A0A3Q0KLR9_SCHMA Loading...

DAGKc domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KLR9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 551 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	31.3	Very low	35	Very low	181 Å²	181	97.5 Å²	97.5	89%	0.892	48%	0.478	S	S	*	.				0	104.8	0	-78.2	-169.8	-175.9	0	0	107.1	F3	M1-F3 HydrophobicContact CB-CD2 4.01Å; M1-F3 HydrophobicContact CB-CE1 4.03Å; M1-F3 HydrophobicContact CB-CE2 3.42Å; M1-F3 VanDerWaalsContact CB-CE2 3.42Å; M1-F3 HydrophobicContact CB-CZ 3.45Å; M1-F3 VanDerWaalsContact CB-CZ 3.45Å; M1-F3 HydrophobicContact CG-CE2 4.43Å; M1-F3 HydrophobicContact CG-CZ 4.03Å; M1-F3 WeakPolarHBondContact O-CD2 3.35Å; M1-F3 WeakPolarHBondContact O-CE2 3.46Å; M1-F3 PolarHBondContact O-N 3.17Å; M1-F3 HydrophobicContact SD-CE1 3.74Å; M1-F3 HydrophobicContact SD-CE2 4.3Å; M1-F3 HydrophobicContact SD-CZ 3.38Å; M1-F3 WeakPolarHBondContact SD-CZ 3.14Å
2	D	32	Very low	35.3	Very low	138 Å²	138	91.2 Å²	91.2	74%	0.738	45%	0.447	S	S	*	.			trans	-82	106.5	172.7	-169.2	-11.5	0	0	0	108.3	S4	D2-S4 VanDerWaalsContact C-N 3.34Å; D2-S4 PolarHBondContact O-N 3.29Å; D2-S4 PolarHBondContact OD1-OG 2.94Å
3	F	33.7	Very low	35.9	Very low	84 Å²	84	84.8 Å²	84.8	37%	0.368	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-84.6	-4.2	-166.3	-76.3	-74.3	0	0	0	114.3	M1 Q5 I6 R308	M1-F3 HydrophobicContact CB-CD2 4.01Å; M1-F3 HydrophobicContact CB-CE1 4.03Å; M1-F3 HydrophobicContact CB-CE2 3.42Å; M1-F3 VanDerWaalsContact CB-CE2 3.42Å; M1-F3 HydrophobicContact CB-CZ 3.45Å; M1-F3 VanDerWaalsContact CB-CZ 3.45Å; M1-F3 HydrophobicContact CG-CE2 4.43Å; M1-F3 HydrophobicContact CG-CZ 4.03Å; M1-F3 WeakPolarHBondContact O-CD2 3.35Å; M1-F3 WeakPolarHBondContact O-CE2 3.46Å; M1-F3 PolarHBondContact O-N 3.17Å; M1-F3 HydrophobicContact SD-CE1 3.74Å; M1-F3 HydrophobicContact SD-CE2 4.3Å; M1-F3 HydrophobicContact SD-CZ 3.38Å; M1-F3 WeakPolarHBondContact SD-CZ 3.14Å; F3-Q5 VanDerWaalsContact C-N 3.28Å; F3-Q5 PolarHBondContact O-N 3.48Å; F3-I6 HydrophobicContact CD1-CD1 4.2Å; F3-I6 PolarHBondContact O-N 3.42Å; F3-I6 VanDerWaalsContact O-N 3.14Å; F3-R308 VanDerWaalsContact CD1-NH2 3.33Å
4	S	34.8	Very low	35.5	Very low	73 Å²	73	87.7 Å²	87.7	51%	0.51	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-64.1	-26.4	-172.9	60.7	0	0	0	0	114.5	D2	D2-S4 VanDerWaalsContact C-N 3.34Å; D2-S4 PolarHBondContact O-N 3.29Å; D2-S4 PolarHBondContact OD1-OG 2.94Å
5	Q	38.7	Very low	35.5	Very low	113 Å²	113	85.1 Å²	85.1	53%	0.528	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-84.2	-22.2	177.6	-61.2	-159.1	15.3	0	0	113.6	F3	F3-Q5 VanDerWaalsContact C-N 3.28Å; F3-Q5 PolarHBondContact O-N 3.48Å
6	I	36.2	Very low	35.1	Very low	28 Å²	28	87.5 Å²	87.5	14%	0.144	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-30.8	-173.8	-59.9	179	0	0	0	111.4	F3 K8 V9 R308	F3-I6 HydrophobicContact CD1-CD1 4.2Å; F3-I6 PolarHBondContact O-N 3.42Å; F3-I6 VanDerWaalsContact O-N 3.14Å; I6-K8 PolarHBondContact O-N 3.46Å; I6-V9 VanDerWaalsContact O-CB 3.23Å; I6-V9 WeakPolarHBondContact O-CB 3.45Å; I6-V9 WeakPolarHBondContact O-CG2 3.5Å; I6-V9 PolarHBondContact O-N 3.34Å; I6-R308 HydrophobicContact CG2-CG 3.89Å; I6-R308 VanDerWaalsContact CG2-CZ 3.49Å
7	D	33.3	Very low	34.7	Very low	102 Å²	102	92.9 Å²	92.9	55%	0.545	46%	0.458	S	S	.	.	H	α-helix	trans	-71.4	-19.6	177	-68	-21	0	0	0	112.6	V9 R308	D7-V9 VanDerWaalsContact C-N 3.28Å; D7-V9 PolarHBondContact O-N 3.25Å; D7-R308 IonicContact OD1-NH1 3.06Å; D7-R308 PolarHBondContact OD1-NH1 3.4Å
8	K	39.6	Very low	34.3	Very low	100 Å²	100	93.7 Å²	93.7	44%	0.435	47%	0.473	S	S	.	.	H	α-helix	trans	-66.9	-29.4	167.7	-66	-179.6	179.8	178	0	111.9	I6 R10 S11 L12	I6-K8 PolarHBondContact O-N 3.46Å; K8-R10 PolarHBondContact O-N 3.33Å; K8-S11 PolarHBondContact O-N 2.78Å; K8-S11 PolarHBondContact O-OG 2.99Å; K8-S11 VanDerWaalsContact O-OG 3.06Å; K8-L12 HydrophobicContact CB-CD1 4.11Å; K8-L12 WeakPolarHBondContact O-CB 3.39Å; K8-L12 WeakPolarHBondContact O-CD1 3.5Å; K8-L12 WeakPolarHBondContact O-CG 3.48Å; K8-L12 PolarHBondContact O-N 3.16Å; K8-L12 VanDerWaalsContact O-N 3.14Å
9	V	37.3	Very low	33.9	Very low	7 Å²	7	95.3 Å²	95.3	4%	0.042	47%	0.473	C	S	.	.	H	α-helix	trans	-65	-38	-177	-177.3	0	0	0	0	112.1	I6 D7 S11 L12 I13 L311 L341 L344	I6-V9 VanDerWaalsContact O-CB 3.23Å; I6-V9 WeakPolarHBondContact O-CB 3.45Å; I6-V9 WeakPolarHBondContact O-CG2 3.5Å; I6-V9 PolarHBondContact O-N 3.34Å; D7-V9 VanDerWaalsContact C-N 3.28Å; D7-V9 PolarHBondContact O-N 3.25Å; V9-S11 VanDerWaalsContact C-N 3.28Å; V9-S11 PolarHBondContact O-N 3.26Å; V9-L12 PolarHBondContact O-N 3.27Å; V9-I13 HydrophobicContact CG1-CD1 4.01Å; V9-L311 HydrophobicContact CG1-CD1 4.35Å; V9-L341 HydrophobicContact CG1-CD2 4.36Å; V9-L344 HydrophobicContact CB-CD1 4.41Å; V9-L344 HydrophobicContact CG1-CD1 3.88Å; V9-L344 HydrophobicContact CG2-CD1 3.88Å
10	R	33.8	Very low	33.5	Very low	209 Å²	209	97 Å²	97	79%	0.789	49%	0.489	S	S	*	.	H	α-helix	trans	-64.9	-34.3	-178.7	-154.8	176.9	-171.5	174.4	1.2	112.2	K8	K8-R10 PolarHBondContact O-N 3.33Å
11	S	34.1	Very low	33.1	Very low	38 Å²	38	97.9 Å²	97.9	27%	0.266	50%	0.504	S	S	.	.	H	α-helix	trans	-92.8	-6.2	-179.4	47.2	0	0	0	0	113.8	K8 V9 R381	K8-S11 PolarHBondContact O-N 2.78Å; K8-S11 PolarHBondContact O-OG 2.99Å; K8-S11 VanDerWaalsContact O-OG 3.06Å; V9-S11 VanDerWaalsContact C-N 3.28Å; V9-S11 PolarHBondContact O-N 3.26Å; S11-R381 VanDerWaalsContact O-CD 3.28Å; S11-R381 WeakPolarHBondContact O-CD 3.37Å; S11-R381 PolarHBondContact O-NE 3.07Å; S11-R381 PolarHBondContact OG-NH1 3.28Å; S11-R381 PolarHBondContact OG-NH2 3.31Å
12	L	39.2	Very low	32.9	Very low	21 Å²	21	94.2 Å²	94.2	11%	0.11	50%	0.497	C	S	.	.	H	α-helix	trans	-87.7	-14.2	176.5	-76.3	159.9	0	0	0	112.7	K8 V9 R384 P390	K8-L12 HydrophobicContact CB-CD1 4.11Å; K8-L12 WeakPolarHBondContact O-CB 3.39Å; K8-L12 WeakPolarHBondContact O-CD1 3.5Å; K8-L12 WeakPolarHBondContact O-CG 3.48Å; K8-L12 PolarHBondContact O-N 3.16Å; K8-L12 VanDerWaalsContact O-N 3.14Å; V9-L12 PolarHBondContact O-N 3.27Å; L12-R384 PolarHBondContact O-NH2 2.94Å; L12-P390 HydrophobicContact CD1-CG 3.55Å
13	I	42.8	Very low	32.7	Very low	8 Å²	8	92.5 Å²	92.5	4%	0.041	50%	0.495	C	S	.	.			trans	-137.2	30.1	-165.7	-39.7	174.3	0	0	0	111.8	V9 V15 M307 V337 L340 L341 L344	V9-I13 HydrophobicContact CG1-CD1 4.01Å; I13-V15 VanDerWaalsContact C-N 3.26Å; I13-V15 PolarHBondContact O-N 3.18Å; I13-M307 HydrophobicContact CB-CE 3.81Å; I13-M307 HydrophobicContact CB-SD 3.47Å; I13-M307 WeakPolarHBondContact CB-SD 3.36Å; I13-M307 HydrophobicContact CD1-SD 4.15Å; I13-M307 HydrophobicContact CG1-SD 4.39Å; I13-M307 HydrophobicContact CG2-CE 4.26Å; I13-M307 HydrophobicContact CG2-SD 3.34Å; I13-M307 WeakPolarHBondContact CG2-SD 3.42Å; I13-M307 WeakPolarHBondContact O-CE 3.28Å; I13-V337 HydrophobicContact CG2-CG1 3.29Å; I13-L340 HydrophobicContact CD1-CB 4.35Å; I13-L340 HydrophobicContact CG1-CD1 4.33Å; I13-L341 HydrophobicContact CD1-CD2 3.4Å; I13-L341 VanDerWaalsContact CD1-CD2 3.4Å; I13-L341 HydrophobicContact CD1-CG 4.06Å; I13-L344 HydrophobicContact CD1-CD1 4.5Å
14	E	30.5	Very low	32.3	Very low	126 Å²	126	98.6 Å²	98.6	59%	0.589	52%	0.522	S	S	*	.			trans	-73.8	92.2	155.7	-77.7	171.9	-176.5	0	0	106.1	L380	E14-L380 HydrophobicContact CB-CD1 3.54Å; E14-L380 WeakPolarHBondContact O-CD1 3.36Å; E14-L380 WeakPolarHBondContact O-CG 3.27Å
15	V	35	Very low	32.1	Very low	48 Å²	48	100 Å²	100	29%	0.291	53%	0.531	S	S	.	.			trans	-119.2	112.6	163.8	179	0	0	0	0	103.4	I13 H17	I13-V15 VanDerWaalsContact C-N 3.26Å; I13-V15 PolarHBondContact O-N 3.18Å; V15-H17 PolarHBondContact O-N 2.89Å
16	D	28.5	Very low	31.4	Very low	124 Å²	124	102 Å²	102	66%	0.663	55%	0.546	S	S	*	.			trans	-43.1	135.8	-171.3	-82.5	-41.5	0	0	0	113.2	C18	D16-C18 PolarHBondContact O-N 3.37Å
17	H	29.7	Very low	31.1	Very low	180 Å²	180	111.4 Å²	111.4	83%	0.833	58%	0.581	S	S	*	*			trans	-62.4	47.8	167.8	-79.2	-71.9	0	0	0	112.8	V15 Y19	V15-H17 PolarHBondContact O-N 2.89Å; H17-Y19 PolarHBondContact O-N 3.02Å
18	C	26.7	Very low	30.7	Very low	107 Å²	107	113.7 Å²	113.7	72%	0.723	59%	0.593	S	S	*	*			trans	-83.1	20.7	171.5	-71.1	0	0	0	0	113.4	D16	D16-C18 PolarHBondContact O-N 3.37Å
19	Y	27.1	Very low	30.1	Very low	123 Å²	123	113.4 Å²	113.4	48%	0.482	60%	0.604	S	S	.	*	S	Bend	trans	-114	83.6	176.8	-71.2	-84.1	0	0	0	110	H17 H494 L495	H17-Y19 PolarHBondContact O-N 3.02Å; Y19-H494 AromaticContact CZ-NE2 3.88Å; Y19-H494 PolarHBondContact OH-NE2 2.88Å; Y19-L495 HydrophobicContact CE1-CD1 4.18Å
20	T	26.2	Very low	29.8	Very low	129 Å²	129	120.3 Å²	120.3	79%	0.791	64%	0.641	S	S	*	*	S	Bend	trans	161.5	35.6	149.9	50	0	0	0	0	113.2
21	S	24.2	Very low	29.4	Very low	116 Å²	116	118.4 Å²	118.4	81%	0.811	65%	0.646	S	S	*	*			trans	-178.7	126.3	162.2	32.9	0	0	0	0	111.5
22	S	27.5	Very low	29.2	Very low	104 Å²	104	124.8 Å²	124.8	73%	0.727	67%	0.672	S	S	*	*			trans	152.9	94.1	157.7	168.2	0	0	0	0	107.3
23	S	27.3	Very low	28.5	Very low	102 Å²	102	130.5 Å²	130.5	71%	0.713	70%	0.701	S	S	*	*				70	125.7	81	69.4	0	0	0	0	113	S25	S23-S25 PolarHBondContact O-N 3.5Å
24	K	25.2	Very low	27.9	Very low	213 Å²	213	139.3 Å²	139.3	93%	0.926	74%	0.739	S	S	*	*			trans	-43.1	130.4	172.3	-72.5	163.2	168.2	174.2	0	111.3
25	S	30.6	Very low	27.5	Very low	101 Å²	101	139.9 Å²	139.9	71%	0.706	75%	0.746	S	S	*	*			trans	-144.8	126.2	148	51.7	0	0	0	0	109.4	S23	S23-S25 PolarHBondContact O-N 3.5Å
26	N	24.5	Very low	27.1	Very low	155 Å²	155	145.2 Å²	145.2	83%	0.829	77%	0.773	S	S	*	*			trans	-66.3	135.5	168.6	-70.2	-29.6	0	0	0	108.3
27	Y	30.1	Very low	26.9	Very low	227 Å²	227	143.8 Å²	143.8	89%	0.89	77%	0.772	S	S	*	*			trans	-140.5	108.2	147.6	-91.8	-78.7	0	0	0	108.1
28	D	25.8	Very low	26.8	Very low	149 Å²	149	140.8 Å²	140.8	80%	0.797	77%	0.768	S	S	*	*			trans	-65.6	160.8	157.5	-101.5	-40.6	0	0	0	110.1
29	S	26.1	Very low	27	Very low	95 Å²	95	146.3 Å²	146.3	66%	0.664	78%	0.776	S	S	*	*			trans	55	117	162.6	58.4	0	0	0	0	117.7
30	D	30.3	Very low	26.9	Very low	152 Å²	152	149.4 Å²	149.4	81%	0.813	79%	0.794	S	S	*	*				-162.6	118.7	106.9	-82.7	-26.1	0	0	0	110.8
31	N	25.8	Very low	27.1	Very low	168 Å²	168	148.1 Å²	148.1	90%	0.898	79%	0.79	S	S	*	*			trans	-73	111.1	160.8	-77	-39.3	0	0	0	106.8
32	E	30.7	Very low	27.1	Very low	172 Å²	172	147.2 Å²	147.2	80%	0.804	78%	0.784	S	S	*	*			trans	-135.6	123	153.5	-77.3	-161.5	157.9	0	0	111.7
33	I	24.7	Very low	27.1	Very low	142 Å²	142	152.5 Å²	152.5	73%	0.728	80%	0.795	S	S	*	*			trans	-64.5	126.8	173.7	-68.9	156.4	0	0	0	108.5
34	F	28.5	Very low	26.9	Very low	193 Å²	193	156.9 Å²	156.9	85%	0.846	80%	0.804	S	S	*	*			trans	-139.2	108.1	151.1	-89	-77.5	0	0	0	110.2
35	N	22.3	Very low	27	Very low	137 Å²	137	152.9 Å²	152.9	73%	0.733	80%	0.797	S	S	*	*			trans	-66.9	168.6	164.4	-82.7	-33.8	0	0	0	111.6
36	L	27.4	Very low	26.8	Very low	161 Å²	161	157.8 Å²	157.8	84%	0.843	81%	0.809	S	S	*	*			trans	123.8	86.5	158.2	-66.2	163.4	0	0	0	110.8
37	S	24.9	Very low	26.9	Very low	94 Å²	94	155.2 Å²	155.2	66%	0.657	79%	0.792	S	S	*	*				92.6	142.7	84.7	90	0	0	0	0	112.5
38	P	27	Very low	26.9	Very low	116 Å²	116	150.3 Å²	150.3	75%	0.753	79%	0.79	S	S	*	*			trans	-94.7	146.1	-166.6	36.5	-30.3	0	0	0	111.7
39	Y	29.8	Very low	27	Very low	224 Å²	224	146.5 Å²	146.5	88%	0.878	78%	0.775	S	S	*	*			trans	-136.1	116.8	162.1	-95.9	-82.4	0	0	0	110.5
40	H	26.4	Very low	27.4	Very low	187 Å²	187	147.1 Å²	147.1	87%	0.866	77%	0.77	S	S	*	*			trans	-78.8	139.2	163.9	-110	-85.8	0	0	0	109.7
41	S	29.3	Very low	27.6	Very low	102 Å²	102	145 Å²	145	71%	0.713	76%	0.759	S	S	*	*			trans	172.1	94.8	141.7	56.5	0	0	0	0	107.9
42	S	24	Very low	28.2	Very low	98 Å²	98	138 Å²	138	69%	0.685	72%	0.722	S	S	*	*				60.9	93.9	98.2	63	0	0	0	0	114
43	F	27.9	Very low	28.3	Very low	215 Å²	215	130.2 Å²	130.2	94%	0.943	69%	0.688	S	S	*	*			trans	-155.3	116.5	144.6	-99.6	-74.1	0	0	0	108.4
44	E	24	Very low	28.6	Very low	193 Å²	193	125 Å²	125	90%	0.902	67%	0.669	S	S	*	*			trans	-76	120.6	177.9	-66.9	172.7	147.7	0	0	110
45	V	27.6	Very low	28.8	Very low	129 Å²	129	120.8 Å²	120.8	78%	0.782	66%	0.661	S	S	*	*			trans	-146	121	150.5	-178.6	0	0	0	0	105.6	E47	V45-E47 PolarHBondContact O-N 3.1Å
46	E	25.1	Very low	29.4	Very low	205 Å²	205	122.1 Å²	122.1	96%	0.958	67%	0.668	S	S	*	*			trans	-59.5	91.7	179.3	-78.2	-174.5	134.6	0	0	111.4
47	E	28.2	Very low	29.5	Very low	101 Å²	101	121.2 Å²	121.2	47%	0.472	67%	0.67	S	S	.	*			trans	-94.4	122.3	165.3	-75.4	-164.5	141.6	0	0	109.5	V45 C49 R419	V45-E47 PolarHBondContact O-N 3.1Å; E47-C49 PolarHBondContact O-N 3.48Å; E47-R419 IonicContact OE1-NH2 3.72Å
48	S	28.3	Very low	29.7	Very low	123 Å²	123	128.1 Å²	128.1	86%	0.86	68%	0.681	S	S	*	*			trans	-69	66	170.9	50.8	0	0	0	0	111.7	L50	S48-L50 PolarHBondContact O-N 3.28Å
49	C	29.1	Very low	29.8	Very low	70 Å²	70	128.2 Å²	128.2	47%	0.473	68%	0.684	S	S	.	*			trans	-81.8	101.4	164.8	-78.9	0	0	0	0	108.5	E47 D51	E47-C49 PolarHBondContact O-N 3.48Å; C49-D51 VanDerWaalsContact C-N 3.32Å; C49-D51 PolarHBondContact O-N 3.4Å
50	L	33.3	Very low	29.5	Very low	107 Å²	107	122.9 Å²	122.9	56%	0.56	68%	0.679	S	S	*	*			trans	-69.7	92.7	165.7	-77.6	166	0	0	0	108.5	S48 V52 L487	S48-L50 PolarHBondContact O-N 3.28Å; L50-V52 VanDerWaalsContact O-CG2 3.25Å; L50-V52 WeakPolarHBondContact O-CG2 3.25Å; L50-V52 PolarHBondContact O-N 3.36Å; L50-L487 HydrophobicContact CB-CD1 4.06Å
51	D	35.2	Very low	29.8	Very low	109 Å²	109	123.3 Å²	123.3	58%	0.583	68%	0.678	S	S	*	*			trans	-67.5	104.3	168.2	-175.1	5.8	0	0	0	108.8	C49 G53	C49-D51 VanDerWaalsContact C-N 3.32Å; C49-D51 PolarHBondContact O-N 3.4Å; D51-G53 PolarHBondContact O-N 3.14Å; D51-G53 PolarHBondContact OD1-N 3.33Å
52	V	39.4	Very low	29.9	Very low	20 Å²	20	127.4 Å²	127.4	12%	0.121	69%	0.686	C	S	.	*	T	Hydrogen-bonded Turn	trans	-80.3	31.1	-177.7	-142.6	0	0	0	0	111.2	L50 L487 R516	L50-V52 VanDerWaalsContact O-CG2 3.25Å; L50-V52 WeakPolarHBondContact O-CG2 3.25Å; L50-V52 PolarHBondContact O-N 3.36Å; V52-L487 HydrophobicContact CG2-CD1 3.5Å; V52-L487 HydrophobicContact CG2-CG 4.14Å; V52-R516 HydrophobicContact CG1-CB 3.5Å; V52-R516 HydrophobicContact CG1-CG 4.08Å; V52-R516 PolarHBondContact O-NH1 2.8Å; V52-R516 VanDerWaalsContact O-NH1 3.13Å
53	G	32.2	Very low	30.1	Very low	9 Å²	9	130.6 Å²	130.6	9%	0.093	69%	0.691	C	S	.	*	T	Hydrogen-bonded Turn	trans	-160.9	-5.5	-172.1	0	0	0	0	0	119	D51 W506	D51-G53 PolarHBondContact O-N 3.14Å; D51-G53 PolarHBondContact OD1-N 3.33Å; G53-W506 WeakPolarHBondContact O-CB 3.33Å; G53-W506 VanDerWaalsContact O-CD1 3.3Å
54	G	30.8	Very low	30.1	Very low	32 Å²	32	129.3 Å²	129.3	33%	0.33	69%	0.687	S	S	.	*	S	Bend	trans	-105.6	158.3	179.4	0	0	0	0	0	114.3
55	P	32.2	Very low	30.2	Very low	105 Å²	105	129.7 Å²	129.7	68%	0.682	68%	0.681	S	S	*	*			trans	-67.8	144.9	162.6	30.4	-30.5	0	0	0	110	T57	P55-T57 PolarHBondContact O-N 3.14Å
56	D	34.5	Very low	30.4	Very low	165 Å²	165	130 Å²	130	88%	0.882	68%	0.682	S	S	*	*			trans	-52.5	118.7	177.9	-73.6	-49	0	0	0	111.2	R58	D56-R58 VanDerWaalsContact C-N 3.29Å; D56-R58 PolarHBondContact O-N 3.48Å
57	T	29.8	Very low	30.6	Very low	142 Å²	142	128 Å²	128	87%	0.871	67%	0.673	S	S	*	*	S	Bend	trans	-75.3	79.4	171.9	41.4	0	0	0	0	110	P55	P55-T57 PolarHBondContact O-N 3.14Å
58	R	30	Very low	30.7	Very low	239 Å²	239	131.5 Å²	131.5	90%	0.902	69%	0.689	S	S	*	*			trans	-151	76.8	154.7	-82.7	-164.8	178.7	175.9	-1	109.3	D56	D56-R58 VanDerWaalsContact C-N 3.29Å; D56-R58 PolarHBondContact O-N 3.48Å
59	C	28.1	Very low	30.6	Very low	118 Å²	118	132.8 Å²	132.8	80%	0.797	69%	0.686	S	S	*	*			trans	-151.4	91.4	154.2	-112.9	0	0	0	0	107.3
60	S	24.9	Very low	30.6	Very low	111 Å²	111	135.1 Å²	135.1	78%	0.776	70%	0.7	S	S	*	*			trans	-67.4	116.2	163.9	44.6	0	0	0	0	108.8
61	F	31.2	Very low	30.2	Very low	196 Å²	196	135 Å²	135	86%	0.86	71%	0.708	S	S	*	*			trans	-143.6	137.2	154.9	-90.2	-74.4	0	0	0	109.8
62	E	31.4	Very low	30	Very low	188 Å²	188	139.9 Å²	139.9	88%	0.879	73%	0.725	S	S	*	*			trans	-70.5	152.5	-158.4	-64.7	172.4	138.4	0	0	114	E64	E62-E64 PolarHBondContact O-N 3.13Å
63	E	28.2	Very low	29.3	Very low	166 Å²	166	146.1 Å²	146.1	78%	0.776	76%	0.757	S	S	*	*			trans	-68.8	114.8	169.4	-132.5	-178.1	162.8	0	0	109.1
64	E	29.1	Very low	29	Very low	187 Å²	187	152.7 Å²	152.7	87%	0.874	79%	0.79	S	S	*	*			trans	-117.2	105.8	160.6	-136.2	178	-166.2	0	0	109.4	E62 V66	E62-E64 PolarHBondContact O-N 3.13Å; E64-V66 PolarHBondContact O-N 3.35Å
65	R	26.2	Very low	28.9	Very low	202 Å²	202	157.4 Å²	157.4	76%	0.762	82%	0.817	S	S	*	*			trans	-72.2	117.5	171.2	-66	178.1	-169.6	166	5.4	108.6
66	V	31.7	Very low	28.6	Very low	134 Å²	134	157.4 Å²	157.4	81%	0.812	82%	0.819	S	S	*	*			trans	-135.9	121.9	153.1	-176	0	0	0	0	109.5	E64	E64-V66 PolarHBondContact O-N 3.35Å
67	H	28.9	Very low	28.2	Very low	165 Å²	165	154.3 Å²	154.3	76%	0.764	81%	0.811	S	S	*	*			trans	-63.5	164.9	174.4	-72.2	-89.3	0	0	0	112.9
68	Q	30.9	Very low	28.3	Very low	174 Å²	174	154.2 Å²	154.2	81%	0.813	81%	0.81	S	S	*	*			trans	101.7	106.4	150.7	-54.3	-175.8	6.5	0	0	118.6
69	N	26.4	Very low	28.2	Very low	149 Å²	149	147.7 Å²	147.7	80%	0.797	80%	0.798	S	S	*	*			trans	84.7	146	131.9	-73.4	-17.6	0	0	0	122.3
70	P	28.7	Very low	28.3	Very low	119 Å²	119	150.2 Å²	150.2	77%	0.773	80%	0.798	S	S	*	*			trans	-109.4	106.9	-158.5	33.4	-15.9	0	0	0	111.5
71	S	25.1	Very low	28.7	Very low	104 Å²	104	148.9 Å²	148.9	73%	0.727	78%	0.782	S	S	*	*			trans	179.5	101.5	161	49.6	0	0	0	0	110.3
72	F	29.7	Very low	28.7	Very low	213 Å²	213	145.8 Å²	145.8	93%	0.934	78%	0.783	S	S	*	*			trans	-141.7	84.2	158.2	-99.5	-80.2	0	0	0	109.5	N74	F72-N74 PolarHBondContact O-N 3.33Å
73	N	25.2	Very low	28.7	Very low	150 Å²	150	145.6 Å²	145.6	80%	0.802	78%	0.782	S	S	*	*			trans	-58	118.4	144.4	-84.1	-24.3	0	0	0	107.3
74	N	27.1	Very low	29	Very low	147 Å²	147	143 Å²	143	79%	0.786	78%	0.778	S	S	*	*			trans	152.7	91.4	146.5	-79.2	-14	0	0	0	110.2	F72	F72-N74 PolarHBondContact O-N 3.33Å
75	C	27.1	Very low	29.4	Very low	132 Å²	132	139.5 Å²	139.5	89%	0.892	76%	0.76	S	S	*	*			trans	-134.8	72.6	147.8	-150.4	0	0	0	0	107.2
76	S	25.6	Very low	29.8	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	76%	0.758	S	S	*	*			trans	-81.4	103.5	172.1	55.1	0	0	0	0	109.5
77	S	27.5	Very low	30.1	Very low	100 Å²	100	140.7 Å²	140.7	70%	0.699	76%	0.764	S	S	*	*			trans	-177.4	61.9	155.4	49.6	0	0	0	0	112.5
78	V	31.9	Very low	30.3	Very low	141 Å²	141	141.9 Å²	141.9	86%	0.855	77%	0.767	S	S	*	*			trans	-140.8	97.1	145.6	-172.5	0	0	0	0	107
79	P	28.4	Very low	30.5	Very low	101 Å²	101	141 Å²	141	66%	0.656	76%	0.763	S	S	*	*			trans	-70.7	152.5	170.8	15.1	-3	0	0	0	109.4
80	E	28.8	Very low	30.7	Very low	172 Å²	172	139.1 Å²	139.1	80%	0.804	76%	0.759	S	S	*	*			trans	73.6	88.8	159.7	-62.5	170.2	-177.7	0	0	118.1
81	L	33.9	Very low	30.8	Very low	83 Å²	83	143.3 Å²	143.3	44%	0.435	77%	0.765	S	S	.	*	S	Bend	trans	-172	8.6	142.3	-103.5	149.2	0	0	0	114.1	P173	L81-P173 HydrophobicContact CD1-CG 3.73Å; L81-P173 HydrophobicContact CD2-CG 4.4Å
82	C	30.4	Very low	31.3	Very low	130 Å²	130	145.2 Å²	145.2	88%	0.878	77%	0.767	S	S	*	*	S	Bend	trans	-88.5	0.5	167.3	-71.1	0	0	0	0	113.5
83	Q	32.5	Very low	31.4	Very low	185 Å²	185	142 Å²	142	86%	0.864	76%	0.76	S	S	*	*	S	Bend	trans	-116.1	-3.1	-175.9	-73.9	-176.7	-3.7	0	0	115.6
84	T	34	Very low	31.7	Very low	112 Å²	112	141.9 Å²	141.9	69%	0.687	76%	0.759	S	S	*	*			trans	-104.2	48.8	176.2	38.5	0	0	0	0	112.5
85	F	37.6	Very low	32.2	Very low	113 Å²	113	142.4 Å²	142.4	50%	0.496	75%	0.751	S	S	.	*	S	Bend	trans	-95.2	134	153	-81.7	-81.6	0	0	0	107.3	R87	F85-R87 PolarHBondContact O-N 3.06Å
86	P	34.7	Very low	32.5	Very low	110 Å²	110	142 Å²	142	71%	0.714	75%	0.745	S	S	*	*			trans	-64.8	101.1	-178.2	25.4	-30.5	0	0	0	109.1	K88	P86-K88 PolarHBondContact O-N 3.15Å
87	R	38.1	Very low	33.5	Very low	251 Å²	251	142.6 Å²	142.6	95%	0.947	73%	0.731	S	S	*	*	S	Bend	trans	-77.9	-4.4	170.5	-110.1	-176	179.4	-175.5	-0.1	112.3	F85	F85-R87 PolarHBondContact O-N 3.06Å
88	K	32	Very low	34.5	Very low	190 Å²	190	142 Å²	142	83%	0.826	72%	0.723	S	S	*	*	S	Bend	trans	-137.6	111.2	173.8	-70.8	-176.9	176.4	179.9	0	108.6	P86	P86-K88 PolarHBondContact O-N 3.15Å
89	Q	35.5	Very low	35.2	Very low	154 Å²	154	142.4 Å²	142.4	72%	0.72	72%	0.72	S	S	*	*			trans	-66.6	132.5	169.6	-80.3	-178.4	-47.2	0	0	109	K91	Q89-K91 PolarHBondContact O-N 2.94Å
90	P	31.2	Very low	36.4	Very low	111 Å²	111	140 Å²	140	72%	0.721	71%	0.705	S	S	*	*			trans	-63.7	128.7	154.1	-2.1	18.4	0	0	0	107.1	D92	P90-D92 VanDerWaalsContact C-N 3.26Å; P90-D92 PolarHBondContact O-N 3.26Å
91	K	30.6	Very low	38.4	Very low	207 Å²	207	132.6 Å²	132.6	90%	0.9	67%	0.67	S	S	*	*	S	Bend	trans	-69.1	87.9	169.2	-72.6	177.1	175.3	-179.8	0	107.6	Q89	Q89-K91 PolarHBondContact O-N 2.94Å
92	D	36.3	Very low	40.5	Very low	144 Å²	144	135.2 Å²	135.2	77%	0.77	67%	0.674	S	S	*	*			trans	-147.8	142.5	159.7	-88.3	-36	0	0	0	108.3	P90	P90-D92 VanDerWaalsContact C-N 3.26Å; P90-D92 PolarHBondContact O-N 3.26Å
93	D	31	Very low	43	Very low	146 Å²	146	137.3 Å²	137.3	78%	0.781	66%	0.664	S	S	*	*	S	Bend	trans	-68	147.7	-148.1	-64.2	-49.9	0	0	0	117
94	N	30.8	Very low	45.6	Very low	146 Å²	146	129.5 Å²	129.5	78%	0.781	63%	0.627	S	S	*	*	S	Bend	trans	85.2	21	147.3	-75.2	-16.2	0	0	0	124.2
95	Y	38	Very low	48.2	Very low	159 Å²	159	124.8 Å²	124.8	62%	0.624	60%	0.598	S	S	*	*			trans	-134	84.9	162.3	-80.4	-90.3	0	0	0	113.5	W97	Y95-W97 PolarHBondContact O-N 3.38Å; Y95-W97 VanDerWaalsContact O-N 3.09Å
96	T	33.6	Very low	50.5	Low	124 Å²	124	123.6 Å²	123.6	76%	0.761	60%	0.596	S	S	*	*			trans	-67.8	97.2	158.9	16.6	0	0	0	0	108.5	V98	T96-V98 PolarHBondContact O-N 3.4Å
97	W	47.1	Very low	53	Low	115 Å²	115	121.6 Å²	121.6	44%	0.436	58%	0.577	S	S	.	*			trans	-52.5	110.1	173.7	-76.7	86	0	0	0	110.1	Y95 E101 L105 W167	Y95-W97 PolarHBondContact O-N 3.38Å; Y95-W97 VanDerWaalsContact O-N 3.09Å; W97-E101 HydrophobicContact CE3-CB 3.68Å; W97-E101 HydrophobicContact CE3-CG 4.4Å; W97-E101 HydrophobicContact CZ3-CB 3.92Å; W97-E101 HydrophobicContact CZ3-CG 4.49Å; W97-E101 WeakPolarHBondContact CZ3-OE2 3.39Å; W97-L105 HydrophobicContact CE3-CD1 4.44Å; W97-L105 HydrophobicContact CZ3-CD1 4.06Å; W97-W167 HydrophobicContact CH2-CB 3.81Å; W97-W167 AromaticContact CH2-CD1 3.96Å; W97-W167 HydrophobicContact CH2-CG 4.13Å; W97-W167 HydrophobicContact CZ2-CB 4.32Å; W97-W167 AromaticContact CZ2-CD1 3.82Å; W97-W167 HydrophobicContact CZ2-CG 4.4Å
98	V	47.8	Very low	55.4	Low	89 Å²	89	110 Å²	110	54%	0.539	53%	0.534	S	S	.	.			trans	-67.7	138.2	179.4	-176.1	0	0	0	0	107.6	T96 C100 E101	T96-V98 PolarHBondContact O-N 3.4Å; V98-C100 HydrophobicContact CG1-CB 4.44Å; V98-C100 VanDerWaalsContact CG1-SG 3.51Å; V98-C100 PolarHBondContact O-N 3.31Å; V98-E101 PolarHBondContact O-N 2.95Å
99	L	47.4	Very low	58.1	Low	148 Å²	148	102 Å²	102	78%	0.775	50%	0.5	S	S	*	.	H	α-helix	trans	-42.9	-30.5	178.3	-87.1	151.4	0	0	0	114	R103	L99-R103 PolarHBondContact O-N 2.91Å
100	C	52.8	Low	60.6	Low	51 Å²	51	97.2 Å²	97.2	35%	0.345	48%	0.483	S	S	.	.	H	α-helix	trans	-64.5	-38.5	177.8	65.4	0	0	0	0	113.5	V98 R103 H104	V98-C100 HydrophobicContact CG1-CB 4.44Å; V98-C100 VanDerWaalsContact CG1-SG 3.51Å; V98-C100 PolarHBondContact O-N 3.31Å; C100-R103 PolarHBondContact O-N 3Å; C100-H104 PolarHBondContact O-CE1 2.96Å; C100-H104 PolarHBondContact O-N 3.41Å; C100-H104 PolarHBondContact O-ND1 2.94Å
101	E	70.4	Confident	63.3	Low	16 Å²	16	92.9 Å²	92.9	8%	0.075	46%	0.456	C	S	.	.	H	α-helix	trans	-70.8	-36.4	-179.6	-67.7	175.1	155.3	0	0	111.1	W97 V98 R103 H104 L105	W97-E101 HydrophobicContact CE3-CB 3.68Å; W97-E101 HydrophobicContact CE3-CG 4.4Å; W97-E101 HydrophobicContact CZ3-CB 3.92Å; W97-E101 HydrophobicContact CZ3-CG 4.49Å; W97-E101 WeakPolarHBondContact CZ3-OE2 3.39Å; V98-E101 PolarHBondContact O-N 2.95Å; E101-R103 VanDerWaalsContact C-N 3.32Å; E101-R103 PolarHBondContact O-N 3.2Å; E101-H104 PolarHBondContact O-N 3.33Å; E101-L105 WeakPolarHBondContact O-CG 3.37Å; E101-L105 PolarHBondContact O-N 3.09Å
102	R	77.7	Confident	66.1	Low	138 Å²	138	83.1 Å²	83.1	52%	0.521	41%	0.413	S	S	.	.	H	α-helix	trans	-59.1	-41.5	176	-171.4	177.1	-178.9	-178.9	0.5	112.2	L105 I106	R102-L105 PolarHBondContact O-N 3.14Å; R102-I106 HydrophobicContact CG-CD1 4.18Å; R102-I106 VanDerWaalsContact O-CG1 3.31Å; R102-I106 WeakPolarHBondContact O-CG1 3.34Å; R102-I106 PolarHBondContact O-N 3.12Å
103	R	83.9	Confident	68.5	Low	174 Å²	174	81.2 Å²	81.2	66%	0.657	40%	0.395	S	S	*	.	H	α-helix	trans	-60.6	-45.9	176.9	-177.2	-178.4	178.7	-176.7	-0.2	111.3	L99 C100 E101 I106 Q107	L99-R103 PolarHBondContact O-N 2.91Å; C100-R103 PolarHBondContact O-N 3Å; E101-R103 VanDerWaalsContact C-N 3.32Å; E101-R103 PolarHBondContact O-N 3.2Å; R103-I106 PolarHBondContact O-N 3.34Å; R103-Q107 WeakPolarHBondContact O-CG 3.31Å; R103-Q107 PolarHBondContact O-N 3.34Å; R103-Q107 VanDerWaalsContact O-N 3.13Å
104	H	87.7	Confident	71	Confident	21 Å²	21	80.3 Å²	80.3	10%	0.097	38%	0.384	C	S	.	.	H	α-helix	trans	-65.7	-41.4	179.2	-64.8	114.1	0	0	0	111.8	C100 E101 I106 Q107 I108 I150 I164	C100-H104 PolarHBondContact O-CE1 2.96Å; C100-H104 PolarHBondContact O-N 3.41Å; C100-H104 PolarHBondContact O-ND1 2.94Å; E101-H104 PolarHBondContact O-N 3.33Å; H104-I106 PolarHBondContact O-N 2.88Å; H104-Q107 WeakPolarHBondContact O-CB 3.47Å; H104-Q107 PolarHBondContact O-N 3.22Å; H104-Q107 VanDerWaalsContact O-N 3.14Å; H104-I108 WeakPolarHBondContact O-CG1 3.42Å; H104-I108 PolarHBondContact O-N 3.07Å; H104-I150 HydrophobicContact CB-CG2 3.68Å; H104-I164 HydrophobicContact CB-CD1 3.83Å
105	L	88	Confident	73.5	Confident	13 Å²	13	73.5 Å²	73.5	7%	0.068	35%	0.348	C	S	.	.	H	α-helix	trans	-60.1	-43.2	175.4	-71.9	178.6	0	0	0	112.4	W97 E101 R102 Q107 I108 L109 I164 W167	W97-L105 HydrophobicContact CE3-CD1 4.44Å; W97-L105 HydrophobicContact CZ3-CD1 4.06Å; E101-L105 WeakPolarHBondContact O-CG 3.37Å; E101-L105 PolarHBondContact O-N 3.09Å; R102-L105 PolarHBondContact O-N 3.14Å; L105-Q107 VanDerWaalsContact C-N 3.29Å; L105-Q107 PolarHBondContact O-N 3.15Å; L105-I108 PolarHBondContact O-N 2.95Å; L105-L109 WeakPolarHBondContact O-CB 3.49Å; L105-L109 WeakPolarHBondContact O-CG 3.26Å; L105-L109 PolarHBondContact O-N 3.19Å; L105-I164 HydrophobicContact CD2-CG1 4.42Å; L105-I164 HydrophobicContact CD2-CG2 4.05Å; L105-W167 HydrophobicContact CD1-CD2 3.7Å; L105-W167 HydrophobicContact CD1-CE3 4.07Å; L105-W167 HydrophobicContact CD1-CG 3.95Å; L105-W167 HydrophobicContact CD1-CZ2 4.42Å; L105-W167 HydrophobicContact CD2-CB 4.37Å; L105-W167 HydrophobicContact CD2-CD2 3.75Å; L105-W167 HydrophobicContact CD2-CE3 3.32Å; L105-W167 HydrophobicContact CD2-CG 4.2Å; L105-W167 HydrophobicContact CD2-CZ3 3.9Å; L105-W167 HydrophobicContact CG-CD2 4.34Å; L105-W167 HydrophobicContact CG-CE3 4.22Å
106	I	86.1	Confident	75.6	Confident	89 Å²	89	67.4 Å²	67.4	46%	0.456	33%	0.326	S	S	.	.	H	α-helix	trans	-61.3	-39.9	175.6	-67.9	165.5	0	0	0	110.9	R102 R103 H104 L109 S110	R102-I106 HydrophobicContact CG-CD1 4.18Å; R102-I106 VanDerWaalsContact O-CG1 3.31Å; R102-I106 WeakPolarHBondContact O-CG1 3.34Å; R102-I106 PolarHBondContact O-N 3.12Å; R103-I106 PolarHBondContact O-N 3.34Å; H104-I106 PolarHBondContact O-N 2.88Å; I106-L109 PolarHBondContact O-N 3.21Å; I106-S110 WeakPolarHBondContact O-CB 3.3Å; I106-S110 PolarHBondContact O-N 2.85Å
107	Q	87.7	Confident	77.7	Confident	68 Å²	68	70.4 Å²	70.4	32%	0.318	32%	0.324	S	S	.	.	H	α-helix	trans	-66.5	-40.6	176.6	-70.9	174.2	-10.9	0	0	112.3	R103 H104 L105 S110 S111 I150	R103-Q107 WeakPolarHBondContact O-CG 3.31Å; R103-Q107 PolarHBondContact O-N 3.34Å; R103-Q107 VanDerWaalsContact O-N 3.13Å; H104-Q107 WeakPolarHBondContact O-CB 3.47Å; H104-Q107 PolarHBondContact O-N 3.22Å; H104-Q107 VanDerWaalsContact O-N 3.14Å; L105-Q107 VanDerWaalsContact C-N 3.29Å; L105-Q107 PolarHBondContact O-N 3.15Å; Q107-S110 PolarHBondContact O-N 3.21Å; Q107-S111 WeakPolarHBondContact O-CB 3.41Å; Q107-S111 PolarHBondContact O-N 2.94Å; Q107-S111 PolarHBondContact O-OG 3.15Å; Q107-I150 HydrophobicContact CB-CD1 3.83Å
108	I	88.1	Confident	78.6	Confident	7 Å²	7	66.9 Å²	66.9	4%	0.036	31%	0.313	C	S	.	.	H	α-helix	trans	-60.8	-52.3	173.8	-66.4	170.5	0	0	0	109.7	H104 L105 S110 S111 L112 L147 I150 I164 Y180	H104-I108 WeakPolarHBondContact O-CG1 3.42Å; H104-I108 PolarHBondContact O-N 3.07Å; L105-I108 PolarHBondContact O-N 2.95Å; I108-S110 VanDerWaalsContact C-N 3.32Å; I108-S110 PolarHBondContact O-N 3.16Å; I108-S111 WeakPolarHBondContact O-CA 3.14Å; I108-S111 WeakPolarHBondContact O-CB 3.34Å; I108-S111 PolarHBondContact O-N 3.17Å; I108-L112 HydrophobicContact CG2-CD1 3.82Å; I108-L112 HydrophobicContact CG2-CG 4.17Å; I108-L112 WeakPolarHBondContact O-CG 3.3Å; I108-L112 PolarHBondContact O-N 2.61Å; I108-L147 HydrophobicContact CD1-CD1 3.78Å; I108-L147 HydrophobicContact CG1-CD1 4.15Å; I108-I150 HydrophobicContact CD1-CD1 4.23Å; I108-I150 HydrophobicContact CG1-CD1 3.46Å; I108-I150 VanDerWaalsContact CG1-CD1 3.46Å; I108-I164 HydrophobicContact CD1-CG2 3.39Å; I108-Y180 HydrophobicContact CG2-CD2 4.46Å; I108-Y180 HydrophobicContact CG2-CE2 4.44Å
109	L	88.5	Confident	79.3	Confident	23 Å²	23	65 Å²	65	12%	0.12	30%	0.299	C	S	.	.	H	α-helix	trans	-58	-43.2	178.9	-72.3	172.2	0	0	0	112.2	L105 I106 S111 L112 R113 W167 L172 L176	L105-L109 WeakPolarHBondContact O-CB 3.49Å; L105-L109 WeakPolarHBondContact O-CG 3.26Å; L105-L109 PolarHBondContact O-N 3.19Å; I106-L109 PolarHBondContact O-N 3.21Å; L109-S111 VanDerWaalsContact C-N 3.28Å; L109-S111 PolarHBondContact O-N 2.96Å; L109-L112 PolarHBondContact O-N 3.28Å; L109-R113 VanDerWaalsContact O-CB 3.29Å; L109-R113 WeakPolarHBondContact O-CB 3.4Å; L109-R113 VanDerWaalsContact O-CG 3.26Å; L109-R113 WeakPolarHBondContact O-CG 3.5Å; L109-R113 PolarHBondContact O-N 3.2Å; L109-W167 HydrophobicContact CD1-CH2 4.04Å; L109-W167 HydrophobicContact CD1-CZ3 4.47Å; L109-W167 HydrophobicContact CD2-CH2 4.44Å; L109-W167 HydrophobicContact CD2-CZ3 4.39Å; L109-W167 HydrophobicContact CG-CH2 4.48Å; L109-W167 HydrophobicContact CG-CZ3 4.47Å; L109-L172 HydrophobicContact CD2-CD2 3.46Å; L109-L172 VanDerWaalsContact CD2-CD2 3.46Å; L109-L176 HydrophobicContact CD2-CD1 4.29Å
110	S	88.3	Confident	79.8	Confident	52 Å²	52	65.6 Å²	65.6	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-61.5	-39.2	175.2	-174.4	0	0	0	0	111.5	I106 Q107 I108 K114	I106-S110 WeakPolarHBondContact O-CB 3.3Å; I106-S110 PolarHBondContact O-N 2.85Å; Q107-S110 PolarHBondContact O-N 3.21Å; I108-S110 VanDerWaalsContact C-N 3.32Å; I108-S110 PolarHBondContact O-N 3.16Å; S110-K114 WeakPolarHBondContact O-CB 3.46Å; S110-K114 WeakPolarHBondContact O-CG 3.1Å; S110-K114 PolarHBondContact O-N 2.79Å
111	S	88.2	Confident	79.7	Confident	21 Å²	21	69.3 Å²	69.3	15%	0.147	30%	0.302	C	S	.	.	H	α-helix	trans	-69.2	-44.2	179.5	-57.6	0	0	0	0	111.7	Q107 I108 L109 K114 V115	Q107-S111 WeakPolarHBondContact O-CB 3.41Å; Q107-S111 PolarHBondContact O-N 2.94Å; Q107-S111 PolarHBondContact O-OG 3.15Å; I108-S111 WeakPolarHBondContact O-CA 3.14Å; I108-S111 WeakPolarHBondContact O-CB 3.34Å; I108-S111 PolarHBondContact O-N 3.17Å; L109-S111 VanDerWaalsContact C-N 3.28Å; L109-S111 PolarHBondContact O-N 2.96Å; S111-K114 WeakPolarHBondContact O-CB 3.28Å; S111-K114 PolarHBondContact O-N 3.27Å; S111-V115 PolarHBondContact O-N 2.87Å
112	L	88.5	Confident	78.8	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-67.4	-43.7	177.1	-62.5	176.4	0	0	0	111.8	I108 L109 K114 V115 L116 L172 L176 I179 Y180 V183	I108-L112 HydrophobicContact CG2-CD1 3.82Å; I108-L112 HydrophobicContact CG2-CG 4.17Å; I108-L112 WeakPolarHBondContact O-CG 3.3Å; I108-L112 PolarHBondContact O-N 2.61Å; L109-L112 PolarHBondContact O-N 3.28Å; L112-K114 VanDerWaalsContact C-N 3.25Å; L112-K114 PolarHBondContact O-N 3.42Å; L112-V115 WeakPolarHBondContact O-CA 3.16Å; L112-V115 WeakPolarHBondContact O-CB 3.45Å; L112-V115 PolarHBondContact O-N 3.43Å; L112-L116 PolarHBondContact O-N 3.45Å; L112-L172 HydrophobicContact CD1-CD1 3.76Å; L112-L172 HydrophobicContact CD1-CD2 4Å; L112-L176 HydrophobicContact CB-CD2 4.16Å; L112-I179 HydrophobicContact CD2-CB 4.49Å; L112-I179 HydrophobicContact CD2-CG2 3.84Å; L112-Y180 HydrophobicContact CD1-CD2 4.09Å; L112-Y180 HydrophobicContact CD1-CG 4.5Å; L112-Y180 HydrophobicContact CD2-CD2 4.43Å; L112-V183 HydrophobicContact CD2-CG2 4.19Å
113	R	87.1	Confident	77.5	Confident	104 Å²	104	68.7 Å²	68.7	39%	0.392	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-31.7	175.3	-74.4	177.8	-177	161	1	112.6	L109 V115 L116 R117 L176	L109-R113 VanDerWaalsContact O-CB 3.29Å; L109-R113 WeakPolarHBondContact O-CB 3.4Å; L109-R113 VanDerWaalsContact O-CG 3.26Å; L109-R113 WeakPolarHBondContact O-CG 3.5Å; L109-R113 PolarHBondContact O-N 3.2Å; R113-V115 VanDerWaalsContact C-N 3.33Å; R113-L116 PolarHBondContact O-N 3.22Å; R113-R117 WeakPolarHBondContact O-CB 3.27Å; R113-R117 WeakPolarHBondContact O-CG 3.32Å; R113-R117 PolarHBondContact O-N 3.29Å; R113-L176 HydrophobicContact CG-CD1 4.29Å
114	K	84.6	Confident	75.8	Confident	126 Å²	126	65 Å²	65	55%	0.548	31%	0.313	S	S	.	.	H	α-helix	trans	-65.4	-37	171.9	-77.4	169.1	-176.3	174.8	0	111.7	S110 S111 L112 N118	S110-K114 WeakPolarHBondContact O-CB 3.46Å; S110-K114 WeakPolarHBondContact O-CG 3.1Å; S110-K114 PolarHBondContact O-N 2.79Å; S111-K114 WeakPolarHBondContact O-CB 3.28Å; S111-K114 PolarHBondContact O-N 3.27Å; L112-K114 VanDerWaalsContact C-N 3.25Å; L112-K114 PolarHBondContact O-N 3.42Å; K114-N118 WeakPolarHBondContact O-CB 3.34Å; K114-N118 PolarHBondContact O-N 3Å; K114-N118 PolarHBondContact O-ND2 3.35Å; K114-N118 PolarHBondContact O-OD1 3.47Å
115	V	81.8	Confident	74	Confident	3 Å²	3	70 Å²	70	2%	0.018	34%	0.336	C	S	.	.	H	α-helix	trans	-65.4	-48.8	173.1	-175.6	0	0	0	0	110	S111 L112 R113 R117 N118 E119 L140 A143 I179	S111-V115 PolarHBondContact O-N 2.87Å; L112-V115 WeakPolarHBondContact O-CA 3.16Å; L112-V115 WeakPolarHBondContact O-CB 3.45Å; L112-V115 PolarHBondContact O-N 3.43Å; R113-V115 VanDerWaalsContact C-N 3.33Å; V115-R117 PolarHBondContact O-N 3.48Å; V115-N118 WeakPolarHBondContact O-CB 3.38Å; V115-N118 PolarHBondContact O-N 3.08Å; V115-N118 VanDerWaalsContact O-N 3.14Å; V115-E119 PolarHBondContact O-N 2.86Å; V115-E119 VanDerWaalsContact O-N 3.1Å; V115-L140 HydrophobicContact CG1-CD2 3.98Å; V115-L140 HydrophobicContact CG1-CG 4.22Å; V115-A143 HydrophobicContact CG2-CB 3.85Å; V115-I179 HydrophobicContact CB-CG2 3.83Å; V115-I179 HydrophobicContact CG1-CD1 4.43Å; V115-I179 HydrophobicContact CG1-CG2 3.78Å; V115-I179 HydrophobicContact CG2-CG2 4.22Å
116	L	82.8	Confident	72.1	Confident	32 Å²	32	71.6 Å²	71.6	17%	0.168	34%	0.343	C	S	.	.	H	α-helix	trans	-60.2	-46.9	180	-170.7	72.6	0	0	0	112.3	L112 R113 N118 E119 Y120 L176 I179	L112-L116 PolarHBondContact O-N 3.45Å; R113-L116 PolarHBondContact O-N 3.22Å; L116-N118 PolarHBondContact O-N 2.94Å; L116-E119 WeakPolarHBondContact O-CB 3.06Å; L116-E119 PolarHBondContact O-N 3.46Å; L116-Y120 HydrophobicContact CD1-CD2 4.4Å; L116-Y120 HydrophobicContact CD1-CE2 3.73Å; L116-Y120 HydrophobicContact CD2-CE2 4.23Å; L116-Y120 HydrophobicContact CG-CD2 4.06Å; L116-Y120 HydrophobicContact CG-CE2 3.69Å; L116-Y120 VanDerWaalsContact O-CD2 3.26Å; L116-Y120 WeakPolarHBondContact O-CD2 3.12Å; L116-Y120 PolarHBondContact O-N 2.95Å; L116-L176 HydrophobicContact CB-CD2 4.13Å; L116-L176 HydrophobicContact CD2-CD2 3.88Å; L116-L176 HydrophobicContact CG-CD2 4.47Å; L116-I179 HydrophobicContact CB-CD1 3.88Å; L116-I179 HydrophobicContact CD1-CD1 3.72Å; L116-I179 HydrophobicContact CG-CD1 4.41Å
