9	-77.1	167.3	0	0	0	111.8	E165 S166 E167 Q171 I172 L173 I180 A278 V297 M299	E165-L169 HydrophobicContact CG-CD1 4.06Å; E165-L169 WeakPolarHBondContact O-CB 3.45Å; E165-L169 WeakPolarHBondContact O-CG 3.33Å; E165-L169 PolarHBondContact O-N 3.05Å; S166-L169 PolarHBondContact O-N 3.49Å; E167-L169 PolarHBondContact O-N 3.37Å; L169-Q171 VanDerWaalsContact C-N 3.29Å; L169-Q171 PolarHBondContact O-N 3.5Å; L169-I172 PolarHBondContact O-N 3.22Å; L169-L173 WeakPolarHBondContact O-CB 3.48Å; L169-L173 WeakPolarHBondContact O-CD1 3.47Å; L169-L173 WeakPolarHBondContact O-CG 3.35Å; L169-L173 PolarHBondContact O-N 3.37Å; L169-I180 HydrophobicContact CB-CD1 4.25Å; L169-A278 HydrophobicContact CD1-CB 4.47Å; L169-A278 HydrophobicContact CD2-CB 4.49Å; L169-A278 HydrophobicContact CG-CB 4.02Å; L169-V297 HydrophobicContact CD1-CG1 3.71Å; L169-V297 HydrophobicContact CD2-CG1 3.94Å; L169-V297 HydrophobicContact CG-CG1 4.33Å; L169-M299 HydrophobicContact CD1-CE 4.32Å; L169-M299 HydrophobicContact CD1-CG 3.55Å; L169-M299 HydrophobicContact CD1-SD 4.31Å
170	A	93.4	Very high	92.4	Very high	52 Å²	52	64.1 Å²	64.1	43%	0.43	35%	0.349	S	S	.	.	H	α-helix	trans	-59.7	-40.5	175	0	0	0	0	0	111.6	S166 E167 K168 L173 A174	S166-A170 VanDerWaalsContact O-CB 3.32Å; S166-A170 WeakPolarHBondContact O-CB 3.47Å; S166-A170 PolarHBondContact O-N 3.14Å; E167-A170 PolarHBondContact O-N 2.93Å; K168-A170 VanDerWaalsContact C-N 3.33Å; K168-A170 PolarHBondContact O-N 3.06Å; A170-L173 PolarHBondContact O-N 3.05Å; A170-A174 WeakPolarHBondContact O-CB 3.3Å; A170-A174 PolarHBondContact O-N 2.73Å
171	Q	94.3	Very high	93	Very high	123 Å²	123	66.4 Å²	66.4	58%	0.575	35%	0.353	S	S	*	.	H	α-helix	trans	-65.2	-44.6	175.1	-67.6	172.1	13.8	0	0	112.2	E167 K168 L169 L173 A174 A175	E167-Q171 WeakPolarHBondContact O-CG 3.45Å; E167-Q171 PolarHBondContact O-N 3.43Å; K168-Q171 WeakPolarHBondContact O-CB 3.21Å; K168-Q171 PolarHBondContact O-N 3.37Å; L169-Q171 VanDerWaalsContact C-N 3.29Å; L169-Q171 PolarHBondContact O-N 3.5Å; Q171-L173 VanDerWaalsContact C-N 3.33Å; Q171-L173 PolarHBondContact O-N 2.86Å; Q171-A174 PolarHBondContact O-N 3.39Å; Q171-A175 PolarHBondContact O-N 3.29Å; Q171-A175 VanDerWaalsContact O-N 3.16Å
172	I	95.3	Very high	93.5	Very high	54 Å²	54	69.2 Å²	69.2	28%	0.277	36%	0.357	S	S	.	.	H	α-helix	trans	-61	-43.7	177.5	-67.6	165.8	0	0	0	110.9	K168 L169	K168-I172 WeakPolarHBondContact O-CG1 3.35Å; K168-I172 PolarHBondContact O-N 3.14Å; L169-I172 PolarHBondContact O-N 3.22Å
173	L	95.6	Very high	93.9	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-72.7	-40.6	-178.7	-70	165.2	0	0	0	112	L169 A170 Q171 A175 R176 E177 L178 I180 L276 V297 V312	L169-L173 WeakPolarHBondContact O-CB 3.48Å; L169-L173 WeakPolarHBondContact O-CD1 3.47Å; L169-L173 WeakPolarHBondContact O-CG 3.35Å; L169-L173 PolarHBondContact O-N 3.37Å; A170-L173 PolarHBondContact O-N 3.05Å; Q171-L173 VanDerWaalsContact C-N 3.33Å; Q171-L173 PolarHBondContact O-N 2.86Å; L173-A175 VanDerWaalsContact C-N 3.29Å; L173-A175 PolarHBondContact O-N 3.09Å; L173-R176 CarbonylContact O-C 3.59Å; L173-R176 WeakPolarHBondContact O-CA 3.27Å; L173-R176 PolarHBondContact O-N 3.35Å; L173-E177 PolarHBondContact O-N 3.31Å; L173-E177 VanDerWaalsContact O-N 3.14Å; L173-L178 CarbonylContact C-O 3.54Å; L173-L178 VanDerWaalsContact C-O 3.31Å; L173-L178 HydrophobicContact CB-CB 4.24Å; L173-L178 WeakPolarHBondContact CB-O 3.38Å; L173-L178 HydrophobicContact CD2-CB 3.84Å; L173-L178 HydrophobicContact CD2-CD1 4.33Å; L173-L178 PolarHBondContact O-N 2.84Å; L173-I180 HydrophobicContact CD1-CB 4.41Å; L173-I180 HydrophobicContact CD1-CD1 3.95Å; L173-I180 HydrophobicContact CD1-CG1 3.19Å; L173-L276 HydrophobicContact CD2-CD1 3.51Å; L173-L276 HydrophobicContact CG-CD1 4.46Å; L173-V297 HydrophobicContact CD1-CG2 4Å; L173-V297 HydrophobicContact CD2-CG2 3.99Å; L173-V312 HydrophobicContact CD2-CG1 3.78Å
174	A	94.1	Very high	94.2	Very high	57 Å²	57	64.7 Å²	64.7	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-60.1	-39.5	176.8	0	0	0	0	0	112	A170 Q171 R176 E177	A170-A174 WeakPolarHBondContact O-CB 3.3Å; A170-A174 PolarHBondContact O-N 2.73Å; Q171-A174 PolarHBondContact O-N 3.39Å; A174-R176 PolarHBondContact O-N 3.2Å; A174-R176 VanDerWaalsContact O-N 3.12Å; A174-E177 PolarHBondContact O-N 3.29Å; A174-E177 VanDerWaalsContact O-N 3.11Å
175	A	94.3	Very high	94.1	Very high	88 Å²	88	65.6 Å²	65.6	73%	0.727	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.9	174.4	0	0	0	0	0	113.6	Q171 L173	Q171-A175 PolarHBondContact O-N 3.29Å; Q171-A175 VanDerWaalsContact O-N 3.16Å; L173-A175 VanDerWaalsContact C-N 3.29Å; L173-A175 PolarHBondContact O-N 3.09Å
176	R	94.6	Very high	94	Very high	99 Å²	99	69.5 Å²	69.5	37%	0.374	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	7.8	178.7	-60.9	-179.8	178	-146.7	4.8	113.2	L173 A174 L178 E274 P282	L173-R176 CarbonylContact O-C 3.59Å; L173-R176 WeakPolarHBondContact O-CA 3.27Å; L173-R176 PolarHBondContact O-N 3.35Å; A174-R176 PolarHBondContact O-N 3.2Å; A174-R176 VanDerWaalsContact O-N 3.12Å; R176-L178 HydrophobicContact CB-CD1 4.01Å; R176-L178 HydrophobicContact CB-CG 4.19Å; R176-L178 PolarHBondContact O-N 3.39Å; R176-E274 IonicContact CZ-OE1 3.95Å; R176-E274 IonicContact NH1-OE1 3.55Å; R176-E274 PolarHBondContact NH1-OE1 3.03Å; R176-E274 IonicContact NH1-OE2 3.19Å; R176-E274 PolarHBondContact NH1-OE2 3.21Å; R176-E274 IonicContact NH2-OE1 3.61Å; R176-E274 PolarHBondContact NH2-OE1 3.46Å; R176-E274 VanDerWaalsContact NH2-OE1 3.08Å; R176-P282 VanDerWaalsContact NH2-CG 3.31Å
177	E	95.3	Very high	93.9	Very high	146 Å²	146	68.2 Å²	68.2	68%	0.682	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	35.6	-174.7	-54.4	178.6	173.9	0	0	113.2	L173 A174 L315	L173-E177 PolarHBondContact O-N 3.31Å; L173-E177 VanDerWaalsContact O-N 3.14Å; A174-E177 PolarHBondContact O-N 3.29Å; A174-E177 VanDerWaalsContact O-N 3.11Å; E177-L315 WeakPolarHBondContact O-CB 3.36Å; E177-L315 PolarHBondContact O-N 3.28Å
178	L	95.7	Very high	94	Very high	24 Å²	24	65.5 Å²	65.5	13%	0.126	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	159.5	178.9	-63.4	172.4	0	0	0	111	L173 R176 I295 V312 T313	L173-L178 CarbonylContact C-O 3.54Å; L173-L178 VanDerWaalsContact C-O 3.31Å; L173-L178 HydrophobicContact CB-CB 4.24Å; L173-L178 WeakPolarHBondContact CB-O 3.38Å; L173-L178 HydrophobicContact CD2-CB 3.84Å; L173-L178 HydrophobicContact CD2-CD1 4.33Å; L173-L178 PolarHBondContact O-N 2.84Å; R176-L178 HydrophobicContact CB-CD1 4.01Å; R176-L178 HydrophobicContact CB-CG 4.19Å; R176-L178 PolarHBondContact O-N 3.39Å; L178-I295 HydrophobicContact CD1-CD1 3.87Å; L178-I295 HydrophobicContact CD1-CG2 4.47Å; L178-V312 HydrophobicContact CD1-CG2 4.28Å; L178-V312 HydrophobicContact CD2-CG2 4.3Å; L178-T313 CarbonylContact C-O 3.6Å; L178-T313 WeakPolarHBondContact CA-O 3.39Å
179	E	94.9	Very high	94.1	Very high	87 Å²	87	62.5 Å²	62.5	41%	0.407	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	155.9	169	64.6	177.2	-171.6	0	0	111.5	K181 V312 T313 L315	E179-K181 PolarHBondContact O-N 3.04Å; E179-V312 CarbonylContact O-C 3.58Å; E179-V312 VanDerWaalsContact O-CA 3.29Å; E179-V312 WeakPolarHBondContact O-CA 3.36Å; E179-T313 HydrophobicContact CG-CG2 3.56Å; E179-T313 PolarHBondContact N-O 3.45Å; E179-T313 PolarHBondContact O-N 3.49Å; E179-T313 WeakPolarHBondContact OE1-CG2 3.22Å; E179-L315 HydrophobicContact CB-CD1 4.13Å; E179-L315 HydrophobicContact CG-CD1 4.49Å
180	I	95.4	Very high	94.2	Very high	46 Å²	46	62.6 Å²	62.6	24%	0.236	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	125.8	177.7	-58.4	-178.6	0	0	0	109.2	L169 L173 V297 M299 N310	L169-I180 HydrophobicContact CB-CD1 4.25Å; L173-I180 HydrophobicContact CD1-CB 4.41Å; L173-I180 HydrophobicContact CD1-CD1 3.95Å; L173-I180 HydrophobicContact CD1-CG1 3.19Å; I180-V297 HydrophobicContact CD1-CG1 4.1Å; I180-V297 HydrophobicContact CG1-CG1 4.4Å; I180-V297 HydrophobicContact CG1-CG2 4.43Å; I180-M299 HydrophobicContact CD1-SD 4.4Å; I180-N310 HydrophobicContact CG2-CB 3.66Å
181	K	95.4	Very high	94.4	Very high	68 Å²	68	60.1 Å²	60.1	30%	0.296	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	109	167.1	-176.2	169.3	170.3	-164.3	0	109.6	E179 I183 D196 E200 S311	E179-K181 PolarHBondContact O-N 3.04Å; K181-I183 PolarHBondContact O-N 3.02Å; K181-D196 VanDerWaalsContact CD-OD2 3.27Å; K181-D196 WeakPolarHBondContact CD-OD2 3.42Å; K181-D196 WeakPolarHBondContact CE-OD1 3.46Å; K181-D196 WeakPolarHBondContact CE-OD2 3.46Å; K181-D196 IonicContact NZ-OD1 2.73Å; K181-D196 PolarHBondContact NZ-OD1 3.22Å; K181-D196 IonicContact NZ-OD2 3.03Å; K181-D196 PolarHBondContact NZ-OD2 3.4Å; K181-E200 IonicContact NZ-OE1 3.98Å; K181-S311 PolarHBondContact N-O 3.03Å; K181-S311 PolarHBondContact O-N 3.31Å
182	Q	94.6	Very high	94.6	Very high	115 Å²	115	54.8 Å²	54.8	54%	0.537	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-64.9	128.5	-173.9	-64	-74.5	35.3	0	0	111.8	N310	Q182-N310 WeakPolarHBondContact CA-OD1 3.47Å; Q182-N310 VanDerWaalsContact OE1-CG 3.28Å; Q182-N310 PolarHBondContact OE1-ND2 3.39Å; Q182-N310 PolarHBondContact OE1-OD1 3.05Å
183	I	95.3	Very high	94.7	Very high	16 Å²	16	52.2 Å²	52.2	8%	0.082	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-103.8	142.3	175.3	-60	-61.1	0	0	0	109.4	K181 C189 A193 D196 H308 N310	K181-I183 PolarHBondContact O-N 3.02Å; I183-C189 HydrophobicContact CG2-CB 4.23Å; I183-A193 HydrophobicContact CG1-CB 4.01Å; I183-D196 HydrophobicContact CD1-CB 4.18Å; I183-H308 PolarHBondContact O-CE1 3Å; I183-H308 VanDerWaalsContact O-CE1 3.23Å; I183-H308 PolarHBondContact O-NE2 3.14Å; I183-N310 PolarHBondContact N-OD1 3.48Å
184	P	93.3	Very high	94.7	Very high	89 Å²	89	52.2 Å²	52.2	58%	0.578	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-55.3	142.5	176.8	-26.2	35.5	0	0	0	113.5	D186	P184-D186 VanDerWaalsContact C-N 3.32Å; P184-D186 PolarHBondContact O-N 3.38Å; P184-D186 VanDerWaalsContact O-N 3.17Å
185	S	89.2	Confident	94.9	Very high	80 Å²	80	51.5 Å²	51.5	56%	0.559	28%	0.279	S	S	*	.			trans	-88.2	60.8	178.9	65	0	0	0	0	111.9
186	D	90.4	Very high	95	Very high	90 Å²	90	48 Å²	48	48%	0.481	25%	0.249	S	C	.	.	S	Bend	trans	-105.7	10.3	-174.8	65.5	-3.2	0	0	0	113.9	P184 H188	P184-D186 VanDerWaalsContact C-N 3.32Å; P184-D186 PolarHBondContact O-N 3.38Å; P184-D186 VanDerWaalsContact O-N 3.17Å; D186-H188 PolarHBondContact O-CD2 2.77Å; D186-H188 PolarHBondContact O-N 2.94Å; D186-H188 WeakPolarHBondContact OD1-CA 3.37Å; D186-H188 WeakPolarHBondContact OD1-CB 3.44Å; D186-H188 IonicContact OD1-CD2 2.69Å; D186-H188 IonicContact OD1-CG 3.75Å; D186-H188 PolarHBondContact OD1-N 2.94Å; D186-H188 IonicContact OD2-CD2 3.67Å
187	G	89.9	Confident	95	Very high	13 Å²	13	43.9 Å²	43.9	13%	0.134	23%	0.234	C	C	.	.	S	Bend	trans	79.8	-3.5	-174.5	0	0	0	0	0	114.1	R211	G187-R211 PolarHBondContact O-NH2 3.22Å
188	H	94.8	Very high	95	Very high	50 Å²	50	37.2 Å²	37.2	23%	0.231	20%	0.203	C	C	.	.			trans	-103.6	8.6	173.5	-53.9	-79.5	0	0	0	112.7	D186 M190 Y191 G192 V207 R211	D186-H188 PolarHBondContact O-CD2 2.77Å; D186-H188 PolarHBondContact O-N 2.94Å; D186-H188 WeakPolarHBondContact OD1-CA 3.37Å; D186-H188 WeakPolarHBondContact OD1-CB 3.44Å; D186-H188 IonicContact OD1-CD2 2.69Å; D186-H188 IonicContact OD1-CG 3.75Å; D186-H188 PolarHBondContact OD1-N 2.94Å; D186-H188 IonicContact OD2-CD2 3.67Å; H188-M190 VanDerWaalsContact C-N 3.35Å; H188-M190 PolarHBondContact O-N 3.11Å; H188-Y191 PolarHBondContact O-N 3.31Å; H188-G192 PolarHBondContact O-N 3.23Å; H188-V207 HydrophobicContact CB-CG1 4Å; H188-R211 VanDerWaalsContact ND1-CZ 3.27Å; H188-R211 PolarHBondContact ND1-NE 2.93Å; H188-R211 PolarHBondContact ND1-NH2 2.95Å
189	C	95.6	Very high	94.9	Very high	14 Å²	14	43 Å²	43	10%	0.095	22%	0.223	C	C	.	.	H	α-helix	trans	-52.8	-42.1	-169.2	59.3	0	0	0	0	115	I183 Y191 G192 A193 H308	I183-C189 HydrophobicContact CG2-CB 4.23Å; C189-Y191 PolarHBondContact O-N 2.8Å; C189-G192 PolarHBondContact O-N 2.99Å; C189-A193 VanDerWaalsContact O-CB 3.32Å; C189-A193 WeakPolarHBondContact O-CB 3.42Å; C189-A193 PolarHBondContact O-N 2.87Å; C189-H308 WeakPolarHBondContact CB-CE1 3.43Å; C189-H308 WeakPolarHBondContact CB-ND1 3.41Å
