A0A087XQZ9_POEFO Loading...

Mitogen-activated protein kinase

AlphaFold DB , UniProt , Accession A0A087XQZ9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 410 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	32.4	Very low	31.1	Very low	233 Å²	233	141.1 Å²	141.1	100%	1.148	84%	0.844	S	S	*	*				0	147.9	0	-72.1	169.5	169.6	0	0	107.4
2	T	34.3	Very low	31.2	Very low	131 Å²	131	137.8 Å²	137.8	80%	0.804	84%	0.844	S	S	*	*			trans	47.8	94.9	168.5	52.5	0	0	0	0	116.4
3	V	28.9	Very low	31.2	Very low	130 Å²	130	134.2 Å²	134.2	79%	0.788	84%	0.837	S	S	*	*			cis	81.5	148.2	45.9	-174.8	0	0	0	0	113
4	S	31.2	Very low	31.8	Very low	105 Å²	105	133.7 Å²	133.7	73%	0.734	84%	0.836	S	S	*	*			trans	89.6	118	-173.5	94.4	0	0	0	0	113.2
5	E	33.3	Very low	31.8	Very low	180 Å²	180	140 Å²	140	84%	0.841	84%	0.838	S	S	*	*			cis	56.8	142.5	24	-51.9	176.1	137.3	0	0	112.9
6	S	29.7	Very low	32.1	Very low	95 Å²	95	140.3 Å²	140.3	66%	0.664	84%	0.841	S	S	*	*			cis	-130	-155.2	-2.4	49.1	0	0	0	0	108.2
7	E	30.9	Very low	32.3	Very low	173 Å²	173	140.2 Å²	140.2	81%	0.808	84%	0.835	S	S	*	*			cis	-159.4	177.4	4.1	-148.6	145.8	-75.4	0	0	109.8
8	E	30.1	Very low	33	Very low	188 Å²	188	138.9 Å²	138.9	88%	0.879	83%	0.831	S	S	*	*			trans	-100.1	153.3	164.2	-70	178.8	98	0	0	110.9
9	A	31.1	Very low	32.8	Very low	105 Å²	105	135 Å²	135	87%	0.868	82%	0.822	S	S	*	*			trans	-142.9	99.6	169	0	0	0	0	0	111.5
10	A	28	Very low	32.9	Very low	108 Å²	108	137.8 Å²	137.8	89%	0.893	83%	0.825	S	S	*	*			trans	-81.8	141.2	172.7	0	0	0	0	0	111.3
11	A	32.1	Very low	32.9	Very low	104 Å²	104	135.5 Å²	135.5	86%	0.86	82%	0.821	S	S	*	*			trans	-112.7	130.3	171.7	0	0	0	0	0	110
12	A	31.8	Very low	32.9	Very low	102 Å²	102	135.9 Å²	135.9	84%	0.843	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-88.2	145.8	-169.3	0	0	0	0	0	113.7
13	A	32.2	Very low	32.8	Very low	91 Å²	91	136.7 Å²	136.7	75%	0.752	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-81.2	139.5	163.5	0	0	0	0	0	110.7
14	P	38.5	Very low	33.4	Very low	127 Å²	127	136.5 Å²	136.5	83%	0.825	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-75.1	135.6	172.8	30.8	-33	0	0	0	110.9
15	R	31.8	Very low	33.3	Very low	228 Å²	228	134.1 Å²	134.1	86%	0.86	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-79.6	146	168.7	-63.6	178.7	-179.4	174.8	-0.7	110.4
16	T	36.7	Very low	33.3	Very low	145 Å²	145	135.2 Å²	135.2	89%	0.89	81%	0.808	S	S	*	*			trans	-121	133.8	151.3	42.6	0	0	0	0	108.8
17	D	35.7	Very low	33.4	Very low	138 Å²	138	133.9 Å²	133.9	74%	0.738	81%	0.809	S	S	*	*			trans	-110.1	177.2	-174.8	-123.9	-20.8	0	0	0	109.4
18	P	45.3	Very low	33.8	Very low	118 Å²	118	132.2 Å²	132.2	77%	0.766	81%	0.813	S	S	*	*				-121.5	165.9	-122.3	37.5	-22.2	0	0	0	115.8
19	G	29.7	Very low	33.9	Very low	64 Å²	64	127 Å²	127	66%	0.66	81%	0.81	S	S	*	*			trans	110.5	135.4	142	0	0	0	0	0	116.8
20	H	33.6	Very low	34	Very low	191 Å²	191	128.3 Å²	128.3	88%	0.884	81%	0.813	S	S	*	*				-153	129.1	114.6	-109.9	66.2	0	0	0	110.4
21	A	32.9	Very low	34.1	Very low	90 Å²	90	126.7 Å²	126.7	74%	0.744	81%	0.807	S	S	*	*			trans	-95.3	133.4	168.8	0	0	0	0	0	109.5
22	R	32.2	Very low	34.2	Very low	240 Å²	240	134.3 Å²	134.3	91%	0.906	81%	0.813	S	S	*	*			trans	-170.6	97.6	154.2	-106	157.3	-162.9	-154.7	4	112.2
23	N	34	Very low	34.1	Very low	148 Å²	148	133.8 Å²	133.8	79%	0.791	81%	0.809	S	S	*	*			trans	-79.8	158.2	137	-129.1	-26.9	0	0	0	106.6	G25	N23-G25 PolarHBondContact OD1-N 3.36Å
24	P	41.3	Very low	34.2	Very low	126 Å²	126	135.6 Å²	135.6	82%	0.818	81%	0.813	S	S	*	*				-136.3	157.7	54.7	37.9	-21	0	0	0	115.6
25	G	28.9	Very low	34	Very low	56 Å²	56	135.9 Å²	135.9	58%	0.577	82%	0.816	S	S	*	*			trans	-88.3	-172.6	178.8	0	0	0	0	0	115.8	N23	N23-G25 PolarHBondContact OD1-N 3.36Å
26	H	33.1	Very low	34.1	Very low	203 Å²	203	129.5 Å²	129.5	94%	0.94	81%	0.813	S	S	*	*			trans	-144.5	167	166.2	-112.7	45.2	0	0	0	111.8
27	G	31.8	Very low	33.8	Very low	67 Å²	67	130.3 Å²	130.3	69%	0.691	81%	0.811	S	S	*	*			trans	-81.1	-166.7	-160.5	0	0	0	0	0	118.1
28	P	40	Very low	33.6	Very low	138 Å²	138	129.3 Å²	129.3	90%	0.896	82%	0.815	S	S	*	*			trans	-85.8	139.7	-152.2	32.3	-36.8	0	0	0	115.1
29	G	30.8	Very low	33.1	Very low	79 Å²	79	129.9 Å²	129.9	81%	0.814	82%	0.816	S	S	*	*			trans	-107.9	118.4	167.6	0	0	0	0	0	111.6
30	S	34	Very low	33.3	Very low	132 Å²	132	132.4 Å²	132.4	92%	0.923	82%	0.821	S	S	*	*			trans	-78.9	119.4	174.4	47.6	0	0	0	0	111.3
31	G	30	Very low	33.2	Very low	74 Å²	74	132 Å²	132	76%	0.763	82%	0.822	S	S	*	*			trans	-136.2	108.4	177.3	0	0	0	0	0	111.9
32	R	33.4	Very low	33.2	Very low	264 Å²	264	132.4 Å²	132.4	100%	0.996	83%	0.825	S	S	*	*			trans	-76.3	126.9	166.6	-86.6	179.6	164.9	176.9	-5.5	109.2
33	A	31.3	Very low	33.4	Very low	91 Å²	91	129 Å²	129	75%	0.752	82%	0.823	S	S	*	*			trans	-116.1	154.3	162.3	0	0	0	0	0	108.8
34	P	33.9	Very low	33.6	Very low	128 Å²	128	127 Å²	127	83%	0.831	82%	0.821	S	S	*	*			trans	-80.5	163.1	-164.7	32.5	-36.6	0	0	0	114
35	C	33.3	Very low	33.5	Very low	133 Å²	133	123.6 Å²	123.6	90%	0.899	81%	0.808	S	S	*	*			trans	-60.2	139.3	165.8	-57	0	0	0	0	110.5
36	A	34	Very low	33.9	Very low	95 Å²	95	127.2 Å²	127.2	79%	0.785	82%	0.821	S	S	*	*			trans	-106.7	145.3	164	0	0	0	0	0	109
37	D	30.1	Very low	34.2	Very low	161 Å²	161	126.8 Å²	126.8	86%	0.861	82%	0.82	S	S	*	*			trans	-66.4	137	-172.3	-61.7	-76.8	0	0	0	113.3	V39	D37-V39 PolarHBondContact O-N 3.07Å
38	S	31.8	Very low	34.6	Very low	118 Å²	118	132.8 Å²	132.8	83%	0.825	83%	0.83	S	S	*	*			trans	-76.3	93.7	178.3	57.3	0	0	0	0	111.2
39	V	35.7	Very low	35	Very low	129 Å²	129	130.7 Å²	130.7	78%	0.782	82%	0.824	S	S	*	*			trans	-64.9	125.3	164.6	-177.2	0	0	0	0	108.4	D37 M41	D37-V39 PolarHBondContact O-N 3.07Å; V39-M41 PolarHBondContact O-N 2.72Å; V39-M41 VanDerWaalsContact O-N 3.14Å
40	P	32.3	Very low	36.1	Very low	118 Å²	118	131.2 Å²	131.2	77%	0.766	82%	0.821	S	S	*	*			trans	-69.4	113.5	178.9	27.4	-33.1	0	0	0	110	A42	P40-A42 PolarHBondContact O-N 2.65Å
41	M	33.2	Very low	37.3	Very low	182 Å²	182	130.4 Å²	130.4	90%	0.897	81%	0.813	S	S	*	*			trans	-64.2	119.2	170.2	-125.9	177.5	175.3	0	0	108.6	V39 I43	V39-M41 PolarHBondContact O-N 2.72Å; V39-M41 VanDerWaalsContact O-N 3.14Å; M41-I43 PolarHBondContact O-N 2.84Å
42	A	32.4	Very low	39	Very low	98 Å²	98	129.7 Å²	129.7	81%	0.81	79%	0.794	S	S	*	*			trans	-65.3	119.6	173.8	0	0	0	0	0	108.7	P40 S44	P40-A42 PolarHBondContact O-N 2.65Å; A42-S44 PolarHBondContact O-N 3.14Å
43	I	36.8	Very low	40.7	Very low	169 Å²	169	120.5 Å²	120.5	87%	0.867	77%	0.769	S	S	*	*			trans	-70.9	103.5	176.4	-56.1	171.9	0	0	0	107.1	M41 G45	M41-I43 PolarHBondContact O-N 2.84Å; I43-G45 PolarHBondContact O-N 2.88Å
44	S	36.8	Very low	42.6	Very low	107 Å²	107	127.5 Å²	127.5	75%	0.748	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-59.6	124.2	166.6	49.5	0	0	0	0	108.7	A42	A42-S44 PolarHBondContact O-N 3.14Å
45	G	38.8	Very low	44.5	Very low	53 Å²	53	124.1 Å²	124.1	55%	0.546	75%	0.75	S	S	.	*	P	Polyproline II helix	trans	-61.2	170.8	169.3	0	0	0	0	0	111.5	I43 E47	I43-G45 PolarHBondContact O-N 2.88Å; G45-E47 PolarHBondContact O-N 2.96Å
46	P	37.5	Very low	46.3	Very low	132 Å²	132	122.8 Å²	122.8	86%	0.857	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-56.2	131.1	172.9	26.2	-34.1	0	0	0	109.7	E48	P46-E48 PolarHBondContact O-N 2.94Å; P46-E48 VanDerWaalsContact O-N 3.11Å
47	E	39.9	Very low	48	Very low	195 Å²	195	128 Å²	128	91%	0.911	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-60.8	117.2	171.9	-82	-173.7	122.4	0	0	109	G45 A49	G45-E47 PolarHBondContact O-N 2.96Å; E47-A49 PolarHBondContact O-N 3.17Å; E47-A49 VanDerWaalsContact O-N 3.12Å
48	E	40.3	Very low	50.1	Low	193 Å²	193	123.3 Å²	123.3	90%	0.902	72%	0.722	S	S	*	*			trans	-67.9	110	176.2	-168.9	168.1	-139	0	0	108.1	P46 A50	P46-E48 PolarHBondContact O-N 2.94Å; P46-E48 VanDerWaalsContact O-N 3.11Å; E48-A50 PolarHBondContact O-N 3.24Å
49	A	49.4	Very low	52.4	Low	93 Å²	93	125 Å²	125	77%	0.769	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-56.6	125.9	-171.2	0	0	0	0	0	110.8	E47	E47-A49 PolarHBondContact O-N 3.17Å; E47-A49 VanDerWaalsContact O-N 3.12Å
50	A	53.6	Low	55	Low	90 Å²	90	122.3 Å²	122.3	74%	0.744	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-53.1	135.5	-173.9	0	0	0	0	0	111.5	E48	E48-A50 PolarHBondContact O-N 3.24Å
51	P	59.3	Low	57.8	Low	116 Å²	116	119.3 Å²	119.3	75%	0.753	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-60.9	142.4	-173.5	24.4	-34.4	0	0	0	111.1
52	P	64.8	Low	60.7	Low	59 Å²	59	117 Å²	117	38%	0.383	67%	0.672	S	S	.	*	P	Polyproline II helix	trans	-59.7	144.4	-173.2	22.2	-32.8	0	0	0	112	R54 W95	P52-R54 PolarHBondContact O-N 3.28Å; P52-W95 HydrophobicContact CB-CD2 3.54Å; P52-W95 HydrophobicContact CB-CE3 3.8Å; P52-W95 HydrophobicContact CB-CG 4.06Å; P52-W95 HydrophobicContact CB-CH2 4.06Å; P52-W95 HydrophobicContact CB-CZ2 3.79Å; P52-W95 HydrophobicContact CB-CZ3 4.06Å; P52-W95 HydrophobicContact CG-CE3 4.48Å; P52-W95 HydrophobicContact CG-CH2 4.12Å; P52-W95 HydrophobicContact CG-CZ2 4.17Å; P52-W95 HydrophobicContact CG-CZ3 4.27Å
53	P	69.9	Low	63.6	Low	70 Å²	70	113 Å²	113	46%	0.455	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-62.5	137.6	-177.4	25.8	-34.4	0	0	0	111	L55 W95	P53-L55 HydrophobicContact CG-CD2 4.48Å; P53-L55 PolarHBondContact O-N 2.89Å; P53-W95 HydrophobicContact CG-CG 4.5Å
54	R	70.9	Confident	66.3	Low	239 Å²	239	112.6 Å²	112.6	90%	0.902	63%	0.629	S	S	*	*			trans	-70.8	95.6	175.5	-71.5	-175.6	173.5	-169.4	-4.5	110.2	P52	P52-R54 PolarHBondContact O-N 3.28Å
55	L	74	Confident	68.8	Low	57 Å²	57	110.8 Å²	110.8	30%	0.298	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-84.1	141.7	177.2	-58.2	174.4	0	0	0	110.9	P53 P72 N94	P53-L55 HydrophobicContact CG-CD2 4.48Å; P53-L55 PolarHBondContact O-N 2.89Å; L55-P72 HydrophobicContact CB-CB 3.85Å; L55-P72 HydrophobicContact CB-CG 3.91Å; L55-P72 HydrophobicContact CD1-CB 4.47Å; L55-P72 WeakPolarHBondContact CD1-O 3.45Å; L55-N94 HydrophobicContact CD1-CB 3.52Å; L55-N94 HydrophobicContact CD2-CB 4.3Å
56	P	71.6	Confident	71.4	Confident	105 Å²	105	111.6 Å²	111.6	68%	0.682	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-66.1	149.1	170.3	30.5	-34.9	0	0	0	110	T58 P72	P56-T58 PolarHBondContact O-N 3.39Å; P56-P72 WeakPolarHBondContact O-CB 3.26Å
57	K	69.5	Low	74	Confident	204 Å²	204	107.3 Å²	107.3	89%	0.887	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-59.7	128.3	172.2	-71.4	-172.8	170.2	-174.9	0	109.9
58	T	74.3	Confident	76.6	Confident	62 Å²	62	98.1 Å²	98.1	38%	0.38	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-96	154.1	171.8	55.3	0	0	0	0	109.8	P56 G71 P72 T75	P56-T58 PolarHBondContact O-N 3.39Å; T58-G71 WeakPolarHBondContact OG1-CA 3.38Å; T58-P72 HydrophobicContact CG2-CB 4.14Å; T58-T75 HydrophobicContact CG2-CG2 3.96Å
59	D	79.6	Confident	79.2	Confident	155 Å²	155	93.7 Å²	93.7	83%	0.829	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-67.7	162.2	168.4	-65.2	-56.6	0	0	0	111.5	E61	D59-E61 PolarHBondContact O-N 3.36Å
60	V	89.4	Confident	81.3	Confident	71 Å²	71	89.5 Å²	89.5	43%	0.43	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-73	117.3	178.7	178.2	0	0	0	0	110	A67 D69	V60-A67 HydrophobicContact CG1-CB 3.83Å; V60-D69 HydrophobicContact CG1-CB 4.29Å; V60-D69 HydrophobicContact CG2-CB 4.26Å
61	E	92.1	Very high	83.2	Confident	56 Å²	56	86.8 Å²	86.8	26%	0.262	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	140.2	179.5	-68.7	-170.8	-145.1	0	0	111.4	D59 F68 T75 N76 L77	D59-E61 PolarHBondContact O-N 3.36Å; E61-F68 PolarHBondContact O-N 3.18Å; E61-T75 VanDerWaalsContact OE1-CA 3.24Å; E61-T75 WeakPolarHBondContact OE1-CA 3.32Å; E61-N76 PolarHBondContact OE1-N 3.5Å; E61-L77 HydrophobicContact CB-CD1 4.49Å; E61-L77 HydrophobicContact CG-CD1 4.5Å; E61-L77 WeakPolarHBondContact OE2-CB 3.31Å; E61-L77 WeakPolarHBondContact OE2-CD1 3.13Å; E61-L77 PolarHBondContact OE2-N 3.21Å
62	L	93.7	Very high	84.9	Confident	132 Å²	132	83.2 Å²	83.2	69%	0.691	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	108.6	177.1	-70.7	178.1	0	0	0	110.8	Q66 A67	L62-Q66 WeakPolarHBondContact CA-O 3.25Å; L62-A67 HydrophobicContact CD2-CB 4.1Å
63	V	94	Very high	86.3	Confident	14 Å²	14	82.4 Å²	82.4	9%	0.085	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	120.3	175.9	-172.2	0	0	0	0	109.6	G65 Q66 F68 L77 Y79 M87	V63-G65 PolarHBondContact O-N 2.91Å; V63-Q66 PolarHBondContact N-O 2.83Å; V63-Q66 PolarHBondContact O-N 2.77Å; V63-F68 HydrophobicContact CB-CD2 4.14Å; V63-F68 HydrophobicContact CB-CE2 4.2Å; V63-F68 HydrophobicContact CG2-CD2 4.15Å; V63-L77 HydrophobicContact CG2-CB 3.68Å; V63-L77 HydrophobicContact CG2-CD2 4.04Å; V63-Y79 HydrophobicContact CG1-CD2 4.47Å; V63-M87 HydrophobicContact CB-SD 4.34Å; V63-M87 HydrophobicContact CG1-SD 4.11Å
64	K	92.7	Very high	87.6	Confident	162 Å²	162	79.2 Å²	79.2	70%	0.704	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	22.9	-178.5	-63.7	-73.2	-174.6	174.9	0	114.4	Y79 M87	K64-Y79 HydrophobicContact CG-CD2 3.88Å; K64-Y79 HydrophobicContact CG-CE2 4.35Å; K64-Y79 HydrophobicContact CG-CG 4.2Å; K64-M87 HydrophobicContact CB-CE 3.91Å; K64-M87 HydrophobicContact CB-SD 4.49Å; K64-M87 HydrophobicContact CG-CE 4.44Å
65	G	90.4	Very high	88.7	Confident	69 Å²	69	68.6 Å²	68.6	71%	0.711	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	-2.1	-176.1	0	0	0	0	0	115.1	V63	V63-G65 PolarHBondContact O-N 2.91Å
66	Q	91.7	Very high	89.7	Confident	69 Å²	69	71 Å²	71	32%	0.322	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	139.4	170.4	-61.5	-174.2	17.6	0	0	110.6	L62 V63 F68 E82 M87	L62-Q66 WeakPolarHBondContact CA-O 3.25Å; V63-Q66 PolarHBondContact N-O 2.83Å; V63-Q66 PolarHBondContact O-N 2.77Å; Q66-F68 HydrophobicContact CB-CE2 4.46Å; Q66-E82 PolarHBondContact NE2-OE1 2.99Å; Q66-M87 HydrophobicContact CB-CE 4.44Å; Q66-M87 VanDerWaalsContact CD-CE 3.47Å; Q66-M87 HydrophobicContact CG-CE 4.03Å
67	A	93.1	Very high	90.9	Very high	42 Å²	42	67 Å²	67	35%	0.347	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	134.4	176.3	0	0	0	0	0	112.1	V60 L62 K104 Y151	V60-A67 HydrophobicContact CG1-CB 3.83Å; L62-A67 HydrophobicContact CD2-CB 4.1Å; A67-K104 PolarHBondContact O-NZ 2.8Å; A67-Y151 PolarHBondContact O-OH 3.19Å
68	F	94.8	Very high	92.2	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.009	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	97.8	173.8	-86.6	-108.7	0	0	0	110.1	E61 V63 Q66 V70 L77 M87 C89 K104 Y151	E61-F68 PolarHBondContact O-N 3.18Å; V63-F68 HydrophobicContact CB-CD2 4.14Å; V63-F68 HydrophobicContact CB-CE2 4.2Å; V63-F68 HydrophobicContact CG2-CD2 4.15Å; Q66-F68 HydrophobicContact CB-CE2 4.46Å; F68-V70 HydrophobicContact CB-CG2 4.42Å; F68-V70 HydrophobicContact CD1-CG1 4.43Å; F68-V70 PolarHBondContact O-N 3.11Å; F68-L77 HydrophobicContact CB-CD2 3.38Å; F68-L77 HydrophobicContact CD1-CD2 3.43Å; F68-L77 VanDerWaalsContact CD1-CD2 3.43Å; F68-L77 HydrophobicContact CD2-CD2 4.41Å; F68-L77 HydrophobicContact CE1-CD2 4.3Å; F68-L77 HydrophobicContact CG-CD2 3.5Å; F68-L77 VanDerWaalsContact CG-CD2 3.5Å; F68-M87 HydrophobicContact CE2-CB 4.38Å; F68-M87 HydrophobicContact CE2-CG 4.25Å; F68-M87 HydrophobicContact CE2-SD 3.73Å; F68-M87 HydrophobicContact CZ-CB 3.99Å; F68-M87 HydrophobicContact CZ-CG 3.96Å; F68-M87 HydrophobicContact CZ-SD 4.06Å; F68-C89 HydrophobicContact CE1-CB 4.21Å; F68-C89 WeakPolarHBondContact CZ-SG 3.15Å; F68-K104 HydrophobicContact CD1-CB 4.34Å; F68-K104 HydrophobicContact CD2-CD 4.4Å; F68-K104 HydrophobicContact CE1-CB 3.58Å; F68-K104 HydrophobicContact CE2-CB 4.35Å; F68-K104 HydrophobicContact CE2-CD 4.13Å; F68-K104 HydrophobicContact CZ-CB 3.57Å; F68-K104 HydrophobicContact CZ-CD 4.22Å; F68-K104 HydrophobicContact CZ-CG 4.48Å; F68-Y151 HydrophobicContact CB-CE1 4.37Å; F68-Y151 AromaticContact CD1-CD1 4Å; F68-Y151 HydrophobicContact CD1-CD1 4Å; F68-Y151 AromaticContact CD1-CE1 3.81Å; F68-Y151 HydrophobicContact CD1-CE1 3.81Å; F68-Y151 HydrophobicContact CE1-CD1 4.34Å; F68-Y151 HydrophobicContact CE1-CE1 4.37Å; F68-Y151 HydrophobicContact CG-CE1 4.15Å
69	D	93.9	Very high	93.2	Very high	101 Å²	101	61.1 Å²	61.1	54%	0.54	35%	0.346	S	S	.	.			trans	-89.3	78.6	178.2	-168	16.1	0	0	0	109.7	V60 Y151	V60-D69 HydrophobicContact CG1-CB 4.29Å; V60-D69 HydrophobicContact CG2-CB 4.26Å; D69-Y151 PolarHBondContact N-OH 2.79Å; D69-Y151 VanDerWaalsContact N-OH 3.07Å
70	V	95	Very high	93.8	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.024	32%	0.322	C	S	.	.			trans	-130.1	0.6	-172.6	-57.5	0	0	0	0	113.5	F68 Y74 L77 I102 I139 Y151	F68-V70 HydrophobicContact CB-CG2 4.42Å; F68-V70 HydrophobicContact CD1-CG1 4.43Å; F68-V70 PolarHBondContact O-N 3.11Å; V70-Y74 WeakPolarHBondContact O-CB 3.49Å; V70-Y74 PolarHBondContact O-N 2.82Å; V70-L77 HydrophobicContact CG2-CD1 3.88Å; V70-L77 HydrophobicContact CG2-CD2 4.02Å; V70-I102 HydrophobicContact CB-CD1 4.45Å; V70-I102 HydrophobicContact CG1-CG2 4.3Å; V70-I102 HydrophobicContact CG2-CD1 4.38Å; V70-I139 HydrophobicContact CB-CD1 3.61Å; V70-I139 HydrophobicContact CG1-CD1 3.77Å; V70-Y151 HydrophobicContact CG1-CD1 3.38Å; V70-Y151 HydrophobicContact CG1-CD2 4.06Å; V70-Y151 HydrophobicContact CG1-CE1 3.72Å; V70-Y151 HydrophobicContact CG1-CE2 4.36Å; V70-Y151 HydrophobicContact CG1-CG 3.57Å
71	G	93.1	Very high	93.7	Very high	34 Å²	34	54.1 Å²	54.1	35%	0.351	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	166.9	177.3	0	0	0	0	0	113.1	T58	T58-G71 WeakPolarHBondContact OG1-CA 3.38Å
72	P	93.4	Very high	93.3	Very high	40 Å²	40	57.2 Å²	57.2	26%	0.26	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	cis	-87.1	-6.1	-1.4	36.4	-36.8	0	0	0	113.6	L55 P56 T58 Y74 N94	L55-P72 HydrophobicContact CB-CB 3.85Å; L55-P72 HydrophobicContact CB-CG 3.91Å; L55-P72 HydrophobicContact CD1-CB 4.47Å; L55-P72 WeakPolarHBondContact CD1-O 3.45Å; P56-P72 WeakPolarHBondContact O-CB 3.26Å; T58-P72 HydrophobicContact CG2-CB 4.14Å; P72-Y74 PolarHBondContact O-N 2.96Å; P72-N94 PolarHBondContact O-ND2 3.32Å
73	R	94.9	Very high	92.2	Very high	42 Å²	42	53.2 Å²	53.2	16%	0.158	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-43.4	-179.7	-178.4	177.2	177.2	-175.3	2.7	111.7	D93 N94 W95 D137	R73-D93 WeakPolarHBondContact CG-OD1 3.33Å; R73-D93 IonicContact CZ-OD1 2.87Å; R73-D93 IonicContact CZ-OD2 2.76Å; R73-D93 IonicContact NE-OD1 3.47Å; R73-D93 PolarHBondContact NE-OD1 2.82Å; R73-D93 IonicContact NE-OD2 3.4Å; R73-D93 PolarHBondContact NE-OD2 3.09Å; R73-D93 IonicContact NH2-OD1 3.83Å; R73-D93 IonicContact NH2-OD2 3.84Å; R73-D93 PolarHBondContact NH2-OD2 3.29Å; R73-N94 WeakPolarHBondContact O-CB 3.23Å; R73-N94 PolarHBondContact O-N 3.4Å; R73-N94 PolarHBondContact O-ND2 3.11Å; R73-W95 VanDerWaalsContact CD-CE3 3.49Å; R73-W95 HydrophobicContact CG-CD2 3.88Å; R73-W95 HydrophobicContact CG-CE3 4.24Å; R73-W95 HydrophobicContact CG-CG 4.08Å; R73-D137 IonicContact CZ-OD2 2.82Å; R73-D137 IonicContact NH1-OD2 3.69Å; R73-D137 PolarHBondContact NH1-OD2 3.04Å
74	Y	96.6	Very high	90.6	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.016	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.1	-177.6	-55.5	-77.4	0	0	0	111.2	V70 P72 Q92 D93 V100 I102 D137 I139 V153	V70-Y74 WeakPolarHBondContact O-CB 3.49Å; V70-Y74 PolarHBondContact O-N 2.82Å; P72-Y74 PolarHBondContact O-N 2.96Å; Y74-Q92 WeakPolarHBondContact CA-O 3.34Å; Y74-D93 HydrophobicContact CD1-CB 3.89Å; Y74-D93 HydrophobicContact CE1-CB 3.65Å; Y74-V100 HydrophobicContact CD1-CG2 3.64Å; Y74-V100 HydrophobicContact CE1-CG1 4.49Å; Y74-V100 HydrophobicContact CE1-CG2 3.69Å; Y74-I102 HydrophobicContact CD1-CD1 3.89Å; Y74-I102 HydrophobicContact CD2-CD1 4.14Å; Y74-I102 HydrophobicContact CG-CD1 3.59Å; Y74-D137 WeakPolarHBondContact OH-CB 3.4Å; Y74-D137 PolarHBondContact OH-OD2 3.31Å; Y74-I139 HydrophobicContact CD2-CD1 3.49Å; Y74-I139 VanDerWaalsContact CD2-CD1 3.49Å; Y74-I139 HydrophobicContact CD2-CG1 4.48Å; Y74-I139 HydrophobicContact CE2-CD1 3.7Å; Y74-I139 HydrophobicContact CE2-CG1 4.25Å; Y74-V153 HydrophobicContact CE1-CG1 3.89Å; Y74-V153 HydrophobicContact CE1-CG2 4.48Å; Y74-V153 HydrophobicContact CE2-CG2 3.91Å
75	T	95.5	Very high	89.5	Confident	15 Å²	15	50 Å²	50	9%	0.092	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	177.1	-177.3	60.1	0	0	0	0	112.2	T58 E61 Q92 N94	T58-T75 HydrophobicContact CG2-CG2 3.96Å; E61-T75 VanDerWaalsContact OE1-CA 3.24Å; E61-T75 WeakPolarHBondContact OE1-CA 3.32Å; T75-Q92 PolarHBondContact N-O 3.27Å; T75-Q92 VanDerWaalsContact N-O 3.09Å; T75-Q92 WeakPolarHBondContact O-CB 3.25Å; T75-Q92 PolarHBondContact O-N 3.12Å; T75-N94 WeakPolarHBondContact CG2-ND2 3.48Å; T75-N94 PolarHBondContact OG1-ND2 3.47Å
76	N	94.9	Very high	89.1	Confident	108 Å²	108	47.4 Å²	47.4	58%	0.578	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	60.3	51.9	179	-57.5	-66.5	0	0	0	112.1	E61 Q92	E61-N76 PolarHBondContact OE1-N 3.5Å; N76-Q92 HydrophobicContact CB-CB 4.47Å
77	L	96.8	Very high	89.2	Confident	22 Å²	22	44.3 Å²	44.3	12%	0.115	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.9	-172.1	-82.5	72.5	0	0	0	112.2	E61 V63 F68 V70 C89 S90 A91	E61-L77 HydrophobicContact CB-CD1 4.49Å; E61-L77 HydrophobicContact CG-CD1 4.5Å; E61-L77 WeakPolarHBondContact OE2-CB 3.31Å; E61-L77 WeakPolarHBondContact OE2-CD1 3.13Å; E61-L77 PolarHBondContact OE2-N 3.21Å; V63-L77 HydrophobicContact CG2-CB 3.68Å; V63-L77 HydrophobicContact CG2-CD2 4.04Å; F68-L77 HydrophobicContact CB-CD2 3.38Å; F68-L77 HydrophobicContact CD1-CD2 3.43Å; F68-L77 VanDerWaalsContact CD1-CD2 3.43Å; F68-L77 HydrophobicContact CD2-CD2 4.41Å; F68-L77 HydrophobicContact CE1-CD2 4.3Å; F68-L77 HydrophobicContact CG-CD2 3.5Å; F68-L77 VanDerWaalsContact CG-CD2 3.5Å; V70-L77 HydrophobicContact CG2-CD1 3.88Å; V70-L77 HydrophobicContact CG2-CD2 4.02Å; L77-C89 HydrophobicContact CB-CB 4.4Å; L77-C89 HydrophobicContact CD2-CB 4.23Å; L77-C89 HydrophobicContact CG-CB 4.38Å; L77-S90 CarbonylContact C-O 3.56Å; L77-S90 WeakPolarHBondContact CA-O 3.38Å; L77-A91 HydrophobicContact CD1-CB 4.07Å; L77-A91 HydrophobicContact CG-CB 4.13Å
78	A	96.4	Very high	89.2	Confident	45 Å²	45	44.1 Å²	44.1	37%	0.372	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	120.5	174.6	0	0	0	0	0	111.1	I80 C89 S90	A78-I80 PolarHBondContact O-N 3.42Å; A78-C89 CarbonylContact O-C 3.59Å; A78-C89 WeakPolarHBondContact O-CA 3.34Å; A78-S90 PolarHBondContact N-O 2.98Å; A78-S90 PolarHBondContact O-N 2.86Å; A78-S90 PolarHBondContact O-OG 3.14Å
79	Y	95.3	Very high	89.3	Confident	96 Å²	96	44 Å²	44	38%	0.376	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	128.5	-179.9	175.5	-91.1	0	0	0	112.9	V63 K64 G81 E82 M87	V63-Y79 HydrophobicContact CG1-CD2 4.47Å; K64-Y79 HydrophobicContact CG-CD2 3.88Å; K64-Y79 HydrophobicContact CG-CE2 4.35Å; K64-Y79 HydrophobicContact CG-CG 4.2Å; Y79-G81 WeakPolarHBondContact CE2-O 3.3Å; Y79-G81 VanDerWaalsContact CZ-CA 3.46Å; Y79-G81 WeakPolarHBondContact OH-CA 3.44Å; Y79-E82 HydrophobicContact CE2-CB 4.46Å; Y79-E82 PolarHBondContact OH-N 2.91Å; Y79-M87 HydrophobicContact CD2-CE 4.28Å; Y79-M87 HydrophobicContact CD2-CG 3.93Å; Y79-M87 HydrophobicContact CD2-SD 3.81Å; Y79-M87 HydrophobicContact CE2-CE 4.11Å; Y79-M87 HydrophobicContact CE2-CG 3.96Å; Y79-M87 HydrophobicContact CE2-SD 4.14Å
80	I	92.3	Very high	89.5	Confident	61 Å²	61	39.8 Å²	39.8	31%	0.313	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-44.5	172.6	-55.3	177.2	0	0	0	110.5	A78 V88 A101 L156	A78-I80 PolarHBondContact O-N 3.42Å; I80-V88 HydrophobicContact CD1-CG1 4.18Å; I80-V88 PolarHBondContact N-O 2.82Å; I80-A101 HydrophobicContact CD1-CB 4.47Å; I80-L156 HydrophobicContact CD1-CD1 3.54Å
81	G	87.9	Confident	89.6	Confident	19 Å²	19	39.6 Å²	39.6	20%	0.196	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.4	179.7	-171.9	0	0	0	0	0	113.5	Y79 V88	Y79-G81 WeakPolarHBondContact CE2-O 3.3Å; Y79-G81 VanDerWaalsContact CZ-CA 3.46Å; Y79-G81 WeakPolarHBondContact OH-CA 3.44Å; G81-V88 PolarHBondContact N-O 2.94Å; G81-V88 PolarHBondContact O-N 3.44Å
82	E	83.1	Confident	89.8	Confident	121 Å²	121	39.7 Å²	39.7	57%	0.565	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-135.5	128	178.3	-170.8	165	-142.3	0	0	108.4	Q66 Y79	Q66-E82 PolarHBondContact NE2-OE1 2.99Å; Y79-E82 HydrophobicContact CE2-CB 4.46Å; Y79-E82 PolarHBondContact OH-N 2.91Å
83	G	69.6	Low	90	Very high	47 Å²	47	37.9 Å²	37.9	49%	0.485	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	178.2	176	0	0	0	0	0	111.4	Y85 G86	G83-Y85 PolarHBondContact O-N 3.25Å; G83-G86 PolarHBondContact N-O 2.65Å; G83-G86 PolarHBondContact O-N 3.22Å
84	A	62	Low	90	Very high	78 Å²	78	37.5 Å²	37.5	65%	0.645	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-1.7	-174.4	0	0	0	0	0	115.7
85	Y	68.4	Low	89.8	Confident	30 Å²	30	40.9 Å²	40.9	12%	0.118	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-154.3	17.6	-177	55.2	-89	0	0	0	113.6	G83 K103 I105 D216	G83-Y85 PolarHBondContact O-N 3.25Å; Y85-K103 PolarHBondContact OH-NZ 2.99Å; Y85-I105 HydrophobicContact CD2-CD1 4.39Å; Y85-I105 HydrophobicContact CD2-CG1 4.32Å; Y85-I105 HydrophobicContact CD2-CG2 3.94Å; Y85-I105 HydrophobicContact CE2-CD1 4.06Å; Y85-I105 HydrophobicContact CE2-CG1 4.41Å; Y85-D216 PolarHBondContact OH-OD1 3.23Å
86	G	82.3	Confident	89.8	Confident	16 Å²	16	43.6 Å²	43.6	17%	0.165	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.8	158.2	-176.2	0	0	0	0	0	116.3	G83 K104	G83-G86 PolarHBondContact N-O 2.65Å; G83-G86 PolarHBondContact O-N 3.22Å; G86-K104 CarbonylContact C-O 3.43Å; G86-K104 WeakPolarHBondContact CA-O 3.22Å
87	M	93	Very high	89.7	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.02	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	140.4	177.9	-177.1	179.6	-68.3	0	0	111.1	V63 K64 Q66 F68 Y79 K104	V63-M87 HydrophobicContact CB-SD 4.34Å; V63-M87 HydrophobicContact CG1-SD 4.11Å; K64-M87 HydrophobicContact CB-CE 3.91Å; K64-M87 HydrophobicContact CB-SD 4.49Å; K64-M87 HydrophobicContact CG-CE 4.44Å; Q66-M87 HydrophobicContact CB-CE 4.44Å; Q66-M87 VanDerWaalsContact CD-CE 3.47Å; Q66-M87 HydrophobicContact CG-CE 4.03Å; F68-M87 HydrophobicContact CE2-CB 4.38Å; F68-M87 HydrophobicContact CE2-CG 4.25Å; F68-M87 HydrophobicContact CE2-SD 3.73Å; F68-M87 HydrophobicContact CZ-CB 3.99Å; F68-M87 HydrophobicContact CZ-CG 3.96Å; F68-M87 HydrophobicContact CZ-SD 4.06Å; Y79-M87 HydrophobicContact CD2-CE 4.28Å; Y79-M87 HydrophobicContact CD2-CG 3.93Å; Y79-M87 HydrophobicContact CD2-SD 3.81Å; Y79-M87 HydrophobicContact CE2-CE 4.11Å; Y79-M87 HydrophobicContact CE2-CG 3.96Å; Y79-M87 HydrophobicContact CE2-SD 4.14Å; M87-K104 PolarHBondContact N-O 3.1Å; M87-K104 VanDerWaalsContact N-O 3.14Å; M87-K104 PolarHBondContact O-N 2.99Å
88	V	94.8	Very high	89.6	Confident	37 Å²	37	50.1 Å²	50.1	22%	0.224	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.4	178.3	-168	0	0	0	0	110.5	I80 G81 A101 I102 K103	I80-V88 HydrophobicContact CD1-CG1 4.18Å; I80-V88 PolarHBondContact N-O 2.82Å; G81-V88 PolarHBondContact N-O 2.94Å; G81-V88 PolarHBondContact O-N 3.44Å; V88-A101 HydrophobicContact CG1-CB 4.46Å; V88-I102 WeakPolarHBondContact CA-O 3.31Å; V88-K103 HydrophobicContact CG2-CB 4.31Å; V88-K103 HydrophobicContact CG2-CG 4.17Å
89	C	96.8	Very high	89.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	151.7	173.9	-62	0	0	0	0	110.3	F68 L77 A78 A101 I102	F68-C89 HydrophobicContact CE1-CB 4.21Å; F68-C89 WeakPolarHBondContact CZ-SG 3.15Å; L77-C89 HydrophobicContact CB-CB 4.4Å; L77-C89 HydrophobicContact CD2-CB 4.23Å; L77-C89 HydrophobicContact CG-CB 4.38Å; A78-C89 CarbonylContact O-C 3.59Å; A78-C89 WeakPolarHBondContact O-CA 3.34Å; C89-A101 CarbonylContact O-C 3.56Å; C89-A101 WeakPolarHBondContact O-CA 3.4Å; C89-I102 PolarHBondContact N-O 2.92Å; C89-I102 PolarHBondContact O-N 3.49Å
90	S	97.3	Very high	89.8	Confident	13 Å²	13	49.3 Å²	49.3	9%	0.091	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	145.5	157.6	62.5	0	0	0	0	108.9	L77 A78 R99 V100	L77-S90 CarbonylContact C-O 3.56Å; L77-S90 WeakPolarHBondContact CA-O 3.38Å; A78-S90 PolarHBondContact N-O 2.98Å; A78-S90 PolarHBondContact O-N 2.86Å; A78-S90 PolarHBondContact O-OG 3.14Å; S90-R99 PolarHBondContact OG-NH2 3.39Å; S90-V100 CarbonylContact C-O 3.46Å; S90-V100 VanDerWaalsContact CA-O 3.23Å; S90-V100 WeakPolarHBondContact CA-O 3.2Å
91	A	97.8	Very high	90	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	160.5	174.9	0	0	0	0	0	110.3	L77 R99 V100 I102	L77-A91 HydrophobicContact CD1-CB 4.07Å; L77-A91 HydrophobicContact CG-CB 4.13Å; A91-R99 CarbonylContact O-C 3.55Å; A91-R99 VanDerWaalsContact O-CA 3.31Å; A91-R99 WeakPolarHBondContact O-CA 3.29Å; A91-V100 HydrophobicContact CB-CG2 4.24Å; A91-V100 PolarHBondContact N-O 2.93Å; A91-V100 PolarHBondContact O-N 2.99Å; A91-I102 HydrophobicContact CB-CD1 3.61Å; A91-I102 HydrophobicContact CB-CG1 4.14Å
92	Q	97.5	Very high	90.5	Very high	35 Å²	35	46 Å²	46	16%	0.164	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	121.5	167.3	-177.2	61	51.3	0	0	108.8	Y74 T75 N76 Q97 Q98	Y74-Q92 WeakPolarHBondContact CA-O 3.34Å; T75-Q92 PolarHBondContact N-O 3.27Å; T75-Q92 VanDerWaalsContact N-O 3.09Å; T75-Q92 WeakPolarHBondContact O-CB 3.25Å; T75-Q92 PolarHBondContact O-N 3.12Å; N76-Q92 HydrophobicContact CB-CB 4.47Å; Q92-Q97 PolarHBondContact NE2-O 2.82Å; Q92-Q98 PolarHBondContact NE2-O 3.19Å
93	D	97.1	Very high	91.1	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.016	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	117.4	165.2	-177.5	-4.1	0	0	0	108.4	R73 Y74 W95 T96 Q97 Q98 V100	R73-D93 WeakPolarHBondContact CG-OD1 3.33Å; R73-D93 IonicContact CZ-OD1 2.87Å; R73-D93 IonicContact CZ-OD2 2.76Å; R73-D93 IonicContact NE-OD1 3.47Å; R73-D93 PolarHBondContact NE-OD1 2.82Å; R73-D93 IonicContact NE-OD2 3.4Å; R73-D93 PolarHBondContact NE-OD2 3.09Å; R73-D93 IonicContact NH2-OD1 3.83Å; R73-D93 IonicContact NH2-OD2 3.84Å; R73-D93 PolarHBondContact NH2-OD2 3.29Å; Y74-D93 HydrophobicContact CD1-CB 3.89Å; Y74-D93 HydrophobicContact CE1-CB 3.65Å; D93-W95 VanDerWaalsContact C-N 3.29Å; D93-W95 PolarHBondContact O-N 2.87Å; D93-W95 WeakPolarHBondContact OD1-CB 3.09Å; D93-W95 PolarHBondContact OD1-N 3.02Å; D93-T96 VanDerWaalsContact CB-OG1 3.3Å; D93-T96 WeakPolarHBondContact CB-OG1 3.44Å; D93-T96 PolarHBondContact OD1-N 2.96Å; D93-T96 VanDerWaalsContact OD2-CG2 3.3Å; D93-T96 WeakPolarHBondContact OD2-CG2 3.38Å; D93-T96 PolarHBondContact OD2-OG1 3.45Å; D93-Q97 WeakPolarHBondContact O-CA 3.48Å; D93-Q97 PolarHBondContact O-N 3.47Å; D93-Q98 WeakPolarHBondContact CB-O 3.44Å; D93-Q98 PolarHBondContact N-O 3.35Å; D93-V100 HydrophobicContact CB-CG1 4.3Å
94	N	94.9	Very high	92.3	Very high	33 Å²	33	39.8 Å²	39.8	18%	0.176	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-11	-178	-66.4	-45.8	0	0	0	112.9	L55 P72 R73 T75 Q97	L55-N94 HydrophobicContact CD1-CB 3.52Å; L55-N94 HydrophobicContact CD2-CB 4.3Å; P72-N94 PolarHBondContact O-ND2 3.32Å; R73-N94 WeakPolarHBondContact O-CB 3.23Å; R73-N94 PolarHBondContact O-N 3.4Å; R73-N94 PolarHBondContact O-ND2 3.11Å; T75-N94 WeakPolarHBondContact CG2-ND2 3.48Å; T75-N94 PolarHBondContact OG1-ND2 3.47Å; N94-Q97 PolarHBondContact O-NE2 3.33Å
95	W	92.9	Very high	93.9	Very high	75 Å²	75	36.1 Å²	36.1	28%	0.284	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-49.1	174.6	-64.8	-5.6	0	0	0	111.9	P52 P53 R73 D93 I406	P52-W95 HydrophobicContact CB-CD2 3.54Å; P52-W95 HydrophobicContact CB-CE3 3.8Å; P52-W95 HydrophobicContact CB-CG 4.06Å; P52-W95 HydrophobicContact CB-CH2 4.06Å; P52-W95 HydrophobicContact CB-CZ2 3.79Å; P52-W95 HydrophobicContact CB-CZ3 4.06Å; P52-W95 HydrophobicContact CG-CE3 4.48Å; P52-W95 HydrophobicContact CG-CH2 4.12Å; P52-W95 HydrophobicContact CG-CZ2 4.17Å; P52-W95 HydrophobicContact CG-CZ3 4.27Å; P53-W95 HydrophobicContact CG-CG 4.5Å; R73-W95 VanDerWaalsContact CD-CE3 3.49Å; R73-W95 HydrophobicContact CG-CD2 3.88Å; R73-W95 HydrophobicContact CG-CE3 4.24Å; R73-W95 HydrophobicContact CG-CG 4.08Å; D93-W95 VanDerWaalsContact C-N 3.29Å; D93-W95 PolarHBondContact O-N 2.87Å; D93-W95 WeakPolarHBondContact OD1-CB 3.09Å; D93-W95 PolarHBondContact OD1-N 3.02Å; W95-I406 HydrophobicContact CH2-CG2 4.07Å; W95-I406 HydrophobicContact CZ3-CG2 3.86Å
