A0A087XR30_POEFO Loading...

HECT-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A087XR30, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 661 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	34.3	Very low	30.9	Very low	242 Å²	242	142.5 Å²	142.5	100%	1.192	84%	0.841	S	S	*	*				0	138.7	0	-76.8	169.9	168.7	0	0	106.3
2	T	36	Very low	32.1	Very low	141 Å²	141	140.6 Å²	140.6	87%	0.865	84%	0.836	S	S	*	*				-92	137.2	-129.9	43.3	0	0	0	0	116.7
3	D	32.4	Very low	32.4	Very low	161 Å²	161	139.5 Å²	139.5	86%	0.861	83%	0.834	S	S	*	*			trans	-57.8	171.1	157.4	-45.4	-84.1	0	0	0	111.6
4	G	32	Very low	32.1	Very low	66 Å²	66	141.3 Å²	141.3	68%	0.68	84%	0.836	S	S	*	*			cis	143.5	141.9	-2.3	0	0	0	0	0	112.6
5	V	33.2	Very low	31.9	Very low	148 Å²	148	141.5 Å²	141.5	90%	0.897	84%	0.84	S	S	*	*			trans	77.5	149.5	159.1	-169.3	0	0	0	0	119.9
6	S	32	Very low	31.8	Very low	102 Å²	102	144.7 Å²	144.7	71%	0.713	84%	0.844	S	S	*	*			trans	-50.4	171.3	177.4	-35.7	0	0	0	0	116.2
7	D	28.7	Very low	31.5	Very low	154 Å²	154	140.6 Å²	140.6	82%	0.824	84%	0.839	S	S	*	*				-173.9	-176	59.2	-143.3	-29.7	0	0	0	114.2
8	Q	30.4	Very low	31.5	Very low	181 Å²	181	140.2 Å²	140.2	85%	0.846	84%	0.841	S	S	*	*			trans	-71.9	154.1	175	-57.6	176.2	-5.2	0	0	114
9	A	27.6	Very low	31.3	Very low	91 Å²	91	141.6 Å²	141.6	75%	0.752	84%	0.838	S	S	*	*			trans	169.1	127.5	131.9	0	0	0	0	0	115.6
10	Q	24.9	Very low	31.2	Very low	196 Å²	196	141.9 Å²	141.9	92%	0.916	84%	0.841	S	S	*	*				55.8	137.3	120	-135.7	155.2	5.4	0	0	123.2
11	A	28.7	Very low	31	Very low	85 Å²	85	143.6 Å²	143.6	70%	0.702	83%	0.833	S	S	*	*			trans	-98.6	-178.4	166.8	0	0	0	0	0	111
12	P	44.7	Very low	30.7	Very low	120 Å²	120	140.8 Å²	140.8	78%	0.779	81%	0.809	S	S	*	*			cis	-119.8	-146.9	-0.9	39.5	-18.2	0	0	0	111.6
13	P	36.3	Very low	30.3	Very low	126 Å²	126	140.5 Å²	140.5	82%	0.818	81%	0.807	S	S	*	*				-138.6	-153	54.9	38.9	-16.7	0	0	0	114.9
14	L	27.6	Very low	30	Very low	165 Å²	165	142 Å²	142	86%	0.864	80%	0.801	S	S	*	*			trans	-114.7	153.3	-175.1	-71.4	143	0	0	0	113.4
15	T	29.7	Very low	29.7	Very low	145 Å²	145	143.2 Å²	143.2	89%	0.89	80%	0.804	S	S	*	*			trans	-136.1	163.9	155	50.3	0	0	0	0	111.4
16	Q	30.1	Very low	29.5	Very low	192 Å²	192	142.9 Å²	142.9	90%	0.897	79%	0.793	S	S	*	*			trans	-120.3	140.5	-145.9	-59	165.2	-15.6	0	0	115.6
17	G	26.3	Very low	29.2	Very low	75 Å²	75	142.7 Å²	142.7	77%	0.773	79%	0.788	S	S	*	*			trans	69.8	174.8	138.8	0	0	0	0	0	119.7
18	P	31.5	Very low	29.1	Very low	134 Å²	134	142.6 Å²	142.6	87%	0.87	79%	0.792	S	S	*	*			cis	-111.6	163.7	9.8	39.3	-30.7	0	0	0	115.7
19	Q	28.8	Very low	28.8	Very low	166 Å²	166	139.6 Å²	139.6	78%	0.776	79%	0.792	S	S	*	*			trans	-86.4	157.3	173.6	-60.2	178.6	-29.9	0	0	112.7
20	T	28.4	Very low	28.7	Very low	148 Å²	148	139.3 Å²	139.3	91%	0.908	80%	0.797	S	S	*	*			trans	-115.1	113.1	141.4	38	0	0	0	0	111.4
21	R	27.1	Very low	28.6	Very low	177 Å²	177	133.8 Å²	133.8	67%	0.668	79%	0.793	S	S	*	*			trans	-51	163.4	159.4	-80	173.1	161	178.6	-1.6	111
22	R	27.6	Very low	28.6	Very low	184 Å²	184	139 Å²	139	69%	0.694	80%	0.803	S	S	*	*			cis	-165	172.2	9.1	-117.7	163.4	-179.8	177.2	-7.3	105.6
23	T	27.6	Very low	27.8	Very low	135 Å²	135	142.4 Å²	142.4	83%	0.828	81%	0.808	S	S	*	*			cis	-158.1	169.8	36.3	-25.9	0	0	0	0	111.4
24	R	26.8	Very low	28.3	Very low	193 Å²	193	141.3 Å²	141.3	73%	0.728	80%	0.801	S	S	*	*			trans	-137.2	148.4	-165.5	159.6	-165.1	177.7	-158.7	2.3	110.8
25	A	25.9	Very low	28.1	Very low	90 Å²	90	142.6 Å²	142.6	74%	0.744	81%	0.805	S	S	*	*			trans	-178.7	151	146	0	0	0	0	0	111.4
26	Q	28.2	Very low	27.9	Very low	141 Å²	141	141.1 Å²	141.1	66%	0.659	80%	0.801	S	S	*	*			cis	-167.1	120.3	-34.4	-123.2	178	-27	0	0	110.1
27	T	27.1	Very low	28.9	Very low	99 Å²	99	137.8 Å²	137.8	61%	0.607	80%	0.796	S	S	*	*			trans	27	135.6	132.9	58.8	0	0	0	0	123.3
28	V	24.9	Very low	28.8	Very low	151 Å²	151	140.1 Å²	140.1	92%	0.915	80%	0.8	S	S	*	*				-138.9	145.7	128.9	174.5	0	0	0	0	108.5
29	S	25.7	Very low	28.5	Very low	119 Å²	119	138 Å²	138	83%	0.832	79%	0.794	S	S	*	*			trans	-153	159.8	-174	50.3	0	0	0	0	113.2
30	G	24.1	Very low	28.4	Very low	84 Å²	84	132.9 Å²	132.9	87%	0.866	78%	0.78	S	S	*	*			trans	143.5	133.4	170.5	0	0	0	0	0	112.1
31	G	22.9	Very low	28.2	Very low	81 Å²	81	132 Å²	132	84%	0.835	78%	0.78	S	S	*	*			cis	-161.6	177.9	-1.8	0	0	0	0	0	111.4
32	E	28.3	Very low	28.4	Very low	194 Å²	194	133 Å²	133	91%	0.907	79%	0.785	S	S	*	*			trans	-108.3	150.7	-168.7	-59.3	171.5	122.6	0	0	113.7
33	E	28.5	Very low	28.7	Very low	192 Å²	192	129.3 Å²	129.3	90%	0.897	78%	0.783	S	S	*	*			trans	-171.4	161.6	132.7	-94.2	-127.6	127.5	0	0	111.5
34	P	46.7	Very low	29.2	Very low	102 Å²	102	130.8 Å²	130.8	66%	0.662	79%	0.785	S	S	*	*			trans	-122.9	157.8	-154.3	40.8	-28.8	0	0	0	117.4
35	M	24.8	Very low	30.2	Very low	193 Å²	193	123.5 Å²	123.5	95%	0.951	76%	0.762	S	S	*	*			trans	-165.3	164.1	148.1	-113.8	-179.3	-130.4	0	0	113.8
36	S	24.2	Very low	31.6	Very low	114 Å²	114	121.3 Å²	121.3	80%	0.797	74%	0.739	S	S	*	*			trans	-105.5	-161.6	-161.8	-45	0	0	0	0	114.2
37	P	51	Low	32.8	Very low	122 Å²	122	120.1 Å²	120.1	79%	0.792	74%	0.744	S	S	*	*				-119	140.9	-112.9	34.8	-16.8	0	0	0	115.8
38	S	24.5	Very low	34.5	Very low	124 Å²	124	117.9 Å²	117.9	87%	0.867	74%	0.74	S	S	*	*			trans	-165.1	144.8	155.7	-131.8	0	0	0	0	116.1
39	A	25.9	Very low	36.7	Very low	89 Å²	89	111.2 Å²	111.2	74%	0.736	70%	0.7	S	S	*	*			trans	63.1	129.8	149.2	0	0	0	0	0	122.1
40	A	26.1	Very low	39.2	Very low	59 Å²	59	106.7 Å²	106.7	49%	0.488	67%	0.667	S	S	.	*			trans	71.3	105	157.4	0	0	0	0	0	118.7	Y42	A40-Y42 HydrophobicContact CB-CD2 4.21Å; A40-Y42 HydrophobicContact CB-CE1 3.99Å; A40-Y42 HydrophobicContact CB-CE2 3.5Å; A40-Y42 VanDerWaalsContact CB-CE2 3.5Å; A40-Y42 WeakPolarHBondContact CB-OH 3.08Å; A40-Y42 WeakPolarHBondContact O-CD2 3.26Å; A40-Y42 VanDerWaalsContact O-CE2 3.3Å; A40-Y42 WeakPolarHBondContact O-CE2 3.23Å; A40-Y42 PolarHBondContact O-N 3.38Å; A40-Y42 VanDerWaalsContact O-N 3.1Å
41	S	24.7	Very low	41.5	Very low	130 Å²	130	107.5 Å²	107.5	91%	0.909	66%	0.657	S	S	*	*			trans	-77.3	83.8	168.2	-47.2	0	0	0	0	110.6	T43	S41-T43 PolarHBondContact O-N 2.99Å
42	Y	30.2	Very low	43.7	Very low	196 Å²	196	104.3 Å²	104.3	77%	0.769	63%	0.625	S	S	*	*			trans	-69.3	122.6	174	-54.3	-82.3	0	0	0	110.8	A40	A40-Y42 HydrophobicContact CB-CD2 4.21Å; A40-Y42 HydrophobicContact CB-CE1 3.99Å; A40-Y42 HydrophobicContact CB-CE2 3.5Å; A40-Y42 VanDerWaalsContact CB-CE2 3.5Å; A40-Y42 WeakPolarHBondContact CB-OH 3.08Å; A40-Y42 WeakPolarHBondContact O-CD2 3.26Å; A40-Y42 VanDerWaalsContact O-CE2 3.3Å; A40-Y42 WeakPolarHBondContact O-CE2 3.23Å; A40-Y42 PolarHBondContact O-N 3.38Å; A40-Y42 VanDerWaalsContact O-N 3.1Å
43	T	34.7	Very low	46	Very low	107 Å²	107	97 Å²	97	66%	0.656	59%	0.589	S	S	*	*			trans	3.9	129.2	153.1	49.3	0	0	0	0	117.9	S41 T45	S41-T43 PolarHBondContact O-N 2.99Å; T43-T45 PolarHBondContact O-N 3.32Å
44	L	38.3	Very low	48.6	Very low	167 Å²	167	90.1 Å²	90.1	87%	0.874	56%	0.557	S	S	*	*	S	Bend	trans	-56.2	96.3	161.8	-79.4	163	0	0	0	110.2
45	T	46.7	Very low	50.4	Low	39 Å²	39	88.3 Å²	88.3	24%	0.239	54%	0.539	C	S	.	.			trans	-143.7	122.4	174.1	-64.9	0	0	0	0	106.5	T43 L49	T43-T45 PolarHBondContact O-N 3.32Å; T45-L49 HydrophobicContact CG2-CB 4.27Å; T45-L49 WeakPolarHBondContact CG2-O 3.5Å
46	T	56.7	Low	53.1	Low	44 Å²	44	84.3 Å²	84.3	27%	0.27	51%	0.514	S	S	.	.			trans	-64.5	132	178.1	-46.6	0	0	0	0	108.6	G48 L49 E55	T46-G48 PolarHBondContact O-N 3.01Å; T46-L49 WeakPolarHBondContact O-CB 3.45Å; T46-L49 PolarHBondContact O-N 3.11Å; T46-E55 HydrophobicContact CG2-CB 3.99Å; T46-E55 PolarHBondContact OG1-N 3.44Å
47	P	54	Low	55.7	Low	117 Å²	117	85.5 Å²	85.5	76%	0.76	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	124.9	-174.7	-31.3	36.1	0	0	0	113.7	R77	P47-R77 PolarHBondContact O-NH2 3.01Å
48	G	61.6	Low	56.9	Low	51 Å²	51	81.3 Å²	81.3	53%	0.526	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	23.4	-176.5	0	0	0	0	0	115.2	T46 R77	T46-G48 PolarHBondContact O-N 3.01Å; G48-R77 PolarHBondContact O-NH2 2.76Å; G48-R77 VanDerWaalsContact O-NH2 3.17Å
49	L	71.5	Confident	58.7	Low	11 Å²	11	81 Å²	81	6%	0.058	48%	0.48	C	S	.	.	S	Bend	trans	-112.5	157.9	162.8	-62.5	-177.4	0	0	0	110.8	T45 T46 W53 E55 Y65 R77 P78	T45-L49 HydrophobicContact CG2-CB 4.27Å; T45-L49 WeakPolarHBondContact CG2-O 3.5Å; T46-L49 WeakPolarHBondContact O-CB 3.45Å; T46-L49 PolarHBondContact O-N 3.11Å; L49-W53 HydrophobicContact CB-CB 3.9Å; L49-W53 HydrophobicContact CD1-CB 4.1Å; L49-E55 HydrophobicContact CD1-CB 4.23Å; L49-Y65 HydrophobicContact CD1-CD1 3.85Å; L49-Y65 HydrophobicContact CD1-CE1 4.44Å; L49-Y65 HydrophobicContact CD2-CD1 3.89Å; L49-Y65 HydrophobicContact CD2-CE1 4.06Å; L49-R77 HydrophobicContact CD2-CG 3.69Å; L49-P78 HydrophobicContact CD2-CG 4.48Å
50	P	78.7	Confident	60.6	Low	24 Å²	24	85 Å²	85	16%	0.156	48%	0.481	C	S	.	.			trans	-68.2	159.6	174.6	-12.8	27	0	0	0	111.9	G52 W53 P78 V80	P50-G52 PolarHBondContact O-N 2.83Å; P50-W53 WeakPolarHBondContact O-CB 3.44Å; P50-W53 PolarHBondContact O-N 2.66Å; P50-W53 VanDerWaalsContact O-N 3.1Å; P50-P78 HydrophobicContact CG-CB 3.99Å; P50-V80 HydrophobicContact CG-CG2 4.1Å
51	P	71.3	Confident	62.1	Low	101 Å²	101	84.6 Å²	84.6	66%	0.656	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	132.7	-179.7	-26.8	35.4	0	0	0	113.2	N69	P51-N69 PolarHBondContact O-ND2 2.63Å
52	G	70.2	Confident	63.8	Low	15 Å²	15	84.5 Å²	84.5	16%	0.155	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	6.2	-177.7	0	0	0	0	0	115	P50 H68	P50-G52 PolarHBondContact O-N 2.83Å; G52-H68 PolarHBondContact O-N 3.47Å
53	W	75.8	Confident	65.8	Low	40 Å²	40	77.2 Å²	77.2	15%	0.152	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	135.5	171.4	-71.5	89.7	0	0	0	113.1	L49 P50 V66 N67 T74 P78	L49-W53 HydrophobicContact CB-CB 3.9Å; L49-W53 HydrophobicContact CD1-CB 4.1Å; P50-W53 WeakPolarHBondContact O-CB 3.44Å; P50-W53 PolarHBondContact O-N 2.66Å; P50-W53 VanDerWaalsContact O-N 3.1Å; W53-V66 CarbonylContact C-O 3.59Å; W53-V66 VanDerWaalsContact CA-O 3.27Å; W53-V66 WeakPolarHBondContact CA-O 3.26Å; W53-V66 VanDerWaalsContact CE3-C 3.48Å; W53-N67 HydrophobicContact CD2-CB 3.7Å; W53-N67 HydrophobicContact CE3-CB 3.6Å; W53-N67 HydrophobicContact CH2-CB 3.67Å; W53-N67 HydrophobicContact CZ2-CB 3.76Å; W53-N67 WeakPolarHBondContact CZ2-ND2 3.44Å; W53-N67 HydrophobicContact CZ3-CB 3.56Å; W53-N67 PolarHBondContact NE1-ND2 3.31Å; W53-T74 HydrophobicContact CH2-CG2 3.8Å; W53-T74 HydrophobicContact CZ3-CG2 3.54Å; W53-P78 HydrophobicContact CB-CG 4.49Å; W53-P78 HydrophobicContact CD2-CB 3.86Å; W53-P78 HydrophobicContact CD2-CG 3.28Å; W53-P78 HydrophobicContact CE3-CB 4.3Å; W53-P78 HydrophobicContact CE3-CG 3.25Å; W53-P78 HydrophobicContact CG-CB 4.2Å; W53-P78 HydrophobicContact CG-CG 3.9Å; W53-P78 HydrophobicContact CH2-CB 4.44Å; W53-P78 HydrophobicContact CH2-CG 3.75Å; W53-P78 HydrophobicContact CZ2-CB 4.01Å; W53-P78 HydrophobicContact CZ2-CG 3.77Å; W53-P78 HydrophobicContact CZ3-CG 3.52Å
54	E	82.8	Confident	67.8	Low	48 Å²	48	74.6 Å²	74.6	22%	0.224	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136.3	178.4	-171.1	-166.4	154.9	0	0	110.5	R56 Y65 V66 H68	E54-R56 HydrophobicContact CG-CG 4.39Å; E54-R56 WeakPolarHBondContact OE1-CG 3.45Å; E54-R56 IonicContact OE1-CZ 2.91Å; E54-R56 IonicContact OE1-NE 3.95Å; E54-R56 PolarHBondContact OE1-NE 3.1Å; E54-R56 IonicContact OE1-NH2 3.14Å; E54-R56 PolarHBondContact OE1-NH2 3.19Å; E54-R56 VanDerWaalsContact OE1-NH2 3.15Å; E54-R56 IonicContact OE2-CZ 2.7Å; E54-R56 IonicContact OE2-NE 2.66Å; E54-R56 PolarHBondContact OE2-NE 2.74Å; E54-R56 IonicContact OE2-NH2 3.64Å; E54-R56 PolarHBondContact OE2-NH2 2.83Å; E54-Y65 CarbonylContact O-C 3.53Å; E54-Y65 WeakPolarHBondContact O-CA 3.36Å; E54-V66 HydrophobicContact CB-CB 4.48Å; E54-V66 PolarHBondContact N-O 3.34Å; E54-V66 PolarHBondContact O-N 2.67Å; E54-H68 WeakPolarHBondContact CB-NE2 3.36Å; E54-H68 IonicContact OE2-CE1 3.8Å; E54-H68 PolarHBondContact OE2-CE1 3.35Å; E54-H68 VanDerWaalsContact OE2-CE1 3.29Å; E54-H68 IonicContact OE2-NE2 3.08Å; E54-H68 PolarHBondContact OE2-NE2 2.87Å
55	E	85	Confident	69.9	Low	63 Å²	63	68 Å²	68	29%	0.294	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127.9	169.2	-168.6	179.1	136.2	0	0	111.2	T46 L49 T63 Y65	T46-E55 HydrophobicContact CG2-CB 3.99Å; T46-E55 PolarHBondContact OG1-N 3.44Å; L49-E55 HydrophobicContact CD1-CB 4.23Å; E55-T63 VanDerWaalsContact CD-CG2 3.44Å; E55-T63 HydrophobicContact CG-CG2 3.36Å; E55-T63 VanDerWaalsContact OE1-CG2 3.28Å; E55-T63 WeakPolarHBondContact OE1-CG2 3.33Å; E55-T63 PolarHBondContact OE1-OG1 3.26Å; E55-Y65 HydrophobicContact CB-CD1 4.09Å; E55-Y65 HydrophobicContact CB-CE1 4.14Å; E55-Y65 HydrophobicContact CG-CD1 4.01Å; E55-Y65 HydrophobicContact CG-CE1 3.71Å
56	R	80.6	Confident	71	Confident	109 Å²	109	66.9 Å²	66.9	41%	0.411	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	166	174	-69.3	-164.2	-179.4	179.1	6.7	111.6	E54 T63 Y64 V66	E54-R56 HydrophobicContact CG-CG 4.39Å; E54-R56 WeakPolarHBondContact OE1-CG 3.45Å; E54-R56 IonicContact OE1-CZ 2.91Å; E54-R56 IonicContact OE1-NE 3.95Å; E54-R56 PolarHBondContact OE1-NE 3.1Å; E54-R56 IonicContact OE1-NH2 3.14Å; E54-R56 PolarHBondContact OE1-NH2 3.19Å; E54-R56 VanDerWaalsContact OE1-NH2 3.15Å; E54-R56 IonicContact OE2-CZ 2.7Å; E54-R56 IonicContact OE2-NE 2.66Å; E54-R56 PolarHBondContact OE2-NE 2.74Å; E54-R56 IonicContact OE2-NH2 3.64Å; E54-R56 PolarHBondContact OE2-NH2 2.83Å; R56-T63 CarbonylContact O-C 3.58Å; R56-T63 WeakPolarHBondContact O-CA 3.23Å; R56-Y64 HydrophobicContact CB-CD1 4.3Å; R56-Y64 HydrophobicContact CB-CD2 4.4Å; R56-Y64 HydrophobicContact CB-CE1 3.74Å; R56-Y64 HydrophobicContact CB-CE2 3.85Å; R56-Y64 VanDerWaalsContact CB-CZ 3.47Å; R56-Y64 PolarHBondContact N-O 2.8Å; R56-Y64 PolarHBondContact O-N 3.32Å; R56-V66 HydrophobicContact CB-CG2 4.45Å; R56-V66 HydrophobicContact CG-CG2 4.16Å
57	K	80.3	Confident	71.7	Confident	140 Å²	140	65.4 Å²	65.4	61%	0.609	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	141.2	173.9	-69.5	179.6	179.9	176.3	0	110.7	R62 Y64	K57-R62 WeakPolarHBondContact CA-O 3.48Å; K57-Y64 VanDerWaalsContact C-CE1 3.5Å
58	D	75.3	Confident	72.1	Confident	34 Å²	34	62.7 Å²	62.7	18%	0.182	34%	0.341	C	S	.	.			trans	-79.5	172.8	174.7	79.1	-3.6	0	0	0	111.8	K60 G61 R62 Y64 W75	D58-K60 PolarHBondContact O-N 3.44Å; D58-K60 VanDerWaalsContact OD1-CA 3.26Å; D58-K60 WeakPolarHBondContact OD1-CA 3.38Å; D58-K60 WeakPolarHBondContact OD1-CB 3.5Å; D58-K60 PolarHBondContact OD1-N 3.34Å; D58-G61 PolarHBondContact O-N 3Å; D58-G61 PolarHBondContact OD1-N 3.28Å; D58-G61 VanDerWaalsContact OD1-N 3.08Å; D58-R62 PolarHBondContact N-O 3.03Å; D58-R62 WeakPolarHBondContact OD1-CB 3.39Å; D58-R62 PolarHBondContact OD1-N 3.33Å; D58-R62 IonicContact OD1-NE 2.8Å; D58-R62 IonicContact OD2-CZ 3.53Å; D58-R62 IonicContact OD2-NE 3.2Å; D58-R62 PolarHBondContact OD2-NE 3.48Å; D58-R62 IonicContact OD2-NH2 2.82Å; D58-R62 PolarHBondContact OD2-NH2 3.01Å; D58-Y64 HydrophobicContact CB-CD1 4.34Å; D58-Y64 HydrophobicContact CB-CE1 4.22Å; D58-W75 HydrophobicContact CB-CH2 4.2Å
59	A	62.3	Low	71.7	Confident	116 Å²	116	65.9 Å²	65.9	96%	0.959	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-4.4	177.1	0	0	0	0	0	114.4
60	K	66	Low	70.8	Confident	174 Å²	174	69.7 Å²	69.7	76%	0.757	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	10.9	173.5	-56.2	-175.8	-178.2	-177.1	0	111.9	D58 R62	D58-K60 PolarHBondContact O-N 3.44Å; D58-K60 VanDerWaalsContact OD1-CA 3.26Å; D58-K60 WeakPolarHBondContact OD1-CA 3.38Å; D58-K60 WeakPolarHBondContact OD1-CB 3.5Å; D58-K60 PolarHBondContact OD1-N 3.34Å; K60-R62 VanDerWaalsContact C-N 3.3Å; K60-R62 HydrophobicContact CB-CG 4.42Å; K60-R62 PolarHBondContact O-N 3.11Å
61	G	58.4	Low	69.7	Low	50 Å²	50	76 Å²	76	52%	0.515	39%	0.387	S	S	.	.	S	Bend	trans	76.3	7.3	178.6	0	0	0	0	0	115.2	D58	D58-G61 PolarHBondContact O-N 3Å; D58-G61 PolarHBondContact OD1-N 3.28Å; D58-G61 VanDerWaalsContact OD1-N 3.08Å
62	R	60.2	Low	68.9	Low	128 Å²	128	74.1 Å²	74.1	48%	0.483	37%	0.374	S	S	.	.			trans	-84.3	128.6	-176.6	-56.4	-178.8	-61.2	159.2	7.6	110.5	K57 D58 K60 W75	K57-R62 WeakPolarHBondContact CA-O 3.48Å; D58-R62 PolarHBondContact N-O 3.03Å; D58-R62 WeakPolarHBondContact OD1-CB 3.39Å; D58-R62 PolarHBondContact OD1-N 3.33Å; D58-R62 IonicContact OD1-NE 2.8Å; D58-R62 IonicContact OD2-CZ 3.53Å; D58-R62 IonicContact OD2-NE 3.2Å; D58-R62 PolarHBondContact OD2-NE 3.48Å; D58-R62 IonicContact OD2-NH2 2.82Å; D58-R62 PolarHBondContact OD2-NH2 3.01Å; K60-R62 VanDerWaalsContact C-N 3.3Å; K60-R62 HydrophobicContact CB-CG 4.42Å; K60-R62 PolarHBondContact O-N 3.11Å; R62-W75 HydrophobicContact CB-CZ3 3.76Å
63	T	71	Confident	68.9	Low	43 Å²	43	77.6 Å²	77.6	26%	0.264	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	132.9	177	-66	0	0	0	0	111.8	E55 R56 Y65	E55-T63 VanDerWaalsContact CD-CG2 3.44Å; E55-T63 HydrophobicContact CG-CG2 3.36Å; E55-T63 VanDerWaalsContact OE1-CG2 3.28Å; E55-T63 WeakPolarHBondContact OE1-CG2 3.33Å; E55-T63 PolarHBondContact OE1-OG1 3.26Å; R56-T63 CarbonylContact O-C 3.58Å; R56-T63 WeakPolarHBondContact O-CA 3.23Å; T63-Y65 HydrophobicContact CG2-CE1 4.06Å; T63-Y65 HydrophobicContact CG2-CE2 4Å
64	Y	77.8	Confident	68.4	Low	52 Å²	52	77.2 Å²	77.2	20%	0.204	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	159.8	166.5	67.6	-82.8	0	0	0	109.7	R56 K57 D58 V66 T73 T74 W75	R56-Y64 HydrophobicContact CB-CD1 4.3Å; R56-Y64 HydrophobicContact CB-CD2 4.4Å; R56-Y64 HydrophobicContact CB-CE1 3.74Å; R56-Y64 HydrophobicContact CB-CE2 3.85Å; R56-Y64 VanDerWaalsContact CB-CZ 3.47Å; R56-Y64 PolarHBondContact N-O 2.8Å; R56-Y64 PolarHBondContact O-N 3.32Å; K57-Y64 VanDerWaalsContact C-CE1 3.5Å; D58-Y64 HydrophobicContact CB-CD1 4.34Å; D58-Y64 HydrophobicContact CB-CE1 4.22Å; Y64-V66 HydrophobicContact CD2-CG2 3.9Å; Y64-V66 HydrophobicContact CE2-CG2 3.51Å; Y64-T73 HydrophobicContact CD2-CG2 4.32Å; Y64-T73 HydrophobicContact CE2-CG2 4.32Å; Y64-T74 CarbonylContact C-O 3.51Å; Y64-T74 WeakPolarHBondContact CA-O 3.49Å; Y64-W75 HydrophobicContact CD1-CH2 4.35Å; Y64-W75 HydrophobicContact CD1-CZ3 4.3Å; Y64-W75 HydrophobicContact CG-CZ3 4.48Å
65	Y	81.3	Confident	68.2	Low	29 Å²	29	81.6 Å²	81.6	11%	0.114	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	133.4	-176.7	-50.7	-90.5	0	0	0	109.1	L49 E54 E55 T63 T73 T74 R77 P78	L49-Y65 HydrophobicContact CD1-CD1 3.85Å; L49-Y65 HydrophobicContact CD1-CE1 4.44Å; L49-Y65 HydrophobicContact CD2-CD1 3.89Å; L49-Y65 HydrophobicContact CD2-CE1 4.06Å; E54-Y65 CarbonylContact O-C 3.53Å; E54-Y65 WeakPolarHBondContact O-CA 3.36Å; E55-Y65 HydrophobicContact CB-CD1 4.09Å; E55-Y65 HydrophobicContact CB-CE1 4.14Å; E55-Y65 HydrophobicContact CG-CD1 4.01Å; E55-Y65 HydrophobicContact CG-CE1 3.71Å; T63-Y65 HydrophobicContact CG2-CE1 4.06Å; T63-Y65 HydrophobicContact CG2-CE2 4Å; Y65-T73 CarbonylContact O-C 3.52Å; Y65-T73 VanDerWaalsContact O-CA 3.29Å; Y65-T73 WeakPolarHBondContact O-CA 3.28Å; Y65-T74 HydrophobicContact CD2-CG2 4.42Å; Y65-T74 PolarHBondContact N-O 2.85Å; Y65-T74 PolarHBondContact O-N 2.84Å; Y65-R77 HydrophobicContact CD1-CG 4.32Å; Y65-R77 HydrophobicContact CD2-CB 4.43Å; Y65-R77 HydrophobicContact CE1-CB 4.09Å; Y65-R77 HydrophobicContact CE1-CG 3.67Å; Y65-R77 HydrophobicContact CE2-CB 3.76Å; Y65-R77 HydrophobicContact CE2-CG 4.29Å; Y65-P78 HydrophobicContact CG-CG 4.4Å
66	V	69.6	Low	67.3	Low	16 Å²	16	82.5 Å²	82.5	10%	0.097	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.7	-177.8	-174.4	0	0	0	0	108.5	W53 E54 R56 Y64 T73	W53-V66 CarbonylContact C-O 3.59Å; W53-V66 VanDerWaalsContact CA-O 3.27Å; W53-V66 WeakPolarHBondContact CA-O 3.26Å; W53-V66 VanDerWaalsContact CE3-C 3.48Å; E54-V66 HydrophobicContact CB-CB 4.48Å; E54-V66 PolarHBondContact N-O 3.34Å; E54-V66 PolarHBondContact O-N 2.67Å; R56-V66 HydrophobicContact CB-CG2 4.45Å; R56-V66 HydrophobicContact CG-CG2 4.16Å; Y64-V66 HydrophobicContact CD2-CG2 3.9Å; Y64-V66 HydrophobicContact CE2-CG2 3.51Å; V66-T73 HydrophobicContact CB-CG2 4.48Å; V66-T73 HydrophobicContact CG1-CG2 4.31Å; V66-T73 HydrophobicContact CG2-CG2 4.08Å
67	N	71.6	Confident	67.4	Low	13 Å²	13	83 Å²	83	7%	0.07	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	113.1	170.5	-174.9	-31.7	0	0	0	108.9	W53 N69 N70 R71 T72	W53-N67 HydrophobicContact CD2-CB 3.7Å; W53-N67 HydrophobicContact CE3-CB 3.6Å; W53-N67 HydrophobicContact CH2-CB 3.67Å; W53-N67 HydrophobicContact CZ2-CB 3.76Å; W53-N67 WeakPolarHBondContact CZ2-ND2 3.44Å; W53-N67 HydrophobicContact CZ3-CB 3.56Å; W53-N67 PolarHBondContact NE1-ND2 3.31Å; N67-N69 WeakPolarHBondContact OD1-CA 3.5Å; N67-N69 WeakPolarHBondContact OD1-CB 3.5Å; N67-N69 PolarHBondContact OD1-N 2.85Å; N67-N70 WeakPolarHBondContact CB-OD1 3.28Å; N67-N70 PolarHBondContact ND2-ND2 3.39Å; N67-N70 PolarHBondContact ND2-OD1 2.95Å; N67-N70 PolarHBondContact OD1-N 2.88Å; N67-N70 PolarHBondContact OD1-OD1 3.17Å; N67-R71 WeakPolarHBondContact O-CA 3.31Å; N67-R71 PolarHBondContact O-N 2.95Å; N67-T72 PolarHBondContact N-O 2.68Å; N67-T72 PolarHBondContact O-N 3.48Å
68	H	62.1	Low	66.7	Low	60 Å²	60	77.1 Å²	77.1	28%	0.278	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-24	-178.7	-66	-69.4	0	0	0	113.2	G52 E54 Y365	G52-H68 PolarHBondContact O-N 3.47Å; E54-H68 WeakPolarHBondContact CB-NE2 3.36Å; E54-H68 IonicContact OE2-CE1 3.8Å; E54-H68 PolarHBondContact OE2-CE1 3.35Å; E54-H68 VanDerWaalsContact OE2-CE1 3.29Å; E54-H68 IonicContact OE2-NE2 3.08Å; E54-H68 PolarHBondContact OE2-NE2 2.87Å; H68-Y365 WeakPolarHBondContact CB-OH 3.3Å
69	N	54	Low	66.6	Low	117 Å²	117	82.4 Å²	82.4	63%	0.626	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-31	-178.9	-55.6	-24.1	0	0	0	112.4	P51 N67	P51-N69 PolarHBondContact O-ND2 2.63Å; N67-N69 WeakPolarHBondContact OD1-CA 3.5Å; N67-N69 WeakPolarHBondContact OD1-CB 3.5Å; N67-N69 PolarHBondContact OD1-N 2.85Å
70	N	52.3	Low	66.2	Low	91 Å²	91	79.9 Å²	79.9	49%	0.487	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	8.9	-179.6	72.2	10	0	0	0	114.5	N67 T72	N67-N70 WeakPolarHBondContact CB-OD1 3.28Å; N67-N70 PolarHBondContact ND2-ND2 3.39Å; N67-N70 PolarHBondContact ND2-OD1 2.95Å; N67-N70 PolarHBondContact OD1-N 2.88Å; N67-N70 PolarHBondContact OD1-OD1 3.17Å; N70-T72 PolarHBondContact O-N 3.26Å; N70-T72 WeakPolarHBondContact OD1-CB 3.42Å; N70-T72 WeakPolarHBondContact OD1-CG2 3.18Å; N70-T72 PolarHBondContact OD1-N 2.69Å; N70-T72 PolarHBondContact OD1-OG1 2.89Å
71	R	56.4	Low	65	Low	157 Å²	157	80.2 Å²	80.2	59%	0.592	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	25.6	177.7	-48.1	-173	-166.2	-168.7	7.7	115.1	N67 Y371 N376	N67-R71 WeakPolarHBondContact O-CA 3.31Å; N67-R71 PolarHBondContact O-N 2.95Å; R71-Y371 PolarHBondContact NH1-OH 3.47Å; R71-Y371 PolarHBondContact NH2-OH 3.2Å; R71-N376 PolarHBondContact NH1-O 3.16Å
72	T	53.2	Low	63.8	Low	62 Å²	62	84.9 Å²	84.9	38%	0.38	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	152.7	177.1	62.1	0	0	0	0	112.4	N67 N70	N67-T72 PolarHBondContact N-O 2.68Å; N67-T72 PolarHBondContact O-N 3.48Å; N70-T72 PolarHBondContact O-N 3.26Å; N70-T72 WeakPolarHBondContact OD1-CB 3.42Å; N70-T72 WeakPolarHBondContact OD1-CG2 3.18Å; N70-T72 PolarHBondContact OD1-N 2.69Å; N70-T72 PolarHBondContact OD1-OG1 2.89Å
73	T	71.8	Confident	62.3	Low	88 Å²	88	85.5 Å²	85.5	54%	0.54	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.5	167	63.4	0	0	0	0	110.7	Y64 Y65 V66	Y64-T73 HydrophobicContact CD2-CG2 4.32Å; Y64-T73 HydrophobicContact CE2-CG2 4.32Å; Y65-T73 CarbonylContact O-C 3.52Å; Y65-T73 VanDerWaalsContact O-CA 3.29Å; Y65-T73 WeakPolarHBondContact O-CA 3.28Å; V66-T73 HydrophobicContact CB-CG2 4.48Å; V66-T73 HydrophobicContact CG1-CG2 4.31Å; V66-T73 HydrophobicContact CG2-CG2 4.08Å
74	T	65.2	Low	60.3	Low	32 Å²	32	92.2 Å²	92.2	20%	0.196	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	145.9	-179.2	-179.3	0	0	0	0	111.1	W53 Y64 Y65 T76 P78	W53-T74 HydrophobicContact CH2-CG2 3.8Å; W53-T74 HydrophobicContact CZ3-CG2 3.54Å; Y64-T74 CarbonylContact C-O 3.51Å; Y64-T74 WeakPolarHBondContact CA-O 3.49Å; Y65-T74 HydrophobicContact CD2-CG2 4.42Å; Y65-T74 PolarHBondContact N-O 2.85Å; Y65-T74 PolarHBondContact O-N 2.84Å; T74-T76 VanDerWaalsContact C-N 3.29Å; T74-T76 WeakPolarHBondContact CG2-O 3.4Å; T74-T76 PolarHBondContact OG1-N 3.48Å; T74-T76 VanDerWaalsContact OG1-N 3.1Å; T74-T76 PolarHBondContact OG1-O 2.91Å; T74-P78 HydrophobicContact CG2-CG 4.45Å
75	W	76.8	Confident	57.9	Low	139 Å²	139	98 Å²	98	53%	0.527	49%	0.494	S	S	.	.	S	Bend	trans	-85.7	-2.3	171.4	-59.5	95.3	0	0	0	112.5	D58 R62 Y64	D58-W75 HydrophobicContact CB-CH2 4.2Å; R62-W75 HydrophobicContact CB-CZ3 3.76Å; Y64-W75 HydrophobicContact CD1-CH2 4.35Å; Y64-W75 HydrophobicContact CD1-CZ3 4.3Å; Y64-W75 HydrophobicContact CG-CZ3 4.48Å
76	T	67.9	Low	55.3	Low	82 Å²	82	100.1 Å²	100.1	50%	0.503	52%	0.524	S	S	.	.	S	Bend	trans	-110.4	125.4	-177.3	-49.3	0	0	0	0	110	T74 P78	T74-T76 VanDerWaalsContact C-N 3.29Å; T74-T76 WeakPolarHBondContact CG2-O 3.4Å; T74-T76 PolarHBondContact OG1-N 3.48Å; T74-T76 VanDerWaalsContact OG1-N 3.1Å; T74-T76 PolarHBondContact OG1-O 2.91Å; T76-P78 WeakPolarHBondContact O-CD 3.47Å
77	R	81.6	Confident	53.2	Low	120 Å²	120	103.9 Å²	103.9	45%	0.453	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-57.6	122.6	-177.1	-167.7	169.4	-174.9	-175.6	5	111	P47 G48 L49 Y65 I79	P47-R77 PolarHBondContact O-NH2 3.01Å; G48-R77 PolarHBondContact O-NH2 2.76Å; G48-R77 VanDerWaalsContact O-NH2 3.17Å; L49-R77 HydrophobicContact CD2-CG 3.69Å; Y65-R77 HydrophobicContact CD1-CG 4.32Å; Y65-R77 HydrophobicContact CD2-CB 4.43Å; Y65-R77 HydrophobicContact CE1-CB 4.09Å; Y65-R77 HydrophobicContact CE1-CG 3.67Å; Y65-R77 HydrophobicContact CE2-CB 3.76Å; Y65-R77 HydrophobicContact CE2-CG 4.29Å; R77-I79 PolarHBondContact O-N 3.22Å
78	P	65.9	Low	51.2	Low	17 Å²	17	108.5 Å²	108.5	11%	0.11	59%	0.591	C	S	.	*	P	Polyproline II helix	trans	-59.5	132.8	172.4	-19.2	27.8	0	0	0	110.7	L49 P50 W53 Y65 T74 T76	L49-P78 HydrophobicContact CD2-CG 4.48Å; P50-P78 HydrophobicContact CG-CB 3.99Å; W53-P78 HydrophobicContact CB-CG 4.49Å; W53-P78 HydrophobicContact CD2-CB 3.86Å; W53-P78 HydrophobicContact CD2-CG 3.28Å; W53-P78 HydrophobicContact CE3-CB 4.3Å; W53-P78 HydrophobicContact CE3-CG 3.25Å; W53-P78 HydrophobicContact CG-CB 4.2Å; W53-P78 HydrophobicContact CG-CG 3.9Å; W53-P78 HydrophobicContact CH2-CB 4.44Å; W53-P78 HydrophobicContact CH2-CG 3.75Å; W53-P78 HydrophobicContact CZ2-CB 4.01Å; W53-P78 HydrophobicContact CZ2-CG 3.77Å; W53-P78 HydrophobicContact CZ3-CG 3.52Å; Y65-P78 HydrophobicContact CG-CG 4.4Å; T74-P78 HydrophobicContact CG2-CG 4.45Å; T76-P78 WeakPolarHBondContact O-CD 3.47Å
79	I	72.5	Confident	49.5	Very low	145 Å²	145	112.3 Å²	112.3	74%	0.744	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-88.4	128.8	-179.9	-57.2	174.1	0	0	0	108.5	R77 Q81	R77-I79 PolarHBondContact O-N 3.22Å; I79-Q81 PolarHBondContact O-N 2.67Å
80	V	54.9	Low	48.2	Very low	63 Å²	63	112.9 Å²	112.9	38%	0.382	63%	0.632	S	S	.	*			trans	-72.6	104.6	168	-176.6	0	0	0	0	107.9	P50 L82	P50-V80 HydrophobicContact CG-CG2 4.1Å; V80-L82 VanDerWaalsContact C-N 3.35Å; V80-L82 HydrophobicContact CG1-CG 4.2Å; V80-L82 PolarHBondContact O-N 3.3Å; V80-L82 VanDerWaalsContact O-N 3.07Å
81	Q	40.3	Very low	47	Very low	181 Å²	181	113.2 Å²	113.2	85%	0.846	65%	0.647	S	S	*	*			trans	-74.6	92.5	165.7	-76	-177	-29.2	0	0	108.4	I79 T83	I79-Q81 PolarHBondContact O-N 2.67Å; Q81-T83 PolarHBondContact O-N 3.09Å
82	L	33.9	Very low	45.5	Very low	147 Å²	147	110.6 Å²	110.6	77%	0.77	66%	0.659	S	S	*	*			trans	-67.5	117.4	161.2	-74.4	163.6	0	0	0	107.6	V80 E84	V80-L82 VanDerWaalsContact C-N 3.35Å; V80-L82 HydrophobicContact CG1-CG 4.2Å; V80-L82 PolarHBondContact O-N 3.3Å; V80-L82 VanDerWaalsContact O-N 3.07Å; L82-E84 PolarHBondContact O-N 3.44Å
83	T	28.4	Very low	44.2	Very low	142 Å²	142	112.4 Å²	112.4	87%	0.871	68%	0.68	S	S	*	*			trans	-76.5	95.2	169.5	49.5	0	0	0	0	108.7	Q81	Q81-T83 PolarHBondContact O-N 3.09Å
84	E	27.9	Very low	42.2	Very low	184 Å²	184	113 Å²	113	86%	0.86	69%	0.694	S	S	*	*			trans	-89.5	134.9	162	-73.7	-170.3	137.1	0	0	109.9	L82	L82-E84 PolarHBondContact O-N 3.44Å
85	D	29	Very low	40.3	Very low	172 Å²	172	116.5 Å²	116.5	92%	0.92	73%	0.726	S	S	*	*			trans	-70.3	131.6	177.1	-78.9	-54.4	0	0	0	112
86	G	26.4	Very low	38	Very low	74 Å²	74	116.9 Å²	116.9	76%	0.763	74%	0.744	S	S	*	*			trans	100.4	128.9	143.7	0	0	0	0	0	119.2
87	A	26	Very low	36.2	Very low	96 Å²	96	117.2 Å²	117.2	79%	0.793	76%	0.755	S	S	*	*			trans	68.6	101.1	151.4	0	0	0	0	0	120.2
88	S	29	Very low	33.6	Very low	110 Å²	110	117.2 Å²	117.2	77%	0.769	77%	0.773	S	S	*	*			trans	28.2	108.5	130.1	-51.9	0	0	0	0	119.6
89	T	26.3	Very low	31.7	Very low	139 Å²	139	120 Å²	120	85%	0.853	81%	0.805	S	S	*	*				164.6	132.8	101	39.5	0	0	0	0	111.2
90	S	27.5	Very low	29.7	Very low	130 Å²	130	119 Å²	119	91%	0.909	81%	0.811	S	S	*	*			trans	-143.1	95.6	167.4	-62.1	0	0	0	0	110.1
91	A	25.9	Very low	28.5	Very low	97 Å²	97	120.8 Å²	120.8	80%	0.802	83%	0.832	S	S	*	*			trans	-94.2	165.4	161.6	0	0	0	0	0	109.7
92	A	25.4	Very low	27.9	Very low	102 Å²	102	117.9 Å²	117.9	84%	0.843	83%	0.832	S	S	*	*			trans	73.2	136.6	-179.5	0	0	0	0	0	115.8
93	A	26.6	Very low	27.7	Very low	101 Å²	101	114.9 Å²	114.9	84%	0.835	83%	0.828	S	S	*	*			cis	-158.2	145.8	-10.7	0	0	0	0	0	111.8
94	A	28.2	Very low	27.7	Very low	99 Å²	99	116.2 Å²	116.2	82%	0.818	83%	0.829	S	S	*	*			trans	-148.3	112.8	151.9	0	0	0	0	0	107.8
95	A	26.3	Very low	27.7	Very low	107 Å²	107	113.7 Å²	113.7	88%	0.884	83%	0.825	S	S	*	*			trans	-82.3	139.5	-176.1	0	0	0	0	0	111.4
96	V	28.2	Very low	28.6	Very low	147 Å²	147	110.7 Å²	110.7	89%	0.891	82%	0.816	S	S	*	*			trans	-126	141.5	165.2	-148.3	0	0	0	0	108.1
97	A	29.5	Very low	28.7	Very low	89 Å²	89	111.6 Å²	111.6	74%	0.736	82%	0.816	S	S	*	*			trans	-79.6	135.6	-164.8	0	0	0	0	0	114.4
98	S	28.3	Very low	28.9	Very low	120 Å²	120	112.6 Å²	112.6	84%	0.839	82%	0.817	S	S	*	*			trans	38.3	119.6	143.3	60.2	0	0	0	0	120.6
99	G	26.1	Very low	29	Very low	75 Å²	75	113.6 Å²	113.6	77%	0.773	82%	0.819	S	S	*	*			trans	-171.8	38.7	172.5	0	0	0	0	0	118.6
100	S	29.2	Very low	29.8	Very low	125 Å²	125	111.9 Å²	111.9	87%	0.874	81%	0.81	S	S	*	*			trans	37.7	116.1	155.2	-54.4	0	0	0	0	121.9
101	A	29.8	Very low	30	Very low	99 Å²	99	110.7 Å²	110.7	82%	0.818	80%	0.802	S	S	*	*				157.6	132.7	117.2	0	0	0	0	0	115.6
102	S	28.4	Very low	30.2	Very low	121 Å²	121	110.6 Å²	110.6	85%	0.846	80%	0.795	S	S	*	*			trans	-20.2	157.7	151.5	-59.8	0	0	0	0	119.3
103	A	29.3	Very low	30.5	Very low	83 Å²	83	110.9 Å²	110.9	69%	0.686	79%	0.791	S	S	*	*			cis	-174.8	-175.7	-7.8	0	0	0	0	0	110.4
104	L	29.5	Very low	30.7	Very low	171 Å²	171	111.1 Å²	111.1	90%	0.895	79%	0.786	S	S	*	*			trans	88.9	104.8	157.5	-68.2	149.4	0	0	0	120.5
105	V	27.4	Very low	30.8	Very low	130 Å²	130	111 Å²	111	79%	0.788	78%	0.779	S	S	*	*			trans	-60.7	-179.6	148.3	-108.4	0	0	0	0	112.8
106	P	47.6	Very low	31	Very low	110 Å²	110	113.5 Å²	113.5	71%	0.714	78%	0.778	S	S	*	*			cis	-140.7	-178.6	-1.9	28.5	-4.2	0	0	0	117.8
107	A	27.4	Very low	31	Very low	92 Å²	92	110.4 Å²	110.4	76%	0.76	77%	0.768	S	S	*	*			trans	67.2	131.9	143.2	0	0	0	0	0	119.4
108	S	31.9	Very low	31.1	Very low	118 Å²	118	111.3 Å²	111.3	83%	0.825	77%	0.769	S	S	*	*				-156.3	148.6	63.4	39.9	0	0	0	0	116.1
109	T	29.8	Very low	31.2	Very low	131 Å²	131	113.3 Å²	113.3	80%	0.804	77%	0.77	S	S	*	*			trans	-81.9	-174.2	162.6	47.4	0	0	0	0	109.4
110	P	43.6	Very low	31.5	Very low	103 Å²	103	118.3 Å²	118.3	67%	0.669	77%	0.773	S	S	*	*			cis	-148.3	173.5	14.8	41.8	-20.4	0	0	0	119.7
111	S	31.1	Very low	31.5	Very low	105 Å²	105	120.3 Å²	120.3	73%	0.734	77%	0.768	S	S	*	*			trans	60.4	152.9	140	62.5	0	0	0	0	119.9
112	S	31.3	Very low	31.5	Very low	95 Å²	95	122.2 Å²	122.2	66%	0.664	76%	0.764	S	S	*	*			cis	-157	138.7	10.3	-1	0	0	0	0	107.4
113	S	30.4	Very low	31.4	Very low	108 Å²	108	125.6 Å²	125.6	76%	0.755	77%	0.766	S	S	*	*				40.5	136.1	97.7	75.8	0	0	0	0	114.1
114	S	31.1	Very low	31.3	Very low	106 Å²	106	127.8 Å²	127.8	74%	0.741	76%	0.762	S	S	*	*			cis	174.2	165.8	27.7	20.3	0	0	0	0	105.3
115	S	31.3	Very low	31.6	Very low	95 Å²	95	125 Å²	125	66%	0.664	75%	0.754	S	S	*	*			cis	-178.8	158.6	4	41.6	0	0	0	0	108.3
116	N	29	Very low	31.6	Very low	160 Å²	160	125.5 Å²	125.5	86%	0.856	75%	0.748	S	S	*	*			trans	40.8	144.9	138.1	-60.7	2.3	0	0	0	121.5
117	A	30	Very low	30.7	Very low	83 Å²	83	125.6 Å²	125.6	69%	0.686	75%	0.747	S	S	*	*			cis	-171.6	166.5	-5.9	0	0	0	0	0	111
118	S	30.9	Very low	30.6	Very low	108 Å²	108	133 Å²	133	76%	0.755	76%	0.755	S	S	*	*			trans	36	121.8	149.4	-47.8	0	0	0	0	122.3
119	N	29.7	Very low	30.3	Very low	162 Å²	162	138.9 Å²	138.9	87%	0.866	76%	0.759	S	S	*	*				177.5	162.6	95.7	-110	-15	0	0	0	115.8
120	H	32.2	Very low	30.8	Very low	179 Å²	179	137.8 Å²	137.8	83%	0.829	75%	0.754	S	S	*	*			trans	-62.6	149.1	171.4	-83.5	-107.2	0	0	0	114.5
121	H	28.9	Very low	30	Very low	168 Å²	168	144.9 Å²	144.9	78%	0.778	77%	0.767	S	S	*	*				-173.6	168.5	105.3	-155.9	65.9	0	0	0	113
122	L	29.7	Very low	29.8	Very low	139 Å²	139	145 Å²	145	73%	0.728	77%	0.768	S	S	*	*			trans	-81	154.5	-175.8	-64	119	0	0	0	114.5
123	H	27.9	Very low	29.6	Very low	191 Å²	191	148 Å²	148	88%	0.884	78%	0.776	S	S	*	*			trans	-162	132.7	140.6	-125.8	-75.5	0	0	0	114
124	E	27.3	Very low	29.4	Very low	129 Å²	129	148 Å²	148	60%	0.603	78%	0.776	S	S	*	*			trans	-92.6	159.7	158	-151.4	-154.8	114.6	0	0	108.5	Q126	E124-Q126 PolarHBondContact OE1-N 3.46Å; E124-Q126 PolarHBondContact OE1-NE2 3.36Å
125	P	35.9	Very low	29.3	Very low	114 Å²	114	148.4 Å²	148.4	74%	0.74	78%	0.779	S	S	*	*				-152.5	141	89.5	37.1	-17.4	0	0	0	117.8
126	Q	27.4	Very low	29.3	Very low	139 Å²	139	149.6 Å²	149.6	65%	0.65	78%	0.784	S	S	*	*				57.5	116.8	129.8	-62.4	-71.9	-74.9	0	0	123.3	E124	E124-Q126 PolarHBondContact OE1-N 3.46Å; E124-Q126 PolarHBondContact OE1-NE2 3.36Å
127	V	27.3	Very low	29.3	Very low	113 Å²	113	148.1 Å²	148.1	69%	0.685	78%	0.781	S	S	*	*				78	108.9	128.7	-179.4	0	0	0	0	120.8
128	R	25.4	Very low	29.2	Very low	248 Å²	248	150 Å²	150	94%	0.936	78%	0.784	S	S	*	*				-170	136.7	115.5	-100.4	169.8	-166.8	-172.5	4.1	113
129	R	27	Very low	29.1	Very low	241 Å²	241	150 Å²	150	91%	0.909	78%	0.78	S	S	*	*			trans	-124	175.9	166.2	-92.9	-171	178.3	-176.9	1.5	107.5
130	P	38.9	Very low	29	Very low	108 Å²	108	149.2 Å²	149.2	70%	0.701	77%	0.774	S	S	*	*			cis	-130.6	170.9	-48	38.4	-24.3	0	0	0	111.1
131	R	27.3	Very low	28.7	Very low	252 Å²	252	146 Å²	146	95%	0.951	77%	0.772	S	S	*	*			trans	-143.9	146.2	154.2	-80.7	-160.8	174.2	140.9	1.6	112.5
132	S	27.6	Very low	28.8	Very low	107 Å²	107	144 Å²	144	75%	0.748	77%	0.772	S	S	*	*			trans	-100.5	179.2	-175.6	-46.9	0	0	0	0	111.9