190	M	97.1	Very high	94.5	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-48.4	176.2	-174.4	-163.5	77.1	0	0	111.9	H188 L194 E261 L262 L265 Y309	H188-M190 VanDerWaalsContact C-N 3.35Å; H188-M190 PolarHBondContact O-N 3.11Å; M190-L194 PolarHBondContact O-N 3Å; M190-E261 HydrophobicContact CE-CB 3.51Å; M190-E261 HydrophobicContact CE-CG 4.26Å; M190-E261 HydrophobicContact SD-CB 4.23Å; M190-L262 HydrophobicContact CE-CD2 4.47Å; M190-L262 HydrophobicContact CG-CD2 3.78Å; M190-L262 HydrophobicContact CG-CG 4.29Å; M190-L262 HydrophobicContact SD-CD1 4.36Å; M190-L262 HydrophobicContact SD-CD2 3.73Å; M190-L262 HydrophobicContact SD-CG 3.7Å; M190-L265 HydrophobicContact CE-CD1 4.07Å; M190-Y309 HydrophobicContact CB-CD2 3.69Å; M190-Y309 HydrophobicContact CB-CE2 4.14Å; M190-Y309 HydrophobicContact CB-CG 4.04Å; M190-Y309 HydrophobicContact CG-CD1 4.49Å; M190-Y309 HydrophobicContact CG-CD2 4.1Å; M190-Y309 HydrophobicContact CG-CE2 4.2Å; M190-Y309 HydrophobicContact CG-CG 4.24Å
191	Y	97.8	Very high	94	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-69.9	-36.4	177.8	-65.4	-81.4	0	0	0	112	H188 C189 L194 E195 L210 R211 I250 E261 L265	H188-Y191 PolarHBondContact O-N 3.31Å; C189-Y191 PolarHBondContact O-N 2.8Å; Y191-L194 PolarHBondContact O-N 2.86Å; Y191-E195 WeakPolarHBondContact O-CB 3.42Å; Y191-E195 PolarHBondContact O-N 3.19Å; Y191-L210 HydrophobicContact CD1-CB 3.73Å; Y191-L210 HydrophobicContact CE1-CB 4.35Å; Y191-R211 HydrophobicContact CD1-CG 3.86Å; Y191-R211 HydrophobicContact CD2-CG 3.82Å; Y191-R211 HydrophobicContact CE1-CB 4.43Å; Y191-R211 HydrophobicContact CE1-CG 3.72Å; Y191-R211 HydrophobicContact CE2-CG 3.7Å; Y191-R211 VanDerWaalsContact CE2-CZ 3.46Å; Y191-R211 HydrophobicContact CG-CG 3.9Å; Y191-I250 WeakPolarHBondContact OH-CG2 3.35Å; Y191-E261 VanDerWaalsContact OH-CG 3.28Å; Y191-E261 WeakPolarHBondContact OH-CG 3.45Å; Y191-L265 HydrophobicContact CD1-CD1 4.08Å; Y191-L265 HydrophobicContact CE1-CD1 3.79Å
192	G	97.1	Very high	93.5	Very high	11 Å²	11	49.5 Å²	49.5	11%	0.113	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-38.9	176.6	0	0	0	0	0	112.3	H188 C189 E195 D196	H188-G192 PolarHBondContact O-N 3.23Å; C189-G192 PolarHBondContact O-N 2.99Å; G192-E195 PolarHBondContact O-N 3.09Å; G192-D196 WeakPolarHBondContact O-CB 3.27Å; G192-D196 PolarHBondContact O-N 3.02Å
193	A	97.4	Very high	93.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.8	-40.5	174.7	0	0	0	0	0	111.7	I183 C189 D196 Q197 L296	I183-A193 HydrophobicContact CG1-CB 4.01Å; C189-A193 VanDerWaalsContact O-CB 3.32Å; C189-A193 WeakPolarHBondContact O-CB 3.42Å; C189-A193 PolarHBondContact O-N 2.87Å; A193-D196 PolarHBondContact O-N 3.22Å; A193-Q197 WeakPolarHBondContact O-CG 3.47Å; A193-Q197 PolarHBondContact O-N 2.89Å; A193-L296 HydrophobicContact CB-CD2 3.65Å
194	L	97.3	Very high	92.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68	-43.7	174.3	-75.3	171	0	0	0	113	M190 Y191 D196 Q197 L198 L210 L262 L265 I273 L294 L296	M190-L194 PolarHBondContact O-N 3Å; Y191-L194 PolarHBondContact O-N 2.86Å; L194-D196 PolarHBondContact O-N 3.48Å; L194-Q197 PolarHBondContact O-N 2.76Å; L194-L198 VanDerWaalsContact O-CB 3.28Å; L194-L198 WeakPolarHBondContact O-CB 3.48Å; L194-L198 WeakPolarHBondContact O-CD1 3.39Å; L194-L198 WeakPolarHBondContact O-CG 3.46Å; L194-L198 PolarHBondContact O-N 2.84Å; L194-L210 HydrophobicContact CB-CD1 4.15Å; L194-L262 HydrophobicContact CD1-CD2 3.9Å; L194-L265 HydrophobicContact CD1-CB 4.47Å; L194-L265 HydrophobicContact CD1-CD1 3.47Å; L194-L265 VanDerWaalsContact CD1-CD1 3.47Å; L194-L265 HydrophobicContact CD1-CG 4.48Å; L194-I273 HydrophobicContact CD1-CD1 4.42Å; L194-I273 HydrophobicContact CD2-CD1 4Å; L194-I273 HydrophobicContact CD2-CG1 4.38Å; L194-I273 HydrophobicContact CD2-CG2 4.32Å; L194-L294 HydrophobicContact CD2-CB 4.23Å; L194-L294 HydrophobicContact CD2-CD1 3.74Å; L194-L296 HydrophobicContact CD2-CD1 4.03Å; L194-L296 HydrophobicContact CD2-CD2 4.11Å; L194-L296 HydrophobicContact CD2-CG 4.36Å; L194-L296 HydrophobicContact CG-CD1 4.06Å; L194-L296 HydrophobicContact CG-CD2 4.26Å
195	E	97	Very high	92.8	Very high	42 Å²	42	47.9 Å²	47.9	20%	0.196	27%	0.265	C	S	.	.	H	α-helix	trans	-54.2	-42.1	173.3	171.4	-176.9	-92.4	0	0	110.7	Y191 G192 R199 L205 T206 V207 L210	Y191-E195 WeakPolarHBondContact O-CB 3.42Å; Y191-E195 PolarHBondContact O-N 3.19Å; G192-E195 PolarHBondContact O-N 3.09Å; E195-R199 WeakPolarHBondContact O-CB 3.46Å; E195-R199 PolarHBondContact O-N 3.42Å; E195-R199 IonicContact OE2-NH2 3.66Å; E195-R199 PolarHBondContact OE2-NH2 3.12Å; E195-L205 WeakPolarHBondContact CG-O 3.17Å; E195-T206 WeakPolarHBondContact OE1-CA 3.24Å; E195-V207 HydrophobicContact CB-CG2 4.23Å; E195-V207 PolarHBondContact OE1-N 3.29Å; E195-L210 HydrophobicContact CB-CD1 4.25Å
196	D	96.4	Very high	93.1	Very high	16 Å²	16	47.5 Å²	47.5	9%	0.086	26%	0.26	C	S	.	.	H	α-helix	trans	-67.1	-48.5	178.7	-170.7	71.8	0	0	0	112.6	K181 I183 G192 A193 L194 L198 R199 E200 S311	K181-D196 VanDerWaalsContact CD-OD2 3.27Å; K181-D196 WeakPolarHBondContact CD-OD2 3.42Å; K181-D196 WeakPolarHBondContact CE-OD1 3.46Å; K181-D196 WeakPolarHBondContact CE-OD2 3.46Å; K181-D196 IonicContact NZ-OD1 2.73Å; K181-D196 PolarHBondContact NZ-OD1 3.22Å; K181-D196 IonicContact NZ-OD2 3.03Å; K181-D196 PolarHBondContact NZ-OD2 3.4Å; I183-D196 HydrophobicContact CD1-CB 4.18Å; G192-D196 WeakPolarHBondContact O-CB 3.27Å; G192-D196 PolarHBondContact O-N 3.02Å; A193-D196 PolarHBondContact O-N 3.22Å; L194-D196 PolarHBondContact O-N 3.48Å; D196-L198 VanDerWaalsContact C-N 3.32Å; D196-L198 PolarHBondContact O-N 3.49Å; D196-R199 WeakPolarHBondContact O-CB 3.18Å; D196-R199 PolarHBondContact O-N 3.42Å; D196-E200 PolarHBondContact O-N 3.11Å; D196-S311 VanDerWaalsContact OD2-CB 3.24Å; D196-S311 WeakPolarHBondContact OD2-CB 3.19Å; D196-S311 PolarHBondContact OD2-OG 2.88Å
197	Q	95.9	Very high	93.4	Very high	12 Å²	12	44.5 Å²	44.5	6%	0.056	25%	0.245	C	C	.	.	H	α-helix	trans	-59.2	-41.9	175.1	-73.4	-68.5	-73.7	0	0	112.3	A193 L194 R199 E200 Q201 L294 I295 L296 S311 V312	A193-Q197 WeakPolarHBondContact O-CG 3.47Å; A193-Q197 PolarHBondContact O-N 2.89Å; L194-Q197 PolarHBondContact O-N 2.76Å; Q197-R199 VanDerWaalsContact C-N 3.32Å; Q197-R199 PolarHBondContact O-N 2.92Å; Q197-E200 PolarHBondContact O-N 3.49Å; Q197-Q201 PolarHBondContact O-N 3.05Å; Q197-L294 HydrophobicContact CB-CB 4.36Å; Q197-L294 HydrophobicContact CB-CD2 3.89Å; Q197-I295 VanDerWaalsContact CD-O 3.28Å; Q197-I295 WeakPolarHBondContact CG-O 3.46Å; Q197-I295 VanDerWaalsContact OE1-N 3.12Å; Q197-I295 PolarHBondContact OE1-O 3.12Å; Q197-L296 HydrophobicContact CG-CD2 4.19Å; Q197-S311 PolarHBondContact NE2-OG 3.31Å; Q197-V312 PolarHBondContact NE2-O 3.13Å
198	L	95	Very high	93.7	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-66.3	-34.6	179	-75.4	169.8	0	0	0	112.2	L194 D196 E200 Q201 N202 C203 L205 L210 L269 L294	L194-L198 VanDerWaalsContact O-CB 3.28Å; L194-L198 WeakPolarHBondContact O-CB 3.48Å; L194-L198 WeakPolarHBondContact O-CD1 3.39Å; L194-L198 WeakPolarHBondContact O-CG 3.46Å; L194-L198 PolarHBondContact O-N 2.84Å; D196-L198 VanDerWaalsContact C-N 3.32Å; D196-L198 PolarHBondContact O-N 3.49Å; L198-E200 VanDerWaalsContact C-N 3.32Å; L198-E200 PolarHBondContact O-N 3.28Å; L198-Q201 CarbonylContact O-C 3.31Å; L198-Q201 WeakPolarHBondContact O-CA 3.37Å; L198-Q201 PolarHBondContact O-N 3.25Å; L198-N202 PolarHBondContact O-N 3.17Å; L198-C203 CarbonylContact C-O 3.4Å; L198-C203 VanDerWaalsContact C-O 3.3Å; L198-C203 HydrophobicContact CB-CB 4.1Å; L198-C203 HydrophobicContact CD2-CB 4.12Å; L198-C203 WeakPolarHBondContact O-CA 3.36Å; L198-C203 WeakPolarHBondContact O-CB 3.46Å; L198-C203 PolarHBondContact O-N 3.01Å; L198-L205 HydrophobicContact CD1-CB 4.25Å; L198-L205 HydrophobicContact CD1-CD1 4.14Å; L198-L210 HydrophobicContact CD1-CD1 4.36Å; L198-L210 HydrophobicContact CD1-CD2 3.98Å; L198-L269 HydrophobicContact CD1-CD1 4.07Å; L198-L269 HydrophobicContact CD1-CD2 4.1Å; L198-L269 HydrophobicContact CD2-CD1 4.27Å; L198-L269 HydrophobicContact CD2-CD2 4.21Å; L198-L294 HydrophobicContact CD2-CD1 3.95Å; L198-L294 HydrophobicContact CD2-CD2 4.18Å; L198-L294 HydrophobicContact CG-CD1 4.18Å
199	R	93.2	Very high	93.8	Very high	147 Å²	147	46.2 Å²	46.2	56%	0.555	27%	0.266	S	S	*	.	H	α-helix	trans	-62.9	-39.7	176.4	-167.1	179.1	-53.1	-178.9	6.8	111.9	E195 D196 Q197 Q201 N202	E195-R199 WeakPolarHBondContact O-CB 3.46Å; E195-R199 PolarHBondContact O-N 3.42Å; E195-R199 IonicContact OE2-NH2 3.66Å; E195-R199 PolarHBondContact OE2-NH2 3.12Å; D196-R199 WeakPolarHBondContact O-CB 3.18Å; D196-R199 PolarHBondContact O-N 3.42Å; Q197-R199 VanDerWaalsContact C-N 3.32Å; Q197-R199 PolarHBondContact O-N 2.92Å; R199-Q201 PolarHBondContact O-N 2.84Å; R199-N202 PolarHBondContact O-N 2.85Å; R199-N202 VanDerWaalsContact O-N 3.09Å
200	E	85.7	Confident	93.9	Very high	91 Å²	91	45.6 Å²	45.6	43%	0.425	26%	0.262	S	S	.	.	H	α-helix	trans	-64.5	-25.4	174.3	-63.9	-171.4	172.7	0	0	112.1	K181 D196 Q197 L198 N202 T313	K181-E200 IonicContact NZ-OE1 3.98Å; D196-E200 PolarHBondContact O-N 3.11Å; Q197-E200 PolarHBondContact O-N 3.49Å; L198-E200 VanDerWaalsContact C-N 3.32Å; L198-E200 PolarHBondContact O-N 3.28Å; E200-N202 VanDerWaalsContact C-N 3.34Å; E200-T313 PolarHBondContact OE1-OG1 3.29Å
201	Q	86.4	Confident	94	Very high	87 Å²	87	45.8 Å²	45.8	41%	0.407	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	14.1	174.4	-59.6	-172	-0.9	0	0	114	Q197 L198 R199 C203 L294	Q197-Q201 PolarHBondContact O-N 3.05Å; L198-Q201 CarbonylContact O-C 3.31Å; L198-Q201 WeakPolarHBondContact O-CA 3.37Å; L198-Q201 PolarHBondContact O-N 3.25Å; R199-Q201 PolarHBondContact O-N 2.84Å; Q201-C203 PolarHBondContact O-N 3.5Å; Q201-L294 VanDerWaalsContact NE2-CD2 3.31Å
202	N	84.6	Confident	94	Very high	158 Å²	158	51.1 Å²	51.1	85%	0.845	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	26.1	-176.1	-58.5	-66.3	0	0	0	114.7	L198 R199 E200	L198-N202 PolarHBondContact O-N 3.17Å; R199-N202 PolarHBondContact O-N 2.85Å; R199-N202 VanDerWaalsContact O-N 3.09Å; E200-N202 VanDerWaalsContact C-N 3.34Å
203	C	86.7	Confident	94	Very high	45 Å²	45	53.4 Å²	53.4	30%	0.304	29%	0.293	S	S	.	.			trans	-104.5	111.5	173.4	-169.5	0	0	0	0	109.9	L198 Q201 L205	L198-C203 CarbonylContact C-O 3.4Å; L198-C203 VanDerWaalsContact C-O 3.3Å; L198-C203 HydrophobicContact CB-CB 4.1Å; L198-C203 HydrophobicContact CD2-CB 4.12Å; L198-C203 WeakPolarHBondContact O-CA 3.36Å; L198-C203 WeakPolarHBondContact O-CB 3.46Å; L198-C203 PolarHBondContact O-N 3.01Å; Q201-C203 PolarHBondContact O-N 3.5Å; C203-L205 VanDerWaalsContact C-N 3.33Å; C203-L205 PolarHBondContact O-N 2.88Å
204	A	86.3	Confident	94.1	Very high	100 Å²	100	53.4 Å²	53.4	83%	0.826	29%	0.293	S	S	*	.			trans	-91.7	58.2	-176.2	0	0	0	0	0	112.2
205	L	94.1	Very high	94.1	Very high	42 Å²	42	53.5 Å²	53.5	22%	0.22	29%	0.294	C	S	.	.			trans	-87.7	136.5	171.1	-71.2	176.5	0	0	0	110.2	E195 L198 C203 A209 L210 L269	E195-L205 WeakPolarHBondContact CG-O 3.17Å; L198-L205 HydrophobicContact CD1-CB 4.25Å; L198-L205 HydrophobicContact CD1-CD1 4.14Å; C203-L205 VanDerWaalsContact C-N 3.33Å; C203-L205 PolarHBondContact O-N 2.88Å; L205-A209 HydrophobicContact CD2-CB 4.48Å; L205-L210 HydrophobicContact CB-CD2 4.11Å; L205-L210 HydrophobicContact CB-CG 4.27Å; L205-L210 HydrophobicContact CD1-CD2 3.92Å; L205-L269 HydrophobicContact CD1-CD2 3.57Å
206	T	96.3	Very high	94.1	Very high	72 Å²	72	56.3 Å²	56.3	44%	0.442	31%	0.307	S	S	.	.			trans	-93	158.6	178.1	63.6	0	0	0	0	111.8	E195 A208 A209 L210	E195-T206 WeakPolarHBondContact OE1-CA 3.24Å; T206-A208 PolarHBondContact O-N 3.3Å; T206-A209 WeakPolarHBondContact O-CB 3.25Å; T206-A209 PolarHBondContact O-N 2.95Å; T206-A209 WeakPolarHBondContact OG1-CB 3.35Å; T206-A209 PolarHBondContact OG1-N 3.26Å; T206-L210 WeakPolarHBondContact O-CG 3.3Å; T206-L210 PolarHBondContact O-N 3.31Å