96	T	94.1	Very high	95.1	Very high	72 Å²	72	37.6 Å²	37.6	44%	0.442	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-12	179.2	60.5	0	0	0	0	113.7	D93 Q98	D93-T96 VanDerWaalsContact CB-OG1 3.3Å; D93-T96 WeakPolarHBondContact CB-OG1 3.44Å; D93-T96 PolarHBondContact OD1-N 2.96Å; D93-T96 VanDerWaalsContact OD2-CG2 3.3Å; D93-T96 WeakPolarHBondContact OD2-CG2 3.38Å; D93-T96 PolarHBondContact OD2-OG1 3.45Å; T96-Q98 PolarHBondContact O-N 3.33Å; T96-Q98 VanDerWaalsContact O-N 3.14Å; T96-Q98 PolarHBondContact OG1-N 3.27Å
97	Q	94.1	Very high	95.6	Very high	133 Å²	133	36.9 Å²	36.9	62%	0.621	18%	0.183	S	C	*	.			trans	59	14.3	-171.5	-62.2	-66.6	-53	0	0	114.2	Q92 D93 N94	Q92-Q97 PolarHBondContact NE2-O 2.82Å; D93-Q97 WeakPolarHBondContact O-CA 3.48Å; D93-Q97 PolarHBondContact O-N 3.47Å; N94-Q97 PolarHBondContact O-NE2 3.33Å
98	Q	94.9	Very high	95.6	Very high	135 Å²	135	37.7 Å²	37.7	63%	0.631	19%	0.187	S	C	*	.			trans	-98.7	158	176	-64.3	-174.3	-4.4	0	0	112.3	Q92 D93 T96	Q92-Q98 PolarHBondContact NE2-O 3.19Å; D93-Q98 WeakPolarHBondContact CB-O 3.44Å; D93-Q98 PolarHBondContact N-O 3.35Å; T96-Q98 PolarHBondContact O-N 3.33Å; T96-Q98 VanDerWaalsContact O-N 3.14Å; T96-Q98 PolarHBondContact OG1-N 3.27Å
99	R	96.6	Very high	95.4	Very high	115 Å²	115	42.5 Å²	42.5	43%	0.434	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	135.9	169.6	-64.5	-173.7	71.3	84.6	1.8	110.4	S90 A91 L156	S90-R99 PolarHBondContact OG-NH2 3.39Å; A91-R99 CarbonylContact O-C 3.55Å; A91-R99 VanDerWaalsContact O-CA 3.31Å; A91-R99 WeakPolarHBondContact O-CA 3.29Å; R99-L156 HydrophobicContact CB-CD2 3.65Å
100	V	97.8	Very high	95.1	Very high	8 Å²	8	47.5 Å²	47.5	5%	0.048	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	160.9	179.8	-65.6	0	0	0	0	110.9	Y74 S90 A91 D93 I102 V153	Y74-V100 HydrophobicContact CD1-CG2 3.64Å; Y74-V100 HydrophobicContact CE1-CG1 4.49Å; Y74-V100 HydrophobicContact CE1-CG2 3.69Å; S90-V100 CarbonylContact C-O 3.46Å; S90-V100 VanDerWaalsContact CA-O 3.23Å; S90-V100 WeakPolarHBondContact CA-O 3.2Å; A91-V100 HydrophobicContact CB-CG2 4.24Å; A91-V100 PolarHBondContact N-O 2.93Å; A91-V100 PolarHBondContact O-N 2.99Å; D93-V100 HydrophobicContact CB-CG1 4.3Å; V100-I102 HydrophobicContact CG2-CD1 4.22Å; V100-I102 HydrophobicContact CG2-CG1 3.99Å; V100-V153 HydrophobicContact CB-CG1 3.76Å; V100-V153 HydrophobicContact CG1-CG1 4.05Å; V100-V153 HydrophobicContact CG2-CG1 3.79Å
101	A	97.6	Very high	94.7	Very high	12 Å²	12	50.5 Å²	50.5	10%	0.099	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	139.1	162.7	0	0	0	0	0	109.5	I80 V88 C89 V153 Q154 L156	I80-A101 HydrophobicContact CD1-CB 4.47Å; V88-A101 HydrophobicContact CG1-CB 4.46Å; C89-A101 CarbonylContact O-C 3.56Å; C89-A101 WeakPolarHBondContact O-CA 3.4Å; A101-V153 CarbonylContact O-C 3.59Å; A101-V153 WeakPolarHBondContact O-CA 3.27Å; A101-Q154 PolarHBondContact N-O 3.08Å; A101-Q154 PolarHBondContact O-N 3.4Å; A101-L156 HydrophobicContact CB-CD1 4.09Å
102	I	97.4	Very high	94.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	116.2	176.5	-52.8	-171.7	0	0	0	108.8	V70 Y74 V88 C89 A91 V100 Y151 I152 V153	V70-I102 HydrophobicContact CB-CD1 4.45Å; V70-I102 HydrophobicContact CG1-CG2 4.3Å; V70-I102 HydrophobicContact CG2-CD1 4.38Å; Y74-I102 HydrophobicContact CD1-CD1 3.89Å; Y74-I102 HydrophobicContact CD2-CD1 4.14Å; Y74-I102 HydrophobicContact CG-CD1 3.59Å; V88-I102 WeakPolarHBondContact CA-O 3.31Å; C89-I102 PolarHBondContact N-O 2.92Å; C89-I102 PolarHBondContact O-N 3.49Å; A91-I102 HydrophobicContact CB-CD1 3.61Å; A91-I102 HydrophobicContact CB-CG1 4.14Å; V100-I102 HydrophobicContact CG2-CD1 4.22Å; V100-I102 HydrophobicContact CG2-CG1 3.99Å; I102-Y151 HydrophobicContact CG2-CD1 4.29Å; I102-I152 WeakPolarHBondContact CA-O 3.5Å; I102-V153 HydrophobicContact CD1-CG2 4.3Å; I102-V153 HydrophobicContact CG1-CG1 4.3Å; I102-V153 HydrophobicContact CG1-CG2 4.16Å; I102-V153 HydrophobicContact CG2-CG2 4.46Å
103	K	95.7	Very high	93.9	Very high	23 Å²	23	54.8 Å²	54.8	10%	0.1	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	104.3	178.6	-178.7	-175.4	-175	-172.3	0	108.9	Y85 V88 I105 E120 Y151 I152	Y85-K103 PolarHBondContact OH-NZ 2.99Å; V88-K103 HydrophobicContact CG2-CB 4.31Å; V88-K103 HydrophobicContact CG2-CG 4.17Å; K103-I105 HydrophobicContact CD-CD1 4.05Å; K103-I105 HydrophobicContact CD-CG1 4.35Å; K103-I105 HydrophobicContact CG-CD1 4.22Å; K103-I105 HydrophobicContact CG-CG1 4Å; K103-E120 IonicContact NZ-OE1 3.26Å; K103-E120 PolarHBondContact NZ-OE1 3.04Å; K103-E120 IonicContact NZ-OE2 3.37Å; K103-E120 PolarHBondContact NZ-OE2 3.37Å; K103-Y151 WeakPolarHBondContact O-CA 3.08Å; K103-I152 HydrophobicContact CB-CB 4.48Å; K103-I152 PolarHBondContact N-O 3.18Å; K103-I152 PolarHBondContact O-N 3.32Å
104	K	96	Very high	93.7	Very high	14 Å²	14	54.6 Å²	54.6	6%	0.061	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	128.7	171.2	-178.8	178.7	-170.3	171.3	0	109.6	A67 F68 G86 M87 D149 Y151	A67-K104 PolarHBondContact O-NZ 2.8Å; F68-K104 HydrophobicContact CD1-CB 4.34Å; F68-K104 HydrophobicContact CD2-CD 4.4Å; F68-K104 HydrophobicContact CE1-CB 3.58Å; F68-K104 HydrophobicContact CE2-CB 4.35Å; F68-K104 HydrophobicContact CE2-CD 4.13Å; F68-K104 HydrophobicContact CZ-CB 3.57Å; F68-K104 HydrophobicContact CZ-CD 4.22Å; F68-K104 HydrophobicContact CZ-CG 4.48Å; G86-K104 CarbonylContact C-O 3.43Å; G86-K104 WeakPolarHBondContact CA-O 3.22Å; M87-K104 PolarHBondContact N-O 3.1Å; M87-K104 VanDerWaalsContact N-O 3.14Å; M87-K104 PolarHBondContact O-N 2.99Å; K104-D149 WeakPolarHBondContact CE-OD1 3.43Å; K104-D149 WeakPolarHBondContact CE-OD2 3.44Å; K104-D149 VanDerWaalsContact NZ-CG 3.27Å; K104-D149 IonicContact NZ-OD1 3.58Å; K104-D149 IonicContact NZ-OD2 3.51Å; K104-D149 PolarHBondContact NZ-OD2 3.17Å; K104-Y151 HydrophobicContact CB-CD1 3.73Å; K104-Y151 HydrophobicContact CB-CE1 3.83Å; K104-Y151 HydrophobicContact CD-CD1 4.38Å; K104-Y151 HydrophobicContact CD-CE1 3.59Å; K104-Y151 HydrophobicContact CG-CD1 3.84Å; K104-Y151 HydrophobicContact CG-CE1 3.53Å; K104-Y151 PolarHBondContact NZ-OH 3.35Å
105	I	94.3	Very high	93.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.5	177.4	-53.2	172.5	0	0	0	109.1	Y85 K103 P107 T117 D149 V150 I152	Y85-I105 HydrophobicContact CD2-CD1 4.39Å; Y85-I105 HydrophobicContact CD2-CG1 4.32Å; Y85-I105 HydrophobicContact CD2-CG2 3.94Å; Y85-I105 HydrophobicContact CE2-CD1 4.06Å; Y85-I105 HydrophobicContact CE2-CG1 4.41Å; K103-I105 HydrophobicContact CD-CD1 4.05Å; K103-I105 HydrophobicContact CD-CG1 4.35Å; K103-I105 HydrophobicContact CG-CD1 4.22Å; K103-I105 HydrophobicContact CG-CG1 4Å; I105-P107 HydrophobicContact CG2-CB 4.02Å; I105-P107 HydrophobicContact CG2-CG 4.07Å; I105-P107 WeakPolarHBondContact O-CD 3.32Å; I105-T117 HydrophobicContact CD1-CG2 4.1Å; I105-T117 HydrophobicContact CG2-CG2 4.22Å; I105-D149 WeakPolarHBondContact O-CA 3.39Å; I105-V150 PolarHBondContact N-O 2.99Å; I105-V150 PolarHBondContact O-N 2.85Å; I105-I152 HydrophobicContact CD1-CD1 3.68Å; I105-I152 HydrophobicContact CD1-CG1 4.26Å
106	S	93.8	Very high	93.4	Very high	62 Å²	62	51.8 Å²	51.8	43%	0.434	25%	0.25	S	C	.	.			trans	-124.1	71.2	179.7	-50	0	0	0	0	110.1	D149	S106-D149 WeakPolarHBondContact CB-OD1 3.5Å; S106-D149 PolarHBondContact OG-OD1 2.81Å
107	P	92.8	Very high	93.3	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	23%	0.229	C	C	.	.			trans	-91.1	-18.2	-159.7	34.7	-32.3	0	0	0	114.5	I105 E109 H110 C114 T117	I105-P107 HydrophobicContact CG2-CB 4.02Å; I105-P107 HydrophobicContact CG2-CG 4.07Å; I105-P107 WeakPolarHBondContact O-CD 3.32Å; P107-E109 PolarHBondContact O-N 2.86Å; P107-H110 PolarHBondContact O-N 3.03Å; P107-C114 PolarHBondContact O-SG 2.72Å; P107-C114 VanDerWaalsContact O-SG 3.36Å; P107-T117 WeakPolarHBondContact CB-OG1 3.44Å; P107-T117 HydrophobicContact CG-CG2 4.35Å
108	F	93.9	Very high	93.3	Very high	20 Å²	20	42 Å²	42	9%	0.088	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-3	-160	-51	-60.7	0	0	0	116	M147 R148 V150 K389 K393 I396	F108-M147 WeakPolarHBondContact CD2-O 3.44Å; F108-M147 HydrophobicContact CE1-CE 3.93Å; F108-M147 HydrophobicContact CE2-CE 4.17Å; F108-M147 HydrophobicContact CE2-CG 3.8Å; F108-M147 HydrophobicContact CE2-SD 4.4Å; F108-M147 HydrophobicContact CZ-CE 3.52Å; F108-M147 HydrophobicContact CZ-CG 3.99Å; F108-M147 HydrophobicContact CZ-SD 3.98Å; F108-R148 VanDerWaalsContact CD2-O 3.28Å; F108-R148 WeakPolarHBondContact CD2-O 3.39Å; F108-V150 HydrophobicContact CE2-CG2 4.14Å; F108-V150 HydrophobicContact CZ-CG2 3.72Å; F108-K389 WeakPolarHBondContact O-CD 2.94Å; F108-K389 PolarHBondContact O-NZ 3.34Å; F108-K393 HydrophobicContact CB-CD 4.31Å; F108-K393 HydrophobicContact CD1-CB 3.73Å; F108-K393 HydrophobicContact CD1-CD 3.89Å; F108-K393 HydrophobicContact CD1-CG 3.5Å; F108-K393 HydrophobicContact CE1-CB 4.02Å; F108-K393 HydrophobicContact CE1-CD 4.38Å; F108-K393 HydrophobicContact CE1-CG 3.63Å; F108-K393 HydrophobicContact CG-CD 3.97Å; F108-K393 HydrophobicContact CG-CG 4.1Å; F108-K393 HydrophobicContact CZ-CG 4.31Å; F108-I396 HydrophobicContact CE1-CB 4.45Å; F108-I396 HydrophobicContact CE1-CD1 3.89Å; F108-I396 HydrophobicContact CE1-CG2 4.28Å; F108-I396 HydrophobicContact CZ-CG2 4.22Å
109	E	90.4	Very high	93.2	Very high	138 Å²	138	36.5 Å²	36.5	65%	0.645	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-30	169.1	-64.8	-50.2	146.3	0	0	112.9	P107 K389	P107-E109 PolarHBondContact O-N 2.86Å; E109-K389 WeakPolarHBondContact O-CD 3.16Å; E109-K389 PolarHBondContact O-NZ 3.26Å; E109-K389 IonicContact OE2-NZ 3.49Å
110	H	90.2	Very high	93	Very high	106 Å²	106	31.1 Å²	31.1	49%	0.491	15%	0.152	S	C	.	.			trans	-128.2	124.8	-170.6	-57.3	-66.1	0	0	0	112.7	P107 T112 Y113 C114	P107-H110 PolarHBondContact O-N 3.03Å; H110-T112 VanDerWaalsContact C-N 3.29Å; H110-T112 PolarHBondContact O-N 3.49Å; H110-Y113 HydrophobicContact CB-CD2 3.89Å; H110-Y113 HydrophobicContact CB-CE2 4.35Å; H110-Y113 HydrophobicContact CB-CG 4.01Å; H110-Y113 AromaticContact CD2-CD2 3.66Å; H110-Y113 AromaticContact CD2-CE2 3.5Å; H110-Y113 VanDerWaalsContact CD2-CE2 3.5Å; H110-Y113 WeakPolarHBondContact CD2-CE2 3.41Å; H110-Y113 PolarHBondContact O-N 3.04Å; H110-C114 PolarHBondContact O-N 2.89Å; H110-C114 VanDerWaalsContact O-N 3.08Å; H110-C114 PolarHBondContact O-SG 2.97Å
111	Q	89.6	Confident	92.9	Very high	76 Å²	76	30.7 Å²	30.7	36%	0.355	15%	0.15	S	C	.	.	H	α-helix	trans	-48.6	-48	176.9	-172.3	-171.2	6.5	0	0	112.3	Y113 C114 Q115 L387 K389 L392	Q111-Y113 VanDerWaalsContact C-N 3.28Å; Q111-Y113 PolarHBondContact O-N 3.49Å; Q111-C114 WeakPolarHBondContact O-CB 3.09Å; Q111-C114 PolarHBondContact O-N 3.46Å; Q111-C114 VanDerWaalsContact O-N 3.14Å; Q111-Q115 WeakPolarHBondContact O-CG 3.48Å; Q111-Q115 PolarHBondContact O-N 2.86Å; Q111-L387 WeakPolarHBondContact CG-O 3.47Å; Q111-L387 PolarHBondContact NE2-O 3.12Å; Q111-K389 HydrophobicContact CB-CB 4.13Å; Q111-L392 HydrophobicContact CG-CD1 4.01Å
112	T	87.6	Confident	92.7	Very high	47 Å²	47	33 Å²	33	29%	0.288	16%	0.158	S	C	.	.	H	α-helix	trans	-63.2	-29.1	179.9	-45.2	0	0	0	0	113.4	H110 R116	H110-T112 VanDerWaalsContact C-N 3.29Å; H110-T112 PolarHBondContact O-N 3.49Å; T112-R116 VanDerWaalsContact O-CG 3.24Å; T112-R116 WeakPolarHBondContact O-CG 3.49Å; T112-R116 PolarHBondContact O-N 3.38Å; T112-R116 VanDerWaalsContact O-N 3.17Å
113	Y	89.9	Confident	92.6	Very high	77 Å²	77	33.2 Å²	33.2	30%	0.302	16%	0.159	S	C	.	.	H	α-helix	trans	-79.3	-36.3	175.4	-63.6	-8.7	0	0	0	111	H110 Q111 R116 T117	H110-Y113 HydrophobicContact CB-CD2 3.89Å; H110-Y113 HydrophobicContact CB-CE2 4.35Å; H110-Y113 HydrophobicContact CB-CG 4.01Å; H110-Y113 AromaticContact CD2-CD2 3.66Å; H110-Y113 AromaticContact CD2-CE2 3.5Å; H110-Y113 VanDerWaalsContact CD2-CE2 3.5Å; H110-Y113 WeakPolarHBondContact CD2-CE2 3.41Å; H110-Y113 PolarHBondContact O-N 3.04Å; Q111-Y113 VanDerWaalsContact C-N 3.28Å; Q111-Y113 PolarHBondContact O-N 3.49Å; Y113-R116 PolarHBondContact O-N 3.4Å; Y113-T117 WeakPolarHBondContact O-CB 3.35Å; Y113-T117 PolarHBondContact O-N 2.6Å; Y113-T117 PolarHBondContact O-OG1 2.75Å
114	C	92.8	Very high	92.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-46.7	170.6	-58.3	0	0	0	0	111.1	P107 H110 Q111 R116 T117 L118 L392 I396	P107-C114 PolarHBondContact O-SG 2.72Å; P107-C114 VanDerWaalsContact O-SG 3.36Å; H110-C114 PolarHBondContact O-N 2.89Å; H110-C114 VanDerWaalsContact O-N 3.08Å; H110-C114 PolarHBondContact O-SG 2.97Å; Q111-C114 WeakPolarHBondContact O-CB 3.09Å; Q111-C114 PolarHBondContact O-N 3.46Å; Q111-C114 VanDerWaalsContact O-N 3.14Å; C114-R116 VanDerWaalsContact C-N 3.34Å; C114-R116 PolarHBondContact O-N 3.19Å; C114-T117 PolarHBondContact O-N 2.82Å; C114-L118 WeakPolarHBondContact O-CB 3.32Å; C114-L118 PolarHBondContact O-N 2.98Å; C114-L392 HydrophobicContact CB-CB 3.63Å; C114-L392 HydrophobicContact CB-CD1 3.94Å; C114-L392 HydrophobicContact CB-CG 4.42Å; C114-I396 HydrophobicContact CB-CD1 4.39Å
115	Q	90.8	Very high	92.5	Very high	17 Å²	17	33.2 Å²	33.2	8%	0.079	16%	0.16	C	C	.	.	H	α-helix	trans	-57.4	-41.6	175.1	-72.3	170.9	-22.2	0	0	112.9	Q111 R119 L384 D385 L392	Q111-Q115 WeakPolarHBondContact O-CG 3.48Å; Q111-Q115 PolarHBondContact O-N 2.86Å; Q115-R119 WeakPolarHBondContact O-CB 3.43Å; Q115-R119 PolarHBondContact O-N 3.04Å; Q115-R119 PolarHBondContact O-NH1 2.98Å; Q115-R119 VanDerWaalsContact O-NH1 3.15Å; Q115-L384 HydrophobicContact CG-CB 4.29Å; Q115-L384 PolarHBondContact NE2-O 3.05Å; Q115-D385 VanDerWaalsContact NE2-C 3.28Å; Q115-D385 PolarHBondContact NE2-O 2.88Å; Q115-L392 HydrophobicContact CG-CD1 3.56Å; Q115-L392 HydrophobicContact CG-CD2 4.38Å
116	R	90.3	Very high	92.5	Very high	32 Å²	32	38 Å²	38	12%	0.121	18%	0.178	C	C	.	.	H	α-helix	trans	-68	-46.7	176.5	-72.7	171.9	-171.4	-156.4	5.3	111.7	T112 Y113 C114 R119 E120 G218	T112-R116 VanDerWaalsContact O-CG 3.24Å; T112-R116 WeakPolarHBondContact O-CG 3.49Å; T112-R116 PolarHBondContact O-N 3.38Å; T112-R116 VanDerWaalsContact O-N 3.17Å; Y113-R116 PolarHBondContact O-N 3.4Å; C114-R116 VanDerWaalsContact C-N 3.34Å; C114-R116 PolarHBondContact O-N 3.19Å; R116-R119 PolarHBondContact O-N 3.43Å; R116-E120 WeakPolarHBondContact O-CB 3.4Å; R116-E120 PolarHBondContact O-N 3.09Å; R116-G218 WeakPolarHBondContact CG-O 3.11Å
117	T	93.3	Very high	92.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-49.1	-177.3	-52.1	0	0	0	0	111.2	I105 P107 Y113 C114 R119 E120 I121 I396	I105-T117 HydrophobicContact CD1-CG2 4.1Å; I105-T117 HydrophobicContact CG2-CG2 4.22Å; P107-T117 WeakPolarHBondContact CB-OG1 3.44Å; P107-T117 HydrophobicContact CG-CG2 4.35Å; Y113-T117 WeakPolarHBondContact O-CB 3.35Å; Y113-T117 PolarHBondContact O-N 2.6Å; Y113-T117 PolarHBondContact O-OG1 2.75Å; C114-T117 PolarHBondContact O-N 2.82Å; T117-R119 VanDerWaalsContact C-N 3.33Å; T117-R119 PolarHBondContact O-N 3.11Å; T117-E120 PolarHBondContact O-N 3.38Å; T117-I121 HydrophobicContact CG2-CD1 3.93Å; T117-I121 WeakPolarHBondContact O-CB 3.18Å; T117-I121 VanDerWaalsContact O-CG1 3.29Å; T117-I121 WeakPolarHBondContact O-CG1 3.31Å; T117-I121 PolarHBondContact O-N 3.36Å; T117-I396 HydrophobicContact CG2-CD1 4.24Å
118	L	93.8	Very high	92.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-41.7	177.7	-176.6	55.4	0	0	0	111.4	C114 I121 K122 L384 L392 M395 I396 E399	C114-L118 WeakPolarHBondContact O-CB 3.32Å; C114-L118 PolarHBondContact O-N 2.98Å; L118-I121 PolarHBondContact O-N 2.81Å; L118-K122 HydrophobicContact CD1-CD 3.95Å; L118-K122 HydrophobicContact CD1-CG 3.96Å; L118-K122 HydrophobicContact CG-CD 4.21Å; L118-K122 HydrophobicContact CG-CG 4.42Å; L118-K122 WeakPolarHBondContact O-CB 3.36Å; L118-K122 VanDerWaalsContact O-CG 3.31Å; L118-K122 WeakPolarHBondContact O-CG 3.49Å; L118-K122 PolarHBondContact O-N 2.94Å; L118-L384 HydrophobicContact CB-CD1 3.95Å; L118-L384 HydrophobicContact CD2-CD1 3.82Å; L118-L384 HydrophobicContact CD2-CD2 3.72Å; L118-L384 HydrophobicContact CD2-CG 4.42Å; L118-L384 HydrophobicContact CG-CD1 3.85Å; L118-L384 HydrophobicContact CG-CD2 4.45Å; L118-L392 HydrophobicContact CD2-CD2 3.77Å; L118-M395 HydrophobicContact CD1-CB 4.16Å; L118-M395 HydrophobicContact CD2-CB 3.54Å; L118-M395 HydrophobicContact CD2-CE 4.09Å; L118-M395 HydrophobicContact CD2-CG 4.38Å; L118-M395 HydrophobicContact CD2-SD 3.98Å; L118-I396 HydrophobicContact CB-CD1 4.1Å; L118-I396 HydrophobicContact CB-CG1 3.71Å; L118-I396 HydrophobicContact CD1-CG1 3.86Å; L118-I396 HydrophobicContact CG-CG1 4.24Å; L118-E399 HydrophobicContact CD1-CB 4.38Å
119	R	92.1	Very high	93.1	Very high	18 Å²	18	46.5 Å²	46.5	7%	0.068	20%	0.201	C	C	.	.	H	α-helix	trans	-64.6	-45.5	177.4	-174.3	177.4	-59.2	99.3	4.9	112.7	Q115 R116 T117 I121 K122 I123 G218 A220 L384 D385	Q115-R119 WeakPolarHBondContact O-CB 3.43Å; Q115-R119 PolarHBondContact O-N 3.04Å; Q115-R119 PolarHBondContact O-NH1 2.98Å; Q115-R119 VanDerWaalsContact O-NH1 3.15Å; R116-R119 PolarHBondContact O-N 3.43Å; T117-R119 VanDerWaalsContact C-N 3.33Å; T117-R119 PolarHBondContact O-N 3.11Å; R119-I121 VanDerWaalsContact C-N 3.34Å; R119-I121 PolarHBondContact O-N 3.38Å; R119-K122 PolarHBondContact O-N 3.12Å; R119-I123 HydrophobicContact CG-CD1 3.69Å; R119-I123 HydrophobicContact CG-CG1 4.4Å; R119-I123 WeakPolarHBondContact O-CB 3.33Å; R119-I123 VanDerWaalsContact O-CG1 3.3Å; R119-I123 WeakPolarHBondContact O-CG1 3.38Å; R119-I123 PolarHBondContact O-N 2.87Å; R119-G218 PolarHBondContact NH1-O 3.14Å; R119-G218 VanDerWaalsContact NH1-O 3.08Å; R119-A220 WeakPolarHBondContact CD-O 3.3Å; R119-A220 PolarHBondContact NE-O 2.95Å; R119-L384 HydrophobicContact CB-CD1 4.28Å; R119-D385 IonicContact NH2-OD1 2.66Å; R119-D385 PolarHBondContact NH2-OD1 2.99Å
120	E	93.9	Very high	93.5	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.009	20%	0.198	C	C	.	.	H	α-helix	trans	-59.5	-45.9	176.2	-176.7	176.9	-136.2	0	0	111	K103 R116 T117 L124 D216 F217	K103-E120 IonicContact NZ-OE1 3.26Å; K103-E120 PolarHBondContact NZ-OE1 3.04Å; K103-E120 IonicContact NZ-OE2 3.37Å; K103-E120 PolarHBondContact NZ-OE2 3.37Å; R116-E120 WeakPolarHBondContact O-CB 3.4Å; R116-E120 PolarHBondContact O-N 3.09Å; T117-E120 PolarHBondContact O-N 3.38Å; E120-L124 HydrophobicContact CG-CD1 3.87Å; E120-L124 HydrophobicContact CG-CG 4.38Å; E120-L124 WeakPolarHBondContact O-CB 3.4Å; E120-L124 WeakPolarHBondContact O-CG 3.38Å; E120-L124 PolarHBondContact O-N 3.4Å; E120-D216 WeakPolarHBondContact OE1-CA 3.26Å; E120-F217 HydrophobicContact CG-CB 4.43Å
121	I	95	Very high	93.9	Very high	0 Å²	0	41 Å²	41	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.8	-52.9	176.3	-68.3	170.8	0	0	0	111	T117 L118 R119 I123 L124 L125 I135 I138 I152 I396 E399 T400	T117-I121 HydrophobicContact CG2-CD1 3.93Å; T117-I121 WeakPolarHBondContact O-CB 3.18Å; T117-I121 VanDerWaalsContact O-CG1 3.29Å; T117-I121 WeakPolarHBondContact O-CG1 3.31Å; T117-I121 PolarHBondContact O-N 3.36Å; L118-I121 PolarHBondContact O-N 2.81Å; R119-I121 VanDerWaalsContact C-N 3.34Å; R119-I121 PolarHBondContact O-N 3.38Å; I121-I123 VanDerWaalsContact C-N 3.3Å; I121-I123 PolarHBondContact O-N 2.99Å; I121-L124 PolarHBondContact O-N 2.94Å; I121-L125 HydrophobicContact CG2-CD1 3.46Å; I121-L125 VanDerWaalsContact CG2-CD1 3.46Å; I121-L125 HydrophobicContact CG2-CG 4.1Å; I121-L125 VanDerWaalsContact O-CB 3.3Å; I121-L125 WeakPolarHBondContact O-CB 3.42Å; I121-L125 VanDerWaalsContact O-CG 3.23Å; I121-L125 WeakPolarHBondContact O-CG 3.44Å; I121-L125 PolarHBondContact O-N 3.21Å; I121-I135 HydrophobicContact CG1-CD1 4.47Å; I121-I138 HydrophobicContact CG1-CD1 4.39Å; I121-I138 HydrophobicContact CG2-CD1 4.03Å; I121-I152 HydrophobicContact CD1-CD1 4.19Å; I121-I152 HydrophobicContact CG1-CD1 3.77Å; I121-I396 HydrophobicContact CD1-CG2 4.45Å; I121-E399 HydrophobicContact CG2-CB 4.48Å; I121-E399 HydrophobicContact CG2-CG 3.74Å; I121-T400 HydrophobicContact CD1-CG2 4.16Å
122	K	93.8	Very high	94.3	Very high	60 Å²	60	37.6 Å²	37.6	26%	0.261	16%	0.16	S	C	.	.	H	α-helix	trans	-64.1	-31.6	-176.9	-69.8	-164.1	72.1	154	0	113.8	L118 R119 T382 E399	L118-K122 HydrophobicContact CD1-CD 3.95Å; L118-K122 HydrophobicContact CD1-CG 3.96Å; L118-K122 HydrophobicContact CG-CD 4.21Å; L118-K122 HydrophobicContact CG-CG 4.42Å; L118-K122 WeakPolarHBondContact O-CB 3.36Å; L118-K122 VanDerWaalsContact O-CG 3.31Å; L118-K122 WeakPolarHBondContact O-CG 3.49Å; L118-K122 PolarHBondContact O-N 2.94Å; R119-K122 PolarHBondContact O-N 3.12Å; K122-T382 HydrophobicContact CD-CG2 4.47Å; K122-E399 WeakPolarHBondContact CD-OE2 3.09Å; K122-E399 WeakPolarHBondContact CE-OE2 3.02Å; K122-E399 HydrophobicContact CG-CG 3.88Å; K122-E399 VanDerWaalsContact CG-OE2 3.31Å; K122-E399 WeakPolarHBondContact CG-OE2 3.32Å; K122-E399 IonicContact NZ-OE2 3.68Å; K122-E399 PolarHBondContact NZ-OE2 3.4Å
123	I	94.4	Very high	94.8	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-74.4	-53	175.2	-68.2	173.8	0	0	0	110.3	R119 I121 L125 R126 F127 V194 F217 A220 F378	R119-I123 HydrophobicContact CG-CD1 3.69Å; R119-I123 HydrophobicContact CG-CG1 4.4Å; R119-I123 WeakPolarHBondContact O-CB 3.33Å; R119-I123 VanDerWaalsContact O-CG1 3.3Å; R119-I123 WeakPolarHBondContact O-CG1 3.38Å; R119-I123 PolarHBondContact O-N 2.87Å; I121-I123 VanDerWaalsContact C-N 3.3Å; I121-I123 PolarHBondContact O-N 2.99Å; I123-L125 VanDerWaalsContact C-N 3.32Å; I123-L125 PolarHBondContact O-N 2.89Å; I123-R126 PolarHBondContact O-N 3.29Å; I123-R126 VanDerWaalsContact O-N 3.11Å; I123-F127 HydrophobicContact CG2-CD1 4.45Å; I123-F127 HydrophobicContact CG2-CD2 3.4Å; I123-F127 HydrophobicContact CG2-CE1 4.39Å; I123-F127 HydrophobicContact CG2-CE2 3.28Å; I123-F127 HydrophobicContact CG2-CG 4.03Å; I123-F127 HydrophobicContact CG2-CZ 3.85Å; I123-F127 PolarHBondContact O-N 3.4Å; I123-V194 HydrophobicContact CD1-CG1 4.15Å; I123-F217 HydrophobicContact CD1-CB 4.43Å; I123-F217 HydrophobicContact CG2-CB 4.36Å; I123-F217 HydrophobicContact CG2-CD1 3.82Å; I123-F217 HydrophobicContact CG2-CE1 4.36Å; I123-F217 HydrophobicContact CG2-CG 4.12Å; I123-A220 HydrophobicContact CD1-CB 3.72Å; I123-F378 HydrophobicContact CB-CZ 4.47Å; I123-F378 HydrophobicContact CG1-CE1 4.1Å; I123-F378 HydrophobicContact CG1-CZ 4.23Å
124	L	95.9	Very high	95.1	Very high	5 Å²	5	33 Å²	33	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-72.7	-18.7	-174.5	-64.3	-173.8	0	0	0	114.6	E120 I121 R126 I132 I133 I135 F217	E120-L124 HydrophobicContact CG-CD1 3.87Å; E120-L124 HydrophobicContact CG-CG 4.38Å; E120-L124 WeakPolarHBondContact O-CB 3.4Å; E120-L124 WeakPolarHBondContact O-CG 3.38Å; E120-L124 PolarHBondContact O-N 3.4Å; I121-L124 PolarHBondContact O-N 2.94Å; L124-R126 VanDerWaalsContact C-N 3.3Å; L124-I132 HydrophobicContact CD2-CG2 3.92Å; L124-I133 HydrophobicContact CD1-CG2 3.98Å; L124-I133 HydrophobicContact CD2-CG2 4.5Å; L124-I133 VanDerWaalsContact CD2-O 3.29Å; L124-I133 WeakPolarHBondContact CD2-O 3.14Å; L124-I135 HydrophobicContact CB-CD1 3.69Å; L124-I135 HydrophobicContact CB-CG1 3.79Å; L124-I135 HydrophobicContact CD1-CD1 4.3Å; L124-I135 HydrophobicContact CD1-CG1 4.17Å; L124-F217 HydrophobicContact CD1-CD2 4.42Å; L124-F217 HydrophobicContact CD2-CD2 3.47Å; L124-F217 VanDerWaalsContact CD2-CD2 3.47Å; L124-F217 HydrophobicContact CD2-CE2 3.63Å; L124-F217 HydrophobicContact CD2-CG 4.2Å; L124-F217 HydrophobicContact CD2-CZ 4.45Å; L124-F217 HydrophobicContact CG-CD2 4.12Å
125	L	94.6	Very high	95.3	Very high	33 Å²	33	34 Å²	34	17%	0.173	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.3	171.1	-68.6	-179.2	0	0	0	114.2	I121 I123 I135 I138 E399 F403	I121-L125 HydrophobicContact CG2-CD1 3.46Å; I121-L125 VanDerWaalsContact CG2-CD1 3.46Å; I121-L125 HydrophobicContact CG2-CG 4.1Å; I121-L125 VanDerWaalsContact O-CB 3.3Å; I121-L125 WeakPolarHBondContact O-CB 3.42Å; I121-L125 VanDerWaalsContact O-CG 3.23Å; I121-L125 WeakPolarHBondContact O-CG 3.44Å; I121-L125 PolarHBondContact O-N 3.21Å; I123-L125 VanDerWaalsContact C-N 3.32Å; I123-L125 PolarHBondContact O-N 2.89Å; L125-I135 HydrophobicContact CD2-CB 3.96Å; L125-I135 HydrophobicContact CD2-CD1 4.33Å; L125-I135 HydrophobicContact CD2-CG2 4Å; L125-I135 HydrophobicContact CG-CD1 4.34Å; L125-I138 HydrophobicContact CD1-CD1 4.25Å; L125-I138 HydrophobicContact CD2-CD1 4.47Å; L125-E399 HydrophobicContact CD1-CG 4.19Å; L125-F403 HydrophobicContact CD1-CE2 4.09Å; L125-F403 HydrophobicContact CD2-CE2 3.71Å; L125-F403 HydrophobicContact CD2-CZ 3.53Å
126	R	94.7	Very high	95.6	Very high	100 Å²	100	37.2 Å²	37.2	38%	0.377	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-27	175.1	-178.3	172.5	177.8	-150.1	10.3	112.5	I123 L124 T376 P377 F378	I123-R126 PolarHBondContact O-N 3.29Å; I123-R126 VanDerWaalsContact O-N 3.11Å; L124-R126 VanDerWaalsContact C-N 3.3Å; R126-T376 VanDerWaalsContact NH2-CB 3.29Å; R126-T376 PolarHBondContact NH2-O 3.47Å; R126-T376 VanDerWaalsContact NH2-O 3.07Å; R126-T376 PolarHBondContact NH2-OG1 2.9Å; R126-P377 PolarHBondContact NH1-O 3.44Å; R126-P377 PolarHBondContact NH2-O 3.39Å; R126-F378 HydrophobicContact CB-CZ 3.93Å; R126-F378 HydrophobicContact CG-CE2 4.29Å; R126-F378 HydrophobicContact CG-CZ 4.07Å; R126-F378 VanDerWaalsContact NH1-CG 3.26Å
127	F	96.4	Very high	95.9	Very high	14 Å²	14	36.5 Å²	36.5	6%	0.061	17%	0.166	C	C	.	.			trans	-74.7	126.7	173.8	-77.2	-4.8	0	0	0	112.3	I123 I132 Y188 I189 A192 V194 F217 F378	I123-F127 HydrophobicContact CG2-CD1 4.45Å; I123-F127 HydrophobicContact CG2-CD2 3.4Å; I123-F127 HydrophobicContact CG2-CE1 4.39Å; I123-F127 HydrophobicContact CG2-CE2 3.28Å; I123-F127 HydrophobicContact CG2-CG 4.03Å; I123-F127 HydrophobicContact CG2-CZ 3.85Å; I123-F127 PolarHBondContact O-N 3.4Å; F127-I132 HydrophobicContact CD2-CD1 3.86Å; F127-I132 HydrophobicContact CD2-CG2 4.27Å; F127-I132 HydrophobicContact CE2-CD1 4.33Å; F127-I132 HydrophobicContact CG-CD1 4.37Å; F127-Y188 HydrophobicContact CB-CE1 4.02Å; F127-Y188 HydrophobicContact CD1-CD1 4.25Å; F127-Y188 AromaticContact CD1-CE1 3.61Å; F127-Y188 HydrophobicContact CD1-CE1 3.61Å; F127-Y188 HydrophobicContact CE1-CD1 4.45Å; F127-Y188 HydrophobicContact CE1-CE1 4.15Å; F127-Y188 HydrophobicContact CG-CD1 4.39Å; F127-Y188 AromaticContact CG-CE1 3.88Å; F127-Y188 HydrophobicContact CG-CE1 3.88Å; F127-I189 HydrophobicContact CE2-CB 4.36Å; F127-I189 HydrophobicContact CE2-CG1 3.84Å; F127-I189 HydrophobicContact CE2-CG2 4.31Å; F127-I189 HydrophobicContact CZ-CB 4.41Å; F127-I189 HydrophobicContact CZ-CG1 4.34Å; F127-I189 HydrophobicContact CZ-CG2 4.34Å; F127-A192 HydrophobicContact CE1-CB 3.49Å; F127-A192 VanDerWaalsContact CE1-CB 3.49Å; F127-A192 HydrophobicContact CZ-CB 3.94Å; F127-V194 HydrophobicContact CE1-CG2 4.45Å; F127-V194 HydrophobicContact CZ-CB 4.07Å; F127-V194 HydrophobicContact CZ-CG1 4.4Å; F127-V194 HydrophobicContact CZ-CG2 3.9Å; F127-F217 HydrophobicContact CD2-CE1 4.22Å; F127-F217 HydrophobicContact CD2-CZ 4.33Å; F127-F217 HydrophobicContact CE2-CD1 4.32Å; F127-F217 AromaticContact CE2-CE1 3.75Å; F127-F217 HydrophobicContact CE2-CE1 3.75Å; F127-F217 HydrophobicContact CE2-CZ 4.25Å; F127-F378 HydrophobicContact CD1-CE2 4.04Å; F127-F378 HydrophobicContact CE1-CD2 4.34Å; F127-F378 AromaticContact CE1-CE2 3.55Å; F127-F378 HydrophobicContact CE1-CE2 3.55Å; F127-F378 HydrophobicContact CE1-CZ 4.32Å; F127-F378 HydrophobicContact CZ-CE2 4.29Å
128	R	96.9	Very high	96.1	Very high	228 Å²	228	36.5 Å²	36.5	86%	0.86	17%	0.166	S	C	*	.			trans	-132.2	90.9	172.3	-176.2	177.7	178.3	159	0.3	109.1	Y188	R128-Y188 PolarHBondContact N-OH 2.93Å; R128-Y188 VanDerWaalsContact N-OH 3.11Å; R128-Y188 PolarHBondContact O-OH 3.13Å
129	H	98.4	Very high	96.2	Very high	20 Å²	20	38.1 Å²	38.1	9%	0.093	17%	0.174	C	C	.	.			trans	-145.3	143.7	-178.2	-172.8	-95	0	0	0	110.4	N131 I132 Y188	H129-N131 VanDerWaalsContact C-N 3.35Å; H129-N131 PolarHBondContact CE1-OD1 3.26Å; H129-N131 PolarHBondContact ND1-N 2.77Å; H129-N131 PolarHBondContact O-N 3.42Å; H129-I132 HydrophobicContact CB-CB 4.23Å; H129-I132 HydrophobicContact CB-CD1 3.77Å; H129-I132 HydrophobicContact CB-CG1 3.92Å; H129-I132 PolarHBondContact O-N 2.6Å; H129-Y188 HydrophobicContact CB-CD1 3.8Å; H129-Y188 HydrophobicContact CB-CD2 4Å; H129-Y188 HydrophobicContact CB-CE1 4.07Å; H129-Y188 HydrophobicContact CB-CE2 4.27Å; H129-Y188 HydrophobicContact CB-CG 3.75Å; H129-Y188 AromaticContact CD2-CD2 3.62Å; H129-Y188 AromaticContact CD2-CG 3.73Å; H129-Y188 AromaticContact CG-CG 3.8Å
130	E	98.3	Very high	96.4	Very high	121 Å²	121	38.1 Å²	38.1	57%	0.565	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-37.2	-173.8	-61.5	179.2	130.3	0	0	112.4	I132 R184 K213	E130-I132 VanDerWaalsContact C-N 3.26Å; E130-I132 PolarHBondContact O-N 3.42Å; E130-R184 IonicContact OE2-CZ 2.65Å; E130-R184 VanDerWaalsContact OE2-CZ 3.27Å; E130-R184 IonicContact OE2-NH1 2.86Å; E130-R184 PolarHBondContact OE2-NH1 3.02Å; E130-R184 IonicContact OE2-NH2 3.96Å; E130-R184 PolarHBondContact OE2-NH2 3.43Å; E130-K213 PolarHBondContact O-NZ 3.47Å
131	N	98.8	Very high	96.4	Very high	7 Å²	7	39.2 Å²	39.2	4%	0.037	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	18.6	178.5	-52.3	107.2	0	0	0	114.3	H129 Q181 R184 L212 K213 I214	H129-N131 VanDerWaalsContact C-N 3.35Å; H129-N131 PolarHBondContact CE1-OD1 3.26Å; H129-N131 PolarHBondContact ND1-N 2.77Å; H129-N131 PolarHBondContact O-N 3.42Å; N131-Q181 VanDerWaalsContact CB-O 3.31Å; N131-Q181 WeakPolarHBondContact CB-O 3.26Å; N131-Q181 WeakPolarHBondContact ND2-CB 3.48Å; N131-Q181 PolarHBondContact ND2-OE1 2.93Å; N131-R184 PolarHBondContact OD1-NH1 3.48Å; N131-L212 VanDerWaalsContact CA-O 3.25Å; N131-L212 WeakPolarHBondContact CA-O 3.3Å; N131-L212 WeakPolarHBondContact CB-O 3.29Å; N131-L212 PolarHBondContact ND2-O 3.08Å; N131-K213 WeakPolarHBondContact O-CA 3.49Å; N131-I214 WeakPolarHBondContact O-CG1 3.29Å; N131-I214 PolarHBondContact O-N 3.11Å
132	I	98.6	Very high	96.2	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.026	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-122.2	146.2	173	-57.4	179.5	0	0	0	108.4	L124 F127 H129 E130 Y188 I189 F217	L124-I132 HydrophobicContact CD2-CG2 3.92Å; F127-I132 HydrophobicContact CD2-CD1 3.86Å; F127-I132 HydrophobicContact CD2-CG2 4.27Å; F127-I132 HydrophobicContact CE2-CD1 4.33Å; F127-I132 HydrophobicContact CG-CD1 4.37Å; H129-I132 HydrophobicContact CB-CB 4.23Å; H129-I132 HydrophobicContact CB-CD1 3.77Å; H129-I132 HydrophobicContact CB-CG1 3.92Å; H129-I132 PolarHBondContact O-N 2.6Å; E130-I132 VanDerWaalsContact C-N 3.26Å; E130-I132 PolarHBondContact O-N 3.42Å; I132-Y188 HydrophobicContact CD1-CD1 3.62Å; I132-Y188 HydrophobicContact CD1-CE1 4.33Å; I132-Y188 HydrophobicContact CD1-CG 4.37Å; I132-I189 HydrophobicContact CD1-CD1 4.16Å; I132-I189 HydrophobicContact CD1-CG1 3.62Å; I132-I189 HydrophobicContact CG1-CD1 4.49Å; I132-I189 HydrophobicContact CG1-CG1 4.46Å; I132-F217 HydrophobicContact CG2-CE2 3.84Å; I132-F217 HydrophobicContact CG2-CZ 3.89Å
133	I	97.8	Very high	96.3	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.015	22%	0.217	C	C	.	.			trans	-74.8	128.6	173.7	-163.2	64	0	0	0	110.7	L124 Q154 M157 L205 K213 I214 C215	L124-I133 HydrophobicContact CD1-CG2 3.98Å; L124-I133 HydrophobicContact CD2-CG2 4.5Å; L124-I133 VanDerWaalsContact CD2-O 3.29Å; L124-I133 WeakPolarHBondContact CD2-O 3.14Å; I133-Q154 HydrophobicContact CD1-CB 4.27Å; I133-Q154 HydrophobicContact CG1-CB 4.02Å; I133-Q154 HydrophobicContact CG1-CG 4.49Å; I133-M157 HydrophobicContact CD1-CG 4.43Å; I133-L205 HydrophobicContact CD1-CD1 4.33Å; I133-L205 HydrophobicContact CG1-CD1 4.48Å; I133-K213 HydrophobicContact CB-CB 4.47Å; I133-K213 HydrophobicContact CD1-CD 3.83Å; I133-I214 WeakPolarHBondContact CG2-O 3.18Å; I133-I214 PolarHBondContact N-O 3.21Å; I133-C215 HydrophobicContact CB-CB 4.18Å; I133-C215 HydrophobicContact CG2-CB 3.55Å
