A0A087YPY2_POEFO Loading...

Myosin light chain 4

AlphaFold DB , UniProt , Accession A0A087YPY2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 202 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	41	Very low	44.6	Very low	240 Å²	240	171.1 Å²	171.1	100%	1.182	87%	0.868	S	S	*	*				0	116.1	0	-69.6	177.3	-179.9	0	0	108.3
2	P	46.7	Very low	44	Very low	124 Å²	124	172.3 Å²	172.3	81%	0.805	87%	0.867	S	S	*	*			trans	-95.3	143.7	172.7	34.6	-27.5	0	0	0	110.8
3	P	46.2	Very low	43.7	Very low	124 Å²	124	167.8 Å²	167.8	81%	0.805	86%	0.858	S	S	*	*			trans	-113.2	104.7	155.5	15	4.4	0	0	0	109.2
4	K	46.5	Very low	43.5	Very low	196 Å²	196	171.4 Å²	171.4	85%	0.852	86%	0.864	S	S	*	*				68	106.8	102.2	-83.3	-171.4	174.7	179.8	0	115.1
5	K	47.3	Very low	43.4	Very low	204 Å²	204	172.9 Å²	172.9	89%	0.887	86%	0.863	S	S	*	*			trans	-50.3	140.2	156	-69	176.7	173.3	-177.3	0	110.8
6	I	46	Very low	43	Very low	165 Å²	165	169.9 Å²	169.9	85%	0.846	86%	0.859	S	S	*	*			trans	-140.6	129.4	148.7	-59.2	-176	0	0	0	109.4
7	E	46.8	Very low	42.9	Very low	174 Å²	174	170.8 Å²	170.8	81%	0.813	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-69.2	165.5	-173.6	-75.5	161.3	99.9	0	0	115.7
8	P	43.7	Very low	42.6	Very low	132 Å²	132	168 Å²	168	86%	0.857	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-79.4	131	-179.8	32.7	-32.2	0	0	0	111.3
9	K	43.3	Very low	42.5	Very low	213 Å²	213	169.9 Å²	169.9	93%	0.926	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-97.9	121.5	167	-94.6	-172.1	173.8	-177.6	0	110.9
10	K	39.1	Very low	42.4	Very low	206 Å²	206	171.7 Å²	171.7	90%	0.896	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-63	160	167.3	-117.5	-169.7	169.9	179.5	0	111.4
11	P	44.5	Very low	42.2	Very low	104 Å²	104	170.8 Å²	170.8	68%	0.675	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-92.3	167.8	-164.7	38.5	-33.9	0	0	0	113.2
12	E	37.6	Very low	42.2	Very low	185 Å²	185	164 Å²	164	86%	0.864	84%	0.839	S	S	*	*			trans	159.3	164.6	143.3	-91.1	177.7	131.7	0	0	110.7
13	P	39.6	Very low	42.1	Very low	114 Å²	114	162.3 Å²	162.3	74%	0.74	84%	0.836	S	S	*	*				-125.3	139.3	-51.6	32.7	-16.7	0	0	0	110.4
14	K	41	Very low	41.9	Very low	219 Å²	219	162.4 Å²	162.4	95%	0.952	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-96.3	124	168.3	-87.8	-171.1	176.6	-177.3	0	110.8
15	K	41.2	Very low	41.9	Very low	194 Å²	194	157.6 Å²	157.6	84%	0.843	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-46.9	144.8	-178.7	-141.6	169.9	-179.4	-177.4	0	113.1	E17	K15-E17 PolarHBondContact O-N 3.09Å
16	P	37.1	Very low	41.8	Very low	124 Å²	124	152.4 Å²	152.4	81%	0.805	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-73.6	125.6	-179.6	30.2	-33.8	0	0	0	110.8
17	E	41.7	Very low	41.9	Very low	185 Å²	185	154 Å²	154	86%	0.864	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-95	149.4	167.9	-83	-176.4	120.8	0	0	110.8	K15	K15-E17 PolarHBondContact O-N 3.09Å
18	P	38.5	Very low	41.8	Very low	121 Å²	121	151.6 Å²	151.6	79%	0.786	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-76.8	144.8	-155	31.1	-34.9	0	0	0	112.6	K20	P18-K20 PolarHBondContact O-N 3.47Å; P18-K20 VanDerWaalsContact O-N 3.09Å
19	K	39.3	Very low	42.2	Very low	205 Å²	205	149.5 Å²	149.5	89%	0.891	82%	0.822	S	S	*	*			trans	-54.5	115	170	-77.5	-179.4	175.6	179.2	0	109
20	K	41.3	Very low	42.5	Very low	204 Å²	204	145.4 Å²	145.4	89%	0.887	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-83.3	119.6	166.7	-139.6	178	-175.9	-177.8	0	107.4	P18	P18-K20 PolarHBondContact O-N 3.47Å; P18-K20 VanDerWaalsContact O-N 3.09Å
21	D	38.5	Very low	43.2	Very low	153 Å²	153	143.2 Å²	143.2	82%	0.818	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-50.4	133.4	-178	-63.8	-71.4	0	0	0	112.8	A23	D21-A23 PolarHBondContact O-N 3.47Å
22	A	40.2	Very low	43.8	Very low	98 Å²	98	144 Å²	144	81%	0.81	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-66.4	127.6	170.3	0	0	0	0	0	109.2
23	A	45.2	Very low	44.9	Very low	89 Å²	89	143.7 Å²	143.7	74%	0.736	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-58.4	143.4	170.1	0	0	0	0	0	110.4	D21 A25	D21-A23 PolarHBondContact O-N 3.47Å; A23-A25 PolarHBondContact O-N 3.39Å
24	P	42	Very low	45.6	Very low	126 Å²	126	144.2 Å²	144.2	82%	0.818	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-66.8	129.4	-179.6	26	-30.7	0	0	0	110.3	A26	P24-A26 PolarHBondContact O-N 3.37Å
25	A	45.3	Very low	46.4	Very low	94 Å²	94	141.3 Å²	141.3	78%	0.777	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-56.6	129.7	172.1	0	0	0	0	0	110.1	A23 K27	A23-A25 PolarHBondContact O-N 3.39Å; A25-K27 PolarHBondContact O-N 3.45Å
26	A	46.4	Very low	47.4	Very low	96 Å²	96	137.7 Å²	137.7	79%	0.793	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-56.9	129.2	169.5	0	0	0	0	0	109.1	P24	P24-A26 PolarHBondContact O-N 3.37Å
27	K	47.8	Very low	48.3	Very low	199 Å²	199	139.6 Å²	139.6	87%	0.865	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-59.1	138.8	175.3	-70.9	-179.6	175.4	-178	0	109.3	A25 A29	A25-K27 PolarHBondContact O-N 3.45Å; K27-A29 PolarHBondContact O-N 3.34Å
28	P	44.9	Very low	49.1	Very low	122 Å²	122	136.2 Å²	136.2	79%	0.792	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-58.2	137.3	171.9	-16.3	28.4	0	0	0	109.7
29	A	52.6	Low	49.8	Very low	88 Å²	88	136.2 Å²	136.2	73%	0.727	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-58.4	143	169.6	0	0	0	0	0	109.7	K27 L31	K27-A29 PolarHBondContact O-N 3.34Å; A29-L31 PolarHBondContact O-N 3.37Å
30	P	48.3	Very low	50.6	Low	128 Å²	128	135.6 Å²	135.6	83%	0.831	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-59.7	134.8	174.2	-16.6	30.1	0	0	0	109.7
31	L	54.8	Low	51.5	Low	160 Å²	160	131.8 Å²	131.8	84%	0.838	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-54.8	142.9	168.1	-79.4	145.2	0	0	0	109.3	A29 E33	A29-L31 PolarHBondContact O-N 3.37Å; L31-E33 PolarHBondContact O-N 3.26Å
32	P	56.2	Low	52.6	Low	121 Å²	121	130 Å²	130	79%	0.786	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-53.8	134.7	171.6	-18.8	29.4	0	0	0	109.7
33	E	60.2	Low	54.1	Low	177 Å²	177	131.4 Å²	131.4	83%	0.827	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-55.5	141.5	175	-66	-179.9	164.3	0	0	110	L31 L35	L31-E33 PolarHBondContact O-N 3.26Å; E33-L35 PolarHBondContact O-N 3.18Å
34	P	55.4	Low	55.8	Low	125 Å²	125	128.7 Å²	128.7	81%	0.812	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-56.1	128.9	172.9	-18.3	29.6	0	0	0	109.1
35	L	57.9	Low	57.8	Low	158 Å²	158	126.6 Å²	126.6	83%	0.827	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-52.7	136.5	171.4	-69.9	166.4	0	0	0	108.7	E33 E37	E33-L35 PolarHBondContact O-N 3.18Å; L35-E37 PolarHBondContact O-N 3.41Å
36	P	61	Low	59.4	Low	118 Å²	118	123.7 Å²	123.7	77%	0.766	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-54.7	126.2	178.3	16.8	-26.3	0	0	0	109.5
37	E	57.2	Low	61	Low	165 Å²	165	128.4 Å²	128.4	77%	0.771	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-52.2	134.1	176.8	-68.1	-176.4	161.6	0	0	109	L35	L35-E37 PolarHBondContact O-N 3.41Å
38	P	57.2	Low	62.9	Low	113 Å²	113	123.1 Å²	123.1	73%	0.734	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-55.1	144.1	175.8	22.3	-31.1	0	0	0	109.3	K40	P38-K40 PolarHBondContact O-N 2.91Å
39	P	55	Low	65	Low	121 Å²	121	118.5 Å²	118.5	79%	0.786	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-50.3	127.3	-178.7	-22.7	30.5	0	0	0	110	E41	P39-E41 PolarHBondContact O-N 3.17Å
40	K	55.9	Low	66.8	Low	192 Å²	192	117.1 Å²	117.1	84%	0.835	65%	0.653	S	S	*	*			trans	-56.1	109.3	172.9	-77.2	-180	-180	174.9	0	107.8	P38	P38-K40 PolarHBondContact O-N 2.91Å
41	E	60.1	Low	69	Low	124 Å²	124	114.3 Å²	114.3	58%	0.579	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-55.1	133.8	170.5	-63.8	-174.3	157.8	0	0	108	P39 D43 K101	P39-E41 PolarHBondContact O-N 3.17Å; E41-D43 PolarHBondContact O-N 2.72Å; E41-K101 WeakPolarHBondContact OE2-CE 3.41Å; E41-K101 IonicContact OE2-NZ 3.69Å; E41-K101 PolarHBondContact OE2-NZ 3.2Å
42	P	61.6	Low	70.9	Confident	117 Å²	117	113 Å²	113	76%	0.76	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-56.2	135.3	177.1	22.5	-30.7	0	0	0	109.2
43	D	71.4	Confident	72.7	Confident	127 Å²	127	108.9 Å²	108.9	68%	0.679	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-56.4	143.5	177.9	-72.4	-44.6	0	0	0	110.1	E41 D45	E41-D43 PolarHBondContact O-N 2.72Å; D43-D45 PolarHBondContact O-N 3.34Å
44	F	79.8	Confident	74.4	Confident	32 Å²	32	103 Å²	103	14%	0.14	57%	0.569	C	S	.	*	P	Polyproline II helix	trans	-63.7	123.7	-179	176.3	-104.1	0	0	0	110.5	P46 V49 V102 M124 H127	F44-P46 HydrophobicContact CD1-CG 3.96Å; F44-P46 HydrophobicContact CE1-CB 3.9Å; F44-P46 HydrophobicContact CE1-CG 3.63Å; F44-P46 HydrophobicContact CZ-CB 4.43Å; F44-P46 WeakPolarHBondContact O-CD 3.44Å; F44-V49 HydrophobicContact CE2-CG2 3.66Å; F44-V49 HydrophobicContact CZ-CG2 3.8Å; F44-V102 HydrophobicContact CD1-CB 4Å; F44-V102 HydrophobicContact CD1-CG1 4.36Å; F44-V102 VanDerWaalsContact CD1-O 3.22Å; F44-V102 WeakPolarHBondContact CD1-O 3.47Å; F44-V102 HydrophobicContact CD2-CG1 4.35Å; F44-V102 HydrophobicContact CE1-CB 4.01Å; F44-V102 HydrophobicContact CE1-CG1 4.35Å; F44-V102 HydrophobicContact CE2-CG1 4.39Å; F44-V102 HydrophobicContact CG-CB 4.41Å; F44-V102 HydrophobicContact CG-CG1 4.34Å; F44-V102 HydrophobicContact CZ-CB 4.47Å; F44-V102 HydrophobicContact CZ-CG1 4.36Å; F44-M124 HydrophobicContact CE1-CG 3.83Å; F44-M124 HydrophobicContact CZ-CG 4.4Å; F44-H127 HydrophobicContact CD2-CB 4.5Å; F44-H127 AromaticContact CD2-CG 3.96Å; F44-H127 HydrophobicContact CE2-CB 3.48Å; F44-H127 VanDerWaalsContact CE2-CB 3.48Å; F44-H127 AromaticContact CE2-CD2 3.84Å; F44-H127 AromaticContact CE2-CG 3.36Å; F44-H127 AromaticContact CE2-ND1 3.61Å; F44-H127 HydrophobicContact CZ-CB 3.83Å
45	D	83.9	Confident	76.4	Confident	81 Å²	81	102.1 Å²	102.1	43%	0.433	56%	0.561	S	S	.	*			trans	-106.9	104.2	171.4	-178.6	6.3	0	0	0	109.9	D43 K47 S48	D43-D45 PolarHBondContact O-N 3.34Å; D45-K47 PolarHBondContact O-N 3.3Å; D45-K47 VanDerWaalsContact O-N 3.11Å; D45-K47 WeakPolarHBondContact OD1-CB 3.49Å; D45-K47 PolarHBondContact OD1-N 3.11Å; D45-S48 PolarHBondContact O-N 3.09Å; D45-S48 VanDerWaalsContact O-N 3.09Å; D45-S48 PolarHBondContact O-OG 3.02Å
46	P	80.6	Confident	78.2	Confident	33 Å²	33	100.4 Å²	100.4	21%	0.214	55%	0.553	C	S	.	*	G	3₁₀ helix	trans	-55	-30.7	178.9	-18.6	25.6	0	0	0	113	F44 S48 V49 P123 M124	F44-P46 HydrophobicContact CD1-CG 3.96Å; F44-P46 HydrophobicContact CE1-CB 3.9Å; F44-P46 HydrophobicContact CE1-CG 3.63Å; F44-P46 HydrophobicContact CZ-CB 4.43Å; F44-P46 WeakPolarHBondContact O-CD 3.44Å; P46-S48 VanDerWaalsContact C-N 3.25Å; P46-S48 PolarHBondContact O-N 3.35Å; P46-V49 PolarHBondContact O-N 3.37Å; P46-P123 HydrophobicContact CB-CB 4.08Å; P46-P123 WeakPolarHBondContact O-CB 3.23Å; P46-M124 HydrophobicContact CG-CE 4.38Å
47	K	80.1	Confident	79.9	Confident	195 Å²	195	98.5 Å²	98.5	85%	0.848	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-74.3	-17.8	-176.1	-61.3	-178.9	-178.8	179.3	0	113.3	D45 V49	D45-K47 PolarHBondContact O-N 3.3Å; D45-K47 VanDerWaalsContact O-N 3.11Å; D45-K47 WeakPolarHBondContact OD1-CB 3.49Å; D45-K47 PolarHBondContact OD1-N 3.11Å; K47-V49 VanDerWaalsContact C-N 3.35Å
48	S	86	Confident	81.8	Confident	89 Å²	89	92.6 Å²	92.6	62%	0.622	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-84.7	-11.2	179.5	72.3	0	0	0	0	113.4	D45 P46	D45-S48 PolarHBondContact O-N 3.09Å; D45-S48 VanDerWaalsContact O-N 3.09Å; D45-S48 PolarHBondContact O-OG 3.02Å; P46-S48 VanDerWaalsContact C-N 3.25Å; P46-S48 PolarHBondContact O-N 3.35Å
49	V	89.7	Confident	83.7	Confident	24 Å²	24	91.6 Å²	91.6	15%	0.145	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-82.7	121.8	-176.1	-175.9	0	0	0	0	110.3	F44 P46 K47 P123 Q126 H127	F44-V49 HydrophobicContact CE2-CG2 3.66Å; F44-V49 HydrophobicContact CZ-CG2 3.8Å; P46-V49 PolarHBondContact O-N 3.37Å; K47-V49 VanDerWaalsContact C-N 3.35Å; V49-P123 HydrophobicContact CB-CB 4.13Å; V49-Q126 HydrophobicContact CG1-CB 3.84Å; V49-Q126 HydrophobicContact CG1-CG 3.5Å; V49-Q126 VanDerWaalsContact CG1-CG 3.5Å; V49-H127 HydrophobicContact CG2-CB 4.45Å
50	A	90.4	Very high	85.7	Confident	59 Å²	59	91.7 Å²	91.7	49%	0.488	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-75.3	123.3	172.4	0	0	0	0	0	110.4	Q126 R130	A50-Q126 VanDerWaalsContact O-CG 3.27Å; A50-Q126 WeakPolarHBondContact O-CG 3.36Å; A50-R130 PolarHBondContact O-NH2 3.35Å
51	I	94	Very high	87.7	Confident	69 Å²	69	83.7 Å²	83.7	35%	0.354	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-78	122.2	174.8	-53.3	-53.4	0	0	0	109.1	F53 I58 L122 P123 Q126	I51-F53 HydrophobicContact CG2-CB 4.28Å; I51-F53 HydrophobicContact CG2-CD2 4.08Å; I51-I58 HydrophobicContact CG2-CD1 4.26Å; I51-L122 HydrophobicContact CD1-CG 4.2Å; I51-L122 HydrophobicContact CG2-CD2 4.14Å; I51-L122 HydrophobicContact CG2-CG 4.47Å; I51-P123 HydrophobicContact CD1-CB 4.18Å; I51-P123 HydrophobicContact CD1-CG 4.16Å; I51-Q126 HydrophobicContact CD1-CB 3.89Å; I51-Q126 HydrophobicContact CD1-CG 4.11Å
52	E	94.3	Very high	89.4	Confident	134 Å²	134	80.8 Å²	80.8	63%	0.626	43%	0.433	S	S	*	.			trans	-114.6	-0.9	-178.7	-69.6	174.9	-168.8	0	0	112.3	R130	E52-R130 IonicContact OE1-CZ 2.65Å; E52-R130 IonicContact OE1-NH1 2.65Å; E52-R130 IonicContact OE1-NH2 3.91Å; E52-R130 PolarHBondContact OE1-NH2 2.81Å; E52-R130 IonicContact OE2-NH2 2.92Å
53	F	94.5	Very high	91	Very high	33 Å²	33	81.8 Å²	81.8	15%	0.145	43%	0.428	C	S	.	.			trans	-67.5	142.2	174.5	-59.1	-56.9	0	0	0	111.6	I51 Q57 I58 F61 L122 L125 Q126	I51-F53 HydrophobicContact CG2-CB 4.28Å; I51-F53 HydrophobicContact CG2-CD2 4.08Å; F53-Q57 HydrophobicContact CB-CB 4.19Å; F53-I58 HydrophobicContact CB-CD1 4.36Å; F53-I58 HydrophobicContact CB-CG1 3.86Å; F53-F61 HydrophobicContact CB-CE2 4.24Å; F53-F61 AromaticContact CD1-CE2 3.6Å; F53-F61 HydrophobicContact CD1-CE2 3.6Å; F53-F61 HydrophobicContact CD1-CZ 4.07Å; F53-F61 HydrophobicContact CD2-CD2 4.35Å; F53-F61 AromaticContact CD2-CE2 3.8Å; F53-F61 HydrophobicContact CD2-CE2 3.8Å; F53-F61 AromaticContact CE1-CE2 3.74Å; F53-F61 HydrophobicContact CE1-CE2 3.74Å; F53-F61 HydrophobicContact CE1-CZ 4.03Å; F53-F61 AromaticContact CE2-CE2 3.91Å; F53-F61 HydrophobicContact CE2-CE2 3.91Å; F53-F61 HydrophobicContact CG-CD2 4.46Å; F53-F61 AromaticContact CG-CE2 3.63Å; F53-F61 HydrophobicContact CG-CE2 3.63Å; F53-F61 AromaticContact CZ-CE2 3.89Å; F53-F61 HydrophobicContact CZ-CE2 3.89Å; F53-F61 HydrophobicContact CZ-CZ 4.43Å; F53-L122 HydrophobicContact CD2-CD1 3.8Å; F53-L122 HydrophobicContact CE2-CD1 4.09Å; F53-L125 HydrophobicContact CE2-CD2 4.24Å; F53-L125 HydrophobicContact CE2-CG 4.28Å; F53-L125 HydrophobicContact CZ-CD2 4.3Å; F53-L125 HydrophobicContact CZ-CG 4.16Å; F53-Q126 HydrophobicContact CD2-CB 4.37Å; F53-Q126 HydrophobicContact CE2-CB 3.63Å; F53-Q126 HydrophobicContact CE2-CG 4.3Å; F53-Q126 HydrophobicContact CZ-CB 4.23Å