207	V	96.7	Very high	94.2	Very high	27 Å²	27	57.6 Å²	57.6	16%	0.164	31%	0.311	C	S	.	.	H	α-helix	trans	-48.6	-44.7	170.9	169.8	0	0	0	0	112	H188 E195 L210 R211	H188-V207 HydrophobicContact CB-CG1 4Å; E195-V207 HydrophobicContact CB-CG2 4.23Å; E195-V207 PolarHBondContact OE1-N 3.29Å; V207-L210 PolarHBondContact O-N 2.96Å; V207-R211 WeakPolarHBondContact O-CG 3.25Å; V207-R211 PolarHBondContact O-N 3.37Å
208	A	96.8	Very high	94.3	Very high	69 Å²	69	57 Å²	57	57%	0.57	31%	0.309	S	S	*	.	H	α-helix	trans	-64.2	-40.9	178.7	0	0	0	0	0	112.3	T206 K212	T206-A208 PolarHBondContact O-N 3.3Å; A208-K212 WeakPolarHBondContact O-CB 3.31Å; A208-K212 PolarHBondContact O-N 2.93Å
209	A	97.1	Very high	94.4	Very high	30 Å²	30	61.4 Å²	61.4	25%	0.248	33%	0.329	C	S	.	.	H	α-helix	trans	-68	-38.7	176.6	0	0	0	0	0	112	L205 T206 Q213	L205-A209 HydrophobicContact CD2-CB 4.48Å; T206-A209 WeakPolarHBondContact O-CB 3.25Å; T206-A209 PolarHBondContact O-N 2.95Å; T206-A209 WeakPolarHBondContact OG1-CB 3.35Å; T206-A209 PolarHBondContact OG1-N 3.26Å; A209-Q213 WeakPolarHBondContact O-CB 3.38Å; A209-Q213 VanDerWaalsContact O-CG 3.28Å; A209-Q213 WeakPolarHBondContact O-CG 3.42Å; A209-Q213 PolarHBondContact O-N 3.44Å; A209-Q213 PolarHBondContact O-NE2 3.43Å; A209-Q213 VanDerWaalsContact O-NE2 3.08Å
210	L	97.6	Very high	94.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.8	-46.4	176.4	-67.6	170.5	0	0	0	110.9	Y191 L194 E195 L198 L205 T206 V207 K212 Q213 T214 L265	Y191-L210 HydrophobicContact CD1-CB 3.73Å; Y191-L210 HydrophobicContact CE1-CB 4.35Å; L194-L210 HydrophobicContact CB-CD1 4.15Å; E195-L210 HydrophobicContact CB-CD1 4.25Å; L198-L210 HydrophobicContact CD1-CD1 4.36Å; L198-L210 HydrophobicContact CD1-CD2 3.98Å; L205-L210 HydrophobicContact CB-CD2 4.11Å; L205-L210 HydrophobicContact CB-CG 4.27Å; L205-L210 HydrophobicContact CD1-CD2 3.92Å; T206-L210 WeakPolarHBondContact O-CG 3.3Å; T206-L210 PolarHBondContact O-N 3.31Å; V207-L210 PolarHBondContact O-N 2.96Å; L210-K212 PolarHBondContact O-N 3.32Å; L210-Q213 PolarHBondContact O-N 2.92Å; L210-T214 WeakPolarHBondContact O-CB 3.26Å; L210-T214 PolarHBondContact O-N 3.32Å; L210-T214 PolarHBondContact O-OG1 3.37Å; L210-L265 HydrophobicContact CB-CD2 4.22Å; L210-L265 HydrophobicContact CD2-CD2 3.9Å
211	R	97.9	Very high	95.1	Very high	7 Å²	7	57.4 Å²	57.4	3%	0.026	33%	0.325	C	S	.	.	H	α-helix	trans	-59	-47.9	176.1	-78.5	179.3	172.2	-89.4	2.7	112.2	G187 H188 Y191 V207 T214 A215 I250 T253 A255	G187-R211 PolarHBondContact O-NH2 3.22Å; H188-R211 VanDerWaalsContact ND1-CZ 3.27Å; H188-R211 PolarHBondContact ND1-NE 2.93Å; H188-R211 PolarHBondContact ND1-NH2 2.95Å; Y191-R211 HydrophobicContact CD1-CG 3.86Å; Y191-R211 HydrophobicContact CD2-CG 3.82Å; Y191-R211 HydrophobicContact CE1-CB 4.43Å; Y191-R211 HydrophobicContact CE1-CG 3.72Å; Y191-R211 HydrophobicContact CE2-CG 3.7Å; Y191-R211 VanDerWaalsContact CE2-CZ 3.46Å; Y191-R211 HydrophobicContact CG-CG 3.9Å; V207-R211 WeakPolarHBondContact O-CG 3.25Å; V207-R211 PolarHBondContact O-N 3.37Å; R211-T214 WeakPolarHBondContact O-CB 3.48Å; R211-T214 PolarHBondContact O-N 3.22Å; R211-A215 PolarHBondContact O-N 3.5Å; R211-I250 HydrophobicContact CB-CG2 4.38Å; R211-I250 WeakPolarHBondContact CD-O 3.49Å; R211-I250 PolarHBondContact NH1-O 3.09Å; R211-T253 PolarHBondContact NH1-O 2.83Å; R211-A255 PolarHBondContact NH1-O 2.94Å; R211-A255 PolarHBondContact NH2-O 3.29Å
212	K	98	Very high	95.5	Very high	112 Å²	112	55.3 Å²	55.3	49%	0.487	32%	0.321	S	S	.	.	H	α-helix	trans	-58.9	-51.5	177.6	-178.3	177.6	170.6	-179	0	111.9	A208 L210 T214 A215 E216	A208-K212 WeakPolarHBondContact O-CB 3.31Å; A208-K212 PolarHBondContact O-N 2.93Å; L210-K212 PolarHBondContact O-N 3.32Å; K212-T214 VanDerWaalsContact C-N 3.28Å; K212-T214 PolarHBondContact O-N 3.38Å; K212-A215 PolarHBondContact O-N 2.94Å; K212-E216 WeakPolarHBondContact CE-OE1 3.44Å; K212-E216 HydrophobicContact CG-CG 4.49Å; K212-E216 IonicContact NZ-OE1 3.04Å; K212-E216 WeakPolarHBondContact O-CG 3.4Å; K212-E216 PolarHBondContact O-N 2.84Å
213	Q	98.1	Very high	96	Very high	59 Å²	59	55.9 Å²	55.9	28%	0.276	32%	0.318	S	S	.	.	H	α-helix	trans	-62.7	-36.8	179.6	-73.2	173.8	88.2	0	0	112	A209 L210 E216 Y217 I268	A209-Q213 WeakPolarHBondContact O-CB 3.38Å; A209-Q213 VanDerWaalsContact O-CG 3.28Å; A209-Q213 WeakPolarHBondContact O-CG 3.42Å; A209-Q213 PolarHBondContact O-N 3.44Å; A209-Q213 PolarHBondContact O-NE2 3.43Å; A209-Q213 VanDerWaalsContact O-NE2 3.08Å; L210-Q213 PolarHBondContact O-N 2.92Å; Q213-E216 PolarHBondContact O-N 2.95Å; Q213-Y217 VanDerWaalsContact O-CB 3.31Å; Q213-Y217 WeakPolarHBondContact O-CB 3.19Å; Q213-Y217 PolarHBondContact O-N 3.41Å; Q213-I268 HydrophobicContact CB-CD1 4.01Å; Q213-I268 HydrophobicContact CB-CG2 4.18Å; Q213-I268 WeakPolarHBondContact O-CD1 3.42Å
214	T	98.1	Very high	96.4	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-60.4	-51.7	176.4	-56.6	0	0	0	0	110.7	L210 R211 K212 E216 Y217 M218 E261 A264 L265	L210-T214 WeakPolarHBondContact O-CB 3.26Å; L210-T214 PolarHBondContact O-N 3.32Å; L210-T214 PolarHBondContact O-OG1 3.37Å; R211-T214 WeakPolarHBondContact O-CB 3.48Å; R211-T214 PolarHBondContact O-N 3.22Å; K212-T214 VanDerWaalsContact C-N 3.28Å; K212-T214 PolarHBondContact O-N 3.38Å; T214-E216 PolarHBondContact O-N 3.19Å; T214-Y217 PolarHBondContact O-N 2.78Å; T214-M218 HydrophobicContact CG2-CG 4.46Å; T214-M218 HydrophobicContact CG2-SD 3.86Å; T214-M218 WeakPolarHBondContact O-CB 3.37Å; T214-M218 VanDerWaalsContact O-CG 3.25Å; T214-M218 WeakPolarHBondContact O-CG 3.42Å; T214-M218 PolarHBondContact O-N 3.2Å; T214-E261 HydrophobicContact CG2-CB 3.89Å; T214-E261 HydrophobicContact CG2-CG 3.88Å; T214-A264 HydrophobicContact CG2-CB 4.09Å; T214-L265 WeakPolarHBondContact OG1-CD2 3.23Å; T214-L265 WeakPolarHBondContact OG1-CG 3.47Å
215	A	97.8	Very high	96.8	Very high	2 Å²	2	53.9 Å²	53.9	2%	0.017	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-43.8	178.2	0	0	0	0	0	112.5	R211 K212 Y217 M218 Q219 C247 I250 V251	R211-A215 PolarHBondContact O-N 3.5Å; K212-A215 PolarHBondContact O-N 2.94Å; A215-Y217 VanDerWaalsContact C-N 3.33Å; A215-Y217 PolarHBondContact O-N 3.44Å; A215-M218 PolarHBondContact O-N 3.12Å; A215-Q219 WeakPolarHBondContact O-CB 3.39Å; A215-Q219 VanDerWaalsContact O-CG 3.26Å; A215-Q219 WeakPolarHBondContact O-CG 3.25Å; A215-Q219 PolarHBondContact O-N 3.02Å; A215-C247 HydrophobicContact CB-CB 4.16Å; A215-C247 WeakPolarHBondContact CB-O 3.44Å; A215-I250 HydrophobicContact CB-CB 4.47Å; A215-I250 HydrophobicContact CB-CG2 4.26Å; A215-V251 HydrophobicContact CB-CG2 3.33Å
216	E	98.2	Very high	96.7	Very high	102 Å²	102	53.6 Å²	53.6	48%	0.477	29%	0.289	S	S	.	.	H	α-helix	trans	-61.7	-40.4	176.9	-72.5	174	165.6	0	0	112	K212 Q213 T214 S220	K212-E216 WeakPolarHBondContact CE-OE1 3.44Å; K212-E216 HydrophobicContact CG-CG 4.49Å; K212-E216 IonicContact NZ-OE1 3.04Å; K212-E216 WeakPolarHBondContact O-CG 3.4Å; K212-E216 PolarHBondContact O-N 2.84Å; Q213-E216 PolarHBondContact O-N 2.95Å; T214-E216 PolarHBondContact O-N 3.19Å; E216-S220 PolarHBondContact O-N 3.04Å; E216-S220 VanDerWaalsContact O-N 3.1Å; E216-S220 PolarHBondContact O-OG 3.39Å
217	Y	98.3	Very high	96.6	Very high	43 Å²	43	53.4 Å²	53.4	17%	0.169	29%	0.289	C	S	.	.	H	α-helix	trans	-66.9	-47.3	176.7	-172.1	-85.8	0	0	0	111.6	Q213 T214 A215 Q219 S220 H221 F225 A264 H267 I268	Q213-Y217 VanDerWaalsContact O-CB 3.31Å; Q213-Y217 WeakPolarHBondContact O-CB 3.19Å; Q213-Y217 PolarHBondContact O-N 3.41Å; T214-Y217 PolarHBondContact O-N 2.78Å; A215-Y217 VanDerWaalsContact C-N 3.33Å; A215-Y217 PolarHBondContact O-N 3.44Å; Y217-Q219 VanDerWaalsContact C-N 3.33Å; Y217-Q219 PolarHBondContact O-N 3.41Å; Y217-S220 WeakPolarHBondContact CA-OG 3.4Å; Y217-S220 PolarHBondContact O-N 3.35Å; Y217-S220 PolarHBondContact O-OG 2.99Å; Y217-H221 HydrophobicContact CE1-CB 4.33Å; Y217-H221 AromaticContact CE2-CE1 3.8Å; Y217-H221 AromaticContact CE2-ND1 3.94Å; Y217-H221 AromaticContact CZ-CE1 3.99Å; Y217-H221 AromaticContact CZ-ND1 3.88Å; Y217-H221 PolarHBondContact O-N 3.43Å; Y217-H221 VanDerWaalsContact O-N 3.07Å; Y217-H221 PolarHBondContact O-ND1 2.89Å; Y217-F225 AromaticContact CD1-CE2 3.9Å; Y217-F225 HydrophobicContact CD1-CE2 3.9Å; Y217-F225 AromaticContact CD1-CZ 3.86Å; Y217-F225 HydrophobicContact CD1-CZ 3.86Å; Y217-F225 AromaticContact CE1-CE2 3.9Å; Y217-F225 HydrophobicContact CE1-CE2 3.9Å; Y217-F225 AromaticContact CE1-CZ 3.81Å; Y217-F225 HydrophobicContact CE1-CZ 3.81Å; Y217-A264 HydrophobicContact CD1-CB 3.76Å; Y217-A264 HydrophobicContact CE1-CB 4.45Å; Y217-A264 HydrophobicContact CG-CB 4.45Å; Y217-H267 HydrophobicContact CE1-CB 3.99Å; Y217-H267 HydrophobicContact CE2-CB 3.75Å; Y217-H267 VanDerWaalsContact CZ-CB 3.4Å; Y217-H267 AromaticContact CZ-CG 3.79Å; Y217-H267 VanDerWaalsContact OH-CB 3.27Å; Y217-H267 WeakPolarHBondContact OH-CB 3.31Å; Y217-I268 HydrophobicContact CD2-CG1 3.82Å; Y217-I268 HydrophobicContact CG-CD1 4.19Å; Y217-I268 HydrophobicContact CG-CG1 3.94Å
218	M	97.7	Very high	96.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.5	-40.5	179.2	-68.3	178.9	82	0	0	111.6	T214 A215 H221 S222 F225 F243 Y246 I250 L260 A264	T214-M218 HydrophobicContact CG2-CG 4.46Å; T214-M218 HydrophobicContact CG2-SD 3.86Å; T214-M218 WeakPolarHBondContact O-CB 3.37Å; T214-M218 VanDerWaalsContact O-CG 3.25Å; T214-M218 WeakPolarHBondContact O-CG 3.42Å; T214-M218 PolarHBondContact O-N 3.2Å; A215-M218 PolarHBondContact O-N 3.12Å; M218-H221 CarbonylContact O-C 3.55Å; M218-H221 PolarHBondContact O-N 3.46Å; M218-S222 WeakPolarHBondContact O-CA 3.5Å; M218-S222 PolarHBondContact O-N 2.89Å; M218-S222 VanDerWaalsContact O-N 3.12Å; M218-F225 HydrophobicContact CB-CD2 4.08Å; M218-F225 HydrophobicContact CB-CE2 4.26Å; M218-F225 HydrophobicContact CB-CG 4.45Å; M218-F225 HydrophobicContact CE-CB 4.14Å; M218-F225 HydrophobicContact CE-CD1 3.67Å; M218-F225 HydrophobicContact CE-CE1 4.24Å; M218-F225 HydrophobicContact CE-CG 3.9Å; M218-F225 HydrophobicContact CG-CD1 4.19Å; M218-F225 HydrophobicContact CG-CD2 4.04Å; M218-F225 HydrophobicContact CG-CE1 4.07Å; M218-F225 HydrophobicContact CG-CE2 3.94Å; M218-F225 HydrophobicContact CG-CG 4.18Å; M218-F225 HydrophobicContact CG-CZ 3.95Å; M218-F243 HydrophobicContact CB-CZ 4.1Å; M218-F243 WeakPolarHBondContact O-CZ 3.35Å; M218-Y246 HydrophobicContact CE-CD1 4.47Å; M218-Y246 HydrophobicContact CE-CE1 3.63Å; M218-Y246 HydrophobicContact SD-CE1 4.4Å; M218-I250 HydrophobicContact SD-CD1 3.73Å; M218-L260 HydrophobicContact CE-CB 4.03Å; M218-A264 HydrophobicContact CG-CB 3.9Å
219	Q	96.2	Very high	96.2	Very high	96 Å²	96	56.4 Å²	56.4	45%	0.449	29%	0.287	S	S	.	.	H	α-helix	trans	-63.4	-41.3	175.3	-73.7	-178.4	26.3	0	0	112.8	A215 Y217 H221 C247	A215-Q219 WeakPolarHBondContact O-CB 3.39Å; A215-Q219 VanDerWaalsContact O-CG 3.26Å; A215-Q219 WeakPolarHBondContact O-CG 3.25Å; A215-Q219 PolarHBondContact O-N 3.02Å; Y217-Q219 VanDerWaalsContact C-N 3.33Å; Y217-Q219 PolarHBondContact O-N 3.41Å; Q219-H221 VanDerWaalsContact C-N 3.28Å; Q219-H221 PolarHBondContact O-N 3.15Å; Q219-C247 HydrophobicContact CG-CB 3.69Å; Q219-C247 VanDerWaalsContact NE2-CB 3.29Å
220	S	97.2	Very high	95.9	Very high	82 Å²	82	58.6 Å²	58.6	57%	0.573	30%	0.298	S	S	*	.	H	α-helix	trans	-74.3	-16.8	179.7	53.6	0	0	0	0	114.1	E216 Y217	E216-S220 PolarHBondContact O-N 3.04Å; E216-S220 VanDerWaalsContact O-N 3.1Å; E216-S220 PolarHBondContact O-OG 3.39Å; Y217-S220 WeakPolarHBondContact CA-OG 3.4Å; Y217-S220 PolarHBondContact O-N 3.35Å; Y217-S220 PolarHBondContact O-OG 2.99Å