117	R	76.5	Confident	70.5	Confident	187 Å²	187	77.1 Å²	77.1	71%	0.706	37%	0.366	S	S	*	.	H	α-helix	trans	-59.2	-36.6	176	-78.8	-176.9	179.9	-176.8	-1	112.2	R113 V115 E119 Y120 F121	R113-R117 WeakPolarHBondContact O-CB 3.27Å; R113-R117 WeakPolarHBondContact O-CG 3.32Å; R113-R117 PolarHBondContact O-N 3.29Å; V115-R117 PolarHBondContact O-N 3.48Å; R117-E119 VanDerWaalsContact C-N 3.32Å; R117-Y120 PolarHBondContact O-N 3.25Å; R117-F121 VanDerWaalsContact O-CB 3.26Å; R117-F121 WeakPolarHBondContact O-CB 3.41Å; R117-F121 PolarHBondContact O-N 2.78Å
118	N	66.7	Low	69.3	Low	40 Å²	40	77.2 Å²	77.2	21%	0.214	37%	0.369	C	S	.	.	H	α-helix	trans	-67	-35.8	176.3	-68.4	-12.5	0	0	0	111	K114 V115 L116 Y122 S139	K114-N118 WeakPolarHBondContact O-CB 3.34Å; K114-N118 PolarHBondContact O-N 3Å; K114-N118 PolarHBondContact O-ND2 3.35Å; K114-N118 PolarHBondContact O-OD1 3.47Å; V115-N118 WeakPolarHBondContact O-CB 3.38Å; V115-N118 PolarHBondContact O-N 3.08Å; V115-N118 VanDerWaalsContact O-N 3.14Å; L116-N118 PolarHBondContact O-N 2.94Å; N118-Y122 HydrophobicContact CB-CD2 3.8Å; N118-Y122 HydrophobicContact CB-CE2 3.74Å; N118-Y122 WeakPolarHBondContact O-CB 3.41Å; N118-Y122 WeakPolarHBondContact O-CD2 3.28Å; N118-Y122 PolarHBondContact O-N 2.97Å; N118-S139 PolarHBondContact ND2-OG 3.27Å
119	E	63.7	Low	68.1	Low	51 Å²	51	82.9 Å²	82.9	24%	0.238	40%	0.398	C	S	.	.	H	α-helix	trans	-61.5	-46.5	174	-66.2	-170.6	146.3	0	0	111.5	V115 L116 R117 S123 K136	V115-E119 PolarHBondContact O-N 2.86Å; V115-E119 VanDerWaalsContact O-N 3.1Å; L116-E119 WeakPolarHBondContact O-CB 3.06Å; L116-E119 PolarHBondContact O-N 3.46Å; R117-E119 VanDerWaalsContact C-N 3.32Å; E119-S123 PolarHBondContact O-N 3.18Å; E119-S123 PolarHBondContact O-OG 2.99Å; E119-K136 VanDerWaalsContact OE1-CD 3.26Å; E119-K136 WeakPolarHBondContact OE1-CD 3.5Å; E119-K136 WeakPolarHBondContact OE1-CE 3.38Å; E119-K136 IonicContact OE1-NZ 3.74Å; E119-K136 PolarHBondContact OE1-NZ 2.97Å
120	Y	57.5	Low	66.8	Low	160 Å²	160	87 Å²	87	63%	0.627	42%	0.42	S	S	*	.	H	α-helix	trans	-71.7	-42.5	-179.2	-71.9	-72.7	0	0	0	114	L116 R117 Y122	L116-Y120 HydrophobicContact CD1-CD2 4.4Å; L116-Y120 HydrophobicContact CD1-CE2 3.73Å; L116-Y120 HydrophobicContact CD2-CE2 4.23Å; L116-Y120 HydrophobicContact CG-CD2 4.06Å; L116-Y120 HydrophobicContact CG-CE2 3.69Å; L116-Y120 VanDerWaalsContact O-CD2 3.26Å; L116-Y120 WeakPolarHBondContact O-CD2 3.12Å; L116-Y120 PolarHBondContact O-N 2.95Å; R117-Y120 PolarHBondContact O-N 3.25Å; Y120-Y122 VanDerWaalsContact C-N 3.34Å; Y120-Y122 PolarHBondContact O-N 2.68Å
121	F	49.3	Very low	65.5	Low	129 Å²	129	89.5 Å²	89.5	57%	0.566	42%	0.422	S	S	*	.	H	α-helix	trans	-73.2	-27	-174.1	-151.1	-89.4	0	0	0	112.9	R117 S124	R117-F121 VanDerWaalsContact O-CB 3.26Å; R117-F121 WeakPolarHBondContact O-CB 3.41Å; R117-F121 PolarHBondContact O-N 2.78Å; F121-S124 PolarHBondContact O-OG 3.34Å; F121-S124 VanDerWaalsContact O-OG 3.13Å
122	Y	52.8	Low	64.4	Low	58 Å²	58	90.8 Å²	90.8	23%	0.227	43%	0.427	C	S	.	.	H	α-helix	trans	-98	-13.8	-175.8	-64.5	-51.9	0	0	0	113.9	N118 Y120 S124 Q125 F126	N118-Y122 HydrophobicContact CB-CD2 3.8Å; N118-Y122 HydrophobicContact CB-CE2 3.74Å; N118-Y122 WeakPolarHBondContact O-CB 3.41Å; N118-Y122 WeakPolarHBondContact O-CD2 3.28Å; N118-Y122 PolarHBondContact O-N 2.97Å; Y120-Y122 VanDerWaalsContact C-N 3.34Å; Y120-Y122 PolarHBondContact O-N 2.68Å; Y122-S124 PolarHBondContact O-N 2.83Å; Y122-Q125 PolarHBondContact O-N 3.47Å; Y122-F126 AromaticContact CD1-CD2 3.97Å; Y122-F126 HydrophobicContact CD1-CD2 3.97Å; Y122-F126 AromaticContact CD1-CE2 3.41Å; Y122-F126 HydrophobicContact CD1-CE2 3.41Å; Y122-F126 VanDerWaalsContact CD1-CE2 3.41Å; Y122-F126 HydrophobicContact CE1-CE2 4.09Å; Y122-F126 HydrophobicContact CG-CD2 4.22Å; Y122-F126 AromaticContact CG-CE2 3.93Å; Y122-F126 HydrophobicContact CG-CE2 3.93Å; Y122-F126 PolarHBondContact O-N 3.39Å
123	S	50.7	Low	63.4	Low	82 Å²	82	95 Å²	95	57%	0.573	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.1	169.2	-61.3	0	0	0	0	112.6	E119	E119-S123 PolarHBondContact O-N 3.18Å; E119-S123 PolarHBondContact O-OG 2.99Å
124	S	48.1	Very low	62.6	Low	96 Å²	96	91 Å²	91	67%	0.671	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-15.1	-178.4	58.9	0	0	0	0	115.3	F121 Y122	F121-S124 PolarHBondContact O-OG 3.34Å; F121-S124 VanDerWaalsContact O-OG 3.13Å; Y122-S124 PolarHBondContact O-N 2.83Å
125	Q	49.6	Very low	61.8	Low	126 Å²	126	86.5 Å²	86.5	59%	0.589	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	-7.6	-172.5	-67.9	-173	-2.9	0	0	114.6	Y122	Y122-Q125 PolarHBondContact O-N 3.47Å
126	F	48.7	Very low	61.6	Low	48 Å²	48	90.7 Å²	90.7	21%	0.211	43%	0.433	C	S	.	.			trans	-116.3	114.7	-180	-72.6	-73.7	0	0	0	111.9	Y122 D128 R131 Y135	Y122-F126 AromaticContact CD1-CD2 3.97Å; Y122-F126 HydrophobicContact CD1-CD2 3.97Å; Y122-F126 AromaticContact CD1-CE2 3.41Å; Y122-F126 HydrophobicContact CD1-CE2 3.41Å; Y122-F126 VanDerWaalsContact CD1-CE2 3.41Å; Y122-F126 HydrophobicContact CE1-CE2 4.09Å; Y122-F126 HydrophobicContact CG-CD2 4.22Å; Y122-F126 AromaticContact CG-CE2 3.93Å; Y122-F126 HydrophobicContact CG-CE2 3.93Å; Y122-F126 PolarHBondContact O-N 3.39Å; F126-D128 PolarHBondContact O-N 3.07Å; F126-R131 HydrophobicContact CD1-CB 3.94Å; F126-R131 HydrophobicContact CD1-CG 4.47Å; F126-R131 HydrophobicContact CE1-CB 4.33Å; F126-R131 HydrophobicContact CG-CB 4.38Å; F126-Y135 HydrophobicContact CE1-CE2 4.05Å; F126-Y135 HydrophobicContact CE2-CD2 4.15Å; F126-Y135 AromaticContact CE2-CE2 3.66Å; F126-Y135 HydrophobicContact CE2-CE2 3.66Å; F126-Y135 HydrophobicContact CZ-CD2 4.3Å; F126-Y135 AromaticContact CZ-CE2 3.4Å; F126-Y135 HydrophobicContact CZ-CE2 3.4Å; F126-Y135 AromaticContact CZ-CZ 3.75Å; F126-Y135 WeakPolarHBondContact CZ-OH 3.42Å
127	H	52.4	Low	61.5	Low	205 Å²	205	94.4 Å²	94.4	95%	0.949	45%	0.45	S	S	*	.	S	Bend	trans	-72	-12.1	165.4	-70.3	-60.6	0	0	0	113.2
128	D	61.2	Low	61.8	Low	69 Å²	69	87.3 Å²	87.3	37%	0.369	43%	0.426	S	S	.	.			trans	-104.4	103.1	-177.2	-173	0.5	0	0	0	111.1	F126 N130 R131 L132	F126-D128 PolarHBondContact O-N 3.07Å; D128-N130 PolarHBondContact O-N 3.35Å; D128-N130 VanDerWaalsContact O-N 3.14Å; D128-N130 VanDerWaalsContact OD1-CB 3.27Å; D128-N130 WeakPolarHBondContact OD1-CB 3.34Å; D128-N130 PolarHBondContact OD1-N 2.98Å; D128-N130 PolarHBondContact OD1-ND2 2.92Å; D128-R131 HydrophobicContact CB-CB 4.26Å; D128-R131 HydrophobicContact CB-CG 4.27Å; D128-R131 WeakPolarHBondContact O-CB 3.45Å; D128-R131 PolarHBondContact O-N 3.15Å; D128-L132 PolarHBondContact O-N 3.11Å
129	I	63.3	Low	62.6	Low	126 Å²	126	85.7 Å²	85.7	65%	0.646	42%	0.417	S	S	*	.	H	α-helix	trans	-52.3	-34.2	176	-65	170.5	0	0	0	111.1	R131 L132 N133	I129-R131 PolarHBondContact O-N 3.09Å; I129-L132 PolarHBondContact O-N 3.26Å; I129-N133 PolarHBondContact O-N 2.75Å; I129-N133 VanDerWaalsContact O-N 3.11Å
130	N	62.2	Low	63.8	Low	111 Å²	111	84.1 Å²	84.1	59%	0.594	41%	0.411	S	S	*	.	H	α-helix	trans	-65	-43.1	179.1	-64.2	-54.9	0	0	0	110.9	D128 L132 N133 I134	D128-N130 PolarHBondContact O-N 3.35Å; D128-N130 VanDerWaalsContact O-N 3.14Å; D128-N130 VanDerWaalsContact OD1-CB 3.27Å; D128-N130 WeakPolarHBondContact OD1-CB 3.34Å; D128-N130 PolarHBondContact OD1-N 2.98Å; D128-N130 PolarHBondContact OD1-ND2 2.92Å; N130-L132 VanDerWaalsContact C-N 3.34Å; N130-L132 PolarHBondContact O-N 2.98Å; N130-N133 PolarHBondContact O-N 3.06Å; N130-I134 WeakPolarHBondContact O-CD1 3.22Å; N130-I134 WeakPolarHBondContact O-CG1 3.48Å; N130-I134 PolarHBondContact O-N 3.14Å
131	R	61.1	Low	65.2	Low	103 Å²	103	79.4 Å²	79.4	39%	0.389	39%	0.394	S	S	.	.	H	α-helix	trans	-58.7	-45.4	174.8	-80.2	-175.9	165.6	-179	-2.2	111.3	F126 D128 I129 N133 I134 Y135	F126-R131 HydrophobicContact CD1-CB 3.94Å; F126-R131 HydrophobicContact CD1-CG 4.47Å; F126-R131 HydrophobicContact CE1-CB 4.33Å; F126-R131 HydrophobicContact CG-CB 4.38Å; D128-R131 HydrophobicContact CB-CB 4.26Å; D128-R131 HydrophobicContact CB-CG 4.27Å; D128-R131 WeakPolarHBondContact O-CB 3.45Å; D128-R131 PolarHBondContact O-N 3.15Å; I129-R131 PolarHBondContact O-N 3.09Å; R131-N133 PolarHBondContact O-N 3.3Å; R131-I134 WeakPolarHBondContact O-CB 3.47Å; R131-I134 PolarHBondContact O-N 3.23Å; R131-Y135 HydrophobicContact CB-CE2 4.48Å; R131-Y135 WeakPolarHBondContact O-CD2 3.44Å; R131-Y135 PolarHBondContact O-N 3.37Å; R131-Y135 VanDerWaalsContact O-N 3.12Å
132	L	63.9	Low	67	Low	49 Å²	49	78.3 Å²	78.3	26%	0.257	39%	0.386	S	S	.	.	H	α-helix	trans	-58.5	-46.9	179.2	-172.9	65.7	0	0	0	112.1	D128 I129 N130 I134 Y135 K136	D128-L132 PolarHBondContact O-N 3.11Å; I129-L132 PolarHBondContact O-N 3.26Å; N130-L132 VanDerWaalsContact C-N 3.34Å; N130-L132 PolarHBondContact O-N 2.98Å; L132-I134 VanDerWaalsContact C-N 3.26Å; L132-I134 PolarHBondContact O-N 3.49Å; L132-Y135 PolarHBondContact O-N 3.18Å; L132-K136 PolarHBondContact O-N 3.33Å
133	N	68.2	Low	68.7	Low	91 Å²	91	75.8 Å²	75.8	49%	0.487	38%	0.377	S	S	.	.	H	α-helix	trans	-58.6	-39	178.8	-75.5	-22.1	0	0	0	112.5	I129 N130 R131 K136 E137	I129-N133 PolarHBondContact O-N 2.75Å; I129-N133 VanDerWaalsContact O-N 3.11Å; N130-N133 PolarHBondContact O-N 3.06Å; R131-N133 PolarHBondContact O-N 3.3Å; N133-K136 PolarHBondContact O-N 3.01Å; N133-E137 WeakPolarHBondContact O-CB 3.47Å; N133-E137 PolarHBondContact O-N 2.75Å
134	I	69.1	Low	70.7	Confident	19 Å²	19	71.9 Å²	71.9	10%	0.097	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-46.8	178.2	-67.5	160.5	0	0	0	112	N130 R131 L132 K136 E137 L138 R512	N130-I134 WeakPolarHBondContact O-CD1 3.22Å; N130-I134 WeakPolarHBondContact O-CG1 3.48Å; N130-I134 PolarHBondContact O-N 3.14Å; R131-I134 WeakPolarHBondContact O-CB 3.47Å; R131-I134 PolarHBondContact O-N 3.23Å; L132-I134 VanDerWaalsContact C-N 3.26Å; L132-I134 PolarHBondContact O-N 3.49Å; I134-K136 VanDerWaalsContact C-N 3.28Å; I134-E137 PolarHBondContact O-N 3.39Å; I134-L138 HydrophobicContact CG2-CD1 3.97Å; I134-L138 WeakPolarHBondContact O-CB 3.38Å; I134-L138 WeakPolarHBondContact O-CG 3.38Å; I134-L138 PolarHBondContact O-N 2.92Å; I134-R512 VanDerWaalsContact CD1-NE 3.29Å; I134-R512 VanDerWaalsContact CD1-NH1 3.27Å; I134-R512 VanDerWaalsContact CG1-NH1 3.27Å
135	Y	68.6	Low	72.6	Confident	32 Å²	32	70.5 Å²	70.5	13%	0.125	34%	0.335	C	S	.	.	H	α-helix	trans	-64.9	-39	179.7	-81.2	-78.2	0	0	0	111.2	F126 R131 L132 L138 S139 C507	F126-Y135 HydrophobicContact CE1-CE2 4.05Å; F126-Y135 HydrophobicContact CE2-CD2 4.15Å; F126-Y135 AromaticContact CE2-CE2 3.66Å; F126-Y135 HydrophobicContact CE2-CE2 3.66Å; F126-Y135 HydrophobicContact CZ-CD2 4.3Å; F126-Y135 AromaticContact CZ-CE2 3.4Å; F126-Y135 HydrophobicContact CZ-CE2 3.4Å; F126-Y135 AromaticContact CZ-CZ 3.75Å; F126-Y135 WeakPolarHBondContact CZ-OH 3.42Å; R131-Y135 HydrophobicContact CB-CE2 4.48Å; R131-Y135 WeakPolarHBondContact O-CD2 3.44Å; R131-Y135 PolarHBondContact O-N 3.37Å; R131-Y135 VanDerWaalsContact O-N 3.12Å; L132-Y135 PolarHBondContact O-N 3.18Å; Y135-L138 PolarHBondContact O-N 2.83Å; Y135-S139 VanDerWaalsContact O-CB 3.27Å; Y135-S139 WeakPolarHBondContact O-CB 3.47Å; Y135-S139 PolarHBondContact O-N 3.25Å; Y135-S139 PolarHBondContact O-OG 3.48Å; Y135-C507 HydrophobicContact CE1-CB 3.38Å; Y135-C507 WeakPolarHBondContact CE1-SG 3.33Å; Y135-C507 HydrophobicContact CE2-CB 4.19Å; Y135-C507 WeakPolarHBondContact OH-CB 3.18Å; Y135-C507 PolarHBondContact OH-SG 3.41Å
136	K	77.4	Confident	74.5	Confident	91 Å²	91	66.1 Å²	66.1	40%	0.396	32%	0.319	S	S	.	.	H	α-helix	trans	-59.8	-51.7	174.2	-179	169.5	173.2	152.8	0	110.7	E119 L132 N133 I134 L138 S139 L140	E119-K136 VanDerWaalsContact OE1-CD 3.26Å; E119-K136 WeakPolarHBondContact OE1-CD 3.5Å; E119-K136 WeakPolarHBondContact OE1-CE 3.38Å; E119-K136 IonicContact OE1-NZ 3.74Å; E119-K136 PolarHBondContact OE1-NZ 2.97Å; L132-K136 PolarHBondContact O-N 3.33Å; N133-K136 PolarHBondContact O-N 3.01Å; I134-K136 VanDerWaalsContact C-N 3.28Å; K136-L138 PolarHBondContact O-N 3.39Å; K136-S139 PolarHBondContact O-N 3.27Å; K136-S139 VanDerWaalsContact O-N 3.16Å; K136-L140 HydrophobicContact CG-CD1 4.14Å; K136-L140 WeakPolarHBondContact O-CG 3.42Å; K136-L140 PolarHBondContact O-N 3.37Å
137	E	81.6	Confident	76.6	Confident	109 Å²	109	64 Å²	64	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-57.7	-45.5	177.5	-167.2	-168.8	166.6	0	0	112.2	N133 I134 S139 L140 H141	N133-E137 WeakPolarHBondContact O-CB 3.47Å; N133-E137 PolarHBondContact O-N 2.75Å; I134-E137 PolarHBondContact O-N 3.39Å; E137-S139 PolarHBondContact O-N 3.04Å; E137-L140 PolarHBondContact O-N 3.01Å; E137-H141 PolarHBondContact O-CD2 3.34Å; E137-H141 VanDerWaalsContact O-CD2 3.3Å; E137-H141 PolarHBondContact O-N 3.08Å; E137-H141 IonicContact OE1-NE2 3.77Å
138	L	81.4	Confident	78.4	Confident	39 Å²	39	57.6 Å²	57.6	20%	0.204	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-38.8	177.1	-77.6	171.7	0	0	0	112.9	I134 Y135 K136 H141 R142 T509	I134-L138 HydrophobicContact CG2-CD1 3.97Å; I134-L138 WeakPolarHBondContact O-CB 3.38Å; I134-L138 WeakPolarHBondContact O-CG 3.38Å; I134-L138 PolarHBondContact O-N 2.92Å; Y135-L138 PolarHBondContact O-N 2.83Å; K136-L138 PolarHBondContact O-N 3.39Å; L138-H141 PolarHBondContact O-N 3.34Å; L138-R142 WeakPolarHBondContact O-CG 2.97Å; L138-R142 PolarHBondContact O-N 3.21Å; L138-R142 VanDerWaalsContact O-N 3.11Å; L138-T509 HydrophobicContact CD1-CG2 4.05Å; L138-T509 HydrophobicContact CD2-CG2 3.9Å; L138-T509 HydrophobicContact CG-CG2 4.26Å
139	S	83.7	Confident	79.7	Confident	6 Å²	6	62.8 Å²	62.8	4%	0.042	29%	0.291	C	S	.	.	H	α-helix	trans	-67.3	-43.8	178.6	-60.6	0	0	0	0	110.5	N118 Y135 K136 E137 H141 R142 A143	N118-S139 PolarHBondContact ND2-OG 3.27Å; Y135-S139 VanDerWaalsContact O-CB 3.27Å; Y135-S139 WeakPolarHBondContact O-CB 3.47Å; Y135-S139 PolarHBondContact O-N 3.25Å; Y135-S139 PolarHBondContact O-OG 3.48Å; K136-S139 PolarHBondContact O-N 3.27Å; K136-S139 VanDerWaalsContact O-N 3.16Å; E137-S139 PolarHBondContact O-N 3.04Å; S139-H141 PolarHBondContact O-N 3.2Å; S139-R142 PolarHBondContact O-N 3.39Å; S139-A143 PolarHBondContact O-N 3.02Å
140	L	88.6	Confident	80.9	Confident	18 Å²	18	57 Å²	57	9%	0.094	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-44.8	173.7	-71.9	170	0	0	0	111.8	V115 K136 E137 R142 A143 A144 I179 V183 I186	V115-L140 HydrophobicContact CG1-CD2 3.98Å; V115-L140 HydrophobicContact CG1-CG 4.22Å; K136-L140 HydrophobicContact CG-CD1 4.14Å; K136-L140 WeakPolarHBondContact O-CG 3.42Å; K136-L140 PolarHBondContact O-N 3.37Å; E137-L140 PolarHBondContact O-N 3.01Å; L140-R142 VanDerWaalsContact C-N 3.3Å; L140-R142 PolarHBondContact O-N 3.15Å; L140-A143 PolarHBondContact O-N 3.49Å; L140-A144 WeakPolarHBondContact O-CB 3.11Å; L140-A144 PolarHBondContact O-N 3.43Å; L140-I179 HydrophobicContact CD2-CG2 3.9Å; L140-V183 HydrophobicContact CD2-CG2 3.93Å; L140-I186 HydrophobicContact CB-CD1 3.52Å
141	H	87.4	Confident	82.1	Confident	61 Å²	61	51.7 Å²	51.7	28%	0.282	23%	0.233	S	C	.	.	H	α-helix	trans	-61.5	-34.1	175.5	-85.9	-56.7	0	0	0	113.8	E137 L138 S139 N145 I186	E137-H141 PolarHBondContact O-CD2 3.34Å; E137-H141 VanDerWaalsContact O-CD2 3.3Å; E137-H141 PolarHBondContact O-N 3.08Å; E137-H141 IonicContact OE1-NE2 3.77Å; L138-H141 PolarHBondContact O-N 3.34Å; S139-H141 PolarHBondContact O-N 3.2Å; H141-N145 VanDerWaalsContact O-CG 3.3Å; H141-N145 PolarHBondContact O-N 3.17Å; H141-N145 PolarHBondContact O-ND2 3.49Å; H141-I186 WeakPolarHBondContact ND1-CG2 3.47Å
142	R	86.4	Confident	83.3	Confident	106 Å²	106	48.5 Å²	48.5	40%	0.4	23%	0.229	S	C	.	.	H	α-helix	trans	-70	-42.7	175	-71.6	178	-157.1	164.1	15.2	111.6	L138 S139 L140 A144 N145 S146	L138-R142 WeakPolarHBondContact O-CG 2.97Å; L138-R142 PolarHBondContact O-N 3.21Å; L138-R142 VanDerWaalsContact O-N 3.11Å; S139-R142 PolarHBondContact O-N 3.39Å; L140-R142 VanDerWaalsContact C-N 3.3Å; L140-R142 PolarHBondContact O-N 3.15Å; R142-A144 VanDerWaalsContact C-N 3.31Å; R142-N145 PolarHBondContact O-N 3.47Å; R142-S146 WeakPolarHBondContact O-CB 3.38Å; R142-S146 PolarHBondContact O-N 3.22Å; R142-S146 PolarHBondContact O-OG 2.82Å
143	A	90.2	Very high	84.4	Confident	5 Å²	5	50.9 Å²	50.9	4%	0.041	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-40.9	174.6	0	0	0	0	0	110.9	V115 S139 L140 S146 L147 V183	V115-A143 HydrophobicContact CG2-CB 3.85Å; S139-A143 PolarHBondContact O-N 3.02Å; L140-A143 PolarHBondContact O-N 3.49Å; A143-S146 WeakPolarHBondContact O-CB 3.23Å; A143-S146 PolarHBondContact O-N 3.35Å; A143-L147 PolarHBondContact O-N 3.17Å; A143-V183 HydrophobicContact CB-CG1 4.36Å; A143-V183 HydrophobicContact CB-CG2 3.49Å; A143-V183 VanDerWaalsContact CB-CG2 3.49Å
144	A	91.4	Very high	85.2	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.8	-49.9	171.8	0	0	0	0	0	112.8	L140 R142 S146 L147 R148 V183 I186 L187	L140-A144 WeakPolarHBondContact O-CB 3.11Å; L140-A144 PolarHBondContact O-N 3.43Å; R142-A144 VanDerWaalsContact C-N 3.31Å; A144-S146 PolarHBondContact O-N 3.01Å; A144-L147 PolarHBondContact O-N 2.82Å; A144-R148 WeakPolarHBondContact O-CB 3.45Å; A144-R148 PolarHBondContact O-N 3.08Å; A144-V183 HydrophobicContact CB-CG1 4.08Å; A144-I186 HydrophobicContact CB-CB 4.11Å; A144-I186 HydrophobicContact CB-CG2 3.59Å; A144-L187 HydrophobicContact CB-CD2 3.91Å; A144-L187 HydrophobicContact CB-CG 3.87Å; A144-L187 WeakPolarHBondContact O-CD2 3.49Å
145	N	88	Confident	85.9	Confident	66 Å²	66	54.8 Å²	54.8	35%	0.353	25%	0.254	S	S	.	.	H	α-helix	trans	-63.6	-31.7	177.2	-70.7	-19.8	0	0	0	112.5	H141 R142 R149 K190	H141-N145 VanDerWaalsContact O-CG 3.3Å; H141-N145 PolarHBondContact O-N 3.17Å; H141-N145 PolarHBondContact O-ND2 3.49Å; R142-N145 PolarHBondContact O-N 3.47Å; N145-R149 WeakPolarHBondContact O-CG 3.49Å; N145-R149 PolarHBondContact O-N 3Å; N145-K190 PolarHBondContact OD1-NZ 2.95Å; N145-K190 VanDerWaalsContact OD1-NZ 3.15Å
146	S	90	Very high	86.6	Confident	35 Å²	35	57.7 Å²	57.7	25%	0.245	27%	0.265	C	S	.	.	H	α-helix	trans	-69.4	-46.1	175.9	-54.3	0	0	0	0	110.8	R142 A143 A144 R148 R149 I150	R142-S146 WeakPolarHBondContact O-CB 3.38Å; R142-S146 PolarHBondContact O-N 3.22Å; R142-S146 PolarHBondContact O-OG 2.82Å; A143-S146 WeakPolarHBondContact O-CB 3.23Å; A143-S146 PolarHBondContact O-N 3.35Å; A144-S146 PolarHBondContact O-N 3.01Å; S146-R148 VanDerWaalsContact C-N 3.31Å; S146-R148 PolarHBondContact O-N 3.21Å; S146-R149 WeakPolarHBondContact O-CB 3.26Å; S146-R149 PolarHBondContact O-N 3.5Å; S146-R149 VanDerWaalsContact O-N 3.13Å; S146-I150 WeakPolarHBondContact O-CG1 3.4Å; S146-I150 PolarHBondContact O-N 2.71Å
147	L	91.8	Very high	87	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-59.8	-41.5	173.5	-178.9	61.1	0	0	0	111.7	I108 A143 A144 R149 I150 F151 Y180 V183 F184 L187	I108-L147 HydrophobicContact CD1-CD1 3.78Å; I108-L147 HydrophobicContact CG1-CD1 4.15Å; A143-L147 PolarHBondContact O-N 3.17Å; A144-L147 PolarHBondContact O-N 2.82Å; L147-R149 VanDerWaalsContact C-N 3.34Å; L147-R149 PolarHBondContact O-N 2.79Å; L147-I150 WeakPolarHBondContact O-CB 3.46Å; L147-I150 PolarHBondContact O-N 2.71Å; L147-F151 HydrophobicContact CD1-CD1 4.42Å; L147-F151 HydrophobicContact CD1-CE1 3.88Å; L147-F151 HydrophobicContact CD1-CE2 4.21Å; L147-F151 HydrophobicContact CD1-CZ 3.76Å; L147-F151 HydrophobicContact CD2-CE2 4.47Å; L147-F151 HydrophobicContact CG-CE2 4.08Å; L147-F151 HydrophobicContact CG-CZ 4.14Å; L147-F151 PolarHBondContact O-N 3.06Å; L147-Y180 HydrophobicContact CD1-CE2 4.47Å; L147-Y180 HydrophobicContact CD2-CE2 3.91Å; L147-V183 HydrophobicContact CB-CG1 4.39Å; L147-V183 HydrophobicContact CD2-CG1 3.96Å; L147-F184 HydrophobicContact CD2-CD2 4.49Å; L147-L187 HydrophobicContact CB-CD1 4.02Å; L147-L187 HydrophobicContact CD2-CD1 3.76Å; L147-L187 HydrophobicContact CG-CD1 3.88Å
148	R	90	Very high	87.3	Confident	69 Å²	69	56.5 Å²	56.5	26%	0.26	26%	0.263	S	S	.	.	H	α-helix	trans	-59.7	-42.4	173.8	-172.9	-171.6	168.2	103.3	12.4	112.3	A144 S146 F151 A152 W156 L187 V193	A144-R148 WeakPolarHBondContact O-CB 3.45Å; A144-R148 PolarHBondContact O-N 3.08Å; S146-R148 VanDerWaalsContact C-N 3.31Å; S146-R148 PolarHBondContact O-N 3.21Å; R148-F151 PolarHBondContact O-N 3.29Å; R148-A152 WeakPolarHBondContact O-CB 3.22Å; R148-A152 PolarHBondContact O-N 3.39Å; R148-W156 HydrophobicContact CG-CH2 3.72Å; R148-W156 HydrophobicContact CG-CZ3 4.48Å; R148-L187 HydrophobicContact CB-CD1 4.47Å; R148-L187 HydrophobicContact CB-CD2 3.91Å; R148-V193 HydrophobicContact CG-CG2 4.18Å
149	R	88.9	Confident	87.5	Confident	179 Å²	179	60.9 Å²	60.9	68%	0.675	28%	0.282	S	S	*	.	H	α-helix	trans	-63.8	-44.5	177.1	-77.3	174.7	-178.2	178.4	-3.3	110.9	N145 S146 L147 F151 A152 D153	N145-R149 WeakPolarHBondContact O-CG 3.49Å; N145-R149 PolarHBondContact O-N 3Å; S146-R149 WeakPolarHBondContact O-CB 3.26Å; S146-R149 PolarHBondContact O-N 3.5Å; S146-R149 VanDerWaalsContact O-N 3.13Å; L147-R149 VanDerWaalsContact C-N 3.34Å; L147-R149 PolarHBondContact O-N 2.79Å; R149-F151 VanDerWaalsContact C-N 3.35Å; R149-F151 PolarHBondContact O-N 3.31Å; R149-A152 CarbonylContact O-C 3.49Å; R149-A152 WeakPolarHBondContact O-CA 3.48Å; R149-A152 WeakPolarHBondContact O-CB 3.33Å; R149-A152 PolarHBondContact O-N 3.1Å; R149-D153 PolarHBondContact O-N 3.27Å
150	I	88.3	Confident	87.6	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-57.5	-46.8	176	-69.6	172.4	0	0	0	111.4	H104 Q107 I108 S146 L147 A152 D153 L154 I164	H104-I150 HydrophobicContact CB-CG2 3.68Å; Q107-I150 HydrophobicContact CB-CD1 3.83Å; I108-I150 HydrophobicContact CD1-CD1 4.23Å; I108-I150 HydrophobicContact CG1-CD1 3.46Å; I108-I150 VanDerWaalsContact CG1-CD1 3.46Å; S146-I150 WeakPolarHBondContact O-CG1 3.4Å; S146-I150 PolarHBondContact O-N 2.71Å; L147-I150 WeakPolarHBondContact O-CB 3.46Å; L147-I150 PolarHBondContact O-N 2.71Å; I150-A152 VanDerWaalsContact C-N 3.28Å; I150-A152 PolarHBondContact O-N 3.17Å; I150-D153 PolarHBondContact O-N 3.46Å; I150-L154 HydrophobicContact CG2-CD1 4.17Å; I150-L154 VanDerWaalsContact O-CG 3.32Å; I150-L154 WeakPolarHBondContact O-CG 3.48Å; I150-L154 PolarHBondContact O-N 3.23Å; I150-I164 HydrophobicContact CG2-CD1 4.38Å
151	F	89.1	Confident	87.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.8	-33.7	174.9	-68.5	-16.5	0	0	0	112.8	L147 R148 R149 L154 W156 C161 I164 L196 L197 L200	L147-F151 HydrophobicContact CD1-CD1 4.42Å; L147-F151 HydrophobicContact CD1-CE1 3.88Å; L147-F151 HydrophobicContact CD1-CE2 4.21Å; L147-F151 HydrophobicContact CD1-CZ 3.76Å; L147-F151 HydrophobicContact CD2-CE2 4.47Å; L147-F151 HydrophobicContact CG-CE2 4.08Å; L147-F151 HydrophobicContact CG-CZ 4.14Å; L147-F151 PolarHBondContact O-N 3.06Å; R148-F151 PolarHBondContact O-N 3.29Å; R149-F151 VanDerWaalsContact C-N 3.35Å; R149-F151 PolarHBondContact O-N 3.31Å; F151-L154 PolarHBondContact O-N 3.28Å; F151-W156 HydrophobicContact CB-CE3 3.7Å; F151-W156 HydrophobicContact CB-CH2 4.49Å; F151-W156 HydrophobicContact CB-CZ3 3.61Å; F151-W156 WeakPolarHBondContact O-CA 3.48Å; F151-W156 PolarHBondContact O-N 2.75Å; F151-C161 HydrophobicContact CD1-CB 4.05Å; F151-C161 VanDerWaalsContact CD1-SG 3.58Å; F151-C161 HydrophobicContact CE1-CB 4.07Å; F151-I164 HydrophobicContact CE1-CG2 4.45Å; F151-L196 HydrophobicContact CB-CD2 4.46Å; F151-L196 HydrophobicContact CD2-CD2 4.23Å; F151-L196 HydrophobicContact CG-CD2 4.5Å; F151-L197 HydrophobicContact CE2-CD2 3.93Å; F151-L200 HydrophobicContact CE2-CD1 4.15Å; F151-L200 HydrophobicContact CZ-CD1 4.08Å
152	A	86.4	Confident	87.8	Confident	36 Å²	36	61.6 Å²	61.6	30%	0.298	28%	0.283	S	S	.	.	H	α-helix	trans	-69.5	-38.8	173.9	0	0	0	0	0	112.6	R148 R149 I150 L154 F155 W156	R148-A152 WeakPolarHBondContact O-CB 3.22Å; R148-A152 PolarHBondContact O-N 3.39Å; R149-A152 CarbonylContact O-C 3.49Å; R149-A152 WeakPolarHBondContact O-CA 3.48Å; R149-A152 WeakPolarHBondContact O-CB 3.33Å; R149-A152 PolarHBondContact O-N 3.1Å; I150-A152 VanDerWaalsContact C-N 3.28Å; I150-A152 PolarHBondContact O-N 3.17Å; A152-L154 PolarHBondContact O-N 3.41Å; A152-F155 WeakPolarHBondContact O-CA 3.25Å; A152-F155 PolarHBondContact O-N 3.22Å; A152-W156 HydrophobicContact CB-CH2 4.23Å; A152-W156 HydrophobicContact CB-CZ2 3.56Å
153	D	86.3	Confident	87.8	Confident	98 Å²	98	57.2 Å²	57.2	52%	0.524	27%	0.269	S	S	.	.	H	α-helix	trans	-66.7	-27.1	176.8	-64.5	-17.9	0	0	0	111.2	R149 I150 F155	R149-D153 PolarHBondContact O-N 3.27Å; I150-D153 PolarHBondContact O-N 3.46Å; D153-F155 PolarHBondContact O-N 3.36Å
154	L	85.3	Confident	87.8	Confident	10 Å²	10	57 Å²	57	5%	0.052	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	12.2	169.7	-64	168.1	0	0	0	113.1	I150 F151 A152 W156 H157 K160 I164	I150-L154 HydrophobicContact CG2-CD1 4.17Å; I150-L154 VanDerWaalsContact O-CG 3.32Å; I150-L154 WeakPolarHBondContact O-CG 3.48Å; I150-L154 PolarHBondContact O-N 3.23Å; F151-L154 PolarHBondContact O-N 3.28Å; A152-L154 PolarHBondContact O-N 3.41Å; L154-W156 PolarHBondContact O-N 3.17Å; L154-W156 VanDerWaalsContact O-N 3.1Å; L154-H157 VanDerWaalsContact O-CB 3.28Å; L154-H157 WeakPolarHBondContact O-CB 3.39Å; L154-H157 PolarHBondContact O-N 3.05Å; L154-K160 HydrophobicContact CD1-CB 4.41Å; L154-K160 HydrophobicContact CD2-CB 4.27Å; L154-K160 HydrophobicContact CD2-CD 4.14Å; L154-I164 HydrophobicContact CD1-CD1 3.35Å
155	F	83.3	Confident	87.9	Confident	182 Å²	182	57 Å²	57	80%	0.798	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	27.5	-177.7	-58.5	-85.4	0	0	0	113.7	A152 D153 H157	A152-F155 WeakPolarHBondContact O-CA 3.25Å; A152-F155 PolarHBondContact O-N 3.22Å; D153-F155 PolarHBondContact O-N 3.36Å; F155-H157 PolarHBondContact O-N 3.06Å; F155-H157 VanDerWaalsContact O-N 3.16Å
156	W	83.7	Confident	88	Confident	94 Å²	94	55.1 Å²	55.1	36%	0.356	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	23.1	-175.4	-46.4	94.6	0	0	0	113.6	R148 F151 A152 L154 I158 V193 L196	R148-W156 HydrophobicContact CG-CH2 3.72Å; R148-W156 HydrophobicContact CG-CZ3 4.48Å; F151-W156 HydrophobicContact CB-CE3 3.7Å; F151-W156 HydrophobicContact CB-CH2 4.49Å; F151-W156 HydrophobicContact CB-CZ3 3.61Å; F151-W156 WeakPolarHBondContact O-CA 3.48Å; F151-W156 PolarHBondContact O-N 2.75Å; A152-W156 HydrophobicContact CB-CH2 4.23Å; A152-W156 HydrophobicContact CB-CZ2 3.56Å; L154-W156 PolarHBondContact O-N 3.17Å; L154-W156 VanDerWaalsContact O-N 3.1Å; W156-I158 PolarHBondContact O-N 2.98Å; W156-I158 VanDerWaalsContact O-N 3.17Å; W156-V193 HydrophobicContact CE3-CG1 4.32Å; W156-V193 HydrophobicContact CH2-CG1 4.24Å; W156-V193 HydrophobicContact CH2-CG2 4.36Å; W156-V193 HydrophobicContact CZ3-CG1 3.54Å; W156-V193 HydrophobicContact CZ3-CG2 4.44Å; W156-L196 HydrophobicContact CB-CD2 4.49Å; W156-L196 HydrophobicContact CE3-CD2 3.56Å; W156-L196 HydrophobicContact CZ3-CD2 4.22Å
157	H	85.8	Confident	88.1	Confident	89 Å²	89	56 Å²	56	41%	0.412	26%	0.255	S	S	.	.			trans	-63.5	116.2	179.2	-162	-80.9	0	0	0	110.1	L154 F155 E159 K160 C161	L154-H157 VanDerWaalsContact O-CB 3.28Å; L154-H157 WeakPolarHBondContact O-CB 3.39Å; L154-H157 PolarHBondContact O-N 3.05Å; F155-H157 PolarHBondContact O-N 3.06Å; F155-H157 VanDerWaalsContact O-N 3.16Å; H157-E159 VanDerWaalsContact C-N 3.33Å; H157-E159 IonicContact CE1-OE2 2.96Å; H157-E159 PolarHBondContact CE1-OE2 3.35Å; H157-E159 PolarHBondContact O-N 3.45Å; H157-K160 HydrophobicContact CB-CB 4.42Å; H157-K160 HydrophobicContact CB-CD 4.35Å; H157-K160 HydrophobicContact CB-CG 4.38Å; H157-K160 PolarHBondContact O-N 3.5Å; H157-C161 WeakPolarHBondContact O-CB 3.34Å; H157-C161 PolarHBondContact O-N 3.49Å; H157-C161 PolarHBondContact O-SG 3.36Å; H157-C161 VanDerWaalsContact O-SG 3.37Å
158	I	86.4	Confident	88	Confident	85 Å²	85	55.9 Å²	55.9	44%	0.436	25%	0.254	S	S	.	.	H	α-helix	trans	-57	-46.5	-169	-64.9	167.2	0	0	0	111	W156 K160 C161 H162 L196 V199	W156-I158 PolarHBondContact O-N 2.98Å; W156-I158 VanDerWaalsContact O-N 3.17Å; I158-K160 PolarHBondContact O-N 3.14Å; I158-C161 PolarHBondContact O-N 3.36Å; I158-H162 WeakPolarHBondContact O-CB 3.13Å; I158-H162 PolarHBondContact O-N 2.94Å; I158-L196 HydrophobicContact CG1-CD1 3.97Å; I158-V199 HydrophobicContact CD1-CG1 4.32Å; I158-V199 HydrophobicContact CG2-CG1 3.75Å
159	E	85.8	Confident	88.1	Confident	131 Å²	131	52.7 Å²	52.7	61%	0.612	24%	0.242	S	C	*	.	H	α-helix	trans	-61	-44.4	-177.9	-61.4	177.8	164.5	0	0	112.7	H157 H162 S163	H157-E159 VanDerWaalsContact C-N 3.33Å; H157-E159 IonicContact CE1-OE2 2.96Å; H157-E159 PolarHBondContact CE1-OE2 3.35Å; H157-E159 PolarHBondContact O-N 3.45Å; E159-H162 PolarHBondContact O-N 2.85Å; E159-S163 PolarHBondContact O-N 3.27Å; E159-S163 PolarHBondContact O-OG 3.28Å; E159-S163 VanDerWaalsContact O-OG 3.07Å
160	K	87.2	Confident	88	Confident	86 Å²	86	47.6 Å²	47.6	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-70.5	-42.9	-179.3	-62.9	-176.6	-178.6	176.7	0	111.4	L154 H157 I158 H162 S163 I164	L154-K160 HydrophobicContact CD1-CB 4.41Å; L154-K160 HydrophobicContact CD2-CB 4.27Å; L154-K160 HydrophobicContact CD2-CD 4.14Å; H157-K160 HydrophobicContact CB-CB 4.42Å; H157-K160 HydrophobicContact CB-CD 4.35Å; H157-K160 HydrophobicContact CB-CG 4.38Å; H157-K160 PolarHBondContact O-N 3.5Å; I158-K160 PolarHBondContact O-N 3.14Å; K160-H162 VanDerWaalsContact C-N 3.29Å; K160-H162 PolarHBondContact O-N 3.43Å; K160-S163 PolarHBondContact O-N 3Å; K160-I164 PolarHBondContact O-N 2.71Å; K160-I164 VanDerWaalsContact O-N 3.11Å
161	C	88.9	Confident	88.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-39.7	174.4	-68.4	0	0	0	0	111.2	F151 H157 I158 H165 L196 L200	F151-C161 HydrophobicContact CD1-CB 4.05Å; F151-C161 VanDerWaalsContact CD1-SG 3.58Å; F151-C161 HydrophobicContact CE1-CB 4.07Å; H157-C161 WeakPolarHBondContact O-CB 3.34Å; H157-C161 PolarHBondContact O-N 3.49Å; H157-C161 PolarHBondContact O-SG 3.36Å; H157-C161 VanDerWaalsContact O-SG 3.37Å; I158-C161 PolarHBondContact O-N 3.36Å; C161-H165 WeakPolarHBondContact O-CB 3.46Å; C161-H165 PolarHBondContact O-N 3.49Å; C161-L196 HydrophobicContact CB-CD2 4.46Å; C161-L200 HydrophobicContact CB-CD1 4.19Å; C161-L200 HydrophobicContact CB-CD2 4.04Å
162	H	90	Very high	88.1	Confident	14 Å²	14	52.5 Å²	52.5	7%	0.065	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-47.8	175.6	174.8	-94.5	0	0	0	111.7	I158 E159 K160 I164 H165 L166 L200 T203	I158-H162 WeakPolarHBondContact O-CB 3.13Å; I158-H162 PolarHBondContact O-N 2.94Å; E159-H162 PolarHBondContact O-N 2.85Å; K160-H162 VanDerWaalsContact C-N 3.29Å; K160-H162 PolarHBondContact O-N 3.43Å; H162-I164 VanDerWaalsContact C-N 3.31Å; H162-I164 PolarHBondContact O-N 3.43Å; H162-H165 PolarHBondContact O-N 3.39Å; H162-L166 WeakPolarHBondContact O-CB 3.5Å; H162-L166 PolarHBondContact O-N 3.39Å; H162-L200 HydrophobicContact CB-CD2 3.78Å; H162-T203 PolarHBondContact CD2-OG1 3.05Å
163	S	88	Confident	88.1	Confident	15 Å²	15	52.5 Å²	52.5	11%	0.105	25%	0.248	C	C	.	.	H	α-helix	trans	-55.9	-45.5	176.5	-63.3	0	0	0	0	111.9	E159 K160 W167	E159-S163 PolarHBondContact O-N 3.27Å; E159-S163 PolarHBondContact O-OG 3.28Å; E159-S163 VanDerWaalsContact O-OG 3.07Å; K160-S163 PolarHBondContact O-N 3Å; S163-W167 WeakPolarHBondContact O-CB 3.49Å; S163-W167 PolarHBondContact O-N 2.71Å
164	I	90.1	Very high	88	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.6	-45.8	176.3	-71.9	177.5	0	0	0	111.9	H104 L105 I108 I150 F151 L154 K160 H162 W167 C168	H104-I164 HydrophobicContact CB-CD1 3.83Å; L105-I164 HydrophobicContact CD2-CG1 4.42Å; L105-I164 HydrophobicContact CD2-CG2 4.05Å; I108-I164 HydrophobicContact CD1-CG2 3.39Å; I150-I164 HydrophobicContact CG2-CD1 4.38Å; F151-I164 HydrophobicContact CE1-CG2 4.45Å; L154-I164 HydrophobicContact CD1-CD1 3.35Å; K160-I164 PolarHBondContact O-N 2.71Å; K160-I164 VanDerWaalsContact O-N 3.11Å; H162-I164 VanDerWaalsContact C-N 3.31Å; H162-I164 PolarHBondContact O-N 3.43Å; I164-W167 PolarHBondContact O-N 3.08Å; I164-C168 PolarHBondContact O-N 3.49Å; I164-C168 PolarHBondContact O-SG 3.04Å; I164-C168 VanDerWaalsContact O-SG 3.4Å
165	H	92.4	Very high	88	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.4	-48	-179.4	-178.8	51.8	0	0	0	111.5	C161 H162 W167 C168 V169 Y180 F184 L200 N201 L204 F217	C161-H165 WeakPolarHBondContact O-CB 3.46Å; C161-H165 PolarHBondContact O-N 3.49Å; H162-H165 PolarHBondContact O-N 3.39Å; H165-W167 VanDerWaalsContact C-N 3.32Å; H165-W167 PolarHBondContact O-N 2.94Å; H165-C168 WeakPolarHBondContact O-CB 3.44Å; H165-C168 PolarHBondContact O-N 2.96Å; H165-V169 WeakPolarHBondContact O-CG2 3.37Å; H165-V169 PolarHBondContact O-N 2.83Å; H165-Y180 AromaticContact CE1-CE1 3.96Å; H165-Y180 AromaticContact ND1-CE1 3.67Å; H165-Y180 AromaticContact ND1-CZ 3.68Å; H165-Y180 PolarHBondContact ND1-OH 3.1Å; H165-F184 AromaticContact CE1-CD2 3.72Å; H165-F184 AromaticContact CE1-CE2 3.25Å; H165-F184 WeakPolarHBondContact CE1-CE2 3.41Å; H165-F184 AromaticContact CE1-CZ 3.58Å; H165-F184 AromaticContact ND1-CD2 3.94Å; H165-F184 AromaticContact ND1-CE2 3.48Å; H165-F184 WeakPolarHBondContact ND1-CE2 3.42Å; H165-F184 AromaticContact NE2-CE2 3.85Å; H165-F184 AromaticContact NE2-CZ 3.76Å; H165-L200 HydrophobicContact CB-CD1 4.33Å; H165-N201 PolarHBondContact NE2-OD1 2.88Å; H165-L204 WeakPolarHBondContact CD2-CD1 3.46Å; H165-L204 WeakPolarHBondContact NE2-CD1 3.23Å; H165-F217 AromaticContact CE1-CE1 3.71Å; H165-F217 AromaticContact CE1-CZ 3.64Å; H165-F217 AromaticContact NE2-CE1 3.89Å
166	L	90.9	Very high	88.3	Confident	26 Å²	26	49 Å²	49	14%	0.136	24%	0.236	C	C	.	.	H	α-helix	trans	-56.9	-45.2	173.9	177.4	67.6	0	0	0	111.4	H162 C168 V169 K170 L204 Y208	H162-L166 WeakPolarHBondContact O-CB 3.5Å; H162-L166 PolarHBondContact O-N 3.39Å; L166-C168 VanDerWaalsContact C-N 3.33Å; L166-C168 PolarHBondContact O-N 3.2Å; L166-V169 PolarHBondContact O-N 2.78Å; L166-K170 HydrophobicContact CD1-CD 3.8Å; L166-K170 HydrophobicContact CD1-CG 4.13Å; L166-K170 HydrophobicContact CG-CD 4.27Å; L166-K170 WeakPolarHBondContact O-CB 3.31Å; L166-K170 PolarHBondContact O-N 3.44Å; L166-L204 HydrophobicContact CB-CD2 4.07Å; L166-L204 HydrophobicContact CD1-CD2 3.47Å; L166-L204 VanDerWaalsContact CD1-CD2 3.47Å; L166-L204 HydrophobicContact CG-CD2 4.37Å; L166-Y208 HydrophobicContact CD1-CD2 3.8Å; L166-Y208 HydrophobicContact CD1-CE1 4.36Å; L166-Y208 HydrophobicContact CD1-CE2 3.51Å; L166-Y208 HydrophobicContact CD1-CG 4.34Å; L166-Y208 HydrophobicContact CD2-CE2 3.79Å; L166-Y208 VanDerWaalsContact CD2-OH 3.23Å; L166-Y208 WeakPolarHBondContact CD2-OH 3.35Å; L166-Y208 HydrophobicContact CG-CE2 4.3Å
167	W	91.1	Very high	88.6	Confident	55 Å²	55	45.3 Å²	45.3	21%	0.208	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-45	177.1	-174.2	94.3	0	0	0	111.3	W97 L105 L109 S163 I164 H165 V169 K170 N171 L172	W97-W167 HydrophobicContact CH2-CB 3.81Å; W97-W167 AromaticContact CH2-CD1 3.96Å; W97-W167 HydrophobicContact CH2-CG 4.13Å; W97-W167 HydrophobicContact CZ2-CB 4.32Å; W97-W167 AromaticContact CZ2-CD1 3.82Å; W97-W167 HydrophobicContact CZ2-CG 4.4Å; L105-W167 HydrophobicContact CD1-CD2 3.7Å; L105-W167 HydrophobicContact CD1-CE3 4.07Å; L105-W167 HydrophobicContact CD1-CG 3.95Å; L105-W167 HydrophobicContact CD1-CZ2 4.42Å; L105-W167 HydrophobicContact CD2-CB 4.37Å; L105-W167 HydrophobicContact CD2-CD2 3.75Å; L105-W167 HydrophobicContact CD2-CE3 3.32Å; L105-W167 HydrophobicContact CD2-CG 4.2Å; L105-W167 HydrophobicContact CD2-CZ3 3.9Å; L105-W167 HydrophobicContact CG-CD2 4.34Å; L105-W167 HydrophobicContact CG-CE3 4.22Å; L109-W167 HydrophobicContact CD1-CH2 4.04Å; L109-W167 HydrophobicContact CD1-CZ3 4.47Å; L109-W167 HydrophobicContact CD2-CH2 4.44Å; L109-W167 HydrophobicContact CD2-CZ3 4.39Å; L109-W167 HydrophobicContact CG-CH2 4.48Å; L109-W167 HydrophobicContact CG-CZ3 4.47Å; S163-W167 WeakPolarHBondContact O-CB 3.49Å; S163-W167 PolarHBondContact O-N 2.71Å; I164-W167 PolarHBondContact O-N 3.08Å; H165-W167 VanDerWaalsContact C-N 3.32Å; H165-W167 PolarHBondContact O-N 2.94Å; W167-V169 PolarHBondContact O-N 2.84Å; W167-K170 PolarHBondContact O-N 2.83Å; W167-N171 HydrophobicContact CD2-CB 4.14Å; W167-N171 HydrophobicContact CH2-CB 4.5Å; W167-N171 HydrophobicContact CZ2-CB 4.07Å; W167-N171 VanDerWaalsContact O-CB 3.28Å; W167-N171 WeakPolarHBondContact O-CB 3.39Å; W167-N171 PolarHBondContact O-N 2.85Å; W167-N171 PolarHBondContact O-ND2 3.45Å; W167-L172 HydrophobicContact CZ3-CD2 4.44Å