54	S	96.8	Very high	92.2	Very high	55 Å²	55	76.7 Å²	76.7	39%	0.385	40%	0.403	S	S	.	.			trans	-69.4	162.2	172.5	74.8	0	0	0	0	111.1	D56 Q57 I58	S54-D56 VanDerWaalsContact C-N 3.25Å; S54-D56 PolarHBondContact O-N 2.86Å; S54-Q57 PolarHBondContact O-N 3.4Å; S54-Q57 WeakPolarHBondContact OG-CG 3.37Å; S54-Q57 PolarHBondContact OG-N 2.65Å; S54-I58 VanDerWaalsContact O-CG1 3.31Å; S54-I58 WeakPolarHBondContact O-CG1 3.18Å; S54-I58 PolarHBondContact O-N 3.46Å
55	T	96.3	Very high	93	Very high	105 Å²	105	75.2 Å²	75.2	64%	0.644	40%	0.397	S	S	*	.	H	α-helix	trans	-55.8	-42.5	174.9	-49	0	0	0	0	111.8	Q57 I58 E59	T55-Q57 PolarHBondContact O-N 2.89Å; T55-I58 PolarHBondContact O-N 3.38Å; T55-E59 PolarHBondContact O-N 3.37Å
56	D	96.8	Very high	93.6	Very high	122 Å²	122	74.4 Å²	74.4	65%	0.652	40%	0.395	S	S	*	.	H	α-helix	trans	-63.9	-42.3	179.7	-59	-22.7	0	0	0	111.3	S54 I58 E59 E60	S54-D56 VanDerWaalsContact C-N 3.25Å; S54-D56 PolarHBondContact O-N 2.86Å; D56-I58 VanDerWaalsContact C-N 3.34Å; D56-I58 PolarHBondContact O-N 3.46Å; D56-E59 PolarHBondContact O-N 3.15Å; D56-E60 WeakPolarHBondContact O-CG 3.45Å; D56-E60 PolarHBondContact O-N 3.03Å
57	Q	96.6	Very high	94.3	Very high	78 Å²	78	80 Å²	80	36%	0.364	42%	0.422	S	S	.	.	H	α-helix	trans	-62.8	-40.8	174.9	-72.3	177.1	-53.5	0	0	111.9	F53 S54 T55 E59 E60 F61	F53-Q57 HydrophobicContact CB-CB 4.19Å; S54-Q57 PolarHBondContact O-N 3.4Å; S54-Q57 WeakPolarHBondContact OG-CG 3.37Å; S54-Q57 PolarHBondContact OG-N 2.65Å; T55-Q57 PolarHBondContact O-N 2.89Å; Q57-E59 VanDerWaalsContact C-N 3.33Å; Q57-E59 PolarHBondContact O-N 3.41Å; Q57-E60 PolarHBondContact O-N 3.31Å; Q57-F61 HydrophobicContact CB-CE2 4.08Å; Q57-F61 HydrophobicContact CB-CZ 4.1Å; Q57-F61 WeakPolarHBondContact O-CB 3.44Å; Q57-F61 WeakPolarHBondContact O-CD1 3.12Å; Q57-F61 VanDerWaalsContact O-CD2 3.23Å; Q57-F61 WeakPolarHBondContact O-CD2 3.13Å; Q57-F61 WeakPolarHBondContact O-CG 3.22Å; Q57-F61 PolarHBondContact O-N 2.86Å
58	I	97.1	Very high	95.1	Very high	41 Å²	41	73.1 Å²	73.1	21%	0.21	39%	0.392	C	S	.	.	H	α-helix	trans	-63.4	-41.4	178.9	-67.9	167.1	0	0	0	110.7	I51 F53 S54 T55 D56 F61 K62 F118 L122	I51-I58 HydrophobicContact CG2-CD1 4.26Å; F53-I58 HydrophobicContact CB-CD1 4.36Å; F53-I58 HydrophobicContact CB-CG1 3.86Å; S54-I58 VanDerWaalsContact O-CG1 3.31Å; S54-I58 WeakPolarHBondContact O-CG1 3.18Å; S54-I58 PolarHBondContact O-N 3.46Å; T55-I58 PolarHBondContact O-N 3.38Å; D56-I58 VanDerWaalsContact C-N 3.34Å; D56-I58 PolarHBondContact O-N 3.46Å; I58-F61 PolarHBondContact O-N 3.07Å; I58-K62 WeakPolarHBondContact O-CB 3.49Å; I58-K62 PolarHBondContact O-N 2.94Å; I58-F118 HydrophobicContact CG2-CE1 3.96Å; I58-F118 HydrophobicContact CG2-CZ 4.14Å; I58-F118 WeakPolarHBondContact O-CZ 3.4Å; I58-L122 HydrophobicContact CD1-CD2 4.33Å; I58-L122 HydrophobicContact CG1-CD1 4.47Å; I58-L122 HydrophobicContact CG1-CD2 4.17Å; I58-L122 HydrophobicContact CG2-CD2 4.26Å
59	E	96.9	Very high	95.6	Very high	93 Å²	93	70.1 Å²	70.1	44%	0.435	37%	0.369	S	S	.	.	H	α-helix	trans	-65.7	-44.2	175.6	-69.4	-61.4	139.9	0	0	111.5	T55 D56 Q57 F61 K62 E63	T55-E59 PolarHBondContact O-N 3.37Å; D56-E59 PolarHBondContact O-N 3.15Å; Q57-E59 VanDerWaalsContact C-N 3.33Å; Q57-E59 PolarHBondContact O-N 3.41Å; E59-F61 VanDerWaalsContact C-N 3.32Å; E59-F61 PolarHBondContact O-N 3.33Å; E59-K62 WeakPolarHBondContact O-CB 3.35Å; E59-K62 PolarHBondContact O-N 3.49Å; E59-K62 VanDerWaalsContact O-N 3.12Å; E59-E63 WeakPolarHBondContact O-CG 3.42Å; E59-E63 PolarHBondContact O-N 2.98Å
60	E	96.8	Very high	95.8	Very high	122 Å²	122	78.6 Å²	78.6	57%	0.57	40%	0.399	S	S	*	.	H	α-helix	trans	-58	-43.6	173.9	-73.7	178.9	-168.2	0	0	112	D56 Q57 K62 E63 A64	D56-E60 WeakPolarHBondContact O-CG 3.45Å; D56-E60 PolarHBondContact O-N 3.03Å; Q57-E60 PolarHBondContact O-N 3.31Å; E60-K62 VanDerWaalsContact C-N 3.29Å; E60-K62 PolarHBondContact O-N 3.46Å; E60-E63 PolarHBondContact O-N 2.78Å; E60-A64 WeakPolarHBondContact O-CB 3.36Å; E60-A64 PolarHBondContact O-N 2.61Å
61	F	97.6	Very high	95.9	Very high	24 Å²	24	77.1 Å²	77.1	11%	0.105	38%	0.384	C	S	.	.	H	α-helix	trans	-64.5	-36.1	177.3	-61.1	-20.1	0	0	0	112.2	F53 Q57 I58 E59 F65 L90 F118 L122 L125	F53-F61 HydrophobicContact CB-CE2 4.24Å; F53-F61 AromaticContact CD1-CE2 3.6Å; F53-F61 HydrophobicContact CD1-CE2 3.6Å; F53-F61 HydrophobicContact CD1-CZ 4.07Å; F53-F61 HydrophobicContact CD2-CD2 4.35Å; F53-F61 AromaticContact CD2-CE2 3.8Å; F53-F61 HydrophobicContact CD2-CE2 3.8Å; F53-F61 AromaticContact CE1-CE2 3.74Å; F53-F61 HydrophobicContact CE1-CE2 3.74Å; F53-F61 HydrophobicContact CE1-CZ 4.03Å; F53-F61 AromaticContact CE2-CE2 3.91Å; F53-F61 HydrophobicContact CE2-CE2 3.91Å; F53-F61 HydrophobicContact CG-CD2 4.46Å; F53-F61 AromaticContact CG-CE2 3.63Å; F53-F61 HydrophobicContact CG-CE2 3.63Å; F53-F61 AromaticContact CZ-CE2 3.89Å; F53-F61 HydrophobicContact CZ-CE2 3.89Å; F53-F61 HydrophobicContact CZ-CZ 4.43Å; Q57-F61 HydrophobicContact CB-CE2 4.08Å; Q57-F61 HydrophobicContact CB-CZ 4.1Å; Q57-F61 WeakPolarHBondContact O-CB 3.44Å; Q57-F61 WeakPolarHBondContact O-CD1 3.12Å; Q57-F61 VanDerWaalsContact O-CD2 3.23Å; Q57-F61 WeakPolarHBondContact O-CD2 3.13Å; Q57-F61 WeakPolarHBondContact O-CG 3.22Å; Q57-F61 PolarHBondContact O-N 2.86Å; I58-F61 PolarHBondContact O-N 3.07Å; E59-F61 VanDerWaalsContact C-N 3.32Å; E59-F61 PolarHBondContact O-N 3.33Å; F61-F65 VanDerWaalsContact O-CB 3.23Å; F61-F65 WeakPolarHBondContact O-CB 3.35Å; F61-F65 PolarHBondContact O-N 3.16Å; F61-L90 HydrophobicContact CB-CD1 4.11Å; F61-L90 HydrophobicContact CD1-CD1 3.98Å; F61-L90 HydrophobicContact CD1-CD2 3.58Å; F61-L90 HydrophobicContact CD1-CG 4.27Å; F61-L90 HydrophobicContact CE1-CD2 4.25Å; F61-L90 HydrophobicContact CG-CD1 4.12Å; F61-L90 HydrophobicContact CG-CD2 4.4Å; F61-F118 HydrophobicContact CB-CE2 3.97Å; F61-F118 HydrophobicContact CB-CZ 4.09Å; F61-L122 HydrophobicContact CD2-CD1 4Å; F61-L125 HydrophobicContact CD1-CD2 4.4Å; F61-L125 HydrophobicContact CD2-CD2 3.58Å; F61-L125 HydrophobicContact CE2-CD2 3.77Å; F61-L125 HydrophobicContact CG-CD2 3.92Å; F61-L125 HydrophobicContact CZ-CD2 4.25Å
62	K	96.7	Very high	95.6	Very high	63 Å²	63	80.3 Å²	80.3	27%	0.274	41%	0.409	S	S	.	.	H	α-helix	trans	-70.6	-40.2	178.3	-170.5	176.9	-177.7	177.8	0	112	I58 E59 E60 F65 T66 M76 F118	I58-K62 WeakPolarHBondContact O-CB 3.49Å; I58-K62 PolarHBondContact O-N 2.94Å; E59-K62 WeakPolarHBondContact O-CB 3.35Å; E59-K62 PolarHBondContact O-N 3.49Å; E59-K62 VanDerWaalsContact O-N 3.12Å; E60-K62 VanDerWaalsContact C-N 3.29Å; E60-K62 PolarHBondContact O-N 3.46Å; K62-F65 PolarHBondContact O-N 3.29Å; K62-T66 PolarHBondContact O-N 3.49Å; K62-T66 PolarHBondContact O-OG1 3Å; K62-M76 HydrophobicContact CD-CE 4.39Å; K62-M76 HydrophobicContact CD-SD 4.34Å; K62-M76 VanDerWaalsContact CE-SD 3.51Å; K62-M76 HydrophobicContact CG-CE 3.97Å; K62-M76 HydrophobicContact CG-SD 3.95Å; K62-F118 HydrophobicContact CB-CD1 4.45Å; K62-F118 HydrophobicContact CB-CD2 4.37Å; K62-F118 HydrophobicContact CB-CE1 4Å; K62-F118 HydrophobicContact CB-CE2 3.93Å; K62-F118 HydrophobicContact CB-CZ 3.72Å; K62-F118 HydrophobicContact CD-CD1 4.45Å; K62-F118 HydrophobicContact CD-CE1 4.37Å; K62-F118 HydrophobicContact CG-CD1 4.25Å; K62-F118 HydrophobicContact CG-CE1 4.25Å; K62-F118 HydrophobicContact CG-CG 4.37Å; K62-F118 HydrophobicContact CG-CZ 4.38Å
63	E	95.8	Very high	95.5	Very high	139 Å²	139	79.2 Å²	79.2	65%	0.65	41%	0.412	S	S	*	.	H	α-helix	trans	-61	-49.5	172.5	-72.7	-173.7	172.7	0	0	110.7	E59 E60 F65 T66 L67	E59-E63 WeakPolarHBondContact O-CG 3.42Å; E59-E63 PolarHBondContact O-N 2.98Å; E60-E63 PolarHBondContact O-N 2.78Å; E63-F65 PolarHBondContact O-N 2.87Å; E63-T66 WeakPolarHBondContact O-CB 3.33Å; E63-T66 PolarHBondContact O-N 2.76Å; E63-L67 PolarHBondContact O-N 3.42Å
64	A	96.1	Very high	95.2	Very high	20 Å²	20	80.1 Å²	80.1	17%	0.165	43%	0.43	C	S	.	.	H	α-helix	trans	-59.8	-45	176.2	0	0	0	0	0	112	E60 T66 L67 F68 L90	E60-A64 WeakPolarHBondContact O-CB 3.36Å; E60-A64 PolarHBondContact O-N 2.61Å; A64-T66 PolarHBondContact O-N 3.3Å; A64-L67 WeakPolarHBondContact O-CB 3.36Å; A64-L67 PolarHBondContact O-N 3.33Å; A64-F68 WeakPolarHBondContact O-CD2 3.39Å; A64-L90 HydrophobicContact CB-CD2 3.51Å; A64-L90 HydrophobicContact CB-CG 4.45Å
65	F	97.3	Very high	95.1	Very high	0 Å²	0	82.5 Å²	82.5	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-57.3	-38.3	177	-172	-84.7	0	0	0	111.9	F61 K62 E63 L67 F68 M76 I78 V86 F118 F121	F61-F65 VanDerWaalsContact O-CB 3.23Å; F61-F65 WeakPolarHBondContact O-CB 3.35Å; F61-F65 PolarHBondContact O-N 3.16Å; K62-F65 PolarHBondContact O-N 3.29Å; E63-F65 PolarHBondContact O-N 2.87Å; F65-L67 VanDerWaalsContact C-N 3.26Å; F65-L67 PolarHBondContact O-N 2.79Å; F65-F68 PolarHBondContact O-N 2.7Å; F65-F68 VanDerWaalsContact O-N 3.11Å; F65-M76 HydrophobicContact CD1-CG 4.06Å; F65-M76 HydrophobicContact CE1-CG 4.22Å; F65-M76 WeakPolarHBondContact CE1-O 3.44Å; F65-I78 HydrophobicContact CD1-CG2 4.37Å; F65-I78 HydrophobicContact CD2-CD1 4.2Å; F65-I78 HydrophobicContact CE1-CG2 3.92Å; F65-I78 HydrophobicContact CE2-CD1 3.48Å; F65-I78 VanDerWaalsContact CE2-CD1 3.48Å; F65-I78 HydrophobicContact CE2-CG1 3.77Å; F65-I78 HydrophobicContact CE2-CG2 4.18Å; F65-I78 HydrophobicContact CZ-CB 4.21Å; F65-I78 HydrophobicContact CZ-CD1 3.93Å; F65-I78 HydrophobicContact CZ-CG1 3.65Å; F65-I78 HydrophobicContact CZ-CG2 3.83Å; F65-V86 HydrophobicContact CD2-CG1 4.12Å; F65-F118 HydrophobicContact CB-CD2 3.85Å; F65-F118 HydrophobicContact CB-CE2 4.3Å; F65-F118 HydrophobicContact CD1-CB 4.26Å; F65-F118 HydrophobicContact CD1-CD2 4.33Å; F65-F118 AromaticContact CD2-CD2 3.97Å; F65-F118 HydrophobicContact CD2-CD2 3.97Å; F65-F118 HydrophobicContact CE1-CB 4.25Å; F65-F118 AromaticContact CG-CD2 3.81Å; F65-F118 HydrophobicContact CG-CD2 3.81Å; F65-F118 HydrophobicContact CZ-CB 4.48Å; F65-F121 HydrophobicContact CD2-CB 4.34Å; F65-F121 AromaticContact CD2-CD1 3.76Å; F65-F121 HydrophobicContact CD2-CD1 3.76Å; F65-F121 HydrophobicContact CD2-CE1 4.17Å; F65-F121 AromaticContact CD2-CG 3.97Å; F65-F121 HydrophobicContact CD2-CG 3.97Å; F65-F121 HydrophobicContact CE2-CB 3.71Å; F65-F121 AromaticContact CE2-CD1 3.97Å; F65-F121 HydrophobicContact CE2-CD1 3.97Å; F65-F121 HydrophobicContact CE2-CD2 4.16Å; F65-F121 AromaticContact CE2-CG 3.68Å; F65-F121 HydrophobicContact CE2-CG 3.68Å
66	T	95.6	Very high	95	Very high	65 Å²	65	80.5 Å²	80.5	40%	0.399	42%	0.419	S	S	.	.	H	α-helix	trans	-65.8	-27.5	178.9	-55.9	0	0	0	0	112.5	K62 E63 A64 F68 D69	K62-T66 PolarHBondContact O-N 3.49Å; K62-T66 PolarHBondContact O-OG1 3Å; E63-T66 WeakPolarHBondContact O-CB 3.33Å; E63-T66 PolarHBondContact O-N 2.76Å; A64-T66 PolarHBondContact O-N 3.3Å; T66-F68 PolarHBondContact O-N 3.18Å; T66-D69 WeakPolarHBondContact O-CB 3.34Å; T66-D69 PolarHBondContact O-N 3.43Å
67	L	95.9	Very high	95	Very high	149 Å²	149	77.8 Å²	77.8	78%	0.78	40%	0.402	S	S	*	.	H	α-helix	trans	-66.6	-21.1	174.8	-60	176.9	0	0	0	113.2	E63 A64 F65	E63-L67 PolarHBondContact O-N 3.42Å; A64-L67 WeakPolarHBondContact O-CB 3.36Å; A64-L67 PolarHBondContact O-N 3.33Å; F65-L67 VanDerWaalsContact C-N 3.26Å; F65-L67 PolarHBondContact O-N 2.79Å
68	F	96.3	Very high	95	Very high	51 Å²	51	74.1 Å²	74.1	22%	0.224	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-5.7	178.9	-71.5	-100.2	0	0	0	113.2	A64 F65 T66 R70 I78 Q82 D85 V86 A89	A64-F68 WeakPolarHBondContact O-CD2 3.39Å; F65-F68 PolarHBondContact O-N 2.7Å; F65-F68 VanDerWaalsContact O-N 3.11Å; T66-F68 PolarHBondContact O-N 3.18Å; F68-R70 PolarHBondContact O-N 3.03Å; F68-I78 HydrophobicContact CB-CG2 3.85Å; F68-Q82 PolarHBondContact O-NE2 3.44Å; F68-D85 HydrophobicContact CE1-CB 3.93Å; F68-V86 HydrophobicContact CB-CG2 3.69Å; F68-V86 HydrophobicContact CD1-CG2 3.77Å; F68-V86 HydrophobicContact CD2-CG2 3.76Å; F68-V86 HydrophobicContact CE1-CG2 4.31Å; F68-V86 HydrophobicContact CE2-CG2 4.29Å; F68-V86 HydrophobicContact CG-CG2 3.47Å; F68-V86 VanDerWaalsContact CG-CG2 3.47Å; F68-A89 HydrophobicContact CE2-CB 3.77Å; F68-A89 HydrophobicContact CZ-CB 3.67Å
69	D	95.7	Very high	95	Very high	27 Å²	27	73.4 Å²	73.4	14%	0.144	38%	0.382	C	S	.	.			trans	-66.8	115.8	176	-172.9	-8.8	0	0	0	110.2	T66 T71 G74 E75 M76 K77	T66-D69 WeakPolarHBondContact O-CB 3.34Å; T66-D69 PolarHBondContact O-N 3.43Å; D69-T71 WeakPolarHBondContact OD1-CA 3.33Å; D69-T71 WeakPolarHBondContact OD1-CB 3.32Å; D69-T71 VanDerWaalsContact OD1-CG2 3.28Å; D69-T71 WeakPolarHBondContact OD1-CG2 3.35Å; D69-T71 PolarHBondContact OD1-N 2.74Å; D69-T71 PolarHBondContact OD1-OG1 3.34Å; D69-T71 PolarHBondContact OD2-OG1 3.03Å; D69-G74 VanDerWaalsContact OD2-CA 3.25Å; D69-G74 WeakPolarHBondContact OD2-CA 3.29Å; D69-E75 PolarHBondContact OD2-N 3.04Å; D69-E75 VanDerWaalsContact OD2-N 3.13Å; D69-M76 VanDerWaalsContact OD2-CA 3.27Å; D69-M76 WeakPolarHBondContact OD2-CA 3.42Å; D69-M76 PolarHBondContact OD2-N 2.93Å; D69-K77 PolarHBondContact OD2-N 3.33Å
70	R	93.9	Very high	95	Very high	201 Å²	201	70.9 Å²	70.9	76%	0.758	37%	0.369	S	S	*	.			trans	-107.6	9.2	176.9	-63.5	-178	-176.2	172.8	4.4	112.4	F68	F68-R70 PolarHBondContact O-N 3.03Å
71	T	92.9	Very high	95	Very high	28 Å²	28	67.6 Å²	67.6	17%	0.172	36%	0.362	C	S	.	.	S	Bend	trans	-68.9	144.5	176.4	66.4	0	0	0	0	110.1	D69 T73 G74 E75 K77	D69-T71 WeakPolarHBondContact OD1-CA 3.33Å; D69-T71 WeakPolarHBondContact OD1-CB 3.32Å; D69-T71 VanDerWaalsContact OD1-CG2 3.28Å; D69-T71 WeakPolarHBondContact OD1-CG2 3.35Å; D69-T71 PolarHBondContact OD1-N 2.74Å; D69-T71 PolarHBondContact OD1-OG1 3.34Å; D69-T71 PolarHBondContact OD2-OG1 3.03Å; T71-T73 PolarHBondContact O-N 3.14Å; T71-T73 VanDerWaalsContact O-N 3.08Å; T71-G74 PolarHBondContact O-N 3.39Å; T71-G74 PolarHBondContact OG1-N 3.28Å; T71-E75 HydrophobicContact CG2-CB 4.39Å; T71-E75 PolarHBondContact OG1-N 3.41Å; T71-K77 HydrophobicContact CG2-CB 4.27Å