134	G	96.8	Very high	96.3	Very high	24 Å²	24	46.4 Å²	46.4	25%	0.247	23%	0.227	C	C	.	.			trans	-81.7	175.4	174.9	0	0	0	0	0	113.3	Q154	G134-Q154 WeakPolarHBondContact O-CG 3.12Å; G134-Q154 PolarHBondContact O-NE2 2.82Å
135	I	97.3	Very high	96.2	Very high	22 Å²	22	52.9 Å²	52.9	11%	0.113	26%	0.257	C	S	.	.			trans	-114	124.1	159.5	-65.4	178.2	0	0	0	107.5	I121 L124 L125 I138 I152 F403	I121-I135 HydrophobicContact CG1-CD1 4.47Å; L124-I135 HydrophobicContact CB-CD1 3.69Å; L124-I135 HydrophobicContact CB-CG1 3.79Å; L124-I135 HydrophobicContact CD1-CD1 4.3Å; L124-I135 HydrophobicContact CD1-CG1 4.17Å; L125-I135 HydrophobicContact CD2-CB 3.96Å; L125-I135 HydrophobicContact CD2-CD1 4.33Å; L125-I135 HydrophobicContact CD2-CG2 4Å; L125-I135 HydrophobicContact CG-CD1 4.34Å; I135-I138 HydrophobicContact CD1-CD1 4.41Å; I135-I138 HydrophobicContact CG2-CD1 3.92Å; I135-I138 HydrophobicContact CG2-CG1 3.52Å; I135-I152 HydrophobicContact CB-CG2 4.34Å; I135-I152 HydrophobicContact CD1-CG2 3.75Å; I135-I152 HydrophobicContact CG1-CG2 3.61Å; I135-I152 HydrophobicContact CG2-CG2 3.95Å; I135-F403 HydrophobicContact CG2-CZ 4.33Å
136	N	96.3	Very high	96.1	Very high	83 Å²	83	56 Å²	56	44%	0.444	27%	0.274	S	S	.	.			trans	-97.7	-33.1	-175.8	-60.3	1.3	0	0	0	111.7	V153 T155	N136-V153 PolarHBondContact N-O 2.93Å; N136-T155 PolarHBondContact ND2-N 3.08Å
137	D	97.1	Very high	96.1	Very high	18 Å²	18	51.2 Å²	51.2	10%	0.096	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	159.1	177.1	-161.2	-2.4	0	0	0	109.6	R73 Y74 V153 F403	R73-D137 IonicContact CZ-OD2 2.82Å; R73-D137 IonicContact NH1-OD2 3.69Å; R73-D137 PolarHBondContact NH1-OD2 3.04Å; Y74-D137 WeakPolarHBondContact OH-CB 3.4Å; Y74-D137 PolarHBondContact OH-OD2 3.31Å; D137-V153 HydrophobicContact CB-CB 3.89Å; D137-V153 HydrophobicContact CB-CG2 3.95Å; D137-V153 WeakPolarHBondContact O-CB 3.44Å; D137-V153 PolarHBondContact O-N 3.16Å; D137-F403 WeakPolarHBondContact OD1-CD1 3.44Å
138	I	97.4	Very high	96	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	115.8	171.2	-50.5	177.3	0	0	0	110.6	I121 L125 I135 V150 Y151 T400 F403 Q404	I121-I138 HydrophobicContact CG1-CD1 4.39Å; I121-I138 HydrophobicContact CG2-CD1 4.03Å; L125-I138 HydrophobicContact CD1-CD1 4.25Å; L125-I138 HydrophobicContact CD2-CD1 4.47Å; I135-I138 HydrophobicContact CD1-CD1 4.41Å; I135-I138 HydrophobicContact CG2-CD1 3.92Å; I135-I138 HydrophobicContact CG2-CG1 3.52Å; I138-V150 HydrophobicContact CG2-CG1 3.49Å; I138-V150 VanDerWaalsContact CG2-CG1 3.49Å; I138-Y151 WeakPolarHBondContact CA-O 3.34Å; I138-T400 HydrophobicContact CB-CG2 4.27Å; I138-T400 HydrophobicContact CD1-CG2 3.83Å; I138-T400 HydrophobicContact CG2-CG2 3.69Å; I138-F403 HydrophobicContact CB-CD2 3.83Å; I138-F403 HydrophobicContact CB-CE2 4.29Å; I138-F403 HydrophobicContact CB-CG 4.14Å; I138-F403 HydrophobicContact CD1-CD2 3.91Å; I138-F403 HydrophobicContact CD1-CE2 3.59Å; I138-F403 HydrophobicContact CD1-CZ 4.36Å; I138-F403 HydrophobicContact CG1-CD2 3.81Å; I138-F403 HydrophobicContact CG1-CE2 3.73Å; I138-F403 HydrophobicContact CG1-CG 4.37Å; I138-F403 HydrophobicContact CG1-CZ 4.22Å; I138-Q404 PolarHBondContact O-NE2 2.96Å
139	I	96.7	Very high	95.9	Very high	33 Å²	33	50.9 Å²	50.9	17%	0.169	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	137.7	-180	-36	163.9	0	0	0	109	V70 Y74 Y151 V153	V70-I139 HydrophobicContact CB-CD1 3.61Å; V70-I139 HydrophobicContact CG1-CD1 3.77Å; Y74-I139 HydrophobicContact CD2-CD1 3.49Å; Y74-I139 VanDerWaalsContact CD2-CD1 3.49Å; Y74-I139 HydrophobicContact CD2-CG1 4.48Å; Y74-I139 HydrophobicContact CE2-CD1 3.7Å; Y74-I139 HydrophobicContact CE2-CG1 4.25Å; I139-Y151 HydrophobicContact CB-CD2 4.27Å; I139-Y151 PolarHBondContact N-O 2.62Å; I139-Y151 PolarHBondContact O-N 2.81Å; I139-V153 HydrophobicContact CD1-CG2 4.15Å; I139-V153 HydrophobicContact CG1-CG2 4.28Å
140	R	95.4	Very high	95.8	Very high	18 Å²	18	49.9 Å²	49.9	7%	0.068	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	171.8	174.9	57.3	158.8	174.6	86.8	-17.3	110	P142 M147 Y397 T400	R140-P142 PolarHBondContact NH1-O 3.09Å; R140-P142 VanDerWaalsContact NH1-O 3.12Å; R140-M147 HydrophobicContact CB-CG 4.22Å; R140-M147 HydrophobicContact CB-SD 4.07Å; R140-M147 WeakPolarHBondContact CD-SD 3.24Å; R140-M147 HydrophobicContact CG-SD 4.4Å; R140-Y397 PolarHBondContact NH2-O 2.76Å; R140-T400 WeakPolarHBondContact CD-OG1 3.43Å; R140-T400 PolarHBondContact NE-OG1 2.99Å
141	A	94.2	Very high	95.7	Very high	25 Å²	25	44.6 Å²	44.6	21%	0.207	23%	0.227	C	C	.	.			trans	-60.7	146.9	166.4	0	0	0	0	0	110.8	Q143 N146 M147	A141-Q143 PolarHBondContact O-N 2.95Å; A141-N146 VanDerWaalsContact CB-C 3.46Å; A141-N146 HydrophobicContact CB-CB 3.78Å; A141-N146 WeakPolarHBondContact CB-O 3.21Å; A141-M147 HydrophobicContact CB-CB 4.34Å
142	P	91.6	Very high	95.7	Very high	85 Å²	85	44.3 Å²	44.3	55%	0.552	23%	0.226	S	C	*	.	S	Bend	trans	-67.9	-34	-176.5	20.4	-28.2	0	0	0	113.3	R140 Y397	R140-P142 PolarHBondContact NH1-O 3.09Å; R140-P142 VanDerWaalsContact NH1-O 3.12Å; P142-Y397 WeakPolarHBondContact O-CE2 3.44Å; P142-Y397 PolarHBondContact O-OH 3.01Å
143	Q	94.1	Very high	95.6	Very high	88 Å²	88	44 Å²	44	41%	0.411	22%	0.224	S	C	.	.	S	Bend	trans	-103.8	151.2	175.8	-48.7	82.9	11.9	0	0	113	A141 E145 N146 M147	A141-Q143 PolarHBondContact O-N 2.95Å; Q143-E145 WeakPolarHBondContact CB-OE2 3.25Å; Q143-E145 PolarHBondContact O-N 3.23Å; Q143-N146 PolarHBondContact O-N 2.83Å; Q143-N146 PolarHBondContact OE1-ND2 2.75Å; Q143-M147 PolarHBondContact O-N 3.36Å; Q143-M147 VanDerWaalsContact O-N 3.13Å
144	L	94.3	Very high	95.6	Very high	42 Å²	42	44.9 Å²	44.9	22%	0.22	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-40.7	-175.8	176.7	64.9	0	0	0	112.7	N146 M147 K393 E394 Y397	L144-N146 VanDerWaalsContact C-N 3.33Å; L144-N146 PolarHBondContact O-N 3.42Å; L144-M147 HydrophobicContact CD1-CE 4.16Å; L144-M147 PolarHBondContact O-N 3.48Å; L144-K393 HydrophobicContact CD1-CD 4.27Å; L144-K393 HydrophobicContact CD1-CG 3.91Å; L144-K393 WeakPolarHBondContact O-CE 3.45Å; L144-K393 PolarHBondContact O-NZ 2.83Å; L144-E394 HydrophobicContact CD2-CG 3.92Å; L144-Y397 HydrophobicContact CB-CD2 4Å; L144-Y397 HydrophobicContact CB-CE2 4.06Å; L144-Y397 HydrophobicContact CB-CG 4.32Å; L144-Y397 HydrophobicContact CD1-CD2 4.11Å; L144-Y397 HydrophobicContact CD1-CG 3.92Å; L144-Y397 VanDerWaalsContact N-CE2 3.33Å
145	E	93.9	Very high	95.6	Very high	142 Å²	142	46.4 Å²	46.4	66%	0.664	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-41.2	-178.6	-54.6	71.6	-156.5	0	0	110.5	Q143 M147	Q143-E145 WeakPolarHBondContact CB-OE2 3.25Å; Q143-E145 PolarHBondContact O-N 3.23Å; E145-M147 VanDerWaalsContact C-N 3.35Å
146	N	93.6	Very high	95.6	Very high	97 Å²	97	47.4 Å²	47.4	52%	0.519	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-16.7	-179.6	-68.1	-34.1	0	0	0	113.1	A141 Q143 L144 R148	A141-N146 VanDerWaalsContact CB-C 3.46Å; A141-N146 HydrophobicContact CB-CB 3.78Å; A141-N146 WeakPolarHBondContact CB-O 3.21Å; Q143-N146 PolarHBondContact O-N 2.83Å; Q143-N146 PolarHBondContact OE1-ND2 2.75Å; L144-N146 VanDerWaalsContact C-N 3.33Å; L144-N146 PolarHBondContact O-N 3.42Å; N146-R148 PolarHBondContact O-N 2.79Å
147	M	94.9	Very high	95.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.221	C	C	.	.			trans	-69.4	97	179	-173.2	176.4	66	0	0	111	F108 R140 A141 Q143 L144 E145 V150 K393 I396 Y397	F108-M147 WeakPolarHBondContact CD2-O 3.44Å; F108-M147 HydrophobicContact CE1-CE 3.93Å; F108-M147 HydrophobicContact CE2-CE 4.17Å; F108-M147 HydrophobicContact CE2-CG 3.8Å; F108-M147 HydrophobicContact CE2-SD 4.4Å; F108-M147 HydrophobicContact CZ-CE 3.52Å; F108-M147 HydrophobicContact CZ-CG 3.99Å; F108-M147 HydrophobicContact CZ-SD 3.98Å; R140-M147 HydrophobicContact CB-CG 4.22Å; R140-M147 HydrophobicContact CB-SD 4.07Å; R140-M147 WeakPolarHBondContact CD-SD 3.24Å; R140-M147 HydrophobicContact CG-SD 4.4Å; A141-M147 HydrophobicContact CB-CB 4.34Å; Q143-M147 PolarHBondContact O-N 3.36Å; Q143-M147 VanDerWaalsContact O-N 3.13Å; L144-M147 HydrophobicContact CD1-CE 4.16Å; L144-M147 PolarHBondContact O-N 3.48Å; E145-M147 VanDerWaalsContact C-N 3.35Å; M147-V150 HydrophobicContact CG-CG2 4.45Å; M147-V150 HydrophobicContact SD-CG2 4.11Å; M147-K393 HydrophobicContact CE-CD 4.43Å; M147-K393 HydrophobicContact CE-CG 3.6Å; M147-K393 WeakPolarHBondContact CE-O 3.37Å; M147-K393 WeakPolarHBondContact O-CE 3.28Å; M147-K393 PolarHBondContact O-NZ 3.16Å; M147-I396 HydrophobicContact CE-CG2 4.28Å; M147-I396 HydrophobicContact SD-CG2 4.48Å; M147-Y397 HydrophobicContact CE-CD2 4.37Å; M147-Y397 HydrophobicContact SD-CD2 4.33Å
148	R	93.4	Very high	95.4	Very high	196 Å²	196	48.1 Å²	48.1	74%	0.74	24%	0.238	S	C	*	.			trans	-100.4	-33.4	172	-62.6	-179.9	-176.8	-174.5	0.4	112.5	F108 N146	F108-R148 VanDerWaalsContact CD2-O 3.28Å; F108-R148 WeakPolarHBondContact CD2-O 3.39Å; N146-R148 PolarHBondContact O-N 2.79Å
149	D	95.1	Very high	95.3	Very high	39 Å²	39	49.9 Å²	49.9	21%	0.209	25%	0.25	C	C	.	.			trans	-125.2	151.5	-175.6	-62.1	-47.8	0	0	0	110.2	K104 I105 S106 Y151	K104-D149 WeakPolarHBondContact CE-OD1 3.43Å; K104-D149 WeakPolarHBondContact CE-OD2 3.44Å; K104-D149 VanDerWaalsContact NZ-CG 3.27Å; K104-D149 IonicContact NZ-OD1 3.58Å; K104-D149 IonicContact NZ-OD2 3.51Å; K104-D149 PolarHBondContact NZ-OD2 3.17Å; I105-D149 WeakPolarHBondContact O-CA 3.39Å; S106-D149 WeakPolarHBondContact CB-OD1 3.5Å; S106-D149 PolarHBondContact OG-OD1 2.81Å; D149-Y151 HydrophobicContact CB-CE2 3.89Å
150	V	96.3	Very high	95.3	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	132.2	168.4	-178.6	0	0	0	0	107.7	I105 F108 I138 M147 I152 I396	I105-V150 PolarHBondContact N-O 2.99Å; I105-V150 PolarHBondContact O-N 2.85Å; F108-V150 HydrophobicContact CE2-CG2 4.14Å; F108-V150 HydrophobicContact CZ-CG2 3.72Å; I138-V150 HydrophobicContact CG2-CG1 3.49Å; I138-V150 VanDerWaalsContact CG2-CG1 3.49Å; M147-V150 HydrophobicContact CG-CG2 4.45Å; M147-V150 HydrophobicContact SD-CG2 4.11Å; V150-I152 HydrophobicContact CG1-CG1 4.29Å; V150-I396 HydrophobicContact CG2-CG2 4.06Å
151	Y	97.1	Very high	95.4	Very high	9 Å²	9	48.1 Å²	48.1	4%	0.035	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	108.9	178.1	-53	-97.5	0	0	0	108.9	A67 F68 D69 V70 I102 K103 K104 I138 I139 D149	A67-Y151 PolarHBondContact O-OH 3.19Å; F68-Y151 HydrophobicContact CB-CE1 4.37Å; F68-Y151 AromaticContact CD1-CD1 4Å; F68-Y151 HydrophobicContact CD1-CD1 4Å; F68-Y151 AromaticContact CD1-CE1 3.81Å; F68-Y151 HydrophobicContact CD1-CE1 3.81Å; F68-Y151 HydrophobicContact CE1-CD1 4.34Å; F68-Y151 HydrophobicContact CE1-CE1 4.37Å; F68-Y151 HydrophobicContact CG-CE1 4.15Å; D69-Y151 PolarHBondContact N-OH 2.79Å; D69-Y151 VanDerWaalsContact N-OH 3.07Å; V70-Y151 HydrophobicContact CG1-CD1 3.38Å; V70-Y151 HydrophobicContact CG1-CD2 4.06Å; V70-Y151 HydrophobicContact CG1-CE1 3.72Å; V70-Y151 HydrophobicContact CG1-CE2 4.36Å; V70-Y151 HydrophobicContact CG1-CG 3.57Å; I102-Y151 HydrophobicContact CG2-CD1 4.29Å; K103-Y151 WeakPolarHBondContact O-CA 3.08Å; K104-Y151 HydrophobicContact CB-CD1 3.73Å; K104-Y151 HydrophobicContact CB-CE1 3.83Å; K104-Y151 HydrophobicContact CD-CD1 4.38Å; K104-Y151 HydrophobicContact CD-CE1 3.59Å; K104-Y151 HydrophobicContact CG-CD1 3.84Å; K104-Y151 HydrophobicContact CG-CE1 3.53Å; K104-Y151 PolarHBondContact NZ-OH 3.35Å; I138-Y151 WeakPolarHBondContact CA-O 3.34Å; I139-Y151 HydrophobicContact CB-CD2 4.27Å; I139-Y151 PolarHBondContact N-O 2.62Å; I139-Y151 PolarHBondContact O-N 2.81Å; D149-Y151 HydrophobicContact CB-CE2 3.89Å
152	I	96.9	Very high	95.5	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.6	178	-55.8	-178.2	0	0	0	108.3	I102 K103 I105 I121 I135 V150 Q154	I102-I152 WeakPolarHBondContact CA-O 3.5Å; K103-I152 HydrophobicContact CB-CB 4.48Å; K103-I152 PolarHBondContact N-O 3.18Å; K103-I152 PolarHBondContact O-N 3.32Å; I105-I152 HydrophobicContact CD1-CD1 3.68Å; I105-I152 HydrophobicContact CD1-CG1 4.26Å; I121-I152 HydrophobicContact CD1-CD1 4.19Å; I121-I152 HydrophobicContact CG1-CD1 3.77Å; I135-I152 HydrophobicContact CB-CG2 4.34Å; I135-I152 HydrophobicContact CD1-CG2 3.75Å; I135-I152 HydrophobicContact CG1-CG2 3.61Å; I135-I152 HydrophobicContact CG2-CG2 3.95Å; V150-I152 HydrophobicContact CG1-CG1 4.29Å; I152-Q154 HydrophobicContact CG2-CG 3.91Å
153	V	97.8	Very high	95.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	131.8	178.7	-172.5	0	0	0	0	109.7	Y74 V100 A101 I102 N136 D137 I139	Y74-V153 HydrophobicContact CE1-CG1 3.89Å; Y74-V153 HydrophobicContact CE1-CG2 4.48Å; Y74-V153 HydrophobicContact CE2-CG2 3.91Å; V100-V153 HydrophobicContact CB-CG1 3.76Å; V100-V153 HydrophobicContact CG1-CG1 4.05Å; V100-V153 HydrophobicContact CG2-CG1 3.79Å; A101-V153 CarbonylContact O-C 3.59Å; A101-V153 WeakPolarHBondContact O-CA 3.27Å; I102-V153 HydrophobicContact CD1-CG2 4.3Å; I102-V153 HydrophobicContact CG1-CG1 4.3Å; I102-V153 HydrophobicContact CG1-CG2 4.16Å; I102-V153 HydrophobicContact CG2-CG2 4.46Å; N136-V153 PolarHBondContact N-O 2.93Å; D137-V153 HydrophobicContact CB-CB 3.89Å; D137-V153 HydrophobicContact CB-CG2 3.95Å; D137-V153 WeakPolarHBondContact O-CB 3.44Å; D137-V153 PolarHBondContact O-N 3.16Å; I139-V153 HydrophobicContact CD1-CG2 4.15Å; I139-V153 HydrophobicContact CG1-CG2 4.28Å
154	Q	97.4	Very high	95.9	Very high	20 Å²	20	48.6 Å²	48.6	9%	0.093	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	165.9	-172.7	-49.3	-165.9	-88.7	0	0	110.7	A101 I133 G134 I152 L156	A101-Q154 PolarHBondContact N-O 3.08Å; A101-Q154 PolarHBondContact O-N 3.4Å; I133-Q154 HydrophobicContact CD1-CB 4.27Å; I133-Q154 HydrophobicContact CG1-CB 4.02Å; I133-Q154 HydrophobicContact CG1-CG 4.49Å; G134-Q154 WeakPolarHBondContact O-CG 3.12Å; G134-Q154 PolarHBondContact O-NE2 2.82Å; I152-Q154 HydrophobicContact CG2-CG 3.91Å; Q154-L156 PolarHBondContact O-N 3.31Å
155	T	96.3	Very high	96	Very high	57 Å²	57	47 Å²	47	35%	0.35	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	130.8	169	-52.7	0	0	0	0	110.3	N136 M157	N136-T155 PolarHBondContact ND2-N 3.08Å; T155-M157 HydrophobicContact CG2-SD 4.25Å
156	L	96.9	Very high	96.2	Very high	42 Å²	42	46.5 Å²	46.5	22%	0.22	22%	0.216	C	C	.	.			trans	-70.5	134.5	172.1	-176.4	58.9	0	0	0	109.7	I80 R99 A101 Q154	I80-L156 HydrophobicContact CD1-CD1 3.54Å; R99-L156 HydrophobicContact CB-CD2 3.65Å; A101-L156 HydrophobicContact CB-CD1 4.09Å; Q154-L156 PolarHBondContact O-N 3.31Å
157	M	96.5	Very high	96.2	Very high	16 Å²	16	46.8 Å²	46.8	8%	0.079	22%	0.221	C	C	.	.			trans	-127.1	135.6	174.4	-55.4	-69.8	-70.1	0	0	108.1	I133 T155 L205 N207 D211 K213	I133-M157 HydrophobicContact CD1-CG 4.43Å; T155-M157 HydrophobicContact CG2-SD 4.25Å; M157-L205 HydrophobicContact CB-CB 3.74Å; M157-L205 HydrophobicContact CB-CD1 4.3Å; M157-L205 HydrophobicContact CE-CB 4.22Å; M157-L205 HydrophobicContact CG-CB 3.72Å; M157-L205 HydrophobicContact CG-CD1 3.97Å; M157-L205 HydrophobicContact CG-CG 4.5Å; M157-N207 HydrophobicContact CE-CB 3.96Å; M157-N207 HydrophobicContact SD-CB 4.29Å; M157-D211 WeakPolarHBondContact CE-O 3.49Å; M157-K213 HydrophobicContact CE-CB 4.16Å; M157-K213 HydrophobicContact CE-CD 4.08Å; M157-K213 HydrophobicContact CE-CG 3.9Å; M157-K213 HydrophobicContact SD-CD 3.79Å; M157-K213 HydrophobicContact SD-CG 4.3Å
158	E	93.3	Very high	96.2	Very high	100 Å²	100	52 Å²	52	47%	0.467	25%	0.245	S	C	.	.	S	Bend	trans	-75.1	-30.1	-166.9	-66.4	91.2	116.2	0	0	113.3	I206 N207 T208	E158-I206 PolarHBondContact N-O 3.3Å; E158-N207 VanDerWaalsContact OE2-CA 3.25Å; E158-N207 WeakPolarHBondContact OE2-CA 3.47Å; E158-N207 WeakPolarHBondContact OE2-CB 3.46Å; E158-T208 HydrophobicContact CG-CG2 4.2Å; E158-T208 VanDerWaalsContact OE1-CB 3.24Å; E158-T208 WeakPolarHBondContact OE1-CB 3.35Å; E158-T208 WeakPolarHBondContact OE1-CG2 3.44Å; E158-T208 PolarHBondContact OE1-N 2.87Å; E158-T208 PolarHBondContact OE1-OG1 2.9Å
159	T	95.5	Very high	96.3	Very high	38 Å²	38	51.3 Å²	51.3	23%	0.233	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	-179.3	179	-162.4	0	0	0	0	112.5	K163 L205 I206	T159-K163 WeakPolarHBondContact OG1-CB 3.45Å; T159-L205 WeakPolarHBondContact O-CA 3Å; T159-I206 HydrophobicContact CG2-CB 3.97Å; T159-I206 PolarHBondContact N-O 3.11Å; T159-I206 PolarHBondContact O-N 2.81Å
160	D	96.8	Very high	96.5	Very high	13 Å²	13	51 Å²	51	7%	0.07	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	158.4	166.6	55	69.3	0	0	0	109.4	Y162 K163 L164 L204 L205	D160-Y162 PolarHBondContact O-N 3.47Å; D160-Y162 WeakPolarHBondContact OD1-CB 3.45Å; D160-Y162 PolarHBondContact OD1-N 3.46Å; D160-K163 PolarHBondContact O-N 2.87Å; D160-K163 WeakPolarHBondContact OD1-CG 2.99Å; D160-K163 PolarHBondContact OD1-N 2.84Å; D160-K163 VanDerWaalsContact OD2-CD 3.23Å; D160-K163 WeakPolarHBondContact OD2-CD 3.28Å; D160-K163 WeakPolarHBondContact OD2-CE 3.27Å; D160-K163 IonicContact OD2-NZ 3.82Å; D160-K163 PolarHBondContact OD2-NZ 3.36Å; D160-L164 PolarHBondContact O-N 2.87Å; D160-L204 WeakPolarHBondContact CA-O 3.38Å; D160-L205 HydrophobicContact CB-CD2 4.22Å
161	L	98.1	Very high	96.5	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-29.1	-178.4	-175.3	64.8	0	0	0	111.9	L164 L165 L170 F178 P201 L204 I206 I266 M270	L161-L164 HydrophobicContact CD1-CD2 4.23Å; L161-L164 PolarHBondContact O-N 3.22Å; L161-L165 HydrophobicContact CD1-CD1 4.07Å; L161-L165 HydrophobicContact CD1-CD2 4.38Å; L161-L165 HydrophobicContact CD1-CG 3.93Å; L161-L165 HydrophobicContact CD2-CD1 4.33Å; L161-L165 HydrophobicContact CG-CD1 3.81Å; L161-L165 HydrophobicContact CG-CG 4.09Å; L161-L165 WeakPolarHBondContact O-CB 3.22Å; L161-L165 VanDerWaalsContact O-CG 3.26Å; L161-L165 WeakPolarHBondContact O-CG 3.23Å; L161-L165 PolarHBondContact O-N 3.4Å; L161-L170 HydrophobicContact CD1-CD1 4.33Å; L161-F178 HydrophobicContact CD1-CD2 4.32Å; L161-P201 CarbonylContact C-O 3.53Å; L161-P201 WeakPolarHBondContact CA-O 3.47Å; L161-P201 HydrophobicContact CB-CB 3.93Å; L161-P201 WeakPolarHBondContact CB-O 3.38Å; L161-P201 HydrophobicContact CD2-CB 4.1Å; L161-P201 HydrophobicContact CD2-CG 4.5Å; L161-P201 HydrophobicContact CG-CB 3.98Å; L161-P201 PolarHBondContact N-O 3.48Å; L161-P201 VanDerWaalsContact N-O 3.1Å; L161-L204 HydrophobicContact CB-CB 4.15Å; L161-L204 HydrophobicContact CD2-CD1 3.81Å; L161-L204 PolarHBondContact N-O 2.93Å; L161-I206 HydrophobicContact CB-CD1 3.86Å; L161-I206 HydrophobicContact CD1-CD1 3.85Å; L161-I206 HydrophobicContact CG-CD1 4.44Å; L161-I266 HydrophobicContact CD2-CG2 3.71Å; L161-M270 HydrophobicContact CD1-CG 4.29Å; L161-M270 HydrophobicContact CD1-SD 4.22Å; L161-M270 HydrophobicContact CD2-CG 4.01Å; L161-M270 HydrophobicContact CD2-SD 3.95Å
162	Y	96.5	Very high	96.6	Very high	91 Å²	91	55.8 Å²	55.8	36%	0.357	28%	0.276	S	S	.	.	H	α-helix	trans	-67.2	-42.3	176.3	175.7	-111	0	0	0	113	D160 K166 P201	D160-Y162 PolarHBondContact O-N 3.47Å; D160-Y162 WeakPolarHBondContact OD1-CB 3.45Å; D160-Y162 PolarHBondContact OD1-N 3.46Å; Y162-K166 HydrophobicContact CE1-CD 4.5Å; Y162-K166 WeakPolarHBondContact O-CG 3.27Å; Y162-K166 PolarHBondContact O-N 3.36Å; Y162-K166 VanDerWaalsContact OH-CE 3.28Å; Y162-K166 WeakPolarHBondContact OH-CE 3.45Å; Y162-K166 PolarHBondContact OH-NZ 3.44Å; Y162-P201 PolarHBondContact N-O 3.23Å
163	K	95.9	Very high	96.7	Very high	87 Å²	87	61.6 Å²	61.6	38%	0.378	30%	0.303	S	S	.	.	H	α-helix	trans	-66	-40.9	170.8	-72.6	168.4	-171.2	139.2	0	111.5	T159 D160 K166 T167	T159-K163 WeakPolarHBondContact OG1-CB 3.45Å; D160-K163 PolarHBondContact O-N 2.87Å; D160-K163 WeakPolarHBondContact OD1-CG 2.99Å; D160-K163 PolarHBondContact OD1-N 2.84Å; D160-K163 VanDerWaalsContact OD2-CD 3.23Å; D160-K163 WeakPolarHBondContact OD2-CD 3.28Å; D160-K163 WeakPolarHBondContact OD2-CE 3.27Å; D160-K163 IonicContact OD2-NZ 3.82Å; D160-K163 PolarHBondContact OD2-NZ 3.36Å; K163-K166 PolarHBondContact O-N 3.36Å; K163-T167 PolarHBondContact O-OG1 3.42Å; K163-T167 VanDerWaalsContact O-OG1 3.08Å
164	L	97.1	Very high	96.7	Very high	31 Å²	31	65.4 Å²	65.4	16%	0.162	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-51.5	178.8	-172.4	62.2	0	0	0	111	D160 L161 K166 T167 Q168 L170 F178 I206	D160-L164 PolarHBondContact O-N 2.87Å; L161-L164 HydrophobicContact CD1-CD2 4.23Å; L161-L164 PolarHBondContact O-N 3.22Å; L164-K166 PolarHBondContact O-N 3.4Å; L164-T167 PolarHBondContact O-N 3.19Å; L164-T167 PolarHBondContact O-OG1 3.06Å; L164-Q168 HydrophobicContact CD1-CB 3.93Å; L164-Q168 HydrophobicContact CD1-CG 3.72Å; L164-Q168 HydrophobicContact CG-CB 4.49Å; L164-Q168 PolarHBondContact O-N 3.48Å; L164-L170 HydrophobicContact CD2-CD2 3.94Å; L164-L170 HydrophobicContact CG-CD2 4.21Å; L164-F178 HydrophobicContact CD2-CE2 3.86Å; L164-F178 HydrophobicContact CD2-CZ 4Å; L164-I206 HydrophobicContact CD2-CD1 3.86Å
165	L	97.5	Very high	96.7	Very high	7 Å²	7	64.6 Å²	64.6	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-68.4	-13.7	-179	-67.1	177.1	0	0	0	114.5	L161 L170 E269 M270 N273	L161-L165 HydrophobicContact CD1-CD1 4.07Å; L161-L165 HydrophobicContact CD1-CD2 4.38Å; L161-L165 HydrophobicContact CD1-CG 3.93Å; L161-L165 HydrophobicContact CD2-CD1 4.33Å; L161-L165 HydrophobicContact CG-CD1 3.81Å; L161-L165 HydrophobicContact CG-CG 4.09Å; L161-L165 WeakPolarHBondContact O-CB 3.22Å; L161-L165 VanDerWaalsContact O-CG 3.26Å; L161-L165 WeakPolarHBondContact O-CG 3.23Å; L161-L165 PolarHBondContact O-N 3.4Å; L165-L170 HydrophobicContact CD2-CD1 3.71Å; L165-L170 HydrophobicContact CD2-CG 3.9Å; L165-E269 HydrophobicContact CD1-CG 3.98Å; L165-M270 HydrophobicContact CD1-CG 4.03Å; L165-M270 HydrophobicContact CD2-CG 4.38Å; L165-N273 PolarHBondContact O-ND2 2.73Å
166	K	96.5	Very high	96.9	Very high	133 Å²	133	61.9 Å²	61.9	58%	0.578	30%	0.3	S	S	*	.	H	α-helix	trans	-77	-21.5	168.7	-80.2	178.5	178.9	178.6	0	114.3	Y162 K163 L164	Y162-K166 HydrophobicContact CE1-CD 4.5Å; Y162-K166 WeakPolarHBondContact O-CG 3.27Å; Y162-K166 PolarHBondContact O-N 3.36Å; Y162-K166 VanDerWaalsContact OH-CE 3.28Å; Y162-K166 WeakPolarHBondContact OH-CE 3.45Å; Y162-K166 PolarHBondContact OH-NZ 3.44Å; K163-K166 PolarHBondContact O-N 3.36Å; L164-K166 PolarHBondContact O-N 3.4Å
167	T	94.8	Very high	96.9	Very high	102 Å²	102	63 Å²	63	63%	0.626	30%	0.302	S	S	*	.	H	α-helix	trans	-125.1	-29.9	-165.3	53.4	0	0	0	0	113.4	K163 L164	K163-T167 PolarHBondContact O-OG1 3.42Å; K163-T167 VanDerWaalsContact O-OG1 3.08Å; L164-T167 PolarHBondContact O-N 3.19Å; L164-T167 PolarHBondContact O-OG1 3.06Å
168	Q	95.5	Very high	97	Very high	110 Å²	110	62.2 Å²	62.2	51%	0.514	30%	0.298	S	S	.	.			trans	-121.3	146.1	-176.8	-56.6	-56.3	-21.8	0	0	111.7	L164 N273	L164-Q168 HydrophobicContact CD1-CB 3.93Å; L164-Q168 HydrophobicContact CD1-CG 3.72Å; L164-Q168 HydrophobicContact CG-CB 4.49Å; L164-Q168 PolarHBondContact O-N 3.48Å; Q168-N273 PolarHBondContact O-ND2 2.81Å
169	K	95.4	Very high	97.3	Very high	181 Å²	181	57.5 Å²	57.5	79%	0.787	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-95.4	129.3	165.3	-64.5	-178.2	179	172.7	0	107.9
170	L	97.5	Very high	97.5	Very high	33 Å²	33	56.5 Å²	56.5	17%	0.173	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-80.7	145.8	-178.7	-57	-174.6	0	0	0	111.1	L161 L164 L165 H174 V175 F178 M270	L161-L170 HydrophobicContact CD1-CD1 4.33Å; L164-L170 HydrophobicContact CD2-CD2 3.94Å; L164-L170 HydrophobicContact CG-CD2 4.21Å; L165-L170 HydrophobicContact CD2-CD1 3.71Å; L165-L170 HydrophobicContact CD2-CG 3.9Å; L170-H174 HydrophobicContact CB-CB 4.14Å; L170-H174 HydrophobicContact CD2-CB 4.39Å; L170-V175 HydrophobicContact CB-CG2 3.65Å; L170-V175 HydrophobicContact CD1-CG2 4.1Å; L170-F178 HydrophobicContact CD1-CD2 3.91Å; L170-F178 HydrophobicContact CD1-CE2 4.06Å; L170-F178 HydrophobicContact CD2-CE2 4.07Å; L170-M270 HydrophobicContact CD1-CB 4.15Å; L170-M270 HydrophobicContact CD1-CG 4Å; L170-M270 HydrophobicContact CD1-SD 4.09Å
171	S	98.1	Very high	97.6	Very high	42 Å²	42	56.2 Å²	56.2	29%	0.294	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-76.6	161.6	163.8	76.5	0	0	0	0	110.1	E173 H174 V175	S171-E173 PolarHBondContact O-N 3.35Å; S171-E173 PolarHBondContact OG-N 3.04Å; S171-E173 PolarHBondContact OG-OE2 2.82Å; S171-H174 PolarHBondContact O-N 2.76Å; S171-H174 VanDerWaalsContact O-N 3.1Å; S171-H174 PolarHBondContact OG-N 3.1Å; S171-H174 PolarHBondContact OG-ND1 2.79Å; S171-V175 WeakPolarHBondContact O-CG2 3.29Å; S171-V175 PolarHBondContact O-N 3.2Å
172	N	98.2	Very high	97.6	Very high	68 Å²	68	56.2 Å²	56.2	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-55.9	-35	176	-169.8	40.4	0	0	0	111.9	V175 C176 D332 Y361	N172-V175 PolarHBondContact O-N 3.07Å; N172-C176 VanDerWaalsContact O-CB 3.25Å; N172-C176 WeakPolarHBondContact O-CB 3.25Å; N172-C176 PolarHBondContact O-N 2.91Å; N172-D332 PolarHBondContact ND2-OD2 2.88Å; N172-Y361 PolarHBondContact O-OH 3.4Å; N172-Y361 WeakPolarHBondContact OD1-CE2 3.22Å; N172-Y361 PolarHBondContact OD1-OH 3.32Å
173	E	98.2	Very high	97.7	Very high	123 Å²	123	51.9 Å²	51.9	58%	0.575	25%	0.249	S	C	*	.	H	α-helix	trans	-64.2	-45.9	176.6	-55.2	132.7	155.5	0	0	111.3	S171 V175 C176 Y177	S171-E173 PolarHBondContact O-N 3.35Å; S171-E173 PolarHBondContact OG-N 3.04Å; S171-E173 PolarHBondContact OG-OE2 2.82Å; E173-V175 PolarHBondContact O-N 3.35Å; E173-C176 PolarHBondContact O-N 3.43Å; E173-Y177 VanDerWaalsContact O-CB 3.29Å; E173-Y177 WeakPolarHBondContact O-CB 3.48Å; E173-Y177 PolarHBondContact O-N 2.89Å
174	H	98.3	Very high	97.9	Very high	79 Å²	79	48.2 Å²	48.2	37%	0.366	23%	0.233	S	C	.	.	H	α-helix	trans	-63.7	-40.6	175.7	-71.3	88.1	0	0	0	112	L170 S171 Y177 F178	L170-H174 HydrophobicContact CB-CB 4.14Å; L170-H174 HydrophobicContact CD2-CB 4.39Å; S171-H174 PolarHBondContact O-N 2.76Å; S171-H174 VanDerWaalsContact O-N 3.1Å; S171-H174 PolarHBondContact OG-N 3.1Å; S171-H174 PolarHBondContact OG-ND1 2.79Å; H174-Y177 PolarHBondContact O-N 2.99Å; H174-F178 HydrophobicContact CB-CD2 4.4Å; H174-F178 HydrophobicContact CB-CE2 4.11Å; H174-F178 WeakPolarHBondContact O-CB 3.47Å; H174-F178 WeakPolarHBondContact O-CD2 3.46Å; H174-F178 VanDerWaalsContact O-CG 3.31Å; H174-F178 WeakPolarHBondContact O-CG 3.31Å; H174-F178 PolarHBondContact O-N 2.82Å
175	V	98.6	Very high	98	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-45.2	176.2	178.6	0	0	0	0	110.8	L170 S171 N172 E173 L179 L267 M270 L271	L170-V175 HydrophobicContact CB-CG2 3.65Å; L170-V175 HydrophobicContact CD1-CG2 4.1Å; S171-V175 WeakPolarHBondContact O-CG2 3.29Å; S171-V175 PolarHBondContact O-N 3.2Å; N172-V175 PolarHBondContact O-N 3.07Å; E173-V175 PolarHBondContact O-N 3.35Å; V175-L179 WeakPolarHBondContact O-CB 3.49Å; V175-L179 PolarHBondContact O-N 2.57Å; V175-L267 HydrophobicContact CG1-CD1 3.58Å; V175-M270 HydrophobicContact CG1-CB 4.13Å; V175-M270 HydrophobicContact CG1-CE 4.16Å; V175-M270 HydrophobicContact CG2-CB 4.19Å; V175-L271 HydrophobicContact CG1-CD2 4.04Å; V175-L271 HydrophobicContact CG1-CG 4.43Å
176	C	98.7	Very high	98	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.007	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-48.5	176	-178.8	0	0	0	0	111.7	N172 E173 L179 Y180 Y361 L362 Q364 Y365	N172-C176 VanDerWaalsContact O-CB 3.25Å; N172-C176 WeakPolarHBondContact O-CB 3.25Å; N172-C176 PolarHBondContact O-N 2.91Å; E173-C176 PolarHBondContact O-N 3.43Å; C176-L179 PolarHBondContact O-N 3.35Å; C176-Y180 WeakPolarHBondContact O-CB 3.28Å; C176-Y180 PolarHBondContact O-N 3.06Å; C176-Y361 HydrophobicContact CB-CE1 4.08Å; C176-Y361 HydrophobicContact CB-CE2 4.3Å; C176-Y361 PolarHBondContact N-OH 2.67Å; C176-Y361 PolarHBondContact SG-O 3.02Å; C176-L362 VanDerWaalsContact SG-CD2 3.59Å; C176-Q364 PolarHBondContact SG-NE2 2.88Å; C176-Y365 HydrophobicContact CB-CE2 4.33Å
177	Y	98.7	Very high	98.1	Very high	65 Å²	65	40.8 Å²	40.8	26%	0.255	20%	0.199	S	C	.	.	H	α-helix	trans	-67.9	-41.9	-177.1	-174.7	-127.6	0	0	0	113	E173 H174 Q181 C210 Y365	E173-Y177 VanDerWaalsContact O-CB 3.29Å; E173-Y177 WeakPolarHBondContact O-CB 3.48Å; E173-Y177 PolarHBondContact O-N 2.89Å; H174-Y177 PolarHBondContact O-N 2.99Å; Y177-Q181 HydrophobicContact CE2-CG 4.24Å; Y177-Q181 VanDerWaalsContact CZ-NE2 3.34Å; Y177-Q181 WeakPolarHBondContact O-CG 3.48Å; Y177-Q181 PolarHBondContact O-N 3.43Å; Y177-Q181 VanDerWaalsContact O-N 3.09Å; Y177-C210 HydrophobicContact CD1-CB 4.5Å; Y177-C210 HydrophobicContact CE1-CB 4.31Å; Y177-C210 WeakPolarHBondContact CE1-O 3.43Å; Y177-Y365 HydrophobicContact CD2-CD1 4.36Å; Y177-Y365 HydrophobicContact CD2-CD2 4.41Å; Y177-Y365 AromaticContact CD2-CE1 3.9Å; Y177-Y365 HydrophobicContact CD2-CE1 3.9Å; Y177-Y365 AromaticContact CD2-CE2 3.95Å; Y177-Y365 HydrophobicContact CD2-CE2 3.95Å; Y177-Y365 AromaticContact CD2-CZ 3.68Å; Y177-Y365 HydrophobicContact CE2-CE1 4.46Å; Y177-Y365 HydrophobicContact CG-CE2 4.36Å
178	F	98.8	Very high	98.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.8	-40.2	172.2	-65.7	-41.5	0	0	0	111.4	L161 L164 L170 H174 Q181 I182 I206 C210 L212 M270	L161-F178 HydrophobicContact CD1-CD2 4.32Å; L164-F178 HydrophobicContact CD2-CE2 3.86Å; L164-F178 HydrophobicContact CD2-CZ 4Å; L170-F178 HydrophobicContact CD1-CD2 3.91Å; L170-F178 HydrophobicContact CD1-CE2 4.06Å; L170-F178 HydrophobicContact CD2-CE2 4.07Å; H174-F178 HydrophobicContact CB-CD2 4.4Å; H174-F178 HydrophobicContact CB-CE2 4.11Å; H174-F178 WeakPolarHBondContact O-CB 3.47Å; H174-F178 WeakPolarHBondContact O-CD2 3.46Å; H174-F178 VanDerWaalsContact O-CG 3.31Å; H174-F178 WeakPolarHBondContact O-CG 3.31Å; H174-F178 PolarHBondContact O-N 2.82Å; F178-Q181 PolarHBondContact O-N 3.23Å; F178-I182 WeakPolarHBondContact O-CB 3.47Å; F178-I182 VanDerWaalsContact O-CD1 3.29Å; F178-I182 WeakPolarHBondContact O-CD1 3.3Å; F178-I182 WeakPolarHBondContact O-CG1 3.16Å; F178-I182 PolarHBondContact O-N 3.42Å; F178-I206 HydrophobicContact CD1-CD1 4.26Å; F178-I206 HydrophobicContact CE1-CD1 3.85Å; F178-I206 HydrophobicContact CE1-CG1 4.3Å; F178-I206 HydrophobicContact CE1-CG2 3.87Å; F178-I206 HydrophobicContact CE2-CD1 4.33Å; F178-I206 HydrophobicContact CZ-CD1 3.9Å; F178-I206 HydrophobicContact CZ-CG2 4.13Å; F178-C210 HydrophobicContact CE1-CB 3.8Å; F178-C210 WeakPolarHBondContact CE1-O 3.31Å; F178-C210 HydrophobicContact CZ-CB 4.06Å; F178-L212 HydrophobicContact CB-CD1 4Å; F178-L212 HydrophobicContact CD1-CB 4.35Å; F178-L212 HydrophobicContact CD1-CD1 3.91Å; F178-L212 HydrophobicContact CG-CD1 4.24Å; F178-M270 HydrophobicContact CB-SD 3.91Å; F178-M270 HydrophobicContact CD2-SD 4.31Å
179	L	98.9	Very high	98.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.9	-44.2	177.3	-172.4	67	0	0	0	112.1	V175 C176 I182 L183 V263 L267 M270 L338 M342 Y361 L362	V175-L179 WeakPolarHBondContact O-CB 3.49Å; V175-L179 PolarHBondContact O-N 2.57Å; C176-L179 PolarHBondContact O-N 3.35Å; L179-I182 PolarHBondContact O-N 3.46Å; L179-L183 HydrophobicContact CD1-CD1 4.35Å; L179-L183 HydrophobicContact CG-CD1 3.97Å; L179-L183 WeakPolarHBondContact O-CG 3.35Å; L179-L183 PolarHBondContact O-N 3.46Å; L179-V263 HydrophobicContact CD1-CG1 3.56Å; L179-L267 HydrophobicContact CD1-CB 4.3Å; L179-L267 HydrophobicContact CD1-CD2 4.49Å; L179-L267 HydrophobicContact CD2-CD1 4.03Å; L179-L267 HydrophobicContact CD2-CD2 3.84Å; L179-L267 HydrophobicContact CD2-CG 4.47Å; L179-M270 HydrophobicContact CB-CE 4.26Å; L179-M270 HydrophobicContact CD1-CE 4.48Å; L179-L338 HydrophobicContact CD2-CD2 3.64Å; L179-M342 HydrophobicContact CD1-CE 4.25Å; L179-Y361 HydrophobicContact CD2-CD1 3.93Å; L179-Y361 HydrophobicContact CD2-CE1 3.93Å; L179-L362 HydrophobicContact CB-CD2 4.45Å; L179-L362 HydrophobicContact CD2-CD2 4.27Å