168	C	91	Very high	88.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.1	-44.4	177	-72.5	0	0	0	0	112	I164 H165 L166 L172 Y180	I164-C168 PolarHBondContact O-N 3.49Å; I164-C168 PolarHBondContact O-SG 3.04Å; I164-C168 VanDerWaalsContact O-SG 3.4Å; H165-C168 WeakPolarHBondContact O-CB 3.44Å; H165-C168 PolarHBondContact O-N 2.96Å; L166-C168 VanDerWaalsContact C-N 3.33Å; L166-C168 PolarHBondContact O-N 3.2Å; C168-L172 HydrophobicContact CB-CD1 3.79Å; C168-L172 HydrophobicContact CB-CG 4.24Å; C168-L172 WeakPolarHBondContact O-CB 3.47Å; C168-L172 WeakPolarHBondContact O-CD1 3.47Å; C168-L172 WeakPolarHBondContact O-CG 3.48Å; C168-L172 PolarHBondContact O-N 2.82Å; C168-Y180 HydrophobicContact CB-CD1 4.09Å; C168-Y180 HydrophobicContact CB-CD2 4.23Å; C168-Y180 HydrophobicContact CB-CE1 3.65Å; C168-Y180 HydrophobicContact CB-CE2 3.8Å; C168-Y180 HydrophobicContact CB-CG 4.35Å; C168-Y180 VanDerWaalsContact CB-CZ 3.49Å
169	V	90.6	Very high	89	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-65.1	-40.1	-179.8	172	0	0	0	0	111.9	H165 L166 W167 Y180 L204 V214 F217	H165-V169 WeakPolarHBondContact O-CG2 3.37Å; H165-V169 PolarHBondContact O-N 2.83Å; L166-V169 PolarHBondContact O-N 2.78Å; W167-V169 PolarHBondContact O-N 2.84Å; V169-Y180 HydrophobicContact CG2-CE1 4.32Å; V169-L204 HydrophobicContact CG2-CD1 4.12Å; V169-V214 HydrophobicContact CG1-CB 4.41Å; V169-V214 HydrophobicContact CG1-CG2 3.99Å; V169-F217 HydrophobicContact CG1-CB 3.76Å; V169-F217 HydrophobicContact CG1-CD1 4.35Å; V169-F217 HydrophobicContact CG1-CG 4.05Å; V169-F217 HydrophobicContact CG2-CB 4.41Å; V169-F217 HydrophobicContact CG2-CD1 3.78Å; V169-F217 HydrophobicContact CG2-CD2 3.99Å; V169-F217 HydrophobicContact CG2-CE1 4.01Å; V169-F217 HydrophobicContact CG2-CE2 4.2Å; V169-F217 HydrophobicContact CG2-CG 3.78Å; V169-F217 HydrophobicContact CG2-CZ 4.23Å
170	K	88	Confident	89.4	Confident	73 Å²	73	34.6 Å²	34.6	32%	0.317	18%	0.178	S	C	.	.	H	α-helix	trans	-85.4	-29.9	-175.7	-71.2	-169.1	168.5	-160.7	0	115.1	L166 W167 Y208 D211 V214	L166-K170 HydrophobicContact CD1-CD 3.8Å; L166-K170 HydrophobicContact CD1-CG 4.13Å; L166-K170 HydrophobicContact CG-CD 4.27Å; L166-K170 WeakPolarHBondContact O-CB 3.31Å; L166-K170 PolarHBondContact O-N 3.44Å; W167-K170 PolarHBondContact O-N 2.83Å; K170-Y208 VanDerWaalsContact NZ-CD1 3.27Å; K170-D211 WeakPolarHBondContact CE-OD2 3.23Å; K170-D211 IonicContact NZ-OD2 3.89Å; K170-D211 PolarHBondContact NZ-OD2 2.82Å; K170-V214 HydrophobicContact CG-CG2 4.46Å
171	N	89	Confident	89.6	Confident	92 Å²	92	30.8 Å²	30.8	49%	0.492	16%	0.162	S	C	.	.	H	α-helix	trans	-119	-5.8	-166.4	-56.4	-88.6	0	0	0	114.1	W167	W167-N171 HydrophobicContact CD2-CB 4.14Å; W167-N171 HydrophobicContact CH2-CB 4.5Å; W167-N171 HydrophobicContact CZ2-CB 4.07Å; W167-N171 VanDerWaalsContact O-CB 3.28Å; W167-N171 WeakPolarHBondContact O-CB 3.39Å; W167-N171 PolarHBondContact O-N 2.85Å; W167-N171 PolarHBondContact O-ND2 3.45Å
172	L	88.9	Confident	89.7	Confident	15 Å²	15	33 Å²	33	8%	0.079	18%	0.177	C	C	.	.	S	Bend	trans	-70.4	138.9	174.2	-76	173.8	0	0	0	110.6	L109 L112 W167 C168 L176 L177 Y180	L109-L172 HydrophobicContact CD2-CD2 3.46Å; L109-L172 VanDerWaalsContact CD2-CD2 3.46Å; L112-L172 HydrophobicContact CD1-CD1 3.76Å; L112-L172 HydrophobicContact CD1-CD2 4Å; W167-L172 HydrophobicContact CZ3-CD2 4.44Å; C168-L172 HydrophobicContact CB-CD1 3.79Å; C168-L172 HydrophobicContact CB-CG 4.24Å; C168-L172 WeakPolarHBondContact O-CB 3.47Å; C168-L172 WeakPolarHBondContact O-CD1 3.47Å; C168-L172 WeakPolarHBondContact O-CG 3.48Å; C168-L172 PolarHBondContact O-N 2.82Å; L172-L176 HydrophobicContact CB-CB 4.42Å; L172-L176 HydrophobicContact CD2-CB 4.17Å; L172-L176 HydrophobicContact CD2-CD1 4.3Å; L172-L177 HydrophobicContact CB-CB 4.33Å; L172-Y180 HydrophobicContact CD1-CD1 4.2Å; L172-Y180 HydrophobicContact CD1-CD2 4.11Å; L172-Y180 HydrophobicContact CD1-CG 3.69Å
173	P	88.2	Confident	89.8	Confident	35 Å²	35	32.3 Å²	32.3	23%	0.227	17%	0.174	C	C	.	.			trans	-56.5	154.5	170.8	-22.3	31	0	0	0	112.1	L81 T175 L176 L177	L81-P173 HydrophobicContact CD1-CG 3.73Å; L81-P173 HydrophobicContact CD2-CG 4.4Å; P173-T175 PolarHBondContact O-N 3.47Å; P173-L176 HydrophobicContact CG-CD1 4.32Å; P173-L176 PolarHBondContact O-N 2.96Å; P173-L177 PolarHBondContact O-N 3.15Å
174	E	83.9	Confident	90	Very high	136 Å²	136	31.6 Å²	31.6	64%	0.636	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-25.1	178.1	-65.1	-158.3	131.8	0	0	113.5	P178 R216	E174-P178 WeakPolarHBondContact O-CD 3.25Å; E174-P178 WeakPolarHBondContact O-CG 3.13Å; E174-R216 IonicContact OE1-CZ 3.9Å; E174-R216 IonicContact OE1-NH1 2.69Å; E174-R216 PolarHBondContact OE1-NH1 2.85Å; E174-R216 IonicContact OE1-NH2 3.16Å
175	T	85.2	Confident	90	Very high	76 Å²	76	31.9 Å²	31.9	47%	0.466	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-25.6	175.3	54.7	0	0	0	0	113.8	P173	P173-T175 PolarHBondContact O-N 3.47Å
176	L	89.5	Confident	89.8	Confident	4 Å²	4	33.1 Å²	33.1	2%	0.021	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-25.2	-176.8	-65.6	-176.4	0	0	0	113.2	L109 L112 R113 L116 L172 P173 I179 Y180	L109-L176 HydrophobicContact CD2-CD1 4.29Å; L112-L176 HydrophobicContact CB-CD2 4.16Å; R113-L176 HydrophobicContact CG-CD1 4.29Å; L116-L176 HydrophobicContact CB-CD2 4.13Å; L116-L176 HydrophobicContact CD2-CD2 3.88Å; L116-L176 HydrophobicContact CG-CD2 4.47Å; L172-L176 HydrophobicContact CB-CB 4.42Å; L172-L176 HydrophobicContact CD2-CB 4.17Å; L172-L176 HydrophobicContact CD2-CD1 4.3Å; P173-L176 HydrophobicContact CG-CD1 4.32Å; P173-L176 PolarHBondContact O-N 2.96Å; L176-I179 HydrophobicContact CD2-CD1 4.34Å; L176-I179 PolarHBondContact O-N 3.1Å; L176-Y180 PolarHBondContact O-N 2.73Å
177	L	90.4	Very high	89.7	Confident	18 Å²	18	31.9 Å²	31.9	9%	0.094	17%	0.171	C	C	.	.	H	α-helix	trans	-59.9	-44.1	179.9	-177.8	65	0	0	0	112.9	L172 P173 I179 Y180 C181 F217	L172-L177 HydrophobicContact CB-CB 4.33Å; P173-L177 PolarHBondContact O-N 3.15Å; L177-I179 VanDerWaalsContact C-N 3.34Å; L177-I179 PolarHBondContact O-N 3.01Å; L177-Y180 WeakPolarHBondContact O-CB 3.4Å; L177-Y180 PolarHBondContact O-N 3.16Å; L177-C181 PolarHBondContact O-N 2.82Å; L177-F217 HydrophobicContact CD1-CD2 4.1Å
178	P	89.2	Confident	89.6	Confident	68 Å²	68	31.3 Å²	31.3	44%	0.442	17%	0.169	S	C	.	.	H	α-helix	trans	-64.3	-36	175.9	-23.2	34.6	0	0	0	113.3	E174 C181 S182	E174-P178 WeakPolarHBondContact O-CD 3.25Å; E174-P178 WeakPolarHBondContact O-CG 3.13Å; P178-C181 PolarHBondContact O-N 2.82Å; P178-S182 PolarHBondContact O-N 3.07Å; P178-S182 PolarHBondContact O-OG 2.97Å
179	I	90.5	Very high	89.3	Confident	11 Å²	11	36.9 Å²	36.9	6%	0.056	19%	0.19	C	C	.	.	H	α-helix	trans	-65.6	-44	175.1	-59.4	179.3	0	0	0	109.6	L112 V115 L116 L140 L176 L177 S182 V183	L112-I179 HydrophobicContact CD2-CB 4.49Å; L112-I179 HydrophobicContact CD2-CG2 3.84Å; V115-I179 HydrophobicContact CB-CG2 3.83Å; V115-I179 HydrophobicContact CG1-CD1 4.43Å; V115-I179 HydrophobicContact CG1-CG2 3.78Å; V115-I179 HydrophobicContact CG2-CG2 4.22Å; L116-I179 HydrophobicContact CB-CD1 3.88Å; L116-I179 HydrophobicContact CD1-CD1 3.72Å; L116-I179 HydrophobicContact CG-CD1 4.41Å; L140-I179 HydrophobicContact CD2-CG2 3.9Å; L176-I179 HydrophobicContact CD2-CD1 4.34Å; L176-I179 PolarHBondContact O-N 3.1Å; L177-I179 VanDerWaalsContact C-N 3.34Å; L177-I179 PolarHBondContact O-N 3.01Å; I179-S182 PolarHBondContact O-N 3.45Å; I179-V183 WeakPolarHBondContact O-CB 3.37Å; I179-V183 VanDerWaalsContact O-CG2 3.25Å; I179-V183 WeakPolarHBondContact O-CG2 3.41Å; I179-V183 PolarHBondContact O-N 3.45Å
180	Y	93.7	Very high	88.7	Confident	1 Å²	1	40.3 Å²	40.3	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-43	175.6	-178.4	-104.1	0	0	0	112	I108 L112 L147 H165 C168 V169 L172 L176 L177 V183 F184 F217	I108-Y180 HydrophobicContact CG2-CD2 4.46Å; I108-Y180 HydrophobicContact CG2-CE2 4.44Å; L112-Y180 HydrophobicContact CD1-CD2 4.09Å; L112-Y180 HydrophobicContact CD1-CG 4.5Å; L112-Y180 HydrophobicContact CD2-CD2 4.43Å; L147-Y180 HydrophobicContact CD1-CE2 4.47Å; L147-Y180 HydrophobicContact CD2-CE2 3.91Å; H165-Y180 AromaticContact CE1-CE1 3.96Å; H165-Y180 AromaticContact ND1-CE1 3.67Å; H165-Y180 AromaticContact ND1-CZ 3.68Å; H165-Y180 PolarHBondContact ND1-OH 3.1Å; C168-Y180 HydrophobicContact CB-CD1 4.09Å; C168-Y180 HydrophobicContact CB-CD2 4.23Å; C168-Y180 HydrophobicContact CB-CE1 3.65Å; C168-Y180 HydrophobicContact CB-CE2 3.8Å; C168-Y180 HydrophobicContact CB-CG 4.35Å; C168-Y180 VanDerWaalsContact CB-CZ 3.49Å; V169-Y180 HydrophobicContact CG2-CE1 4.32Å; L172-Y180 HydrophobicContact CD1-CD1 4.2Å; L172-Y180 HydrophobicContact CD1-CD2 4.11Å; L172-Y180 HydrophobicContact CD1-CG 3.69Å; L176-Y180 PolarHBondContact O-N 2.73Å; L177-Y180 WeakPolarHBondContact O-CB 3.4Å; L177-Y180 PolarHBondContact O-N 3.16Å; Y180-V183 WeakPolarHBondContact O-CB 3.31Å; Y180-V183 PolarHBondContact O-N 3.2Å; Y180-F184 WeakPolarHBondContact O-CB 3.46Å; Y180-F184 PolarHBondContact O-N 3.39Å; Y180-F217 AromaticContact CD1-CE2 3.94Å; Y180-F217 HydrophobicContact CD1-CE2 3.94Å; Y180-F217 HydrophobicContact CE1-CE2 4.14Å; Y180-F217 HydrophobicContact CE1-CZ 4.39Å
181	C	92.5	Very high	87.9	Confident	5 Å²	5	43 Å²	43	3%	0.034	22%	0.223	C	C	.	.	H	α-helix	trans	-57.9	-48.9	173.8	-172.6	0	0	0	0	111.5	L177 P178 V183 F184 C185 F217	L177-C181 PolarHBondContact O-N 2.82Å; P178-C181 PolarHBondContact O-N 2.82Å; C181-V183 VanDerWaalsContact C-N 3.31Å; C181-V183 PolarHBondContact O-N 2.97Å; C181-F184 CarbonylContact O-C 3.6Å; C181-F184 WeakPolarHBondContact O-CA 3.47Å; C181-F184 WeakPolarHBondContact O-CB 3.32Å; C181-F184 PolarHBondContact O-N 3.42Å; C181-C185 PolarHBondContact O-N 3.17Å; C181-C185 PolarHBondContact O-SG 2.94Å; C181-C185 VanDerWaalsContact O-SG 3.35Å; C181-F217 HydrophobicContact CB-CD2 4.22Å; C181-F217 HydrophobicContact CB-CE2 3.94Å
182	S	91.3	Very high	86.9	Confident	46 Å²	46	47.2 Å²	47.2	32%	0.322	24%	0.236	S	C	.	.	H	α-helix	trans	-58.6	-42.4	176.4	-60.1	0	0	0	0	112.4	P178 I179 F184 C185 I186	P178-S182 PolarHBondContact O-N 3.07Å; P178-S182 PolarHBondContact O-OG 2.97Å; I179-S182 PolarHBondContact O-N 3.45Å; S182-F184 VanDerWaalsContact C-N 3.34Å; S182-F184 PolarHBondContact O-N 2.95Å; S182-C185 PolarHBondContact O-N 3.06Å; S182-I186 WeakPolarHBondContact O-CG1 3.26Å; S182-I186 PolarHBondContact O-N 3.01Å
183	V	92	Very high	86.2	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-42	175	164	0	0	0	0	111.6	L112 L140 A143 A144 L147 I179 Y180 C181 I186 L187	L112-V183 HydrophobicContact CD2-CG2 4.19Å; L140-V183 HydrophobicContact CD2-CG2 3.93Å; A143-V183 HydrophobicContact CB-CG1 4.36Å; A143-V183 HydrophobicContact CB-CG2 3.49Å; A143-V183 VanDerWaalsContact CB-CG2 3.49Å; A144-V183 HydrophobicContact CB-CG1 4.08Å; L147-V183 HydrophobicContact CB-CG1 4.39Å; L147-V183 HydrophobicContact CD2-CG1 3.96Å; I179-V183 WeakPolarHBondContact O-CB 3.37Å; I179-V183 VanDerWaalsContact O-CG2 3.25Å; I179-V183 WeakPolarHBondContact O-CG2 3.41Å; I179-V183 PolarHBondContact O-N 3.45Å; Y180-V183 WeakPolarHBondContact O-CB 3.31Å; Y180-V183 PolarHBondContact O-N 3.2Å; C181-V183 VanDerWaalsContact C-N 3.31Å; C181-V183 PolarHBondContact O-N 2.97Å; V183-I186 PolarHBondContact O-N 3.16Å; V183-L187 PolarHBondContact O-N 3.18Å
184	F	91.7	Very high	85.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-68	-42.6	178.2	-160.7	-91.6	0	0	0	111.6	L147 H165 Y180 C181 S182 I186 L187 W188 L197 N201 F217 F221	L147-F184 HydrophobicContact CD2-CD2 4.49Å; H165-F184 AromaticContact CE1-CD2 3.72Å; H165-F184 AromaticContact CE1-CE2 3.25Å; H165-F184 WeakPolarHBondContact CE1-CE2 3.41Å; H165-F184 AromaticContact CE1-CZ 3.58Å; H165-F184 AromaticContact ND1-CD2 3.94Å; H165-F184 AromaticContact ND1-CE2 3.48Å; H165-F184 WeakPolarHBondContact ND1-CE2 3.42Å; H165-F184 AromaticContact NE2-CE2 3.85Å; H165-F184 AromaticContact NE2-CZ 3.76Å; Y180-F184 WeakPolarHBondContact O-CB 3.46Å; Y180-F184 PolarHBondContact O-N 3.39Å; C181-F184 CarbonylContact O-C 3.6Å; C181-F184 WeakPolarHBondContact O-CA 3.47Å; C181-F184 WeakPolarHBondContact O-CB 3.32Å; C181-F184 PolarHBondContact O-N 3.42Å; S182-F184 VanDerWaalsContact C-N 3.34Å; S182-F184 PolarHBondContact O-N 2.95Å; F184-I186 PolarHBondContact O-N 2.98Å; F184-L187 PolarHBondContact O-N 3.45Å; F184-L187 VanDerWaalsContact O-N 3.13Å; F184-W188 HydrophobicContact CE1-CE3 4.02Å; F184-W188 HydrophobicContact CE1-CZ3 4.24Å; F184-W188 PolarHBondContact O-N 2.97Å; F184-L197 HydrophobicContact CD2-CD2 4.33Å; F184-L197 HydrophobicContact CE1-CB 4.19Å; F184-L197 HydrophobicContact CE1-CD2 4.41Å; F184-L197 HydrophobicContact CE2-CD2 3.62Å; F184-L197 HydrophobicContact CZ-CB 3.95Å; F184-L197 HydrophobicContact CZ-CD2 3.67Å; F184-L197 HydrophobicContact CZ-CG 4.28Å; F184-N201 WeakPolarHBondContact CE1-OD1 3.34Å; F184-N201 WeakPolarHBondContact CZ-OD1 3.38Å; F184-F217 HydrophobicContact CB-CZ 4.47Å; F184-F217 HydrophobicContact CD1-CZ 4.2Å; F184-F217 HydrophobicContact CG-CZ 4.24Å; F184-F221 AromaticContact CD1-CD2 3.94Å; F184-F221 HydrophobicContact CD1-CD2 3.94Å; F184-F221 AromaticContact CD1-CE2 3.48Å; F184-F221 HydrophobicContact CD1-CE2 3.48Å; F184-F221 VanDerWaalsContact CD1-CE2 3.48Å; F184-F221 HydrophobicContact CD1-CZ 4.03Å; F184-F221 HydrophobicContact CE1-CE2 4.03Å; F184-F221 HydrophobicContact CE1-CZ 4.11Å
185	C	90.1	Very high	85.7	Confident	6 Å²	6	44 Å²	44	4%	0.041	23%	0.227	C	C	.	.	H	α-helix	trans	-56.3	-45.3	172	-71	0	0	0	0	112.4	C181 S182 L187 W188 R189 F221	C181-C185 PolarHBondContact O-N 3.17Å; C181-C185 PolarHBondContact O-SG 2.94Å; C181-C185 VanDerWaalsContact O-SG 3.35Å; S182-C185 PolarHBondContact O-N 3.06Å; C185-L187 VanDerWaalsContact C-N 3.3Å; C185-L187 PolarHBondContact O-N 2.88Å; C185-W188 WeakPolarHBondContact O-CB 3.23Å; C185-W188 PolarHBondContact O-N 3.48Å; C185-W188 VanDerWaalsContact O-N 3.15Å; C185-R189 WeakPolarHBondContact O-CG 3.46Å; C185-R189 PolarHBondContact O-N 3.45Å; C185-F221 WeakPolarHBondContact SG-CD2 3.42Å
186	I	88.7	Confident	85.8	Confident	25 Å²	25	41.4 Å²	41.4	13%	0.128	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-39.9	176.4	-73.2	169.1	0	0	0	111.6	L140 H141 A144 S182 V183 F184 K190	L140-I186 HydrophobicContact CB-CD1 3.52Å; H141-I186 WeakPolarHBondContact ND1-CG2 3.47Å; A144-I186 HydrophobicContact CB-CB 4.11Å; A144-I186 HydrophobicContact CB-CG2 3.59Å; S182-I186 WeakPolarHBondContact O-CG1 3.26Å; S182-I186 PolarHBondContact O-N 3.01Å; V183-I186 PolarHBondContact O-N 3.16Å; F184-I186 PolarHBondContact O-N 2.98Å; I186-K190 PolarHBondContact O-N 3.19Å
187	L	88.9	Confident	85.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-69.7	-37.1	175.6	-72.7	-177	0	0	0	112.3	A144 L147 R148 V183 F184 C185 K190 L197	A144-L187 HydrophobicContact CB-CD2 3.91Å; A144-L187 HydrophobicContact CB-CG 3.87Å; A144-L187 WeakPolarHBondContact O-CD2 3.49Å; L147-L187 HydrophobicContact CB-CD1 4.02Å; L147-L187 HydrophobicContact CD2-CD1 3.76Å; L147-L187 HydrophobicContact CG-CD1 3.88Å; R148-L187 HydrophobicContact CB-CD1 4.47Å; R148-L187 HydrophobicContact CB-CD2 3.91Å; V183-L187 PolarHBondContact O-N 3.18Å; F184-L187 PolarHBondContact O-N 3.45Å; F184-L187 VanDerWaalsContact O-N 3.13Å; C185-L187 VanDerWaalsContact C-N 3.3Å; C185-L187 PolarHBondContact O-N 2.88Å; L187-K190 WeakPolarHBondContact O-CB 3.36Å; L187-K190 PolarHBondContact O-N 3.43Å; L187-K190 VanDerWaalsContact O-N 3.13Å; L187-L197 HydrophobicContact CB-CD1 3.79Å
188	W	88.5	Confident	85.6	Confident	43 Å²	43	46.1 Å²	46.1	16%	0.163	23%	0.229	C	C	.	.	H	α-helix	trans	-59.5	-46.4	176.7	-167.1	-89.4	0	0	0	112.4	F184 C185 K190 L197 K198 N201 F221 I225	F184-W188 HydrophobicContact CE1-CE3 4.02Å; F184-W188 HydrophobicContact CE1-CZ3 4.24Å; F184-W188 PolarHBondContact O-N 2.97Å; C185-W188 WeakPolarHBondContact O-CB 3.23Å; C185-W188 PolarHBondContact O-N 3.48Å; C185-W188 VanDerWaalsContact O-N 3.15Å; W188-K190 PolarHBondContact O-N 3.29Å; W188-L197 HydrophobicContact CB-CD1 4.25Å; W188-L197 HydrophobicContact CD2-CB 4.45Å; W188-L197 HydrophobicContact CE3-CB 3.34Å; W188-L197 HydrophobicContact CE3-CD1 4.07Å; W188-L197 HydrophobicContact CE3-CG 4.35Å; W188-L197 HydrophobicContact CZ3-CB 3.52Å; W188-L197 WeakPolarHBondContact CZ3-O 3.37Å; W188-K198 HydrophobicContact CH2-CB 4.07Å; W188-K198 HydrophobicContact CH2-CG 3.37Å; W188-K198 HydrophobicContact CZ2-CG 3.57Å; W188-K198 HydrophobicContact CZ3-CG 4.18Å; W188-N201 HydrophobicContact CZ3-CB 4.46Å; W188-F221 HydrophobicContact CB-CE2 4.33Å; W188-F221 HydrophobicContact CB-CZ 4.19Å; W188-F221 HydrophobicContact CD2-CE1 4.33Å; W188-F221 HydrophobicContact CD2-CE2 4.48Å; W188-F221 AromaticContact CD2-CZ 3.55Å; W188-F221 HydrophobicContact CD2-CZ 3.55Å; W188-F221 HydrophobicContact CE3-CE1 4.2Å; W188-F221 HydrophobicContact CE3-CE2 4.37Å; W188-F221 AromaticContact CE3-CZ 3.46Å; W188-F221 HydrophobicContact CE3-CZ 3.46Å; W188-F221 VanDerWaalsContact CE3-CZ 3.46Å; W188-F221 HydrophobicContact CG-CE2 4.46Å; W188-F221 AromaticContact CG-CZ 3.86Å; W188-F221 HydrophobicContact CG-CZ 3.86Å; W188-F221 HydrophobicContact CH2-CE1 4.3Å; W188-F221 HydrophobicContact CH2-CZ 4.34Å; W188-F221 HydrophobicContact CZ2-CE1 4.47Å; W188-F221 HydrophobicContact CZ2-CZ 4.45Å; W188-F221 HydrophobicContact CZ3-CE1 4.15Å; W188-F221 AromaticContact CZ3-CZ 3.86Å; W188-F221 HydrophobicContact CZ3-CZ 3.86Å; W188-I225 HydrophobicContact CD2-CD1 4.37Å; W188-I225 HydrophobicContact CG-CD1 4Å
189	R	83.5	Confident	85.6	Confident	117 Å²	117	45.6 Å²	45.6	44%	0.442	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-22.9	176.9	-66.3	178.2	-171.7	-178	1	112.7	C185 N191 S224 E228	C185-R189 WeakPolarHBondContact O-CG 3.46Å; C185-R189 PolarHBondContact O-N 3.45Å; R189-N191 PolarHBondContact O-N 3.04Å; R189-S224 PolarHBondContact NH2-O 3.42Å; R189-E228 VanDerWaalsContact CZ-CD 3.45Å; R189-E228 IonicContact CZ-OE1 2.8Å; R189-E228 IonicContact CZ-OE2 3.42Å; R189-E228 IonicContact NE-OE2 3.08Å; R189-E228 IonicContact NH1-OE1 3.34Å; R189-E228 PolarHBondContact NH1-OE1 2.91Å; R189-E228 IonicContact NH1-OE2 2.92Å; R189-E228 PolarHBondContact NH1-OE2 3.11Å; R189-E228 IonicContact NH2-OE1 2.77Å; R189-E228 PolarHBondContact NH2-OE1 3.21Å; R189-E228 IonicContact NH2-OE2 3.22Å; R189-E228 PolarHBondContact NH2-OE2 3.36Å
190	K	77.9	Confident	85.6	Confident	74 Å²	74	45.1 Å²	45.1	32%	0.322	22%	0.222	S	C	.	.	S	Bend	trans	-83.7	91.1	172.3	-68	-179.3	-177.8	-178.2	0	109.4	N145 I186 L187 W188 K192 V193	N145-K190 PolarHBondContact OD1-NZ 2.95Å; N145-K190 VanDerWaalsContact OD1-NZ 3.15Å; I186-K190 PolarHBondContact O-N 3.19Å; L187-K190 WeakPolarHBondContact O-CB 3.36Å; L187-K190 PolarHBondContact O-N 3.43Å; L187-K190 VanDerWaalsContact O-N 3.13Å; W188-K190 PolarHBondContact O-N 3.29Å; K190-K192 PolarHBondContact O-N 2.97Å; K190-V193 PolarHBondContact O-N 3.36Å; K190-V193 VanDerWaalsContact O-N 3.1Å
191	N	71.4	Confident	85.4	Confident	131 Å²	131	45.6 Å²	45.6	70%	0.701	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-37.8	-26.7	-178.7	-76.4	-14.6	0	0	0	117.3	R189 V193 N194	R189-N191 PolarHBondContact O-N 3.04Å; N191-V193 VanDerWaalsContact C-N 3.33Å; N191-V193 PolarHBondContact O-N 3.32Å; N191-N194 PolarHBondContact O-N 3.05Å
192	K	68.8	Low	85.2	Confident	180 Å²	180	47.1 Å²	47.1	78%	0.783	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-19.3	179.4	-65.8	-170.3	178.6	-170.9	0	115.9	K190	K190-K192 PolarHBondContact O-N 2.97Å
193	V	74.7	Confident	85	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.024	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-6.9	177.6	-156.3	0	0	0	0	112.1	R148 W156 K190 N191 P195 L196 L197	R148-V193 HydrophobicContact CG-CG2 4.18Å; W156-V193 HydrophobicContact CE3-CG1 4.32Å; W156-V193 HydrophobicContact CH2-CG1 4.24Å; W156-V193 HydrophobicContact CH2-CG2 4.36Å; W156-V193 HydrophobicContact CZ3-CG1 3.54Å; W156-V193 HydrophobicContact CZ3-CG2 4.44Å; K190-V193 PolarHBondContact O-N 3.36Å; K190-V193 VanDerWaalsContact O-N 3.1Å; N191-V193 VanDerWaalsContact C-N 3.33Å; N191-V193 PolarHBondContact O-N 3.32Å; V193-P195 VanDerWaalsContact C-CD 3.43Å; V193-P195 VanDerWaalsContact C-N 3.34Å; V193-L196 HydrophobicContact CG1-CB 4.41Å; V193-L196 HydrophobicContact CG1-CD2 4.47Å; V193-L196 PolarHBondContact O-N 3Å; V193-L196 VanDerWaalsContact O-N 3.1Å; V193-L197 HydrophobicContact CB-CD1 4.18Å; V193-L197 HydrophobicContact CB-CG 4.31Å; V193-L197 HydrophobicContact CG1-CD1 4.33Å; V193-L197 HydrophobicContact CG1-CD2 4.2Å; V193-L197 HydrophobicContact CG1-CG 4Å; V193-L197 WeakPolarHBondContact O-CG 3.48Å; V193-L197 PolarHBondContact O-N 3.42Å; V193-L197 VanDerWaalsContact O-N 3.17Å
194	N	78.4	Confident	84.9	Confident	25 Å²	25	45.9 Å²	45.9	13%	0.134	23%	0.228	C	C	.	.	H	α-helix	trans	-53	-41.6	-171.5	-165.2	-20.9	0	0	0	113.5	N191 L196 L197 K198	N191-N194 PolarHBondContact O-N 3.05Å; N194-L196 PolarHBondContact O-N 2.91Å; N194-L197 PolarHBondContact O-N 2.67Å; N194-K198 WeakPolarHBondContact O-CB 3.39Å; N194-K198 WeakPolarHBondContact O-CG 3.31Å; N194-K198 PolarHBondContact O-N 2.89Å; N194-K198 WeakPolarHBondContact OD1-CE 3.08Å; N194-K198 WeakPolarHBondContact OD1-CG 3.22Å
195	P	83	Confident	84.7	Confident	90 Å²	90	50.2 Å²	50.2	58%	0.584	25%	0.249	S	C	*	.	H	α-helix	trans	-58.9	-45.6	176.8	-24.6	35	0	0	0	114.1	V193 K198 V199	V193-P195 VanDerWaalsContact C-CD 3.43Å; V193-P195 VanDerWaalsContact C-N 3.34Å; P195-K198 PolarHBondContact O-N 3.23Å; P195-V199 WeakPolarHBondContact O-CG2 3.46Å; P195-V199 PolarHBondContact O-N 3.33Å
196	L	86.7	Confident	84.5	Confident	21 Å²	21	56.8 Å²	56.8	11%	0.11	28%	0.279	C	S	.	.	H	α-helix	trans	-63.8	-48.6	177.8	174.3	64.9	0	0	0	110.4	F151 W156 I158 C161 V193 N194 K198 V199 L200	F151-L196 HydrophobicContact CB-CD2 4.46Å; F151-L196 HydrophobicContact CD2-CD2 4.23Å; F151-L196 HydrophobicContact CG-CD2 4.5Å; W156-L196 HydrophobicContact CB-CD2 4.49Å; W156-L196 HydrophobicContact CE3-CD2 3.56Å; W156-L196 HydrophobicContact CZ3-CD2 4.22Å; I158-L196 HydrophobicContact CG1-CD1 3.97Å; C161-L196 HydrophobicContact CB-CD2 4.46Å; V193-L196 HydrophobicContact CG1-CB 4.41Å; V193-L196 HydrophobicContact CG1-CD2 4.47Å; V193-L196 PolarHBondContact O-N 3Å; V193-L196 VanDerWaalsContact O-N 3.1Å; N194-L196 PolarHBondContact O-N 2.91Å; L196-K198 VanDerWaalsContact C-N 3.26Å; L196-K198 PolarHBondContact O-N 3.27Å; L196-V199 WeakPolarHBondContact O-CB 3.38Å; L196-V199 PolarHBondContact O-N 3Å; L196-V199 VanDerWaalsContact O-N 3.07Å; L196-L200 HydrophobicContact CD1-CD2 4.25Å; L196-L200 HydrophobicContact CD1-CG 4.18Å; L196-L200 HydrophobicContact CG-CD1 4.2Å; L196-L200 HydrophobicContact CG-CG 4.23Å; L196-L200 WeakPolarHBondContact O-CG 3.11Å; L196-L200 PolarHBondContact O-N 3.41Å
197	L	88.6	Confident	84.4	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.5	-36.7	-177.1	-55.7	174.8	0	0	0	111.6	F151 F184 L187 W188 V193 N194 L200 N201	F151-L197 HydrophobicContact CE2-CD2 3.93Å; F184-L197 HydrophobicContact CD2-CD2 4.33Å; F184-L197 HydrophobicContact CE1-CB 4.19Å; F184-L197 HydrophobicContact CE1-CD2 4.41Å; F184-L197 HydrophobicContact CE2-CD2 3.62Å; F184-L197 HydrophobicContact CZ-CB 3.95Å; F184-L197 HydrophobicContact CZ-CD2 3.67Å; F184-L197 HydrophobicContact CZ-CG 4.28Å; L187-L197 HydrophobicContact CB-CD1 3.79Å; W188-L197 HydrophobicContact CB-CD1 4.25Å; W188-L197 HydrophobicContact CD2-CB 4.45Å; W188-L197 HydrophobicContact CE3-CB 3.34Å; W188-L197 HydrophobicContact CE3-CD1 4.07Å; W188-L197 HydrophobicContact CE3-CG 4.35Å; W188-L197 HydrophobicContact CZ3-CB 3.52Å; W188-L197 WeakPolarHBondContact CZ3-O 3.37Å; V193-L197 HydrophobicContact CB-CD1 4.18Å; V193-L197 HydrophobicContact CB-CG 4.31Å; V193-L197 HydrophobicContact CG1-CD1 4.33Å; V193-L197 HydrophobicContact CG1-CD2 4.2Å; V193-L197 HydrophobicContact CG1-CG 4Å; V193-L197 WeakPolarHBondContact O-CG 3.48Å; V193-L197 PolarHBondContact O-N 3.42Å; V193-L197 VanDerWaalsContact O-N 3.17Å; N194-L197 PolarHBondContact O-N 2.67Å; L197-L200 HydrophobicContact CD2-CD1 4.36Å; L197-L200 PolarHBondContact O-N 2.93Å; L197-N201 PolarHBondContact O-N 3.07Å
198	K	87.5	Confident	84.3	Confident	120 Å²	120	66.6 Å²	66.6	52%	0.522	32%	0.315	S	S	.	.	H	α-helix	trans	-57.8	-47.9	171.8	-80	178.6	174.3	-171.9	0	111.9	W188 N194 P195 L196 L200 N201 A202	W188-K198 HydrophobicContact CH2-CB 4.07Å; W188-K198 HydrophobicContact CH2-CG 3.37Å; W188-K198 HydrophobicContact CZ2-CG 3.57Å; W188-K198 HydrophobicContact CZ3-CG 4.18Å; N194-K198 WeakPolarHBondContact O-CB 3.39Å; N194-K198 WeakPolarHBondContact O-CG 3.31Å; N194-K198 PolarHBondContact O-N 2.89Å; N194-K198 WeakPolarHBondContact OD1-CE 3.08Å; N194-K198 WeakPolarHBondContact OD1-CG 3.22Å; P195-K198 PolarHBondContact O-N 3.23Å; L196-K198 VanDerWaalsContact C-N 3.26Å; L196-K198 PolarHBondContact O-N 3.27Å; K198-L200 VanDerWaalsContact C-N 3.35Å; K198-N201 PolarHBondContact O-N 2.78Å; K198-A202 VanDerWaalsContact O-CB 3.28Å; K198-A202 WeakPolarHBondContact O-CB 3.2Å; K198-A202 PolarHBondContact O-N 2.78Å
199	V	89.1	Confident	83.8	Confident	58 Å²	58	68.5 Å²	68.5	35%	0.352	33%	0.331	S	S	.	.	H	α-helix	trans	-61	-45.7	176.4	175.2	0	0	0	0	110.3	I158 P195 L196 N201 A202 T203	I158-V199 HydrophobicContact CD1-CG1 4.32Å; I158-V199 HydrophobicContact CG2-CG1 3.75Å; P195-V199 WeakPolarHBondContact O-CG2 3.46Å; P195-V199 PolarHBondContact O-N 3.33Å; L196-V199 WeakPolarHBondContact O-CB 3.38Å; L196-V199 PolarHBondContact O-N 3Å; L196-V199 VanDerWaalsContact O-N 3.07Å; V199-N201 PolarHBondContact O-N 3.41Å; V199-A202 PolarHBondContact O-N 2.97Å; V199-T203 HydrophobicContact CG1-CG2 4.25Å; V199-T203 WeakPolarHBondContact O-CB 3.46Å; V199-T203 WeakPolarHBondContact O-CG2 3.45Å; V199-T203 PolarHBondContact O-N 3.37Å; V199-T203 PolarHBondContact O-OG1 3.49Å
200	L	90.7	Very high	83.8	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-58.7	-49	179.1	-63.5	-176.3	0	0	0	112.3	F151 C161 H162 H165 L196 L197 K198 T203 L204	F151-L200 HydrophobicContact CE2-CD1 4.15Å; F151-L200 HydrophobicContact CZ-CD1 4.08Å; C161-L200 HydrophobicContact CB-CD1 4.19Å; C161-L200 HydrophobicContact CB-CD2 4.04Å; H162-L200 HydrophobicContact CB-CD2 3.78Å; H165-L200 HydrophobicContact CB-CD1 4.33Å; L196-L200 HydrophobicContact CD1-CD2 4.25Å; L196-L200 HydrophobicContact CD1-CG 4.18Å; L196-L200 HydrophobicContact CG-CD1 4.2Å; L196-L200 HydrophobicContact CG-CG 4.23Å; L196-L200 WeakPolarHBondContact O-CG 3.11Å; L196-L200 PolarHBondContact O-N 3.41Å; L197-L200 HydrophobicContact CD2-CD1 4.36Å; L197-L200 PolarHBondContact O-N 2.93Å; K198-L200 VanDerWaalsContact C-N 3.35Å; L200-T203 WeakPolarHBondContact CA-OG1 3.4Å; L200-T203 PolarHBondContact O-N 3.19Å; L200-T203 PolarHBondContact O-OG1 3.27Å; L200-L204 PolarHBondContact O-N 3.39Å
201	N	89.6	Confident	84.2	Confident	11 Å²	11	68.9 Å²	68.9	6%	0.059	35%	0.345	C	S	.	.	H	α-helix	trans	-66.6	-38.6	178.3	-80.8	7.3	0	0	0	112.4	H165 F184 W188 L197 K198 V199 L204 Q205 L218 F221	H165-N201 PolarHBondContact NE2-OD1 2.88Å; F184-N201 WeakPolarHBondContact CE1-OD1 3.34Å; F184-N201 WeakPolarHBondContact CZ-OD1 3.38Å; W188-N201 HydrophobicContact CZ3-CB 4.46Å; L197-N201 PolarHBondContact O-N 3.07Å; K198-N201 PolarHBondContact O-N 2.78Å; V199-N201 PolarHBondContact O-N 3.41Å; N201-L204 PolarHBondContact O-N 3.39Å; N201-Q205 WeakPolarHBondContact O-CB 3.49Å; N201-Q205 PolarHBondContact O-N 2.84Å; N201-L218 HydrophobicContact CB-CD2 4.31Å; N201-F221 WeakPolarHBondContact ND2-CD1 3.4Å; N201-F221 WeakPolarHBondContact ND2-CE1 3.17Å
202	A	88.2	Confident	85	Confident	37 Å²	37	68.4 Å²	68.4	31%	0.306	35%	0.347	S	S	.	.	H	α-helix	trans	-62.2	-46.3	175	0	0	0	0	0	111	K198 V199 L204 Q205 E206	K198-A202 VanDerWaalsContact O-CB 3.28Å; K198-A202 WeakPolarHBondContact O-CB 3.2Å; K198-A202 PolarHBondContact O-N 2.78Å; V199-A202 PolarHBondContact O-N 2.97Å; A202-L204 VanDerWaalsContact C-N 3.32Å; A202-L204 PolarHBondContact O-N 3.33Å; A202-Q205 PolarHBondContact O-N 2.91Å; A202-Q205 VanDerWaalsContact O-N 3.14Å; A202-E206 WeakPolarHBondContact O-CB 3.35Å; A202-E206 WeakPolarHBondContact O-CG 3.01Å; A202-E206 PolarHBondContact O-N 2.93Å
203	T	88	Confident	85.7	Confident	21 Å²	21	61.4 Å²	61.4	13%	0.129	32%	0.322	C	S	.	.	H	α-helix	trans	-63.3	-35.2	177.2	50	0	0	0	0	113.1	H162 V199 L200 R207	H162-T203 PolarHBondContact CD2-OG1 3.05Å; V199-T203 HydrophobicContact CG1-CG2 4.25Å; V199-T203 WeakPolarHBondContact O-CB 3.46Å; V199-T203 WeakPolarHBondContact O-CG2 3.45Å; V199-T203 PolarHBondContact O-N 3.37Å; V199-T203 PolarHBondContact O-OG1 3.49Å; L200-T203 WeakPolarHBondContact CA-OG1 3.4Å; L200-T203 PolarHBondContact O-N 3.19Å; L200-T203 PolarHBondContact O-OG1 3.27Å; T203-R207 WeakPolarHBondContact O-CB 3.25Å; T203-R207 WeakPolarHBondContact O-CG 3.47Å; T203-R207 PolarHBondContact O-N 3.16Å; T203-R207 VanDerWaalsContact O-N 3.07Å
204	L	88.7	Confident	86.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.5	-47.1	171.9	-77.8	-173	0	0	0	111.5	H165 L166 V169 L200 N201 A202 Y208 V214	H165-L204 WeakPolarHBondContact CD2-CD1 3.46Å; H165-L204 WeakPolarHBondContact NE2-CD1 3.23Å; L166-L204 HydrophobicContact CB-CD2 4.07Å; L166-L204 HydrophobicContact CD1-CD2 3.47Å; L166-L204 VanDerWaalsContact CD1-CD2 3.47Å; L166-L204 HydrophobicContact CG-CD2 4.37Å; V169-L204 HydrophobicContact CG2-CD1 4.12Å; L200-L204 PolarHBondContact O-N 3.39Å; N201-L204 PolarHBondContact O-N 3.39Å; A202-L204 VanDerWaalsContact C-N 3.32Å; A202-L204 PolarHBondContact O-N 3.33Å; L204-Y208 HydrophobicContact CD2-CD2 4.06Å; L204-Y208 HydrophobicContact CD2-CE2 4.39Å; L204-Y208 WeakPolarHBondContact O-CB 3.46Å; L204-Y208 PolarHBondContact O-N 2.98Å; L204-V214 HydrophobicContact CB-CG1 4.04Å
205	Q	87.2	Confident	86.8	Confident	92 Å²	92	63.5 Å²	63.5	43%	0.43	33%	0.333	S	S	.	.	H	α-helix	trans	-64.6	-39.7	-178.9	-171.2	175.6	-16.4	0	0	111.7	N201 A202 V209 L218	N201-Q205 WeakPolarHBondContact O-CB 3.49Å; N201-Q205 PolarHBondContact O-N 2.84Å; A202-Q205 PolarHBondContact O-N 2.91Å; A202-Q205 VanDerWaalsContact O-N 3.14Å; Q205-V209 WeakPolarHBondContact O-CG2 3.35Å; Q205-L218 HydrophobicContact CB-CD1 4Å; Q205-L218 HydrophobicContact CG-CD1 4.35Å
206	E	86.6	Confident	87	Confident	144 Å²	144	65.4 Å²	65.4	67%	0.673	33%	0.329	S	S	*	.	H	α-helix	trans	-73.2	-41.7	-179.9	-72.8	170.9	-170.6	0	0	113	A202	A202-E206 WeakPolarHBondContact O-CB 3.35Å; A202-E206 WeakPolarHBondContact O-CG 3.01Å; A202-E206 PolarHBondContact O-N 2.93Å
207	R	86.1	Confident	87.2	Confident	165 Å²	165	64.4 Å²	64.4	62%	0.623	32%	0.324	S	S	*	.	H	α-helix	trans	-89.9	-20.4	-173.2	-64.6	-175.1	-179.7	-169.8	0.9	114.3	T203	T203-R207 WeakPolarHBondContact O-CB 3.25Å; T203-R207 WeakPolarHBondContact O-CG 3.47Å; T203-R207 PolarHBondContact O-N 3.16Å; T203-R207 VanDerWaalsContact O-N 3.07Å
208	Y	88.1	Confident	87.3	Confident	66 Å²	66	64.9 Å²	64.9	26%	0.259	33%	0.326	S	S	.	.			trans	-131.9	37.7	-172.4	-56.9	-78.5	0	0	0	112.8	L166 K170 L204 N210 D211 V214	L166-Y208 HydrophobicContact CD1-CD2 3.8Å; L166-Y208 HydrophobicContact CD1-CE1 4.36Å; L166-Y208 HydrophobicContact CD1-CE2 3.51Å; L166-Y208 HydrophobicContact CD1-CG 4.34Å; L166-Y208 HydrophobicContact CD2-CE2 3.79Å; L166-Y208 VanDerWaalsContact CD2-OH 3.23Å; L166-Y208 WeakPolarHBondContact CD2-OH 3.35Å; L166-Y208 HydrophobicContact CG-CE2 4.3Å; K170-Y208 VanDerWaalsContact NZ-CD1 3.27Å; L204-Y208 HydrophobicContact CD2-CD2 4.06Å; L204-Y208 HydrophobicContact CD2-CE2 4.39Å; L204-Y208 WeakPolarHBondContact O-CB 3.46Å; L204-Y208 PolarHBondContact O-N 2.98Å; Y208-N210 PolarHBondContact O-N 3.4Å; Y208-N210 VanDerWaalsContact O-N 3.08Å; Y208-D211 WeakPolarHBondContact O-CB 3.4Å; Y208-D211 PolarHBondContact O-N 2.91Å; Y208-V214 HydrophobicContact CG-CG2 4.47Å
209	V	76.9	Confident	87.3	Confident	83 Å²	83	62.8 Å²	62.8	50%	0.503	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-37.6	-179.5	-177.3	0	0	0	0	113	Q205 N215	Q205-V209 WeakPolarHBondContact O-CG2 3.35Å; V209-N215 PolarHBondContact O-ND2 2.87Å; V209-N215 PolarHBondContact O-OD1 3.16Å
210	N	83.1	Confident	87.2	Confident	155 Å²	155	63 Å²	63	83%	0.829	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	2.2	-174.5	-62.3	-22	0	0	0	113.8	Y208	Y208-N210 PolarHBondContact O-N 3.4Å; Y208-N210 VanDerWaalsContact O-N 3.08Å
211	D	87.7	Confident	87.1	Confident	44 Å²	44	63.4 Å²	63.4	24%	0.235	33%	0.328	C	S	.	.			trans	-85.4	118.4	-176.3	-167.9	-60.9	0	0	0	111	K170 Y208 A213 V214 N215	K170-D211 WeakPolarHBondContact CE-OD2 3.23Å; K170-D211 IonicContact NZ-OD2 3.89Å; K170-D211 PolarHBondContact NZ-OD2 2.82Å; Y208-D211 WeakPolarHBondContact O-CB 3.4Å; Y208-D211 PolarHBondContact O-N 2.91Å; D211-A213 VanDerWaalsContact C-N 3.31Å; D211-A213 PolarHBondContact O-N 2.8Å; D211-A213 WeakPolarHBondContact OD1-CB 3.41Å; D211-A213 PolarHBondContact OD1-N 2.81Å; D211-V214 HydrophobicContact CB-CB 4.06Å; D211-V214 HydrophobicContact CB-CG2 3.91Å; D211-V214 PolarHBondContact O-N 2.83Å; D211-V214 PolarHBondContact OD1-N 3.08Å; D211-N215 PolarHBondContact O-N 3.12Å; D211-N215 PolarHBondContact O-ND2 2.84Å
212	V	87	Confident	86.9	Confident	121 Å²	121	69 Å²	69	73%	0.733	35%	0.348	S	S	*	.	H	α-helix	trans	-59.9	-40.2	-175.3	-179.6	0	0	0	0	111.9	R216	V212-R216 WeakPolarHBondContact O-CB 3.38Å; V212-R216 PolarHBondContact O-N 3.24Å
213	A	85.1	Confident	86.7	Confident	32 Å²	32	69.8 Å²	69.8	26%	0.264	35%	0.352	S	S	.	.	H	α-helix	trans	-69.4	-40.1	-178.4	0	0	0	0	0	111.4	D211 F217	D211-A213 VanDerWaalsContact C-N 3.31Å; D211-A213 PolarHBondContact O-N 2.8Å; D211-A213 WeakPolarHBondContact OD1-CB 3.41Å; D211-A213 PolarHBondContact OD1-N 2.81Å; A213-F217 PolarHBondContact O-N 2.89Å; A213-F217 VanDerWaalsContact O-N 3.07Å
214	V	88.1	Confident	86.3	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-65.7	-45.2	176.6	178.2	0	0	0	0	110.9	V169 K170 L204 Y208 D211 R216 F217 L218	V169-V214 HydrophobicContact CG1-CB 4.41Å; V169-V214 HydrophobicContact CG1-CG2 3.99Å; K170-V214 HydrophobicContact CG-CG2 4.46Å; L204-V214 HydrophobicContact CB-CG1 4.04Å; Y208-V214 HydrophobicContact CG-CG2 4.47Å; D211-V214 HydrophobicContact CB-CB 4.06Å; D211-V214 HydrophobicContact CB-CG2 3.91Å; D211-V214 PolarHBondContact O-N 2.83Å; D211-V214 PolarHBondContact OD1-N 3.08Å; V214-R216 PolarHBondContact O-N 3.31Å; V214-F217 PolarHBondContact O-N 3.4Å; V214-L218 HydrophobicContact CG1-CD1 3.92Å; V214-L218 HydrophobicContact CG1-CG 4.32Å; V214-L218 WeakPolarHBondContact O-CG 3.45Å; V214-L218 PolarHBondContact O-N 3.19Å
215	N	87.5	Confident	85.9	Confident	73 Å²	73	72.9 Å²	72.9	39%	0.39	37%	0.37	S	S	.	.	H	α-helix	trans	-62.8	-41.1	178.2	-76.8	-33.4	0	0	0	112.3	V209 D211 L218 S219	V209-N215 PolarHBondContact O-ND2 2.87Å; V209-N215 PolarHBondContact O-OD1 3.16Å; D211-N215 PolarHBondContact O-N 3.12Å; D211-N215 PolarHBondContact O-ND2 2.84Å; N215-L218 PolarHBondContact O-N 3.2Å; N215-S219 WeakPolarHBondContact O-CB 3.44Å; N215-S219 PolarHBondContact O-N 2.94Å