72	P	88.9	Confident	95	Very high	137 Å²	137	67 Å²	67	89%	0.89	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.3	-175.2	-24.7	34.4	0	0	0	114.7
73	T	90.6	Very high	95	Very high	111 Å²	111	64 Å²	64	68%	0.681	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.1	4.9	-172.5	50.2	0	0	0	0	113.8	T71 E75	T71-T73 PolarHBondContact O-N 3.14Å; T71-T73 VanDerWaalsContact O-N 3.08Å; T73-E75 WeakPolarHBondContact OG1-CG 3.27Å
74	G	89.3	Confident	95	Very high	52 Å²	52	57.6 Å²	57.6	54%	0.536	32%	0.318	S	S	.	.			trans	65.1	53	-178.8	0	0	0	0	0	112.4	D69 T71 M76	D69-G74 VanDerWaalsContact OD2-CA 3.25Å; D69-G74 WeakPolarHBondContact OD2-CA 3.29Å; T71-G74 PolarHBondContact O-N 3.39Å; T71-G74 PolarHBondContact OG1-N 3.28Å; G74-M76 PolarHBondContact O-N 3.42Å; G74-M76 VanDerWaalsContact O-N 3.16Å
75	E	93.3	Very high	95.1	Very high	105 Å²	105	60.4 Å²	60.4	49%	0.491	33%	0.33	S	S	.	.			trans	-71.8	2.4	-179	-59.8	-169.7	177.5	0	0	114.2	D69 T71 T73 K77	D69-E75 PolarHBondContact OD2-N 3.04Å; D69-E75 VanDerWaalsContact OD2-N 3.13Å; T71-E75 HydrophobicContact CG2-CB 4.39Å; T71-E75 PolarHBondContact OG1-N 3.41Å; T73-E75 WeakPolarHBondContact OG1-CG 3.27Å; E75-K77 HydrophobicContact CB-CD 4.21Å; E75-K77 HydrophobicContact CB-CG 4.35Å; E75-K77 IonicContact OE2-NZ 2.86Å; E75-K77 PolarHBondContact OE2-NZ 3.4Å
76	M	94.9	Very high	95.1	Very high	62 Å²	62	60.4 Å²	60.4	31%	0.305	33%	0.33	S	S	.	.	S	Bend	trans	56.7	52.7	-172.5	-166	174.2	-77.5	0	0	110.9	K62 F65 D69 G74 F118	K62-M76 HydrophobicContact CD-CE 4.39Å; K62-M76 HydrophobicContact CD-SD 4.34Å; K62-M76 VanDerWaalsContact CE-SD 3.51Å; K62-M76 HydrophobicContact CG-CE 3.97Å; K62-M76 HydrophobicContact CG-SD 3.95Å; F65-M76 HydrophobicContact CD1-CG 4.06Å; F65-M76 HydrophobicContact CE1-CG 4.22Å; F65-M76 WeakPolarHBondContact CE1-O 3.44Å; D69-M76 VanDerWaalsContact OD2-CA 3.27Å; D69-M76 WeakPolarHBondContact OD2-CA 3.42Å; D69-M76 PolarHBondContact OD2-N 2.93Å; G74-M76 PolarHBondContact O-N 3.42Å; G74-M76 VanDerWaalsContact O-N 3.16Å; M76-F118 HydrophobicContact CG-CB 4.3Å; M76-F118 HydrophobicContact SD-CB 4.27Å
77	K	96.7	Very high	95.2	Very high	66 Å²	66	57.3 Å²	57.3	29%	0.287	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	146.8	178.2	-68	175.8	-167.8	156.8	0	111.5	D69 T71 E75 M115 L116 D117	D69-K77 PolarHBondContact OD2-N 3.33Å; T71-K77 HydrophobicContact CG2-CB 4.27Å; E75-K77 HydrophobicContact CB-CD 4.21Å; E75-K77 HydrophobicContact CB-CG 4.35Å; E75-K77 IonicContact OE2-NZ 2.86Å; E75-K77 PolarHBondContact OE2-NZ 3.4Å; K77-M115 HydrophobicContact CB-CB 4.34Å; K77-M115 HydrophobicContact CD-CB 4.1Å; K77-L116 VanDerWaalsContact CA-O 3.28Å; K77-L116 WeakPolarHBondContact CA-O 3.46Å; K77-D117 HydrophobicContact CG-CB 4.3Å
78	I	97.3	Very high	95.2	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	158.4	172	67	177.5	0	0	0	109.7	F65 F68 Q82 V86 M115 L116	F65-I78 HydrophobicContact CD1-CG2 4.37Å; F65-I78 HydrophobicContact CD2-CD1 4.2Å; F65-I78 HydrophobicContact CE1-CG2 3.92Å; F65-I78 HydrophobicContact CE2-CD1 3.48Å; F65-I78 VanDerWaalsContact CE2-CD1 3.48Å; F65-I78 HydrophobicContact CE2-CG1 3.77Å; F65-I78 HydrophobicContact CE2-CG2 4.18Å; F65-I78 HydrophobicContact CZ-CB 4.21Å; F65-I78 HydrophobicContact CZ-CD1 3.93Å; F65-I78 HydrophobicContact CZ-CG1 3.65Å; F65-I78 HydrophobicContact CZ-CG2 3.83Å; F68-I78 HydrophobicContact CB-CG2 3.85Å; I78-Q82 HydrophobicContact CB-CB 4.11Å; I78-Q82 HydrophobicContact CD1-CB 4.37Å; I78-V86 HydrophobicContact CD1-CB 4.3Å; I78-V86 HydrophobicContact CD1-CG2 3.66Å; I78-M115 CarbonylContact O-C 3.53Å; I78-M115 WeakPolarHBondContact O-CA 3.33Å; I78-L116 HydrophobicContact CD1-CD2 4.48Å; I78-L116 HydrophobicContact CG1-CB 4.15Å; I78-L116 PolarHBondContact N-O 2.85Å; I78-L116 PolarHBondContact O-N 3.03Å
79	T	97.3	Very high	95.2	Very high	25 Å²	25	55.1 Å²	55.1	15%	0.153	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	156.7	168.4	62.5	0	0	0	0	111	A81 Q82 K114 M115	T79-A81 PolarHBondContact O-N 3.35Å; T79-Q82 WeakPolarHBondContact O-CB 3.42Å; T79-Q82 PolarHBondContact O-N 2.96Å; T79-Q82 WeakPolarHBondContact OG1-CG 3.28Å; T79-Q82 PolarHBondContact OG1-OE1 3.47Å; T79-K114 WeakPolarHBondContact CA-O 3.02Å; T79-M115 HydrophobicContact CG2-CE 3.59Å; T79-M115 HydrophobicContact CG2-SD 3.99Å
80	Y	97.1	Very high	95.2	Very high	41 Å²	41	55.2 Å²	55.2	16%	0.161	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-56.2	-35.8	174.1	-84.1	27.8	0	0	0	112.1	Q82 C83 L103 P106 M111 K114 L116	Y80-Q82 PolarHBondContact O-N 3.14Å; Y80-C83 WeakPolarHBondContact O-CB 3.47Å; Y80-C83 PolarHBondContact O-N 3.1Å; Y80-C83 VanDerWaalsContact O-N 3.11Å; Y80-L103 HydrophobicContact CD1-CD2 4.28Å; Y80-L103 HydrophobicContact CD2-CB 4.37Å; Y80-L103 HydrophobicContact CD2-CD1 4.3Å; Y80-L103 HydrophobicContact CD2-CD2 3.99Å; Y80-L103 HydrophobicContact CD2-CG 4.47Å; Y80-L103 HydrophobicContact CE2-CD2 4.23Å; Y80-L103 HydrophobicContact CG-CD1 4.41Å; Y80-L103 HydrophobicContact CG-CD2 4.01Å; Y80-P106 HydrophobicContact CD2-CB 4.02Å; Y80-P106 HydrophobicContact CD2-CG 4.12Å; Y80-P106 HydrophobicContact CE2-CB 4.33Å; Y80-M111 PolarHBondContact N-O 3.06Å; Y80-K114 HydrophobicContact CD1-CB 3.73Å; Y80-K114 WeakPolarHBondContact CD1-O 3.45Å; Y80-K114 HydrophobicContact CD2-CB 4.01Å; Y80-K114 HydrophobicContact CD2-CD 4.33Å; Y80-K114 HydrophobicContact CE1-CB 3.71Å; Y80-K114 HydrophobicContact CE2-CB 4Å; Y80-K114 HydrophobicContact CE2-CD 3.78Å; Y80-K114 HydrophobicContact CG-CB 3.89Å; Y80-K114 PolarHBondContact N-O 3.11Å; Y80-L116 HydrophobicContact CD1-CB 3.99Å; Y80-L116 HydrophobicContact CE1-CB 3.96Å; Y80-L116 HydrophobicContact CE1-CD1 4.25Å
81	A	96.3	Very high	95.1	Very high	52 Å²	52	48.3 Å²	48.3	43%	0.43	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-59.4	-32	176	0	0	0	0	0	113.2	T79 C83 M111	T79-A81 PolarHBondContact O-N 3.35Å; A81-C83 VanDerWaalsContact C-N 3.32Å; A81-M111 HydrophobicContact CB-CB 4.26Å; A81-M111 WeakPolarHBondContact CB-O 3.49Å; A81-M111 PolarHBondContact N-O 2.85Å
82	Q	96.9	Very high	95.2	Very high	12 Å²	12	49 Å²	49	6%	0.056	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-81.3	-11.3	179.8	-67.6	170.1	-82.1	0	0	113	F68 I78 T79 Y80 G84 D85 V86	F68-Q82 PolarHBondContact O-NE2 3.44Å; I78-Q82 HydrophobicContact CB-CB 4.11Å; I78-Q82 HydrophobicContact CD1-CB 4.37Å; T79-Q82 WeakPolarHBondContact O-CB 3.42Å; T79-Q82 PolarHBondContact O-N 2.96Å; T79-Q82 WeakPolarHBondContact OG1-CG 3.28Å; T79-Q82 PolarHBondContact OG1-OE1 3.47Å; Y80-Q82 PolarHBondContact O-N 3.14Å; Q82-G84 VanDerWaalsContact C-N 3.32Å; Q82-G84 PolarHBondContact O-N 2.94Å; Q82-D85 PolarHBondContact O-N 2.91Å; Q82-D85 VanDerWaalsContact O-N 3.1Å; Q82-V86 WeakPolarHBondContact O-CG2 3.29Å; Q82-V86 PolarHBondContact O-N 3.3Å
83	C	97.2	Very high	95.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-56.6	-44.9	-173.5	-174.7	0	0	0	0	112.4	Y80 A81 V86 M87 V99 L103 L116	Y80-C83 WeakPolarHBondContact O-CB 3.47Å; Y80-C83 PolarHBondContact O-N 3.1Å; Y80-C83 VanDerWaalsContact O-N 3.11Å; A81-C83 VanDerWaalsContact C-N 3.32Å; C83-V86 PolarHBondContact O-N 3.1Å; C83-M87 WeakPolarHBondContact O-CG 3.24Å; C83-M87 PolarHBondContact O-N 3Å; C83-M87 VanDerWaalsContact O-N 3.09Å; C83-M87 WeakPolarHBondContact SG-CE 3.42Å; C83-V99 HydrophobicContact CB-CG1 4.27Å; C83-L103 HydrophobicContact CB-CD1 4.18Å; C83-L103 HydrophobicContact CB-CD2 4.23Å; C83-L116 HydrophobicContact CB-CD2 4.39Å
84	G	96.8	Very high	95.7	Very high	4 Å²	4	43 Å²	43	4%	0.041	25%	0.254	C	S	.	.	H	α-helix	trans	-64.7	-38.9	177.2	0	0	0	0	0	113.2	Q82 M87 R88	Q82-G84 VanDerWaalsContact C-N 3.32Å; Q82-G84 PolarHBondContact O-N 2.94Å; G84-M87 PolarHBondContact O-N 2.95Å; G84-R88 WeakPolarHBondContact O-CG 3.27Å; G84-R88 PolarHBondContact O-N 3.45Å
85	D	96.6	Very high	96	Very high	79 Å²	79	43.3 Å²	43.3	42%	0.422	25%	0.246	S	C	.	.	H	α-helix	trans	-65.2	-40.6	178.8	-62.3	-21.7	0	0	0	111.5	F68 Q82 R88 A89	F68-D85 HydrophobicContact CE1-CB 3.93Å; Q82-D85 PolarHBondContact O-N 2.91Å; Q82-D85 VanDerWaalsContact O-N 3.1Å; D85-R88 PolarHBondContact O-N 2.83Å; D85-R88 IonicContact OD1-NH1 2.79Å; D85-A89 WeakPolarHBondContact O-CB 3.42Å; D85-A89 PolarHBondContact O-N 3.28Å
86	V	97.6	Very high	96	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-42.2	176.4	-177.3	0	0	0	0	111	F65 F68 I78 Q82 C83 R88 A89 L90 F121	F65-V86 HydrophobicContact CD2-CG1 4.12Å; F68-V86 HydrophobicContact CB-CG2 3.69Å; F68-V86 HydrophobicContact CD1-CG2 3.77Å; F68-V86 HydrophobicContact CD2-CG2 3.76Å; F68-V86 HydrophobicContact CE1-CG2 4.31Å; F68-V86 HydrophobicContact CE2-CG2 4.29Å; F68-V86 HydrophobicContact CG-CG2 3.47Å; F68-V86 VanDerWaalsContact CG-CG2 3.47Å; I78-V86 HydrophobicContact CD1-CB 4.3Å; I78-V86 HydrophobicContact CD1-CG2 3.66Å; Q82-V86 WeakPolarHBondContact O-CG2 3.29Å; Q82-V86 PolarHBondContact O-N 3.3Å; C83-V86 PolarHBondContact O-N 3.1Å; V86-R88 VanDerWaalsContact C-N 3.29Å; V86-R88 PolarHBondContact O-N 3.24Å; V86-A89 PolarHBondContact O-N 3.36Å; V86-L90 HydrophobicContact CG1-CD1 4.18Å; V86-L90 WeakPolarHBondContact O-CG 3.42Å; V86-L90 PolarHBondContact O-N 3.01Å; V86-F121 HydrophobicContact CB-CE2 4.17Å; V86-F121 HydrophobicContact CB-CZ 4.01Å; V86-F121 HydrophobicContact CG1-CE1 3.96Å; V86-F121 HydrophobicContact CG1-CE2 4.11Å; V86-F121 HydrophobicContact CG1-CZ 3.52Å
87	M	97.1	Very high	96	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.6	-41.5	175.2	-70	172.2	-179.9	0	0	111.8	C83 G84 L90 G91 Q92 P94 V99 V102 F121 M124 L125 I128	C83-M87 WeakPolarHBondContact O-CG 3.24Å; C83-M87 PolarHBondContact O-N 3Å; C83-M87 VanDerWaalsContact O-N 3.09Å; C83-M87 WeakPolarHBondContact SG-CE 3.42Å; G84-M87 PolarHBondContact O-N 2.95Å; M87-L90 CarbonylContact O-C 3.54Å; M87-L90 PolarHBondContact O-N 2.97Å; M87-G91 PolarHBondContact O-N 2.74Å; M87-Q92 HydrophobicContact CB-CB 4.43Å; M87-Q92 WeakPolarHBondContact O-CB 3.14Å; M87-Q92 PolarHBondContact O-N 2.89Å; M87-P94 HydrophobicContact CB-CG 3.96Å; M87-P94 HydrophobicContact SD-CG 4.13Å; M87-V99 HydrophobicContact SD-CG2 4.26Å; M87-V102 HydrophobicContact CE-CG2 3.94Å; M87-F121 HydrophobicContact CE-CD2 4.4Å; M87-F121 HydrophobicContact CE-CE2 3.91Å; M87-F121 HydrophobicContact CG-CE2 3.79Å; M87-F121 HydrophobicContact CG-CZ 3.91Å; M87-M124 HydrophobicContact CE-CB 3.77Å; M87-L125 HydrophobicContact CG-CD1 4.23Å; M87-I128 HydrophobicContact CE-CG1 4.2Å; M87-I128 HydrophobicContact SD-CG1 3.91Å
88	R	96	Very high	95.9	Very high	93 Å²	93	41.3 Å²	41.3	35%	0.351	25%	0.25	S	S	.	.	H	α-helix	trans	-66.2	-41.5	175.9	-69	172.5	-168.1	120.3	0.6	112.8	G84 D85 V86 L90 G91 Q92 P94 N96	G84-R88 WeakPolarHBondContact O-CG 3.27Å; G84-R88 PolarHBondContact O-N 3.45Å; D85-R88 PolarHBondContact O-N 2.83Å; D85-R88 IonicContact OD1-NH1 2.79Å; V86-R88 VanDerWaalsContact C-N 3.29Å; V86-R88 PolarHBondContact O-N 3.24Å; R88-L90 PolarHBondContact O-N 3.49Å; R88-G91 PolarHBondContact O-N 3.16Å; R88-Q92 VanDerWaalsContact CA-O 3.22Å; R88-Q92 WeakPolarHBondContact CA-O 3.42Å; R88-P94 PolarHBondContact NH2-O 3.13Å; R88-N96 PolarHBondContact NH2-OD1 3.29Å
89	A	96.1	Very high	95.9	Very high	61 Å²	61	41.6 Å²	41.6	50%	0.504	25%	0.252	S	S	.	.	H	α-helix	trans	-63.1	-25	173.9	0	0	0	0	0	113.1	F68 D85 V86 G91	F68-A89 HydrophobicContact CE2-CB 3.77Å; F68-A89 HydrophobicContact CZ-CB 3.67Å; D85-A89 WeakPolarHBondContact O-CB 3.42Å; D85-A89 PolarHBondContact O-N 3.28Å; V86-A89 PolarHBondContact O-N 3.36Å; A89-G91 VanDerWaalsContact C-N 3.29Å
90	L	95.6	Very high	95.8	Very high	29 Å²	29	43.5 Å²	43.5	15%	0.152	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	16.1	174.4	-65.4	179.8	0	0	0	113.6	F61 A64 V86 M87 R88 Q92 F121 L125	F61-L90 HydrophobicContact CB-CD1 4.11Å; F61-L90 HydrophobicContact CD1-CD1 3.98Å; F61-L90 HydrophobicContact CD1-CD2 3.58Å; F61-L90 HydrophobicContact CD1-CG 4.27Å; F61-L90 HydrophobicContact CE1-CD2 4.25Å; F61-L90 HydrophobicContact CG-CD1 4.12Å; F61-L90 HydrophobicContact CG-CD2 4.4Å; A64-L90 HydrophobicContact CB-CD2 3.51Å; A64-L90 HydrophobicContact CB-CG 4.45Å; V86-L90 HydrophobicContact CG1-CD1 4.18Å; V86-L90 WeakPolarHBondContact O-CG 3.42Å; V86-L90 PolarHBondContact O-N 3.01Å; M87-L90 CarbonylContact O-C 3.54Å; M87-L90 PolarHBondContact O-N 2.97Å; R88-L90 PolarHBondContact O-N 3.49Å; L90-Q92 PolarHBondContact O-N 2.9Å; L90-F121 HydrophobicContact CD1-CE1 3.86Å; L90-F121 HydrophobicContact CD1-CZ 4.14Å; L90-L125 HydrophobicContact CB-CD1 4.3Å; L90-L125 HydrophobicContact CD1-CD1 4.16Å; L90-L125 HydrophobicContact CD1-CD2 3.58Å
91	G	92.9	Very high	95.6	Very high	57 Å²	57	44.6 Å²	44.6	59%	0.588	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	16.8	173.4	0	0	0	0	0	114.8	M87 R88 A89	M87-G91 PolarHBondContact O-N 2.74Å; R88-G91 PolarHBondContact O-N 3.16Å; A89-G91 VanDerWaalsContact C-N 3.29Å
92	Q	95.1	Very high	95.5	Very high	43 Å²	43	42.2 Å²	42.2	20%	0.201	25%	0.247	C	C	.	.			trans	-98.3	147.5	172.9	-54.6	-54.4	-52.6	0	0	111	M87 R88 L90 P94 L125 I128	M87-Q92 HydrophobicContact CB-CB 4.43Å; M87-Q92 WeakPolarHBondContact O-CB 3.14Å; M87-Q92 PolarHBondContact O-N 2.89Å; R88-Q92 VanDerWaalsContact CA-O 3.22Å; R88-Q92 WeakPolarHBondContact CA-O 3.42Å; L90-Q92 PolarHBondContact O-N 2.9Å; Q92-P94 WeakPolarHBondContact O-CD 3.42Å; Q92-L125 HydrophobicContact CG-CD1 3.78Å; Q92-I128 HydrophobicContact CB-CG2 3.89Å; Q92-I128 HydrophobicContact CG-CG2 4.25Å
93	N	94.1	Very high	95.5	Very high	112 Å²	112	42.3 Å²	42.3	60%	0.599	25%	0.248	S	C	*	.			trans	-116.3	61.5	177.6	-66.2	-50.9	0	0	0	112.2
94	P	95.5	Very high	95.3	Very high	8 Å²	8	44.6 Å²	44.6	5%	0.052	27%	0.271	C	S	.	.			trans	-70.8	146.8	178.2	31.5	-35.1	0	0	0	111.7	M87 R88 Q92 D98 V99 I128	M87-P94 HydrophobicContact CB-CG 3.96Å; M87-P94 HydrophobicContact SD-CG 4.13Å; R88-P94 PolarHBondContact NH2-O 3.13Å; Q92-P94 WeakPolarHBondContact O-CD 3.42Å; P94-D98 HydrophobicContact CB-CB 4.08Å; P94-V99 HydrophobicContact CB-CG2 3.97Å; P94-V99 HydrophobicContact CG-CG2 3.87Å; P94-I128 HydrophobicContact CB-CD1 4.2Å; P94-I128 HydrophobicContact CB-CG2 3.89Å; P94-I128 HydrophobicContact CG-CG2 4.28Å