180	Y	98.9	Very high	98.5	Very high	18 Å²	18	23.1 Å²	23.1	7%	0.071	11%	0.111	C	C	.	.	H	α-helix	trans	-56.1	-52.1	173.7	171.6	-109.1	0	0	0	111.4	C176 I182 L183 R184 L357 Y365 E371	C176-Y180 WeakPolarHBondContact O-CB 3.28Å; C176-Y180 PolarHBondContact O-N 3.06Å; Y180-I182 VanDerWaalsContact C-N 3.34Å; Y180-I182 PolarHBondContact O-N 2.85Å; Y180-L183 PolarHBondContact O-N 2.94Å; Y180-L183 VanDerWaalsContact O-N 3.12Å; Y180-R184 WeakPolarHBondContact O-CB 3.48Å; Y180-R184 PolarHBondContact O-N 2.84Å; Y180-L357 HydrophobicContact CD2-CD2 3.71Å; Y180-L357 HydrophobicContact CE2-CD2 3.88Å; Y180-Y365 HydrophobicContact CD1-CD2 4.45Å; Y180-Y365 HydrophobicContact CD1-CG 4.09Å; Y180-Y365 WeakPolarHBondContact CE2-O 3.49Å; Y180-Y365 HydrophobicContact CG-CD2 4.21Å; Y180-Y365 HydrophobicContact CG-CG 4.12Å; Y180-Y365 VanDerWaalsContact CZ-O 3.24Å; Y180-Y365 PolarHBondContact OH-O 2.92Å; Y180-E371 HydrophobicContact CE2-CG 4.49Å
181	Q	98.9	Very high	98.5	Very high	6 Å²	6	22.7 Å²	22.7	3%	0.028	11%	0.111	C	C	.	.	H	α-helix	trans	-62.6	-37.4	-180	-72.2	-174.2	80.8	0	0	113.4	N131 Y177 F178 G185 C210 L212	N131-Q181 VanDerWaalsContact CB-O 3.31Å; N131-Q181 WeakPolarHBondContact CB-O 3.26Å; N131-Q181 WeakPolarHBondContact ND2-CB 3.48Å; N131-Q181 PolarHBondContact ND2-OE1 2.93Å; Y177-Q181 HydrophobicContact CE2-CG 4.24Å; Y177-Q181 VanDerWaalsContact CZ-NE2 3.34Å; Y177-Q181 WeakPolarHBondContact O-CG 3.48Å; Y177-Q181 PolarHBondContact O-N 3.43Å; Y177-Q181 VanDerWaalsContact O-N 3.09Å; F178-Q181 PolarHBondContact O-N 3.23Å; Q181-G185 PolarHBondContact O-N 3.43Å; Q181-C210 PolarHBondContact NE2-O 3.45Å; Q181-L212 HydrophobicContact CB-CB 4Å; Q181-L212 HydrophobicContact CB-CD2 4.24Å
182	I	98.9	Very high	98.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.3	-46.5	173.3	-68.6	159.5	0	0	0	110.1	F178 L179 Y180 L186 L204 L212 V263 I266 M270	F178-I182 WeakPolarHBondContact O-CB 3.47Å; F178-I182 VanDerWaalsContact O-CD1 3.29Å; F178-I182 WeakPolarHBondContact O-CD1 3.3Å; F178-I182 WeakPolarHBondContact O-CG1 3.16Å; F178-I182 PolarHBondContact O-N 3.42Å; L179-I182 PolarHBondContact O-N 3.46Å; Y180-I182 VanDerWaalsContact C-N 3.34Å; Y180-I182 PolarHBondContact O-N 2.85Å; I182-L186 VanDerWaalsContact O-CB 3.27Å; I182-L186 WeakPolarHBondContact O-CB 3.41Å; I182-L186 PolarHBondContact O-N 3.07Å; I182-L204 HydrophobicContact CD1-CD1 3.54Å; I182-L204 HydrophobicContact CG1-CD1 3.81Å; I182-L204 HydrophobicContact CG1-CD2 4.19Å; I182-L212 HydrophobicContact CD1-CD1 4.1Å; I182-L212 HydrophobicContact CG1-CD1 3.75Å; I182-L212 HydrophobicContact CG1-CD2 3.74Å; I182-L212 HydrophobicContact CG1-CG 4.44Å; I182-V263 HydrophobicContact CG2-CG1 4.02Å; I182-V263 HydrophobicContact CG2-CG2 3.66Å; I182-I266 HydrophobicContact CD1-CG2 4.19Å; I182-M270 HydrophobicContact CD1-CE 4.41Å
183	L	98.9	Very high	98.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-72.6	-40.4	-177.7	-68.7	167.4	0	0	0	112.8	L179 Y180 G185 L186 K187 M260 V263 M342 V353 A356 L357 L362	L179-L183 HydrophobicContact CD1-CD1 4.35Å; L179-L183 HydrophobicContact CG-CD1 3.97Å; L179-L183 WeakPolarHBondContact O-CG 3.35Å; L179-L183 PolarHBondContact O-N 3.46Å; Y180-L183 PolarHBondContact O-N 2.94Å; Y180-L183 VanDerWaalsContact O-N 3.12Å; L183-G185 VanDerWaalsContact C-N 3.35Å; L183-G185 PolarHBondContact O-N 3.26Å; L183-L186 CarbonylContact O-C 3.59Å; L183-L186 PolarHBondContact O-N 3.11Å; L183-L186 VanDerWaalsContact O-N 3.07Å; L183-K187 PolarHBondContact O-N 2.89Å; L183-M260 HydrophobicContact CD2-CE 3.76Å; L183-M260 HydrophobicContact CD2-SD 4.05Å; L183-V263 HydrophobicContact CD2-CG1 4.11Å; L183-M342 HydrophobicContact CD1-CE 3.9Å; L183-M342 HydrophobicContact CD2-CE 3.89Å; L183-M342 HydrophobicContact CG-CE 4.4Å; L183-V353 HydrophobicContact CB-CG2 4.22Å; L183-V353 HydrophobicContact CD2-CG2 3.96Å; L183-V353 VanDerWaalsContact O-CG2 3.22Å; L183-V353 WeakPolarHBondContact O-CG2 3.47Å; L183-A356 HydrophobicContact CD1-CB 4.01Å; L183-A356 HydrophobicContact CD2-CB 4.08Å; L183-L357 HydrophobicContact CB-CD1 4.41Å; L183-L357 HydrophobicContact CB-CD2 3.62Å; L183-L357 HydrophobicContact CB-CG 3.82Å; L183-L362 HydrophobicContact CD1-CD1 3.53Å
184	R	98.9	Very high	98	Very high	11 Å²	11	14 Å²	14	4%	0.042	7%	0.066	C	C	.	.	H	α-helix	trans	-58.9	-46.7	173.5	-175.1	-179.7	176.9	-114.7	12.2	110.7	E130 N131 Y180 L186 K187 Y188 D370 E371	E130-R184 IonicContact OE2-CZ 2.65Å; E130-R184 VanDerWaalsContact OE2-CZ 3.27Å; E130-R184 IonicContact OE2-NH1 2.86Å; E130-R184 PolarHBondContact OE2-NH1 3.02Å; E130-R184 IonicContact OE2-NH2 3.96Å; E130-R184 PolarHBondContact OE2-NH2 3.43Å; N131-R184 PolarHBondContact OD1-NH1 3.48Å; Y180-R184 WeakPolarHBondContact O-CB 3.48Å; Y180-R184 PolarHBondContact O-N 2.84Å; R184-L186 VanDerWaalsContact C-N 3.34Å; R184-L186 PolarHBondContact O-N 3.41Å; R184-K187 PolarHBondContact O-N 3.1Å; R184-Y188 PolarHBondContact O-N 2.98Å; R184-D370 VanDerWaalsContact CZ-O 3.22Å; R184-D370 IonicContact CZ-OD1 3.74Å; R184-D370 IonicContact CZ-OD2 3.39Å; R184-D370 PolarHBondContact NE-O 2.88Å; R184-D370 IonicContact NE-OD2 2.85Å; R184-D370 VanDerWaalsContact NH2-CG 3.31Å; R184-D370 PolarHBondContact NH2-O 2.72Å; R184-D370 IonicContact NH2-OD1 2.73Å; R184-D370 PolarHBondContact NH2-OD1 2.69Å; R184-D370 IonicContact NH2-OD2 2.99Å; R184-D370 PolarHBondContact NH2-OD2 3.22Å; R184-E371 HydrophobicContact CG-CG 4.22Å
185	G	98.8	Very high	97.7	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-59.5	-40.9	171	0	0	0	0	0	113.3	Q181 L183 Y188 I189	Q181-G185 PolarHBondContact O-N 3.43Å; L183-G185 VanDerWaalsContact C-N 3.35Å; L183-G185 PolarHBondContact O-N 3.26Å; G185-Y188 PolarHBondContact O-N 2.88Å; G185-I189 VanDerWaalsContact O-CG1 3.28Å; G185-I189 WeakPolarHBondContact O-CG1 3.26Å; G185-I189 PolarHBondContact O-N 2.94Å
186	L	98.8	Very high	97.6	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-71.4	-33.3	179.9	-169.4	59.7	0	0	0	113.2	I182 L183 R184 Y188 I189 H190 L199 D259 M260 V263 V353	I182-L186 VanDerWaalsContact O-CB 3.27Å; I182-L186 WeakPolarHBondContact O-CB 3.41Å; I182-L186 PolarHBondContact O-N 3.07Å; L183-L186 CarbonylContact O-C 3.59Å; L183-L186 PolarHBondContact O-N 3.11Å; L183-L186 VanDerWaalsContact O-N 3.07Å; R184-L186 VanDerWaalsContact C-N 3.34Å; R184-L186 PolarHBondContact O-N 3.41Å; L186-Y188 VanDerWaalsContact C-N 3.34Å; L186-Y188 PolarHBondContact O-N 2.95Å; L186-I189 HydrophobicContact CD1-CB 4.35Å; L186-I189 HydrophobicContact CD1-CD1 4.3Å; L186-I189 PolarHBondContact O-N 3.35Å; L186-H190 WeakPolarHBondContact CD1-NE2 3.16Å; L186-H190 VanDerWaalsContact O-CB 3.25Å; L186-H190 WeakPolarHBondContact O-CB 3.4Å; L186-H190 PolarHBondContact O-N 3.38Å; L186-L199 HydrophobicContact CD1-CD1 4.05Å; L186-L199 HydrophobicContact CD2-CD1 4.13Å; L186-D259 HydrophobicContact CD1-CB 3.99Å; L186-D259 HydrophobicContact CD2-CB 3.97Å; L186-M260 HydrophobicContact CD2-SD 3.75Å; L186-V263 HydrophobicContact CD2-CG2 3.86Å; L186-V353 HydrophobicContact CB-CG2 3.97Å; L186-V353 HydrophobicContact CD2-CG2 4.42Å; L186-V353 HydrophobicContact CG-CG2 4.21Å
187	K	98.7	Very high	97.2	Very high	15 Å²	15	12.8 Å²	12.8	7%	0.065	6%	0.057	C	C	.	.	H	α-helix	trans	-58	-45.9	172.3	-172.6	-166.2	-172.4	-179.3	0	110.9	L183 R184 H190 S191 V353 L357 E371 E373	L183-K187 PolarHBondContact O-N 2.89Å; R184-K187 PolarHBondContact O-N 3.1Å; K187-H190 PolarHBondContact O-N 3.27Å; K187-S191 WeakPolarHBondContact O-CB 3.48Å; K187-S191 PolarHBondContact O-N 2.96Å; K187-S191 PolarHBondContact O-OG 3.36Å; K187-V353 HydrophobicContact CB-CG1 4.31Å; K187-V353 HydrophobicContact CB-CG2 4.15Å; K187-L357 HydrophobicContact CB-CD1 3.97Å; K187-L357 HydrophobicContact CD-CD1 3.86Å; K187-L357 HydrophobicContact CG-CD1 4.3Å; K187-E371 HydrophobicContact CD-CB 3.91Å; K187-E371 WeakPolarHBondContact CE-O 3.47Å; K187-E371 PolarHBondContact NZ-O 3.07Å; K187-E371 IonicContact NZ-OE2 3.76Å; K187-E371 PolarHBondContact NZ-OE2 3.48Å; K187-E373 WeakPolarHBondContact CE-OE1 3.07Å; K187-E373 HydrophobicContact CG-CG 4.41Å
188	Y	98.7	Very high	96.9	Very high	20 Å²	20	10.5 Å²	10.5	8%	0.078	5%	0.049	C	C	.	.	H	α-helix	trans	-62.8	-43.5	175.1	-171.2	-85	0	0	0	112.3	F127 R128 H129 I132 R184 G185 L186 H190 S191 A192 A374	F127-Y188 HydrophobicContact CB-CE1 4.02Å; F127-Y188 HydrophobicContact CD1-CD1 4.25Å; F127-Y188 AromaticContact CD1-CE1 3.61Å; F127-Y188 HydrophobicContact CD1-CE1 3.61Å; F127-Y188 HydrophobicContact CE1-CD1 4.45Å; F127-Y188 HydrophobicContact CE1-CE1 4.15Å; F127-Y188 HydrophobicContact CG-CD1 4.39Å; F127-Y188 AromaticContact CG-CE1 3.88Å; F127-Y188 HydrophobicContact CG-CE1 3.88Å; R128-Y188 PolarHBondContact N-OH 2.93Å; R128-Y188 VanDerWaalsContact N-OH 3.11Å; R128-Y188 PolarHBondContact O-OH 3.13Å; H129-Y188 HydrophobicContact CB-CD1 3.8Å; H129-Y188 HydrophobicContact CB-CD2 4Å; H129-Y188 HydrophobicContact CB-CE1 4.07Å; H129-Y188 HydrophobicContact CB-CE2 4.27Å; H129-Y188 HydrophobicContact CB-CG 3.75Å; H129-Y188 AromaticContact CD2-CD2 3.62Å; H129-Y188 AromaticContact CD2-CG 3.73Å; H129-Y188 AromaticContact CG-CG 3.8Å; I132-Y188 HydrophobicContact CD1-CD1 3.62Å; I132-Y188 HydrophobicContact CD1-CE1 4.33Å; I132-Y188 HydrophobicContact CD1-CG 4.37Å; R184-Y188 PolarHBondContact O-N 2.98Å; G185-Y188 PolarHBondContact O-N 2.88Å; L186-Y188 VanDerWaalsContact C-N 3.34Å; L186-Y188 PolarHBondContact O-N 2.95Å; Y188-H190 PolarHBondContact O-N 3.1Å; Y188-S191 WeakPolarHBondContact CA-OG 3.33Å; Y188-S191 PolarHBondContact O-OG 3.19Å; Y188-A192 PolarHBondContact O-N 3.04Å; Y188-A374 HydrophobicContact CE1-CB 4.15Å; Y188-A374 HydrophobicContact CE2-CB 4.17Å
189	I	98.4	Very high	96.8	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-62.7	-43.5	176.5	-62.2	163.8	0	0	0	111	F127 I132 G185 L186 A192 V194 I214 F217	F127-I189 HydrophobicContact CE2-CB 4.36Å; F127-I189 HydrophobicContact CE2-CG1 3.84Å; F127-I189 HydrophobicContact CE2-CG2 4.31Å; F127-I189 HydrophobicContact CZ-CB 4.41Å; F127-I189 HydrophobicContact CZ-CG1 4.34Å; F127-I189 HydrophobicContact CZ-CG2 4.34Å; I132-I189 HydrophobicContact CD1-CD1 4.16Å; I132-I189 HydrophobicContact CD1-CG1 3.62Å; I132-I189 HydrophobicContact CG1-CD1 4.49Å; I132-I189 HydrophobicContact CG1-CG1 4.46Å; G185-I189 VanDerWaalsContact O-CG1 3.28Å; G185-I189 WeakPolarHBondContact O-CG1 3.26Å; G185-I189 PolarHBondContact O-N 2.94Å; L186-I189 HydrophobicContact CD1-CB 4.35Å; L186-I189 HydrophobicContact CD1-CD1 4.3Å; L186-I189 PolarHBondContact O-N 3.35Å; I189-A192 WeakPolarHBondContact O-CB 3.49Å; I189-A192 PolarHBondContact O-N 3.18Å; I189-V194 HydrophobicContact CG2-CB 3.89Å; I189-V194 HydrophobicContact CG2-CG1 3.9Å; I189-V194 WeakPolarHBondContact O-CB 3.39Å; I189-V194 PolarHBondContact O-N 3.11Å; I189-V194 VanDerWaalsContact O-N 3.11Å; I189-I214 HydrophobicContact CD1-CD1 3.87Å; I189-I214 HydrophobicContact CD1-CG2 4.19Å; I189-F217 HydrophobicContact CD1-CE1 3.77Å; I189-F217 HydrophobicContact CD1-CZ 3.7Å; I189-F217 HydrophobicContact CG1-CE1 4.01Å; I189-F217 HydrophobicContact CG1-CZ 4.17Å; I189-F217 HydrophobicContact CG2-CE1 4.34Å
190	H	97.4	Very high	96.7	Very high	1 Å²	1	11.5 Å²	11.5	1%	0.005	5%	0.054	C	C	.	.	H	α-helix	trans	-77.3	-33.6	-175.2	-80.6	-167	0	0	0	113.4	L186 K187 Y188 A192 N193 V194 K256 D259 V353	L186-H190 WeakPolarHBondContact CD1-NE2 3.16Å; L186-H190 VanDerWaalsContact O-CB 3.25Å; L186-H190 WeakPolarHBondContact O-CB 3.4Å; L186-H190 PolarHBondContact O-N 3.38Å; K187-H190 PolarHBondContact O-N 3.27Å; Y188-H190 PolarHBondContact O-N 3.1Å; H190-A192 VanDerWaalsContact C-N 3.27Å; H190-N193 PolarHBondContact O-N 3.26Å; H190-N193 VanDerWaalsContact O-N 3.15Å; H190-V194 PolarHBondContact CD2-O 3.35Å; H190-V194 VanDerWaalsContact CD2-O 3.27Å; H190-K256 HydrophobicContact CB-CD 3.86Å; H190-K256 HydrophobicContact CB-CG 4.26Å; H190-K256 PolarHBondContact CE1-O 3.01Å; H190-K256 VanDerWaalsContact CE1-O 3.28Å; H190-K256 WeakPolarHBondContact O-CE 3.2Å; H190-K256 PolarHBondContact O-NZ 3.12Å; H190-D259 IonicContact CD2-OD2 2.86Å; H190-D259 IonicContact CE1-OD2 2.6Å; H190-D259 IonicContact NE2-OD2 2.73Å; H190-D259 PolarHBondContact NE2-OD2 3.25Å; H190-V353 HydrophobicContact CB-CG1 4.12Å
191	S	97.4	Very high	96.7	Very high	25 Å²	25	10.7 Å²	10.7	18%	0.175	5%	0.051	C	C	.	.	H	α-helix	trans	-64.2	-34.7	170.6	51.7	0	0	0	0	111.3	K187 Y188 N193 E373 A374	K187-S191 WeakPolarHBondContact O-CB 3.48Å; K187-S191 PolarHBondContact O-N 2.96Å; K187-S191 PolarHBondContact O-OG 3.36Å; Y188-S191 WeakPolarHBondContact CA-OG 3.33Å; Y188-S191 PolarHBondContact O-OG 3.19Å; S191-N193 PolarHBondContact O-N 3.38Å; S191-E373 WeakPolarHBondContact OG-CA 3.44Å; S191-E373 WeakPolarHBondContact OG-CB 3.24Å; S191-A374 PolarHBondContact OG-N 3.41Å; S191-A374 VanDerWaalsContact OG-N 3.1Å
192	A	96.1	Very high	96.5	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	4.2	171.9	0	0	0	0	0	115.2	F127 Y188 I189 H190 V194 A374 P377 F378	F127-A192 HydrophobicContact CE1-CB 3.49Å; F127-A192 VanDerWaalsContact CE1-CB 3.49Å; F127-A192 HydrophobicContact CZ-CB 3.94Å; Y188-A192 PolarHBondContact O-N 3.04Å; I189-A192 WeakPolarHBondContact O-CB 3.49Å; I189-A192 PolarHBondContact O-N 3.18Å; H190-A192 VanDerWaalsContact C-N 3.27Å; A192-V194 HydrophobicContact CB-CG2 4.26Å; A192-V194 PolarHBondContact O-N 2.86Å; A192-A374 HydrophobicContact CB-CB 3.57Å; A192-P377 CarbonylContact O-C 3.57Å; A192-P377 WeakPolarHBondContact O-CA 3.11Å; A192-F378 HydrophobicContact CB-CD2 4.12Å; A192-F378 HydrophobicContact CB-CE2 4.4Å; A192-F378 PolarHBondContact O-N 2.87Å
193	N	93.6	Very high	96.4	Very high	51 Å²	51	13 Å²	13	27%	0.273	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	26.9	-171.9	-157.2	54.1	0	0	0	114.9	H190 S191 I222 A223 P377	H190-N193 PolarHBondContact O-N 3.26Å; H190-N193 VanDerWaalsContact O-N 3.15Å; S191-N193 PolarHBondContact O-N 3.38Å; N193-I222 WeakPolarHBondContact ND2-CG2 3.28Å; N193-I222 WeakPolarHBondContact O-CA 3.45Å; N193-A223 PolarHBondContact ND2-O 3.2Å; N193-A223 PolarHBondContact O-N 2.8Å; N193-P377 HydrophobicContact CB-CB 3.98Å
194	V	93.6	Very high	96.4	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	145.9	176.6	178.2	0	0	0	0	110.3	I123 F127 I189 H190 A192 A220 R221 I222 F378	I123-V194 HydrophobicContact CD1-CG1 4.15Å; F127-V194 HydrophobicContact CE1-CG2 4.45Å; F127-V194 HydrophobicContact CZ-CB 4.07Å; F127-V194 HydrophobicContact CZ-CG1 4.4Å; F127-V194 HydrophobicContact CZ-CG2 3.9Å; I189-V194 HydrophobicContact CG2-CB 3.89Å; I189-V194 HydrophobicContact CG2-CG1 3.9Å; I189-V194 WeakPolarHBondContact O-CB 3.39Å; I189-V194 PolarHBondContact O-N 3.11Å; I189-V194 VanDerWaalsContact O-N 3.11Å; H190-V194 PolarHBondContact CD2-O 3.35Å; H190-V194 VanDerWaalsContact CD2-O 3.27Å; A192-V194 HydrophobicContact CB-CG2 4.26Å; A192-V194 PolarHBondContact O-N 2.86Å; V194-A220 HydrophobicContact CG1-CB 4.15Å; V194-R221 WeakPolarHBondContact CA-O 3.1Å; V194-I222 HydrophobicContact CG2-CD1 4.25Å; V194-F378 HydrophobicContact CG2-CB 4.21Å; V194-F378 HydrophobicContact CG2-CD2 3.61Å; V194-F378 HydrophobicContact CG2-CE2 4.13Å; V194-F378 HydrophobicContact CG2-CG 3.96Å
195	L	93	Very high	96.4	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	132.8	169.1	-54.6	178.3	0	0	0	108.8	R197 A220 R221 A223 K256 I258 D259	L195-R197 HydrophobicContact CB-CG 3.77Å; L195-A220 CarbonylContact O-C 3.54Å; L195-A220 WeakPolarHBondContact O-CA 3.17Å; L195-A220 WeakPolarHBondContact O-CB 3.4Å; L195-R221 PolarHBondContact N-O 3.37Å; L195-R221 PolarHBondContact O-N 3.28Å; L195-R221 VanDerWaalsContact O-N 3.09Å; L195-A223 HydrophobicContact CD1-CB 3.94Å; L195-A223 HydrophobicContact CD2-CB 3.96Å; L195-A223 HydrophobicContact CG-CB 3.82Å; L195-K256 HydrophobicContact CD2-CB 4.41Å; L195-K256 HydrophobicContact CD2-CG 4.04Å; L195-I258 HydrophobicContact CD1-CD1 4.06Å; L195-D259 WeakPolarHBondContact CA-OD2 3.29Å
196	H	94.6	Very high	96.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.075	C	C	.	.			trans	-77.5	-45.6	-178.4	-172.2	-55.9	0	0	0	111.9	D198 L199 N203 I214 C215 D216 F217 D259	H196-D198 PolarHBondContact CE1-O 3.01Å; H196-D198 PolarHBondContact ND1-N 3.38Å; H196-D198 PolarHBondContact O-N 3.3Å; H196-L199 HydrophobicContact CB-CD1 4.48Å; H196-L199 HydrophobicContact CB-CD2 4.21Å; H196-L199 HydrophobicContact CB-CG 3.95Å; H196-N203 PolarHBondContact CE1-ND2 3.49Å; H196-N203 VanDerWaalsContact CE1-ND2 3.32Å; H196-I214 VanDerWaalsContact CD2-CG2 3.42Å; H196-I214 WeakPolarHBondContact CD2-CG2 3.42Å; H196-I214 WeakPolarHBondContact NE2-CG2 3.43Å; H196-C215 PolarHBondContact CE1-O 3.29Å; H196-C215 PolarHBondContact NE2-O 3.11Å; H196-D216 PolarHBondContact CE1-O 3.05Å; H196-F217 AromaticContact CD2-CE1 3.77Å; H196-F217 AromaticContact CD2-CZ 3.93Å; H196-F217 AromaticContact NE2-CE2 3.86Å; H196-D259 PolarHBondContact N-OD1 3.26Å; H196-D259 PolarHBondContact N-OD2 2.89Å
197	R	91.8	Very high	96.1	Very high	57 Å²	57	16 Å²	16	22%	0.215	8%	0.083	C	C	.	.	S	Bend	trans	69.3	-0.3	171.9	-51.2	170.3	76.2	-131.4	13.9	116.1	L195 L219 I258 D259	L195-R197 HydrophobicContact CB-CG 3.77Å; R197-L219 PolarHBondContact NH1-O 3.48Å; R197-I258 HydrophobicContact CG-CD1 3.89Å; R197-D259 PolarHBondContact N-OD1 3.21Å
198	D	92.3	Very high	95.8	Very high	16 Å²	16	21 Å²	21	9%	0.086	12%	0.115	C	C	.	.			trans	-147.1	33.5	177.5	-162	20.8	0	0	0	112.9	H196 K200 N203 L219	H196-D198 PolarHBondContact CE1-O 3.01Å; H196-D198 PolarHBondContact ND1-N 3.38Å; H196-D198 PolarHBondContact O-N 3.3Å; D198-K200 PolarHBondContact O-N 3.12Å; D198-K200 WeakPolarHBondContact OD1-CE 3.26Å; D198-K200 IonicContact OD1-NZ 3.48Å; D198-K200 PolarHBondContact OD1-NZ 3.1Å; D198-K200 IonicContact OD2-NZ 3.94Å; D198-K200 PolarHBondContact OD2-NZ 3.04Å; D198-N203 PolarHBondContact O-ND2 3.44Å; D198-L219 HydrophobicContact CB-CB 4.28Å; D198-L219 HydrophobicContact CB-CD1 3.94Å; D198-L219 WeakPolarHBondContact OD2-CD1 3.39Å
199	L	96.9	Very high	95.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.139	C	C	.	.			trans	-62.9	125.7	172.2	-71.6	176.6	0	0	0	110.8	L186 H196 L204 I214 Y242 D259 V263 I266	L186-L199 HydrophobicContact CD1-CD1 4.05Å; L186-L199 HydrophobicContact CD2-CD1 4.13Å; H196-L199 HydrophobicContact CB-CD1 4.48Å; H196-L199 HydrophobicContact CB-CD2 4.21Å; H196-L199 HydrophobicContact CB-CG 3.95Å; L199-L204 HydrophobicContact CD2-CD2 4.5Å; L199-I214 HydrophobicContact CD2-CG2 3.86Å; L199-Y242 WeakPolarHBondContact O-CB 3.38Å; L199-D259 HydrophobicContact CD1-CB 3.84Å; L199-V263 HydrophobicContact CD1-CG2 3.91Å; L199-I266 HydrophobicContact CB-CD1 4.22Å
200	K	96.9	Very high	95.5	Very high	22 Å²	22	26.1 Å²	26.1	10%	0.096	15%	0.15	C	C	.	.			trans	-164.8	160.9	-178.6	61.7	-161.7	168.2	-161.7	0	109.6	D198 S202 N203 Y242	D198-K200 PolarHBondContact O-N 3.12Å; D198-K200 WeakPolarHBondContact OD1-CE 3.26Å; D198-K200 IonicContact OD1-NZ 3.48Å; D198-K200 PolarHBondContact OD1-NZ 3.1Å; D198-K200 IonicContact OD2-NZ 3.94Å; D198-K200 PolarHBondContact OD2-NZ 3.04Å; K200-S202 WeakPolarHBondContact CE-OG 3.32Å; K200-S202 WeakPolarHBondContact CG-OG 3.43Å; K200-S202 PolarHBondContact O-N 3.11Å; K200-N203 VanDerWaalsContact CE-ND2 3.29Å; K200-N203 WeakPolarHBondContact CE-ND2 3.14Å; K200-N203 WeakPolarHBondContact CE-OD1 3.5Å; K200-N203 HydrophobicContact CG-CB 4.16Å; K200-N203 PolarHBondContact O-N 3.29Å; K200-Y242 HydrophobicContact CB-CD1 4.37Å; K200-Y242 HydrophobicContact CB-CD2 3.45Å; K200-Y242 VanDerWaalsContact CB-CD2 3.45Å; K200-Y242 HydrophobicContact CB-CE1 4.39Å; K200-Y242 HydrophobicContact CB-CE2 3.46Å; K200-Y242 VanDerWaalsContact CB-CE2 3.46Å; K200-Y242 HydrophobicContact CB-CG 3.95Å
201	P	97.9	Very high	95.6	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-60.8	-20.3	-174.6	-25.8	37	0	0	0	115.6	L161 Y162 N203 Y242 I266	L161-P201 CarbonylContact C-O 3.53Å; L161-P201 WeakPolarHBondContact CA-O 3.47Å; L161-P201 HydrophobicContact CB-CB 3.93Å; L161-P201 WeakPolarHBondContact CB-O 3.38Å; L161-P201 HydrophobicContact CD2-CB 4.1Å; L161-P201 HydrophobicContact CD2-CG 4.5Å; L161-P201 HydrophobicContact CG-CB 3.98Å; L161-P201 PolarHBondContact N-O 3.48Å; L161-P201 VanDerWaalsContact N-O 3.1Å; Y162-P201 PolarHBondContact N-O 3.23Å; P201-N203 VanDerWaalsContact C-N 3.31Å; P201-Y242 VanDerWaalsContact CD-CE1 3.46Å; P201-Y242 VanDerWaalsContact CD-OH 3.24Å; P201-Y242 WeakPolarHBondContact CD-OH 3.37Å; P201-Y242 HydrophobicContact CG-CE1 4.18Å; P201-I266 HydrophobicContact CG-CG1 4.19Å; P201-I266 HydrophobicContact CG-CG2 4.44Å
202	S	95.3	Very high	95.6	Very high	46 Å²	46	27.8 Å²	27.8	32%	0.322	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-76.6	-17.8	173.3	64.4	0	0	0	0	113.8	K200	K200-S202 WeakPolarHBondContact CE-OG 3.32Å; K200-S202 WeakPolarHBondContact CG-OG 3.43Å; K200-S202 PolarHBondContact O-N 3.11Å
203	N	96.8	Very high	95.7	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.053	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-103.8	14	-177.1	-66.5	27.8	0	0	0	111.5	H196 D198 K200 P201 C215 D216	H196-N203 PolarHBondContact CE1-ND2 3.49Å; H196-N203 VanDerWaalsContact CE1-ND2 3.32Å; D198-N203 PolarHBondContact O-ND2 3.44Å; K200-N203 VanDerWaalsContact CE-ND2 3.29Å; K200-N203 WeakPolarHBondContact CE-ND2 3.14Å; K200-N203 WeakPolarHBondContact CE-OD1 3.5Å; K200-N203 HydrophobicContact CG-CB 4.16Å; K200-N203 PolarHBondContact O-N 3.29Å; P201-N203 VanDerWaalsContact C-N 3.31Å; N203-C215 VanDerWaalsContact CA-SG 3.58Å; N203-C215 PolarHBondContact O-N 3.1Å; N203-C215 PolarHBondContact O-SG 2.98Å; N203-D216 WeakPolarHBondContact ND2-CB 3.39Å; N203-D216 PolarHBondContact ND2-OD2 3.15Å
204	L	98.4	Very high	96	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	95.9	174.8	-58.6	179.9	0	0	0	107.2	D160 L161 I182 L199 L212 I214 I266	D160-L204 WeakPolarHBondContact CA-O 3.38Å; L161-L204 HydrophobicContact CB-CB 4.15Å; L161-L204 HydrophobicContact CD2-CD1 3.81Å; L161-L204 PolarHBondContact N-O 2.93Å; I182-L204 HydrophobicContact CD1-CD1 3.54Å; I182-L204 HydrophobicContact CG1-CD1 3.81Å; I182-L204 HydrophobicContact CG1-CD2 4.19Å; L199-L204 HydrophobicContact CD2-CD2 4.5Å; L204-L212 HydrophobicContact CB-CD1 4.31Å; L204-L212 HydrophobicContact CB-CG 4.47Å; L204-L212 HydrophobicContact CD2-CD2 4.3Å; L204-I214 HydrophobicContact CD2-CB 4.47Å; L204-I214 HydrophobicContact CD2-CG1 3.8Å; L204-I266 HydrophobicContact CD1-CD1 3.99Å; L204-I266 HydrophobicContact CD1-CG2 3.98Å
205	L	98.3	Very high	96.1	Very high	37 Å²	37	27.9 Å²	27.9	19%	0.194	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	142.9	-179.1	-54	-179.2	0	0	0	109.8	I133 M157 T159 D160 L212 K213 C215	I133-L205 HydrophobicContact CD1-CD1 4.33Å; I133-L205 HydrophobicContact CG1-CD1 4.48Å; M157-L205 HydrophobicContact CB-CB 3.74Å; M157-L205 HydrophobicContact CB-CD1 4.3Å; M157-L205 HydrophobicContact CE-CB 4.22Å; M157-L205 HydrophobicContact CG-CB 3.72Å; M157-L205 HydrophobicContact CG-CD1 3.97Å; M157-L205 HydrophobicContact CG-CG 4.5Å; T159-L205 WeakPolarHBondContact O-CA 3Å; D160-L205 HydrophobicContact CB-CD2 4.22Å; L205-L212 CarbonylContact O-C 3.59Å; L205-L212 VanDerWaalsContact O-CA 3.28Å; L205-L212 WeakPolarHBondContact O-CA 3.25Å; L205-K213 PolarHBondContact N-O 3.29Å; L205-K213 PolarHBondContact O-N 2.93Å; L205-C215 HydrophobicContact CD1-CB 4.04Å; L205-C215 HydrophobicContact CG-CB 4.26Å
206	I	98	Very high	96.1	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.015	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	136.3	-175.9	-56.2	173	0	0	0	109.3	E158 T159 L161 L164 F178 D211 L212	E158-I206 PolarHBondContact N-O 3.3Å; T159-I206 HydrophobicContact CG2-CB 3.97Å; T159-I206 PolarHBondContact N-O 3.11Å; T159-I206 PolarHBondContact O-N 2.81Å; L161-I206 HydrophobicContact CB-CD1 3.86Å; L161-I206 HydrophobicContact CD1-CD1 3.85Å; L161-I206 HydrophobicContact CG-CD1 4.44Å; L164-I206 HydrophobicContact CD2-CD1 3.86Å; F178-I206 HydrophobicContact CD1-CD1 4.26Å; F178-I206 HydrophobicContact CE1-CD1 3.85Å; F178-I206 HydrophobicContact CE1-CG1 4.3Å; F178-I206 HydrophobicContact CE1-CG2 3.87Å; F178-I206 HydrophobicContact CE2-CD1 4.33Å; F178-I206 HydrophobicContact CZ-CD1 3.9Å; F178-I206 HydrophobicContact CZ-CG2 4.13Å; I206-D211 WeakPolarHBondContact CA-O 3.35Å; I206-L212 HydrophobicContact CG1-CD1 4.36Å; I206-L212 HydrophobicContact CG1-CG 4.44Å
207	N	94.7	Very high	96	Very high	32 Å²	32	29.4 Å²	29.4	17%	0.171	17%	0.165	C	C	.	.			trans	-100.3	-179	176	71.8	1.5	0	0	0	112.6	M157 E158 T209 C210 D211	M157-N207 HydrophobicContact CE-CB 3.96Å; M157-N207 HydrophobicContact SD-CB 4.29Å; E158-N207 VanDerWaalsContact OE2-CA 3.25Å; E158-N207 WeakPolarHBondContact OE2-CA 3.47Å; E158-N207 WeakPolarHBondContact OE2-CB 3.46Å; N207-T209 VanDerWaalsContact C-N 3.26Å; N207-T209 PolarHBondContact ND2-OG1 3.12Å; N207-T209 VanDerWaalsContact ND2-OG1 3.11Å; N207-T209 PolarHBondContact O-N 3.28Å; N207-T209 PolarHBondContact OD1-N 3.43Å; N207-T209 VanDerWaalsContact OD1-N 3.16Å; N207-T209 PolarHBondContact OD1-OG1 3.04Å; N207-T209 VanDerWaalsContact OD1-OG1 3.08Å; N207-C210 PolarHBondContact O-N 2.8Å; N207-C210 VanDerWaalsContact O-N 3.09Å; N207-C210 PolarHBondContact OD1-N 3.21Å; N207-C210 VanDerWaalsContact OD1-N 3.08Å; N207-D211 PolarHBondContact N-O 3.4Å; N207-D211 PolarHBondContact ND2-OD2 3.19Å; N207-D211 WeakPolarHBondContact OD1-CB 3.46Å; N207-D211 PolarHBondContact OD1-N 2.94Å; N207-D211 PolarHBondContact OD1-O 3.24Å; N207-D211 PolarHBondContact OD1-OD2 3.18Å
208	T	92.3	Very high	95.8	Very high	120 Å²	120	26.7 Å²	26.7	74%	0.736	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-23	179.3	38.4	0	0	0	0	114.8	E158 C210	E158-T208 HydrophobicContact CG-CG2 4.2Å; E158-T208 VanDerWaalsContact OE1-CB 3.24Å; E158-T208 WeakPolarHBondContact OE1-CB 3.35Å; E158-T208 WeakPolarHBondContact OE1-CG2 3.44Å; E158-T208 PolarHBondContact OE1-N 2.87Å; E158-T208 PolarHBondContact OE1-OG1 2.9Å; T208-C210 VanDerWaalsContact C-N 3.34Å
209	T	94.4	Very high	95.6	Very high	96 Å²	96	27.8 Å²	27.8	59%	0.589	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	3.2	173.7	33.6	0	0	0	0	113.8	N207 D211	N207-T209 VanDerWaalsContact C-N 3.26Å; N207-T209 PolarHBondContact ND2-OG1 3.12Å; N207-T209 VanDerWaalsContact ND2-OG1 3.11Å; N207-T209 PolarHBondContact O-N 3.28Å; N207-T209 PolarHBondContact OD1-N 3.43Å; N207-T209 VanDerWaalsContact OD1-N 3.16Å; N207-T209 PolarHBondContact OD1-OG1 3.04Å; N207-T209 VanDerWaalsContact OD1-OG1 3.08Å; T209-D211 VanDerWaalsContact C-N 3.25Å; T209-D211 WeakPolarHBondContact CB-OD2 3.47Å; T209-D211 PolarHBondContact O-N 3.27Å; T209-D211 PolarHBondContact OG1-OD2 3.44Å
210	C	96.5	Very high	95.3	Very high	33 Å²	33	27.8 Å²	27.8	22%	0.223	16%	0.16	C	C	.	.			trans	64.9	20.8	-175	-64.9	0	0	0	0	115.1	Y177 F178 Q181 N207 T208	Y177-C210 HydrophobicContact CD1-CB 4.5Å; Y177-C210 HydrophobicContact CE1-CB 4.31Å; Y177-C210 WeakPolarHBondContact CE1-O 3.43Å; F178-C210 HydrophobicContact CE1-CB 3.8Å; F178-C210 WeakPolarHBondContact CE1-O 3.31Å; F178-C210 HydrophobicContact CZ-CB 4.06Å; Q181-C210 PolarHBondContact NE2-O 3.45Å; N207-C210 PolarHBondContact O-N 2.8Å; N207-C210 VanDerWaalsContact O-N 3.09Å; N207-C210 PolarHBondContact OD1-N 3.21Å; N207-C210 VanDerWaalsContact OD1-N 3.08Å; T208-C210 VanDerWaalsContact C-N 3.34Å
211	D	97.9	Very high	94.8	Very high	60 Å²	60	28.1 Å²	28.1	32%	0.321	16%	0.161	S	C	.	.			trans	-69.3	132.7	164.8	-47.6	-65.3	0	0	0	109.2	M157 I206 N207 T209	M157-D211 WeakPolarHBondContact CE-O 3.49Å; I206-D211 WeakPolarHBondContact CA-O 3.35Å; N207-D211 PolarHBondContact N-O 3.4Å; N207-D211 PolarHBondContact ND2-OD2 3.19Å; N207-D211 WeakPolarHBondContact OD1-CB 3.46Å; N207-D211 PolarHBondContact OD1-N 2.94Å; N207-D211 PolarHBondContact OD1-O 3.24Å; N207-D211 PolarHBondContact OD1-OD2 3.18Å; T209-D211 VanDerWaalsContact C-N 3.25Å; T209-D211 WeakPolarHBondContact CB-OD2 3.47Å; T209-D211 PolarHBondContact O-N 3.27Å; T209-D211 PolarHBondContact OG1-OD2 3.44Å
212	L	98.6	Very high	94.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	133.1	-173.6	178.5	153.1	0	0	0	110.9	N131 F178 Q181 I182 L204 L205 I206 I214	N131-L212 VanDerWaalsContact CA-O 3.25Å; N131-L212 WeakPolarHBondContact CA-O 3.3Å; N131-L212 WeakPolarHBondContact CB-O 3.29Å; N131-L212 PolarHBondContact ND2-O 3.08Å; F178-L212 HydrophobicContact CB-CD1 4Å; F178-L212 HydrophobicContact CD1-CB 4.35Å; F178-L212 HydrophobicContact CD1-CD1 3.91Å; F178-L212 HydrophobicContact CG-CD1 4.24Å; Q181-L212 HydrophobicContact CB-CB 4Å; Q181-L212 HydrophobicContact CB-CD2 4.24Å; I182-L212 HydrophobicContact CD1-CD1 4.1Å; I182-L212 HydrophobicContact CG1-CD1 3.75Å; I182-L212 HydrophobicContact CG1-CD2 3.74Å; I182-L212 HydrophobicContact CG1-CG 4.44Å; L204-L212 HydrophobicContact CB-CD1 4.31Å; L204-L212 HydrophobicContact CB-CG 4.47Å; L204-L212 HydrophobicContact CD2-CD2 4.3Å; L205-L212 CarbonylContact O-C 3.59Å; L205-L212 VanDerWaalsContact O-CA 3.28Å; L205-L212 WeakPolarHBondContact O-CA 3.25Å; I206-L212 HydrophobicContact CG1-CD1 4.36Å; I206-L212 HydrophobicContact CG1-CG 4.44Å; L212-I214 HydrophobicContact CD2-CG1 4.47Å
213	K	98.8	Very high	93.6	Very high	39 Å²	39	26.8 Å²	26.8	17%	0.17	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	126.2	176.9	-65	-174.1	-173.2	-68.5	0	112.5	E130 N131 I133 M157 L205	E130-K213 PolarHBondContact O-NZ 3.47Å; N131-K213 WeakPolarHBondContact O-CA 3.49Å; I133-K213 HydrophobicContact CB-CB 4.47Å; I133-K213 HydrophobicContact CD1-CD 3.83Å; M157-K213 HydrophobicContact CE-CB 4.16Å; M157-K213 HydrophobicContact CE-CD 4.08Å; M157-K213 HydrophobicContact CE-CG 3.9Å; M157-K213 HydrophobicContact SD-CD 3.79Å; M157-K213 HydrophobicContact SD-CG 4.3Å; L205-K213 PolarHBondContact N-O 3.29Å; L205-K213 PolarHBondContact O-N 2.93Å
214	I	98.7	Very high	92.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	136	173.2	-59.2	169	0	0	0	110	N131 I133 I189 H196 L199 L204 L212 F217	N131-I214 WeakPolarHBondContact O-CG1 3.29Å; N131-I214 PolarHBondContact O-N 3.11Å; I133-I214 WeakPolarHBondContact CG2-O 3.18Å; I133-I214 PolarHBondContact N-O 3.21Å; I189-I214 HydrophobicContact CD1-CD1 3.87Å; I189-I214 HydrophobicContact CD1-CG2 4.19Å; H196-I214 VanDerWaalsContact CD2-CG2 3.42Å; H196-I214 WeakPolarHBondContact CD2-CG2 3.42Å; H196-I214 WeakPolarHBondContact NE2-CG2 3.43Å; L199-I214 HydrophobicContact CD2-CG2 3.86Å; L204-I214 HydrophobicContact CD2-CB 4.47Å; L204-I214 HydrophobicContact CD2-CG1 3.8Å; L212-I214 HydrophobicContact CD2-CG1 4.47Å; I214-F217 HydrophobicContact CG2-CE2 4.19Å; I214-F217 HydrophobicContact CG2-CZ 3.94Å
215	C	96.3	Very high	90.7	Very high	14 Å²	14	33.3 Å²	33.3	10%	0.095	19%	0.194	C	C	.	.			trans	-138.4	177.9	-179.2	73.3	0	0	0	0	114.6	I133 H196 N203 L205	I133-C215 HydrophobicContact CB-CB 4.18Å; I133-C215 HydrophobicContact CG2-CB 3.55Å; H196-C215 PolarHBondContact CE1-O 3.29Å; H196-C215 PolarHBondContact NE2-O 3.11Å; N203-C215 VanDerWaalsContact CA-SG 3.58Å; N203-C215 PolarHBondContact O-N 3.1Å; N203-C215 PolarHBondContact O-SG 2.98Å; L205-C215 HydrophobicContact CD1-CB 4.04Å; L205-C215 HydrophobicContact CG-CB 4.26Å
216	D	92.3	Very high	88.7	Confident	32 Å²	32	36.7 Å²	36.7	17%	0.171	22%	0.215	C	C	.	.			trans	58.6	72.5	-179.9	-175.2	21.8	0	0	0	114.3	Y85 E120 H196 N203 G218	Y85-D216 PolarHBondContact OH-OD1 3.23Å; E120-D216 WeakPolarHBondContact OE1-CA 3.26Å; H196-D216 PolarHBondContact CE1-O 3.05Å; N203-D216 WeakPolarHBondContact ND2-CB 3.39Å; N203-D216 PolarHBondContact ND2-OD2 3.15Å; D216-G218 VanDerWaalsContact C-N 3.26Å; D216-G218 PolarHBondContact O-N 3.16Å