221	H	96.8	Very high	95.4	Very high	72 Å²	72	59.8 Å²	59.8	33%	0.333	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	39.8	-179.4	-61.7	77.3	0	0	0	111.1	Y217 M218 Q219 E223 D224 F225	Y217-H221 HydrophobicContact CE1-CB 4.33Å; Y217-H221 AromaticContact CE2-CE1 3.8Å; Y217-H221 AromaticContact CE2-ND1 3.94Å; Y217-H221 AromaticContact CZ-CE1 3.99Å; Y217-H221 AromaticContact CZ-ND1 3.88Å; Y217-H221 PolarHBondContact O-N 3.43Å; Y217-H221 VanDerWaalsContact O-N 3.07Å; Y217-H221 PolarHBondContact O-ND1 2.89Å; M218-H221 CarbonylContact O-C 3.55Å; M218-H221 PolarHBondContact O-N 3.46Å; Q219-H221 VanDerWaalsContact C-N 3.28Å; Q219-H221 PolarHBondContact O-N 3.15Å; H221-E223 PolarHBondContact O-N 3.45Å; H221-E223 VanDerWaalsContact O-N 3.1Å; H221-D224 WeakPolarHBondContact O-CB 3.31Å; H221-D224 PolarHBondContact O-N 3.36Å; H221-F225 HydrophobicContact CB-CD2 4.41Å; H221-F225 HydrophobicContact CB-CE2 3.98Å; H221-F225 WeakPolarHBondContact O-CD2 3.17Å
222	S	95.5	Very high	94.9	Very high	44 Å²	44	64.9 Å²	64.9	31%	0.308	34%	0.338	S	S	.	.	H	α-helix	trans	-54.8	-35.2	-170.9	59.2	0	0	0	0	113.9	M218 D224 F225 L226 F243	M218-S222 WeakPolarHBondContact O-CA 3.5Å; M218-S222 PolarHBondContact O-N 2.89Å; M218-S222 VanDerWaalsContact O-N 3.12Å; S222-D224 PolarHBondContact O-N 3.32Å; S222-F225 PolarHBondContact O-N 2.91Å; S222-F225 VanDerWaalsContact O-N 3.13Å; S222-L226 WeakPolarHBondContact O-CB 3.29Å; S222-L226 PolarHBondContact O-N 3.17Å; S222-F243 VanDerWaalsContact CB-CE1 3.47Å
223	E	94.6	Very high	94.4	Very high	170 Å²	170	66.9 Å²	66.9	79%	0.794	35%	0.354	S	S	*	.	H	α-helix	trans	-59.8	-28.7	178.5	-61.5	-175.5	-179	0	0	113.3	H221 P227	H221-E223 PolarHBondContact O-N 3.45Å; H221-E223 VanDerWaalsContact O-N 3.1Å; E223-P227 WeakPolarHBondContact O-CD 2.92Å; E223-P227 WeakPolarHBondContact O-CG 3.32Å
224	D	94.9	Very high	94	Very high	97 Å²	97	68 Å²	68	52%	0.519	37%	0.365	S	S	.	.	H	α-helix	trans	-81	-21	-179.9	-64.9	-25.8	0	0	0	112.7	H221 S222 F228	H221-D224 WeakPolarHBondContact O-CB 3.31Å; H221-D224 PolarHBondContact O-N 3.36Å; S222-D224 PolarHBondContact O-N 3.32Å; D224-F228 WeakPolarHBondContact O-CD2 3.44Å; D224-F228 WeakPolarHBondContact O-CE2 2.81Å
225	F	95.4	Very high	93.6	Very high	6 Å²	6	70.5 Å²	70.5	3%	0.026	39%	0.392	C	S	.	.	H	α-helix	trans	-109.8	-38.5	-173.4	-63.4	-77.6	0	0	0	113.3	Y217 M218 H221 S222 P227 F228 F243 L260 A264	Y217-F225 AromaticContact CD1-CE2 3.9Å; Y217-F225 HydrophobicContact CD1-CE2 3.9Å; Y217-F225 AromaticContact CD1-CZ 3.86Å; Y217-F225 HydrophobicContact CD1-CZ 3.86Å; Y217-F225 AromaticContact CE1-CE2 3.9Å; Y217-F225 HydrophobicContact CE1-CE2 3.9Å; Y217-F225 AromaticContact CE1-CZ 3.81Å; Y217-F225 HydrophobicContact CE1-CZ 3.81Å; M218-F225 HydrophobicContact CB-CD2 4.08Å; M218-F225 HydrophobicContact CB-CE2 4.26Å; M218-F225 HydrophobicContact CB-CG 4.45Å; M218-F225 HydrophobicContact CE-CB 4.14Å; M218-F225 HydrophobicContact CE-CD1 3.67Å; M218-F225 HydrophobicContact CE-CE1 4.24Å; M218-F225 HydrophobicContact CE-CG 3.9Å; M218-F225 HydrophobicContact CG-CD1 4.19Å; M218-F225 HydrophobicContact CG-CD2 4.04Å; M218-F225 HydrophobicContact CG-CE1 4.07Å; M218-F225 HydrophobicContact CG-CE2 3.94Å; M218-F225 HydrophobicContact CG-CG 4.18Å; M218-F225 HydrophobicContact CG-CZ 3.95Å; H221-F225 HydrophobicContact CB-CD2 4.41Å; H221-F225 HydrophobicContact CB-CE2 3.98Å; H221-F225 WeakPolarHBondContact O-CD2 3.17Å; S222-F225 PolarHBondContact O-N 2.91Å; S222-F225 VanDerWaalsContact O-N 3.13Å; F225-P227 VanDerWaalsContact C-N 3.34Å; F225-F228 PolarHBondContact O-N 3.41Å; F225-F243 HydrophobicContact CB-CE2 4.03Å; F225-F243 HydrophobicContact CB-CZ 4.19Å; F225-L260 HydrophobicContact CD1-CB 4.25Å; F225-L260 HydrophobicContact CD1-CD2 4.38Å; F225-A264 HydrophobicContact CE1-CB 4.07Å; F225-A264 HydrophobicContact CZ-CB 3.78Å
226	L	92.6	Very high	93.2	Very high	36 Å²	36	75.6 Å²	75.6	19%	0.188	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-57.1	-35.5	-175	-165.6	134.1	0	0	0	114	S222 F228 L229 M237 F243	S222-L226 WeakPolarHBondContact O-CB 3.29Å; S222-L226 PolarHBondContact O-N 3.17Å; L226-F228 PolarHBondContact O-N 3.35Å; L226-F228 VanDerWaalsContact O-N 3.14Å; L226-L229 PolarHBondContact O-N 2.98Å; L226-M237 HydrophobicContact CD2-CE 3.7Å; L226-F243 HydrophobicContact CD1-CB 3.95Å; L226-F243 HydrophobicContact CD1-CG 4.1Å
227	P	93	Very high	92.9	Very high	68 Å²	68	75.5 Å²	75.5	44%	0.442	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-58.1	-23.1	173.4	-27.2	37.4	0	0	0	115.4	E223 F225 M237	E223-P227 WeakPolarHBondContact O-CD 2.92Å; E223-P227 WeakPolarHBondContact O-CG 3.32Å; F225-P227 VanDerWaalsContact C-N 3.34Å; P227-M237 HydrophobicContact CB-CE 4.43Å
228	F	92.8	Very high	92.6	Very high	146 Å²	146	75.8 Å²	75.8	64%	0.64	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-100.7	-2.1	-176.3	-56.3	-76.3	0	0	0	113.3	D224 F225 L226 L260	D224-F228 WeakPolarHBondContact O-CD2 3.44Å; D224-F228 WeakPolarHBondContact O-CE2 2.81Å; F225-F228 PolarHBondContact O-N 3.41Å; L226-F228 PolarHBondContact O-N 3.35Å; L226-F228 VanDerWaalsContact O-N 3.14Å; F228-L260 HydrophobicContact CB-CD1 4.17Å; F228-L260 HydrophobicContact CB-CD2 3.78Å; F228-L260 HydrophobicContact CD2-CD2 4.27Å; F228-L260 HydrophobicContact CG-CD2 4.19Å
229	L	92.1	Very high	92.4	Very high	12 Å²	12	78.6 Å²	78.6	6%	0.063	44%	0.437	C	S	.	.			trans	-105.7	116.3	-178.9	-71.1	170	0	0	0	110.6	L226 M237 Y238 F243 Y246 L260	L226-L229 PolarHBondContact O-N 2.98Å; L229-M237 CarbonylContact O-C 3.6Å; L229-M237 WeakPolarHBondContact O-CA 3.37Å; L229-Y238 HydrophobicContact CB-CD1 4.23Å; L229-Y238 HydrophobicContact CB-CD2 3.79Å; L229-Y238 HydrophobicContact CB-CE2 4.17Å; L229-Y238 HydrophobicContact CB-CG 3.82Å; L229-Y238 HydrophobicContact CD1-CD2 4.2Å; L229-Y238 HydrophobicContact CD2-CE2 4.39Å; L229-Y238 HydrophobicContact CG-CD2 4.47Å; L229-Y238 PolarHBondContact O-N 2.84Å; L229-F243 HydrophobicContact CD1-CD2 3.43Å; L229-F243 VanDerWaalsContact CD1-CD2 3.43Å; L229-F243 HydrophobicContact CD1-CE2 3.5Å; L229-Y246 HydrophobicContact CD1-CD1 3.89Å; L229-Y246 HydrophobicContact CD1-CE1 3.91Å; L229-Y246 HydrophobicContact CD1-CG 4.46Å; L229-Y246 HydrophobicContact CD2-CE1 4.08Å; L229-Y246 HydrophobicContact CD2-CE2 4.11Å; L229-L260 HydrophobicContact CD1-CD1 4.44Å; L229-L260 HydrophobicContact CD2-CD1 3.57Å; L229-L260 HydrophobicContact CG-CD1 3.78Å
230	T	91.7	Very high	92.1	Very high	76 Å²	76	78.5 Å²	78.5	47%	0.466	45%	0.445	S	S	.	.	B	Isolated β-bridge	trans	-124.6	140.3	-179.4	57.4	0	0	0	0	111.8	P232 N236 Y238	T230-P232 WeakPolarHBondContact O-CD 3.36Å; T230-N236 CarbonylContact C-O 3.51Å; T230-N236 VanDerWaalsContact CA-O 3.25Å; T230-N236 WeakPolarHBondContact CA-O 3.38Å; T230-Y238 WeakPolarHBondContact O-CE1 3.32Å
231	N	87.6	Confident	91.9	Very high	25 Å²	25	81.3 Å²	81.3	13%	0.134	45%	0.449	C	S	.	.			trans	-72.7	122.1	177.4	-176.5	-41.9	0	0	0	109.9	N233 T234 G235 N236 Y238 E242	N231-N233 PolarHBondContact O-N 3.02Å; N231-N233 VanDerWaalsContact O-N 3.11Å; N231-N233 PolarHBondContact OD1-N 3.22Å; N231-T234 WeakPolarHBondContact CB-OG1 3.31Å; N231-T234 PolarHBondContact O-N 3.03Å; N231-G235 WeakPolarHBondContact O-CA 3.46Å; N231-G235 PolarHBondContact O-N 2.81Å; N231-N236 PolarHBondContact N-O 2.88Å; N231-Y238 HydrophobicContact CB-CD1 4.31Å; N231-Y238 HydrophobicContact CB-CE1 4.14Å; N231-E242 PolarHBondContact ND2-OE1 3.39Å
232	P	86	Confident	91.8	Very high	115 Å²	115	81 Å²	81	75%	0.747	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.1	-175.7	-24.6	33.1	0	0	0	114.1	T230	T230-P232 WeakPolarHBondContact O-CD 3.36Å
233	N	88.3	Confident	91.8	Very high	153 Å²	153	79.3 Å²	79.3	82%	0.818	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-36.1	-176	-60.1	-50.9	0	0	0	112.5	N231	N231-N233 PolarHBondContact O-N 3.02Å; N231-N233 VanDerWaalsContact O-N 3.11Å; N231-N233 PolarHBondContact OD1-N 3.22Å
234	T	89.8	Confident	91.8	Very high	82 Å²	82	72.3 Å²	72.3	50%	0.503	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-20.3	-174.6	66.4	0	0	0	0	112.8	N231 N236	N231-T234 WeakPolarHBondContact CB-OG1 3.31Å; N231-T234 PolarHBondContact O-N 3.03Å; T234-N236 PolarHBondContact O-N 3.48Å; T234-N236 PolarHBondContact OG1-N 3.46Å
235	G	88.6	Confident	91.9	Very high	54 Å²	54	74.1 Å²	74.1	56%	0.557	41%	0.412	S	S	*	.			trans	70.8	-0.7	-173.5	0	0	0	0	0	114.3	N231	N231-G235 WeakPolarHBondContact O-CA 3.46Å; N231-G235 PolarHBondContact O-N 2.81Å
236	N	90.8	Very high	91.9	Very high	109 Å²	109	76.1 Å²	76.1	58%	0.583	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-83.3	156.8	-179.8	-64.9	-37.4	0	0	0	111	T230 N231 T234	T230-N236 CarbonylContact C-O 3.51Å; T230-N236 VanDerWaalsContact CA-O 3.25Å; T230-N236 WeakPolarHBondContact CA-O 3.38Å; N231-N236 PolarHBondContact N-O 2.88Å; T234-N236 PolarHBondContact O-N 3.48Å; T234-N236 PolarHBondContact OG1-N 3.46Å
237	M	91.2	Very high	92.1	Very high	100 Å²	100	74.4 Å²	74.4	49%	0.493	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-58.6	148.9	169.6	-67.2	173.7	57.1	0	0	110.8	L226 P227 L229	L226-M237 HydrophobicContact CD2-CE 3.7Å; P227-M237 HydrophobicContact CB-CE 4.43Å; L229-M237 CarbonylContact O-C 3.6Å; L229-M237 WeakPolarHBondContact O-CA 3.37Å
238	Y	91.6	Very high	92.3	Very high	48 Å²	48	75.1 Å²	75.1	19%	0.188	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-59.3	140.1	175.8	-82.4	17.3	0	0	0	111.5	L229 T230 N231 E242 Y246	L229-Y238 HydrophobicContact CB-CD1 4.23Å; L229-Y238 HydrophobicContact CB-CD2 3.79Å; L229-Y238 HydrophobicContact CB-CE2 4.17Å; L229-Y238 HydrophobicContact CB-CG 3.82Å; L229-Y238 HydrophobicContact CD1-CD2 4.2Å; L229-Y238 HydrophobicContact CD2-CE2 4.39Å; L229-Y238 HydrophobicContact CG-CD2 4.47Å; L229-Y238 PolarHBondContact O-N 2.84Å; T230-Y238 WeakPolarHBondContact O-CE1 3.32Å; N231-Y238 HydrophobicContact CB-CD1 4.31Å; N231-Y238 HydrophobicContact CB-CE1 4.14Å; Y238-E242 WeakPolarHBondContact CA-OE2 3.4Å; Y238-E242 HydrophobicContact CD2-CB 4.11Å; Y238-E242 HydrophobicContact CG-CB 4Å; Y238-Y246 HydrophobicContact CE2-CD2 4.14Å; Y238-Y246 HydrophobicContact CE2-CG 4.12Å
239	T	93	Very high	92.5	Very high	59 Å²	59	71 Å²	71	36%	0.362	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-73.2	162.1	164.4	80.8	0	0	0	0	110.4	E241 E242 F243	T239-E241 VanDerWaalsContact CB-OE2 3.26Å; T239-E241 WeakPolarHBondContact CB-OE2 3.41Å; T239-E241 PolarHBondContact O-N 3.4Å; T239-E241 PolarHBondContact OG1-N 2.92Å; T239-E241 PolarHBondContact OG1-OE2 3.24Å; T239-E242 PolarHBondContact N-OE2 3.04Å; T239-E242 PolarHBondContact O-N 2.83Å; T239-E242 VanDerWaalsContact O-N 3.12Å; T239-E242 PolarHBondContact OG1-N 3.09Å; T239-F243 WeakPolarHBondContact O-CB 3.44Å; T239-F243 PolarHBondContact O-N 3.5Å
240	P	91.4	Very high	92.7	Very high	94 Å²	94	70.7 Å²	70.7	61%	0.61	39%	0.394	S	S	*	.	H	α-helix	trans	-54.1	-34.4	174	-27.3	36.5	0	0	0	113.4	G244	P240-G244 PolarHBondContact O-N 3.29Å
241	E	92.4	Very high	92.9	Very high	142 Å²	142	69.8 Å²	69.8	66%	0.664	39%	0.388	S	S	*	.	H	α-helix	trans	-70.5	-42.8	177	-57.3	74.3	-159.7	0	0	112.1	T239 F243 G244 K245	T239-E241 VanDerWaalsContact CB-OE2 3.26Å; T239-E241 WeakPolarHBondContact CB-OE2 3.41Å; T239-E241 PolarHBondContact O-N 3.4Å; T239-E241 PolarHBondContact OG1-N 2.92Å; T239-E241 PolarHBondContact OG1-OE2 3.24Å; E241-F243 VanDerWaalsContact C-N 3.32Å; E241-G244 PolarHBondContact O-N 2.93Å; E241-K245 PolarHBondContact O-N 3.02Å
242	E	94.2	Very high	93.3	Very high	65 Å²	65	74.4 Å²	74.4	30%	0.304	41%	0.413	S	S	.	.	H	α-helix	trans	-64.7	-38.5	174.7	-69.4	178.8	133.4	0	0	111.4	N231 Y238 T239 K245 Y246	N231-E242 PolarHBondContact ND2-OE1 3.39Å; Y238-E242 WeakPolarHBondContact CA-OE2 3.4Å; Y238-E242 HydrophobicContact CD2-CB 4.11Å; Y238-E242 HydrophobicContact CG-CB 4Å; T239-E242 PolarHBondContact N-OE2 3.04Å; T239-E242 PolarHBondContact O-N 2.83Å; T239-E242 VanDerWaalsContact O-N 3.12Å; T239-E242 PolarHBondContact OG1-N 3.09Å; E242-K245 PolarHBondContact O-N 2.95Å; E242-Y246 WeakPolarHBondContact O-CB 3.38Å; E242-Y246 PolarHBondContact O-N 3.22Å