95	T	95.3	Very high	95.2	Very high	60 Å²	60	51 Å²	51	37%	0.368	30%	0.298	S	S	.	.			trans	-70.7	160.5	165.9	68	0	0	0	0	110.3	A97 D98 V99	T95-A97 PolarHBondContact O-N 2.6Å; T95-D98 WeakPolarHBondContact CB-OD2 3.27Å; T95-D98 PolarHBondContact N-OD2 3.14Å; T95-D98 WeakPolarHBondContact O-CB 3.4Å; T95-D98 PolarHBondContact O-N 3.24Å; T95-D98 VanDerWaalsContact O-N 3.14Å; T95-D98 PolarHBondContact OG1-N 3.02Å; T95-D98 PolarHBondContact OG1-OD2 3.48Å; T95-V99 WeakPolarHBondContact O-CG2 3.36Å; T95-V99 PolarHBondContact O-N 2.64Å; T95-V99 VanDerWaalsContact O-N 3.1Å
96	N	94.8	Very high	95	Very high	75 Å²	75	48.2 Å²	48.2	40%	0.401	28%	0.284	S	S	.	.	H	α-helix	trans	-61.7	-34	174	-61	-44.6	0	0	0	111	R88 V99 L100 E169	R88-N96 PolarHBondContact NH2-OD1 3.29Å; N96-V99 PolarHBondContact O-N 3.27Å; N96-L100 WeakPolarHBondContact O-CB 3.49Å; N96-L100 VanDerWaalsContact O-CG 3.28Å; N96-L100 WeakPolarHBondContact O-CG 3.28Å; N96-L100 PolarHBondContact O-N 3.02Å; N96-E169 WeakPolarHBondContact CB-OE1 3.21Å; N96-E169 VanDerWaalsContact CB-OE2 3.31Å; N96-E169 WeakPolarHBondContact CB-OE2 3.35Å; N96-E169 VanDerWaalsContact N-CD 3.34Å; N96-E169 PolarHBondContact N-OE1 3.48Å; N96-E169 VanDerWaalsContact N-OE1 3.15Å; N96-E169 PolarHBondContact N-OE2 3.18Å; N96-E169 PolarHBondContact ND2-OE2 3.22Å; N96-E169 VanDerWaalsContact ND2-OE2 3.08Å
97	A	94.3	Very high	94.9	Very high	54 Å²	54	55.6 Å²	55.6	45%	0.446	31%	0.312	S	S	.	.	H	α-helix	trans	-61.5	-42	172.2	0	0	0	0	0	112.7	T95 L100 K101 E169	T95-A97 PolarHBondContact O-N 2.6Å; A97-L100 PolarHBondContact O-N 2.88Å; A97-K101 WeakPolarHBondContact O-CB 3.46Å; A97-K101 PolarHBondContact O-N 2.97Å; A97-E169 PolarHBondContact N-OE1 3.08Å
98	D	94.6	Very high	94.7	Very high	61 Å²	61	60.5 Å²	60.5	33%	0.326	34%	0.344	S	S	.	.	H	α-helix	trans	-63.3	-45.7	176.7	-63.6	-46.1	0	0	0	111.4	P94 T95 L100 K101 V102 I128	P94-D98 HydrophobicContact CB-CB 4.08Å; T95-D98 WeakPolarHBondContact CB-OD2 3.27Å; T95-D98 PolarHBondContact N-OD2 3.14Å; T95-D98 WeakPolarHBondContact O-CB 3.4Å; T95-D98 PolarHBondContact O-N 3.24Å; T95-D98 VanDerWaalsContact O-N 3.14Å; T95-D98 PolarHBondContact OG1-N 3.02Å; T95-D98 PolarHBondContact OG1-OD2 3.48Å; D98-L100 PolarHBondContact O-N 3.46Å; D98-K101 WeakPolarHBondContact O-CB 3.24Å; D98-K101 PolarHBondContact O-N 3.49Å; D98-K101 VanDerWaalsContact O-N 3.15Å; D98-V102 PolarHBondContact O-N 3.33Å; D98-I128 HydrophobicContact CB-CD1 3.85Å
99	V	95.9	Very high	94.6	Very high	8 Å²	8	61.5 Å²	61.5	5%	0.048	35%	0.353	C	S	.	.	H	α-helix	trans	-59.8	-47	176.9	178	0	0	0	0	110.3	C83 M87 P94 T95 N96 K101 V102 L103	C83-V99 HydrophobicContact CB-CG1 4.27Å; M87-V99 HydrophobicContact SD-CG2 4.26Å; P94-V99 HydrophobicContact CB-CG2 3.97Å; P94-V99 HydrophobicContact CG-CG2 3.87Å; T95-V99 WeakPolarHBondContact O-CG2 3.36Å; T95-V99 PolarHBondContact O-N 2.64Å; T95-V99 VanDerWaalsContact O-N 3.1Å; N96-V99 PolarHBondContact O-N 3.27Å; V99-K101 VanDerWaalsContact C-N 3.28Å; V99-K101 PolarHBondContact O-N 3.02Å; V99-V102 VanDerWaalsContact O-CG2 3.29Å; V99-V102 WeakPolarHBondContact O-CG2 3.31Å; V99-V102 PolarHBondContact O-N 3.08Å; V99-L103 HydrophobicContact CG1-CD1 3.85Å; V99-L103 HydrophobicContact CG1-CG 4.48Å; V99-L103 WeakPolarHBondContact O-CB 3.28Å; V99-L103 VanDerWaalsContact O-CG 3.24Å; V99-L103 WeakPolarHBondContact O-CG 3.4Å; V99-L103 PolarHBondContact O-N 2.76Å
100	L	95.2	Very high	94.5	Very high	65 Å²	65	59.3 Å²	59.3	34%	0.34	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-37.2	176.5	-72.6	174.2	0	0	0	112.1	N96 A97 D98 L103 G104 K105 P106 M111	N96-L100 WeakPolarHBondContact O-CB 3.49Å; N96-L100 VanDerWaalsContact O-CG 3.28Å; N96-L100 WeakPolarHBondContact O-CG 3.28Å; N96-L100 PolarHBondContact O-N 3.02Å; A97-L100 PolarHBondContact O-N 2.88Å; D98-L100 PolarHBondContact O-N 3.46Å; L100-L103 PolarHBondContact O-N 3.15Å; L100-G104 PolarHBondContact O-N 2.97Å; L100-K105 WeakPolarHBondContact O-CA 3.2Å; L100-K105 PolarHBondContact O-N 3.23Å; L100-P106 HydrophobicContact CD2-CG 4.13Å; L100-M111 HydrophobicContact CD2-CE 3.61Å; L100-M111 HydrophobicContact CD2-SD 4.18Å
101	K	93.9	Very high	94.5	Very high	63 Å²	63	60.1 Å²	60.1	27%	0.274	34%	0.336	S	S	.	.	H	α-helix	trans	-64.9	-48.7	178.5	179.9	175.8	173.5	175.6	0	111.6	E41 A97 D98 V99 L103 G104	E41-K101 WeakPolarHBondContact OE2-CE 3.41Å; E41-K101 IonicContact OE2-NZ 3.69Å; E41-K101 PolarHBondContact OE2-NZ 3.2Å; A97-K101 WeakPolarHBondContact O-CB 3.46Å; A97-K101 PolarHBondContact O-N 2.97Å; D98-K101 WeakPolarHBondContact O-CB 3.24Å; D98-K101 PolarHBondContact O-N 3.49Å; D98-K101 VanDerWaalsContact O-N 3.15Å; V99-K101 VanDerWaalsContact C-N 3.28Å; V99-K101 PolarHBondContact O-N 3.02Å; K101-L103 VanDerWaalsContact C-N 3.25Å; K101-L103 PolarHBondContact O-N 3.29Å; K101-G104 PolarHBondContact O-N 3.41Å
102	V	95	Very high	94.5	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.018	34%	0.336	C	S	.	.	H	α-helix	trans	-69.6	-24.1	179.7	-60.3	0	0	0	0	112.9	F44 M87 D98 V99 G104 M124 I128	F44-V102 HydrophobicContact CD1-CB 4Å; F44-V102 HydrophobicContact CD1-CG1 4.36Å; F44-V102 VanDerWaalsContact CD1-O 3.22Å; F44-V102 WeakPolarHBondContact CD1-O 3.47Å; F44-V102 HydrophobicContact CD2-CG1 4.35Å; F44-V102 HydrophobicContact CE1-CB 4.01Å; F44-V102 HydrophobicContact CE1-CG1 4.35Å; F44-V102 HydrophobicContact CE2-CG1 4.39Å; F44-V102 HydrophobicContact CG-CB 4.41Å; F44-V102 HydrophobicContact CG-CG1 4.34Å; F44-V102 HydrophobicContact CZ-CB 4.47Å; F44-V102 HydrophobicContact CZ-CG1 4.36Å; M87-V102 HydrophobicContact CE-CG2 3.94Å; D98-V102 PolarHBondContact O-N 3.33Å; V99-V102 VanDerWaalsContact O-CG2 3.29Å; V99-V102 WeakPolarHBondContact O-CG2 3.31Å; V99-V102 PolarHBondContact O-N 3.08Å; V102-G104 VanDerWaalsContact C-N 3.26Å; V102-G104 PolarHBondContact O-N 3.12Å; V102-M124 HydrophobicContact CB-CB 4.08Å; V102-M124 HydrophobicContact CB-CG 4.1Å; V102-M124 HydrophobicContact CG2-CB 4.07Å; V102-M124 HydrophobicContact CG2-CG 4.34Å; V102-M124 HydrophobicContact CG2-SD 4.46Å; V102-M124 WeakPolarHBondContact O-CE 3.48Å; V102-I128 HydrophobicContact CG1-CD1 3.88Å; V102-I128 HydrophobicContact CG1-CG1 4.28Å
103	L	95.3	Very high	94.4	Very high	14 Å²	14	64.9 Å²	64.9	7%	0.073	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-1.2	171	-68.4	173.8	0	0	0	114	Y80 C83 V99 L100 K101 P106 M111 L116 M124	Y80-L103 HydrophobicContact CD1-CD2 4.28Å; Y80-L103 HydrophobicContact CD2-CB 4.37Å; Y80-L103 HydrophobicContact CD2-CD1 4.3Å; Y80-L103 HydrophobicContact CD2-CD2 3.99Å; Y80-L103 HydrophobicContact CD2-CG 4.47Å; Y80-L103 HydrophobicContact CE2-CD2 4.23Å; Y80-L103 HydrophobicContact CG-CD1 4.41Å; Y80-L103 HydrophobicContact CG-CD2 4.01Å; C83-L103 HydrophobicContact CB-CD1 4.18Å; C83-L103 HydrophobicContact CB-CD2 4.23Å; V99-L103 HydrophobicContact CG1-CD1 3.85Å; V99-L103 HydrophobicContact CG1-CG 4.48Å; V99-L103 WeakPolarHBondContact O-CB 3.28Å; V99-L103 VanDerWaalsContact O-CG 3.24Å; V99-L103 WeakPolarHBondContact O-CG 3.4Å; V99-L103 PolarHBondContact O-N 2.76Å; L100-L103 PolarHBondContact O-N 3.15Å; K101-L103 VanDerWaalsContact C-N 3.25Å; K101-L103 PolarHBondContact O-N 3.29Å; L103-P106 HydrophobicContact CB-CG 4Å; L103-P106 HydrophobicContact CD1-CG 4.43Å; L103-M111 HydrophobicContact CD1-SD 4.15Å; L103-L116 HydrophobicContact CD2-CD2 4.34Å; L103-M124 HydrophobicContact CD2-CE 4.32Å; L103-M124 HydrophobicContact CD2-SD 4.01Å
104	G	93.9	Very high	94.5	Very high	48 Å²	48	63.4 Å²	63.4	50%	0.495	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	34	-179.6	0	0	0	0	0	114	L100 K101 V102	L100-G104 PolarHBondContact O-N 2.97Å; K101-G104 PolarHBondContact O-N 3.41Å; V102-G104 VanDerWaalsContact C-N 3.26Å; V102-G104 PolarHBondContact O-N 3.12Å
105	K	93.5	Very high	94.5	Very high	138 Å²	138	67.5 Å²	67.5	60%	0.6	36%	0.362	S	S	*	.	S	Bend	trans	51.2	60.6	178.6	-62	172.9	-177.1	161.5	0	112.3	L100	L100-K105 WeakPolarHBondContact O-CA 3.2Å; L100-K105 PolarHBondContact O-N 3.23Å
106	P	93.9	Very high	94.6	Very high	20 Å²	20	64.8 Å²	64.8	13%	0.13	35%	0.346	C	S	.	.			trans	-63.1	158.1	-179.6	29.9	-36.7	0	0	0	111.4	Y80 L100 L103 D110 M111	Y80-P106 HydrophobicContact CD2-CB 4.02Å; Y80-P106 HydrophobicContact CD2-CG 4.12Å; Y80-P106 HydrophobicContact CE2-CB 4.33Å; L100-P106 HydrophobicContact CD2-CG 4.13Å; L103-P106 HydrophobicContact CB-CG 4Å; L103-P106 HydrophobicContact CD1-CG 4.43Å; P106-D110 HydrophobicContact CB-CB 4.06Å; P106-M111 HydrophobicContact CG-SD 3.76Å
107	R	94.8	Very high	94.7	Very high	155 Å²	155	64.3 Å²	64.3	59%	0.585	34%	0.343	S	S	*	.			trans	-71.7	154.9	169.8	-60.5	173.3	-63.2	166.9	10.5	109.9	E109 D110 M111	R107-E109 WeakPolarHBondContact CB-OE2 3.31Å; R107-E109 PolarHBondContact O-N 3.41Å; R107-E109 VanDerWaalsContact O-N 3.16Å; R107-D110 IonicContact CZ-OD1 3.69Å; R107-D110 IonicContact NE-OD1 3.67Å; R107-D110 IonicContact NE-OD2 3.37Å; R107-D110 PolarHBondContact NE-OD2 3.28Å; R107-D110 IonicContact NH2-OD1 2.97Å; R107-D110 PolarHBondContact NH2-OD1 3.3Å; R107-D110 IonicContact NH2-OD2 3.47Å; R107-D110 WeakPolarHBondContact O-CB 3.48Å; R107-D110 PolarHBondContact O-N 3.48Å; R107-M111 PolarHBondContact O-N 3.15Å
108	P	93.3	Very high	94.8	Very high	104 Å²	104	62 Å²	62	68%	0.675	32%	0.323	S	S	*	.	H	α-helix	trans	-54.5	-36.8	179.7	-27.7	36.3	0	0	0	114	D110 M111	P108-D110 VanDerWaalsContact C-N 3.27Å; P108-D110 PolarHBondContact O-N 3.21Å; P108-M111 WeakPolarHBondContact O-CB 3.48Å; P108-M111 PolarHBondContact O-N 3.09Å
109	E	93.8	Very high	94.8	Very high	113 Å²	113	65.6 Å²	65.6	53%	0.528	34%	0.338	S	S	.	.	H	α-helix	trans	-70.5	-27.5	179.4	-52.7	74.6	-159.5	0	0	112	R107 M111 I113	R107-E109 WeakPolarHBondContact CB-OE2 3.31Å; R107-E109 PolarHBondContact O-N 3.41Å; R107-E109 VanDerWaalsContact O-N 3.16Å; E109-M111 VanDerWaalsContact C-N 3.27Å; E109-M111 PolarHBondContact O-N 3.42Å; E109-I113 WeakPolarHBondContact O-CD1 3.17Å; E109-I113 VanDerWaalsContact O-CG1 3.32Å; E109-I113 WeakPolarHBondContact O-CG1 3.47Å
110	D	94.7	Very high	94.8	Very high	15 Å²	15	67.8 Å²	67.8	8%	0.08	35%	0.351	C	S	.	.	H	α-helix	trans	-72.1	-24.4	178.6	-66.8	-20	0	0	0	111.2	P106 R107 P108 S112 I113 K114	P106-D110 HydrophobicContact CB-CB 4.06Å; R107-D110 IonicContact CZ-OD1 3.69Å; R107-D110 IonicContact NE-OD1 3.67Å; R107-D110 IonicContact NE-OD2 3.37Å; R107-D110 PolarHBondContact NE-OD2 3.28Å; R107-D110 IonicContact NH2-OD1 2.97Å; R107-D110 PolarHBondContact NH2-OD1 3.3Å; R107-D110 IonicContact NH2-OD2 3.47Å; R107-D110 WeakPolarHBondContact O-CB 3.48Å; R107-D110 PolarHBondContact O-N 3.48Å; P108-D110 VanDerWaalsContact C-N 3.27Å; P108-D110 PolarHBondContact O-N 3.21Å; D110-S112 VanDerWaalsContact C-N 3.31Å; D110-S112 PolarHBondContact O-N 3.1Å; D110-I113 PolarHBondContact O-N 3.05Å; D110-K114 HydrophobicContact CB-CD 3.83Å; D110-K114 HydrophobicContact CB-CG 4Å; D110-K114 VanDerWaalsContact CG-CE 3.49Å; D110-K114 WeakPolarHBondContact O-CB 3.23Å; D110-K114 PolarHBondContact O-N 3.35Å; D110-K114 IonicContact OD1-NZ 3.93Å; D110-K114 WeakPolarHBondContact OD2-CE 3.36Å; D110-K114 IonicContact OD2-NZ 2.81Å; D110-K114 PolarHBondContact OD2-NZ 3.43Å
111	M	95.1	Very high	94.9	Very high	47 Å²	47	64.7 Å²	64.7	23%	0.232	34%	0.335	C	S	.	.	H	α-helix	trans	-60.1	-38.5	-177.6	-71.1	-70.8	-106.2	0	0	112.6	Y80 A81 L100 L103 P106 R107 P108 E109	Y80-M111 PolarHBondContact N-O 3.06Å; A81-M111 HydrophobicContact CB-CB 4.26Å; A81-M111 WeakPolarHBondContact CB-O 3.49Å; A81-M111 PolarHBondContact N-O 2.85Å; L100-M111 HydrophobicContact CD2-CE 3.61Å; L100-M111 HydrophobicContact CD2-SD 4.18Å; L103-M111 HydrophobicContact CD1-SD 4.15Å; P106-M111 HydrophobicContact CG-SD 3.76Å; R107-M111 PolarHBondContact O-N 3.15Å; P108-M111 WeakPolarHBondContact O-CB 3.48Å; P108-M111 PolarHBondContact O-N 3.09Å; E109-M111 VanDerWaalsContact C-N 3.27Å; E109-M111 PolarHBondContact O-N 3.42Å
112	S	93.5	Very high	95	Very high	82 Å²	82	62.3 Å²	62.3	57%	0.573	33%	0.325	S	S	*	.	H	α-helix	trans	-94	-11.1	-178.3	58	0	0	0	0	114.1	D110	D110-S112 VanDerWaalsContact C-N 3.31Å; D110-S112 PolarHBondContact O-N 3.1Å
113	I	92.9	Very high	95	Very high	117 Å²	117	63 Å²	63	60%	0.6	33%	0.33	S	S	*	.	H	α-helix	trans	-108.4	-44.3	-173.2	-60.7	173.8	0	0	0	111.4	E109 D110 M115	E109-I113 WeakPolarHBondContact O-CD1 3.17Å; E109-I113 VanDerWaalsContact O-CG1 3.32Å; E109-I113 WeakPolarHBondContact O-CG1 3.47Å; D110-I113 PolarHBondContact O-N 3.05Å; I113-M115 PolarHBondContact O-N 2.79Å
114	K	95.4	Very high	95.1	Very high	82 Å²	82	62.6 Å²	62.6	36%	0.357	33%	0.328	S	S	.	.			trans	-72.5	134	-177.1	-71.2	-171.5	179.3	157	0	110.1	T79 Y80 D110	T79-K114 WeakPolarHBondContact CA-O 3.02Å; Y80-K114 HydrophobicContact CD1-CB 3.73Å; Y80-K114 WeakPolarHBondContact CD1-O 3.45Å; Y80-K114 HydrophobicContact CD2-CB 4.01Å; Y80-K114 HydrophobicContact CD2-CD 4.33Å; Y80-K114 HydrophobicContact CE1-CB 3.71Å; Y80-K114 HydrophobicContact CE2-CB 4Å; Y80-K114 HydrophobicContact CE2-CD 3.78Å; Y80-K114 HydrophobicContact CG-CB 3.89Å; Y80-K114 PolarHBondContact N-O 3.11Å; D110-K114 HydrophobicContact CB-CD 3.83Å; D110-K114 HydrophobicContact CB-CG 4Å; D110-K114 VanDerWaalsContact CG-CE 3.49Å; D110-K114 WeakPolarHBondContact O-CB 3.23Å; D110-K114 PolarHBondContact O-N 3.35Å; D110-K114 IonicContact OD1-NZ 3.93Å; D110-K114 WeakPolarHBondContact OD2-CE 3.36Å; D110-K114 IonicContact OD2-NZ 2.81Å; D110-K114 PolarHBondContact OD2-NZ 3.43Å
115	M	96.2	Very high	95.2	Very high	93 Å²	93	60.4 Å²	60.4	46%	0.458	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	145	176.5	-62.4	-69.2	154.5	0	0	109.7	K77 I78 T79 I113	K77-M115 HydrophobicContact CB-CB 4.34Å; K77-M115 HydrophobicContact CD-CB 4.1Å; I78-M115 CarbonylContact O-C 3.53Å; I78-M115 WeakPolarHBondContact O-CA 3.33Å; T79-M115 HydrophobicContact CG2-CE 3.59Å; T79-M115 HydrophobicContact CG2-SD 3.99Å; I113-M115 PolarHBondContact O-N 2.79Å