217	F	93.3	Very high	86.7	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-83.9	10.1	178.8	-73.9	-97	0	0	0	113.6	E120 I123 L124 F127 I132 I189 H196 I214 L219 A220	E120-F217 HydrophobicContact CG-CB 4.43Å; I123-F217 HydrophobicContact CD1-CB 4.43Å; I123-F217 HydrophobicContact CG2-CB 4.36Å; I123-F217 HydrophobicContact CG2-CD1 3.82Å; I123-F217 HydrophobicContact CG2-CE1 4.36Å; I123-F217 HydrophobicContact CG2-CG 4.12Å; L124-F217 HydrophobicContact CD1-CD2 4.42Å; L124-F217 HydrophobicContact CD2-CD2 3.47Å; L124-F217 VanDerWaalsContact CD2-CD2 3.47Å; L124-F217 HydrophobicContact CD2-CE2 3.63Å; L124-F217 HydrophobicContact CD2-CG 4.2Å; L124-F217 HydrophobicContact CD2-CZ 4.45Å; L124-F217 HydrophobicContact CG-CD2 4.12Å; F127-F217 HydrophobicContact CD2-CE1 4.22Å; F127-F217 HydrophobicContact CD2-CZ 4.33Å; F127-F217 HydrophobicContact CE2-CD1 4.32Å; F127-F217 AromaticContact CE2-CE1 3.75Å; F127-F217 HydrophobicContact CE2-CE1 3.75Å; F127-F217 HydrophobicContact CE2-CZ 4.25Å; I132-F217 HydrophobicContact CG2-CE2 3.84Å; I132-F217 HydrophobicContact CG2-CZ 3.89Å; I189-F217 HydrophobicContact CD1-CE1 3.77Å; I189-F217 HydrophobicContact CD1-CZ 3.7Å; I189-F217 HydrophobicContact CG1-CE1 4.01Å; I189-F217 HydrophobicContact CG1-CZ 4.17Å; I189-F217 HydrophobicContact CG2-CE1 4.34Å; H196-F217 AromaticContact CD2-CE1 3.77Å; H196-F217 AromaticContact CD2-CZ 3.93Å; H196-F217 AromaticContact NE2-CE2 3.86Å; I214-F217 HydrophobicContact CG2-CE2 4.19Å; I214-F217 HydrophobicContact CG2-CZ 3.94Å; F217-L219 VanDerWaalsContact C-N 3.27Å; F217-L219 PolarHBondContact O-N 3.21Å; F217-A220 HydrophobicContact CB-CB 4.45Å; F217-A220 HydrophobicContact CD1-CB 4.42Å; F217-A220 WeakPolarHBondContact O-CB 3.18Å; F217-A220 PolarHBondContact O-N 2.92Å; F217-A220 VanDerWaalsContact O-N 3.13Å
218	G	88.2	Confident	84.8	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.01	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-60.9	-33.1	-175	0	0	0	0	0	114.1	R116 R119 D216	R116-G218 WeakPolarHBondContact CG-O 3.11Å; R119-G218 PolarHBondContact NH1-O 3.14Å; R119-G218 VanDerWaalsContact NH1-O 3.08Å; D216-G218 VanDerWaalsContact C-N 3.26Å; D216-G218 PolarHBondContact O-N 3.16Å
219	L	87.9	Confident	82.8	Confident	38 Å²	38	38.4 Å²	38.4	20%	0.199	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-89.4	-2.5	179.1	-72	-176.8	0	0	0	115	R197 D198 F217	R197-L219 PolarHBondContact NH1-O 3.48Å; D198-L219 HydrophobicContact CB-CB 4.28Å; D198-L219 HydrophobicContact CB-CD1 3.94Å; D198-L219 WeakPolarHBondContact OD2-CD1 3.39Å; F217-L219 VanDerWaalsContact C-N 3.27Å; F217-L219 PolarHBondContact O-N 3.21Å
220	A	89.7	Confident	80.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.222	C	C	.	.			trans	-58.4	163.5	-179.4	0	0	0	0	0	112.8	R119 I123 V194 L195 F217	R119-A220 WeakPolarHBondContact CD-O 3.3Å; R119-A220 PolarHBondContact NE-O 2.95Å; I123-A220 HydrophobicContact CD1-CB 3.72Å; V194-A220 HydrophobicContact CG1-CB 4.15Å; L195-A220 CarbonylContact O-C 3.54Å; L195-A220 WeakPolarHBondContact O-CA 3.17Å; L195-A220 WeakPolarHBondContact O-CB 3.4Å; F217-A220 HydrophobicContact CB-CB 4.45Å; F217-A220 HydrophobicContact CD1-CB 4.42Å; F217-A220 WeakPolarHBondContact O-CB 3.18Å; F217-A220 PolarHBondContact O-N 2.92Å; F217-A220 VanDerWaalsContact O-N 3.13Å
221	R	87	Confident	77.6	Confident	29 Å²	29	40.4 Å²	40.4	11%	0.109	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	166.2	168.2	-78	-62.3	-177.9	-69.1	2.5	110.7	V194 L195 H229 D385	V194-R221 WeakPolarHBondContact CA-O 3.1Å; L195-R221 PolarHBondContact N-O 3.37Å; L195-R221 PolarHBondContact O-N 3.28Å; L195-R221 VanDerWaalsContact O-N 3.09Å; R221-H229 WeakPolarHBondContact CB-NE2 3.32Å; R221-H229 WeakPolarHBondContact CG-NE2 3.49Å; R221-D385 IonicContact CZ-OD1 3.94Å; R221-D385 IonicContact CZ-OD2 3.36Å; R221-D385 VanDerWaalsContact CZ-OD2 3.23Å; R221-D385 IonicContact NE-OD1 3.73Å; R221-D385 IonicContact NE-OD2 3.55Å; R221-D385 PolarHBondContact NE-OD2 3.3Å; R221-D385 IonicContact NH2-OD1 2.74Å; R221-D385 PolarHBondContact NH2-OD1 3.31Å; R221-D385 IonicContact NH2-OD2 2.74Å; R221-D385 PolarHBondContact NH2-OD2 2.93Å
222	I	86.4	Confident	74.7	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.041	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	143.1	165	-47.3	-42.2	0	0	0	106.9	N193 V194 D224 F378 F380	N193-I222 WeakPolarHBondContact ND2-CG2 3.28Å; N193-I222 WeakPolarHBondContact O-CA 3.45Å; V194-I222 HydrophobicContact CG2-CD1 4.25Å; I222-D224 PolarHBondContact O-N 3.41Å; I222-F378 HydrophobicContact CD1-CB 3.41Å; I222-F378 VanDerWaalsContact CD1-CB 3.41Å; I222-F378 HydrophobicContact CD1-CD1 4.28Å; I222-F378 HydrophobicContact CD1-CG 4.09Å; I222-F378 HydrophobicContact CG1-CB 4.3Å; I222-F380 HydrophobicContact CB-CD1 4.39Å; I222-F380 HydrophobicContact CB-CE1 3.83Å; I222-F380 HydrophobicContact CB-CZ 4.2Å; I222-F380 HydrophobicContact CG2-CE1 3.89Å; I222-F380 HydrophobicContact CG2-CE2 4.31Å; I222-F380 HydrophobicContact CG2-CZ 3.75Å
223	A	81.4	Confident	71.9	Confident	11 Å²	11	50.6 Å²	50.6	9%	0.091	28%	0.281	C	S	.	.			trans	-78.2	111.6	177.2	0	0	0	0	0	110	N193 L195	N193-A223 PolarHBondContact ND2-O 3.2Å; N193-A223 PolarHBondContact O-N 2.8Å; L195-A223 HydrophobicContact CD1-CB 3.94Å; L195-A223 HydrophobicContact CD2-CB 3.96Å; L195-A223 HydrophobicContact CG-CB 3.82Å
224	D	72.3	Confident	69.1	Low	19 Å²	19	53.9 Å²	53.9	10%	0.102	30%	0.304	C	S	.	.			trans	-109.3	117.2	167.8	-152	-20.5	0	0	0	112.2	I222 V226 H227 F380	I222-D224 PolarHBondContact O-N 3.41Å; D224-V226 VanDerWaalsContact C-N 3.26Å; D224-V226 WeakPolarHBondContact OD1-CA 3.4Å; D224-V226 VanDerWaalsContact OD1-CB 3.3Å; D224-V226 WeakPolarHBondContact OD1-CB 3.28Å; D224-V226 PolarHBondContact OD1-N 2.98Å; D224-H227 PolarHBondContact OD1-N 2.86Å; D224-H227 WeakPolarHBondContact OD2-CA 3.31Å; D224-H227 WeakPolarHBondContact OD2-CB 3.24Å; D224-H227 IonicContact OD2-CG 3.63Å; D224-H227 PolarHBondContact OD2-N 3Å; D224-H227 IonicContact OD2-ND1 3.39Å; D224-H227 PolarHBondContact OD2-ND1 2.85Å; D224-F380 HydrophobicContact CB-CE1 3.6Å; D224-F380 HydrophobicContact CB-CE2 4.34Å; D224-F380 HydrophobicContact CB-CZ 3.35Å; D224-F380 VanDerWaalsContact CG-CZ 3.46Å
225	P	62.7	Low	66.4	Low	128 Å²	128	58.1 Å²	58.1	83%	0.831	32%	0.324	S	S	*	.	S	Bend	trans	-72.9	-14.2	164.9	-16.7	32.2	0	0	0	114.2
226	V	56	Low	64.4	Low	107 Å²	107	64 Å²	64	65%	0.648	35%	0.345	S	S	*	.	S	Bend	trans	-111.8	-61.3	-166	-171.4	0	0	0	0	112.2	D224 D228	D224-V226 VanDerWaalsContact C-N 3.26Å; D224-V226 WeakPolarHBondContact OD1-CA 3.4Å; D224-V226 VanDerWaalsContact OD1-CB 3.3Å; D224-V226 WeakPolarHBondContact OD1-CB 3.28Å; D224-V226 PolarHBondContact OD1-N 2.98Å; V226-D228 PolarHBondContact O-N 3.36Å
227	H	54.5	Low	62.2	Low	136 Å²	136	67.5 Å²	67.5	63%	0.63	37%	0.367	S	S	*	.	S	Bend	trans	-96.1	81.3	178.2	-42.9	87.5	0	0	0	110.7	D224 H229	D224-H227 PolarHBondContact OD1-N 2.86Å; D224-H227 WeakPolarHBondContact OD2-CA 3.31Å; D224-H227 WeakPolarHBondContact OD2-CB 3.24Å; D224-H227 IonicContact OD2-CG 3.63Å; D224-H227 PolarHBondContact OD2-N 3Å; D224-H227 IonicContact OD2-ND1 3.39Å; D224-H227 PolarHBondContact OD2-ND1 2.85Å; H227-H229 PolarHBondContact O-N 3.2Å
228	D	54.8	Low	60.4	Low	29 Å²	29	68.5 Å²	68.5	16%	0.155	38%	0.376	C	S	.	.			trans	-45.8	131.9	169	-171.6	38.8	0	0	0	112	V226 T230 K252	V226-D228 PolarHBondContact O-N 3.36Å; D228-T230 VanDerWaalsContact C-N 3.28Å; D228-T230 WeakPolarHBondContact O-CG2 3.36Å; D228-T230 PolarHBondContact O-N 2.81Å; D228-K252 HydrophobicContact CB-CD 4.44Å; D228-K252 WeakPolarHBondContact OD1-CA 3.32Å; D228-K252 WeakPolarHBondContact OD2-CD 3.36Å; D228-K252 VanDerWaalsContact OD2-CE 3.25Å; D228-K252 WeakPolarHBondContact OD2-CE 3.23Å; D228-K252 WeakPolarHBondContact OD2-CG 3.34Å; D228-K252 IonicContact OD2-NZ 2.69Å
229	H	50.4	Low	59.6	Low	27 Å²	27	71.3 Å²	71.3	13%	0.125	39%	0.393	C	S	.	.			trans	-68.4	85.4	177.3	-48.6	-75.7	0	0	0	110.1	R221 H227 G231 E383	R221-H229 WeakPolarHBondContact CB-NE2 3.32Å; R221-H229 WeakPolarHBondContact CG-NE2 3.49Å; H227-H229 PolarHBondContact O-N 3.2Å; H229-G231 PolarHBondContact O-N 2.83Å; H229-E383 IonicContact CE1-OE1 3.02Å; H229-E383 PolarHBondContact CE1-OE1 2.96Å; H229-E383 VanDerWaalsContact CE1-OE1 3.26Å; H229-E383 IonicContact CE1-OE2 2.96Å; H229-E383 PolarHBondContact CE1-OE2 3.34Å; H229-E383 IonicContact ND1-OE1 2.63Å; H229-E383 IonicContact ND1-OE2 3.23Å; H229-E383 PolarHBondContact ND1-OE2 3.28Å
230	T	42.2	Very low	59.5	Low	121 Å²	121	71.7 Å²	71.7	74%	0.742	39%	0.391	S	S	*	.			trans	-68.3	-11.4	-177.9	56.3	0	0	0	0	113.8	D228 F232	D228-T230 VanDerWaalsContact C-N 3.28Å; D228-T230 WeakPolarHBondContact O-CG2 3.36Å; D228-T230 PolarHBondContact O-N 2.81Å; T230-F232 PolarHBondContact O-N 3.39Å; T230-F232 VanDerWaalsContact O-N 3.12Å
231	G	40.6	Very low	59.7	Low	50 Å²	50	75.5 Å²	75.5	52%	0.515	41%	0.406	S	S	.	.	S	Bend	trans	-53.1	116.4	170.5	0	0	0	0	0	110.4	H229 L233	H229-G231 PolarHBondContact O-N 2.83Å; G231-L233 PolarHBondContact O-N 2.69Å
232	F	35.7	Very low	60.1	Low	202 Å²	202	74.9 Å²	74.9	89%	0.886	40%	0.404	S	S	*	.			trans	-50	102.1	-176.4	-128.7	-94.7	0	0	0	109.5	T230 T234	T230-F232 PolarHBondContact O-N 3.39Å; T230-F232 VanDerWaalsContact O-N 3.12Å; F232-T234 PolarHBondContact O-N 3.29Å; F232-T234 VanDerWaalsContact O-N 3.16Å
233	L	41.2	Very low	60.3	Low	72 Å²	72	78.2 Å²	78.2	38%	0.377	42%	0.416	S	S	.	.			trans	-53	123.9	-167.4	-68.3	148.8	0	0	0	108.9	G231 E235 Y254	G231-L233 PolarHBondContact O-N 2.69Å; L233-E235 PolarHBondContact O-N 2.96Å; L233-Y254 HydrophobicContact CD1-CE2 4.32Å; L233-Y254 WeakPolarHBondContact CD1-OH 3.42Å; L233-Y254 HydrophobicContact CD2-CE2 4.11Å; L233-Y254 VanDerWaalsContact CD2-OH 3.31Å; L233-Y254 WeakPolarHBondContact CD2-OH 3.49Å
234	T	39.8	Very low	60.8	Low	107 Å²	107	77.8 Å²	77.8	66%	0.656	41%	0.412	S	S	*	.			trans	-69.1	88.3	-172.4	-21.2	0	0	0	0	109.8	F232	F232-T234 PolarHBondContact O-N 3.29Å; F232-T234 VanDerWaalsContact O-N 3.16Å
235	E	42.5	Very low	61.7	Low	89 Å²	89	76.9 Å²	76.9	42%	0.416	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	160	-165.5	-149.3	-177.3	163.9	0	0	109.5	L233 V237	L233-E235 PolarHBondContact O-N 2.96Å; E235-V237 PolarHBondContact O-N 3.14Å
236	Y	53.2	Low	62.8	Low	139 Å²	139	71.4 Å²	71.4	55%	0.545	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	-7.9	170.9	-52.7	-86.3	0	0	0	122.4
237	V	45.8	Very low	64	Low	104 Å²	104	68 Å²	68	63%	0.63	35%	0.348	S	S	*	.	S	Bend	trans	-99	17	-171.8	-148.2	0	0	0	0	117.1	E235	E235-V237 PolarHBondContact O-N 3.14Å
238	A	57	Low	65.1	Low	22 Å²	22	61.9 Å²	61.9	18%	0.182	32%	0.32	C	S	.	.	S	Bend	trans	-150.1	162.4	179.8	0	0	0	0	0	114.2	R240	A238-R240 PolarHBondContact O-N 3.49Å
239	T	70.1	Confident	66	Low	60 Å²	60	60.7 Å²	60.7	37%	0.368	31%	0.314	S	S	.	.			trans	-56.1	129.9	175	-50.6	0	0	0	0	110.8	W241 Y242	T239-W241 HydrophobicContact CG2-CB 4.28Å; T239-W241 HydrophobicContact CG2-CD2 3.78Å; T239-W241 HydrophobicContact CG2-CE3 3.94Å; T239-W241 HydrophobicContact CG2-CG 3.92Å; T239-Y242 HydrophobicContact CG2-CD2 4.26Å; T239-Y242 HydrophobicContact CG2-CE2 3.81Å
240	R	85.5	Confident	66.8	Low	45 Å²	45	60.8 Å²	60.8	17%	0.17	32%	0.315	C	S	.	.			trans	-93.8	-13.8	-173.7	-68.5	172.5	-172.9	72.4	-4.4	114.1	A238 Y242 R243 Q285	A238-R240 PolarHBondContact O-N 3.49Å; R240-Y242 PolarHBondContact O-N 2.72Å; R240-Y242 VanDerWaalsContact O-N 3.12Å; R240-R243 WeakPolarHBondContact O-CB 3.34Å; R240-R243 WeakPolarHBondContact O-CG 3.28Å; R240-R243 PolarHBondContact O-N 3.36Å; R240-Q285 HydrophobicContact CB-CG 4.38Å; R240-Q285 VanDerWaalsContact O-CD 3.24Å; R240-Q285 PolarHBondContact O-NE2 3.5Å
241	W	95.2	Very high	67.3	Low	81 Å²	81	58.9 Å²	58.9	31%	0.307	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.3	-163.7	-53	-21	0	0	0	114.6	T239 C265 P275 F277 P278 G279 Q285	T239-W241 HydrophobicContact CG2-CB 4.28Å; T239-W241 HydrophobicContact CG2-CD2 3.78Å; T239-W241 HydrophobicContact CG2-CE3 3.94Å; T239-W241 HydrophobicContact CG2-CG 3.92Å; W241-C265 PolarHBondContact O-SG 3.11Å; W241-P275 HydrophobicContact CD2-CB 4.14Å; W241-P275 HydrophobicContact CD2-CG 4.44Å; W241-P275 HydrophobicContact CE3-CB 3.57Å; W241-P275 HydrophobicContact CE3-CG 3.75Å; W241-P275 HydrophobicContact CH2-CG 4.41Å; W241-P275 HydrophobicContact CZ3-CB 4.09Å; W241-P275 HydrophobicContact CZ3-CG 3.74Å; W241-F277 WeakPolarHBondContact CA-O 3.06Å; W241-F277 WeakPolarHBondContact CB-O 3.23Å; W241-F277 VanDerWaalsContact CD1-O 3.31Å; W241-P278 VanDerWaalsContact CD1-CA 3.49Å; W241-P278 VanDerWaalsContact NE1-C 3.33Å; W241-G279 PolarHBondContact NE1-O 3.17Å; W241-Q285 PolarHBondContact O-NE2 3.46Å
242	Y	95.3	Very high	68.1	Low	15 Å²	15	62.1 Å²	62.1	6%	0.059	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	0.1	-179.7	-44.2	-80.7	0	0	0	113	L199 K200 P201 T239 R240 W261 S262 C265 I266 E269	L199-Y242 WeakPolarHBondContact O-CB 3.38Å; K200-Y242 HydrophobicContact CB-CD1 4.37Å; K200-Y242 HydrophobicContact CB-CD2 3.45Å; K200-Y242 VanDerWaalsContact CB-CD2 3.45Å; K200-Y242 HydrophobicContact CB-CE1 4.39Å; K200-Y242 HydrophobicContact CB-CE2 3.46Å; K200-Y242 VanDerWaalsContact CB-CE2 3.46Å; K200-Y242 HydrophobicContact CB-CG 3.95Å; P201-Y242 VanDerWaalsContact CD-CE1 3.46Å; P201-Y242 VanDerWaalsContact CD-OH 3.24Å; P201-Y242 WeakPolarHBondContact CD-OH 3.37Å; P201-Y242 HydrophobicContact CG-CE1 4.18Å; T239-Y242 HydrophobicContact CG2-CD2 4.26Å; T239-Y242 HydrophobicContact CG2-CE2 3.81Å; R240-Y242 PolarHBondContact O-N 2.72Å; R240-Y242 VanDerWaalsContact O-N 3.12Å; Y242-W261 VanDerWaalsContact O-CD1 3.29Å; Y242-S262 PolarHBondContact O-OG 2.86Å; Y242-S262 VanDerWaalsContact O-OG 3.06Å; Y242-C265 HydrophobicContact CD1-CB 3.7Å; Y242-C265 HydrophobicContact CE1-CB 4.43Å; Y242-I266 HydrophobicContact CD1-CG1 4.04Å; Y242-I266 HydrophobicContact CE1-CG1 4.21Å; Y242-E269 PolarHBondContact OH-OE2 2.92Å; Y242-E269 VanDerWaalsContact OH-OE2 3.06Å
243	R	91.1	Very high	69	Low	79 Å²	79	54.7 Å²	54.7	30%	0.298	29%	0.288	S	S	.	.			trans	-77.1	134	-177.8	-63.7	-178.7	179.8	-151.1	-8.1	111.6	R240 M248 W261	R240-R243 WeakPolarHBondContact O-CB 3.34Å; R240-R243 WeakPolarHBondContact O-CG 3.28Å; R240-R243 PolarHBondContact O-N 3.36Å; R243-M248 HydrophobicContact CB-SD 4.28Å; R243-W261 PolarHBondContact O-NE1 2.92Å; R243-W261 VanDerWaalsContact O-NE1 3.13Å
244	A	91.5	Very high	70.3	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	27%	0.274	C	S	.	.			trans	-69.8	149.1	177.6	0	0	0	0	0	112.5	E246 I247 W261	A244-E246 VanDerWaalsContact C-N 3.27Å; A244-E246 VanDerWaalsContact CB-CD 3.45Å; A244-E246 HydrophobicContact CB-CG 4.49Å; A244-E246 WeakPolarHBondContact CB-OE1 3.41Å; A244-E246 PolarHBondContact O-N 2.87Å; A244-I247 HydrophobicContact CB-CG1 4.3Å; A244-I247 WeakPolarHBondContact O-CB 3.44Å; A244-I247 PolarHBondContact O-N 3.46Å; A244-I247 VanDerWaalsContact O-N 3.12Å; A244-W261 HydrophobicContact CB-CB 3.69Å; A244-W261 HydrophobicContact CB-CD2 4.07Å; A244-W261 HydrophobicContact CB-CG 3.52Å
245	P	90.3	Very high	72.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-61.7	-33.3	-174.2	24.5	-33.9	0	0	0	112.6	I247 M248 L249 W261 L286 I289 F345	P245-I247 VanDerWaalsContact C-N 3.27Å; P245-I247 PolarHBondContact O-N 3.13Å; P245-M248 CarbonylContact O-C 3.49Å; P245-M248 WeakPolarHBondContact O-CA 3.4Å; P245-M248 WeakPolarHBondContact O-CB 3.5Å; P245-M248 PolarHBondContact O-N 2.96Å; P245-L249 HydrophobicContact CB-CD1 4.23Å; P245-L249 WeakPolarHBondContact O-CD1 3.46Å; P245-L249 VanDerWaalsContact O-CG 3.23Å; P245-L249 WeakPolarHBondContact O-CG 3.24Å; P245-L249 PolarHBondContact O-N 3.02Å; P245-W261 HydrophobicContact CG-CE3 4.42Å; P245-W261 HydrophobicContact CG-CH2 4.14Å; P245-W261 HydrophobicContact CG-CZ3 4.06Å; P245-L286 HydrophobicContact CB-CD1 4.47Å; P245-I289 HydrophobicContact CB-CD1 4.3Å; P245-I289 HydrophobicContact CB-CG2 4.44Å; P245-F345 HydrophobicContact CB-CD2 3.96Å; P245-F345 HydrophobicContact CB-CE2 3.74Å; P245-F345 HydrophobicContact CG-CD2 3.84Å; P245-F345 HydrophobicContact CG-CE2 4.12Å; P245-F345 HydrophobicContact CG-CG 4.41Å
246	E	85.6	Confident	74.9	Confident	13 Å²	13	48.6 Å²	48.6	6%	0.061	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-61.9	-31	177.5	63.1	-82	-172.7	0	0	113.4	A244 M248 L249 N250 P347 R350	A244-E246 VanDerWaalsContact C-N 3.27Å; A244-E246 VanDerWaalsContact CB-CD 3.45Å; A244-E246 HydrophobicContact CB-CG 4.49Å; A244-E246 WeakPolarHBondContact CB-OE1 3.41Å; A244-E246 PolarHBondContact O-N 2.87Å; E246-M248 PolarHBondContact O-N 3.48Å; E246-M248 VanDerWaalsContact O-N 3.15Å; E246-L249 PolarHBondContact O-N 3.36Å; E246-L249 VanDerWaalsContact O-N 3.09Å; E246-N250 PolarHBondContact O-N 3.06Å; E246-P347 HydrophobicContact CB-CG 4.28Å; E246-P347 HydrophobicContact CG-CB 4.36Å; E246-P347 HydrophobicContact CG-CG 4.12Å; E246-R350 IonicContact OE1-CZ 3.87Å; E246-R350 IonicContact OE1-NH1 2.75Å; E246-R350 PolarHBondContact OE1-NH1 2.77Å; E246-R350 IonicContact OE1-NH2 3.27Å; E246-R350 PolarHBondContact OE1-NH2 3.45Å; E246-R350 IonicContact OE2-CZ 4Å; E246-R350 IonicContact OE2-NH1 2.82Å; E246-R350 IonicContact OE2-NH2 2.86Å; E246-R350 PolarHBondContact OE2-NH2 3.18Å
247	I	81.1	Confident	76.8	Confident	35 Å²	35	42.5 Å²	42.5	18%	0.179	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-64	-17.3	173.3	-54.6	-54.1	0	0	0	112	A244 P245 Y254 I258	A244-I247 HydrophobicContact CB-CG1 4.3Å; A244-I247 WeakPolarHBondContact O-CB 3.44Å; A244-I247 PolarHBondContact O-N 3.46Å; A244-I247 VanDerWaalsContact O-N 3.12Å; P245-I247 VanDerWaalsContact C-N 3.27Å; P245-I247 PolarHBondContact O-N 3.13Å; I247-Y254 HydrophobicContact CD1-CD1 3.92Å; I247-Y254 HydrophobicContact CD1-CE1 3.44Å; I247-Y254 VanDerWaalsContact CD1-CE1 3.44Å; I247-I258 HydrophobicContact CD1-CG2 3.91Å; I247-I258 HydrophobicContact CG1-CG2 4.38Å
248	M	77.4	Confident	79.1	Confident	9 Å²	9	38 Å²	38	4%	0.044	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-111.7	10.8	179.9	-67.6	139.3	44.5	0	0	112.8	R243 P245 E246 Y282 Q285 L286 I289	R243-M248 HydrophobicContact CB-SD 4.28Å; P245-M248 CarbonylContact O-C 3.49Å; P245-M248 WeakPolarHBondContact O-CA 3.4Å; P245-M248 WeakPolarHBondContact O-CB 3.5Å; P245-M248 PolarHBondContact O-N 2.96Å; E246-M248 PolarHBondContact O-N 3.48Å; E246-M248 VanDerWaalsContact O-N 3.15Å; M248-Y282 VanDerWaalsContact CA-CZ 3.47Å; M248-Y282 VanDerWaalsContact CA-OH 3.32Å; M248-Y282 WeakPolarHBondContact CA-OH 3.22Å; M248-Y282 HydrophobicContact CB-CD1 4.49Å; M248-Y282 HydrophobicContact CB-CE1 4.02Å; M248-Y282 HydrophobicContact CB-CE2 4.26Å; M248-Y282 HydrophobicContact CG-CD2 4.24Å; M248-Y282 HydrophobicContact CG-CE2 4.11Å; M248-Y282 VanDerWaalsContact O-CE1 3.31Å; M248-Y282 WeakPolarHBondContact O-CE1 3.41Å; M248-Y282 PolarHBondContact O-OH 3.12Å; M248-Y282 VanDerWaalsContact O-OH 3.08Å; M248-Q285 HydrophobicContact CE-CB 3.67Å; M248-Q285 HydrophobicContact CE-CG 3.54Å; M248-Q285 HydrophobicContact SD-CB 4.14Å; M248-Q285 HydrophobicContact SD-CG 3.64Å; M248-L286 VanDerWaalsContact CE-CA 3.46Å; M248-L286 HydrophobicContact CE-CB 3.58Å; M248-L286 HydrophobicContact CE-CD1 4.29Å; M248-L286 HydrophobicContact CE-CG 4.49Å; M248-I289 HydrophobicContact CE-CD1 3.95Å
249	L	74.3	Confident	81	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.021	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.5	-48	-175.5	-65.9	167.6	0	0	0	111.6	P245 E246 L286 I304 N306 A309 L313 F345	P245-L249 HydrophobicContact CB-CD1 4.23Å; P245-L249 WeakPolarHBondContact O-CD1 3.46Å; P245-L249 VanDerWaalsContact O-CG 3.23Å; P245-L249 WeakPolarHBondContact O-CG 3.24Å; P245-L249 PolarHBondContact O-N 3.02Å; E246-L249 PolarHBondContact O-N 3.36Å; E246-L249 VanDerWaalsContact O-N 3.09Å; L249-L286 HydrophobicContact CD1-CD1 4.44Å; L249-L286 HydrophobicContact CD2-CD1 4.45Å; L249-L286 HydrophobicContact CD2-CD2 3.77Å; L249-I304 HydrophobicContact CB-CG2 4.39Å; L249-I304 HydrophobicContact CD1-CD1 3.97Å; L249-N306 WeakPolarHBondContact O-CB 3.12Å; L249-N306 PolarHBondContact O-ND2 3.29Å; L249-A309 HydrophobicContact CB-CB 4.11Å; L249-A309 HydrophobicContact CD2-CB 3.85Å; L249-A309 WeakPolarHBondContact O-CB 3.49Å; L249-L313 HydrophobicContact CD1-CD1 4.02Å; L249-L313 HydrophobicContact CD2-CD1 3.7Å; L249-L313 HydrophobicContact CD2-CD2 4.24Å; L249-L313 HydrophobicContact CD2-CG 3.96Å; L249-F345 HydrophobicContact CD1-CE2 4.1Å; L249-F345 HydrophobicContact CD1-CZ 3.59Å
250	N	66.6	Low	82.3	Confident	28 Å²	28	34.1 Å²	34.1	15%	0.15	18%	0.177	C	C	.	.			trans	-103.2	147.2	175.4	-65.7	-36.5	0	0	0	110	E246 K252 I305 N306	E246-N250 PolarHBondContact O-N 3.06Å; N250-K252 VanDerWaalsContact CB-O 3.26Å; N250-K252 WeakPolarHBondContact CB-O 3.33Å; N250-I305 PolarHBondContact OD1-N 2.89Å; N250-N306 PolarHBondContact OD1-N 2.91Å
251	S	52.7	Low	82.9	Confident	82 Å²	82	32 Å²	32	57%	0.573	17%	0.169	S	C	*	.	S	Bend	trans	-78.2	-9.4	164.3	66.3	0	0	0	0	112.5
252	K	57.4	Low	83.1	Confident	117 Å²	117	28.5 Å²	28.5	51%	0.509	16%	0.157	S	C	.	.			trans	-124.1	150.3	-168.8	-46.2	-144.9	162.1	-157	0	111.4	D228 N250	D228-K252 HydrophobicContact CB-CD 4.44Å; D228-K252 WeakPolarHBondContact OD1-CA 3.32Å; D228-K252 WeakPolarHBondContact OD2-CD 3.36Å; D228-K252 VanDerWaalsContact OD2-CE 3.25Å; D228-K252 WeakPolarHBondContact OD2-CE 3.23Å; D228-K252 WeakPolarHBondContact OD2-CG 3.34Å; D228-K252 IonicContact OD2-NZ 2.69Å; N250-K252 VanDerWaalsContact CB-O 3.26Å; N250-K252 WeakPolarHBondContact CB-O 3.33Å
253	G	54.8	Low	83.2	Confident	47 Å²	47	27.8 Å²	27.8	49%	0.485	15%	0.154	S	C	.	.			trans	104.6	51.1	167.9	0	0	0	0	0	114.6	S255	G253-S255 PolarHBondContact O-N 2.89Å
254	Y	69.3	Low	83.6	Confident	23 Å²	23	24 Å²	24	9%	0.09	14%	0.14	C	C	.	.			trans	-71.2	106.7	165.7	-70.7	-77.9	0	0	0	109.7	L233 I247 I258	L233-Y254 HydrophobicContact CD1-CE2 4.32Å; L233-Y254 WeakPolarHBondContact CD1-OH 3.42Å; L233-Y254 HydrophobicContact CD2-CE2 4.11Å; L233-Y254 VanDerWaalsContact CD2-OH 3.31Å; L233-Y254 WeakPolarHBondContact CD2-OH 3.49Å; I247-Y254 HydrophobicContact CD1-CD1 3.92Å; I247-Y254 HydrophobicContact CD1-CE1 3.44Å; I247-Y254 VanDerWaalsContact CD1-CE1 3.44Å; Y254-I258 HydrophobicContact CD1-CD1 3.78Å
255	S	86.2	Confident	84	Confident	48 Å²	48	24.1 Å²	24.1	34%	0.336	14%	0.14	S	C	.	.			trans	-131.7	169.5	175.9	82.5	0	0	0	0	111.5	G253 S257 I258	G253-S255 PolarHBondContact O-N 2.89Å; S255-S257 PolarHBondContact O-N 3.06Å; S255-S257 PolarHBondContact OG-N 3.12Å; S255-S257 PolarHBondContact OG-OG 3.08Å; S255-I258 VanDerWaalsContact O-CG1 3.24Å; S255-I258 WeakPolarHBondContact O-CG1 3.37Å; S255-I258 WeakPolarHBondContact O-CG2 3.44Å; S255-I258 PolarHBondContact O-N 2.94Å
256	K	93.3	Very high	84.4	Confident	69 Å²	69	24.1 Å²	24.1	30%	0.3	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.4	-31.9	175.9	-68.4	-176.4	174.4	-166.9	0	113.8	H190 L195 I258 D259 M260 E354	H190-K256 HydrophobicContact CB-CD 3.86Å; H190-K256 HydrophobicContact CB-CG 4.26Å; H190-K256 PolarHBondContact CE1-O 3.01Å; H190-K256 VanDerWaalsContact CE1-O 3.28Å; H190-K256 WeakPolarHBondContact O-CE 3.2Å; H190-K256 PolarHBondContact O-NZ 3.12Å; L195-K256 HydrophobicContact CD2-CB 4.41Å; L195-K256 HydrophobicContact CD2-CG 4.04Å; K256-I258 PolarHBondContact O-N 3.01Å; K256-I258 VanDerWaalsContact O-N 3.12Å; K256-D259 PolarHBondContact O-N 3.05Å; K256-M260 PolarHBondContact O-N 2.96Å; K256-E354 IonicContact NZ-OE1 2.68Å
257	S	93.6	Very high	85	Confident	11 Å²	11	23.5 Å²	23.5	8%	0.077	14%	0.137	C	C	.	.	H	α-helix	trans	-55.7	-26.9	178.5	69	0	0	0	0	115	S255 M260 W261 P347 R350	S255-S257 PolarHBondContact O-N 3.06Å; S255-S257 PolarHBondContact OG-N 3.12Å; S255-S257 PolarHBondContact OG-OG 3.08Å; S257-M260 PolarHBondContact O-N 3.27Å; S257-W261 PolarHBondContact O-N 3.36Å; S257-P347 VanDerWaalsContact OG-CB 3.31Å; S257-P347 WeakPolarHBondContact OG-CB 3.41Å; S257-R350 VanDerWaalsContact C-NH1 3.34Å; S257-R350 VanDerWaalsContact O-CD 3.3Å; S257-R350 WeakPolarHBondContact O-CD 3.31Å; S257-R350 PolarHBondContact O-NH1 3.26Å
258	I	93.3	Very high	85.9	Confident	8 Å²	8	21.8 Å²	21.8	4%	0.041	13%	0.129	C	C	.	.	H	α-helix	trans	-71.8	-34.1	-177.3	72.7	-164.9	0	0	0	111.9	L195 R197 I247 Y254 S255 K256 S262	L195-I258 HydrophobicContact CD1-CD1 4.06Å; R197-I258 HydrophobicContact CG-CD1 3.89Å; I247-I258 HydrophobicContact CD1-CG2 3.91Å; I247-I258 HydrophobicContact CG1-CG2 4.38Å; Y254-I258 HydrophobicContact CD1-CD1 3.78Å; S255-I258 VanDerWaalsContact O-CG1 3.24Å; S255-I258 WeakPolarHBondContact O-CG1 3.37Å; S255-I258 WeakPolarHBondContact O-CG2 3.44Å; S255-I258 PolarHBondContact O-N 2.94Å; K256-I258 PolarHBondContact O-N 3.01Å; K256-I258 VanDerWaalsContact O-N 3.12Å; I258-S262 PolarHBondContact O-N 3.33Å; I258-S262 PolarHBondContact O-OG 3.1Å
259	D	96.7	Very high	86.9	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-74.1	-40.4	175.2	-68	-29.8	0	0	0	109.3	L186 H190 L195 H196 R197 L199 K256 W261 S262 V263	L186-D259 HydrophobicContact CD1-CB 3.99Å; L186-D259 HydrophobicContact CD2-CB 3.97Å; H190-D259 IonicContact CD2-OD2 2.86Å; H190-D259 IonicContact CE1-OD2 2.6Å; H190-D259 IonicContact NE2-OD2 2.73Å; H190-D259 PolarHBondContact NE2-OD2 3.25Å; L195-D259 WeakPolarHBondContact CA-OD2 3.29Å; H196-D259 PolarHBondContact N-OD1 3.26Å; H196-D259 PolarHBondContact N-OD2 2.89Å; R197-D259 PolarHBondContact N-OD1 3.21Å; L199-D259 HydrophobicContact CD1-CB 3.84Å; K256-D259 PolarHBondContact O-N 3.05Å; D259-W261 VanDerWaalsContact C-N 3.32Å; D259-W261 PolarHBondContact O-N 3.47Å; D259-S262 CarbonylContact O-C 3.41Å; D259-S262 WeakPolarHBondContact O-CA 3.46Å; D259-S262 VanDerWaalsContact O-CB 3.26Å; D259-S262 WeakPolarHBondContact O-CB 3.49Å; D259-S262 PolarHBondContact O-N 2.89Å; D259-V263 WeakPolarHBondContact O-CG2 3.46Å; D259-V263 PolarHBondContact O-N 3.42Å
260	M	98.4	Very high	88	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-60.5	-37.7	175.2	-66.1	-56	-62.9	0	0	113.1	L183 L186 K256 S257 V263 G264 M342 I351 T352 V353 A356	L183-M260 HydrophobicContact CD2-CE 3.76Å; L183-M260 HydrophobicContact CD2-SD 4.05Å; L186-M260 HydrophobicContact CD2-SD 3.75Å; K256-M260 PolarHBondContact O-N 2.96Å; S257-M260 PolarHBondContact O-N 3.27Å; M260-V263 PolarHBondContact O-N 2.66Å; M260-G264 PolarHBondContact O-N 2.91Å; M260-M342 HydrophobicContact CE-CE 4.06Å; M260-M342 HydrophobicContact CE-CG 4.43Å; M260-I351 HydrophobicContact CE-CG2 4.04Å; M260-T352 VanDerWaalsContact CE-O 3.31Å; M260-T352 WeakPolarHBondContact CE-O 3.39Å; M260-V353 HydrophobicContact CE-CB 4.46Å; M260-V353 HydrophobicContact SD-CB 3.68Å; M260-V353 HydrophobicContact SD-CG2 4.22Å; M260-A356 HydrophobicContact CE-CB 3.63Å
261	W	97.9	Very high	89.5	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-43.3	169.9	175.9	-79.6	0	0	0	112	Y242 R243 A244 P245 S257 D259 V263 G264 C265 F277 I289 L293 L343	Y242-W261 VanDerWaalsContact O-CD1 3.29Å; R243-W261 PolarHBondContact O-NE1 2.92Å; R243-W261 VanDerWaalsContact O-NE1 3.13Å; A244-W261 HydrophobicContact CB-CB 3.69Å; A244-W261 HydrophobicContact CB-CD2 4.07Å; A244-W261 HydrophobicContact CB-CG 3.52Å; P245-W261 HydrophobicContact CG-CE3 4.42Å; P245-W261 HydrophobicContact CG-CH2 4.14Å; P245-W261 HydrophobicContact CG-CZ3 4.06Å; S257-W261 PolarHBondContact O-N 3.36Å; D259-W261 VanDerWaalsContact C-N 3.32Å; D259-W261 PolarHBondContact O-N 3.47Å; W261-V263 VanDerWaalsContact C-N 3.31Å; W261-V263 PolarHBondContact O-N 2.79Å; W261-G264 WeakPolarHBondContact O-CA 3.34Å; W261-G264 PolarHBondContact O-N 3.07Å; W261-G264 VanDerWaalsContact O-N 3.11Å; W261-C265 PolarHBondContact O-N 2.93Å; W261-F277 HydrophobicContact CH2-CE2 4.01Å; W261-F277 HydrophobicContact CH2-CZ 4.44Å; W261-F277 AromaticContact CZ2-CD2 3.92Å; W261-F277 HydrophobicContact CZ2-CD2 3.92Å; W261-F277 AromaticContact CZ2-CE2 3.42Å; W261-F277 HydrophobicContact CZ2-CE2 3.42Å; W261-F277 VanDerWaalsContact CZ2-CE2 3.42Å; W261-F277 HydrophobicContact CZ2-CZ 4.23Å; W261-I289 HydrophobicContact CH2-CD1 4.39Å; W261-I289 HydrophobicContact CH2-CG1 4.4Å; W261-I289 HydrophobicContact CH2-CG2 3.67Å; W261-I289 HydrophobicContact CZ2-CD1 3.69Å; W261-I289 HydrophobicContact CZ2-CG1 3.85Å; W261-I289 HydrophobicContact CZ2-CG2 4.01Å; W261-L293 HydrophobicContact CH2-CD1 3.72Å; W261-L293 HydrophobicContact CZ3-CD1 3.95Å; W261-L343 HydrophobicContact CD2-CD2 3.8Å; W261-L343 HydrophobicContact CE3-CD2 3.9Å; W261-L343 HydrophobicContact CG-CD2 4.34Å; W261-L343 HydrophobicContact CH2-CD2 4.17Å; W261-L343 HydrophobicContact CZ2-CD2 4.06Å; W261-L343 HydrophobicContact CZ3-CB 4.23Å; W261-L343 HydrophobicContact CZ3-CD2 4.09Å
262	S	98.1	Very high	91.7	Very high	8 Å²	8	20.2 Å²	20.2	6%	0.056	12%	0.117	C	C	.	.	H	α-helix	trans	-60.2	-42	177.7	-53.3	0	0	0	0	111.1	Y242 I258 D259 C265 I266	Y242-S262 PolarHBondContact O-OG 2.86Å; Y242-S262 VanDerWaalsContact O-OG 3.06Å; I258-S262 PolarHBondContact O-N 3.33Å; I258-S262 PolarHBondContact O-OG 3.1Å; D259-S262 CarbonylContact O-C 3.41Å; D259-S262 WeakPolarHBondContact O-CA 3.46Å; D259-S262 VanDerWaalsContact O-CB 3.26Å; D259-S262 WeakPolarHBondContact O-CB 3.49Å; D259-S262 PolarHBondContact O-N 2.89Å; S262-C265 WeakPolarHBondContact O-CB 3.5Å; S262-C265 PolarHBondContact O-N 2.8Å; S262-I266 WeakPolarHBondContact O-CD1 3.41Å; S262-I266 VanDerWaalsContact O-CG1 3.26Å; S262-I266 WeakPolarHBondContact O-CG1 3.43Å; S262-I266 PolarHBondContact O-N 3.34Å
263	V	98.9	Very high	93.6	Very high	0 Å²	0	17 Å²	17	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.1	-41.5	172.4	178.5	0	0	0	0	111.6	L179 I182 L183 L186 L199 D259 M260 W261 C265 I266 L267 M342	L179-V263 HydrophobicContact CD1-CG1 3.56Å; I182-V263 HydrophobicContact CG2-CG1 4.02Å; I182-V263 HydrophobicContact CG2-CG2 3.66Å; L183-V263 HydrophobicContact CD2-CG1 4.11Å; L186-V263 HydrophobicContact CD2-CG2 3.86Å; L199-V263 HydrophobicContact CD1-CG2 3.91Å; D259-V263 WeakPolarHBondContact O-CG2 3.46Å; D259-V263 PolarHBondContact O-N 3.42Å; M260-V263 PolarHBondContact O-N 2.66Å; W261-V263 VanDerWaalsContact C-N 3.31Å; W261-V263 PolarHBondContact O-N 2.79Å; V263-C265 PolarHBondContact O-N 3.01Å; V263-I266 WeakPolarHBondContact O-CB 3.47Å; V263-I266 PolarHBondContact O-N 2.9Å; V263-I266 VanDerWaalsContact O-N 3.1Å; V263-L267 PolarHBondContact O-N 2.92Å; V263-M342 HydrophobicContact CB-SD 4.5Å; V263-M342 HydrophobicContact CG1-CE 3.97Å; V263-M342 HydrophobicContact CG1-SD 3.98Å
264	G	98.8	Very high	95.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58.5	-42.3	172.5	0	0	0	0	0	113.4	M260 W261 I266 L267 A268 L339	M260-G264 PolarHBondContact O-N 2.91Å; W261-G264 WeakPolarHBondContact O-CA 3.34Å; W261-G264 PolarHBondContact O-N 3.07Å; W261-G264 VanDerWaalsContact O-N 3.11Å; G264-I266 VanDerWaalsContact C-N 3.34Å; G264-I266 PolarHBondContact O-N 3.34Å; G264-L267 PolarHBondContact O-N 3.36Å; G264-A268 PolarHBondContact O-N 3.01Å; G264-L339 WeakPolarHBondContact O-CD1 3.5Å
265	C	98.8	Very high	96.9	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-63	-39.1	172.8	-76.4	0	0	0	0	112.3	W241 Y242 W261 S262 V263 A268 E269 I276 F277	W241-C265 PolarHBondContact O-SG 3.11Å; Y242-C265 HydrophobicContact CD1-CB 3.7Å; Y242-C265 HydrophobicContact CE1-CB 4.43Å; W261-C265 PolarHBondContact O-N 2.93Å; S262-C265 WeakPolarHBondContact O-CB 3.5Å; S262-C265 PolarHBondContact O-N 2.8Å; V263-C265 PolarHBondContact O-N 3.01Å; C265-A268 PolarHBondContact O-N 3.44Å; C265-E269 PolarHBondContact O-N 3.25Å; C265-I276 HydrophobicContact CB-CG2 4.25Å; C265-F277 VanDerWaalsContact SG-CD2 3.57Å