216	R	87.9	Confident	84.9	Confident	130 Å²	130	73.1 Å²	73.1	49%	0.491	37%	0.374	S	S	.	.	H	α-helix	trans	-59.4	-49.8	174.2	-173.5	176.6	-178.4	179.4	-0.5	111.3	E174 V212 V214 L218 S219 D220	E174-R216 IonicContact OE1-CZ 3.9Å; E174-R216 IonicContact OE1-NH1 2.69Å; E174-R216 PolarHBondContact OE1-NH1 2.85Å; E174-R216 IonicContact OE1-NH2 3.16Å; V212-R216 WeakPolarHBondContact O-CB 3.38Å; V212-R216 PolarHBondContact O-N 3.24Å; V214-R216 PolarHBondContact O-N 3.31Å; R216-L218 PolarHBondContact O-N 3.42Å; R216-S219 PolarHBondContact O-N 2.86Å; R216-D220 VanDerWaalsContact O-CG 3.32Å; R216-D220 PolarHBondContact O-N 3.42Å
217	F	90.8	Very high	83.4	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-59	-47.1	177.3	172.8	-95.9	0	0	0	112.7	H165 V169 L177 Y180 C181 F184 A213 V214 S219 D220 F221	H165-F217 AromaticContact CE1-CE1 3.71Å; H165-F217 AromaticContact CE1-CZ 3.64Å; H165-F217 AromaticContact NE2-CE1 3.89Å; V169-F217 HydrophobicContact CG1-CB 3.76Å; V169-F217 HydrophobicContact CG1-CD1 4.35Å; V169-F217 HydrophobicContact CG1-CG 4.05Å; V169-F217 HydrophobicContact CG2-CB 4.41Å; V169-F217 HydrophobicContact CG2-CD1 3.78Å; V169-F217 HydrophobicContact CG2-CD2 3.99Å; V169-F217 HydrophobicContact CG2-CE1 4.01Å; V169-F217 HydrophobicContact CG2-CE2 4.2Å; V169-F217 HydrophobicContact CG2-CG 3.78Å; V169-F217 HydrophobicContact CG2-CZ 4.23Å; L177-F217 HydrophobicContact CD1-CD2 4.1Å; Y180-F217 AromaticContact CD1-CE2 3.94Å; Y180-F217 HydrophobicContact CD1-CE2 3.94Å; Y180-F217 HydrophobicContact CE1-CE2 4.14Å; Y180-F217 HydrophobicContact CE1-CZ 4.39Å; C181-F217 HydrophobicContact CB-CD2 4.22Å; C181-F217 HydrophobicContact CB-CE2 3.94Å; F184-F217 HydrophobicContact CB-CZ 4.47Å; F184-F217 HydrophobicContact CD1-CZ 4.2Å; F184-F217 HydrophobicContact CG-CZ 4.24Å; A213-F217 PolarHBondContact O-N 2.89Å; A213-F217 VanDerWaalsContact O-N 3.07Å; V214-F217 PolarHBondContact O-N 3.4Å; F217-S219 VanDerWaalsContact C-N 3.32Å; F217-S219 PolarHBondContact O-N 3.2Å; F217-D220 PolarHBondContact O-N 3.05Å; F217-F221 WeakPolarHBondContact O-CB 3.49Å; F217-F221 PolarHBondContact O-N 3.46Å
218	L	89.9	Confident	81.5	Confident	10 Å²	10	70.3 Å²	70.3	5%	0.052	37%	0.372	C	S	.	.	H	α-helix	trans	-65.8	-34.9	-179.5	-70.9	176	0	0	0	112.3	N201 Q205 V214 N215 R216 R222	N201-L218 HydrophobicContact CB-CD2 4.31Å; Q205-L218 HydrophobicContact CB-CD1 4Å; Q205-L218 HydrophobicContact CG-CD1 4.35Å; V214-L218 HydrophobicContact CG1-CD1 3.92Å; V214-L218 HydrophobicContact CG1-CG 4.32Å; V214-L218 WeakPolarHBondContact O-CG 3.45Å; V214-L218 PolarHBondContact O-N 3.19Å; N215-L218 PolarHBondContact O-N 3.2Å; R216-L218 PolarHBondContact O-N 3.42Å; L218-R222 WeakPolarHBondContact O-CB 3.46Å; L218-R222 VanDerWaalsContact O-CG 3.24Å; L218-R222 WeakPolarHBondContact O-CG 3.35Å; L218-R222 PolarHBondContact O-N 3.43Å
219	S	87.4	Confident	79	Confident	76 Å²	76	71.7 Å²	71.7	53%	0.531	39%	0.39	S	S	.	.	H	α-helix	trans	-63.9	-53.2	173.9	-178.6	0	0	0	0	111.5	N215 R216 F217 F221 R222 S223	N215-S219 WeakPolarHBondContact O-CB 3.44Å; N215-S219 PolarHBondContact O-N 2.94Å; R216-S219 PolarHBondContact O-N 2.86Å; F217-S219 VanDerWaalsContact C-N 3.32Å; F217-S219 PolarHBondContact O-N 3.2Å; S219-F221 PolarHBondContact O-N 3.24Å; S219-R222 PolarHBondContact O-N 3.36Å; S219-R222 VanDerWaalsContact O-N 3.14Å; S219-S223 PolarHBondContact O-N 3Å; S219-S223 PolarHBondContact O-OG 3.01Å
220	D	86.2	Confident	76.9	Confident	62 Å²	62	73 Å²	73	33%	0.332	40%	0.395	S	S	.	.	H	α-helix	trans	-62	-34.6	179.5	-66.7	-12.8	0	0	0	112.1	R216 F217 S223 S224	R216-D220 VanDerWaalsContact O-CG 3.32Å; R216-D220 PolarHBondContact O-N 3.42Å; F217-D220 PolarHBondContact O-N 3.05Å; D220-S223 PolarHBondContact O-OG 3.44Å; D220-S224 WeakPolarHBondContact O-CB 3.27Å; D220-S224 PolarHBondContact O-N 2.97Å; D220-S224 PolarHBondContact O-OG 2.96Å
221	F	88.6	Confident	74.5	Confident	9 Å²	9	73.8 Å²	73.8	4%	0.039	40%	0.399	C	S	.	.	H	α-helix	trans	-68.1	-42.4	175.8	177.4	-103.6	0	0	0	112.2	F184 C185 W188 N201 F217 S219 S224 I225	F184-F221 AromaticContact CD1-CD2 3.94Å; F184-F221 HydrophobicContact CD1-CD2 3.94Å; F184-F221 AromaticContact CD1-CE2 3.48Å; F184-F221 HydrophobicContact CD1-CE2 3.48Å; F184-F221 VanDerWaalsContact CD1-CE2 3.48Å; F184-F221 HydrophobicContact CD1-CZ 4.03Å; F184-F221 HydrophobicContact CE1-CE2 4.03Å; F184-F221 HydrophobicContact CE1-CZ 4.11Å; C185-F221 WeakPolarHBondContact SG-CD2 3.42Å; W188-F221 HydrophobicContact CB-CE2 4.33Å; W188-F221 HydrophobicContact CB-CZ 4.19Å; W188-F221 HydrophobicContact CD2-CE1 4.33Å; W188-F221 HydrophobicContact CD2-CE2 4.48Å; W188-F221 AromaticContact CD2-CZ 3.55Å; W188-F221 HydrophobicContact CD2-CZ 3.55Å; W188-F221 HydrophobicContact CE3-CE1 4.2Å; W188-F221 HydrophobicContact CE3-CE2 4.37Å; W188-F221 AromaticContact CE3-CZ 3.46Å; W188-F221 HydrophobicContact CE3-CZ 3.46Å; W188-F221 VanDerWaalsContact CE3-CZ 3.46Å; W188-F221 HydrophobicContact CG-CE2 4.46Å; W188-F221 AromaticContact CG-CZ 3.86Å; W188-F221 HydrophobicContact CG-CZ 3.86Å; W188-F221 HydrophobicContact CH2-CE1 4.3Å; W188-F221 HydrophobicContact CH2-CZ 4.34Å; W188-F221 HydrophobicContact CZ2-CE1 4.47Å; W188-F221 HydrophobicContact CZ2-CZ 4.45Å; W188-F221 HydrophobicContact CZ3-CE1 4.15Å; W188-F221 AromaticContact CZ3-CZ 3.86Å; W188-F221 HydrophobicContact CZ3-CZ 3.86Å; N201-F221 WeakPolarHBondContact ND2-CD1 3.4Å; N201-F221 WeakPolarHBondContact ND2-CE1 3.17Å; F217-F221 WeakPolarHBondContact O-CB 3.49Å; F217-F221 PolarHBondContact O-N 3.46Å; S219-F221 PolarHBondContact O-N 3.24Å; F221-S224 PolarHBondContact O-N 2.92Å; F221-I225 HydrophobicContact CD1-CD1 4.06Å; F221-I225 HydrophobicContact CD2-CD1 4.26Å; F221-I225 HydrophobicContact CE1-CD1 3.36Å; F221-I225 HydrophobicContact CE2-CD1 3.58Å; F221-I225 HydrophobicContact CE2-CG1 4.41Å; F221-I225 HydrophobicContact CG-CD1 4.47Å; F221-I225 HydrophobicContact CZ-CD1 3.11Å; F221-I225 HydrophobicContact CZ-CG1 4.34Å; F221-I225 PolarHBondContact O-N 3.42Å
222	R	86.8	Confident	71.8	Confident	128 Å²	128	74.5 Å²	74.5	48%	0.483	42%	0.416	S	S	.	.	H	α-helix	trans	-67.2	-41.5	179.1	-77.5	174.4	-177	-175	4.7	112	L218 S219 I225 N226	L218-R222 WeakPolarHBondContact O-CB 3.46Å; L218-R222 VanDerWaalsContact O-CG 3.24Å; L218-R222 WeakPolarHBondContact O-CG 3.35Å; L218-R222 PolarHBondContact O-N 3.43Å; S219-R222 PolarHBondContact O-N 3.36Å; S219-R222 VanDerWaalsContact O-N 3.14Å; R222-I225 PolarHBondContact O-N 3.34Å; R222-N226 VanDerWaalsContact O-CG 3.29Å; R222-N226 PolarHBondContact O-N 3.34Å; R222-N226 PolarHBondContact O-ND2 3.43Å
223	S	82.7	Confident	69.1	Low	55 Å²	55	75 Å²	75	39%	0.385	41%	0.413	S	S	.	.	H	α-helix	trans	-60.8	-46.8	175.1	56.1	0	0	0	0	111.3	S219 D220 I225 N226 D227	S219-S223 PolarHBondContact O-N 3Å; S219-S223 PolarHBondContact O-OG 3.01Å; D220-S223 PolarHBondContact O-OG 3.44Å; S223-I225 PolarHBondContact O-N 2.94Å; S223-I225 VanDerWaalsContact O-N 3.12Å; S223-N226 PolarHBondContact O-N 3.18Å; S223-D227 PolarHBondContact O-N 3.26Å; S223-D227 VanDerWaalsContact O-N 3.11Å
224	S	80.4	Confident	66.5	Low	41 Å²	41	82.6 Å²	82.6	29%	0.287	44%	0.441	S	S	.	.	H	α-helix	trans	-62.4	-21.9	-178.9	-61.9	0	0	0	0	115.3	R189 D220 F221	R189-S224 PolarHBondContact NH2-O 3.42Å; D220-S224 WeakPolarHBondContact O-CB 3.27Å; D220-S224 PolarHBondContact O-N 2.97Å; D220-S224 PolarHBondContact O-OG 2.96Å; F221-S224 PolarHBondContact O-N 2.92Å
225	I	79.6	Confident	63.8	Low	44 Å²	44	91.7 Å²	91.7	23%	0.226	48%	0.48	C	S	.	.	H	α-helix	trans	-89.4	-33	175.8	-70.8	173.5	0	0	0	111.4	W188 F221 R222 S223	W188-I225 HydrophobicContact CD2-CD1 4.37Å; W188-I225 HydrophobicContact CG-CD1 4Å; F221-I225 HydrophobicContact CD1-CD1 4.06Å; F221-I225 HydrophobicContact CD2-CD1 4.26Å; F221-I225 HydrophobicContact CE1-CD1 3.36Å; F221-I225 HydrophobicContact CE2-CD1 3.58Å; F221-I225 HydrophobicContact CE2-CG1 4.41Å; F221-I225 HydrophobicContact CG-CD1 4.47Å; F221-I225 HydrophobicContact CZ-CD1 3.11Å; F221-I225 HydrophobicContact CZ-CG1 4.34Å; F221-I225 PolarHBondContact O-N 3.42Å; R222-I225 PolarHBondContact O-N 3.34Å; S223-I225 PolarHBondContact O-N 2.94Å; S223-I225 VanDerWaalsContact O-N 3.12Å
226	N	66.2	Low	61.3	Low	98 Å²	98	94.5 Å²	94.5	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-81.8	-28.4	-174.8	-69.8	-16.5	0	0	0	113.2	R222 S223 E228 C229	R222-N226 VanDerWaalsContact O-CG 3.29Å; R222-N226 PolarHBondContact O-N 3.34Å; R222-N226 PolarHBondContact O-ND2 3.43Å; S223-N226 PolarHBondContact O-N 3.18Å; N226-E228 PolarHBondContact O-N 3.44Å; N226-E228 VanDerWaalsContact O-N 3.14Å; N226-C229 PolarHBondContact O-N 2.75Å
227	D	55.8	Low	58.3	Low	125 Å²	125	93.5 Å²	93.5	67%	0.668	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-19	-177.6	-78.8	-20.7	0	0	0	114.6	S223	S223-D227 PolarHBondContact O-N 3.26Å; S223-D227 VanDerWaalsContact O-N 3.11Å
228	E	46.8	Very low	55.6	Low	125 Å²	125	101.7 Å²	101.7	58%	0.584	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-9.6	175.2	-83.4	178.3	-165.5	0	0	114.2	R189 N226	R189-E228 VanDerWaalsContact CZ-CD 3.45Å; R189-E228 IonicContact CZ-OE1 2.8Å; R189-E228 IonicContact CZ-OE2 3.42Å; R189-E228 IonicContact NE-OE2 3.08Å; R189-E228 IonicContact NH1-OE1 3.34Å; R189-E228 PolarHBondContact NH1-OE1 2.91Å; R189-E228 IonicContact NH1-OE2 2.92Å; R189-E228 PolarHBondContact NH1-OE2 3.11Å; R189-E228 IonicContact NH2-OE1 2.77Å; R189-E228 PolarHBondContact NH2-OE1 3.21Å; R189-E228 IonicContact NH2-OE2 3.22Å; R189-E228 PolarHBondContact NH2-OE2 3.36Å; N226-E228 PolarHBondContact O-N 3.44Å; N226-E228 VanDerWaalsContact O-N 3.14Å
229	C	35.1	Very low	52.7	Low	94 Å²	94	109.4 Å²	109.4	64%	0.635	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-13.3	178.3	-83.8	0	0	0	0	113.6	N226	N226-C229 PolarHBondContact O-N 2.75Å
230	N	32.5	Very low	49.8	Very low	112 Å²	112	111.1 Å²	111.1	60%	0.599	60%	0.603	S	S	*	*	S	Bend	trans	-95.8	-8.6	-175.3	-77.9	-20.2	0	0	0	115.1	G232	N230-G232 VanDerWaalsContact C-N 3.29Å
231	D	32.8	Very low	47	Very low	170 Å²	170	113.2 Å²	113.2	91%	0.909	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	8	170.3	-96.3	-16	0	0	0	113.6
232	G	30.6	Very low	44	Very low	59 Å²	59	117.7 Å²	117.7	61%	0.608	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	10.4	-179.4	0	0	0	0	0	115.6	N230 K234	N230-G232 VanDerWaalsContact C-N 3.29Å; G232-K234 VanDerWaalsContact C-N 3.27Å; G232-K234 PolarHBondContact O-N 3.18Å
233	I	30.3	Very low	41.1	Very low	131 Å²	131	123.6 Å²	123.6	67%	0.672	68%	0.678	S	S	*	*			trans	-72.2	81.1	-178.5	-54.2	174	0	0	0	109.9
234	K	29.4	Very low	38.2	Very low	193 Å²	193	125.9 Å²	125.9	84%	0.839	69%	0.694	S	S	*	*			trans	176.1	83.6	151.4	-97	163.7	-170.6	-177.8	0	108.8	G232	G232-K234 VanDerWaalsContact C-N 3.27Å; G232-K234 PolarHBondContact O-N 3.18Å
235	K	33.1	Very low	35.6	Very low	190 Å²	190	131.3 Å²	131.3	83%	0.826	72%	0.718	S	S	*	*	S	Bend	trans	167.8	93.8	131.5	-89.3	163.9	-176.7	-176.1	0	111.5
236	T	33.7	Very low	33.1	Very low	133 Å²	133	135.8 Å²	135.8	82%	0.816	74%	0.741	S	S	*	*			trans	52.5	113.5	132.3	50.3	0	0	0	0	119.5
237	S	25.5	Very low	31.2	Very low	108 Å²	108	136.9 Å²	136.9	76%	0.755	75%	0.751	S	S	*	*			trans	-47.3	141.8	156.7	56.9	0	0	0	0	113.5
238	L	33.6	Very low	29.9	Very low	173 Å²	173	140.7 Å²	140.7	91%	0.906	76%	0.762	S	S	*	*			trans	-159.9	136.4	131.3	-108	141.5	0	0	0	109.6
239	Q	30.4	Very low	29.2	Very low	172 Å²	172	141 Å²	141	80%	0.804	77%	0.768	S	S	*	*			trans	-72.2	155.4	-167.6	-76.4	162.4	-42.5	0	0	113.6
240	S	26.3	Very low	29.3	Very low	111 Å²	111	139.3 Å²	139.3	78%	0.776	75%	0.752	S	S	*	*			trans	10.4	126.8	147.3	58.6	0	0	0	0	119.2
241	S	26.9	Very low	29.4	Very low	106 Å²	106	137.8 Å²	137.8	74%	0.741	75%	0.748	S	S	*	*				177.9	132.3	113.6	-165	0	0	0	0	111
242	S	26	Very low	30	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	73%	0.729	S	S	*	*			trans	56.8	118.6	141.6	-53.3	0	0	0	0	122.1
243	R	24.7	Very low	30.7	Very low	252 Å²	252	135.4 Å²	135.4	95%	0.951	72%	0.721	S	S	*	*			trans	24.5	103.7	135.3	-67.3	178.7	175.4	176.8	-1.5	116.9
244	S	23.5	Very low	31.4	Very low	104 Å²	104	130.7 Å²	130.7	73%	0.727	70%	0.697	S	S	*	*			trans	-173.5	131.7	137.9	179.2	0	0	0	0	110.3	I246	S244-I246 PolarHBondContact O-N 3.34Å
245	I	24.5	Very low	31.9	Very low	155 Å²	155	126.5 Å²	126.5	80%	0.795	69%	0.692	S	S	*	*			trans	-25.7	123.3	153.2	-60.6	148.9	0	0	0	110.9
246	I	27.2	Very low	32.1	Very low	138 Å²	138	122.6 Å²	122.6	71%	0.708	68%	0.68	S	S	*	*			trans	-171.9	115.9	148.3	-87.1	140.9	0	0	0	107.7	S244 K248	S244-I246 PolarHBondContact O-N 3.34Å; I246-K248 PolarHBondContact O-N 2.84Å
247	T	25.7	Very low	32.2	Very low	120 Å²	120	123.7 Å²	123.7	74%	0.736	68%	0.681	S	S	*	*			trans	-38.5	114.6	161.7	44.1	0	0	0	0	112.6
248	K	30.2	Very low	32.6	Very low	205 Å²	205	128.5 Å²	128.5	89%	0.891	68%	0.682	S	S	*	*			trans	-97.3	105.6	168	-76.5	-171.1	177.7	-178.9	0	110	I246	I246-K248 PolarHBondContact O-N 2.84Å
249	N	31.8	Very low	32.8	Very low	132 Å²	132	122.4 Å²	122.4	71%	0.706	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-46.5	137	175.8	-61.9	-27.2	0	0	0	112.3	P251	N249-P251 WeakPolarHBondContact O-CD 3.41Å
250	I	36.3	Very low	33.6	Very low	59 Å²	59	120.9 Å²	120.9	30%	0.303	66%	0.657	S	S	.	*	P	Polyproline II helix	trans	-63.4	124.5	154.6	-62.6	168.3	0	0	0	105.3	T252 L296	I250-T252 PolarHBondContact O-N 3.32Å; I250-L296 HydrophobicContact CG2-CD1 3.72Å
251	P	34.7	Very low	34.8	Very low	80 Å²	80	119.9 Å²	119.9	52%	0.519	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-56.6	124.2	172.5	-20.8	32	0	0	0	108.6	N249 Q253	N249-P251 WeakPolarHBondContact O-CD 3.41Å; P251-Q253 WeakPolarHBondContact CB-O 3.44Å; P251-Q253 PolarHBondContact O-N 3.45Å
252	T	45.6	Very low	36.2	Very low	83 Å²	83	115.6 Å²	115.6	51%	0.509	62%	0.615	S	S	.	*	S	Bend	trans	-60.3	-13.3	175.9	28.6	0	0	0	0	112.7	I250	I250-T252 PolarHBondContact O-N 3.32Å
253	Q	44.6	Very low	38	Very low	95 Å²	95	114.2 Å²	114.2	44%	0.444	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.2	123.1	167.3	-62.4	-169.3	1.2	0	0	109.7	P251	P251-Q253 WeakPolarHBondContact CB-O 3.44Å; P251-Q253 PolarHBondContact O-N 3.45Å
254	I	45.6	Very low	40.7	Very low	32 Å²	32	102.8 Å²	102.8	16%	0.164	56%	0.56	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.3	100.5	170.9	-58.6	174.5	0	0	0	106.2	L256 L296	I254-L256 HydrophobicContact CG2-CD1 3.55Å; I254-L296 HydrophobicContact CD1-CD1 4.35Å
255	S	39.2	Very low	43.9	Very low	106 Å²	106	98 Å²	98	74%	0.741	53%	0.526	S	S	*	.			trans	-104.5	103.5	165.7	55.3	0	0	0	0	108.3
256	L	37.3	Very low	47.2	Very low	108 Å²	108	90.9 Å²	90.9	57%	0.565	49%	0.489	S	S	*	.			trans	-113.3	123	168.1	-95.5	107.8	0	0	0	108.3	I254	I254-L256 HydrophobicContact CG2-CD1 3.55Å
257	N	36.6	Very low	50.4	Low	155 Å²	155	84.3 Å²	84.3	83%	0.829	46%	0.455	S	S	*	.			trans	29.4	98.5	168.2	-66.6	-9.4	0	0	0	116.1	S259	N257-S259 PolarHBondContact O-N 2.9Å; N257-S259 VanDerWaalsContact O-N 3.1Å
258	R	34.1	Very low	53.7	Low	209 Å²	209	78.6 Å²	78.6	79%	0.789	42%	0.42	S	S	*	.			trans	-46.2	114.4	175.1	-80.6	-177.3	179	-156.7	3.1	111.5	D263	R258-D263 WeakPolarHBondContact CD-OD1 3.38Å; R258-D263 IonicContact CZ-OD1 3.81Å; R258-D263 IonicContact CZ-OD2 2.89Å; R258-D263 IonicContact NE-OD1 3.42Å; R258-D263 PolarHBondContact NE-OD1 3.41Å; R258-D263 VanDerWaalsContact NE-OD1 3.16Å; R258-D263 VanDerWaalsContact NH1-CG 3.27Å; R258-D263 IonicContact NH1-OD1 3.75Å; R258-D263 PolarHBondContact NH1-OD1 3.42Å; R258-D263 IonicContact NH1-OD2 3.28Å; R258-D263 PolarHBondContact NH1-OD2 3.09Å; R258-D263 IonicContact NH2-OD1 2.8Å
259	S	38.9	Very low	56.7	Low	46 Å²	46	68.8 Å²	68.8	32%	0.322	38%	0.378	S	S	.	.			trans	-79.5	145.9	152.1	71.7	0	0	0	0	107.8	N257 I261 G262 E290	N257-S259 PolarHBondContact O-N 2.9Å; N257-S259 VanDerWaalsContact O-N 3.1Å; S259-I261 PolarHBondContact O-N 3.41Å; S259-G262 PolarHBondContact O-N 2.91Å; S259-E290 PolarHBondContact OG-O 3.48Å
260	T	45.7	Very low	59.6	Low	140 Å²	140	62.5 Å²	62.5	86%	0.859	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-14.3	-178.2	46.8	0	0	0	0	114.4
261	I	51.2	Low	62	Low	90 Å²	90	60.5 Å²	60.5	46%	0.462	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-29	178.4	-63.3	171	0	0	0	111.7	S259 D263 I265	S259-I261 PolarHBondContact O-N 3.41Å; I261-D263 VanDerWaalsContact C-N 3.33Å; I261-D263 PolarHBondContact O-N 2.82Å; I261-I265 HydrophobicContact CG2-CD1 4.46Å; I261-I265 WeakPolarHBondContact O-CD1 3.4Å
262	G	56.7	Low	64	Low	16 Å²	16	58.1 Å²	58.1	17%	0.165	32%	0.316	C	S	.	.			trans	-80.7	-7.3	-169.8	0	0	0	0	0	115.6	S259 G264 I265 I291	S259-G262 PolarHBondContact O-N 2.91Å; G262-G264 PolarHBondContact O-N 2.88Å; G262-G264 VanDerWaalsContact O-N 3.1Å; G262-I265 PolarHBondContact O-N 2.7Å; G262-I291 VanDerWaalsContact CA-O 3.27Å; G262-I291 WeakPolarHBondContact CA-O 3.38Å
263	D	64.9	Low	65.1	Low	74 Å²	74	57.4 Å²	57.4	40%	0.396	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	113.2	175.9	-80.7	-4.6	0	0	0	109.5	R258 I261 R529	R258-D263 WeakPolarHBondContact CD-OD1 3.38Å; R258-D263 IonicContact CZ-OD1 3.81Å; R258-D263 IonicContact CZ-OD2 2.89Å; R258-D263 IonicContact NE-OD1 3.42Å; R258-D263 PolarHBondContact NE-OD1 3.41Å; R258-D263 VanDerWaalsContact NE-OD1 3.16Å; R258-D263 VanDerWaalsContact NH1-CG 3.27Å; R258-D263 IonicContact NH1-OD1 3.75Å; R258-D263 PolarHBondContact NH1-OD1 3.42Å; R258-D263 IonicContact NH1-OD2 3.28Å; R258-D263 PolarHBondContact NH1-OD2 3.09Å; R258-D263 IonicContact NH2-OD1 2.8Å; I261-D263 VanDerWaalsContact C-N 3.33Å; I261-D263 PolarHBondContact O-N 2.82Å; D263-R529 PolarHBondContact O-NH2 3.02Å
264	G	81.6	Confident	66.3	Low	12 Å²	12	54.6 Å²	54.6	12%	0.124	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	87	20.5	176.7	0	0	0	0	0	117.6	G262 E328 S329	G262-G264 PolarHBondContact O-N 2.88Å; G262-G264 VanDerWaalsContact O-N 3.1Å; G264-E328 WeakPolarHBondContact CA-OE2 3.32Å; G264-S329 PolarHBondContact O-N 3.2Å
265	I	90	Very high	67.3	Low	4 Å²	4	56.2 Å²	56.2	2%	0.021	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.7	173.8	-60.5	167.6	0	0	0	109.5	I261 G262 L267 G292 Q293 Y331 I525	I261-I265 HydrophobicContact CG2-CD1 4.46Å; I261-I265 WeakPolarHBondContact O-CD1 3.4Å; G262-I265 PolarHBondContact O-N 2.7Å; I265-L267 HydrophobicContact CG2-CD2 3.81Å; I265-L267 HydrophobicContact CG2-CG 4.36Å; I265-G292 CarbonylContact O-C 3.59Å; I265-G292 WeakPolarHBondContact O-CA 3.34Å; I265-Q293 PolarHBondContact O-N 3.01Å; I265-Y331 HydrophobicContact CG2-CD2 4.01Å; I265-Y331 HydrophobicContact CG2-CE2 4.36Å; I265-I525 HydrophobicContact CD1-CG2 3.85Å
266	I	92.6	Very high	68.5	Low	4 Å²	4	57.5 Å²	57.5	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125	177	-60.2	171	0	0	0	109.2	Q293 Y325 E328 S329 I330 Y331	I266-Q293 WeakPolarHBondContact CA-O 3.4Å; I266-Y325 HydrophobicContact CD1-CD1 3.3Å; I266-Y325 HydrophobicContact CD1-CD2 3.33Å; I266-Y325 HydrophobicContact CD1-CE1 3.76Å; I266-Y325 HydrophobicContact CD1-CE2 3.8Å; I266-Y325 HydrophobicContact CD1-CG 3.03Å; I266-E328 HydrophobicContact CD1-CB 3.85Å; I266-E328 HydrophobicContact CD1-CG 4.19Å; I266-E328 HydrophobicContact CG1-CB 4.33Å; I266-S329 PolarHBondContact N-O 2.99Å; I266-I330 HydrophobicContact CB-CG1 4.09Å; I266-I330 HydrophobicContact CD1-CG1 4.28Å; I266-Y331 PolarHBondContact O-N 2.92Å
267	L	95.1	Very high	70.2	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	97.8	179.1	-54.9	-177.3	0	0	0	109	I265 C269 L288 I291 Q293 N295 Y331 V333 I525	I265-L267 HydrophobicContact CG2-CD2 3.81Å; I265-L267 HydrophobicContact CG2-CG 4.36Å; L267-C269 PolarHBondContact O-N 3.12Å; L267-L288 HydrophobicContact CD1-CB 4.04Å; L267-L288 HydrophobicContact CD1-CD2 4.22Å; L267-L288 WeakPolarHBondContact CD1-O 3.46Å; L267-I291 HydrophobicContact CD1-CB 4.33Å; L267-Q293 PolarHBondContact N-O 3.04Å; L267-N295 PolarHBondContact O-N 3.19Å; L267-Y331 WeakPolarHBondContact CA-O 3.44Å; L267-Y331 HydrophobicContact CD2-CG 4.5Å; L267-V333 HydrophobicContact CB-CG2 4.26Å; L267-V333 HydrophobicContact CD2-CG2 4.31Å; L267-I525 HydrophobicContact CD2-CD1 4.14Å
268	A	94.4	Very high	72.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	104.7	174.7	0	0	0	0	0	109.5	L321 Y331 L332 V333	A268-L321 HydrophobicContact CB-CD1 3.8Å; A268-Y331 PolarHBondContact N-O 3.16Å; A268-L332 HydrophobicContact CB-CD2 3.74Å; A268-V333 PolarHBondContact O-N 2.93Å
269	C	94.7	Very high	75	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	139.3	-171	-75.2	0	0	0	0	112.4	L267 I294 N295 L296 R317 V333	L267-C269 PolarHBondContact O-N 3.12Å; C269-I294 HydrophobicContact CB-CG2 4.29Å; C269-N295 PolarHBondContact N-O 2.67Å; C269-L296 HydrophobicContact CB-CD2 3.74Å; C269-R317 PolarHBondContact O-NH1 3.16Å; C269-R317 PolarHBondContact O-NH2 2.99Å; C269-R317 VanDerWaalsContact O-NH2 3.16Å; C269-V333 CarbonylContact C-O 3.42Å; C269-V333 VanDerWaalsContact CA-O 3.26Å; C269-V333 WeakPolarHBondContact CA-O 3.41Å
270	M	92	Very high	77.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	103.5	168.9	-170.5	174.3	-161.7	0	0	109.9	F272 E297 R310 F314 V333 S334 F335 G338 L341 M342	M270-F272 HydrophobicContact CE-CB 4.47Å; M270-E297 WeakPolarHBondContact CA-OE1 3.43Å; M270-R310 HydrophobicContact CE-CG 3.8Å; M270-F314 HydrophobicContact CB-CD2 4.32Å; M270-F314 HydrophobicContact CB-CE2 3.98Å; M270-F314 HydrophobicContact CG-CD2 4.49Å; M270-F314 HydrophobicContact SD-CD2 4.33Å; M270-F314 HydrophobicContact SD-CG 4.35Å; M270-V333 PolarHBondContact N-O 3.44Å; M270-S334 CarbonylContact O-C 3.56Å; M270-S334 VanDerWaalsContact O-CA 3.3Å; M270-S334 WeakPolarHBondContact O-CA 3.46Å; M270-F335 PolarHBondContact O-N 3.27Å; M270-G338 VanDerWaalsContact SD-O 3.32Å; M270-L341 HydrophobicContact CE-CB 3.5Å; M270-L341 HydrophobicContact CE-CD1 3.44Å; M270-L341 VanDerWaalsContact CE-CD1 3.44Å; M270-L341 HydrophobicContact CE-CG 4.11Å; M270-L341 HydrophobicContact SD-CB 3.73Å; M270-M342 HydrophobicContact SD-CB 4.19Å
271	T	87	Confident	79.5	Confident	17 Å²	17	45.2 Å²	45.2	10%	0.104	24%	0.239	C	C	.	.			trans	-96.3	-7.4	-174.5	66.7	0	0	0	0	114.2	A274 L281 L285 L296 E297 F335	T271-A274 WeakPolarHBondContact O-CA 3.36Å; T271-A274 WeakPolarHBondContact O-CB 3.36Å; T271-A274 PolarHBondContact O-N 2.95Å; T271-L281 HydrophobicContact CG2-CD1 4.05Å; T271-L281 HydrophobicContact CG2-CD2 4.16Å; T271-L285 HydrophobicContact CG2-CD1 4.43Å; T271-L285 HydrophobicContact CG2-CD2 4.29Å; T271-L296 HydrophobicContact CG2-CD2 4.02Å; T271-E297 WeakPolarHBondContact CB-OE2 3.4Å; T271-E297 WeakPolarHBondContact CG2-OE2 3.44Å; T271-E297 PolarHBondContact N-OE1 2.72Å; T271-E297 PolarHBondContact N-OE2 3.04Å; T271-E297 VanDerWaalsContact N-OE2 3.12Å; T271-E297 PolarHBondContact OG1-OE1 2.8Å; T271-E297 PolarHBondContact OG1-OE2 2.99Å; T271-F335 HydrophobicContact CG2-CD2 3.97Å; T271-F335 HydrophobicContact CG2-CE2 4.15Å
272	F	77	Confident	81.4	Confident	29 Å²	29	45.3 Å²	45.3	13%	0.127	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	136.3	179.2	177.8	-104.9	0	0	0	114.7	M270 E297 M307 R310 G338 L341	M270-F272 HydrophobicContact CE-CB 4.47Å; F272-E297 PolarHBondContact N-OE1 3.39Å; F272-M307 HydrophobicContact CE1-CG 4.38Å; F272-R310 VanDerWaalsContact CZ-NH1 3.32Å; F272-G338 WeakPolarHBondContact O-CA 3.36Å; F272-G338 PolarHBondContact O-N 3.48Å; F272-L341 HydrophobicContact CD1-CD1 3.78Å; F272-L341 HydrophobicContact CE1-CD1 4.17Å
273	P	68.4	Low	83	Confident	69 Å²	69	48.4 Å²	48.4	45%	0.448	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	cis	-95.7	36.8	-1.5	39	-37.6	0	0	0	113.7
274	A	69.8	Low	84.4	Confident	35 Å²	35	45.3 Å²	45.3	29%	0.289	23%	0.23	S	C	.	.			trans	-65.1	134.2	-172.4	0	0	0	0	0	111.9	T271 L281	T271-A274 WeakPolarHBondContact O-CA 3.36Å; T271-A274 WeakPolarHBondContact O-CB 3.36Å; T271-A274 PolarHBondContact O-N 2.95Å; A274-L281 HydrophobicContact CB-CD2 3.64Å
275	P	67.1	Low	84.9	Confident	66 Å²	66	45 Å²	45	43%	0.429	23%	0.226	S	C	.	.			trans	-70.7	142.9	-179.1	28.8	-33.6	0	0	0	110.7	D277 S278	P275-D277 WeakPolarHBondContact CB-OD1 3.41Å; P275-D277 PolarHBondContact O-N 3.29Å; P275-D277 VanDerWaalsContact O-N 3.13Å; P275-S278 WeakPolarHBondContact O-CB 3.37Å; P275-S278 PolarHBondContact O-N 2.79Å
276	R	64.2	Low	85	Confident	133 Å²	133	47.2 Å²	47.2	50%	0.502	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-26.3	-172.1	-61	-179.4	-177.2	-171.6	-2	113.6	Q282	R276-Q282 PolarHBondContact O-NE2 2.89Å
277	D	71.8	Confident	85	Confident	123 Å²	123	48.1 Å²	48.1	66%	0.658	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	7.3	-179.2	69.2	-30	0	0	0	113.3	P275 K279	P275-D277 WeakPolarHBondContact CB-OD1 3.41Å; P275-D277 PolarHBondContact O-N 3.29Å; P275-D277 VanDerWaalsContact O-N 3.13Å; D277-K279 PolarHBondContact O-N 3.12Å
278	S	84.4	Confident	85	Confident	33 Å²	33	48.1 Å²	48.1	23%	0.231	25%	0.246	C	C	.	.			trans	-64.5	97.2	177.3	179.2	0	0	0	0	111	P275 R280 L281 Q282	P275-S278 WeakPolarHBondContact O-CB 3.37Å; P275-S278 PolarHBondContact O-N 2.79Å; S278-R280 PolarHBondContact O-N 2.9Å; S278-R280 VanDerWaalsContact O-N 3.16Å; S278-L281 PolarHBondContact O-N 2.7Å; S278-L281 WeakPolarHBondContact OG-CB 3.38Å; S278-L281 PolarHBondContact OG-N 3.23Å; S278-L281 VanDerWaalsContact OG-N 3.15Å; S278-Q282 WeakPolarHBondContact O-CG 3.39Å; S278-Q282 PolarHBondContact O-N 2.76Å
279	K	87.9	Confident	84.9	Confident	176 Å²	176	48.6 Å²	48.6	77%	0.765	25%	0.251	S	S	*	.	H	α-helix	trans	-54.1	-35.1	175	-64.4	-173.5	178.4	-172.4	0	112.6	D277 K283	D277-K279 PolarHBondContact O-N 3.12Å; K279-K283 WeakPolarHBondContact O-CB 3.3Å; K279-K283 PolarHBondContact O-N 2.96Å
280	R	89.6	Confident	84.7	Confident	52 Å²	52	53 Å²	53	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-73.1	-41.4	178.1	-175.5	170.1	172.5	-126.1	-2.3	111.5	S278 K283 L284 L495 L496 R497 Q510 D514	S278-R280 PolarHBondContact O-N 2.9Å; S278-R280 VanDerWaalsContact O-N 3.16Å; R280-K283 PolarHBondContact O-N 2.93Å; R280-L284 HydrophobicContact CG-CD1 4.23Å; R280-L284 HydrophobicContact CG-CG 4.4Å; R280-L284 VanDerWaalsContact O-CG 3.32Å; R280-L284 WeakPolarHBondContact O-CG 3.35Å; R280-L284 PolarHBondContact O-N 3.29Å; R280-L495 PolarHBondContact NH1-O 3.11Å; R280-L496 PolarHBondContact NH1-O 3.32Å; R280-L496 PolarHBondContact NH2-O 3.17Å; R280-R497 VanDerWaalsContact NH1-CG 3.27Å; R280-Q510 VanDerWaalsContact CZ-NE2 3.28Å; R280-D514 IonicContact CZ-OD1 2.71Å; R280-D514 IonicContact NE-OD1 3.71Å; R280-D514 PolarHBondContact NE-OD1 3.24Å; R280-D514 IonicContact NE-OD2 2.8Å; R280-D514 PolarHBondContact NE-OD2 2.98Å; R280-D514 IonicContact NH2-OD1 2.93Å; R280-D514 PolarHBondContact NH2-OD1 3.12Å
281	L	89.8	Confident	84.7	Confident	17 Å²	17	53.1 Å²	53.1	9%	0.089	27%	0.272	C	S	.	.	H	α-helix	trans	-60.3	-48.2	173.9	179.5	70.6	0	0	0	110.5	T271 A274 S278 K283 L284 L285 F335	T271-L281 HydrophobicContact CG2-CD1 4.05Å; T271-L281 HydrophobicContact CG2-CD2 4.16Å; A274-L281 HydrophobicContact CB-CD2 3.64Å; S278-L281 PolarHBondContact O-N 2.7Å; S278-L281 WeakPolarHBondContact OG-CB 3.38Å; S278-L281 PolarHBondContact OG-N 3.23Å; S278-L281 VanDerWaalsContact OG-N 3.15Å; L281-K283 VanDerWaalsContact C-N 3.26Å; L281-K283 PolarHBondContact O-N 2.8Å; L281-L284 PolarHBondContact O-N 2.87Å; L281-L285 HydrophobicContact CD1-CD1 4.4Å; L281-L285 HydrophobicContact CD1-CG 4.25Å; L281-L285 HydrophobicContact CD2-CD1 4.34Å; L281-L285 HydrophobicContact CG-CD1 3.93Å; L281-L285 HydrophobicContact CG-CG 4.19Å; L281-L285 WeakPolarHBondContact O-CG 3.3Å; L281-L285 PolarHBondContact O-N 2.96Å; L281-F335 HydrophobicContact CD1-CD1 4.15Å; L281-F335 HydrophobicContact CD1-CD2 4.2Å; L281-F335 HydrophobicContact CD1-CE1 4.1Å; L281-F335 HydrophobicContact CD1-CE2 4.16Å; L281-F335 HydrophobicContact CD1-CG 4.19Å; L281-F335 HydrophobicContact CD1-CZ 4.1Å
282	Q	89.9	Confident	84.8	Confident	92 Å²	92	52.5 Å²	52.5	43%	0.43	27%	0.27	S	S	.	.	H	α-helix	trans	-56.7	-41.3	177.4	-69.5	176.2	-1.8	0	0	111.8	R276 S278 S286	R276-Q282 PolarHBondContact O-NE2 2.89Å; S278-Q282 WeakPolarHBondContact O-CG 3.39Å; S278-Q282 PolarHBondContact O-N 2.76Å; Q282-S286 WeakPolarHBondContact O-CB 3.25Å; Q282-S286 PolarHBondContact O-N 2.87Å
283	K	91.7	Very high	85.5	Confident	81 Å²	81	54.1 Å²	54.1	35%	0.352	28%	0.278	S	S	.	.	H	α-helix	trans	-63	-45.2	173.2	-177.3	176.4	179.6	170.1	0	112.5	K279 R280 L281 S286 L287 S511	K279-K283 WeakPolarHBondContact O-CB 3.3Å; K279-K283 PolarHBondContact O-N 2.96Å; R280-K283 PolarHBondContact O-N 2.93Å; L281-K283 VanDerWaalsContact C-N 3.26Å; L281-K283 PolarHBondContact O-N 2.8Å; K283-S286 WeakPolarHBondContact O-CB 3.26Å; K283-S286 PolarHBondContact O-N 2.8Å; K283-L287 HydrophobicContact CG-CD1 4.39Å; K283-L287 WeakPolarHBondContact O-CG 3.48Å; K283-L287 PolarHBondContact O-N 3.5Å; K283-S511 PolarHBondContact NZ-OG 3.32Å
284	L	93	Very high	86.6	Confident	9 Å²	9	50.9 Å²	50.9	5%	0.047	26%	0.256	C	S	.	.	H	α-helix	trans	-64.2	-42	178.4	-71	173.9	0	0	0	111.7	R280 L281 L287 L288 F335 D514 M517 M518	R280-L284 HydrophobicContact CG-CD1 4.23Å; R280-L284 HydrophobicContact CG-CG 4.4Å; R280-L284 VanDerWaalsContact O-CG 3.32Å; R280-L284 WeakPolarHBondContact O-CG 3.35Å; R280-L284 PolarHBondContact O-N 3.29Å; L281-L284 PolarHBondContact O-N 2.87Å; L284-L287 PolarHBondContact O-N 2.89Å; L284-L288 WeakPolarHBondContact O-CG 2.96Å; L284-L288 PolarHBondContact O-N 3.41Å; L284-F335 HydrophobicContact CB-CE1 4.43Å; L284-F335 HydrophobicContact CD1-CE1 4.11Å; L284-D514 HydrophobicContact CD2-CB 3.85Å; L284-M517 HydrophobicContact CD1-CE 4.18Å; L284-M517 HydrophobicContact CD2-CE 3.42Å; L284-M517 VanDerWaalsContact CD2-CE 3.42Å; L284-M517 HydrophobicContact CG-CE 4.43Å; L284-M518 HydrophobicContact CD2-CE 4.18Å
285	L	92.5	Very high	87.7	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-62.6	-43.4	173	-67.4	175.6	0	0	0	110.8	T271 L281 L287 L288 G289 I294 L296 F335	T271-L285 HydrophobicContact CG2-CD1 4.43Å; T271-L285 HydrophobicContact CG2-CD2 4.29Å; L281-L285 HydrophobicContact CD1-CD1 4.4Å; L281-L285 HydrophobicContact CD1-CG 4.25Å; L281-L285 HydrophobicContact CD2-CD1 4.34Å; L281-L285 HydrophobicContact CG-CD1 3.93Å; L281-L285 HydrophobicContact CG-CG 4.19Å; L281-L285 WeakPolarHBondContact O-CG 3.3Å; L281-L285 PolarHBondContact O-N 2.96Å; L285-L287 VanDerWaalsContact C-N 3.29Å; L285-L287 PolarHBondContact O-N 3.17Å; L285-L288 HydrophobicContact CD2-CD1 4.32Å; L285-L288 PolarHBondContact O-N 2.82Å; L285-G289 PolarHBondContact O-N 3.45Å; L285-I294 HydrophobicContact CB-CD1 4.36Å; L285-I294 WeakPolarHBondContact O-CD1 3.49Å; L285-L296 HydrophobicContact CD1-CD1 4.15Å; L285-L296 HydrophobicContact CD1-CD2 3.9Å; L285-L296 HydrophobicContact CD2-CD2 3.87Å; L285-F335 HydrophobicContact CD2-CE2 4.26Å; L285-F335 HydrophobicContact CD2-CZ 4.43Å
286	S	92.3	Very high	88.8	Confident	50 Å²	50	47.6 Å²	47.6	35%	0.35	23%	0.23	S	C	.	.	H	α-helix	trans	-57	-43.4	174.3	-172.8	0	0	0	0	112.1	Q282 K283 G289 E290	Q282-S286 WeakPolarHBondContact O-CB 3.25Å; Q282-S286 PolarHBondContact O-N 2.87Å; K283-S286 WeakPolarHBondContact O-CB 3.26Å; K283-S286 PolarHBondContact O-N 2.8Å; S286-G289 PolarHBondContact O-N 2.96Å; S286-E290 PolarHBondContact O-N 3.33Å
287	L	93	Very high	89.8	Confident	22 Å²	22	41.4 Å²	41.4	12%	0.115	21%	0.207	C	C	.	.	H	α-helix	trans	-69.9	-34.9	178.3	-67.2	168.7	0	0	0	112.8	K283 L284 L285 G289 E290 M518	K283-L287 HydrophobicContact CG-CD1 4.39Å; K283-L287 WeakPolarHBondContact O-CG 3.48Å; K283-L287 PolarHBondContact O-N 3.5Å; L284-L287 PolarHBondContact O-N 2.89Å; L285-L287 VanDerWaalsContact C-N 3.29Å; L285-L287 PolarHBondContact O-N 3.17Å; L287-G289 PolarHBondContact O-N 2.93Å; L287-E290 WeakPolarHBondContact O-CB 3.47Å; L287-E290 PolarHBondContact O-N 3.19Å; L287-M518 HydrophobicContact CB-CG 3.67Å; L287-M518 HydrophobicContact CB-SD 3.8Å; L287-M518 HydrophobicContact CD1-CG 3.96Å; L287-M518 HydrophobicContact CG-CG 4.39Å
288	L	93.7	Very high	90.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.3	-33.3	171.2	-74.7	171.2	0	0	0	111.2	L267 L284 L285 E290 I291 G292 I294 V333 F335 M518 I521	L267-L288 HydrophobicContact CD1-CB 4.04Å; L267-L288 HydrophobicContact CD1-CD2 4.22Å; L267-L288 WeakPolarHBondContact CD1-O 3.46Å; L284-L288 WeakPolarHBondContact O-CG 2.96Å; L284-L288 PolarHBondContact O-N 3.41Å; L285-L288 HydrophobicContact CD2-CD1 4.32Å; L285-L288 PolarHBondContact O-N 2.82Å; L288-E290 PolarHBondContact O-N 3.44Å; L288-I291 HydrophobicContact CD2-CD1 4.13Å; L288-I291 WeakPolarHBondContact O-CA 3.46Å; L288-I291 VanDerWaalsContact O-CB 3.29Å; L288-I291 WeakPolarHBondContact O-CB 3.33Å; L288-I291 PolarHBondContact O-N 3.29Å; L288-G292 PolarHBondContact O-N 3.3Å; L288-I294 HydrophobicContact CB-CD1 3.84Å; L288-I294 HydrophobicContact CB-CG1 4.44Å; L288-V333 HydrophobicContact CD1-CG1 4.11Å; L288-F335 HydrophobicContact CD1-CE2 4.45Å; L288-F335 HydrophobicContact CD1-CZ 3.91Å; L288-M518 HydrophobicContact CD2-CE 4.18Å; L288-M518 HydrophobicContact CD2-SD 3.75Å; L288-M518 HydrophobicContact CG-CE 4.37Å; L288-M518 HydrophobicContact CG-SD 3.85Å; L288-I521 HydrophobicContact CD2-CD1 4.01Å; L288-I521 HydrophobicContact CD2-CG2 4.35Å
289	G	92.6	Very high	90	Very high	11 Å²	11	41.7 Å²	41.7	11%	0.113	20%	0.202	C	C	.	.	H	α-helix	trans	-65.9	-22.3	177.8	0	0	0	0	0	113	L285 S286 L287 I291	L285-G289 PolarHBondContact O-N 3.45Å; S286-G289 PolarHBondContact O-N 2.96Å; L287-G289 PolarHBondContact O-N 2.93Å; G289-I291 VanDerWaalsContact C-N 3.25Å; G289-I291 PolarHBondContact O-N 2.9Å
290	E	90.9	Very high	89.6	Confident	92 Å²	92	37.8 Å²	37.8	43%	0.43	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-17.2	170.8	-59	174.1	-171	0	0	112.9	S259 S286 L287 L288	S259-E290 PolarHBondContact OG-O 3.48Å; S286-E290 PolarHBondContact O-N 3.33Å; L287-E290 WeakPolarHBondContact O-CB 3.47Å; L287-E290 PolarHBondContact O-N 3.19Å; L288-E290 PolarHBondContact O-N 3.44Å
291	I	91.9	Very high	89.2	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.01	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-41.8	-179.5	-52.5	-179.4	0	0	0	111.4	G262 L267 L288 G289 M518 I521 K522 I525	G262-I291 VanDerWaalsContact CA-O 3.27Å; G262-I291 WeakPolarHBondContact CA-O 3.38Å; L267-I291 HydrophobicContact CD1-CB 4.33Å; L288-I291 HydrophobicContact CD2-CD1 4.13Å; L288-I291 WeakPolarHBondContact O-CA 3.46Å; L288-I291 VanDerWaalsContact O-CB 3.29Å; L288-I291 WeakPolarHBondContact O-CB 3.33Å; L288-I291 PolarHBondContact O-N 3.29Å; G289-I291 VanDerWaalsContact C-N 3.25Å; G289-I291 PolarHBondContact O-N 2.9Å; I291-M518 HydrophobicContact CD1-SD 4.46Å; I291-I521 HydrophobicContact CD1-CB 4.33Å; I291-I521 HydrophobicContact CD1-CG2 3.87Å; I291-K522 HydrophobicContact CD1-CG 3.63Å; I291-K522 HydrophobicContact CG1-CD 4.24Å; I291-K522 VanDerWaalsContact CG1-CE 3.48Å; I291-K522 HydrophobicContact CG1-CG 3.7Å; I291-K522 HydrophobicContact CG2-CG 4.21Å; I291-I525 HydrophobicContact CG2-CD1 3.69Å
292	G	89.5	Confident	88.5	Confident	5 Å²	5	37.1 Å²	37.1	5%	0.052	19%	0.185	C	C	.	.	S	Bend	trans	-170.4	174.1	-176.2	0	0	0	0	0	112.3	I265 L288 I294	I265-G292 CarbonylContact O-C 3.59Å; I265-G292 WeakPolarHBondContact O-CA 3.34Å; L288-G292 PolarHBondContact O-N 3.3Å; G292-I294 PolarHBondContact O-N 3.05Å