116	L	96.4	Very high	95.3	Very high	3 Å²	3	54 Å²	54	2%	0.016	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128	176.9	-174.9	68.1	0	0	0	107.6	K77 I78 Y80 C83 L103 T120 F121 M124	K77-L116 VanDerWaalsContact CA-O 3.28Å; K77-L116 WeakPolarHBondContact CA-O 3.46Å; I78-L116 HydrophobicContact CD1-CD2 4.48Å; I78-L116 HydrophobicContact CG1-CB 4.15Å; I78-L116 PolarHBondContact N-O 2.85Å; I78-L116 PolarHBondContact O-N 3.03Å; Y80-L116 HydrophobicContact CD1-CB 3.99Å; Y80-L116 HydrophobicContact CE1-CB 3.96Å; Y80-L116 HydrophobicContact CE1-CD1 4.25Å; C83-L116 HydrophobicContact CB-CD2 4.39Å; L103-L116 HydrophobicContact CD2-CD2 4.34Å; L116-T120 HydrophobicContact CD1-CG2 3.57Å; L116-F121 HydrophobicContact CD2-CB 3.91Å; L116-F121 HydrophobicContact CD2-CD2 3.88Å; L116-F121 HydrophobicContact CD2-CG 4.4Å; L116-F121 HydrophobicContact CG-CB 4.2Å; L116-M124 HydrophobicContact CD1-CE 3.88Å; L116-M124 HydrophobicContact CD1-SD 4.21Å; L116-M124 HydrophobicContact CD2-SD 4.05Å
117	D	97	Very high	95.4	Very high	65 Å²	65	56.4 Å²	56.4	35%	0.348	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	166	171.8	59.6	36.8	0	0	0	111.3	K77 E119 T120 F121	K77-D117 HydrophobicContact CG-CB 4.3Å; D117-E119 PolarHBondContact O-N 3.25Å; D117-T120 PolarHBondContact O-N 2.81Å; D117-T120 WeakPolarHBondContact OD1-CB 3.48Å; D117-T120 PolarHBondContact OD1-N 2.76Å; D117-T120 PolarHBondContact OD1-OG1 3.21Å; D117-F121 WeakPolarHBondContact O-CB 3.45Å; D117-F121 PolarHBondContact O-N 3.39Å
118	F	96.6	Very high	95.4	Very high	6 Å²	6	49.4 Å²	49.4	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-61.7	-41.2	-177.6	-178.7	-104.4	0	0	0	113	I58 F61 K62 F65 M76 T120 F121 L122	I58-F118 HydrophobicContact CG2-CE1 3.96Å; I58-F118 HydrophobicContact CG2-CZ 4.14Å; I58-F118 WeakPolarHBondContact O-CZ 3.4Å; F61-F118 HydrophobicContact CB-CE2 3.97Å; F61-F118 HydrophobicContact CB-CZ 4.09Å; K62-F118 HydrophobicContact CB-CD1 4.45Å; K62-F118 HydrophobicContact CB-CD2 4.37Å; K62-F118 HydrophobicContact CB-CE1 4Å; K62-F118 HydrophobicContact CB-CE2 3.93Å; K62-F118 HydrophobicContact CB-CZ 3.72Å; K62-F118 HydrophobicContact CD-CD1 4.45Å; K62-F118 HydrophobicContact CD-CE1 4.37Å; K62-F118 HydrophobicContact CG-CD1 4.25Å; K62-F118 HydrophobicContact CG-CE1 4.25Å; K62-F118 HydrophobicContact CG-CG 4.37Å; K62-F118 HydrophobicContact CG-CZ 4.38Å; F65-F118 HydrophobicContact CB-CD2 3.85Å; F65-F118 HydrophobicContact CB-CE2 4.3Å; F65-F118 HydrophobicContact CD1-CB 4.26Å; F65-F118 HydrophobicContact CD1-CD2 4.33Å; F65-F118 AromaticContact CD2-CD2 3.97Å; F65-F118 HydrophobicContact CD2-CD2 3.97Å; F65-F118 HydrophobicContact CE1-CB 4.25Å; F65-F118 AromaticContact CG-CD2 3.81Å; F65-F118 HydrophobicContact CG-CD2 3.81Å; F65-F118 HydrophobicContact CZ-CB 4.48Å; M76-F118 HydrophobicContact CG-CB 4.3Å; M76-F118 HydrophobicContact SD-CB 4.27Å; F118-T120 PolarHBondContact O-N 3.11Å; F118-F121 HydrophobicContact CD2-CD1 4.43Å; F118-F121 PolarHBondContact O-N 3.34Å; F118-F121 VanDerWaalsContact O-N 3.1Å; F118-L122 HydrophobicContact CE1-CD2 4.42Å; F118-L122 HydrophobicContact CZ-CD1 4.2Å; F118-L122 PolarHBondContact O-N 2.8Å
119	E	95.1	Very high	95.3	Very high	136 Å²	136	46.2 Å²	46.2	64%	0.636	24%	0.241	S	C	*	.	H	α-helix	trans	-62.8	-32.9	-179.2	-61.6	-60.7	143.4	0	0	112.2	D117 P123	D117-E119 PolarHBondContact O-N 3.25Å; E119-P123 WeakPolarHBondContact O-CD 3.34Å
120	T	95.1	Very high	95.2	Very high	54 Å²	54	45.6 Å²	45.6	33%	0.331	23%	0.233	S	C	.	.	H	α-helix	trans	-82.5	-29.6	175.3	-50.4	0	0	0	0	112	L116 D117 F118 M124	L116-T120 HydrophobicContact CD1-CG2 3.57Å; D117-T120 PolarHBondContact O-N 2.81Å; D117-T120 WeakPolarHBondContact OD1-CB 3.48Å; D117-T120 PolarHBondContact OD1-N 2.76Å; D117-T120 PolarHBondContact OD1-OG1 3.21Å; F118-T120 PolarHBondContact O-N 3.11Å; T120-M124 HydrophobicContact CG2-CE 3.91Å
121	F	97.2	Very high	94.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-71.4	-40.4	176.6	173.7	-99.8	0	0	0	113	F65 V86 M87 L90 L116 D117 F118 M124 L125	F65-F121 HydrophobicContact CD2-CB 4.34Å; F65-F121 AromaticContact CD2-CD1 3.76Å; F65-F121 HydrophobicContact CD2-CD1 3.76Å; F65-F121 HydrophobicContact CD2-CE1 4.17Å; F65-F121 AromaticContact CD2-CG 3.97Å; F65-F121 HydrophobicContact CD2-CG 3.97Å; F65-F121 HydrophobicContact CE2-CB 3.71Å; F65-F121 AromaticContact CE2-CD1 3.97Å; F65-F121 HydrophobicContact CE2-CD1 3.97Å; F65-F121 HydrophobicContact CE2-CD2 4.16Å; F65-F121 AromaticContact CE2-CG 3.68Å; F65-F121 HydrophobicContact CE2-CG 3.68Å; V86-F121 HydrophobicContact CB-CE2 4.17Å; V86-F121 HydrophobicContact CB-CZ 4.01Å; V86-F121 HydrophobicContact CG1-CE1 3.96Å; V86-F121 HydrophobicContact CG1-CE2 4.11Å; V86-F121 HydrophobicContact CG1-CZ 3.52Å; M87-F121 HydrophobicContact CE-CD2 4.4Å; M87-F121 HydrophobicContact CE-CE2 3.91Å; M87-F121 HydrophobicContact CG-CE2 3.79Å; M87-F121 HydrophobicContact CG-CZ 3.91Å; L90-F121 HydrophobicContact CD1-CE1 3.86Å; L90-F121 HydrophobicContact CD1-CZ 4.14Å; L116-F121 HydrophobicContact CD2-CB 3.91Å; L116-F121 HydrophobicContact CD2-CD2 3.88Å; L116-F121 HydrophobicContact CD2-CG 4.4Å; L116-F121 HydrophobicContact CG-CB 4.2Å; D117-F121 WeakPolarHBondContact O-CB 3.45Å; D117-F121 PolarHBondContact O-N 3.39Å; F118-F121 HydrophobicContact CD2-CD1 4.43Å; F118-F121 PolarHBondContact O-N 3.34Å; F118-F121 VanDerWaalsContact O-N 3.1Å; F121-M124 WeakPolarHBondContact O-CA 3.25Å; F121-M124 VanDerWaalsContact O-CB 3.27Å; F121-M124 WeakPolarHBondContact O-CB 3.46Å; F121-M124 PolarHBondContact O-N 2.99Å; F121-L125 HydrophobicContact CD1-CB 4.49Å; F121-L125 HydrophobicContact CE1-CB 4.01Å; F121-L125 HydrophobicContact CE1-CD2 4.05Å; F121-L125 HydrophobicContact CE1-CG 4.44Å; F121-L125 HydrophobicContact CZ-CB 4.22Å; F121-L125 HydrophobicContact CZ-CD1 4.34Å; F121-L125 PolarHBondContact O-N 3.04Å
122	L	96.5	Very high	93.8	Very high	13 Å²	13	54.7 Å²	54.7	7%	0.068	28%	0.281	C	S	.	.	H	α-helix	trans	-57.7	-43.5	-172.9	-175.7	68	0	0	0	113.7	I51 F53 I58 F61 F118 M124 L125 Q126	I51-L122 HydrophobicContact CD1-CG 4.2Å; I51-L122 HydrophobicContact CG2-CD2 4.14Å; I51-L122 HydrophobicContact CG2-CG 4.47Å; F53-L122 HydrophobicContact CD2-CD1 3.8Å; F53-L122 HydrophobicContact CE2-CD1 4.09Å; I58-L122 HydrophobicContact CD1-CD2 4.33Å; I58-L122 HydrophobicContact CG1-CD1 4.47Å; I58-L122 HydrophobicContact CG1-CD2 4.17Å; I58-L122 HydrophobicContact CG2-CD2 4.26Å; F61-L122 HydrophobicContact CD2-CD1 4Å; F118-L122 HydrophobicContact CE1-CD2 4.42Å; F118-L122 HydrophobicContact CZ-CD1 4.2Å; F118-L122 PolarHBondContact O-N 2.8Å; L122-M124 VanDerWaalsContact C-N 3.31Å; L122-M124 PolarHBondContact O-N 2.82Å; L122-L125 PolarHBondContact O-N 3.21Å; L122-Q126 WeakPolarHBondContact O-CB 3.37Å; L122-Q126 PolarHBondContact O-N 3.5Å
123	P	96	Very high	93.2	Very high	18 Å²	18	58.2 Å²	58.2	12%	0.117	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-31.2	173	-19.6	30.8	0	0	0	113.9	P46 V49 I51 E119 H127	P46-P123 HydrophobicContact CB-CB 4.08Å; P46-P123 WeakPolarHBondContact O-CB 3.23Å; V49-P123 HydrophobicContact CB-CB 4.13Å; I51-P123 HydrophobicContact CD1-CB 4.18Å; I51-P123 HydrophobicContact CD1-CG 4.16Å; E119-P123 WeakPolarHBondContact O-CD 3.34Å; P123-H127 PolarHBondContact O-N 3.25Å
124	M	96.4	Very high	92.8	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.03	28%	0.283	C	S	.	.	H	α-helix	trans	-66.7	-47.3	174.2	-59	174.1	-177.7	0	0	110.3	F44 P46 M87 V102 L103 L116 T120 F121 L122 Q126 H127 I128	F44-M124 HydrophobicContact CE1-CG 3.83Å; F44-M124 HydrophobicContact CZ-CG 4.4Å; P46-M124 HydrophobicContact CG-CE 4.38Å; M87-M124 HydrophobicContact CE-CB 3.77Å; V102-M124 HydrophobicContact CB-CB 4.08Å; V102-M124 HydrophobicContact CB-CG 4.1Å; V102-M124 HydrophobicContact CG2-CB 4.07Å; V102-M124 HydrophobicContact CG2-CG 4.34Å; V102-M124 HydrophobicContact CG2-SD 4.46Å; V102-M124 WeakPolarHBondContact O-CE 3.48Å; L103-M124 HydrophobicContact CD2-CE 4.32Å; L103-M124 HydrophobicContact CD2-SD 4.01Å; L116-M124 HydrophobicContact CD1-CE 3.88Å; L116-M124 HydrophobicContact CD1-SD 4.21Å; L116-M124 HydrophobicContact CD2-SD 4.05Å; T120-M124 HydrophobicContact CG2-CE 3.91Å; F121-M124 WeakPolarHBondContact O-CA 3.25Å; F121-M124 VanDerWaalsContact O-CB 3.27Å; F121-M124 WeakPolarHBondContact O-CB 3.46Å; F121-M124 PolarHBondContact O-N 2.99Å; L122-M124 VanDerWaalsContact C-N 3.31Å; L122-M124 PolarHBondContact O-N 2.82Å; M124-Q126 VanDerWaalsContact C-N 3.31Å; M124-Q126 PolarHBondContact O-N 3.33Å; M124-H127 WeakPolarHBondContact O-CB 3.47Å; M124-H127 PolarHBondContact O-N 3.22Å; M124-H127 VanDerWaalsContact O-N 3.14Å; M124-I128 WeakPolarHBondContact O-CG1 3.22Å; M124-I128 PolarHBondContact O-N 3Å
125	L	96.7	Very high	92.5	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-58.5	-43.8	175.3	-179.1	68.8	0	0	0	111.4	F53 F61 M87 L90 Q92 F121 L122 H127 I128 S129	F53-L125 HydrophobicContact CE2-CD2 4.24Å; F53-L125 HydrophobicContact CE2-CG 4.28Å; F53-L125 HydrophobicContact CZ-CD2 4.3Å; F53-L125 HydrophobicContact CZ-CG 4.16Å; F61-L125 HydrophobicContact CD1-CD2 4.4Å; F61-L125 HydrophobicContact CD2-CD2 3.58Å; F61-L125 HydrophobicContact CE2-CD2 3.77Å; F61-L125 HydrophobicContact CG-CD2 3.92Å; F61-L125 HydrophobicContact CZ-CD2 4.25Å; M87-L125 HydrophobicContact CG-CD1 4.23Å; L90-L125 HydrophobicContact CB-CD1 4.3Å; L90-L125 HydrophobicContact CD1-CD1 4.16Å; L90-L125 HydrophobicContact CD1-CD2 3.58Å; Q92-L125 HydrophobicContact CG-CD1 3.78Å; F121-L125 HydrophobicContact CD1-CB 4.49Å; F121-L125 HydrophobicContact CE1-CB 4.01Å; F121-L125 HydrophobicContact CE1-CD2 4.05Å; F121-L125 HydrophobicContact CE1-CG 4.44Å; F121-L125 HydrophobicContact CZ-CB 4.22Å; F121-L125 HydrophobicContact CZ-CD1 4.34Å; F121-L125 PolarHBondContact O-N 3.04Å; L122-L125 PolarHBondContact O-N 3.21Å; L125-H127 VanDerWaalsContact C-N 3.29Å; L125-H127 PolarHBondContact O-N 3.04Å; L125-I128 PolarHBondContact O-N 2.89Å; L125-S129 WeakPolarHBondContact O-CB 3.32Å; L125-S129 PolarHBondContact O-N 3.38Å; L125-S129 PolarHBondContact O-OG 2.98Å
126	Q	95.8	Very high	92.3	Very high	5 Å²	5	54 Å²	54	2%	0.023	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-34.4	177	179.6	63.8	78.8	0	0	113	V49 A50 I51 F53 L122 M124 S129 R130	V49-Q126 HydrophobicContact CG1-CB 3.84Å; V49-Q126 HydrophobicContact CG1-CG 3.5Å; V49-Q126 VanDerWaalsContact CG1-CG 3.5Å; A50-Q126 VanDerWaalsContact O-CG 3.27Å; A50-Q126 WeakPolarHBondContact O-CG 3.36Å; I51-Q126 HydrophobicContact CD1-CB 3.89Å; I51-Q126 HydrophobicContact CD1-CG 4.11Å; F53-Q126 HydrophobicContact CD2-CB 4.37Å; F53-Q126 HydrophobicContact CE2-CB 3.63Å; F53-Q126 HydrophobicContact CE2-CG 4.3Å; F53-Q126 HydrophobicContact CZ-CB 4.23Å; L122-Q126 WeakPolarHBondContact O-CB 3.37Å; L122-Q126 PolarHBondContact O-N 3.5Å; M124-Q126 VanDerWaalsContact C-N 3.31Å; M124-Q126 PolarHBondContact O-N 3.33Å; Q126-S129 PolarHBondContact NE2-OG 3.49Å; Q126-S129 PolarHBondContact O-OG 3.02Å; Q126-R130 VanDerWaalsContact NE2-NE 3.2Å; Q126-R130 WeakPolarHBondContact O-CD 3.35Å; Q126-R130 VanDerWaalsContact O-CG 3.29Å; Q126-R130 WeakPolarHBondContact O-CG 3.32Å
127	H	94.3	Very high	92.1	Very high	70 Å²	70	56.5 Å²	56.5	32%	0.324	29%	0.294	S	S	.	.	H	α-helix	trans	-68.9	-47.6	174.8	-178.2	76.3	0	0	0	111.3	F44 V49 P123 M124 L125 S129 R130	F44-H127 HydrophobicContact CD2-CB 4.5Å; F44-H127 AromaticContact CD2-CG 3.96Å; F44-H127 HydrophobicContact CE2-CB 3.48Å; F44-H127 VanDerWaalsContact CE2-CB 3.48Å; F44-H127 AromaticContact CE2-CD2 3.84Å; F44-H127 AromaticContact CE2-CG 3.36Å; F44-H127 AromaticContact CE2-ND1 3.61Å; F44-H127 HydrophobicContact CZ-CB 3.83Å; V49-H127 HydrophobicContact CG2-CB 4.45Å; P123-H127 PolarHBondContact O-N 3.25Å; M124-H127 WeakPolarHBondContact O-CB 3.47Å; M124-H127 PolarHBondContact O-N 3.22Å; M124-H127 VanDerWaalsContact O-N 3.14Å; L125-H127 VanDerWaalsContact C-N 3.29Å; L125-H127 PolarHBondContact O-N 3.04Å; H127-S129 VanDerWaalsContact C-N 3.32Å; H127-S129 PolarHBondContact O-N 3.4Å; H127-R130 PolarHBondContact O-N 3.35Å
128	I	94.6	Very high	92	Very high	7 Å²	7	58.5 Å²	58.5	4%	0.036	30%	0.301	C	S	.	.	H	α-helix	trans	-61.5	-40.3	178.4	-64.4	-57.5	0	0	0	111.2	M87 Q92 P94 D98 V102 M124 L125 R130 A131	M87-I128 HydrophobicContact CE-CG1 4.2Å; M87-I128 HydrophobicContact SD-CG1 3.91Å; Q92-I128 HydrophobicContact CB-CG2 3.89Å; Q92-I128 HydrophobicContact CG-CG2 4.25Å; P94-I128 HydrophobicContact CB-CD1 4.2Å; P94-I128 HydrophobicContact CB-CG2 3.89Å; P94-I128 HydrophobicContact CG-CG2 4.28Å; D98-I128 HydrophobicContact CB-CD1 3.85Å; V102-I128 HydrophobicContact CG1-CD1 3.88Å; V102-I128 HydrophobicContact CG1-CG1 4.28Å; M124-I128 WeakPolarHBondContact O-CG1 3.22Å; M124-I128 PolarHBondContact O-N 3Å; L125-I128 PolarHBondContact O-N 2.89Å; I128-R130 PolarHBondContact O-N 3.39Å; I128-R130 VanDerWaalsContact O-N 3.14Å; I128-A131 VanDerWaalsContact O-CB 3.24Å; I128-A131 WeakPolarHBondContact O-CB 3.47Å; I128-A131 PolarHBondContact O-N 2.9Å
129	S	93.1	Very high	92	Very high	38 Å²	38	62.2 Å²	62.2	27%	0.266	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.9	179.5	72.4	0	0	0	0	114.4	L125 Q126 H127	L125-S129 WeakPolarHBondContact O-CB 3.32Å; L125-S129 PolarHBondContact O-N 3.38Å; L125-S129 PolarHBondContact O-OG 2.98Å; Q126-S129 PolarHBondContact NE2-OG 3.49Å; Q126-S129 PolarHBondContact O-OG 3.02Å; H127-S129 VanDerWaalsContact C-N 3.32Å; H127-S129 PolarHBondContact O-N 3.4Å
130	R	90.5	Very high	92	Very high	99 Å²	99	59.5 Å²	59.5	37%	0.374	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-7.9	175.8	-67.5	166.4	179.4	-132.5	1.7	112.9	A50 E52 Q126 H127 I128 K132	A50-R130 PolarHBondContact O-NH2 3.35Å; E52-R130 IonicContact OE1-CZ 2.65Å; E52-R130 IonicContact OE1-NH1 2.65Å; E52-R130 IonicContact OE1-NH2 3.91Å; E52-R130 PolarHBondContact OE1-NH2 2.81Å; E52-R130 IonicContact OE2-NH2 2.92Å; Q126-R130 VanDerWaalsContact NE2-NE 3.2Å; Q126-R130 WeakPolarHBondContact O-CD 3.35Å; Q126-R130 VanDerWaalsContact O-CG 3.29Å; Q126-R130 WeakPolarHBondContact O-CG 3.32Å; H127-R130 PolarHBondContact O-N 3.35Å; I128-R130 PolarHBondContact O-N 3.39Å; I128-R130 VanDerWaalsContact O-N 3.14Å; R130-K132 WeakPolarHBondContact O-CG 3.47Å; R130-K132 PolarHBondContact O-N 2.96Å
131	A	85.6	Confident	92.1	Very high	51 Å²	51	57.2 Å²	57.2	42%	0.421	29%	0.294	S	S	.	.			trans	-66.1	117.8	178	0	0	0	0	0	109.8	I128	I128-A131 VanDerWaalsContact O-CB 3.24Å; I128-A131 WeakPolarHBondContact O-CB 3.47Å; I128-A131 PolarHBondContact O-N 2.9Å
132	K	75.3	Confident	92	Very high	203 Å²	203	61.3 Å²	61.3	88%	0.883	31%	0.313	S	S	*	.			trans	-97.5	-10.4	-175.4	-61.8	-172.8	-179.3	-178.7	0	114	R130	R130-K132 WeakPolarHBondContact O-CG 3.47Å; R130-K132 PolarHBondContact O-N 2.96Å