266	I	98.9	Very high	97.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-67.3	-41.4	177.7	-66.1	162.3	0	0	0	110.8	L161 I182 L199 P201 L204 Y242 S262 V263 G264 E269 M270	L161-I266 HydrophobicContact CD2-CG2 3.71Å; I182-I266 HydrophobicContact CD1-CG2 4.19Å; L199-I266 HydrophobicContact CB-CD1 4.22Å; P201-I266 HydrophobicContact CG-CG1 4.19Å; P201-I266 HydrophobicContact CG-CG2 4.44Å; L204-I266 HydrophobicContact CD1-CD1 3.99Å; L204-I266 HydrophobicContact CD1-CG2 3.98Å; Y242-I266 HydrophobicContact CD1-CG1 4.04Å; Y242-I266 HydrophobicContact CE1-CG1 4.21Å; S262-I266 WeakPolarHBondContact O-CD1 3.41Å; S262-I266 VanDerWaalsContact O-CG1 3.26Å; S262-I266 WeakPolarHBondContact O-CG1 3.43Å; S262-I266 PolarHBondContact O-N 3.34Å; V263-I266 WeakPolarHBondContact O-CB 3.47Å; V263-I266 PolarHBondContact O-N 2.9Å; V263-I266 VanDerWaalsContact O-N 3.1Å; G264-I266 VanDerWaalsContact C-N 3.34Å; G264-I266 PolarHBondContact O-N 3.34Å; I266-E269 PolarHBondContact O-N 3.25Å; I266-M270 HydrophobicContact CG2-CE 4.37Å; I266-M270 HydrophobicContact CG2-CG 4.47Å; I266-M270 WeakPolarHBondContact O-CG 3.33Å; I266-M270 PolarHBondContact O-N 3.41Å
267	L	98.9	Very high	97.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-59.9	-46.8	174.2	177	55.9	0	0	0	111.6	V175 L179 V263 G264 E269 M270 L271 L339 M342	V175-L267 HydrophobicContact CG1-CD1 3.58Å; L179-L267 HydrophobicContact CD1-CB 4.3Å; L179-L267 HydrophobicContact CD1-CD2 4.49Å; L179-L267 HydrophobicContact CD2-CD1 4.03Å; L179-L267 HydrophobicContact CD2-CD2 3.84Å; L179-L267 HydrophobicContact CD2-CG 4.47Å; V263-L267 PolarHBondContact O-N 2.92Å; G264-L267 PolarHBondContact O-N 3.36Å; L267-E269 VanDerWaalsContact C-N 3.29Å; L267-E269 PolarHBondContact O-N 2.96Å; L267-M270 HydrophobicContact CD1-CE 4.27Å; L267-M270 PolarHBondContact O-N 3.28Å; L267-L271 HydrophobicContact CD1-CD1 4.19Å; L267-L271 HydrophobicContact CD1-CG 4.2Å; L267-L271 HydrophobicContact CG-CD1 4.24Å; L267-L271 VanDerWaalsContact O-CG 3.32Å; L267-L271 WeakPolarHBondContact O-CG 3.48Å; L267-L271 PolarHBondContact O-N 2.95Å; L267-L339 HydrophobicContact CB-CD1 4.22Å; L267-L339 HydrophobicContact CD2-CB 3.94Å; L267-L339 HydrophobicContact CD2-CD1 4.16Å; L267-L339 HydrophobicContact CG-CD1 4.19Å; L267-M342 HydrophobicContact CD2-SD 4.32Å
268	A	98.8	Very high	97.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.7	-35.8	174.7	0	0	0	0	0	113.2	G264 C265 S272 I276 F328 L339	G264-A268 PolarHBondContact O-N 3.01Å; C265-A268 PolarHBondContact O-N 3.44Å; A268-S272 PolarHBondContact O-N 3.09Å; A268-S272 PolarHBondContact O-OG 2.83Å; A268-I276 HydrophobicContact CB-CB 3.79Å; A268-I276 HydrophobicContact CB-CD1 3.83Å; A268-I276 HydrophobicContact CB-CG1 4.34Å; A268-I276 HydrophobicContact CB-CG2 3.78Å; A268-F328 HydrophobicContact CB-CE1 4.42Å; A268-F328 HydrophobicContact CB-CZ 3.81Å; A268-F328 WeakPolarHBondContact O-CE1 3.18Å; A268-L339 HydrophobicContact CB-CD1 4.08Å; A268-L339 HydrophobicContact CB-CD2 4.3Å
269	E	98.6	Very high	97.8	Very high	10 Å²	10	19.5 Å²	19.5	5%	0.047	11%	0.105	C	C	.	.	H	α-helix	trans	-72.8	-37.1	175.8	-170.2	160.5	155.2	0	0	112	L165 Y242 C265 I266 L267 S272 N273 K274 P275	L165-E269 HydrophobicContact CD1-CG 3.98Å; Y242-E269 PolarHBondContact OH-OE2 2.92Å; Y242-E269 VanDerWaalsContact OH-OE2 3.06Å; C265-E269 PolarHBondContact O-N 3.25Å; I266-E269 PolarHBondContact O-N 3.25Å; L267-E269 VanDerWaalsContact C-N 3.29Å; L267-E269 PolarHBondContact O-N 2.96Å; E269-S272 PolarHBondContact O-N 2.93Å; E269-N273 VanDerWaalsContact O-CA 3.27Å; E269-N273 WeakPolarHBondContact O-CA 3.23Å; E269-N273 PolarHBondContact O-N 2.77Å; E269-K274 WeakPolarHBondContact CA-O 3.49Å; E269-P275 WeakPolarHBondContact OE2-CA 3.45Å; E269-P275 VanDerWaalsContact OE2-CB 3.32Å; E269-P275 WeakPolarHBondContact OE2-CB 3.37Å
270	M	98.7	Very high	97.4	Very high	3 Å²	3	27.7 Å²	27.7	2%	0.015	14%	0.141	C	C	.	.	H	α-helix	trans	-62.6	-39.2	171.4	-74	-164.5	-65.7	0	0	112.7	L161 L165 L170 V175 F178 L179 I182 I266 L267 S272	L161-M270 HydrophobicContact CD1-CG 4.29Å; L161-M270 HydrophobicContact CD1-SD 4.22Å; L161-M270 HydrophobicContact CD2-CG 4.01Å; L161-M270 HydrophobicContact CD2-SD 3.95Å; L165-M270 HydrophobicContact CD1-CG 4.03Å; L165-M270 HydrophobicContact CD2-CG 4.38Å; L170-M270 HydrophobicContact CD1-CB 4.15Å; L170-M270 HydrophobicContact CD1-CG 4Å; L170-M270 HydrophobicContact CD1-SD 4.09Å; V175-M270 HydrophobicContact CG1-CB 4.13Å; V175-M270 HydrophobicContact CG1-CE 4.16Å; V175-M270 HydrophobicContact CG2-CB 4.19Å; F178-M270 HydrophobicContact CB-SD 3.91Å; F178-M270 HydrophobicContact CD2-SD 4.31Å; L179-M270 HydrophobicContact CB-CE 4.26Å; L179-M270 HydrophobicContact CD1-CE 4.48Å; I182-M270 HydrophobicContact CD1-CE 4.41Å; I266-M270 HydrophobicContact CG2-CE 4.37Å; I266-M270 HydrophobicContact CG2-CG 4.47Å; I266-M270 WeakPolarHBondContact O-CG 3.33Å; I266-M270 PolarHBondContact O-N 3.41Å; L267-M270 HydrophobicContact CD1-CE 4.27Å; L267-M270 PolarHBondContact O-N 3.28Å; M270-S272 VanDerWaalsContact C-N 3.27Å; M270-S272 PolarHBondContact O-N 2.74Å
271	L	98.4	Very high	96.7	Very high	37 Å²	37	32.6 Å²	32.6	19%	0.194	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-10.7	178.8	-69.9	173.9	0	0	0	114.4	V175 L267 F328 A331 L336 L339	V175-L271 HydrophobicContact CG1-CD2 4.04Å; V175-L271 HydrophobicContact CG1-CG 4.43Å; L267-L271 HydrophobicContact CD1-CD1 4.19Å; L267-L271 HydrophobicContact CD1-CG 4.2Å; L267-L271 HydrophobicContact CG-CD1 4.24Å; L267-L271 VanDerWaalsContact O-CG 3.32Å; L267-L271 WeakPolarHBondContact O-CG 3.48Å; L267-L271 PolarHBondContact O-N 2.95Å; L271-F328 HydrophobicContact CB-CD1 3.95Å; L271-F328 HydrophobicContact CB-CE1 4.37Å; L271-F328 HydrophobicContact CB-CG 4.47Å; L271-A331 HydrophobicContact CD1-CB 4.14Å; L271-A331 HydrophobicContact CD2-CB 3.81Å; L271-A331 HydrophobicContact CG-CB 4.48Å; L271-L336 HydrophobicContact CD1-CD2 3.96Å; L271-L339 HydrophobicContact CD1-CD2 4.28Å
272	S	97.4	Very high	95.8	Very high	40 Å²	40	36.5 Å²	36.5	28%	0.28	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-142.4	-5.1	-170.4	67.3	0	0	0	0	116.7	A268 E269 M270 K274	A268-S272 PolarHBondContact O-N 3.09Å; A268-S272 PolarHBondContact O-OG 2.83Å; E269-S272 PolarHBondContact O-N 2.93Å; M270-S272 VanDerWaalsContact C-N 3.27Å; M270-S272 PolarHBondContact O-N 2.74Å; S272-K274 PolarHBondContact O-N 2.91Å; S272-K274 PolarHBondContact OG-N 3.27Å; S272-K274 PolarHBondContact OG-O 3.46Å
273	N	97.6	Very high	95	Very high	50 Å²	50	39.9 Å²	39.9	27%	0.267	20%	0.196	S	C	.	.	S	Bend	trans	56	24.1	-169.8	-62.5	100.5	0	0	0	113.9	L165 Q168 E269	L165-N273 PolarHBondContact O-ND2 2.73Å; Q168-N273 PolarHBondContact O-ND2 2.81Å; E269-N273 VanDerWaalsContact O-CA 3.27Å; E269-N273 WeakPolarHBondContact O-CA 3.23Å; E269-N273 PolarHBondContact O-N 2.77Å
274	K	96.7	Very high	94.5	Very high	147 Å²	147	41.4 Å²	41.4	64%	0.639	20%	0.204	S	C	*	.	S	Bend	trans	-144.5	137.9	-175.8	-65.7	179.1	-174.5	175.5	0	112.6	E269 S272 I276	E269-K274 WeakPolarHBondContact CA-O 3.49Å; S272-K274 PolarHBondContact O-N 2.91Å; S272-K274 PolarHBondContact OG-N 3.27Å; S272-K274 PolarHBondContact OG-O 3.46Å; K274-I276 PolarHBondContact O-N 2.08Å
275	P	97.4	Very high	94.2	Very high	35 Å²	35	41.5 Å²	41.5	23%	0.227	21%	0.205	C	C	.	.			trans	-61.5	126.3	173.1	24.8	-34.8	0	0	0	110.8	W241 E269 P278	W241-P275 HydrophobicContact CD2-CB 4.14Å; W241-P275 HydrophobicContact CD2-CG 4.44Å; W241-P275 HydrophobicContact CE3-CB 3.57Å; W241-P275 HydrophobicContact CE3-CG 3.75Å; W241-P275 HydrophobicContact CH2-CG 4.41Å; W241-P275 HydrophobicContact CZ3-CB 4.09Å; W241-P275 HydrophobicContact CZ3-CG 3.74Å; E269-P275 WeakPolarHBondContact OE2-CA 3.45Å; E269-P275 VanDerWaalsContact OE2-CB 3.32Å; E269-P275 WeakPolarHBondContact OE2-CB 3.37Å; P275-P278 HydrophobicContact CB-CB 4.46Å; P275-P278 HydrophobicContact CG-CB 4.12Å; P275-P278 WeakPolarHBondContact O-CD 3.47Å
276	I	98.1	Very high	93.7	Very high	26 Å²	26	41.4 Å²	41.4	13%	0.133	20%	0.204	C	C	.	.	S	Bend	trans	-68.2	-35.3	-177.9	-176.1	175.2	0	0	0	113	C265 A268 K274 P278 W324 F328 L343	C265-I276 HydrophobicContact CB-CG2 4.25Å; A268-I276 HydrophobicContact CB-CB 3.79Å; A268-I276 HydrophobicContact CB-CD1 3.83Å; A268-I276 HydrophobicContact CB-CG1 4.34Å; A268-I276 HydrophobicContact CB-CG2 3.78Å; K274-I276 PolarHBondContact O-N 2.08Å; I276-P278 VanDerWaalsContact C-CD 3.49Å; I276-P278 WeakPolarHBondContact O-CD 2.93Å; I276-W324 HydrophobicContact CD1-CZ3 3.91Å; I276-F328 HydrophobicContact CD1-CZ 4.25Å; I276-L343 HydrophobicContact CD1-CD1 3.92Å
277	F	97.6	Very high	93.4	Very high	1 Å²	1	44 Å²	44	0%	0.004	22%	0.218	C	C	.	.			trans	-123.5	73	-179.2	-52.5	-49.7	0	0	0	111.7	W241 W261 C265 G279 Q285 H288 I289 V292 L343	W241-F277 WeakPolarHBondContact CA-O 3.06Å; W241-F277 WeakPolarHBondContact CB-O 3.23Å; W241-F277 VanDerWaalsContact CD1-O 3.31Å; W261-F277 HydrophobicContact CH2-CE2 4.01Å; W261-F277 HydrophobicContact CH2-CZ 4.44Å; W261-F277 AromaticContact CZ2-CD2 3.92Å; W261-F277 HydrophobicContact CZ2-CD2 3.92Å; W261-F277 AromaticContact CZ2-CE2 3.42Å; W261-F277 HydrophobicContact CZ2-CE2 3.42Å; W261-F277 VanDerWaalsContact CZ2-CE2 3.42Å; W261-F277 HydrophobicContact CZ2-CZ 4.23Å; C265-F277 VanDerWaalsContact SG-CD2 3.57Å; F277-G279 PolarHBondContact O-N 3.35Å; F277-Q285 PolarHBondContact O-NE2 2.89Å; F277-Q285 PolarHBondContact O-OE1 2.84Å; F277-H288 HydrophobicContact CB-CB 4.22Å; F277-H288 HydrophobicContact CD1-CB 4.31Å; F277-I289 HydrophobicContact CB-CG1 4.25Å; F277-I289 HydrophobicContact CD1-CG1 4Å; F277-I289 HydrophobicContact CD2-CG1 3.75Å; F277-I289 HydrophobicContact CE1-CG1 4.29Å; F277-I289 HydrophobicContact CE2-CG1 4.08Å; F277-I289 HydrophobicContact CG-CG1 3.72Å; F277-I289 HydrophobicContact CZ-CG1 4.34Å; F277-V292 HydrophobicContact CE1-CB 3.92Å; F277-V292 HydrophobicContact CE1-CG2 3.87Å; F277-L343 HydrophobicContact CE2-CD1 4.2Å; F277-L343 HydrophobicContact CE2-CD2 4.22Å; F277-L343 HydrophobicContact CZ-CD1 4.27Å
278	P	96	Very high	93.2	Very high	46 Å²	46	47.1 Å²	47.1	30%	0.299	23%	0.232	S	C	.	.			trans	-80.1	46.6	-172.6	34.7	-38.1	0	0	0	114	W241 P275 I276	W241-P278 VanDerWaalsContact CD1-CA 3.49Å; W241-P278 VanDerWaalsContact NE1-C 3.33Å; P275-P278 HydrophobicContact CB-CB 4.46Å; P275-P278 HydrophobicContact CG-CB 4.12Å; P275-P278 WeakPolarHBondContact O-CD 3.47Å; I276-P278 VanDerWaalsContact C-CD 3.49Å; I276-P278 WeakPolarHBondContact O-CD 2.93Å
279	G	92.8	Very high	93.1	Very high	3 Å²	3	47.1 Å²	47.1	3%	0.031	23%	0.232	C	C	.	.			trans	-63.1	136.3	-175.3	0	0	0	0	0	114	W241 F277 Q285	W241-G279 PolarHBondContact NE1-O 3.17Å; F277-G279 PolarHBondContact O-N 3.35Å; G279-Q285 VanDerWaalsContact N-OE1 3.15Å
280	K	88.3	Confident	92.9	Very high	172 Å²	172	46.9 Å²	46.9	75%	0.748	23%	0.231	S	C	*	.	S	Bend	trans	-80.8	-34.2	-179	-62.4	165.8	-175.2	169.1	0	112.7	D284	K280-D284 WeakPolarHBondContact CB-OD2 3.5Å; K280-D284 WeakPolarHBondContact CG-OD2 3.46Å; K280-D284 PolarHBondContact N-OD2 2.98Å
281	H	84.1	Confident	92.8	Very high	104 Å²	104	48.2 Å²	48.2	48%	0.481	25%	0.246	S	C	.	.	S	Bend	trans	-145.8	174.5	178.8	53.6	90.3	0	0	0	111.1	L283 D284 Q285	H281-L283 PolarHBondContact O-N 3.31Å; H281-D284 WeakPolarHBondContact O-CB 3.33Å; H281-D284 PolarHBondContact O-N 3.4Å; H281-Q285 PolarHBondContact O-N 3.24Å
282	Y	77.9	Confident	92.7	Very high	82 Å²	82	47.1 Å²	47.1	32%	0.322	24%	0.241	S	C	.	.	H	α-helix	trans	-48.6	-56.6	-172.2	-172.8	-81.4	0	0	0	113.9	M248 D284 Q285 L286	M248-Y282 VanDerWaalsContact CA-CZ 3.47Å; M248-Y282 VanDerWaalsContact CA-OH 3.32Å; M248-Y282 WeakPolarHBondContact CA-OH 3.22Å; M248-Y282 HydrophobicContact CB-CD1 4.49Å; M248-Y282 HydrophobicContact CB-CE1 4.02Å; M248-Y282 HydrophobicContact CB-CE2 4.26Å; M248-Y282 HydrophobicContact CG-CD2 4.24Å; M248-Y282 HydrophobicContact CG-CE2 4.11Å; M248-Y282 VanDerWaalsContact O-CE1 3.31Å; M248-Y282 WeakPolarHBondContact O-CE1 3.41Å; M248-Y282 PolarHBondContact O-OH 3.12Å; M248-Y282 VanDerWaalsContact O-OH 3.08Å; Y282-D284 VanDerWaalsContact C-N 3.3Å; Y282-D284 PolarHBondContact O-N 2.82Å; Y282-Q285 WeakPolarHBondContact O-CB 3.33Å; Y282-Q285 PolarHBondContact O-N 2.92Å; Y282-L286 PolarHBondContact O-N 3.39Å
283	L	82.4	Confident	92.7	Very high	79 Å²	79	46.3 Å²	46.3	41%	0.414	23%	0.233	S	C	.	.	H	α-helix	trans	-69.4	-25.5	179.1	-65	172.9	0	0	0	113.4	H281 N287 Y312	H281-L283 PolarHBondContact O-N 3.31Å; L283-N287 WeakPolarHBondContact O-CB 3.45Å; L283-N287 PolarHBondContact O-N 2.83Å; L283-N287 PolarHBondContact O-ND2 3.26Å; L283-Y312 HydrophobicContact CD2-CE1 4Å; L283-Y312 HydrophobicContact CD2-CE2 4.4Å
284	D	88.8	Confident	92.7	Very high	33 Å²	33	44 Å²	44	18%	0.176	22%	0.222	C	C	.	.	H	α-helix	trans	-74.3	-41.6	178.3	-167.4	43.5	0	0	0	110.7	K280 H281 Y282 L286 N287 H288	K280-D284 WeakPolarHBondContact CB-OD2 3.5Å; K280-D284 WeakPolarHBondContact CG-OD2 3.46Å; K280-D284 PolarHBondContact N-OD2 2.98Å; H281-D284 WeakPolarHBondContact O-CB 3.33Å; H281-D284 PolarHBondContact O-N 3.4Å; Y282-D284 VanDerWaalsContact C-N 3.3Å; Y282-D284 PolarHBondContact O-N 2.82Å; D284-L286 VanDerWaalsContact C-N 3.29Å; D284-L286 PolarHBondContact O-N 2.99Å; D284-N287 PolarHBondContact O-N 2.78Å; D284-N287 VanDerWaalsContact O-N 3.12Å; D284-H288 PolarHBondContact O-CD2 3.4Å; D284-H288 PolarHBondContact O-N 3.46Å; D284-H288 IonicContact OD1-CD2 2.87Å
285	Q	91.5	Very high	92.5	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-54.5	-45.4	170.8	-170.9	65.5	34.1	0	0	111.2	R240 W241 M248 F277 G279 H281 Y282 H288 I289	R240-Q285 HydrophobicContact CB-CG 4.38Å; R240-Q285 VanDerWaalsContact O-CD 3.24Å; R240-Q285 PolarHBondContact O-NE2 3.5Å; W241-Q285 PolarHBondContact O-NE2 3.46Å; M248-Q285 HydrophobicContact CE-CB 3.67Å; M248-Q285 HydrophobicContact CE-CG 3.54Å; M248-Q285 HydrophobicContact SD-CB 4.14Å; M248-Q285 HydrophobicContact SD-CG 3.64Å; F277-Q285 PolarHBondContact O-NE2 2.89Å; F277-Q285 PolarHBondContact O-OE1 2.84Å; G279-Q285 VanDerWaalsContact N-OE1 3.15Å; H281-Q285 PolarHBondContact O-N 3.24Å; Y282-Q285 WeakPolarHBondContact O-CB 3.33Å; Y282-Q285 PolarHBondContact O-N 2.92Å; Q285-H288 PolarHBondContact O-N 3.32Å; Q285-I289 HydrophobicContact CG-CD1 4.46Å; Q285-I289 WeakPolarHBondContact O-CG1 3.48Å; Q285-I289 PolarHBondContact O-N 2.85Å; Q285-I289 VanDerWaalsContact O-N 3.1Å
286	L	89.8	Confident	92.3	Very high	1 Å²	1	38 Å²	38	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-66.8	-39.8	177.5	-175.5	56.5	0	0	0	111.7	P245 M248 L249 Y282 D284 H288 I289 L290 Y312 L313	P245-L286 HydrophobicContact CB-CD1 4.47Å; M248-L286 VanDerWaalsContact CE-CA 3.46Å; M248-L286 HydrophobicContact CE-CB 3.58Å; M248-L286 HydrophobicContact CE-CD1 4.29Å; M248-L286 HydrophobicContact CE-CG 4.49Å; L249-L286 HydrophobicContact CD1-CD1 4.44Å; L249-L286 HydrophobicContact CD2-CD1 4.45Å; L249-L286 HydrophobicContact CD2-CD2 3.77Å; Y282-L286 PolarHBondContact O-N 3.39Å; D284-L286 VanDerWaalsContact C-N 3.29Å; D284-L286 PolarHBondContact O-N 2.99Å; L286-H288 VanDerWaalsContact C-N 3.35Å; L286-H288 PolarHBondContact O-N 3.38Å; L286-I289 PolarHBondContact O-N 2.99Å; L286-L290 HydrophobicContact CD1-CD1 4.06Å; L286-L290 HydrophobicContact CD1-CG 4.15Å; L286-L290 HydrophobicContact CG-CD1 3.98Å; L286-L290 HydrophobicContact CG-CG 4.47Å; L286-L290 WeakPolarHBondContact O-CB 3.42Å; L286-L290 VanDerWaalsContact O-CG 3.28Å; L286-L290 WeakPolarHBondContact O-CG 3.46Å; L286-L290 PolarHBondContact O-N 3.37Å; L286-Y312 HydrophobicContact CD2-CD1 4.2Å; L286-Y312 HydrophobicContact CD2-CE1 3.82Å; L286-L313 HydrophobicContact CD1-CD2 4.41Å; L286-L313 HydrophobicContact CD2-CD2 4.13Å; L286-L313 HydrophobicContact CG-CD2 4.48Å
287	N	91.1	Very high	92.1	Very high	53 Å²	53	39.2 Å²	39.2	28%	0.283	21%	0.209	S	C	.	.	H	α-helix	trans	-65.1	-35.8	177	-87.6	-60.3	0	0	0	113.7	L283 D284 G291 K319	L283-N287 WeakPolarHBondContact O-CB 3.45Å; L283-N287 PolarHBondContact O-N 2.83Å; L283-N287 PolarHBondContact O-ND2 3.26Å; D284-N287 PolarHBondContact O-N 2.78Å; D284-N287 VanDerWaalsContact O-N 3.12Å; N287-G291 PolarHBondContact O-N 3.04Å; N287-K319 PolarHBondContact O-NZ 3.18Å; N287-K319 PolarHBondContact OD1-NZ 3.08Å
288	H	95.6	Very high	91.7	Very high	67 Å²	67	44.1 Å²	44.1	31%	0.31	23%	0.232	S	C	.	.	H	α-helix	trans	-63.9	-48.2	171.4	-90.5	-79.1	0	0	0	111.9	F277 D284 Q285 L286 G291 V292	F277-H288 HydrophobicContact CB-CB 4.22Å; F277-H288 HydrophobicContact CD1-CB 4.31Å; D284-H288 PolarHBondContact O-CD2 3.4Å; D284-H288 PolarHBondContact O-N 3.46Å; D284-H288 IonicContact OD1-CD2 2.87Å; Q285-H288 PolarHBondContact O-N 3.32Å; L286-H288 VanDerWaalsContact C-N 3.35Å; L286-H288 PolarHBondContact O-N 3.38Å; H288-G291 WeakPolarHBondContact O-CA 3.38Å; H288-G291 PolarHBondContact O-N 3.06Å; H288-G291 VanDerWaalsContact O-N 3.08Å; H288-V292 PolarHBondContact O-N 3.37Å
289	I	96.1	Very high	91.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.8	-53	178.2	-68.7	170.8	0	0	0	111.1	P245 M248 W261 F277 Q285 L286 G291 V292 L293	P245-I289 HydrophobicContact CB-CD1 4.3Å; P245-I289 HydrophobicContact CB-CG2 4.44Å; M248-I289 HydrophobicContact CE-CD1 3.95Å; W261-I289 HydrophobicContact CH2-CD1 4.39Å; W261-I289 HydrophobicContact CH2-CG1 4.4Å; W261-I289 HydrophobicContact CH2-CG2 3.67Å; W261-I289 HydrophobicContact CZ2-CD1 3.69Å; W261-I289 HydrophobicContact CZ2-CG1 3.85Å; W261-I289 HydrophobicContact CZ2-CG2 4.01Å; F277-I289 HydrophobicContact CB-CG1 4.25Å; F277-I289 HydrophobicContact CD1-CG1 4Å; F277-I289 HydrophobicContact CD2-CG1 3.75Å; F277-I289 HydrophobicContact CE1-CG1 4.29Å; F277-I289 HydrophobicContact CE2-CG1 4.08Å; F277-I289 HydrophobicContact CG-CG1 3.72Å; F277-I289 HydrophobicContact CZ-CG1 4.34Å; Q285-I289 HydrophobicContact CG-CD1 4.46Å; Q285-I289 WeakPolarHBondContact O-CG1 3.48Å; Q285-I289 PolarHBondContact O-N 2.85Å; Q285-I289 VanDerWaalsContact O-N 3.1Å; L286-I289 PolarHBondContact O-N 2.99Å; I289-G291 PolarHBondContact O-N 2.94Å; I289-V292 PolarHBondContact O-N 3.42Å; I289-V292 VanDerWaalsContact O-N 3.11Å; I289-L293 HydrophobicContact CG2-CD1 3.95Å; I289-L293 HydrophobicContact CG2-CG 4.41Å; I289-L293 PolarHBondContact O-N 3.01Å
290	L	95.3	Very high	91.4	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-20	177.8	-60.8	174.1	0	0	0	112.7	L286 V292 G294 P296 L313 L316 K319 F345	L286-L290 HydrophobicContact CD1-CD1 4.06Å; L286-L290 HydrophobicContact CD1-CG 4.15Å; L286-L290 HydrophobicContact CG-CD1 3.98Å; L286-L290 HydrophobicContact CG-CG 4.47Å; L286-L290 WeakPolarHBondContact O-CB 3.42Å; L286-L290 VanDerWaalsContact O-CG 3.28Å; L286-L290 WeakPolarHBondContact O-CG 3.46Å; L286-L290 PolarHBondContact O-N 3.37Å; L290-V292 VanDerWaalsContact C-N 3.28Å; L290-G294 WeakPolarHBondContact CD2-O 3.23Å; L290-G294 CarbonylContact O-C 3.58Å; L290-G294 VanDerWaalsContact O-CA 3.28Å; L290-G294 WeakPolarHBondContact O-CA 3.38Å; L290-G294 PolarHBondContact O-N 2.68Å; L290-G294 VanDerWaalsContact O-N 3.12Å; L290-P296 HydrophobicContact CD2-CG 3.84Å; L290-L313 HydrophobicContact CD1-CD2 3.53Å; L290-L313 HydrophobicContact CD2-CD2 4.5Å; L290-L316 HydrophobicContact CD1-CD1 3.61Å; L290-K319 HydrophobicContact CB-CD 4.08Å; L290-K319 WeakPolarHBondContact O-CD 3.36Å; L290-F345 HydrophobicContact CD2-CD2 4.33Å; L290-F345 HydrophobicContact CD2-CE2 3.92Å
291	G	96.1	Very high	91.3	Very high	31 Å²	31	40.8 Å²	40.8	32%	0.32	22%	0.215	S	C	.	.	H	α-helix	trans	-69.1	-23.4	173.3	0	0	0	0	0	113.6	N287 H288 I289 I322	N287-G291 PolarHBondContact O-N 3.04Å; H288-G291 WeakPolarHBondContact O-CA 3.38Å; H288-G291 PolarHBondContact O-N 3.06Å; H288-G291 VanDerWaalsContact O-N 3.08Å; I289-G291 PolarHBondContact O-N 2.94Å; G291-I322 WeakPolarHBondContact O-CD1 3.3Å
292	V	97.2	Very high	91.4	Very high	15 Å²	15	40.2 Å²	40.2	9%	0.091	22%	0.216	C	C	.	.	H	α-helix	trans	-104.9	-50.3	176.2	175.1	0	0	0	0	111.4	F277 H288 I289 L290 G294 R321 I322 W324 L327	F277-V292 HydrophobicContact CE1-CB 3.92Å; F277-V292 HydrophobicContact CE1-CG2 3.87Å; H288-V292 PolarHBondContact O-N 3.37Å; I289-V292 PolarHBondContact O-N 3.42Å; I289-V292 VanDerWaalsContact O-N 3.11Å; L290-V292 VanDerWaalsContact C-N 3.28Å; V292-G294 PolarHBondContact O-N 3.26Å; V292-R321 WeakPolarHBondContact O-CA 3.35Å; V292-I322 PolarHBondContact O-N 3.15Å; V292-W324 HydrophobicContact CG1-CE3 4.31Å; V292-W324 HydrophobicContact CG1-CH2 4Å; V292-W324 HydrophobicContact CG1-CZ3 3.55Å; V292-L327 HydrophobicContact CG1-CD1 3.6Å; V292-L327 HydrophobicContact CG2-CD1 4.26Å
293	L	97	Very high	91.6	Very high	22 Å²	22	38.7 Å²	38.7	12%	0.115	22%	0.217	C	C	.	.	H	α-helix	trans	-73.4	-17.4	-177.1	-62.2	-172	0	0	0	113.4	W261 I289 R321 W324 L343 F345	W261-L293 HydrophobicContact CH2-CD1 3.72Å; W261-L293 HydrophobicContact CZ3-CD1 3.95Å; I289-L293 HydrophobicContact CG2-CD1 3.95Å; I289-L293 HydrophobicContact CG2-CG 4.41Å; I289-L293 PolarHBondContact O-N 3.01Å; L293-R321 WeakPolarHBondContact O-CB 3.46Å; L293-R321 WeakPolarHBondContact O-CG 3.45Å; L293-W324 HydrophobicContact CD2-CH2 3.7Å; L293-W324 HydrophobicContact CD2-CZ2 3.84Å; L293-L343 VanDerWaalsContact CD1-O 3.26Å; L293-L343 WeakPolarHBondContact CD1-O 3.49Å; L293-L343 WeakPolarHBondContact CD2-O 3.5Å; L293-F345 HydrophobicContact CD1-CB 4.03Å
294	G	96.1	Very high	91.6	Very high	3 Å²	3	35.3 Å²	35.3	3%	0.031	20%	0.199	C	C	.	.			trans	82.6	-170.6	-170.2	0	0	0	0	0	112.5	L290 V292 K319	L290-G294 WeakPolarHBondContact CD2-O 3.23Å; L290-G294 CarbonylContact O-C 3.58Å; L290-G294 VanDerWaalsContact O-CA 3.28Å; L290-G294 WeakPolarHBondContact O-CA 3.38Å; L290-G294 PolarHBondContact O-N 2.68Å; L290-G294 VanDerWaalsContact O-N 3.12Å; V292-G294 PolarHBondContact O-N 3.26Å; G294-K319 CarbonylContact C-O 3.48Å; G294-K319 WeakPolarHBondContact CA-O 3.42Å
295	S	94.3	Very high	91	Very high	33 Å²	33	40.2 Å²	40.2	23%	0.231	22%	0.224	C	C	.	.	S	Bend	trans	-72.8	140	172.4	-69.4	0	0	0	0	111	Q318 K319	S295-Q318 PolarHBondContact OG-OE1 3.37Å; S295-K319 PolarHBondContact N-O 3.44Å; S295-K319 PolarHBondContact OG-N 3.2Å
296	P	93.3	Very high	90.4	Very high	23 Å²	23	43.1 Å²	43.1	15%	0.149	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-67.9	153.5	-178.7	-17.5	33	0	0	0	111.9	L290 D300 L301 F345	L290-P296 HydrophobicContact CD2-CG 3.84Å; P296-D300 HydrophobicContact CB-CB 4.33Å; P296-L301 HydrophobicContact CB-CD2 4.1Å; P296-L301 HydrophobicContact CB-CG 4.21Å; P296-L301 HydrophobicContact CG-CD2 4.2Å; P296-F345 HydrophobicContact CB-CD1 3.85Å; P296-F345 HydrophobicContact CB-CE1 3.63Å; P296-F345 HydrophobicContact CB-CG 4.42Å; P296-F345 HydrophobicContact CB-CZ 4.01Å; P296-F345 HydrophobicContact CG-CD1 4.1Å; P296-F345 HydrophobicContact CG-CD2 4.22Å; P296-F345 HydrophobicContact CG-CE1 3.63Å; P296-F345 HydrophobicContact CG-CE2 3.76Å; P296-F345 HydrophobicContact CG-CG 4.38Å; P296-F345 HydrophobicContact CG-CZ 3.44Å; P296-F345 VanDerWaalsContact CG-CZ 3.44Å
297	S	92.4	Very high	90	Very high	51 Å²	51	48.1 Å²	48.1	36%	0.357	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-67.8	158.9	175.5	80.2	0	0	0	0	111.3	E299 D300 L301	S297-E299 PolarHBondContact O-N 3.32Å; S297-E299 PolarHBondContact OG-N 3.02Å; S297-D300 WeakPolarHBondContact CB-OD2 3.4Å; S297-D300 PolarHBondContact N-OD2 3.33Å; S297-D300 PolarHBondContact O-N 2.92Å; S297-D300 VanDerWaalsContact O-N 3.1Å; S297-D300 PolarHBondContact OG-N 2.97Å; S297-D300 PolarHBondContact OG-OD2 3.09Å; S297-L301 WeakPolarHBondContact O-CG 2.98Å; S297-L301 PolarHBondContact O-N 3.35Å
298	Q	90.1	Very high	89.5	Confident	104 Å²	104	54 Å²	54	49%	0.486	29%	0.289	S	S	.	.	H	α-helix	trans	-61.3	-28.3	176.6	-173.8	56.4	67.2	0	0	112.4	N302	Q298-N302 PolarHBondContact NE2-OD1 2.77Å; Q298-N302 PolarHBondContact O-N 2.83Å; Q298-N302 VanDerWaalsContact O-N 3.14Å; Q298-N302 PolarHBondContact O-ND2 2.89Å; Q298-N302 PolarHBondContact O-OD1 2.93Å
299	E	90.8	Very high	88.8	Confident	115 Å²	115	51.4 Å²	51.4	54%	0.537	28%	0.278	S	S	.	.	H	α-helix	trans	-66.2	-47.8	173.4	-164.3	-153.6	140.3	0	0	111	S297 L301 N302 C303 K349	S297-E299 PolarHBondContact O-N 3.32Å; S297-E299 PolarHBondContact OG-N 3.02Å; E299-L301 VanDerWaalsContact C-N 3.34Å; E299-L301 PolarHBondContact O-N 2.87Å; E299-N302 WeakPolarHBondContact O-CB 3.3Å; E299-N302 PolarHBondContact O-N 3.44Å; E299-C303 PolarHBondContact O-N 3.03Å; E299-K349 WeakPolarHBondContact OE1-CE 3.43Å; E299-K349 IonicContact OE1-NZ 2.66Å; E299-K349 PolarHBondContact OE1-NZ 3.02Å; E299-K349 IonicContact OE2-NZ 3.27Å; E299-K349 PolarHBondContact OE2-NZ 3.47Å
300	D	90.4	Very high	88.3	Confident	22 Å²	22	54.2 Å²	54.2	12%	0.118	29%	0.289	C	S	.	.	H	α-helix	trans	-69.4	-32.7	-179.4	-50	-48.6	0	0	0	111.9	P296 S297 N302 C303 F345 N346 K349	P296-D300 HydrophobicContact CB-CB 4.33Å; S297-D300 WeakPolarHBondContact CB-OD2 3.4Å; S297-D300 PolarHBondContact N-OD2 3.33Å; S297-D300 PolarHBondContact O-N 2.92Å; S297-D300 VanDerWaalsContact O-N 3.1Å; S297-D300 PolarHBondContact OG-N 2.97Å; S297-D300 PolarHBondContact OG-OD2 3.09Å; D300-N302 VanDerWaalsContact C-N 3.29Å; D300-N302 PolarHBondContact O-N 3.46Å; D300-C303 WeakPolarHBondContact O-CB 3.19Å; D300-C303 PolarHBondContact O-N 3.02Å; D300-F345 HydrophobicContact CB-CD1 4.09Å; D300-F345 HydrophobicContact CB-CE1 4.42Å; D300-N346 HydrophobicContact CB-CB 4.12Å; D300-N346 VanDerWaalsContact OD1-CB 3.29Å; D300-N346 WeakPolarHBondContact OD1-CB 3.3Å; D300-N346 PolarHBondContact OD1-ND2 3.12Å; D300-K349 IonicContact OD1-NZ 3.87Å; D300-K349 PolarHBondContact OD1-NZ 3.48Å
301	L	87.6	Confident	87.8	Confident	13 Å²	13	58 Å²	58	7%	0.068	31%	0.309	C	S	.	.	H	α-helix	trans	-63.9	-32.9	169.8	-69.1	176.9	0	0	0	112.4	P296 S297 E299 C303 I304 R310 L313 Q314	P296-L301 HydrophobicContact CB-CD2 4.1Å; P296-L301 HydrophobicContact CB-CG 4.21Å; P296-L301 HydrophobicContact CG-CD2 4.2Å; S297-L301 WeakPolarHBondContact O-CG 2.98Å; S297-L301 PolarHBondContact O-N 3.35Å; E299-L301 VanDerWaalsContact C-N 3.34Å; E299-L301 PolarHBondContact O-N 2.87Å; L301-C303 VanDerWaalsContact C-N 3.31Å; L301-I304 HydrophobicContact CD2-CD1 4.13Å; L301-I304 PolarHBondContact O-N 2.87Å; L301-R310 PolarHBondContact O-NE 2.86Å; L301-L313 HydrophobicContact CD2-CB 3.81Å; L301-L313 HydrophobicContact CD2-CD1 3.67Å; L301-L313 HydrophobicContact CD2-CG 4.42Å; L301-Q314 HydrophobicContact CD1-CG 3.91Å
302	N	86.3	Confident	87.3	Confident	92 Å²	92	59.8 Å²	59.8	49%	0.492	31%	0.307	S	S	.	.	H	α-helix	trans	-70.2	-28.3	176.9	-67.2	-15.7	0	0	0	112	Q298 E299 D300 I304 R310	Q298-N302 PolarHBondContact NE2-OD1 2.77Å; Q298-N302 PolarHBondContact O-N 2.83Å; Q298-N302 VanDerWaalsContact O-N 3.14Å; Q298-N302 PolarHBondContact O-ND2 2.89Å; Q298-N302 PolarHBondContact O-OD1 2.93Å; E299-N302 WeakPolarHBondContact O-CB 3.3Å; E299-N302 PolarHBondContact O-N 3.44Å; D300-N302 VanDerWaalsContact C-N 3.29Å; D300-N302 PolarHBondContact O-N 3.46Å; N302-I304 VanDerWaalsContact C-N 3.26Å; N302-I304 PolarHBondContact O-N 3.23Å; N302-R310 PolarHBondContact O-NH2 2.84Å
303	C	82.3	Confident	86.9	Confident	51 Å²	51	59.5 Å²	59.5	35%	0.345	31%	0.305	S	S	.	.	H	α-helix	trans	-69.5	-18.8	173.1	-61.3	0	0	0	0	113.7	E299 D300 L301 I305 N346	E299-C303 PolarHBondContact O-N 3.03Å; D300-C303 WeakPolarHBondContact O-CB 3.19Å; D300-C303 PolarHBondContact O-N 3.02Å; L301-C303 VanDerWaalsContact C-N 3.31Å; C303-I305 PolarHBondContact O-N 2.79Å; C303-N346 PolarHBondContact SG-ND2 3.45Å; C303-N346 VanDerWaalsContact SG-ND2 3.43Å
304	I	81.9	Confident	86.5	Confident	7 Å²	7	63.1 Å²	63.1	4%	0.036	32%	0.321	C	S	.	.			trans	-77.9	107.6	177.5	-59.5	171.7	0	0	0	109	L249 L301 N302 N306 A309 R310 L313 F345	L249-I304 HydrophobicContact CB-CG2 4.39Å; L249-I304 HydrophobicContact CD1-CD1 3.97Å; L301-I304 HydrophobicContact CD2-CD1 4.13Å; L301-I304 PolarHBondContact O-N 2.87Å; N302-I304 VanDerWaalsContact C-N 3.26Å; N302-I304 PolarHBondContact O-N 3.23Å; I304-N306 VanDerWaalsContact C-N 3.34Å; I304-N306 HydrophobicContact CG2-CB 4.46Å; I304-A309 HydrophobicContact CG2-CB 4.12Å; I304-R310 HydrophobicContact CG2-CB 4.39Å; I304-R310 PolarHBondContact O-NE 3.41Å; I304-R310 PolarHBondContact O-NH2 3.48Å; I304-L313 HydrophobicContact CD1-CD1 3.28Å; I304-F345 HydrophobicContact CD1-CE1 4.24Å; I304-F345 HydrophobicContact CD1-CZ 4.27Å
305	I	76.2	Confident	86.2	Confident	136 Å²	136	67.1 Å²	67.1	70%	0.697	35%	0.348	S	S	*	.			trans	-70	-33.9	-178.1	-60.6	169.3	0	0	0	110.9	N250 C303 L307	N250-I305 PolarHBondContact OD1-N 2.89Å; C303-I305 PolarHBondContact O-N 2.79Å; I305-L307 PolarHBondContact O-N 2.78Å; I305-L307 VanDerWaalsContact O-N 3.09Å
306	N	78.9	Confident	86	Confident	62 Å²	62	67 Å²	67	33%	0.332	35%	0.345	S	S	.	.			trans	-72.5	103.1	-179.4	-178.8	-1.1	0	0	0	112.1	L249 N250 I304 K308 A309 R310	L249-N306 WeakPolarHBondContact O-CB 3.12Å; L249-N306 PolarHBondContact O-ND2 3.29Å; N250-N306 PolarHBondContact OD1-N 2.91Å; I304-N306 VanDerWaalsContact C-N 3.34Å; I304-N306 HydrophobicContact CG2-CB 4.46Å; N306-K308 VanDerWaalsContact C-N 3.26Å; N306-K308 PolarHBondContact O-N 3.19Å; N306-K308 WeakPolarHBondContact OD1-CB 3.41Å; N306-K308 PolarHBondContact OD1-N 3.01Å; N306-A309 HydrophobicContact CB-CB 3.96Å; N306-A309 PolarHBondContact O-N 3.3Å; N306-A309 PolarHBondContact OD1-N 2.68Å; N306-R310 PolarHBondContact O-N 3.32Å
307	L	81	Confident	86	Confident	106 Å²	106	70.7 Å²	70.7	56%	0.555	37%	0.369	S	S	*	.	H	α-helix	trans	-57.3	-33.8	179.7	-172.7	63.3	0	0	0	113.4	I305 N311	I305-L307 PolarHBondContact O-N 2.78Å; I305-L307 VanDerWaalsContact O-N 3.09Å; L307-N311 WeakPolarHBondContact CD1-OD1 3.39Å; L307-N311 WeakPolarHBondContact O-CB 3.26Å; L307-N311 PolarHBondContact O-N 3.3Å; L307-N311 PolarHBondContact O-OD1 3.32Å
308	K	80.2	Confident	86	Confident	178 Å²	178	76.2 Å²	76.2	77%	0.774	39%	0.389	S	S	*	.	H	α-helix	trans	-65.8	-42	176.3	-67.8	-178.5	178.2	177.9	0	111.3	N306 Y312	N306-K308 VanDerWaalsContact C-N 3.26Å; N306-K308 PolarHBondContact O-N 3.19Å; N306-K308 WeakPolarHBondContact OD1-CB 3.41Å; N306-K308 PolarHBondContact OD1-N 3.01Å; K308-Y312 WeakPolarHBondContact O-CB 3.38Å; K308-Y312 PolarHBondContact O-N 2.73Å
309	A	81.2	Confident	86.3	Confident	11 Å²	11	74.1 Å²	74.1	9%	0.091	38%	0.379	C	S	.	.	H	α-helix	trans	-70.1	-40.8	178.4	0	0	0	0	0	112	L249 I304 N306 Y312 L313	L249-A309 HydrophobicContact CB-CB 4.11Å; L249-A309 HydrophobicContact CD2-CB 3.85Å; L249-A309 WeakPolarHBondContact O-CB 3.49Å; I304-A309 HydrophobicContact CG2-CB 4.12Å; N306-A309 HydrophobicContact CB-CB 3.96Å; N306-A309 PolarHBondContact O-N 3.3Å; N306-A309 PolarHBondContact OD1-N 2.68Å; A309-Y312 PolarHBondContact O-N 3.36Å; A309-L313 WeakPolarHBondContact O-CG 3.44Å; A309-L313 PolarHBondContact O-N 3.21Å
310	R	85	Confident	86.5	Confident	60 Å²	60	74.8 Å²	74.8	23%	0.226	39%	0.391	C	S	.	.	H	α-helix	trans	-59.3	-50.5	173.2	-171.4	-172	-65.8	177.7	-1.3	111.5	L301 N302 I304 N306 Y312 L313 Q314	L301-R310 PolarHBondContact O-NE 2.86Å; N302-R310 PolarHBondContact O-NH2 2.84Å; I304-R310 HydrophobicContact CG2-CB 4.39Å; I304-R310 PolarHBondContact O-NE 3.41Å; I304-R310 PolarHBondContact O-NH2 3.48Å; N306-R310 PolarHBondContact O-N 3.32Å; R310-Y312 VanDerWaalsContact C-N 3.32Å; R310-Y312 PolarHBondContact O-N 3.31Å; R310-L313 PolarHBondContact O-N 2.98Å; R310-Q314 WeakPolarHBondContact O-CG 3.49Å; R310-Q314 PolarHBondContact O-N 2.87Å
311	N	86.4	Confident	86.8	Confident	84 Å²	84	79.1 Å²	79.1	45%	0.449	41%	0.406	S	S	.	.	H	α-helix	trans	-62.5	-38.2	178.8	-67.9	6.1	0	0	0	111.9	L307 Q314 S315	L307-N311 WeakPolarHBondContact CD1-OD1 3.39Å; L307-N311 WeakPolarHBondContact O-CB 3.26Å; L307-N311 PolarHBondContact O-N 3.3Å; L307-N311 PolarHBondContact O-OD1 3.32Å; N311-Q314 PolarHBondContact O-N 3Å; N311-S315 PolarHBondContact O-N 3.13Å