293	Q	91.5	Very high	87.7	Confident	63 Å²	63	37 Å²	37	29%	0.294	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	122.6	179.9	-175.2	-179.5	-3.2	0	0	110.3	I265 I266 L267	I265-Q293 PolarHBondContact O-N 3.01Å; I266-Q293 WeakPolarHBondContact CA-O 3.4Å; L267-Q293 PolarHBondContact N-O 3.04Å
294	I	92.2	Very high	86.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	127	178.6	-58.1	179.7	0	0	0	110.2	C269 L285 L288 G292 L296	C269-I294 HydrophobicContact CB-CG2 4.29Å; L285-I294 HydrophobicContact CB-CD1 4.36Å; L285-I294 WeakPolarHBondContact O-CD1 3.49Å; L288-I294 HydrophobicContact CB-CD1 3.84Å; L288-I294 HydrophobicContact CB-CG1 4.44Å; G292-I294 PolarHBondContact O-N 3.05Å; I294-L296 HydrophobicContact CG2-CD1 4.39Å; I294-L296 HydrophobicContact CG2-CD2 4.05Å; I294-L296 HydrophobicContact CG2-CG 3.7Å
295	N	91.9	Very high	85.8	Confident	25 Å²	25	40 Å²	40	13%	0.134	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	107.3	164.4	-173.4	-80.5	0	0	0	109.8	L267 C269 R317 L321	L267-N295 PolarHBondContact O-N 3.19Å; C269-N295 PolarHBondContact N-O 2.67Å; N295-R317 PolarHBondContact O-NH1 3.28Å; N295-R317 VanDerWaalsContact O-NH1 3.12Å; N295-R317 WeakPolarHBondContact OD1-CD 3.32Å; N295-R317 PolarHBondContact OD1-NH1 3.09Å; N295-L321 HydrophobicContact CB-CD1 4.02Å; N295-L321 HydrophobicContact CB-CD2 4.39Å
296	L	89.9	Confident	85.2	Confident	7 Å²	7	42.8 Å²	42.8	4%	0.037	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-91.8	161.1	179.6	-75.3	168.2	0	0	0	112.3	I250 I254 C269 T271 L285 I294 D298 R317	I250-L296 HydrophobicContact CG2-CD1 3.72Å; I254-L296 HydrophobicContact CD1-CD1 4.35Å; C269-L296 HydrophobicContact CB-CD2 3.74Å; T271-L296 HydrophobicContact CG2-CD2 4.02Å; L285-L296 HydrophobicContact CD1-CD1 4.15Å; L285-L296 HydrophobicContact CD1-CD2 3.9Å; L285-L296 HydrophobicContact CD2-CD2 3.87Å; I294-L296 HydrophobicContact CG2-CD1 4.39Å; I294-L296 HydrophobicContact CG2-CD2 4.05Å; I294-L296 HydrophobicContact CG2-CG 3.7Å; L296-D298 PolarHBondContact O-N 3.48Å; L296-R317 PolarHBondContact O-NH1 3.06Å
297	E	85.7	Confident	84.5	Confident	3 Å²	3	42.4 Å²	42.4	1%	0.014	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-53.2	134.4	172.9	-61.3	126.9	128.9	0	0	110.4	M270 T271 F272 E301 Q302	M270-E297 WeakPolarHBondContact CA-OE1 3.43Å; T271-E297 WeakPolarHBondContact CB-OE2 3.4Å; T271-E297 WeakPolarHBondContact CG2-OE2 3.44Å; T271-E297 PolarHBondContact N-OE1 2.72Å; T271-E297 PolarHBondContact N-OE2 3.04Å; T271-E297 VanDerWaalsContact N-OE2 3.12Å; T271-E297 PolarHBondContact OG1-OE1 2.8Å; T271-E297 PolarHBondContact OG1-OE2 2.99Å; F272-E297 PolarHBondContact N-OE1 3.39Å; E297-E301 HydrophobicContact CB-CB 3.91Å; E297-E301 HydrophobicContact CG-CB 4.47Å; E297-Q302 HydrophobicContact CB-CG 3.8Å; E297-Q302 PolarHBondContact O-NE2 3.16Å
298	D	81.6	Confident	83.9	Confident	49 Å²	49	45.1 Å²	45.1	26%	0.262	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-71.1	171.6	173.7	65.9	16.6	0	0	0	111.3	L296 E300 E301 Q302	L296-D298 PolarHBondContact O-N 3.48Å; D298-E300 PolarHBondContact O-N 3.23Å; D298-E300 PolarHBondContact OD1-N 3.4Å; D298-E301 PolarHBondContact O-N 2.84Å; D298-E301 VanDerWaalsContact OD1-CB 3.28Å; D298-E301 WeakPolarHBondContact OD1-CB 3.41Å; D298-E301 VanDerWaalsContact OD1-CG 3.3Å; D298-E301 WeakPolarHBondContact OD1-CG 3.44Å; D298-E301 PolarHBondContact OD1-N 2.91Å; D298-Q302 WeakPolarHBondContact O-CB 3.38Å; D298-Q302 VanDerWaalsContact O-CG 3.27Å; D298-Q302 WeakPolarHBondContact O-CG 3.49Å; D298-Q302 PolarHBondContact O-N 3.27Å
299	H	78.3	Confident	83.5	Confident	114 Å²	114	48.8 Å²	48.8	53%	0.528	25%	0.249	S	C	.	.	H	α-helix	trans	-59.6	-34.3	-178.8	-174.2	-79.4	0	0	0	111.9	Q302 I303	H299-Q302 PolarHBondContact O-N 2.93Å; H299-I303 VanDerWaalsContact CE1-CG2 3.49Å; H299-I303 WeakPolarHBondContact CE1-CG2 3.47Å; H299-I303 WeakPolarHBondContact O-CG1 3.38Å; H299-I303 PolarHBondContact O-N 2.85Å; H299-I303 VanDerWaalsContact O-N 3.1Å
300	E	80.5	Confident	83.1	Confident	94 Å²	94	48.6 Å²	48.6	44%	0.439	24%	0.244	S	C	.	.	H	α-helix	trans	-66.1	-48.5	179.7	-166.6	-175.3	169.4	0	0	111.3	D298 Q302 I303 C304 L313 R316	D298-E300 PolarHBondContact O-N 3.23Å; D298-E300 PolarHBondContact OD1-N 3.4Å; E300-Q302 VanDerWaalsContact C-N 3.29Å; E300-Q302 PolarHBondContact O-N 3.15Å; E300-I303 WeakPolarHBondContact O-CG1 3.29Å; E300-I303 PolarHBondContact O-N 3.13Å; E300-C304 VanDerWaalsContact O-CB 3.27Å; E300-C304 WeakPolarHBondContact O-CB 3.27Å; E300-C304 PolarHBondContact O-N 3.41Å; E300-L313 HydrophobicContact CG-CD1 4Å; E300-L313 HydrophobicContact CG-CD2 4.5Å; E300-R316 IonicContact OE2-NH2 3.44Å
301	E	81.4	Confident	83	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.009	23%	0.227	C	C	.	.	H	α-helix	trans	-59.9	-39.1	173.9	-78.5	-178.4	-145.4	0	0	112.1	E297 D298 R310 L313 R317	E297-E301 HydrophobicContact CB-CB 3.91Å; E297-E301 HydrophobicContact CG-CB 4.47Å; D298-E301 PolarHBondContact O-N 2.84Å; D298-E301 VanDerWaalsContact OD1-CB 3.28Å; D298-E301 WeakPolarHBondContact OD1-CB 3.41Å; D298-E301 VanDerWaalsContact OD1-CG 3.3Å; D298-E301 WeakPolarHBondContact OD1-CG 3.44Å; D298-E301 PolarHBondContact OD1-N 2.91Å; E301-R310 VanDerWaalsContact O-CZ 3.27Å; E301-R310 PolarHBondContact O-NE 2.79Å; E301-R310 PolarHBondContact O-NH2 3.47Å; E301-L313 HydrophobicContact CG-CB 3.38Å; E301-L313 HydrophobicContact CG-CD1 4.01Å; E301-L313 HydrophobicContact CG-CG 4.3Å; E301-R317 VanDerWaalsContact CD-NE 3.27Å; E301-R317 WeakPolarHBondContact OE1-CB 3.44Å; E301-R317 WeakPolarHBondContact OE1-CD 2.79Å; E301-R317 IonicContact OE1-CZ 3.94Å; E301-R317 IonicContact OE1-NE 3.79Å; E301-R317 PolarHBondContact OE1-NE 3.33Å; E301-R317 IonicContact OE1-NH2 2.82Å; E301-R317 IonicContact OE2-CZ 2.72Å; E301-R317 VanDerWaalsContact OE2-CZ 3.26Å; E301-R317 IonicContact OE2-NE 3.26Å; E301-R317 PolarHBondContact OE2-NE 3.02Å; E301-R317 IonicContact OE2-NH2 3.2Å; E301-R317 PolarHBondContact OE2-NH2 3.32Å
302	Q	74.4	Confident	82.8	Confident	52 Å²	52	49.6 Å²	49.6	24%	0.243	25%	0.245	C	C	.	.	H	α-helix	trans	-71.1	-38.2	-177.3	-73.2	-179.2	27.8	0	0	113.1	E297 D298 H299 E300 C304 R310	E297-Q302 HydrophobicContact CB-CG 3.8Å; E297-Q302 PolarHBondContact O-NE2 3.16Å; D298-Q302 WeakPolarHBondContact O-CB 3.38Å; D298-Q302 VanDerWaalsContact O-CG 3.27Å; D298-Q302 WeakPolarHBondContact O-CG 3.49Å; D298-Q302 PolarHBondContact O-N 3.27Å; H299-Q302 PolarHBondContact O-N 2.93Å; E300-Q302 VanDerWaalsContact C-N 3.29Å; E300-Q302 PolarHBondContact O-N 3.15Å; Q302-C304 VanDerWaalsContact C-N 3.33Å; Q302-R310 PolarHBondContact O-NH2 3.04Å
303	I	72.4	Confident	82.8	Confident	89 Å²	89	49.9 Å²	49.9	46%	0.456	25%	0.245	S	C	.	.	H	α-helix	trans	-82.7	-11.5	178.4	65.7	178.9	0	0	0	113.5	H299 E300 D305	H299-I303 VanDerWaalsContact CE1-CG2 3.49Å; H299-I303 WeakPolarHBondContact CE1-CG2 3.47Å; H299-I303 WeakPolarHBondContact O-CG1 3.38Å; H299-I303 PolarHBondContact O-N 2.85Å; H299-I303 VanDerWaalsContact O-N 3.1Å; E300-I303 WeakPolarHBondContact O-CG1 3.29Å; E300-I303 PolarHBondContact O-N 3.13Å; I303-D305 PolarHBondContact O-N 3.11Å; I303-D305 VanDerWaalsContact O-N 3.11Å
304	C	75.4	Confident	82.8	Confident	13 Å²	13	46.9 Å²	46.9	9%	0.088	23%	0.231	C	C	.	.			trans	-74	99	-174.1	177.9	0	0	0	0	112.7	E300 Q302 S306 L309 R310 L313	E300-C304 VanDerWaalsContact O-CB 3.27Å; E300-C304 WeakPolarHBondContact O-CB 3.27Å; E300-C304 PolarHBondContact O-N 3.41Å; Q302-C304 VanDerWaalsContact C-N 3.33Å; C304-S306 VanDerWaalsContact C-N 3.26Å; C304-S306 PolarHBondContact O-N 2.83Å; C304-S306 PolarHBondContact SG-O 2.78Å; C304-L309 WeakPolarHBondContact SG-CB 3.27Å; C304-L309 VanDerWaalsContact SG-CD2 3.51Å; C304-L309 WeakPolarHBondContact SG-CG 3.33Å; C304-R310 PolarHBondContact O-NH1 3.1Å; C304-R310 PolarHBondContact O-NH2 3.25Å; C304-R310 PolarHBondContact SG-N 2.8Å; C304-R310 VanDerWaalsContact SG-N 3.45Å; C304-L313 HydrophobicContact CB-CD1 4.26Å
305	D	69.7	Low	82.7	Confident	142 Å²	142	47.3 Å²	47.3	76%	0.759	23%	0.234	S	C	*	.			trans	-69.2	-24.8	178.8	-66.6	-32.3	0	0	0	113.5	I303 M307	I303-D305 PolarHBondContact O-N 3.11Å; I303-D305 VanDerWaalsContact O-N 3.11Å; D305-M307 PolarHBondContact O-N 3.48Å
306	S	81.3	Confident	82.6	Confident	64 Å²	64	52.3 Å²	52.3	45%	0.448	25%	0.251	S	S	.	.			trans	-73.1	109.4	178.4	174.3	0	0	0	0	111.4	C304 R308 L309 R310	C304-S306 VanDerWaalsContact C-N 3.26Å; C304-S306 PolarHBondContact O-N 2.83Å; C304-S306 PolarHBondContact SG-O 2.78Å; S306-R308 PolarHBondContact O-N 2.98Å; S306-L309 PolarHBondContact O-N 3.25Å; S306-L309 PolarHBondContact OG-N 3.21Å; S306-R310 PolarHBondContact O-N 2.82Å
307	M	77.5	Confident	82.7	Confident	41 Å²	41	53 Å²	53	20%	0.202	25%	0.253	C	S	.	.	H	α-helix	trans	-54.2	-37.6	176.8	-67.2	-174	-72.6	0	0	113.5	I13 F272 D305 R310 L311 L341	I13-M307 HydrophobicContact CB-CE 3.81Å; I13-M307 HydrophobicContact CB-SD 3.47Å; I13-M307 WeakPolarHBondContact CB-SD 3.36Å; I13-M307 HydrophobicContact CD1-SD 4.15Å; I13-M307 HydrophobicContact CG1-SD 4.39Å; I13-M307 HydrophobicContact CG2-CE 4.26Å; I13-M307 HydrophobicContact CG2-SD 3.34Å; I13-M307 WeakPolarHBondContact CG2-SD 3.42Å; I13-M307 WeakPolarHBondContact O-CE 3.28Å; F272-M307 HydrophobicContact CE1-CG 4.38Å; D305-M307 PolarHBondContact O-N 3.48Å; M307-R310 PolarHBondContact O-N 3.39Å; M307-L311 WeakPolarHBondContact O-CB 3.27Å; M307-L311 PolarHBondContact O-N 3.01Å; M307-L341 HydrophobicContact CB-CD2 4.24Å
308	R	80.5	Confident	83	Confident	79 Å²	79	52.9 Å²	52.9	30%	0.298	25%	0.252	S	S	.	.	H	α-helix	trans	-64.9	-42	177.2	178.9	176.7	175.1	136.4	-5.9	111.4	F3 I6 D7 S306 R312	F3-R308 VanDerWaalsContact CD1-NH2 3.33Å; I6-R308 HydrophobicContact CG2-CG 3.89Å; I6-R308 VanDerWaalsContact CG2-CZ 3.49Å; D7-R308 IonicContact OD1-NH1 3.06Å; D7-R308 PolarHBondContact OD1-NH1 3.4Å; S306-R308 PolarHBondContact O-N 2.98Å; R308-R312 WeakPolarHBondContact O-CG 3.49Å; R308-R312 PolarHBondContact O-N 3.02Å
309	L	83.5	Confident	83.4	Confident	77 Å²	77	52.5 Å²	52.5	40%	0.403	25%	0.25	S	C	.	.	H	α-helix	trans	-71.7	-41.1	177.8	178.8	62.2	0	0	0	110.4	C304 S306 L311 R312 L313	C304-L309 WeakPolarHBondContact SG-CB 3.27Å; C304-L309 VanDerWaalsContact SG-CD2 3.51Å; C304-L309 WeakPolarHBondContact SG-CG 3.33Å; S306-L309 PolarHBondContact O-N 3.25Å; S306-L309 PolarHBondContact OG-N 3.21Å; L309-L311 VanDerWaalsContact C-N 3.34Å; L309-L311 PolarHBondContact O-N 3.35Å; L309-R312 WeakPolarHBondContact O-CB 3.49Å; L309-R312 PolarHBondContact O-N 2.76Å; L309-R312 VanDerWaalsContact O-N 3.09Å; L309-L313 HydrophobicContact CD1-CG 4.33Å; L309-L313 HydrophobicContact CG-CD1 4.18Å; L309-L313 HydrophobicContact CG-CG 4.44Å; L309-L313 WeakPolarHBondContact O-CG 3.3Å; L309-L313 PolarHBondContact O-N 3.25Å
310	R	85.4	Confident	83.8	Confident	7 Å²	7	51.3 Å²	51.3	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-59.6	-41.5	174.1	-174.6	173.7	-80.3	124.5	-6.8	112.5	M270 F272 E301 Q302 C304 S306 M307 R312 L313 F314	M270-R310 HydrophobicContact CE-CG 3.8Å; F272-R310 VanDerWaalsContact CZ-NH1 3.32Å; E301-R310 VanDerWaalsContact O-CZ 3.27Å; E301-R310 PolarHBondContact O-NE 2.79Å; E301-R310 PolarHBondContact O-NH2 3.47Å; Q302-R310 PolarHBondContact O-NH2 3.04Å; C304-R310 PolarHBondContact O-NH1 3.1Å; C304-R310 PolarHBondContact O-NH2 3.25Å; C304-R310 PolarHBondContact SG-N 2.8Å; C304-R310 VanDerWaalsContact SG-N 3.45Å; S306-R310 PolarHBondContact O-N 2.82Å; M307-R310 PolarHBondContact O-N 3.39Å; R310-R312 VanDerWaalsContact C-N 3.35Å; R310-R312 PolarHBondContact O-N 3.17Å; R310-L313 PolarHBondContact O-N 2.65Å; R310-F314 WeakPolarHBondContact O-CB 3.01Å; R310-F314 PolarHBondContact O-N 3.38Å
311	L	88.1	Confident	84.2	Confident	12 Å²	12	47 Å²	47	6%	0.063	23%	0.228	C	C	.	.	H	α-helix	trans	-58.3	-46.3	172.5	-178.9	151.3	0	0	0	111.3	V9 M307 L309 F314 V315 L344	V9-L311 HydrophobicContact CG1-CD1 4.35Å; M307-L311 WeakPolarHBondContact O-CB 3.27Å; M307-L311 PolarHBondContact O-N 3.01Å; L309-L311 VanDerWaalsContact C-N 3.34Å; L309-L311 PolarHBondContact O-N 3.35Å; L311-F314 PolarHBondContact O-N 2.87Å; L311-V315 HydrophobicContact CD2-CG2 4.15Å; L311-V315 WeakPolarHBondContact O-CB 3.4Å; L311-V315 VanDerWaalsContact O-CG2 3.26Å; L311-V315 WeakPolarHBondContact O-CG2 3.35Å; L311-V315 PolarHBondContact O-N 3.12Å; L311-L344 HydrophobicContact CD1-CB 3.82Å
312	R	88.2	Confident	84.5	Confident	103 Å²	103	47.7 Å²	47.7	39%	0.389	23%	0.231	S	C	.	.	H	α-helix	trans	-63.8	-43.2	179.1	-73.7	174.7	174	-172.7	-5.3	112.6	R308 L309 R310 V315 R316	R308-R312 WeakPolarHBondContact O-CG 3.49Å; R308-R312 PolarHBondContact O-N 3.02Å; L309-R312 WeakPolarHBondContact O-CB 3.49Å; L309-R312 PolarHBondContact O-N 2.76Å; L309-R312 VanDerWaalsContact O-N 3.09Å; R310-R312 VanDerWaalsContact C-N 3.35Å; R310-R312 PolarHBondContact O-N 3.17Å; R312-V315 PolarHBondContact O-N 2.91Å; R312-R316 PolarHBondContact O-N 2.93Å
313	L	89.7	Confident	85	Confident	12 Å²	12	48.8 Å²	48.8	6%	0.063	24%	0.239	C	C	.	.	H	α-helix	trans	-64.9	-45.5	177.9	-68	172.4	0	0	0	110.9	E300 E301 C304 L309 R310 V315 R316 R317	E300-L313 HydrophobicContact CG-CD1 4Å; E300-L313 HydrophobicContact CG-CD2 4.5Å; E301-L313 HydrophobicContact CG-CB 3.38Å; E301-L313 HydrophobicContact CG-CD1 4.01Å; E301-L313 HydrophobicContact CG-CG 4.3Å; C304-L313 HydrophobicContact CB-CD1 4.26Å; L309-L313 HydrophobicContact CD1-CG 4.33Å; L309-L313 HydrophobicContact CG-CD1 4.18Å; L309-L313 HydrophobicContact CG-CG 4.44Å; L309-L313 WeakPolarHBondContact O-CG 3.3Å; L309-L313 PolarHBondContact O-N 3.25Å; R310-L313 PolarHBondContact O-N 2.65Å; L313-V315 PolarHBondContact O-N 2.92Å; L313-R316 WeakPolarHBondContact O-CB 3.42Å; L313-R316 PolarHBondContact O-N 2.9Å; L313-R316 VanDerWaalsContact O-N 3.11Å; L313-R317 PolarHBondContact O-N 2.77Å
314	F	91.4	Very high	85.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.8	-45.6	174.4	-179.2	-100	0	0	0	112	M270 R310 L311 R316 R317 V318 L332 M342 S345	M270-F314 HydrophobicContact CB-CD2 4.32Å; M270-F314 HydrophobicContact CB-CE2 3.98Å; M270-F314 HydrophobicContact CG-CD2 4.49Å; M270-F314 HydrophobicContact SD-CD2 4.33Å; M270-F314 HydrophobicContact SD-CG 4.35Å; R310-F314 WeakPolarHBondContact O-CB 3.01Å; R310-F314 PolarHBondContact O-N 3.38Å; L311-F314 PolarHBondContact O-N 2.87Å; F314-R316 VanDerWaalsContact C-N 3.33Å; F314-R316 PolarHBondContact O-N 3.33Å; F314-R317 PolarHBondContact O-N 3.22Å; F314-V318 HydrophobicContact CD1-CG2 4.13Å; F314-V318 HydrophobicContact CD2-CG2 4.4Å; F314-V318 HydrophobicContact CE1-CG2 3.67Å; F314-V318 HydrophobicContact CE2-CG2 3.95Å; F314-V318 HydrophobicContact CG-CG2 4.49Å; F314-V318 HydrophobicContact CZ-CG2 3.57Å; F314-V318 WeakPolarHBondContact O-CG2 3.49Å; F314-V318 PolarHBondContact O-N 3.34Å; F314-L332 HydrophobicContact CZ-CD2 4.5Å; F314-M342 HydrophobicContact CE1-CB 4.2Å; F314-M342 HydrophobicContact CE1-CG 3.78Å; F314-M342 HydrophobicContact CZ-CB 4.37Å; F314-M342 HydrophobicContact CZ-CG 3.79Å; F314-S345 WeakPolarHBondContact CD1-OG 3.44Å
315	V	90.8	Very high	86	Confident	8 Å²	8	52.1 Å²	52.1	5%	0.048	25%	0.249	C	C	.	.	H	α-helix	trans	-56.8	-46.4	174.2	165.6	0	0	0	0	111	L311 R312 L313 R317 V318 I319 I349	L311-V315 HydrophobicContact CD2-CG2 4.15Å; L311-V315 WeakPolarHBondContact O-CB 3.4Å; L311-V315 VanDerWaalsContact O-CG2 3.26Å; L311-V315 WeakPolarHBondContact O-CG2 3.35Å; L311-V315 PolarHBondContact O-N 3.12Å; R312-V315 PolarHBondContact O-N 2.91Å; L313-V315 PolarHBondContact O-N 2.92Å; V315-R317 PolarHBondContact O-N 2.8Å; V315-V318 PolarHBondContact O-N 3.28Å; V315-I319 HydrophobicContact CG1-CD1 3.76Å; V315-I319 HydrophobicContact CG1-CG1 4.49Å; V315-I319 VanDerWaalsContact O-CG1 3.31Å; V315-I319 WeakPolarHBondContact O-CG1 3.36Å; V315-I319 PolarHBondContact O-N 2.88Å; V315-I349 HydrophobicContact CB-CG1 4.47Å; V315-I349 HydrophobicContact CG1-CG1 3.96Å; V315-I349 HydrophobicContact CG2-CD1 4.46Å; V315-I349 HydrophobicContact CG2-CG1 4.24Å
316	R	90.2	Very high	86.2	Confident	131 Å²	131	50.8 Å²	50.8	49%	0.494	24%	0.237	S	C	.	.	H	α-helix	trans	-59.5	-46.5	177.2	-173	177.7	82.8	173.8	-1.4	111.1	E300 R312 L313 F314 I319 N320	E300-R316 IonicContact OE2-NH2 3.44Å; R312-R316 PolarHBondContact O-N 2.93Å; L313-R316 WeakPolarHBondContact O-CB 3.42Å; L313-R316 PolarHBondContact O-N 2.9Å; L313-R316 VanDerWaalsContact O-N 3.11Å; F314-R316 VanDerWaalsContact C-N 3.33Å; F314-R316 PolarHBondContact O-N 3.33Å; R316-I319 PolarHBondContact O-N 3.25Å; R316-N320 VanDerWaalsContact O-CG 3.24Å; R316-N320 PolarHBondContact O-N 3.3Å; R316-N320 PolarHBondContact O-OD1 2.94Å
317	R	91.2	Very high	85.9	Confident	22 Å²	22	55.4 Å²	55.4	8%	0.083	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-45.6	179.1	-178.4	162.4	59.1	106.5	-0.8	112	C269 N295 L296 E301 L313 F314 V315 N320 L321	C269-R317 PolarHBondContact O-NH1 3.16Å; C269-R317 PolarHBondContact O-NH2 2.99Å; C269-R317 VanDerWaalsContact O-NH2 3.16Å; N295-R317 PolarHBondContact O-NH1 3.28Å; N295-R317 VanDerWaalsContact O-NH1 3.12Å; N295-R317 WeakPolarHBondContact OD1-CD 3.32Å; N295-R317 PolarHBondContact OD1-NH1 3.09Å; L296-R317 PolarHBondContact O-NH1 3.06Å; E301-R317 VanDerWaalsContact CD-NE 3.27Å; E301-R317 WeakPolarHBondContact OE1-CB 3.44Å; E301-R317 WeakPolarHBondContact OE1-CD 2.79Å; E301-R317 IonicContact OE1-CZ 3.94Å; E301-R317 IonicContact OE1-NE 3.79Å; E301-R317 PolarHBondContact OE1-NE 3.33Å; E301-R317 IonicContact OE1-NH2 2.82Å; E301-R317 IonicContact OE2-CZ 2.72Å; E301-R317 VanDerWaalsContact OE2-CZ 3.26Å; E301-R317 IonicContact OE2-NE 3.26Å; E301-R317 PolarHBondContact OE2-NE 3.02Å; E301-R317 IonicContact OE2-NH2 3.2Å; E301-R317 PolarHBondContact OE2-NH2 3.32Å; L313-R317 PolarHBondContact O-N 2.77Å; F314-R317 PolarHBondContact O-N 3.22Å; V315-R317 PolarHBondContact O-N 2.8Å; R317-N320 PolarHBondContact O-N 3.48Å; R317-L321 HydrophobicContact CG-CD1 4.43Å; R317-L321 WeakPolarHBondContact O-CG 3.27Å; R317-L321 PolarHBondContact O-N 3.43Å
318	V	91.4	Very high	86.2	Confident	0 Å²	0	57 Å²	57	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64	-43.5	177.4	176.4	0	0	0	0	111.2	F314 V315 N320 L321 L322 L332 I349 I367	F314-V318 HydrophobicContact CD1-CG2 4.13Å; F314-V318 HydrophobicContact CD2-CG2 4.4Å; F314-V318 HydrophobicContact CE1-CG2 3.67Å; F314-V318 HydrophobicContact CE2-CG2 3.95Å; F314-V318 HydrophobicContact CG-CG2 4.49Å; F314-V318 HydrophobicContact CZ-CG2 3.57Å; F314-V318 WeakPolarHBondContact O-CG2 3.49Å; F314-V318 PolarHBondContact O-N 3.34Å; V315-V318 PolarHBondContact O-N 3.28Å; V318-N320 VanDerWaalsContact C-N 3.32Å; V318-N320 PolarHBondContact O-N 3.23Å; V318-L321 WeakPolarHBondContact O-CB 3.38Å; V318-L321 PolarHBondContact O-N 3.47Å; V318-L321 VanDerWaalsContact O-N 3.16Å; V318-L322 HydrophobicContact CG1-CD1 4.05Å; V318-L322 HydrophobicContact CG1-CG 4.23Å; V318-L322 VanDerWaalsContact O-CG 3.25Å; V318-L322 WeakPolarHBondContact O-CG 2.9Å; V318-L322 PolarHBondContact O-N 3.44Å; V318-L332 HydrophobicContact CG1-CD2 4.07Å; V318-L332 HydrophobicContact CG2-CD2 3.98Å; V318-I349 HydrophobicContact CB-CD1 3.85Å; V318-I349 HydrophobicContact CG1-CD1 3.67Å; V318-I367 HydrophobicContact CG1-CD1 4.35Å
319	I	89.4	Confident	86.5	Confident	40 Å²	40	54 Å²	54	21%	0.205	25%	0.254	C	S	.	.	H	α-helix	trans	-58.3	-45.6	176.1	-70	168.9	0	0	0	111.1	V315 R316 L321 L322 D323 I349 L352	V315-I319 HydrophobicContact CG1-CD1 3.76Å; V315-I319 HydrophobicContact CG1-CG1 4.49Å; V315-I319 VanDerWaalsContact O-CG1 3.31Å; V315-I319 WeakPolarHBondContact O-CG1 3.36Å; V315-I319 PolarHBondContact O-N 2.88Å; R316-I319 PolarHBondContact O-N 3.25Å; I319-L321 VanDerWaalsContact C-N 3.31Å; I319-L321 PolarHBondContact O-N 3.37Å; I319-L322 PolarHBondContact O-N 3.49Å; I319-D323 PolarHBondContact O-N 3.21Å; I319-I349 HydrophobicContact CG1-CG1 4.43Å; I319-L352 HydrophobicContact CD1-CD1 4.19Å
320	N	88.5	Confident	86.9	Confident	89 Å²	89	50.3 Å²	50.3	48%	0.476	24%	0.235	S	C	.	.	H	α-helix	trans	-59.9	-41.4	176.7	-68.3	-7.1	0	0	0	111.9	R316 R317 V318 D323 E324	R316-N320 VanDerWaalsContact O-CG 3.24Å; R316-N320 PolarHBondContact O-N 3.3Å; R316-N320 PolarHBondContact O-OD1 2.94Å; R317-N320 PolarHBondContact O-N 3.48Å; V318-N320 VanDerWaalsContact C-N 3.32Å; V318-N320 PolarHBondContact O-N 3.23Å; N320-D323 PolarHBondContact O-N 2.92Å; N320-E324 WeakPolarHBondContact O-CB 3.37Å; N320-E324 PolarHBondContact O-N 2.9Å
321	L	88.6	Confident	87.4	Confident	5 Å²	5	50 Å²	50	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-41.2	175.8	-71.3	172.7	0	0	0	112.6	A268 N295 R317 V318 I319 D323 E324 Y325 I330	A268-L321 HydrophobicContact CB-CD1 3.8Å; N295-L321 HydrophobicContact CB-CD1 4.02Å; N295-L321 HydrophobicContact CB-CD2 4.39Å; R317-L321 HydrophobicContact CG-CD1 4.43Å; R317-L321 WeakPolarHBondContact O-CG 3.27Å; R317-L321 PolarHBondContact O-N 3.43Å; V318-L321 WeakPolarHBondContact O-CB 3.38Å; V318-L321 PolarHBondContact O-N 3.47Å; V318-L321 VanDerWaalsContact O-N 3.16Å; I319-L321 VanDerWaalsContact C-N 3.31Å; I319-L321 PolarHBondContact O-N 3.37Å; L321-D323 PolarHBondContact O-N 3.39Å; L321-E324 PolarHBondContact O-N 3.37Å; L321-Y325 HydrophobicContact CD2-CD2 3.91Å; L321-Y325 HydrophobicContact CD2-CE2 3.7Å; L321-Y325 WeakPolarHBondContact O-CB 3.48Å; L321-Y325 PolarHBondContact O-N 3.28Å; L321-I330 HydrophobicContact CB-CD1 4.48Å
322	L	87.2	Confident	87.8	Confident	15 Å²	15	49.4 Å²	49.4	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-32.9	177.2	-63.4	169	0	0	0	111.5	V318 I319 I330 I349 S366 I367	V318-L322 HydrophobicContact CG1-CD1 4.05Å; V318-L322 HydrophobicContact CG1-CG 4.23Å; V318-L322 VanDerWaalsContact O-CG 3.25Å; V318-L322 WeakPolarHBondContact O-CG 2.9Å; V318-L322 PolarHBondContact O-N 3.44Å; I319-L322 PolarHBondContact O-N 3.49Å; L322-I330 HydrophobicContact CD2-CD1 3.68Å; L322-I330 HydrophobicContact CG-CD1 4.38Å; L322-I349 HydrophobicContact CD1-CG2 4.14Å; L322-S366 WeakPolarHBondContact CD2-OG 3.21Å; L322-I367 HydrophobicContact CD1-CD1 4.35Å; L322-I367 HydrophobicContact CD1-CG1 4.32Å; L322-I367 HydrophobicContact CD2-CG1 3.65Å
323	D	85.1	Confident	88.2	Confident	76 Å²	76	44.5 Å²	44.5	41%	0.406	21%	0.212	S	C	.	.	H	α-helix	trans	-79.7	-36.8	176.9	-79.8	-32.8	0	0	0	113.3	I319 N320 L321 K326 R364	I319-D323 PolarHBondContact O-N 3.21Å; N320-D323 PolarHBondContact O-N 2.92Å; L321-D323 PolarHBondContact O-N 3.39Å; D323-K326 VanDerWaalsContact O-CE 3.23Å; D323-K326 WeakPolarHBondContact O-CE 3.43Å; D323-K326 WeakPolarHBondContact O-CG 3.45Å; D323-R364 IonicContact OD1-NH1 2.85Å; D323-R364 PolarHBondContact OD1-NH1 3.36Å
324	E	84.8	Confident	88.4	Confident	129 Å²	129	43.9 Å²	43.9	60%	0.603	21%	0.209	S	C	*	.	H	α-helix	trans	-71.3	-43.6	178.4	-174.4	176.5	178.1	0	0	111.6	N320 L321	N320-E324 WeakPolarHBondContact O-CB 3.37Å; N320-E324 PolarHBondContact O-N 2.9Å; L321-E324 PolarHBondContact O-N 3.37Å
325	Y	82.9	Confident	88.5	Confident	42 Å²	42	44.9 Å²	44.9	17%	0.165	21%	0.214	C	C	.	.			trans	-113	60.3	-170.7	-62.1	-81.1	0	0	0	112.8	I266 L321 N327 E328	I266-Y325 HydrophobicContact CD1-CD1 3.3Å; I266-Y325 HydrophobicContact CD1-CD2 3.33Å; I266-Y325 HydrophobicContact CD1-CE1 3.76Å; I266-Y325 HydrophobicContact CD1-CE2 3.8Å; I266-Y325 HydrophobicContact CD1-CG 3.03Å; L321-Y325 HydrophobicContact CD2-CD2 3.91Å; L321-Y325 HydrophobicContact CD2-CE2 3.7Å; L321-Y325 WeakPolarHBondContact O-CB 3.48Å; L321-Y325 PolarHBondContact O-N 3.28Å; Y325-N327 PolarHBondContact O-N 2.99Å; Y325-N327 VanDerWaalsContact O-N 3.16Å; Y325-E328 HydrophobicContact CD1-CG 3.99Å; Y325-E328 HydrophobicContact CG-CG 4.47Å; Y325-E328 PolarHBondContact O-N 2.9Å
326	K	75.5	Confident	88.4	Confident	115 Å²	115	45.3 Å²	45.3	50%	0.5	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.1	-173.3	-65.2	177.6	-174.8	167.1	0	115	D323	D323-K326 VanDerWaalsContact O-CE 3.23Å; D323-K326 WeakPolarHBondContact O-CE 3.43Å; D323-K326 WeakPolarHBondContact O-CG 3.45Å
327	N	74.6	Confident	88.2	Confident	160 Å²	160	40 Å²	40	86%	0.856	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-0.2	-175.5	-62.9	-18.3	0	0	0	113.2	Y325	Y325-N327 PolarHBondContact O-N 2.99Å; Y325-N327 VanDerWaalsContact O-N 3.16Å
328	E	82.6	Confident	88.2	Confident	75 Å²	75	39 Å²	39	35%	0.35	20%	0.198	S	C	.	.	S	Bend	trans	-99.4	154	-177	-52.5	-66.9	-157.2	0	0	111.5	G264 I266 Y325 I330	G264-E328 WeakPolarHBondContact CA-OE2 3.32Å; I266-E328 HydrophobicContact CD1-CB 3.85Å; I266-E328 HydrophobicContact CD1-CG 4.19Å; I266-E328 HydrophobicContact CG1-CB 4.33Å; Y325-E328 HydrophobicContact CD1-CG 3.99Å; Y325-E328 HydrophobicContact CG-CG 4.47Å; Y325-E328 PolarHBondContact O-N 2.9Å; E328-I330 PolarHBondContact O-N 2.97Å
329	S	88.2	Confident	88.2	Confident	15 Å²	15	39 Å²	39	11%	0.105	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	111.7	176.5	-61.3	0	0	0	0	110.7	G264 I266 N368	G264-S329 PolarHBondContact O-N 3.2Å; I266-S329 PolarHBondContact N-O 2.99Å; S329-N368 WeakPolarHBondContact CA-OD1 3.32Å; S329-N368 WeakPolarHBondContact CB-OD1 3.47Å
330	I	91.8	Very high	88.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.8	-179.8	-63.3	159.6	0	0	0	109.8	I266 L321 L322 E328 L332 S366 I367 N368	I266-I330 HydrophobicContact CB-CG1 4.09Å; I266-I330 HydrophobicContact CD1-CG1 4.28Å; L321-I330 HydrophobicContact CB-CD1 4.48Å; L322-I330 HydrophobicContact CD2-CD1 3.68Å; L322-I330 HydrophobicContact CG-CD1 4.38Å; E328-I330 PolarHBondContact O-N 2.97Å; I330-L332 HydrophobicContact CG2-CD2 4.27Å; I330-S366 WeakPolarHBondContact CB-O 3.3Å; I330-S366 PolarHBondContact N-O 3.47Å; I330-I367 CarbonylContact O-C 3.59Å; I330-I367 WeakPolarHBondContact O-CA 3.26Å; I330-N368 PolarHBondContact N-OD1 2.77Å; I330-N368 PolarHBondContact O-N 2.85Å
331	Y	95.2	Very high	88.4	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137	172.7	-67.9	-94.4	0	0	0	109.9	I265 I266 L267 A268 N368 G369 F524 I525 T528	I265-Y331 HydrophobicContact CG2-CD2 4.01Å; I265-Y331 HydrophobicContact CG2-CE2 4.36Å; I266-Y331 PolarHBondContact O-N 2.92Å; L267-Y331 WeakPolarHBondContact CA-O 3.44Å; L267-Y331 HydrophobicContact CD2-CG 4.5Å; A268-Y331 PolarHBondContact N-O 3.16Å; Y331-N368 HydrophobicContact CE1-CB 3.96Å; Y331-N368 HydrophobicContact CE2-CB 3.98Å; Y331-G369 WeakPolarHBondContact CA-O 3.34Å; Y331-F524 HydrophobicContact CD1-CE1 4.34Å; Y331-F524 HydrophobicContact CE1-CE1 4.31Å; Y331-I525 HydrophobicContact CD1-CG1 3.96Å; Y331-I525 HydrophobicContact CD2-CG1 4.3Å; Y331-I525 HydrophobicContact CD2-CG2 4.45Å; Y331-I525 HydrophobicContact CE1-CB 4.39Å; Y331-I525 HydrophobicContact CE1-CG1 3.88Å; Y331-I525 HydrophobicContact CE1-CG2 4.5Å; Y331-I525 HydrophobicContact CE2-CB 4.46Å; Y331-I525 HydrophobicContact CE2-CG1 4.22Å; Y331-I525 HydrophobicContact CE2-CG2 3.76Å; Y331-I525 HydrophobicContact CG-CG1 4.18Å; Y331-I525 PolarHBondContact OH-O 2.96Å; Y331-T528 VanDerWaalsContact CE1-OG1 3.23Å; Y331-T528 WeakPolarHBondContact CE1-OG1 3.28Å; Y331-T528 PolarHBondContact OH-OG1 3.3Å
332	L	96.3	Very high	88.6	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.8	174.2	-51.2	-174.8	0	0	0	109	A268 F314 V318 I330 M342 V346 I367 G369 I370 I371	A268-L332 HydrophobicContact CB-CD2 3.74Å; F314-L332 HydrophobicContact CZ-CD2 4.5Å; V318-L332 HydrophobicContact CG1-CD2 4.07Å; V318-L332 HydrophobicContact CG2-CD2 3.98Å; I330-L332 HydrophobicContact CG2-CD2 4.27Å; L332-M342 HydrophobicContact CB-CE 3.6Å; L332-M342 HydrophobicContact CB-CG 4.01Å; L332-M342 HydrophobicContact CB-SD 3.6Å; L332-M342 VanDerWaalsContact CB-SD 3.6Å; L332-M342 HydrophobicContact CD1-CG 4.06Å; L332-M342 HydrophobicContact CD1-SD 4.19Å; L332-M342 WeakPolarHBondContact O-CE 3.39Å; L332-V346 HydrophobicContact CD1-CG2 3.32Å; L332-I367 HydrophobicContact CD1-CD1 4.26Å; L332-I367 HydrophobicContact CD1-CG2 4.33Å; L332-I367 HydrophobicContact CG-CG2 4.1Å; L332-G369 PolarHBondContact N-O 2.91Å; L332-G369 VanDerWaalsContact N-O 3.08Å; L332-I370 HydrophobicContact CB-CG1 4.48Å; L332-I371 PolarHBondContact O-N 3.33Å
333	V	96.7	Very high	88.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.3	178.4	-172.5	0	0	0	0	110.2	L267 A268 C269 M270 L288 F335 I371 I373	L267-V333 HydrophobicContact CB-CG2 4.26Å; L267-V333 HydrophobicContact CD2-CG2 4.31Å; A268-V333 PolarHBondContact O-N 2.93Å; C269-V333 CarbonylContact C-O 3.42Å; C269-V333 VanDerWaalsContact CA-O 3.26Å; C269-V333 WeakPolarHBondContact CA-O 3.41Å; M270-V333 PolarHBondContact N-O 3.44Å; L288-V333 HydrophobicContact CD1-CG1 4.11Å; V333-F335 HydrophobicContact CG1-CE2 4.24Å; V333-F335 HydrophobicContact CG1-CZ 4.49Å; V333-I371 WeakPolarHBondContact CA-O 3.38Å; V333-I371 HydrophobicContact CG1-CB 4.43Å; V333-I371 HydrophobicContact CG1-CG2 4.36Å; V333-I371 HydrophobicContact CG2-CB 4.31Å; V333-I371 HydrophobicContact CG2-CD1 3.96Å; V333-I373 HydrophobicContact CG1-CD1 3.98Å
334	S	95.2	Very high	89.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	155	177.6	50.4	0	0	0	0	113.4	M270 S339 M342 I371 I373	M270-S334 CarbonylContact O-C 3.56Å; M270-S334 VanDerWaalsContact O-CA 3.3Å; M270-S334 WeakPolarHBondContact O-CA 3.46Å; S334-S339 VanDerWaalsContact CB-CA 3.4Å; S334-S339 WeakPolarHBondContact CB-OG 3.49Å; S334-S339 WeakPolarHBondContact OG-CA 3.08Å; S334-S339 WeakPolarHBondContact OG-CB 3.42Å; S334-S339 PolarHBondContact OG-OG 3.48Å; S334-M342 VanDerWaalsContact CB-CE 3.43Å; S334-M342 WeakPolarHBondContact OG-CE 3.47Å; S334-I371 PolarHBondContact N-O 3.13Å; S334-I373 WeakPolarHBondContact O-CA 3.32Å; S334-I373 VanDerWaalsContact O-CB 3.25Å; S334-I373 WeakPolarHBondContact O-CB 3.34Å; S334-I373 PolarHBondContact O-N 3.23Å
335	F	92.6	Very high	89.5	Confident	20 Å²	20	23.2 Å²	23.2	9%	0.088	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.3	174.4	-61.7	-94.7	0	0	0	111.1	M270 T271 L281 L284 L285 L288 V333 V337 G338 I373	M270-F335 PolarHBondContact O-N 3.27Å; T271-F335 HydrophobicContact CG2-CD2 3.97Å; T271-F335 HydrophobicContact CG2-CE2 4.15Å; L281-F335 HydrophobicContact CD1-CD1 4.15Å; L281-F335 HydrophobicContact CD1-CD2 4.2Å; L281-F335 HydrophobicContact CD1-CE1 4.1Å; L281-F335 HydrophobicContact CD1-CE2 4.16Å; L281-F335 HydrophobicContact CD1-CG 4.19Å; L281-F335 HydrophobicContact CD1-CZ 4.1Å; L284-F335 HydrophobicContact CB-CE1 4.43Å; L284-F335 HydrophobicContact CD1-CE1 4.11Å; L285-F335 HydrophobicContact CD2-CE2 4.26Å; L285-F335 HydrophobicContact CD2-CZ 4.43Å; L288-F335 HydrophobicContact CD1-CE2 4.45Å; L288-F335 HydrophobicContact CD1-CZ 3.91Å; V333-F335 HydrophobicContact CG1-CE2 4.24Å; V333-F335 HydrophobicContact CG1-CZ 4.49Å; F335-V337 PolarHBondContact O-N 3.02Å; F335-G338 WeakPolarHBondContact O-CA 2.83Å; F335-G338 PolarHBondContact O-N 3.43Å; F335-I373 CarbonylContact C-O 3.42Å; F335-I373 WeakPolarHBondContact CA-O 3.22Å; F335-I373 HydrophobicContact CD1-CB 4.06Å; F335-I373 HydrophobicContact CD1-CD1 4.16Å; F335-I373 HydrophobicContact CD1-CG2 4.01Å; F335-I373 HydrophobicContact CE1-CB 4.37Å; F335-I373 HydrophobicContact CE1-CD1 3.61Å; F335-I373 HydrophobicContact CE1-CG2 4.24Å; F335-I373 HydrophobicContact CZ-CD1 3.89Å
336	G	89.5	Confident	89.9	Confident	17 Å²	17	21.2 Å²	21.2	18%	0.175	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	-130.4	173.1	0	0	0	0	0	113	G338 S339 I373 G374 P376	G336-G338 PolarHBondContact O-N 2.99Å; G336-S339 WeakPolarHBondContact O-CB 3.21Å; G336-S339 PolarHBondContact O-N 3.14Å; G336-S339 PolarHBondContact O-OG 3.32Å; G336-I373 PolarHBondContact N-O 3.03Å; G336-G374 WeakPolarHBondContact CA-O 3.28Å; G336-P376 WeakPolarHBondContact O-CD 3.49Å
337	V	85.5	Confident	90.5	Very high	21 Å²	21	16.8 Å²	16.8	13%	0.127	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-29.3	178.4	-179.6	0	0	0	0	112.5	I13 F335 S339 L340 P376	I13-V337 HydrophobicContact CG2-CG1 3.29Å; F335-V337 PolarHBondContact O-N 3.02Å; V337-S339 PolarHBondContact O-N 3.28Å; V337-L340 WeakPolarHBondContact O-CB 3.36Å; V337-L340 PolarHBondContact O-N 3.42Å; V337-P376 HydrophobicContact CG2-CG 4.29Å
338	G	89.8	Confident	91.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-54.6	-24.6	172.3	0	0	0	0	0	113.1	M270 F272 F335 G336 L340 L341 M342	M270-G338 VanDerWaalsContact SD-O 3.32Å; F272-G338 WeakPolarHBondContact O-CA 3.36Å; F272-G338 PolarHBondContact O-N 3.48Å; F335-G338 WeakPolarHBondContact O-CA 2.83Å; F335-G338 PolarHBondContact O-N 3.43Å; G336-G338 PolarHBondContact O-N 2.99Å; G338-L340 VanDerWaalsContact C-N 3.33Å; G338-L340 PolarHBondContact O-N 3.1Å; G338-L341 PolarHBondContact O-N 3.16Å; G338-M342 WeakPolarHBondContact O-CB 3.41Å; G338-M342 PolarHBondContact O-N 2.94Å
339	S	92.9	Very high	91.4	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-64.1	-35.1	175	-51	0	0	0	0	113.6	S334 G336 V337 L343 L375	S334-S339 VanDerWaalsContact CB-CA 3.4Å; S334-S339 WeakPolarHBondContact CB-OG 3.49Å; S334-S339 WeakPolarHBondContact OG-CA 3.08Å; S334-S339 WeakPolarHBondContact OG-CB 3.42Å; S334-S339 PolarHBondContact OG-OG 3.48Å; G336-S339 WeakPolarHBondContact O-CB 3.21Å; G336-S339 PolarHBondContact O-N 3.14Å; G336-S339 PolarHBondContact O-OG 3.32Å; V337-S339 PolarHBondContact O-N 3.28Å; S339-L343 VanDerWaalsContact O-CG 3.22Å; S339-L343 WeakPolarHBondContact O-CG 3.27Å; S339-L343 PolarHBondContact O-N 3.15Å; S339-L343 VanDerWaalsContact O-N 3.08Å; S339-L375 VanDerWaalsContact CB-CD1 3.48Å
340	L	90.2	Very high	91.1	Very high	4 Å²	4	8.9 Å²	8.9	2%	0.021	5%	0.049	C	C	.	.	H	α-helix	trans	-66.8	-44.8	174.7	-65.8	173.4	0	0	0	110.9	I13 V337 G338 M342 L343 L344 L375 P376 R384 L391	I13-L340 HydrophobicContact CD1-CB 4.35Å; I13-L340 HydrophobicContact CG1-CD1 4.33Å; V337-L340 WeakPolarHBondContact O-CB 3.36Å; V337-L340 PolarHBondContact O-N 3.42Å; G338-L340 VanDerWaalsContact C-N 3.33Å; G338-L340 PolarHBondContact O-N 3.1Å; L340-M342 VanDerWaalsContact C-N 3.35Å; L340-M342 PolarHBondContact O-N 2.99Å; L340-L343 PolarHBondContact O-N 3.06Å; L340-L344 WeakPolarHBondContact O-CB 3.42Å; L340-L344 VanDerWaalsContact O-CG 3.26Å; L340-L344 WeakPolarHBondContact O-CG 3.42Å; L340-L344 PolarHBondContact O-N 3.13Å; L340-L375 HydrophobicContact CD2-CD1 3.64Å; L340-L375 HydrophobicContact CG-CD1 3.95Å; L340-P376 HydrophobicContact CD1-CG 3.75Å; L340-P376 HydrophobicContact CG-CG 4.07Å; L340-R384 VanDerWaalsContact CD1-NH2 3.3Å; L340-L391 HydrophobicContact CD2-CD1 3.76Å
341	L	90.5	Very high	90.7	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-64	-41.7	-179.9	-65.8	176.2	0	0	0	111.3	V9 I13 M270 F272 M307 G338 L344 S345	V9-L341 HydrophobicContact CG1-CD2 4.36Å; I13-L341 HydrophobicContact CD1-CD2 3.4Å; I13-L341 VanDerWaalsContact CD1-CD2 3.4Å; I13-L341 HydrophobicContact CD1-CG 4.06Å; M270-L341 HydrophobicContact CE-CB 3.5Å; M270-L341 HydrophobicContact CE-CD1 3.44Å; M270-L341 VanDerWaalsContact CE-CD1 3.44Å; M270-L341 HydrophobicContact CE-CG 4.11Å; M270-L341 HydrophobicContact SD-CB 3.73Å; F272-L341 HydrophobicContact CD1-CD1 3.78Å; F272-L341 HydrophobicContact CE1-CD1 4.17Å; M307-L341 HydrophobicContact CB-CD2 4.24Å; G338-L341 PolarHBondContact O-N 3.16Å; L341-L344 PolarHBondContact O-N 3.05Å; L341-S345 WeakPolarHBondContact O-CB 3.37Å; L341-S345 PolarHBondContact O-N 3.04Å; L341-S345 PolarHBondContact O-OG 3.3Å