133	D	81.5	Confident	91.9	Very high	156 Å²	156	62.6 Å²	62.6	83%	0.834	33%	0.329	S	S	*	.			trans	-111.2	67.3	-170.1	-161.1	8.2	0	0	0	110.7
134	Q	83.8	Confident	91.9	Very high	85 Å²	85	62.8 Å²	62.8	40%	0.397	33%	0.329	S	S	.	.	S	Bend	trans	-97.6	6.4	179.6	-66.5	-173.3	-10.1	0	0	113
135	G	88.9	Confident	91.8	Very high	37 Å²	37	67.7 Å²	67.7	38%	0.381	35%	0.347	S	S	.	.			trans	74.4	149.5	-170	0	0	0	0	0	112.6	D139	G135-D139 WeakPolarHBondContact CA-OD2 3.43Å
136	N	91.4	Very high	91.8	Very high	80 Å²	80	73.2 Å²	73.2	43%	0.428	38%	0.381	S	S	.	.			trans	-105.6	170.4	174.7	73.3	66.5	0	0	0	111.1	E138 D139 F140	N136-E138 VanDerWaalsContact C-N 3.27Å; N136-E138 PolarHBondContact O-N 3.25Å; N136-E138 WeakPolarHBondContact OD1-CA 3.42Å; N136-E138 VanDerWaalsContact OD1-CB 3.3Å; N136-E138 WeakPolarHBondContact OD1-CB 3.32Å; N136-E138 PolarHBondContact OD1-N 2.66Å; N136-D139 VanDerWaalsContact CG-OD2 3.23Å; N136-D139 PolarHBondContact N-OD2 3.28Å; N136-D139 PolarHBondContact ND2-OD1 3.41Å; N136-D139 VanDerWaalsContact ND2-OD1 3.14Å; N136-D139 PolarHBondContact ND2-OD2 2.89Å; N136-D139 WeakPolarHBondContact O-CB 3.36Å; N136-D139 PolarHBondContact O-N 3.12Å; N136-D139 PolarHBondContact OD1-N 3.13Å; N136-F140 WeakPolarHBondContact O-CD2 3.38Å; N136-F140 PolarHBondContact O-N 3.05Å
137	F	93.8	Very high	91.7	Very high	56 Å²	56	75.2 Å²	75.2	25%	0.246	39%	0.389	C	S	.	.	H	α-helix	trans	-49.4	-44.4	-179.5	177.7	-99	0	0	0	113.8	F140 V141 T193 V196 K197 L200	F137-F140 PolarHBondContact O-N 3.27Å; F137-V141 HydrophobicContact CD1-CG2 4.2Å; F137-V141 HydrophobicContact CD2-CG2 4.49Å; F137-V141 HydrophobicContact CE1-CG2 3.7Å; F137-V141 HydrophobicContact CE2-CG2 3.99Å; F137-V141 HydrophobicContact CZ-CG2 3.58Å; F137-V141 WeakPolarHBondContact O-CG2 3.33Å; F137-V141 PolarHBondContact O-N 3.45Å; F137-V141 VanDerWaalsContact O-N 3.09Å; F137-T193 HydrophobicContact CE1-CG2 4.44Å; F137-T193 HydrophobicContact CZ-CG2 3.76Å; F137-V196 HydrophobicContact CD2-CB 4.34Å; F137-V196 HydrophobicContact CD2-CG1 3.48Å; F137-V196 VanDerWaalsContact CD2-CG1 3.48Å; F137-V196 HydrophobicContact CE2-CB 3.9Å; F137-V196 HydrophobicContact CE2-CG1 3.56Å; F137-V196 HydrophobicContact CG-CG1 4.45Å; F137-K197 HydrophobicContact CD2-CG 4.36Å; F137-K197 HydrophobicContact CE2-CD 4.48Å; F137-K197 HydrophobicContact CE2-CG 3.49Å; F137-K197 VanDerWaalsContact CE2-CG 3.49Å; F137-K197 HydrophobicContact CZ-CG 4Å; F137-L200 HydrophobicContact CB-CD1 4.25Å; F137-L200 HydrophobicContact CD2-CD1 4.06Å
138	E	94.9	Very high	91.7	Very high	107 Å²	107	72.7 Å²	72.7	50%	0.5	38%	0.378	S	S	.	.	H	α-helix	trans	-67.4	-37.2	-179.5	-59.5	-61.9	151.8	0	0	111.3	N136 F140 V141 E142	N136-E138 VanDerWaalsContact C-N 3.27Å; N136-E138 PolarHBondContact O-N 3.25Å; N136-E138 WeakPolarHBondContact OD1-CA 3.42Å; N136-E138 VanDerWaalsContact OD1-CB 3.3Å; N136-E138 WeakPolarHBondContact OD1-CB 3.32Å; N136-E138 PolarHBondContact OD1-N 2.66Å; E138-F140 VanDerWaalsContact C-N 3.32Å; E138-F140 PolarHBondContact O-N 3.37Å; E138-V141 PolarHBondContact O-N 3.09Å; E138-E142 WeakPolarHBondContact O-CB 3.42Å; E138-E142 WeakPolarHBondContact O-CG 3.43Å; E138-E142 PolarHBondContact O-N 3.42Å
139	D	95.2	Very high	91.6	Very high	85 Å²	85	80.1 Å²	80.1	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-60.3	-43.3	177.8	-55.5	-29.6	0	0	0	111.2	G135 N136 G143	G135-D139 WeakPolarHBondContact CA-OD2 3.43Å; N136-D139 VanDerWaalsContact CG-OD2 3.23Å; N136-D139 PolarHBondContact N-OD2 3.28Å; N136-D139 PolarHBondContact ND2-OD1 3.41Å; N136-D139 VanDerWaalsContact ND2-OD1 3.14Å; N136-D139 PolarHBondContact ND2-OD2 2.89Å; N136-D139 WeakPolarHBondContact O-CB 3.36Å; N136-D139 PolarHBondContact O-N 3.12Å; N136-D139 PolarHBondContact OD1-N 3.13Å; D139-G143 PolarHBondContact O-N 3.38Å
140	F	95.7	Very high	91.5	Very high	79 Å²	79	86 Å²	86	35%	0.346	43%	0.434	S	S	.	.	H	α-helix	trans	-67.6	-41.2	176.9	-72.9	-78	0	0	0	112.4	N136 F137 E138 G143 L144 V196 L200	N136-F140 WeakPolarHBondContact O-CD2 3.38Å; N136-F140 PolarHBondContact O-N 3.05Å; F137-F140 PolarHBondContact O-N 3.27Å; E138-F140 VanDerWaalsContact C-N 3.32Å; E138-F140 PolarHBondContact O-N 3.37Å; F140-G143 PolarHBondContact O-N 3.27Å; F140-L144 PolarHBondContact O-N 3.14Å; F140-L144 VanDerWaalsContact O-N 3.07Å; F140-V196 HydrophobicContact CB-CB 4.45Å; F140-V196 HydrophobicContact CB-CG1 3.61Å; F140-V196 HydrophobicContact CB-CG2 3.85Å; F140-V196 HydrophobicContact CG-CG1 4.35Å; F140-L200 HydrophobicContact CD2-CD1 4.38Å; F140-L200 HydrophobicContact CD2-CD2 4.46Å; F140-L200 HydrophobicContact CE2-CD2 4.19Å
141	V	96.1	Very high	91.7	Very high	5 Å²	5	84.3 Å²	84.3	3%	0.03	45%	0.447	C	S	.	.	H	α-helix	trans	-65.5	-45.2	178.7	169.6	0	0	0	0	111.2	F137 E138 G143 L144 R145 Y192 V196	F137-V141 HydrophobicContact CD1-CG2 4.2Å; F137-V141 HydrophobicContact CD2-CG2 4.49Å; F137-V141 HydrophobicContact CE1-CG2 3.7Å; F137-V141 HydrophobicContact CE2-CG2 3.99Å; F137-V141 HydrophobicContact CZ-CG2 3.58Å; F137-V141 WeakPolarHBondContact O-CG2 3.33Å; F137-V141 PolarHBondContact O-N 3.45Å; F137-V141 VanDerWaalsContact O-N 3.09Å; E138-V141 PolarHBondContact O-N 3.09Å; V141-G143 VanDerWaalsContact C-N 3.33Å; V141-L144 PolarHBondContact O-N 3.37Å; V141-R145 WeakPolarHBondContact O-CB 3.18Å; V141-R145 PolarHBondContact O-N 3.17Å; V141-Y192 HydrophobicContact CG1-CD2 4.22Å; V141-Y192 HydrophobicContact CG1-CE2 3.86Å; V141-V196 HydrophobicContact CG2-CB 4.19Å; V141-V196 HydrophobicContact CG2-CG1 4.26Å; V141-V196 HydrophobicContact CG2-CG2 4.19Å
142	E	95.7	Very high	92.1	Very high	86 Å²	86	85.8 Å²	85.8	40%	0.402	45%	0.448	S	S	.	.	H	α-helix	trans	-65.2	-38	176	-68.8	-57.7	144.7	0	0	111.5	E138 L144 R145	E138-E142 WeakPolarHBondContact O-CB 3.42Å; E138-E142 WeakPolarHBondContact O-CG 3.43Å; E138-E142 PolarHBondContact O-N 3.42Å; E142-L144 VanDerWaalsContact C-N 3.33Å; E142-L144 PolarHBondContact O-N 2.73Å; E142-R145 PolarHBondContact O-N 2.8Å; E142-R145 IonicContact OE1-CZ 3.61Å; E142-R145 IonicContact OE1-NE 3.96Å; E142-R145 IonicContact OE1-NH1 2.7Å; E142-R145 PolarHBondContact OE1-NH1 3.29Å; E142-R145 IonicContact OE1-NH2 3.76Å; E142-R145 PolarHBondContact OE1-NH2 2.98Å; E142-R145 IonicContact OE2-CZ 3.78Å; E142-R145 IonicContact OE2-NE 2.87Å; E142-R145 IonicContact OE2-NH1 3.45Å; E142-R145 PolarHBondContact OE2-NH1 3.43Å
143	G	94.8	Very high	93	Very high	40 Å²	40	76.8 Å²	76.8	41%	0.412	41%	0.413	S	S	.	.	H	α-helix	trans	-59.2	-41.8	174.5	0	0	0	0	0	113	D139 F140 V141	D139-G143 PolarHBondContact O-N 3.38Å; F140-G143 PolarHBondContact O-N 3.27Å; V141-G143 VanDerWaalsContact C-N 3.33Å
144	L	95.7	Very high	93.8	Very high	22 Å²	22	71 Å²	71	12%	0.115	38%	0.383	C	S	.	.	H	α-helix	trans	-77.9	-28.7	177.6	-68.2	177.8	0	0	0	113.4	F140 V141 E142 V146 F147 I155 L160 Y192 F195 V196	F140-L144 PolarHBondContact O-N 3.14Å; F140-L144 VanDerWaalsContact O-N 3.07Å; V141-L144 PolarHBondContact O-N 3.37Å; E142-L144 VanDerWaalsContact C-N 3.33Å; E142-L144 PolarHBondContact O-N 2.73Å; L144-V146 PolarHBondContact O-N 3.4Å; L144-V146 VanDerWaalsContact O-N 3.15Å; L144-F147 PolarHBondContact O-N 2.85Å; L144-I155 HydrophobicContact CD2-CD1 4.37Å; L144-L160 HydrophobicContact CD2-CD1 3.72Å; L144-Y192 HydrophobicContact CB-CD2 4.28Å; L144-Y192 HydrophobicContact CB-CG 4.13Å; L144-F195 HydrophobicContact CD1-CD1 4.11Å; L144-V196 HydrophobicContact CD1-CG2 3.68Å
145	R	95.6	Very high	94.4	Very high	109 Å²	109	67.2 Å²	67.2	41%	0.411	37%	0.365	S	S	.	.	H	α-helix	trans	-58.6	-27.7	177.8	-174.4	-178.1	-68.7	157.1	10.1	112.6	V141 E142 F147 D148	V141-R145 WeakPolarHBondContact O-CB 3.18Å; V141-R145 PolarHBondContact O-N 3.17Å; E142-R145 PolarHBondContact O-N 2.8Å; E142-R145 IonicContact OE1-CZ 3.61Å; E142-R145 IonicContact OE1-NE 3.96Å; E142-R145 IonicContact OE1-NH1 2.7Å; E142-R145 PolarHBondContact OE1-NH1 3.29Å; E142-R145 IonicContact OE1-NH2 3.76Å; E142-R145 PolarHBondContact OE1-NH2 2.98Å; E142-R145 IonicContact OE2-CZ 3.78Å; E142-R145 IonicContact OE2-NE 2.87Å; E142-R145 IonicContact OE2-NH1 3.45Å; E142-R145 PolarHBondContact OE2-NH1 3.43Å; R145-F147 PolarHBondContact O-N 2.85Å; R145-F147 VanDerWaalsContact O-N 3.08Å; R145-D148 PolarHBondContact O-N 3.24Å
146	V	94.9	Very high	94.7	Very high	117 Å²	117	70 Å²	70	71%	0.709	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.8	176.4	-178	0	0	0	0	112.5	L144	L144-V146 PolarHBondContact O-N 3.4Å; L144-V146 VanDerWaalsContact O-N 3.15Å
147	F	94	Very high	94.9	Very high	47 Å²	47	66.2 Å²	66.2	21%	0.206	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-8.3	178.7	-54.4	-76.1	0	0	0	113.6	L144 R145 K149 I155 V163 L167	L144-F147 PolarHBondContact O-N 2.85Å; R145-F147 PolarHBondContact O-N 2.85Å; R145-F147 VanDerWaalsContact O-N 3.08Å; F147-K149 PolarHBondContact O-N 3.39Å; F147-K149 VanDerWaalsContact O-N 3.15Å; F147-I155 HydrophobicContact CB-CG2 4.02Å; F147-V163 HydrophobicContact CD1-CG2 3.73Å; F147-V163 HydrophobicContact CD2-CG2 4.41Å; F147-V163 HydrophobicContact CE1-CG1 4.48Å; F147-V163 HydrophobicContact CE1-CG2 3.37Å; F147-V163 HydrophobicContact CE2-CG1 3.92Å; F147-V163 HydrophobicContact CE2-CG2 4.11Å; F147-V163 HydrophobicContact CG-CG2 4.24Å; F147-V163 HydrophobicContact CZ-CB 4.38Å; F147-V163 HydrophobicContact CZ-CG1 3.82Å; F147-V163 HydrophobicContact CZ-CG2 3.59Å; F147-L167 HydrophobicContact CE1-CD1 4.46Å; F147-L167 HydrophobicContact CZ-CD1 4.03Å
148	D	95.5	Very high	95	Very high	17 Å²	17	66.8 Å²	66.8	9%	0.091	36%	0.364	C	S	.	.			trans	-81.8	91.2	174.1	-178.3	0.4	0	0	0	110.2	R145 E150 G151 N152 G153 T154 I155 Y192	R145-D148 PolarHBondContact O-N 3.24Å; D148-E150 PolarHBondContact O-N 3.24Å; D148-E150 PolarHBondContact OD1-N 3.27Å; D148-E150 VanDerWaalsContact OD1-N 3.09Å; D148-G151 VanDerWaalsContact CG-N 3.31Å; D148-G151 WeakPolarHBondContact OD1-CA 3.47Å; D148-G151 PolarHBondContact OD1-N 3.41Å; D148-G151 VanDerWaalsContact OD2-C 3.23Å; D148-G151 VanDerWaalsContact OD2-CA 3.27Å; D148-G151 WeakPolarHBondContact OD2-CA 3.36Å; D148-N152 PolarHBondContact OD1-N 3.01Å; D148-N152 PolarHBondContact OD2-N 3.15Å; D148-G153 PolarHBondContact OD2-N 3.2Å; D148-T154 VanDerWaalsContact CG-O 3.3Å; D148-I155 HydrophobicContact CB-CG2 4.05Å; D148-Y192 HydrophobicContact CB-CE1 3.85Å
149	K	91.6	Very high	95	Very high	164 Å²	164	64.2 Å²	64.2	71%	0.713	35%	0.352	S	S	*	.	S	Bend	trans	-66.8	-24.8	-179.3	-67	170.7	-176	126.7	0	113.1	F147 E159	F147-K149 PolarHBondContact O-N 3.39Å; F147-K149 VanDerWaalsContact O-N 3.15Å; K149-E159 IonicContact NZ-OE1 2.72Å; K149-E159 PolarHBondContact NZ-OE1 2.91Å; K149-E159 IonicContact NZ-OE2 2.8Å; K149-E159 PolarHBondContact NZ-OE2 2.82Å
150	E	91.9	Very high	95	Very high	161 Å²	161	60.3 Å²	60.3	75%	0.752	33%	0.331	S	S	*	.	S	Bend	trans	-99	-14.3	-174.4	-61.3	-170.4	162.3	0	0	112.5	D148 N152	D148-E150 PolarHBondContact O-N 3.24Å; D148-E150 PolarHBondContact OD1-N 3.27Å; D148-E150 VanDerWaalsContact OD1-N 3.09Å; E150-N152 HydrophobicContact CB-CB 4.34Å; E150-N152 PolarHBondContact O-N 3.07Å; E150-N152 PolarHBondContact OE2-ND2 2.99Å
151	G	93.9	Very high	95	Very high	63 Å²	63	59.5 Å²	59.5	65%	0.649	33%	0.326	S	S	*	.	S	Bend	trans	66.1	26.1	-176.5	0	0	0	0	0	113	D148	D148-G151 VanDerWaalsContact CG-N 3.31Å; D148-G151 WeakPolarHBondContact OD1-CA 3.47Å; D148-G151 PolarHBondContact OD1-N 3.41Å; D148-G151 VanDerWaalsContact OD2-C 3.23Å; D148-G151 VanDerWaalsContact OD2-CA 3.27Å; D148-G151 WeakPolarHBondContact OD2-CA 3.36Å
152	N	93.8	Very high	95	Very high	83 Å²	83	65.2 Å²	65.2	44%	0.444	35%	0.352	S	S	.	.	S	Bend	trans	-96.5	-0.2	-173	71.2	11	0	0	0	113.4	D148 E150 T154	D148-N152 PolarHBondContact OD1-N 3.01Å; D148-N152 PolarHBondContact OD2-N 3.15Å; E150-N152 HydrophobicContact CB-CB 4.34Å; E150-N152 PolarHBondContact O-N 3.07Å; E150-N152 PolarHBondContact OE2-ND2 2.99Å; N152-T154 PolarHBondContact ND2-OG1 3.44Å; N152-T154 WeakPolarHBondContact OD1-CA 3.3Å; N152-T154 WeakPolarHBondContact OD1-CB 3.45Å; N152-T154 PolarHBondContact OD1-N 3.2Å; N152-T154 PolarHBondContact OD1-O 3.42Å; N152-T154 PolarHBondContact OD1-OG1 3.44Å
153	G	95.4	Very high	95	Very high	14 Å²	14	62.1 Å²	62.1	14%	0.144	34%	0.339	C	S	.	.	S	Bend	trans	88	11.8	-177.8	0	0	0	0	0	114.3	D148 N191 Y192	D148-G153 PolarHBondContact OD2-N 3.2Å; G153-N191 PolarHBondContact O-ND2 3.28Å; G153-Y192 VanDerWaalsContact CA-CE1 3.43Å; G153-Y192 WeakPolarHBondContact O-CD1 3.49Å; G153-Y192 WeakPolarHBondContact O-CE1 3.18Å
154	T	96.6	Very high	95	Very high	34 Å²	34	62.1 Å²	62.1	21%	0.209	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	154.8	-178.7	71.1	0	0	0	0	112.9	D148 N152 I190	D148-T154 VanDerWaalsContact CG-O 3.3Å; N152-T154 PolarHBondContact ND2-OG1 3.44Å; N152-T154 WeakPolarHBondContact OD1-CA 3.3Å; N152-T154 WeakPolarHBondContact OD1-CB 3.45Å; N152-T154 PolarHBondContact OD1-N 3.2Å; N152-T154 PolarHBondContact OD1-O 3.42Å; N152-T154 PolarHBondContact OD1-OG1 3.44Å; T154-I190 CarbonylContact C-O 3.58Å; T154-I190 WeakPolarHBondContact CA-O 3.44Å; T154-I190 WeakPolarHBondContact CB-O 3.2Å
155	I	96.6	Very high	95	Very high	5 Å²	5	61.9 Å²	61.9	3%	0.026	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	150	173.9	56.7	-178.2	0	0	0	109.8	L144 F147 D148 G157 L160 C189 I190 Y192	L144-I155 HydrophobicContact CD2-CD1 4.37Å; F147-I155 HydrophobicContact CB-CG2 4.02Å; D148-I155 HydrophobicContact CB-CG2 4.05Å; I155-G157 PolarHBondContact O-N 2.99Å; I155-L160 HydrophobicContact CD1-CB 3.82Å; I155-L160 HydrophobicContact CD1-CD1 3.82Å; I155-L160 HydrophobicContact CD1-CD2 3.99Å; I155-L160 HydrophobicContact CD1-CG 4.08Å; I155-L160 HydrophobicContact CG1-CB 4.38Å; I155-C189 CarbonylContact O-C 3.52Å; I155-C189 WeakPolarHBondContact O-CA 3.4Å; I155-I190 HydrophobicContact CG1-CB 4.3Å; I155-I190 PolarHBondContact N-O 3.39Å; I155-I190 PolarHBondContact O-N 3.25Å; I155-Y192 HydrophobicContact CG2-CD1 4.03Å
156	M	96.1	Very high	94.9	Very high	97 Å²	97	59.1 Å²	59.1	48%	0.478	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	130.7	175.4	-170.4	68.8	63	0	0	109.3	A158 E159 L160	M156-A158 HydrophobicContact CG-CB 4.17Å; M156-A158 PolarHBondContact O-N 3.42Å; M156-E159 HydrophobicContact CB-CB 4.03Å; M156-E159 WeakPolarHBondContact O-CA 3.43Å; M156-E159 WeakPolarHBondContact O-CB 3.49Å; M156-E159 PolarHBondContact O-N 3.4Å; M156-L160 PolarHBondContact O-N 3.21Å