133	L	26.3	Very low	29.5	Very low	158 Å²	158	142.5 Å²	142.5	83%	0.827	77%	0.77	S	S	*	*			trans	113.6	115.1	149	-61.8	-179.8	0	0	0	118.5
134	S	25.7	Very low	29.6	Very low	109 Å²	109	140.7 Å²	140.7	76%	0.762	77%	0.766	S	S	*	*				82	131.3	125	-58.5	0	0	0	0	122
135	S	29.9	Very low	29.7	Very low	113 Å²	113	143.8 Å²	143.8	79%	0.79	78%	0.781	S	S	*	*			trans	-63.2	162.6	163.7	-30.6	0	0	0	0	113.3
136	P	31.6	Very low	29.3	Very low	120 Å²	120	142.1 Å²	142.1	78%	0.779	79%	0.785	S	S	*	*			trans	-107.8	143.7	152.9	34.6	-25.9	0	0	0	112.8
137	T	29	Very low	29.4	Very low	130 Å²	130	139.7 Å²	139.7	80%	0.798	79%	0.788	S	S	*	*			trans	-119.3	141.2	165.2	-66.2	0	0	0	0	108.1
138	V	28.2	Very low	29.5	Very low	122 Å²	122	142.5 Å²	142.5	74%	0.739	80%	0.8	S	S	*	*			trans	-143.1	103.5	175.7	178.8	0	0	0	0	105.4
139	T	27.5	Very low	29.7	Very low	109 Å²	109	137.3 Å²	137.3	67%	0.669	79%	0.79	S	S	*	*				50.7	142.2	80.5	64.1	0	0	0	0	113.9
140	L	27.6	Very low	29.8	Very low	144 Å²	144	131.6 Å²	131.6	75%	0.754	78%	0.777	S	S	*	*			cis	-158.3	158.9	-2.2	-122	157.2	0	0	0	106
141	S	27.3	Very low	29.2	Very low	113 Å²	113	134.6 Å²	134.6	79%	0.79	78%	0.781	S	S	*	*				174.9	149.2	103	-67.4	0	0	0	0	112.3
142	T	29.8	Very low	29.4	Very low	126 Å²	126	128.3 Å²	128.3	77%	0.773	77%	0.771	S	S	*	*			trans	-111.9	-158.8	171.3	52.4	0	0	0	0	108.4
143	P	45.2	Very low	29.4	Very low	106 Å²	106	134.3 Å²	134.3	69%	0.688	78%	0.777	S	S	*	*			cis	-141.3	178.2	-5.6	39.6	-18.8	0	0	0	117.2
144	L	29.3	Very low	29.4	Very low	153 Å²	153	138.1 Å²	138.1	80%	0.801	78%	0.78	S	S	*	*			trans	170	118.8	134.2	-111.6	75.9	0	0	0	106.7
145	E	29.8	Very low	29.4	Very low	195 Å²	195	137.7 Å²	137.7	91%	0.911	78%	0.783	S	S	*	*				88.8	126.4	54.4	-157.6	175.3	-127.8	0	0	114.2
146	G	28.3	Very low	29.4	Very low	79 Å²	79	138.5 Å²	138.5	81%	0.814	78%	0.783	S	S	*	*			trans	145.6	119.2	176.7	0	0	0	0	0	114.5
147	A	29.3	Very low	29	Very low	88 Å²	88	142.2 Å²	142.2	73%	0.727	79%	0.787	S	S	*	*			trans	-119	156.6	-170.7	0	0	0	0	0	114.3
148	N	29.5	Very low	28.9	Very low	172 Å²	172	142.2 Å²	142.2	92%	0.92	78%	0.782	S	S	*	*				167.7	-176.9	124.1	-88.4	-42.5	0	0	0	114.3
149	N	27.6	Very low	28.9	Very low	139 Å²	139	143.3 Å²	143.3	74%	0.743	79%	0.789	S	S	*	*			trans	-128.7	158.1	-139.6	-144	-8.3	0	0	0	114.3
150	I	30.4	Very low	28.9	Very low	121 Å²	121	145.7 Å²	145.7	62%	0.621	80%	0.797	S	S	*	*			trans	85.1	125.7	142.6	-85.1	162.2	0	0	0	123.6
151	Q	27	Very low	28.8	Very low	171 Å²	171	145 Å²	145	80%	0.799	80%	0.804	S	S	*	*			trans	66.7	159.4	150.2	-74.3	169.4	34.3	0	0	122.2
152	V	30	Very low	28.6	Very low	120 Å²	120	147 Å²	147	73%	0.727	81%	0.806	S	S	*	*			cis	-178.8	150.9	-41.8	128.7	0	0	0	0	110.2
153	R	27.4	Very low	29.3	Very low	233 Å²	233	145.6 Å²	145.6	88%	0.879	80%	0.799	S	S	*	*			trans	100	130.3	176.6	-65.4	171.8	179.1	-171.4	-0.6	114.9
154	R	27.5	Very low	28.2	Very low	238 Å²	238	149.9 Å²	149.9	90%	0.898	81%	0.81	S	S	*	*			cis	106.5	109	25.6	-176.3	-167.9	-157.1	179.7	9.1	111.8
155	A	25.9	Very low	28	Very low	100 Å²	100	147.9 Å²	147.9	83%	0.826	81%	0.809	S	S	*	*			trans	-162.6	152.9	148.9	0	0	0	0	0	111.2
156	V	29.2	Very low	28.2	Very low	129 Å²	129	144.3 Å²	144.3	78%	0.782	80%	0.802	S	S	*	*			trans	-137.2	150.1	-176.8	-170.3	0	0	0	0	107.2
157	K	24.3	Very low	28	Very low	199 Å²	199	148.4 Å²	148.4	87%	0.865	80%	0.8	S	S	*	*			trans	-155.8	124.2	154.6	-154	171.3	-178.2	-179	0	114.1
158	D	25.9	Very low	27.7	Very low	130 Å²	130	151.4 Å²	151.4	70%	0.695	80%	0.803	S	S	*	*			trans	-81.7	165.6	170.4	-56.4	-72.1	0	0	0	112.9
159	T	27.8	Very low	27.5	Very low	144 Å²	144	148.9 Å²	148.9	88%	0.883	80%	0.799	S	S	*	*			trans	-151.4	137.9	143.6	-28.6	0	0	0	0	110.7
160	L	28.3	Very low	27.5	Very low	159 Å²	159	147.7 Å²	147.7	83%	0.832	80%	0.799	S	S	*	*			trans	-119.1	144.7	-177.6	-90.1	159.1	0	0	0	110.4
161	S	24.9	Very low	27.4	Very low	130 Å²	130	153.3 Å²	153.3	91%	0.909	81%	0.814	S	S	*	*			trans	-173.6	157.7	143.8	-82.4	0	0	0	0	111.6
162	N	24.2	Very low	27.4	Very low	154 Å²	154	150.6 Å²	150.6	82%	0.824	81%	0.814	S	S	*	*			trans	-128.8	-165.6	-165.2	-163.6	39	0	0	0	110.4
163	P	42.9	Very low	27.3	Very low	97 Å²	97	150.1 Å²	150.1	63%	0.63	82%	0.816	S	S	*	*				-104.4	160.8	-80.8	35.5	-24.2	0	0	0	114.4
164	Q	23	Very low	27.4	Very low	197 Å²	197	145 Å²	145	92%	0.921	81%	0.813	S	S	*	*			trans	-161.8	141.8	149.5	-125.1	166.4	-13.2	0	0	114.5
165	S	24.4	Very low	27.3	Very low	111 Å²	111	143.4 Å²	143.4	78%	0.776	81%	0.812	S	S	*	*			trans	-127	168.7	164.7	-53.9	0	0	0	0	107.5
166	P	35.3	Very low	27.2	Very low	119 Å²	119	143.6 Å²	143.6	77%	0.773	81%	0.808	S	S	*	*			cis	-126.2	178.7	-7.8	40.3	-25.5	0	0	0	113.3
167	Q	22.1	Very low	27	Very low	165 Å²	165	146.3 Å²	146.3	77%	0.771	81%	0.812	S	S	*	*				152.9	120.6	123.3	-170.4	165.4	-1	0	0	114.6
168	L	25.1	Very low	27.1	Very low	151 Å²	151	145.3 Å²	145.3	79%	0.791	81%	0.81	S	S	*	*			trans	32.4	126.5	150.4	-57.2	169.4	0	0	0	121.8
169	S	23.4	Very low	27.1	Very low	119 Å²	119	148.6 Å²	148.6	83%	0.832	82%	0.818	S	S	*	*			trans	-149.1	158.3	152.2	-72.2	0	0	0	0	109.1
170	P	29.1	Very low	27	Very low	114 Å²	114	147.7 Å²	147.7	74%	0.74	81%	0.813	S	S	*	*			trans	-124.3	140.8	-132.4	37.6	-25.6	0	0	0	115.5
171	Y	28.7	Very low	27.1	Very low	239 Å²	239	149.1 Å²	149.1	94%	0.937	82%	0.815	S	S	*	*			trans	-158.3	136.8	146.8	-120	-82.3	0	0	0	111.2
172	S	26.4	Very low	27.5	Very low	114 Å²	114	151 Å²	151	80%	0.797	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-83.7	123.2	-171.1	-54.8	0	0	0	0	112.7
173	S	26.9	Very low	28.4	Very low	111 Å²	111	146.8 Å²	146.8	78%	0.776	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-69.5	135.7	171.8	-53.1	0	0	0	0	112
174	P	29.2	Very low	29.2	Very low	125 Å²	125	149.1 Å²	149.1	81%	0.812	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-63.8	136	166.3	-18.7	31.9	0	0	0	110.7	S176	P174-S176 PolarHBondContact O-N 3.35Å
175	K	25.3	Very low	31.2	Very low	204 Å²	204	141.7 Å²	141.7	89%	0.887	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-66.9	116.6	176.6	-67.1	176.5	178.6	177.5	0	110	Q177	K175-Q177 PolarHBondContact O-N 2.86Å; K175-Q177 VanDerWaalsContact O-N 3.15Å
176	S	24.9	Very low	33.6	Very low	105 Å²	105	137.7 Å²	137.7	73%	0.734	73%	0.73	S	S	*	*			trans	-68.6	106.8	171.5	53.3	0	0	0	0	110.4	P174 H178	P174-S176 PolarHBondContact O-N 3.35Å; S176-H178 PolarHBondContact O-N 3.29Å
177	Q	24.7	Very low	34.9	Very low	185 Å²	185	137.9 Å²	137.9	86%	0.864	73%	0.732	S	S	*	*			trans	-65.7	121.6	162.3	-73.1	-179.9	-23.8	0	0	108.4	K175 K179	K175-Q177 PolarHBondContact O-N 2.86Å; K175-Q177 VanDerWaalsContact O-N 3.15Å; Q177-K179 PolarHBondContact O-N 2.8Å
178	H	26.6	Very low	37	Very low	179 Å²	179	131.6 Å²	131.6	83%	0.829	71%	0.711	S	S	*	*			trans	-63.2	101.9	169.8	-84.3	-91.4	0	0	0	109.4	S176 T180	S176-H178 PolarHBondContact O-N 3.29Å; H178-T180 PolarHBondContact O-N 3.36Å
179	K	25.1	Very low	39.6	Very low	199 Å²	199	127 Å²	127	87%	0.865	68%	0.683	S	S	*	*			trans	-75.5	110.2	155.2	-86.2	-172.9	173.9	-178.2	0	107.5	Q177 Q181	Q177-K179 PolarHBondContact O-N 2.8Å; K179-Q181 PolarHBondContact O-N 2.9Å
180	T	27.1	Very low	42.2	Very low	125 Å²	125	124.3 Å²	124.3	77%	0.767	66%	0.657	S	S	*	*			trans	-58.7	119.4	173.5	-32.4	0	0	0	0	109.2	H178 Q182	H178-T180 PolarHBondContact O-N 3.36Å; T180-Q182 PolarHBondContact O-N 2.97Å
181	Q	28.8	Very low	44.9	Very low	188 Å²	188	123 Å²	123	88%	0.879	64%	0.642	S	S	*	*			trans	-65.8	103.2	169.5	-74.8	176.5	-23.1	0	0	108.2	K179 S183	K179-Q181 PolarHBondContact O-N 2.9Å; Q181-S183 VanDerWaalsContact C-N 3.33Å; Q181-S183 PolarHBondContact O-N 3.26Å
182	Q	34.3	Very low	47.1	Very low	171 Å²	171	117.5 Å²	117.5	80%	0.799	62%	0.62	S	S	*	*			trans	-73.3	92.1	169.9	-76.9	-173	-15.8	0	0	108.7	T180 F184	T180-Q182 PolarHBondContact O-N 2.97Å; Q182-F184 PolarHBondContact O-N 3.29Å
183	S	43.8	Very low	49.5	Very low	64 Å²	64	117.8 Å²	117.8	45%	0.448	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-62.2	125.6	170.1	63.5	0	0	0	0	109.6	Q181 R215	Q181-S183 VanDerWaalsContact C-N 3.33Å; Q181-S183 PolarHBondContact O-N 3.26Å; S183-R215 PolarHBondContact O-NH1 3.26Å; S183-R215 PolarHBondContact OG-NH1 2.99Å; S183-R215 PolarHBondContact OG-NH2 3.33Å
184	F	58.4	Low	51.9	Low	146 Å²	146	113 Å²	113	64%	0.64	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-62.2	142.5	-174	-56.5	-81.2	0	0	0	112.7	Q182 R215	Q182-F184 PolarHBondContact O-N 3.29Å; F184-R215 VanDerWaalsContact O-CD 3.31Å; F184-R215 WeakPolarHBondContact O-CD 3.39Å; F184-R215 PolarHBondContact O-NH1 3.14Å
185	L	66.3	Low	53.6	Low	41 Å²	41	114.3 Å²	114.3	22%	0.215	59%	0.587	C	S	.	*	P	Polyproline II helix	trans	-102.9	164.5	168.7	-66.6	171.2	0	0	0	109.9	W189 E190 M191 F201 P214	L185-W189 HydrophobicContact CB-CB 3.83Å; L185-W189 HydrophobicContact CD1-CB 4.17Å; L185-W189 WeakPolarHBondContact CD1-O 3.12Å; L185-E190 VanDerWaalsContact CD1-C 3.48Å; L185-M191 HydrophobicContact CD1-CB 3.89Å; L185-M191 VanDerWaalsContact CD1-N 3.25Å; L185-F201 HydrophobicContact CD1-CD1 4.11Å; L185-F201 HydrophobicContact CD2-CD1 3.79Å; L185-F201 HydrophobicContact CD2-CE1 3.87Å; L185-P214 HydrophobicContact CD2-CG 3.93Å
186	P	74.4	Confident	55.7	Low	27 Å²	27	110.3 Å²	110.3	18%	0.175	58%	0.575	C	S	.	*	P	Polyproline II helix	trans	-57.6	155.4	171.9	-23.4	34.8	0	0	0	112.5	G188 W189 P214 Y218	P186-G188 PolarHBondContact O-N 3.16Å; P186-W189 HydrophobicContact CB-CG 4.47Å; P186-W189 WeakPolarHBondContact O-CB 3.43Å; P186-W189 PolarHBondContact O-N 2.87Å; P186-P214 HydrophobicContact CG-CB 4.27Å; P186-P214 HydrophobicContact CG-CG 4.34Å; P186-Y218 HydrophobicContact CG-CE2 4.14Å
187	P	61.6	Low	57.6	Low	124 Å²	124	107.9 Å²	107.9	81%	0.805	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.8	131.9	178	-27.9	36.1	0	0	0	113	W189 N205	P187-W189 VanDerWaalsContact C-N 3.33Å; P187-N205 PolarHBondContact O-ND2 2.88Å
188	G	67.6	Low	59.7	Low	33 Å²	33	105.5 Å²	105.5	34%	0.34	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	80.4	2.6	-175.9	0	0	0	0	0	115.3	P186 H204	P186-G188 PolarHBondContact O-N 3.16Å; G188-H204 VanDerWaalsContact O-CB 3.27Å; G188-H204 WeakPolarHBondContact O-CB 3.26Å; G188-H204 PolarHBondContact O-CD2 3.32Å; G188-H204 VanDerWaalsContact O-CD2 3.31Å; G188-H204 PolarHBondContact O-N 3.39Å
189	W	78.6	Confident	62	Low	55 Å²	55	99.7 Å²	99.7	21%	0.208	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	138	174.1	-72.8	75	0	0	0	112.8	L185 P186 P187 F201 I202 D203 T210 P214	L185-W189 HydrophobicContact CB-CB 3.83Å; L185-W189 HydrophobicContact CD1-CB 4.17Å; L185-W189 WeakPolarHBondContact CD1-O 3.12Å; P186-W189 HydrophobicContact CB-CG 4.47Å; P186-W189 WeakPolarHBondContact O-CB 3.43Å; P186-W189 PolarHBondContact O-N 2.87Å; P187-W189 VanDerWaalsContact C-N 3.33Å; W189-F201 HydrophobicContact CE3-CB 3.95Å; W189-F201 HydrophobicContact CZ3-CB 3.99Å; W189-I202 CarbonylContact C-O 3.59Å; W189-I202 VanDerWaalsContact CA-O 3.3Å; W189-I202 WeakPolarHBondContact CA-O 3.33Å; W189-D203 HydrophobicContact CD2-CB 3.84Å; W189-D203 HydrophobicContact CE3-CB 3.98Å; W189-D203 HydrophobicContact CH2-CB 3.78Å; W189-D203 HydrophobicContact CZ2-CB 3.57Å; W189-D203 HydrophobicContact CZ3-CB 3.97Å; W189-T210 HydrophobicContact CH2-CG2 4.01Å; W189-T210 HydrophobicContact CZ3-CG2 3.61Å; W189-P214 HydrophobicContact CB-CG 4.41Å; W189-P214 HydrophobicContact CD2-CB 3.69Å; W189-P214 HydrophobicContact CD2-CG 3.67Å; W189-P214 HydrophobicContact CE3-CB 3.7Å; W189-P214 HydrophobicContact CE3-CG 3.48Å; W189-P214 VanDerWaalsContact CE3-CG 3.48Å; W189-P214 HydrophobicContact CG-CB 4.36Å; W189-P214 HydrophobicContact CG-CG 4.12Å; W189-P214 HydrophobicContact CH2-CB 3.83Å; W189-P214 HydrophobicContact CH2-CG 4.48Å; W189-P214 HydrophobicContact CZ2-CB 3.85Å; W189-P214 HydrophobicContact CZ3-CB 3.76Å; W189-P214 HydrophobicContact CZ3-CG 3.91Å
190	E	79.3	Confident	64.4	Low	61 Å²	61	92.3 Å²	92.3	29%	0.285	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	133.5	178.8	-177.2	-172	167.6	0	0	110.5	L185 R192 F201 I202 H204	L185-E190 VanDerWaalsContact CD1-C 3.48Å; E190-R192 HydrophobicContact CG-CG 4.45Å; E190-R192 IonicContact OE1-CZ 2.91Å; E190-R192 IonicContact OE1-NE 3.73Å; E190-R192 PolarHBondContact OE1-NE 2.95Å; E190-R192 IonicContact OE1-NH2 2.74Å; E190-R192 PolarHBondContact OE1-NH2 3.39Å; E190-R192 IonicContact OE2-CZ 2.73Å; E190-R192 IonicContact OE2-NE 2.81Å; E190-R192 IonicContact OE2-NH2 2.76Å; E190-R192 PolarHBondContact OE2-NH2 2.84Å; E190-F201 CarbonylContact O-C 3.59Å; E190-F201 WeakPolarHBondContact O-CA 3.43Å; E190-I202 HydrophobicContact CB-CB 4.37Å; E190-I202 PolarHBondContact N-O 3.38Å; E190-I202 PolarHBondContact O-N 2.97Å; E190-H204 WeakPolarHBondContact CB-NE2 3.35Å; E190-H204 IonicContact OE2-CE1 3.01Å; E190-H204 PolarHBondContact OE2-CE1 3.29Å; E190-H204 IonicContact OE2-NE2 2.83Å; E190-H204 PolarHBondContact OE2-NE2 3.03Å
191	M	84.4	Confident	67.3	Low	87 Å²	87	86.9 Å²	86.9	43%	0.429	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	131.6	170.5	179	-179.7	68.8	0	0	109.8	L185 P199 F200 F201	L185-M191 HydrophobicContact CD1-CB 3.89Å; L185-M191 VanDerWaalsContact CD1-N 3.25Å; M191-P199 HydrophobicContact CG-CB 4.12Å; M191-P199 HydrophobicContact SD-CB 3.92Å; M191-F200 WeakPolarHBondContact CA-O 3.47Å; M191-F201 HydrophobicContact CB-CD1 3.84Å; M191-F201 HydrophobicContact CB-CE1 3.87Å; M191-F201 HydrophobicContact CG-CD1 4.08Å; M191-F201 HydrophobicContact CG-CE1 3.78Å; M191-F201 HydrophobicContact CG-CZ 4.41Å; M191-F201 HydrophobicContact SD-CE1 3.85Å; M191-F201 HydrophobicContact SD-CZ 4.24Å
192	R	76.3	Confident	69.5	Low	123 Å²	123	79 Å²	79	46%	0.464	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	162.5	167.9	-68.5	-163	-177.8	166.6	9.3	110.7	E190 P199 F200 I202	E190-R192 HydrophobicContact CG-CG 4.45Å; E190-R192 IonicContact OE1-CZ 2.91Å; E190-R192 IonicContact OE1-NE 3.73Å; E190-R192 PolarHBondContact OE1-NE 2.95Å; E190-R192 IonicContact OE1-NH2 2.74Å; E190-R192 PolarHBondContact OE1-NH2 3.39Å; E190-R192 IonicContact OE2-CZ 2.73Å; E190-R192 IonicContact OE2-NE 2.81Å; E190-R192 IonicContact OE2-NH2 2.76Å; E190-R192 PolarHBondContact OE2-NH2 2.84Å; R192-P199 CarbonylContact O-C 3.54Å; R192-P199 VanDerWaalsContact O-CA 3.28Å; R192-P199 WeakPolarHBondContact O-CA 3.4Å; R192-F200 HydrophobicContact CB-CD1 4.13Å; R192-F200 HydrophobicContact CB-CE1 3.53Å; R192-F200 HydrophobicContact CB-CE2 4.17Å; R192-F200 HydrophobicContact CB-CZ 3.57Å; R192-F200 HydrophobicContact CG-CZ 4.42Å; R192-F200 PolarHBondContact N-O 2.91Å; R192-F200 WeakPolarHBondContact O-CD1 3.43Å; R192-F200 PolarHBondContact O-N 3.41Å; R192-F200 VanDerWaalsContact O-O 3.1Å; R192-I202 HydrophobicContact CG-CD1 4.04Å
193	I	75.3	Confident	71.8	Confident	120 Å²	120	71.7 Å²	71.7	62%	0.615	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.2	175	-60.5	177.3	0	0	0	107.5
194	A	79	Confident	72.8	Confident	11 Å²	11	73.3 Å²	73.3	9%	0.091	39%	0.392	C	S	.	.			trans	-74.7	161.6	175.2	0	0	0	0	0	110.9	N196 G197 R198 F200 W211	A194-N196 WeakPolarHBondContact CB-OD1 3.48Å; A194-N196 PolarHBondContact O-N 3.34Å; A194-G197 PolarHBondContact O-N 3.31Å; A194-R198 PolarHBondContact N-O 3.47Å; A194-F200 HydrophobicContact CB-CD1 4.04Å; A194-F200 HydrophobicContact CB-CE1 4.18Å; A194-W211 HydrophobicContact CB-CH2 3.82Å; A194-W211 HydrophobicContact CB-CZ3 4.02Å
195	P	63.8	Low	73.4	Confident	152 Å²	152	71.8 Å²	71.8	99%	0.987	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-17.3	-177	-27.1	36.1	0	0	0	115.6	G197	P195-G197 VanDerWaalsContact C-N 3.32Å
196	N	69.2	Low	73.8	Confident	120 Å²	120	72.9 Å²	72.9	64%	0.642	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	7.2	174.2	64.2	2.5	0	0	0	114	A194 R198	A194-N196 WeakPolarHBondContact CB-OD1 3.48Å; A194-N196 PolarHBondContact O-N 3.34Å; N196-R198 VanDerWaalsContact C-N 3.3Å; N196-R198 PolarHBondContact O-N 3.36Å; N196-R198 WeakPolarHBondContact OD1-CB 3.46Å; N196-R198 PolarHBondContact OD1-N 3.04Å; N196-R198 VanDerWaalsContact OD1-N 3.08Å
197	G	65.4	Low	73.8	Confident	54 Å²	54	82.4 Å²	82.4	56%	0.557	43%	0.434	S	S	*	.	S	Bend	trans	80.9	-2.9	-178.7	0	0	0	0	0	115.4	A194 P195	A194-G197 PolarHBondContact O-N 3.31Å; P195-G197 VanDerWaalsContact C-N 3.32Å
198	R	68.7	Low	74	Confident	136 Å²	136	79.9 Å²	79.9	51%	0.513	42%	0.417	S	S	.	.			trans	-81.1	131.2	179.6	-170.8	178.8	177.1	175.6	0.7	111	A194 N196 W211	A194-R198 PolarHBondContact N-O 3.47Å; N196-R198 VanDerWaalsContact C-N 3.3Å; N196-R198 PolarHBondContact O-N 3.36Å; N196-R198 WeakPolarHBondContact OD1-CB 3.46Å; N196-R198 PolarHBondContact OD1-N 3.04Å; N196-R198 VanDerWaalsContact OD1-N 3.08Å; R198-W211 HydrophobicContact CB-CZ3 4.1Å; R198-W211 HydrophobicContact CG-CE3 3.95Å; R198-W211 HydrophobicContact CG-CZ3 3.98Å
199	P	74.3	Confident	74.5	Confident	57 Å²	57	83 Å²	83	37%	0.37	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	146.1	171.7	29.5	-34.1	0	0	0	111.6	M191 R192	M191-P199 HydrophobicContact CG-CB 4.12Å; M191-P199 HydrophobicContact SD-CB 3.92Å; R192-P199 CarbonylContact O-C 3.54Å; R192-P199 VanDerWaalsContact O-CA 3.28Å; R192-P199 WeakPolarHBondContact O-CA 3.4Å
200	F	75.8	Confident	74.3	Confident	44 Å²	44	82 Å²	82	19%	0.193	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	156.4	168.6	71.7	-82.7	0	0	0	109.7	M191 R192 A194 I202 T209 W211	M191-F200 WeakPolarHBondContact CA-O 3.47Å; R192-F200 HydrophobicContact CB-CD1 4.13Å; R192-F200 HydrophobicContact CB-CE1 3.53Å; R192-F200 HydrophobicContact CB-CE2 4.17Å; R192-F200 HydrophobicContact CB-CZ 3.57Å; R192-F200 HydrophobicContact CG-CZ 4.42Å; R192-F200 PolarHBondContact N-O 2.91Å; R192-F200 WeakPolarHBondContact O-CD1 3.43Å; R192-F200 PolarHBondContact O-N 3.41Å; R192-F200 VanDerWaalsContact O-O 3.1Å; A194-F200 HydrophobicContact CB-CD1 4.04Å; A194-F200 HydrophobicContact CB-CE1 4.18Å; F200-I202 HydrophobicContact CD2-CG1 4.13Å; F200-I202 HydrophobicContact CE2-CD1 3.91Å; F200-I202 HydrophobicContact CE2-CG1 3.81Å; F200-T209 HydrophobicContact CE2-CG2 4.44Å; F200-W211 HydrophobicContact CB-CD2 4.15Å; F200-W211 HydrophobicContact CB-CE3 3.62Å; F200-W211 HydrophobicContact CB-CH2 4.3Å; F200-W211 HydrophobicContact CB-CZ3 3.71Å; F200-W211 HydrophobicContact CD1-CZ3 4.33Å; F200-W211 HydrophobicContact CG-CZ3 4.37Å
201	F	87.3	Confident	74.2	Confident	11 Å²	11	85.2 Å²	85.2	5%	0.048	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.4	-172.9	-52	-89.5	0	0	0	109.9	L185 W189 E190 M191 T209 T210 E212 D213	L185-F201 HydrophobicContact CD1-CD1 4.11Å; L185-F201 HydrophobicContact CD2-CD1 3.79Å; L185-F201 HydrophobicContact CD2-CE1 3.87Å; W189-F201 HydrophobicContact CE3-CB 3.95Å; W189-F201 HydrophobicContact CZ3-CB 3.99Å; E190-F201 CarbonylContact O-C 3.59Å; E190-F201 WeakPolarHBondContact O-CA 3.43Å; M191-F201 HydrophobicContact CB-CD1 3.84Å; M191-F201 HydrophobicContact CB-CE1 3.87Å; M191-F201 HydrophobicContact CG-CD1 4.08Å; M191-F201 HydrophobicContact CG-CE1 3.78Å; M191-F201 HydrophobicContact CG-CZ 4.41Å; M191-F201 HydrophobicContact SD-CE1 3.85Å; M191-F201 HydrophobicContact SD-CZ 4.24Å; F201-T209 CarbonylContact O-C 3.6Å; F201-T209 WeakPolarHBondContact O-CA 3.12Å; F201-T210 HydrophobicContact CB-CG2 4.14Å; F201-T210 PolarHBondContact N-O 3Å; F201-T210 PolarHBondContact O-N 3.47Å; F201-E212 WeakPolarHBondContact CD2-O 3.3Å; F201-D213 HydrophobicContact CD2-CB 4.46Å; F201-D213 HydrophobicContact CE1-CB 4.36Å; F201-D213 VanDerWaalsContact CE2-CA 3.49Å; F201-D213 HydrophobicContact CE2-CB 3.78Å; F201-D213 HydrophobicContact CZ-CB 3.72Å; F201-D213 WeakPolarHBondContact CZ-OD2 3.5Å
202	I	75.8	Confident	73.4	Confident	23 Å²	23	86.1 Å²	86.1	12%	0.118	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122.9	-178.6	-49.2	-178.4	0	0	0	106.8	W189 E190 R192 F200 T209	W189-I202 CarbonylContact C-O 3.59Å; W189-I202 VanDerWaalsContact CA-O 3.3Å; W189-I202 WeakPolarHBondContact CA-O 3.33Å; E190-I202 HydrophobicContact CB-CB 4.37Å; E190-I202 PolarHBondContact N-O 3.38Å; E190-I202 PolarHBondContact O-N 2.97Å; R192-I202 HydrophobicContact CG-CD1 4.04Å; F200-I202 HydrophobicContact CD2-CG1 4.13Å; F200-I202 HydrophobicContact CE2-CD1 3.91Å; F200-I202 HydrophobicContact CE2-CG1 3.81Å; I202-T209 HydrophobicContact CB-CG2 4.43Å; I202-T209 HydrophobicContact CG1-CG2 4.03Å; I202-T209 HydrophobicContact CG2-CG2 4.22Å
203	D	82.1	Confident	73.2	Confident	17 Å²	17	81.5 Å²	81.5	9%	0.091	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	106	170.4	-178.7	8.2	0	0	0	109	W189 N205 S206 R207 T208	W189-D203 HydrophobicContact CD2-CB 3.84Å; W189-D203 HydrophobicContact CE3-CB 3.98Å; W189-D203 HydrophobicContact CH2-CB 3.78Å; W189-D203 HydrophobicContact CZ2-CB 3.57Å; W189-D203 HydrophobicContact CZ3-CB 3.97Å; D203-N205 PolarHBondContact O-N 2.84Å; D203-N205 WeakPolarHBondContact OD1-CA 3.35Å; D203-N205 WeakPolarHBondContact OD1-CB 3.38Å; D203-N205 PolarHBondContact OD1-N 3.32Å; D203-N205 PolarHBondContact OD1-ND2 3.09Å; D203-S206 WeakPolarHBondContact CB-OG 3.25Å; D203-S206 PolarHBondContact OD1-N 3.34Å; D203-S206 WeakPolarHBondContact OD2-CB 3.49Å; D203-S206 PolarHBondContact OD2-N 3.15Å; D203-S206 PolarHBondContact OD2-OG 2.78Å; D203-R207 WeakPolarHBondContact O-CA 3.35Å; D203-R207 PolarHBondContact O-N 2.98Å; D203-T208 PolarHBondContact N-O 3.28Å; D203-T208 PolarHBondContact O-N 3.47Å
204	H	64.7	Low	72.6	Confident	98 Å²	98	76 Å²	76	45%	0.454	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-16.5	177.1	-66.7	-80.3	0	0	0	112.8	G188 E190	G188-H204 VanDerWaalsContact O-CB 3.27Å; G188-H204 WeakPolarHBondContact O-CB 3.26Å; G188-H204 PolarHBondContact O-CD2 3.32Å; G188-H204 VanDerWaalsContact O-CD2 3.31Å; G188-H204 PolarHBondContact O-N 3.39Å; E190-H204 WeakPolarHBondContact CB-NE2 3.35Å; E190-H204 IonicContact OE2-CE1 3.01Å; E190-H204 PolarHBondContact OE2-CE1 3.29Å; E190-H204 IonicContact OE2-NE2 2.83Å; E190-H204 PolarHBondContact OE2-NE2 3.03Å
205	N	71.8	Confident	72.1	Confident	113 Å²	113	80.2 Å²	80.2	60%	0.604	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-47	177.3	-47.7	-71.4	0	0	0	110.8	P187 D203	P187-N205 PolarHBondContact O-ND2 2.88Å; D203-N205 PolarHBondContact O-N 2.84Å; D203-N205 WeakPolarHBondContact OD1-CA 3.35Å; D203-N205 WeakPolarHBondContact OD1-CB 3.38Å; D203-N205 PolarHBondContact OD1-N 3.32Å; D203-N205 PolarHBondContact OD1-ND2 3.09Å
206	S	74.9	Confident	71.7	Confident	64 Å²	64	80.3 Å²	80.3	45%	0.448	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-11.8	177.4	69.9	0	0	0	0	114.1	D203 T208	D203-S206 WeakPolarHBondContact CB-OG 3.25Å; D203-S206 PolarHBondContact OD1-N 3.34Å; D203-S206 WeakPolarHBondContact OD2-CB 3.49Å; D203-S206 PolarHBondContact OD2-N 3.15Å; D203-S206 PolarHBondContact OD2-OG 2.78Å; S206-T208 VanDerWaalsContact C-N 3.3Å; S206-T208 PolarHBondContact OG-OG1 3.01Å; S206-T208 VanDerWaalsContact OG-OG1 3.09Å
207	R	74.1	Confident	70.7	Confident	227 Å²	227	81.1 Å²	81.1	86%	0.857	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	33.1	-172.7	-54.3	-179.6	-178.5	171.9	0.6	113.8	D203	D203-R207 WeakPolarHBondContact O-CA 3.35Å; D203-R207 PolarHBondContact O-N 2.98Å
208	T	66.3	Low	69.4	Low	71 Å²	71	86.6 Å²	86.6	44%	0.436	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	163.6	175.6	70.7	0	0	0	0	112.4	D203 S206	D203-T208 PolarHBondContact N-O 3.28Å; D203-T208 PolarHBondContact O-N 3.47Å; S206-T208 VanDerWaalsContact C-N 3.3Å; S206-T208 PolarHBondContact OG-OG1 3.01Å; S206-T208 VanDerWaalsContact OG-OG1 3.09Å
209	T	78.4	Confident	68	Low	98 Å²	98	84.4 Å²	84.4	60%	0.601	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	146.8	171.4	57.9	0	0	0	0	110.2	F200 F201 I202	F200-T209 HydrophobicContact CE2-CG2 4.44Å; F201-T209 CarbonylContact O-C 3.6Å; F201-T209 WeakPolarHBondContact O-CA 3.12Å; I202-T209 HydrophobicContact CB-CG2 4.43Å; I202-T209 HydrophobicContact CG1-CG2 4.03Å; I202-T209 HydrophobicContact CG2-CG2 4.22Å
210	T	74.4	Confident	66.5	Low	34 Å²	34	88.1 Å²	88.1	21%	0.209	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152.7	-179.5	175.6	0	0	0	0	111.1	W189 F201 E212	W189-T210 HydrophobicContact CH2-CG2 4.01Å; W189-T210 HydrophobicContact CZ3-CG2 3.61Å; F201-T210 HydrophobicContact CB-CG2 4.14Å; F201-T210 PolarHBondContact N-O 3Å; F201-T210 PolarHBondContact O-N 3.47Å; T210-E212 VanDerWaalsContact C-N 3.33Å; T210-E212 WeakPolarHBondContact CG2-O 3.35Å; T210-E212 PolarHBondContact OG1-N 3.2Å; T210-E212 VanDerWaalsContact OG1-N 3.08Å
211	W	76.2	Confident	64.8	Low	130 Å²	130	94.1 Å²	94.1	49%	0.492	46%	0.46	S	S	.	.	S	Bend	trans	-90	-1.3	173.2	-61.1	99	0	0	0	113	A194 R198 F200	A194-W211 HydrophobicContact CB-CH2 3.82Å; A194-W211 HydrophobicContact CB-CZ3 4.02Å; R198-W211 HydrophobicContact CB-CZ3 4.1Å; R198-W211 HydrophobicContact CG-CE3 3.95Å; R198-W211 HydrophobicContact CG-CZ3 3.98Å; F200-W211 HydrophobicContact CB-CD2 4.15Å; F200-W211 HydrophobicContact CB-CE3 3.62Å; F200-W211 HydrophobicContact CB-CH2 4.3Å; F200-W211 HydrophobicContact CB-CZ3 3.71Å; F200-W211 HydrophobicContact CD1-CZ3 4.33Å; F200-W211 HydrophobicContact CG-CZ3 4.37Å
212	E	68.4	Low	62.2	Low	105 Å²	105	102.6 Å²	102.6	49%	0.491	50%	0.501	S	S	.	.	S	Bend	trans	-106.6	136.2	-177.2	-61.3	173.4	162.5	0	0	110	F201 T210 K217	F201-E212 WeakPolarHBondContact CD2-O 3.3Å; T210-E212 VanDerWaalsContact C-N 3.33Å; T210-E212 WeakPolarHBondContact CG2-O 3.35Å; T210-E212 PolarHBondContact OG1-N 3.2Å; T210-E212 VanDerWaalsContact OG1-N 3.08Å; E212-K217 WeakPolarHBondContact OE2-CE 3.5Å; E212-K217 IonicContact OE2-NZ 3.44Å; E212-K217 PolarHBondContact OE2-NZ 3.23Å
213	D	71.9	Confident	60.6	Low	26 Å²	26	108.2 Å²	108.2	14%	0.139	52%	0.521	C	S	.	.			trans	-71.1	124.6	-177.3	-167.7	-45.1	0	0	0	110.9	F201 R215 L216	F201-D213 HydrophobicContact CD2-CB 4.46Å; F201-D213 HydrophobicContact CE1-CB 4.36Å; F201-D213 VanDerWaalsContact CE2-CA 3.49Å; F201-D213 HydrophobicContact CE2-CB 3.78Å; F201-D213 HydrophobicContact CZ-CB 3.72Å; F201-D213 WeakPolarHBondContact CZ-OD2 3.5Å; D213-R215 PolarHBondContact O-N 3.24Å; D213-R215 VanDerWaalsContact O-N 3.07Å; D213-R215 WeakPolarHBondContact OD1-CB 3.3Å; D213-R215 VanDerWaalsContact OD1-CG 3.28Å; D213-R215 WeakPolarHBondContact OD1-CG 3.28Å; D213-R215 IonicContact OD1-CZ 3.29Å; D213-R215 PolarHBondContact OD1-N 3.14Å; D213-R215 IonicContact OD1-NE 3.35Å; D213-R215 PolarHBondContact OD1-NE 2.86Å; D213-R215 IonicContact OD1-NH2 3.15Å; D213-R215 IonicContact OD2-CZ 2.75Å; D213-R215 VanDerWaalsContact OD2-CZ 3.28Å; D213-R215 IonicContact OD2-NE 2.79Å; D213-R215 PolarHBondContact OD2-NE 3.24Å; D213-R215 VanDerWaalsContact OD2-NE 3.12Å; D213-R215 IonicContact OD2-NH2 2.8Å; D213-R215 PolarHBondContact OD2-NH2 3.46Å; D213-L216 HydrophobicContact CB-CD1 4.07Å; D213-L216 HydrophobicContact CB-CG 4.21Å; D213-L216 PolarHBondContact O-N 3.25Å; D213-L216 VanDerWaalsContact O-N 3.08Å
214	P	62.5	Low	58.1	Low	5 Å²	5	113.9 Å²	113.9	3%	0.032	55%	0.552	C	S	.	*	G	3₁₀ helix	trans	-59.3	-23.2	-179.2	26.7	-38.1	0	0	0	113.3	L185 P186 W189 L216 K217 Y218	L185-P214 HydrophobicContact CD2-CG 3.93Å; P186-P214 HydrophobicContact CG-CB 4.27Å; P186-P214 HydrophobicContact CG-CG 4.34Å; W189-P214 HydrophobicContact CB-CG 4.41Å; W189-P214 HydrophobicContact CD2-CB 3.69Å; W189-P214 HydrophobicContact CD2-CG 3.67Å; W189-P214 HydrophobicContact CE3-CB 3.7Å; W189-P214 HydrophobicContact CE3-CG 3.48Å; W189-P214 VanDerWaalsContact CE3-CG 3.48Å; W189-P214 HydrophobicContact CG-CB 4.36Å; W189-P214 HydrophobicContact CG-CG 4.12Å; W189-P214 HydrophobicContact CH2-CB 3.83Å; W189-P214 HydrophobicContact CH2-CG 4.48Å; W189-P214 HydrophobicContact CZ2-CB 3.85Å; W189-P214 HydrophobicContact CZ3-CB 3.76Å; W189-P214 HydrophobicContact CZ3-CG 3.91Å; P214-L216 VanDerWaalsContact C-N 3.25Å; P214-L216 PolarHBondContact O-N 3.17Å; P214-K217 PolarHBondContact O-N 3.36Å; P214-Y218 WeakPolarHBondContact O-CD2 3.09Å
215	R	67.7	Low	56.6	Low	100 Å²	100	116.1 Å²	116.1	38%	0.377	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-70.3	-22.2	179.9	-60.8	173.5	-72.4	-171.3	8.7	113.1	S183 F184 D213 K217	S183-R215 PolarHBondContact O-NH1 3.26Å; S183-R215 PolarHBondContact OG-NH1 2.99Å; S183-R215 PolarHBondContact OG-NH2 3.33Å; F184-R215 VanDerWaalsContact O-CD 3.31Å; F184-R215 WeakPolarHBondContact O-CD 3.39Å; F184-R215 PolarHBondContact O-NH1 3.14Å; D213-R215 PolarHBondContact O-N 3.24Å; D213-R215 VanDerWaalsContact O-N 3.07Å; D213-R215 WeakPolarHBondContact OD1-CB 3.3Å; D213-R215 VanDerWaalsContact OD1-CG 3.28Å; D213-R215 WeakPolarHBondContact OD1-CG 3.28Å; D213-R215 IonicContact OD1-CZ 3.29Å; D213-R215 PolarHBondContact OD1-N 3.14Å; D213-R215 IonicContact OD1-NE 3.35Å; D213-R215 PolarHBondContact OD1-NE 2.86Å; D213-R215 IonicContact OD1-NH2 3.15Å; D213-R215 IonicContact OD2-CZ 2.75Å; D213-R215 VanDerWaalsContact OD2-CZ 3.28Å; D213-R215 IonicContact OD2-NE 2.79Å; D213-R215 PolarHBondContact OD2-NE 3.24Å; D213-R215 VanDerWaalsContact OD2-NE 3.12Å; D213-R215 IonicContact OD2-NH2 2.8Å; D213-R215 PolarHBondContact OD2-NH2 3.46Å; R215-K217 VanDerWaalsContact C-N 3.32Å
216	L	56	Low	55.2	Low	153 Å²	153	119 Å²	119	80%	0.801	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-85	-7.1	176.2	-59.7	174.1	0	0	0	112.6	D213 P214	D213-L216 HydrophobicContact CB-CD1 4.07Å; D213-L216 HydrophobicContact CB-CG 4.21Å; D213-L216 PolarHBondContact O-N 3.25Å; D213-L216 VanDerWaalsContact O-N 3.08Å; P214-L216 VanDerWaalsContact C-N 3.25Å; P214-L216 PolarHBondContact O-N 3.17Å
217	K	47.3	Very low	53.4	Low	138 Å²	138	118.8 Å²	118.8	60%	0.6	57%	0.574	S	S	*	*	S	Bend	trans	-107.6	6	-172.8	-85.6	-164.2	175.8	-179.2	0	115.9	E212 P214 R215 P219	E212-K217 WeakPolarHBondContact OE2-CE 3.5Å; E212-K217 IonicContact OE2-NZ 3.44Å; E212-K217 PolarHBondContact OE2-NZ 3.23Å; P214-K217 PolarHBondContact O-N 3.36Å; R215-K217 VanDerWaalsContact C-N 3.32Å; K217-P219 VanDerWaalsContact O-CD 3.28Å; K217-P219 WeakPolarHBondContact O-CD 3.23Å
218	Y	39.8	Very low	52	Low	169 Å²	169	113.1 Å²	113.1	66%	0.663	56%	0.558	S	S	*	*			trans	-96.8	101.8	171.2	-79.7	-85.5	0	0	0	110.4	P186 P214	P186-Y218 HydrophobicContact CG-CE2 4.14Å; P214-Y218 WeakPolarHBondContact O-CD2 3.09Å
219	P	39	Very low	50.9	Low	90 Å²	90	116.5 Å²	116.5	58%	0.584	57%	0.569	S	S	*	*			trans	-80.3	148.9	173	-2.1	23.3	0	0	0	109.1	K217 H221	K217-P219 VanDerWaalsContact O-CD 3.28Å; K217-P219 WeakPolarHBondContact O-CD 3.23Å; P219-H221 PolarHBondContact O-N 3.02Å
220	V	41.5	Very low	49.1	Very low	135 Å²	135	114.7 Å²	114.7	82%	0.818	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-58.2	-11.6	179	-168.9	0	0	0	0	113.5	M222	V220-M222 PolarHBondContact O-N 3.31Å
221	H	40.2	Very low	47.7	Very low	170 Å²	170	116.1 Å²	116.1	79%	0.787	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-82.7	3.8	-168.9	-70.3	77	0	0	0	116.5	P219	P219-H221 PolarHBondContact O-N 3.02Å
222	M	33.8	Very low	46.7	Very low	188 Å²	188	113 Å²	113	93%	0.926	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-89.9	-0.8	171.7	-91.5	-151.5	158.4	0	0	115.1	V220 N224	V220-M222 PolarHBondContact O-N 3.31Å; M222-N224 PolarHBondContact O-N 3Å
223	R	42.2	Very low	46.2	Very low	142 Å²	142	108.5 Å²	108.5	54%	0.536	55%	0.551	S	S	.	*			trans	-83.1	104.7	170.8	-151.1	178.5	-164	167.8	1.3	108.9	E232	R223-E232 IonicContact CZ-OE2 3.54Å; R223-E232 IonicContact NE-OE2 3.43Å; R223-E232 PolarHBondContact NE-OE2 3.44Å; R223-E232 IonicContact NH2-OE2 2.71Å; R223-E232 PolarHBondContact NH2-OE2 3.29Å
224	N	29.3	Very low	45.8	Very low	136 Å²	136	108.9 Å²	108.9	73%	0.727	56%	0.56	S	S	*	*			trans	-142.3	127	178.1	-140.5	-24.8	0	0	0	113.3	M222	M222-N224 PolarHBondContact O-N 3Å
225	K	32.4	Very low	46.3	Very low	145 Å²	145	114.4 Å²	114.4	63%	0.63	60%	0.597	S	S	*	*	S	Bend	trans	71.3	104.4	178.3	-64.2	-171.3	174.4	-177.5	0	119.1
226	N	42.9	Very low	46.8	Very low	172 Å²	172	111.3 Å²	111.3	92%	0.92	59%	0.587	S	S	*	*			trans	61.5	50.4	145.5	-61.8	21.4	0	0	0	118.7
227	S	37.6	Very low	47.9	Very low	60 Å²	60	105.7 Å²	105.7	42%	0.42	56%	0.56	S	S	.	*			trans	-128.5	120.9	168.6	54.1	0	0	0	0	111.2	E232	S227-E232 WeakPolarHBondContact CB-OE1 3.5Å; S227-E232 PolarHBondContact OG-OE1 3.16Å
228	M	45	Very low	49.4	Very low	108 Å²	108	103.4 Å²	103.4	53%	0.532	56%	0.559	S	S	.	*			trans	-146.7	44.8	-177.9	-131.9	161.7	87.1	0	0	110.5	R644 L648	M228-R644 VanDerWaalsContact CB-NH2 3.33Å; M228-R644 VanDerWaalsContact CE-NH2 3.3Å; M228-R644 VanDerWaalsContact CG-NH2 3.28Å; M228-R644 PolarHBondContact O-NH1 2.94Å; M228-R644 PolarHBondContact O-NH2 2.85Å; M228-L648 HydrophobicContact CE-CD1 3.82Å
229	E	42.1	Very low	51.3	Low	143 Å²	143	97 Å²	97	67%	0.668	54%	0.544	S	S	*	.			trans	-88.3	153.8	174.1	-79.6	-62.2	119.1	0	0	111.5	G231 E232	E229-G231 PolarHBondContact O-N 3.12Å; E229-E232 PolarHBondContact O-N 2.69Å
230	P	41.9	Very low	53.5	Low	60 Å²	60	94.8 Å²	94.8	39%	0.39	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-2.7	-175.9	-25.6	36.1	0	0	0	117.4
231	G	44.5	Very low	55.6	Low	64 Å²	64	91.3 Å²	91.3	66%	0.66	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-4.7	-179.5	0	0	0	0	0	116.3	E229 L233	E229-G231 PolarHBondContact O-N 3.12Å; G231-L233 PolarHBondContact O-N 3.34Å
232	E	55	Low	57.7	Low	64 Å²	64	86.3 Å²	86.3	30%	0.299	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	6.4	-166.6	-73.8	-145.2	163.3	0	0	117.5	R223 S227 E229 G234	R223-E232 IonicContact CZ-OE2 3.54Å; R223-E232 IonicContact NE-OE2 3.43Å; R223-E232 PolarHBondContact NE-OE2 3.44Å; R223-E232 IonicContact NH2-OE2 2.71Å; R223-E232 PolarHBondContact NH2-OE2 3.29Å; S227-E232 WeakPolarHBondContact CB-OE1 3.5Å; S227-E232 PolarHBondContact OG-OE1 3.16Å; E229-E232 PolarHBondContact O-N 2.69Å; E232-G234 PolarHBondContact O-N 3.28Å; E232-G234 VanDerWaalsContact O-N 3.08Å
233	L	58.6	Low	60.1	Low	11 Å²	11	82.8 Å²	82.8	6%	0.058	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	6.5	170.6	-72.6	178.8	0	0	0	113.7	G231 R266 K571 L574 L575	G231-L233 PolarHBondContact O-N 3.34Å; L233-R266 VanDerWaalsContact O-CD 3.31Å; L233-R266 WeakPolarHBondContact O-CD 3.3Å; L233-K571 HydrophobicContact CD1-CG 4.48Å; L233-L574 HydrophobicContact CD1-CB 4.37Å; L233-L574 HydrophobicContact CD2-CB 3.67Å; L233-L575 HydrophobicContact CD1-CG 4.4Å; L233-L575 HydrophobicContact CD2-CD2 3.87Å; L233-L575 HydrophobicContact CD2-CG 3.9Å; L233-L575 HydrophobicContact CG-CD2 3.71Å; L233-L575 HydrophobicContact CG-CG 3.97Å
234	G	62.7	Low	61.9	Low	33 Å²	33	80.8 Å²	80.8	34%	0.34	46%	0.456	S	S	.	.			trans	74.3	167	-167.3	0	0	0	0	0	112.3	E232 R266	E232-G234 PolarHBondContact O-N 3.28Å; E232-G234 VanDerWaalsContact O-N 3.08Å; G234-R266 PolarHBondContact O-NH1 3.46Å
235	P	72.3	Confident	64.3	Low	122 Å²	122	78 Å²	78	79%	0.792	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-59.4	147.4	173.5	28	-34.8	0	0	0	110