342	M	93.6	Very high	89.9	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-65.5	-45.2	177.8	-177.8	-118.4	-86.8	0	0	111.9	M270 F314 L332 S334 G338 L340 L344 S345 V346 I370	M270-M342 HydrophobicContact SD-CB 4.19Å; F314-M342 HydrophobicContact CE1-CB 4.2Å; F314-M342 HydrophobicContact CE1-CG 3.78Å; F314-M342 HydrophobicContact CZ-CB 4.37Å; F314-M342 HydrophobicContact CZ-CG 3.79Å; L332-M342 HydrophobicContact CB-CE 3.6Å; L332-M342 HydrophobicContact CB-CG 4.01Å; L332-M342 HydrophobicContact CB-SD 3.6Å; L332-M342 VanDerWaalsContact CB-SD 3.6Å; L332-M342 HydrophobicContact CD1-CG 4.06Å; L332-M342 HydrophobicContact CD1-SD 4.19Å; L332-M342 WeakPolarHBondContact O-CE 3.39Å; S334-M342 VanDerWaalsContact CB-CE 3.43Å; S334-M342 WeakPolarHBondContact OG-CE 3.47Å; G338-M342 WeakPolarHBondContact O-CB 3.41Å; G338-M342 PolarHBondContact O-N 2.94Å; L340-M342 VanDerWaalsContact C-N 3.35Å; L340-M342 PolarHBondContact O-N 2.99Å; M342-L344 VanDerWaalsContact C-N 3.33Å; M342-L344 PolarHBondContact O-N 3.18Å; M342-S345 WeakPolarHBondContact O-CB 3.18Å; M342-S345 PolarHBondContact O-N 2.89Å; M342-S345 VanDerWaalsContact O-N 3.1Å; M342-V346 WeakPolarHBondContact O-CG2 3.45Å; M342-V346 PolarHBondContact O-N 3.29Å; M342-I370 HydrophobicContact CE-CG2 3.97Å; M342-I370 HydrophobicContact SD-CB 4.46Å; M342-I370 HydrophobicContact SD-CG1 4.45Å; M342-I370 HydrophobicContact SD-CG2 3.37Å; M342-I370 WeakPolarHBondContact SD-CG2 3.45Å
343	L	93.3	Very high	88.7	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.1	-40.9	176.7	-69	172.8	0	0	0	112.3	S339 L340 S345 V346 I347 I370 L375 L391 I394 I399 F401	S339-L343 VanDerWaalsContact O-CG 3.22Å; S339-L343 WeakPolarHBondContact O-CG 3.27Å; S339-L343 PolarHBondContact O-N 3.15Å; S339-L343 VanDerWaalsContact O-N 3.08Å; L340-L343 PolarHBondContact O-N 3.06Å; L343-S345 VanDerWaalsContact C-N 3.34Å; L343-V346 PolarHBondContact O-N 3.03Å; L343-I347 WeakPolarHBondContact O-CG1 3.42Å; L343-I347 PolarHBondContact O-N 3.33Å; L343-I370 HydrophobicContact CD2-CD1 4.32Å; L343-I370 HydrophobicContact CD2-CG2 4.03Å; L343-L375 HydrophobicContact CD1-CD1 4.25Å; L343-L375 HydrophobicContact CD1-CD2 4.33Å; L343-L391 HydrophobicContact CB-CD2 3.73Å; L343-L391 HydrophobicContact CD1-CD2 4.21Å; L343-I394 HydrophobicContact CB-CD1 4.11Å; L343-I394 HydrophobicContact CD1-CD1 4.05Å; L343-I394 HydrophobicContact CD2-CD1 3.9Å; L343-I394 HydrophobicContact CG-CD1 4.23Å; L343-I399 HydrophobicContact CD2-CD1 4.23Å; L343-F401 HydrophobicContact CD1-CE1 4.47Å
344	L	91	Very high	86.9	Confident	19 Å²	19	23.7 Å²	23.7	10%	0.099	13%	0.133	C	C	.	.	H	α-helix	trans	-64.7	-38.3	173.6	-69.6	167.8	0	0	0	112.3	V9 I13 L311 L340 L341 M342 V346 I347 H348 P390 L391	V9-L344 HydrophobicContact CB-CD1 4.41Å; V9-L344 HydrophobicContact CG1-CD1 3.88Å; V9-L344 HydrophobicContact CG2-CD1 3.88Å; I13-L344 HydrophobicContact CD1-CD1 4.5Å; L311-L344 HydrophobicContact CD1-CB 3.82Å; L340-L344 WeakPolarHBondContact O-CB 3.42Å; L340-L344 VanDerWaalsContact O-CG 3.26Å; L340-L344 WeakPolarHBondContact O-CG 3.42Å; L340-L344 PolarHBondContact O-N 3.13Å; L341-L344 PolarHBondContact O-N 3.05Å; M342-L344 VanDerWaalsContact C-N 3.33Å; M342-L344 PolarHBondContact O-N 3.18Å; L344-V346 VanDerWaalsContact C-N 3.33Å; L344-V346 PolarHBondContact O-N 2.87Å; L344-I347 HydrophobicContact CD2-CD1 4.47Å; L344-I347 PolarHBondContact O-N 3.2Å; L344-H348 PolarHBondContact O-N 2.91Å; L344-P390 HydrophobicContact CD2-CB 4.09Å; L344-P390 HydrophobicContact CD2-CG 3.97Å; L344-L391 HydrophobicContact CD2-CD2 4.3Å; L344-L391 HydrophobicContact CG-CD2 4.33Å
345	S	91.5	Very high	85	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.1	-40.5	176.6	-58.5	0	0	0	0	111.6	F314 L341 M342 L343 H348 I349	F314-S345 WeakPolarHBondContact CD1-OG 3.44Å; L341-S345 WeakPolarHBondContact O-CB 3.37Å; L341-S345 PolarHBondContact O-N 3.04Å; L341-S345 PolarHBondContact O-OG 3.3Å; M342-S345 WeakPolarHBondContact O-CB 3.18Å; M342-S345 PolarHBondContact O-N 2.89Å; M342-S345 VanDerWaalsContact O-N 3.1Å; L343-S345 VanDerWaalsContact C-N 3.34Å; S345-H348 WeakPolarHBondContact O-CB 3.42Å; S345-H348 PolarHBondContact O-N 2.89Å; S345-I349 WeakPolarHBondContact O-CD1 2.99Å; S345-I349 VanDerWaalsContact O-CG1 3.25Å; S345-I349 WeakPolarHBondContact O-CG1 3.47Å; S345-I349 PolarHBondContact O-N 3.32Å
346	V	91.2	Very high	83.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.5	-44.8	177	168.7	0	0	0	0	111.8	L332 M342 L343 L344 H348 I349 L350 I370 P395 L397	L332-V346 HydrophobicContact CD1-CG2 3.32Å; M342-V346 WeakPolarHBondContact O-CG2 3.45Å; M342-V346 PolarHBondContact O-N 3.29Å; L343-V346 PolarHBondContact O-N 3.03Å; L344-V346 VanDerWaalsContact C-N 3.33Å; L344-V346 PolarHBondContact O-N 2.87Å; V346-H348 PolarHBondContact O-N 2.99Å; V346-I349 PolarHBondContact O-N 3.29Å; V346-L350 HydrophobicContact CG1-CD1 3.8Å; V346-L350 WeakPolarHBondContact O-CB 3.38Å; V346-L350 PolarHBondContact O-N 3.22Å; V346-I370 HydrophobicContact CB-CD1 4.33Å; V346-I370 HydrophobicContact CG1-CD1 3.97Å; V346-I370 HydrophobicContact CG2-CD1 3.81Å; V346-I370 HydrophobicContact CG2-CG1 4.42Å; V346-P395 HydrophobicContact CG1-CG 4.08Å; V346-L397 HydrophobicContact CG1-CD1 3.8Å
347	I	89.2	Confident	81.2	Confident	22 Å²	22	39.4 Å²	39.4	11%	0.113	21%	0.213	C	C	.	.	H	α-helix	trans	-55.7	-44.7	175.3	-64.8	162.1	0	0	0	109.5	L343 L344 S351 P390 S393 I394	L343-I347 WeakPolarHBondContact O-CG1 3.42Å; L343-I347 PolarHBondContact O-N 3.33Å; L344-I347 HydrophobicContact CD2-CD1 4.47Å; L344-I347 PolarHBondContact O-N 3.2Å; I347-S351 WeakPolarHBondContact O-CB 3.33Å; I347-S351 PolarHBondContact O-N 3.14Å; I347-P390 WeakPolarHBondContact CD1-O 3.46Å; I347-S393 WeakPolarHBondContact CD1-OG 3.39Å; I347-I394 HydrophobicContact CD1-CG1 3.94Å; I347-I394 HydrophobicContact CG1-CG1 4.13Å
348	H	87.5	Confident	79.3	Confident	64 Å²	64	46.9 Å²	46.9	30%	0.296	25%	0.247	S	C	.	.	H	α-helix	trans	-67.4	-47.3	179.5	-174.7	-107.1	0	0	0	113	L344 S345 V346 L350 S351 L352	L344-H348 PolarHBondContact O-N 2.91Å; S345-H348 WeakPolarHBondContact O-CB 3.42Å; S345-H348 PolarHBondContact O-N 2.89Å; V346-H348 PolarHBondContact O-N 2.99Å; H348-L350 VanDerWaalsContact C-N 3.31Å; H348-L350 PolarHBondContact O-N 2.92Å; H348-S351 PolarHBondContact O-N 3.19Å; H348-L352 WeakPolarHBondContact O-CG 3.11Å; H348-L352 PolarHBondContact O-N 3.1Å; H348-L352 VanDerWaalsContact O-N 3.08Å
349	I	88.3	Confident	77	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-56.8	-46.3	178.5	-70.1	160.1	0	0	0	110.6	V315 V318 I319 L322 S345 V346 L352 N353 I367	V315-I349 HydrophobicContact CB-CG1 4.47Å; V315-I349 HydrophobicContact CG1-CG1 3.96Å; V315-I349 HydrophobicContact CG2-CD1 4.46Å; V315-I349 HydrophobicContact CG2-CG1 4.24Å; V318-I349 HydrophobicContact CB-CD1 3.85Å; V318-I349 HydrophobicContact CG1-CD1 3.67Å; I319-I349 HydrophobicContact CG1-CG1 4.43Å; L322-I349 HydrophobicContact CD1-CG2 4.14Å; S345-I349 WeakPolarHBondContact O-CD1 2.99Å; S345-I349 VanDerWaalsContact O-CG1 3.25Å; S345-I349 WeakPolarHBondContact O-CG1 3.47Å; S345-I349 PolarHBondContact O-N 3.32Å; V346-I349 PolarHBondContact O-N 3.29Å; I349-L352 WeakPolarHBondContact O-CB 3.1Å; I349-L352 PolarHBondContact O-N 3.3Å; I349-N353 PolarHBondContact O-N 3.12Å; I349-N353 VanDerWaalsContact O-N 3.15Å; I349-I367 HydrophobicContact CG2-CD1 4.4Å
350	L	82.4	Confident	74.3	Confident	19 Å²	19	59.8 Å²	59.8	10%	0.099	32%	0.316	C	S	.	.	H	α-helix	trans	-74.5	-30.1	-176.9	-68.2	174.5	0	0	0	112.6	V346 H348 L352 N353 N354 T365 P395 L397	V346-L350 HydrophobicContact CG1-CD1 3.8Å; V346-L350 WeakPolarHBondContact O-CB 3.38Å; V346-L350 PolarHBondContact O-N 3.22Å; H348-L350 VanDerWaalsContact C-N 3.31Å; H348-L350 PolarHBondContact O-N 2.92Å; L350-L352 VanDerWaalsContact C-N 3.3Å; L350-L352 PolarHBondContact O-N 2.72Å; L350-N353 PolarHBondContact O-N 3.21Å; L350-N354 PolarHBondContact O-N 3.4Å; L350-T365 HydrophobicContact CD2-CG2 3.26Å; L350-P395 HydrophobicContact CB-CG 4.16Å; L350-P395 HydrophobicContact CD1-CB 3.78Å; L350-P395 HydrophobicContact CD1-CG 3.08Å; L350-P395 HydrophobicContact CG-CG 4.19Å; L350-L397 HydrophobicContact CD1-CD1 3.82Å; L350-L397 HydrophobicContact CD1-CG 4.32Å
351	S	82.2	Confident	71.8	Confident	72 Å²	72	71.4 Å²	71.4	50%	0.503	36%	0.361	S	S	.	.	H	α-helix	trans	-63	-36	169.1	-171.9	0	0	0	0	112.6	I347 H348 S355	I347-S351 WeakPolarHBondContact O-CB 3.33Å; I347-S351 PolarHBondContact O-N 3.14Å; H348-S351 PolarHBondContact O-N 3.19Å; S351-S355 PolarHBondContact O-OG 3.41Å
352	L	79.4	Confident	69.4	Low	71 Å²	71	75.5 Å²	75.5	37%	0.372	39%	0.386	S	S	.	.	H	α-helix	trans	-70.6	-37.7	177.4	-68.6	172.1	0	0	0	112	I319 H348 I349 L350 S355	I319-L352 HydrophobicContact CD1-CD1 4.19Å; H348-L352 WeakPolarHBondContact O-CG 3.11Å; H348-L352 PolarHBondContact O-N 3.1Å; H348-L352 VanDerWaalsContact O-N 3.08Å; I349-L352 WeakPolarHBondContact O-CB 3.1Å; I349-L352 PolarHBondContact O-N 3.3Å; L350-L352 VanDerWaalsContact C-N 3.3Å; L350-L352 PolarHBondContact O-N 2.72Å; L352-S355 PolarHBondContact O-N 3.29Å
353	N	69.5	Low	67	Low	38 Å²	38	81.9 Å²	81.9	20%	0.203	42%	0.42	C	S	.	.	H	α-helix	trans	-69.2	-38.4	-179.6	-75.7	1.5	0	0	0	112.5	I349 L350 S355 R356 S357 R364 T365	I349-N353 PolarHBondContact O-N 3.12Å; I349-N353 VanDerWaalsContact O-N 3.15Å; L350-N353 PolarHBondContact O-N 3.21Å; N353-S355 PolarHBondContact O-N 3.2Å; N353-R356 PolarHBondContact O-N 3.25Å; N353-S357 PolarHBondContact O-N 3.45Å; N353-R364 PolarHBondContact ND2-O 3.11Å; N353-T365 HydrophobicContact CB-CG2 4.4Å
354	N	60.1	Low	64.7	Low	129 Å²	129	87.8 Å²	87.8	69%	0.69	44%	0.442	S	S	*	.	H	α-helix	trans	-59	-32.3	174.6	-73.4	-0.4	0	0	0	112.2	L350 R356	L350-N354 PolarHBondContact O-N 3.4Å; N354-R356 VanDerWaalsContact C-N 3.28Å; N354-R356 PolarHBondContact O-N 3.21Å
355	S	55.3	Low	63.1	Low	95 Å²	95	89.9 Å²	89.9	66%	0.664	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-14.4	178.7	-52	0	0	0	0	113.6	S351 L352 N353	S351-S355 PolarHBondContact O-OG 3.41Å; L352-S355 PolarHBondContact O-N 3.29Å; N353-S355 PolarHBondContact O-N 3.2Å
356	R	51.6	Low	62.1	Low	195 Å²	195	91 Å²	91	74%	0.736	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-12.9	-178.6	-77	-178	165.1	177.7	-4.9	113.5	N353 N354 E358	N353-R356 PolarHBondContact O-N 3.25Å; N354-R356 VanDerWaalsContact C-N 3.28Å; N354-R356 PolarHBondContact O-N 3.21Å; R356-E358 PolarHBondContact O-N 2.89Å
357	S	50.3	Low	61.9	Low	78 Å²	78	91.3 Å²	91.3	55%	0.545	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-81.9	-4.2	-167.7	-167.3	0	0	0	0	115.4	N353 N359	N353-S357 PolarHBondContact O-N 3.45Å; S357-N359 PolarHBondContact O-N 2.64Å
358	E	45.9	Very low	62	Low	178 Å²	178	91.6 Å²	91.6	83%	0.832	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-68.1	-13.6	-178.6	-75	-176.5	165.1	0	0	114.1	R356	R356-E358 PolarHBondContact O-N 2.89Å
359	N	41.5	Very low	62.2	Low	144 Å²	144	88.6 Å²	88.6	77%	0.77	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-128	10.2	-171.2	-75.2	-31.2	0	0	0	117	S357	S357-N359 PolarHBondContact O-N 2.64Å
360	N	37	Very low	62.6	Low	127 Å²	127	88.5 Å²	88.5	68%	0.679	45%	0.453	S	S	*	.			trans	-156.8	123.9	173.1	-88.9	-49.3	0	0	0	112.9	T362	N360-T362 PolarHBondContact O-N 3.36Å
361	Y	37.7	Very low	63.2	Low	248 Å²	248	87.6 Å²	87.6	97%	0.973	45%	0.448	S	S	*	.			trans	-64.1	27.8	179	-97.6	-88.6	0	0	0	115.9
362	T	39.6	Very low	63.9	Low	85 Å²	85	84.2 Å²	84.2	52%	0.521	42%	0.424	S	S	.	.			trans	-105.3	104.6	173	64	0	0	0	0	109.7	N360 R364	N360-T362 PolarHBondContact O-N 3.36Å; T362-R364 PolarHBondContact O-N 3.4Å
363	N	41.8	Very low	64.7	Low	134 Å²	134	81.2 Å²	81.2	72%	0.717	41%	0.409	S	S	*	.			trans	-57.8	68.9	176.1	-143.2	-4.8	0	0	0	111.3	T365	N363-T365 PolarHBondContact O-N 3.29Å
364	R	46.7	Very low	65.8	Low	124 Å²	124	79.6 Å²	79.6	47%	0.468	40%	0.401	S	S	.	.			trans	-91.3	86.6	-174.9	-79.7	-161.1	-172	175.8	12.8	111.5	D323 N353 T362	D323-R364 IonicContact OD1-NH1 2.85Å; D323-R364 PolarHBondContact OD1-NH1 3.36Å; N353-R364 PolarHBondContact ND2-O 3.11Å; T362-R364 PolarHBondContact O-N 3.4Å
365	T	56.1	Low	67.4	Low	63 Å²	63	73.5 Å²	73.5	39%	0.387	37%	0.369	S	S	.	.			trans	-138.8	91	147.4	57.2	0	0	0	0	109.2	L350 N353 N363 I367	L350-T365 HydrophobicContact CD2-CG2 3.26Å; N353-T365 HydrophobicContact CB-CG2 4.4Å; N363-T365 PolarHBondContact O-N 3.29Å; T365-I367 PolarHBondContact O-N 3.18Å; T365-I367 VanDerWaalsContact O-N 3.15Å
366	S	70.1	Confident	69.1	Low	25 Å²	25	69.1 Å²	69.1	18%	0.175	34%	0.338	C	S	.	.			trans	-78	18.9	-179.2	40.5	0	0	0	0	114.3	L322 I330 N368	L322-S366 WeakPolarHBondContact CD2-OG 3.21Å; I330-S366 WeakPolarHBondContact CB-O 3.3Å; I330-S366 PolarHBondContact N-O 3.47Å; S366-N368 PolarHBondContact O-N 3.45Å; S366-N368 PolarHBondContact O-OD1 3.49Å; S366-N368 VanDerWaalsContact O-OD1 3.12Å
367	I	88.6	Confident	71	Confident	6 Å²	6	60 Å²	60	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	106.7	171.8	-55.5	173.4	0	0	0	108.3	V318 L322 I330 L332 I349 T365 L397	V318-I367 HydrophobicContact CG1-CD1 4.35Å; L322-I367 HydrophobicContact CD1-CD1 4.35Å; L322-I367 HydrophobicContact CD1-CG1 4.32Å; L322-I367 HydrophobicContact CD2-CG1 3.65Å; I330-I367 CarbonylContact O-C 3.59Å; I330-I367 WeakPolarHBondContact O-CA 3.26Å; L332-I367 HydrophobicContact CD1-CD1 4.26Å; L332-I367 HydrophobicContact CD1-CG2 4.33Å; L332-I367 HydrophobicContact CG-CG2 4.1Å; I349-I367 HydrophobicContact CG2-CD1 4.4Å; T365-I367 PolarHBondContact O-N 3.18Å; T365-I367 VanDerWaalsContact O-N 3.15Å; I367-L397 HydrophobicContact CB-CD1 4.37Å; I367-L397 HydrophobicContact CG2-CD1 4Å; I367-L397 WeakPolarHBondContact O-CD2 3.5Å
368	N	89.7	Confident	72.7	Confident	28 Å²	28	58.8 Å²	58.8	15%	0.15	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-20.8	-176.2	-62	86.1	0	0	0	113.5	S329 I330 Y331 S366 S532	S329-N368 WeakPolarHBondContact CA-OD1 3.32Å; S329-N368 WeakPolarHBondContact CB-OD1 3.47Å; I330-N368 PolarHBondContact N-OD1 2.77Å; I330-N368 PolarHBondContact O-N 2.85Å; Y331-N368 HydrophobicContact CE1-CB 3.96Å; Y331-N368 HydrophobicContact CE2-CB 3.98Å; S366-N368 PolarHBondContact O-N 3.45Å; S366-N368 PolarHBondContact O-OD1 3.49Å; S366-N368 VanDerWaalsContact O-OD1 3.12Å; N368-S532 PolarHBondContact ND2-OG 2.94Å; N368-S532 VanDerWaalsContact ND2-OG 3.16Å
369	G	92.7	Very high	74.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	166.6	178.1	0	0	0	0	0	114.4	Y331 L332 P398	Y331-G369 WeakPolarHBondContact CA-O 3.34Å; L332-G369 PolarHBondContact N-O 2.91Å; L332-G369 VanDerWaalsContact N-O 3.08Å; G369-P398 WeakPolarHBondContact CA-O 3.47Å
370	I	95.5	Very high	75.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	134.9	-178.7	-63.2	165	0	0	0	109.8	L332 M342 L343 V346 L397 P398 I399 L400	L332-I370 HydrophobicContact CB-CG1 4.48Å; M342-I370 HydrophobicContact CE-CG2 3.97Å; M342-I370 HydrophobicContact SD-CB 4.46Å; M342-I370 HydrophobicContact SD-CG1 4.45Å; M342-I370 HydrophobicContact SD-CG2 3.37Å; M342-I370 WeakPolarHBondContact SD-CG2 3.45Å; L343-I370 HydrophobicContact CD2-CD1 4.32Å; L343-I370 HydrophobicContact CD2-CG2 4.03Å; V346-I370 HydrophobicContact CB-CD1 4.33Å; V346-I370 HydrophobicContact CG1-CD1 3.97Å; V346-I370 HydrophobicContact CG2-CD1 3.81Å; V346-I370 HydrophobicContact CG2-CG1 4.42Å; I370-L397 HydrophobicContact CD1-CB 4.37Å; I370-L397 HydrophobicContact CD1-CD1 3.94Å; I370-P398 PolarHBondContact N-O 3.1Å; I370-I399 HydrophobicContact CB-CB 4.45Å; I370-I399 HydrophobicContact CB-CG1 4.19Å; I370-I399 HydrophobicContact CB-CG2 4.08Å; I370-I399 HydrophobicContact CD1-CD1 4.2Å; I370-I399 HydrophobicContact CD1-CG1 4.29Å; I370-I399 HydrophobicContact CG2-CG2 4.02Å; I370-I399 CarbonylContact O-C 3.48Å; I370-I399 VanDerWaalsContact O-CA 3.31Å; I370-I399 WeakPolarHBondContact O-CA 3.26Å; I370-L400 PolarHBondContact O-N 2.95Å
371	I	97	Very high	77.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	111.6	178.2	-60.8	150.6	0	0	0	108.7	L332 V333 S334 I373 L400 I402 I521 F524 I525	L332-I371 PolarHBondContact O-N 3.33Å; V333-I371 WeakPolarHBondContact CA-O 3.38Å; V333-I371 HydrophobicContact CG1-CB 4.43Å; V333-I371 HydrophobicContact CG1-CG2 4.36Å; V333-I371 HydrophobicContact CG2-CB 4.31Å; V333-I371 HydrophobicContact CG2-CD1 3.96Å; S334-I371 PolarHBondContact N-O 3.13Å; I371-I373 HydrophobicContact CG2-CD1 4.42Å; I371-I373 HydrophobicContact CG2-CG1 4.07Å; I371-L400 WeakPolarHBondContact CA-O 3.39Å; I371-L400 HydrophobicContact CG1-CB 4.39Å; I371-L400 HydrophobicContact CG2-CD2 4.4Å; I371-I402 HydrophobicContact CG2-CD1 4.44Å; I371-I521 HydrophobicContact CD1-CG2 3.69Å; I371-I521 HydrophobicContact CG2-CD1 3.98Å; I371-I521 HydrophobicContact CG2-CG1 4Å; I371-F524 HydrophobicContact CD1-CD1 4.27Å; I371-F524 HydrophobicContact CD1-CE1 4.46Å; I371-F524 HydrophobicContact CG1-CD1 3.87Å; I371-F524 HydrophobicContact CG1-CE1 3.85Å; I371-I525 HydrophobicContact CD1-CD1 4.24Å; I371-I525 HydrophobicContact CD1-CG1 4.34Å
372	C	96.3	Very high	79.4	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113	-179.9	-65.2	0	0	0	0	111	L375 L400 F401 I402	C372-L375 HydrophobicContact CB-CB 4.32Å; C372-L400 PolarHBondContact N-O 3.19Å; C372-F401 HydrophobicContact CB-CD1 3.91Å; C372-F401 HydrophobicContact CB-CE1 4.36Å; C372-I402 PolarHBondContact O-N 3.34Å
373	I	95.4	Very high	81.7	Confident	8 Å²	8	41.1 Å²	41.1	4%	0.041	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	109	-176.4	-54.7	179.7	0	0	0	109.5	V333 S334 F335 G336 I371 I402 L496 M517 I521	V333-I373 HydrophobicContact CG1-CD1 3.98Å; S334-I373 WeakPolarHBondContact O-CA 3.32Å; S334-I373 VanDerWaalsContact O-CB 3.25Å; S334-I373 WeakPolarHBondContact O-CB 3.34Å; S334-I373 PolarHBondContact O-N 3.23Å; F335-I373 CarbonylContact C-O 3.42Å; F335-I373 WeakPolarHBondContact CA-O 3.22Å; F335-I373 HydrophobicContact CD1-CB 4.06Å; F335-I373 HydrophobicContact CD1-CD1 4.16Å; F335-I373 HydrophobicContact CD1-CG2 4.01Å; F335-I373 HydrophobicContact CE1-CB 4.37Å; F335-I373 HydrophobicContact CE1-CD1 3.61Å; F335-I373 HydrophobicContact CE1-CG2 4.24Å; F335-I373 HydrophobicContact CZ-CD1 3.89Å; G336-I373 PolarHBondContact N-O 3.03Å; I371-I373 HydrophobicContact CG2-CD1 4.42Å; I371-I373 HydrophobicContact CG2-CG1 4.07Å; I373-I402 HydrophobicContact CG1-CD1 4.29Å; I373-L496 HydrophobicContact CG2-CD1 3.29Å; I373-L496 HydrophobicContact CG2-CG 4.43Å; I373-M517 HydrophobicContact CG2-CE 4.39Å; I373-M517 HydrophobicContact CG2-SD 4.09Å; I373-I521 HydrophobicContact CD1-CD1 4.14Å
374	G	92.9	Very high	83.9	Confident	5 Å²	5	35.4 Å²	35.4	5%	0.052	18%	0.178	C	C	.	.	S	Bend	trans	73.9	35.1	178.1	0	0	0	0	0	114.3	G336 P376 I402	G336-G374 WeakPolarHBondContact CA-O 3.28Å; G374-P376 WeakPolarHBondContact O-CD 3.5Å; G374-I402 PolarHBondContact N-O 3.33Å
375	L	93.1	Very high	85.8	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.158	C	C	.	.			trans	-55.3	126.3	178.2	173.8	71.1	0	0	0	111.3	S339 L340 L343 C372 L377 F401 I403 F418	S339-L375 VanDerWaalsContact CB-CD1 3.48Å; L340-L375 HydrophobicContact CD2-CD1 3.64Å; L340-L375 HydrophobicContact CG-CD1 3.95Å; L343-L375 HydrophobicContact CD1-CD1 4.25Å; L343-L375 HydrophobicContact CD1-CD2 4.33Å; C372-L375 HydrophobicContact CB-CB 4.32Å; L375-L377 HydrophobicContact CD2-CD2 3.67Å; L375-L377 HydrophobicContact CG-CD2 4.08Å; L375-L377 PolarHBondContact O-N 3.2Å; L375-F401 HydrophobicContact CD2-CD1 3.72Å; L375-F401 HydrophobicContact CD2-CE1 3.66Å; L375-I403 HydrophobicContact CB-CD1 3.98Å; L375-F418 HydrophobicContact CD2-CD1 4.48Å; L375-F418 HydrophobicContact CD2-CE1 3.95Å
376	P	91	Very high	87.2	Confident	3 Å²	3	31 Å²	31	2%	0.019	16%	0.16	C	C	.	.			trans	-74.6	110.4	171.7	29.1	-35.9	0	0	0	111.5	G336 V337 L340 G374 L409	G336-P376 WeakPolarHBondContact O-CD 3.49Å; V337-P376 HydrophobicContact CG2-CG 4.29Å; L340-P376 HydrophobicContact CD1-CG 3.75Å; L340-P376 HydrophobicContact CG-CG 4.07Å; G374-P376 WeakPolarHBondContact O-CD 3.5Å; P376-L409 CarbonylContact C-O 3.49Å; P376-L409 HydrophobicContact CB-CB 3.85Å; P376-L409 HydrophobicContact CB-CD1 4.01Å; P376-L409 HydrophobicContact CB-CG 4.5Å
377	L	92.3	Very high	87.7	Confident	3 Å²	3	37 Å²	37	2%	0.016	19%	0.189	C	C	.	.			trans	-92	-11	178.9	-61.8	171.6	0	0	0	113.7	L375 R384 I403 L409 E414 A415 F418	L375-L377 HydrophobicContact CD2-CD2 3.67Å; L375-L377 HydrophobicContact CG-CD2 4.08Å; L375-L377 PolarHBondContact O-N 3.2Å; L377-R384 HydrophobicContact CD2-CB 4.47Å; L377-R384 WeakPolarHBondContact O-CG 3.38Å; L377-R384 PolarHBondContact O-N 3.48Å; L377-I403 HydrophobicContact CD1-CD1 4.31Å; L377-L409 CarbonylContact C-O 3.59Å; L377-L409 WeakPolarHBondContact CA-O 3.46Å; L377-L409 PolarHBondContact N-O 3.39Å; L377-E414 HydrophobicContact CB-CB 4.04Å; L377-E414 HydrophobicContact CD1-CB 4.02Å; L377-A415 HydrophobicContact CD1-CB 3.69Å; L377-F418 HydrophobicContact CD2-CB 3.93Å; L377-F418 HydrophobicContact CD2-CD1 3.43Å; L377-F418 VanDerWaalsContact CD2-CD1 3.43Å; L377-F418 HydrophobicContact CD2-CD2 4.41Å; L377-F418 HydrophobicContact CD2-CE1 3.98Å; L377-F418 HydrophobicContact CD2-CG 3.67Å
378	I	86.7	Confident	87.3	Confident	54 Å²	54	43 Å²	43	28%	0.277	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.2	169.8	-55.7	176.8	0	0	0	107.5	K383 L409 E414	I378-K383 HydrophobicContact CG1-CG 4.38Å; I378-L409 PolarHBondContact N-O 3.14Å; I378-E414 HydrophobicContact CD1-CG 3.79Å; I378-E414 HydrophobicContact CG1-CG 3.94Å
379	G	77.5	Confident	87.2	Confident	17 Å²	17	42.3 Å²	42.3	18%	0.175	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	-170.9	172.1	0	0	0	0	0	111.3	R381 G382	G379-R381 PolarHBondContact O-N 2.95Å; G379-G382 PolarHBondContact N-O 3.5Å; G379-G382 PolarHBondContact O-N 3.39Å
380	L	70.8	Confident	86.8	Confident	124 Å²	124	43.3 Å²	43.3	65%	0.649	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-28.9	-179.6	-66.6	-177.9	0	0	0	113.7	E14 G382	E14-L380 HydrophobicContact CB-CD1 3.54Å; E14-L380 WeakPolarHBondContact O-CD1 3.36Å; E14-L380 WeakPolarHBondContact O-CG 3.27Å; L380-G382 PolarHBondContact O-N 3.11Å
381	R	71.9	Confident	86.5	Confident	138 Å²	138	43.5 Å²	43.5	52%	0.521	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	8.1	176.2	-75.7	-171.1	150.4	166.8	-1.7	114.6	S11 G379	S11-R381 VanDerWaalsContact O-CD 3.28Å; S11-R381 WeakPolarHBondContact O-CD 3.37Å; S11-R381 PolarHBondContact O-NE 3.07Å; S11-R381 PolarHBondContact OG-NH1 3.28Å; S11-R381 PolarHBondContact OG-NH2 3.31Å; G379-R381 PolarHBondContact O-N 2.95Å
382	G	81.6	Confident	86.2	Confident	27 Å²	27	45.1 Å²	45.1	28%	0.278	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	94.4	-151	-176.5	0	0	0	0	0	112.8	G379 L380	G379-G382 PolarHBondContact N-O 3.5Å; G379-G382 PolarHBondContact O-N 3.39Å; L380-G382 PolarHBondContact O-N 3.11Å
383	K	88.3	Confident	85.7	Confident	104 Å²	104	46.7 Å²	46.7	45%	0.452	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	144.1	-172.1	-64.9	-178.8	178.4	-179.4	0	110.2	I378 E386	I378-K383 HydrophobicContact CG1-CG 4.38Å; K383-E386 PolarHBondContact N-OE1 2.92Å; K383-E386 WeakPolarHBondContact O-CG 3.35Å
384	R	88.4	Confident	85.2	Confident	14 Å²	14	46.5 Å²	46.5	5%	0.053	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	152.6	172.3	-61.9	-59.1	-179	-166.3	-4.3	111.5	L12 L340 L377 E386 D389 L391 F418 R421	L12-R384 PolarHBondContact O-NH2 2.94Å; L340-R384 VanDerWaalsContact CD1-NH2 3.3Å; L377-R384 HydrophobicContact CD2-CB 4.47Å; L377-R384 WeakPolarHBondContact O-CG 3.38Å; L377-R384 PolarHBondContact O-N 3.48Å; R384-E386 VanDerWaalsContact C-N 3.34Å; R384-D389 VanDerWaalsContact CA-OD2 3.27Å; R384-D389 WeakPolarHBondContact CA-OD2 3.37Å; R384-D389 WeakPolarHBondContact CD-OD2 3.47Å; R384-L391 HydrophobicContact CG-CD1 4.49Å; R384-F418 HydrophobicContact CB-CD2 3.79Å; R384-F418 HydrophobicContact CB-CE2 3.76Å; R384-F418 HydrophobicContact CB-CZ 4.49Å; R384-R421 PolarHBondContact O-NH1 3.39Å; R384-R421 VanDerWaalsContact O-NH1 3.16Å
385	G	86.5	Confident	84.5	Confident	5 Å²	5	48 Å²	48	5%	0.052	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	11.9	-178.9	0	0	0	0	0	114.6	D389 R421	G385-D389 PolarHBondContact N-OD2 2.94Å; G385-R421 WeakPolarHBondContact O-CD 3.42Å
386	E	85.5	Confident	84	Confident	91 Å²	91	50.9 Å²	50.9	43%	0.425	28%	0.277	S	S	.	.			trans	-65.5	166.3	169.9	-75	179.7	-161.6	0	0	111.9	K383 R384 N388 D389 L392	K383-E386 PolarHBondContact N-OE1 2.92Å; K383-E386 WeakPolarHBondContact O-CG 3.35Å; R384-E386 VanDerWaalsContact C-N 3.34Å; E386-N388 PolarHBondContact O-N 3.41Å; E386-D389 VanDerWaalsContact O-CB 3.25Å; E386-D389 WeakPolarHBondContact O-CB 3.26Å; E386-D389 PolarHBondContact O-N 3.16Å; E386-L392 WeakPolarHBondContact O-CD1 3.48Å
387	L	79.7	Confident	83.8	Confident	150 Å²	150	51.6 Å²	51.6	79%	0.785	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	129.4	177.4	-162.4	83.8	0	0	0	109	D389	L387-D389 VanDerWaalsContact C-N 3.34Å
388	N	81.6	Confident	83.8	Confident	131 Å²	131	52.2 Å²	52.2	70%	0.701	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	5.9	-174.7	-45.4	-51.3	0	0	0	116.7	E386 P390	E386-N388 PolarHBondContact O-N 3.41Å; N388-P390 WeakPolarHBondContact O-CD 3.47Å
389	D	85.9	Confident	84.2	Confident	15 Å²	15	49.7 Å²	49.7	8%	0.08	27%	0.271	C	S	.	.			trans	-64.2	119.4	168.9	-171.5	-26.6	0	0	0	109.2	R384 G385 E386 L387 L391 L392	R384-D389 VanDerWaalsContact CA-OD2 3.27Å; R384-D389 WeakPolarHBondContact CA-OD2 3.37Å; R384-D389 WeakPolarHBondContact CD-OD2 3.47Å; G385-D389 PolarHBondContact N-OD2 2.94Å; E386-D389 VanDerWaalsContact O-CB 3.25Å; E386-D389 WeakPolarHBondContact O-CB 3.26Å; E386-D389 PolarHBondContact O-N 3.16Å; L387-D389 VanDerWaalsContact C-N 3.34Å; D389-L391 PolarHBondContact O-N 2.89Å; D389-L391 VanDerWaalsContact O-N 3.07Å; D389-L391 WeakPolarHBondContact OD1-CB 3.26Å; D389-L391 WeakPolarHBondContact OD1-CG 3.37Å; D389-L391 PolarHBondContact OD1-N 3.3Å; D389-L392 HydrophobicContact CB-CG 4.32Å; D389-L392 WeakPolarHBondContact O-CB 3.44Å; D389-L392 PolarHBondContact O-N 3.46Å
390	P	85.5	Confident	85.1	Confident	21 Å²	21	49.3 Å²	49.3	14%	0.136	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-58.8	-23.3	-179.1	24.3	-35	0	0	0	112.7	L12 L344 I347 N388 L392 S393	L12-P390 HydrophobicContact CD1-CG 3.55Å; L344-P390 HydrophobicContact CD2-CB 4.09Å; L344-P390 HydrophobicContact CD2-CG 3.97Å; I347-P390 WeakPolarHBondContact CD1-O 3.46Å; N388-P390 WeakPolarHBondContact O-CD 3.47Å; P390-L392 PolarHBondContact O-N 3.38Å; P390-S393 VanDerWaalsContact O-CB 3.31Å; P390-S393 WeakPolarHBondContact O-CB 3.48Å; P390-S393 PolarHBondContact O-N 3.47Å; P390-S393 PolarHBondContact O-OG 2.84Å
391	L	89.9	Confident	86.2	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.021	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-65.3	-21.7	175.8	-58.2	-180	0	0	0	112.8	L340 L343 L344 R384 D389 S393 I394 F418 L422	L340-L391 HydrophobicContact CD2-CD1 3.76Å; L343-L391 HydrophobicContact CB-CD2 3.73Å; L343-L391 HydrophobicContact CD1-CD2 4.21Å; L344-L391 HydrophobicContact CD2-CD2 4.3Å; L344-L391 HydrophobicContact CG-CD2 4.33Å; R384-L391 HydrophobicContact CG-CD1 4.49Å; D389-L391 PolarHBondContact O-N 2.89Å; D389-L391 VanDerWaalsContact O-N 3.07Å; D389-L391 WeakPolarHBondContact OD1-CB 3.26Å; D389-L391 WeakPolarHBondContact OD1-CG 3.37Å; D389-L391 PolarHBondContact OD1-N 3.3Å; L391-S393 PolarHBondContact O-N 3.32Å; L391-S393 VanDerWaalsContact O-N 3.17Å; L391-I394 HydrophobicContact CB-CD1 3.93Å; L391-I394 HydrophobicContact CD2-CD1 4.17Å; L391-I394 WeakPolarHBondContact O-CB 3.31Å; L391-I394 WeakPolarHBondContact O-CD1 3.39Å; L391-I394 WeakPolarHBondContact O-CG1 3.45Å; L391-I394 PolarHBondContact O-N 3.42Å; L391-I394 VanDerWaalsContact O-N 3.15Å; L391-F418 HydrophobicContact CB-CE2 4.35Å; L391-F418 HydrophobicContact CB-CZ 4.13Å; L391-F418 HydrophobicContact CD1-CE2 4.41Å; L391-F418 HydrophobicContact CD1-CZ 4.01Å; L391-L422 VanDerWaalsContact O-CD2 3.28Å; L391-L422 WeakPolarHBondContact O-CD2 3.39Å
392	L	89.4	Confident	87.4	Confident	33 Å²	33	37 Å²	37	17%	0.173	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-66.4	-15.3	171.4	-63	-177.3	0	0	0	112.6	E386 D389 P390 I394 R421 L422 A425	E386-L392 WeakPolarHBondContact O-CD1 3.48Å; D389-L392 HydrophobicContact CB-CG 4.32Å; D389-L392 WeakPolarHBondContact O-CB 3.44Å; D389-L392 PolarHBondContact O-N 3.46Å; P390-L392 PolarHBondContact O-N 3.38Å; L392-I394 VanDerWaalsContact C-N 3.33Å; L392-R421 HydrophobicContact CD2-CB 4.12Å; L392-L422 HydrophobicContact CD2-CD2 4.38Å; L392-A425 HydrophobicContact CB-CB 3.99Å; L392-A425 HydrophobicContact CD2-CB 4.16Å; L392-A425 WeakPolarHBondContact O-CB 3.43Å
393	S	86.7	Confident	88.1	Confident	33 Å²	33	35.8 Å²	35.8	23%	0.231	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-86.1	-2.5	176.9	77.6	0	0	0	0	113.8	I347 P390 L391 K429	I347-S393 WeakPolarHBondContact CD1-OG 3.39Å; P390-S393 VanDerWaalsContact O-CB 3.31Å; P390-S393 WeakPolarHBondContact O-CB 3.48Å; P390-S393 PolarHBondContact O-N 3.47Å; P390-S393 PolarHBondContact O-OG 2.84Å; L391-S393 PolarHBondContact O-N 3.32Å; L391-S393 VanDerWaalsContact O-N 3.17Å; S393-K429 VanDerWaalsContact CA-NZ 3.34Å; S393-K429 PolarHBondContact O-NZ 3.07Å
394	I	85.2	Confident	88.3	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.021	18%	0.176	C	C	.	.			trans	-53.1	125.4	-177.3	-68.8	160.7	0	0	0	110.5	L343 I347 L391 L392 I399 L422	L343-I394 HydrophobicContact CB-CD1 4.11Å; L343-I394 HydrophobicContact CD1-CD1 4.05Å; L343-I394 HydrophobicContact CD2-CD1 3.9Å; L343-I394 HydrophobicContact CG-CD1 4.23Å; I347-I394 HydrophobicContact CD1-CG1 3.94Å; I347-I394 HydrophobicContact CG1-CG1 4.13Å; L391-I394 HydrophobicContact CB-CD1 3.93Å; L391-I394 HydrophobicContact CD2-CD1 4.17Å; L391-I394 WeakPolarHBondContact O-CB 3.31Å; L391-I394 WeakPolarHBondContact O-CD1 3.39Å; L391-I394 WeakPolarHBondContact O-CG1 3.45Å; L391-I394 PolarHBondContact O-N 3.42Å; L391-I394 VanDerWaalsContact O-N 3.15Å; L392-I394 VanDerWaalsContact C-N 3.33Å; I394-I399 HydrophobicContact CG2-CD1 3.68Å; I394-L422 HydrophobicContact CD1-CD2 4.22Å
395	P	77.5	Confident	88.5	Confident	36 Å²	36	31.9 Å²	31.9	23%	0.234	19%	0.187	C	C	.	.			trans	-65.7	170.8	-178.4	23.4	-31.3	0	0	0	112.4	V346 L350 L397 R426	V346-P395 HydrophobicContact CG1-CG 4.08Å; L350-P395 HydrophobicContact CB-CG 4.16Å; L350-P395 HydrophobicContact CD1-CB 3.78Å; L350-P395 HydrophobicContact CD1-CG 3.08Å; L350-P395 HydrophobicContact CG-CG 4.19Å; P395-L397 PolarHBondContact O-N 3.47Å; P395-R426 PolarHBondContact O-NH2 2.96Å
396	A	82.3	Confident	88.6	Confident	62 Å²	62	37.2 Å²	37.2	51%	0.512	21%	0.206	S	C	.	.	S	Bend	trans	-74.8	65.9	-171.9	0	0	0	0	0	112.1	P482	A396-P482 VanDerWaalsContact C-CG 3.41Å; A396-P482 HydrophobicContact CB-CG 3.48Å; A396-P482 VanDerWaalsContact CB-CG 3.48Å; A396-P482 WeakPolarHBondContact O-CB 3.21Å; A396-P482 VanDerWaalsContact O-CG 3.26Å; A396-P482 WeakPolarHBondContact O-CG 3.17Å
397	L	87.3	Confident	88.8	Confident	18 Å²	18	33.5 Å²	33.5	9%	0.094	19%	0.19	C	C	.	.			trans	-108.3	147.8	172	-69	177.6	0	0	0	111.1	V346 L350 I367 I370 P395 I399 R426	V346-L397 HydrophobicContact CG1-CD1 3.8Å; L350-L397 HydrophobicContact CD1-CD1 3.82Å; L350-L397 HydrophobicContact CD1-CG 4.32Å; I367-L397 HydrophobicContact CB-CD1 4.37Å; I367-L397 HydrophobicContact CG2-CD1 4Å; I367-L397 WeakPolarHBondContact O-CD2 3.5Å; I370-L397 HydrophobicContact CD1-CB 4.37Å; I370-L397 HydrophobicContact CD1-CD1 3.94Å; P395-L397 PolarHBondContact O-N 3.47Å; L397-I399 WeakPolarHBondContact O-CG1 3.29Å; L397-I399 PolarHBondContact O-N 3Å; L397-R426 PolarHBondContact O-NH1 3.48Å; L397-R426 PolarHBondContact O-NH2 3.44Å
398	P	91.6	Very high	89.3	Confident	16 Å²	16	37.1 Å²	37.1	10%	0.104	19%	0.193	C	C	.	.			trans	-60.6	133.3	168	-21.6	33.7	0	0	0	110.9	G369 I370 P482 F524 T528	G369-P398 WeakPolarHBondContact CA-O 3.47Å; I370-P398 PolarHBondContact N-O 3.1Å; P398-P482 HydrophobicContact CG-CB 4.43Å; P398-F524 HydrophobicContact CB-CE2 4.02Å; P398-F524 HydrophobicContact CB-CZ 3.83Å; P398-T528 HydrophobicContact CB-CG2 3.39Å; P398-T528 HydrophobicContact CG-CG2 3.73Å
399	I	94.5	Very high	89.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	128.9	179.8	-46.1	-171.8	0	0	0	110.1	L343 I370 I394 L397 F401 T483 F484 D485	L343-I399 HydrophobicContact CD2-CD1 4.23Å; I370-I399 HydrophobicContact CB-CB 4.45Å; I370-I399 HydrophobicContact CB-CG1 4.19Å; I370-I399 HydrophobicContact CB-CG2 4.08Å; I370-I399 HydrophobicContact CD1-CD1 4.2Å; I370-I399 HydrophobicContact CD1-CG1 4.29Å; I370-I399 HydrophobicContact CG2-CG2 4.02Å; I370-I399 CarbonylContact O-C 3.48Å; I370-I399 VanDerWaalsContact O-CA 3.31Å; I370-I399 WeakPolarHBondContact O-CA 3.26Å; I394-I399 HydrophobicContact CG2-CD1 3.68Å; L397-I399 WeakPolarHBondContact O-CG1 3.29Å; L397-I399 PolarHBondContact O-N 3Å; I399-F401 HydrophobicContact CB-CE2 4.27Å; I399-F401 HydrophobicContact CB-CZ 4.26Å; I399-F401 HydrophobicContact CD1-CZ 4.48Å; I399-F401 HydrophobicContact CG2-CD1 4.23Å; I399-F401 HydrophobicContact CG2-CD2 4.34Å; I399-F401 HydrophobicContact CG2-CE1 3.73Å; I399-F401 HydrophobicContact CG2-CE2 3.88Å; I399-F401 HydrophobicContact CG2-CZ 3.55Å; I399-T483 PolarHBondContact N-O 3.01Å; I399-F484 HydrophobicContact CB-CD1 4.11Å; I399-F484 HydrophobicContact CD1-CD1 4.19Å; I399-F484 HydrophobicContact CD1-CE1 3.81Å; I399-F484 HydrophobicContact CG1-CD1 4.21Å; I399-F484 HydrophobicContact CG1-CE1 4.22Å; I399-F484 CarbonylContact O-C 3.57Å; I399-F484 WeakPolarHBondContact O-CA 3.46Å; I399-D485 PolarHBondContact O-N 3.41Å
400	L	96.3	Very high	89.7	Confident	9 Å²	9	32.2 Å²	32.2	5%	0.047	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.9	169	176.9	63.3	0	0	0	110.1	I370 I371 C372 I402 D485 L487 I521 F524	I370-L400 PolarHBondContact O-N 2.95Å; I371-L400 WeakPolarHBondContact CA-O 3.39Å; I371-L400 HydrophobicContact CG1-CB 4.39Å; I371-L400 HydrophobicContact CG2-CD2 4.4Å; C372-L400 PolarHBondContact N-O 3.19Å; L400-I402 HydrophobicContact CD2-CD1 4.06Å; L400-I402 HydrophobicContact CD2-CG1 4.16Å; L400-I402 HydrophobicContact CG-CD1 4.46Å; L400-I402 HydrophobicContact CG-CG1 4.02Å; L400-D485 WeakPolarHBondContact CA-O 3.48Å; L400-D485 HydrophobicContact CD1-CB 3.79Å; L400-L487 HydrophobicContact CD1-CB 4.38Å; L400-I521 HydrophobicContact CD2-CG1 4.08Å; L400-F524 HydrophobicContact CB-CD1 4.04Å; L400-F524 HydrophobicContact CB-CD2 3.76Å; L400-F524 HydrophobicContact CB-CE1 4.15Å; L400-F524 HydrophobicContact CB-CE2 3.87Å; L400-F524 HydrophobicContact CB-CG 3.84Å; L400-F524 HydrophobicContact CB-CZ 4.05Å; L400-F524 HydrophobicContact CD2-CB 3.87Å; L400-F524 HydrophobicContact CD2-CD1 4.43Å; L400-F524 HydrophobicContact CD2-CG 4.07Å; L400-F524 HydrophobicContact CG-CG 4.49Å
401	F	95.9	Very high	89.9	Confident	5 Å²	5	31.3 Å²	31.3	2%	0.022	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	125.6	169.9	-59.5	-72	0	0	0	110.4	L343 C372 L375 I399 I403 F418 L422 F484 D485 V486 L487	L343-F401 HydrophobicContact CD1-CE1 4.47Å; C372-F401 HydrophobicContact CB-CD1 3.91Å; C372-F401 HydrophobicContact CB-CE1 4.36Å; L375-F401 HydrophobicContact CD2-CD1 3.72Å; L375-F401 HydrophobicContact CD2-CE1 3.66Å; I399-F401 HydrophobicContact CB-CE2 4.27Å; I399-F401 HydrophobicContact CB-CZ 4.26Å; I399-F401 HydrophobicContact CD1-CZ 4.48Å; I399-F401 HydrophobicContact CG2-CD1 4.23Å; I399-F401 HydrophobicContact CG2-CD2 4.34Å; I399-F401 HydrophobicContact CG2-CE1 3.73Å; I399-F401 HydrophobicContact CG2-CE2 3.88Å; I399-F401 HydrophobicContact CG2-CZ 3.55Å; F401-I403 HydrophobicContact CB-CG1 4.31Å; F401-F418 HydrophobicContact CE1-CE1 4.05Å; F401-F418 HydrophobicContact CZ-CD1 4.41Å; F401-F418 AromaticContact CZ-CE1 3.89Å; F401-F418 HydrophobicContact CZ-CE1 3.89Å; F401-L422 HydrophobicContact CE2-CD1 3.91Å; F401-L422 HydrophobicContact CZ-CD1 3.72Å; F401-F484 HydrophobicContact CE2-CB 4.47Å; F401-F484 AromaticContact CE2-CD1 3.95Å; F401-F484 HydrophobicContact CE2-CD1 3.95Å; F401-F484 HydrophobicContact CZ-CD1 4.5Å; F401-D485 PolarHBondContact N-O 3.28Å; F401-V486 HydrophobicContact CB-CG2 4.32Å; F401-V486 HydrophobicContact CD2-CG2 4.1Å; F401-V486 CarbonylContact O-C 3.6Å; F401-V486 WeakPolarHBondContact O-CA 3.4Å; F401-L487 PolarHBondContact O-N 3.04Å