157	G	95.7	Very high	94.8	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-57.3	-39.8	-179.7	0	0	0	0	0	112.5	I155 E159 L160 R161 G188	I155-G157 PolarHBondContact O-N 2.99Å; G157-E159 VanDerWaalsContact C-N 3.29Å; G157-E159 PolarHBondContact O-N 2.99Å; G157-L160 PolarHBondContact O-N 2.92Å; G157-R161 WeakPolarHBondContact O-CD 3.39Å; G157-R161 WeakPolarHBondContact O-CG 3.34Å; G157-R161 PolarHBondContact O-N 2.98Å; G157-G188 PolarHBondContact N-O 3.42Å
158	A	95.4	Very high	94.8	Very high	67 Å²	67	59.8 Å²	59.8	55%	0.554	35%	0.345	S	S	*	.	H	α-helix	trans	-60.2	-35	173.2	0	0	0	0	0	113.5	M156 H162	M156-A158 HydrophobicContact CG-CB 4.17Å; M156-A158 PolarHBondContact O-N 3.42Å; A158-H162 PolarHBondContact O-N 2.65Å
159	E	94.8	Very high	94.7	Very high	54 Å²	54	63.1 Å²	63.1	25%	0.252	36%	0.36	S	S	.	.	H	α-helix	trans	-72.1	-44.2	177.2	-176.3	159.4	-156.8	0	0	110.6	K149 M156 G157 R161 H162 V163	K149-E159 IonicContact NZ-OE1 2.72Å; K149-E159 PolarHBondContact NZ-OE1 2.91Å; K149-E159 IonicContact NZ-OE2 2.8Å; K149-E159 PolarHBondContact NZ-OE2 2.82Å; M156-E159 HydrophobicContact CB-CB 4.03Å; M156-E159 WeakPolarHBondContact O-CA 3.43Å; M156-E159 WeakPolarHBondContact O-CB 3.49Å; M156-E159 PolarHBondContact O-N 3.4Å; G157-E159 VanDerWaalsContact C-N 3.29Å; G157-E159 PolarHBondContact O-N 2.99Å; E159-R161 PolarHBondContact O-N 3.29Å; E159-H162 PolarHBondContact O-N 2.87Å; E159-V163 WeakPolarHBondContact O-CG2 3.28Å; E159-V163 PolarHBondContact O-N 3.08Å
160	L	95.6	Very high	94.9	Very high	2 Å²	2	64 Å²	64	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-61.1	-43.2	175.8	-176.8	57.2	0	0	0	111.9	L144 I155 M156 G157 H162 V163 L164 M180 I190 F195	L144-L160 HydrophobicContact CD2-CD1 3.72Å; I155-L160 HydrophobicContact CD1-CB 3.82Å; I155-L160 HydrophobicContact CD1-CD1 3.82Å; I155-L160 HydrophobicContact CD1-CD2 3.99Å; I155-L160 HydrophobicContact CD1-CG 4.08Å; I155-L160 HydrophobicContact CG1-CB 4.38Å; M156-L160 PolarHBondContact O-N 3.21Å; G157-L160 PolarHBondContact O-N 2.92Å; L160-H162 VanDerWaalsContact C-N 3.33Å; L160-H162 PolarHBondContact O-N 3.2Å; L160-V163 PolarHBondContact O-N 2.98Å; L160-L164 HydrophobicContact CD1-CD1 4.14Å; L160-L164 HydrophobicContact CD1-CG 4.12Å; L160-L164 HydrophobicContact CG-CD1 3.98Å; L160-L164 HydrophobicContact CG-CG 4.41Å; L160-L164 WeakPolarHBondContact O-CG 3.41Å; L160-L164 PolarHBondContact O-N 2.94Å; L160-M180 HydrophobicContact CB-CE 4.34Å; L160-M180 HydrophobicContact CB-SD 4.48Å; L160-M180 HydrophobicContact CD2-CE 4.2Å; L160-M180 HydrophobicContact CD2-SD 3.62Å; L160-M180 HydrophobicContact CG-CE 4.46Å; L160-M180 HydrophobicContact CG-SD 3.98Å; L160-I190 HydrophobicContact CB-CD1 4.45Å; L160-I190 HydrophobicContact CD2-CD1 3.76Å; L160-I190 HydrophobicContact CD2-CG2 4.39Å; L160-F195 HydrophobicContact CD2-CD1 4.3Å; L160-F195 HydrophobicContact CD2-CE1 4.06Å; L160-F195 HydrophobicContact CD2-CZ 4.2Å
161	R	96.2	Very high	95.1	Very high	63 Å²	63	59 Å²	59	24%	0.238	34%	0.336	C	S	.	.	H	α-helix	trans	-56	-48.8	175.9	-71.8	164.6	178.8	-81.9	3.7	111.5	G157 E159 V163 L164 A165 V176 D177 M180 E184	G157-R161 WeakPolarHBondContact O-CD 3.39Å; G157-R161 WeakPolarHBondContact O-CG 3.34Å; G157-R161 PolarHBondContact O-N 2.98Å; E159-R161 PolarHBondContact O-N 3.29Å; R161-V163 VanDerWaalsContact C-N 3.32Å; R161-V163 PolarHBondContact O-N 3.34Å; R161-L164 PolarHBondContact O-N 3.09Å; R161-A165 WeakPolarHBondContact O-CB 3.49Å; R161-A165 PolarHBondContact O-N 3.35Å; R161-A165 VanDerWaalsContact O-N 3.09Å; R161-V176 HydrophobicContact CB-CG1 3.98Å; R161-V176 HydrophobicContact CG-CG1 3.75Å; R161-D177 IonicContact CZ-OD1 3.79Å; R161-D177 IonicContact NH1-OD1 2.65Å; R161-D177 PolarHBondContact NH1-OD1 3.35Å; R161-M180 HydrophobicContact CG-CE 3.67Å; R161-M180 HydrophobicContact CG-CG 4.06Å; R161-M180 HydrophobicContact CG-SD 4.4Å; R161-E184 IonicContact CZ-OE1 3.51Å; R161-E184 IonicContact NE-OE1 2.93Å; R161-E184 PolarHBondContact NE-OE1 3.24Å; R161-E184 IonicContact NH2-OE1 3.19Å; R161-E184 PolarHBondContact NH2-OE1 3.16Å
162	H	95.4	Very high	95.2	Very high	125 Å²	125	59.7 Å²	59.7	58%	0.579	33%	0.328	S	S	*	.	H	α-helix	trans	-61.9	-42.1	178.9	-174.5	68.4	0	0	0	111.9	A158 E159 L160 A165 T166	A158-H162 PolarHBondContact O-N 2.65Å; E159-H162 PolarHBondContact O-N 2.87Å; L160-H162 VanDerWaalsContact C-N 3.33Å; L160-H162 PolarHBondContact O-N 3.2Å; H162-A165 PolarHBondContact O-N 3.03Å; H162-T166 WeakPolarHBondContact O-CB 3.47Å; H162-T166 WeakPolarHBondContact O-CG2 3.33Å; H162-T166 PolarHBondContact O-N 3.08Å; H162-T166 VanDerWaalsContact O-N 3.13Å; H162-T166 PolarHBondContact O-OG1 3.11Å
163	V	94.8	Very high	95.2	Very high	20 Å²	20	61.5 Å²	61.5	12%	0.121	33%	0.334	C	S	.	.	H	α-helix	trans	-59.6	-50.6	177.7	164.5	0	0	0	0	111.1	F147 E159 L160 R161 A165 T166 L167	F147-V163 HydrophobicContact CD1-CG2 3.73Å; F147-V163 HydrophobicContact CD2-CG2 4.41Å; F147-V163 HydrophobicContact CE1-CG1 4.48Å; F147-V163 HydrophobicContact CE1-CG2 3.37Å; F147-V163 HydrophobicContact CE2-CG1 3.92Å; F147-V163 HydrophobicContact CE2-CG2 4.11Å; F147-V163 HydrophobicContact CG-CG2 4.24Å; F147-V163 HydrophobicContact CZ-CB 4.38Å; F147-V163 HydrophobicContact CZ-CG1 3.82Å; F147-V163 HydrophobicContact CZ-CG2 3.59Å; E159-V163 WeakPolarHBondContact O-CG2 3.28Å; E159-V163 PolarHBondContact O-N 3.08Å; L160-V163 PolarHBondContact O-N 2.98Å; R161-V163 VanDerWaalsContact C-N 3.32Å; R161-V163 PolarHBondContact O-N 3.34Å; V163-A165 VanDerWaalsContact C-N 3.31Å; V163-A165 PolarHBondContact O-N 2.91Å; V163-T166 PolarHBondContact O-N 3.37Å; V163-L167 HydrophobicContact CG1-CD1 4.17Å; V163-L167 HydrophobicContact CG2-CD1 4.44Å; V163-L167 PolarHBondContact O-N 3.4Å
164	L	95.8	Very high	95.3	Very high	40 Å²	40	66.3 Å²	66.3	21%	0.209	36%	0.356	C	S	.	.	H	α-helix	trans	-65.4	-30.8	-178.6	-66.4	171.4	0	0	0	113.5	L160 R161 M171 V176 L179 M180	L160-L164 HydrophobicContact CD1-CD1 4.14Å; L160-L164 HydrophobicContact CD1-CG 4.12Å; L160-L164 HydrophobicContact CG-CD1 3.98Å; L160-L164 HydrophobicContact CG-CG 4.41Å; L160-L164 WeakPolarHBondContact O-CG 3.41Å; L160-L164 PolarHBondContact O-N 2.94Å; R161-L164 PolarHBondContact O-N 3.09Å; L164-M171 HydrophobicContact CB-SD 4.24Å; L164-M171 HydrophobicContact CD2-SD 4.34Å; L164-M171 PolarHBondContact O-N 3.15Å; L164-M171 VanDerWaalsContact O-N 3.12Å; L164-V176 HydrophobicContact CB-CG2 4Å; L164-L179 HydrophobicContact CD1-CD2 3.97Å; L164-M180 HydrophobicContact CD1-SD 4.42Å
165	A	95.6	Very high	95.2	Very high	17 Å²	17	68.6 Å²	68.6	14%	0.14	37%	0.365	C	S	.	.	H	α-helix	trans	-83.8	-15.3	178.6	0	0	0	0	0	113.9	R161 H162 V163 R170	R161-A165 WeakPolarHBondContact O-CB 3.49Å; R161-A165 PolarHBondContact O-N 3.35Å; R161-A165 VanDerWaalsContact O-N 3.09Å; H162-A165 PolarHBondContact O-N 3.03Å; V163-A165 VanDerWaalsContact C-N 3.31Å; V163-A165 PolarHBondContact O-N 2.91Å; A165-R170 WeakPolarHBondContact O-CB 3.33Å; A165-R170 WeakPolarHBondContact O-CD 3.2Å; A165-R170 WeakPolarHBondContact O-CG 3.45Å
166	T	93.3	Very high	95.2	Very high	51 Å²	51	68.4 Å²	68.4	31%	0.313	36%	0.364	S	S	.	.	H	α-helix	trans	-121	-36.4	-170.7	61.2	0	0	0	0	115.4	H162 V163 R170	H162-T166 WeakPolarHBondContact O-CB 3.47Å; H162-T166 WeakPolarHBondContact O-CG2 3.33Å; H162-T166 PolarHBondContact O-N 3.08Å; H162-T166 VanDerWaalsContact O-N 3.13Å; H162-T166 PolarHBondContact O-OG1 3.11Å; V163-T166 PolarHBondContact O-N 3.37Å; T166-R170 PolarHBondContact O-NE 2.99Å; T166-R170 VanDerWaalsContact O-NE 3.15Å
167	L	93.3	Very high	95.2	Very high	102 Å²	102	67.6 Å²	67.6	53%	0.534	36%	0.361	S	S	.	.	S	Bend	trans	-97	145.7	-175.5	-63.2	179.8	0	0	0	111.4	F147 V163	F147-L167 HydrophobicContact CE1-CD1 4.46Å; F147-L167 HydrophobicContact CZ-CD1 4.03Å; V163-L167 HydrophobicContact CG1-CD1 4.17Å; V163-L167 HydrophobicContact CG2-CD1 4.44Å; V163-L167 PolarHBondContact O-N 3.4Å
168	G	93.4	Very high	95.2	Very high	77 Å²	77	75.9 Å²	75.9	79%	0.794	39%	0.392	S	S	*	.	S	Bend	trans	66.2	-140.6	178.8	0	0	0	0	0	113.6	R170	G168-R170 PolarHBondContact O-N 2.8Å
169	E	93.8	Very high	95.2	Very high	86 Å²	86	75 Å²	75	40%	0.402	38%	0.378	S	S	.	.	S	Bend	trans	-79	101.2	170.9	-64.8	-168.5	158.6	0	0	109.4	N96 A97 M171	N96-E169 WeakPolarHBondContact CB-OE1 3.21Å; N96-E169 VanDerWaalsContact CB-OE2 3.31Å; N96-E169 WeakPolarHBondContact CB-OE2 3.35Å; N96-E169 VanDerWaalsContact N-CD 3.34Å; N96-E169 PolarHBondContact N-OE1 3.48Å; N96-E169 VanDerWaalsContact N-OE1 3.15Å; N96-E169 PolarHBondContact N-OE2 3.18Å; N96-E169 PolarHBondContact ND2-OE2 3.22Å; N96-E169 VanDerWaalsContact ND2-OE2 3.08Å; A97-E169 PolarHBondContact N-OE1 3.08Å; E169-M171 PolarHBondContact O-N 2.72Å
170	R	95.4	Very high	95.2	Very high	182 Å²	182	72.4 Å²	72.4	69%	0.687	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-63.5	130.3	-171.2	-61	179.2	-176.1	162.4	3.4	111.7	A165 T166 G168	A165-R170 WeakPolarHBondContact O-CB 3.33Å; A165-R170 WeakPolarHBondContact O-CD 3.2Å; A165-R170 WeakPolarHBondContact O-CG 3.45Å; T166-R170 PolarHBondContact O-NE 2.99Å; T166-R170 VanDerWaalsContact O-NE 3.15Å; G168-R170 PolarHBondContact O-N 2.8Å
171	M	95.2	Very high	95.1	Very high	56 Å²	56	75.5 Å²	75.5	28%	0.276	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-81.7	150.2	167.9	-62.6	-179.7	70	0	0	110.4	L164 E169 E175 V176 L179	L164-M171 HydrophobicContact CB-SD 4.24Å; L164-M171 HydrophobicContact CD2-SD 4.34Å; L164-M171 PolarHBondContact O-N 3.15Å; L164-M171 VanDerWaalsContact O-N 3.12Å; E169-M171 PolarHBondContact O-N 2.72Å; M171-E175 HydrophobicContact CB-CB 4.26Å; M171-E175 HydrophobicContact CE-CB 3.63Å; M171-V176 HydrophobicContact CB-CG2 3.61Å; M171-V176 HydrophobicContact SD-CG2 4.43Å; M171-L179 HydrophobicContact CE-CB 4.47Å; M171-L179 HydrophobicContact CE-CD2 3.91Å; M171-L179 HydrophobicContact SD-CD2 4.11Å
172	T	96.1	Very high	95	Very high	78 Å²	78	76.3 Å²	76.3	48%	0.479	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-72.1	153.9	167.5	61.2	0	0	0	0	110.4	D174 E175 V176	T172-D174 PolarHBondContact O-N 3.28Å; T172-E175 WeakPolarHBondContact CB-OE2 3.05Å; T172-E175 PolarHBondContact N-OE2 3Å; T172-E175 WeakPolarHBondContact O-CB 3.21Å; T172-E175 PolarHBondContact O-N 2.93Å; T172-E175 WeakPolarHBondContact OG1-CG 3.39Å; T172-E175 PolarHBondContact OG1-N 3.05Å; T172-E175 PolarHBondContact OG1-OE2 2.65Å; T172-V176 WeakPolarHBondContact O-CG2 3.24Å; T172-V176 PolarHBondContact O-N 3.35Å
173	E	94.9	Very high	95	Very high	122 Å²	122	72.6 Å²	72.6	57%	0.57	40%	0.403	S	S	*	.	H	α-helix	trans	-52.9	-41.3	177.2	-62.9	-65.8	154	0	0	111.6	E175 V176 D177	E173-E175 VanDerWaalsContact C-N 3.34Å; E173-E175 PolarHBondContact O-N 2.87Å; E173-V176 PolarHBondContact O-N 3.17Å; E173-D177 WeakPolarHBondContact O-CB 3.45Å; E173-D177 PolarHBondContact O-N 3.35Å
174	D	96.9	Very high	95	Very high	115 Å²	115	75.2 Å²	75.2	62%	0.615	41%	0.414	S	S	*	.	H	α-helix	trans	-65.1	-33.1	177.9	-67.8	-29.2	0	0	0	113.3	T172 R178	T172-D174 PolarHBondContact O-N 3.28Å; D174-R178 VanDerWaalsContact O-CG 3.28Å; D174-R178 WeakPolarHBondContact O-CG 3.48Å; D174-R178 PolarHBondContact O-N 2.9Å; D174-R178 PolarHBondContact O-NE 3.25Å
175	E	95.9	Very high	94.9	Very high	81 Å²	81	77 Å²	77	38%	0.379	42%	0.423	S	S	.	.	H	α-helix	trans	-73.2	-41.4	174.5	-71	165.1	140.2	0	0	111.1	M171 T172 E173 R178 L179	M171-E175 HydrophobicContact CB-CB 4.26Å; M171-E175 HydrophobicContact CE-CB 3.63Å; T172-E175 WeakPolarHBondContact CB-OE2 3.05Å; T172-E175 PolarHBondContact N-OE2 3Å; T172-E175 WeakPolarHBondContact O-CB 3.21Å; T172-E175 PolarHBondContact O-N 2.93Å; T172-E175 WeakPolarHBondContact OG1-CG 3.39Å; T172-E175 PolarHBondContact OG1-N 3.05Å; T172-E175 PolarHBondContact OG1-OE2 2.65Å; E173-E175 VanDerWaalsContact C-N 3.34Å; E173-E175 PolarHBondContact O-N 2.87Å; E175-R178 PolarHBondContact O-N 3.17Å; E175-L179 WeakPolarHBondContact O-CB 3.39Å; E175-L179 PolarHBondContact O-N 2.77Å
176	V	96.4	Very high	94.9	Very high	1 Å²	1	81.3 Å²	81.3	1%	0.006	46%	0.459	C	S	.	.	H	α-helix	trans	-62.6	-47	175.7	176.1	0	0	0	0	110.4	R161 L164 M171 T172 E173 R178 L179 M180	R161-V176 HydrophobicContact CB-CG1 3.98Å; R161-V176 HydrophobicContact CG-CG1 3.75Å; L164-V176 HydrophobicContact CB-CG2 4Å; M171-V176 HydrophobicContact CB-CG2 3.61Å; M171-V176 HydrophobicContact SD-CG2 4.43Å; T172-V176 WeakPolarHBondContact O-CG2 3.24Å; T172-V176 PolarHBondContact O-N 3.35Å; E173-V176 PolarHBondContact O-N 3.17Å; V176-R178 VanDerWaalsContact C-N 3.3Å; V176-R178 PolarHBondContact O-N 2.94Å; V176-L179 PolarHBondContact O-N 2.8Å; V176-M180 HydrophobicContact CG1-CG 3.84Å; V176-M180 VanDerWaalsContact O-CB 3.24Å; V176-M180 WeakPolarHBondContact O-CB 3.5Å; V176-M180 WeakPolarHBondContact O-CG 3.27Å; V176-M180 PolarHBondContact O-N 3.09Å
177	D	95.5	Very high	94.8	Very high	80 Å²	80	85 Å²	85	43%	0.428	48%	0.477	S	S	.	.	H	α-helix	trans	-58.7	-42	179	-84	-20.3	0	0	0	112.4	R161 E173 A181	R161-D177 IonicContact CZ-OD1 3.79Å; R161-D177 IonicContact NH1-OD1 2.65Å; R161-D177 PolarHBondContact NH1-OD1 3.35Å; E173-D177 WeakPolarHBondContact O-CB 3.45Å; E173-D177 PolarHBondContact O-N 3.35Å; D177-A181 PolarHBondContact O-N 3.44Å; D177-A181 VanDerWaalsContact O-N 3.17Å
178	R	95.6	Very high	94.9	Very high	174 Å²	174	81.2 Å²	81.2	66%	0.657	46%	0.463	S	S	*	.	H	α-helix	trans	-65.5	-42.6	175.9	-76.4	-179.5	-74.1	174.2	0.4	112.2	D174 E175 V176	D174-R178 VanDerWaalsContact O-CG 3.28Å; D174-R178 WeakPolarHBondContact O-CG 3.48Å; D174-R178 PolarHBondContact O-N 2.9Å; D174-R178 PolarHBondContact O-NE 3.25Å; E175-R178 PolarHBondContact O-N 3.17Å; V176-R178 VanDerWaalsContact C-N 3.3Å; V176-R178 PolarHBondContact O-N 2.94Å
179	L	95.2	Very high	95	Very high	48 Å²	48	78.8 Å²	78.8	25%	0.251	43%	0.433	S	S	.	.	H	α-helix	trans	-67.3	-37	179.1	178.4	60	0	0	0	112.5	L164 M171 E175 V176 F195 I199	L164-L179 HydrophobicContact CD1-CD2 3.97Å; M171-L179 HydrophobicContact CE-CB 4.47Å; M171-L179 HydrophobicContact CE-CD2 3.91Å; M171-L179 HydrophobicContact SD-CD2 4.11Å; E175-L179 WeakPolarHBondContact O-CB 3.39Å; E175-L179 PolarHBondContact O-N 2.77Å; V176-L179 PolarHBondContact O-N 2.8Å; L179-F195 HydrophobicContact CD1-CE2 4.19Å; L179-F195 HydrophobicContact CD1-CZ 4.09Å; L179-F195 HydrophobicContact CD2-CZ 3.99Å; L179-F195 HydrophobicContact CG-CE2 4.12Å; L179-F195 HydrophobicContact CG-CZ 3.87Å; L179-I199 HydrophobicContact CD1-CG2 3.87Å