243	F	95.6	Very high	93.7	Very high	9 Å²	9	71.8 Å²	71.8	4%	0.039	39%	0.394	C	S	.	.	H	α-helix	trans	-65.2	-41.6	174.6	-176.8	-109	0	0	0	112.6	M218 S222 F225 L226 L229 T239 E241 K245 Y246 C247	M218-F243 HydrophobicContact CB-CZ 4.1Å; M218-F243 WeakPolarHBondContact O-CZ 3.35Å; S222-F243 VanDerWaalsContact CB-CE1 3.47Å; F225-F243 HydrophobicContact CB-CE2 4.03Å; F225-F243 HydrophobicContact CB-CZ 4.19Å; L226-F243 HydrophobicContact CD1-CB 3.95Å; L226-F243 HydrophobicContact CD1-CG 4.1Å; L229-F243 HydrophobicContact CD1-CD2 3.43Å; L229-F243 VanDerWaalsContact CD1-CD2 3.43Å; L229-F243 HydrophobicContact CD1-CE2 3.5Å; T239-F243 WeakPolarHBondContact O-CB 3.44Å; T239-F243 PolarHBondContact O-N 3.5Å; E241-F243 VanDerWaalsContact C-N 3.32Å; F243-K245 VanDerWaalsContact C-N 3.34Å; F243-K245 PolarHBondContact O-N 2.84Å; F243-Y246 HydrophobicContact CE2-CD1 4.5Å; F243-Y246 WeakPolarHBondContact O-CB 3.45Å; F243-Y246 PolarHBondContact O-N 3.28Å; F243-C247 PolarHBondContact O-N 2.91Å; F243-C247 PolarHBondContact O-SG 3.36Å
244	G	95.4	Very high	93.9	Very high	23 Å²	23	66.7 Å²	66.7	24%	0.237	37%	0.374	C	S	.	.	H	α-helix	trans	-57.7	-48	172.6	0	0	0	0	0	111.4	P240 E241 Y246 C247 D248	P240-G244 PolarHBondContact O-N 3.29Å; E241-G244 PolarHBondContact O-N 2.93Å; G244-Y246 VanDerWaalsContact C-N 3.33Å; G244-Y246 PolarHBondContact O-N 3.09Å; G244-C247 PolarHBondContact O-N 3.28Å; G244-D248 PolarHBondContact O-N 3.22Å
245	K	95.8	Very high	94.1	Very high	134 Å²	134	64.6 Å²	64.6	58%	0.583	37%	0.365	S	S	*	.	H	α-helix	trans	-60.1	-41.8	175.7	-175.1	-175.4	174.5	-170.1	0	112.4	E241 E242 F243 C247 D248 D249	E241-K245 PolarHBondContact O-N 3.02Å; E242-K245 PolarHBondContact O-N 2.95Å; F243-K245 VanDerWaalsContact C-N 3.34Å; F243-K245 PolarHBondContact O-N 2.84Å; K245-C247 VanDerWaalsContact C-N 3.33Å; K245-C247 PolarHBondContact O-N 2.95Å; K245-D248 WeakPolarHBondContact O-CB 3.34Å; K245-D248 PolarHBondContact O-N 3.35Å; K245-D249 WeakPolarHBondContact O-CB 3.43Å; K245-D249 VanDerWaalsContact O-CG 3.32Å; K245-D249 PolarHBondContact O-N 2.71Å
246	Y	96	Very high	94.2	Very high	48 Å²	48	68.9 Å²	68.9	19%	0.188	36%	0.364	C	S	.	.	H	α-helix	trans	-59.3	-44.5	176.7	174.8	-100.7	0	0	0	112.2	M218 L229 Y238 E242 F243 G244 D248 D249 I250 E261	M218-Y246 HydrophobicContact CE-CD1 4.47Å; M218-Y246 HydrophobicContact CE-CE1 3.63Å; M218-Y246 HydrophobicContact SD-CE1 4.4Å; L229-Y246 HydrophobicContact CD1-CD1 3.89Å; L229-Y246 HydrophobicContact CD1-CE1 3.91Å; L229-Y246 HydrophobicContact CD1-CG 4.46Å; L229-Y246 HydrophobicContact CD2-CE1 4.08Å; L229-Y246 HydrophobicContact CD2-CE2 4.11Å; Y238-Y246 HydrophobicContact CE2-CD2 4.14Å; Y238-Y246 HydrophobicContact CE2-CG 4.12Å; E242-Y246 WeakPolarHBondContact O-CB 3.38Å; E242-Y246 PolarHBondContact O-N 3.22Å; F243-Y246 HydrophobicContact CE2-CD1 4.5Å; F243-Y246 WeakPolarHBondContact O-CB 3.45Å; F243-Y246 PolarHBondContact O-N 3.28Å; G244-Y246 VanDerWaalsContact C-N 3.33Å; G244-Y246 PolarHBondContact O-N 3.09Å; Y246-D248 VanDerWaalsContact C-N 3.34Å; Y246-D248 PolarHBondContact O-N 3.47Å; Y246-D249 PolarHBondContact O-N 3.18Å; Y246-I250 HydrophobicContact CD1-CD1 4Å; Y246-I250 HydrophobicContact CE1-CD1 3.54Å; Y246-I250 HydrophobicContact CE1-CG1 4.41Å; Y246-I250 WeakPolarHBondContact O-CG1 3.29Å; Y246-I250 PolarHBondContact O-N 3.02Å; Y246-E261 PolarHBondContact OH-OE1 2.85Å
247	C	96.8	Very high	94.4	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-65.6	-38	175.5	-62.4	0	0	0	0	111.8	A215 Q219 F243 G244 K245 D249 I250 V251	A215-C247 HydrophobicContact CB-CB 4.16Å; A215-C247 WeakPolarHBondContact CB-O 3.44Å; Q219-C247 HydrophobicContact CG-CB 3.69Å; Q219-C247 VanDerWaalsContact NE2-CB 3.29Å; F243-C247 PolarHBondContact O-N 2.91Å; F243-C247 PolarHBondContact O-SG 3.36Å; G244-C247 PolarHBondContact O-N 3.28Å; K245-C247 VanDerWaalsContact C-N 3.33Å; K245-C247 PolarHBondContact O-N 2.95Å; C247-D249 VanDerWaalsContact C-N 3.35Å; C247-I250 WeakPolarHBondContact O-CB 3.39Å; C247-I250 PolarHBondContact O-N 3.4Å; C247-V251 PolarHBondContact O-N 3.32Å
248	D	97	Very high	94.5	Very high	84 Å²	84	60.4 Å²	60.4	45%	0.449	33%	0.329	S	S	.	.	H	α-helix	trans	-64.1	-40.2	173.8	-72.2	-22.9	0	0	0	111.8	G244 K245 Y246 I250 V251 N252	G244-D248 PolarHBondContact O-N 3.22Å; K245-D248 WeakPolarHBondContact O-CB 3.34Å; K245-D248 PolarHBondContact O-N 3.35Å; Y246-D248 VanDerWaalsContact C-N 3.34Å; Y246-D248 PolarHBondContact O-N 3.47Å; D248-I250 VanDerWaalsContact C-N 3.34Å; D248-I250 PolarHBondContact O-N 3.43Å; D248-V251 PolarHBondContact O-N 2.93Å; D248-N252 WeakPolarHBondContact O-CB 3.45Å; D248-N252 PolarHBondContact O-N 3.31Å; D248-N252 PolarHBondContact O-ND2 3.18Å
249	D	96.6	Very high	94.7	Very high	59 Å²	59	62.7 Å²	62.7	32%	0.316	34%	0.341	S	S	.	.	H	α-helix	trans	-65.1	-37.4	177.9	-74.5	-21.7	0	0	0	111	K245 Y246 C247 V251 T253	K245-D249 WeakPolarHBondContact O-CB 3.43Å; K245-D249 VanDerWaalsContact O-CG 3.32Å; K245-D249 PolarHBondContact O-N 2.71Å; Y246-D249 PolarHBondContact O-N 3.18Å; C247-D249 VanDerWaalsContact C-N 3.35Å; D249-V251 VanDerWaalsContact C-N 3.26Å; D249-V251 PolarHBondContact O-N 3.49Å; D249-T253 WeakPolarHBondContact O-CB 3.27Å; D249-T253 PolarHBondContact O-N 3.45Å; D249-T253 PolarHBondContact O-OG1 3.38Å
250	I	96.6	Very high	94.9	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.026	33%	0.331	C	S	.	.	H	α-helix	trans	-55.5	-42.3	173.2	-73.7	169.9	0	0	0	111.3	Y191 R211 A215 M218 Y246 C247 D248 E261	Y191-I250 WeakPolarHBondContact OH-CG2 3.35Å; R211-I250 HydrophobicContact CB-CG2 4.38Å; R211-I250 WeakPolarHBondContact CD-O 3.49Å; R211-I250 PolarHBondContact NH1-O 3.09Å; A215-I250 HydrophobicContact CB-CB 4.47Å; A215-I250 HydrophobicContact CB-CG2 4.26Å; M218-I250 HydrophobicContact SD-CD1 3.73Å; Y246-I250 HydrophobicContact CD1-CD1 4Å; Y246-I250 HydrophobicContact CE1-CD1 3.54Å; Y246-I250 HydrophobicContact CE1-CG1 4.41Å; Y246-I250 WeakPolarHBondContact O-CG1 3.29Å; Y246-I250 PolarHBondContact O-N 3.02Å; C247-I250 WeakPolarHBondContact O-CB 3.39Å; C247-I250 PolarHBondContact O-N 3.4Å; D248-I250 VanDerWaalsContact C-N 3.34Å; D248-I250 PolarHBondContact O-N 3.43Å; I250-E261 HydrophobicContact CD1-CG 4.17Å
251	V	96.8	Very high	95.2	Very high	57 Å²	57	57.2 Å²	57.2	35%	0.345	30%	0.304	S	S	.	.	H	α-helix	trans	-79.8	-45.1	-176.5	-177.8	0	0	0	0	112	A215 C247 D248 D249	A215-V251 HydrophobicContact CB-CG2 3.33Å; C247-V251 PolarHBondContact O-N 3.32Å; D248-V251 PolarHBondContact O-N 2.93Å; D249-V251 VanDerWaalsContact C-N 3.26Å; D249-V251 PolarHBondContact O-N 3.49Å
252	N	95.4	Very high	95.4	Very high	123 Å²	123	50.5 Å²	50.5	66%	0.658	27%	0.272	S	S	*	.	H	α-helix	trans	-97.2	-7	-163.9	-62.8	-63	0	0	0	114	D248	D248-N252 WeakPolarHBondContact O-CB 3.45Å; D248-N252 PolarHBondContact O-N 3.31Å; D248-N252 PolarHBondContact O-ND2 3.18Å
253	T	95	Very high	95.6	Very high	59 Å²	59	51.5 Å²	51.5	36%	0.362	27%	0.273	S	S	.	.	S	Bend	trans	-131.3	173.9	-175.2	79.5	0	0	0	0	112.7	R211 D249 A255	R211-T253 PolarHBondContact NH1-O 2.83Å; D249-T253 WeakPolarHBondContact O-CB 3.27Å; D249-T253 PolarHBondContact O-N 3.45Å; D249-T253 PolarHBondContact O-OG1 3.38Å; T253-A255 PolarHBondContact O-N 3.45Å; T253-A255 WeakPolarHBondContact OG1-CB 3.41Å; T253-A255 PolarHBondContact OG1-N 2.86Å; T253-A255 VanDerWaalsContact OG1-N 3.09Å
254	A	92.9	Very high	95.7	Very high	47 Å²	47	51 Å²	51	39%	0.388	27%	0.271	S	S	.	.			trans	-86.6	31.8	169.1	0	0	0	0	0	112.3	W256	A254-W256 PolarHBondContact O-N 3.3Å
255	A	92.6	Very high	95.8	Very high	37 Å²	37	50 Å²	50	31%	0.306	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-53.8	132.1	172.6	0	0	0	0	0	109.9	R211 T253	R211-A255 PolarHBondContact NH1-O 2.94Å; R211-A255 PolarHBondContact NH2-O 3.29Å; T253-A255 PolarHBondContact O-N 3.45Å; T253-A255 WeakPolarHBondContact OG1-CB 3.41Å; T253-A255 PolarHBondContact OG1-N 2.86Å; T253-A255 VanDerWaalsContact OG1-N 3.09Å
256	W	92.1	Very high	95.9	Very high	144 Å²	144	43.6 Å²	43.6	55%	0.545	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-67.8	134.1	-179.8	-65.2	3.3	0	0	0	109.2	A254 L305	A254-W256 PolarHBondContact O-N 3.3Å; W256-L305 HydrophobicContact CH2-CB 4.21Å; W256-L305 HydrophobicContact CZ2-CB 4.36Å
257	G	93.6	Very high	96	Very high	14 Å²	14	42.9 Å²	42.9	14%	0.144	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-91.2	155.2	172.9	0	0	0	0	0	111.4	E261	G257-E261 WeakPolarHBondContact CA-OE2 3.3Å
258	G	94.4	Very high	96	Very high	18 Å²	18	44.8 Å²	44.8	19%	0.186	24%	0.241	C	C	.	.			trans	-147.9	-144.7	175.4	0	0	0	0	0	112.4	L260 E261 L262	G258-L260 VanDerWaalsContact C-N 3.34Å; G258-L260 PolarHBondContact O-N 2.98Å; G258-E261 PolarHBondContact N-OE2 3Å; G258-E261 PolarHBondContact O-N 3.42Å; G258-L262 WeakPolarHBondContact O-CG 3.27Å; G258-L262 PolarHBondContact O-N 3.04Å
259	Q	95	Very high	95.9	Very high	96 Å²	96	41.8 Å²	41.8	45%	0.449	22%	0.224	S	C	.	.	H	α-helix	trans	-59.9	-39	-170.1	-173.6	67.3	11.7	0	0	113.7	L262 R263 V285	Q259-L262 PolarHBondContact O-N 3.45Å; Q259-R263 WeakPolarHBondContact O-CB 3.48Å; Q259-R263 PolarHBondContact O-N 3.49Å; Q259-V285 VanDerWaalsContact NE2-CG2 3.31Å
260	L	96.4	Very high	95.9	Very high	31 Å²	31	43.5 Å²	43.5	16%	0.162	23%	0.231	C	C	.	.	H	α-helix	trans	-67.4	-44.1	-177.8	-61.5	-179.2	0	0	0	111.2	M218 F225 F228 L229 G258 R263 A264	M218-L260 HydrophobicContact CE-CB 4.03Å; F225-L260 HydrophobicContact CD1-CB 4.25Å; F225-L260 HydrophobicContact CD1-CD2 4.38Å; F228-L260 HydrophobicContact CB-CD1 4.17Å; F228-L260 HydrophobicContact CB-CD2 3.78Å; F228-L260 HydrophobicContact CD2-CD2 4.27Å; F228-L260 HydrophobicContact CG-CD2 4.19Å; L229-L260 HydrophobicContact CD1-CD1 4.44Å; L229-L260 HydrophobicContact CD2-CD1 3.57Å; L229-L260 HydrophobicContact CG-CD1 3.78Å; G258-L260 VanDerWaalsContact C-N 3.34Å; G258-L260 PolarHBondContact O-N 2.98Å; L260-R263 WeakPolarHBondContact O-CB 3.36Å; L260-R263 PolarHBondContact O-N 3.01Å; L260-A264 PolarHBondContact O-N 2.98Å
261	E	97.7	Very high	95.9	Very high	7 Å²	7	43.6 Å²	43.6	3%	0.033	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-41.3	176.9	-67.2	63.5	-107.1	0	0	110.6	M190 Y191 T214 Y246 I250 G257 G258 R263 A264 L265	M190-E261 HydrophobicContact CE-CB 3.51Å; M190-E261 HydrophobicContact CE-CG 4.26Å; M190-E261 HydrophobicContact SD-CB 4.23Å; Y191-E261 VanDerWaalsContact OH-CG 3.28Å; Y191-E261 WeakPolarHBondContact OH-CG 3.45Å; T214-E261 HydrophobicContact CG2-CB 3.89Å; T214-E261 HydrophobicContact CG2-CG 3.88Å; Y246-E261 PolarHBondContact OH-OE1 2.85Å; I250-E261 HydrophobicContact CD1-CG 4.17Å; G257-E261 WeakPolarHBondContact CA-OE2 3.3Å; G258-E261 PolarHBondContact N-OE2 3Å; G258-E261 PolarHBondContact O-N 3.42Å; E261-R263 VanDerWaalsContact C-N 3.31Å; E261-R263 PolarHBondContact O-N 3.1Å; E261-A264 PolarHBondContact O-N 3.19Å; E261-L265 VanDerWaalsContact O-CB 3.31Å; E261-L265 WeakPolarHBondContact O-CB 3.39Å; E261-L265 WeakPolarHBondContact O-CD1 3.35Å; E261-L265 VanDerWaalsContact O-CG 3.23Å; E261-L265 WeakPolarHBondContact O-CG 3.49Å; E261-L265 PolarHBondContact O-N 3.41Å
262	L	98	Very high	95.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-38.9	175	-68.4	176.2	0	0	0	111.7	M190 L194 G258 Q259 L265 S266 I273 I275 L296 Y309	M190-L262 HydrophobicContact CE-CD2 4.47Å; M190-L262 HydrophobicContact CG-CD2 3.78Å; M190-L262 HydrophobicContact CG-CG 4.29Å; M190-L262 HydrophobicContact SD-CD1 4.36Å; M190-L262 HydrophobicContact SD-CD2 3.73Å; M190-L262 HydrophobicContact SD-CG 3.7Å; L194-L262 HydrophobicContact CD1-CD2 3.9Å; G258-L262 WeakPolarHBondContact O-CG 3.27Å; G258-L262 PolarHBondContact O-N 3.04Å; Q259-L262 PolarHBondContact O-N 3.45Å; L262-L265 PolarHBondContact O-N 3.18Å; L262-S266 WeakPolarHBondContact O-CB 3.46Å; L262-S266 PolarHBondContact O-N 3.06Å; L262-I273 HydrophobicContact CD2-CD1 4.21Å; L262-I273 HydrophobicContact CD2-CG2 4.36Å; L262-I275 HydrophobicContact CD1-CD1 3.63Å; L262-I275 HydrophobicContact CD1-CG1 4.01Å; L262-L296 HydrophobicContact CD2-CD1 3.89Å; L262-Y309 HydrophobicContact CD1-CE1 4.14Å