236	L	78.3	Confident	66.5	Low	35 Å²	35	77.7 Å²	77.7	18%	0.183	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-58	152.8	167.8	-62.2	168.6	0	0	0	109.6	W240 E242 Y252 P265 R266	L236-W240 HydrophobicContact CB-CB 3.84Å; L236-W240 HydrophobicContact CD1-CB 4.41Å; L236-E242 HydrophobicContact CD1-CB 3.85Å; L236-E242 VanDerWaalsContact CD1-N 3.35Å; L236-Y252 HydrophobicContact CD2-CD1 4.08Å; L236-Y252 HydrophobicContact CD2-CE1 3.96Å; L236-P265 HydrophobicContact CD2-CG 3.95Å; L236-R266 HydrophobicContact CD2-CG 4.49Å
237	P	80.3	Confident	67.9	Low	35 Å²	35	73 Å²	73	23%	0.227	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-56.3	150.6	175.8	-22.8	34.1	0	0	0	111.4	G239 W240 P265	P237-G239 PolarHBondContact O-N 2.85Å; P237-W240 VanDerWaalsContact O-CB 3.32Å; P237-W240 WeakPolarHBondContact O-CB 3.31Å; P237-W240 PolarHBondContact O-N 3.45Å; P237-P265 HydrophobicContact CG-CB 4.18Å; P237-P265 HydrophobicContact CG-CG 4.43Å
238	P	77.8	Confident	69.4	Low	89 Å²	89	72 Å²	72	58%	0.578	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	129.6	-175.9	-29.1	36.1	0	0	0	113.3	N256	P238-N256 PolarHBondContact O-ND2 2.66Å
239	G	79.6	Confident	70.6	Confident	34 Å²	34	70 Å²	70	35%	0.351	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	3.1	-176.8	0	0	0	0	0	115.3	P237 H255	P237-G239 PolarHBondContact O-N 2.85Å; G239-H255 VanDerWaalsContact O-CB 3.23Å; G239-H255 WeakPolarHBondContact O-CB 3.43Å; G239-H255 PolarHBondContact O-CD2 3.3Å; G239-H255 PolarHBondContact O-N 3.49Å
240	W	85.1	Confident	72.4	Confident	45 Å²	45	64 Å²	64	17%	0.17	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	143.4	172.4	-71.9	79.7	0	0	0	112.8	L236 P237 I253 D254 Q261 P265	L236-W240 HydrophobicContact CB-CB 3.84Å; L236-W240 HydrophobicContact CD1-CB 4.41Å; P237-W240 VanDerWaalsContact O-CB 3.32Å; P237-W240 WeakPolarHBondContact O-CB 3.31Å; P237-W240 PolarHBondContact O-N 3.45Å; W240-I253 CarbonylContact C-O 3.56Å; W240-I253 WeakPolarHBondContact CA-O 3.23Å; W240-D254 HydrophobicContact CD2-CB 4Å; W240-D254 HydrophobicContact CE3-CB 4.02Å; W240-D254 HydrophobicContact CH2-CB 3.71Å; W240-D254 HydrophobicContact CZ2-CB 3.67Å; W240-D254 HydrophobicContact CZ3-CB 3.88Å; W240-Q261 HydrophobicContact CH2-CG 4.09Å; W240-Q261 VanDerWaalsContact CH2-NE2 3.3Å; W240-Q261 HydrophobicContact CZ3-CG 3.82Å; W240-P265 HydrophobicContact CB-CG 4.15Å; W240-P265 HydrophobicContact CD2-CB 3.52Å; W240-P265 HydrophobicContact CD2-CG 3.59Å; W240-P265 HydrophobicContact CE3-CB 3.7Å; W240-P265 HydrophobicContact CE3-CG 3.57Å; W240-P265 HydrophobicContact CG-CB 4.07Å; W240-P265 HydrophobicContact CG-CG 3.88Å; W240-P265 HydrophobicContact CH2-CB 4.03Å; W240-P265 HydrophobicContact CZ2-CB 3.89Å; W240-P265 HydrophobicContact CZ3-CB 3.94Å; W240-P265 HydrophobicContact CZ3-CG 4.17Å
241	E	85.9	Confident	74.3	Confident	61 Å²	61	62.9 Å²	62.9	29%	0.285	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	130.9	177.4	-174.7	-175.4	173.9	0	0	110.7	R243 Y252 I253 H255	E241-R243 HydrophobicContact CG-CG 4.3Å; E241-R243 IonicContact OE1-CZ 3.43Å; E241-R243 IonicContact OE1-NE 2.64Å; E241-R243 PolarHBondContact OE1-NE 2.85Å; E241-R243 IonicContact OE1-NH2 2.77Å; E241-R243 PolarHBondContact OE1-NH2 2.96Å; E241-R243 IonicContact OE2-CZ 3.52Å; E241-R243 IonicContact OE2-NE 3.28Å; E241-R243 IonicContact OE2-NH2 3.85Å; E241-R243 PolarHBondContact OE2-NH2 2.84Å; E241-Y252 CarbonylContact O-C 3.58Å; E241-Y252 WeakPolarHBondContact O-CA 3.24Å; E241-I253 HydrophobicContact CB-CB 4.34Å; E241-I253 PolarHBondContact N-O 2.75Å; E241-I253 PolarHBondContact O-N 3.47Å; E241-H255 IonicContact OE2-CD2 3.85Å; E241-H255 IonicContact OE2-CE1 3.49Å; E241-H255 PolarHBondContact OE2-CE1 3.42Å; E241-H255 IonicContact OE2-NE2 3.45Å; E241-H255 PolarHBondContact OE2-NE2 3.32Å
242	E	85.4	Confident	76.4	Confident	65 Å²	65	60.4 Å²	60.4	30%	0.304	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	129.7	173.2	-177.7	169.7	158.2	0	0	109.2	L236 T250 Y252 R266 K571	L236-E242 HydrophobicContact CD1-CB 3.85Å; L236-E242 VanDerWaalsContact CD1-N 3.35Å; E242-T250 HydrophobicContact CG-CG2 3.42Å; E242-T250 VanDerWaalsContact CG-CG2 3.42Å; E242-Y252 HydrophobicContact CB-CD1 3.97Å; E242-Y252 HydrophobicContact CB-CE1 3.75Å; E242-Y252 HydrophobicContact CG-CD1 4.22Å; E242-Y252 HydrophobicContact CG-CE1 3.63Å; E242-Y252 WeakPolarHBondContact OE2-CE1 3.3Å; E242-R266 IonicContact OE2-NH2 3.37Å; E242-R266 PolarHBondContact OE2-NH2 3.05Å; E242-K571 IonicContact OE1-NZ 3.3Å; E242-K571 PolarHBondContact OE1-NZ 3.39Å
243	R	83.1	Confident	77.9	Confident	115 Å²	115	58.4 Å²	58.4	43%	0.434	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	156.8	173.7	-69.7	-159.3	-173.6	148.2	6.9	111.5	E241 T250 F251 I253	E241-R243 HydrophobicContact CG-CG 4.3Å; E241-R243 IonicContact OE1-CZ 3.43Å; E241-R243 IonicContact OE1-NE 2.64Å; E241-R243 PolarHBondContact OE1-NE 2.85Å; E241-R243 IonicContact OE1-NH2 2.77Å; E241-R243 PolarHBondContact OE1-NH2 2.96Å; E241-R243 IonicContact OE2-CZ 3.52Å; E241-R243 IonicContact OE2-NE 3.28Å; E241-R243 IonicContact OE2-NH2 3.85Å; E241-R243 PolarHBondContact OE2-NH2 2.84Å; R243-T250 CarbonylContact O-C 3.55Å; R243-T250 WeakPolarHBondContact O-CA 3.3Å; R243-F251 HydrophobicContact CB-CD1 4.19Å; R243-F251 HydrophobicContact CB-CE1 3.61Å; R243-F251 HydrophobicContact CB-CE2 4.23Å; R243-F251 HydrophobicContact CB-CZ 3.65Å; R243-F251 PolarHBondContact N-O 3.13Å; R243-F251 WeakPolarHBondContact O-CD1 3.25Å; R243-F251 PolarHBondContact O-N 3.37Å; R243-F251 VanDerWaalsContact O-O 3.09Å; R243-I253 HydrophobicContact CG-CD1 4.09Å
244	V	79.6	Confident	79.3	Confident	99 Å²	99	58.4 Å²	58.4	60%	0.6	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	129	174.3	-177.1	0	0	0	0	108.7
245	H	80.6	Confident	80.3	Confident	79 Å²	79	60.4 Å²	60.4	37%	0.366	33%	0.334	S	S	.	.			trans	-79	164.9	175	-175	-101.3	0	0	0	110.6	D247 G248 R249 F251 W262	H245-D247 IonicContact CE1-OD1 2.74Å; H245-D247 IonicContact CE1-OD2 3.58Å; H245-D247 IonicContact CG-OD1 3.14Å; H245-D247 IonicContact ND1-OD1 3.49Å; H245-D247 PolarHBondContact ND1-OD1 3.02Å; H245-D247 IonicContact ND1-OD2 3.93Å; H245-D247 PolarHBondContact ND1-OD2 3.09Å; H245-D247 PolarHBondContact O-N 2.97Å; H245-G248 PolarHBondContact O-N 3.46Å; H245-R249 WeakPolarHBondContact CB-O 3.4Å; H245-R249 PolarHBondContact N-O 3.14Å; H245-F251 HydrophobicContact CB-CD1 3.92Å; H245-F251 HydrophobicContact CB-CE1 4.03Å; H245-W262 HydrophobicContact CB-CH2 4.24Å; H245-W262 HydrophobicContact CB-CZ3 4.34Å
246	T	77.9	Confident	80.9	Confident	138 Å²	138	59.8 Å²	59.8	85%	0.847	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.5	-172.8	50.3	0	0	0	0	114.9
247	D	73.3	Confident	81.4	Confident	73 Å²	73	62.2 Å²	62.2	39%	0.39	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	12.6	173.7	61	3.5	0	0	0	113.2	H245 R249	H245-D247 IonicContact CE1-OD1 2.74Å; H245-D247 IonicContact CE1-OD2 3.58Å; H245-D247 IonicContact CG-OD1 3.14Å; H245-D247 IonicContact ND1-OD1 3.49Å; H245-D247 PolarHBondContact ND1-OD1 3.02Å; H245-D247 IonicContact ND1-OD2 3.93Å; H245-D247 PolarHBondContact ND1-OD2 3.09Å; H245-D247 PolarHBondContact O-N 2.97Å; D247-R249 VanDerWaalsContact C-N 3.31Å; D247-R249 PolarHBondContact O-N 2.79Å; D247-R249 WeakPolarHBondContact OD1-CB 3.38Å; D247-R249 PolarHBondContact OD1-N 2.89Å; D247-R249 IonicContact OD1-NE 3.33Å; D247-R249 IonicContact OD2-CZ 2.63Å; D247-R249 IonicContact OD2-NE 2.71Å; D247-R249 PolarHBondContact OD2-NE 2.96Å; D247-R249 IonicContact OD2-NH2 3.11Å; D247-R249 PolarHBondContact OD2-NH2 3.08Å
248	G	67.8	Low	81.7	Confident	39 Å²	39	68.1 Å²	68.1	40%	0.402	36%	0.363	S	S	.	.	S	Bend	trans	81.5	-1.4	178.7	0	0	0	0	0	115.1	H245	H245-G248 PolarHBondContact O-N 3.46Å
249	R	70.9	Confident	82.1	Confident	65 Å²	65	67.1 Å²	67.1	25%	0.245	36%	0.355	C	S	.	.			trans	-79	135	178.9	-71.3	-174.6	-70.7	173	-3	112.4	H245 D247 W262 N562 P564	H245-R249 WeakPolarHBondContact CB-O 3.4Å; H245-R249 PolarHBondContact N-O 3.14Å; D247-R249 VanDerWaalsContact C-N 3.31Å; D247-R249 PolarHBondContact O-N 2.79Å; D247-R249 WeakPolarHBondContact OD1-CB 3.38Å; D247-R249 PolarHBondContact OD1-N 2.89Å; D247-R249 IonicContact OD1-NE 3.33Å; D247-R249 IonicContact OD2-CZ 2.63Å; D247-R249 IonicContact OD2-NE 2.71Å; D247-R249 PolarHBondContact OD2-NE 2.96Å; D247-R249 IonicContact OD2-NH2 3.11Å; D247-R249 PolarHBondContact OD2-NH2 3.08Å; R249-W262 HydrophobicContact CB-CE3 4.25Å; R249-W262 HydrophobicContact CB-CZ3 3.64Å; R249-N562 WeakPolarHBondContact CD-O 3.45Å; R249-P564 HydrophobicContact CG-CG 3.87Å
250	T	79.3	Confident	82.5	Confident	19 Å²	19	70 Å²	70	12%	0.117	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	135.3	172.7	-57.9	0	0	0	0	110.6	E242 R243 Y252 Q567	E242-T250 HydrophobicContact CG-CG2 3.42Å; E242-T250 VanDerWaalsContact CG-CG2 3.42Å; R243-T250 CarbonylContact O-C 3.55Å; R243-T250 WeakPolarHBondContact O-CA 3.3Å; T250-Y252 HydrophobicContact CG2-CE1 4.37Å; T250-Y252 HydrophobicContact CG2-CE2 3.9Å; T250-Q567 PolarHBondContact O-NE2 3.24Å
251	F	82.6	Confident	82.5	Confident	36 Å²	36	69.9 Å²	69.9	16%	0.158	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	159.4	170.4	72.8	-80.2	0	0	0	110.6	R243 H245 I253 T260 W262	R243-F251 HydrophobicContact CB-CD1 4.19Å; R243-F251 HydrophobicContact CB-CE1 3.61Å; R243-F251 HydrophobicContact CB-CE2 4.23Å; R243-F251 HydrophobicContact CB-CZ 3.65Å; R243-F251 PolarHBondContact N-O 3.13Å; R243-F251 WeakPolarHBondContact O-CD1 3.25Å; R243-F251 PolarHBondContact O-N 3.37Å; R243-F251 VanDerWaalsContact O-O 3.09Å; H245-F251 HydrophobicContact CB-CD1 3.92Å; H245-F251 HydrophobicContact CB-CE1 4.03Å; F251-I253 HydrophobicContact CD2-CG1 4.06Å; F251-I253 HydrophobicContact CE2-CD1 3.85Å; F251-I253 HydrophobicContact CE2-CG1 3.68Å; F251-I253 HydrophobicContact CZ-CD1 4.45Å; F251-T260 HydrophobicContact CD2-CG2 4.45Å; F251-T260 HydrophobicContact CE2-CG2 4.4Å; F251-W262 HydrophobicContact CB-CD2 4.25Å; F251-W262 HydrophobicContact CB-CE3 3.73Å; F251-W262 HydrophobicContact CB-CH2 4.42Å; F251-W262 HydrophobicContact CB-CZ3 3.82Å
252	Y	87.5	Confident	82.3	Confident	12 Å²	12	70.8 Å²	70.8	5%	0.047	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.6	-174.2	-59.6	-89.6	0	0	0	110	L236 E241 E242 T250 T260 Q261 E263 D264 P265	L236-Y252 HydrophobicContact CD2-CD1 4.08Å; L236-Y252 HydrophobicContact CD2-CE1 3.96Å; E241-Y252 CarbonylContact O-C 3.58Å; E241-Y252 WeakPolarHBondContact O-CA 3.24Å; E242-Y252 HydrophobicContact CB-CD1 3.97Å; E242-Y252 HydrophobicContact CB-CE1 3.75Å; E242-Y252 HydrophobicContact CG-CD1 4.22Å; E242-Y252 HydrophobicContact CG-CE1 3.63Å; E242-Y252 WeakPolarHBondContact OE2-CE1 3.3Å; T250-Y252 HydrophobicContact CG2-CE1 4.37Å; T250-Y252 HydrophobicContact CG2-CE2 3.9Å; Y252-T260 CarbonylContact O-C 3.58Å; Y252-T260 VanDerWaalsContact O-CA 3.29Å; Y252-T260 WeakPolarHBondContact O-CA 3.28Å; Y252-Q261 PolarHBondContact N-O 3.1Å; Y252-Q261 PolarHBondContact O-N 2.95Å; Y252-E263 VanDerWaalsContact CD2-C 3.44Å; Y252-E263 WeakPolarHBondContact CD2-O 3.44Å; Y252-D264 HydrophobicContact CE1-CB 4.33Å; Y252-D264 VanDerWaalsContact CE2-CA 3.44Å; Y252-D264 HydrophobicContact CE2-CB 3.86Å; Y252-D264 PolarHBondContact OH-OD2 2.93Å; Y252-P265 HydrophobicContact CD1-CG 4.37Å
253	I	87.6	Confident	82	Confident	21 Å²	21	70.8 Å²	70.8	11%	0.108	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	119.9	-179.1	-51	178.7	0	0	0	108	W240 E241 R243 F251 T260	W240-I253 CarbonylContact C-O 3.56Å; W240-I253 WeakPolarHBondContact CA-O 3.23Å; E241-I253 HydrophobicContact CB-CB 4.34Å; E241-I253 PolarHBondContact N-O 2.75Å; E241-I253 PolarHBondContact O-N 3.47Å; R243-I253 HydrophobicContact CG-CD1 4.09Å; F251-I253 HydrophobicContact CD2-CG1 4.06Å; F251-I253 HydrophobicContact CE2-CD1 3.85Å; F251-I253 HydrophobicContact CE2-CG1 3.68Å; F251-I253 HydrophobicContact CZ-CD1 4.45Å; I253-T260 HydrophobicContact CB-CG2 4.37Å; I253-T260 HydrophobicContact CG1-CG2 3.98Å; I253-T260 HydrophobicContact CG2-CG2 4.22Å
254	D	88	Confident	81.9	Confident	11 Å²	11	65.9 Å²	65.9	6%	0.059	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	103.2	169.8	-179	14.2	0	0	0	109.8	W240 N256 T257 K258 T259	W240-D254 HydrophobicContact CD2-CB 4Å; W240-D254 HydrophobicContact CE3-CB 4.02Å; W240-D254 HydrophobicContact CH2-CB 3.71Å; W240-D254 HydrophobicContact CZ2-CB 3.67Å; W240-D254 HydrophobicContact CZ3-CB 3.88Å; D254-N256 PolarHBondContact O-N 2.82Å; D254-N256 WeakPolarHBondContact OD1-CA 3.21Å; D254-N256 WeakPolarHBondContact OD1-CB 3.25Å; D254-N256 PolarHBondContact OD1-N 3.35Å; D254-N256 PolarHBondContact OD1-ND2 3.1Å; D254-T257 VanDerWaalsContact CG-OG1 3.29Å; D254-T257 VanDerWaalsContact OD2-CB 3.26Å; D254-T257 WeakPolarHBondContact OD2-CB 3.21Å; D254-T257 WeakPolarHBondContact OD2-CG2 3.39Å; D254-T257 PolarHBondContact OD2-N 3.31Å; D254-T257 VanDerWaalsContact OD2-N 3.16Å; D254-T257 PolarHBondContact OD2-OG1 2.81Å; D254-K258 VanDerWaalsContact O-CA 3.23Å; D254-K258 WeakPolarHBondContact O-CA 3.4Å; D254-K258 PolarHBondContact O-N 2.91Å; D254-T259 PolarHBondContact N-O 3.23Å; D254-T259 PolarHBondContact O-N 2.87Å
255	H	84.1	Confident	81.9	Confident	76 Å²	76	61.3 Å²	61.3	35%	0.352	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-12.8	175.5	-69.2	-83.8	0	0	0	113.3	G239 E241 K258	G239-H255 VanDerWaalsContact O-CB 3.23Å; G239-H255 WeakPolarHBondContact O-CB 3.43Å; G239-H255 PolarHBondContact O-CD2 3.3Å; G239-H255 PolarHBondContact O-N 3.49Å; E241-H255 IonicContact OE2-CD2 3.85Å; E241-H255 IonicContact OE2-CE1 3.49Å; E241-H255 PolarHBondContact OE2-CE1 3.42Å; E241-H255 IonicContact OE2-NE2 3.45Å; E241-H255 PolarHBondContact OE2-NE2 3.32Å; H255-K258 WeakPolarHBondContact O-CD 3.43Å; H255-K258 WeakPolarHBondContact O-CE 3.4Å; H255-K258 PolarHBondContact O-NZ 3.23Å
256	N	84.5	Confident	81.9	Confident	109 Å²	109	58.4 Å²	58.4	58%	0.583	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-48.9	176.1	-51.3	-73.6	0	0	0	111.1	P238 D254	P238-N256 PolarHBondContact O-ND2 2.66Å; D254-N256 PolarHBondContact O-N 2.82Å; D254-N256 WeakPolarHBondContact OD1-CA 3.21Å; D254-N256 WeakPolarHBondContact OD1-CB 3.25Å; D254-N256 PolarHBondContact OD1-N 3.35Å; D254-N256 PolarHBondContact OD1-ND2 3.1Å
257	T	87.8	Confident	81.6	Confident	86 Å²	86	52.3 Å²	52.3	53%	0.528	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-9.8	178	61.2	0	0	0	0	114.4	D254 T259	D254-T257 VanDerWaalsContact CG-OG1 3.29Å; D254-T257 VanDerWaalsContact OD2-CB 3.26Å; D254-T257 WeakPolarHBondContact OD2-CB 3.21Å; D254-T257 WeakPolarHBondContact OD2-CG2 3.39Å; D254-T257 PolarHBondContact OD2-N 3.31Å; D254-T257 VanDerWaalsContact OD2-N 3.16Å; D254-T257 PolarHBondContact OD2-OG1 2.81Å; T257-T259 VanDerWaalsContact C-N 3.26Å; T257-T259 PolarHBondContact O-N 3.05Å; T257-T259 PolarHBondContact OG1-OG1 2.83Å
258	K	87	Confident	81.4	Confident	159 Å²	159	55.7 Å²	55.7	69%	0.691	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	36.2	-172	-54.1	-54.6	-174.9	-162.3	0	113	D254 H255	D254-K258 VanDerWaalsContact O-CA 3.23Å; D254-K258 WeakPolarHBondContact O-CA 3.4Å; D254-K258 PolarHBondContact O-N 2.91Å; H255-K258 WeakPolarHBondContact O-CD 3.43Å; H255-K258 WeakPolarHBondContact O-CE 3.4Å; H255-K258 PolarHBondContact O-NZ 3.23Å
259	T	87.6	Confident	81.7	Confident	67 Å²	67	55.8 Å²	55.8	41%	0.411	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	162.7	176.2	64.2	0	0	0	0	111.4	D254 T257	D254-T259 PolarHBondContact N-O 3.23Å; D254-T259 PolarHBondContact O-N 2.87Å; T257-T259 VanDerWaalsContact C-N 3.26Å; T257-T259 PolarHBondContact O-N 3.05Å; T257-T259 PolarHBondContact OG1-OG1 2.83Å
260	T	87.6	Confident	81.4	Confident	95 Å²	95	56.5 Å²	56.5	58%	0.583	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.6	146.8	168.9	60.6	0	0	0	0	109.7	F251 Y252 I253	F251-T260 HydrophobicContact CD2-CG2 4.45Å; F251-T260 HydrophobicContact CE2-CG2 4.4Å; Y252-T260 CarbonylContact O-C 3.58Å; Y252-T260 VanDerWaalsContact O-CA 3.29Å; Y252-T260 WeakPolarHBondContact O-CA 3.28Å; I253-T260 HydrophobicContact CB-CG2 4.37Å; I253-T260 HydrophobicContact CG1-CG2 3.98Å; I253-T260 HydrophobicContact CG2-CG2 4.22Å
261	Q	83.9	Confident	80.7	Confident	42 Å²	42	60.3 Å²	60.3	20%	0.196	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	166	177.8	68.7	-177.9	33	0	0	110.7	W240 Y252 E263	W240-Q261 HydrophobicContact CH2-CG 4.09Å; W240-Q261 VanDerWaalsContact CH2-NE2 3.3Å; W240-Q261 HydrophobicContact CZ3-CG 3.82Å; Y252-Q261 PolarHBondContact N-O 3.1Å; Y252-Q261 PolarHBondContact O-N 2.95Å; Q261-E263 HydrophobicContact CG-CB 4.27Å; Q261-E263 WeakPolarHBondContact CG-O 3.15Å; Q261-E263 PolarHBondContact NE2-O 3.21Å
262	W	81.3	Confident	80.1	Confident	81 Å²	81	60.4 Å²	60.4	31%	0.307	33%	0.327	S	S	.	.	S	Bend	trans	-96.8	-11.8	178.2	-60	94.8	0	0	0	112.1	H245 R249 F251	H245-W262 HydrophobicContact CB-CH2 4.24Å; H245-W262 HydrophobicContact CB-CZ3 4.34Å; R249-W262 HydrophobicContact CB-CE3 4.25Å; R249-W262 HydrophobicContact CB-CZ3 3.64Å; F251-W262 HydrophobicContact CB-CD2 4.25Å; F251-W262 HydrophobicContact CB-CE3 3.73Å; F251-W262 HydrophobicContact CB-CH2 4.42Å; F251-W262 HydrophobicContact CB-CZ3 3.82Å
263	E	79.4	Confident	79.3	Confident	65 Å²	65	60.1 Å²	60.1	30%	0.304	33%	0.326	S	S	.	.	S	Bend	trans	-77.8	131.4	177	-71	57.7	-138.1	0	0	111.9	Y252 Q261 P265 R550	Y252-E263 VanDerWaalsContact CD2-C 3.44Å; Y252-E263 WeakPolarHBondContact CD2-O 3.44Å; Q261-E263 HydrophobicContact CG-CB 4.27Å; Q261-E263 WeakPolarHBondContact CG-O 3.15Å; Q261-E263 PolarHBondContact NE2-O 3.21Å; E263-P265 WeakPolarHBondContact O-CD 3.33Å; E263-R550 IonicContact OE1-NH2 3.93Å; E263-R550 PolarHBondContact OE1-NH2 2.87Å; E263-R550 VanDerWaalsContact OE1-NH2 3.16Å
264	D	81.1	Confident	78.3	Confident	11 Å²	11	59.8 Å²	59.8	6%	0.059	33%	0.328	C	S	.	.			trans	-64.5	121.6	168.1	-170.1	-36.2	0	0	0	109.6	Y252 R266 L267	Y252-D264 HydrophobicContact CE1-CB 4.33Å; Y252-D264 VanDerWaalsContact CE2-CA 3.44Å; Y252-D264 HydrophobicContact CE2-CB 3.86Å; Y252-D264 PolarHBondContact OH-OD2 2.93Å; D264-R266 PolarHBondContact O-N 3.47Å; D264-R266 VanDerWaalsContact O-N 3.09Å; D264-R266 WeakPolarHBondContact OD1-CB 3.13Å; D264-R266 VanDerWaalsContact OD1-CG 3.31Å; D264-R266 WeakPolarHBondContact OD1-CG 3.3Å; D264-R266 IonicContact OD1-CZ 3.19Å; D264-R266 PolarHBondContact OD1-N 2.84Å; D264-R266 IonicContact OD1-NE 3.47Å; D264-R266 PolarHBondContact OD1-NE 2.83Å; D264-R266 IonicContact OD1-NH2 3.96Å; D264-R266 IonicContact OD2-CZ 2.73Å; D264-R266 VanDerWaalsContact OD2-CZ 3.28Å; D264-R266 IonicContact OD2-NE 2.7Å; D264-R266 PolarHBondContact OD2-NE 3.22Å; D264-R266 IonicContact OD2-NH2 3.46Å; D264-R266 PolarHBondContact OD2-NH2 2.97Å; D264-L267 HydrophobicContact CB-CD1 4.34Å; D264-L267 HydrophobicContact CB-CG 4.49Å; D264-L267 VanDerWaalsContact O-CB 3.26Å; D264-L267 WeakPolarHBondContact O-CB 3.37Å; D264-L267 PolarHBondContact O-N 2.96Å
265	P	80.8	Confident	77.4	Confident	4 Å²	4	62.5 Å²	62.5	3%	0.026	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-61.5	-19.4	-179.6	28.6	-38.7	0	0	0	113.1	L236 P237 W240 Y252 E263 L267 Q268	L236-P265 HydrophobicContact CD2-CG 3.95Å; P237-P265 HydrophobicContact CG-CB 4.18Å; P237-P265 HydrophobicContact CG-CG 4.43Å; W240-P265 HydrophobicContact CB-CG 4.15Å; W240-P265 HydrophobicContact CD2-CB 3.52Å; W240-P265 HydrophobicContact CD2-CG 3.59Å; W240-P265 HydrophobicContact CE3-CB 3.7Å; W240-P265 HydrophobicContact CE3-CG 3.57Å; W240-P265 HydrophobicContact CG-CB 4.07Å; W240-P265 HydrophobicContact CG-CG 3.88Å; W240-P265 HydrophobicContact CH2-CB 4.03Å; W240-P265 HydrophobicContact CZ2-CB 3.89Å; W240-P265 HydrophobicContact CZ3-CB 3.94Å; W240-P265 HydrophobicContact CZ3-CG 4.17Å; Y252-P265 HydrophobicContact CD1-CG 4.37Å; E263-P265 WeakPolarHBondContact O-CD 3.33Å; P265-L267 PolarHBondContact O-N 2.88Å; P265-Q268 WeakPolarHBondContact O-CB 3.15Å; P265-Q268 PolarHBondContact O-N 3.37Å; P265-Q268 VanDerWaalsContact O-N 3.1Å
266	R	79.9	Confident	76.5	Confident	18 Å²	18	62.4 Å²	62.4	7%	0.068	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-66.1	-17.7	174.2	-63.9	173.5	-74.8	-145	-3.1	112.8	L233 G234 L236 E242 D264 Q268 S269 I272	L233-R266 VanDerWaalsContact O-CD 3.31Å; L233-R266 WeakPolarHBondContact O-CD 3.3Å; G234-R266 PolarHBondContact O-NH1 3.46Å; L236-R266 HydrophobicContact CD2-CG 4.49Å; E242-R266 IonicContact OE2-NH2 3.37Å; E242-R266 PolarHBondContact OE2-NH2 3.05Å; D264-R266 PolarHBondContact O-N 3.47Å; D264-R266 VanDerWaalsContact O-N 3.09Å; D264-R266 WeakPolarHBondContact OD1-CB 3.13Å; D264-R266 VanDerWaalsContact OD1-CG 3.31Å; D264-R266 WeakPolarHBondContact OD1-CG 3.3Å; D264-R266 IonicContact OD1-CZ 3.19Å; D264-R266 PolarHBondContact OD1-N 2.84Å; D264-R266 IonicContact OD1-NE 3.47Å; D264-R266 PolarHBondContact OD1-NE 2.83Å; D264-R266 IonicContact OD1-NH2 3.96Å; D264-R266 IonicContact OD2-CZ 2.73Å; D264-R266 VanDerWaalsContact OD2-CZ 3.28Å; D264-R266 IonicContact OD2-NE 2.7Å; D264-R266 PolarHBondContact OD2-NE 3.22Å; D264-R266 IonicContact OD2-NH2 3.46Å; D264-R266 PolarHBondContact OD2-NH2 2.97Å; R266-Q268 PolarHBondContact O-N 3.4Å; R266-Q268 VanDerWaalsContact O-N 3.17Å; R266-S269 WeakPolarHBondContact O-CB 3.24Å; R266-S269 PolarHBondContact O-N 3.4Å; R266-I272 HydrophobicContact CB-CD1 3.79Å; R266-I272 HydrophobicContact CG-CD1 4Å
267	L	72.3	Confident	75.4	Confident	10 Å²	10	58.8 Å²	58.8	5%	0.052	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-63.1	-13.2	169.4	-73.5	162.8	0	0	0	113.7	D264 P265 T273 L574	D264-L267 HydrophobicContact CB-CD1 4.34Å; D264-L267 HydrophobicContact CB-CG 4.49Å; D264-L267 VanDerWaalsContact O-CB 3.26Å; D264-L267 WeakPolarHBondContact O-CB 3.37Å; D264-L267 PolarHBondContact O-N 2.96Å; P265-L267 PolarHBondContact O-N 2.88Å; L267-T273 HydrophobicContact CD2-CG2 4.23Å; L267-T273 WeakPolarHBondContact O-CG2 3.22Å; L267-L574 HydrophobicContact CD2-CD1 3.97Å; L267-L574 HydrophobicContact CD2-CD2 3.93Å; L267-L574 HydrophobicContact CD2-CG 4.36Å; L267-L574 HydrophobicContact CG-CD1 4.16Å
268	Q	68.6	Low	74	Confident	143 Å²	143	59.8 Å²	59.8	67%	0.668	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-93.7	1.1	174.9	-56.4	179.1	11.2	0	0	112.6	P265 R266 P270	P265-Q268 WeakPolarHBondContact O-CB 3.15Å; P265-Q268 PolarHBondContact O-N 3.37Å; P265-Q268 VanDerWaalsContact O-N 3.1Å; R266-Q268 PolarHBondContact O-N 3.4Å; R266-Q268 VanDerWaalsContact O-N 3.17Å; Q268-P270 WeakPolarHBondContact O-CD 3.19Å
269	S	73.3	Confident	72.8	Confident	41 Å²	41	58.8 Å²	58.8	29%	0.287	34%	0.341	S	S	.	.			trans	-101.2	109	-177.7	-175.9	0	0	0	0	111.2	R266 A271 I272 T273	R266-S269 WeakPolarHBondContact O-CB 3.24Å; R266-S269 PolarHBondContact O-N 3.4Å; S269-A271 PolarHBondContact O-N 2.93Å; S269-A271 VanDerWaalsContact O-N 3.1Å; S269-I272 PolarHBondContact O-N 2.86Å; S269-T273 PolarHBondContact O-N 3.31Å; S269-T273 PolarHBondContact O-OG1 2.67Å
270	P	65.7	Low	72	Confident	80 Å²	80	56.8 Å²	56.8	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-24.5	179.1	-24.3	35	0	0	0	113.7	Q268 I272 G274	Q268-P270 WeakPolarHBondContact O-CD 3.19Å; P270-I272 PolarHBondContact O-N 3.07Å; P270-G274 WeakPolarHBondContact CA-O 3.38Å; P270-G274 CarbonylContact O-C 3.59Å; P270-G274 VanDerWaalsContact O-C 3.22Å; P270-G274 VanDerWaalsContact O-CA 3.3Å; P270-G274 WeakPolarHBondContact O-CA 3.3Å; P270-G274 PolarHBondContact O-N 2.67Å
271	A	64.6	Low	70.9	Confident	99 Å²	99	60.1 Å²	60.1	82%	0.818	33%	0.332	S	S	*	.	H	α-helix	trans	-68.4	-17.3	174.7	0	0	0	0	0	113.6	S269	S269-A271 PolarHBondContact O-N 2.93Å; S269-A271 VanDerWaalsContact O-N 3.1Å
272	I	69.8	Low	70.2	Confident	39 Å²	39	63.4 Å²	63.4	20%	0.2	35%	0.347	C	S	.	.	H	α-helix	trans	-108.9	-44.5	179.6	-60	174.1	0	0	0	110	R266 S269 P270 L574 R581	R266-I272 HydrophobicContact CB-CD1 3.79Å; R266-I272 HydrophobicContact CG-CD1 4Å; S269-I272 PolarHBondContact O-N 2.86Å; P270-I272 PolarHBondContact O-N 3.07Å; I272-L574 HydrophobicContact CG2-CD2 4.04Å; I272-R581 VanDerWaalsContact O-CZ 3.31Å; I272-R581 PolarHBondContact O-NH1 3.08Å; I272-R581 PolarHBondContact O-NH2 3.38Å
273	T	70.8	Confident	69.7	Low	6 Å²	6	60.2 Å²	60.2	4%	0.037	34%	0.335	C	S	.	.	H	α-helix	trans	-80.7	-23.4	-177.8	55.8	0	0	0	0	113.9	L267 S269 D545 V546 N547 L574	L267-T273 HydrophobicContact CD2-CG2 4.23Å; L267-T273 WeakPolarHBondContact O-CG2 3.22Å; S269-T273 PolarHBondContact O-N 3.31Å; S269-T273 PolarHBondContact O-OG1 2.67Å; T273-D545 WeakPolarHBondContact O-CA 3.48Å; T273-V546 PolarHBondContact O-N 2.95Å; T273-N547 HydrophobicContact CG2-CB 4.1Å; T273-L574 HydrophobicContact CG2-CD2 4.14Å
274	G	66.7	Low	69.4	Low	13 Å²	13	58.5 Å²	58.5	13%	0.134	33%	0.327	C	S	.	.			trans	104.1	164	-165.4	0	0	0	0	0	111.4	P270 A276	P270-G274 WeakPolarHBondContact CA-O 3.38Å; P270-G274 CarbonylContact O-C 3.59Å; P270-G274 VanDerWaalsContact O-C 3.22Å; P270-G274 VanDerWaalsContact O-CA 3.3Å; P270-G274 WeakPolarHBondContact O-CA 3.3Å; P270-G274 PolarHBondContact O-N 2.67Å; G274-A276 PolarHBondContact O-N 2.95Å
275	P	69.5	Low	69.4	Low	68 Å²	68	63.1 Å²	63.1	44%	0.442	35%	0.348	S	S	.	.	S	Bend	trans	-63.7	132.3	177.3	27.8	-33.9	0	0	0	110.6	V277 D543	P275-V277 PolarHBondContact O-N 3Å; P275-D543 HydrophobicContact CG-CB 3.86Å
276	A	65.4	Low	69.5	Low	74 Å²	74	65.9 Å²	65.9	61%	0.612	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-61.7	129.5	180	0	0	0	0	0	111.2	G274 P278 D545	G274-A276 PolarHBondContact O-N 2.95Å; A276-P278 VanDerWaalsContact O-CD 3.29Å; A276-P278 WeakPolarHBondContact O-CD 3.31Å; A276-D545 WeakPolarHBondContact CA-OD2 3.25Å
277	V	61.5	Low	69.6	Low	33 Å²	33	66.4 Å²	66.4	20%	0.2	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-74	116.1	-177.8	-177.7	0	0	0	0	110.5	P275 Y279 L541 D545 M596	P275-V277 PolarHBondContact O-N 3Å; V277-Y279 PolarHBondContact O-N 2.9Å; V277-L541 HydrophobicContact CB-CD1 4.41Å; V277-L541 HydrophobicContact CG1-CD1 3.65Å; V277-L541 HydrophobicContact CG2-CD1 3.8Å; V277-D545 HydrophobicContact CG2-CB 4Å; V277-M596 WeakPolarHBondContact CG1-O 3.28Å
278	P	57.6	Low	70.3	Confident	107 Å²	107	69.3 Å²	69.3	70%	0.695	38%	0.377	S	S	*	.			trans	-78	110.5	179.4	31	-32.2	0	0	0	110.4	A276 S280	A276-P278 VanDerWaalsContact O-CD 3.29Å; A276-P278 WeakPolarHBondContact O-CD 3.31Å; P278-S280 PolarHBondContact O-N 3.26Å
279	Y	62.2	Low	71.4	Confident	139 Å²	139	67.7 Å²	67.7	55%	0.545	37%	0.366	S	S	.	.			trans	-60.6	120	175.9	-179.1	-91.1	0	0	0	111.6	V277 R281 N597	V277-Y279 PolarHBondContact O-N 2.9Å; Y279-R281 HydrophobicContact CE1-CB 3.95Å; Y279-R281 HydrophobicContact CE1-CG 4.41Å; Y279-N597 HydrophobicContact CD2-CB 3.81Å; Y279-N597 HydrophobicContact CE2-CB 4Å; Y279-N597 WeakPolarHBondContact CE2-ND2 3.2Å
280	S	69.6	Low	72.3	Confident	24 Å²	24	65.8 Å²	65.8	17%	0.168	35%	0.352	C	S	.	.			trans	-103.2	109.7	175.2	-179.2	0	0	0	0	110.9	P278 E282 F283 K284 N597	P278-S280 PolarHBondContact O-N 3.26Å; S280-E282 VanDerWaalsContact C-N 3.3Å; S280-F283 WeakPolarHBondContact OG-CB 3.39Å; S280-F283 PolarHBondContact OG-N 3.36Å; S280-F283 VanDerWaalsContact OG-N 3.08Å; S280-K284 WeakPolarHBondContact O-CB 3.24Å; S280-K284 PolarHBondContact O-N 2.85Å; S280-K284 VanDerWaalsContact O-N 3.11Å; S280-N597 PolarHBondContact N-OD1 3.4Å; S280-N597 PolarHBondContact O-ND2 2.92Å
281	R	65.8	Low	73.5	Confident	166 Å²	166	65.2 Å²	65.2	63%	0.626	34%	0.34	S	S	*	.	H	α-helix	trans	-71.1	-30.6	175.7	-165.7	-169.1	172.9	-166.3	-2	111.3	Y279 Q285	Y279-R281 HydrophobicContact CE1-CB 3.95Å; Y279-R281 HydrophobicContact CE1-CG 4.41Å; R281-Q285 WeakPolarHBondContact O-CG 3.25Å; R281-Q285 PolarHBondContact O-N 2.73Å; R281-Q285 VanDerWaalsContact O-N 3.13Å; R281-Q285 PolarHBondContact O-NE2 3.47Å
282	E	67.8	Low	74.8	Confident	111 Å²	111	68.6 Å²	68.6	52%	0.519	34%	0.336	S	S	.	.	H	α-helix	trans	-71.7	-47.9	-179.9	-67.3	59.8	-131.5	0	0	109.9	S280 K284 Q285 K286	S280-E282 VanDerWaalsContact C-N 3.3Å; E282-K284 PolarHBondContact O-N 2.86Å; E282-Q285 PolarHBondContact O-N 2.86Å; E282-K286 WeakPolarHBondContact O-CG 3.31Å; E282-K286 PolarHBondContact O-N 3.18Å
283	F	70.8	Confident	75.9	Confident	13 Å²	13	72 Å²	72	6%	0.057	35%	0.349	C	S	.	.	H	α-helix	trans	-60	-45.3	172.6	178	-99.6	0	0	0	111.4	S280 Q285 K286 Y287 F529 E533 M596	S280-F283 WeakPolarHBondContact OG-CB 3.39Å; S280-F283 PolarHBondContact OG-N 3.36Å; S280-F283 VanDerWaalsContact OG-N 3.08Å; F283-Q285 VanDerWaalsContact C-N 3.29Å; F283-Q285 PolarHBondContact O-N 2.61Å; F283-K286 WeakPolarHBondContact O-CB 3.41Å; F283-K286 PolarHBondContact O-N 2.92Å; F283-K286 VanDerWaalsContact O-N 3.11Å; F283-Y287 WeakPolarHBondContact O-CB 3.45Å; F283-Y287 PolarHBondContact O-N 3.39Å; F283-F529 AromaticContact CD2-CD1 3.9Å; F283-F529 HydrophobicContact CD2-CD1 3.9Å; F283-F529 AromaticContact CD2-CE1 3.88Å; F283-F529 HydrophobicContact CD2-CE1 3.88Å; F283-F529 AromaticContact CE2-CD1 3.76Å; F283-F529 HydrophobicContact CE2-CD1 3.76Å; F283-F529 AromaticContact CE2-CE1 3.62Å; F283-F529 HydrophobicContact CE2-CE1 3.62Å; F283-F529 HydrophobicContact CZ-CE1 4.42Å; F283-E533 HydrophobicContact CD2-CB 3.77Å; F283-E533 HydrophobicContact CD2-CG 3.73Å; F283-E533 HydrophobicContact CE2-CB 3.93Å; F283-E533 HydrophobicContact CE2-CG 4.39Å; F283-E533 WeakPolarHBondContact CE2-O 3.48Å; F283-M596 HydrophobicContact CB-CE 3.9Å; F283-M596 HydrophobicContact CB-SD 3.81Å; F283-M596 HydrophobicContact CD1-CB 4.04Å; F283-M596 HydrophobicContact CD1-CE 4.44Å; F283-M596 HydrophobicContact CD1-CG 4Å; F283-M596 HydrophobicContact CD1-SD 3.29Å; F283-M596 WeakPolarHBondContact CD1-SD 3.42Å; F283-M596 HydrophobicContact CD2-CE 4.33Å; F283-M596 HydrophobicContact CD2-SD 3.45Å; F283-M596 WeakPolarHBondContact CD2-SD 3.37Å; F283-M596 HydrophobicContact CE1-CB 3.72Å; F283-M596 HydrophobicContact CE1-CG 4.14Å; F283-M596 HydrophobicContact CE1-SD 3.59Å; F283-M596 VanDerWaalsContact CE1-SD 3.59Å; F283-M596 HydrophobicContact CE2-SD 3.72Å; F283-M596 HydrophobicContact CG-CE 3.98Å; F283-M596 HydrophobicContact CG-CG 4.44Å; F283-M596 HydrophobicContact CG-SD 3.2Å; F283-M596 WeakPolarHBondContact CG-SD 3.26Å; F283-M596 HydrophobicContact CZ-CB 4.3Å; F283-M596 HydrophobicContact CZ-SD 3.78Å
284	K	74	Confident	76.8	Confident	30 Å²	30	72.9 Å²	72.9	13%	0.13	35%	0.354	C	S	.	.	H	α-helix	trans	-55.3	-44.5	177.7	-178.9	54.3	177.1	168.3	0	111.9	S280 E282 Y287 D288 E601	S280-K284 WeakPolarHBondContact O-CB 3.24Å; S280-K284 PolarHBondContact O-N 2.85Å; S280-K284 VanDerWaalsContact O-N 3.11Å; E282-K284 PolarHBondContact O-N 2.86Å; K284-Y287 PolarHBondContact O-N 2.91Å; K284-D288 WeakPolarHBondContact CE-OD1 3.17Å; K284-D288 WeakPolarHBondContact CE-OD2 3.37Å; K284-D288 IonicContact NZ-OD1 2.68Å; K284-D288 PolarHBondContact NZ-OD1 3.37Å; K284-D288 IonicContact NZ-OD2 2.88Å; K284-D288 PolarHBondContact NZ-OD2 3.48Å; K284-D288 WeakPolarHBondContact O-CB 3.42Å; K284-D288 VanDerWaalsContact O-CG 3.24Å; K284-D288 PolarHBondContact O-N 2.85Å; K284-E601 WeakPolarHBondContact CE-OE1 3.41Å; K284-E601 VanDerWaalsContact NZ-CD 3.28Å; K284-E601 IonicContact NZ-OE1 2.67Å; K284-E601 PolarHBondContact NZ-OE1 2.84Å; K284-E601 IonicContact NZ-OE2 3.55Å; K284-E601 PolarHBondContact NZ-OE2 3.08Å
285	Q	80.9	Confident	77.5	Confident	108 Å²	108	80.2 Å²	80.2	51%	0.505	38%	0.382	S	S	.	.	H	α-helix	trans	-64.2	-43.5	175.8	-74.3	169.5	68.7	0	0	112.9	R281 E282 F283 Y289	R281-Q285 WeakPolarHBondContact O-CG 3.25Å; R281-Q285 PolarHBondContact O-N 2.73Å; R281-Q285 VanDerWaalsContact O-N 3.13Å; R281-Q285 PolarHBondContact O-NE2 3.47Å; E282-Q285 PolarHBondContact O-N 2.86Å; F283-Q285 VanDerWaalsContact C-N 3.29Å; F283-Q285 PolarHBondContact O-N 2.61Å; Q285-Y289 WeakPolarHBondContact O-CB 3.18Å; Q285-Y289 PolarHBondContact O-N 3.17Å
286	K	83.1	Confident	78	Confident	62 Å²	62	81 Å²	81	27%	0.27	38%	0.378	S	S	.	.	H	α-helix	trans	-60.4	-46	174.6	-69.6	168.5	178.4	171.9	0	111.2	E282 F283 Y289 F290 I528 F529 E533	E282-K286 WeakPolarHBondContact O-CG 3.31Å; E282-K286 PolarHBondContact O-N 3.18Å; F283-K286 WeakPolarHBondContact O-CB 3.41Å; F283-K286 PolarHBondContact O-N 2.92Å; F283-K286 VanDerWaalsContact O-N 3.11Å; K286-Y289 PolarHBondContact O-N 2.92Å; K286-F290 VanDerWaalsContact O-CB 3.23Å; K286-F290 WeakPolarHBondContact O-CB 3.3Å; K286-F290 PolarHBondContact O-N 3.37Å; K286-I528 HydrophobicContact CB-CD1 4.09Å; K286-I528 HydrophobicContact CB-CG1 4.33Å; K286-I528 WeakPolarHBondContact CD-O 3.34Å; K286-I528 VanDerWaalsContact CE-O 3.24Å; K286-I528 WeakPolarHBondContact CE-O 3.27Å; K286-F529 HydrophobicContact CB-CD1 3.96Å; K286-F529 HydrophobicContact CB-CE1 3.47Å; K286-F529 VanDerWaalsContact CB-CE1 3.47Å; K286-F529 HydrophobicContact CB-CZ 4.11Å; K286-F529 HydrophobicContact CD-CD1 4.06Å; K286-F529 HydrophobicContact CD-CE1 4.41Å; K286-E533 WeakPolarHBondContact CD-OE1 3.5Å; K286-E533 IonicContact NZ-OE1 3.75Å; K286-E533 PolarHBondContact NZ-OE1 3.36Å; K286-E533 IonicContact NZ-OE2 2.67Å; K286-E533 PolarHBondContact NZ-OE2 3.16Å
287	Y	82.6	Confident	78.8	Confident	29 Å²	29	79.6 Å²	79.6	11%	0.114	36%	0.363	C	S	.	.	H	α-helix	trans	-64.3	-45	178.8	177.7	-98.8	0	0	0	112.7	F283 K284 Y289 F290 R291 L537	F283-Y287 WeakPolarHBondContact O-CB 3.45Å; F283-Y287 PolarHBondContact O-N 3.39Å; K284-Y287 PolarHBondContact O-N 2.91Å; Y287-Y289 VanDerWaalsContact C-N 3.34Å; Y287-Y289 PolarHBondContact O-N 2.95Å; Y287-F290 WeakPolarHBondContact O-CB 3.25Å; Y287-F290 PolarHBondContact O-N 3.31Å; Y287-R291 HydrophobicContact CD1-CG 4.22Å; Y287-R291 HydrophobicContact CD2-CG 4.36Å; Y287-R291 HydrophobicContact CE1-CG 3.86Å; Y287-R291 HydrophobicContact CE2-CG 4Å; Y287-R291 HydrophobicContact CG-CG 4.48Å; Y287-R291 WeakPolarHBondContact O-CB 3.1Å; Y287-R291 WeakPolarHBondContact O-CG 3.45Å; Y287-R291 PolarHBondContact O-N 3.44Å; Y287-R291 PolarHBondContact OH-NE 2.83Å; Y287-R291 PolarHBondContact OH-NH2 3.02Å; Y287-L537 HydrophobicContact CD2-CD1 3.8Å; Y287-L537 HydrophobicContact CE2-CD1 3.91Å
288	D	85.9	Confident	79.5	Confident	70 Å²	70	83.3 Å²	83.3	37%	0.374	40%	0.397	S	S	.	.	H	α-helix	trans	-66.7	-37.3	177.6	-68.9	-16.5	0	0	0	111.2	K284 K292	K284-D288 WeakPolarHBondContact CE-OD1 3.17Å; K284-D288 WeakPolarHBondContact CE-OD2 3.37Å; K284-D288 IonicContact NZ-OD1 2.68Å; K284-D288 PolarHBondContact NZ-OD1 3.37Å; K284-D288 IonicContact NZ-OD2 2.88Å; K284-D288 PolarHBondContact NZ-OD2 3.48Å; K284-D288 WeakPolarHBondContact O-CB 3.42Å; K284-D288 VanDerWaalsContact O-CG 3.24Å; K284-D288 PolarHBondContact O-N 2.85Å; D288-K292 VanDerWaalsContact O-CB 3.23Å; D288-K292 WeakPolarHBondContact O-CB 3.23Å; D288-K292 PolarHBondContact O-N 3.14Å