180	M	94.3	Very high	95.2	Very high	1 Å²	1	74.7 Å²	74.7	1%	0.005	41%	0.414	C	S	.	.	H	α-helix	trans	-84.9	-11.1	-174.5	-66.2	-73.9	-62.2	0	0	113.3	L160 R161 L164 V176 G182 Q183 E184 I190	L160-M180 HydrophobicContact CB-CE 4.34Å; L160-M180 HydrophobicContact CB-SD 4.48Å; L160-M180 HydrophobicContact CD2-CE 4.2Å; L160-M180 HydrophobicContact CD2-SD 3.62Å; L160-M180 HydrophobicContact CG-CE 4.46Å; L160-M180 HydrophobicContact CG-SD 3.98Å; R161-M180 HydrophobicContact CG-CE 3.67Å; R161-M180 HydrophobicContact CG-CG 4.06Å; R161-M180 HydrophobicContact CG-SD 4.4Å; L164-M180 HydrophobicContact CD1-SD 4.42Å; V176-M180 HydrophobicContact CG1-CG 3.84Å; V176-M180 VanDerWaalsContact O-CB 3.24Å; V176-M180 WeakPolarHBondContact O-CB 3.5Å; V176-M180 WeakPolarHBondContact O-CG 3.27Å; V176-M180 PolarHBondContact O-N 3.09Å; M180-G182 PolarHBondContact O-N 3.48Å; M180-G182 VanDerWaalsContact O-N 3.14Å; M180-Q183 PolarHBondContact O-N 2.88Å; M180-Q183 VanDerWaalsContact O-N 3.13Å; M180-E184 HydrophobicContact CE-CG 4.44Å; M180-I190 HydrophobicContact CE-CD1 3.05Å; M180-I190 HydrophobicContact CE-CG1 4.46Å; M180-I190 HydrophobicContact SD-CD1 3.88Å
181	A	94.3	Very high	95.3	Very high	67 Å²	67	69.3 Å²	69.3	55%	0.554	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	117.9	-178	0	0	0	0	0	111.5	D177 Q183	D177-A181 PolarHBondContact O-N 3.44Å; D177-A181 VanDerWaalsContact O-N 3.17Å; A181-Q183 VanDerWaalsContact C-N 3.3Å; A181-Q183 PolarHBondContact O-N 3.29Å
182	G	93.3	Very high	95.3	Very high	80 Å²	80	67.2 Å²	67.2	83%	0.825	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	8	177.9	0	0	0	0	0	115.7	M180	M180-G182 PolarHBondContact O-N 3.48Å; M180-G182 VanDerWaalsContact O-N 3.14Å
183	Q	95.2	Very high	95.3	Very high	46 Å²	46	65.5 Å²	65.5	22%	0.215	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-24.1	178.2	-58.4	-58.5	-49.2	0	0	113.2	M180 A181 I190 F195 H198	M180-Q183 PolarHBondContact O-N 2.88Å; M180-Q183 VanDerWaalsContact O-N 3.13Å; A181-Q183 VanDerWaalsContact C-N 3.3Å; A181-Q183 PolarHBondContact O-N 3.29Å; Q183-I190 HydrophobicContact CB-CD1 4.49Å; Q183-F195 HydrophobicContact CB-CD2 4.24Å; Q183-F195 HydrophobicContact CG-CD2 3.85Å; Q183-F195 HydrophobicContact CG-CE2 4.05Å; Q183-H198 PolarHBondContact NE2-CD2 2.65Å; Q183-H198 VanDerWaalsContact NE2-CD2 3.29Å; Q183-H198 PolarHBondContact NE2-NE2 2.84Å
184	E	95.8	Very high	95.3	Very high	75 Å²	75	63 Å²	63	35%	0.35	37%	0.373	S	S	.	.			trans	-78.5	137.9	179.3	-68	172.8	-167.7	0	0	111.2	R161 M180 C189 I190	R161-E184 IonicContact CZ-OE1 3.51Å; R161-E184 IonicContact NE-OE1 2.93Å; R161-E184 PolarHBondContact NE-OE1 3.24Å; R161-E184 IonicContact NH2-OE1 3.19Å; R161-E184 PolarHBondContact NH2-OE1 3.16Å; M180-E184 HydrophobicContact CE-CG 4.44Å; E184-C189 WeakPolarHBondContact CA-O 3.39Å; E184-I190 HydrophobicContact CB-CG1 4.5Å; E184-I190 HydrophobicContact CG-CD1 3.88Å; E184-I190 HydrophobicContact CG-CG1 3.81Å
185	D	94.1	Very high	95.3	Very high	77 Å²	77	57.8 Å²	57.8	41%	0.412	35%	0.345	S	S	.	.			trans	-80.6	-176.6	172.1	75.7	7.1	0	0	0	112.2	N187 G188 C189	D185-N187 PolarHBondContact O-N 3.21Å; D185-N187 VanDerWaalsContact O-N 3.07Å; D185-N187 VanDerWaalsContact OD1-CA 3.31Å; D185-N187 WeakPolarHBondContact OD1-CA 3.49Å; D185-N187 WeakPolarHBondContact OD1-CB 3.45Å; D185-N187 PolarHBondContact OD1-N 2.91Å; D185-G188 PolarHBondContact O-N 2.94Å; D185-G188 PolarHBondContact OD1-N 3.22Å; D185-G188 VanDerWaalsContact OD1-N 3.09Å; D185-C189 PolarHBondContact N-O 2.94Å; D185-C189 PolarHBondContact OD1-N 3.49Å
186	A	94.2	Very high	95.3	Very high	108 Å²	108	54 Å²	54	89%	0.893	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.5	179.7	0	0	0	0	0	114.4
187	N	92.9	Very high	95.3	Very high	130 Å²	130	59.8 Å²	59.8	70%	0.695	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	0.3	177.7	-53.9	-53.2	0	0	0	112.3	D185 C189	D185-N187 PolarHBondContact O-N 3.21Å; D185-N187 VanDerWaalsContact O-N 3.07Å; D185-N187 VanDerWaalsContact OD1-CA 3.31Å; D185-N187 WeakPolarHBondContact OD1-CA 3.49Å; D185-N187 WeakPolarHBondContact OD1-CB 3.45Å; D185-N187 PolarHBondContact OD1-N 2.91Å; N187-C189 VanDerWaalsContact C-N 3.33Å
188	G	94.7	Very high	95.2	Very high	22 Å²	22	60.5 Å²	60.5	23%	0.227	35%	0.353	C	S	.	.	S	Bend	trans	77	18.4	-174.3	0	0	0	0	0	113.5	G157 D185	G157-G188 PolarHBondContact N-O 3.42Å; D185-G188 PolarHBondContact O-N 2.94Å; D185-G188 PolarHBondContact OD1-N 3.22Å; D185-G188 VanDerWaalsContact OD1-N 3.09Å
189	C	95.9	Very high	95.1	Very high	25 Å²	25	55.1 Å²	55.1	17%	0.169	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	153.8	178.4	-67.4	0	0	0	0	111.2	I155 E184 D185 N187	I155-C189 CarbonylContact O-C 3.52Å; I155-C189 WeakPolarHBondContact O-CA 3.4Å; E184-C189 WeakPolarHBondContact CA-O 3.39Å; D185-C189 PolarHBondContact N-O 2.94Å; D185-C189 PolarHBondContact OD1-N 3.49Å; N187-C189 VanDerWaalsContact C-N 3.33Å
190	I	96.9	Very high	94.9	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.1	-178.6	-62.5	172	0	0	0	108.9	T154 I155 L160 M180 Q183 E184 Y192 F195	T154-I190 CarbonylContact C-O 3.58Å; T154-I190 WeakPolarHBondContact CA-O 3.44Å; T154-I190 WeakPolarHBondContact CB-O 3.2Å; I155-I190 HydrophobicContact CG1-CB 4.3Å; I155-I190 PolarHBondContact N-O 3.39Å; I155-I190 PolarHBondContact O-N 3.25Å; L160-I190 HydrophobicContact CB-CD1 4.45Å; L160-I190 HydrophobicContact CD2-CD1 3.76Å; L160-I190 HydrophobicContact CD2-CG2 4.39Å; M180-I190 HydrophobicContact CE-CD1 3.05Å; M180-I190 HydrophobicContact CE-CG1 4.46Å; M180-I190 HydrophobicContact SD-CD1 3.88Å; Q183-I190 HydrophobicContact CB-CD1 4.49Å; E184-I190 HydrophobicContact CB-CG1 4.5Å; E184-I190 HydrophobicContact CG-CD1 3.88Å; E184-I190 HydrophobicContact CG-CG1 3.81Å; I190-Y192 PolarHBondContact O-N 3.41Å; I190-Y192 VanDerWaalsContact O-N 3.16Å; I190-F195 HydrophobicContact CG2-CB 3.91Å; I190-F195 HydrophobicContact CG2-CD2 4.45Å; I190-F195 HydrophobicContact CG2-CG 4.26Å
191	N	97.1	Very high	94.6	Very high	68 Å²	68	61.4 Å²	61.4	36%	0.364	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	102.6	167	-174.8	-75.5	0	0	0	109	G153 T193 S194 F195	G153-N191 PolarHBondContact O-ND2 3.28Å; N191-T193 PolarHBondContact O-N 2.8Å; N191-T193 WeakPolarHBondContact OD1-CB 3.39Å; N191-T193 PolarHBondContact OD1-N 2.94Å; N191-S194 PolarHBondContact O-N 3.25Å; N191-S194 PolarHBondContact OD1-N 3.21Å; N191-S194 PolarHBondContact OD1-OG 2.78Å; N191-F195 PolarHBondContact O-N 3.18Å
192	Y	96.3	Very high	93.6	Very high	13 Å²	13	64.5 Å²	64.5	5%	0.051	42%	0.416	C	S	.	.	H	α-helix	trans	-66.3	-25.2	-173	56.9	-101.9	0	0	0	113	V141 L144 D148 G153 I155 I190 F195 V196	V141-Y192 HydrophobicContact CG1-CD2 4.22Å; V141-Y192 HydrophobicContact CG1-CE2 3.86Å; L144-Y192 HydrophobicContact CB-CD2 4.28Å; L144-Y192 HydrophobicContact CB-CG 4.13Å; D148-Y192 HydrophobicContact CB-CE1 3.85Å; G153-Y192 VanDerWaalsContact CA-CE1 3.43Å; G153-Y192 WeakPolarHBondContact O-CD1 3.49Å; G153-Y192 WeakPolarHBondContact O-CE1 3.18Å; I155-Y192 HydrophobicContact CG2-CD1 4.03Å; I190-Y192 PolarHBondContact O-N 3.41Å; I190-Y192 VanDerWaalsContact O-N 3.16Å; Y192-F195 PolarHBondContact O-N 3.19Å; Y192-V196 WeakPolarHBondContact O-CG2 3.45Å; Y192-V196 PolarHBondContact O-N 3.14Å
193	T	96.1	Very high	93.7	Very high	42 Å²	42	63.7 Å²	63.7	26%	0.258	40%	0.395	S	S	.	.	H	α-helix	trans	-69.4	-44.4	176.2	-58.5	0	0	0	0	111	F137 N191 K197	F137-T193 HydrophobicContact CE1-CG2 4.44Å; F137-T193 HydrophobicContact CZ-CG2 3.76Å; N191-T193 PolarHBondContact O-N 2.8Å; N191-T193 WeakPolarHBondContact OD1-CB 3.39Å; N191-T193 PolarHBondContact OD1-N 2.94Å; T193-K197 WeakPolarHBondContact O-CG 3.49Å; T193-K197 PolarHBondContact O-N 3.41Å
194	S	95.6	Very high	93.6	Very high	69 Å²	69	64.6 Å²	64.6	48%	0.483	41%	0.405	S	S	.	.	H	α-helix	trans	-66.3	-39.8	173.6	-65	0	0	0	0	111.7	N191 K197 H198	N191-S194 PolarHBondContact O-N 3.25Å; N191-S194 PolarHBondContact OD1-N 3.21Å; N191-S194 PolarHBondContact OD1-OG 2.78Å; S194-K197 PolarHBondContact O-N 3.29Å; S194-H198 PolarHBondContact O-N 2.81Å
195	F	96.2	Very high	93.5	Very high	6 Å²	6	64.1 Å²	64.1	3%	0.026	41%	0.408	C	S	.	.	H	α-helix	trans	-59.6	-46.9	175	179.6	-105	0	0	0	111.9	L144 L160 L179 Q183 I190 N191 Y192 K197 H198 I199	L144-F195 HydrophobicContact CD1-CD1 4.11Å; L160-F195 HydrophobicContact CD2-CD1 4.3Å; L160-F195 HydrophobicContact CD2-CE1 4.06Å; L160-F195 HydrophobicContact CD2-CZ 4.2Å; L179-F195 HydrophobicContact CD1-CE2 4.19Å; L179-F195 HydrophobicContact CD1-CZ 4.09Å; L179-F195 HydrophobicContact CD2-CZ 3.99Å; L179-F195 HydrophobicContact CG-CE2 4.12Å; L179-F195 HydrophobicContact CG-CZ 3.87Å; Q183-F195 HydrophobicContact CB-CD2 4.24Å; Q183-F195 HydrophobicContact CG-CD2 3.85Å; Q183-F195 HydrophobicContact CG-CE2 4.05Å; I190-F195 HydrophobicContact CG2-CB 3.91Å; I190-F195 HydrophobicContact CG2-CD2 4.45Å; I190-F195 HydrophobicContact CG2-CG 4.26Å; N191-F195 PolarHBondContact O-N 3.18Å; Y192-F195 PolarHBondContact O-N 3.19Å; F195-K197 VanDerWaalsContact C-N 3.31Å; F195-K197 PolarHBondContact O-N 2.93Å; F195-H198 WeakPolarHBondContact O-CB 3.29Å; F195-H198 PolarHBondContact O-N 3.13Å; F195-H198 VanDerWaalsContact O-N 3.08Å; F195-I199 HydrophobicContact CD1-CG2 4.49Å; F195-I199 HydrophobicContact CE1-CD1 4.39Å; F195-I199 HydrophobicContact CE1-CG2 4.09Å; F195-I199 HydrophobicContact CE2-CG2 4.11Å; F195-I199 HydrophobicContact CZ-CG2 3.89Å; F195-I199 PolarHBondContact O-N 3.42Å
196	V	96.3	Very high	93.4	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-61.8	-38.3	176.7	174.7	0	0	0	0	111.6	F137 F140 V141 L144 Y192 H198 I199 L200	F137-V196 HydrophobicContact CD2-CB 4.34Å; F137-V196 HydrophobicContact CD2-CG1 3.48Å; F137-V196 VanDerWaalsContact CD2-CG1 3.48Å; F137-V196 HydrophobicContact CE2-CB 3.9Å; F137-V196 HydrophobicContact CE2-CG1 3.56Å; F137-V196 HydrophobicContact CG-CG1 4.45Å; F140-V196 HydrophobicContact CB-CB 4.45Å; F140-V196 HydrophobicContact CB-CG1 3.61Å; F140-V196 HydrophobicContact CB-CG2 3.85Å; F140-V196 HydrophobicContact CG-CG1 4.35Å; V141-V196 HydrophobicContact CG2-CB 4.19Å; V141-V196 HydrophobicContact CG2-CG1 4.26Å; V141-V196 HydrophobicContact CG2-CG2 4.19Å; L144-V196 HydrophobicContact CD1-CG2 3.68Å; Y192-V196 WeakPolarHBondContact O-CG2 3.45Å; Y192-V196 PolarHBondContact O-N 3.14Å; V196-H198 VanDerWaalsContact C-N 3.32Å; V196-H198 PolarHBondContact O-N 2.93Å; V196-I199 HydrophobicContact CG2-CD1 4.45Å; V196-I199 WeakPolarHBondContact O-CG1 3.47Å; V196-L200 HydrophobicContact CG1-CD1 3.83Å; V196-L200 HydrophobicContact CG1-CG 4.3Å; V196-L200 WeakPolarHBondContact O-CB 3.38Å; V196-L200 WeakPolarHBondContact O-CG 3.31Å; V196-L200 PolarHBondContact O-N 2.87Å; V196-L200 VanDerWaalsContact O-N 3.11Å
197	K	95.4	Very high	93.4	Very high	124 Å²	124	60.5 Å²	60.5	54%	0.539	38%	0.377	S	S	.	.	H	α-helix	trans	-63.6	-40.5	173.9	-70	178.9	-176.8	172.8	0	111.9	F137 T193 S194 F195 S201	F137-K197 HydrophobicContact CD2-CG 4.36Å; F137-K197 HydrophobicContact CE2-CD 4.48Å; F137-K197 HydrophobicContact CE2-CG 3.49Å; F137-K197 VanDerWaalsContact CE2-CG 3.49Å; F137-K197 HydrophobicContact CZ-CG 4Å; T193-K197 WeakPolarHBondContact O-CG 3.49Å; T193-K197 PolarHBondContact O-N 3.41Å; S194-K197 PolarHBondContact O-N 3.29Å; F195-K197 VanDerWaalsContact C-N 3.31Å; F195-K197 PolarHBondContact O-N 2.93Å; K197-S201 VanDerWaalsContact O-CB 3.29Å; K197-S201 WeakPolarHBondContact O-CB 3.44Å; K197-S201 PolarHBondContact O-N 2.98Å; K197-S201 PolarHBondContact O-OG 3.36Å
198	H	94.1	Very high	93.4	Very high	94 Å²	94	55.9 Å²	55.9	44%	0.435	36%	0.356	S	S	.	.	H	α-helix	trans	-61.3	-51.2	178.5	178.9	60.4	0	0	0	111.1	Q183 S194 F195 V196 L200 S201	Q183-H198 PolarHBondContact NE2-CD2 2.65Å; Q183-H198 VanDerWaalsContact NE2-CD2 3.29Å; Q183-H198 PolarHBondContact NE2-NE2 2.84Å; S194-H198 PolarHBondContact O-N 2.81Å; F195-H198 WeakPolarHBondContact O-CB 3.29Å; F195-H198 PolarHBondContact O-N 3.13Å; F195-H198 VanDerWaalsContact O-N 3.08Å; V196-H198 VanDerWaalsContact C-N 3.32Å; V196-H198 PolarHBondContact O-N 2.93Å; H198-L200 PolarHBondContact O-N 3.09Å; H198-S201 PolarHBondContact O-N 2.8Å; H198-S201 PolarHBondContact O-OG 3.07Å
199	I	93.1	Very high	93.3	Very high	62 Å²	62	58.3 Å²	58.3	32%	0.318	37%	0.365	S	S	.	.	H	α-helix	trans	-65.5	-34.6	-178.4	67.3	-177.7	0	0	0	113.1	L179 F195 V196 S201	L179-I199 HydrophobicContact CD1-CG2 3.87Å; F195-I199 HydrophobicContact CD1-CG2 4.49Å; F195-I199 HydrophobicContact CE1-CD1 4.39Å; F195-I199 HydrophobicContact CE1-CG2 4.09Å; F195-I199 HydrophobicContact CE2-CG2 4.11Å; F195-I199 HydrophobicContact CZ-CG2 3.89Å; F195-I199 PolarHBondContact O-N 3.42Å; V196-I199 HydrophobicContact CG2-CD1 4.45Å; V196-I199 WeakPolarHBondContact O-CG1 3.47Å; I199-S201 VanDerWaalsContact C-N 3.3Å
200	L	91.4	Very high	93.1	Very high	89 Å²	89	60.8 Å²	60.8	47%	0.466	38%	0.38	S	S	.	.	H	α-helix	trans	-81.9	-8.6	179.6	-66.2	-179.7	0	0	0	113.6	F137 F140 V196 H198	F137-L200 HydrophobicContact CB-CD1 4.25Å; F137-L200 HydrophobicContact CD2-CD1 4.06Å; F140-L200 HydrophobicContact CD2-CD1 4.38Å; F140-L200 HydrophobicContact CD2-CD2 4.46Å; F140-L200 HydrophobicContact CE2-CD2 4.19Å; V196-L200 HydrophobicContact CG1-CD1 3.83Å; V196-L200 HydrophobicContact CG1-CG 4.3Å; V196-L200 WeakPolarHBondContact O-CB 3.38Å; V196-L200 WeakPolarHBondContact O-CG 3.31Å; V196-L200 PolarHBondContact O-N 2.87Å; V196-L200 VanDerWaalsContact O-N 3.11Å; H198-L200 PolarHBondContact O-N 3.09Å
201	S	88.7	Confident	92.8	Very high	91 Å²	91	65.8 Å²	65.8	64%	0.636	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-6.8	178.5	69	0	0	0	0	114.4	K197 H198 I199	K197-S201 VanDerWaalsContact O-CB 3.29Å; K197-S201 WeakPolarHBondContact O-CB 3.44Å; K197-S201 PolarHBondContact O-N 2.98Å; K197-S201 PolarHBondContact O-OG 3.36Å; H198-S201 PolarHBondContact O-N 2.8Å; H198-S201 PolarHBondContact O-OG 3.07Å; I199-S201 VanDerWaalsContact C-N 3.3Å
202	G	73.5	Confident	92.4	Very high	132 Å²	132	65.6 Å²	65.6	100%	1.361	42%	0.416	S	S	*	.			trans	-81.6	0	-177	0	0	0	0	0	114.8

Retrieved 202 of 202 residues in 42.3 ms (Link to these results)

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