312	Y	85.6	Confident	87.2	Confident	67 Å²	67	80.8 Å²	80.8	26%	0.263	41%	0.414	S	S	.	.	H	α-helix	trans	-59.6	-51.2	173.7	173.3	-103.8	0	0	0	111.5	L283 L286 K308 A309 R310 Q314 S315 L316	L283-Y312 HydrophobicContact CD2-CE1 4Å; L283-Y312 HydrophobicContact CD2-CE2 4.4Å; L286-Y312 HydrophobicContact CD2-CD1 4.2Å; L286-Y312 HydrophobicContact CD2-CE1 3.82Å; K308-Y312 WeakPolarHBondContact O-CB 3.38Å; K308-Y312 PolarHBondContact O-N 2.73Å; A309-Y312 PolarHBondContact O-N 3.36Å; R310-Y312 VanDerWaalsContact C-N 3.32Å; R310-Y312 PolarHBondContact O-N 3.31Å; Y312-Q314 VanDerWaalsContact C-N 3.31Å; Y312-Q314 PolarHBondContact O-N 3.39Å; Y312-S315 WeakPolarHBondContact O-CB 3.47Å; Y312-S315 PolarHBondContact O-N 3.23Å; Y312-S315 PolarHBondContact O-OG 3.21Å; Y312-L316 HydrophobicContact CE1-CD1 4.01Å; Y312-L316 HydrophobicContact CE1-CD2 4.41Å; Y312-L316 HydrophobicContact CE1-CG 4.42Å; Y312-L316 HydrophobicContact CE2-CD2 4.23Å; Y312-L316 PolarHBondContact O-N 3.09Å
313	L	87.4	Confident	87.7	Confident	10 Å²	10	79.6 Å²	79.6	5%	0.052	41%	0.411	C	S	.	.	H	α-helix	trans	-59.8	-40.5	178.2	-71.1	174.1	0	0	0	112.4	L249 L286 L290 L301 I304 A309 R310 S315 L316 F345	L249-L313 HydrophobicContact CD1-CD1 4.02Å; L249-L313 HydrophobicContact CD2-CD1 3.7Å; L249-L313 HydrophobicContact CD2-CD2 4.24Å; L249-L313 HydrophobicContact CD2-CG 3.96Å; L286-L313 HydrophobicContact CD1-CD2 4.41Å; L286-L313 HydrophobicContact CD2-CD2 4.13Å; L286-L313 HydrophobicContact CG-CD2 4.48Å; L290-L313 HydrophobicContact CD1-CD2 3.53Å; L290-L313 HydrophobicContact CD2-CD2 4.5Å; L301-L313 HydrophobicContact CD2-CB 3.81Å; L301-L313 HydrophobicContact CD2-CD1 3.67Å; L301-L313 HydrophobicContact CD2-CG 4.42Å; I304-L313 HydrophobicContact CD1-CD1 3.28Å; A309-L313 WeakPolarHBondContact O-CG 3.44Å; A309-L313 PolarHBondContact O-N 3.21Å; R310-L313 PolarHBondContact O-N 2.98Å; L313-S315 PolarHBondContact O-N 2.93Å; L313-L316 HydrophobicContact CD2-CD1 4.24Å; L313-L316 PolarHBondContact O-N 2.89Å; L313-F345 HydrophobicContact CD1-CZ 4.15Å
314	Q	89.3	Confident	88.4	Confident	98 Å²	98	78.2 Å²	78.2	46%	0.458	40%	0.399	S	S	.	.	H	α-helix	trans	-68.4	-20.5	176.5	-71.2	177.5	-51.4	0	0	113.7	L301 R310 N311 Y312	L301-Q314 HydrophobicContact CD1-CG 3.91Å; R310-Q314 WeakPolarHBondContact O-CG 3.49Å; R310-Q314 PolarHBondContact O-N 2.87Å; N311-Q314 PolarHBondContact O-N 3Å; Y312-Q314 VanDerWaalsContact C-N 3.31Å; Y312-Q314 PolarHBondContact O-N 3.39Å
315	S	90.4	Very high	89.1	Confident	86 Å²	86	82.7 Å²	82.7	60%	0.601	42%	0.423	S	S	*	.	H	α-helix	trans	-83.9	-10.5	174.7	77.2	0	0	0	0	114.4	N311 Y312 L313	N311-S315 PolarHBondContact O-N 3.13Å; Y312-S315 WeakPolarHBondContact O-CB 3.47Å; Y312-S315 PolarHBondContact O-N 3.23Å; Y312-S315 PolarHBondContact O-OG 3.21Å; L313-S315 PolarHBondContact O-N 2.93Å
316	L	89.8	Confident	90.1	Very high	30 Å²	30	85.4 Å²	85.4	16%	0.157	42%	0.424	C	S	.	.	S	Bend	trans	-77.3	145.9	179.1	-64.8	177.9	0	0	0	111.2	L290 Y312 L313	L290-L316 HydrophobicContact CD1-CD1 3.61Å; Y312-L316 HydrophobicContact CE1-CD1 4.01Å; Y312-L316 HydrophobicContact CE1-CD2 4.41Å; Y312-L316 HydrophobicContact CE1-CG 4.42Å; Y312-L316 HydrophobicContact CE2-CD2 4.23Å; Y312-L316 PolarHBondContact O-N 3.09Å; L313-L316 HydrophobicContact CD2-CD1 4.24Å; L313-L316 PolarHBondContact O-N 2.89Å
317	P	92.7	Very high	90.9	Very high	102 Å²	102	85.6 Å²	85.6	66%	0.662	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-55.3	142.4	168.7	-24.5	34.3	0	0	0	111.7	K319	P317-K319 PolarHBondContact O-N 2.97Å
318	Q	93.6	Very high	91.7	Very high	166 Å²	166	81.3 Å²	81.3	78%	0.776	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-61.4	126.8	177.5	-74	-66.6	-22.5	0	0	111.3	S295	S295-Q318 PolarHBondContact OG-OE1 3.37Å
319	K	94.8	Very high	92.5	Very high	60 Å²	60	77.9 Å²	77.9	26%	0.261	40%	0.398	S	S	.	.			trans	-112.8	125.6	178.3	-66.4	177.6	-176.5	173.8	0	109.8	N287 L290 G294 S295 P317	N287-K319 PolarHBondContact O-NZ 3.18Å; N287-K319 PolarHBondContact OD1-NZ 3.08Å; L290-K319 HydrophobicContact CB-CD 4.08Å; L290-K319 WeakPolarHBondContact O-CD 3.36Å; G294-K319 CarbonylContact C-O 3.48Å; G294-K319 WeakPolarHBondContact CA-O 3.42Å; S295-K319 PolarHBondContact N-O 3.44Å; S295-K319 PolarHBondContact OG-N 3.2Å; P317-K319 PolarHBondContact O-N 2.97Å
320	T	95.3	Very high	93.2	Very high	130 Å²	130	87.2 Å²	87.2	80%	0.798	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-73.2	138.5	169.8	-47.1	0	0	0	0	109.9
321	R	95.9	Very high	93.8	Very high	113 Å²	113	85.5 Å²	85.5	43%	0.426	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-58.6	137.6	172.5	-175.2	171	-176.4	170.4	5.5	111.1	V292 L293 C340	V292-R321 WeakPolarHBondContact O-CA 3.35Å; L293-R321 WeakPolarHBondContact O-CB 3.46Å; L293-R321 WeakPolarHBondContact O-CG 3.45Å; R321-C340 PolarHBondContact NH2-SG 2.82Å
322	I	96.9	Very high	94.3	Very high	48 Å²	48	83.6 Å²	83.6	25%	0.246	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-85.3	125.4	169.6	-55.1	-176.9	0	0	0	108.3	G291 V292 L327	G291-I322 WeakPolarHBondContact O-CD1 3.3Å; V292-I322 PolarHBondContact O-N 3.15Å; I322-L327 HydrophobicContact CG2-CD1 4.18Å; I322-L327 HydrophobicContact CG2-CD2 4.06Å; I322-L327 HydrophobicContact CG2-CG 3.84Å
323	P	96.8	Very high	94.9	Very high	67 Å²	67	85.4 Å²	85.4	44%	0.435	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-60.2	142	172.9	-27	37.8	0	0	0	112.9	D325 R326 L327	P323-D325 WeakPolarHBondContact CB-OD1 3.17Å; P323-R326 HydrophobicContact CB-CB 4.4Å; P323-R326 WeakPolarHBondContact O-CB 3.31Å; P323-R326 PolarHBondContact O-N 2.88Å; P323-L327 PolarHBondContact O-N 3.09Å
324	W	97.3	Very high	95.5	Very high	21 Å²	21	88.2 Å²	88.2	8%	0.08	46%	0.457	C	S	.	.	H	α-helix	trans	-68.1	-38	-175.3	-64.7	131.9	0	0	0	113.3	I276 V292 L293 R326 L327 F328 L336 L339 C340 L343	I276-W324 HydrophobicContact CD1-CZ3 3.91Å; V292-W324 HydrophobicContact CG1-CE3 4.31Å; V292-W324 HydrophobicContact CG1-CH2 4Å; V292-W324 HydrophobicContact CG1-CZ3 3.55Å; L293-W324 HydrophobicContact CD2-CH2 3.7Å; L293-W324 HydrophobicContact CD2-CZ2 3.84Å; W324-R326 PolarHBondContact O-N 2.81Å; W324-L327 HydrophobicContact CE3-CD1 4.07Å; W324-L327 HydrophobicContact CZ3-CD1 4.25Å; W324-L327 PolarHBondContact O-N 3.32Å; W324-F328 HydrophobicContact CE3-CE2 4.01Å; W324-F328 HydrophobicContact CZ3-CE2 4.46Å; W324-F328 WeakPolarHBondContact O-CD2 3.1Å; W324-F328 PolarHBondContact O-N 2.94Å; W324-L336 HydrophobicContact CB-CB 4.15Å; W324-L336 HydrophobicContact CB-CD1 4.2Å; W324-L336 HydrophobicContact CB-CD2 4.28Å; W324-L336 HydrophobicContact CB-CG 4.45Å; W324-L339 HydrophobicContact CD2-CD2 4.47Å; W324-L339 HydrophobicContact CE3-CD2 4.23Å; W324-L339 HydrophobicContact CZ3-CD2 4.48Å; W324-C340 VanDerWaalsContact NE1-CA 3.29Å; W324-C340 PolarHBondContact NE1-SG 3.44Å; W324-C340 VanDerWaalsContact NE1-SG 3.42Å; W324-L343 HydrophobicContact CH2-CB 3.95Å; W324-L343 HydrophobicContact CH2-CD1 3.68Å; W324-L343 HydrophobicContact CH2-CG 4.46Å; W324-L343 HydrophobicContact CZ2-CB 4.03Å; W324-L343 HydrophobicContact CZ2-CD1 4.42Å; W324-L343 HydrophobicContact CZ3-CD1 4.25Å
325	D	96.5	Very high	95.9	Very high	102 Å²	102	83.6 Å²	83.6	55%	0.545	44%	0.435	S	S	.	.	H	α-helix	trans	-57.1	-36.1	173.2	64.1	-44.7	0	0	0	111.9	P323 L327 F328 P329 L336	P323-D325 WeakPolarHBondContact CB-OD1 3.17Å; D325-L327 VanDerWaalsContact C-N 3.32Å; D325-L327 PolarHBondContact O-N 3.05Å; D325-F328 CarbonylContact O-C 3.59Å; D325-F328 PolarHBondContact O-N 3.48Å; D325-P329 WeakPolarHBondContact O-CA 3.32Å; D325-P329 WeakPolarHBondContact O-CB 3.33Å; D325-P329 WeakPolarHBondContact O-CD 3.45Å; D325-L336 HydrophobicContact CB-CD1 4.45Å
326	R	96.8	Very high	96.3	Very high	192 Å²	192	80.3 Å²	80.3	73%	0.725	41%	0.411	S	S	*	.	H	α-helix	trans	-68.1	-29.6	174.9	-175	177.1	175.8	-169.4	-1.1	113.1	P323 W324	P323-R326 HydrophobicContact CB-CB 4.4Å; P323-R326 WeakPolarHBondContact O-CB 3.31Å; P323-R326 PolarHBondContact O-N 2.88Å; W324-R326 PolarHBondContact O-N 2.81Å
327	L	96.5	Very high	96.7	Very high	66 Å²	66	83.3 Å²	83.3	35%	0.346	43%	0.427	S	S	.	.	H	α-helix	trans	-84.2	-35.7	176.1	-68.5	175.6	0	0	0	112.1	V292 I322 P323 W324 D325 P329	V292-L327 HydrophobicContact CG1-CD1 3.6Å; V292-L327 HydrophobicContact CG2-CD1 4.26Å; I322-L327 HydrophobicContact CG2-CD1 4.18Å; I322-L327 HydrophobicContact CG2-CD2 4.06Å; I322-L327 HydrophobicContact CG2-CG 3.84Å; P323-L327 PolarHBondContact O-N 3.09Å; W324-L327 HydrophobicContact CE3-CD1 4.07Å; W324-L327 HydrophobicContact CZ3-CD1 4.25Å; W324-L327 PolarHBondContact O-N 3.32Å; D325-L327 VanDerWaalsContact C-N 3.32Å; D325-L327 PolarHBondContact O-N 3.05Å; L327-P329 VanDerWaalsContact C-CD 3.43Å; L327-P329 WeakPolarHBondContact O-CD 3.44Å
328	F	97.6	Very high	97	Very high	17 Å²	17	78.5 Å²	78.5	8%	0.075	40%	0.396	C	S	.	.			trans	-128.7	60.2	-173.1	-49.6	-71	0	0	0	111.7	A268 L271 I276 W324 D325 K330 A331 L336 L339	A268-F328 HydrophobicContact CB-CE1 4.42Å; A268-F328 HydrophobicContact CB-CZ 3.81Å; A268-F328 WeakPolarHBondContact O-CE1 3.18Å; L271-F328 HydrophobicContact CB-CD1 3.95Å; L271-F328 HydrophobicContact CB-CE1 4.37Å; L271-F328 HydrophobicContact CB-CG 4.47Å; I276-F328 HydrophobicContact CD1-CZ 4.25Å; W324-F328 HydrophobicContact CE3-CE2 4.01Å; W324-F328 HydrophobicContact CZ3-CE2 4.46Å; W324-F328 WeakPolarHBondContact O-CD2 3.1Å; W324-F328 PolarHBondContact O-N 2.94Å; D325-F328 CarbonylContact O-C 3.59Å; D325-F328 PolarHBondContact O-N 3.48Å; F328-K330 PolarHBondContact O-N 3.22Å; F328-A331 HydrophobicContact CB-CB 3.84Å; F328-A331 WeakPolarHBondContact O-CB 3.47Å; F328-A331 PolarHBondContact O-N 3.17Å; F328-L336 HydrophobicContact CB-CD2 3.83Å; F328-L336 HydrophobicContact CD2-CD2 3.81Å; F328-L336 HydrophobicContact CG-CD2 4.15Å; F328-L339 HydrophobicContact CD2-CD2 4.04Å; F328-L339 HydrophobicContact CE2-CD2 3.63Å; F328-L339 HydrophobicContact CZ-CD2 4.36Å
329	P	96.8	Very high	97.3	Very high	106 Å²	106	70.6 Å²	70.6	69%	0.688	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	14.8	-169.8	30.2	-38.7	0	0	0	115.4	D325 L327	D325-P329 WeakPolarHBondContact O-CA 3.32Å; D325-P329 WeakPolarHBondContact O-CB 3.33Å; D325-P329 WeakPolarHBondContact O-CD 3.45Å; L327-P329 VanDerWaalsContact C-CD 3.43Å; L327-P329 WeakPolarHBondContact O-CD 3.44Å
330	K	95.2	Very high	97.4	Very high	206 Å²	206	69.2 Å²	69.2	90%	0.896	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.6	2.8	175.8	-62.1	-167.9	175.5	-164.7	0	112.9	F328	F328-K330 PolarHBondContact O-N 3.22Å
331	A	97.6	Very high	97.6	Very high	24 Å²	24	65 Å²	65	20%	0.198	33%	0.331	C	S	.	.	S	Bend	trans	-79.4	156.9	177.3	0	0	0	0	0	111	L271 F328 L336	L271-A331 HydrophobicContact CD1-CB 4.14Å; L271-A331 HydrophobicContact CD2-CB 3.81Å; L271-A331 HydrophobicContact CG-CB 4.48Å; F328-A331 HydrophobicContact CB-CB 3.84Å; F328-A331 WeakPolarHBondContact O-CB 3.47Å; F328-A331 PolarHBondContact O-N 3.17Å; A331-L336 HydrophobicContact CB-CD1 4.15Å; A331-L336 HydrophobicContact CB-CD2 3.66Å; A331-L336 HydrophobicContact CB-CG 3.87Å
332	D	98.1	Very high	97.7	Very high	45 Å²	45	59.6 Å²	59.6	24%	0.241	31%	0.311	C	S	.	.			trans	-63.7	130.9	171	-169.7	-46.4	0	0	0	110.3	N172 K334 A335 L336 Y361	N172-D332 PolarHBondContact ND2-OD2 2.88Å; D332-K334 PolarHBondContact O-N 2.73Å; D332-K334 VanDerWaalsContact OD1-CB 3.31Å; D332-K334 WeakPolarHBondContact OD1-CB 3.4Å; D332-K334 PolarHBondContact OD1-N 2.84Å; D332-A335 HydrophobicContact CB-CB 4Å; D332-A335 WeakPolarHBondContact O-CA 3.32Å; D332-A335 WeakPolarHBondContact O-CB 3.31Å; D332-A335 PolarHBondContact O-N 2.94Å; D332-L336 PolarHBondContact O-N 2.99Å; D332-L336 VanDerWaalsContact O-N 3.11Å; D332-Y361 HydrophobicContact CB-CE2 4.01Å
333	P	98.4	Very high	97.8	Very high	105 Å²	105	57.3 Å²	57.3	68%	0.682	30%	0.3	S	S	*	.	H	α-helix	trans	-53.1	-35.3	175.6	-27.6	35.9	0	0	0	113.6	L336 D337	P333-L336 PolarHBondContact O-N 2.95Å; P333-D337 PolarHBondContact O-N 2.66Å
334	K	98.6	Very high	97.8	Very high	69 Å²	69	55.9 Å²	55.9	30%	0.3	29%	0.289	S	S	.	.	H	α-helix	trans	-68	-34.9	176.1	-59.3	-175.5	168.7	-166.5	0	112.2	D332 L336 D337 L338 H359 P360 Y361 E363	D332-K334 PolarHBondContact O-N 2.73Å; D332-K334 VanDerWaalsContact OD1-CB 3.31Å; D332-K334 WeakPolarHBondContact OD1-CB 3.4Å; D332-K334 PolarHBondContact OD1-N 2.84Å; K334-L336 VanDerWaalsContact C-N 3.32Å; K334-D337 PolarHBondContact O-N 2.57Å; K334-L338 PolarHBondContact O-N 3.22Å; K334-L338 VanDerWaalsContact O-N 3.11Å; K334-H359 PolarHBondContact O-CE1 3.43Å; K334-H359 VanDerWaalsContact O-CE1 3.32Å; K334-P360 HydrophobicContact CD-CB 4.32Å; K334-P360 VanDerWaalsContact CD-O 3.26Å; K334-P360 WeakPolarHBondContact CD-O 3.36Å; K334-P360 PolarHBondContact NZ-O 2.6Å; K334-Y361 HydrophobicContact CB-CD2 3.94Å; K334-Y361 HydrophobicContact CB-CG 4.3Å; K334-E363 IonicContact NZ-OE1 2.77Å; K334-E363 PolarHBondContact NZ-OE1 3.18Å; K334-E363 IonicContact NZ-OE2 3.83Å; K334-E363 PolarHBondContact NZ-OE2 3.01Å
335	A	98.6	Very high	97.7	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-66.5	-37.3	174.4	0	0	0	0	0	111.3	D332 L339 Y361	D332-A335 HydrophobicContact CB-CB 4Å; D332-A335 WeakPolarHBondContact O-CA 3.32Å; D332-A335 WeakPolarHBondContact O-CB 3.31Å; D332-A335 PolarHBondContact O-N 2.94Å; A335-L339 WeakPolarHBondContact O-CB 3.07Å; A335-L339 PolarHBondContact O-N 3.08Å; A335-Y361 HydrophobicContact CB-CD1 4.2Å; A335-Y361 HydrophobicContact CB-CD2 3.97Å; A335-Y361 HydrophobicContact CB-CE1 3.87Å; A335-Y361 HydrophobicContact CB-CE2 3.64Å; A335-Y361 HydrophobicContact CB-CG 4.24Å
336	L	98.6	Very high	97.5	Very high	18 Å²	18	51.3 Å²	51.3	9%	0.094	27%	0.266	C	S	.	.	H	α-helix	trans	-73.2	-29.2	178.5	-61.1	-172.2	0	0	0	113.2	L271 W324 D325 F328 A331 D332 P333 K334 L339 C340	L271-L336 HydrophobicContact CD1-CD2 3.96Å; W324-L336 HydrophobicContact CB-CB 4.15Å; W324-L336 HydrophobicContact CB-CD1 4.2Å; W324-L336 HydrophobicContact CB-CD2 4.28Å; W324-L336 HydrophobicContact CB-CG 4.45Å; D325-L336 HydrophobicContact CB-CD1 4.45Å; F328-L336 HydrophobicContact CB-CD2 3.83Å; F328-L336 HydrophobicContact CD2-CD2 3.81Å; F328-L336 HydrophobicContact CG-CD2 4.15Å; A331-L336 HydrophobicContact CB-CD1 4.15Å; A331-L336 HydrophobicContact CB-CD2 3.66Å; A331-L336 HydrophobicContact CB-CG 3.87Å; D332-L336 PolarHBondContact O-N 2.99Å; D332-L336 VanDerWaalsContact O-N 3.11Å; P333-L336 PolarHBondContact O-N 2.95Å; K334-L336 VanDerWaalsContact C-N 3.32Å; L336-L339 HydrophobicContact CD2-CD2 4.21Å; L336-C340 WeakPolarHBondContact O-CB 3.24Å; L336-C340 PolarHBondContact O-N 3.36Å
337	D	98.8	Very high	97.2	Very high	93 Å²	93	43.6 Å²	43.6	50%	0.497	24%	0.241	S	C	.	.	H	α-helix	trans	-70.2	-47.9	171.7	-154.9	38.3	0	0	0	111	P333 K334 L339 C340 C341 H359	P333-D337 PolarHBondContact O-N 2.66Å; K334-D337 PolarHBondContact O-N 2.57Å; D337-L339 VanDerWaalsContact C-N 3.31Å; D337-L339 PolarHBondContact O-N 2.98Å; D337-C340 WeakPolarHBondContact O-CA 3.45Å; D337-C340 WeakPolarHBondContact O-CB 3.49Å; D337-C340 PolarHBondContact O-N 3.3Å; D337-C341 PolarHBondContact O-N 3.5Å; D337-C341 PolarHBondContact O-SG 2.81Å; D337-C341 VanDerWaalsContact O-SG 3.38Å; D337-H359 IonicContact OD2-NE2 2.72Å
338	L	98.8	Very high	97	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-41.5	174.2	-172.4	49.4	0	0	0	112.2	L179 K334 C340 C341 M342 I351 A356 H359 Y361 L362	L179-L338 HydrophobicContact CD2-CD2 3.64Å; K334-L338 PolarHBondContact O-N 3.22Å; K334-L338 VanDerWaalsContact O-N 3.11Å; L338-C340 VanDerWaalsContact C-N 3.28Å; L338-C340 PolarHBondContact O-N 2.84Å; L338-C341 PolarHBondContact O-N 2.96Å; L338-M342 HydrophobicContact CD1-CE 3.92Å; L338-M342 HydrophobicContact CD1-CG 4.45Å; L338-M342 HydrophobicContact CD2-CE 4.16Å; L338-M342 HydrophobicContact CG-CE 3.86Å; L338-M342 HydrophobicContact CG-SD 4.36Å; L338-M342 WeakPolarHBondContact O-CG 3.44Å; L338-M342 PolarHBondContact O-N 3.36Å; L338-I351 HydrophobicContact CD1-CD1 3.89Å; L338-A356 HydrophobicContact CD1-CB 4.09Å; L338-H359 HydrophobicContact CD1-CB 3.92Å; L338-H359 HydrophobicContact CD2-CB 4.17Å; L338-Y361 HydrophobicContact CD2-CD1 4.14Å; L338-L362 HydrophobicContact CD2-CD1 4.38Å; L338-L362 HydrophobicContact CD2-CG 4.42Å
339	L	98.8	Very high	96.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-36.6	173.3	-177.8	63.3	0	0	0	112.1	G264 L267 A268 L271 W324 F328 A335 L336 D337 L343	G264-L339 WeakPolarHBondContact O-CD1 3.5Å; L267-L339 HydrophobicContact CB-CD1 4.22Å; L267-L339 HydrophobicContact CD2-CB 3.94Å; L267-L339 HydrophobicContact CD2-CD1 4.16Å; L267-L339 HydrophobicContact CG-CD1 4.19Å; A268-L339 HydrophobicContact CB-CD1 4.08Å; A268-L339 HydrophobicContact CB-CD2 4.3Å; L271-L339 HydrophobicContact CD1-CD2 4.28Å; W324-L339 HydrophobicContact CD2-CD2 4.47Å; W324-L339 HydrophobicContact CE3-CD2 4.23Å; W324-L339 HydrophobicContact CZ3-CD2 4.48Å; F328-L339 HydrophobicContact CD2-CD2 4.04Å; F328-L339 HydrophobicContact CE2-CD2 3.63Å; F328-L339 HydrophobicContact CZ-CD2 4.36Å; A335-L339 WeakPolarHBondContact O-CB 3.07Å; A335-L339 PolarHBondContact O-N 3.08Å; L336-L339 HydrophobicContact CD2-CD2 4.21Å; D337-L339 VanDerWaalsContact C-N 3.31Å; D337-L339 PolarHBondContact O-N 2.98Å; L339-L343 HydrophobicContact CD1-CD1 3.59Å; L339-L343 HydrophobicContact CD1-CG 3.97Å; L339-L343 HydrophobicContact CG-CD1 4.17Å; L339-L343 WeakPolarHBondContact O-CB 3.41Å; L339-L343 PolarHBondContact O-N 3.27Å
340	C	98.3	Very high	96.9	Very high	32 Å²	32	46 Å²	46	22%	0.216	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-47.5	173.9	-164.7	0	0	0	0	111.4	R321 W324 L336 D337 L338 T344	R321-C340 PolarHBondContact NH2-SG 2.82Å; W324-C340 VanDerWaalsContact NE1-CA 3.29Å; W324-C340 PolarHBondContact NE1-SG 3.44Å; W324-C340 VanDerWaalsContact NE1-SG 3.42Å; L336-C340 WeakPolarHBondContact O-CB 3.24Å; L336-C340 PolarHBondContact O-N 3.36Å; D337-C340 WeakPolarHBondContact O-CA 3.45Å; D337-C340 WeakPolarHBondContact O-CB 3.49Å; D337-C340 PolarHBondContact O-N 3.3Å; L338-C340 VanDerWaalsContact C-N 3.28Å; L338-C340 PolarHBondContact O-N 2.84Å; C340-T344 PolarHBondContact O-N 3.41Å; C340-T344 PolarHBondContact O-OG1 2.84Å
341	C	98.6	Very high	97	Very high	40 Å²	40	37.3 Å²	37.3	27%	0.27	21%	0.207	S	C	.	.	H	α-helix	trans	-66.5	-39.8	-179.5	-63.4	0	0	0	0	112.5	D337 L338 T344 I351	D337-C341 PolarHBondContact O-N 3.5Å; D337-C341 PolarHBondContact O-SG 2.81Å; D337-C341 VanDerWaalsContact O-SG 3.38Å; L338-C341 PolarHBondContact O-N 2.96Å; C341-T344 PolarHBondContact O-OG1 2.59Å; C341-I351 HydrophobicContact CB-CB 3.92Å; C341-I351 HydrophobicContact CB-CD1 3.97Å; C341-I351 HydrophobicContact CB-CG2 3.95Å; C341-I351 PolarHBondContact O-N 3.05Å
342	M	98.6	Very high	97.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-69.8	-42.9	175.9	-71.1	-180	174.5	0	0	113.2	L179 L183 M260 V263 L267 L338 T344 R350 I351 A356	L179-M342 HydrophobicContact CD1-CE 4.25Å; L183-M342 HydrophobicContact CD1-CE 3.9Å; L183-M342 HydrophobicContact CD2-CE 3.89Å; L183-M342 HydrophobicContact CG-CE 4.4Å; M260-M342 HydrophobicContact CE-CE 4.06Å; M260-M342 HydrophobicContact CE-CG 4.43Å; V263-M342 HydrophobicContact CB-SD 4.5Å; V263-M342 HydrophobicContact CG1-CE 3.97Å; V263-M342 HydrophobicContact CG1-SD 3.98Å; L267-M342 HydrophobicContact CD2-SD 4.32Å; L338-M342 HydrophobicContact CD1-CE 3.92Å; L338-M342 HydrophobicContact CD1-CG 4.45Å; L338-M342 HydrophobicContact CD2-CE 4.16Å; L338-M342 HydrophobicContact CG-CE 3.86Å; L338-M342 HydrophobicContact CG-SD 4.36Å; L338-M342 WeakPolarHBondContact O-CG 3.44Å; L338-M342 PolarHBondContact O-N 3.36Å; M342-T344 PolarHBondContact O-N 3.14Å; M342-R350 WeakPolarHBondContact O-CD 3.16Å; M342-R350 VanDerWaalsContact O-CG 3.23Å; M342-R350 WeakPolarHBondContact O-CG 3.42Å; M342-I351 HydrophobicContact CB-CG2 4.46Å; M342-I351 HydrophobicContact CG-CG2 3.76Å; M342-A356 HydrophobicContact CE-CB 3.98Å
343	L	98.4	Very high	97.1	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	31.8	178.7	-63.1	-177.8	0	0	0	112.8	W261 I276 F277 L293 W324 L339 F345	W261-L343 HydrophobicContact CD2-CD2 3.8Å; W261-L343 HydrophobicContact CE3-CD2 3.9Å; W261-L343 HydrophobicContact CG-CD2 4.34Å; W261-L343 HydrophobicContact CH2-CD2 4.17Å; W261-L343 HydrophobicContact CZ2-CD2 4.06Å; W261-L343 HydrophobicContact CZ3-CB 4.23Å; W261-L343 HydrophobicContact CZ3-CD2 4.09Å; I276-L343 HydrophobicContact CD1-CD1 3.92Å; F277-L343 HydrophobicContact CE2-CD1 4.2Å; F277-L343 HydrophobicContact CE2-CD2 4.22Å; F277-L343 HydrophobicContact CZ-CD1 4.27Å; L293-L343 VanDerWaalsContact CD1-O 3.26Å; L293-L343 WeakPolarHBondContact CD1-O 3.49Å; L293-L343 WeakPolarHBondContact CD2-O 3.5Å; W324-L343 HydrophobicContact CH2-CB 3.95Å; W324-L343 HydrophobicContact CH2-CD1 3.68Å; W324-L343 HydrophobicContact CH2-CG 4.46Å; W324-L343 HydrophobicContact CZ2-CB 4.03Å; W324-L343 HydrophobicContact CZ2-CD1 4.42Å; W324-L343 HydrophobicContact CZ3-CD1 4.25Å; L339-L343 HydrophobicContact CD1-CD1 3.59Å; L339-L343 HydrophobicContact CD1-CG 3.97Å; L339-L343 HydrophobicContact CG-CD1 4.17Å; L339-L343 WeakPolarHBondContact O-CB 3.41Å; L339-L343 PolarHBondContact O-N 3.27Å; L343-F345 PolarHBondContact O-N 2.86Å
344	T	97.4	Very high	97.1	Very high	36 Å²	36	35 Å²	35	22%	0.221	19%	0.185	C	C	.	.			trans	-67.9	124.2	168.5	-59.8	0	0	0	0	110.2	C340 C341 M342 N346 K349 R350	C340-T344 PolarHBondContact O-N 3.41Å; C340-T344 PolarHBondContact O-OG1 2.84Å; C341-T344 PolarHBondContact O-OG1 2.59Å; M342-T344 PolarHBondContact O-N 3.14Å; T344-N346 PolarHBondContact O-N 3.22Å; T344-K349 HydrophobicContact CG2-CB 3.73Å; T344-R350 PolarHBondContact O-NE 2.73Å; T344-R350 PolarHBondContact O-NH2 3.07Å
345	F	94.8	Very high	97.1	Very high	22 Å²	22	36.2 Å²	36.2	10%	0.096	20%	0.195	C	C	.	.	S	Bend	trans	-59.2	-44.3	-178	177.6	-90	0	0	0	112.6	P245 L249 L290 L293 P296 D300 I304 L313 L343 P347 R350	P245-F345 HydrophobicContact CB-CD2 3.96Å; P245-F345 HydrophobicContact CB-CE2 3.74Å; P245-F345 HydrophobicContact CG-CD2 3.84Å; P245-F345 HydrophobicContact CG-CE2 4.12Å; P245-F345 HydrophobicContact CG-CG 4.41Å; L249-F345 HydrophobicContact CD1-CE2 4.1Å; L249-F345 HydrophobicContact CD1-CZ 3.59Å; L290-F345 HydrophobicContact CD2-CD2 4.33Å; L290-F345 HydrophobicContact CD2-CE2 3.92Å; L293-F345 HydrophobicContact CD1-CB 4.03Å; P296-F345 HydrophobicContact CB-CD1 3.85Å; P296-F345 HydrophobicContact CB-CE1 3.63Å; P296-F345 HydrophobicContact CB-CG 4.42Å; P296-F345 HydrophobicContact CB-CZ 4.01Å; P296-F345 HydrophobicContact CG-CD1 4.1Å; P296-F345 HydrophobicContact CG-CD2 4.22Å; P296-F345 HydrophobicContact CG-CE1 3.63Å; P296-F345 HydrophobicContact CG-CE2 3.76Å; P296-F345 HydrophobicContact CG-CG 4.38Å; P296-F345 HydrophobicContact CG-CZ 3.44Å; P296-F345 VanDerWaalsContact CG-CZ 3.44Å; D300-F345 HydrophobicContact CB-CD1 4.09Å; D300-F345 HydrophobicContact CB-CE1 4.42Å; I304-F345 HydrophobicContact CD1-CE1 4.24Å; I304-F345 HydrophobicContact CD1-CZ 4.27Å; L313-F345 HydrophobicContact CD1-CZ 4.15Å; L343-F345 PolarHBondContact O-N 2.86Å; F345-P347 WeakPolarHBondContact O-CD 3.37Å; F345-R350 PolarHBondContact O-NH2 3.41Å
346	N	92.1	Very high	97.1	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.027	20%	0.195	C	C	.	.	S	Bend	trans	-80.7	115.8	179.3	-173.2	-21.2	0	0	0	110.1	D300 C303 T344 N348 K349 R350	D300-N346 HydrophobicContact CB-CB 4.12Å; D300-N346 VanDerWaalsContact OD1-CB 3.29Å; D300-N346 WeakPolarHBondContact OD1-CB 3.3Å; D300-N346 PolarHBondContact OD1-ND2 3.12Å; C303-N346 PolarHBondContact SG-ND2 3.45Å; C303-N346 VanDerWaalsContact SG-ND2 3.43Å; T344-N346 PolarHBondContact O-N 3.22Å; N346-N348 PolarHBondContact O-N 2.93Å; N346-N348 PolarHBondContact OD1-N 3.35Å; N346-K349 HydrophobicContact CB-CB 4.31Å; N346-K349 HydrophobicContact CB-CD 4.1Å; N346-K349 HydrophobicContact CB-CG 4.26Å; N346-K349 PolarHBondContact O-N 3.17Å; N346-R350 PolarHBondContact O-N 3.37Å
347	P	91.4	Very high	97.1	Very high	31 Å²	31	35.4 Å²	35.4	20%	0.201	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-61.4	-27.9	-176	23.9	-34	0	0	0	113.2	E246 S257 F345 K349 R350	E246-P347 HydrophobicContact CB-CG 4.28Å; E246-P347 HydrophobicContact CG-CB 4.36Å; E246-P347 HydrophobicContact CG-CG 4.12Å; S257-P347 VanDerWaalsContact OG-CB 3.31Å; S257-P347 WeakPolarHBondContact OG-CB 3.41Å; F345-P347 WeakPolarHBondContact O-CD 3.37Å; P347-K349 PolarHBondContact O-N 2.96Å; P347-R350 WeakPolarHBondContact O-CB 3.22Å; P347-R350 PolarHBondContact O-N 3.26Å
348	N	90.7	Very high	97.1	Very high	134 Å²	134	33.2 Å²	33.2	72%	0.717	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-76.1	-9.8	179.4	-58.6	-19.1	0	0	0	113.4	N346	N346-N348 PolarHBondContact O-N 2.93Å; N346-N348 PolarHBondContact OD1-N 3.35Å
349	K	95	Very high	97.1	Very high	88 Å²	88	34.2 Å²	34.2	38%	0.383	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-112.2	3.1	175.8	-62.1	178.3	-179.6	169.9	0	112.1	E299 D300 T344 N346 P347	E299-K349 WeakPolarHBondContact OE1-CE 3.43Å; E299-K349 IonicContact OE1-NZ 2.66Å; E299-K349 PolarHBondContact OE1-NZ 3.02Å; E299-K349 IonicContact OE2-NZ 3.27Å; E299-K349 PolarHBondContact OE2-NZ 3.47Å; D300-K349 IonicContact OD1-NZ 3.87Å; D300-K349 PolarHBondContact OD1-NZ 3.48Å; T344-K349 HydrophobicContact CG2-CB 3.73Å; N346-K349 HydrophobicContact CB-CB 4.31Å; N346-K349 HydrophobicContact CB-CD 4.1Å; N346-K349 HydrophobicContact CB-CG 4.26Å; N346-K349 PolarHBondContact O-N 3.17Å; P347-K349 PolarHBondContact O-N 2.96Å
350	R	97.1	Very high	97.1	Very high	16 Å²	16	37.4 Å²	37.4	6%	0.06	21%	0.211	C	C	.	.	S	Bend	trans	-82.5	138.9	-178.7	-162.4	176.4	-61.9	143.4	6.2	109.1	E246 S257 M342 T344 F345 N346 P347	E246-R350 IonicContact OE1-CZ 3.87Å; E246-R350 IonicContact OE1-NH1 2.75Å; E246-R350 PolarHBondContact OE1-NH1 2.77Å; E246-R350 IonicContact OE1-NH2 3.27Å; E246-R350 PolarHBondContact OE1-NH2 3.45Å; E246-R350 IonicContact OE2-CZ 4Å; E246-R350 IonicContact OE2-NH1 2.82Å; E246-R350 IonicContact OE2-NH2 2.86Å; E246-R350 PolarHBondContact OE2-NH2 3.18Å; S257-R350 VanDerWaalsContact C-NH1 3.34Å; S257-R350 VanDerWaalsContact O-CD 3.3Å; S257-R350 WeakPolarHBondContact O-CD 3.31Å; S257-R350 PolarHBondContact O-NH1 3.26Å; M342-R350 WeakPolarHBondContact O-CD 3.16Å; M342-R350 VanDerWaalsContact O-CG 3.23Å; M342-R350 WeakPolarHBondContact O-CG 3.42Å; T344-R350 PolarHBondContact O-NE 2.73Å; T344-R350 PolarHBondContact O-NH2 3.07Å; F345-R350 PolarHBondContact O-NH2 3.41Å; N346-R350 PolarHBondContact O-N 3.37Å; P347-R350 WeakPolarHBondContact O-CB 3.22Å; P347-R350 PolarHBondContact O-N 3.26Å
351	I	98.6	Very high	97.1	Very high	25 Å²	25	36.3 Å²	36.3	13%	0.128	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-58.6	141.5	-178	-164.2	167	0	0	0	111.7	M260 L338 C341 M342 D355 A356	M260-I351 HydrophobicContact CE-CG2 4.04Å; L338-I351 HydrophobicContact CD1-CD1 3.89Å; C341-I351 HydrophobicContact CB-CB 3.92Å; C341-I351 HydrophobicContact CB-CD1 3.97Å; C341-I351 HydrophobicContact CB-CG2 3.95Å; C341-I351 PolarHBondContact O-N 3.05Å; M342-I351 HydrophobicContact CB-CG2 4.46Å; M342-I351 HydrophobicContact CG-CG2 3.76Å; I351-D355 HydrophobicContact CD1-CB 4.02Å; I351-D355 HydrophobicContact CG1-CB 3.47Å; I351-D355 VanDerWaalsContact CG1-CB 3.47Å; I351-A356 HydrophobicContact CD1-CB 4.13Å; I351-A356 HydrophobicContact CG1-CB 4.24Å; I351-A356 HydrophobicContact CG2-CB 4.32Å
352	T	98.4	Very high	97.1	Very high	59 Å²	59	34.4 Å²	34.4	36%	0.362	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-74.7	171.7	173.8	70.8	0	0	0	0	110.7	M260 E354 D355 A356	M260-T352 VanDerWaalsContact CE-O 3.31Å; M260-T352 WeakPolarHBondContact CE-O 3.39Å; T352-E354 VanDerWaalsContact C-N 3.32Å; T352-E354 VanDerWaalsContact CB-OE2 3.27Å; T352-E354 WeakPolarHBondContact CB-OE2 3.19Å; T352-E354 PolarHBondContact OG1-OE2 3.17Å; T352-D355 WeakPolarHBondContact CB-OD2 3.33Å; T352-D355 WeakPolarHBondContact CG2-OD2 3.31Å; T352-D355 WeakPolarHBondContact OG1-CB 3.11Å; T352-D355 PolarHBondContact OG1-N 3.21Å; T352-D355 PolarHBondContact OG1-OD2 3.18Å; T352-A356 WeakPolarHBondContact O-CB 3.48Å; T352-A356 PolarHBondContact O-N 2.68Å; T352-A356 VanDerWaalsContact O-N 3.11Å
353	V	98.6	Very high	97.1	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-74	-33.1	177.5	60.8	0	0	0	0	110.7	L183 L186 K187 H190 M260 A356 L357	L183-V353 HydrophobicContact CB-CG2 4.22Å; L183-V353 HydrophobicContact CD2-CG2 3.96Å; L183-V353 VanDerWaalsContact O-CG2 3.22Å; L183-V353 WeakPolarHBondContact O-CG2 3.47Å; L186-V353 HydrophobicContact CB-CG2 3.97Å; L186-V353 HydrophobicContact CD2-CG2 4.42Å; L186-V353 HydrophobicContact CG-CG2 4.21Å; K187-V353 HydrophobicContact CB-CG1 4.31Å; K187-V353 HydrophobicContact CB-CG2 4.15Å; H190-V353 HydrophobicContact CB-CG1 4.12Å; M260-V353 HydrophobicContact CE-CB 4.46Å; M260-V353 HydrophobicContact SD-CB 3.68Å; M260-V353 HydrophobicContact SD-CG2 4.22Å; V353-A356 PolarHBondContact O-N 3.06Å; V353-L357 HydrophobicContact CG2-CD1 4.42Å; V353-L357 WeakPolarHBondContact O-CG 3.38Å; V353-L357 PolarHBondContact O-N 2.9Å
354	E	98.4	Very high	97	Very high	65 Å²	65	46.1 Å²	46.1	30%	0.304	24%	0.244	S	C	.	.	H	α-helix	trans	-66.8	-49.6	176.6	-55.3	84.5	169.2	0	0	111	K256 T352 A356 L357 A358	K256-E354 IonicContact NZ-OE1 2.68Å; T352-E354 VanDerWaalsContact C-N 3.32Å; T352-E354 VanDerWaalsContact CB-OE2 3.27Å; T352-E354 WeakPolarHBondContact CB-OE2 3.19Å; T352-E354 PolarHBondContact OG1-OE2 3.17Å; E354-A356 VanDerWaalsContact C-N 3.29Å; E354-A356 PolarHBondContact O-N 3.18Å; E354-L357 PolarHBondContact O-N 2.98Å; E354-A358 PolarHBondContact O-N 3.06Å
355	D	98.6	Very high	97	Very high	95 Å²	95	47.7 Å²	47.7	51%	0.508	25%	0.247	S	C	.	.	H	α-helix	trans	-64.4	-32.7	174.4	-64.6	-50.8	0	0	0	112.3	I351 T352 H359	I351-D355 HydrophobicContact CD1-CB 4.02Å; I351-D355 HydrophobicContact CG1-CB 3.47Å; I351-D355 VanDerWaalsContact CG1-CB 3.47Å; T352-D355 WeakPolarHBondContact CB-OD2 3.33Å; T352-D355 WeakPolarHBondContact CG2-OD2 3.31Å; T352-D355 WeakPolarHBondContact OG1-CB 3.11Å; T352-D355 PolarHBondContact OG1-N 3.21Å; T352-D355 PolarHBondContact OG1-OD2 3.18Å; D355-H359 PolarHBondContact O-N 3.19Å
356	A	98.8	Very high	97.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-73	-33.7	179.5	0	0	0	0	0	112.7	L183 M260 L338 M342 I351 T352 V353 E354 H359 L362	L183-A356 HydrophobicContact CD1-CB 4.01Å; L183-A356 HydrophobicContact CD2-CB 4.08Å; M260-A356 HydrophobicContact CE-CB 3.63Å; L338-A356 HydrophobicContact CD1-CB 4.09Å; M342-A356 HydrophobicContact CE-CB 3.98Å; I351-A356 HydrophobicContact CD1-CB 4.13Å; I351-A356 HydrophobicContact CG1-CB 4.24Å; I351-A356 HydrophobicContact CG2-CB 4.32Å; T352-A356 WeakPolarHBondContact O-CB 3.48Å; T352-A356 PolarHBondContact O-N 2.68Å; T352-A356 VanDerWaalsContact O-N 3.11Å; V353-A356 PolarHBondContact O-N 3.06Å; E354-A356 VanDerWaalsContact C-N 3.29Å; E354-A356 PolarHBondContact O-N 3.18Å; A356-H359 VanDerWaalsContact O-CB 3.23Å; A356-H359 WeakPolarHBondContact O-CB 3.25Å; A356-H359 PolarHBondContact O-N 3.03Å; A356-L362 WeakPolarHBondContact O-CD1 3.18Å
357	L	98.8	Very high	97.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.6	-43.6	171.6	-77.8	163.4	0	0	0	111.1	Y180 L183 K187 V353 E354 H359 Y366	Y180-L357 HydrophobicContact CD2-CD2 3.71Å; Y180-L357 HydrophobicContact CE2-CD2 3.88Å; L183-L357 HydrophobicContact CB-CD1 4.41Å; L183-L357 HydrophobicContact CB-CD2 3.62Å; L183-L357 HydrophobicContact CB-CG 3.82Å; K187-L357 HydrophobicContact CB-CD1 3.97Å; K187-L357 HydrophobicContact CD-CD1 3.86Å; K187-L357 HydrophobicContact CG-CD1 4.3Å; V353-L357 HydrophobicContact CG2-CD1 4.42Å; V353-L357 WeakPolarHBondContact O-CG 3.38Å; V353-L357 PolarHBondContact O-N 2.9Å; E354-L357 PolarHBondContact O-N 2.98Å; L357-H359 PolarHBondContact O-N 3.43Å; L357-H359 VanDerWaalsContact O-N 3.09Å; L357-Y366 HydrophobicContact CB-CD2 3.91Å; L357-Y366 HydrophobicContact CB-CE2 4.03Å; L357-Y366 VanDerWaalsContact O-CD2 3.25Å; L357-Y366 WeakPolarHBondContact O-CD2 3.35Å