402	I	96.8	Very high	90	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	111.2	174.1	-50.3	-174.8	0	0	0	108.8	I371 C372 I373 G374 L400 L487 I489 L496 M517 I521	I371-I402 HydrophobicContact CG2-CD1 4.44Å; C372-I402 PolarHBondContact O-N 3.34Å; I373-I402 HydrophobicContact CG1-CD1 4.29Å; G374-I402 PolarHBondContact N-O 3.33Å; L400-I402 HydrophobicContact CD2-CD1 4.06Å; L400-I402 HydrophobicContact CD2-CG1 4.16Å; L400-I402 HydrophobicContact CG-CD1 4.46Å; L400-I402 HydrophobicContact CG-CG1 4.02Å; I402-L487 CarbonylContact C-O 3.53Å; I402-L487 WeakPolarHBondContact CA-O 3.21Å; I402-L487 HydrophobicContact CD1-CD2 4.41Å; I402-L487 HydrophobicContact CG1-CB 4.32Å; I402-L487 HydrophobicContact CG1-CD2 4.42Å; I402-L487 HydrophobicContact CG2-CB 4.49Å; I402-L487 HydrophobicContact CG2-CD2 4.12Å; I402-I489 HydrophobicContact CG2-CD1 3.76Å; I402-I489 HydrophobicContact CG2-CG1 4.07Å; I402-L496 HydrophobicContact CB-CD1 4.43Å; I402-L496 HydrophobicContact CG2-CD1 3.74Å; I402-M517 HydrophobicContact CD1-CG 3.58Å; I402-M517 HydrophobicContact CD1-SD 4.25Å; I402-M517 HydrophobicContact CG2-CG 3.98Å; I402-M517 HydrophobicContact CG2-SD 3.87Å; I402-I521 HydrophobicContact CD1-CD1 4Å; I402-I521 HydrophobicContact CD1-CG1 3.83Å
403	I	94.9	Very high	90.1	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.4	-168.9	-55	-64.3	0	0	0	110.6	L375 L377 F401 G410 A415 L487 V488 I489	L375-I403 HydrophobicContact CB-CD1 3.98Å; L377-I403 HydrophobicContact CD1-CD1 4.31Å; F401-I403 HydrophobicContact CB-CG1 4.31Å; I403-G410 WeakPolarHBondContact CG2-O 3.4Å; I403-A415 HydrophobicContact CB-CB 4.29Å; I403-A415 HydrophobicContact CG1-CB 3.94Å; I403-A415 HydrophobicContact CG2-CB 4.27Å; I403-L487 PolarHBondContact N-O 2.96Å; I403-V488 CarbonylContact O-C 3.57Å; I403-V488 WeakPolarHBondContact O-CA 3.25Å; I403-I489 PolarHBondContact O-N 3.13Å
404	G	93.5	Very high	90.4	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	127.5	172.2	0	0	0	0	0	110.2	R406 S407 G411 A492	G404-R406 PolarHBondContact O-N 3.01Å; G404-S407 WeakPolarHBondContact O-CB 3.33Å; G404-S407 PolarHBondContact O-N 2.98Å; G404-G411 WeakPolarHBondContact O-CA 3.5Å; G404-A492 CarbonylContact C-O 3.59Å; G404-A492 WeakPolarHBondContact CA-O 3.42Å
405	A	91.3	Very high	90.8	Very high	35 Å²	35	42.9 Å²	42.9	29%	0.289	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.6	-177.5	0	0	0	0	0	113.2	V488 I489	A405-V488 HydrophobicContact CB-CG1 3.66Å; A405-I489 PolarHBondContact N-O 3.32Å
406	R	88.8	Confident	91.5	Very high	118 Å²	118	42.2 Å²	42.2	45%	0.445	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	24	177.7	-63.4	-175.3	174.1	-179.7	-8	112.4	G404 R408 A492	G404-R406 PolarHBondContact O-N 3.01Å; R406-R408 PolarHBondContact O-N 3.41Å; R406-A492 CarbonylContact C-O 3.48Å; R406-A492 WeakPolarHBondContact CA-O 3.34Å; R406-A492 WeakPolarHBondContact CB-O 2.96Å; R406-A492 PolarHBondContact N-O 3.43Å
407	S	91	Very high	91.9	Very high	13 Å²	13	43.1 Å²	43.1	9%	0.091	19%	0.193	C	C	.	.			trans	-60.3	122.9	172.2	169	0	0	0	0	110	G404 L409 G410 H494	G404-S407 WeakPolarHBondContact O-CB 3.33Å; G404-S407 PolarHBondContact O-N 2.98Å; S407-L409 PolarHBondContact O-N 3.15Å; S407-L409 PolarHBondContact OG-N 3.13Å; S407-G410 WeakPolarHBondContact CB-O 3.39Å; S407-G410 CarbonylContact O-C 3.55Å; S407-G410 PolarHBondContact O-N 3.4Å; S407-G410 PolarHBondContact OG-O 2.76Å; S407-H494 VanDerWaalsContact OG-CB 3.23Å; S407-H494 WeakPolarHBondContact OG-CB 3.47Å
408	R	88.9	Confident	92.2	Very high	226 Å²	226	42.4 Å²	42.4	85%	0.853	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.8	172.3	-66.5	-178.7	178.3	177.1	-2.9	112.3	R406 G410	R406-R408 PolarHBondContact O-N 3.41Å; R408-G410 VanDerWaalsContact C-N 3.28Å
409	L	88.1	Confident	92.3	Very high	41 Å²	41	45.4 Å²	45.4	22%	0.215	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	25.5	178.4	-54.3	179.7	0	0	0	111.3	P376 L377 I378 S407 H494	P376-L409 CarbonylContact C-O 3.49Å; P376-L409 HydrophobicContact CB-CB 3.85Å; P376-L409 HydrophobicContact CB-CD1 4.01Å; P376-L409 HydrophobicContact CB-CG 4.5Å; L377-L409 CarbonylContact C-O 3.59Å; L377-L409 WeakPolarHBondContact CA-O 3.46Å; L377-L409 PolarHBondContact N-O 3.39Å; I378-L409 PolarHBondContact N-O 3.14Å; S407-L409 PolarHBondContact O-N 3.15Å; S407-L409 PolarHBondContact OG-N 3.13Å; L409-H494 HydrophobicContact CB-CB 4.21Å; L409-H494 HydrophobicContact CD1-CB 4.09Å; L409-H494 HydrophobicContact CG-CB 4.06Å
410	G	87.9	Confident	92.1	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.01	22%	0.222	C	C	.	.			trans	101.5	117.8	-177.1	0	0	0	0	0	112.2	I403 S407 R408	I403-G410 WeakPolarHBondContact CG2-O 3.4Å; S407-G410 WeakPolarHBondContact CB-O 3.39Å; S407-G410 CarbonylContact O-C 3.55Å; S407-G410 PolarHBondContact O-N 3.4Å; S407-G410 PolarHBondContact OG-O 2.76Å; R408-G410 VanDerWaalsContact C-N 3.28Å
411	G	90.6	Very high	91.9	Very high	3 Å²	3	53.4 Å²	53.4	3%	0.031	23%	0.231	C	C	.	.			trans	-104.5	-143.2	-175.2	0	0	0	0	0	112.1	G404 K413 E414 A415	G404-G411 WeakPolarHBondContact O-CA 3.5Å; G411-K413 PolarHBondContact O-N 2.91Å; G411-E414 PolarHBondContact N-OE2 3.28Å; G411-E414 PolarHBondContact O-N 3.47Å; G411-A415 WeakPolarHBondContact O-CB 3.48Å; G411-A415 PolarHBondContact O-N 3.19Å
412	Y	90.8	Very high	91.6	Very high	101 Å²	101	53.3 Å²	53.3	40%	0.396	23%	0.231	S	C	.	.	H	α-helix	trans	-55.4	-51.5	-177.4	174.2	-96.1	0	0	0	112.6	E414 A415 I416 V488	Y412-E414 PolarHBondContact O-N 2.87Å; Y412-A415 PolarHBondContact O-N 3.3Å; Y412-I416 HydrophobicContact CD2-CG1 4.34Å; Y412-I416 HydrophobicContact CE1-CG1 4.21Å; Y412-I416 HydrophobicContact CE2-CD1 4.26Å; Y412-I416 HydrophobicContact CE2-CG1 3.92Å; Y412-I416 WeakPolarHBondContact O-CG1 3.36Å; Y412-I416 PolarHBondContact O-N 3.24Å; Y412-I416 VanDerWaalsContact O-N 3.08Å; Y412-V488 HydrophobicContact CD2-CB 4.06Å; Y412-V488 HydrophobicContact CD2-CG1 4.01Å; Y412-V488 HydrophobicContact CD2-CG2 3.74Å; Y412-V488 HydrophobicContact CE2-CG2 4.46Å
413	K	92.6	Very high	91.2	Very high	165 Å²	165	58.7 Å²	58.7	72%	0.717	25%	0.254	S	S	*	.	H	α-helix	trans	-61.7	-46.1	-174.8	-67.4	-174.2	178.1	-175.7	0	111.3	G411 A415 E417	G411-K413 PolarHBondContact O-N 2.91Å; K413-A415 VanDerWaalsContact C-N 3.34Å; K413-A415 PolarHBondContact O-N 2.96Å; K413-E417 WeakPolarHBondContact O-CB 3.46Å; K413-E417 PolarHBondContact O-N 2.87Å; K413-E417 VanDerWaalsContact O-N 3.08Å
414	E	93.2	Very high	90.9	Very high	48 Å²	48	62 Å²	62	22%	0.224	27%	0.272	C	S	.	.	H	α-helix	trans	-65.8	-36.5	178.5	-66.8	70.7	-148.3	0	0	112.2	L377 I378 G411 Y412 F418	L377-E414 HydrophobicContact CB-CB 4.04Å; L377-E414 HydrophobicContact CD1-CB 4.02Å; I378-E414 HydrophobicContact CD1-CG 3.79Å; I378-E414 HydrophobicContact CG1-CG 3.94Å; G411-E414 PolarHBondContact N-OE2 3.28Å; G411-E414 PolarHBondContact O-N 3.47Å; Y412-E414 PolarHBondContact O-N 2.87Å; E414-F418 WeakPolarHBondContact O-CB 3.49Å; E414-F418 PolarHBondContact O-N 2.87Å
415	A	92.8	Very high	90.6	Very high	3 Å²	3	62.5 Å²	62.5	3%	0.025	28%	0.277	C	S	.	.	H	α-helix	trans	-66.6	-45.4	179.7	0	0	0	0	0	112.4	L377 I403 G411 Y412 K413 F418 R419 V486	L377-A415 HydrophobicContact CD1-CB 3.69Å; I403-A415 HydrophobicContact CB-CB 4.29Å; I403-A415 HydrophobicContact CG1-CB 3.94Å; I403-A415 HydrophobicContact CG2-CB 4.27Å; G411-A415 WeakPolarHBondContact O-CB 3.48Å; G411-A415 PolarHBondContact O-N 3.19Å; Y412-A415 PolarHBondContact O-N 3.3Å; K413-A415 VanDerWaalsContact C-N 3.34Å; K413-A415 PolarHBondContact O-N 2.96Å; A415-F418 PolarHBondContact O-N 3.43Å; A415-R419 WeakPolarHBondContact O-CB 3.41Å; A415-R419 PolarHBondContact O-N 3.35Å; A415-V486 HydrophobicContact CB-CG1 4.06Å
416	I	91.9	Very high	90.3	Very high	21 Å²	21	62.1 Å²	62.1	11%	0.108	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-42.9	177	-62.5	-57.3	0	0	0	110.6	Y412 R419 K420	Y412-I416 HydrophobicContact CD2-CG1 4.34Å; Y412-I416 HydrophobicContact CE1-CG1 4.21Å; Y412-I416 HydrophobicContact CE2-CD1 4.26Å; Y412-I416 HydrophobicContact CE2-CG1 3.92Å; Y412-I416 WeakPolarHBondContact O-CG1 3.36Å; Y412-I416 PolarHBondContact O-N 3.24Å; Y412-I416 VanDerWaalsContact O-N 3.08Å; I416-R419 WeakPolarHBondContact O-CB 3.41Å; I416-R419 PolarHBondContact O-N 2.88Å; I416-K420 HydrophobicContact CG2-CD 4.49Å; I416-K420 WeakPolarHBondContact O-CG 3.42Å; I416-K420 PolarHBondContact O-N 2.9Å
417	E	92.3	Very high	90	Very high	81 Å²	81	63.5 Å²	63.5	38%	0.379	27%	0.273	S	S	.	.	H	α-helix	trans	-64.2	-43.4	177.5	-179.5	57.2	-161.1	0	0	112	K413 R419 K420 R421	K413-E417 WeakPolarHBondContact O-CB 3.46Å; K413-E417 PolarHBondContact O-N 2.87Å; K413-E417 VanDerWaalsContact O-N 3.08Å; E417-R419 PolarHBondContact O-N 2.87Å; E417-K420 PolarHBondContact O-N 3.48Å; E417-R421 VanDerWaalsContact O-CG 3.3Å; E417-R421 WeakPolarHBondContact O-CG 3.4Å; E417-R421 PolarHBondContact O-N 3.44Å; E417-R421 IonicContact OE1-CZ 3.43Å; E417-R421 IonicContact OE1-NE 2.79Å; E417-R421 PolarHBondContact OE1-NE 3.46Å; E417-R421 IonicContact OE1-NH2 3.2Å; E417-R421 PolarHBondContact OE1-NH2 2.77Å
418	F	93	Very high	89.6	Confident	3 Å²	3	70 Å²	70	1%	0.013	30%	0.295	C	S	.	.	H	α-helix	trans	-61.8	-43.1	175.5	-178.1	-118.4	0	0	0	112	L375 L377 R384 L391 F401 E414 A415 K420 R421 L422	L375-F418 HydrophobicContact CD2-CD1 4.48Å; L375-F418 HydrophobicContact CD2-CE1 3.95Å; L377-F418 HydrophobicContact CD2-CB 3.93Å; L377-F418 HydrophobicContact CD2-CD1 3.43Å; L377-F418 VanDerWaalsContact CD2-CD1 3.43Å; L377-F418 HydrophobicContact CD2-CD2 4.41Å; L377-F418 HydrophobicContact CD2-CE1 3.98Å; L377-F418 HydrophobicContact CD2-CG 3.67Å; R384-F418 HydrophobicContact CB-CD2 3.79Å; R384-F418 HydrophobicContact CB-CE2 3.76Å; R384-F418 HydrophobicContact CB-CZ 4.49Å; L391-F418 HydrophobicContact CB-CE2 4.35Å; L391-F418 HydrophobicContact CB-CZ 4.13Å; L391-F418 HydrophobicContact CD1-CE2 4.41Å; L391-F418 HydrophobicContact CD1-CZ 4.01Å; F401-F418 HydrophobicContact CE1-CE1 4.05Å; F401-F418 HydrophobicContact CZ-CD1 4.41Å; F401-F418 AromaticContact CZ-CE1 3.89Å; F401-F418 HydrophobicContact CZ-CE1 3.89Å; E414-F418 WeakPolarHBondContact O-CB 3.49Å; E414-F418 PolarHBondContact O-N 2.87Å; A415-F418 PolarHBondContact O-N 3.43Å; F418-K420 PolarHBondContact O-N 3.01Å; F418-R421 PolarHBondContact O-N 3.43Å; F418-L422 HydrophobicContact CD1-CD1 3.82Å; F418-L422 HydrophobicContact CD1-CG 4.48Å; F418-L422 HydrophobicContact CD2-CG 4.49Å; F418-L422 HydrophobicContact CE1-CD1 3.42Å; F418-L422 VanDerWaalsContact CE1-CD1 3.42Å; F418-L422 HydrophobicContact CE1-CG 4.16Å; F418-L422 HydrophobicContact CE2-CD1 4.3Å; F418-L422 HydrophobicContact CE2-CD2 4.4Å; F418-L422 HydrophobicContact CE2-CG 4.15Å; F418-L422 HydrophobicContact CG-CD1 4.43Å; F418-L422 HydrophobicContact CZ-CD1 3.69Å; F418-L422 HydrophobicContact CZ-CD2 4.16Å; F418-L422 HydrophobicContact CZ-CG 3.98Å; F418-L422 WeakPolarHBondContact O-CB 3.32Å; F418-L422 WeakPolarHBondContact O-CG 3.09Å; F418-L422 PolarHBondContact O-N 3.24Å
419	R	92.7	Very high	89	Confident	79 Å²	79	64 Å²	64	30%	0.298	28%	0.275	S	S	.	.	H	α-helix	trans	-57.1	-46.8	173.4	176.9	-178	126.7	-175.4	-10.5	111.7	E47 A415 I416 E417 R421 L422 F423 F484 V486	E47-R419 IonicContact OE1-NH2 3.72Å; A415-R419 WeakPolarHBondContact O-CB 3.41Å; A415-R419 PolarHBondContact O-N 3.35Å; I416-R419 WeakPolarHBondContact O-CB 3.41Å; I416-R419 PolarHBondContact O-N 2.88Å; E417-R419 PolarHBondContact O-N 2.87Å; R419-R421 PolarHBondContact O-N 3.03Å; R419-L422 PolarHBondContact O-N 2.9Å; R419-F423 PolarHBondContact O-N 3Å; R419-F484 WeakPolarHBondContact CD-O 3.41Å; R419-F484 HydrophobicContact CG-CB 3.86Å; R419-V486 HydrophobicContact CB-CG2 4.07Å; R419-V486 HydrophobicContact CG-CG2 4.23Å
420	K	91	Very high	88.1	Confident	114 Å²	114	66.7 Å²	66.7	50%	0.496	28%	0.283	S	S	.	.	H	α-helix	trans	-59.7	-44.9	177.6	-73.2	177.6	-180	-175.9	0	111.6	I416 E417 F418 F423 N424	I416-K420 HydrophobicContact CG2-CD 4.49Å; I416-K420 WeakPolarHBondContact O-CG 3.42Å; I416-K420 PolarHBondContact O-N 2.9Å; E417-K420 PolarHBondContact O-N 3.48Å; F418-K420 PolarHBondContact O-N 3.01Å; K420-F423 PolarHBondContact O-N 2.69Å; K420-N424 WeakPolarHBondContact O-CB 3Å; K420-N424 VanDerWaalsContact O-CG 3.28Å; K420-N424 PolarHBondContact O-N 2.99Å; K420-N424 PolarHBondContact O-ND2 3.4Å
421	R	91.3	Very high	87.1	Confident	64 Å²	64	71.5 Å²	71.5	24%	0.242	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-42.5	178.1	-67.8	165.4	179.5	-158.1	-2.6	112.3	R384 G385 L392 E417 F418 R419 N424 A425	R384-R421 PolarHBondContact O-NH1 3.39Å; R384-R421 VanDerWaalsContact O-NH1 3.16Å; G385-R421 WeakPolarHBondContact O-CD 3.42Å; L392-R421 HydrophobicContact CD2-CB 4.12Å; E417-R421 VanDerWaalsContact O-CG 3.3Å; E417-R421 WeakPolarHBondContact O-CG 3.4Å; E417-R421 PolarHBondContact O-N 3.44Å; E417-R421 IonicContact OE1-CZ 3.43Å; E417-R421 IonicContact OE1-NE 2.79Å; E417-R421 PolarHBondContact OE1-NE 3.46Å; E417-R421 IonicContact OE1-NH2 3.2Å; E417-R421 PolarHBondContact OE1-NH2 2.77Å; F418-R421 PolarHBondContact O-N 3.43Å; R419-R421 PolarHBondContact O-N 3.03Å; R421-N424 PolarHBondContact O-N 3.39Å; R421-A425 WeakPolarHBondContact O-CB 3.43Å; R421-A425 PolarHBondContact O-N 3.39Å
422	L	91	Very high	85.8	Confident	2 Å²	2	77.1 Å²	77.1	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-44.1	174.8	-78.4	175.5	0	0	0	112.2	L391 L392 I394 F401 F418 R419 A425 R426 F484	L391-L422 VanDerWaalsContact O-CD2 3.28Å; L391-L422 WeakPolarHBondContact O-CD2 3.39Å; L392-L422 HydrophobicContact CD2-CD2 4.38Å; I394-L422 HydrophobicContact CD1-CD2 4.22Å; F401-L422 HydrophobicContact CE2-CD1 3.91Å; F401-L422 HydrophobicContact CZ-CD1 3.72Å; F418-L422 HydrophobicContact CD1-CD1 3.82Å; F418-L422 HydrophobicContact CD1-CG 4.48Å; F418-L422 HydrophobicContact CD2-CG 4.49Å; F418-L422 HydrophobicContact CE1-CD1 3.42Å; F418-L422 VanDerWaalsContact CE1-CD1 3.42Å; F418-L422 HydrophobicContact CE1-CG 4.16Å; F418-L422 HydrophobicContact CE2-CD1 4.3Å; F418-L422 HydrophobicContact CE2-CD2 4.4Å; F418-L422 HydrophobicContact CE2-CG 4.15Å; F418-L422 HydrophobicContact CG-CD1 4.43Å; F418-L422 HydrophobicContact CZ-CD1 3.69Å; F418-L422 HydrophobicContact CZ-CD2 4.16Å; F418-L422 HydrophobicContact CZ-CG 3.98Å; F418-L422 WeakPolarHBondContact O-CB 3.32Å; F418-L422 WeakPolarHBondContact O-CG 3.09Å; F418-L422 PolarHBondContact O-N 3.24Å; R419-L422 PolarHBondContact O-N 2.9Å; L422-A425 PolarHBondContact O-N 2.84Å; L422-R426 PolarHBondContact O-N 3.46Å; L422-F484 HydrophobicContact CB-CD2 4.17Å; L422-F484 HydrophobicContact CB-CE1 4.01Å; L422-F484 HydrophobicContact CB-CE2 3.61Å; L422-F484 HydrophobicContact CB-CZ 3.5Å; L422-F484 VanDerWaalsContact CB-CZ 3.5Å; L422-F484 HydrophobicContact CD1-CD1 4.06Å; L422-F484 HydrophobicContact CD1-CE1 3.77Å; L422-F484 HydrophobicContact CD1-CZ 4.13Å; L422-F484 HydrophobicContact CD2-CZ 4.36Å; L422-F484 HydrophobicContact CG-CE1 4.36Å; L422-F484 HydrophobicContact CG-CZ 4.23Å
423	F	88	Confident	84.4	Confident	113 Å²	113	77.2 Å²	77.2	50%	0.496	34%	0.34	S	S	.	.	H	α-helix	trans	-59.8	-48	175.7	-176.1	-95.3	0	0	0	111.5	R419 K420 A425 R426 R427	R419-F423 PolarHBondContact O-N 3Å; K420-F423 PolarHBondContact O-N 2.69Å; F423-A425 VanDerWaalsContact C-N 3.34Å; F423-A425 PolarHBondContact O-N 3.44Å; F423-R426 PolarHBondContact O-N 2.77Å; F423-R427 PolarHBondContact O-N 3.36Å
424	N	87.9	Confident	82.5	Confident	71 Å²	71	76 Å²	76	38%	0.38	34%	0.335	S	S	.	.	H	α-helix	trans	-61.7	-40.4	177.4	-70.6	-20.6	0	0	0	112.4	K420 R421 R427 R428	K420-N424 WeakPolarHBondContact O-CB 3Å; K420-N424 VanDerWaalsContact O-CG 3.28Å; K420-N424 PolarHBondContact O-N 2.99Å; K420-N424 PolarHBondContact O-ND2 3.4Å; R421-N424 PolarHBondContact O-N 3.39Å; N424-R427 PolarHBondContact O-N 2.85Å; N424-R428 WeakPolarHBondContact O-CG 3.47Å; N424-R428 PolarHBondContact O-N 2.87Å
425	A	87.1	Confident	80.3	Confident	11 Å²	11	83.2 Å²	83.2	9%	0.091	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-41.5	175.8	0	0	0	0	0	112	L392 R421 L422 F423 K429	L392-A425 HydrophobicContact CB-CB 3.99Å; L392-A425 HydrophobicContact CD2-CB 4.16Å; L392-A425 WeakPolarHBondContact O-CB 3.43Å; R421-A425 WeakPolarHBondContact O-CB 3.43Å; R421-A425 PolarHBondContact O-N 3.39Å; L422-A425 PolarHBondContact O-N 2.84Å; F423-A425 VanDerWaalsContact C-N 3.34Å; F423-A425 PolarHBondContact O-N 3.44Å; A425-K429 PolarHBondContact O-N 3.35Å; A425-K429 VanDerWaalsContact O-N 3.15Å
426	R	85.1	Confident	78.3	Confident	26 Å²	26	87.4 Å²	87.4	10%	0.098	39%	0.386	C	S	.	.	H	α-helix	trans	-64	-42.5	174	-74.7	-168.4	175.7	160.8	2.5	112.3	P395 L397 L422 F423 R428 K429 R430 P482 F484	P395-R426 PolarHBondContact O-NH2 2.96Å; L397-R426 PolarHBondContact O-NH1 3.48Å; L397-R426 PolarHBondContact O-NH2 3.44Å; L422-R426 PolarHBondContact O-N 3.46Å; F423-R426 PolarHBondContact O-N 2.77Å; R426-R428 PolarHBondContact O-N 3.1Å; R426-K429 PolarHBondContact O-N 2.71Å; R426-R430 PolarHBondContact O-N 3.43Å; R426-R430 VanDerWaalsContact O-N 3.13Å; R426-P482 PolarHBondContact NH1-O 3.19Å; R426-F484 HydrophobicContact CG-CE2 4.21Å; R426-F484 HydrophobicContact CG-CZ 4.17Å; R426-F484 VanDerWaalsContact NH2-CE1 3.3Å
427	R	83.2	Confident	76.1	Confident	148 Å²	148	91.8 Å²	91.8	56%	0.558	41%	0.409	S	S	*	.	H	α-helix	trans	-60.9	-44.7	177.7	-170.5	177	179.3	173.2	2.9	111.8	F423 N424 K429 R430 Q431	F423-R427 PolarHBondContact O-N 3.36Å; N424-R427 PolarHBondContact O-N 2.85Å; R427-K429 PolarHBondContact O-N 3.46Å; R427-R430 PolarHBondContact O-N 2.99Å; R427-Q431 PolarHBondContact O-N 3.29Å; R427-Q431 VanDerWaalsContact O-N 3.1Å
428	R	81.8	Confident	73.8	Confident	149 Å²	149	94.4 Å²	94.4	56%	0.562	43%	0.426	S	S	*	.	H	α-helix	trans	-62.1	-41.6	177.1	-70.1	174.1	-167.7	152.8	1.9	112.5	N424 R426 R430 Q431 L432	N424-R428 WeakPolarHBondContact O-CG 3.47Å; N424-R428 PolarHBondContact O-N 2.87Å; R426-R428 PolarHBondContact O-N 3.1Å; R428-R430 PolarHBondContact O-N 3.4Å; R428-Q431 PolarHBondContact O-N 2.87Å; R428-L432 WeakPolarHBondContact O-CD1 3.28Å; R428-L432 PolarHBondContact O-N 3.13Å; R428-L432 VanDerWaalsContact O-N 3.14Å
429	K	75.7	Confident	71.2	Confident	99 Å²	99	100.6 Å²	100.6	43%	0.43	46%	0.459	S	S	.	.	H	α-helix	trans	-61.4	-41.8	176	-75.9	-173.7	174.9	-164.4	0	112.2	S393 A425 R426 R427 L432 I433	S393-K429 VanDerWaalsContact CA-NZ 3.34Å; S393-K429 PolarHBondContact O-NZ 3.07Å; A425-K429 PolarHBondContact O-N 3.35Å; A425-K429 VanDerWaalsContact O-N 3.15Å; R426-K429 PolarHBondContact O-N 2.71Å; R427-K429 PolarHBondContact O-N 3.46Å; K429-L432 PolarHBondContact O-N 3.13Å; K429-I433 WeakPolarHBondContact O-CG1 3.34Å; K429-I433 PolarHBondContact O-N 3.2Å
430	R	70.3	Confident	68.5	Low	98 Å²	98	103.7 Å²	103.7	37%	0.37	48%	0.482	S	S	.	.	H	α-helix	trans	-62.7	-44	175.9	-73.3	-178.1	176.9	171.7	-3.9	111.9	R426 R427 R428 L432 I433 F434 S481	R426-R430 PolarHBondContact O-N 3.43Å; R426-R430 VanDerWaalsContact O-N 3.13Å; R427-R430 PolarHBondContact O-N 2.99Å; R428-R430 PolarHBondContact O-N 3.4Å; R430-L432 VanDerWaalsContact C-N 3.29Å; R430-L432 PolarHBondContact O-N 3.37Å; R430-I433 PolarHBondContact O-N 2.94Å; R430-I433 VanDerWaalsContact O-N 3.14Å; R430-F434 HydrophobicContact CB-CE2 4.48Å; R430-F434 WeakPolarHBondContact O-CD2 3.32Å; R430-F434 PolarHBondContact O-N 3.48Å; R430-S481 PolarHBondContact NH1-OG 3.21Å
431	Q	67	Low	65.9	Low	103 Å²	103	104.9 Å²	104.9	48%	0.481	49%	0.493	S	S	.	.	H	α-helix	trans	-63.2	-32.7	178.8	-73.3	177.1	-20.4	0	0	113.5	R427 R428 R435	R427-Q431 PolarHBondContact O-N 3.29Å; R427-Q431 VanDerWaalsContact O-N 3.1Å; R428-Q431 PolarHBondContact O-N 2.87Å; Q431-R435 PolarHBondContact O-N 3.15Å
432	L	64.1	Low	63.3	Low	120 Å²	120	108.1 Å²	108.1	63%	0.628	52%	0.515	S	S	*	.	H	α-helix	trans	-66.2	-40.6	173.3	-100.9	100.5	0	0	0	112	R428 K429 R430 R435 T436	R428-L432 WeakPolarHBondContact O-CD1 3.28Å; R428-L432 PolarHBondContact O-N 3.13Å; R428-L432 VanDerWaalsContact O-N 3.14Å; K429-L432 PolarHBondContact O-N 3.13Å; R430-L432 VanDerWaalsContact C-N 3.29Å; R430-L432 PolarHBondContact O-N 3.37Å; L432-R435 PolarHBondContact O-N 3.42Å; L432-T436 PolarHBondContact O-N 3.01Å; L432-T436 PolarHBondContact O-OG1 2.88Å
433	I	60.2	Low	60.5	Low	103 Å²	103	114.9 Å²	114.9	53%	0.528	55%	0.552	S	S	.	*	H	α-helix	trans	-61.7	-49.9	179	-63.1	165.9	0	0	0	109.8	K429 R430 R435 T436 D437	K429-I433 WeakPolarHBondContact O-CG1 3.34Å; K429-I433 PolarHBondContact O-N 3.2Å; R430-I433 PolarHBondContact O-N 2.94Å; R430-I433 VanDerWaalsContact O-N 3.14Å; I433-R435 PolarHBondContact O-N 3.2Å; I433-R435 VanDerWaalsContact O-N 3.16Å; I433-T436 PolarHBondContact O-N 3.06Å; I433-D437 PolarHBondContact O-N 3.19Å
434	F	52.4	Low	57.8	Low	141 Å²	141	116.5 Å²	116.5	62%	0.618	56%	0.564	S	S	*	*	H	α-helix	trans	-63.4	-22.3	178.5	-72.2	-68.1	0	0	0	115.1	R430	R430-F434 HydrophobicContact CB-CE2 4.48Å; R430-F434 WeakPolarHBondContact O-CD2 3.32Å; R430-F434 PolarHBondContact O-N 3.48Å
435	R	48.3	Very low	55.2	Low	198 Å²	198	119.2 Å²	119.2	75%	0.747	58%	0.578	S	S	*	*	H	α-helix	trans	-81.9	-20.3	174.5	-81	-174.9	172.6	179.9	-2.4	113.3	Q431 L432 I433	Q431-R435 PolarHBondContact O-N 3.15Å; L432-R435 PolarHBondContact O-N 3.42Å; I433-R435 PolarHBondContact O-N 3.2Å; I433-R435 VanDerWaalsContact O-N 3.16Å
436	T	49.3	Very low	52.4	Low	92 Å²	92	125.6 Å²	125.6	56%	0.564	61%	0.605	S	S	*	*	H	α-helix	trans	-84.6	-34.7	-178	-37	0	0	0	0	109.9	L432 I433 N438	L432-T436 PolarHBondContact O-N 3.01Å; L432-T436 PolarHBondContact O-OG1 2.88Å; I433-T436 PolarHBondContact O-N 3.06Å; T436-N438 VanDerWaalsContact C-N 3.27Å; T436-N438 PolarHBondContact O-N 3.5Å
437	D	46.2	Very low	50	Low	112 Å²	112	133 Å²	133	60%	0.599	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-11.5	179.4	-62.4	-19.7	0	0	0	114.6	I433	I433-D437 PolarHBondContact O-N 3.19Å
438	N	44.9	Very low	47.4	Very low	136 Å²	136	131.6 Å²	131.6	73%	0.727	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-1.7	-178.7	-80.2	-25.2	0	0	0	114.5	T436	T436-N438 VanDerWaalsContact C-N 3.27Å; T436-N438 PolarHBondContact O-N 3.5Å
439	N	37.7	Very low	44.8	Very low	134 Å²	134	135.2 Å²	135.2	72%	0.717	66%	0.662	S	S	*	*			trans	-125.5	35.3	-176	-83.5	-1.3	0	0	0	112.9	N441	N439-N441 PolarHBondContact O-N 3.46Å
440	D	35.3	Very low	42.7	Very low	144 Å²	144	136.1 Å²	136.1	77%	0.77	68%	0.676	S	S	*	*			trans	-75.5	70.5	158.8	-77.9	-19.8	0	0	0	109
441	N	36.9	Very low	40.7	Very low	138 Å²	138	137.6 Å²	137.6	74%	0.738	69%	0.692	S	S	*	*	S	Bend	trans	-164.4	114	154.5	-90.3	-29.7	0	0	0	108.4	N439	N439-N441 PolarHBondContact O-N 3.46Å
442	D	35.9	Very low	39.1	Very low	132 Å²	132	140.5 Å²	140.5	71%	0.706	71%	0.705	S	S	*	*			trans	69.3	105.9	150.5	-60.7	-24.3	0	0	0	119.5
443	N	33.2	Very low	37.4	Very low	145 Å²	145	143.8 Å²	143.8	78%	0.775	71%	0.714	S	S	*	*			trans	79	143.7	134.9	-64.8	-40.9	0	0	0	118.8
444	L	30.5	Very low	36.1	Very low	146 Å²	146	150.4 Å²	150.4	76%	0.764	73%	0.732	S	S	*	*			trans	99.6	96.3	152.8	-100.3	70.5	0	0	0	119.6
445	I	34.3	Very low	35.1	Very low	128 Å²	128	151.4 Å²	151.4	66%	0.656	74%	0.739	S	S	*	*				70	98.8	120.2	-62.5	175.7	0	0	0	116.9	M447	I445-M447 PolarHBondContact O-N 3.33Å
446	H	28.6	Very low	34.4	Very low	145 Å²	145	151.4 Å²	151.4	67%	0.671	74%	0.744	S	S	*	*				31.8	90.5	112.7	-145.1	-58.4	0	0	0	115.6	N448	H446-N448 PolarHBondContact CE1-ND2 3.26Å; H446-N448 PolarHBondContact CE1-OD1 2.93Å
447	M	33.2	Very low	33.7	Very low	182 Å²	182	153.1 Å²	153.1	90%	0.897	75%	0.749	S	S	*	*			trans	-122.1	103.4	158.3	-89.8	-66.6	171	0	0	111.1	I445	I445-M447 PolarHBondContact O-N 3.33Å
448	N	29.8	Very low	33.1	Very low	119 Å²	119	155.5 Å²	155.5	64%	0.636	76%	0.761	S	S	*	*			trans	-57.9	151.4	170.1	-81	-33.7	0	0	0	111.6	H446 T450	H446-N448 PolarHBondContact CE1-ND2 3.26Å; H446-N448 PolarHBondContact CE1-OD1 2.93Å; N448-T450 PolarHBondContact O-N 3.35Å
449	Y	26.4	Very low	32.5	Very low	224 Å²	224	152.9 Å²	152.9	88%	0.878	77%	0.766	S	S	*	*			trans	-40.4	124.4	149.7	-84.8	-104.3	0	0	0	111.3
450	T	31.3	Very low	32.2	Very low	118 Å²	118	151.9 Å²	151.9	72%	0.724	77%	0.77	S	S	*	*			trans	171.5	124.5	131.7	33.1	0	0	0	0	112.5	N448	N448-T450 PolarHBondContact O-N 3.35Å
451	N	28.7	Very low	32.1	Very low	130 Å²	130	150.9 Å²	150.9	70%	0.695	78%	0.775	S	S	*	*			trans	61.6	147.1	132	-62.8	-21.8	0	0	0	124.6
452	H	33.4	Very low	31.6	Very low	164 Å²	164	149.9 Å²	149.9	76%	0.759	78%	0.778	S	S	*	*			trans	93.7	105.9	147.5	-64.2	-50.2	0	0	0	117.8
453	F	29	Very low	31.6	Very low	189 Å²	189	150 Å²	150	83%	0.829	78%	0.783	S	S	*	*				46.6	103.6	83	-100.1	-84	0	0	0	114.2
454	R	31.8	Very low	31.2	Very low	241 Å²	241	149.2 Å²	149.2	91%	0.909	78%	0.784	S	S	*	*				171.6	140.3	110.6	-103.5	178.7	175	158	-0.9	115
455	H	31.5	Very low	31.2	Very low	162 Å²	162	147.4 Å²	147.4	75%	0.75	78%	0.781	S	S	*	*			trans	-37.9	150.8	160.6	-86.1	-88.9	0	0	0	118.9
456	K	34.8	Very low	30.8	Very low	198 Å²	198	146.9 Å²	146.9	86%	0.861	78%	0.784	S	S	*	*				175.6	115.9	120.7	-96.8	172.5	177.4	-175.7	0	108.7
457	I	35.2	Very low	30.7	Very low	128 Å²	128	146 Å²	146	66%	0.656	79%	0.789	S	S	*	*				75.7	116.2	72.9	-66.6	179.5	0	0	0	114.4
458	N	31.9	Very low	30.4	Very low	162 Å²	162	142.8 Å²	142.8	87%	0.866	78%	0.78	S	S	*	*			trans	83.8	127	152.1	-64.9	-8.7	0	0	0	122.3
459	G	32.2	Very low	30.3	Very low	81 Å²	81	143.5 Å²	143.5	84%	0.835	79%	0.788	S	S	*	*			trans	163	82.9	164.7	0	0	0	0	0	112.9
460	S	31.3	Very low	30.5	Very low	113 Å²	113	138 Å²	138	79%	0.79	78%	0.778	S	S	*	*			trans	-68	135.4	174	43.9	0	0	0	0	113
461	S	33.7	Very low	30.3	Very low	124 Å²	124	139.4 Å²	139.4	87%	0.867	78%	0.776	S	S	*	*			trans	-171	129	150.6	-73.4	0	0	0	0	110.4
462	S	27.9	Very low	30.5	Very low	116 Å²	116	140 Å²	140	81%	0.811	78%	0.779	S	S	*	*			trans	-66.6	126.1	179.6	50.5	0	0	0	0	114
463	V	35.3	Very low	30.2	Very low	134 Å²	134	137.3 Å²	137.3	81%	0.812	77%	0.77	S	S	*	*			trans	-152	119.3	153.7	-176.5	0	0	0	0	109
464	T	24.6	Very low	30.2	Very low	130 Å²	130	135.5 Å²	135.5	80%	0.798	77%	0.769	S	S	*	*			trans	-71.1	140.9	164.8	39.8	0	0	0	0	111.2
465	P	30.3	Very low	30.3	Very low	108 Å²	108	130.3 Å²	130.3	70%	0.701	76%	0.759	S	S	*	*				-142.1	126.6	128.2	30.2	-12.6	0	0	0	111.7
466	T	26	Very low	30.1	Very low	116 Å²	116	131.5 Å²	131.5	71%	0.712	77%	0.765	S	S	*	*				51.9	120.8	88.1	-17.6	0	0	0	0	114.8
467	T	25.6	Very low	30	Very low	126 Å²	126	128.7 Å²	128.7	77%	0.773	76%	0.759	S	S	*	*			trans	59.6	121.3	153.9	33.7	0	0	0	0	116.6
468	T	27.9	Very low	29.7	Very low	116 Å²	116	130.5 Å²	130.5	71%	0.712	77%	0.77	S	S	*	*				-157.9	130.3	62.4	42.7	0	0	0	0	111	V470	T468-V470 PolarHBondContact O-N 2.85Å; T468-V470 VanDerWaalsContact O-N 3.17Å
469	V	26.8	Very low	29.8	Very low	133 Å²	133	126.4 Å²	126.4	81%	0.806	75%	0.754	S	S	*	*			trans	-66.8	105.7	159.2	176	0	0	0	0	106.5	H471	V469-H471 PolarHBondContact O-N 3.05Å
470	V	32.2	Very low	30.2	Very low	110 Å²	110	127.9 Å²	127.9	67%	0.667	74%	0.742	S	S	*	*			trans	-88.8	100.7	167	-178.6	0	0	0	0	106.2	T468 D472	T468-V470 PolarHBondContact O-N 2.85Å; T468-V470 VanDerWaalsContact O-N 3.17Å; V470-D472 PolarHBondContact O-N 3.43Å
471	H	27.2	Very low	30.9	Very low	146 Å²	146	124.3 Å²	124.3	68%	0.676	72%	0.717	S	S	*	*			trans	-59.8	109.5	155.1	-98.4	-86.4	0	0	0	106.9	V469 D473	V469-H471 PolarHBondContact O-N 3.05Å; H471-D473 VanDerWaalsContact C-N 3.31Å; H471-D473 IonicContact CE1-OD2 3.77Å; H471-D473 IonicContact CG-OD2 3.84Å; H471-D473 IonicContact ND1-OD2 2.89Å; H471-D473 PolarHBondContact ND1-OD2 3.06Å
472	D	31.1	Very low	32	Very low	142 Å²	142	119.6 Å²	119.6	76%	0.759	68%	0.683	S	S	*	*			trans	-102.3	62.6	169.1	-149.1	18.8	0	0	0	107.2	V470	V470-D472 PolarHBondContact O-N 3.43Å
473	D	28.6	Very low	34.3	Very low	108 Å²	108	116 Å²	116	58%	0.578	66%	0.656	S	S	*	*			trans	-84.4	134	159	-67.7	-52.9	0	0	0	106.1	H471	H471-D473 VanDerWaalsContact C-N 3.31Å; H471-D473 IonicContact CE1-OD2 3.77Å; H471-D473 IonicContact CG-OD2 3.84Å; H471-D473 IonicContact ND1-OD2 2.89Å; H471-D473 PolarHBondContact ND1-OD2 3.06Å
474	N	28.7	Very low	36.8	Very low	151 Å²	151	110.3 Å²	110.3	81%	0.807	62%	0.62	S	S	*	*			trans	100.1	72.2	178.9	-47.6	-52.1	0	0	0	116.3
475	D	32.8	Very low	40	Very low	132 Å²	132	106 Å²	106	71%	0.706	59%	0.593	S	S	*	*			trans	-136.2	47.7	151.4	-122.1	-3.2	0	0	0	110	L477	D475-L477 PolarHBondContact O-N 3.27Å
476	E	28.4	Very low	43	Very low	188 Å²	188	102 Å²	102	88%	0.879	57%	0.566	S	S	*	*			trans	-72.7	67.6	154.3	-85.8	-167.5	145.3	0	0	109
477	L	33	Very low	46.3	Very low	138 Å²	138	96.9 Å²	96.9	72%	0.723	53%	0.534	S	S	*	.			trans	-106.1	87.5	165.7	-105.9	99.6	0	0	0	110.5	D475 S479	D475-L477 PolarHBondContact O-N 3.27Å; L477-S479 PolarHBondContact O-N 3.44Å
478	N	27.5	Very low	49.5	Very low	166 Å²	166	92 Å²	92	89%	0.888	50%	0.504	S	S	*	.			trans	10.4	79	135.2	-70	-31.8	0	0	0	116.2
479	S	34.7	Very low	52.6	Low	77 Å²	77	86.6 Å²	86.6	54%	0.538	47%	0.471	S	S	.	.			trans	-149.8	115.4	144.7	69.2	0	0	0	0	108	L477 S481	L477-S479 PolarHBondContact O-N 3.44Å; S479-S481 PolarHBondContact O-N 2.71Å; S479-S481 PolarHBondContact O-OG 2.91Å; S479-S481 VanDerWaalsContact O-OG 3.09Å
480	I	41	Very low	55.5	Low	112 Å²	112	81 Å²	81	57%	0.574	44%	0.44	S	S	*	.			trans	-59.2	90.6	179.4	-62.9	169.8	0	0	0	107.6	Q531	I480-Q531 HydrophobicContact CG2-CG 4.02Å
481	S	45.5	Very low	58	Low	38 Å²	38	75.9 Å²	75.9	27%	0.266	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-78.2	131.6	-177.2	-66.9	0	0	0	0	107.2	R430 S479 T483	R430-S481 PolarHBondContact NH1-OG 3.21Å; S479-S481 PolarHBondContact O-N 2.71Å; S479-S481 PolarHBondContact O-OG 2.91Å; S479-S481 VanDerWaalsContact O-OG 3.09Å; S481-T483 VanDerWaalsContact O-CG2 3.3Å; S481-T483 WeakPolarHBondContact O-CG2 3.46Å; S481-T483 PolarHBondContact O-N 2.93Å
482	P	56.1	Low	61.1	Low	24 Å²	24	69 Å²	69	16%	0.156	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-54.2	118.3	-179.6	12.6	-21.2	0	0	0	108.9	A396 P398 R426	A396-P482 VanDerWaalsContact C-CG 3.41Å; A396-P482 HydrophobicContact CB-CG 3.48Å; A396-P482 VanDerWaalsContact CB-CG 3.48Å; A396-P482 WeakPolarHBondContact O-CB 3.21Å; A396-P482 VanDerWaalsContact O-CG 3.26Å; A396-P482 WeakPolarHBondContact O-CG 3.17Å; P398-P482 HydrophobicContact CG-CB 4.43Å; R426-P482 PolarHBondContact NH1-O 3.19Å
483	T	76.8	Confident	64	Low	40 Å²	40	63.6 Å²	63.6	25%	0.245	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-85	136.7	-163.6	43.8	0	0	0	0	110.5	I399 S481 K527	I399-T483 PolarHBondContact N-O 3.01Å; S481-T483 VanDerWaalsContact O-CG2 3.3Å; S481-T483 WeakPolarHBondContact O-CG2 3.46Å; S481-T483 PolarHBondContact O-N 2.93Å; T483-K527 PolarHBondContact OG1-NZ 3.42Å
484	F	88.4	Confident	66.8	Low	15 Å²	15	59.6 Å²	59.6	7%	0.066	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	98.8	166.4	-64.3	-67.4	0	0	0	107.6	I399 F401 R419 L422 R426	I399-F484 HydrophobicContact CB-CD1 4.11Å; I399-F484 HydrophobicContact CD1-CD1 4.19Å; I399-F484 HydrophobicContact CD1-CE1 3.81Å; I399-F484 HydrophobicContact CG1-CD1 4.21Å; I399-F484 HydrophobicContact CG1-CE1 4.22Å; I399-F484 CarbonylContact O-C 3.57Å; I399-F484 WeakPolarHBondContact O-CA 3.46Å; F401-F484 HydrophobicContact CE2-CB 4.47Å; F401-F484 AromaticContact CE2-CD1 3.95Å; F401-F484 HydrophobicContact CE2-CD1 3.95Å; F401-F484 HydrophobicContact CZ-CD1 4.5Å; R419-F484 WeakPolarHBondContact CD-O 3.41Å; R419-F484 HydrophobicContact CG-CB 3.86Å; L422-F484 HydrophobicContact CB-CD2 4.17Å; L422-F484 HydrophobicContact CB-CE1 4.01Å; L422-F484 HydrophobicContact CB-CE2 3.61Å; L422-F484 HydrophobicContact CB-CZ 3.5Å; L422-F484 VanDerWaalsContact CB-CZ 3.5Å; L422-F484 HydrophobicContact CD1-CD1 4.06Å; L422-F484 HydrophobicContact CD1-CE1 3.77Å; L422-F484 HydrophobicContact CD1-CZ 4.13Å; L422-F484 HydrophobicContact CD2-CZ 4.36Å; L422-F484 HydrophobicContact CG-CE1 4.36Å; L422-F484 HydrophobicContact CG-CZ 4.23Å; R426-F484 HydrophobicContact CG-CE2 4.21Å; R426-F484 HydrophobicContact CG-CZ 4.17Å; R426-F484 VanDerWaalsContact NH2-CE1 3.3Å
485	D	92.2	Very high	69.7	Low	40 Å²	40	55.6 Å²	55.6	21%	0.214	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	139.3	177.1	-68.1	-15.6	0	0	0	109.1	I399 L400 F401 K527	I399-D485 PolarHBondContact O-N 3.41Å; L400-D485 WeakPolarHBondContact CA-O 3.48Å; L400-D485 HydrophobicContact CD1-CB 3.79Å; F401-D485 PolarHBondContact N-O 3.28Å; D485-K527 IonicContact OD1-NZ 3.88Å; D485-K527 PolarHBondContact OD1-NZ 2.89Å; D485-K527 IonicContact OD2-NZ 2.69Å; D485-K527 PolarHBondContact OD2-NZ 2.98Å
486	V	92.6	Very high	72.5	Confident	24 Å²	24	49.4 Å²	49.4	15%	0.145	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	117.4	179	-177.9	0	0	0	0	109	F401 A415 R419 V488	F401-V486 HydrophobicContact CB-CG2 4.32Å; F401-V486 HydrophobicContact CD2-CG2 4.1Å; F401-V486 CarbonylContact O-C 3.6Å; F401-V486 WeakPolarHBondContact O-CA 3.4Å; A415-V486 HydrophobicContact CB-CG1 4.06Å; R419-V486 HydrophobicContact CB-CG2 4.07Å; R419-V486 HydrophobicContact CG-CG2 4.23Å; V486-V488 HydrophobicContact CG1-CG2 3.79Å
487	L	94.6	Very high	75.5	Confident	9 Å²	9	46.1 Å²	46.1	5%	0.047	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.3	169.9	-177.4	68.5	0	0	0	109.4	L50 V52 L400 F401 I402 I403 A520	L50-L487 HydrophobicContact CB-CD1 4.06Å; V52-L487 HydrophobicContact CG2-CD1 3.5Å; V52-L487 HydrophobicContact CG2-CG 4.14Å; L400-L487 HydrophobicContact CD1-CB 4.38Å; F401-L487 PolarHBondContact O-N 3.04Å; I402-L487 CarbonylContact C-O 3.53Å; I402-L487 WeakPolarHBondContact CA-O 3.21Å; I402-L487 HydrophobicContact CD1-CD2 4.41Å; I402-L487 HydrophobicContact CG1-CB 4.32Å; I402-L487 HydrophobicContact CG1-CD2 4.42Å; I402-L487 HydrophobicContact CG2-CB 4.49Å; I402-L487 HydrophobicContact CG2-CD2 4.12Å; I403-L487 PolarHBondContact N-O 2.96Å; L487-A520 HydrophobicContact CD2-CB 3.56Å
488	V	92.9	Very high	78.3	Confident	23 Å²	23	40.4 Å²	40.4	14%	0.139	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.7	175.8	-178	0	0	0	0	110.6	I403 A405 Y412 V486 G490	I403-V488 CarbonylContact O-C 3.57Å; I403-V488 WeakPolarHBondContact O-CA 3.25Å; A405-V488 HydrophobicContact CB-CG1 3.66Å; Y412-V488 HydrophobicContact CD2-CB 4.06Å; Y412-V488 HydrophobicContact CD2-CG1 4.01Å; Y412-V488 HydrophobicContact CD2-CG2 3.74Å; Y412-V488 HydrophobicContact CE2-CG2 4.46Å; V486-V488 HydrophobicContact CG1-CG2 3.79Å; V488-G490 PolarHBondContact O-N 3.4Å
489	I	92.7	Very high	81.1	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.015	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	105.5	176	-53.9	-175.1	0	0	0	108.4	I402 I403 A405 G491 A492 L496 M498 V513 M517	I402-I489 HydrophobicContact CG2-CD1 3.76Å; I402-I489 HydrophobicContact CG2-CG1 4.07Å; I403-I489 PolarHBondContact O-N 3.13Å; A405-I489 PolarHBondContact N-O 3.32Å; I489-G491 PolarHBondContact O-N 3.14Å; I489-A492 HydrophobicContact CB-CB 3.98Å; I489-A492 HydrophobicContact CG2-CB 3.63Å; I489-A492 PolarHBondContact O-N 2.95Å; I489-L496 HydrophobicContact CD1-CB 4.28Å; I489-L496 HydrophobicContact CD1-CD1 4.02Å; I489-L496 HydrophobicContact CD1-CD2 4.18Å; I489-L496 HydrophobicContact CD1-CG 4.4Å; I489-M498 HydrophobicContact CG2-SD 3.91Å; I489-V513 HydrophobicContact CD1-CG1 4.04Å; I489-V513 HydrophobicContact CG2-CG1 3.5Å; I489-M517 HydrophobicContact CD1-CG 4.45Å; I489-M517 HydrophobicContact CD1-SD 4.04Å