289	Y	91.7	Very high	80.8	Confident	110 Å²	110	83 Å²	83	43%	0.431	39%	0.39	S	S	.	.	H	α-helix	trans	-62.5	-47.4	170.7	172.6	-94.3	0	0	0	111.9	Q285 K286 Y287 K292 K293 L525 I528	Q285-Y289 WeakPolarHBondContact O-CB 3.18Å; Q285-Y289 PolarHBondContact O-N 3.17Å; K286-Y289 PolarHBondContact O-N 2.92Å; Y287-Y289 VanDerWaalsContact C-N 3.34Å; Y287-Y289 PolarHBondContact O-N 2.95Å; Y289-K292 PolarHBondContact O-N 3.2Å; Y289-K293 HydrophobicContact CE1-CG 4.14Å; Y289-K293 HydrophobicContact CE2-CG 4.28Å; Y289-K293 WeakPolarHBondContact O-CG 3.26Å; Y289-K293 PolarHBondContact O-N 3.09Å; Y289-K293 VanDerWaalsContact O-N 3.12Å; Y289-K293 WeakPolarHBondContact OH-CE 3.19Å; Y289-L525 HydrophobicContact CE1-CD2 4.4Å; Y289-I528 HydrophobicContact CD1-CD1 3.8Å; Y289-I528 HydrophobicContact CE1-CD1 4.35Å
290	F	93	Very high	81.9	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-56.2	-54.4	176.8	174.9	-102.1	0	0	0	111.4	K286 Y287 K292 K293 L294 V407 I521 L525 I526 I528 F529 L537	K286-F290 VanDerWaalsContact O-CB 3.23Å; K286-F290 WeakPolarHBondContact O-CB 3.3Å; K286-F290 PolarHBondContact O-N 3.37Å; Y287-F290 WeakPolarHBondContact O-CB 3.25Å; Y287-F290 PolarHBondContact O-N 3.31Å; F290-K292 VanDerWaalsContact C-N 3.32Å; F290-K292 PolarHBondContact O-N 3.33Å; F290-K293 WeakPolarHBondContact O-CA 3.35Å; F290-K293 WeakPolarHBondContact O-CB 3.46Å; F290-K293 PolarHBondContact O-N 3.14Å; F290-L294 HydrophobicContact CD1-CD1 4.02Å; F290-L294 HydrophobicContact CD1-CG 4.41Å; F290-L294 HydrophobicContact CE1-CD1 3.37Å; F290-L294 HydrophobicContact CE1-CG 4.07Å; F290-L294 HydrophobicContact CE2-CD1 4.47Å; F290-L294 HydrophobicContact CE2-CD2 4.44Å; F290-L294 HydrophobicContact CE2-CG 4.47Å; F290-L294 HydrophobicContact CZ-CD1 3.63Å; F290-L294 HydrophobicContact CZ-CD2 4.24Å; F290-L294 HydrophobicContact CZ-CG 4.09Å; F290-L294 PolarHBondContact O-N 3.29Å; F290-V407 HydrophobicContact CE1-CG1 3.65Å; F290-V407 HydrophobicContact CZ-CG1 3.44Å; F290-V407 VanDerWaalsContact CZ-CG1 3.44Å; F290-I521 HydrophobicContact CE2-CG2 3.95Å; F290-I521 HydrophobicContact CZ-CD1 4.36Å; F290-I521 HydrophobicContact CZ-CG2 3.94Å; F290-L525 HydrophobicContact CD2-CB 3.75Å; F290-L525 VanDerWaalsContact CD2-O 3.3Å; F290-L525 WeakPolarHBondContact CD2-O 3.42Å; F290-L525 HydrophobicContact CE2-CB 3.76Å; F290-I526 HydrophobicContact CE2-CG2 4.18Å; F290-I528 HydrophobicContact CB-CD1 4.23Å; F290-F529 HydrophobicContact CB-CE2 4.1Å; F290-F529 HydrophobicContact CB-CZ 3.9Å; F290-F529 AromaticContact CD2-CE2 3.84Å; F290-F529 HydrophobicContact CD2-CE2 3.84Å; F290-F529 HydrophobicContact CD2-CZ 4.45Å; F290-F529 HydrophobicContact CE2-CE2 4.41Å; F290-F529 AromaticContact CG-CE2 3.94Å; F290-F529 HydrophobicContact CG-CE2 3.94Å; F290-F529 HydrophobicContact CG-CZ 4.09Å; F290-L537 HydrophobicContact CE1-CD1 4.29Å; F290-L537 HydrophobicContact CE1-CD2 4.26Å; F290-L537 HydrophobicContact CZ-CD2 4.27Å
291	R	89.8	Confident	82.7	Confident	69 Å²	69	78.5 Å²	78.5	26%	0.26	38%	0.376	S	S	.	.	H	α-helix	trans	-59	-39.8	177.2	-72.2	-58.1	-151.7	140.5	19.7	112.8	Y287 K293 L294 F408	Y287-R291 HydrophobicContact CD1-CG 4.22Å; Y287-R291 HydrophobicContact CD2-CG 4.36Å; Y287-R291 HydrophobicContact CE1-CG 3.86Å; Y287-R291 HydrophobicContact CE2-CG 4Å; Y287-R291 HydrophobicContact CG-CG 4.48Å; Y287-R291 WeakPolarHBondContact O-CB 3.1Å; Y287-R291 WeakPolarHBondContact O-CG 3.45Å; Y287-R291 PolarHBondContact O-N 3.44Å; Y287-R291 PolarHBondContact OH-NE 2.83Å; Y287-R291 PolarHBondContact OH-NH2 3.02Å; R291-K293 PolarHBondContact O-N 3.3Å; R291-L294 PolarHBondContact O-N 3.16Å; R291-F408 PolarHBondContact NH1-O 3.5Å
292	K	92.1	Very high	83.6	Confident	169 Å²	169	77.4 Å²	77.4	74%	0.735	38%	0.383	S	S	*	.	H	α-helix	trans	-65.1	-23.6	175.5	-175.2	173.8	-179.5	176.1	0	113.3	D288 Y289 F290	D288-K292 VanDerWaalsContact O-CB 3.23Å; D288-K292 WeakPolarHBondContact O-CB 3.23Å; D288-K292 PolarHBondContact O-N 3.14Å; Y289-K292 PolarHBondContact O-N 3.2Å; F290-K292 VanDerWaalsContact C-N 3.32Å; F290-K292 PolarHBondContact O-N 3.33Å
293	K	92.7	Very high	84.6	Confident	111 Å²	111	78.2 Å²	78.2	48%	0.483	38%	0.381	S	S	.	.	H	α-helix	trans	-89.5	-28.6	176.2	-68.3	-78.1	-179.8	156.5	0	112.9	Y289 F290 R291 K295 L525	Y289-K293 HydrophobicContact CE1-CG 4.14Å; Y289-K293 HydrophobicContact CE2-CG 4.28Å; Y289-K293 WeakPolarHBondContact O-CG 3.26Å; Y289-K293 PolarHBondContact O-N 3.09Å; Y289-K293 VanDerWaalsContact O-N 3.12Å; Y289-K293 WeakPolarHBondContact OH-CE 3.19Å; F290-K293 WeakPolarHBondContact O-CA 3.35Å; F290-K293 WeakPolarHBondContact O-CB 3.46Å; F290-K293 PolarHBondContact O-N 3.14Å; R291-K293 PolarHBondContact O-N 3.3Å; K293-K295 VanDerWaalsContact C-N 3.33Å; K293-K295 PolarHBondContact O-N 3.12Å; K293-L525 HydrophobicContact CB-CD1 3.77Å; K293-L525 HydrophobicContact CB-CD2 3.72Å; K293-L525 HydrophobicContact CB-CG 4.44Å; K293-L525 HydrophobicContact CG-CD2 3.98Å
294	L	89.4	Confident	85.6	Confident	24 Å²	24	77.9 Å²	77.9	13%	0.126	38%	0.38	C	S	.	.			trans	-70.1	82.8	171.6	-67.8	-171.2	0	0	0	111.9	F290 R291 F408 I521 L525	F290-L294 HydrophobicContact CD1-CD1 4.02Å; F290-L294 HydrophobicContact CD1-CG 4.41Å; F290-L294 HydrophobicContact CE1-CD1 3.37Å; F290-L294 HydrophobicContact CE1-CG 4.07Å; F290-L294 HydrophobicContact CE2-CD1 4.47Å; F290-L294 HydrophobicContact CE2-CD2 4.44Å; F290-L294 HydrophobicContact CE2-CG 4.47Å; F290-L294 HydrophobicContact CZ-CD1 3.63Å; F290-L294 HydrophobicContact CZ-CD2 4.24Å; F290-L294 HydrophobicContact CZ-CG 4.09Å; F290-L294 PolarHBondContact O-N 3.29Å; R291-L294 PolarHBondContact O-N 3.16Å; L294-F408 HydrophobicContact CB-CD2 4.36Å; L294-F408 HydrophobicContact CB-CE2 4.18Å; L294-F408 HydrophobicContact CD1-CD2 4.12Å; L294-F408 HydrophobicContact CD2-CD2 4.29Å; L294-I521 HydrophobicContact CD1-CD1 4.01Å; L294-I521 HydrophobicContact CD2-CD1 3.84Å; L294-L525 HydrophobicContact CD2-CD1 4.03Å
295	K	82.3	Confident	86.3	Confident	168 Å²	168	79.1 Å²	79.1	73%	0.73	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-92.5	136.5	172.7	-64.5	-174.1	178.1	-175.4	0	110.6	K293 P297	K293-K295 VanDerWaalsContact C-N 3.33Å; K293-K295 PolarHBondContact O-N 3.12Å; K295-P297 VanDerWaalsContact O-CD 3.3Å; K295-P297 WeakPolarHBondContact O-CD 3.28Å
296	K	80.3	Confident	86.8	Confident	84 Å²	84	74 Å²	74	37%	0.365	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-73.6	122.7	165.4	-174.4	-164.2	171.1	-169.8	0	109.2	I300 P301 F408	K296-I300 HydrophobicContact CG-CD1 4.15Å; K296-I300 PolarHBondContact NZ-O 3.37Å; K296-P301 PolarHBondContact NZ-O 3.15Å; K296-F408 HydrophobicContact CB-CZ 4.41Å
297	P	81.6	Confident	87.2	Confident	45 Å²	45	76 Å²	76	29%	0.292	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-54	144.6	167.4	-27.1	31.5	0	0	0	113.5	K295 D299 I300	K295-P297 VanDerWaalsContact O-CD 3.3Å; K295-P297 WeakPolarHBondContact O-CD 3.28Å; P297-D299 VanDerWaalsContact C-N 3.29Å; P297-D299 WeakPolarHBondContact CB-OD1 3.25Å; P297-D299 PolarHBondContact O-N 2.97Å; P297-I300 HydrophobicContact CB-CD1 3.52Å; P297-I300 HydrophobicContact CB-CG1 4.09Å; P297-I300 HydrophobicContact CG-CD1 3.57Å
298	A	76	Confident	87.7	Confident	111 Å²	111	74.7 Å²	74.7	92%	0.917	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-17.8	-172.2	0	0	0	0	0	113.9
299	D	84.3	Confident	87.9	Confident	101 Å²	101	74.7 Å²	74.7	54%	0.54	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	9.2	-176.8	69.2	-53.8	0	0	0	113.6	P297 R326	P297-D299 VanDerWaalsContact C-N 3.29Å; P297-D299 WeakPolarHBondContact CB-OD1 3.25Å; P297-D299 PolarHBondContact O-N 2.97Å; D299-R326 PolarHBondContact O-NH2 3.12Å; D299-R326 IonicContact OD2-CZ 2.73Å; D299-R326 IonicContact OD2-NH1 3.44Å; D299-R326 PolarHBondContact OD2-NH1 2.84Å; D299-R326 IonicContact OD2-NH2 3.81Å
300	I	87.3	Confident	87.7	Confident	7 Å²	7	72.1 Å²	72.1	4%	0.036	35%	0.353	C	S	.	.	S	Bend	trans	-94.3	136.6	178.4	-68.2	162.6	0	0	0	109.6	K296 P297 D328 K331 A332	K296-I300 HydrophobicContact CG-CD1 4.15Å; K296-I300 PolarHBondContact NZ-O 3.37Å; P297-I300 HydrophobicContact CB-CD1 3.52Å; P297-I300 HydrophobicContact CB-CG1 4.09Å; P297-I300 HydrophobicContact CG-CD1 3.57Å; I300-D328 HydrophobicContact CD1-CB 3.94Å; I300-D328 VanDerWaalsContact CD1-O 3.31Å; I300-D328 WeakPolarHBondContact CD1-O 3.43Å; I300-D328 HydrophobicContact CG1-CB 4.25Å; I300-K331 HydrophobicContact CD1-CB 4.2Å; I300-A332 HydrophobicContact CG2-CB 3.75Å
301	P	85.1	Confident	87.5	Confident	60 Å²	60	79.6 Å²	79.6	39%	0.39	39%	0.393	S	S	.	.			trans	-52.4	156.4	177.9	22.5	-35.5	0	0	0	113.4	K296 R303 V329 A332	K296-P301 PolarHBondContact NZ-O 3.15Å; P301-R303 PolarHBondContact O-N 3.09Å; P301-V329 HydrophobicContact CG-CG1 4.01Å; P301-A332 HydrophobicContact CG-CB 4.48Å; P301-A332 VanDerWaalsContact O-CB 3.22Å; P301-A332 WeakPolarHBondContact O-CB 3.37Å
302	N	84.8	Confident	87.6	Confident	144 Å²	144	80.1 Å²	80.1	77%	0.77	40%	0.401	S	S	*	.	S	Bend	trans	-66.7	-37.7	-178.8	-79.2	-14.3	0	0	0	112.7	R333	N302-R333 WeakPolarHBondContact O-CB 3.49Å; N302-R333 PolarHBondContact O-N 2.78Å
303	R	88.9	Confident	87.7	Confident	127 Å²	127	72.5 Å²	72.5	48%	0.479	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	151.5	176.1	76.7	-177.4	-168	-151.2	4.9	112.3	P301 E305 R333 W335	P301-R303 PolarHBondContact O-N 3.09Å; R303-E305 IonicContact CZ-OE2 2.69Å; R303-E305 IonicContact NE-OE2 3.56Å; R303-E305 PolarHBondContact NE-OE2 3.18Å; R303-E305 IonicContact NH2-OE1 2.67Å; R303-E305 IonicContact NH2-OE2 3.14Å; R303-E305 PolarHBondContact NH2-OE2 3.24Å; R303-R333 CarbonylContact C-O 3.56Å; R303-R333 VanDerWaalsContact CA-O 3.24Å; R303-R333 WeakPolarHBondContact CA-O 3.26Å; R303-W335 HydrophobicContact CB-CB 4.39Å
304	F	91	Very high	87.7	Confident	6 Å²	6	67.5 Å²	67.5	3%	0.026	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	115	165.4	176.7	-112.4	0	0	0	108.7	M306 R320 L324 V329 L330 A332 R333 L334 W335	F304-M306 HydrophobicContact CD1-CG 4.03Å; F304-M306 HydrophobicContact CD1-SD 4.42Å; F304-M306 HydrophobicContact CE1-CG 3.53Å; F304-M306 HydrophobicContact CE1-SD 3.51Å; F304-M306 VanDerWaalsContact CE1-SD 3.51Å; F304-M306 HydrophobicContact CZ-CG 4.11Å; F304-M306 HydrophobicContact CZ-SD 4.11Å; F304-R320 VanDerWaalsContact CE2-NH2 3.3Å; F304-R320 HydrophobicContact CZ-CG 4.27Å; F304-L324 HydrophobicContact CE2-CD1 3.85Å; F304-L324 HydrophobicContact CE2-CD2 4.03Å; F304-L324 HydrophobicContact CE2-CG 4.47Å; F304-L324 HydrophobicContact CZ-CD1 3.82Å; F304-V329 HydrophobicContact CD2-CG1 3.68Å; F304-V329 HydrophobicContact CE2-CG1 4.22Å; F304-V329 HydrophobicContact CG-CG1 4.5Å; F304-L330 HydrophobicContact CD1-CD2 4.09Å; F304-L330 HydrophobicContact CE1-CD2 3.57Å; F304-L330 HydrophobicContact CE2-CD2 4.47Å; F304-L330 HydrophobicContact CZ-CD2 3.8Å; F304-A332 HydrophobicContact CB-CB 3.96Å; F304-R333 PolarHBondContact N-O 3.38Å; F304-L334 HydrophobicContact CD1-CD2 4.03Å; F304-W335 PolarHBondContact O-N 3.07Å
305	E	90.5	Very high	87.9	Confident	56 Å²	56	69.6 Å²	69.6	26%	0.262	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.6	-170.2	-169.5	171.4	156.4	0	0	111.5	R303 K307 R320 W335	R303-E305 IonicContact CZ-OE2 2.69Å; R303-E305 IonicContact NE-OE2 3.56Å; R303-E305 PolarHBondContact NE-OE2 3.18Å; R303-E305 IonicContact NH2-OE1 2.67Å; R303-E305 IonicContact NH2-OE2 3.14Å; R303-E305 PolarHBondContact NH2-OE2 3.24Å; E305-K307 IonicContact OE1-NZ 3.35Å; E305-R320 PolarHBondContact O-NE 3.05Å; E305-R320 PolarHBondContact O-NH2 3.06Å; E305-W335 WeakPolarHBondContact CA-O 3.33Å
306	M	91.2	Very high	88.6	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	121.9	173	-51.3	-151.6	-57	0	0	109.1	F304 L308 R320 I321 W335 I336 E337 W353	F304-M306 HydrophobicContact CD1-CG 4.03Å; F304-M306 HydrophobicContact CD1-SD 4.42Å; F304-M306 HydrophobicContact CE1-CG 3.53Å; F304-M306 HydrophobicContact CE1-SD 3.51Å; F304-M306 VanDerWaalsContact CE1-SD 3.51Å; F304-M306 HydrophobicContact CZ-CG 4.11Å; F304-M306 HydrophobicContact CZ-SD 4.11Å; M306-L308 HydrophobicContact CB-CD1 4.46Å; M306-L308 HydrophobicContact CB-CD2 4.47Å; M306-L308 HydrophobicContact CB-CG 4.24Å; M306-L308 HydrophobicContact CE-CD1 3.98Å; M306-R320 HydrophobicContact CB-CG 4.33Å; M306-R320 HydrophobicContact CG-CG 3.77Å; M306-R320 HydrophobicContact SD-CB 4.06Å; M306-R320 HydrophobicContact SD-CG 3.47Å; M306-R320 WeakPolarHBondContact SD-CG 3.37Å; M306-I321 HydrophobicContact CE-CD1 4.45Å; M306-I321 HydrophobicContact SD-CD1 4.36Å; M306-I321 HydrophobicContact SD-CG1 4.15Å; M306-W335 PolarHBondContact N-O 3.48Å; M306-I336 HydrophobicContact CB-CD1 4Å; M306-I336 HydrophobicContact CE-CD1 3.55Å; M306-I336 HydrophobicContact CG-CD1 4.14Å; M306-I336 WeakPolarHBondContact O-CA 3.44Å; M306-E337 PolarHBondContact O-N 3.13Å; M306-W353 HydrophobicContact CE-CD2 4.12Å; M306-W353 HydrophobicContact CE-CH2 4.05Å; M306-W353 HydrophobicContact CE-CZ2 3.35Å
307	K	90.8	Very high	89.3	Confident	104 Å²	104	58.9 Å²	58.9	45%	0.452	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.3	167	-61.5	178.5	-176.1	-73.5	0	106.8	E305 E337	E305-K307 IonicContact OE1-NZ 3.35Å; K307-E337 CarbonylContact C-O 3.55Å; K307-E337 VanDerWaalsContact CA-O 3.31Å; K307-E337 WeakPolarHBondContact CA-O 3.48Å; K307-E337 HydrophobicContact CG-CB 4.25Å; K307-E337 IonicContact NZ-OE1 3.2Å; K307-E337 PolarHBondContact NZ-OE1 3.2Å; K307-E337 IonicContact NZ-OE2 2.59Å; K307-E337 PolarHBondContact NZ-OE2 3.45Å
308	L	92.5	Very high	90	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.4	-169.5	-59.3	175.1	0	0	0	111.5	M306 I313 E316 I336 E337 F338 E339 W353	M306-L308 HydrophobicContact CB-CD1 4.46Å; M306-L308 HydrophobicContact CB-CD2 4.47Å; M306-L308 HydrophobicContact CB-CG 4.24Å; M306-L308 HydrophobicContact CE-CD1 3.98Å; L308-I313 HydrophobicContact CD1-CG1 4.46Å; L308-E316 VanDerWaalsContact CA-OE2 3.3Å; L308-E316 WeakPolarHBondContact CA-OE2 3.47Å; L308-E316 HydrophobicContact CD2-CB 3.53Å; L308-I336 HydrophobicContact CD1-CG2 4.29Å; L308-E337 PolarHBondContact N-O 2.86Å; L308-F338 HydrophobicContact CB-CD1 4.18Å; L308-F338 HydrophobicContact CB-CE1 4.23Å; L308-F338 CarbonylContact O-C 3.54Å; L308-F338 VanDerWaalsContact O-CA 3.25Å; L308-F338 WeakPolarHBondContact O-CA 3.36Å; L308-E339 PolarHBondContact O-N 2.83Å; L308-W353 VanDerWaalsContact CD1-NE1 3.35Å
309	H	90.9	Very high	91	Very high	69 Å²	69	59.7 Å²	59.7	32%	0.319	28%	0.283	S	S	.	.			trans	-92.7	136.7	164.2	-63.1	83	0	0	0	110.3	N311 N312 I313 E316 E339	H309-N311 VanDerWaalsContact C-N 3.29Å; H309-N311 PolarHBondContact O-N 2.91Å; H309-N312 HydrophobicContact CB-CB 4.35Å; H309-N312 CarbonylContact O-C 3.54Å; H309-N312 PolarHBondContact O-N 2.98Å; H309-N312 VanDerWaalsContact O-N 3.14Å; H309-I313 PolarHBondContact O-N 2.93Å; H309-I313 VanDerWaalsContact O-N 3.09Å; H309-E316 IonicContact CG-OE1 2.66Å; H309-E316 IonicContact CG-OE2 3.1Å; H309-E316 PolarHBondContact N-OE2 3.49Å; H309-E316 IonicContact ND1-OE1 2.83Å; H309-E316 PolarHBondContact ND1-OE1 3.49Å; H309-E316 IonicContact ND1-OE2 2.73Å; H309-E316 PolarHBondContact ND1-OE2 3.11Å; H309-E339 IonicContact CE1-OE2 3.39Å; H309-E339 PolarHBondContact CE1-OE2 3.28Å; H309-E339 IonicContact NE2-OE2 2.68Å
310	R	88.2	Confident	91.5	Very high	56 Å²	56	59 Å²	59	21%	0.211	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-53.8	-46.2	175	-71.5	-173.1	177.9	-91.7	-13.4	112.1	N312 I313 F338 E341 E352	R310-N312 PolarHBondContact O-N 3.31Å; R310-I313 WeakPolarHBondContact O-CB 3.44Å; R310-I313 WeakPolarHBondContact O-CG2 3.22Å; R310-I313 PolarHBondContact O-N 3.13Å; R310-F338 HydrophobicContact CG-CD1 3.79Å; R310-F338 HydrophobicContact CG-CE1 4.11Å; R310-F338 HydrophobicContact CG-CG 4.07Å; R310-E341 WeakPolarHBondContact CD-OE1 3.33Å; R310-E341 IonicContact CZ-OE1 2.68Å; R310-E341 IonicContact CZ-OE2 3.78Å; R310-E341 VanDerWaalsContact CZ-OE2 3.29Å; R310-E341 IonicContact NE-OE1 2.86Å; R310-E341 PolarHBondContact NE-OE1 3.09Å; R310-E341 IonicContact NE-OE2 3.28Å; R310-E341 PolarHBondContact NE-OE2 2.93Å; R310-E341 IonicContact NH2-OE1 3.17Å; R310-E341 IonicContact NH2-OE2 2.96Å; R310-E341 PolarHBondContact NH2-OE2 3.48Å; R310-E352 IonicContact CZ-OE1 3.07Å; R310-E352 IonicContact CZ-OE2 2.67Å; R310-E352 IonicContact NH1-OE1 3.28Å; R310-E352 PolarHBondContact NH1-OE1 3.35Å; R310-E352 IonicContact NH1-OE2 3.9Å; R310-E352 PolarHBondContact NH1-OE2 2.89Å; R310-E352 IonicContact NH2-OE1 3.78Å; R310-E352 PolarHBondContact NH2-OE1 3.08Å; R310-E352 IonicContact NH2-OE2 3.88Å; R310-E352 PolarHBondContact NH2-OE2 2.82Å
311	N	88.8	Confident	91.9	Very high	158 Å²	158	58.7 Å²	58.7	85%	0.845	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-65.1	-21.6	-177.4	-59.6	-4.1	0	0	0	113.9	H309	H309-N311 VanDerWaalsContact C-N 3.29Å; H309-N311 PolarHBondContact O-N 2.91Å
312	N	91.2	Very high	92.5	Very high	80 Å²	80	57.9 Å²	57.9	43%	0.428	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-119.9	21.5	-178	-62.5	-20.7	0	0	0	112	H309 R310 F314 E315 E316	H309-N312 HydrophobicContact CB-CB 4.35Å; H309-N312 CarbonylContact O-C 3.54Å; H309-N312 PolarHBondContact O-N 2.98Å; H309-N312 VanDerWaalsContact O-N 3.14Å; R310-N312 PolarHBondContact O-N 3.31Å; N312-F314 PolarHBondContact O-N 2.96Å; N312-F314 VanDerWaalsContact O-N 3.14Å; N312-E315 PolarHBondContact O-N 3.26Å; N312-E316 HydrophobicContact CB-CG 3.96Å; N312-E316 WeakPolarHBondContact CB-OE1 3.32Å; N312-E316 PolarHBondContact ND2-OE1 3.13Å; N312-E316 PolarHBondContact O-N 3.18Å
313	I	93.6	Very high	93	Very high	9 Å²	9	55 Å²	55	5%	0.046	25%	0.254	C	S	.	.	H	α-helix	trans	-54.4	-39.8	-168.7	-170.7	177.2	0	0	0	112.7	L308 H309 R310 S317 F338 L356 L357 E360	L308-I313 HydrophobicContact CD1-CG1 4.46Å; H309-I313 PolarHBondContact O-N 2.93Å; H309-I313 VanDerWaalsContact O-N 3.09Å; R310-I313 WeakPolarHBondContact O-CB 3.44Å; R310-I313 WeakPolarHBondContact O-CG2 3.22Å; R310-I313 PolarHBondContact O-N 3.13Å; I313-S317 WeakPolarHBondContact O-CB 3.31Å; I313-S317 PolarHBondContact O-N 3.15Å; I313-S317 VanDerWaalsContact O-N 3.09Å; I313-S317 PolarHBondContact O-OG 2.91Å; I313-F338 HydrophobicContact CD1-CE1 4.11Å; I313-F338 HydrophobicContact CD1-CZ 4.08Å; I313-F338 HydrophobicContact CG1-CE1 4.42Å; I313-L356 HydrophobicContact CD1-CB 3.49Å; I313-L356 VanDerWaalsContact CD1-CB 3.49Å; I313-L356 HydrophobicContact CD1-CD1 4.18Å; I313-L357 HydrophobicContact CD1-CB 4.38Å; I313-E360 HydrophobicContact CG2-CG 4.02Å
314	F	93.9	Very high	93.2	Very high	6 Å²	6	50.2 Å²	50.2	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-63.5	-57.6	179.3	-175.1	-105.8	0	0	0	111.6	N312 E316 S317 Y318 L357 E360 M361 Y395 F398	N312-F314 PolarHBondContact O-N 2.96Å; N312-F314 VanDerWaalsContact O-N 3.14Å; F314-E316 PolarHBondContact O-N 3.18Å; F314-S317 PolarHBondContact O-N 3.36Å; F314-Y318 WeakPolarHBondContact O-CB 3.39Å; F314-Y318 PolarHBondContact O-N 3.42Å; F314-L357 HydrophobicContact CB-CD1 4.31Å; F314-L357 HydrophobicContact CD2-CD1 3.87Å; F314-E360 HydrophobicContact CB-CB 3.87Å; F314-E360 HydrophobicContact CB-CG 4.28Å; F314-E360 HydrophobicContact CD2-CB 3.87Å; F314-E360 HydrophobicContact CG-CB 4.13Å; F314-M361 HydrophobicContact CD2-CG 4.12Å; F314-M361 HydrophobicContact CE2-CB 4.37Å; F314-M361 HydrophobicContact CE2-CG 3.84Å; F314-Y395 AromaticContact CE1-CD1 3.81Å; F314-Y395 HydrophobicContact CE1-CD1 3.81Å; F314-Y395 AromaticContact CE1-CE1 3.57Å; F314-Y395 HydrophobicContact CE1-CE1 3.57Å; F314-Y395 AromaticContact CZ-CD1 3.62Å; F314-Y395 HydrophobicContact CZ-CD1 3.62Å; F314-Y395 AromaticContact CZ-CE1 3.91Å; F314-Y395 HydrophobicContact CZ-CE1 3.91Å; F314-F398 HydrophobicContact CD2-CE1 4.22Å; F314-F398 HydrophobicContact CE2-CD1 4.48Å; F314-F398 AromaticContact CE2-CE1 3.93Å; F314-F398 HydrophobicContact CE2-CE1 3.93Å
315	E	93.3	Very high	93	Very high	67 Å²	67	60.1 Å²	60.1	31%	0.313	28%	0.281	S	S	.	.	H	α-helix	trans	-71.9	-33.2	-173.3	-52.5	-58.5	177.7	0	0	113.9	N312 R319	N312-E315 PolarHBondContact O-N 3.26Å; E315-R319 WeakPolarHBondContact O-CB 3.15Å; E315-R319 WeakPolarHBondContact O-CG 3.46Å; E315-R319 PolarHBondContact O-N 2.97Å; E315-R319 PolarHBondContact O-NE 2.87Å; E315-R319 VanDerWaalsContact O-NE 3.1Å
316	E	95.6	Very high	93.1	Very high	28 Å²	28	62.1 Å²	62.1	13%	0.131	29%	0.286	C	S	.	.	H	α-helix	trans	-71.8	-39.4	175.1	-69	-179.9	-172.3	0	0	110.9	L308 H309 N312 F314 R319 R320	L308-E316 VanDerWaalsContact CA-OE2 3.3Å; L308-E316 WeakPolarHBondContact CA-OE2 3.47Å; L308-E316 HydrophobicContact CD2-CB 3.53Å; H309-E316 IonicContact CG-OE1 2.66Å; H309-E316 IonicContact CG-OE2 3.1Å; H309-E316 PolarHBondContact N-OE2 3.49Å; H309-E316 IonicContact ND1-OE1 2.83Å; H309-E316 PolarHBondContact ND1-OE1 3.49Å; H309-E316 IonicContact ND1-OE2 2.73Å; H309-E316 PolarHBondContact ND1-OE2 3.11Å; N312-E316 HydrophobicContact CB-CG 3.96Å; N312-E316 WeakPolarHBondContact CB-OE1 3.32Å; N312-E316 PolarHBondContact ND2-OE1 3.13Å; N312-E316 PolarHBondContact O-N 3.18Å; F314-E316 PolarHBondContact O-N 3.18Å; E316-R319 VanDerWaalsContact CG-NH2 3.26Å; E316-R320 WeakPolarHBondContact O-CB 3.47Å; E316-R320 PolarHBondContact O-N 3.28Å
317	S	96.6	Very high	93.1	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.8	-44.9	172.1	-60.2	0	0	0	0	111.7	I313 F314 R320 I321 W353	I313-S317 WeakPolarHBondContact O-CB 3.31Å; I313-S317 PolarHBondContact O-N 3.15Å; I313-S317 VanDerWaalsContact O-N 3.09Å; I313-S317 PolarHBondContact O-OG 2.91Å; F314-S317 PolarHBondContact O-N 3.36Å; S317-R320 PolarHBondContact O-N 3.23Å; S317-I321 VanDerWaalsContact O-CB 3.3Å; S317-I321 WeakPolarHBondContact O-CB 3.32Å; S317-I321 WeakPolarHBondContact O-CG1 3.32Å; S317-I321 PolarHBondContact O-N 3.27Å; S317-W353 PolarHBondContact OG-NE1 3.21Å
318	Y	96.4	Very high	93.1	Very high	34 Å²	34	60.6 Å²	60.6	13%	0.133	28%	0.284	C	S	.	.	H	α-helix	trans	-55.2	-57.4	176.3	174.5	-105	0	0	0	111.2	F314 R320 I321 M322 S394 Y395 F398	F314-Y318 WeakPolarHBondContact O-CB 3.39Å; F314-Y318 PolarHBondContact O-N 3.42Å; Y318-R320 VanDerWaalsContact C-N 3.29Å; Y318-R320 PolarHBondContact O-N 3.44Å; Y318-I321 PolarHBondContact O-N 3.31Å; Y318-M322 HydrophobicContact CD2-CG 3.75Å; Y318-M322 HydrophobicContact CE2-CG 3.68Å; Y318-M322 HydrophobicContact CG-CG 4.43Å; Y318-M322 VanDerWaalsContact O-CB 3.26Å; Y318-M322 WeakPolarHBondContact O-CB 3.46Å; Y318-M322 WeakPolarHBondContact O-CG 3.48Å; Y318-M322 PolarHBondContact O-N 3.12Å; Y318-S394 WeakPolarHBondContact OH-CB 3.09Å; Y318-S394 PolarHBondContact OH-OG 3.29Å; Y318-Y395 HydrophobicContact CD1-CE1 4.24Å; Y318-Y395 AromaticContact CD2-CD1 3.87Å; Y318-Y395 HydrophobicContact CD2-CD1 3.87Å; Y318-Y395 AromaticContact CD2-CE1 3.9Å; Y318-Y395 HydrophobicContact CD2-CE1 3.9Å; Y318-Y395 HydrophobicContact CE1-CE1 4.3Å; Y318-Y395 AromaticContact CE2-CD1 3.89Å; Y318-Y395 HydrophobicContact CE2-CD1 3.89Å; Y318-Y395 AromaticContact CE2-CE1 3.97Å; Y318-Y395 HydrophobicContact CE2-CE1 3.97Å; Y318-Y395 HydrophobicContact CE2-CG 4.36Å; Y318-Y395 HydrophobicContact CG-CD1 4.46Å; Y318-Y395 HydrophobicContact CG-CE1 4.05Å; Y318-F398 VanDerWaalsContact CA-CE2 3.46Å; Y318-F398 HydrophobicContact CD2-CB 3.64Å; Y318-F398 AromaticContact CD2-CD1 3.87Å; Y318-F398 HydrophobicContact CD2-CD1 3.87Å; Y318-F398 HydrophobicContact CD2-CD2 4.1Å; Y318-F398 AromaticContact CD2-CG 3.61Å; Y318-F398 HydrophobicContact CD2-CG 3.61Å; Y318-F398 HydrophobicContact CE2-CB 3.95Å; Y318-F398 HydrophobicContact CE2-CG 4.42Å
319	R	95.6	Very high	93.1	Very high	139 Å²	139	61.8 Å²	61.8	53%	0.525	29%	0.291	S	S	.	.	H	α-helix	trans	-56.7	-41.8	177.3	-77.8	177.1	-85.2	122	-6.5	112.2	E315 E316 S323	E315-R319 WeakPolarHBondContact O-CB 3.15Å; E315-R319 WeakPolarHBondContact O-CG 3.46Å; E315-R319 PolarHBondContact O-N 2.97Å; E315-R319 PolarHBondContact O-NE 2.87Å; E315-R319 VanDerWaalsContact O-NE 3.1Å; E316-R319 VanDerWaalsContact CG-NH2 3.26Å; R319-S323 VanDerWaalsContact O-CB 3.23Å; R319-S323 WeakPolarHBondContact O-CB 3.14Å; R319-S323 PolarHBondContact O-N 2.89Å; R319-S323 PolarHBondContact O-OG 3.02Å
320	R	95.3	Very high	93.3	Very high	87 Å²	87	58.5 Å²	58.5	33%	0.328	28%	0.276	S	S	.	.	H	α-helix	trans	-72.8	-33.4	-175.4	-173.8	64.3	-172.6	97.7	-1.4	114	F304 E305 M306 E316 S317 Y318 S323	F304-R320 VanDerWaalsContact CE2-NH2 3.3Å; F304-R320 HydrophobicContact CZ-CG 4.27Å; E305-R320 PolarHBondContact O-NE 3.05Å; E305-R320 PolarHBondContact O-NH2 3.06Å; M306-R320 HydrophobicContact CB-CG 4.33Å; M306-R320 HydrophobicContact CG-CG 3.77Å; M306-R320 HydrophobicContact SD-CB 4.06Å; M306-R320 HydrophobicContact SD-CG 3.47Å; M306-R320 WeakPolarHBondContact SD-CG 3.37Å; E316-R320 WeakPolarHBondContact O-CB 3.47Å; E316-R320 PolarHBondContact O-N 3.28Å; S317-R320 PolarHBondContact O-N 3.23Å; Y318-R320 VanDerWaalsContact C-N 3.29Å; Y318-R320 PolarHBondContact O-N 3.44Å; R320-S323 PolarHBondContact O-OG 2.86Å
321	I	96.8	Very high	93.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-89	-37.8	-179.1	-71.6	172.5	0	0	0	111.5	M306 S317 Y318 L330 W353 F398 R401 V402 M405	M306-I321 HydrophobicContact CE-CD1 4.45Å; M306-I321 HydrophobicContact SD-CD1 4.36Å; M306-I321 HydrophobicContact SD-CG1 4.15Å; S317-I321 VanDerWaalsContact O-CB 3.3Å; S317-I321 WeakPolarHBondContact O-CB 3.32Å; S317-I321 WeakPolarHBondContact O-CG1 3.32Å; S317-I321 PolarHBondContact O-N 3.27Å; Y318-I321 PolarHBondContact O-N 3.31Å; I321-L330 HydrophobicContact CG1-CD2 4.12Å; I321-L330 HydrophobicContact CG2-CD1 4.03Å; I321-L330 HydrophobicContact CG2-CD2 4.48Å; I321-W353 HydrophobicContact CD1-CH2 3.78Å; I321-W353 HydrophobicContact CD1-CZ2 3.75Å; I321-F398 HydrophobicContact CB-CD2 4.14Å; I321-F398 HydrophobicContact CB-CE2 4.05Å; I321-F398 HydrophobicContact CD1-CE2 3.95Å; I321-F398 HydrophobicContact CG2-CD2 4.01Å; I321-F398 HydrophobicContact CG2-CE2 4.28Å; I321-R401 HydrophobicContact CG2-CB 3.99Å; I321-R401 PolarHBondContact O-NH1 2.97Å; I321-V402 HydrophobicContact CD1-CG2 4.12Å; I321-M405 HydrophobicContact CD1-CE 4.18Å; I321-M405 HydrophobicContact CD1-SD 3.81Å; I321-M405 HydrophobicContact CG1-SD 4.48Å
322	M	96.3	Very high	93.6	Very high	43 Å²	43	49.6 Å²	49.6	21%	0.212	23%	0.231	C	C	.	.	H	α-helix	trans	-77.3	-29.7	-178.1	-65.3	-58.8	-81.5	0	0	113.4	Y318 L324 S394 K397 F398	Y318-M322 HydrophobicContact CD2-CG 3.75Å; Y318-M322 HydrophobicContact CE2-CG 3.68Å; Y318-M322 HydrophobicContact CG-CG 4.43Å; Y318-M322 VanDerWaalsContact O-CB 3.26Å; Y318-M322 WeakPolarHBondContact O-CB 3.46Å; Y318-M322 WeakPolarHBondContact O-CG 3.48Å; Y318-M322 PolarHBondContact O-N 3.12Å; M322-L324 PolarHBondContact O-N 3.31Å; M322-L324 VanDerWaalsContact O-N 3.11Å; M322-S394 WeakPolarHBondContact CE-O 3.39Å; M322-K397 HydrophobicContact CE-CB 4.16Å; M322-K397 HydrophobicContact CE-CD 4.36Å; M322-K397 HydrophobicContact CE-CG 4.11Å; M322-F398 HydrophobicContact CE-CB 4.42Å; M322-F398 HydrophobicContact CG-CB 3.9Å; M322-F398 HydrophobicContact CG-CD2 4.2Å; M322-F398 HydrophobicContact CG-CG 4.43Å; M322-F398 HydrophobicContact SD-CB 3.73Å
323	S	95.1	Very high	93.5	Very high	82 Å²	82	52.3 Å²	52.3	57%	0.573	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-6.5	174	56.1	0	0	0	0	115.1	R319 R320 K325	R319-S323 VanDerWaalsContact O-CB 3.23Å; R319-S323 WeakPolarHBondContact O-CB 3.14Å; R319-S323 PolarHBondContact O-N 2.89Å; R319-S323 PolarHBondContact O-OG 3.02Å; R320-S323 PolarHBondContact O-OG 2.86Å; S323-K325 PolarHBondContact O-N 3.12Å
324	L	92.9	Very high	93.4	Very high	28 Å²	28	52.4 Å²	52.4	15%	0.147	24%	0.236	C	C	.	.			trans	-75.7	114.2	179.4	-65.2	-179.8	0	0	0	112.5	F304 M322 R326 L330	F304-L324 HydrophobicContact CE2-CD1 3.85Å; F304-L324 HydrophobicContact CE2-CD2 4.03Å; F304-L324 HydrophobicContact CE2-CG 4.47Å; F304-L324 HydrophobicContact CZ-CD1 3.82Å; M322-L324 PolarHBondContact O-N 3.31Å; M322-L324 VanDerWaalsContact O-N 3.11Å; L324-R326 PolarHBondContact O-N 3.46Å; L324-L330 HydrophobicContact CD1-CD1 4.23Å; L324-L330 HydrophobicContact CD1-CD2 3.37Å; L324-L330 HydrophobicContact CD1-CG 3.63Å
325	K	88.6	Confident	93.1	Very high	213 Å²	213	54.5 Å²	54.5	93%	0.926	24%	0.244	S	C	*	.	S	Bend	trans	-66.3	-22.7	170.5	-62	-174.7	178.7	-176	0	113.9	S323	S323-K325 PolarHBondContact O-N 3.12Å
326	R	91.3	Very high	92.9	Very high	98 Å²	98	51.4 Å²	51.4	37%	0.37	23%	0.229	S	C	.	.			trans	-128.1	96.5	179.4	-173.2	170.3	75.6	159.5	10.7	110.4	D299 L324 D328 V329	D299-R326 PolarHBondContact O-NH2 3.12Å; D299-R326 IonicContact OD2-CZ 2.73Å; D299-R326 IonicContact OD2-NH1 3.44Å; D299-R326 PolarHBondContact OD2-NH1 2.84Å; D299-R326 IonicContact OD2-NH2 3.81Å; L324-R326 PolarHBondContact O-N 3.46Å; R326-D328 HydrophobicContact CG-CB 4.18Å; R326-D328 PolarHBondContact O-N 3.42Å; R326-V329 HydrophobicContact CB-CG2 4.33Å; R326-V329 WeakPolarHBondContact O-CB 3.43Å; R326-V329 WeakPolarHBondContact O-CG2 3.5Å; R326-V329 PolarHBondContact O-N 2.91Å; R326-V329 VanDerWaalsContact O-N 3.16Å
327	P	91.6	Very high	92.5	Very high	20 Å²	20	53.4 Å²	53.4	13%	0.13	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-57.4	-31.4	-176.8	-27.5	36.1	0	0	0	114.1	V329 L330 E519 L520	P327-V329 PolarHBondContact O-N 3.47Å; P327-L330 VanDerWaalsContact O-CB 3.26Å; P327-L330 WeakPolarHBondContact O-CB 3.25Å; P327-L330 WeakPolarHBondContact O-CG 3.39Å; P327-L330 PolarHBondContact O-N 2.91Å; P327-E519 HydrophobicContact CB-CB 3.87Å; P327-E519 HydrophobicContact CB-CG 4.3Å; P327-E519 WeakPolarHBondContact CB-OE2 3.41Å; P327-E519 HydrophobicContact CG-CB 4.21Å; P327-E519 VanDerWaalsContact CG-CD 3.46Å; P327-E519 HydrophobicContact CG-CG 4.06Å; P327-E519 WeakPolarHBondContact CG-OE2 3.46Å; P327-L520 HydrophobicContact CB-CD2 4.42Å; P327-L520 WeakPolarHBondContact O-CD2 3.49Å
328	D	91	Very high	92.1	Very high	54 Å²	54	53.8 Å²	53.8	29%	0.289	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-52	-24.7	176.1	-71.6	-63.6	0	0	0	114.4	I300 R326 L330 K331	I300-D328 HydrophobicContact CD1-CB 3.94Å; I300-D328 VanDerWaalsContact CD1-O 3.31Å; I300-D328 WeakPolarHBondContact CD1-O 3.43Å; I300-D328 HydrophobicContact CG1-CB 4.25Å; R326-D328 HydrophobicContact CG-CB 4.18Å; R326-D328 PolarHBondContact O-N 3.42Å; D328-L330 PolarHBondContact O-N 3.31Å; D328-K331 VanDerWaalsContact O-CB 3.28Å; D328-K331 WeakPolarHBondContact O-CB 3.5Å; D328-K331 PolarHBondContact O-N 3.24Å; D328-K331 IonicContact OD1-NZ 3.57Å; D328-K331 PolarHBondContact OD1-NZ 2.83Å
329	V	92.5	Very high	91.4	Very high	26 Å²	26	57.2 Å²	57.2	16%	0.158	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-58.3	-28.2	175	176.9	0	0	0	0	112.1	P301 F304 R326 P327 K331 A332	P301-V329 HydrophobicContact CG-CG1 4.01Å; F304-V329 HydrophobicContact CD2-CG1 3.68Å; F304-V329 HydrophobicContact CE2-CG1 4.22Å; F304-V329 HydrophobicContact CG-CG1 4.5Å; R326-V329 HydrophobicContact CB-CG2 4.33Å; R326-V329 WeakPolarHBondContact O-CB 3.43Å; R326-V329 WeakPolarHBondContact O-CG2 3.5Å; R326-V329 PolarHBondContact O-N 2.91Å; R326-V329 VanDerWaalsContact O-N 3.16Å; P327-V329 PolarHBondContact O-N 3.47Å; V329-K331 PolarHBondContact O-N 3.45Å; V329-A332 WeakPolarHBondContact O-CB 3.16Å; V329-A332 PolarHBondContact O-N 3.1Å
330	L	94.1	Very high	90.6	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.005	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-67.3	-13.8	175.3	-58.9	170.8	0	0	0	113.5	F304 I321 L324 P327 D328 A332 R401 M405 H409 L520	F304-L330 HydrophobicContact CD1-CD2 4.09Å; F304-L330 HydrophobicContact CE1-CD2 3.57Å; F304-L330 HydrophobicContact CE2-CD2 4.47Å; F304-L330 HydrophobicContact CZ-CD2 3.8Å; I321-L330 HydrophobicContact CG1-CD2 4.12Å; I321-L330 HydrophobicContact CG2-CD1 4.03Å; I321-L330 HydrophobicContact CG2-CD2 4.48Å; L324-L330 HydrophobicContact CD1-CD1 4.23Å; L324-L330 HydrophobicContact CD1-CD2 3.37Å; L324-L330 HydrophobicContact CD1-CG 3.63Å; P327-L330 VanDerWaalsContact O-CB 3.26Å; P327-L330 WeakPolarHBondContact O-CB 3.25Å; P327-L330 WeakPolarHBondContact O-CG 3.39Å; P327-L330 PolarHBondContact O-N 2.91Å; D328-L330 PolarHBondContact O-N 3.31Å; L330-A332 VanDerWaalsContact C-N 3.29Å; L330-R401 HydrophobicContact CD1-CB 4.44Å; L330-M405 HydrophobicContact CB-CG 3.94Å; L330-M405 HydrophobicContact CB-SD 4.14Å; L330-M405 HydrophobicContact CD1-CG 4.31Å; L330-M405 HydrophobicContact CD1-SD 3.97Å; L330-M405 HydrophobicContact CD2-CE 4.08Å; L330-M405 HydrophobicContact CD2-SD 3.83Å; L330-M405 HydrophobicContact CG-SD 4.19Å; L330-H409 PolarHBondContact O-NE2 3.3Å; L330-L520 HydrophobicContact CB-CD1 4.25Å; L330-L520 HydrophobicContact CB-CD2 4.01Å; L330-L520 HydrophobicContact CD1-CD1 4.12Å; L330-L520 HydrophobicContact CD1-CD2 4.39Å
331	K	92.9	Very high	89.6	Confident	26 Å²	26	54.6 Å²	54.6	11%	0.113	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-81.9	-3.8	171.9	-59.1	169.4	-177	159.2	0	112.6	I300 D328 V329 F408 E519 L520	I300-K331 HydrophobicContact CD1-CB 4.2Å; D328-K331 VanDerWaalsContact O-CB 3.28Å; D328-K331 WeakPolarHBondContact O-CB 3.5Å; D328-K331 PolarHBondContact O-N 3.24Å; D328-K331 IonicContact OD1-NZ 3.57Å; D328-K331 PolarHBondContact OD1-NZ 2.83Å; V329-K331 PolarHBondContact O-N 3.45Å; K331-F408 HydrophobicContact CB-CD1 4.21Å; K331-F408 HydrophobicContact CB-CE1 3.64Å; K331-F408 HydrophobicContact CB-CE2 4.21Å; K331-F408 HydrophobicContact CB-CZ 3.65Å; K331-F408 HydrophobicContact CD-CD2 4.47Å; K331-F408 HydrophobicContact CD-CE2 4.03Å; K331-F408 HydrophobicContact CD-CZ 4.29Å; K331-F408 HydrophobicContact CG-CD1 4.26Å; K331-F408 HydrophobicContact CG-CD2 4.11Å; K331-F408 HydrophobicContact CG-CE1 4.05Å; K331-F408 HydrophobicContact CG-CE2 3.89Å; K331-F408 HydrophobicContact CG-CG 4.29Å; K331-F408 HydrophobicContact CG-CZ 3.87Å; K331-E519 PolarHBondContact NZ-O 2.93Å; K331-L520 WeakPolarHBondContact CE-O 3.34Å; K331-L520 HydrophobicContact CG-CD2 4.11Å; K331-L520 PolarHBondContact NZ-O 3.5Å
332	A	91.7	Very high	87.9	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.31	C	S	.	.	S	Bend	trans	-68.7	163.6	169	0	0	0	0	0	111.5	I300 P301 F304 V329 L330 L334 H409	I300-A332 HydrophobicContact CG2-CB 3.75Å; P301-A332 HydrophobicContact CG-CB 4.48Å; P301-A332 VanDerWaalsContact O-CB 3.22Å; P301-A332 WeakPolarHBondContact O-CB 3.37Å; F304-A332 HydrophobicContact CB-CB 3.96Å; V329-A332 WeakPolarHBondContact O-CB 3.16Å; V329-A332 PolarHBondContact O-N 3.1Å; L330-A332 VanDerWaalsContact C-N 3.29Å; A332-L334 PolarHBondContact O-N 3.45Å; A332-L334 VanDerWaalsContact O-N 3.13Å; A332-H409 PolarHBondContact O-CE1 2.89Å
333	R	88.7	Confident	86	Confident	137 Å²	137	63.2 Å²	63.2	52%	0.517	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	119.5	174.2	179.6	178.6	173	173.4	-0.3	109.1	N302 R303 F304 W335	N302-R333 WeakPolarHBondContact O-CB 3.49Å; N302-R333 PolarHBondContact O-N 2.78Å; R303-R333 CarbonylContact C-O 3.56Å; R303-R333 VanDerWaalsContact CA-O 3.24Å; R303-R333 WeakPolarHBondContact CA-O 3.26Å; F304-R333 PolarHBondContact N-O 3.38Å; R333-W335 PolarHBondContact O-N 2.9Å