263	R	97.6	Very high	96.1	Very high	86 Å²	86	35.4 Å²	35.4	33%	0.325	19%	0.186	S	C	.	.	H	α-helix	trans	-62.4	-49.2	174.3	-178.4	63.5	178.5	169.9	8.7	111.3	Q259 L260 E261 L265 S266 H267 V285 E288	Q259-R263 WeakPolarHBondContact O-CB 3.48Å; Q259-R263 PolarHBondContact O-N 3.49Å; L260-R263 WeakPolarHBondContact O-CB 3.36Å; L260-R263 PolarHBondContact O-N 3.01Å; E261-R263 VanDerWaalsContact C-N 3.31Å; E261-R263 PolarHBondContact O-N 3.1Å; R263-L265 PolarHBondContact O-N 2.88Å; R263-S266 PolarHBondContact O-N 3.49Å; R263-H267 PolarHBondContact NE-NE2 3.12Å; R263-H267 PolarHBondContact NH2-CE1 3.29Å; R263-H267 PolarHBondContact NH2-NE2 3.42Å; R263-H267 VanDerWaalsContact NH2-NE2 3.12Å; R263-H267 PolarHBondContact O-CD2 3.47Å; R263-H267 PolarHBondContact O-N 3.15Å; R263-V285 HydrophobicContact CB-CG1 4.07Å; R263-E288 IonicContact CZ-OE1 3.44Å; R263-E288 IonicContact NH1-OE1 3.08Å; R263-E288 PolarHBondContact NH1-OE1 3.28Å; R263-E288 IonicContact NH1-OE2 3.72Å; R263-E288 PolarHBondContact NH1-OE2 3.11Å; R263-E288 IonicContact NH2-OE1 3.38Å; R263-E288 PolarHBondContact NH2-OE1 2.99Å
264	A	98	Very high	96.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.8	-46.6	175.6	0	0	0	0	0	111.8	T214 Y217 M218 F225 L260 E261 S266 H267 I268	T214-A264 HydrophobicContact CG2-CB 4.09Å; Y217-A264 HydrophobicContact CD1-CB 3.76Å; Y217-A264 HydrophobicContact CE1-CB 4.45Å; Y217-A264 HydrophobicContact CG-CB 4.45Å; M218-A264 HydrophobicContact CG-CB 3.9Å; F225-A264 HydrophobicContact CE1-CB 4.07Å; F225-A264 HydrophobicContact CZ-CB 3.78Å; L260-A264 PolarHBondContact O-N 2.98Å; E261-A264 PolarHBondContact O-N 3.19Å; A264-S266 VanDerWaalsContact C-N 3.33Å; A264-S266 PolarHBondContact O-N 3.26Å; A264-H267 WeakPolarHBondContact O-CB 3.28Å; A264-H267 PolarHBondContact O-N 2.91Å; A264-H267 VanDerWaalsContact O-N 3.14Å; A264-I268 WeakPolarHBondContact O-CD1 3.33Å; A264-I268 VanDerWaalsContact O-CG1 3.28Å; A264-I268 WeakPolarHBondContact O-CG1 3.23Å; A264-I268 PolarHBondContact O-N 3.41Å
265	L	97.9	Very high	96.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-37.8	179.2	-75.6	165.7	0	0	0	112.7	M190 Y191 L194 L210 T214 E261 L262 R263 H267 I268 L269 I273	M190-L265 HydrophobicContact CE-CD1 4.07Å; Y191-L265 HydrophobicContact CD1-CD1 4.08Å; Y191-L265 HydrophobicContact CE1-CD1 3.79Å; L194-L265 HydrophobicContact CD1-CB 4.47Å; L194-L265 HydrophobicContact CD1-CD1 3.47Å; L194-L265 VanDerWaalsContact CD1-CD1 3.47Å; L194-L265 HydrophobicContact CD1-CG 4.48Å; L210-L265 HydrophobicContact CB-CD2 4.22Å; L210-L265 HydrophobicContact CD2-CD2 3.9Å; T214-L265 WeakPolarHBondContact OG1-CD2 3.23Å; T214-L265 WeakPolarHBondContact OG1-CG 3.47Å; E261-L265 VanDerWaalsContact O-CB 3.31Å; E261-L265 WeakPolarHBondContact O-CB 3.39Å; E261-L265 WeakPolarHBondContact O-CD1 3.35Å; E261-L265 VanDerWaalsContact O-CG 3.23Å; E261-L265 WeakPolarHBondContact O-CG 3.49Å; E261-L265 PolarHBondContact O-N 3.41Å; L262-L265 PolarHBondContact O-N 3.18Å; R263-L265 PolarHBondContact O-N 2.88Å; L265-H267 VanDerWaalsContact C-N 3.33Å; L265-H267 PolarHBondContact O-N 2.98Å; L265-I268 HydrophobicContact CD2-CD1 4.27Å; L265-I268 PolarHBondContact O-N 2.94Å; L265-L269 VanDerWaalsContact O-CB 3.29Å; L265-L269 WeakPolarHBondContact O-CB 3.33Å; L265-L269 VanDerWaalsContact O-CG 3.22Å; L265-L269 WeakPolarHBondContact O-CG 3.5Å; L265-L269 PolarHBondContact O-N 2.97Å; L265-I273 HydrophobicContact CB-CD1 4.2Å
266	S	97.8	Very high	96.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.9	-41.5	174.1	-177.3	0	0	0	0	111.9	L262 R263 A264 Q270 T271 V285 G286 Y289	L262-S266 WeakPolarHBondContact O-CB 3.46Å; L262-S266 PolarHBondContact O-N 3.06Å; R263-S266 PolarHBondContact O-N 3.49Å; A264-S266 VanDerWaalsContact C-N 3.33Å; A264-S266 PolarHBondContact O-N 3.26Å; S266-Q270 VanDerWaalsContact O-CA 3.31Å; S266-Q270 WeakPolarHBondContact O-CA 3.34Å; S266-Q270 PolarHBondContact O-N 2.69Å; S266-T271 WeakPolarHBondContact CA-O 3.36Å; S266-T271 PolarHBondContact O-N 3.05Å; S266-T271 PolarHBondContact OG-O 2.93Å; S266-V285 PolarHBondContact OG-O 2.89Å; S266-G286 VanDerWaalsContact OG-CA 3.28Å; S266-G286 WeakPolarHBondContact OG-CA 3.27Å; S266-Y289 WeakPolarHBondContact O-CE2 3.32Å
267	H	97.6	Very high	96.8	Very high	33 Å²	33	25 Å²	25	15%	0.153	13%	0.125	C	C	.	.	H	α-helix	trans	-64.4	-44.3	172.4	-72.4	-73.9	0	0	0	112.6	Y217 R263 A264 L265 Q270 E288 Y289	Y217-H267 HydrophobicContact CE1-CB 3.99Å; Y217-H267 HydrophobicContact CE2-CB 3.75Å; Y217-H267 VanDerWaalsContact CZ-CB 3.4Å; Y217-H267 AromaticContact CZ-CG 3.79Å; Y217-H267 VanDerWaalsContact OH-CB 3.27Å; Y217-H267 WeakPolarHBondContact OH-CB 3.31Å; R263-H267 PolarHBondContact NE-NE2 3.12Å; R263-H267 PolarHBondContact NH2-CE1 3.29Å; R263-H267 PolarHBondContact NH2-NE2 3.42Å; R263-H267 VanDerWaalsContact NH2-NE2 3.12Å; R263-H267 PolarHBondContact O-CD2 3.47Å; R263-H267 PolarHBondContact O-N 3.15Å; A264-H267 WeakPolarHBondContact O-CB 3.28Å; A264-H267 PolarHBondContact O-N 2.91Å; A264-H267 VanDerWaalsContact O-N 3.14Å; L265-H267 VanDerWaalsContact C-N 3.33Å; L265-H267 PolarHBondContact O-N 2.98Å; H267-Q270 PolarHBondContact O-N 3.27Å; H267-Q270 PolarHBondContact O-NE2 3.48Å; H267-E288 IonicContact CE1-OE1 3.75Å; H267-E288 PolarHBondContact CE1-OE1 3.36Å; H267-Y289 WeakPolarHBondContact CA-OH 3.36Å; H267-Y289 AromaticContact ND1-CZ 3.86Å; H267-Y289 PolarHBondContact ND1-OH 3.27Å
268	I	96.6	Very high	96.8	Very high	41 Å²	41	25 Å²	25	21%	0.21	12%	0.124	C	C	.	.	H	α-helix	trans	-62.3	-46.5	179.7	-66.5	156.7	0	0	0	111.1	Q213 Y217 A264 L265 Q270	Q213-I268 HydrophobicContact CB-CD1 4.01Å; Q213-I268 HydrophobicContact CB-CG2 4.18Å; Q213-I268 WeakPolarHBondContact O-CD1 3.42Å; Y217-I268 HydrophobicContact CD2-CG1 3.82Å; Y217-I268 HydrophobicContact CG-CD1 4.19Å; Y217-I268 HydrophobicContact CG-CG1 3.94Å; A264-I268 WeakPolarHBondContact O-CD1 3.33Å; A264-I268 VanDerWaalsContact O-CG1 3.28Å; A264-I268 WeakPolarHBondContact O-CG1 3.23Å; A264-I268 PolarHBondContact O-N 3.41Å; L265-I268 HydrophobicContact CD2-CD1 4.27Å; L265-I268 PolarHBondContact O-N 2.94Å; I268-Q270 VanDerWaalsContact C-N 3.29Å
269	L	95.7	Very high	96.6	Very high	20 Å²	20	29.1 Å²	29.1	11%	0.105	14%	0.142	C	C	.	.	H	α-helix	trans	-81.3	-12.7	-177	-60.6	171.5	0	0	0	112.4	L198 L205 L265 T271 K291 L294	L198-L269 HydrophobicContact CD1-CD1 4.07Å; L198-L269 HydrophobicContact CD1-CD2 4.1Å; L198-L269 HydrophobicContact CD2-CD1 4.27Å; L198-L269 HydrophobicContact CD2-CD2 4.21Å; L205-L269 HydrophobicContact CD1-CD2 3.57Å; L265-L269 VanDerWaalsContact O-CB 3.29Å; L265-L269 WeakPolarHBondContact O-CB 3.33Å; L265-L269 VanDerWaalsContact O-CG 3.22Å; L265-L269 WeakPolarHBondContact O-CG 3.5Å; L265-L269 PolarHBondContact O-N 2.97Å; L269-T271 PolarHBondContact O-N 3.35Å; L269-T271 PolarHBondContact O-OG1 3.05Å; L269-K291 PolarHBondContact O-NZ 3.01Å; L269-L294 HydrophobicContact CD1-CD1 3.86Å
270	Q	96.4	Very high	96.4	Very high	96 Å²	96	26.7 Å²	26.7	45%	0.449	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	44.6	-172.3	-62.6	-77.7	-62.1	0	0	110.5	S266 H267 I268 Y289 K291	S266-Q270 VanDerWaalsContact O-CA 3.31Å; S266-Q270 WeakPolarHBondContact O-CA 3.34Å; S266-Q270 PolarHBondContact O-N 2.69Å; H267-Q270 PolarHBondContact O-N 3.27Å; H267-Q270 PolarHBondContact O-NE2 3.48Å; I268-Q270 VanDerWaalsContact C-N 3.29Å; Q270-Y289 HydrophobicContact CB-CD1 4.11Å; Q270-Y289 HydrophobicContact CB-CE1 4.23Å; Q270-Y289 HydrophobicContact CG-CE1 4.37Å; Q270-Y289 PolarHBondContact NE2-OH 2.98Å; Q270-K291 WeakPolarHBondContact O-CD 3.4Å; Q270-K291 WeakPolarHBondContact O-CE 3.47Å; Q270-K291 PolarHBondContact O-NZ 3.32Å
271	T	96.3	Very high	96.3	Very high	6 Å²	6	30.3 Å²	30.3	4%	0.037	16%	0.163	C	C	.	.	S	Bend	trans	-143.4	135.1	-171.5	-51.2	0	0	0	0	109	S266 L269 K291 N292 L294	S266-T271 WeakPolarHBondContact CA-O 3.36Å; S266-T271 PolarHBondContact O-N 3.05Å; S266-T271 PolarHBondContact OG-O 2.93Å; L269-T271 PolarHBondContact O-N 3.35Å; L269-T271 PolarHBondContact O-OG1 3.05Å; T271-K291 HydrophobicContact CG2-CB 4.04Å; T271-K291 HydrophobicContact CG2-CD 4.38Å; T271-K291 WeakPolarHBondContact OG1-CD 3.28Å; T271-K291 PolarHBondContact OG1-NZ 3.06Å; T271-N292 VanDerWaalsContact CG2-O 3.3Å; T271-N292 WeakPolarHBondContact CG2-O 3.33Å; T271-L294 HydrophobicContact CG2-CG 4.07Å
272	P	97.7	Very high	96.2	Very high	8 Å²	8	32.5 Å²	32.5	5%	0.052	18%	0.178	C	C	.	.			trans	-66	151.6	174.2	-15.5	29.7	0	0	0	111.4	V284 V285 G286 Y289 K291 P293 L294	P272-V284 HydrophobicContact CB-CG1 4.27Å; P272-V285 CarbonylContact C-O 3.55Å; P272-V285 VanDerWaalsContact CA-O 3.28Å; P272-V285 WeakPolarHBondContact CA-O 3.22Å; P272-G286 WeakPolarHBondContact CG-O 3.31Å; P272-Y289 WeakPolarHBondContact CG-O 3.23Å; P272-K291 VanDerWaalsContact CD-O 3.3Å; P272-K291 WeakPolarHBondContact CD-O 3.49Å; P272-K291 WeakPolarHBondContact CG-O 3.21Å; P272-P293 HydrophobicContact CB-CB 4.14Å; P272-P293 CarbonylContact O-C 3.3Å; P272-P293 VanDerWaalsContact O-CA 3.23Å; P272-P293 WeakPolarHBondContact O-CA 3.48Å; P272-L294 PolarHBondContact O-N 2.81Å
273	I	98.3	Very high	96.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	116.9	173.7	-55.2	173.1	0	0	0	107.8	L194 L262 L265 I275 V284 V285 L294 L296	L194-I273 HydrophobicContact CD1-CD1 4.42Å; L194-I273 HydrophobicContact CD2-CD1 4Å; L194-I273 HydrophobicContact CD2-CG1 4.38Å; L194-I273 HydrophobicContact CD2-CG2 4.32Å; L262-I273 HydrophobicContact CD2-CD1 4.21Å; L262-I273 HydrophobicContact CD2-CG2 4.36Å; L265-I273 HydrophobicContact CB-CD1 4.2Å; I273-I275 HydrophobicContact CG2-CG1 4.43Å; I273-V284 WeakPolarHBondContact O-CA 3.47Å; I273-V285 PolarHBondContact N-O 2.92Å; I273-V285 PolarHBondContact O-N 3.19Å; I273-L294 CarbonylContact C-O 3.36Å; I273-L294 WeakPolarHBondContact CA-O 3.35Å; I273-L294 HydrophobicContact CG1-CB 4.44Å; I273-L294 HydrophobicContact CG1-CD1 4.44Å; I273-L296 HydrophobicContact CG2-CD1 3.81Å; I273-L296 HydrophobicContact CG2-CG 4.05Å
274	E	97.8	Very high	96.1	Very high	26 Å²	26	33.9 Å²	33.9	12%	0.121	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127	175.9	-177.3	179.1	-164.7	0	0	109.7	R176 L276 P282 I283 V284 P293 L294 I295 L296	R176-E274 IonicContact CZ-OE1 3.95Å; R176-E274 IonicContact NH1-OE1 3.55Å; R176-E274 PolarHBondContact NH1-OE1 3.03Å; R176-E274 IonicContact NH1-OE2 3.19Å; R176-E274 PolarHBondContact NH1-OE2 3.21Å; R176-E274 IonicContact NH2-OE1 3.61Å; R176-E274 PolarHBondContact NH2-OE1 3.46Å; R176-E274 VanDerWaalsContact NH2-OE1 3.08Å; E274-L276 HydrophobicContact CG-CD2 4.17Å; E274-P282 HydrophobicContact CG-CB 4.01Å; E274-P282 WeakPolarHBondContact OE1-CB 3.38Å; E274-I283 CarbonylContact C-O 3.39Å; E274-I283 WeakPolarHBondContact CA-O 3.46Å; E274-V284 HydrophobicContact CB-CG2 4.32Å; E274-V284 HydrophobicContact CG-CG2 4.08Å; E274-P293 HydrophobicContact CB-CB 4.12Å; E274-L294 PolarHBondContact N-O 3.49Å; E274-I295 WeakPolarHBondContact O-CA 3.24Å; E274-L296 PolarHBondContact O-N 3.46Å
275	I	97.8	Very high	96.1	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	115.2	-179.2	-54.3	130.6	0	0	0	108.5	L262 I273 Q277 P282 I283 V285 L296 Y309	L262-I275 HydrophobicContact CD1-CD1 3.63Å; L262-I275 HydrophobicContact CD1-CG1 4.01Å; I273-I275 HydrophobicContact CG2-CG1 4.43Å; I275-Q277 HydrophobicContact CG2-CG 4.27Å; I275-P282 WeakPolarHBondContact O-CA 3.47Å; I275-I283 HydrophobicContact CB-CB 4.46Å; I275-I283 HydrophobicContact CD1-CB 4.3Å; I275-I283 HydrophobicContact CD1-CG2 4.22Å; I275-I283 PolarHBondContact N-O 3.43Å; I275-I283 PolarHBondContact O-N 2.94Å; I275-V285 HydrophobicContact CD1-CG2 3.91Å; I275-L296 WeakPolarHBondContact CA-O 3.42Å; I275-Y309 HydrophobicContact CG2-CE1 4.19Å