490	G	88.1	Confident	83.6	Confident	15 Å²	15	37.9 Å²	37.9	16%	0.155	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	131.2	175	0	0	0	0	0	111.4	V488 A492 M498 W506	V488-G490 PolarHBondContact O-N 3.4Å; G490-A492 PolarHBondContact O-N 3.03Å; G490-M498 WeakPolarHBondContact O-CE 3.4Å; G490-M498 VanDerWaalsContact O-SD 3.35Å; G490-W506 WeakPolarHBondContact O-CH2 3.37Å; G490-W506 WeakPolarHBondContact O-CZ3 3.45Å
491	G	85.8	Confident	85.8	Confident	3 Å²	3	35.1 Å²	35.1	3%	0.031	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	7.6	168.8	0	0	0	0	0	116.6	I489 W506	I489-G491 PolarHBondContact O-N 3.14Å; G491-W506 VanDerWaalsContact CA-CZ3 3.48Å
492	A	91.8	Very high	87.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-82.9	148.8	170.6	0	0	0	0	0	111.4	G404 R406 I489 G490 R497 M498	G404-A492 CarbonylContact C-O 3.59Å; G404-A492 WeakPolarHBondContact CA-O 3.42Å; R406-A492 CarbonylContact C-O 3.48Å; R406-A492 WeakPolarHBondContact CA-O 3.34Å; R406-A492 WeakPolarHBondContact CB-O 2.96Å; R406-A492 PolarHBondContact N-O 3.43Å; I489-A492 HydrophobicContact CB-CB 3.98Å; I489-A492 HydrophobicContact CG2-CB 3.63Å; I489-A492 PolarHBondContact O-N 2.95Å; G490-A492 PolarHBondContact O-N 3.03Å; A492-R497 VanDerWaalsContact CA-O 3.3Å; A492-R497 WeakPolarHBondContact CA-O 3.28Å; A492-M498 HydrophobicContact CB-SD 3.78Å
493	D	91.2	Very high	89.1	Confident	30 Å²	30	33.3 Å²	33.3	16%	0.16	18%	0.183	C	C	.	.			trans	-78.2	-173.5	172.1	71.4	6.5	0	0	0	112.2	L495 L496 R497	D493-L495 PolarHBondContact O-N 2.95Å; D493-L495 VanDerWaalsContact OD1-C 3.32Å; D493-L495 WeakPolarHBondContact OD1-CA 3.35Å; D493-L495 PolarHBondContact OD1-N 3.4Å; D493-L496 WeakPolarHBondContact O-CA 3.25Å; D493-L496 PolarHBondContact O-N 3.16Å; D493-L496 PolarHBondContact OD1-N 3Å; D493-L496 VanDerWaalsContact OD1-N 3.12Å; D493-R497 PolarHBondContact N-O 2.87Å; D493-R497 WeakPolarHBondContact OD1-CB 3.36Å; D493-R497 PolarHBondContact OD1-N 3.1Å; D493-R497 IonicContact OD1-NE 3.27Å; D493-R497 IonicContact OD2-CZ 3.33Å; D493-R497 VanDerWaalsContact OD2-CZ 3.28Å; D493-R497 IonicContact OD2-NE 3.12Å; D493-R497 PolarHBondContact OD2-NE 3.17Å; D493-R497 IonicContact OD2-NH2 3.04Å; D493-R497 PolarHBondContact OD2-NH2 3.1Å
494	H	88.5	Confident	89.4	Confident	23 Å²	23	38.2 Å²	38.2	11%	0.106	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.8	179.2	58.8	-76.3	0	0	0	113.6	Y19 S407 L409 L496	Y19-H494 AromaticContact CZ-NE2 3.88Å; Y19-H494 PolarHBondContact OH-NE2 2.88Å; S407-H494 VanDerWaalsContact OG-CB 3.23Å; S407-H494 WeakPolarHBondContact OG-CB 3.47Å; L409-H494 HydrophobicContact CB-CB 4.21Å; L409-H494 HydrophobicContact CD1-CB 4.09Å; L409-H494 HydrophobicContact CG-CB 4.06Å; H494-L496 VanDerWaalsContact C-N 3.29Å
495	L	88.6	Confident	89.2	Confident	67 Å²	67	44.4 Å²	44.4	35%	0.351	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	10.4	169.9	-62.4	-179.6	0	0	0	111.7	Y19 R280 D493 R497	Y19-L495 HydrophobicContact CE1-CD1 4.18Å; R280-L495 PolarHBondContact NH1-O 3.11Å; D493-L495 PolarHBondContact O-N 2.95Å; D493-L495 VanDerWaalsContact OD1-C 3.32Å; D493-L495 WeakPolarHBondContact OD1-CA 3.35Å; D493-L495 PolarHBondContact OD1-N 3.4Å; L495-R497 HydrophobicContact CB-CG 4.14Å; L495-R497 PolarHBondContact O-N 3.46Å
496	L	92.4	Very high	88.7	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	22%	0.222	C	C	.	.			trans	58.7	27	-175.8	-51.2	-178.6	0	0	0	113.6	R280 I373 I402 I489 D493 H494 Q510 M517	R280-L496 PolarHBondContact NH1-O 3.32Å; R280-L496 PolarHBondContact NH2-O 3.17Å; I373-L496 HydrophobicContact CG2-CD1 3.29Å; I373-L496 HydrophobicContact CG2-CG 4.43Å; I402-L496 HydrophobicContact CB-CD1 4.43Å; I402-L496 HydrophobicContact CG2-CD1 3.74Å; I489-L496 HydrophobicContact CD1-CB 4.28Å; I489-L496 HydrophobicContact CD1-CD1 4.02Å; I489-L496 HydrophobicContact CD1-CD2 4.18Å; I489-L496 HydrophobicContact CD1-CG 4.4Å; D493-L496 WeakPolarHBondContact O-CA 3.25Å; D493-L496 PolarHBondContact O-N 3.16Å; D493-L496 PolarHBondContact OD1-N 3Å; D493-L496 VanDerWaalsContact OD1-N 3.12Å; H494-L496 VanDerWaalsContact C-N 3.29Å; L496-Q510 PolarHBondContact O-NE2 3.49Å; L496-M517 HydrophobicContact CD1-SD 3.56Å; L496-M517 VanDerWaalsContact CD1-SD 3.56Å
497	R	91.9	Very high	88.4	Confident	119 Å²	119	46.5 Å²	46.5	45%	0.449	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-86.7	129.2	174.4	-60.6	176.6	-60.7	-174.1	2.4	109.3	R280 A492 D493 L495	R280-R497 VanDerWaalsContact NH1-CG 3.27Å; A492-R497 VanDerWaalsContact CA-O 3.3Å; A492-R497 WeakPolarHBondContact CA-O 3.28Å; D493-R497 PolarHBondContact N-O 2.87Å; D493-R497 WeakPolarHBondContact OD1-CB 3.36Å; D493-R497 PolarHBondContact OD1-N 3.1Å; D493-R497 IonicContact OD1-NE 3.27Å; D493-R497 IonicContact OD2-CZ 3.33Å; D493-R497 VanDerWaalsContact OD2-CZ 3.28Å; D493-R497 IonicContact OD2-NE 3.12Å; D493-R497 PolarHBondContact OD2-NE 3.17Å; D493-R497 IonicContact OD2-NH2 3.04Å; D493-R497 PolarHBondContact OD2-NH2 3.1Å; L495-R497 HydrophobicContact CB-CG 4.14Å; L495-R497 PolarHBondContact O-N 3.46Å
498	M	91.6	Very high	88.1	Confident	18 Å²	18	46.4 Å²	46.4	9%	0.089	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-77	131.2	176.3	-62.2	-64.9	-70.8	0	0	110.3	I489 G490 A492 A502 C503 W506 T508 V513	I489-M498 HydrophobicContact CG2-SD 3.91Å; G490-M498 WeakPolarHBondContact O-CE 3.4Å; G490-M498 VanDerWaalsContact O-SD 3.35Å; A492-M498 HydrophobicContact CB-SD 3.78Å; M498-A502 HydrophobicContact CE-CB 4.22Å; M498-C503 WeakPolarHBondContact CB-SG 3.39Å; M498-W506 HydrophobicContact CE-CE3 3.51Å; M498-W506 HydrophobicContact CE-CZ3 3.56Å; M498-T508 HydrophobicContact CE-CG2 4.04Å; M498-V513 HydrophobicContact CE-CG2 4.23Å; M498-V513 HydrophobicContact CG-CB 4.23Å; M498-V513 HydrophobicContact CG-CG1 4.27Å; M498-V513 HydrophobicContact CG-CG2 3.82Å; M498-V513 HydrophobicContact SD-CG1 4.28Å; M498-V513 HydrophobicContact SD-CG2 4.02Å
499	Q	86.5	Confident	88	Confident	91 Å²	91	46.7 Å²	46.7	43%	0.425	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-65.4	142.1	168.1	-70.3	-170.9	-18.6	0	0	110.3	S501 A502 C503	Q499-S501 PolarHBondContact O-N 3.31Å; Q499-S501 VanDerWaalsContact O-N 3.17Å; Q499-A502 HydrophobicContact CB-CB 4.17Å; Q499-A502 WeakPolarHBondContact O-CA 3.17Å; Q499-A502 WeakPolarHBondContact O-CB 3.39Å; Q499-A502 PolarHBondContact O-N 3.18Å; Q499-C503 PolarHBondContact O-N 2.89Å
500	P	86.6	Confident	88	Confident	99 Å²	99	48.7 Å²	48.7	64%	0.643	24%	0.239	S	C	*	.	H	α-helix	trans	-56.4	-33.2	176.6	-27.8	35.2	0	0	0	113.8	R504	P500-R504 WeakPolarHBondContact O-CB 3.46Å; P500-R504 WeakPolarHBondContact O-CG 3.19Å; P500-R504 PolarHBondContact O-N 2.84Å; P500-R504 PolarHBondContact O-NE 3.29Å
501	S	87.6	Confident	88.2	Confident	55 Å²	55	50.3 Å²	50.3	39%	0.385	25%	0.248	S	C	.	.	H	α-helix	trans	-62.9	-42.4	172	49.9	0	0	0	0	112.2	Q499 R504 R505	Q499-S501 PolarHBondContact O-N 3.31Å; Q499-S501 VanDerWaalsContact O-N 3.17Å; S501-R504 WeakPolarHBondContact O-CB 3.35Å; S501-R504 PolarHBondContact O-N 3.49Å; S501-R505 WeakPolarHBondContact O-CB 3.47Å; S501-R505 PolarHBondContact O-N 2.96Å
502	A	83.8	Confident	88.5	Confident	1 Å²	1	54 Å²	54	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-67.8	-46.3	177.4	0	0	0	0	0	112	M498 Q499 R504 R505 W506	M498-A502 HydrophobicContact CE-CB 4.22Å; Q499-A502 HydrophobicContact CB-CB 4.17Å; Q499-A502 WeakPolarHBondContact O-CA 3.17Å; Q499-A502 WeakPolarHBondContact O-CB 3.39Å; Q499-A502 PolarHBondContact O-N 3.18Å; A502-R504 PolarHBondContact O-N 3.4Å; A502-R505 PolarHBondContact O-N 2.96Å; A502-W506 HydrophobicContact CB-CE3 3.93Å; A502-W506 HydrophobicContact CB-CH2 4.35Å; A502-W506 HydrophobicContact CB-CZ3 3.6Å; A502-W506 PolarHBondContact O-N 3.34Å
503	C	86.3	Confident	88.5	Confident	23 Å²	23	54.1 Å²	54.1	16%	0.155	26%	0.261	C	S	.	.	H	α-helix	trans	-54.6	-40.6	171.4	-75.4	0	0	0	0	112.1	M498 Q499 C507 T508	M498-C503 WeakPolarHBondContact CB-SG 3.39Å; Q499-C503 PolarHBondContact O-N 2.89Å; C503-C507 VanDerWaalsContact O-CA 3.28Å; C503-C507 WeakPolarHBondContact O-CA 3.42Å; C503-C507 PolarHBondContact O-N 3.17Å; C503-T508 WeakPolarHBondContact CB-O 3.49Å; C503-T508 PolarHBondContact O-N 3Å
504	R	83.3	Confident	88.7	Confident	143 Å²	143	52.8 Å²	52.8	54%	0.54	26%	0.255	S	S	.	.	H	α-helix	trans	-65.7	-48.8	176.6	-77.5	-172.6	-73.6	-174.3	1.5	111.9	P500 S501 A502 C507	P500-R504 WeakPolarHBondContact O-CB 3.46Å; P500-R504 WeakPolarHBondContact O-CG 3.19Å; P500-R504 PolarHBondContact O-N 2.84Å; P500-R504 PolarHBondContact O-NE 3.29Å; S501-R504 WeakPolarHBondContact O-CB 3.35Å; S501-R504 PolarHBondContact O-N 3.49Å; A502-R504 PolarHBondContact O-N 3.4Å; R504-C507 PolarHBondContact O-N 3.49Å; R504-C507 PolarHBondContact O-SG 2.89Å; R504-C507 VanDerWaalsContact O-SG 3.39Å
505	R	84.4	Confident	88.9	Confident	144 Å²	144	55.6 Å²	55.6	54%	0.543	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-43	-177.2	-175.4	171.7	63.5	169.6	3.8	112.2	S501 A502	S501-R505 WeakPolarHBondContact O-CB 3.47Å; S501-R505 PolarHBondContact O-N 2.96Å; A502-R505 PolarHBondContact O-N 2.96Å
506	W	81.7	Confident	89.1	Confident	67 Å²	67	57 Å²	57	25%	0.254	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	6.6	-179.7	-59.6	-47	0	0	0	114.3	G53 G490 G491 M498 A502 T508	G53-W506 WeakPolarHBondContact O-CB 3.33Å; G53-W506 VanDerWaalsContact O-CD1 3.3Å; G490-W506 WeakPolarHBondContact O-CH2 3.37Å; G490-W506 WeakPolarHBondContact O-CZ3 3.45Å; G491-W506 VanDerWaalsContact CA-CZ3 3.48Å; M498-W506 HydrophobicContact CE-CE3 3.51Å; M498-W506 HydrophobicContact CE-CZ3 3.56Å; A502-W506 HydrophobicContact CB-CE3 3.93Å; A502-W506 HydrophobicContact CB-CH2 4.35Å; A502-W506 HydrophobicContact CB-CZ3 3.6Å; A502-W506 PolarHBondContact O-N 3.34Å; W506-T508 HydrophobicContact CB-CG2 4.22Å; W506-T508 PolarHBondContact O-N 3.45Å; W506-T508 VanDerWaalsContact O-N 3.15Å
507	C	86.5	Confident	89.2	Confident	42 Å²	42	57 Å²	57	28%	0.284	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	42.5	171.9	-54.5	0	0	0	0	113.6	Y135 C503 R504	Y135-C507 HydrophobicContact CE1-CB 3.38Å; Y135-C507 WeakPolarHBondContact CE1-SG 3.33Å; Y135-C507 HydrophobicContact CE2-CB 4.19Å; Y135-C507 WeakPolarHBondContact OH-CB 3.18Å; Y135-C507 PolarHBondContact OH-SG 3.41Å; C503-C507 VanDerWaalsContact O-CA 3.28Å; C503-C507 WeakPolarHBondContact O-CA 3.42Å; C503-C507 PolarHBondContact O-N 3.17Å; R504-C507 PolarHBondContact O-N 3.49Å; R504-C507 PolarHBondContact O-SG 2.89Å; R504-C507 VanDerWaalsContact O-SG 3.39Å
508	T	87.7	Confident	89.3	Confident	6 Å²	6	51.5 Å²	51.5	4%	0.037	25%	0.25	C	C	.	.			trans	-124.5	173.6	-176.5	-168.2	0	0	0	0	110.4	M498 C503 W506 V513	M498-T508 HydrophobicContact CE-CG2 4.04Å; C503-T508 WeakPolarHBondContact CB-O 3.49Å; C503-T508 PolarHBondContact O-N 3Å; W506-T508 HydrophobicContact CB-CG2 4.22Å; W506-T508 PolarHBondContact O-N 3.45Å; W506-T508 VanDerWaalsContact O-N 3.15Å; T508-V513 HydrophobicContact CG2-CG2 4.04Å
509	T	91.4	Very high	89.4	Confident	30 Å²	30	54.2 Å²	54.2	18%	0.184	26%	0.264	C	S	.	.			trans	-127.7	159.7	174.3	70.7	0	0	0	0	109.5	L138 S511 R512 V513	L138-T509 HydrophobicContact CD1-CG2 4.05Å; L138-T509 HydrophobicContact CD2-CG2 3.9Å; L138-T509 HydrophobicContact CG-CG2 4.26Å; T509-S511 PolarHBondContact O-N 3.43Å; T509-R512 PolarHBondContact O-N 2.8Å; T509-R512 VanDerWaalsContact O-N 3.09Å; T509-R512 PolarHBondContact OG1-N 3.48Å; T509-V513 PolarHBondContact O-N 2.82Å
510	Q	93.3	Very high	89.8	Confident	45 Å²	45	50.7 Å²	50.7	21%	0.21	25%	0.251	C	S	.	.	H	α-helix	trans	-53.7	-43.8	173.8	-173.2	62	60.9	0	0	111.4	R280 L496 R512 V513 D514	R280-Q510 VanDerWaalsContact CZ-NE2 3.28Å; L496-Q510 PolarHBondContact O-NE2 3.49Å; Q510-R512 VanDerWaalsContact C-N 3.32Å; Q510-R512 PolarHBondContact O-N 3.19Å; Q510-V513 PolarHBondContact O-N 3.31Å; Q510-D514 PolarHBondContact NE2-OD1 2.78Å; Q510-D514 WeakPolarHBondContact O-CB 3.39Å; Q510-D514 PolarHBondContact O-N 3.23Å
511	S	92.2	Very high	90.2	Very high	49 Å²	49	46 Å²	46	34%	0.343	22%	0.22	S	C	.	.	H	α-helix	trans	-59.4	-39.3	177.9	-62.5	0	0	0	0	113	K283 T509 D514 I515	K283-S511 PolarHBondContact NZ-OG 3.32Å; T509-S511 PolarHBondContact O-N 3.43Å; S511-D514 PolarHBondContact O-N 3.06Å; S511-I515 WeakPolarHBondContact O-CG1 3.37Å; S511-I515 PolarHBondContact O-N 3.41Å
512	R	90.8	Very high	90.5	Very high	80 Å²	80	46.4 Å²	46.4	30%	0.302	22%	0.215	S	C	.	.	H	α-helix	trans	-69.5	-41.1	176.7	-77.9	-155.8	175.9	66.4	35.3	112.8	I134 T509 Q510 D514 I515 R516	I134-R512 VanDerWaalsContact CD1-NE 3.29Å; I134-R512 VanDerWaalsContact CD1-NH1 3.27Å; I134-R512 VanDerWaalsContact CG1-NH1 3.27Å; T509-R512 PolarHBondContact O-N 2.8Å; T509-R512 VanDerWaalsContact O-N 3.09Å; T509-R512 PolarHBondContact OG1-N 3.48Å; Q510-R512 VanDerWaalsContact C-N 3.32Å; Q510-R512 PolarHBondContact O-N 3.19Å; R512-D514 VanDerWaalsContact C-N 3.29Å; R512-I515 PolarHBondContact O-N 3.11Å; R512-R516 WeakPolarHBondContact O-CG 3.46Å; R512-R516 PolarHBondContact O-N 3.07Å
513	V	92.3	Very high	90.9	Very high	2 Å²	2	53 Å²	53	1%	0.012	24%	0.243	C	C	.	.	H	α-helix	trans	-60.9	-44.1	175	172.4	0	0	0	0	109.9	I489 M498 T508 T509 Q510 I515 R516 M517	I489-V513 HydrophobicContact CD1-CG1 4.04Å; I489-V513 HydrophobicContact CG2-CG1 3.5Å; M498-V513 HydrophobicContact CE-CG2 4.23Å; M498-V513 HydrophobicContact CG-CB 4.23Å; M498-V513 HydrophobicContact CG-CG1 4.27Å; M498-V513 HydrophobicContact CG-CG2 3.82Å; M498-V513 HydrophobicContact SD-CG1 4.28Å; M498-V513 HydrophobicContact SD-CG2 4.02Å; T508-V513 HydrophobicContact CG2-CG2 4.04Å; T509-V513 PolarHBondContact O-N 2.82Å; Q510-V513 PolarHBondContact O-N 3.31Å; V513-I515 PolarHBondContact O-N 2.91Å; V513-R516 PolarHBondContact O-N 2.9Å; V513-M517 WeakPolarHBondContact O-CB 3.38Å; V513-M517 PolarHBondContact O-N 3.29Å
514	D	94.5	Very high	91.2	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-45	175.8	-64.3	-16.4	0	0	0	111.3	R280 L284 Q510 S511 R512 M517 M518	R280-D514 IonicContact CZ-OD1 2.71Å; R280-D514 IonicContact NE-OD1 3.71Å; R280-D514 PolarHBondContact NE-OD1 3.24Å; R280-D514 IonicContact NE-OD2 2.8Å; R280-D514 PolarHBondContact NE-OD2 2.98Å; R280-D514 IonicContact NH2-OD1 2.93Å; R280-D514 PolarHBondContact NH2-OD1 3.12Å; L284-D514 HydrophobicContact CD2-CB 3.85Å; Q510-D514 PolarHBondContact NE2-OD1 2.78Å; Q510-D514 WeakPolarHBondContact O-CB 3.39Å; Q510-D514 PolarHBondContact O-N 3.23Å; S511-D514 PolarHBondContact O-N 3.06Å; R512-D514 VanDerWaalsContact C-N 3.29Å; D514-M517 WeakPolarHBondContact O-CB 3.22Å; D514-M517 PolarHBondContact O-N 3.42Å; D514-M518 VanDerWaalsContact O-CG 3.3Å; D514-M518 WeakPolarHBondContact O-CG 3.17Å; D514-M518 PolarHBondContact O-N 3.09Å
515	I	92.9	Very high	91.6	Very high	81 Å²	81	45.5 Å²	45.5	42%	0.415	21%	0.212	S	C	.	.	H	α-helix	trans	-62.8	-43.7	175.9	-69.6	164.2	0	0	0	112	S511 R512 V513 M517 M518 N519	S511-I515 WeakPolarHBondContact O-CG1 3.37Å; S511-I515 PolarHBondContact O-N 3.41Å; R512-I515 PolarHBondContact O-N 3.11Å; V513-I515 PolarHBondContact O-N 2.91Å; I515-M517 VanDerWaalsContact C-N 3.3Å; I515-M517 PolarHBondContact O-N 3.37Å; I515-M518 WeakPolarHBondContact O-CB 3.5Å; I515-M518 PolarHBondContact O-N 3.07Å; I515-M518 VanDerWaalsContact O-N 3.16Å; I515-N519 PolarHBondContact O-N 3.41Å
516	R	92.5	Very high	91.8	Very high	96 Å²	96	41.5 Å²	41.5	36%	0.362	21%	0.206	S	C	.	.	H	α-helix	trans	-65.1	-36.8	178.3	-72.2	-176.9	178.1	-175.9	-9.1	111.9	V52 R512 V513 M518 N519 A520	V52-R516 HydrophobicContact CG1-CB 3.5Å; V52-R516 HydrophobicContact CG1-CG 4.08Å; V52-R516 PolarHBondContact O-NH1 2.8Å; V52-R516 VanDerWaalsContact O-NH1 3.13Å; R512-R516 WeakPolarHBondContact O-CG 3.46Å; R512-R516 PolarHBondContact O-N 3.07Å; V513-R516 PolarHBondContact O-N 2.9Å; R516-M518 VanDerWaalsContact C-N 3.33Å; R516-N519 PolarHBondContact O-N 3.43Å; R516-A520 PolarHBondContact O-N 2.8Å
517	M	94.9	Very high	92	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-44.7	171.9	-173.1	175.9	72.6	0	0	110.9	L284 I373 I402 I489 L496 V513 D514 I515 N519 A520 I521	L284-M517 HydrophobicContact CD1-CE 4.18Å; L284-M517 HydrophobicContact CD2-CE 3.42Å; L284-M517 VanDerWaalsContact CD2-CE 3.42Å; L284-M517 HydrophobicContact CG-CE 4.43Å; I373-M517 HydrophobicContact CG2-CE 4.39Å; I373-M517 HydrophobicContact CG2-SD 4.09Å; I402-M517 HydrophobicContact CD1-CG 3.58Å; I402-M517 HydrophobicContact CD1-SD 4.25Å; I402-M517 HydrophobicContact CG2-CG 3.98Å; I402-M517 HydrophobicContact CG2-SD 3.87Å; I489-M517 HydrophobicContact CD1-CG 4.45Å; I489-M517 HydrophobicContact CD1-SD 4.04Å; L496-M517 HydrophobicContact CD1-SD 3.56Å; L496-M517 VanDerWaalsContact CD1-SD 3.56Å; V513-M517 WeakPolarHBondContact O-CB 3.38Å; V513-M517 PolarHBondContact O-N 3.29Å; D514-M517 WeakPolarHBondContact O-CB 3.22Å; D514-M517 PolarHBondContact O-N 3.42Å; I515-M517 VanDerWaalsContact C-N 3.3Å; I515-M517 PolarHBondContact O-N 3.37Å; M517-N519 PolarHBondContact O-N 3.01Å; M517-A520 WeakPolarHBondContact O-CB 3.04Å; M517-A520 PolarHBondContact O-N 3.23Å; M517-I521 WeakPolarHBondContact O-CG1 3.42Å; M517-I521 PolarHBondContact O-N 3.29Å
518	M	95.3	Very high	92	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.025	20%	0.196	C	C	.	.	H	α-helix	trans	-63.7	-39.3	175.4	-62.8	-65.3	106	0	0	112.5	L284 L287 L288 I291 D514 I515 R516 A520 I521 K522	L284-M518 HydrophobicContact CD2-CE 4.18Å; L287-M518 HydrophobicContact CB-CG 3.67Å; L287-M518 HydrophobicContact CB-SD 3.8Å; L287-M518 HydrophobicContact CD1-CG 3.96Å; L287-M518 HydrophobicContact CG-CG 4.39Å; L288-M518 HydrophobicContact CD2-CE 4.18Å; L288-M518 HydrophobicContact CD2-SD 3.75Å; L288-M518 HydrophobicContact CG-CE 4.37Å; L288-M518 HydrophobicContact CG-SD 3.85Å; I291-M518 HydrophobicContact CD1-SD 4.46Å; D514-M518 VanDerWaalsContact O-CG 3.3Å; D514-M518 WeakPolarHBondContact O-CG 3.17Å; D514-M518 PolarHBondContact O-N 3.09Å; I515-M518 WeakPolarHBondContact O-CB 3.5Å; I515-M518 PolarHBondContact O-N 3.07Å; I515-M518 VanDerWaalsContact O-N 3.16Å; R516-M518 VanDerWaalsContact C-N 3.33Å; M518-A520 VanDerWaalsContact C-N 3.3Å; M518-A520 PolarHBondContact O-N 2.9Å; M518-I521 HydrophobicContact CE-CD1 3.53Å; M518-I521 WeakPolarHBondContact O-CB 3.43Å; M518-I521 PolarHBondContact O-N 3.07Å; M518-I521 HydrophobicContact SD-CD1 4.37Å; M518-K522 WeakPolarHBondContact O-CG 3.42Å; M518-K522 PolarHBondContact O-N 3.32Å
519	N	93.5	Very high	91.6	Very high	75 Å²	75	43 Å²	43	40%	0.401	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-37.3	175.1	-71.2	-14.4	0	0	0	112.2	I515 R516 M517 K522 K523	I515-N519 PolarHBondContact O-N 3.41Å; R516-N519 PolarHBondContact O-N 3.43Å; M517-N519 PolarHBondContact O-N 3.01Å; N519-K522 PolarHBondContact O-N 2.89Å; N519-K523 WeakPolarHBondContact O-CG 3.24Å; N519-K523 PolarHBondContact O-N 3.35Å
520	A	93.8	Very high	90.5	Very high	16 Å²	16	46.3 Å²	46.3	13%	0.132	22%	0.222	C	C	.	.	H	α-helix	trans	-66.2	-39.6	173.9	0	0	0	0	0	111.9	L487 R516 M517 M518 K523 F524	L487-A520 HydrophobicContact CD2-CB 3.56Å; R516-A520 PolarHBondContact O-N 2.8Å; M517-A520 WeakPolarHBondContact O-CB 3.04Å; M517-A520 PolarHBondContact O-N 3.23Å; M518-A520 VanDerWaalsContact C-N 3.3Å; M518-A520 PolarHBondContact O-N 2.9Å; A520-K523 PolarHBondContact O-N 2.79Å; A520-F524 WeakPolarHBondContact O-CB 3.37Å; A520-F524 PolarHBondContact O-N 3.46Å
521	I	95.5	Very high	88.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.6	-46.3	173.5	-67.2	173.4	0	0	0	111.1	L288 I291 I371 I373 L400 I402 M517 M518 K523 F524 I525	L288-I521 HydrophobicContact CD2-CD1 4.01Å; L288-I521 HydrophobicContact CD2-CG2 4.35Å; I291-I521 HydrophobicContact CD1-CB 4.33Å; I291-I521 HydrophobicContact CD1-CG2 3.87Å; I371-I521 HydrophobicContact CD1-CG2 3.69Å; I371-I521 HydrophobicContact CG2-CD1 3.98Å; I371-I521 HydrophobicContact CG2-CG1 4Å; I373-I521 HydrophobicContact CD1-CD1 4.14Å; L400-I521 HydrophobicContact CD2-CG1 4.08Å; I402-I521 HydrophobicContact CD1-CD1 4Å; I402-I521 HydrophobicContact CD1-CG1 3.83Å; M517-I521 WeakPolarHBondContact O-CG1 3.42Å; M517-I521 PolarHBondContact O-N 3.29Å; M518-I521 HydrophobicContact CE-CD1 3.53Å; M518-I521 WeakPolarHBondContact O-CB 3.43Å; M518-I521 PolarHBondContact O-N 3.07Å; M518-I521 HydrophobicContact SD-CD1 4.37Å; I521-K523 VanDerWaalsContact C-N 3.34Å; I521-K523 PolarHBondContact O-N 2.96Å; I521-F524 PolarHBondContact O-N 2.96Å; I521-I525 HydrophobicContact CG2-CD1 3.75Å; I521-I525 HydrophobicContact CG2-CG1 4.47Å; I521-I525 WeakPolarHBondContact O-CG1 3.23Å; I521-I525 PolarHBondContact O-N 3.17Å
522	K	93.7	Very high	87.2	Confident	64 Å²	64	45.7 Å²	45.7	28%	0.278	22%	0.218	S	C	.	.	H	α-helix	trans	-55.7	-48.4	174.5	-73.4	-179.2	178	177.2	0	111	I291 M518 N519 F524 I525 C526	I291-K522 HydrophobicContact CD1-CG 3.63Å; I291-K522 HydrophobicContact CG1-CD 4.24Å; I291-K522 VanDerWaalsContact CG1-CE 3.48Å; I291-K522 HydrophobicContact CG1-CG 3.7Å; I291-K522 HydrophobicContact CG2-CG 4.21Å; M518-K522 WeakPolarHBondContact O-CG 3.42Å; M518-K522 PolarHBondContact O-N 3.32Å; N519-K522 PolarHBondContact O-N 2.89Å; K522-F524 PolarHBondContact O-N 3.32Å; K522-I525 PolarHBondContact O-N 3.47Å; K522-C526 PolarHBondContact O-N 2.92Å; K522-C526 PolarHBondContact O-SG 3.42Å
523	K	92	Very high	85.4	Confident	139 Å²	139	48 Å²	48	60%	0.604	23%	0.23	S	C	*	.	H	α-helix	trans	-60.1	-43.9	177.5	-75.5	-179.3	179.2	-170.6	0	112.5	N519 A520 I521 C526 K527	N519-K523 WeakPolarHBondContact O-CG 3.24Å; N519-K523 PolarHBondContact O-N 3.35Å; A520-K523 PolarHBondContact O-N 2.79Å; I521-K523 VanDerWaalsContact C-N 3.34Å; I521-K523 PolarHBondContact O-N 2.96Å; K523-C526 PolarHBondContact O-N 2.94Å; K523-K527 WeakPolarHBondContact O-CB 3.33Å; K523-K527 PolarHBondContact O-N 3.31Å
524	F	93.4	Very high	83.2	Confident	6 Å²	6	52.7 Å²	52.7	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-49.3	176.8	173	-100.8	0	0	0	111.5	Y331 I371 P398 L400 A520 I521 K522 C526 K527 T528	Y331-F524 HydrophobicContact CD1-CE1 4.34Å; Y331-F524 HydrophobicContact CE1-CE1 4.31Å; I371-F524 HydrophobicContact CD1-CD1 4.27Å; I371-F524 HydrophobicContact CD1-CE1 4.46Å; I371-F524 HydrophobicContact CG1-CD1 3.87Å; I371-F524 HydrophobicContact CG1-CE1 3.85Å; P398-F524 HydrophobicContact CB-CE2 4.02Å; P398-F524 HydrophobicContact CB-CZ 3.83Å; L400-F524 HydrophobicContact CB-CD1 4.04Å; L400-F524 HydrophobicContact CB-CD2 3.76Å; L400-F524 HydrophobicContact CB-CE1 4.15Å; L400-F524 HydrophobicContact CB-CE2 3.87Å; L400-F524 HydrophobicContact CB-CG 3.84Å; L400-F524 HydrophobicContact CB-CZ 4.05Å; L400-F524 HydrophobicContact CD2-CB 3.87Å; L400-F524 HydrophobicContact CD2-CD1 4.43Å; L400-F524 HydrophobicContact CD2-CG 4.07Å; L400-F524 HydrophobicContact CG-CG 4.49Å; A520-F524 WeakPolarHBondContact O-CB 3.37Å; A520-F524 PolarHBondContact O-N 3.46Å; I521-F524 PolarHBondContact O-N 2.96Å; K522-F524 PolarHBondContact O-N 3.32Å; F524-C526 VanDerWaalsContact C-N 3.35Å; F524-C526 PolarHBondContact O-N 3.07Å; F524-K527 WeakPolarHBondContact O-CB 3.37Å; F524-K527 PolarHBondContact O-N 2.93Å; F524-T528 HydrophobicContact CD2-CG2 4.26Å; F524-T528 HydrophobicContact CE1-CG2 4.27Å; F524-T528 HydrophobicContact CE2-CG2 3.87Å; F524-T528 HydrophobicContact CZ-CG2 3.88Å; F524-T528 WeakPolarHBondContact O-CG2 3.47Å; F524-T528 PolarHBondContact O-N 3.42Å; F524-T528 PolarHBondContact O-OG1 3.46Å
525	I	91.7	Very high	81.1	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-43.1	178.2	-70.9	166.8	0	0	0	111.5	I265 L267 I291 Y331 I371 I521 K522 T528 R529	I265-I525 HydrophobicContact CD1-CG2 3.85Å; L267-I525 HydrophobicContact CD2-CD1 4.14Å; I291-I525 HydrophobicContact CG2-CD1 3.69Å; Y331-I525 HydrophobicContact CD1-CG1 3.96Å; Y331-I525 HydrophobicContact CD2-CG1 4.3Å; Y331-I525 HydrophobicContact CD2-CG2 4.45Å; Y331-I525 HydrophobicContact CE1-CB 4.39Å; Y331-I525 HydrophobicContact CE1-CG1 3.88Å; Y331-I525 HydrophobicContact CE1-CG2 4.5Å; Y331-I525 HydrophobicContact CE2-CB 4.46Å; Y331-I525 HydrophobicContact CE2-CG1 4.22Å; Y331-I525 HydrophobicContact CE2-CG2 3.76Å; Y331-I525 HydrophobicContact CG-CG1 4.18Å; Y331-I525 PolarHBondContact OH-O 2.96Å; I371-I525 HydrophobicContact CD1-CD1 4.24Å; I371-I525 HydrophobicContact CD1-CG1 4.34Å; I521-I525 HydrophobicContact CG2-CD1 3.75Å; I521-I525 HydrophobicContact CG2-CG1 4.47Å; I521-I525 WeakPolarHBondContact O-CG1 3.23Å; I521-I525 PolarHBondContact O-N 3.17Å; K522-I525 PolarHBondContact O-N 3.47Å; I525-T528 WeakPolarHBondContact CA-OG1 3.44Å; I525-T528 PolarHBondContact O-N 3.46Å; I525-T528 PolarHBondContact O-OG1 3.14Å; I525-T528 VanDerWaalsContact O-OG1 3.1Å; I525-R529 VanDerWaalsContact O-CB 3.27Å; I525-R529 WeakPolarHBondContact O-CB 3.49Å; I525-R529 PolarHBondContact O-N 3.04Å
526	C	88.2	Confident	79	Confident	60 Å²	60	59.7 Å²	59.7	41%	0.405	28%	0.284	S	S	.	.	H	α-helix	trans	-60.6	-47	175.8	-68.1	0	0	0	0	111.5	K522 K523 F524 T528 R529 I530	K522-C526 PolarHBondContact O-N 2.92Å; K522-C526 PolarHBondContact O-SG 3.42Å; K523-C526 PolarHBondContact O-N 2.94Å; F524-C526 VanDerWaalsContact C-N 3.35Å; F524-C526 PolarHBondContact O-N 3.07Å; C526-T528 PolarHBondContact O-N 3.43Å; C526-R529 PolarHBondContact O-N 3.45Å; C526-I530 WeakPolarHBondContact O-CG1 3.43Å; C526-I530 PolarHBondContact O-N 2.95Å; C526-I530 VanDerWaalsContact O-N 3.16Å
527	K	86.7	Confident	76.6	Confident	75 Å²	75	58.7 Å²	58.7	33%	0.326	29%	0.291	S	S	.	.	H	α-helix	trans	-58.1	-46.2	178.3	176.1	-176.3	167.7	-167.1	0	111.7	T483 D485 K523 F524 Q531	T483-K527 PolarHBondContact OG1-NZ 3.42Å; D485-K527 IonicContact OD1-NZ 3.88Å; D485-K527 PolarHBondContact OD1-NZ 2.89Å; D485-K527 IonicContact OD2-NZ 2.69Å; D485-K527 PolarHBondContact OD2-NZ 2.98Å; K523-K527 WeakPolarHBondContact O-CB 3.33Å; K523-K527 PolarHBondContact O-N 3.31Å; F524-K527 WeakPolarHBondContact O-CB 3.37Å; F524-K527 PolarHBondContact O-N 2.93Å; K527-Q531 WeakPolarHBondContact O-CG 3.44Å; K527-Q531 PolarHBondContact O-N 3.06Å
528	T	86.1	Confident	74.2	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-75.7	-29.4	-177.5	49.8	0	0	0	0	113.3	Y331 P398 F524 I525 C526 S532	Y331-T528 VanDerWaalsContact CE1-OG1 3.23Å; Y331-T528 WeakPolarHBondContact CE1-OG1 3.28Å; Y331-T528 PolarHBondContact OH-OG1 3.3Å; P398-T528 HydrophobicContact CB-CG2 3.39Å; P398-T528 HydrophobicContact CG-CG2 3.73Å; F524-T528 HydrophobicContact CD2-CG2 4.26Å; F524-T528 HydrophobicContact CE1-CG2 4.27Å; F524-T528 HydrophobicContact CE2-CG2 3.87Å; F524-T528 HydrophobicContact CZ-CG2 3.88Å; F524-T528 WeakPolarHBondContact O-CG2 3.47Å; F524-T528 PolarHBondContact O-N 3.42Å; F524-T528 PolarHBondContact O-OG1 3.46Å; I525-T528 WeakPolarHBondContact CA-OG1 3.44Å; I525-T528 PolarHBondContact O-N 3.46Å; I525-T528 PolarHBondContact O-OG1 3.14Å; I525-T528 VanDerWaalsContact O-OG1 3.1Å; C526-T528 PolarHBondContact O-N 3.43Å; T528-S532 PolarHBondContact O-N 2.85Å; T528-S532 VanDerWaalsContact O-N 3.17Å; T528-S532 PolarHBondContact O-OG 3.37Å
529	R	79.6	Confident	71.8	Confident	71 Å²	71	68 Å²	68	27%	0.268	34%	0.338	S	S	.	.	H	α-helix	trans	-67.7	-44.2	175	-167.3	175.6	-175.6	171.4	3.1	111.2	D263 I525 C526 Q531 S532 F533	D263-R529 PolarHBondContact O-NH2 3.02Å; I525-R529 VanDerWaalsContact O-CB 3.27Å; I525-R529 WeakPolarHBondContact O-CB 3.49Å; I525-R529 PolarHBondContact O-N 3.04Å; C526-R529 PolarHBondContact O-N 3.45Å; R529-Q531 PolarHBondContact O-N 3.33Å; R529-S532 WeakPolarHBondContact O-CB 3.38Å; R529-S532 PolarHBondContact O-N 3.29Å; R529-S532 VanDerWaalsContact O-N 3.1Å; R529-F533 HydrophobicContact CG-CD2 4.18Å; R529-F533 HydrophobicContact CG-CE2 3.89Å; R529-F533 VanDerWaalsContact O-CD2 3.31Å; R529-F533 WeakPolarHBondContact O-CD2 2.93Å; R529-F533 PolarHBondContact O-N 3.37Å; R529-F533 VanDerWaalsContact O-N 3.17Å
530	I	67.3	Low	69.7	Low	100 Å²	100	72.5 Å²	72.5	51%	0.513	36%	0.355	S	S	.	.	H	α-helix	trans	-59.3	-46.6	176.9	-65.7	164.6	0	0	0	110.7	C526 S532 F533 E534	C526-I530 WeakPolarHBondContact O-CG1 3.43Å; C526-I530 PolarHBondContact O-N 2.95Å; C526-I530 VanDerWaalsContact O-N 3.16Å; I530-S532 PolarHBondContact O-N 3.46Å; I530-F533 PolarHBondContact O-N 3Å; I530-E534 PolarHBondContact O-N 3.44Å
531	Q	58.5	Low	67.3	Low	47 Å²	47	79.6 Å²	79.6	22%	0.22	39%	0.387	C	S	.	.	H	α-helix	trans	-60.1	-31.5	176.7	-69.7	177.7	-8.6	0	0	113.1	I480 K527 R529 K535	I480-Q531 HydrophobicContact CG2-CG 4.02Å; K527-Q531 WeakPolarHBondContact O-CG 3.44Å; K527-Q531 PolarHBondContact O-N 3.06Å; R529-Q531 PolarHBondContact O-N 3.33Å; Q531-K535 PolarHBondContact O-N 3Å
532	S	57.6	Low	64.9	Low	33 Å²	33	86 Å²	86	23%	0.231	42%	0.421	C	S	.	.	H	α-helix	trans	-70.8	-36.3	176.6	-54.6	0	0	0	0	111.6	N368 T528 R529 I530 L536	N368-S532 PolarHBondContact ND2-OG 2.94Å; N368-S532 VanDerWaalsContact ND2-OG 3.16Å; T528-S532 PolarHBondContact O-N 2.85Å; T528-S532 VanDerWaalsContact O-N 3.17Å; T528-S532 PolarHBondContact O-OG 3.37Å; R529-S532 WeakPolarHBondContact O-CB 3.38Å; R529-S532 PolarHBondContact O-N 3.29Å; R529-S532 VanDerWaalsContact O-N 3.1Å; I530-S532 PolarHBondContact O-N 3.46Å; S532-L536 WeakPolarHBondContact O-CG 3.46Å; S532-L536 PolarHBondContact O-N 3.14Å
533	F	53.1	Low	62.2	Low	130 Å²	130	85.9 Å²	85.9	57%	0.57	43%	0.428	S	S	*	.	H	α-helix	trans	-70.5	-41.5	176.4	-83.9	-75.6	0	0	0	112.8	R529 I530 K535 L536 S537	R529-F533 HydrophobicContact CG-CD2 4.18Å; R529-F533 HydrophobicContact CG-CE2 3.89Å; R529-F533 VanDerWaalsContact O-CD2 3.31Å; R529-F533 WeakPolarHBondContact O-CD2 2.93Å; R529-F533 PolarHBondContact O-N 3.37Å; R529-F533 VanDerWaalsContact O-N 3.17Å; I530-F533 PolarHBondContact O-N 3Å; F533-K535 VanDerWaalsContact C-N 3.29Å; F533-K535 PolarHBondContact O-N 2.74Å; F533-L536 PolarHBondContact O-N 2.91Å; F533-S537 PolarHBondContact O-N 2.97Å
534	E	45.8	Very low	59.7	Low	99 Å²	99	84.9 Å²	84.9	46%	0.463	44%	0.435	S	S	.	.	H	α-helix	trans	-61.4	-39.8	176.2	-71.6	174.2	176.3	0	0	111.6	I530 S537 M538	I530-E534 PolarHBondContact O-N 3.44Å; E534-S537 PolarHBondContact O-N 3.09Å; E534-M538 PolarHBondContact O-N 2.95Å; E534-M538 VanDerWaalsContact O-N 3.09Å
535	K	50.6	Low	57.1	Low	131 Å²	131	92.7 Å²	92.7	57%	0.57	48%	0.477	S	S	*	.	H	α-helix	trans	-63.1	-44.1	176.5	-167.1	176.7	-179.6	-172.6	0	112.2	Q531 F533 S537 M538 D539	Q531-K535 PolarHBondContact O-N 3Å; F533-K535 VanDerWaalsContact C-N 3.29Å; F533-K535 PolarHBondContact O-N 2.74Å; K535-S537 VanDerWaalsContact C-N 3.33Å; K535-S537 PolarHBondContact O-N 3.07Å; K535-M538 PolarHBondContact O-N 3.38Å; K535-D539 VanDerWaalsContact O-CG 3.31Å; K535-D539 PolarHBondContact O-N 2.86Å
536	L	49.2	Very low	54.8	Low	101 Å²	101	98.1 Å²	98.1	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-36.5	176.1	-74.6	165.3	0	0	0	112.5	S532 F533 F540	S532-L536 WeakPolarHBondContact O-CG 3.46Å; S532-L536 PolarHBondContact O-N 3.14Å; F533-L536 PolarHBondContact O-N 2.91Å; L536-F540 PolarHBondContact O-N 3.01Å; L536-F540 VanDerWaalsContact O-N 3.15Å
537	S	42.8	Very low	52.6	Low	74 Å²	74	101.1 Å²	101.1	52%	0.517	53%	0.529	S	S	.	.	H	α-helix	trans	-67.6	-38	178.3	-168.5	0	0	0	0	112.1	F533 E534 K535 M541	F533-S537 PolarHBondContact O-N 2.97Å; E534-S537 PolarHBondContact O-N 3.09Å; K535-S537 VanDerWaalsContact C-N 3.33Å; K535-S537 PolarHBondContact O-N 3.07Å; S537-M541 PolarHBondContact O-N 3.35Å
538	M	44.6	Very low	50.5	Low	128 Å²	128	105.2 Å²	105.2	63%	0.631	55%	0.554	S	S	*	*	H	α-helix	trans	-72.1	-39.3	176.6	-70.2	-134.5	-67.4	0	0	112.2	E534 K535 F540 M541 L542	E534-M538 PolarHBondContact O-N 2.95Å; E534-M538 VanDerWaalsContact O-N 3.09Å; K535-M538 PolarHBondContact O-N 3.38Å; M538-F540 VanDerWaalsContact C-N 3.26Å; M538-F540 PolarHBondContact O-N 3.07Å; M538-M541 PolarHBondContact O-N 3.46Å; M538-M541 VanDerWaalsContact O-N 3.11Å; M538-L542 WeakPolarHBondContact O-CB 3.35Å; M538-L542 WeakPolarHBondContact O-CG 3.03Å; M538-L542 PolarHBondContact O-N 2.69Å
539	D	45.3	Very low	48.4	Very low	75 Å²	75	108.5 Å²	108.5	40%	0.401	59%	0.589	S	S	.	*	H	α-helix	trans	-62.1	-35.1	176.9	-70.4	-17.7	0	0	0	111.5	K535 S543	K535-D539 VanDerWaalsContact O-CG 3.31Å; K535-D539 PolarHBondContact O-N 2.86Å; D539-S543 PolarHBondContact O-N 2.96Å; D539-S543 VanDerWaalsContact O-N 3.12Å
540	F	47.6	Very low	46.2	Very low	170 Å²	170	113 Å²	113	75%	0.746	62%	0.618	S	S	*	*	H	α-helix	trans	-71.8	-28.7	173.8	-107.4	-86.1	0	0	0	114.1	L536 M538 S543	L536-F540 PolarHBondContact O-N 3.01Å; L536-F540 VanDerWaalsContact O-N 3.15Å; M538-F540 VanDerWaalsContact C-N 3.26Å; M538-F540 PolarHBondContact O-N 3.07Å; F540-S543 PolarHBondContact O-OG 3.34Å
541	M	44.5	Very low	44.9	Very low	164 Å²	164	123.3 Å²	123.3	81%	0.808	65%	0.65	S	S	*	*	H	α-helix	trans	-82	-23.8	175.9	-73.8	-145.6	156.3	0	0	113.1	S537 M538	S537-M541 PolarHBondContact O-N 3.35Å; M538-M541 PolarHBondContact O-N 3.46Å; M538-M541 VanDerWaalsContact O-N 3.11Å
542	L	45.5	Very low	44.2	Very low	136 Å²	136	127.2 Å²	127.2	71%	0.712	67%	0.672	S	S	*	*	H	α-helix	trans	-96	-8.7	179.5	-68.8	168.5	0	0	0	113.6	M538	M538-L542 WeakPolarHBondContact O-CB 3.35Å; M538-L542 WeakPolarHBondContact O-CG 3.03Å; M538-L542 PolarHBondContact O-N 2.69Å
543	S	36.8	Very low	43.5	Very low	61 Å²	61	132.1 Å²	132.1	43%	0.427	70%	0.695	S	S	.	*	S	Bend	trans	-65	125	169	45.4	0	0	0	0	110.1	D539 F540 L545	D539-S543 PolarHBondContact O-N 2.96Å; D539-S543 VanDerWaalsContact O-N 3.12Å; F540-S543 PolarHBondContact O-OG 3.34Å; S543-L545 PolarHBondContact O-N 3.27Å; S543-L545 VanDerWaalsContact O-N 3.14Å
544	P	38.2	Very low	43	Very low	117 Å²	117	132.2 Å²	132.2	76%	0.76	70%	0.702	S	S	*	*			trans	-63	120.7	-176	24.1	-31.4	0	0	0	109.5	T546	P544-T546 VanDerWaalsContact C-N 3.34Å; P544-T546 PolarHBondContact O-N 3.32Å
545	L	40.2	Very low	42.8	Very low	171 Å²	171	134.2 Å²	134.2	90%	0.895	72%	0.716	S	S	*	*			trans	-55.1	100.6	163.9	-79.6	157.9	0	0	0	107.5	S543	S543-L545 PolarHBondContact O-N 3.27Å; S543-L545 VanDerWaalsContact O-N 3.14Å
546	T	43.4	Very low	42.3	Very low	117 Å²	117	134.4 Å²	134.4	72%	0.718	73%	0.725	S	S	*	*			trans	-58.9	124	168.7	47.5	0	0	0	0	107.6	P544 N548	P544-T546 VanDerWaalsContact C-N 3.34Å; P544-T546 PolarHBondContact O-N 3.32Å; T546-N548 PolarHBondContact O-N 3.48Å
547	P	41.6	Very low	41.9	Very low	122 Å²	122	136.6 Å²	136.6	79%	0.792	74%	0.738	S	S	*	*			trans	-67.2	123.1	176.1	27	-29.4	0	0	0	107.6	G549	P547-G549 VanDerWaalsContact C-N 3.31Å; P547-G549 PolarHBondContact O-N 3.08Å
548	N	41.3	Very low	41.8	Very low	161 Å²	161	141.1 Å²	141.1	86%	0.861	75%	0.754	S	S	*	*			trans	-56.5	99.1	165	-95.4	-14	0	0	0	108.1	T546 N550	T546-N548 PolarHBondContact O-N 3.48Å; N548-N550 PolarHBondContact O-N 3.02Å
549	G	42.8	Very low	41.6	Very low	71 Å²	71	142.1 Å²	142.1	73%	0.732	76%	0.764	S	S	*	*			trans	-74.6	108.5	167.3	0	0	0	0	0	108.7	P547 R551	P547-G549 VanDerWaalsContact C-N 3.31Å; P547-G549 PolarHBondContact O-N 3.08Å; G549-R551 PolarHBondContact O-N 2.81Å
550	N	34.3	Very low	41.3	Very low	164 Å²	164	147.7 Å²	147.7	88%	0.877	79%	0.794	S	S	*	*			trans	-58	113.7	157.8	-79.1	-25.3	0	0	0	109.1	N548	N548-N550 PolarHBondContact O-N 3.02Å
551	R	39	Very low	40.7	Very low	318 Å²	318	145.6 Å²	145.6	100%	1.2	80%	0.798	S	S	*	*			trans	-163.1	0	144	-111.1	-179.4	-170.5	-171.7	3.3	110.9	G549	G549-R551 PolarHBondContact O-N 2.81Å

Retrieved 551 of 551 residues in 134 ms (Link to these results)

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