334	L	90.4	Very high	84.1	Confident	12 Å²	12	66.2 Å²	66.2	6%	0.063	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	134.9	177.5	-54.1	-178.1	0	0	0	109.9	F304 A332 I336 A350 W353 F354 M405	F304-L334 HydrophobicContact CD1-CD2 4.03Å; A332-L334 PolarHBondContact O-N 3.45Å; A332-L334 VanDerWaalsContact O-N 3.13Å; L334-I336 HydrophobicContact CB-CD1 4.46Å; L334-A350 HydrophobicContact CB-CB 4.46Å; L334-W353 HydrophobicContact CD1-CZ3 4.39Å; L334-F354 HydrophobicContact CD1-CE2 3.68Å; L334-F354 HydrophobicContact CD1-CZ 3.93Å; L334-M405 HydrophobicContact CD1-CE 3.97Å; L334-M405 HydrophobicContact CD2-CE 3.7Å
335	W	88.1	Confident	82.3	Confident	50 Å²	50	66.3 Å²	66.3	19%	0.189	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	96.7	175.8	-169.5	-74.1	0	0	0	107.2	R303 F304 E305 M306 R333 Y346	R303-W335 HydrophobicContact CB-CB 4.39Å; F304-W335 PolarHBondContact O-N 3.07Å; E305-W335 WeakPolarHBondContact CA-O 3.33Å; M306-W335 PolarHBondContact N-O 3.48Å; R333-W335 PolarHBondContact O-N 2.9Å; W335-Y346 HydrophobicContact CD2-CD1 4.34Å; W335-Y346 AromaticContact CE2-CD1 3.69Å; W335-Y346 AromaticContact CE2-CE1 3.88Å; W335-Y346 AromaticContact CH2-CD1 3.9Å; W335-Y346 HydrophobicContact CH2-CD1 3.9Å; W335-Y346 AromaticContact CH2-CD2 3.75Å; W335-Y346 HydrophobicContact CH2-CD2 3.75Å; W335-Y346 HydrophobicContact CH2-CE1 4.01Å; W335-Y346 AromaticContact CH2-CE2 3.83Å; W335-Y346 HydrophobicContact CH2-CE2 3.83Å; W335-Y346 AromaticContact CH2-CG 3.78Å; W335-Y346 HydrophobicContact CH2-CG 3.78Å; W335-Y346 AromaticContact CH2-CZ 3.97Å; W335-Y346 AromaticContact CZ2-CD1 3.47Å; W335-Y346 HydrophobicContact CZ2-CD1 3.47Å; W335-Y346 VanDerWaalsContact CZ2-CD1 3.47Å; W335-Y346 HydrophobicContact CZ2-CD2 4.12Å; W335-Y346 AromaticContact CZ2-CE1 3.36Å; W335-Y346 HydrophobicContact CZ2-CE1 3.36Å; W335-Y346 HydrophobicContact CZ2-CE2 4Å; W335-Y346 AromaticContact CZ2-CG 3.87Å; W335-Y346 HydrophobicContact CZ2-CG 3.87Å; W335-Y346 AromaticContact CZ2-CZ 3.64Å; W335-Y346 HydrophobicContact CZ3-CD2 4.31Å; W335-Y346 HydrophobicContact CZ3-CG 4.16Å
336	I	89.6	Confident	81	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	136.1	-178.3	-47	-56.3	0	0	0	108.6	M306 L308 L334 V349 A350 W353	M306-I336 HydrophobicContact CB-CD1 4Å; M306-I336 HydrophobicContact CE-CD1 3.55Å; M306-I336 HydrophobicContact CG-CD1 4.14Å; M306-I336 WeakPolarHBondContact O-CA 3.44Å; L308-I336 HydrophobicContact CD1-CG2 4.29Å; L334-I336 HydrophobicContact CB-CD1 4.46Å; I336-V349 HydrophobicContact CB-CG1 3.95Å; I336-V349 HydrophobicContact CG2-CG1 3.93Å; I336-A350 HydrophobicContact CG1-CB 4.13Å; I336-W353 HydrophobicContact CD1-CD2 4.34Å; I336-W353 HydrophobicContact CD1-CG 4.44Å; I336-W353 HydrophobicContact CG1-CB 4.22Å; I336-W353 HydrophobicContact CG1-CG 4.29Å; I336-W353 HydrophobicContact CG2-CB 4.07Å; I336-W353 HydrophobicContact CG2-CG 4.2Å
337	E	87.6	Confident	79.7	Confident	70 Å²	70	56.5 Å²	56.5	33%	0.327	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	121.9	178.4	-175.6	179.9	142.3	0	0	107.6	M306 K307 L308	M306-E337 PolarHBondContact O-N 3.13Å; K307-E337 CarbonylContact C-O 3.55Å; K307-E337 VanDerWaalsContact CA-O 3.31Å; K307-E337 WeakPolarHBondContact CA-O 3.48Å; K307-E337 HydrophobicContact CG-CB 4.25Å; K307-E337 IonicContact NZ-OE1 3.2Å; K307-E337 PolarHBondContact NZ-OE1 3.2Å; K307-E337 IonicContact NZ-OE2 2.59Å; K307-E337 PolarHBondContact NZ-OE2 3.45Å; L308-E337 PolarHBondContact N-O 2.86Å
338	F	87.4	Confident	78.8	Confident	7 Å²	7	55.6 Å²	55.6	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128	171.5	-71.9	-65.1	0	0	0	109.2	L308 R310 I313 E341 V349 E352 W353 L356	L308-F338 HydrophobicContact CB-CD1 4.18Å; L308-F338 HydrophobicContact CB-CE1 4.23Å; L308-F338 CarbonylContact O-C 3.54Å; L308-F338 VanDerWaalsContact O-CA 3.25Å; L308-F338 WeakPolarHBondContact O-CA 3.36Å; R310-F338 HydrophobicContact CG-CD1 3.79Å; R310-F338 HydrophobicContact CG-CE1 4.11Å; R310-F338 HydrophobicContact CG-CG 4.07Å; I313-F338 HydrophobicContact CD1-CE1 4.11Å; I313-F338 HydrophobicContact CD1-CZ 4.08Å; I313-F338 HydrophobicContact CG1-CE1 4.42Å; F338-E341 HydrophobicContact CB-CB 4.2Å; F338-E341 HydrophobicContact CB-CG 4.41Å; F338-E341 PolarHBondContact O-N 3.44Å; F338-E341 VanDerWaalsContact O-N 3.1Å; F338-V349 HydrophobicContact CD2-CG1 3.64Å; F338-V349 HydrophobicContact CE2-CG1 3.65Å; F338-E352 WeakPolarHBondContact CE2-OE2 3.2Å; F338-W353 HydrophobicContact CZ-CB 4.42Å; F338-L356 HydrophobicContact CZ-CD1 4.21Å
339	E	82.9	Confident	78.4	Confident	106 Å²	106	53.4 Å²	53.4	50%	0.495	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	136.2	-174.8	-170	156.5	178.8	0	0	110.5	L308 H309 E341	L308-E339 PolarHBondContact O-N 2.83Å; H309-E339 IonicContact CE1-OE2 3.39Å; H309-E339 PolarHBondContact CE1-OE2 3.28Å; H309-E339 IonicContact NE2-OE2 2.68Å; E339-E341 VanDerWaalsContact C-N 3.3Å; E339-E341 PolarHBondContact O-N 2.96Å
340	S	77.4	Confident	78	Confident	123 Å²	123	52.4 Å²	52.4	86%	0.86	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	-4.3	-167.7	-46.3	0	0	0	0	117
341	E	74.5	Confident	77.4	Confident	48 Å²	48	53.2 Å²	53.2	22%	0.224	26%	0.263	C	S	.	.			trans	-104.7	129.3	178.1	-72.6	165.4	-131.5	0	0	112.8	R310 F338 E339 G343	R310-E341 WeakPolarHBondContact CD-OE1 3.33Å; R310-E341 IonicContact CZ-OE1 2.68Å; R310-E341 IonicContact CZ-OE2 3.78Å; R310-E341 VanDerWaalsContact CZ-OE2 3.29Å; R310-E341 IonicContact NE-OE1 2.86Å; R310-E341 PolarHBondContact NE-OE1 3.09Å; R310-E341 IonicContact NE-OE2 3.28Å; R310-E341 PolarHBondContact NE-OE2 2.93Å; R310-E341 IonicContact NH2-OE1 3.17Å; R310-E341 IonicContact NH2-OE2 2.96Å; R310-E341 PolarHBondContact NH2-OE2 3.48Å; F338-E341 HydrophobicContact CB-CB 4.2Å; F338-E341 HydrophobicContact CB-CG 4.41Å; F338-E341 PolarHBondContact O-N 3.44Å; F338-E341 VanDerWaalsContact O-N 3.1Å; E339-E341 VanDerWaalsContact C-N 3.3Å; E339-E341 PolarHBondContact O-N 2.96Å; E341-G343 VanDerWaalsContact C-N 3.28Å; E341-G343 PolarHBondContact O-N 3Å
342	K	61.8	Low	77.1	Confident	199 Å²	199	52.2 Å²	52.2	87%	0.865	26%	0.259	S	S	*	.			trans	-82	69.9	173.9	-74.7	-176.2	-179	170.9	0	111.9	L344	K342-L344 PolarHBondContact O-N 3.45Å
343	G	55.9	Low	77.1	Confident	26 Å²	26	52.2 Å²	52.2	27%	0.268	26%	0.259	S	S	.	.			trans	-63.2	105.8	173.5	0	0	0	0	0	112.8	E341 Y346	E341-G343 VanDerWaalsContact C-N 3.28Å; E341-G343 PolarHBondContact O-N 3Å; G343-Y346 WeakPolarHBondContact O-CE1 3.46Å
344	L	54.3	Low	77.3	Confident	144 Å²	144	45.7 Å²	45.7	75%	0.754	23%	0.234	S	C	*	.			trans	-79.3	-20.8	170	-76.1	159.5	0	0	0	112.6	K342	K342-L344 PolarHBondContact O-N 3.45Å
345	D	56.6	Low	77.2	Confident	31 Å²	31	45.5 Å²	45.5	17%	0.166	23%	0.233	C	C	.	.			trans	-110	62.9	-163	-157.9	36.3	0	0	0	113.7	G347 G348 V349 T627 C628	D345-G347 VanDerWaalsContact C-N 3.28Å; D345-G347 PolarHBondContact O-N 3.45Å; D345-G348 WeakPolarHBondContact O-CA 3.48Å; D345-G348 PolarHBondContact O-N 3.22Å; D345-V349 PolarHBondContact O-N 3Å; D345-T627 WeakPolarHBondContact OD2-CA 3.39Å; D345-T627 PolarHBondContact OD2-N 3Å; D345-T627 PolarHBondContact OD2-OG1 3.21Å; D345-C628 VanDerWaalsContact CG-SG 3.52Å; D345-C628 WeakPolarHBondContact OD1-CB 3.48Å; D345-C628 PolarHBondContact OD1-SG 3.39Å; D345-C628 PolarHBondContact OD2-N 2.82Å
346	Y	60.3	Low	77.3	Confident	95 Å²	95	45.1 Å²	45.1	37%	0.373	23%	0.234	S	C	.	.	H	α-helix	trans	-53.2	-25.5	-164.4	-57.6	-68.1	0	0	0	118.3	W335 G343	W335-Y346 HydrophobicContact CD2-CD1 4.34Å; W335-Y346 AromaticContact CE2-CD1 3.69Å; W335-Y346 AromaticContact CE2-CE1 3.88Å; W335-Y346 AromaticContact CH2-CD1 3.9Å; W335-Y346 HydrophobicContact CH2-CD1 3.9Å; W335-Y346 AromaticContact CH2-CD2 3.75Å; W335-Y346 HydrophobicContact CH2-CD2 3.75Å; W335-Y346 HydrophobicContact CH2-CE1 4.01Å; W335-Y346 AromaticContact CH2-CE2 3.83Å; W335-Y346 HydrophobicContact CH2-CE2 3.83Å; W335-Y346 AromaticContact CH2-CG 3.78Å; W335-Y346 HydrophobicContact CH2-CG 3.78Å; W335-Y346 AromaticContact CH2-CZ 3.97Å; W335-Y346 AromaticContact CZ2-CD1 3.47Å; W335-Y346 HydrophobicContact CZ2-CD1 3.47Å; W335-Y346 VanDerWaalsContact CZ2-CD1 3.47Å; W335-Y346 HydrophobicContact CZ2-CD2 4.12Å; W335-Y346 AromaticContact CZ2-CE1 3.36Å; W335-Y346 HydrophobicContact CZ2-CE1 3.36Å; W335-Y346 HydrophobicContact CZ2-CE2 4Å; W335-Y346 AromaticContact CZ2-CG 3.87Å; W335-Y346 HydrophobicContact CZ2-CG 3.87Å; W335-Y346 AromaticContact CZ2-CZ 3.64Å; W335-Y346 HydrophobicContact CZ3-CD2 4.31Å; W335-Y346 HydrophobicContact CZ3-CG 4.16Å; G343-Y346 WeakPolarHBondContact O-CE1 3.46Å
347	G	64	Low	77.5	Confident	10 Å²	10	45 Å²	45	10%	0.103	23%	0.234	C	C	.	.	H	α-helix	trans	-93.5	-12.6	176.2	0	0	0	0	0	114.5	D345 S605 C628	D345-G347 VanDerWaalsContact C-N 3.28Å; D345-G347 PolarHBondContact O-N 3.45Å; G347-S605 WeakPolarHBondContact CA-OG 3.05Å; G347-C628 VanDerWaalsContact CA-SG 3.52Å; G347-C628 PolarHBondContact N-SG 3.12Å
348	G	72.6	Confident	77.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-75.3	-54.1	169.9	0	0	0	0	0	112.4	D345 A350 R351 E352 T627 C628	D345-G348 WeakPolarHBondContact O-CA 3.48Å; D345-G348 PolarHBondContact O-N 3.22Å; G348-A350 PolarHBondContact O-N 2.93Å; G348-A350 VanDerWaalsContact O-N 3.12Å; G348-R351 WeakPolarHBondContact O-CA 3.31Å; G348-R351 WeakPolarHBondContact O-CB 3.12Å; G348-R351 PolarHBondContact O-N 2.69Å; G348-E352 PolarHBondContact O-N 3.14Å; G348-T627 WeakPolarHBondContact CA-OG1 3.39Å; G348-C628 PolarHBondContact N-SG 2.63Å; G348-C628 VanDerWaalsContact N-SG 3.43Å
349	V	82.1	Confident	77.9	Confident	9 Å²	9	46.3 Å²	46.3	6%	0.055	24%	0.238	C	C	.	.	H	α-helix	trans	-52.8	-35.6	174.3	-171.8	0	0	0	0	111.2	I336 F338 D345 R351 E352 W353	I336-V349 HydrophobicContact CB-CG1 3.95Å; I336-V349 HydrophobicContact CG2-CG1 3.93Å; F338-V349 HydrophobicContact CD2-CG1 3.64Å; F338-V349 HydrophobicContact CE2-CG1 3.65Å; D345-V349 PolarHBondContact O-N 3Å; V349-R351 PolarHBondContact O-N 3.29Å; V349-E352 PolarHBondContact O-N 3.21Å; V349-W353 WeakPolarHBondContact O-CB 3.29Å; V349-W353 PolarHBondContact O-N 3.24Å
350	A	85.3	Confident	78.3	Confident	5 Å²	5	44.2 Å²	44.2	4%	0.041	23%	0.228	C	C	.	.	H	α-helix	trans	-66.5	-32.1	174.5	0	0	0	0	0	114.1	L334 I336 G348 F354	L334-A350 HydrophobicContact CB-CB 4.46Å; I336-A350 HydrophobicContact CG1-CB 4.13Å; G348-A350 PolarHBondContact O-N 2.93Å; G348-A350 VanDerWaalsContact O-N 3.12Å; A350-F354 WeakPolarHBondContact O-CD2 3.42Å; A350-F354 PolarHBondContact O-N 3.03Å
351	R	82.3	Confident	79.1	Confident	17 Å²	17	38.4 Å²	38.4	6%	0.064	19%	0.188	C	C	.	.	H	α-helix	trans	-74	-44.8	172.6	-60.9	-154.3	-160.9	80.8	-8.4	111.3	G348 V349 W353 F354 F355 K411 T589 G590 Y603 G604 T627 N630	G348-R351 WeakPolarHBondContact O-CA 3.31Å; G348-R351 WeakPolarHBondContact O-CB 3.12Å; G348-R351 PolarHBondContact O-N 2.69Å; V349-R351 PolarHBondContact O-N 3.29Å; R351-W353 VanDerWaalsContact C-N 3.26Å; R351-W353 PolarHBondContact O-N 3.17Å; R351-F354 PolarHBondContact O-N 3.18Å; R351-F354 VanDerWaalsContact O-N 3.12Å; R351-F355 PolarHBondContact O-N 2.88Å; R351-K411 HydrophobicContact CG-CD 3.91Å; R351-K411 VanDerWaalsContact CG-NZ 3.29Å; R351-T589 VanDerWaalsContact CD-O 3.31Å; R351-T589 WeakPolarHBondContact CD-O 3.36Å; R351-T589 VanDerWaalsContact CZ-O 3.28Å; R351-T589 PolarHBondContact NH1-O 2.7Å; R351-G590 CarbonylContact C-O 3.56Å; R351-G590 VanDerWaalsContact CB-O 3.22Å; R351-G590 WeakPolarHBondContact CB-O 3.3Å; R351-Y603 PolarHBondContact NH2-O 2.95Å; R351-G604 VanDerWaalsContact NH2-CA 3.33Å; R351-T627 PolarHBondContact NH1-O 2.87Å; R351-T627 PolarHBondContact NH2-O 3.31Å; R351-N630 PolarHBondContact NH2-OD1 2.61Å
352	E	85.4	Confident	79.9	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.028	18%	0.18	C	C	.	.	H	α-helix	trans	-56.6	-44.1	176.4	-176	-174	-143.5	0	0	110.9	R310 F338 G348 V349 F354 F355 L356 F657	R310-E352 IonicContact CZ-OE1 3.07Å; R310-E352 IonicContact CZ-OE2 2.67Å; R310-E352 IonicContact NH1-OE1 3.28Å; R310-E352 PolarHBondContact NH1-OE1 3.35Å; R310-E352 IonicContact NH1-OE2 3.9Å; R310-E352 PolarHBondContact NH1-OE2 2.89Å; R310-E352 IonicContact NH2-OE1 3.78Å; R310-E352 PolarHBondContact NH2-OE1 3.08Å; R310-E352 IonicContact NH2-OE2 3.88Å; R310-E352 PolarHBondContact NH2-OE2 2.82Å; F338-E352 WeakPolarHBondContact CE2-OE2 3.2Å; G348-E352 PolarHBondContact O-N 3.14Å; V349-E352 PolarHBondContact O-N 3.21Å; E352-F354 PolarHBondContact O-N 3.3Å; E352-F355 WeakPolarHBondContact O-CB 3.25Å; E352-F355 PolarHBondContact O-N 2.99Å; E352-F355 VanDerWaalsContact O-N 3.14Å; E352-L356 HydrophobicContact CG-CD1 3.72Å; E352-L356 HydrophobicContact CG-CG 4Å; E352-L356 WeakPolarHBondContact O-CB 3.49Å; E352-L356 WeakPolarHBondContact O-CG 3.36Å; E352-L356 PolarHBondContact O-N 3.01Å; E352-F657 HydrophobicContact CB-CD2 4.49Å; E352-F657 HydrophobicContact CB-CE2 4.02Å; E352-F657 VanDerWaalsContact CD-CD2 3.43Å; E352-F657 HydrophobicContact CG-CD2 4.4Å; E352-F657 HydrophobicContact CG-CE2 4.04Å; E352-F657 WeakPolarHBondContact OE1-CD2 3.34Å; E352-F657 WeakPolarHBondContact OE2-CD2 3.23Å
353	W	92.4	Very high	81	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.7	-45.7	175.3	173	76.9	0	0	0	112.8	M306 L308 S317 I321 L334 I336 F338 V349 R351 F355 L357 V402 M405	M306-W353 HydrophobicContact CE-CD2 4.12Å; M306-W353 HydrophobicContact CE-CH2 4.05Å; M306-W353 HydrophobicContact CE-CZ2 3.35Å; L308-W353 VanDerWaalsContact CD1-NE1 3.35Å; S317-W353 PolarHBondContact OG-NE1 3.21Å; I321-W353 HydrophobicContact CD1-CH2 3.78Å; I321-W353 HydrophobicContact CD1-CZ2 3.75Å; L334-W353 HydrophobicContact CD1-CZ3 4.39Å; I336-W353 HydrophobicContact CD1-CD2 4.34Å; I336-W353 HydrophobicContact CD1-CG 4.44Å; I336-W353 HydrophobicContact CG1-CB 4.22Å; I336-W353 HydrophobicContact CG1-CG 4.29Å; I336-W353 HydrophobicContact CG2-CB 4.07Å; I336-W353 HydrophobicContact CG2-CG 4.2Å; F338-W353 HydrophobicContact CZ-CB 4.42Å; V349-W353 WeakPolarHBondContact O-CB 3.29Å; V349-W353 PolarHBondContact O-N 3.24Å; R351-W353 VanDerWaalsContact C-N 3.26Å; R351-W353 PolarHBondContact O-N 3.17Å; W353-F355 VanDerWaalsContact C-N 3.35Å; W353-F355 PolarHBondContact O-N 3.38Å; W353-L357 HydrophobicContact CH2-CD2 3.91Å; W353-L357 HydrophobicContact CZ2-CD2 3.28Å; W353-L357 WeakPolarHBondContact O-CB 3.35Å; W353-L357 PolarHBondContact O-N 3.35Å; W353-V402 HydrophobicContact CH2-CG1 4.36Å; W353-M405 HydrophobicContact CH2-CE 3.67Å; W353-M405 HydrophobicContact CH2-SD 4.32Å; W353-M405 HydrophobicContact CZ3-CE 3.86Å
354	F	93.4	Very high	82.4	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.4	-42.9	174.9	-83.8	-70.7	0	0	0	112.1	L334 A350 R351 E352 S358 V402 M405 A406 K411 L413	L334-F354 HydrophobicContact CD1-CE2 3.68Å; L334-F354 HydrophobicContact CD1-CZ 3.93Å; A350-F354 WeakPolarHBondContact O-CD2 3.42Å; A350-F354 PolarHBondContact O-N 3.03Å; R351-F354 PolarHBondContact O-N 3.18Å; R351-F354 VanDerWaalsContact O-N 3.12Å; E352-F354 PolarHBondContact O-N 3.3Å; F354-S358 VanDerWaalsContact O-CB 3.31Å; F354-S358 WeakPolarHBondContact O-CB 3.46Å; F354-S358 PolarHBondContact O-N 3.03Å; F354-S358 PolarHBondContact O-OG 3.12Å; F354-V402 HydrophobicContact CD1-CG1 4.02Å; F354-V402 HydrophobicContact CE1-CG1 4Å; F354-V402 WeakPolarHBondContact CE1-O 3.46Å; F354-M405 HydrophobicContact CE1-CB 3.97Å; F354-M405 HydrophobicContact CZ-CB 3.77Å; F354-A406 HydrophobicContact CD1-CB 3.92Å; F354-A406 HydrophobicContact CE1-CB 3.61Å; F354-A406 HydrophobicContact CZ-CB 4.19Å; F354-K411 HydrophobicContact CB-CB 4.49Å; F354-K411 HydrophobicContact CD2-CB 3.38Å; F354-K411 HydrophobicContact CD2-CG 3.52Å; F354-K411 HydrophobicContact CE2-CB 3.61Å; F354-K411 HydrophobicContact CE2-CG 3.45Å; F354-K411 VanDerWaalsContact CE2-CG 3.45Å; F354-K411 HydrophobicContact CG-CB 3.97Å; F354-K411 HydrophobicContact CZ-CB 4.34Å; F354-K411 HydrophobicContact CZ-CG 4.42Å; F354-L413 HydrophobicContact CB-CD2 4.48Å; F354-L413 HydrophobicContact CD1-CD2 3.82Å
355	F	87	Confident	83.8	Confident	7 Å²	7	30.9 Å²	30.9	3%	0.031	14%	0.143	C	C	.	.	H	α-helix	trans	-63.5	-54.7	179.3	170.2	-97.5	0	0	0	112.2	R351 E352 W353 L357 S358 K359 D414 Q586 S592	R351-F355 PolarHBondContact O-N 2.88Å; E352-F355 WeakPolarHBondContact O-CB 3.25Å; E352-F355 PolarHBondContact O-N 2.99Å; E352-F355 VanDerWaalsContact O-N 3.14Å; W353-F355 VanDerWaalsContact C-N 3.35Å; W353-F355 PolarHBondContact O-N 3.38Å; F355-L357 VanDerWaalsContact C-N 3.34Å; F355-L357 PolarHBondContact O-N 3.02Å; F355-S358 WeakPolarHBondContact CA-OG 3.27Å; F355-S358 PolarHBondContact O-N 2.88Å; F355-S358 PolarHBondContact O-OG 2.9Å; F355-K359 HydrophobicContact CE1-CD 4.13Å; F355-K359 HydrophobicContact CZ-CD 4.08Å; F355-K359 PolarHBondContact O-N 3.31Å; F355-K359 VanDerWaalsContact O-N 3.13Å; F355-D414 HydrophobicContact CD2-CB 3.85Å; F355-D414 HydrophobicContact CE2-CB 4.13Å; F355-D414 WeakPolarHBondContact CE2-OD2 3.21Å; F355-Q586 VanDerWaalsContact CE1-CD 3.46Å; F355-S592 WeakPolarHBondContact CD2-OG 3.4Å; F355-S592 WeakPolarHBondContact CE2-OG 3.42Å
356	L	90.4	Very high	85.1	Confident	43 Å²	43	33.4 Å²	33.4	23%	0.225	15%	0.15	C	C	.	.	H	α-helix	trans	-60.4	-44.8	178.6	-67.8	177.7	0	0	0	111	I313 F338 E352 S358 K359 E360	I313-L356 HydrophobicContact CD1-CB 3.49Å; I313-L356 VanDerWaalsContact CD1-CB 3.49Å; I313-L356 HydrophobicContact CD1-CD1 4.18Å; F338-L356 HydrophobicContact CZ-CD1 4.21Å; E352-L356 HydrophobicContact CG-CD1 3.72Å; E352-L356 HydrophobicContact CG-CG 4Å; E352-L356 WeakPolarHBondContact O-CB 3.49Å; E352-L356 WeakPolarHBondContact O-CG 3.36Å; E352-L356 PolarHBondContact O-N 3.01Å; L356-S358 VanDerWaalsContact C-N 3.34Å; L356-S358 PolarHBondContact O-N 3.5Å; L356-K359 PolarHBondContact O-N 2.68Å; L356-E360 PolarHBondContact O-N 3.23Å
357	L	94.7	Very high	86.5	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.7	-36.4	177.7	-175.9	60	0	0	0	112	I313 F314 W353 F355 K359 E360 M361 F398 V402	I313-L357 HydrophobicContact CD1-CB 4.38Å; F314-L357 HydrophobicContact CB-CD1 4.31Å; F314-L357 HydrophobicContact CD2-CD1 3.87Å; W353-L357 HydrophobicContact CH2-CD2 3.91Å; W353-L357 HydrophobicContact CZ2-CD2 3.28Å; W353-L357 WeakPolarHBondContact O-CB 3.35Å; W353-L357 PolarHBondContact O-N 3.35Å; F355-L357 VanDerWaalsContact C-N 3.34Å; F355-L357 PolarHBondContact O-N 3.02Å; L357-K359 VanDerWaalsContact C-N 3.31Å; L357-K359 PolarHBondContact O-N 2.83Å; L357-E360 PolarHBondContact O-N 2.82Å; L357-M361 HydrophobicContact CD1-CG 4.11Å; L357-M361 HydrophobicContact CD2-SD 4.4Å; L357-M361 HydrophobicContact CG-CE 4.19Å; L357-M361 HydrophobicContact CG-CG 4.01Å; L357-M361 HydrophobicContact CG-SD 4.02Å; L357-M361 WeakPolarHBondContact O-CB 3.24Å; L357-M361 VanDerWaalsContact O-CG 3.23Å; L357-M361 WeakPolarHBondContact O-CG 3.33Å; L357-M361 PolarHBondContact O-N 3.26Å; L357-F398 HydrophobicContact CD1-CE1 4.41Å; L357-F398 HydrophobicContact CD1-CZ 4.14Å; L357-F398 HydrophobicContact CD2-CZ 4.01Å; L357-V402 HydrophobicContact CD2-CG1 3.94Å; L357-V402 HydrophobicContact CD2-CG2 3.92Å
358	S	93.1	Very high	87.9	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64	-34.7	175.1	54	0	0	0	0	113.2	F354 F355 L356 F362 D414	F354-S358 VanDerWaalsContact O-CB 3.31Å; F354-S358 WeakPolarHBondContact O-CB 3.46Å; F354-S358 PolarHBondContact O-N 3.03Å; F354-S358 PolarHBondContact O-OG 3.12Å; F355-S358 WeakPolarHBondContact CA-OG 3.27Å; F355-S358 PolarHBondContact O-N 2.88Å; F355-S358 PolarHBondContact O-OG 2.9Å; L356-S358 VanDerWaalsContact C-N 3.34Å; L356-S358 PolarHBondContact O-N 3.5Å; S358-F362 WeakPolarHBondContact O-CB 3.46Å; S358-F362 WeakPolarHBondContact O-CD2 3.23Å; S358-F362 VanDerWaalsContact O-CG 3.3Å; S358-F362 WeakPolarHBondContact O-CG 3.33Å; S358-F362 PolarHBondContact O-N 2.88Å; S358-F362 VanDerWaalsContact O-N 3.09Å; S358-D414 VanDerWaalsContact OG-CB 3.29Å; S358-D414 WeakPolarHBondContact OG-CB 3.26Å; S358-D414 PolarHBondContact OG-N 2.97Å
359	K	88.5	Confident	88.9	Confident	104 Å²	104	29 Å²	29	45%	0.452	13%	0.133	S	C	.	.	H	α-helix	trans	-63.2	-42.2	173.7	-72.6	-173.3	168.1	-173.6	0	112.4	F355 L356 L357 N363 D414	F355-K359 HydrophobicContact CE1-CD 4.13Å; F355-K359 HydrophobicContact CZ-CD 4.08Å; F355-K359 PolarHBondContact O-N 3.31Å; F355-K359 VanDerWaalsContact O-N 3.13Å; L356-K359 PolarHBondContact O-N 2.68Å; L357-K359 VanDerWaalsContact C-N 3.31Å; L357-K359 PolarHBondContact O-N 2.83Å; K359-N363 WeakPolarHBondContact O-CB 3.24Å; K359-N363 PolarHBondContact O-N 2.96Å; K359-D414 WeakPolarHBondContact CE-OD2 3.14Å
360	E	92.3	Very high	89.3	Confident	61 Å²	61	31.1 Å²	31.1	29%	0.285	14%	0.142	S	C	.	.	H	α-helix	trans	-70.7	-48.4	175.2	-61.5	-51	138.3	0	0	112.2	I313 F314 L356 L357 F362 N363 Y366	I313-E360 HydrophobicContact CG2-CG 4.02Å; F314-E360 HydrophobicContact CB-CB 3.87Å; F314-E360 HydrophobicContact CB-CG 4.28Å; F314-E360 HydrophobicContact CD2-CB 3.87Å; F314-E360 HydrophobicContact CG-CB 4.13Å; L356-E360 PolarHBondContact O-N 3.23Å; L357-E360 PolarHBondContact O-N 2.82Å; E360-F362 PolarHBondContact O-N 3.26Å; E360-F362 VanDerWaalsContact O-N 3.12Å; E360-N363 WeakPolarHBondContact O-CB 3.29Å; E360-N363 PolarHBondContact O-N 2.84Å; E360-N363 VanDerWaalsContact O-N 3.16Å; E360-Y366 HydrophobicContact CB-CE2 4.32Å; E360-Y366 VanDerWaalsContact O-CD2 3.22Å; E360-Y366 WeakPolarHBondContact O-CD2 3.42Å; E360-Y366 WeakPolarHBondContact O-CE2 3.23Å; E360-Y366 WeakPolarHBondContact OE2-CE2 3.39Å; E360-Y366 PolarHBondContact OE2-OH 3.43Å
361	M	93.4	Very high	89	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-55.6	-33.5	-179.8	-73.8	-173.5	-54.1	0	0	113.4	F314 L357 F369 F398 I399 V402 L413	F314-M361 HydrophobicContact CD2-CG 4.12Å; F314-M361 HydrophobicContact CE2-CB 4.37Å; F314-M361 HydrophobicContact CE2-CG 3.84Å; L357-M361 HydrophobicContact CD1-CG 4.11Å; L357-M361 HydrophobicContact CD2-SD 4.4Å; L357-M361 HydrophobicContact CG-CE 4.19Å; L357-M361 HydrophobicContact CG-CG 4.01Å; L357-M361 HydrophobicContact CG-SD 4.02Å; L357-M361 WeakPolarHBondContact O-CB 3.24Å; L357-M361 VanDerWaalsContact O-CG 3.23Å; L357-M361 WeakPolarHBondContact O-CG 3.33Å; L357-M361 PolarHBondContact O-N 3.26Å; M361-F369 WeakPolarHBondContact O-CD2 3.37Å; M361-F369 WeakPolarHBondContact O-CE2 3.38Å; M361-F398 HydrophobicContact CG-CE1 4.25Å; M361-F398 HydrophobicContact SD-CE1 4.31Å; M361-I399 HydrophobicContact CB-CD1 4.11Å; M361-I399 HydrophobicContact CB-CG1 4.13Å; M361-I399 HydrophobicContact CG-CD1 4.34Å; M361-I399 HydrophobicContact CG-CG1 3.87Å; M361-I399 HydrophobicContact SD-CB 4.18Å; M361-I399 HydrophobicContact SD-CG1 3.79Å; M361-I399 HydrophobicContact SD-CG2 4.07Å; M361-V402 HydrophobicContact CE-CB 4.2Å; M361-V402 HydrophobicContact CE-CG1 3.6Å; M361-V402 HydrophobicContact SD-CB 3.79Å; M361-V402 HydrophobicContact SD-CG1 3.78Å; M361-V402 HydrophobicContact SD-CG2 4.02Å; M361-L413 HydrophobicContact CE-CD2 4.21Å
362	F	91.1	Very high	88.5	Confident	13 Å²	13	33.7 Å²	33.7	6%	0.057	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	8.1	-174.5	-52.3	-31.9	0	0	0	113.3	S358 E360 P364 F369 L379 I399 L413 F417	S358-F362 WeakPolarHBondContact O-CB 3.46Å; S358-F362 WeakPolarHBondContact O-CD2 3.23Å; S358-F362 VanDerWaalsContact O-CG 3.3Å; S358-F362 WeakPolarHBondContact O-CG 3.33Å; S358-F362 PolarHBondContact O-N 2.88Å; S358-F362 VanDerWaalsContact O-N 3.09Å; E360-F362 PolarHBondContact O-N 3.26Å; E360-F362 VanDerWaalsContact O-N 3.12Å; F362-P364 VanDerWaalsContact O-CD 3.24Å; F362-P364 WeakPolarHBondContact O-CD 3.48Å; F362-F369 HydrophobicContact CD1-CD2 4.13Å; F362-F369 AromaticContact CD1-CE2 3.74Å; F362-F369 HydrophobicContact CD1-CE2 3.74Å; F362-F369 HydrophobicContact CD1-CZ 4.11Å; F362-F369 HydrophobicContact CE1-CE2 4.22Å; F362-F369 HydrophobicContact CE1-CZ 4.27Å; F362-L379 HydrophobicContact CB-CD1 3.79Å; F362-L379 HydrophobicContact CG-CD1 4.35Å; F362-I399 HydrophobicContact CE1-CG2 3.77Å; F362-I399 HydrophobicContact CZ-CG2 4.47Å; F362-L413 HydrophobicContact CE2-CB 4.17Å; F362-L413 HydrophobicContact CE2-CD1 4.43Å; F362-L413 HydrophobicContact CZ-CD1 4.08Å; F362-F417 HydrophobicContact CD1-CE1 4.23Å; F362-F417 AromaticContact CD1-CZ 3.78Å; F362-F417 HydrophobicContact CD1-CZ 3.78Å; F362-F417 HydrophobicContact CD2-CZ 4.07Å; F362-F417 HydrophobicContact CE1-CE1 4.34Å; F362-F417 AromaticContact CE1-CZ 3.57Å; F362-F417 HydrophobicContact CE1-CZ 3.57Å; F362-F417 HydrophobicContact CE2-CE2 4.25Å; F362-F417 AromaticContact CE2-CZ 3.83Å; F362-F417 HydrophobicContact CE2-CZ 3.83Å; F362-F417 HydrophobicContact CG-CZ 4.06Å; F362-F417 HydrophobicContact CZ-CE2 4.14Å; F362-F417 AromaticContact CZ-CZ 3.59Å; F362-F417 HydrophobicContact CZ-CZ 3.59Å
363	N	86.8	Confident	87.2	Confident	44 Å²	44	36.9 Å²	36.9	24%	0.235	18%	0.18	C	C	.	.			trans	-70.2	116.8	173.7	-179	-2.5	0	0	0	110.1	K359 E360 Y365 Y366	K359-N363 WeakPolarHBondContact O-CB 3.24Å; K359-N363 PolarHBondContact O-N 2.96Å; E360-N363 WeakPolarHBondContact O-CB 3.29Å; E360-N363 PolarHBondContact O-N 2.84Å; E360-N363 VanDerWaalsContact O-N 3.16Å; N363-Y365 PolarHBondContact O-N 2.87Å; N363-Y365 VanDerWaalsContact O-N 3.07Å; N363-Y365 WeakPolarHBondContact OD1-CB 3.43Å; N363-Y365 WeakPolarHBondContact OD1-CD2 3.32Å; N363-Y365 PolarHBondContact OD1-N 3.15Å; N363-Y365 VanDerWaalsContact OD1-N 3.13Å; N363-Y366 HydrophobicContact CB-CD2 3.88Å; N363-Y366 HydrophobicContact CB-CE2 4.06Å; N363-Y366 PolarHBondContact O-N 3.39Å
364	P	84.9	Confident	85.2	Confident	32 Å²	32	39.5 Å²	39.5	21%	0.208	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-62	-18.1	-178.1	-26.8	38.8	0	0	0	114.6	F362 Y366 G367 F369 Y371 L379	F362-P364 VanDerWaalsContact O-CD 3.24Å; F362-P364 WeakPolarHBondContact O-CD 3.48Å; P364-Y366 PolarHBondContact O-N 3.15Å; P364-G367 PolarHBondContact O-N 3.26Å; P364-F369 VanDerWaalsContact CA-O 3.32Å; P364-F369 WeakPolarHBondContact CA-O 3.24Å; P364-F369 WeakPolarHBondContact CB-O 3.33Å; P364-Y371 HydrophobicContact CG-CD2 4.31Å; P364-Y371 HydrophobicContact CG-CE1 4.21Å; P364-Y371 HydrophobicContact CG-CE2 3.73Å; P364-L379 HydrophobicContact CG-CD2 4.25Å
365	Y	82.9	Confident	83.4	Confident	171 Å²	171	40.8 Å²	40.8	67%	0.671	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-62.3	-23.7	176	-70.9	-59.6	0	0	0	113.8	H68 N363 G367	H68-Y365 WeakPolarHBondContact CB-OH 3.3Å; N363-Y365 PolarHBondContact O-N 2.87Å; N363-Y365 VanDerWaalsContact O-N 3.07Å; N363-Y365 WeakPolarHBondContact OD1-CB 3.43Å; N363-Y365 WeakPolarHBondContact OD1-CD2 3.32Å; N363-Y365 PolarHBondContact OD1-N 3.15Å; N363-Y365 VanDerWaalsContact OD1-N 3.13Å; Y365-G367 PolarHBondContact O-N 3.05Å
366	Y	84	Confident	81.9	Confident	83 Å²	83	46.4 Å²	46.4	33%	0.325	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-77.5	-2.2	172.1	-65.9	-66.1	0	0	0	113.7	E360 N363 P364 L368	E360-Y366 HydrophobicContact CB-CE2 4.32Å; E360-Y366 VanDerWaalsContact O-CD2 3.22Å; E360-Y366 WeakPolarHBondContact O-CD2 3.42Å; E360-Y366 WeakPolarHBondContact O-CE2 3.23Å; E360-Y366 WeakPolarHBondContact OE2-CE2 3.39Å; E360-Y366 PolarHBondContact OE2-OH 3.43Å; N363-Y366 HydrophobicContact CB-CD2 3.88Å; N363-Y366 HydrophobicContact CB-CE2 4.06Å; N363-Y366 PolarHBondContact O-N 3.39Å; P364-Y366 PolarHBondContact O-N 3.15Å; Y366-L368 PolarHBondContact O-N 3.1Å; Y366-L368 VanDerWaalsContact O-N 3.12Å
367	G	89.7	Confident	80.5	Confident	8 Å²	8	50.7 Å²	50.7	8%	0.082	25%	0.247	C	C	.	.	S	Bend	trans	70	3.1	178	0	0	0	0	0	115.1	P364 Y365 N382 S385	P364-G367 PolarHBondContact O-N 3.26Å; Y365-G367 PolarHBondContact O-N 3.05Å; G367-N382 VanDerWaalsContact O-CB 3.31Å; G367-N382 WeakPolarHBondContact O-CB 3.5Å; G367-N382 PolarHBondContact O-ND2 3.49Å; G367-S385 VanDerWaalsContact O-CA 3.3Å; G367-S385 WeakPolarHBondContact O-CA 3.22Å; G367-S385 VanDerWaalsContact O-CB 3.24Å; G367-S385 WeakPolarHBondContact O-CB 3.44Å
368	L	94.1	Very high	79.3	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.252	C	S	.	.	S	Bend	trans	-77.2	-40.9	178.3	-59.9	178.1	0	0	0	112.1	Y366 N382 H392 Y395 F396 I399	Y366-L368 PolarHBondContact O-N 3.1Å; Y366-L368 VanDerWaalsContact O-N 3.12Å; L368-N382 WeakPolarHBondContact O-CB 3.43Å; L368-N382 PolarHBondContact O-N 3.23Å; L368-H392 HydrophobicContact CD2-CB 3.87Å; L368-Y395 HydrophobicContact CD1-CG 4.35Å; L368-F396 HydrophobicContact CB-CZ 4.09Å; L368-F396 HydrophobicContact CD2-CE2 4.05Å; L368-F396 HydrophobicContact CD2-CZ 4.37Å; L368-F396 WeakPolarHBondContact O-CZ 3.37Å; L368-I399 HydrophobicContact CD1-CD1 3.83Å
369	F	93.8	Very high	78.9	Confident	3 Å²	3	52 Å²	52	1%	0.013	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	158.3	178.9	-63.7	-88.6	0	0	0	110.7	M361 F362 P364 L379 Q380 I381 F396 I399 F417 F421	M361-F369 WeakPolarHBondContact O-CD2 3.37Å; M361-F369 WeakPolarHBondContact O-CE2 3.38Å; F362-F369 HydrophobicContact CD1-CD2 4.13Å; F362-F369 AromaticContact CD1-CE2 3.74Å; F362-F369 HydrophobicContact CD1-CE2 3.74Å; F362-F369 HydrophobicContact CD1-CZ 4.11Å; F362-F369 HydrophobicContact CE1-CE2 4.22Å; F362-F369 HydrophobicContact CE1-CZ 4.27Å; P364-F369 VanDerWaalsContact CA-O 3.32Å; P364-F369 WeakPolarHBondContact CA-O 3.24Å; P364-F369 WeakPolarHBondContact CB-O 3.33Å; F369-L379 HydrophobicContact CB-CD2 4.14Å; F369-Q380 WeakPolarHBondContact CA-O 3.45Å; F369-I381 HydrophobicContact CD1-CG1 4.38Å; F369-I381 HydrophobicContact CE1-CG1 3.97Å; F369-F396 HydrophobicContact CE1-CE1 4.25Å; F369-F396 HydrophobicContact CE2-CE1 4.16Å; F369-F396 HydrophobicContact CZ-CD1 4.45Å; F369-F396 AromaticContact CZ-CE1 3.82Å; F369-F396 HydrophobicContact CZ-CE1 3.82Å; F369-I399 HydrophobicContact CE2-CD1 3.91Å; F369-F417 HydrophobicContact CD1-CD1 4.48Å; F369-F417 AromaticContact CD1-CE1 3.96Å; F369-F417 HydrophobicContact CD1-CE1 3.96Å; F369-F417 HydrophobicContact CE1-CD1 4.25Å; F369-F417 AromaticContact CE1-CE1 3.62Å; F369-F417 HydrophobicContact CE1-CE1 3.62Å; F369-F417 HydrophobicContact CZ-CE1 4.2Å; F369-F421 HydrophobicContact CE1-CE2 4.4Å
370	E	89.1	Confident	79	Confident	54 Å²	54	47.6 Å²	47.6	25%	0.252	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	160.4	173.7	63.7	-174.9	-163.3	0	0	109.5	L379 Q380 N382 R505	E370-L379 WeakPolarHBondContact O-CA 3.33Å; E370-Q380 HydrophobicContact CG-CG 3.55Å; E370-Q380 PolarHBondContact N-O 3.02Å; E370-Q380 PolarHBondContact O-N 3.37Å; E370-Q380 PolarHBondContact OE1-NE2 3.12Å; E370-N382 HydrophobicContact CB-CB 4.36Å; E370-N382 HydrophobicContact CG-CB 4.32Å; E370-N382 PolarHBondContact OE2-OD1 2.96Å; E370-R505 IonicContact OE1-NH2 3.15Å
371	Y	80.6	Confident	79.1	Confident	71 Å²	71	45.1 Å²	45.1	28%	0.278	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	150.5	172.2	-62.2	-62.2	0	0	0	111.1	R71 P364 T378 L379	R71-Y371 PolarHBondContact NH1-OH 3.47Å; R71-Y371 PolarHBondContact NH2-OH 3.2Å; P364-Y371 HydrophobicContact CG-CD2 4.31Å; P364-Y371 HydrophobicContact CG-CE1 4.21Å; P364-Y371 HydrophobicContact CG-CE2 3.73Å; Y371-T378 WeakPolarHBondContact CA-O 3.1Å; Y371-L379 HydrophobicContact CD1-CD2 4.07Å; Y371-L379 HydrophobicContact CE1-CD2 3.9Å
372	S	70.3	Confident	79.1	Confident	6 Å²	6	45.9 Å²	45.9	4%	0.042	23%	0.228	C	C	.	.			trans	-66.2	160.1	168.5	47.5	0	0	0	0	112.5	T374 T378	S372-T374 VanDerWaalsContact C-N 3.26Å; S372-T374 PolarHBondContact O-N 3.4Å; S372-T378 PolarHBondContact N-O 3.45Å; S372-T378 WeakPolarHBondContact OG-CB 3.38Å; S372-T378 PolarHBondContact OG-O 3.49Å
373	A	59.5	Low	79.2	Confident	73 Å²	73	46.1 Å²	46.1	60%	0.603	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-26.3	-179.4	0	0	0	0	0	113.2	V438 D439	A373-V438 PolarHBondContact N-O 2.95Å; A373-D439 HydrophobicContact CB-CB 4.31Å
374	T	50.6	Low	79.4	Confident	54 Å²	54	46.1 Å²	46.1	33%	0.331	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-30.1	-178.6	38.1	0	0	0	0	114.8	S372 S437 V438	S372-T374 VanDerWaalsContact C-N 3.26Å; S372-T374 PolarHBondContact O-N 3.4Å; T374-S437 PolarHBondContact OG1-O 2.82Å; T374-V438 PolarHBondContact N-O 2.96Å; T374-V438 PolarHBondContact OG1-O 3.27Å
375	D	53.8	Low	79.8	Confident	27 Å²	27	44.6 Å²	44.6	14%	0.144	22%	0.221	C	C	.	.			trans	-160.4	162.7	-174	66.2	57.8	0	0	0	114.5	Y377 T378	D375-Y377 VanDerWaalsContact C-N 3.35Å; D375-Y377 HydrophobicContact CB-CD1 3.68Å; D375-Y377 HydrophobicContact CB-CE1 3.38Å; D375-Y377 VanDerWaalsContact CG-CD1 3.44Å; D375-Y377 PolarHBondContact O-N 3.07Å; D375-Y377 VanDerWaalsContact OD1-CD1 3.31Å; D375-Y377 WeakPolarHBondContact OD1-CD1 3.48Å; D375-Y377 WeakPolarHBondContact OD1-CE1 3.35Å; D375-Y377 PolarHBondContact OD1-N 2.99Å; D375-Y377 WeakPolarHBondContact OD2-CE1 3.35Å; D375-Y377 PolarHBondContact OD2-OH 3.12Å; D375-T378 WeakPolarHBondContact OD1-CB 3.23Å; D375-T378 PolarHBondContact OD1-N 2.87Å; D375-T378 PolarHBondContact OD1-OG1 3.03Å; D375-T378 PolarHBondContact OD2-OG1 2.82Å; D375-T378 VanDerWaalsContact OD2-OG1 3.09Å
376	N	56	Low	80.1	Confident	126 Å²	126	38 Å²	38	67%	0.674	21%	0.205	S	C	*	.	S	Bend	trans	-93.4	27.9	-178.5	-62.8	-28.1	0	0	0	113.3	R71	R71-N376 PolarHBondContact NH1-O 3.16Å
377	Y	62	Low	80.2	Confident	132 Å²	132	39.1 Å²	39.1	52%	0.518	22%	0.216	S	C	.	.	S	Bend	trans	-137.1	-30.5	-179.5	70.1	-92.9	0	0	0	114.9	D375	D375-Y377 VanDerWaalsContact C-N 3.35Å; D375-Y377 HydrophobicContact CB-CD1 3.68Å; D375-Y377 HydrophobicContact CB-CE1 3.38Å; D375-Y377 VanDerWaalsContact CG-CD1 3.44Å; D375-Y377 PolarHBondContact O-N 3.07Å; D375-Y377 VanDerWaalsContact OD1-CD1 3.31Å; D375-Y377 WeakPolarHBondContact OD1-CD1 3.48Å; D375-Y377 WeakPolarHBondContact OD1-CE1 3.35Å; D375-Y377 PolarHBondContact OD1-N 2.99Å; D375-Y377 WeakPolarHBondContact OD2-CE1 3.35Å; D375-Y377 PolarHBondContact OD2-OH 3.12Å
378	T	68.5	Low	79.8	Confident	19 Å²	19	42.5 Å²	42.5	12%	0.117	24%	0.237	C	C	.	.			trans	-82.2	132	178.7	-45.9	0	0	0	0	110.5	Y371 S372 D375 I418	Y371-T378 WeakPolarHBondContact CA-O 3.1Å; S372-T378 PolarHBondContact N-O 3.45Å; S372-T378 WeakPolarHBondContact OG-CB 3.38Å; S372-T378 PolarHBondContact OG-O 3.49Å; D375-T378 WeakPolarHBondContact OD1-CB 3.23Å; D375-T378 PolarHBondContact OD1-N 2.87Å; D375-T378 PolarHBondContact OD1-OG1 3.03Å; D375-T378 PolarHBondContact OD2-OG1 2.82Å; D375-T378 VanDerWaalsContact OD2-OG1 3.09Å; T378-I418 HydrophobicContact CG2-CB 4.37Å; T378-I418 HydrophobicContact CG2-CG2 3.59Å