276	L	97	Very high	96	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	132.7	177.4	-56.7	179.6	0	0	0	110.4	L173 E274 P282 I295 L296 V297 Y298	L173-L276 HydrophobicContact CD2-CD1 3.51Å; L173-L276 HydrophobicContact CG-CD1 4.46Å; E274-L276 HydrophobicContact CG-CD2 4.17Å; L276-P282 HydrophobicContact CD2-CB 3.82Å; L276-P282 HydrophobicContact CD2-CG 3.68Å; L276-I295 HydrophobicContact CD1-CG2 3.71Å; L276-I295 HydrophobicContact CG-CG2 4.05Å; L276-L296 PolarHBondContact N-O 3.41Å; L276-V297 HydrophobicContact CB-CG2 4.33Å; L276-V297 HydrophobicContact CD1-CG2 4.48Å; L276-Y298 PolarHBondContact O-N 3.01Å
277	Q	95.4	Very high	95.9	Very high	40 Å²	40	41.3 Å²	41.3	19%	0.187	23%	0.229	C	C	.	.			trans	-133.8	154.2	-178.8	-60.5	-174.2	-29.5	0	0	109.9	I275 Y298	I275-Q277 HydrophobicContact CG2-CG 4.27Å; Q277-Y298 HydrophobicContact CG-CD1 3.82Å; Q277-Y298 HydrophobicContact CG-CG 4.34Å
278	A	93.4	Very high	95.8	Very high	16 Å²	16	44.4 Å²	44.4	13%	0.132	24%	0.244	C	C	.	.	S	Bend	trans	-75	-36.7	-175.2	0	0	0	0	0	114.2	E165 K168 L169	E165-A278 HydrophobicContact CB-CB 4.35Å; E165-A278 HydrophobicContact CG-CB 3.67Å; K168-A278 HydrophobicContact CB-CB 4.02Å; K168-A278 HydrophobicContact CD-CB 4.15Å; L169-A278 HydrophobicContact CD1-CB 4.47Å; L169-A278 HydrophobicContact CD2-CB 4.49Å; L169-A278 HydrophobicContact CG-CB 4.02Å
279	D	89.8	Confident	95.8	Very high	103 Å²	103	43.9 Å²	43.9	55%	0.551	24%	0.239	S	C	*	.	S	Bend	trans	-108	2.6	-168.2	-63.7	-40.2	0	0	0	113.3	K168	K168-D279 IonicContact NZ-OD1 3.2Å; K168-D279 PolarHBondContact NZ-OD1 2.94Å
280	A	92.1	Very high	95.7	Very high	46 Å²	46	49.3 Å²	49.3	38%	0.38	28%	0.276	S	S	.	.	S	Bend	trans	-143.8	157.6	-177	0	0	0	0	0	111.7
281	P	94	Very high	95.6	Very high	106 Å²	106	49.9 Å²	49.9	69%	0.688	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-56.8	152.6	170.5	-23.3	34.2	0	0	0	112.1	I283	P281-I283 PolarHBondContact O-N 2.98Å
282	P	95.3	Very high	95.4	Very high	53 Å²	53	56 Å²	56	34%	0.344	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-52.3	135	172.9	-25.3	33.2	0	0	0	112.1	R176 E274 I275 L276	R176-P282 VanDerWaalsContact NH2-CG 3.31Å; E274-P282 HydrophobicContact CG-CB 4.01Å; E274-P282 WeakPolarHBondContact OE1-CB 3.38Å; I275-P282 WeakPolarHBondContact O-CA 3.47Å; L276-P282 HydrophobicContact CD2-CB 3.82Å; L276-P282 HydrophobicContact CD2-CG 3.68Å
283	I	96.4	Very high	95.3	Very high	63 Å²	63	57.9 Å²	57.9	32%	0.323	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123.8	174	-61.4	169.9	0	0	0	107.4	E274 I275 P281 V285	E274-I283 CarbonylContact C-O 3.39Å; E274-I283 WeakPolarHBondContact CA-O 3.46Å; I275-I283 HydrophobicContact CB-CB 4.46Å; I275-I283 HydrophobicContact CD1-CB 4.3Å; I275-I283 HydrophobicContact CD1-CG2 4.22Å; I275-I283 PolarHBondContact N-O 3.43Å; I275-I283 PolarHBondContact O-N 2.94Å; P281-I283 PolarHBondContact O-N 2.98Å; I283-V285 HydrophobicContact CG2-CG2 4.3Å
284	V	97.3	Very high	95.2	Very high	52 Å²	52	57.9 Å²	57.9	32%	0.315	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.8	175.6	-171.8	0	0	0	0	109.1	P272 I273 E274 E287	P272-V284 HydrophobicContact CB-CG1 4.27Å; I273-V284 WeakPolarHBondContact O-CA 3.47Å; E274-V284 HydrophobicContact CB-CG2 4.32Å; E274-V284 HydrophobicContact CG-CG2 4.08Å; V284-E287 HydrophobicContact CB-CG 3.89Å; V284-E287 HydrophobicContact CG1-CG 3.6Å
285	V	97.3	Very high	95.2	Very high	6 Å²	6	58 Å²	58	4%	0.036	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.7	176.8	-176	0	0	0	0	108.4	Q259 R263 S266 P272 I273 I275 I283	Q259-V285 VanDerWaalsContact NE2-CG2 3.31Å; R263-V285 HydrophobicContact CB-CG1 4.07Å; S266-V285 PolarHBondContact OG-O 2.89Å; P272-V285 CarbonylContact C-O 3.55Å; P272-V285 VanDerWaalsContact CA-O 3.28Å; P272-V285 WeakPolarHBondContact CA-O 3.22Å; I273-V285 PolarHBondContact N-O 2.92Å; I273-V285 PolarHBondContact O-N 3.19Å; I275-V285 HydrophobicContact CD1-CG2 3.91Å; I283-V285 HydrophobicContact CG2-CG2 4.3Å
286	G	96.2	Very high	95.2	Very high	2 Å²	2	57.9 Å²	57.9	2%	0.021	32%	0.322	C	S	.	.			trans	85.2	34.2	179	0	0	0	0	0	114.6	S266 P272 E288 Y289	S266-G286 VanDerWaalsContact OG-CA 3.28Å; S266-G286 WeakPolarHBondContact OG-CA 3.27Å; P272-G286 WeakPolarHBondContact CG-O 3.31Å; G286-E288 WeakPolarHBondContact CA-OE2 3.49Å; G286-E288 PolarHBondContact O-N 3.05Å; G286-Y289 WeakPolarHBondContact O-CD2 3.47Å; G286-Y289 PolarHBondContact O-N 3.31Å
287	E	96	Very high	95.2	Very high	149 Å²	149	57.9 Å²	57.9	70%	0.696	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-19.6	177	-65.8	-177	-169.9	0	0	113	V284 Y289	V284-E287 HydrophobicContact CB-CG 3.89Å; V284-E287 HydrophobicContact CG1-CG 3.6Å; E287-Y289 PolarHBondContact O-N 3.34Å
288	E	95.8	Very high	95.3	Very high	98 Å²	98	57.4 Å²	57.4	46%	0.458	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.7	173.7	60.4	-98.7	-131.1	0	0	114.5	R263 H267 G286	R263-E288 IonicContact CZ-OE1 3.44Å; R263-E288 IonicContact NH1-OE1 3.08Å; R263-E288 PolarHBondContact NH1-OE1 3.28Å; R263-E288 IonicContact NH1-OE2 3.72Å; R263-E288 PolarHBondContact NH1-OE2 3.11Å; R263-E288 IonicContact NH2-OE1 3.38Å; R263-E288 PolarHBondContact NH2-OE1 2.99Å; H267-E288 IonicContact CE1-OE1 3.75Å; H267-E288 PolarHBondContact CE1-OE1 3.36Å; G286-E288 WeakPolarHBondContact CA-OE2 3.49Å; G286-E288 PolarHBondContact O-N 3.05Å
289	Y	96.3	Very high	95.3	Very high	30 Å²	30	56.9 Å²	56.9	12%	0.118	31%	0.313	C	S	.	.	S	Bend	trans	-95.3	131	-177.7	-60.1	-61	0	0	0	112.3	S266 H267 Q270 P272 G286 E287 K291	S266-Y289 WeakPolarHBondContact O-CE2 3.32Å; H267-Y289 WeakPolarHBondContact CA-OH 3.36Å; H267-Y289 AromaticContact ND1-CZ 3.86Å; H267-Y289 PolarHBondContact ND1-OH 3.27Å; Q270-Y289 HydrophobicContact CB-CD1 4.11Å; Q270-Y289 HydrophobicContact CB-CE1 4.23Å; Q270-Y289 HydrophobicContact CG-CE1 4.37Å; Q270-Y289 PolarHBondContact NE2-OH 2.98Å; P272-Y289 WeakPolarHBondContact CG-O 3.23Å; G286-Y289 WeakPolarHBondContact O-CD2 3.47Å; G286-Y289 PolarHBondContact O-N 3.31Å; E287-Y289 PolarHBondContact O-N 3.34Å; Y289-K291 PolarHBondContact O-N 3.31Å; Y289-K291 VanDerWaalsContact O-N 3.16Å
290	P	93.4	Very high	95.4	Very high	134 Å²	134	57.9 Å²	57.9	87%	0.87	31%	0.31	S	S	*	.			trans	-81.4	7.1	-173.2	33.8	-37.7	0	0	0	114.5
291	K	93.6	Very high	95.1	Very high	108 Å²	108	58.5 Å²	58.5	47%	0.47	30%	0.304	S	S	.	.	S	Bend	trans	-82.6	160.9	-177.9	-66.6	-174.1	-165.3	161.9	0	111.3	L269 Q270 T271 P272 Y289	L269-K291 PolarHBondContact O-NZ 3.01Å; Q270-K291 WeakPolarHBondContact O-CD 3.4Å; Q270-K291 WeakPolarHBondContact O-CE 3.47Å; Q270-K291 PolarHBondContact O-NZ 3.32Å; T271-K291 HydrophobicContact CG2-CB 4.04Å; T271-K291 HydrophobicContact CG2-CD 4.38Å; T271-K291 WeakPolarHBondContact OG1-CD 3.28Å; T271-K291 PolarHBondContact OG1-NZ 3.06Å; P272-K291 VanDerWaalsContact CD-O 3.3Å; P272-K291 WeakPolarHBondContact CD-O 3.49Å; P272-K291 WeakPolarHBondContact CG-O 3.21Å; Y289-K291 PolarHBondContact O-N 3.31Å; Y289-K291 VanDerWaalsContact O-N 3.16Å
292	N	92.5	Very high	94.4	Very high	133 Å²	133	53.6 Å²	53.6	71%	0.711	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-62.4	135.7	170.6	-66.1	-32.6	0	0	0	110.1	T271	T271-N292 VanDerWaalsContact CG2-O 3.3Å; T271-N292 WeakPolarHBondContact CG2-O 3.33Å
293	P	95.6	Very high	93.6	Very high	48 Å²	48	54.7 Å²	54.7	31%	0.312	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-67.1	148.1	-176.2	26.5	-34.1	0	0	0	112	P272 E274	P272-P293 HydrophobicContact CB-CB 4.14Å; P272-P293 CarbonylContact O-C 3.3Å; P272-P293 VanDerWaalsContact O-CA 3.23Å; P272-P293 WeakPolarHBondContact O-CA 3.48Å; E274-P293 HydrophobicContact CB-CB 4.12Å
294	L	96.8	Very high	92.4	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.4	159.6	-57.8	173	0	0	0	107.8	L194 Q197 L198 Q201 L269 T271 P272 I273 E274	L194-L294 HydrophobicContact CD2-CB 4.23Å; L194-L294 HydrophobicContact CD2-CD1 3.74Å; Q197-L294 HydrophobicContact CB-CB 4.36Å; Q197-L294 HydrophobicContact CB-CD2 3.89Å; L198-L294 HydrophobicContact CD2-CD1 3.95Å; L198-L294 HydrophobicContact CD2-CD2 4.18Å; L198-L294 HydrophobicContact CG-CD1 4.18Å; Q201-L294 VanDerWaalsContact NE2-CD2 3.31Å; L269-L294 HydrophobicContact CD1-CD1 3.86Å; T271-L294 HydrophobicContact CG2-CG 4.07Å; P272-L294 PolarHBondContact O-N 2.81Å; I273-L294 CarbonylContact C-O 3.36Å; I273-L294 WeakPolarHBondContact CA-O 3.35Å; I273-L294 HydrophobicContact CG1-CB 4.44Å; I273-L294 HydrophobicContact CG1-CD1 4.44Å; E274-L294 PolarHBondContact N-O 3.49Å
295	I	97.5	Very high	91	Very high	28 Å²	28	60.6 Å²	60.6	14%	0.144	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.8	-174	-56.9	173.5	0	0	0	109.2	L178 Q197 E274 L276 V312	L178-I295 HydrophobicContact CD1-CD1 3.87Å; L178-I295 HydrophobicContact CD1-CG2 4.47Å; Q197-I295 VanDerWaalsContact CD-O 3.28Å; Q197-I295 WeakPolarHBondContact CG-O 3.46Å; Q197-I295 VanDerWaalsContact OE1-N 3.12Å; Q197-I295 PolarHBondContact OE1-O 3.12Å; E274-I295 WeakPolarHBondContact O-CA 3.24Å; L276-I295 HydrophobicContact CD1-CG2 3.71Å; L276-I295 HydrophobicContact CG-CG2 4.05Å; I295-V312 HydrophobicContact CB-CG2 3.65Å; I295-V312 HydrophobicContact CG2-CG1 3.99Å; I295-V312 HydrophobicContact CG2-CG2 3.8Å
296	L	97.8	Very high	90.4	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	150.8	176.2	-55.7	-176.8	0	0	0	109.9	A193 L194 Q197 L262 I273 E274 I275 L276 Y309	A193-L296 HydrophobicContact CB-CD2 3.65Å; L194-L296 HydrophobicContact CD2-CD1 4.03Å; L194-L296 HydrophobicContact CD2-CD2 4.11Å; L194-L296 HydrophobicContact CD2-CG 4.36Å; L194-L296 HydrophobicContact CG-CD1 4.06Å; L194-L296 HydrophobicContact CG-CD2 4.26Å; Q197-L296 HydrophobicContact CG-CD2 4.19Å; L262-L296 HydrophobicContact CD2-CD1 3.89Å; I273-L296 HydrophobicContact CG2-CD1 3.81Å; I273-L296 HydrophobicContact CG2-CG 4.05Å; E274-L296 PolarHBondContact O-N 3.46Å; I275-L296 WeakPolarHBondContact CA-O 3.42Å; L276-L296 PolarHBondContact N-O 3.41Å; L296-Y309 HydrophobicContact CB-CD1 4.4Å; L296-Y309 HydrophobicContact CD1-CD1 4.28Å
297	V	97.3	Very high	90.2	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122	171.2	173.7	0	0	0	0	108.4	L169 L173 I180 L276 M299 Y309 N310 V312	L169-V297 HydrophobicContact CD1-CG1 3.71Å; L169-V297 HydrophobicContact CD2-CG1 3.94Å; L169-V297 HydrophobicContact CG-CG1 4.33Å; L173-V297 HydrophobicContact CD1-CG2 4Å; L173-V297 HydrophobicContact CD2-CG2 3.99Å; I180-V297 HydrophobicContact CD1-CG1 4.1Å; I180-V297 HydrophobicContact CG1-CG1 4.4Å; I180-V297 HydrophobicContact CG1-CG2 4.43Å; L276-V297 HydrophobicContact CB-CG2 4.33Å; L276-V297 HydrophobicContact CD1-CG2 4.48Å; V297-M299 HydrophobicContact CG1-CG 4.08Å; V297-Y309 CarbonylContact O-C 3.49Å; V297-Y309 WeakPolarHBondContact O-CA 3.33Å; V297-N310 HydrophobicContact CB-CB 4.35Å; V297-N310 PolarHBondContact N-O 2.98Å; V297-N310 PolarHBondContact O-N 3.09Å; V297-V312 HydrophobicContact CG2-CG1 3.48Å; V297-V312 VanDerWaalsContact CG2-CG1 3.48Å
298	Y	96.3	Very high	90.1	Very high	31 Å²	31	59 Å²	59	12%	0.122	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126.9	175.2	171.9	-90.3	0	0	0	110.3	L276 Q277 R300 E307 Y309	L276-Y298 PolarHBondContact O-N 3.01Å; Q277-Y298 HydrophobicContact CG-CD1 3.82Å; Q277-Y298 HydrophobicContact CG-CG 4.34Å; Y298-R300 HydrophobicContact CE1-CB 4.41Å; Y298-E307 HydrophobicContact CE2-CB 3.94Å; Y298-E307 HydrophobicContact CE2-CG 4.31Å; Y298-E307 VanDerWaalsContact OH-CG 3.27Å; Y298-E307 WeakPolarHBondContact OH-CG 3.44Å; Y298-E307 PolarHBondContact OH-OE1 3.18Å; Y298-E307 VanDerWaalsContact OH-OE1 3.09Å; Y298-E307 PolarHBondContact OH-OE2 2.86Å; Y298-Y309 HydrophobicContact CD2-CD1 4.18Å; Y298-Y309 HydrophobicContact CD2-CD2 4.2Å; Y298-Y309 AromaticContact CD2-CE1 3.71Å; Y298-Y309 HydrophobicContact CD2-CE1 3.71Å; Y298-Y309 AromaticContact CD2-CE2 3.73Å; Y298-Y309 HydrophobicContact CD2-CE2 3.73Å; Y298-Y309 HydrophobicContact CD2-CG 4.42Å; Y298-Y309 AromaticContact CD2-CZ 3.46Å; Y298-Y309 VanDerWaalsContact CD2-CZ 3.46Å; Y298-Y309 HydrophobicContact CE2-CE2 4.09Å; Y298-Y309 HydrophobicContact CG-CE1 4.28Å