358	A	98.6	Very high	97.5	Very high	48 Å²	48	56 Å²	56	40%	0.397	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-0.6	175.7	0	0	0	0	0	114.9	E354 Y366	E354-A358 PolarHBondContact O-N 3.06Å; A358-Y366 HydrophobicContact CB-CE1 4.07Å; A358-Y366 HydrophobicContact CB-CE2 3.92Å
359	H	98.8	Very high	97.8	Very high	21 Å²	21	55.9 Å²	55.9	10%	0.097	29%	0.292	C	S	.	.	S	Bend	trans	-72.5	140.2	-175.1	-170.1	-94	0	0	0	112.2	K334 D337 L338 D355 A356 L357 Y361 L362	K334-H359 PolarHBondContact O-CE1 3.43Å; K334-H359 VanDerWaalsContact O-CE1 3.32Å; D337-H359 IonicContact OD2-NE2 2.72Å; L338-H359 HydrophobicContact CD1-CB 3.92Å; L338-H359 HydrophobicContact CD2-CB 4.17Å; D355-H359 PolarHBondContact O-N 3.19Å; A356-H359 VanDerWaalsContact O-CB 3.23Å; A356-H359 WeakPolarHBondContact O-CB 3.25Å; A356-H359 PolarHBondContact O-N 3.03Å; L357-H359 PolarHBondContact O-N 3.43Å; L357-H359 VanDerWaalsContact O-N 3.09Å; H359-Y361 PolarHBondContact ND1-N 2.96Å; H359-Y361 PolarHBondContact O-N 3.4Å; H359-L362 PolarHBondContact O-N 3.21Å
360	P	98.7	Very high	97.8	Very high	66 Å²	66	55.7 Å²	55.7	43%	0.429	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-11.2	-178.6	-29.4	36.3	0	0	0	117.2	K334 L362 E363	K334-P360 HydrophobicContact CD-CB 4.32Å; K334-P360 VanDerWaalsContact CD-O 3.26Å; K334-P360 WeakPolarHBondContact CD-O 3.36Å; K334-P360 PolarHBondContact NZ-O 2.6Å; P360-L362 VanDerWaalsContact C-N 3.34Å; P360-E363 VanDerWaalsContact O-CD 3.22Å; P360-E363 WeakPolarHBondContact O-CG 3.31Å; P360-E363 VanDerWaalsContact O-OE2 3.08Å
361	Y	98.8	Very high	97.8	Very high	9 Å²	9	55.1 Å²	55.1	4%	0.035	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-23.8	172.4	-176	-124.7	0	0	0	113.1	N172 C176 L179 D332 K334 A335 L338 H359	N172-Y361 PolarHBondContact O-OH 3.4Å; N172-Y361 WeakPolarHBondContact OD1-CE2 3.22Å; N172-Y361 PolarHBondContact OD1-OH 3.32Å; C176-Y361 HydrophobicContact CB-CE1 4.08Å; C176-Y361 HydrophobicContact CB-CE2 4.3Å; C176-Y361 PolarHBondContact N-OH 2.67Å; C176-Y361 PolarHBondContact SG-O 3.02Å; L179-Y361 HydrophobicContact CD2-CD1 3.93Å; L179-Y361 HydrophobicContact CD2-CE1 3.93Å; D332-Y361 HydrophobicContact CB-CE2 4.01Å; K334-Y361 HydrophobicContact CB-CD2 3.94Å; K334-Y361 HydrophobicContact CB-CG 4.3Å; A335-Y361 HydrophobicContact CB-CD1 4.2Å; A335-Y361 HydrophobicContact CB-CD2 3.97Å; A335-Y361 HydrophobicContact CB-CE1 3.87Å; A335-Y361 HydrophobicContact CB-CE2 3.64Å; A335-Y361 HydrophobicContact CB-CG 4.24Å; L338-Y361 HydrophobicContact CD2-CD1 4.14Å; H359-Y361 PolarHBondContact ND1-N 2.96Å; H359-Y361 PolarHBondContact O-N 3.4Å
362	L	98.6	Very high	97.8	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.305	C	S	.	.	S	Bend	trans	-109.9	10.1	-177	-54.7	-177.1	0	0	0	112.3	C176 L179 L183 L338 A356 H359 P360 Q364 Y365 Y366	C176-L362 VanDerWaalsContact SG-CD2 3.59Å; L179-L362 HydrophobicContact CB-CD2 4.45Å; L179-L362 HydrophobicContact CD2-CD2 4.27Å; L183-L362 HydrophobicContact CD1-CD1 3.53Å; L338-L362 HydrophobicContact CD2-CD1 4.38Å; L338-L362 HydrophobicContact CD2-CG 4.42Å; A356-L362 WeakPolarHBondContact O-CD1 3.18Å; H359-L362 PolarHBondContact O-N 3.21Å; P360-L362 VanDerWaalsContact C-N 3.34Å; L362-Q364 PolarHBondContact O-N 2.94Å; L362-Y365 PolarHBondContact O-N 3.27Å; L362-Y366 PolarHBondContact O-N 2.63Å
363	E	97.8	Very high	97.7	Very high	130 Å²	130	59.2 Å²	59.2	61%	0.607	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-19.4	-175.9	72.1	-167.7	-179.7	0	0	115.1	K334 P360	K334-E363 IonicContact NZ-OE1 2.77Å; K334-E363 PolarHBondContact NZ-OE1 3.18Å; K334-E363 IonicContact NZ-OE2 3.83Å; K334-E363 PolarHBondContact NZ-OE2 3.01Å; P360-E363 VanDerWaalsContact O-CD 3.22Å; P360-E363 WeakPolarHBondContact O-CG 3.31Å; P360-E363 VanDerWaalsContact O-OE2 3.08Å
364	Q	97.4	Very high	97.6	Very high	118 Å²	118	60 Å²	60	55%	0.551	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-12.4	176.9	65.7	177.2	-12.2	0	0	114.4	C176 L362	C176-Q364 PolarHBondContact SG-NE2 2.88Å; L362-Q364 PolarHBondContact O-N 2.94Å
365	Y	97.5	Very high	97.3	Very high	69 Å²	69	66.1 Å²	66.1	27%	0.271	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-21.7	-178.3	-60.4	-52	0	0	0	113.5	C176 Y177 Y180 L362 D367	C176-Y365 HydrophobicContact CB-CE2 4.33Å; Y177-Y365 HydrophobicContact CD2-CD1 4.36Å; Y177-Y365 HydrophobicContact CD2-CD2 4.41Å; Y177-Y365 AromaticContact CD2-CE1 3.9Å; Y177-Y365 HydrophobicContact CD2-CE1 3.9Å; Y177-Y365 AromaticContact CD2-CE2 3.95Å; Y177-Y365 HydrophobicContact CD2-CE2 3.95Å; Y177-Y365 AromaticContact CD2-CZ 3.68Å; Y177-Y365 HydrophobicContact CE2-CE1 4.46Å; Y177-Y365 HydrophobicContact CG-CE2 4.36Å; Y180-Y365 HydrophobicContact CD1-CD2 4.45Å; Y180-Y365 HydrophobicContact CD1-CG 4.09Å; Y180-Y365 WeakPolarHBondContact CE2-O 3.49Å; Y180-Y365 HydrophobicContact CG-CD2 4.21Å; Y180-Y365 HydrophobicContact CG-CG 4.12Å; Y180-Y365 VanDerWaalsContact CZ-O 3.24Å; Y180-Y365 PolarHBondContact OH-O 2.92Å; L362-Y365 PolarHBondContact O-N 3.27Å; Y365-D367 PolarHBondContact O-N 3.37Å; Y365-D367 VanDerWaalsContact O-N 3.12Å
366	Y	97.4	Very high	97	Very high	94 Å²	94	65.2 Å²	65.2	37%	0.369	35%	0.346	S	S	.	.			trans	-61.2	108.5	-178.3	177.9	-117.9	0	0	0	112.5	L357 A358 L362 P368 E371	L357-Y366 HydrophobicContact CB-CD2 3.91Å; L357-Y366 HydrophobicContact CB-CE2 4.03Å; L357-Y366 VanDerWaalsContact O-CD2 3.25Å; L357-Y366 WeakPolarHBondContact O-CD2 3.35Å; A358-Y366 HydrophobicContact CB-CE1 4.07Å; A358-Y366 HydrophobicContact CB-CE2 3.92Å; L362-Y366 PolarHBondContact O-N 2.63Å; Y366-P368 HydrophobicContact CE1-CG 3.94Å; Y366-P368 HydrophobicContact CE2-CG 3.76Å; Y366-P368 VanDerWaalsContact CZ-CG 3.42Å; Y366-P368 WeakPolarHBondContact OH-CG 3.11Å; Y366-E371 WeakPolarHBondContact CD2-OE1 3.39Å
367	D	96.8	Very high	96.7	Very high	70 Å²	70	68.9 Å²	68.9	37%	0.374	37%	0.369	S	S	.	.			trans	-138.2	100.2	170.7	-172.9	-21.8	0	0	0	109.7	Y365 T369 D370 E371	Y365-D367 PolarHBondContact O-N 3.37Å; Y365-D367 VanDerWaalsContact O-N 3.12Å; D367-T369 PolarHBondContact O-N 3.17Å; D367-T369 WeakPolarHBondContact OD1-CA 3.29Å; D367-T369 WeakPolarHBondContact OD1-CB 3.38Å; D367-T369 PolarHBondContact OD1-N 3.15Å; D367-T369 PolarHBondContact OD1-OG1 3.07Å; D367-T369 PolarHBondContact OD2-OG1 2.87Å; D367-D370 HydrophobicContact CB-CB 4.42Å; D367-D370 CarbonylContact O-C 3.54Å; D367-D370 PolarHBondContact O-N 2.83Å; D367-E371 VanDerWaalsContact O-CG 3.3Å; D367-E371 WeakPolarHBondContact O-CG 3.18Å; D367-E371 PolarHBondContact O-N 3.36Å; D367-E371 VanDerWaalsContact O-N 3.14Å
368	P	94.9	Very high	96.1	Very high	69 Å²	69	69.4 Å²	69.4	45%	0.448	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-17	176.9	-30.6	38.2	0	0	0	115.8	Y366	Y366-P368 HydrophobicContact CE1-CG 3.94Å; Y366-P368 HydrophobicContact CE2-CG 3.76Å; Y366-P368 VanDerWaalsContact CZ-CG 3.42Å; Y366-P368 WeakPolarHBondContact OH-CG 3.11Å
369	T	95.4	Very high	95.2	Very high	131 Å²	131	70.9 Å²	70.9	80%	0.804	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-21.7	177.8	74	0	0	0	0	113.5	D367	D367-T369 PolarHBondContact O-N 3.17Å; D367-T369 WeakPolarHBondContact OD1-CA 3.29Å; D367-T369 WeakPolarHBondContact OD1-CB 3.38Å; D367-T369 PolarHBondContact OD1-N 3.15Å; D367-T369 PolarHBondContact OD1-OG1 3.07Å; D367-T369 PolarHBondContact OD2-OG1 2.87Å
370	D	96.3	Very high	93.6	Very high	83 Å²	83	74.1 Å²	74.1	44%	0.444	39%	0.387	S	S	.	.	S	Bend	trans	-104.4	13.2	169.7	-174.6	40.2	0	0	0	112.4	R184 D367 P372	R184-D370 VanDerWaalsContact CZ-O 3.22Å; R184-D370 IonicContact CZ-OD1 3.74Å; R184-D370 IonicContact CZ-OD2 3.39Å; R184-D370 PolarHBondContact NE-O 2.88Å; R184-D370 IonicContact NE-OD2 2.85Å; R184-D370 VanDerWaalsContact NH2-CG 3.31Å; R184-D370 PolarHBondContact NH2-O 2.72Å; R184-D370 IonicContact NH2-OD1 2.73Å; R184-D370 PolarHBondContact NH2-OD1 2.69Å; R184-D370 IonicContact NH2-OD2 2.99Å; R184-D370 PolarHBondContact NH2-OD2 3.22Å; D367-D370 HydrophobicContact CB-CB 4.42Å; D367-D370 CarbonylContact O-C 3.54Å; D367-D370 PolarHBondContact O-N 2.83Å; D370-P372 WeakPolarHBondContact O-CD 3.5Å
371	E	97.3	Very high	92	Very high	5 Å²	5	77 Å²	77	2%	0.023	40%	0.404	C	S	.	.	S	Bend	trans	-111	74.1	173.7	-71.7	172.1	-174	0	0	111	Y180 R184 K187 Y366 D367	Y180-E371 HydrophobicContact CE2-CG 4.49Å; R184-E371 HydrophobicContact CG-CG 4.22Å; K187-E371 HydrophobicContact CD-CB 3.91Å; K187-E371 WeakPolarHBondContact CE-O 3.47Å; K187-E371 PolarHBondContact NZ-O 3.07Å; K187-E371 IonicContact NZ-OE2 3.76Å; K187-E371 PolarHBondContact NZ-OE2 3.48Å; Y366-E371 WeakPolarHBondContact CD2-OE1 3.39Å; D367-E371 VanDerWaalsContact O-CG 3.3Å; D367-E371 WeakPolarHBondContact O-CG 3.18Å; D367-E371 PolarHBondContact O-N 3.36Å; D367-E371 VanDerWaalsContact O-N 3.14Å
372	P	97.5	Very high	90.3	Very high	59 Å²	59	77.9 Å²	77.9	38%	0.383	41%	0.41	S	S	.	.			trans	-69.4	154.4	-171.9	29.1	-36.9	0	0	0	113.2	D370	D370-P372 WeakPolarHBondContact O-CD 3.5Å
373	E	97.6	Very high	88.9	Confident	111 Å²	111	80.2 Å²	80.2	52%	0.519	42%	0.421	S	S	.	.			trans	-108.9	162.8	174.6	-71.2	-178.9	-155.4	0	0	110.7	K187 S191	K187-E373 WeakPolarHBondContact CE-OE1 3.07Å; K187-E373 HydrophobicContact CG-CG 4.41Å; S191-E373 WeakPolarHBondContact OG-CA 3.44Å; S191-E373 WeakPolarHBondContact OG-CB 3.24Å
374	A	96	Very high	87.6	Confident	17 Å²	17	74.2 Å²	74.2	14%	0.14	39%	0.393	C	S	.	.			trans	-75	129.8	177	0	0	0	0	0	111.2	Y188 S191 A192 T376	Y188-A374 HydrophobicContact CE1-CB 4.15Å; Y188-A374 HydrophobicContact CE2-CB 4.17Å; S191-A374 PolarHBondContact OG-N 3.41Å; S191-A374 VanDerWaalsContact OG-N 3.1Å; A192-A374 HydrophobicContact CB-CB 3.57Å; A374-T376 PolarHBondContact O-N 3.14Å
375	E	92.3	Very high	86.3	Confident	193 Å²	193	71 Å²	71	90%	0.902	38%	0.38	S	S	*	.	S	Bend	trans	-51	-33.5	-176.1	-60.7	176.7	175.8	0	0	114.4
376	T	91.7	Very high	85.5	Confident	77 Å²	77	75.3 Å²	75.3	47%	0.472	41%	0.407	S	S	.	.	S	Bend	trans	-148.4	141.2	-178.4	42	0	0	0	0	110.6	R126 A374	R126-T376 VanDerWaalsContact NH2-CB 3.29Å; R126-T376 PolarHBondContact NH2-O 3.47Å; R126-T376 VanDerWaalsContact NH2-O 3.07Å; R126-T376 PolarHBondContact NH2-OG1 2.9Å; A374-T376 PolarHBondContact O-N 3.14Å
377	P	91.9	Very high	85	Confident	76 Å²	76	73.5 Å²	73.5	49%	0.494	40%	0.404	S	S	.	.			trans	-73	166.1	178.2	31	-35.9	0	0	0	112.7	R126 A192 N193	R126-P377 PolarHBondContact NH1-O 3.44Å; R126-P377 PolarHBondContact NH2-O 3.39Å; A192-P377 CarbonylContact O-C 3.57Å; A192-P377 WeakPolarHBondContact O-CA 3.11Å; N193-P377 HydrophobicContact CB-CB 3.98Å
378	F	87.9	Confident	84.8	Confident	11 Å²	11	73 Å²	73	5%	0.048	41%	0.405	C	S	.	.			trans	-85.6	148.9	165.2	-76	-106.9	0	0	0	111.1	I123 R126 F127 A192 V194 I222 T382	I123-F378 HydrophobicContact CB-CZ 4.47Å; I123-F378 HydrophobicContact CG1-CE1 4.1Å; I123-F378 HydrophobicContact CG1-CZ 4.23Å; R126-F378 HydrophobicContact CB-CZ 3.93Å; R126-F378 HydrophobicContact CG-CE2 4.29Å; R126-F378 HydrophobicContact CG-CZ 4.07Å; R126-F378 VanDerWaalsContact NH1-CG 3.26Å; F127-F378 HydrophobicContact CD1-CE2 4.04Å; F127-F378 HydrophobicContact CE1-CD2 4.34Å; F127-F378 AromaticContact CE1-CE2 3.55Å; F127-F378 HydrophobicContact CE1-CE2 3.55Å; F127-F378 HydrophobicContact CE1-CZ 4.32Å; F127-F378 HydrophobicContact CZ-CE2 4.29Å; A192-F378 HydrophobicContact CB-CD2 4.12Å; A192-F378 HydrophobicContact CB-CE2 4.4Å; A192-F378 PolarHBondContact O-N 2.87Å; V194-F378 HydrophobicContact CG2-CB 4.21Å; V194-F378 HydrophobicContact CG2-CD2 3.61Å; V194-F378 HydrophobicContact CG2-CE2 4.13Å; V194-F378 HydrophobicContact CG2-CG 3.96Å; I222-F378 HydrophobicContact CD1-CB 3.41Å; I222-F378 VanDerWaalsContact CD1-CB 3.41Å; I222-F378 HydrophobicContact CD1-CD1 4.28Å; I222-F378 HydrophobicContact CD1-CG 4.09Å; I222-F378 HydrophobicContact CG1-CB 4.3Å; F378-T382 HydrophobicContact CD1-CG2 4.16Å
379	D	78.8	Confident	84.8	Confident	79 Å²	79	72.3 Å²	72.3	42%	0.422	39%	0.394	S	S	.	.			trans	-120.7	170.4	179.9	69.8	66.7	0	0	0	112.5	T381 T382	D379-T381 VanDerWaalsContact C-N 3.26Å; D379-T381 PolarHBondContact O-N 2.96Å; D379-T381 WeakPolarHBondContact OD1-CA 3.46Å; D379-T381 WeakPolarHBondContact OD1-CB 3.29Å; D379-T381 WeakPolarHBondContact OD1-CG2 3.34Å; D379-T381 PolarHBondContact OD1-N 2.87Å; D379-T381 PolarHBondContact OD1-OG1 3Å; D379-T382 VanDerWaalsContact O-CB 3.31Å; D379-T382 WeakPolarHBondContact O-CB 2.99Å; D379-T382 PolarHBondContact O-N 3.45Å; D379-T382 VanDerWaalsContact O-N 3.07Å; D379-T382 PolarHBondContact O-OG1 2.89Å
380	F	66	Low	84.7	Confident	89 Å²	89	71.2 Å²	71.2	39%	0.39	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-70.6	-11.9	-174.6	-66	-72.9	0	0	0	115.3	I222 D224 T382 E383	I222-F380 HydrophobicContact CB-CD1 4.39Å; I222-F380 HydrophobicContact CB-CE1 3.83Å; I222-F380 HydrophobicContact CB-CZ 4.2Å; I222-F380 HydrophobicContact CG2-CE1 3.89Å; I222-F380 HydrophobicContact CG2-CE2 4.31Å; I222-F380 HydrophobicContact CG2-CZ 3.75Å; D224-F380 HydrophobicContact CB-CE1 3.6Å; D224-F380 HydrophobicContact CB-CE2 4.34Å; D224-F380 HydrophobicContact CB-CZ 3.35Å; D224-F380 VanDerWaalsContact CG-CZ 3.46Å; F380-T382 PolarHBondContact O-N 2.99Å; F380-E383 HydrophobicContact CD1-CG 4.11Å; F380-E383 PolarHBondContact O-N 2.87Å; F380-E383 VanDerWaalsContact O-N 3.14Å
381	T	64.8	Low	84.6	Confident	128 Å²	128	69.7 Å²	69.7	79%	0.785	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-68.4	-12	168.7	75.5	0	0	0	0	112.1	D379 E383	D379-T381 VanDerWaalsContact C-N 3.26Å; D379-T381 PolarHBondContact O-N 2.96Å; D379-T381 WeakPolarHBondContact OD1-CA 3.46Å; D379-T381 WeakPolarHBondContact OD1-CB 3.29Å; D379-T381 WeakPolarHBondContact OD1-CG2 3.34Å; D379-T381 PolarHBondContact OD1-N 2.87Å; D379-T381 PolarHBondContact OD1-OG1 3Å; T381-E383 VanDerWaalsContact C-N 3.34Å
382	T	61.8	Low	84.5	Confident	27 Å²	27	69.4 Å²	69.4	17%	0.166	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-83.5	-1.6	172.5	-24.9	0	0	0	0	113.7	K122 F378 D379 F380	K122-T382 HydrophobicContact CD-CG2 4.47Å; F378-T382 HydrophobicContact CD1-CG2 4.16Å; D379-T382 VanDerWaalsContact O-CB 3.31Å; D379-T382 WeakPolarHBondContact O-CB 2.99Å; D379-T382 PolarHBondContact O-N 3.45Å; D379-T382 VanDerWaalsContact O-N 3.07Å; D379-T382 PolarHBondContact O-OG1 2.89Å; F380-T382 PolarHBondContact O-N 2.99Å
383	E	69.3	Low	84.5	Confident	48 Å²	48	68.6 Å²	68.6	22%	0.224	36%	0.363	C	S	.	.			trans	-81.7	151.3	179.5	-61	-128.6	170.8	0	0	112.9	H229 F380 T381	H229-E383 IonicContact CE1-OE1 3.02Å; H229-E383 PolarHBondContact CE1-OE1 2.96Å; H229-E383 VanDerWaalsContact CE1-OE1 3.26Å; H229-E383 IonicContact CE1-OE2 2.96Å; H229-E383 PolarHBondContact CE1-OE2 3.34Å; H229-E383 IonicContact ND1-OE1 2.63Å; H229-E383 IonicContact ND1-OE2 3.23Å; H229-E383 PolarHBondContact ND1-OE2 3.28Å; F380-E383 HydrophobicContact CD1-CG 4.11Å; F380-E383 PolarHBondContact O-N 2.87Å; F380-E383 VanDerWaalsContact O-N 3.14Å; T381-E383 VanDerWaalsContact C-N 3.34Å
384	L	70.6	Confident	84.4	Confident	4 Å²	4	67.6 Å²	67.6	2%	0.021	36%	0.358	C	S	.	.			trans	-134.1	3.9	-161.1	-58.3	174.9	0	0	0	113	Q115 L118 R119 D386 L387 L392 M395	Q115-L384 HydrophobicContact CG-CB 4.29Å; Q115-L384 PolarHBondContact NE2-O 3.05Å; L118-L384 HydrophobicContact CB-CD1 3.95Å; L118-L384 HydrophobicContact CD2-CD1 3.82Å; L118-L384 HydrophobicContact CD2-CD2 3.72Å; L118-L384 HydrophobicContact CD2-CG 4.42Å; L118-L384 HydrophobicContact CG-CD1 3.85Å; L118-L384 HydrophobicContact CG-CD2 4.45Å; R119-L384 HydrophobicContact CB-CD1 4.28Å; L384-D386 VanDerWaalsContact C-N 3.34Å; L384-D386 PolarHBondContact O-N 2.94Å; L384-L387 HydrophobicContact CD2-CD1 4.02Å; L384-L387 PolarHBondContact O-N 2.74Å; L384-L392 HydrophobicContact CB-CD2 4.09Å; L384-L392 HydrophobicContact CD1-CD2 4.48Å; L384-L392 HydrophobicContact CD2-CD2 4.13Å; L384-L392 HydrophobicContact CG-CD2 4.46Å; L384-M395 HydrophobicContact CD2-CE 3.9Å; L384-M395 HydrophobicContact CD2-SD 4.46Å
385	D	71.8	Confident	84.4	Confident	51 Å²	51	69.5 Å²	69.5	27%	0.273	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-21.5	-153.9	-78.3	7.4	0	0	0	113.6	Q115 R119 R221	Q115-D385 VanDerWaalsContact NE2-C 3.28Å; Q115-D385 PolarHBondContact NE2-O 2.88Å; R119-D385 IonicContact NH2-OD1 2.66Å; R119-D385 PolarHBondContact NH2-OD1 2.99Å; R221-D385 IonicContact CZ-OD1 3.94Å; R221-D385 IonicContact CZ-OD2 3.36Å; R221-D385 VanDerWaalsContact CZ-OD2 3.23Å; R221-D385 IonicContact NE-OD1 3.73Å; R221-D385 IonicContact NE-OD2 3.55Å; R221-D385 PolarHBondContact NE-OD2 3.3Å; R221-D385 IonicContact NH2-OD1 2.74Å; R221-D385 PolarHBondContact NH2-OD1 3.31Å; R221-D385 IonicContact NH2-OD2 2.74Å; R221-D385 PolarHBondContact NH2-OD2 2.93Å
386	D	80.2	Confident	84.6	Confident	159 Å²	159	60.3 Å²	60.3	85%	0.85	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-3.4	175.8	-65.9	-53.4	0	0	0	115	L384	L384-D386 VanDerWaalsContact C-N 3.34Å; L384-D386 PolarHBondContact O-N 2.94Å
387	L	87.2	Confident	84.8	Confident	57 Å²	57	59.5 Å²	59.5	30%	0.298	31%	0.311	S	S	.	.			trans	-76.9	139.2	-173.8	-63.9	178	0	0	0	112.8	Q111 L384 L392 M395	Q111-L387 WeakPolarHBondContact CG-O 3.47Å; Q111-L387 PolarHBondContact NE2-O 3.12Å; L384-L387 HydrophobicContact CD2-CD1 4.02Å; L384-L387 PolarHBondContact O-N 2.74Å; L387-L392 HydrophobicContact CB-CD1 4.33Å; L387-L392 HydrophobicContact CB-CD2 3.92Å; L387-L392 HydrophobicContact CB-CG 3.9Å; L387-L392 HydrophobicContact CD1-CD2 4.09Å; L387-L392 VanDerWaalsContact O-CD1 3.29Å; L387-L392 WeakPolarHBondContact O-CD1 3.48Å; L387-M395 HydrophobicContact CD1-CE 4.28Å; L387-M395 HydrophobicContact CD1-SD 3.68Å
388	P	92.8	Very high	84.9	Confident	60 Å²	60	61 Å²	61	39%	0.39	31%	0.314	S	S	.	.			trans	-69.6	158	178.3	30.6	-35.5	0	0	0	111.9	E390 T391 L392	P388-E390 PolarHBondContact O-N 3.46Å; P388-T391 PolarHBondContact O-N 2.86Å; P388-L392 WeakPolarHBondContact O-CG 3.39Å; P388-L392 PolarHBondContact O-N 3.36Å
389	K	93.3	Very high	85.3	Confident	54 Å²	54	62.4 Å²	62.4	24%	0.235	32%	0.321	C	S	.	.	H	α-helix	trans	-66.2	-26.4	-172.2	72.1	174.3	-167.4	152.4	0	113.2	F108 E109 Q111 K393	F108-K389 WeakPolarHBondContact O-CD 2.94Å; F108-K389 PolarHBondContact O-NZ 3.34Å; E109-K389 WeakPolarHBondContact O-CD 3.16Å; E109-K389 PolarHBondContact O-NZ 3.26Å; E109-K389 IonicContact OE2-NZ 3.49Å; Q111-K389 HydrophobicContact CB-CB 4.13Å; K389-K393 WeakPolarHBondContact O-CB 3.43Å; K389-K393 PolarHBondContact O-N 3.28Å
390	E	94.3	Very high	86.1	Confident	107 Å²	107	58.6 Å²	58.6	50%	0.5	30%	0.301	S	S	.	.	H	α-helix	trans	-67.3	-53.5	176.3	-66.2	66.5	-149	0	0	110.6	P388 L392 K393 E394	P388-E390 PolarHBondContact O-N 3.46Å; E390-L392 VanDerWaalsContact C-N 3.3Å; E390-L392 PolarHBondContact O-N 3.14Å; E390-K393 WeakPolarHBondContact O-CA 3.47Å; E390-K393 VanDerWaalsContact O-CB 3.28Å; E390-K393 WeakPolarHBondContact O-CB 3.43Å; E390-K393 PolarHBondContact O-N 3.12Å; E390-E394 PolarHBondContact O-N 3.08Å
391	T	94.9	Very high	87.4	Confident	51 Å²	51	56.2 Å²	56.2	31%	0.313	30%	0.298	S	S	.	.	H	α-helix	trans	-62.6	-36.9	174.7	-56.5	0	0	0	0	112.2	P388 K393 E394 M395	P388-T391 PolarHBondContact O-N 2.86Å; T391-K393 VanDerWaalsContact C-N 3.27Å; T391-K393 PolarHBondContact O-N 3.43Å; T391-E394 WeakPolarHBondContact CA-OE2 3.39Å; T391-E394 WeakPolarHBondContact O-CB 3.46Å; T391-E394 PolarHBondContact O-N 2.96Å; T391-M395 HydrophobicContact CG2-SD 4.33Å; T391-M395 VanDerWaalsContact O-CG 3.29Å; T391-M395 WeakPolarHBondContact O-CG 3.5Å; T391-M395 PolarHBondContact O-N 3.07Å
392	L	94.9	Very high	88.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.7	-30	173	-67.3	165.6	0	0	0	112.5	Q111 C114 Q115 L118 L384 L387 P388 E390 I396	Q111-L392 HydrophobicContact CG-CD1 4.01Å; C114-L392 HydrophobicContact CB-CB 3.63Å; C114-L392 HydrophobicContact CB-CD1 3.94Å; C114-L392 HydrophobicContact CB-CG 4.42Å; Q115-L392 HydrophobicContact CG-CD1 3.56Å; Q115-L392 HydrophobicContact CG-CD2 4.38Å; L118-L392 HydrophobicContact CD2-CD2 3.77Å; L384-L392 HydrophobicContact CB-CD2 4.09Å; L384-L392 HydrophobicContact CD1-CD2 4.48Å; L384-L392 HydrophobicContact CD2-CD2 4.13Å; L384-L392 HydrophobicContact CG-CD2 4.46Å; L387-L392 HydrophobicContact CB-CD1 4.33Å; L387-L392 HydrophobicContact CB-CD2 3.92Å; L387-L392 HydrophobicContact CB-CG 3.9Å; L387-L392 HydrophobicContact CD1-CD2 4.09Å; L387-L392 VanDerWaalsContact O-CD1 3.29Å; L387-L392 WeakPolarHBondContact O-CD1 3.48Å; P388-L392 WeakPolarHBondContact O-CG 3.39Å; P388-L392 PolarHBondContact O-N 3.36Å; E390-L392 VanDerWaalsContact C-N 3.3Å; E390-L392 PolarHBondContact O-N 3.14Å; L392-I396 WeakPolarHBondContact O-CD1 3.33Å; L392-I396 WeakPolarHBondContact O-CG1 3.22Å; L392-I396 PolarHBondContact O-N 3.02Å
393	K	96.4	Very high	90	Very high	42 Å²	42	56.5 Å²	56.5	18%	0.183	28%	0.282	C	S	.	.	H	α-helix	trans	-70.1	-42.1	173.3	-177.4	-179.4	-178	-172.9	0	111.5	F108 L144 M147 K389 E390 T391 I396 Y397	F108-K393 HydrophobicContact CB-CD 4.31Å; F108-K393 HydrophobicContact CD1-CB 3.73Å; F108-K393 HydrophobicContact CD1-CD 3.89Å; F108-K393 HydrophobicContact CD1-CG 3.5Å; F108-K393 HydrophobicContact CE1-CB 4.02Å; F108-K393 HydrophobicContact CE1-CD 4.38Å; F108-K393 HydrophobicContact CE1-CG 3.63Å; F108-K393 HydrophobicContact CG-CD 3.97Å; F108-K393 HydrophobicContact CG-CG 4.1Å; F108-K393 HydrophobicContact CZ-CG 4.31Å; L144-K393 HydrophobicContact CD1-CD 4.27Å; L144-K393 HydrophobicContact CD1-CG 3.91Å; L144-K393 WeakPolarHBondContact O-CE 3.45Å; L144-K393 PolarHBondContact O-NZ 2.83Å; M147-K393 HydrophobicContact CE-CD 4.43Å; M147-K393 HydrophobicContact CE-CG 3.6Å; M147-K393 WeakPolarHBondContact CE-O 3.37Å; M147-K393 WeakPolarHBondContact O-CE 3.28Å; M147-K393 PolarHBondContact O-NZ 3.16Å; K389-K393 WeakPolarHBondContact O-CB 3.43Å; K389-K393 PolarHBondContact O-N 3.28Å; E390-K393 WeakPolarHBondContact O-CA 3.47Å; E390-K393 VanDerWaalsContact O-CB 3.28Å; E390-K393 WeakPolarHBondContact O-CB 3.43Å; E390-K393 PolarHBondContact O-N 3.12Å; T391-K393 VanDerWaalsContact C-N 3.27Å; T391-K393 PolarHBondContact O-N 3.43Å; K393-I396 PolarHBondContact O-N 2.82Å; K393-Y397 WeakPolarHBondContact O-CB 3.42Å; K393-Y397 PolarHBondContact O-N 2.74Å
394	E	96.2	Very high	90.7	Very high	89 Å²	89	55.9 Å²	55.9	42%	0.416	28%	0.28	S	S	.	.	H	α-helix	trans	-58.4	-51.1	173	-67.8	162.5	171.4	0	0	110.4	L144 E390 T391 I396 Y397 D398	L144-E394 HydrophobicContact CD2-CG 3.92Å; E390-E394 PolarHBondContact O-N 3.08Å; T391-E394 WeakPolarHBondContact CA-OE2 3.39Å; T391-E394 WeakPolarHBondContact O-CB 3.46Å; T391-E394 PolarHBondContact O-N 2.96Å; E394-I396 VanDerWaalsContact C-N 3.31Å; E394-I396 PolarHBondContact O-N 3.23Å; E394-Y397 WeakPolarHBondContact O-CA 3.49Å; E394-Y397 WeakPolarHBondContact O-CB 3.28Å; E394-Y397 PolarHBondContact O-N 2.56Å; E394-D398 PolarHBondContact O-N 3.3Å
395	M	95.6	Very high	90.1	Very high	57 Å²	57	60.7 Å²	60.7	28%	0.281	31%	0.309	S	S	.	.	H	α-helix	trans	-60.1	-36.5	177.1	-66.7	173.1	83.8	0	0	113.3	L118 L384 L387 T391 E399	L118-M395 HydrophobicContact CD1-CB 4.16Å; L118-M395 HydrophobicContact CD2-CB 3.54Å; L118-M395 HydrophobicContact CD2-CE 4.09Å; L118-M395 HydrophobicContact CD2-CG 4.38Å; L118-M395 HydrophobicContact CD2-SD 3.98Å; L384-M395 HydrophobicContact CD2-CE 3.9Å; L384-M395 HydrophobicContact CD2-SD 4.46Å; L387-M395 HydrophobicContact CD1-CE 4.28Å; L387-M395 HydrophobicContact CD1-SD 3.68Å; T391-M395 HydrophobicContact CG2-SD 4.33Å; T391-M395 VanDerWaalsContact O-CG 3.29Å; T391-M395 WeakPolarHBondContact O-CG 3.5Å; T391-M395 PolarHBondContact O-N 3.07Å; M395-E399 VanDerWaalsContact O-CB 3.22Å; M395-E399 WeakPolarHBondContact O-CB 3.29Å; M395-E399 PolarHBondContact O-N 3.01Å
396	I	95.9	Very high	89	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.4	-40.9	172.9	-72.5	165.4	0	0	0	110.9	F108 C114 T117 L118 I121 M147 V150 L392 K393 E394 T400	F108-I396 HydrophobicContact CE1-CB 4.45Å; F108-I396 HydrophobicContact CE1-CD1 3.89Å; F108-I396 HydrophobicContact CE1-CG2 4.28Å; F108-I396 HydrophobicContact CZ-CG2 4.22Å; C114-I396 HydrophobicContact CB-CD1 4.39Å; T117-I396 HydrophobicContact CG2-CD1 4.24Å; L118-I396 HydrophobicContact CB-CD1 4.1Å; L118-I396 HydrophobicContact CB-CG1 3.71Å; L118-I396 HydrophobicContact CD1-CG1 3.86Å; L118-I396 HydrophobicContact CG-CG1 4.24Å; I121-I396 HydrophobicContact CD1-CG2 4.45Å; M147-I396 HydrophobicContact CE-CG2 4.28Å; M147-I396 HydrophobicContact SD-CG2 4.48Å; V150-I396 HydrophobicContact CG2-CG2 4.06Å; L392-I396 WeakPolarHBondContact O-CD1 3.33Å; L392-I396 WeakPolarHBondContact O-CG1 3.22Å; L392-I396 PolarHBondContact O-N 3.02Å; K393-I396 PolarHBondContact O-N 2.82Å; E394-I396 VanDerWaalsContact C-N 3.31Å; E394-I396 PolarHBondContact O-N 3.23Å; I396-T400 HydrophobicContact CG2-CG2 4.47Å; I396-T400 WeakPolarHBondContact O-CB 3.43Å; I396-T400 WeakPolarHBondContact O-CG2 3.39Å; I396-T400 PolarHBondContact O-N 3.32Å; I396-T400 PolarHBondContact O-OG1 3.24Å
397	Y	96.3	Very high	87.1	Confident	60 Å²	60	59.7 Å²	59.7	24%	0.235	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-40.1	179.1	176.5	-89.1	0	0	0	112.4	R140 P142 L144 M147 K393 E394 T400 A401	R140-Y397 PolarHBondContact NH2-O 2.76Å; P142-Y397 WeakPolarHBondContact O-CE2 3.44Å; P142-Y397 PolarHBondContact O-OH 3.01Å; L144-Y397 HydrophobicContact CB-CD2 4Å; L144-Y397 HydrophobicContact CB-CE2 4.06Å; L144-Y397 HydrophobicContact CB-CG 4.32Å; L144-Y397 HydrophobicContact CD1-CD2 4.11Å; L144-Y397 HydrophobicContact CD1-CG 3.92Å; L144-Y397 VanDerWaalsContact N-CE2 3.33Å; M147-Y397 HydrophobicContact CE-CD2 4.37Å; M147-Y397 HydrophobicContact SD-CD2 4.33Å; K393-Y397 WeakPolarHBondContact O-CB 3.42Å; K393-Y397 PolarHBondContact O-N 2.74Å; E394-Y397 WeakPolarHBondContact O-CA 3.49Å; E394-Y397 WeakPolarHBondContact O-CB 3.28Å; E394-Y397 PolarHBondContact O-N 2.56Å; Y397-T400 PolarHBondContact O-OG1 2.78Å; Y397-T400 VanDerWaalsContact O-OG1 3.06Å; Y397-A401 PolarHBondContact O-N 2.87Å
398	D	95.2	Very high	84.5	Confident	107 Å²	107	63.9 Å²	63.9	57%	0.572	33%	0.331	S	S	*	.	H	α-helix	trans	-72.4	-48.4	178.7	-68.5	-20.6	0	0	0	112.1	E394 T400 A401	E394-D398 PolarHBondContact O-N 3.3Å; D398-T400 PolarHBondContact O-N 3.02Å; D398-A401 WeakPolarHBondContact O-CB 3.4Å; D398-A401 PolarHBondContact O-N 3.38Å
399	E	94.4	Very high	81.7	Confident	41 Å²	41	64.5 Å²	64.5	19%	0.192	35%	0.348	C	S	.	.	H	α-helix	trans	-60.2	-30.4	179.8	-166.1	67.1	-107.9	0	0	112.1	L118 I121 K122 L125 M395 R402	L118-E399 HydrophobicContact CD1-CB 4.38Å; I121-E399 HydrophobicContact CG2-CB 4.48Å; I121-E399 HydrophobicContact CG2-CG 3.74Å; K122-E399 WeakPolarHBondContact CD-OE2 3.09Å; K122-E399 WeakPolarHBondContact CE-OE2 3.02Å; K122-E399 HydrophobicContact CG-CG 3.88Å; K122-E399 VanDerWaalsContact CG-OE2 3.31Å; K122-E399 WeakPolarHBondContact CG-OE2 3.32Å; K122-E399 IonicContact NZ-OE2 3.68Å; K122-E399 PolarHBondContact NZ-OE2 3.4Å; L125-E399 HydrophobicContact CD1-CG 4.19Å; M395-E399 VanDerWaalsContact O-CB 3.22Å; M395-E399 WeakPolarHBondContact O-CB 3.29Å; M395-E399 PolarHBondContact O-N 3.01Å; E399-R402 PolarHBondContact O-NE 3.13Å; E399-R402 IonicContact OE1-CZ 3.49Å; E399-R402 IonicContact OE1-NH2 2.83Å; E399-R402 PolarHBondContact OE1-NH2 3.28Å
400	T	95.7	Very high	78.6	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-8.1	176.2	59.2	0	0	0	0	114.4	I121 I138 R140 I396 Y397 D398 R402 F403	I121-T400 HydrophobicContact CD1-CG2 4.16Å; I138-T400 HydrophobicContact CB-CG2 4.27Å; I138-T400 HydrophobicContact CD1-CG2 3.83Å; I138-T400 HydrophobicContact CG2-CG2 3.69Å; R140-T400 WeakPolarHBondContact CD-OG1 3.43Å; R140-T400 PolarHBondContact NE-OG1 2.99Å; I396-T400 HydrophobicContact CG2-CG2 4.47Å; I396-T400 WeakPolarHBondContact O-CB 3.43Å; I396-T400 WeakPolarHBondContact O-CG2 3.39Å; I396-T400 PolarHBondContact O-N 3.32Å; I396-T400 PolarHBondContact O-OG1 3.24Å; Y397-T400 PolarHBondContact O-OG1 2.78Å; Y397-T400 VanDerWaalsContact O-OG1 3.06Å; D398-T400 PolarHBondContact O-N 3.02Å; T400-R402 PolarHBondContact O-N 3.41Å; T400-F403 PolarHBondContact O-N 2.8Å
401	A	93.9	Very high	77.9	Confident	39 Å²	39	68.4 Å²	68.4	32%	0.322	39%	0.39	S	S	.	.	H	α-helix	trans	-60.1	-32.8	-177.1	0	0	0	0	0	112.5	Y397 D398 F403 Q404	Y397-A401 PolarHBondContact O-N 2.87Å; D398-A401 WeakPolarHBondContact O-CB 3.4Å; D398-A401 PolarHBondContact O-N 3.38Å; A401-F403 PolarHBondContact O-N 3.29Å; A401-Q404 PolarHBondContact O-N 3.47Å
402	R	90.8	Very high	77	Confident	130 Å²	130	69.3 Å²	69.3	49%	0.491	39%	0.394	S	S	.	.	H	α-helix	trans	-54.4	-25.6	177.7	70	173.2	93.3	-177.9	4	114.4	E399 T400	E399-R402 PolarHBondContact O-NE 3.13Å; E399-R402 IonicContact OE1-CZ 3.49Å; E399-R402 IonicContact OE1-NH2 2.83Å; E399-R402 PolarHBondContact OE1-NH2 3.28Å; T400-R402 PolarHBondContact O-N 3.41Å
403	F	91	Very high	76	Confident	31 Å²	31	73.1 Å²	73.1	14%	0.136	42%	0.416	C	S	.	.	H	α-helix	trans	-86.6	-21	179.7	-66.2	-78.6	0	0	0	113.2	L125 I135 D137 I138 T400 A401	L125-F403 HydrophobicContact CD1-CE2 4.09Å; L125-F403 HydrophobicContact CD2-CE2 3.71Å; L125-F403 HydrophobicContact CD2-CZ 3.53Å; I135-F403 HydrophobicContact CG2-CZ 4.33Å; D137-F403 WeakPolarHBondContact OD1-CD1 3.44Å; I138-F403 HydrophobicContact CB-CD2 3.83Å; I138-F403 HydrophobicContact CB-CE2 4.29Å; I138-F403 HydrophobicContact CB-CG 4.14Å; I138-F403 HydrophobicContact CD1-CD2 3.91Å; I138-F403 HydrophobicContact CD1-CE2 3.59Å; I138-F403 HydrophobicContact CD1-CZ 4.36Å; I138-F403 HydrophobicContact CG1-CD2 3.81Å; I138-F403 HydrophobicContact CG1-CE2 3.73Å; I138-F403 HydrophobicContact CG1-CG 4.37Å; I138-F403 HydrophobicContact CG1-CZ 4.22Å; T400-F403 PolarHBondContact O-N 2.8Å; A401-F403 PolarHBondContact O-N 3.29Å
404	Q	84.6	Confident	74.8	Confident	35 Å²	35	74.9 Å²	74.9	16%	0.164	43%	0.429	C	S	.	.	H	α-helix	trans	-78	-24.9	-175	-50.7	-49.7	-64.3	0	0	112.9	I138 A401 I406 S407	I138-Q404 PolarHBondContact O-NE2 2.96Å; A401-Q404 PolarHBondContact O-N 3.47Å; Q404-I406 PolarHBondContact O-N 2.95Å; Q404-S407 PolarHBondContact O-N 2.87Å
405	T	56.2	Low	73.4	Confident	105 Å²	105	74.1 Å²	74.1	64%	0.644	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-60.8	-27.5	-174.7	-37	0	0	0	0	113.4	S407	T405-S407 VanDerWaalsContact C-N 3.26Å; T405-S407 PolarHBondContact O-N 2.98Å
406	I	49.8	Very low	71.9	Confident	103 Å²	103	75.2 Å²	75.2	53%	0.528	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-70.3	-24.5	179.2	-56	177.4	0	0	0	111.5	W95 Q404	W95-I406 HydrophobicContact CH2-CG2 4.07Å; W95-I406 HydrophobicContact CZ3-CG2 3.86Å; Q404-I406 PolarHBondContact O-N 2.95Å
407	S	40.2	Very low	70.2	Confident	86 Å²	86	80.6 Å²	80.6	60%	0.601	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-94.6	-0.2	-175.7	-63.7	0	0	0	0	114.8	Q404 T405	Q404-S407 PolarHBondContact O-N 2.87Å; T405-S407 VanDerWaalsContact C-N 3.26Å; T405-S407 PolarHBondContact O-N 2.98Å
408	L	32.9	Very low	68.2	Low	145 Å²	145	82.2 Å²	82.2	76%	0.759	49%	0.49	S	S	*	.			trans	-101.4	12.5	-177.7	-75.7	166.2	0	0	0	114	S410	L408-S410 VanDerWaalsContact C-N 3.31Å; L408-S410 PolarHBondContact O-N 3.01Å
409	G	33.8	Very low	66	Low	72 Å²	72	80.1 Å²	80.1	74%	0.742	48%	0.483	S	S	*	.			trans	-84.3	52.8	175.1	0	0	0	0	0	114.5
410	S	28.7	Very low	63.4	Low	174 Å²	174	83.6 Å²	83.6	100%	1.217	51%	0.509	S	S	*	.			trans	-150.2	0	177.9	69.1	0	0	0	0	114	L408	L408-S410 VanDerWaalsContact C-N 3.31Å; L408-S410 PolarHBondContact O-N 3.01Å

Retrieved 410 of 410 residues in 570.7 ms (Link to these results)

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