379	L	85.9	Confident	79.4	Confident	10 Å²	10	44.3 Å²	44.3	5%	0.052	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	139.7	-171.8	-64.2	156.7	0	0	0	111.8	F362 P364 F369 E370 Y371 F416 F417 I418	F362-L379 HydrophobicContact CB-CD1 3.79Å; F362-L379 HydrophobicContact CG-CD1 4.35Å; P364-L379 HydrophobicContact CG-CD2 4.25Å; F369-L379 HydrophobicContact CB-CD2 4.14Å; E370-L379 WeakPolarHBondContact O-CA 3.33Å; Y371-L379 HydrophobicContact CD1-CD2 4.07Å; Y371-L379 HydrophobicContact CE1-CD2 3.9Å; L379-F416 WeakPolarHBondContact CB-O 3.34Å; L379-F416 PolarHBondContact N-O 3.06Å; L379-F417 HydrophobicContact CB-CD1 3.83Å; L379-F417 HydrophobicContact CB-CE1 4.02Å; L379-F417 HydrophobicContact CD1-CE1 4.16Å; L379-F417 WeakPolarHBondContact O-CA 3.47Å; L379-I418 PolarHBondContact O-N 3.23Å
380	Q	89.3	Confident	79.2	Confident	10 Å²	10	53.2 Å²	53.2	5%	0.047	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	158.1	164.6	68.3	-177.4	1.2	0	0	110.1	F369 E370 N382 I418	F369-Q380 WeakPolarHBondContact CA-O 3.45Å; E370-Q380 HydrophobicContact CG-CG 3.55Å; E370-Q380 PolarHBondContact N-O 3.02Å; E370-Q380 PolarHBondContact O-N 3.37Å; E370-Q380 PolarHBondContact OE1-NE2 3.12Å; Q380-N382 PolarHBondContact O-N 2.79Å; Q380-I418 HydrophobicContact CB-CD1 3.6Å; Q380-I418 HydrophobicContact CB-CG1 3.9Å; Q380-I418 HydrophobicContact CB-CG2 4.26Å
381	I	95.3	Very high	79.3	Confident	10 Å²	10	55.3 Å²	55.3	5%	0.051	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	129.4	172.4	-67.3	177	0	0	0	108.1	F369 P383 F396 F421 V506 Q509 M510	F369-I381 HydrophobicContact CD1-CG1 4.38Å; F369-I381 HydrophobicContact CE1-CG1 3.97Å; I381-P383 WeakPolarHBondContact O-CD 3.46Å; I381-F396 HydrophobicContact CD1-CE1 4.29Å; I381-F396 HydrophobicContact CG1-CE1 4.06Å; I381-F396 HydrophobicContact CG2-CE1 4.13Å; I381-F396 HydrophobicContact CG2-CZ 3.76Å; I381-F421 HydrophobicContact CD1-CD2 4.23Å; I381-F421 HydrophobicContact CD1-CE2 3.99Å; I381-F421 HydrophobicContact CG1-CD2 4.21Å; I381-F421 HydrophobicContact CG1-CE2 4.08Å; I381-V506 HydrophobicContact CB-CB 4.14Å; I381-V506 HydrophobicContact CB-CG1 3.91Å; I381-V506 HydrophobicContact CG2-CB 3.87Å; I381-V506 HydrophobicContact CG2-CG1 3.68Å; I381-Q509 HydrophobicContact CD1-CB 4.14Å; I381-Q509 HydrophobicContact CG2-CB 3.69Å; I381-Q509 HydrophobicContact CG2-CG 3.83Å; I381-M510 HydrophobicContact CD1-CB 4.31Å; I381-M510 HydrophobicContact CD1-CE 4.1Å
382	N	93.3	Very high	80.1	Confident	16 Å²	16	53 Å²	53	9%	0.086	29%	0.293	C	S	.	.			trans	-69.3	117.6	171	177.8	2.3	0	0	0	109.1	G367 L368 E370 Q380 N384 S385	G367-N382 VanDerWaalsContact O-CB 3.31Å; G367-N382 WeakPolarHBondContact O-CB 3.5Å; G367-N382 PolarHBondContact O-ND2 3.49Å; L368-N382 WeakPolarHBondContact O-CB 3.43Å; L368-N382 PolarHBondContact O-N 3.23Å; E370-N382 HydrophobicContact CB-CB 4.36Å; E370-N382 HydrophobicContact CG-CB 4.32Å; E370-N382 PolarHBondContact OE2-OD1 2.96Å; Q380-N382 PolarHBondContact O-N 2.79Å; N382-N384 PolarHBondContact O-N 3.11Å; N382-N384 WeakPolarHBondContact OD1-CA 3.46Å; N382-N384 WeakPolarHBondContact OD1-CB 2.95Å; N382-N384 PolarHBondContact OD1-N 2.91Å; N382-S385 VanDerWaalsContact O-CB 3.25Å; N382-S385 WeakPolarHBondContact O-CB 3.42Å; N382-S385 PolarHBondContact O-N 2.78Å; N382-S385 VanDerWaalsContact O-N 3.16Å; N382-S385 PolarHBondContact O-OG 2.73Å
383	P	92.3	Very high	81.4	Confident	18 Å²	18	55.8 Å²	55.8	12%	0.117	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-37.9	176	-16.1	27.6	0	0	0	111.8	I381 S385 R505 V506 Q509	I381-P383 WeakPolarHBondContact O-CD 3.46Å; P383-S385 PolarHBondContact O-N 2.72Å; P383-R505 HydrophobicContact CB-CB 4.31Å; P383-R505 HydrophobicContact CB-CG 4.06Å; P383-R505 HydrophobicContact CG-CG 4.05Å; P383-V506 HydrophobicContact CB-CG1 4.31Å; P383-V506 HydrophobicContact CG-CG1 4.19Å; P383-Q509 PolarHBondContact O-NE2 2.89Å; P383-Q509 VanDerWaalsContact O-NE2 3.14Å
384	N	91.3	Very high	83.2	Confident	45 Å²	45	54 Å²	54	24%	0.241	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	10.9	-178.6	-68.3	-38.4	0	0	0	113.3	N382 G386 L387 C388 N467	N382-N384 PolarHBondContact O-N 3.11Å; N382-N384 WeakPolarHBondContact OD1-CA 3.46Å; N382-N384 WeakPolarHBondContact OD1-CB 2.95Å; N382-N384 PolarHBondContact OD1-N 2.91Å; N384-G386 PolarHBondContact O-N 3.03Å; N384-G386 VanDerWaalsContact O-N 3.12Å; N384-L387 HydrophobicContact CB-CD1 4.09Å; N384-L387 WeakPolarHBondContact O-CA 3.34Å; N384-L387 WeakPolarHBondContact O-CB 3.43Å; N384-L387 PolarHBondContact O-N 2.82Å; N384-C388 PolarHBondContact O-N 3.26Å; N384-N467 PolarHBondContact OD1-ND2 3Å
385	S	93.7	Very high	85.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-53.3	-33.3	177.5	43.4	0	0	0	0	114	G367 N382 P383 L387 C388 N389 H392 Q509	G367-S385 VanDerWaalsContact O-CA 3.3Å; G367-S385 WeakPolarHBondContact O-CA 3.22Å; G367-S385 VanDerWaalsContact O-CB 3.24Å; G367-S385 WeakPolarHBondContact O-CB 3.44Å; N382-S385 VanDerWaalsContact O-CB 3.25Å; N382-S385 WeakPolarHBondContact O-CB 3.42Å; N382-S385 PolarHBondContact O-N 2.78Å; N382-S385 VanDerWaalsContact O-N 3.16Å; N382-S385 PolarHBondContact O-OG 2.73Å; P383-S385 PolarHBondContact O-N 2.72Å; S385-L387 VanDerWaalsContact C-N 3.29Å; S385-L387 PolarHBondContact O-N 2.67Å; S385-C388 PolarHBondContact O-N 2.8Å; S385-N389 PolarHBondContact O-N 3.2Å; S385-H392 PolarHBondContact OG-ND1 2.83Å; S385-Q509 PolarHBondContact OG-NE2 3.26Å
386	G	90.1	Very high	87.5	Confident	31 Å²	31	51.7 Å²	51.7	32%	0.32	27%	0.274	S	S	.	.	H	α-helix	trans	-73.7	-14.4	175.9	0	0	0	0	0	115	N384 H392	N384-G386 PolarHBondContact O-N 3.03Å; N384-G386 VanDerWaalsContact O-N 3.12Å; G386-H392 VanDerWaalsContact CA-CD2 3.49Å; G386-H392 WeakPolarHBondContact CA-CD2 3.45Å; G386-H392 PolarHBondContact N-ND1 2.97Å
387	L	85.6	Confident	89.5	Confident	108 Å²	108	47.3 Å²	47.3	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-86.5	-27.3	171.8	-56.4	177.1	0	0	0	111.3	N384 S385 F468	N384-L387 HydrophobicContact CB-CD1 4.09Å; N384-L387 WeakPolarHBondContact O-CA 3.34Å; N384-L387 WeakPolarHBondContact O-CB 3.43Å; N384-L387 PolarHBondContact O-N 2.82Å; S385-L387 VanDerWaalsContact C-N 3.29Å; S385-L387 PolarHBondContact O-N 2.67Å; L387-F468 HydrophobicContact CB-CE2 4.45Å; L387-F468 HydrophobicContact CD1-CE2 3.86Å
388	C	81.7	Confident	91.2	Very high	78 Å²	78	41 Å²	41	53%	0.527	23%	0.225	S	C	.	.	H	α-helix	trans	-81.8	-30.4	174.3	-58.2	0	0	0	0	112.8	N384 S385	N384-C388 PolarHBondContact O-N 3.26Å; S385-C388 PolarHBondContact O-N 2.8Å
389	N	84.4	Confident	92.6	Very high	40 Å²	40	40.1 Å²	40.1	21%	0.214	22%	0.219	C	C	.	.			trans	-154.7	114.7	-170.7	-177	-13.8	0	0	0	111	S385 D391 H392 Y395	S385-N389 PolarHBondContact O-N 3.2Å; N389-D391 VanDerWaalsContact C-N 3.26Å; N389-D391 PolarHBondContact O-N 2.71Å; N389-D391 PolarHBondContact OD1-N 3.44Å; N389-H392 HydrophobicContact CB-CB 4.31Å; N389-H392 VanDerWaalsContact O-CB 3.26Å; N389-H392 WeakPolarHBondContact O-CB 3.5Å; N389-H392 PolarHBondContact O-N 2.92Å; N389-H392 VanDerWaalsContact O-N 3.11Å; N389-Y395 VanDerWaalsContact ND2-CD2 3.3Å; N389-Y395 WeakPolarHBondContact ND2-CD2 3.48Å; N389-Y395 WeakPolarHBondContact ND2-CE2 3.29Å
390	E	89.7	Confident	93.2	Very high	190 Å²	190	39.7 Å²	39.7	89%	0.888	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-34.6	179.9	-61.7	-173.5	166.9	0	0	112.3	H392	E390-H392 VanDerWaalsContact C-N 3.25Å; E390-H392 PolarHBondContact O-N 3.13Å
391	D	92.4	Very high	93.6	Very high	98 Å²	98	39.9 Å²	39.9	52%	0.524	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	8.1	179	-81.3	-39.5	0	0	0	113.3	N389 L393 S394 Y395	N389-D391 VanDerWaalsContact C-N 3.26Å; N389-D391 PolarHBondContact O-N 2.71Å; N389-D391 PolarHBondContact OD1-N 3.44Å; D391-L393 PolarHBondContact O-N 2.82Å; D391-S394 WeakPolarHBondContact O-CA 3.41Å; D391-S394 WeakPolarHBondContact O-CB 3.35Å; D391-S394 PolarHBondContact O-N 3.14Å; D391-Y395 HydrophobicContact CB-CD2 4.1Å; D391-Y395 HydrophobicContact CB-CE2 3.8Å; D391-Y395 WeakPolarHBondContact O-CD2 3.47Å; D391-Y395 PolarHBondContact O-N 2.72Å
392	H	95.5	Very high	93.8	Very high	21 Å²	21	39.4 Å²	39.4	10%	0.097	21%	0.214	C	C	.	.	H	α-helix	trans	-51	-37.8	-171.7	76	130.7	0	0	0	114.1	L368 S385 G386 N389 E390 S394 Y395 F396	L368-H392 HydrophobicContact CD2-CB 3.87Å; S385-H392 PolarHBondContact OG-ND1 2.83Å; G386-H392 VanDerWaalsContact CA-CD2 3.49Å; G386-H392 WeakPolarHBondContact CA-CD2 3.45Å; G386-H392 PolarHBondContact N-ND1 2.97Å; N389-H392 HydrophobicContact CB-CB 4.31Å; N389-H392 VanDerWaalsContact O-CB 3.26Å; N389-H392 WeakPolarHBondContact O-CB 3.5Å; N389-H392 PolarHBondContact O-N 2.92Å; N389-H392 VanDerWaalsContact O-N 3.11Å; E390-H392 VanDerWaalsContact C-N 3.25Å; E390-H392 PolarHBondContact O-N 3.13Å; H392-S394 VanDerWaalsContact C-N 3.34Å; H392-S394 PolarHBondContact O-N 3.39Å; H392-Y395 WeakPolarHBondContact O-CB 3.44Å; H392-Y395 PolarHBondContact O-N 3.45Å; H392-F396 HydrophobicContact CB-CE2 4.4Å; H392-F396 AromaticContact ND1-CE2 3.96Å; H392-F396 WeakPolarHBondContact O-CD2 3.38Å; H392-F396 PolarHBondContact O-N 3.29Å
393	L	97.8	Very high	94	Very high	65 Å²	65	38.7 Å²	38.7	34%	0.34	21%	0.211	S	C	.	.	H	α-helix	trans	-64.6	-36.3	177.2	-58.6	-175.3	0	0	0	112.6	D391 F396 K397 K508 Q509 A512	D391-L393 PolarHBondContact O-N 2.82Å; L393-F396 PolarHBondContact O-N 3.48Å; L393-K397 PolarHBondContact O-N 2.85Å; L393-K508 HydrophobicContact CD2-CB 3.9Å; L393-Q509 HydrophobicContact CD2-CG 4.34Å; L393-A512 HydrophobicContact CB-CB 4.28Å; L393-A512 WeakPolarHBondContact O-CB 3.05Å
394	S	97.2	Very high	94.2	Very high	37 Å²	37	37.8 Å²	37.8	26%	0.259	21%	0.205	S	C	.	.	H	α-helix	trans	-66.7	-39.5	174.3	-170.3	0	0	0	0	111	Y318 M322 D391 H392 K397 F398	Y318-S394 WeakPolarHBondContact OH-CB 3.09Å; Y318-S394 PolarHBondContact OH-OG 3.29Å; M322-S394 WeakPolarHBondContact CE-O 3.39Å; D391-S394 WeakPolarHBondContact O-CA 3.41Å; D391-S394 WeakPolarHBondContact O-CB 3.35Å; D391-S394 PolarHBondContact O-N 3.14Å; H392-S394 VanDerWaalsContact C-N 3.34Å; H392-S394 PolarHBondContact O-N 3.39Å; S394-K397 PolarHBondContact O-N 3.07Å; S394-F398 WeakPolarHBondContact O-CB 3.29Å; S394-F398 PolarHBondContact O-N 2.92Å
395	Y	97.1	Very high	94.4	Very high	30 Å²	30	35.7 Å²	35.7	12%	0.118	19%	0.194	C	C	.	.	H	α-helix	trans	-63.6	-43.4	171.6	-70.6	-76.6	0	0	0	112.2	F314 Y318 L368 N389 D391 H392 K397 F398 I399	F314-Y395 AromaticContact CE1-CD1 3.81Å; F314-Y395 HydrophobicContact CE1-CD1 3.81Å; F314-Y395 AromaticContact CE1-CE1 3.57Å; F314-Y395 HydrophobicContact CE1-CE1 3.57Å; F314-Y395 AromaticContact CZ-CD1 3.62Å; F314-Y395 HydrophobicContact CZ-CD1 3.62Å; F314-Y395 AromaticContact CZ-CE1 3.91Å; F314-Y395 HydrophobicContact CZ-CE1 3.91Å; Y318-Y395 HydrophobicContact CD1-CE1 4.24Å; Y318-Y395 AromaticContact CD2-CD1 3.87Å; Y318-Y395 HydrophobicContact CD2-CD1 3.87Å; Y318-Y395 AromaticContact CD2-CE1 3.9Å; Y318-Y395 HydrophobicContact CD2-CE1 3.9Å; Y318-Y395 HydrophobicContact CE1-CE1 4.3Å; Y318-Y395 AromaticContact CE2-CD1 3.89Å; Y318-Y395 HydrophobicContact CE2-CD1 3.89Å; Y318-Y395 AromaticContact CE2-CE1 3.97Å; Y318-Y395 HydrophobicContact CE2-CE1 3.97Å; Y318-Y395 HydrophobicContact CE2-CG 4.36Å; Y318-Y395 HydrophobicContact CG-CD1 4.46Å; Y318-Y395 HydrophobicContact CG-CE1 4.05Å; L368-Y395 HydrophobicContact CD1-CG 4.35Å; N389-Y395 VanDerWaalsContact ND2-CD2 3.3Å; N389-Y395 WeakPolarHBondContact ND2-CD2 3.48Å; N389-Y395 WeakPolarHBondContact ND2-CE2 3.29Å; D391-Y395 HydrophobicContact CB-CD2 4.1Å; D391-Y395 HydrophobicContact CB-CE2 3.8Å; D391-Y395 WeakPolarHBondContact O-CD2 3.47Å; D391-Y395 PolarHBondContact O-N 2.72Å; H392-Y395 WeakPolarHBondContact O-CB 3.44Å; H392-Y395 PolarHBondContact O-N 3.45Å; Y395-K397 VanDerWaalsContact C-N 3.32Å; Y395-K397 PolarHBondContact O-N 2.68Å; Y395-F398 WeakPolarHBondContact O-CB 3.43Å; Y395-F398 PolarHBondContact O-N 3.36Å; Y395-F398 VanDerWaalsContact O-N 3.16Å; Y395-I399 VanDerWaalsContact O-CG1 3.23Å; Y395-I399 WeakPolarHBondContact O-CG1 3.4Å; Y395-I399 PolarHBondContact O-N 2.98Å
396	F	98.4	Very high	94.5	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-59.7	-41.7	173.5	-79	-68	0	0	0	112.3	L368 F369 I381 H392 L393 I399 G400 Q509 A512 F513	L368-F396 HydrophobicContact CB-CZ 4.09Å; L368-F396 HydrophobicContact CD2-CE2 4.05Å; L368-F396 HydrophobicContact CD2-CZ 4.37Å; L368-F396 WeakPolarHBondContact O-CZ 3.37Å; F369-F396 HydrophobicContact CE1-CE1 4.25Å; F369-F396 HydrophobicContact CE2-CE1 4.16Å; F369-F396 HydrophobicContact CZ-CD1 4.45Å; F369-F396 AromaticContact CZ-CE1 3.82Å; F369-F396 HydrophobicContact CZ-CE1 3.82Å; I381-F396 HydrophobicContact CD1-CE1 4.29Å; I381-F396 HydrophobicContact CG1-CE1 4.06Å; I381-F396 HydrophobicContact CG2-CE1 4.13Å; I381-F396 HydrophobicContact CG2-CZ 3.76Å; H392-F396 HydrophobicContact CB-CE2 4.4Å; H392-F396 AromaticContact ND1-CE2 3.96Å; H392-F396 WeakPolarHBondContact O-CD2 3.38Å; H392-F396 PolarHBondContact O-N 3.29Å; L393-F396 PolarHBondContact O-N 3.48Å; F396-I399 PolarHBondContact O-N 2.89Å; F396-G400 PolarHBondContact O-N 3.11Å; F396-Q509 HydrophobicContact CD1-CB 4.26Å; F396-Q509 HydrophobicContact CD2-CB 3.62Å; F396-Q509 HydrophobicContact CD2-CG 3.68Å; F396-Q509 HydrophobicContact CE1-CB 4.24Å; F396-Q509 HydrophobicContact CE2-CB 3.61Å; F396-Q509 HydrophobicContact CE2-CG 3.35Å; F396-Q509 HydrophobicContact CG-CB 3.98Å; F396-Q509 HydrophobicContact CZ-CB 3.93Å; F396-Q509 HydrophobicContact CZ-CG 3.95Å; F396-A512 HydrophobicContact CB-CB 3.96Å; F396-F513 HydrophobicContact CB-CB 4.39Å; F396-F513 WeakPolarHBondContact O-CA 3.43Å
397	K	98.4	Very high	94.7	Very high	35 Å²	35	34.4 Å²	34.4	15%	0.152	18%	0.18	C	C	.	.	H	α-helix	trans	-63.6	-39.8	174.2	-177	169.1	179.8	171.5	0	112.7	M322 L393 S394 Y395 G400 R401 A512 E515 G516 E519	M322-K397 HydrophobicContact CE-CB 4.16Å; M322-K397 HydrophobicContact CE-CD 4.36Å; M322-K397 HydrophobicContact CE-CG 4.11Å; L393-K397 PolarHBondContact O-N 2.85Å; S394-K397 PolarHBondContact O-N 3.07Å; Y395-K397 VanDerWaalsContact C-N 3.32Å; Y395-K397 PolarHBondContact O-N 2.68Å; K397-G400 PolarHBondContact O-N 3.05Å; K397-R401 PolarHBondContact O-N 2.86Å; K397-A512 VanDerWaalsContact CA-O 3.25Å; K397-A512 WeakPolarHBondContact CA-O 3.24Å; K397-A512 HydrophobicContact CB-CB 4.41Å; K397-E515 HydrophobicContact CD-CG 4.37Å; K397-E515 IonicContact NZ-OE1 2.76Å; K397-E515 PolarHBondContact NZ-OE1 3.31Å; K397-G516 WeakPolarHBondContact O-CA 3.42Å; K397-E519 WeakPolarHBondContact CE-OE1 3.16Å; K397-E519 IonicContact NZ-OE1 3.17Å; K397-E519 PolarHBondContact NZ-OE1 2.86Å
398	F	98.2	Very high	95.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.2	-49.8	172.3	163.1	-113.2	0	0	0	112	F314 Y318 I321 M322 L357 M361 S394 Y395 G400 R401 V402	F314-F398 HydrophobicContact CD2-CE1 4.22Å; F314-F398 HydrophobicContact CE2-CD1 4.48Å; F314-F398 AromaticContact CE2-CE1 3.93Å; F314-F398 HydrophobicContact CE2-CE1 3.93Å; Y318-F398 VanDerWaalsContact CA-CE2 3.46Å; Y318-F398 HydrophobicContact CD2-CB 3.64Å; Y318-F398 AromaticContact CD2-CD1 3.87Å; Y318-F398 HydrophobicContact CD2-CD1 3.87Å; Y318-F398 HydrophobicContact CD2-CD2 4.1Å; Y318-F398 AromaticContact CD2-CG 3.61Å; Y318-F398 HydrophobicContact CD2-CG 3.61Å; Y318-F398 HydrophobicContact CE2-CB 3.95Å; Y318-F398 HydrophobicContact CE2-CG 4.42Å; I321-F398 HydrophobicContact CB-CD2 4.14Å; I321-F398 HydrophobicContact CB-CE2 4.05Å; I321-F398 HydrophobicContact CD1-CE2 3.95Å; I321-F398 HydrophobicContact CG2-CD2 4.01Å; I321-F398 HydrophobicContact CG2-CE2 4.28Å; M322-F398 HydrophobicContact CE-CB 4.42Å; M322-F398 HydrophobicContact CG-CB 3.9Å; M322-F398 HydrophobicContact CG-CD2 4.2Å; M322-F398 HydrophobicContact CG-CG 4.43Å; M322-F398 HydrophobicContact SD-CB 3.73Å; L357-F398 HydrophobicContact CD1-CE1 4.41Å; L357-F398 HydrophobicContact CD1-CZ 4.14Å; L357-F398 HydrophobicContact CD2-CZ 4.01Å; M361-F398 HydrophobicContact CG-CE1 4.25Å; M361-F398 HydrophobicContact SD-CE1 4.31Å; S394-F398 WeakPolarHBondContact O-CB 3.29Å; S394-F398 PolarHBondContact O-N 2.92Å; Y395-F398 WeakPolarHBondContact O-CB 3.43Å; Y395-F398 PolarHBondContact O-N 3.36Å; Y395-F398 VanDerWaalsContact O-N 3.16Å; F398-G400 VanDerWaalsContact C-N 3.26Å; F398-G400 PolarHBondContact O-N 3.17Å; F398-R401 WeakPolarHBondContact O-CA 3.07Å; F398-R401 WeakPolarHBondContact O-CB 3.31Å; F398-R401 PolarHBondContact O-N 3.06Å; F398-V402 HydrophobicContact CD2-CG2 4.05Å; F398-V402 HydrophobicContact CE1-CG2 4.39Å; F398-V402 HydrophobicContact CE2-CG2 3.59Å; F398-V402 HydrophobicContact CZ-CG2 3.8Å; F398-V402 WeakPolarHBondContact O-CG2 3.21Å; F398-V402 PolarHBondContact O-N 3.47Å
399	I	98	Very high	95.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.8	-38.3	178.6	-64.4	173.5	0	0	0	110.3	M361 F362 L368 F369 Y395 F396 V402 A403 F513	M361-I399 HydrophobicContact CB-CD1 4.11Å; M361-I399 HydrophobicContact CB-CG1 4.13Å; M361-I399 HydrophobicContact CG-CD1 4.34Å; M361-I399 HydrophobicContact CG-CG1 3.87Å; M361-I399 HydrophobicContact SD-CB 4.18Å; M361-I399 HydrophobicContact SD-CG1 3.79Å; M361-I399 HydrophobicContact SD-CG2 4.07Å; F362-I399 HydrophobicContact CE1-CG2 3.77Å; F362-I399 HydrophobicContact CZ-CG2 4.47Å; L368-I399 HydrophobicContact CD1-CD1 3.83Å; F369-I399 HydrophobicContact CE2-CD1 3.91Å; Y395-I399 VanDerWaalsContact O-CG1 3.23Å; Y395-I399 WeakPolarHBondContact O-CG1 3.4Å; Y395-I399 PolarHBondContact O-N 2.98Å; F396-I399 PolarHBondContact O-N 2.89Å; I399-V402 PolarHBondContact O-N 2.82Å; I399-A403 WeakPolarHBondContact O-CB 3.38Å; I399-A403 PolarHBondContact O-N 2.75Å; I399-F513 HydrophobicContact CB-CD2 4.48Å; I399-F513 HydrophobicContact CG2-CD2 4.1Å; I399-F513 HydrophobicContact CG2-CE2 4.02Å
400	G	98.1	Very high	95.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-56.2	-48.4	170	0	0	0	0	0	112.9	F396 K397 F398 A403 G404 F513 G516 F517	F396-G400 PolarHBondContact O-N 3.11Å; K397-G400 PolarHBondContact O-N 3.05Å; F398-G400 VanDerWaalsContact C-N 3.26Å; F398-G400 PolarHBondContact O-N 3.17Å; G400-A403 PolarHBondContact O-N 3.29Å; G400-G404 PolarHBondContact O-N 3.24Å; G400-F513 VanDerWaalsContact CA-O 3.25Å; G400-F513 WeakPolarHBondContact CA-O 2.91Å; G400-G516 VanDerWaalsContact C-C 3.41Å; G400-F517 VanDerWaalsContact O-CA 3.24Å; G400-F517 WeakPolarHBondContact O-CA 3.43Å; G400-F517 PolarHBondContact O-N 2.94Å
401	R	98.3	Very high	95.7	Very high	14 Å²	14	20.1 Å²	20.1	5%	0.053	11%	0.108	C	C	.	.	H	α-helix	trans	-59.5	-46.4	173.9	-73.7	-179.7	172.3	175.4	5.4	111.5	I321 L330 K397 F398 A403 G404 M405 G516 E519 L520	I321-R401 HydrophobicContact CG2-CB 3.99Å; I321-R401 PolarHBondContact O-NH1 2.97Å; L330-R401 HydrophobicContact CD1-CB 4.44Å; K397-R401 PolarHBondContact O-N 2.86Å; F398-R401 WeakPolarHBondContact O-CA 3.07Å; F398-R401 WeakPolarHBondContact O-CB 3.31Å; F398-R401 PolarHBondContact O-N 3.06Å; R401-A403 PolarHBondContact O-N 2.88Å; R401-G404 PolarHBondContact O-N 3.5Å; R401-M405 VanDerWaalsContact O-CG 3.26Å; R401-M405 WeakPolarHBondContact O-CG 3.46Å; R401-M405 PolarHBondContact O-N 3.26Å; R401-G516 WeakPolarHBondContact CA-O 3.38Å; R401-E519 IonicContact CZ-OE1 2.81Å; R401-E519 IonicContact CZ-OE2 3.97Å; R401-E519 IonicContact NE-OE2 3.71Å; R401-E519 PolarHBondContact NE-OE2 3.4Å; R401-E519 VanDerWaalsContact NH2-CD 3.35Å; R401-E519 IonicContact NH2-OE1 2.7Å; R401-E519 PolarHBondContact NH2-OE1 2.76Å; R401-E519 IonicContact NH2-OE2 3.01Å; R401-E519 PolarHBondContact NH2-OE2 3.45Å; R401-L520 VanDerWaalsContact O-CD1 3.3Å; R401-L520 WeakPolarHBondContact O-CD1 3.42Å
402	V	98	Very high	95.5	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.2	-41.3	179.8	178.8	0	0	0	0	111	I321 W353 F354 L357 M361 F398 I399 M405 A406 L413	I321-V402 HydrophobicContact CD1-CG2 4.12Å; W353-V402 HydrophobicContact CH2-CG1 4.36Å; F354-V402 HydrophobicContact CD1-CG1 4.02Å; F354-V402 HydrophobicContact CE1-CG1 4Å; F354-V402 WeakPolarHBondContact CE1-O 3.46Å; L357-V402 HydrophobicContact CD2-CG1 3.94Å; L357-V402 HydrophobicContact CD2-CG2 3.92Å; M361-V402 HydrophobicContact CE-CB 4.2Å; M361-V402 HydrophobicContact CE-CG1 3.6Å; M361-V402 HydrophobicContact SD-CB 3.79Å; M361-V402 HydrophobicContact SD-CG1 3.78Å; M361-V402 HydrophobicContact SD-CG2 4.02Å; F398-V402 HydrophobicContact CD2-CG2 4.05Å; F398-V402 HydrophobicContact CE1-CG2 4.39Å; F398-V402 HydrophobicContact CE2-CG2 3.59Å; F398-V402 HydrophobicContact CZ-CG2 3.8Å; F398-V402 WeakPolarHBondContact O-CG2 3.21Å; F398-V402 PolarHBondContact O-N 3.47Å; I399-V402 PolarHBondContact O-N 2.82Å; V402-M405 WeakPolarHBondContact O-CB 3.35Å; V402-M405 PolarHBondContact O-N 2.94Å; V402-A406 WeakPolarHBondContact O-CB 3.37Å; V402-A406 PolarHBondContact O-N 3.36Å; V402-L413 HydrophobicContact CG1-CD2 4.38Å
403	A	97.6	Very high	95.3	Very high	1 Å²	1	16 Å²	16	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-63.4	-42	173.1	0	0	0	0	0	112.7	I399 G400 R401 M405 A406 V407 L413 F513 F517 M538	I399-A403 WeakPolarHBondContact O-CB 3.38Å; I399-A403 PolarHBondContact O-N 2.75Å; G400-A403 PolarHBondContact O-N 3.29Å; R401-A403 PolarHBondContact O-N 2.88Å; A403-M405 VanDerWaalsContact C-N 3.32Å; A403-M405 PolarHBondContact O-N 3.4Å; A403-A406 PolarHBondContact O-N 3.25Å; A403-V407 WeakPolarHBondContact O-CG2 3.15Å; A403-V407 PolarHBondContact O-N 3.07Å; A403-L413 HydrophobicContact CB-CD1 4.01Å; A403-F513 HydrophobicContact CB-CE2 3.98Å; A403-F513 HydrophobicContact CB-CZ 3.92Å; A403-F517 HydrophobicContact CB-CD2 3.84Å; A403-F517 HydrophobicContact CB-CE2 4.18Å; A403-M538 HydrophobicContact CB-CE 4.13Å
404	G	97	Very high	94.8	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.8	-37.9	172.7	0	0	0	0	0	112.7	G400 R401 F408	G400-G404 PolarHBondContact O-N 3.24Å; R401-G404 PolarHBondContact O-N 3.5Å; G404-F408 VanDerWaalsContact O-CB 3.25Å; G404-F408 WeakPolarHBondContact O-CB 3.49Å; G404-F408 PolarHBondContact O-N 3.39Å
405	M	96.2	Very high	94.1	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-65.7	-45.2	173.3	-68.6	168.9	65.7	0	0	111.6	I321 L330 L334 W353 F354 R401 V402 A403 F408 H409 L520	I321-M405 HydrophobicContact CD1-CE 4.18Å; I321-M405 HydrophobicContact CD1-SD 3.81Å; I321-M405 HydrophobicContact CG1-SD 4.48Å; L330-M405 HydrophobicContact CB-CG 3.94Å; L330-M405 HydrophobicContact CB-SD 4.14Å; L330-M405 HydrophobicContact CD1-CG 4.31Å; L330-M405 HydrophobicContact CD1-SD 3.97Å; L330-M405 HydrophobicContact CD2-CE 4.08Å; L330-M405 HydrophobicContact CD2-SD 3.83Å; L330-M405 HydrophobicContact CG-SD 4.19Å; L334-M405 HydrophobicContact CD1-CE 3.97Å; L334-M405 HydrophobicContact CD2-CE 3.7Å; W353-M405 HydrophobicContact CH2-CE 3.67Å; W353-M405 HydrophobicContact CH2-SD 4.32Å; W353-M405 HydrophobicContact CZ3-CE 3.86Å; F354-M405 HydrophobicContact CE1-CB 3.97Å; F354-M405 HydrophobicContact CZ-CB 3.77Å; R401-M405 VanDerWaalsContact O-CG 3.26Å; R401-M405 WeakPolarHBondContact O-CG 3.46Å; R401-M405 PolarHBondContact O-N 3.26Å; V402-M405 WeakPolarHBondContact O-CB 3.35Å; V402-M405 PolarHBondContact O-N 2.94Å; A403-M405 VanDerWaalsContact C-N 3.32Å; A403-M405 PolarHBondContact O-N 3.4Å; M405-F408 PolarHBondContact O-N 3.16Å; M405-H409 WeakPolarHBondContact O-CB 3.47Å; M405-H409 PolarHBondContact O-CD2 3.2Å; M405-H409 PolarHBondContact O-N 2.95Å; M405-L520 HydrophobicContact CB-CD1 4.34Å; M405-L520 HydrophobicContact CG-CD1 3.49Å; M405-L520 VanDerWaalsContact CG-CD1 3.49Å
406	A	94.4	Very high	93.4	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-57.6	-53.4	-179.9	0	0	0	0	0	110.3	F354 V402 A403 F408 H409 G410 K411 L413	F354-A406 HydrophobicContact CD1-CB 3.92Å; F354-A406 HydrophobicContact CE1-CB 3.61Å; F354-A406 HydrophobicContact CZ-CB 4.19Å; V402-A406 WeakPolarHBondContact O-CB 3.37Å; V402-A406 PolarHBondContact O-N 3.36Å; A403-A406 PolarHBondContact O-N 3.25Å; A406-F408 PolarHBondContact O-N 3.48Å; A406-H409 PolarHBondContact O-N 2.95Å; A406-G410 WeakPolarHBondContact O-CA 3.49Å; A406-G410 PolarHBondContact O-N 3.45Å; A406-K411 CarbonylContact C-O 3.52Å; A406-K411 WeakPolarHBondContact CB-O 3.23Å; A406-K411 PolarHBondContact O-N 3.36Å; A406-L413 HydrophobicContact CB-CD1 4.4Å; A406-L413 HydrophobicContact CB-CD2 3.86Å; A406-L413 HydrophobicContact CB-CG 3.91Å
407	V	94.4	Very high	92.8	Very high	3 Å²	3	15.8 Å²	15.8	2%	0.018	8%	0.081	C	C	.	.	H	α-helix	trans	-60.8	-42.4	176.9	174	0	0	0	0	112	F290 A403 G410 F517 I521 L537 M538	F290-V407 HydrophobicContact CE1-CG1 3.65Å; F290-V407 HydrophobicContact CZ-CG1 3.44Å; F290-V407 VanDerWaalsContact CZ-CG1 3.44Å; A403-V407 WeakPolarHBondContact O-CG2 3.15Å; A403-V407 PolarHBondContact O-N 3.07Å; V407-G410 PolarHBondContact O-N 3.34Å; V407-F517 HydrophobicContact CG2-CE2 4.09Å; V407-F517 HydrophobicContact CG2-CZ 4.26Å; V407-I521 HydrophobicContact CB-CD1 4.34Å; V407-I521 HydrophobicContact CB-CG1 4.28Å; V407-I521 HydrophobicContact CG1-CD1 3.99Å; V407-I521 HydrophobicContact CG1-CG1 4.12Å; V407-L537 HydrophobicContact CG1-CD1 4.46Å; V407-L537 HydrophobicContact CG1-CD2 4.02Å; V407-L537 HydrophobicContact CG1-CG 4.12Å; V407-L537 HydrophobicContact CG2-CG 4.41Å; V407-M538 HydrophobicContact CG2-CG 3.62Å
408	F	94.3	Very high	92.1	Very high	21 Å²	21	14.7 Å²	14.7	9%	0.092	8%	0.077	C	C	.	.	H	α-helix	trans	-63.2	-46.3	179.5	-173.7	-91.3	0	0	0	112.1	R291 L294 K296 K331 G404 M405 A406 I521	R291-F408 PolarHBondContact NH1-O 3.5Å; L294-F408 HydrophobicContact CB-CD2 4.36Å; L294-F408 HydrophobicContact CB-CE2 4.18Å; L294-F408 HydrophobicContact CD1-CD2 4.12Å; L294-F408 HydrophobicContact CD2-CD2 4.29Å; K296-F408 HydrophobicContact CB-CZ 4.41Å; K331-F408 HydrophobicContact CB-CD1 4.21Å; K331-F408 HydrophobicContact CB-CE1 3.64Å; K331-F408 HydrophobicContact CB-CE2 4.21Å; K331-F408 HydrophobicContact CB-CZ 3.65Å; K331-F408 HydrophobicContact CD-CD2 4.47Å; K331-F408 HydrophobicContact CD-CE2 4.03Å; K331-F408 HydrophobicContact CD-CZ 4.29Å; K331-F408 HydrophobicContact CG-CD1 4.26Å; K331-F408 HydrophobicContact CG-CD2 4.11Å; K331-F408 HydrophobicContact CG-CE1 4.05Å; K331-F408 HydrophobicContact CG-CE2 3.89Å; K331-F408 HydrophobicContact CG-CG 4.29Å; K331-F408 HydrophobicContact CG-CZ 3.87Å; G404-F408 VanDerWaalsContact O-CB 3.25Å; G404-F408 WeakPolarHBondContact O-CB 3.49Å; G404-F408 PolarHBondContact O-N 3.39Å; M405-F408 PolarHBondContact O-N 3.16Å; A406-F408 PolarHBondContact O-N 3.48Å; F408-I521 HydrophobicContact CB-CD1 3.83Å; F408-I521 HydrophobicContact CD2-CD1 4.2Å
409	H	91.1	Very high	91.1	Very high	44 Å²	44	19.2 Å²	19.2	20%	0.204	9%	0.094	C	C	.	.	H	α-helix	trans	-84.5	-9.1	-176.3	-68.4	-64.1	0	0	0	113.6	L330 A332 M405 A406 K411	L330-H409 PolarHBondContact O-NE2 3.3Å; A332-H409 PolarHBondContact O-CE1 2.89Å; M405-H409 WeakPolarHBondContact O-CB 3.47Å; M405-H409 PolarHBondContact O-CD2 3.2Å; M405-H409 PolarHBondContact O-N 2.95Å; A406-H409 PolarHBondContact O-N 2.95Å; H409-K411 HydrophobicContact CB-CG 4.08Å
410	G	88.4	Confident	90.6	Very high	27 Å²	27	19.2 Å²	19.2	28%	0.278	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	39.7	-175.1	0	0	0	0	0	113.2	A406 V407	A406-G410 WeakPolarHBondContact O-CA 3.49Å; A406-G410 PolarHBondContact O-N 3.45Å; V407-G410 PolarHBondContact O-N 3.34Å
411	K	89.3	Confident	90.4	Very high	25 Å²	25	19.6 Å²	19.6	11%	0.109	10%	0.096	C	C	.	.			trans	-108.4	153.5	172.6	-50.1	-49.1	-151.7	174.2	0	108.1	R351 F354 A406 H409	R351-K411 HydrophobicContact CG-CD 3.91Å; R351-K411 VanDerWaalsContact CG-NZ 3.29Å; F354-K411 HydrophobicContact CB-CB 4.49Å; F354-K411 HydrophobicContact CD2-CB 3.38Å; F354-K411 HydrophobicContact CD2-CG 3.52Å; F354-K411 HydrophobicContact CE2-CB 3.61Å; F354-K411 HydrophobicContact CE2-CG 3.45Å; F354-K411 VanDerWaalsContact CE2-CG 3.45Å; F354-K411 HydrophobicContact CG-CB 3.97Å; F354-K411 HydrophobicContact CZ-CB 4.34Å; F354-K411 HydrophobicContact CZ-CG 4.42Å; A406-K411 CarbonylContact C-O 3.52Å; A406-K411 WeakPolarHBondContact CB-O 3.23Å; A406-K411 PolarHBondContact O-N 3.36Å; H409-K411 HydrophobicContact CB-CG 4.08Å
412	L	88.2	Confident	90.1	Very high	31 Å²	31	19 Å²	19	16%	0.162	9%	0.093	C	C	.	.			trans	-108.2	144.8	-175.1	-58.9	175.1	0	0	0	109.5	M538 R593	L412-M538 WeakPolarHBondContact CA-O 3.47Å; L412-R593 HydrophobicContact CB-CB 3.99Å; L412-R593 HydrophobicContact CB-CG 4.21Å; L412-R593 HydrophobicContact CD1-CB 3.54Å; L412-R593 HydrophobicContact CG-CB 4.39Å
413	L	91.1	Very high	89.8	Confident	1 Å²	1	19.8 Å²	19.8	1%	0.005	10%	0.097	C	C	.	.			trans	-96.9	143	173.6	-59.1	179.8	0	0	0	110.6	F354 M361 F362 V402 A403 A406 G415 M538 C539	F354-L413 HydrophobicContact CB-CD2 4.48Å; F354-L413 HydrophobicContact CD1-CD2 3.82Å; M361-L413 HydrophobicContact CE-CD2 4.21Å; F362-L413 HydrophobicContact CE2-CB 4.17Å; F362-L413 HydrophobicContact CE2-CD1 4.43Å; F362-L413 HydrophobicContact CZ-CD1 4.08Å; V402-L413 HydrophobicContact CG1-CD2 4.38Å; A403-L413 HydrophobicContact CB-CD1 4.01Å; A406-L413 HydrophobicContact CB-CD1 4.4Å; A406-L413 HydrophobicContact CB-CD2 3.86Å; A406-L413 HydrophobicContact CB-CG 3.91Å; L413-G415 VanDerWaalsContact C-N 3.31Å; L413-G415 PolarHBondContact O-N 2.89Å; L413-G415 VanDerWaalsContact O-N 3.11Å; L413-M538 PolarHBondContact N-O 3.44Å; L413-C539 WeakPolarHBondContact O-CA 3.39Å
414	D	87.1	Confident	89.7	Confident	42 Å²	42	21 Å²	21	23%	0.225	10%	0.103	C	C	.	.	S	Bend	trans	-85.3	72.6	175.3	-156.6	43.1	0	0	0	109.8	F355 S358 K359 S592	F355-D414 HydrophobicContact CD2-CB 3.85Å; F355-D414 HydrophobicContact CE2-CB 4.13Å; F355-D414 WeakPolarHBondContact CE2-OD2 3.21Å; S358-D414 VanDerWaalsContact OG-CB 3.29Å; S358-D414 WeakPolarHBondContact OG-CB 3.26Å; S358-D414 PolarHBondContact OG-N 2.97Å; K359-D414 WeakPolarHBondContact CE-OD2 3.14Å; D414-S592 PolarHBondContact OD1-OG 3.09Å
415	G	83.4	Confident	89.7	Confident	3 Å²	3	21.1 Å²	21.1	3%	0.031	10%	0.104	C	C	.	.			trans	-147.2	146.4	179.2	0	0	0	0	0	112.4	L413 C539	L413-G415 VanDerWaalsContact C-N 3.31Å; L413-G415 PolarHBondContact O-N 2.89Å; L413-G415 VanDerWaalsContact O-N 3.11Å; G415-C539 WeakPolarHBondContact O-CB 3.27Å; G415-C539 PolarHBondContact O-SG 3.32Å
416	F	81.6	Confident	89.6	Confident	75 Å²	75	21.6 Å²	21.6	33%	0.329	11%	0.106	S	C	.	.			trans	-124.9	113.8	173.4	-69	-86.6	0	0	0	108.1	L379	L379-F416 WeakPolarHBondContact CB-O 3.34Å; L379-F416 PolarHBondContact N-O 3.06Å
417	F	86.5	Confident	89.5	Confident	8 Å²	8	24.8 Å²	24.8	4%	0.035	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-106.6	149.9	-177.8	-60.2	-75	0	0	0	111.6	F362 F369 L379 R419 F421 Y422	F362-F417 HydrophobicContact CD1-CE1 4.23Å; F362-F417 AromaticContact CD1-CZ 3.78Å; F362-F417 HydrophobicContact CD1-CZ 3.78Å; F362-F417 HydrophobicContact CD2-CZ 4.07Å; F362-F417 HydrophobicContact CE1-CE1 4.34Å; F362-F417 AromaticContact CE1-CZ 3.57Å; F362-F417 HydrophobicContact CE1-CZ 3.57Å; F362-F417 HydrophobicContact CE2-CE2 4.25Å; F362-F417 AromaticContact CE2-CZ 3.83Å; F362-F417 HydrophobicContact CE2-CZ 3.83Å; F362-F417 HydrophobicContact CG-CZ 4.06Å; F362-F417 HydrophobicContact CZ-CE2 4.14Å; F362-F417 AromaticContact CZ-CZ 3.59Å; F362-F417 HydrophobicContact CZ-CZ 3.59Å; F369-F417 HydrophobicContact CD1-CD1 4.48Å; F369-F417 AromaticContact CD1-CE1 3.96Å; F369-F417 HydrophobicContact CD1-CE1 3.96Å; F369-F417 HydrophobicContact CE1-CD1 4.25Å; F369-F417 AromaticContact CE1-CE1 3.62Å; F369-F417 HydrophobicContact CE1-CE1 3.62Å; F369-F417 HydrophobicContact CZ-CE1 4.2Å; L379-F417 HydrophobicContact CB-CD1 3.83Å; L379-F417 HydrophobicContact CB-CE1 4.02Å; L379-F417 HydrophobicContact CD1-CE1 4.16Å; L379-F417 WeakPolarHBondContact O-CA 3.47Å; F417-R419 PolarHBondContact O-N 2.99Å; F417-F421 HydrophobicContact CB-CB 3.89Å; F417-F421 HydrophobicContact CB-CD1 3.88Å; F417-F421 HydrophobicContact CB-CG 3.9Å; F417-F421 HydrophobicContact CD1-CD2 4.41Å; F417-F421 HydrophobicContact CD1-CE2 4.49Å; F417-F421 HydrophobicContact CD1-CG 4.44Å; F417-F421 HydrophobicContact CD2-CD1 4.24Å; F417-F421 HydrophobicContact CD2-CE1 4.2Å; F417-F421 AromaticContact CG-CD1 3.95Å; F417-F421 HydrophobicContact CG-CD1 3.95Å; F417-F421 HydrophobicContact CG-CE1 4.21Å; F417-F421 HydrophobicContact CG-CG 4.16Å; F417-Y422 HydrophobicContact CB-CE1 4.44Å; F417-Y422 HydrophobicContact CB-CE2 4.04Å; F417-Y422 HydrophobicContact CD2-CE1 4.21Å; F417-Y422 WeakPolarHBondContact O-CE2 3.35Å
418	I	82.6	Confident	89.4	Confident	12 Å²	12	28.5 Å²	28.5	6%	0.062	16%	0.155	C	C	.	.			trans	-56.5	140.1	171.8	61.9	163.7	0	0	0	110.5	T378 L379 Q380 P420 F421 V438 F502	T378-I418 HydrophobicContact CG2-CB 4.37Å; T378-I418 HydrophobicContact CG2-CG2 3.59Å; L379-I418 PolarHBondContact O-N 3.23Å; Q380-I418 HydrophobicContact CB-CD1 3.6Å; Q380-I418 HydrophobicContact CB-CG1 3.9Å; Q380-I418 HydrophobicContact CB-CG2 4.26Å; I418-P420 VanDerWaalsContact C-CD 3.42Å; I418-P420 VanDerWaalsContact C-N 3.28Å; I418-P420 HydrophobicContact CD1-CB 3.87Å; I418-P420 HydrophobicContact CD1-CG 4.02Å; I418-P420 HydrophobicContact CG1-CB 4.22Å; I418-P420 HydrophobicContact CG1-CG 4.42Å; I418-P420 VanDerWaalsContact O-N 3.11Å; I418-F421 HydrophobicContact CG1-CB 4.43Å; I418-F421 WeakPolarHBondContact O-CB 3.27Å; I418-F421 PolarHBondContact O-N 2.9Å; I418-V438 HydrophobicContact CB-CG2 3.76Å; I418-V438 HydrophobicContact CD1-CG1 4.35Å; I418-V438 HydrophobicContact CD1-CG2 4.2Å; I418-V438 HydrophobicContact CG2-CB 4.44Å; I418-V438 HydrophobicContact CG2-CG1 4.03Å; I418-V438 HydrophobicContact CG2-CG2 3.7Å; I418-F502 HydrophobicContact CD1-CD1 3.86Å; I418-F502 HydrophobicContact CD1-CE1 3.81Å
419	R	77.7	Confident	89.2	Confident	95 Å²	95	35 Å²	35	36%	0.358	19%	0.186	S	C	.	.	H	α-helix	trans	-48.6	-38.4	179.1	-174	-179.2	-179.5	170.4	2.4	114.9	F417 F421 Y422 K423 D434 E531	F417-R419 PolarHBondContact O-N 2.99Å; R419-F421 PolarHBondContact O-N 3.21Å; R419-Y422 PolarHBondContact O-N 2.87Å; R419-K423 PolarHBondContact O-N 2.75Å; R419-K423 VanDerWaalsContact O-N 3.1Å; R419-D434 WeakPolarHBondContact CD-OD1 3.4Å; R419-D434 IonicContact NE-OD1 3.72Å; R419-E531 HydrophobicContact CG-CB 4.44Å; R419-E531 HydrophobicContact CG-CG 3.84Å; R419-E531 IonicContact CZ-OE1 3.01Å; R419-E531 IonicContact NE-OE1 3.19Å; R419-E531 PolarHBondContact NE-OE1 3.22Å; R419-E531 VanDerWaalsContact NE-OE1 3.11Å; R419-E531 IonicContact NH2-OE1 3.23Å; R419-E531 PolarHBondContact NH2-OE1 2.89Å