299	M	94.2	Very high	90.2	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.025	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.3	-179	-64.2	-174.9	73.4	0	0	109	S166 L169 I180 V297 A302 E307 H308	S166-M299 WeakPolarHBondContact OG-CE 3.28Å; L169-M299 HydrophobicContact CD1-CE 4.32Å; L169-M299 HydrophobicContact CD1-CG 3.55Å; L169-M299 HydrophobicContact CD1-SD 4.31Å; I180-M299 HydrophobicContact CD1-SD 4.4Å; V297-M299 HydrophobicContact CG1-CG 4.08Å; M299-A302 HydrophobicContact CB-CB 3.6Å; M299-A302 HydrophobicContact CE-CB 4.23Å; M299-A302 HydrophobicContact CG-CB 4.41Å; M299-A302 HydrophobicContact SD-CB 4.04Å; M299-E307 CarbonylContact O-C 3.51Å; M299-E307 VanDerWaalsContact O-CA 3.3Å; M299-E307 WeakPolarHBondContact O-CA 3.4Å; M299-H308 PolarHBondContact N-O 2.7Å; M299-H308 PolarHBondContact O-N 3.01Å
300	R	90.9	Very high	90.2	Very high	124 Å²	124	53.9 Å²	53.9	47%	0.468	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-24	179.9	-171.8	167.5	62.4	128.5	-2.6	112.4	E165 Y298 G306	E165-R300 VanDerWaalsContact CD-N 3.35Å; E165-R300 WeakPolarHBondContact OE1-CB 3.4Å; E165-R300 PolarHBondContact OE1-N 3.22Å; E165-R300 PolarHBondContact OE2-N 3.01Å; Y298-R300 HydrophobicContact CE1-CB 4.41Å; R300-G306 CarbonylContact O-C 3.07Å; R300-G306 WeakPolarHBondContact O-CA 3.47Å
301	H	87.3	Confident	90.4	Very high	59 Å²	59	47.5 Å²	47.5	27%	0.273	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	23.3	-175.2	-48.1	100.5	0	0	0	112.5	A161 R162 E165 Y303	A161-H301 HydrophobicContact CB-CB 4.37Å; R162-H301 HydrophobicContact CB-CB 4.34Å; R162-H301 VanDerWaalsContact CB-O 3.27Å; R162-H301 WeakPolarHBondContact CB-O 3.31Å; R162-H301 VanDerWaalsContact CG-O 3.24Å; R162-H301 WeakPolarHBondContact CG-O 3.45Å; E165-H301 IonicContact OE1-ND1 2.71Å; E165-H301 WeakPolarHBondContact OE2-CA 3.32Å; E165-H301 PolarHBondContact OE2-N 3.4Å; E165-H301 IonicContact OE2-ND1 3.65Å; H301-Y303 VanDerWaalsContact C-N 3.31Å; H301-Y303 PolarHBondContact O-N 3.05Å
302	A	79.1	Confident	90.5	Very high	3 Å²	3	42.6 Å²	42.6	3%	0.025	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	-39.2	-177.9	0	0	0	0	0	113	R162 M299 G306 H308	R162-A302 WeakPolarHBondContact CD-O 3.46Å; R162-A302 VanDerWaalsContact CZ-O 3.23Å; R162-A302 PolarHBondContact NE-O 3.06Å; M299-A302 HydrophobicContact CB-CB 3.6Å; M299-A302 HydrophobicContact CE-CB 4.23Å; M299-A302 HydrophobicContact CG-CB 4.41Å; M299-A302 HydrophobicContact SD-CB 4.04Å; A302-G306 PolarHBondContact N-O 3.07Å; A302-H308 HydrophobicContact CB-CB 3.72Å
303	Y	79	Confident	90.6	Very high	75 Å²	75	37.9 Å²	37.9	29%	0.294	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	171	-177	-60.9	-72.4	0	0	0	111.7	H301 L305 G306 H308	H301-Y303 VanDerWaalsContact C-N 3.31Å; H301-Y303 PolarHBondContact O-N 3.05Å; Y303-L305 PolarHBondContact O-N 3.31Å; Y303-L305 VanDerWaalsContact O-N 3.14Å; Y303-G306 PolarHBondContact N-O 3.28Å; Y303-G306 WeakPolarHBondContact O-CA 3.36Å; Y303-G306 PolarHBondContact O-N 3.44Å; Y303-H308 HydrophobicContact CD2-CB 3.94Å; Y303-H308 AromaticContact CD2-CG 3.83Å; Y303-H308 AromaticContact CD2-ND1 3.95Å; Y303-H308 HydrophobicContact CE2-CB 4.06Å; Y303-H308 AromaticContact CE2-CD2 3.62Å; Y303-H308 AromaticContact CE2-CE1 3.74Å; Y303-H308 AromaticContact CE2-CG 3.49Å; Y303-H308 VanDerWaalsContact CE2-CG 3.49Å; Y303-H308 AromaticContact CE2-ND1 3.59Å; Y303-H308 AromaticContact CE2-NE2 3.76Å
304	G	69.4	Low	90.5	Very high	93 Å²	93	45.2 Å²	45.2	96%	0.959	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.7	178.1	0	0	0	0	0	114.4	G306	G304-G306 VanDerWaalsContact C-N 3.33Å
305	L	69.6	Low	90	Very high	147 Å²	147	48.5 Å²	48.5	77%	0.77	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-2.7	173.3	-65.4	173.4	0	0	0	113.2	W256 Y303	W256-L305 HydrophobicContact CH2-CB 4.21Å; W256-L305 HydrophobicContact CZ2-CB 4.36Å; Y303-L305 PolarHBondContact O-N 3.31Å; Y303-L305 VanDerWaalsContact O-N 3.14Å
306	G	83.6	Confident	89	Confident	19 Å²	19	52.9 Å²	52.9	20%	0.196	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	93.9	-110.1	176.8	0	0	0	0	0	113.4	R300 A302 Y303 G304	R300-G306 CarbonylContact O-C 3.07Å; R300-G306 WeakPolarHBondContact O-CA 3.47Å; A302-G306 PolarHBondContact N-O 3.07Å; Y303-G306 PolarHBondContact N-O 3.28Å; Y303-G306 WeakPolarHBondContact O-CA 3.36Å; Y303-G306 PolarHBondContact O-N 3.44Å; G304-G306 VanDerWaalsContact C-N 3.33Å
307	E	91.4	Very high	87.3	Confident	100 Å²	100	58.5 Å²	58.5	47%	0.467	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	138.3	-163.1	-54.6	-175.4	179.1	0	0	113.6	Y298 M299	Y298-E307 HydrophobicContact CE2-CB 3.94Å; Y298-E307 HydrophobicContact CE2-CG 4.31Å; Y298-E307 VanDerWaalsContact OH-CG 3.27Å; Y298-E307 WeakPolarHBondContact OH-CG 3.44Å; Y298-E307 PolarHBondContact OH-OE1 3.18Å; Y298-E307 VanDerWaalsContact OH-OE1 3.09Å; Y298-E307 PolarHBondContact OH-OE2 2.86Å; M299-E307 CarbonylContact O-C 3.51Å; M299-E307 VanDerWaalsContact O-CA 3.3Å; M299-E307 WeakPolarHBondContact O-CA 3.4Å
308	H	95.3	Very high	85	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.019	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	145.3	-179.5	-172.4	78.3	0	0	0	112.4	I183 C189 M299 A302 Y303 N310	I183-H308 PolarHBondContact O-CE1 3Å; I183-H308 VanDerWaalsContact O-CE1 3.23Å; I183-H308 PolarHBondContact O-NE2 3.14Å; C189-H308 WeakPolarHBondContact CB-CE1 3.43Å; C189-H308 WeakPolarHBondContact CB-ND1 3.41Å; M299-H308 PolarHBondContact N-O 2.7Å; M299-H308 PolarHBondContact O-N 3.01Å; A302-H308 HydrophobicContact CB-CB 3.72Å; Y303-H308 HydrophobicContact CD2-CB 3.94Å; Y303-H308 AromaticContact CD2-CG 3.83Å; Y303-H308 AromaticContact CD2-ND1 3.95Å; Y303-H308 HydrophobicContact CE2-CB 4.06Å; Y303-H308 AromaticContact CE2-CD2 3.62Å; Y303-H308 AromaticContact CE2-CE1 3.74Å; Y303-H308 AromaticContact CE2-CG 3.49Å; Y303-H308 VanDerWaalsContact CE2-CG 3.49Å; Y303-H308 AromaticContact CE2-ND1 3.59Å; Y303-H308 AromaticContact CE2-NE2 3.76Å; H308-N310 PolarHBondContact CD2-ND2 2.81Å; H308-N310 PolarHBondContact CD2-OD1 2.92Å; H308-N310 PolarHBondContact NE2-OD1 2.85Å
309	Y	96.8	Very high	82.8	Confident	21 Å²	21	67 Å²	67	8%	0.082	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	135.8	173.3	-69.7	-92.9	0	0	0	111	M190 L262 I275 L296 V297 Y298	M190-Y309 HydrophobicContact CB-CD2 3.69Å; M190-Y309 HydrophobicContact CB-CE2 4.14Å; M190-Y309 HydrophobicContact CB-CG 4.04Å; M190-Y309 HydrophobicContact CG-CD1 4.49Å; M190-Y309 HydrophobicContact CG-CD2 4.1Å; M190-Y309 HydrophobicContact CG-CE2 4.2Å; M190-Y309 HydrophobicContact CG-CG 4.24Å; L262-Y309 HydrophobicContact CD1-CE1 4.14Å; I275-Y309 HydrophobicContact CG2-CE1 4.19Å; L296-Y309 HydrophobicContact CB-CD1 4.4Å; L296-Y309 HydrophobicContact CD1-CD1 4.28Å; V297-Y309 CarbonylContact O-C 3.49Å; V297-Y309 WeakPolarHBondContact O-CA 3.33Å; Y298-Y309 HydrophobicContact CD2-CD1 4.18Å; Y298-Y309 HydrophobicContact CD2-CD2 4.2Å; Y298-Y309 AromaticContact CD2-CE1 3.71Å; Y298-Y309 HydrophobicContact CD2-CE1 3.71Å; Y298-Y309 AromaticContact CD2-CE2 3.73Å; Y298-Y309 HydrophobicContact CD2-CE2 3.73Å; Y298-Y309 HydrophobicContact CD2-CG 4.42Å; Y298-Y309 AromaticContact CD2-CZ 3.46Å; Y298-Y309 VanDerWaalsContact CD2-CZ 3.46Å; Y298-Y309 HydrophobicContact CE2-CE2 4.09Å; Y298-Y309 HydrophobicContact CG-CE1 4.28Å
310	N	97.1	Very high	80.4	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	157.8	171.7	-73.7	-51.1	0	0	0	110.8	I180 Q182 I183 V297 H308	I180-N310 HydrophobicContact CG2-CB 3.66Å; Q182-N310 WeakPolarHBondContact CA-OD1 3.47Å; Q182-N310 VanDerWaalsContact OE1-CG 3.28Å; Q182-N310 PolarHBondContact OE1-ND2 3.39Å; Q182-N310 PolarHBondContact OE1-OD1 3.05Å; I183-N310 PolarHBondContact N-OD1 3.48Å; V297-N310 HydrophobicContact CB-CB 4.35Å; V297-N310 PolarHBondContact N-O 2.98Å; V297-N310 PolarHBondContact O-N 3.09Å; H308-N310 PolarHBondContact CD2-ND2 2.81Å; H308-N310 PolarHBondContact CD2-OD1 2.92Å; H308-N310 PolarHBondContact NE2-OD1 2.85Å
311	S	97.2	Very high	78.1	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	169.8	169.7	-175.6	0	0	0	0	109.3	K181 D196 Q197	K181-S311 PolarHBondContact N-O 3.03Å; K181-S311 PolarHBondContact O-N 3.31Å; D196-S311 VanDerWaalsContact OD2-CB 3.24Å; D196-S311 WeakPolarHBondContact OD2-CB 3.19Å; D196-S311 PolarHBondContact OD2-OG 2.88Å; Q197-S311 PolarHBondContact NE2-OG 3.31Å
312	V	96.5	Very high	75.9	Confident	4 Å²	4	81 Å²	81	2%	0.024	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	156.5	169.1	-59.5	0	0	0	0	110.1	L173 L178 E179 Q197 I295 V297	L173-V312 HydrophobicContact CD2-CG1 3.78Å; L178-V312 HydrophobicContact CD1-CG2 4.28Å; L178-V312 HydrophobicContact CD2-CG2 4.3Å; E179-V312 CarbonylContact O-C 3.58Å; E179-V312 VanDerWaalsContact O-CA 3.29Å; E179-V312 WeakPolarHBondContact O-CA 3.36Å; Q197-V312 PolarHBondContact NE2-O 3.13Å; I295-V312 HydrophobicContact CB-CG2 3.65Å; I295-V312 HydrophobicContact CG2-CG1 3.99Å; I295-V312 HydrophobicContact CG2-CG2 3.8Å; V297-V312 HydrophobicContact CG2-CG1 3.48Å; V297-V312 VanDerWaalsContact CG2-CG1 3.48Å
313	T	94.6	Very high	73.9	Confident	35 Å²	35	86.7 Å²	86.7	22%	0.215	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	164.8	166.5	-160.7	0	0	0	0	109.9	L178 E179 E200	L178-T313 CarbonylContact C-O 3.6Å; L178-T313 WeakPolarHBondContact CA-O 3.39Å; E179-T313 HydrophobicContact CG-CG2 3.56Å; E179-T313 PolarHBondContact N-O 3.45Å; E179-T313 PolarHBondContact O-N 3.49Å; E179-T313 WeakPolarHBondContact OE1-CG2 3.22Å; E200-T313 PolarHBondContact OE1-OG1 3.29Å
314	R	92.4	Very high	71.9	Confident	202 Å²	202	92.9 Å²	92.9	76%	0.762	55%	0.552	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-69.1	134.6	179.1	-71.1	-172.7	175.6	146.9	0.9	109.8	V316	R314-V316 PolarHBondContact O-N 3.16Å
315	L	86.6	Confident	72	Confident	69 Å²	69	92.9 Å²	92.9	36%	0.361	53%	0.532	S	S	.	.			trans	-65.7	105.7	174.8	-171.8	70.8	0	0	0	108.9	E177 E179 N317	E177-L315 WeakPolarHBondContact O-CB 3.36Å; E177-L315 PolarHBondContact O-N 3.28Å; E179-L315 HydrophobicContact CB-CD1 4.13Å; E179-L315 HydrophobicContact CG-CD1 4.49Å; L315-N317 PolarHBondContact O-N 3.48Å
316	V	77.7	Confident	72.1	Confident	119 Å²	119	90 Å²	90	72%	0.721	52%	0.519	S	S	*	.			trans	-79.4	101.9	175.7	-173.6	0	0	0	0	107.9	R314 S318	R314-V316 PolarHBondContact O-N 3.16Å; V316-S318 VanDerWaalsContact C-N 3.31Å; V316-S318 PolarHBondContact O-N 3.26Å
317	N	61.5	Low	71.5	Confident	118 Å²	118	93.9 Å²	93.9	63%	0.631	54%	0.537	S	S	*	.			trans	-65.9	90	171.3	-74.8	-25.6	0	0	0	109.7	L315 A319	L315-N317 PolarHBondContact O-N 3.48Å; N317-A319 PolarHBondContact O-N 3.36Å
318	S	49.4	Very low	70.3	Confident	122 Å²	122	93.6 Å²	93.6	85%	0.853	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	41.3	173.2	54.7	0	0	0	0	112.4	V316	V316-S318 VanDerWaalsContact C-N 3.31Å; V316-S318 PolarHBondContact O-N 3.26Å
319	A	49.2	Very low	68.8	Low	87 Å²	87	99.2 Å²	99.2	72%	0.719	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	3.5	-175.6	0	0	0	0	0	114.6	N317	N317-A319 PolarHBondContact O-N 3.36Å
320	T	43.3	Very low	66.9	Low	126 Å²	126	104.4 Å²	104.4	77%	0.773	61%	0.607	S	S	*	*			trans	-131.5	59.3	-179.9	56.8	0	0	0	0	113.2
321	E	43.4	Very low	64.7	Low	189 Å²	189	111.9 Å²	111.9	88%	0.883	65%	0.65	S	S	*	*	S	Bend	trans	-132.9	25.7	162.9	-76.7	-164.6	153.5	0	0	112.9
322	N	40.9	Very low	62.2	Low	168 Å²	168	120.5 Å²	120.5	90%	0.898	70%	0.7	S	S	*	*	S	Bend	trans	-127.9	51.4	170.3	-87.8	-17.8	0	0	0	111.5
323	C	37.2	Very low	59.4	Low	123 Å²	123	130.2 Å²	130.2	83%	0.831	76%	0.756	S	S	*	*			trans	-159.8	91.6	157.1	-152.4	0	0	0	0	110.4
324	S	36.2	Very low	56.2	Low	204 Å²	204	138.8 Å²	138.8	100%	1.427	81%	0.805	S	S	*	*			trans	-158.4	0	150	-75	0	0	0	0	108.9

Retrieved 324 of 324 residues in 97.9 ms (Link to these results)

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