420	P	87.9	Confident	89	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.006	18%	0.18	C	C	.	.	H	α-helix	trans	-46.6	-39.3	168	-35.9	40.2	0	0	0	115.5	I418 K423 M424 I430 D434 F502	I418-P420 VanDerWaalsContact C-CD 3.42Å; I418-P420 VanDerWaalsContact C-N 3.28Å; I418-P420 HydrophobicContact CD1-CB 3.87Å; I418-P420 HydrophobicContact CD1-CG 4.02Å; I418-P420 HydrophobicContact CG1-CB 4.22Å; I418-P420 HydrophobicContact CG1-CG 4.42Å; I418-P420 VanDerWaalsContact O-N 3.11Å; P420-K423 PolarHBondContact O-N 3.29Å; P420-M424 WeakPolarHBondContact O-CG 3.35Å; P420-M424 PolarHBondContact O-N 3.15Å; P420-I430 HydrophobicContact CB-CD1 4.1Å; P420-I430 HydrophobicContact CB-CG2 4.29Å; P420-I430 HydrophobicContact CG-CG2 4.12Å; P420-D434 HydrophobicContact CG-CB 4.09Å; P420-F502 HydrophobicContact CB-CB 4.15Å; P420-F502 HydrophobicContact CB-CD1 3.77Å; P420-F502 HydrophobicContact CB-CE1 4.32Å; P420-F502 HydrophobicContact CB-CG 3.92Å; P420-F502 HydrophobicContact CG-CD1 3.74Å; P420-F502 HydrophobicContact CG-CD2 4.19Å; P420-F502 HydrophobicContact CG-CE1 3.8Å; P420-F502 HydrophobicContact CG-CE2 4.22Å; P420-F502 HydrophobicContact CG-CG 3.95Å; P420-F502 HydrophobicContact CG-CZ 4.04Å
421	F	93.8	Very high	88.8	Confident	7 Å²	7	34.7 Å²	34.7	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-58.7	-51.9	-180	-176.9	-89.2	0	0	0	111.6	F369 I381 F417 I418 R419 K423 M424 M425 M510 F513	F369-F421 HydrophobicContact CE1-CE2 4.4Å; I381-F421 HydrophobicContact CD1-CD2 4.23Å; I381-F421 HydrophobicContact CD1-CE2 3.99Å; I381-F421 HydrophobicContact CG1-CD2 4.21Å; I381-F421 HydrophobicContact CG1-CE2 4.08Å; F417-F421 HydrophobicContact CB-CB 3.89Å; F417-F421 HydrophobicContact CB-CD1 3.88Å; F417-F421 HydrophobicContact CB-CG 3.9Å; F417-F421 HydrophobicContact CD1-CD2 4.41Å; F417-F421 HydrophobicContact CD1-CE2 4.49Å; F417-F421 HydrophobicContact CD1-CG 4.44Å; F417-F421 HydrophobicContact CD2-CD1 4.24Å; F417-F421 HydrophobicContact CD2-CE1 4.2Å; F417-F421 AromaticContact CG-CD1 3.95Å; F417-F421 HydrophobicContact CG-CD1 3.95Å; F417-F421 HydrophobicContact CG-CE1 4.21Å; F417-F421 HydrophobicContact CG-CG 4.16Å; I418-F421 HydrophobicContact CG1-CB 4.43Å; I418-F421 WeakPolarHBondContact O-CB 3.27Å; I418-F421 PolarHBondContact O-N 2.9Å; R419-F421 PolarHBondContact O-N 3.21Å; F421-K423 VanDerWaalsContact C-N 3.34Å; F421-K423 PolarHBondContact O-N 2.8Å; F421-M424 WeakPolarHBondContact O-CB 3.49Å; F421-M424 PolarHBondContact O-N 3.3Å; F421-M425 HydrophobicContact CD1-SD 4.05Å; F421-M425 HydrophobicContact CE1-CG 4.43Å; F421-M425 HydrophobicContact CE1-SD 3.64Å; F421-M425 WeakPolarHBondContact O-CG 3.36Å; F421-M425 PolarHBondContact O-N 2.81Å; F421-M425 VanDerWaalsContact O-N 3.12Å; F421-M510 HydrophobicContact CD1-CE 4.5Å; F421-M510 HydrophobicContact CD2-CE 3.47Å; F421-M510 VanDerWaalsContact CD2-CE 3.47Å; F421-M510 HydrophobicContact CE2-CE 3.55Å; F421-M510 HydrophobicContact CG-CE 3.97Å; F421-M510 HydrophobicContact CZ-CE 4.12Å; F421-F513 HydrophobicContact CE1-CE1 4.14Å; F421-F513 HydrophobicContact CE1-CZ 4.14Å; F421-F513 HydrophobicContact CZ-CD1 4.18Å; F421-F513 HydrophobicContact CZ-CD2 4.47Å; F421-F513 AromaticContact CZ-CE1 3.83Å; F421-F513 HydrophobicContact CZ-CE1 3.83Å; F421-F513 HydrophobicContact CZ-CE2 4.14Å; F421-F513 HydrophobicContact CZ-CG 4.5Å; F421-F513 AromaticContact CZ-CZ 3.81Å; F421-F513 HydrophobicContact CZ-CZ 3.81Å
422	Y	92.3	Very high	88.4	Confident	1 Å²	1	34.5 Å²	34.5	0%	0.004	18%	0.183	C	C	.	.	H	α-helix	trans	-67.4	-34.2	177.4	-52.7	-65.6	0	0	0	112.1	F417 R419 M425 L426 L534 E535	F417-Y422 HydrophobicContact CB-CE1 4.44Å; F417-Y422 HydrophobicContact CB-CE2 4.04Å; F417-Y422 HydrophobicContact CD2-CE1 4.21Å; F417-Y422 WeakPolarHBondContact O-CE2 3.35Å; R419-Y422 PolarHBondContact O-N 2.87Å; Y422-M425 HydrophobicContact CD1-SD 4.44Å; Y422-M425 PolarHBondContact O-N 2.83Å; Y422-L426 WeakPolarHBondContact O-CG 3.39Å; Y422-L426 PolarHBondContact O-N 3Å; Y422-L534 HydrophobicContact CD1-CD2 4.38Å; Y422-L534 HydrophobicContact CD1-CG 4.23Å; Y422-E535 HydrophobicContact CD1-CB 4.48Å; Y422-E535 HydrophobicContact CD2-CB 4.11Å; Y422-E535 HydrophobicContact CE1-CB 3.99Å; Y422-E535 HydrophobicContact CE2-CB 3.58Å; Y422-E535 HydrophobicContact CE2-CG 3.96Å; Y422-E535 WeakPolarHBondContact CE2-OE1 3.5Å; Y422-E535 VanDerWaalsContact CZ-CB 3.48Å; Y422-E535 WeakPolarHBondContact OH-CG 3.28Å; Y422-E535 PolarHBondContact OH-OE1 2.87Å
423	K	90.8	Very high	87.6	Confident	18 Å²	18	39.6 Å²	39.6	8%	0.078	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-42	173.4	-77.3	-173.1	166.7	-167.9	0	112.4	R419 P420 F421 L426 G427 K428 Q429 I430 D434 E531	R419-K423 PolarHBondContact O-N 2.75Å; R419-K423 VanDerWaalsContact O-N 3.1Å; P420-K423 PolarHBondContact O-N 3.29Å; F421-K423 VanDerWaalsContact C-N 3.34Å; F421-K423 PolarHBondContact O-N 2.8Å; K423-L426 PolarHBondContact O-N 3.17Å; K423-G427 PolarHBondContact O-N 3.36Å; K423-K428 HydrophobicContact CB-CB 4.18Å; K423-K428 HydrophobicContact CG-CB 4.22Å; K423-K428 PolarHBondContact O-N 3.07Å; K423-Q429 PolarHBondContact NZ-O 3.17Å; K423-I430 HydrophobicContact CB-CG1 4.06Å; K423-I430 HydrophobicContact CD-CG1 4.36Å; K423-D434 VanDerWaalsContact CE-OD1 3.23Å; K423-D434 WeakPolarHBondContact CE-OD1 3.42Å; K423-D434 IonicContact NZ-OD1 3.75Å; K423-D434 PolarHBondContact NZ-OD1 2.88Å; K423-D434 IonicContact NZ-OD2 3.16Å; K423-D434 PolarHBondContact NZ-OD2 2.8Å; K423-E531 WeakPolarHBondContact CE-OE1 3.34Å; K423-E531 HydrophobicContact CG-CB 4.08Å; K423-E531 HydrophobicContact CG-CG 4.15Å
424	M	95.5	Very high	86.9	Confident	26 Å²	26	39.7 Å²	39.7	13%	0.128	20%	0.204	C	C	.	.	H	α-helix	trans	-59.4	-45.8	172.8	-68.8	177.3	84.8	0	0	111.2	P420 F421 L426 G427 I430 F502 V503 V506 M510	P420-M424 WeakPolarHBondContact O-CG 3.35Å; P420-M424 PolarHBondContact O-N 3.15Å; F421-M424 WeakPolarHBondContact O-CB 3.49Å; F421-M424 PolarHBondContact O-N 3.3Å; M424-L426 VanDerWaalsContact C-N 3.27Å; M424-L426 PolarHBondContact O-N 2.73Å; M424-G427 PolarHBondContact O-N 3.1Å; M424-I430 HydrophobicContact CG-CD1 3.84Å; M424-F502 VanDerWaalsContact SD-O 3.33Å; M424-V503 HydrophobicContact CE-CB 4.42Å; M424-V503 HydrophobicContact CE-CG1 4.11Å; M424-V506 HydrophobicContact CE-CG2 4.05Å; M424-V506 HydrophobicContact SD-CG2 4.27Å; M424-M510 HydrophobicContact CB-CE 3.93Å; M424-M510 HydrophobicContact CB-CG 4.08Å; M424-M510 HydrophobicContact CB-SD 4.28Å; M424-M510 HydrophobicContact CE-CB 3.65Å; M424-M510 HydrophobicContact CE-CG 3.67Å; M424-M510 HydrophobicContact SD-CB 4.46Å; M424-M510 HydrophobicContact SD-CE 3.94Å; M424-M510 HydrophobicContact SD-CG 4.24Å
425	M	96.4	Very high	86.6	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-58.4	-38.7	177.3	-67.7	179.8	65.9	0	0	113	F421 Y422 G427 M510 F513 L514 F517 I526 L534 M538	F421-M425 HydrophobicContact CD1-SD 4.05Å; F421-M425 HydrophobicContact CE1-CG 4.43Å; F421-M425 HydrophobicContact CE1-SD 3.64Å; F421-M425 WeakPolarHBondContact O-CG 3.36Å; F421-M425 PolarHBondContact O-N 2.81Å; F421-M425 VanDerWaalsContact O-N 3.12Å; Y422-M425 HydrophobicContact CD1-SD 4.44Å; Y422-M425 PolarHBondContact O-N 2.83Å; M425-G427 VanDerWaalsContact C-N 3.33Å; M425-M510 HydrophobicContact CG-CE 4.45Å; M425-M510 HydrophobicContact CG-SD 4.11Å; M425-F513 HydrophobicContact CE-CE1 3.79Å; M425-F513 HydrophobicContact CE-CZ 4.34Å; M425-F513 HydrophobicContact CG-CE1 4.13Å; M425-F513 HydrophobicContact SD-CE1 3.72Å; M425-F513 HydrophobicContact SD-CZ 4.32Å; M425-L514 HydrophobicContact CB-CD2 4.18Å; M425-L514 HydrophobicContact CG-CD2 4.08Å; M425-F517 HydrophobicContact CE-CD1 4.45Å; M425-F517 HydrophobicContact CE-CD2 4.24Å; M425-F517 HydrophobicContact CE-CE1 4.27Å; M425-F517 HydrophobicContact CE-CE2 4.06Å; M425-F517 HydrophobicContact CE-CG 4.44Å; M425-F517 HydrophobicContact CE-CZ 4.07Å; M425-I526 HydrophobicContact CB-CD1 4.47Å; M425-I526 HydrophobicContact CE-CD1 4.28Å; M425-L534 HydrophobicContact CB-CD2 3.96Å; M425-L534 HydrophobicContact CE-CD2 4.11Å; M425-L534 HydrophobicContact SD-CD2 4.08Å; M425-M538 HydrophobicContact CE-CE 4.46Å; M425-M538 HydrophobicContact CE-SD 3.71Å; M425-M538 HydrophobicContact SD-CE 4.44Å; M425-M538 HydrophobicContact SD-SD 4Å
426	L	94.2	Very high	86.1	Confident	10 Å²	10	41.6 Å²	41.6	5%	0.052	21%	0.211	C	C	.	.	H	α-helix	trans	-80.9	-11.9	179.3	-65.1	169.8	0	0	0	113.2	Y422 K423 M424 K428 I526 E531 L534	Y422-L426 WeakPolarHBondContact O-CG 3.39Å; Y422-L426 PolarHBondContact O-N 3Å; K423-L426 PolarHBondContact O-N 3.17Å; M424-L426 VanDerWaalsContact C-N 3.27Å; M424-L426 PolarHBondContact O-N 2.73Å; L426-K428 VanDerWaalsContact C-N 3.33Å; L426-K428 HydrophobicContact CB-CD 4.23Å; L426-K428 HydrophobicContact CB-CG 3.9Å; L426-K428 HydrophobicContact CD1-CD 4.16Å; L426-I526 HydrophobicContact CD2-CD1 4.4Å; L426-I526 HydrophobicContact CD2-CG1 4.39Å; L426-I526 WeakPolarHBondContact CD2-O 3.38Å; L426-E531 HydrophobicContact CD1-CB 4.15Å; L426-L534 HydrophobicContact CD1-CB 4.49Å; L426-L534 HydrophobicContact CD1-CD2 4.16Å; L426-L534 HydrophobicContact CD2-CD2 3.93Å; L426-L534 HydrophobicContact CG-CD2 3.78Å
427	G	94.2	Very high	85	Confident	68 Å²	68	41.2 Å²	41.2	70%	0.701	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.4	30.6	-170.8	0	0	0	0	0	113.2	K423 M424 M425	K423-G427 PolarHBondContact O-N 3.36Å; M424-G427 PolarHBondContact O-N 3.1Å; M425-G427 VanDerWaalsContact C-N 3.33Å
428	K	90.7	Very high	84.2	Confident	80 Å²	80	40.8 Å²	40.8	35%	0.348	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-88.8	149.9	178	-70.9	-174.2	-179.9	-170.6	0	111.5	K423 L426 E531	K423-K428 HydrophobicContact CB-CB 4.18Å; K423-K428 HydrophobicContact CG-CB 4.22Å; K423-K428 PolarHBondContact O-N 3.07Å; L426-K428 VanDerWaalsContact C-N 3.33Å; L426-K428 HydrophobicContact CB-CD 4.23Å; L426-K428 HydrophobicContact CB-CG 3.9Å; L426-K428 HydrophobicContact CD1-CD 4.16Å; K428-E531 WeakPolarHBondContact CD-OE2 3.1Å; K428-E531 IonicContact NZ-OE2 3.29Å; K428-E531 PolarHBondContact NZ-OE2 3.18Å
429	Q	89.8	Confident	83.8	Confident	159 Å²	159	41.8 Å²	41.8	74%	0.743	22%	0.221	S	C	*	.	P	Polyproline II helix	trans	-63.1	134.4	172.3	-74.5	-67.1	-3.8	0	0	111.8	K423	K423-Q429 PolarHBondContact NZ-O 3.17Å
430	I	88.1	Confident	83.4	Confident	17 Å²	17	40.1 Å²	40.1	9%	0.087	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-98.7	137.3	174.9	-51.5	176.2	0	0	0	106.9	P420 K423 M424 D434 I498 F502 V503	P420-I430 HydrophobicContact CB-CD1 4.1Å; P420-I430 HydrophobicContact CB-CG2 4.29Å; P420-I430 HydrophobicContact CG-CG2 4.12Å; K423-I430 HydrophobicContact CB-CG1 4.06Å; K423-I430 HydrophobicContact CD-CG1 4.36Å; M424-I430 HydrophobicContact CG-CD1 3.84Å; I430-D434 HydrophobicContact CG2-CB 3.97Å; I430-I498 HydrophobicContact CB-CG2 4.39Å; I430-I498 HydrophobicContact CG2-CG2 3.99Å; I430-F502 HydrophobicContact CD1-CB 3.97Å; I430-F502 HydrophobicContact CG2-CB 4.32Å; I430-F502 HydrophobicContact CG2-CD2 3.76Å; I430-F502 HydrophobicContact CG2-CE2 4.44Å; I430-F502 HydrophobicContact CG2-CG 4.27Å; I430-V503 HydrophobicContact CD1-CG2 3.59Å
431	S	82.9	Confident	83	Confident	46 Å²	46	47.2 Å²	47.2	32%	0.322	26%	0.257	S	S	.	.			trans	-125.6	164	-168.4	68.6	0	0	0	0	111.4	K433 D434	S431-K433 PolarHBondContact O-N 3.45Å; S431-K433 VanDerWaalsContact O-N 3.11Å; S431-D434 WeakPolarHBondContact CB-OD2 3.44Å; S431-D434 PolarHBondContact N-OD2 3.41Å; S431-D434 WeakPolarHBondContact O-CB 3.24Å; S431-D434 PolarHBondContact O-N 3.47Å; S431-D434 PolarHBondContact OG-OD2 3.11Å
432	L	81.1	Confident	82.6	Confident	22 Å²	22	50.4 Å²	50.4	12%	0.115	27%	0.269	C	S	.	.	H	α-helix	trans	-50.4	-36.3	172.5	175.9	60.6	0	0	0	112.6	D434 M435 Y443 L446 L450 I494 I498	L432-D434 PolarHBondContact O-N 3.4Å; L432-M435 VanDerWaalsContact O-CB 3.24Å; L432-M435 WeakPolarHBondContact O-CB 3.43Å; L432-M435 PolarHBondContact O-N 3.02Å; L432-M435 VanDerWaalsContact O-N 3.07Å; L432-Y443 HydrophobicContact CD1-CD2 3.81Å; L432-Y443 HydrophobicContact CD1-CE2 4.37Å; L432-Y443 HydrophobicContact CG-CD2 3.96Å; L432-Y443 HydrophobicContact CG-CE2 4.01Å; L432-Y443 VanDerWaalsContact O-CD2 3.29Å; L432-Y443 WeakPolarHBondContact O-CD2 3.48Å; L432-L446 HydrophobicContact CD1-CB 3.52Å; L432-L446 HydrophobicContact CD1-CD1 3.87Å; L432-L446 HydrophobicContact CD1-CG 4.38Å; L432-L450 HydrophobicContact CD2-CD2 3.85Å; L432-I494 HydrophobicContact CB-CG2 4.32Å; L432-I494 HydrophobicContact CD1-CG2 4.26Å; L432-I494 HydrophobicContact CD2-CG2 4.28Å; L432-I498 HydrophobicContact CD1-CD1 4.14Å
433	K	72	Confident	82	Confident	138 Å²	138	51.5 Å²	51.5	60%	0.6	27%	0.273	S	S	*	.	H	α-helix	trans	-64.9	-26.3	178.2	-174.4	168.5	-176.9	174.4	0	113.3	S431 M435 E436	S431-K433 PolarHBondContact O-N 3.45Å; S431-K433 VanDerWaalsContact O-N 3.11Å; K433-M435 PolarHBondContact O-N 2.7Å; K433-E436 WeakPolarHBondContact O-CB 3.31Å; K433-E436 PolarHBondContact O-N 2.94Å
434	D	76.5	Confident	81.5	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-73.6	-14.8	176.4	-55.8	-75.8	0	0	0	112.4	R419 P420 K423 I430 S431 L432 S437	R419-D434 WeakPolarHBondContact CD-OD1 3.4Å; R419-D434 IonicContact NE-OD1 3.72Å; P420-D434 HydrophobicContact CG-CB 4.09Å; K423-D434 VanDerWaalsContact CE-OD1 3.23Å; K423-D434 WeakPolarHBondContact CE-OD1 3.42Å; K423-D434 IonicContact NZ-OD1 3.75Å; K423-D434 PolarHBondContact NZ-OD1 2.88Å; K423-D434 IonicContact NZ-OD2 3.16Å; K423-D434 PolarHBondContact NZ-OD2 2.8Å; I430-D434 HydrophobicContact CG2-CB 3.97Å; S431-D434 WeakPolarHBondContact CB-OD2 3.44Å; S431-D434 PolarHBondContact N-OD2 3.41Å; S431-D434 WeakPolarHBondContact O-CB 3.24Å; S431-D434 PolarHBondContact O-N 3.47Å; S431-D434 PolarHBondContact OG-OD2 3.11Å; L432-D434 PolarHBondContact O-N 3.4Å; D434-S437 PolarHBondContact O-OG 3Å
435	M	80.2	Confident	81.4	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-71.8	-34.5	171.2	-170.2	72.9	75.1	0	0	112	L432 K433 S437 V438 D439 Y442 Y443 L446 I498 R501 F502	L432-M435 VanDerWaalsContact O-CB 3.24Å; L432-M435 WeakPolarHBondContact O-CB 3.43Å; L432-M435 PolarHBondContact O-N 3.02Å; L432-M435 VanDerWaalsContact O-N 3.07Å; K433-M435 PolarHBondContact O-N 2.7Å; M435-S437 PolarHBondContact O-N 2.63Å; M435-V438 PolarHBondContact O-N 3.43Å; M435-D439 HydrophobicContact CG-CB 4.44Å; M435-D439 CarbonylContact O-C 3.59Å; M435-D439 PolarHBondContact O-N 2.87Å; M435-D439 HydrophobicContact SD-CB 4Å; M435-Y442 HydrophobicContact CE-CD1 3.56Å; M435-Y442 HydrophobicContact CE-CE1 3.86Å; M435-Y442 HydrophobicContact CG-CD1 4.35Å; M435-Y442 HydrophobicContact SD-CD1 3.94Å; M435-Y443 HydrophobicContact CB-CD2 4.35Å; M435-L446 HydrophobicContact CE-CD1 4.23Å; M435-I498 HydrophobicContact CB-CD1 4.12Å; M435-I498 HydrophobicContact CE-CD1 3.41Å; M435-I498 VanDerWaalsContact CE-CD1 3.41Å; M435-R501 HydrophobicContact CE-CB 4.35Å; M435-R501 HydrophobicContact CE-CG 3.88Å; M435-F502 HydrophobicContact CB-CE2 4.33Å; M435-F502 HydrophobicContact CE-CE2 3.69Å; M435-F502 HydrophobicContact CE-CZ 3.98Å; M435-F502 HydrophobicContact SD-CE2 3.86Å; M435-F502 HydrophobicContact SD-CZ 3.57Å; M435-F502 VanDerWaalsContact SD-CZ 3.57Å
436	E	72.4	Confident	81.2	Confident	85 Å²	85	57 Å²	57	40%	0.397	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-35.4	-174	-173.7	169.8	-125.1	0	0	113.3	K433 Y443	K433-E436 WeakPolarHBondContact O-CB 3.31Å; K433-E436 PolarHBondContact O-N 2.94Å; E436-Y443 HydrophobicContact CB-CD1 3.81Å; E436-Y443 HydrophobicContact CB-CD2 3.99Å; E436-Y443 HydrophobicContact CB-CE1 3.8Å; E436-Y443 HydrophobicContact CB-CE2 4Å; E436-Y443 HydrophobicContact CB-CG 3.86Å; E436-Y443 HydrophobicContact CG-CD1 3.8Å; E436-Y443 HydrophobicContact CG-CE1 3.52Å; E436-Y443 HydrophobicContact CG-CG 4.37Å; E436-Y443 WeakPolarHBondContact OE1-CE1 3.46Å; E436-Y443 VanDerWaalsContact OE1-CZ 3.24Å; E436-Y443 PolarHBondContact OE1-OH 3.26Å
437	S	59.9	Low	80.8	Confident	66 Å²	66	59.8 Å²	59.8	46%	0.462	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-15	178.6	55.5	0	0	0	0	115	T374 D434 M435	T374-S437 PolarHBondContact OG1-O 2.82Å; D434-S437 PolarHBondContact O-OG 3Å; M435-S437 PolarHBondContact O-N 2.63Å
438	V	68.8	Low	80.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-37.5	-175.2	-175.1	0	0	0	0	112.2	A373 T374 I418 M435 F502	A373-V438 PolarHBondContact N-O 2.95Å; T374-V438 PolarHBondContact N-O 2.96Å; T374-V438 PolarHBondContact OG1-O 3.27Å; I418-V438 HydrophobicContact CB-CG2 3.76Å; I418-V438 HydrophobicContact CD1-CG1 4.35Å; I418-V438 HydrophobicContact CD1-CG2 4.2Å; I418-V438 HydrophobicContact CG2-CB 4.44Å; I418-V438 HydrophobicContact CG2-CG1 4.03Å; I418-V438 HydrophobicContact CG2-CG2 3.7Å; M435-V438 PolarHBondContact O-N 3.43Å; V438-F502 HydrophobicContact CB-CE1 4.21Å; V438-F502 HydrophobicContact CB-CZ 4.13Å; V438-F502 HydrophobicContact CG1-CE1 4Å; V438-F502 HydrophobicContact CG1-CZ 4.35Å; V438-F502 HydrophobicContact CG2-CE1 4.08Å; V438-F502 HydrophobicContact CG2-CZ 4.11Å
439	D	74.3	Confident	81.1	Confident	33 Å²	33	59 Å²	59	18%	0.176	30%	0.296	C	S	.	.			trans	-154.1	92.4	-179.9	-166.9	-33.5	0	0	0	108.8	A373 M435 E441 Y442 Y443	A373-D439 HydrophobicContact CB-CB 4.31Å; M435-D439 HydrophobicContact CG-CB 4.44Å; M435-D439 CarbonylContact O-C 3.59Å; M435-D439 PolarHBondContact O-N 2.87Å; M435-D439 HydrophobicContact SD-CB 4Å; D439-E441 VanDerWaalsContact C-N 3.33Å; D439-E441 PolarHBondContact OD1-N 3.16Å; D439-Y442 VanDerWaalsContact OD1-CB 3.26Å; D439-Y442 WeakPolarHBondContact OD1-CB 3.07Å; D439-Y442 PolarHBondContact OD1-N 3.34Å; D439-Y443 VanDerWaalsContact O-CB 3.23Å; D439-Y443 WeakPolarHBondContact O-CB 3.45Å; D439-Y443 PolarHBondContact O-N 2.76Å
440	S	70.6	Confident	81.2	Confident	59 Å²	59	54.5 Å²	54.5	41%	0.413	28%	0.276	S	S	.	.	H	α-helix	trans	-71.5	-27.9	-175.6	59	0	0	0	0	112.8	N444	S440-N444 WeakPolarHBondContact O-CB 3.33Å; S440-N444 PolarHBondContact O-N 2.93Å; S440-N444 PolarHBondContact O-ND2 3.46Å
441	E	77.9	Confident	81.4	Confident	151 Å²	151	59.8 Å²	59.8	71%	0.706	30%	0.3	S	S	*	.	H	α-helix	trans	-73.2	-45.7	177.1	-175.8	167.6	-167.2	0	0	111.1	D439 N444 S445	D439-E441 VanDerWaalsContact C-N 3.33Å; D439-E441 PolarHBondContact OD1-N 3.16Å; E441-N444 PolarHBondContact O-N 3.32Å; E441-S445 PolarHBondContact O-N 3.17Å; E441-S445 PolarHBondContact O-OG 3.38Å
442	Y	85.4	Confident	82	Confident	74 Å²	74	60.6 Å²	60.6	29%	0.29	30%	0.301	S	S	.	.	H	α-helix	trans	-67.1	-39.4	175.2	-160.3	-103.4	0	0	0	111.8	M435 D439 N444 S445 L446 V497	M435-Y442 HydrophobicContact CE-CD1 3.56Å; M435-Y442 HydrophobicContact CE-CE1 3.86Å; M435-Y442 HydrophobicContact CG-CD1 4.35Å; M435-Y442 HydrophobicContact SD-CD1 3.94Å; D439-Y442 VanDerWaalsContact OD1-CB 3.26Å; D439-Y442 WeakPolarHBondContact OD1-CB 3.07Å; D439-Y442 PolarHBondContact OD1-N 3.34Å; Y442-N444 PolarHBondContact O-N 2.76Å; Y442-S445 WeakPolarHBondContact O-CB 3.32Å; Y442-S445 PolarHBondContact O-N 2.73Å; Y442-L446 HydrophobicContact CD1-CD1 3.82Å; Y442-L446 HydrophobicContact CD1-CG 4.22Å; Y442-L446 HydrophobicContact CE1-CD1 3.68Å; Y442-L446 HydrophobicContact CE1-CD2 4.47Å; Y442-L446 HydrophobicContact CE1-CG 4.12Å; Y442-L446 WeakPolarHBondContact O-CG 3.3Å; Y442-L446 PolarHBondContact O-N 3.08Å; Y442-V497 HydrophobicContact CE1-CG1 3.63Å; Y442-V497 VanDerWaalsContact OH-CG1 3.27Å; Y442-V497 WeakPolarHBondContact OH-CG1 3.41Å
443	Y	79.8	Confident	82.7	Confident	24 Å²	24	63.6 Å²	63.6	9%	0.094	32%	0.317	C	S	.	.	H	α-helix	trans	-57.3	-47.2	170.2	166.1	-107.2	0	0	0	112.5	L432 M435 E436 D439 S445 L446 K447	L432-Y443 HydrophobicContact CD1-CD2 3.81Å; L432-Y443 HydrophobicContact CD1-CE2 4.37Å; L432-Y443 HydrophobicContact CG-CD2 3.96Å; L432-Y443 HydrophobicContact CG-CE2 4.01Å; L432-Y443 VanDerWaalsContact O-CD2 3.29Å; L432-Y443 WeakPolarHBondContact O-CD2 3.48Å; M435-Y443 HydrophobicContact CB-CD2 4.35Å; E436-Y443 HydrophobicContact CB-CD1 3.81Å; E436-Y443 HydrophobicContact CB-CD2 3.99Å; E436-Y443 HydrophobicContact CB-CE1 3.8Å; E436-Y443 HydrophobicContact CB-CE2 4Å; E436-Y443 HydrophobicContact CB-CG 3.86Å; E436-Y443 HydrophobicContact CG-CD1 3.8Å; E436-Y443 HydrophobicContact CG-CE1 3.52Å; E436-Y443 HydrophobicContact CG-CG 4.37Å; E436-Y443 WeakPolarHBondContact OE1-CE1 3.46Å; E436-Y443 VanDerWaalsContact OE1-CZ 3.24Å; E436-Y443 PolarHBondContact OE1-OH 3.26Å; D439-Y443 VanDerWaalsContact O-CB 3.23Å; D439-Y443 WeakPolarHBondContact O-CB 3.45Å; D439-Y443 PolarHBondContact O-N 2.76Å; Y443-S445 VanDerWaalsContact C-N 3.27Å; Y443-S445 PolarHBondContact O-N 3.26Å; Y443-L446 PolarHBondContact O-N 2.82Å; Y443-K447 HydrophobicContact CE1-CD 4.26Å; Y443-K447 WeakPolarHBondContact O-CB 3.31Å; Y443-K447 PolarHBondContact O-N 2.89Å
444	N	80.9	Confident	83.7	Confident	94 Å²	94	57 Å²	57	50%	0.503	29%	0.289	S	S	.	.	H	α-helix	trans	-61	-38.2	178.1	-76.8	-35.8	0	0	0	111.7	S440 E441 Y442 K447 W448	S440-N444 WeakPolarHBondContact O-CB 3.33Å; S440-N444 PolarHBondContact O-N 2.93Å; S440-N444 PolarHBondContact O-ND2 3.46Å; E441-N444 PolarHBondContact O-N 3.32Å; Y442-N444 PolarHBondContact O-N 2.76Å; N444-K447 PolarHBondContact O-N 3.39Å; N444-W448 WeakPolarHBondContact O-CB 3.42Å; N444-W448 PolarHBondContact O-N 2.71Å
445	S	92.5	Very high	84.4	Confident	63 Å²	63	60.2 Å²	60.2	44%	0.441	31%	0.309	S	S	.	.	H	α-helix	trans	-65.3	-48.9	176.7	-57.5	0	0	0	0	112.2	E441 Y442 Y443 K447 W448 I449	E441-S445 PolarHBondContact O-N 3.17Å; E441-S445 PolarHBondContact O-OG 3.38Å; Y442-S445 WeakPolarHBondContact O-CB 3.32Å; Y442-S445 PolarHBondContact O-N 2.73Å; Y443-S445 VanDerWaalsContact C-N 3.27Å; Y443-S445 PolarHBondContact O-N 3.26Å; S445-K447 VanDerWaalsContact C-N 3.32Å; S445-K447 PolarHBondContact O-N 2.93Å; S445-W448 WeakPolarHBondContact O-CB 3.33Å; S445-W448 PolarHBondContact O-N 2.97Å; S445-I449 WeakPolarHBondContact O-CG1 3.17Å; S445-I449 PolarHBondContact O-N 3.43Å; S445-I449 VanDerWaalsContact O-N 3.07Å
446	L	92.1	Very high	84.9	Confident	4 Å²	4	69.4 Å²	69.4	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-65.4	-34.8	175.8	-67.8	-180	0	0	0	112.7	L432 M435 Y442 Y443 I449 L450 I494 V497 I498	L432-L446 HydrophobicContact CD1-CB 3.52Å; L432-L446 HydrophobicContact CD1-CD1 3.87Å; L432-L446 HydrophobicContact CD1-CG 4.38Å; M435-L446 HydrophobicContact CE-CD1 4.23Å; Y442-L446 HydrophobicContact CD1-CD1 3.82Å; Y442-L446 HydrophobicContact CD1-CG 4.22Å; Y442-L446 HydrophobicContact CE1-CD1 3.68Å; Y442-L446 HydrophobicContact CE1-CD2 4.47Å; Y442-L446 HydrophobicContact CE1-CG 4.12Å; Y442-L446 WeakPolarHBondContact O-CG 3.3Å; Y442-L446 PolarHBondContact O-N 3.08Å; Y443-L446 PolarHBondContact O-N 2.82Å; L446-I449 HydrophobicContact CD2-CD1 4.38Å; L446-I449 PolarHBondContact O-N 3.05Å; L446-L450 PolarHBondContact O-N 3.31Å; L446-I494 HydrophobicContact CD2-CG1 4.34Å; L446-I494 WeakPolarHBondContact O-CD1 3.2Å; L446-V497 HydrophobicContact CD1-CG1 3.95Å; L446-V497 HydrophobicContact CD2-CG1 4.1Å; L446-I498 HydrophobicContact CD1-CD1 3.8Å
447	K	86.6	Confident	85.8	Confident	70 Å²	70	69.4 Å²	69.4	30%	0.304	35%	0.354	S	S	.	.	H	α-helix	trans	-67.2	-39.4	173.9	-177.9	178.7	174.1	-175.9	0	111.7	Y443 N444 S445 I449 L450 E451	Y443-K447 HydrophobicContact CE1-CD 4.26Å; Y443-K447 WeakPolarHBondContact O-CB 3.31Å; Y443-K447 PolarHBondContact O-N 2.89Å; N444-K447 PolarHBondContact O-N 3.39Å; S445-K447 VanDerWaalsContact C-N 3.32Å; S445-K447 PolarHBondContact O-N 2.93Å; K447-I449 VanDerWaalsContact C-N 3.34Å; K447-I449 PolarHBondContact O-N 2.99Å; K447-L450 WeakPolarHBondContact O-CB 3.47Å; K447-L450 PolarHBondContact O-N 2.77Å; K447-L450 VanDerWaalsContact O-N 3.16Å; K447-E451 WeakPolarHBondContact CE-OE1 3.4Å; K447-E451 HydrophobicContact CG-CG 4.49Å; K447-E451 WeakPolarHBondContact O-CB 3.5Å; K447-E451 WeakPolarHBondContact O-CG 3.33Å; K447-E451 PolarHBondContact O-N 3.38Å
448	W	94.8	Very high	87.3	Confident	119 Å²	119	70.8 Å²	70.8	45%	0.451	36%	0.356	S	S	.	.	H	α-helix	trans	-60.3	-45.5	172.8	-172.4	96.6	0	0	0	111	N444 S445 L450 E451 N452 L457	N444-W448 WeakPolarHBondContact O-CB 3.42Å; N444-W448 PolarHBondContact O-N 2.71Å; S445-W448 WeakPolarHBondContact O-CB 3.33Å; S445-W448 PolarHBondContact O-N 2.97Å; W448-L450 VanDerWaalsContact C-N 3.29Å; W448-L450 PolarHBondContact O-N 3.37Å; W448-E451 PolarHBondContact O-N 2.81Å; W448-N452 HydrophobicContact CD2-CB 4.01Å; W448-N452 HydrophobicContact CE3-CB 4.09Å; W448-N452 HydrophobicContact CH2-CB 3.75Å; W448-N452 HydrophobicContact CZ2-CB 3.68Å; W448-N452 HydrophobicContact CZ3-CB 3.95Å; W448-N452 PolarHBondContact NE1-ND2 2.79Å; W448-N452 WeakPolarHBondContact O-CB 3.44Å; W448-N452 PolarHBondContact O-N 3.11Å; W448-N452 PolarHBondContact O-ND2 3.38Å; W448-L457 HydrophobicContact CE3-CD1 4.23Å; W448-L457 HydrophobicContact CZ3-CD1 3.7Å; W448-L457 HydrophobicContact CZ3-CG 4.3Å
449	I	95.6	Very high	88.5	Confident	13 Å²	13	72.9 Å²	72.9	7%	0.067	37%	0.367	C	S	.	.	H	α-helix	trans	-59.5	-39.3	174.2	-67.8	159.8	0	0	0	111	S445 L446 K447 E451 P454 L457 L459 K490 Y493 I494	S445-I449 WeakPolarHBondContact O-CG1 3.17Å; S445-I449 PolarHBondContact O-N 3.43Å; S445-I449 VanDerWaalsContact O-N 3.07Å; L446-I449 HydrophobicContact CD2-CD1 4.38Å; L446-I449 PolarHBondContact O-N 3.05Å; K447-I449 VanDerWaalsContact C-N 3.34Å; K447-I449 PolarHBondContact O-N 2.99Å; I449-E451 PolarHBondContact O-N 2.73Å; I449-P454 HydrophobicContact CG2-CB 4.06Å; I449-P454 HydrophobicContact CG2-CG 4.29Å; I449-L457 HydrophobicContact CG1-CD1 4.23Å; I449-L459 HydrophobicContact CD1-CD1 3.6Å; I449-L459 HydrophobicContact CG1-CD1 4.12Å; I449-K490 HydrophobicContact CG2-CB 4.14Å; I449-K490 WeakPolarHBondContact O-CD 3.33Å; I449-K490 VanDerWaalsContact O-CE 3.31Å; I449-K490 WeakPolarHBondContact O-CE 2.97Å; I449-K490 PolarHBondContact O-NZ 2.83Å; I449-Y493 HydrophobicContact CD1-CE1 4.32Å; I449-I494 HydrophobicContact CB-CD1 4.43Å; I449-I494 HydrophobicContact CG2-CD1 4.03Å; I449-I494 HydrophobicContact CG2-CG1 4.26Å
450	L	92.6	Very high	89.6	Confident	64 Å²	64	75.2 Å²	75.2	34%	0.335	37%	0.373	S	S	.	.	H	α-helix	trans	-64.1	-39.9	177	-172	60.7	0	0	0	112.5	L432 L446 K447 W448 K490 K491 I494	L432-L450 HydrophobicContact CD2-CD2 3.85Å; L446-L450 PolarHBondContact O-N 3.31Å; K447-L450 WeakPolarHBondContact O-CB 3.47Å; K447-L450 PolarHBondContact O-N 2.77Å; K447-L450 VanDerWaalsContact O-N 3.16Å; W448-L450 VanDerWaalsContact C-N 3.29Å; W448-L450 PolarHBondContact O-N 3.37Å; L450-K490 WeakPolarHBondContact O-CE 3.45Å; L450-K490 PolarHBondContact O-NZ 3.01Å; L450-K491 HydrophobicContact CD1-CG 3.94Å; L450-I494 HydrophobicContact CB-CD1 3.71Å; L450-I494 HydrophobicContact CD1-CD1 3.95Å; L450-I494 HydrophobicContact CG-CD1 4.38Å
451	E	92.7	Very high	90.9	Very high	128 Å²	128	72.4 Å²	72.4	60%	0.598	35%	0.353	S	S	*	.	H	α-helix	trans	-88	-24.7	-172.6	-69	174.6	177.2	0	0	113.5	K447 W448 I449	K447-E451 WeakPolarHBondContact CE-OE1 3.4Å; K447-E451 HydrophobicContact CG-CG 4.49Å; K447-E451 WeakPolarHBondContact O-CB 3.5Å; K447-E451 WeakPolarHBondContact O-CG 3.33Å; K447-E451 PolarHBondContact O-N 3.38Å; W448-E451 PolarHBondContact O-N 2.81Å; I449-E451 PolarHBondContact O-N 2.73Å
452	N	95.9	Very high	91.7	Very high	63 Å²	63	66 Å²	66	34%	0.337	33%	0.325	S	S	.	.	S	Bend	trans	-121.1	169.7	-173.7	-57.4	-89.3	0	0	0	112.1	W448 P454 K490	W448-N452 HydrophobicContact CD2-CB 4.01Å; W448-N452 HydrophobicContact CE3-CB 4.09Å; W448-N452 HydrophobicContact CH2-CB 3.75Å; W448-N452 HydrophobicContact CZ2-CB 3.68Å; W448-N452 HydrophobicContact CZ3-CB 3.95Å; W448-N452 PolarHBondContact NE1-ND2 2.79Å; W448-N452 WeakPolarHBondContact O-CB 3.44Å; W448-N452 PolarHBondContact O-N 3.11Å; W448-N452 PolarHBondContact O-ND2 3.38Å; N452-P454 WeakPolarHBondContact O-CD 3.48Å; N452-K490 PolarHBondContact O-NZ 3.3Å
453	D	94.4	Very high	92.1	Very high	84 Å²	84	63.2 Å²	63.2	45%	0.449	32%	0.315	S	S	.	.			trans	-79.2	118.2	174.4	-167.4	-26.5	0	0	0	110.2	T455	D453-T455 VanDerWaalsContact C-N 3.33Å; D453-T455 VanDerWaalsContact OD1-CB 3.24Å; D453-T455 WeakPolarHBondContact OD1-CB 3.18Å; D453-T455 PolarHBondContact OD1-N 3.02Å; D453-T455 PolarHBondContact OD1-OG1 2.96Å
454	P	93.8	Very high	92.6	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.341	C	S	.	.			trans	-86.3	1.3	-178.5	36.6	-36.3	0	0	0	113.8	I449 N452 E456 L457 L459 V485 K490	I449-P454 HydrophobicContact CG2-CB 4.06Å; I449-P454 HydrophobicContact CG2-CG 4.29Å; N452-P454 WeakPolarHBondContact O-CD 3.48Å; P454-E456 PolarHBondContact O-N 2.96Å; P454-E456 VanDerWaalsContact O-N 3.17Å; P454-L457 HydrophobicContact CB-CD1 4.28Å; P454-L457 VanDerWaalsContact O-CB 3.29Å; P454-L457 WeakPolarHBondContact O-CB 3.23Å; P454-L457 PolarHBondContact O-N 2.83Å; P454-L459 HydrophobicContact CB-CD1 4.47Å; P454-V485 HydrophobicContact CG-CG1 3.99Å; P454-K490 HydrophobicContact CG-CB 4Å; P454-K490 HydrophobicContact CG-CD 4.23Å
455	T	90.3	Very high	92.7	Very high	71 Å²	71	65 Å²	65	44%	0.436	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-59.3	-31.8	-172.3	-54.3	0	0	0	0	112.8	D453 L457	D453-T455 VanDerWaalsContact C-N 3.33Å; D453-T455 VanDerWaalsContact OD1-CB 3.24Å; D453-T455 WeakPolarHBondContact OD1-CB 3.18Å; D453-T455 PolarHBondContact OD1-N 3.02Å; D453-T455 PolarHBondContact OD1-OG1 2.96Å; T455-L457 PolarHBondContact O-N 3.33Å
456	E	91	Very high	92.2	Very high	192 Å²	192	67 Å²	67	90%	0.897	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-72.7	-11.6	175.8	-63.1	-171.2	167.5	0	0	114.1	P454	P454-E456 PolarHBondContact O-N 2.96Å; P454-E456 VanDerWaalsContact O-N 3.17Å
457	L	91.4	Very high	91.5	Very high	86 Å²	86	68.5 Å²	68.5	45%	0.45	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-87.1	-8.3	179.7	-56.5	-179.2	0	0	0	113.7	W448 I449 P454 T455 L459	W448-L457 HydrophobicContact CE3-CD1 4.23Å; W448-L457 HydrophobicContact CZ3-CD1 3.7Å; W448-L457 HydrophobicContact CZ3-CG 4.3Å; I449-L457 HydrophobicContact CG1-CD1 4.23Å; P454-L457 HydrophobicContact CB-CD1 4.28Å; P454-L457 VanDerWaalsContact O-CB 3.29Å; P454-L457 WeakPolarHBondContact O-CB 3.23Å; P454-L457 PolarHBondContact O-N 2.83Å; T455-L457 PolarHBondContact O-N 3.33Å; L457-L459 HydrophobicContact CB-CD1 4.16Å; L457-L459 HydrophobicContact CB-CG 3.79Å; L457-L459 HydrophobicContact CD1-CD1 3.86Å; L457-L459 HydrophobicContact CD1-CG 4.39Å; L457-L459 PolarHBondContact O-N 2.83Å; L457-L459 VanDerWaalsContact O-N 3.08Å
458	D	91.9	Very high	90.9	Very high	95 Å²	95	73.8 Å²	73.8	51%	0.508	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.8	35.5	-172.2	-167.2	29.5	0	0	0	113.8	R460	D458-R460 IonicContact OD1-CZ 2.66Å; D458-R460 IonicContact OD1-NE 2.63Å; D458-R460 IonicContact OD1-NH2 3.7Å; D458-R460 PolarHBondContact OD1-NH2 3.29Å; D458-R460 VanDerWaalsContact OD1-NH2 3.08Å; D458-R460 IonicContact OD2-NH2 3.49Å
459	L	94.7	Very high	90.1	Very high	44 Å²	44	71 Å²	71	23%	0.23	37%	0.371	C	S	.	.			trans	-65.1	148.2	174.6	-67.4	175.3	0	0	0	110.3	I449 P454 L457 V484 V485 Y493	I449-L459 HydrophobicContact CD1-CD1 3.6Å; I449-L459 HydrophobicContact CG1-CD1 4.12Å; P454-L459 HydrophobicContact CB-CD1 4.47Å; L457-L459 HydrophobicContact CB-CD1 4.16Å; L457-L459 HydrophobicContact CB-CG 3.79Å; L457-L459 HydrophobicContact CD1-CD1 3.86Å; L457-L459 HydrophobicContact CD1-CG 4.39Å; L457-L459 PolarHBondContact O-N 2.83Å; L457-L459 VanDerWaalsContact O-N 3.08Å; L459-V484 CarbonylContact O-C 3.53Å; L459-V484 WeakPolarHBondContact O-CA 3.45Å; L459-V485 HydrophobicContact CB-CB 3.91Å; L459-V485 HydrophobicContact CB-CG2 3.87Å; L459-V485 PolarHBondContact O-N 2.94Å; L459-Y493 HydrophobicContact CD1-CE1 4.24Å
460	R	96.3	Very high	89.6	Confident	81 Å²	81	76 Å²	76	31%	0.306	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-125.8	166.3	178.2	-74.9	149.5	-172.1	-70.7	-15.7	110.3	D458 C462 S481 M483 Y493	D458-R460 IonicContact OD1-CZ 2.66Å; D458-R460 IonicContact OD1-NE 2.63Å; D458-R460 IonicContact OD1-NH2 3.7Å; D458-R460 PolarHBondContact OD1-NH2 3.29Å; D458-R460 VanDerWaalsContact OD1-NH2 3.08Å; D458-R460 IonicContact OD2-NH2 3.49Å; R460-C462 VanDerWaalsContact CB-SG 3.55Å; R460-C462 PolarHBondContact O-N 2.84Å; R460-S481 VanDerWaalsContact CD-O 3.28Å; R460-S481 WeakPolarHBondContact CD-O 3.42Å; R460-S481 WeakPolarHBondContact CG-O 3.42Å; R460-S481 PolarHBondContact NH1-O 3.34Å; R460-M483 CarbonylContact C-O 3.55Å; R460-M483 WeakPolarHBondContact CA-O 3.22Å; R460-Y493 WeakPolarHBondContact O-CE2 3.42Å
461	F	97.4	Very high	89.3	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	41%	0.405	C	S	.	.	S	Bend	trans	-76.5	46.5	176.3	-81.4	-101.5	0	0	0	112.5	L476 K477 G480 M483 V485 N489 E492 Y493 L496	F461-L476 VanDerWaalsContact O-CB 3.31Å; F461-L476 WeakPolarHBondContact O-CB 3.4Å; F461-L476 PolarHBondContact O-N 2.94Å; F461-K477 HydrophobicContact CB-CD 4.39Å; F461-K477 HydrophobicContact CB-CG 4.19Å; F461-K477 HydrophobicContact CD1-CD 3.61Å; F461-K477 VanDerWaalsContact CD1-CE 3.43Å; F461-K477 HydrophobicContact CD1-CG 4.2Å; F461-K477 HydrophobicContact CE1-CD 4.08Å; F461-K477 HydrophobicContact CG-CD 4.12Å; F461-K477 HydrophobicContact CG-CG 4.45Å; F461-K477 VanDerWaalsContact CZ-NZ 3.32Å; F461-G480 CarbonylContact C-O 3.6Å; F461-G480 WeakPolarHBondContact CA-O 3.38Å; F461-G480 WeakPolarHBondContact CB-O 3.39Å; F461-G480 PolarHBondContact N-O 2.92Å; F461-G480 CarbonylContact O-C 3.6Å; F461-G480 VanDerWaalsContact O-CA 3.25Å; F461-G480 WeakPolarHBondContact O-CA 3.31Å; F461-M483 HydrophobicContact CB-CB 4.41Å; F461-M483 HydrophobicContact CD2-CB 4.01Å; F461-M483 PolarHBondContact N-O 2.8Å; F461-V485 HydrophobicContact CD2-CG2 3.93Å; F461-V485 HydrophobicContact CE2-CG2 3.94Å; F461-N489 HydrophobicContact CE2-CB 4.35Å; F461-N489 WeakPolarHBondContact CE2-OD1 3.33Å; F461-N489 HydrophobicContact CZ-CB 4.1Å; F461-E492 HydrophobicContact CE1-CB 4.08Å; F461-E492 HydrophobicContact CE1-CG 4.01Å; F461-E492 HydrophobicContact CZ-CB 4.26Å; F461-Y493 HydrophobicContact CD1-CD2 4.32Å; F461-Y493 VanDerWaalsContact CE1-CA 3.47Å; F461-Y493 HydrophobicContact CG-CD2 4.41Å; F461-L496 HydrophobicContact CD1-CD1 3.75Å; F461-L496 HydrophobicContact CE1-CD1 3.91Å
462	C	95.8	Very high	89	Confident	17 Å²	17	77.1 Å²	77.1	12%	0.115	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	164.2	178.3	61.1	0	0	0	0	109.6	R460 Q473 V474	R460-C462 VanDerWaalsContact CB-SG 3.55Å; R460-C462 PolarHBondContact O-N 2.84Å; C462-Q473 HydrophobicContact CB-CG 4.02Å; C462-Q473 PolarHBondContact SG-NE2 2.89Å; C462-V474 CarbonylContact C-O 3.57Å; C462-V474 WeakPolarHBondContact CA-O 3.31Å
463	I	93.2	Very high	88.8	Confident	16 Å²	16	79.7 Å²	79.7	8%	0.082	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156.6	179.8	48.4	167.7	0	0	0	109.9	Q473 V474 L476 V497 W500	I463-Q473 CarbonylContact O-C 3.51Å; I463-Q473 WeakPolarHBondContact O-CA 3.41Å; I463-V474 HydrophobicContact CG1-CB 4.15Å; I463-V474 PolarHBondContact N-O 3.19Å; I463-V474 PolarHBondContact O-N 3.43Å; I463-L476 HydrophobicContact CD1-CD2 3.78Å; I463-L476 HydrophobicContact CG1-CD2 3.89Å; I463-L476 HydrophobicContact CG1-CG 4.41Å; I463-L476 HydrophobicContact CG2-CD1 4.25Å; I463-L476 HydrophobicContact CG2-CD2 4.24Å; I463-L476 HydrophobicContact CG2-CG 4.42Å; I463-V497 HydrophobicContact CG2-CG2 4.29Å; I463-W500 HydrophobicContact CD1-CD2 3.15Å; I463-W500 HydrophobicContact CD1-CE3 3.19Å; I463-W500 HydrophobicContact CD1-CG 3.76Å; I463-W500 HydrophobicContact CD1-CH2 3.65Å; I463-W500 HydrophobicContact CD1-CZ2 3.59Å; I463-W500 HydrophobicContact CD1-CZ3 3.46Å; I463-W500 VanDerWaalsContact CD1-CZ3 3.46Å
464	D	90.2	Very high	88.7	Confident	117 Å²	117	77.8 Å²	77.8	63%	0.626	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.9	177.8	-65.7	-34.7	0	0	0	110.3	T471	D464-T471 HydrophobicContact CB-CG2 3.65Å
465	E	83.9	Confident	88.8	Confident	37 Å²	37	81 Å²	81	17%	0.173	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	131	165.4	-87.8	-159.9	138	0	0	110.6	T471 Y472 W500 R505	E465-T471 CarbonylContact O-C 3.53Å; E465-T471 WeakPolarHBondContact O-CA 3.32Å; E465-Y472 PolarHBondContact N-O 3.37Å; E465-Y472 PolarHBondContact O-N 3.09Å; E465-W500 VanDerWaalsContact CD-CH2 3.41Å; E465-W500 HydrophobicContact CG-CH2 3.45Å; E465-W500 VanDerWaalsContact CG-CH2 3.45Å; E465-W500 HydrophobicContact CG-CZ2 3.55Å; E465-W500 WeakPolarHBondContact OE1-CH2 3.05Å; E465-W500 VanDerWaalsContact OE1-CZ2 3.23Å; E465-W500 WeakPolarHBondContact OE1-CZ2 3.07Å; E465-R505 IonicContact OE1-NH1 3.95Å; E465-R505 PolarHBondContact OE1-NH1 3.32Å; E465-R505 VanDerWaalsContact OE1-NH1 3.09Å
466	D	80.8	Confident	89.1	Confident	105 Å²	105	78.5 Å²	78.5	56%	0.561	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	111.6	166.6	-176.1	-13.7	0	0	0	109.8	G469 Q470	D466-G469 WeakPolarHBondContact OD1-CA 3.44Å; D466-G469 PolarHBondContact OD1-N 3.03Å; D466-Q470 PolarHBondContact OD1-N 2.77Å
467	N	78.1	Confident	89.3	Confident	36 Å²	36	70.9 Å²	70.9	19%	0.193	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	106.8	169.8	-82.3	16.9	0	0	0	109.5	N384 G469 Q470 Y472	N384-N467 PolarHBondContact OD1-ND2 3Å; N467-G469 VanDerWaalsContact C-N 3.33Å; N467-G469 PolarHBondContact O-N 3.07Å; N467-Q470 PolarHBondContact N-O 3.3Å; N467-Q470 PolarHBondContact O-N 2.92Å; N467-Q470 VanDerWaalsContact O-N 3.13Å; N467-Y472 HydrophobicContact CB-CD2 4.23Å; N467-Y472 HydrophobicContact CB-CE2 4.13Å
468	F	74.4	Confident	89.4	Confident	181 Å²	181	72.5 Å²	72.5	79%	0.794	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	36.2	177.8	-62.8	-84.2	0	0	0	115	L387 Q470	L387-F468 HydrophobicContact CB-CE2 4.45Å; L387-F468 HydrophobicContact CD1-CE2 3.86Å; F468-Q470 VanDerWaalsContact C-N 3.34Å
469	G	78.8	Confident	89.5	Confident	61 Å²	61	71.4 Å²	71.4	63%	0.629	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	10.5	-178.2	0	0	0	0	0	113.6	D466 N467	D466-G469 WeakPolarHBondContact OD1-CA 3.44Å; D466-G469 PolarHBondContact OD1-N 3.03Å; N467-G469 VanDerWaalsContact C-N 3.33Å; N467-G469 PolarHBondContact O-N 3.07Å
470	Q	83.1	Confident	89.5	Confident	118 Å²	118	69.3 Å²	69.3	55%	0.551	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	118.5	171.6	-64.6	-173.3	6.5	0	0	109.3	D466 N467 F468 Y472	D466-Q470 PolarHBondContact OD1-N 2.77Å; N467-Q470 PolarHBondContact N-O 3.3Å; N467-Q470 PolarHBondContact O-N 2.92Å; N467-Q470 VanDerWaalsContact O-N 3.13Å; F468-Q470 VanDerWaalsContact C-N 3.34Å; Q470-Y472 HydrophobicContact CB-CD2 4.46Å; Q470-Y472 HydrophobicContact CB-CE2 3.7Å; Q470-Y472 VanDerWaalsContact O-CD2 3.28Å; Q470-Y472 WeakPolarHBondContact O-CD2 3.37Å; Q470-Y472 WeakPolarHBondContact O-CE2 3.37Å; Q470-Y472 PolarHBondContact OE1-OH 2.88Å
471	T	86.9	Confident	89.4	Confident	94 Å²	94	67 Å²	67	58%	0.577	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	126.6	178	-46.3	0	0	0	0	110.6	D464 E465	D464-T471 HydrophobicContact CB-CG2 3.65Å; E465-T471 CarbonylContact O-C 3.53Å; E465-T471 WeakPolarHBondContact O-CA 3.32Å
472	Y	87.3	Confident	89.3	Confident	121 Å²	121	72.7 Å²	72.7	48%	0.475	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131.6	176.1	-63.5	-86.2	0	0	0	110.4	E465 N467 Q470	E465-Y472 PolarHBondContact N-O 3.37Å; E465-Y472 PolarHBondContact O-N 3.09Å; N467-Y472 HydrophobicContact CB-CD2 4.23Å; N467-Y472 HydrophobicContact CB-CE2 4.13Å; Q470-Y472 HydrophobicContact CB-CD2 4.46Å; Q470-Y472 HydrophobicContact CB-CE2 3.7Å; Q470-Y472 VanDerWaalsContact O-CD2 3.28Å; Q470-Y472 WeakPolarHBondContact O-CD2 3.37Å; Q470-Y472 WeakPolarHBondContact O-CE2 3.37Å; Q470-Y472 PolarHBondContact OE1-OH 2.88Å
473	Q	91.6	Very high	89.3	Confident	117 Å²	117	75.6 Å²	75.6	55%	0.547	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	125.8	177.4	-166.9	177.6	7.8	0	0	110.1	C462 I463	C462-Q473 HydrophobicContact CB-CG 4.02Å; C462-Q473 PolarHBondContact SG-NE2 2.89Å; I463-Q473 CarbonylContact O-C 3.51Å; I463-Q473 WeakPolarHBondContact O-CA 3.41Å
474	V	92.4	Very high	89.4	Confident	45 Å²	45	77.3 Å²	77.3	27%	0.273	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.7	179.3	-176.2	0	0	0	0	109.7	C462 I463 L476	C462-V474 CarbonylContact C-O 3.57Å; C462-V474 WeakPolarHBondContact CA-O 3.31Å; I463-V474 HydrophobicContact CG1-CB 4.15Å; I463-V474 PolarHBondContact N-O 3.19Å; I463-V474 PolarHBondContact O-N 3.43Å; V474-L476 PolarHBondContact O-N 3.34Å
475	D	96.1	Very high	89.8	Confident	66 Å²	66	71.8 Å²	71.8	35%	0.353	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	124	171.8	-97.3	13.2	0	0	0	110.8	K477 S479 G480 S481	D475-K477 VanDerWaalsContact C-N 3.32Å; D475-K477 WeakPolarHBondContact CB-O 3.19Å; D475-S479 WeakPolarHBondContact OD2-CA 3.49Å; D475-S479 PolarHBondContact OD2-N 3.19Å; D475-G480 VanDerWaalsContact CG-N 3.28Å; D475-G480 PolarHBondContact OD2-N 2.88Å; D475-S481 WeakPolarHBondContact OD1-CB 3.14Å; D475-S481 PolarHBondContact OD1-N 2.98Å
476	L	95.6	Very high	90.3	Very high	20 Å²	20	71.9 Å²	71.9	11%	0.105	40%	0.395	C	S	.	.	S	Bend	trans	-74.3	-25.4	176.9	-65.7	175.5	0	0	0	112.5	F461 I463 V474 Y493 L496 V497 W500	F461-L476 VanDerWaalsContact O-CB 3.31Å; F461-L476 WeakPolarHBondContact O-CB 3.4Å; F461-L476 PolarHBondContact O-N 2.94Å; I463-L476 HydrophobicContact CD1-CD2 3.78Å; I463-L476 HydrophobicContact CG1-CD2 3.89Å; I463-L476 HydrophobicContact CG1-CG 4.41Å; I463-L476 HydrophobicContact CG2-CD1 4.25Å; I463-L476 HydrophobicContact CG2-CD2 4.24Å; I463-L476 HydrophobicContact CG2-CG 4.42Å; V474-L476 PolarHBondContact O-N 3.34Å; L476-Y493 HydrophobicContact CD1-CD2 3.81Å; L476-Y493 HydrophobicContact CD1-CE2 3.69Å; L476-L496 HydrophobicContact CB-CB 4.08Å; L476-L496 HydrophobicContact CB-CD1 4.39Å; L476-L496 HydrophobicContact CD1-CB 4.33Å; L476-V497 HydrophobicContact CD1-CG2 3.61Å; L476-W500 HydrophobicContact CD2-CB 3.85Å; L476-W500 HydrophobicContact CD2-CG 4.12Å
477	K	94.6	Very high	91.1	Very high	31 Å²	31	70.1 Å²	70.1	14%	0.135	39%	0.385	C	S	.	.	S	Bend	trans	-149.6	165.1	173.9	71.6	-170.5	-171.9	-168.7	0	109	F461 D475 S479 G480 M483 E492 L496	F461-K477 HydrophobicContact CB-CD 4.39Å; F461-K477 HydrophobicContact CB-CG 4.19Å; F461-K477 HydrophobicContact CD1-CD 3.61Å; F461-K477 VanDerWaalsContact CD1-CE 3.43Å; F461-K477 HydrophobicContact CD1-CG 4.2Å; F461-K477 HydrophobicContact CE1-CD 4.08Å; F461-K477 HydrophobicContact CG-CD 4.12Å; F461-K477 HydrophobicContact CG-CG 4.45Å; F461-K477 VanDerWaalsContact CZ-NZ 3.32Å; D475-K477 VanDerWaalsContact C-N 3.32Å; D475-K477 WeakPolarHBondContact CB-O 3.19Å; K477-S479 PolarHBondContact O-N 3.43Å; K477-G480 WeakPolarHBondContact O-CA 3.47Å; K477-G480 PolarHBondContact O-N 2.66Å; K477-M483 WeakPolarHBondContact CE-SD 3.24Å; K477-E492 VanDerWaalsContact CD-OE1 3.26Å; K477-E492 WeakPolarHBondContact CD-OE1 3.21Å; K477-E492 IonicContact NZ-OE1 3.12Å; K477-E492 PolarHBondContact NZ-OE1 2.84Å; K477-E492 IonicContact NZ-OE2 2.92Å; K477-E492 PolarHBondContact NZ-OE2 2.76Å; K477-L496 HydrophobicContact CB-CD1 4.12Å; K477-L496 HydrophobicContact CD-CD1 3.84Å; K477-L496 HydrophobicContact CG-CD1 4.36Å
478	P	94.9	Very high	91.9	Very high	120 Å²	120	75.7 Å²	75.7	78%	0.779	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	130.3	-178	-25.6	35.2	0	0	0	112.7	G480	P478-G480 VanDerWaalsContact C-N 3.28Å; P478-G480 PolarHBondContact O-N 3.2Å
479	S	94	Very high	93	Very high	72 Å²	72	68.8 Å²	68.8	50%	0.503	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	37.9	-173.8	-62.7	0	0	0	0	113.1	D475 K477 D482 M483	D475-S479 WeakPolarHBondContact OD2-CA 3.49Å; D475-S479 PolarHBondContact OD2-N 3.19Å; K477-S479 PolarHBondContact O-N 3.43Å; S479-D482 PolarHBondContact O-N 2.85Å; S479-M483 WeakPolarHBondContact O-CG 3.21Å; S479-M483 PolarHBondContact O-N 3.36Å
480	G	94.2	Very high	93.9	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-40.7	-175.3	0	0	0	0	0	113.2	F461 D475 K477 P478 D482 M483	F461-G480 CarbonylContact C-O 3.6Å; F461-G480 WeakPolarHBondContact CA-O 3.38Å; F461-G480 WeakPolarHBondContact CB-O 3.39Å; F461-G480 PolarHBondContact N-O 2.92Å; F461-G480 CarbonylContact O-C 3.6Å; F461-G480 VanDerWaalsContact O-CA 3.25Å; F461-G480 WeakPolarHBondContact O-CA 3.31Å; D475-G480 VanDerWaalsContact CG-N 3.28Å; D475-G480 PolarHBondContact OD2-N 2.88Å; K477-G480 WeakPolarHBondContact O-CA 3.47Å; K477-G480 PolarHBondContact O-N 2.66Å; P478-G480 VanDerWaalsContact C-N 3.28Å; P478-G480 PolarHBondContact O-N 3.2Å; G480-D482 PolarHBondContact O-N 2.89Å; G480-M483 PolarHBondContact O-N 3.44Å; G480-M483 VanDerWaalsContact O-N 3.09Å
481	S	94.3	Very high	94.5	Very high	33 Å²	33	67.4 Å²	67.4	23%	0.231	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-31.3	174.3	59.4	0	0	0	0	114.1	R460 D475	R460-S481 VanDerWaalsContact CD-O 3.28Å; R460-S481 WeakPolarHBondContact CD-O 3.42Å; R460-S481 WeakPolarHBondContact CG-O 3.42Å; R460-S481 PolarHBondContact NH1-O 3.34Å; D475-S481 WeakPolarHBondContact OD1-CB 3.14Å; D475-S481 PolarHBondContact OD1-N 2.98Å
482	D	94.6	Very high	95	Very high	119 Å²	119	67.1 Å²	67.1	64%	0.636	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-19.4	177.9	-62.7	-41.9	0	0	0	112.6	S479 G480	S479-D482 PolarHBondContact O-N 2.85Å; G480-D482 PolarHBondContact O-N 2.89Å
483	M	95.8	Very high	95.4	Very high	79 Å²	79	62 Å²	62	39%	0.389	33%	0.329	S	S	.	.	S	Bend	trans	-95.6	112.4	-175.1	-69.3	-173.4	72.6	0	0	112.1	R460 F461 K477 S479 G480	R460-M483 CarbonylContact C-O 3.55Å; R460-M483 WeakPolarHBondContact CA-O 3.22Å; F461-M483 HydrophobicContact CB-CB 4.41Å; F461-M483 HydrophobicContact CD2-CB 4.01Å; F461-M483 PolarHBondContact N-O 2.8Å; K477-M483 WeakPolarHBondContact CE-SD 3.24Å; S479-M483 WeakPolarHBondContact O-CG 3.21Å; S479-M483 PolarHBondContact O-N 3.36Å; G480-M483 PolarHBondContact O-N 3.44Å; G480-M483 VanDerWaalsContact O-N 3.09Å
484	V	96.3	Very high	95.7	Very high	52 Å²	52	56.7 Å²	56.7	32%	0.315	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-72.2	141.6	174.6	-178	0	0	0	0	111.3	L459 N489	L459-V484 CarbonylContact O-C 3.53Å; L459-V484 WeakPolarHBondContact O-CA 3.45Å; V484-N489 PolarHBondContact O-ND2 3.49Å
485	V	97.2	Very high	95.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.316	C	S	.	.			trans	-81.4	119.8	173.3	-175.8	0	0	0	0	109.2	P454 L459 F461 N489 K490 Y493	P454-V485 HydrophobicContact CG-CG1 3.99Å; L459-V485 HydrophobicContact CB-CB 3.91Å; L459-V485 HydrophobicContact CB-CG2 3.87Å; L459-V485 PolarHBondContact O-N 2.94Å; F461-V485 HydrophobicContact CD2-CG2 3.93Å; F461-V485 HydrophobicContact CE2-CG2 3.94Å; V485-N489 VanDerWaalsContact CA-OD1 3.26Å; V485-N489 WeakPolarHBondContact CA-OD1 3.32Å; V485-K490 HydrophobicContact CG1-CB 3.96Å; V485-Y493 HydrophobicContact CG1-CD1 4.16Å; V485-Y493 HydrophobicContact CG1-CG 4.04Å; V485-Y493 HydrophobicContact CG2-CD1 4.2Å; V485-Y493 HydrophobicContact CG2-CD2 3.52Å; V485-Y493 HydrophobicContact CG2-CE2 4.04Å; V485-Y493 HydrophobicContact CG2-CG 3.61Å
486	T	96	Very high	95.9	Very high	40 Å²	40	58.3 Å²	58.3	25%	0.245	31%	0.311	C	S	.	.			trans	-116.2	170.6	179.9	75.9	0	0	0	0	110.4	E488 N489 K490	T486-E488 VanDerWaalsContact CB-OE2 3.25Å; T486-E488 WeakPolarHBondContact CB-OE2 3.37Å; T486-E488 PolarHBondContact O-N 2.84Å; T486-E488 VanDerWaalsContact O-N 3.12Å; T486-E488 PolarHBondContact OG1-N 2.87Å; T486-E488 PolarHBondContact OG1-OE2 3.46Å; T486-N489 PolarHBondContact N-OD1 3.07Å; T486-N489 PolarHBondContact O-N 2.96Å; T486-N489 PolarHBondContact O-OD1 3.27Å; T486-K490 WeakPolarHBondContact O-CB 3.36Å; T486-K490 PolarHBondContact O-N 2.81Å
487	N	96.3	Very high	95.9	Very high	68 Å²	68	57.4 Å²	57.4	36%	0.364	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-29.2	179.5	-169.2	41.3	0	0	0	113.6	K490	N487-K490 WeakPolarHBondContact O-CD 3.34Å; N487-K490 WeakPolarHBondContact OD1-CE 3.18Å; N487-K490 PolarHBondContact OD1-NZ 3.3Å
488	E	96.5	Very high	95.7	Very high	153 Å²	153	56 Å²	56	72%	0.715	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-39.2	179.9	-59.1	67.2	-142.6	0	0	112.7	T486	T486-E488 VanDerWaalsContact CB-OE2 3.25Å; T486-E488 WeakPolarHBondContact CB-OE2 3.37Å; T486-E488 PolarHBondContact O-N 2.84Å; T486-E488 VanDerWaalsContact O-N 3.12Å; T486-E488 PolarHBondContact OG1-N 2.87Å; T486-E488 PolarHBondContact OG1-OE2 3.46Å
489	N	96.5	Very high	95.8	Very high	35 Å²	35	53.4 Å²	53.4	19%	0.187	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-9	-171.6	74.6	25.5	0	0	0	113.9	F461 V484 V485 T486 K491 E492 Y493	F461-N489 HydrophobicContact CE2-CB 4.35Å; F461-N489 WeakPolarHBondContact CE2-OD1 3.33Å; F461-N489 HydrophobicContact CZ-CB 4.1Å; V484-N489 PolarHBondContact O-ND2 3.49Å; V485-N489 VanDerWaalsContact CA-OD1 3.26Å; V485-N489 WeakPolarHBondContact CA-OD1 3.32Å; T486-N489 PolarHBondContact N-OD1 3.07Å; T486-N489 PolarHBondContact O-N 2.96Å; T486-N489 PolarHBondContact O-OD1 3.27Å; N489-K491 PolarHBondContact O-N 3.13Å; N489-E492 VanDerWaalsContact O-CB 3.3Å; N489-E492 WeakPolarHBondContact O-CB 3.28Å; N489-E492 PolarHBondContact O-N 2.83Å; N489-Y493 PolarHBondContact O-N 3.29Å
490	K	96.8	Very high	95.8	Very high	15 Å²	15	51.4 Å²	51.4	7%	0.065	26%	0.259	C	S	.	.	H	α-helix	trans	-52.6	-28.1	-176.9	74.1	-165.9	-165.7	177	0	116.1	I449 L450 N452 P454 V485 T486 N487 Y493 I494	I449-K490 HydrophobicContact CG2-CB 4.14Å; I449-K490 WeakPolarHBondContact O-CD 3.33Å; I449-K490 VanDerWaalsContact O-CE 3.31Å; I449-K490 WeakPolarHBondContact O-CE 2.97Å; I449-K490 PolarHBondContact O-NZ 2.83Å; L450-K490 WeakPolarHBondContact O-CE 3.45Å; L450-K490 PolarHBondContact O-NZ 3.01Å; N452-K490 PolarHBondContact O-NZ 3.3Å; P454-K490 HydrophobicContact CG-CB 4Å; P454-K490 HydrophobicContact CG-CD 4.23Å; V485-K490 HydrophobicContact CG1-CB 3.96Å; T486-K490 WeakPolarHBondContact O-CB 3.36Å; T486-K490 PolarHBondContact O-N 2.81Å; N487-K490 WeakPolarHBondContact O-CD 3.34Å; N487-K490 WeakPolarHBondContact OD1-CE 3.18Å; N487-K490 PolarHBondContact OD1-NZ 3.3Å; K490-Y493 PolarHBondContact O-N 3.24Å; K490-I494 WeakPolarHBondContact O-CD1 3.12Å; K490-I494 VanDerWaalsContact O-CG1 3.29Å; K490-I494 WeakPolarHBondContact O-CG1 3.29Å; K490-I494 PolarHBondContact O-N 3.17Å
491	K	96.3	Very high	95.6	Very high	136 Å²	136	52.7 Å²	52.7	59%	0.591	26%	0.264	S	S	*	.	H	α-helix	trans	-67	-44.8	175.3	-68.4	-178.8	-178.7	174.6	0	111.5	L450 N489 Y493 I494 D495	L450-K491 HydrophobicContact CD1-CG 3.94Å; N489-K491 PolarHBondContact O-N 3.13Å; K491-Y493 VanDerWaalsContact C-N 3.3Å; K491-Y493 PolarHBondContact O-N 3.48Å; K491-I494 PolarHBondContact O-N 3.11Å; K491-D495 WeakPolarHBondContact O-CB 3.37Å; K491-D495 VanDerWaalsContact O-CG 3.31Å; K491-D495 PolarHBondContact O-N 3.08Å
492	E	97.3	Very high	95.5	Very high	87 Å²	87	51.4 Å²	51.4	41%	0.407	25%	0.254	S	S	.	.	H	α-helix	trans	-61.2	-41.5	174.6	-168.9	-158	164.6	0	0	110.5	F461 K477 N489 D495 L496	F461-E492 HydrophobicContact CE1-CB 4.08Å; F461-E492 HydrophobicContact CE1-CG 4.01Å; F461-E492 HydrophobicContact CZ-CB 4.26Å; K477-E492 VanDerWaalsContact CD-OE1 3.26Å; K477-E492 WeakPolarHBondContact CD-OE1 3.21Å; K477-E492 IonicContact NZ-OE1 3.12Å; K477-E492 PolarHBondContact NZ-OE1 2.84Å; K477-E492 IonicContact NZ-OE2 2.92Å; K477-E492 PolarHBondContact NZ-OE2 2.76Å; N489-E492 VanDerWaalsContact O-CB 3.3Å; N489-E492 WeakPolarHBondContact O-CB 3.28Å; N489-E492 PolarHBondContact O-N 2.83Å; E492-D495 PolarHBondContact O-N 3.4Å; E492-L496 HydrophobicContact CG-CD1 4.08Å; E492-L496 WeakPolarHBondContact O-CB 3.45Å; E492-L496 VanDerWaalsContact O-CG 3.25Å; E492-L496 WeakPolarHBondContact O-CG 3.31Å; E492-L496 PolarHBondContact O-N 2.86Å
493	Y	97.1	Very high	95.5	Very high	15 Å²	15	46.4 Å²	46.4	6%	0.059	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-51.3	175.1	171.9	-104.4	0	0	0	111.6	I449 L459 R460 F461 L476 V485 N489 K490 K491 D495 L496 V497	I449-Y493 HydrophobicContact CD1-CE1 4.32Å; L459-Y493 HydrophobicContact CD1-CE1 4.24Å; R460-Y493 WeakPolarHBondContact O-CE2 3.42Å; F461-Y493 HydrophobicContact CD1-CD2 4.32Å; F461-Y493 VanDerWaalsContact CE1-CA 3.47Å; F461-Y493 HydrophobicContact CG-CD2 4.41Å; L476-Y493 HydrophobicContact CD1-CD2 3.81Å; L476-Y493 HydrophobicContact CD1-CE2 3.69Å; V485-Y493 HydrophobicContact CG1-CD1 4.16Å; V485-Y493 HydrophobicContact CG1-CG 4.04Å; V485-Y493 HydrophobicContact CG2-CD1 4.2Å; V485-Y493 HydrophobicContact CG2-CD2 3.52Å; V485-Y493 HydrophobicContact CG2-CE2 4.04Å; V485-Y493 HydrophobicContact CG2-CG 3.61Å; N489-Y493 PolarHBondContact O-N 3.29Å; K490-Y493 PolarHBondContact O-N 3.24Å; K491-Y493 VanDerWaalsContact C-N 3.3Å; K491-Y493 PolarHBondContact O-N 3.48Å; Y493-D495 PolarHBondContact O-N 2.97Å; Y493-L496 PolarHBondContact O-N 2.74Å; Y493-V497 HydrophobicContact CD1-CG2 4.5Å; Y493-V497 HydrophobicContact CD2-CG2 4.29Å; Y493-V497 HydrophobicContact CE1-CG2 4.08Å; Y493-V497 HydrophobicContact CE2-CG2 3.85Å; Y493-V497 WeakPolarHBondContact O-CG2 3.05Å; Y493-V497 PolarHBondContact O-N 2.85Å
494	I	96.1	Very high	95.4	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-59.8	-47.9	178	-68	161.1	0	0	0	111	L432 L446 I449 L450 K490 K491 L496 V497 I498	L432-I494 HydrophobicContact CB-CG2 4.32Å; L432-I494 HydrophobicContact CD1-CG2 4.26Å; L432-I494 HydrophobicContact CD2-CG2 4.28Å; L446-I494 HydrophobicContact CD2-CG1 4.34Å; L446-I494 WeakPolarHBondContact O-CD1 3.2Å; I449-I494 HydrophobicContact CB-CD1 4.43Å; I449-I494 HydrophobicContact CG2-CD1 4.03Å; I449-I494 HydrophobicContact CG2-CG1 4.26Å; L450-I494 HydrophobicContact CB-CD1 3.71Å; L450-I494 HydrophobicContact CD1-CD1 3.95Å; L450-I494 HydrophobicContact CG-CD1 4.38Å; K490-I494 WeakPolarHBondContact O-CD1 3.12Å; K490-I494 VanDerWaalsContact O-CG1 3.29Å; K490-I494 WeakPolarHBondContact O-CG1 3.29Å; K490-I494 PolarHBondContact O-N 3.17Å; K491-I494 PolarHBondContact O-N 3.11Å; I494-L496 VanDerWaalsContact C-N 3.3Å; I494-L496 PolarHBondContact O-N 3.49Å; I494-V497 PolarHBondContact O-N 3.43Å; I494-I498 HydrophobicContact CG2-CG1 4.31Å; I494-I498 WeakPolarHBondContact O-CG1 3.23Å; I494-I498 PolarHBondContact O-N 2.88Å
495	D	95.7	Very high	95.2	Very high	102 Å²	102	47 Å²	47	55%	0.545	23%	0.226	S	C	.	.	H	α-helix	trans	-60.4	-40.6	-179.4	-71.2	-24.9	0	0	0	111.3	K491 E492 Y493 I498 Q499	K491-D495 WeakPolarHBondContact O-CB 3.37Å; K491-D495 VanDerWaalsContact O-CG 3.31Å; K491-D495 PolarHBondContact O-N 3.08Å; E492-D495 PolarHBondContact O-N 3.4Å; Y493-D495 PolarHBondContact O-N 2.97Å; D495-I498 PolarHBondContact O-N 3.26Å; D495-Q499 WeakPolarHBondContact O-CB 3.49Å; D495-Q499 PolarHBondContact O-N 3.15Å
496	L	96.8	Very high	95.2	Very high	44 Å²	44	47.5 Å²	47.5	23%	0.23	23%	0.229	C	C	.	.	H	α-helix	trans	-68.6	-36.9	175.4	-71.2	170.1	0	0	0	113.1	F461 L476 K477 E492 Y493 I494 W500	F461-L496 HydrophobicContact CD1-CD1 3.75Å; F461-L496 HydrophobicContact CE1-CD1 3.91Å; L476-L496 HydrophobicContact CB-CB 4.08Å; L476-L496 HydrophobicContact CB-CD1 4.39Å; L476-L496 HydrophobicContact CD1-CB 4.33Å; K477-L496 HydrophobicContact CB-CD1 4.12Å; K477-L496 HydrophobicContact CD-CD1 3.84Å; K477-L496 HydrophobicContact CG-CD1 4.36Å; E492-L496 HydrophobicContact CG-CD1 4.08Å; E492-L496 WeakPolarHBondContact O-CB 3.45Å; E492-L496 VanDerWaalsContact O-CG 3.25Å; E492-L496 WeakPolarHBondContact O-CG 3.31Å; E492-L496 PolarHBondContact O-N 2.86Å; Y493-L496 PolarHBondContact O-N 2.74Å; I494-L496 VanDerWaalsContact C-N 3.3Å; I494-L496 PolarHBondContact O-N 3.49Å; L496-W500 VanDerWaalsContact O-CB 3.28Å; L496-W500 WeakPolarHBondContact O-CB 3.37Å; L496-W500 PolarHBondContact O-N 3.24Å
497	V	95.6	Very high	95.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-47.3	172.8	167.9	0	0	0	0	111	Y442 L446 I463 L476 Y493 I494 W500 R501	Y442-V497 HydrophobicContact CE1-CG1 3.63Å; Y442-V497 VanDerWaalsContact OH-CG1 3.27Å; Y442-V497 WeakPolarHBondContact OH-CG1 3.41Å; L446-V497 HydrophobicContact CD1-CG1 3.95Å; L446-V497 HydrophobicContact CD2-CG1 4.1Å; I463-V497 HydrophobicContact CG2-CG2 4.29Å; L476-V497 HydrophobicContact CD1-CG2 3.61Å; Y493-V497 HydrophobicContact CD1-CG2 4.5Å; Y493-V497 HydrophobicContact CD2-CG2 4.29Å; Y493-V497 HydrophobicContact CE1-CG2 4.08Å; Y493-V497 HydrophobicContact CE2-CG2 3.85Å; Y493-V497 WeakPolarHBondContact O-CG2 3.05Å; Y493-V497 PolarHBondContact O-N 2.85Å; I494-V497 PolarHBondContact O-N 3.43Å; V497-W500 PolarHBondContact O-N 3.31Å; V497-R501 VanDerWaalsContact O-CB 3.23Å; V497-R501 WeakPolarHBondContact O-CB 3.47Å; V497-R501 PolarHBondContact O-N 3.39Å
498	I	92.3	Very high	95.3	Very high	2 Å²	2	53 Å²	53	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-60.7	-48	177.1	-65.6	-56.8	0	0	0	110.7	I430 L432 M435 L446 I494 D495 W500 R501 F502	I430-I498 HydrophobicContact CB-CG2 4.39Å; I430-I498 HydrophobicContact CG2-CG2 3.99Å; L432-I498 HydrophobicContact CD1-CD1 4.14Å; M435-I498 HydrophobicContact CB-CD1 4.12Å; M435-I498 HydrophobicContact CE-CD1 3.41Å; M435-I498 VanDerWaalsContact CE-CD1 3.41Å; L446-I498 HydrophobicContact CD1-CD1 3.8Å; I494-I498 HydrophobicContact CG2-CG1 4.31Å; I494-I498 WeakPolarHBondContact O-CG1 3.23Å; I494-I498 PolarHBondContact O-N 2.88Å; D495-I498 PolarHBondContact O-N 3.26Å; I498-W500 PolarHBondContact O-N 2.69Å; I498-R501 PolarHBondContact O-N 3.24Å; I498-F502 HydrophobicContact CG2-CD2 4.09Å; I498-F502 PolarHBondContact O-N 2.81Å; I498-F502 VanDerWaalsContact O-N 3.16Å
499	Q	95.2	Very high	95.4	Very high	66 Å²	66	46 Å²	46	31%	0.308	22%	0.215	S	C	.	.	H	α-helix	trans	-59.1	-46	177.9	176.7	59.4	30.4	0	0	111.1	D495 V503 N504	D495-Q499 WeakPolarHBondContact O-CB 3.49Å; D495-Q499 PolarHBondContact O-N 3.15Å; Q499-V503 VanDerWaalsContact NE2-CG1 3.35Å; Q499-V503 WeakPolarHBondContact O-CA 3.41Å; Q499-V503 WeakPolarHBondContact O-CB 3.4Å; Q499-V503 PolarHBondContact O-N 2.77Å; Q499-N504 WeakPolarHBondContact CG-OD1 3.49Å; Q499-N504 PolarHBondContact NE2-OD1 3.38Å; Q499-N504 PolarHBondContact O-N 2.78Å; Q499-N504 PolarHBondContact O-OD1 3.14Å
500	W	94.4	Very high	95.4	Very high	29 Å²	29	44.4 Å²	44.4	11%	0.11	21%	0.207	C	C	.	.	H	α-helix	trans	-65	-47.6	177.8	176	96.1	0	0	0	112.5	I463 E465 L476 L496 V497 I498 F502 N504 R505	I463-W500 HydrophobicContact CD1-CD2 3.15Å; I463-W500 HydrophobicContact CD1-CE3 3.19Å; I463-W500 HydrophobicContact CD1-CG 3.76Å; I463-W500 HydrophobicContact CD1-CH2 3.65Å; I463-W500 HydrophobicContact CD1-CZ2 3.59Å; I463-W500 HydrophobicContact CD1-CZ3 3.46Å; I463-W500 VanDerWaalsContact CD1-CZ3 3.46Å; E465-W500 VanDerWaalsContact CD-CH2 3.41Å; E465-W500 HydrophobicContact CG-CH2 3.45Å; E465-W500 VanDerWaalsContact CG-CH2 3.45Å; E465-W500 HydrophobicContact CG-CZ2 3.55Å; E465-W500 WeakPolarHBondContact OE1-CH2 3.05Å; E465-W500 VanDerWaalsContact OE1-CZ2 3.23Å; E465-W500 WeakPolarHBondContact OE1-CZ2 3.07Å; L476-W500 HydrophobicContact CD2-CB 3.85Å; L476-W500 HydrophobicContact CD2-CG 4.12Å; L496-W500 VanDerWaalsContact O-CB 3.28Å; L496-W500 WeakPolarHBondContact O-CB 3.37Å; L496-W500 PolarHBondContact O-N 3.24Å; V497-W500 PolarHBondContact O-N 3.31Å; I498-W500 PolarHBondContact O-N 2.69Å; W500-F502 VanDerWaalsContact C-N 3.34Å; W500-F502 PolarHBondContact O-N 3.25Å; W500-N504 PolarHBondContact O-N 3.37Å; W500-R505 HydrophobicContact CZ2-CB 4.41Å; W500-R505 PolarHBondContact O-N 2.83Å
501	R	91.1	Very high	95.5	Very high	28 Å²	28	47.9 Å²	47.9	11%	0.106	23%	0.226	C	C	.	.	H	α-helix	trans	-67	-31	-171.8	175.6	58	178.5	75.6	4	113.6	M435 V497 I498 R505	M435-R501 HydrophobicContact CE-CB 4.35Å; M435-R501 HydrophobicContact CE-CG 3.88Å; V497-R501 VanDerWaalsContact O-CB 3.23Å; V497-R501 WeakPolarHBondContact O-CB 3.47Å; V497-R501 PolarHBondContact O-N 3.39Å; I498-R501 PolarHBondContact O-N 3.24Å; R501-R505 PolarHBondContact O-NE 2.87Å; R501-R505 VanDerWaalsContact O-NE 3.15Å
502	F	90.7	Very high	95.6	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-108.9	-24.2	-178.4	-67.7	-56.1	0	0	0	115	I418 P420 M424 I430 M435 V438 I498 W500 V506	I418-F502 HydrophobicContact CD1-CD1 3.86Å; I418-F502 HydrophobicContact CD1-CE1 3.81Å; P420-F502 HydrophobicContact CB-CB 4.15Å; P420-F502 HydrophobicContact CB-CD1 3.77Å; P420-F502 HydrophobicContact CB-CE1 4.32Å; P420-F502 HydrophobicContact CB-CG 3.92Å; P420-F502 HydrophobicContact CG-CD1 3.74Å; P420-F502 HydrophobicContact CG-CD2 4.19Å; P420-F502 HydrophobicContact CG-CE1 3.8Å; P420-F502 HydrophobicContact CG-CE2 4.22Å; P420-F502 HydrophobicContact CG-CG 3.95Å; P420-F502 HydrophobicContact CG-CZ 4.04Å; M424-F502 VanDerWaalsContact SD-O 3.33Å; I430-F502 HydrophobicContact CD1-CB 3.97Å; I430-F502 HydrophobicContact CG2-CB 4.32Å; I430-F502 HydrophobicContact CG2-CD2 3.76Å; I430-F502 HydrophobicContact CG2-CE2 4.44Å; I430-F502 HydrophobicContact CG2-CG 4.27Å; M435-F502 HydrophobicContact CB-CE2 4.33Å; M435-F502 HydrophobicContact CE-CE2 3.69Å; M435-F502 HydrophobicContact CE-CZ 3.98Å; M435-F502 HydrophobicContact SD-CE2 3.86Å; M435-F502 HydrophobicContact SD-CZ 3.57Å; M435-F502 VanDerWaalsContact SD-CZ 3.57Å; V438-F502 HydrophobicContact CB-CE1 4.21Å; V438-F502 HydrophobicContact CB-CZ 4.13Å; V438-F502 HydrophobicContact CG1-CE1 4Å; V438-F502 HydrophobicContact CG1-CZ 4.35Å; V438-F502 HydrophobicContact CG2-CE1 4.08Å; V438-F502 HydrophobicContact CG2-CZ 4.11Å; I498-F502 HydrophobicContact CG2-CD2 4.09Å; I498-F502 PolarHBondContact O-N 2.81Å; I498-F502 VanDerWaalsContact O-N 3.16Å; W500-F502 VanDerWaalsContact C-N 3.34Å; W500-F502 PolarHBondContact O-N 3.25Å; F502-V506 WeakPolarHBondContact O-CG2 3.43Å
503	V	94.8	Very high	95.7	Very high	14 Å²	14	37.9 Å²	37.9	9%	0.085	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-65.5	-172.5	-173.4	0	0	0	0	111.4	M424 I430 Q499 R505 V506 Q507	M424-V503 HydrophobicContact CE-CB 4.42Å; M424-V503 HydrophobicContact CE-CG1 4.11Å; I430-V503 HydrophobicContact CD1-CG2 3.59Å; Q499-V503 VanDerWaalsContact NE2-CG1 3.35Å; Q499-V503 WeakPolarHBondContact O-CA 3.41Å; Q499-V503 WeakPolarHBondContact O-CB 3.4Å; Q499-V503 PolarHBondContact O-N 2.77Å; V503-R505 PolarHBondContact O-N 3.3Å; V503-V506 CarbonylContact O-C 3.5Å; V503-V506 PolarHBondContact O-N 2.92Å; V503-V506 VanDerWaalsContact O-N 3.14Å; V503-Q507 PolarHBondContact O-N 3.19Å
504	N	94.3	Very high	95.7	Very high	88 Å²	88	38.6 Å²	38.6	47%	0.471	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-59.5	-44.3	-164.9	-63.4	24.4	0	0	0	112.6	Q499 W500 V506	Q499-N504 WeakPolarHBondContact CG-OD1 3.49Å; Q499-N504 PolarHBondContact NE2-OD1 3.38Å; Q499-N504 PolarHBondContact O-N 2.78Å; Q499-N504 PolarHBondContact O-OD1 3.14Å; W500-N504 PolarHBondContact O-N 3.37Å; N504-V506 VanDerWaalsContact C-N 3.28Å; N504-V506 PolarHBondContact O-N 3.08Å
505	R	93.1	Very high	95.8	Very high	54 Å²	54	43.2 Å²	43.2	20%	0.204	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-73.1	-12.8	-176.4	75	-173.6	-159.8	141.4	11.3	115.2	E370 P383 E465 W500 R501 V503	E370-R505 IonicContact OE1-NH2 3.15Å; P383-R505 HydrophobicContact CB-CB 4.31Å; P383-R505 HydrophobicContact CB-CG 4.06Å; P383-R505 HydrophobicContact CG-CG 4.05Å; E465-R505 IonicContact OE1-NH1 3.95Å; E465-R505 PolarHBondContact OE1-NH1 3.32Å; E465-R505 VanDerWaalsContact OE1-NH1 3.09Å; W500-R505 HydrophobicContact CZ2-CB 4.41Å; W500-R505 PolarHBondContact O-N 2.83Å; R501-R505 PolarHBondContact O-NE 2.87Å; R501-R505 VanDerWaalsContact O-NE 3.15Å; V503-R505 PolarHBondContact O-N 3.3Å
506	V	96	Very high	95.9	Very high	11 Å²	11	38.3 Å²	38.3	7%	0.067	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-122.6	8.4	178.8	-62.6	0	0	0	0	113.6	I381 P383 M424 F502 V503 N504 K508 Q509 M510	I381-V506 HydrophobicContact CB-CB 4.14Å; I381-V506 HydrophobicContact CB-CG1 3.91Å; I381-V506 HydrophobicContact CG2-CB 3.87Å; I381-V506 HydrophobicContact CG2-CG1 3.68Å; P383-V506 HydrophobicContact CB-CG1 4.31Å; P383-V506 HydrophobicContact CG-CG1 4.19Å; M424-V506 HydrophobicContact CE-CG2 4.05Å; M424-V506 HydrophobicContact SD-CG2 4.27Å; F502-V506 WeakPolarHBondContact O-CG2 3.43Å; V503-V506 CarbonylContact O-C 3.5Å; V503-V506 PolarHBondContact O-N 2.92Å; V503-V506 VanDerWaalsContact O-N 3.14Å; N504-V506 VanDerWaalsContact C-N 3.28Å; N504-V506 PolarHBondContact O-N 3.08Å; V506-K508 VanDerWaalsContact C-N 3.33Å; V506-K508 PolarHBondContact O-N 2.91Å; V506-Q509 VanDerWaalsContact C-OE1 3.25Å; V506-Q509 WeakPolarHBondContact O-CB 3.47Å; V506-Q509 PolarHBondContact O-N 3.4Å; V506-Q509 PolarHBondContact O-OE1 3.47Å; V506-M510 PolarHBondContact O-N 3.25Å
507	Q	96.6	Very high	95.9	Very high	69 Å²	69	36.2 Å²	36.2	32%	0.322	17%	0.172	S	C	.	.	H	α-helix	trans	-61.6	-36.9	-171.1	-172.8	66.4	71.4	0	0	113.1	V503 N511	V503-Q507 PolarHBondContact O-N 3.19Å; Q507-N511 PolarHBondContact NE2-OD1 2.7Å; Q507-N511 VanDerWaalsContact O-CB 3.28Å; Q507-N511 WeakPolarHBondContact O-CB 3.25Å; Q507-N511 PolarHBondContact O-N 3Å; Q507-N511 PolarHBondContact O-ND2 3.41Å; Q507-N511 PolarHBondContact O-OD1 3.1Å
508	K	97.8	Very high	96	Very high	154 Å²	154	39 Å²	39	67%	0.67	19%	0.188	S	C	*	.	H	α-helix	trans	-66.4	-43.8	-179.8	-64	-179.9	-177.6	173.9	0	111.1	L393 V506 N511 A512	L393-K508 HydrophobicContact CD2-CB 3.9Å; V506-K508 VanDerWaalsContact C-N 3.33Å; V506-K508 PolarHBondContact O-N 2.91Å; K508-N511 PolarHBondContact O-N 2.85Å; K508-A512 PolarHBondContact O-N 2.81Å
509	Q	98.2	Very high	96.1	Very high	8 Å²	8	41.2 Å²	41.2	4%	0.037	20%	0.199	C	C	.	.	H	α-helix	trans	-63.1	-49.4	177.7	-61.8	88.3	-35	0	0	110.9	I381 P383 S385 L393 F396 V506 N511 A512 F513	I381-Q509 HydrophobicContact CD1-CB 4.14Å; I381-Q509 HydrophobicContact CG2-CB 3.69Å; I381-Q509 HydrophobicContact CG2-CG 3.83Å; P383-Q509 PolarHBondContact O-NE2 2.89Å; P383-Q509 VanDerWaalsContact O-NE2 3.14Å; S385-Q509 PolarHBondContact OG-NE2 3.26Å; L393-Q509 HydrophobicContact CD2-CG 4.34Å; F396-Q509 HydrophobicContact CD1-CB 4.26Å; F396-Q509 HydrophobicContact CD2-CB 3.62Å; F396-Q509 HydrophobicContact CD2-CG 3.68Å; F396-Q509 HydrophobicContact CE1-CB 4.24Å; F396-Q509 HydrophobicContact CE2-CB 3.61Å; F396-Q509 HydrophobicContact CE2-CG 3.35Å; F396-Q509 HydrophobicContact CG-CB 3.98Å; F396-Q509 HydrophobicContact CZ-CB 3.93Å; F396-Q509 HydrophobicContact CZ-CG 3.95Å; V506-Q509 VanDerWaalsContact C-OE1 3.25Å; V506-Q509 WeakPolarHBondContact O-CB 3.47Å; V506-Q509 PolarHBondContact O-N 3.4Å; V506-Q509 PolarHBondContact O-OE1 3.47Å; Q509-N511 PolarHBondContact O-N 2.64Å; Q509-A512 PolarHBondContact O-N 2.84Å; Q509-F513 PolarHBondContact O-N 3.42Å
510	M	98	Very high	96.1	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-63.9	-38.3	176.6	178.8	57.6	68.1	0	0	112.2	I381 F421 M424 M425 V506 F513 L514	I381-M510 HydrophobicContact CD1-CB 4.31Å; I381-M510 HydrophobicContact CD1-CE 4.1Å; F421-M510 HydrophobicContact CD1-CE 4.5Å; F421-M510 HydrophobicContact CD2-CE 3.47Å; F421-M510 VanDerWaalsContact CD2-CE 3.47Å; F421-M510 HydrophobicContact CE2-CE 3.55Å; F421-M510 HydrophobicContact CG-CE 3.97Å; F421-M510 HydrophobicContact CZ-CE 4.12Å; M424-M510 HydrophobicContact CB-CE 3.93Å; M424-M510 HydrophobicContact CB-CG 4.08Å; M424-M510 HydrophobicContact CB-SD 4.28Å; M424-M510 HydrophobicContact CE-CB 3.65Å; M424-M510 HydrophobicContact CE-CG 3.67Å; M424-M510 HydrophobicContact SD-CB 4.46Å; M424-M510 HydrophobicContact SD-CE 3.94Å; M424-M510 HydrophobicContact SD-CG 4.24Å; M425-M510 HydrophobicContact CG-CE 4.45Å; M425-M510 HydrophobicContact CG-SD 4.11Å; V506-M510 PolarHBondContact O-N 3.25Å; M510-F513 PolarHBondContact O-N 3.08Å; M510-F513 HydrophobicContact SD-CD1 3.97Å; M510-L514 HydrophobicContact CG-CD1 4.07Å; M510-L514 HydrophobicContact CG-CG 4.45Å; M510-L514 WeakPolarHBondContact O-CB 3.31Å; M510-L514 PolarHBondContact O-N 2.88Å; M510-L514 HydrophobicContact SD-CD1 4.04Å; M510-L514 HydrophobicContact SD-CG 3.92Å
511	N	98.3	Very high	96.2	Very high	87 Å²	87	36.8 Å²	36.8	47%	0.465	18%	0.18	S	C	.	.	H	α-helix	trans	-61.3	-46.1	175.1	-75.3	-4.1	0	0	0	111.6	Q507 K508 Q509 L514 E515	Q507-N511 PolarHBondContact NE2-OD1 2.7Å; Q507-N511 VanDerWaalsContact O-CB 3.28Å; Q507-N511 WeakPolarHBondContact O-CB 3.25Å; Q507-N511 PolarHBondContact O-N 3Å; Q507-N511 PolarHBondContact O-ND2 3.41Å; Q507-N511 PolarHBondContact O-OD1 3.1Å; K508-N511 PolarHBondContact O-N 2.85Å; Q509-N511 PolarHBondContact O-N 2.64Å; N511-L514 PolarHBondContact O-N 3.45Å; N511-E515 WeakPolarHBondContact O-CB 3.43Å; N511-E515 PolarHBondContact O-N 3.48Å
512	A	98.5	Very high	96.4	Very high	9 Å²	9	38.7 Å²	38.7	7%	0.074	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-42.1	177.3	0	0	0	0	0	112	L393 F396 K397 K508 Q509 E515 G516	L393-A512 HydrophobicContact CB-CB 4.28Å; L393-A512 WeakPolarHBondContact O-CB 3.05Å; F396-A512 HydrophobicContact CB-CB 3.96Å; K397-A512 VanDerWaalsContact CA-O 3.25Å; K397-A512 WeakPolarHBondContact CA-O 3.24Å; K397-A512 HydrophobicContact CB-CB 4.41Å; K508-A512 PolarHBondContact O-N 2.81Å; Q509-A512 PolarHBondContact O-N 2.84Å; A512-E515 WeakPolarHBondContact O-CB 3.5Å; A512-E515 PolarHBondContact O-N 3.34Å; A512-G516 PolarHBondContact O-N 2.97Å; A512-G516 VanDerWaalsContact O-N 3.09Å
513	F	98.5	Very high	96.5	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.018	21%	0.206	C	C	.	.	H	α-helix	trans	-59.6	-48	173.3	174.1	-90.5	0	0	0	112.2	F396 I399 G400 A403 F421 M425 Q509 M510 E515 G516 F517 M538	F396-F513 HydrophobicContact CB-CB 4.39Å; F396-F513 WeakPolarHBondContact O-CA 3.43Å; I399-F513 HydrophobicContact CB-CD2 4.48Å; I399-F513 HydrophobicContact CG2-CD2 4.1Å; I399-F513 HydrophobicContact CG2-CE2 4.02Å; G400-F513 VanDerWaalsContact CA-O 3.25Å; G400-F513 WeakPolarHBondContact CA-O 2.91Å; A403-F513 HydrophobicContact CB-CE2 3.98Å; A403-F513 HydrophobicContact CB-CZ 3.92Å; F421-F513 HydrophobicContact CE1-CE1 4.14Å; F421-F513 HydrophobicContact CE1-CZ 4.14Å; F421-F513 HydrophobicContact CZ-CD1 4.18Å; F421-F513 HydrophobicContact CZ-CD2 4.47Å; F421-F513 AromaticContact CZ-CE1 3.83Å; F421-F513 HydrophobicContact CZ-CE1 3.83Å; F421-F513 HydrophobicContact CZ-CE2 4.14Å; F421-F513 HydrophobicContact CZ-CG 4.5Å; F421-F513 AromaticContact CZ-CZ 3.81Å; F421-F513 HydrophobicContact CZ-CZ 3.81Å; M425-F513 HydrophobicContact CE-CE1 3.79Å; M425-F513 HydrophobicContact CE-CZ 4.34Å; M425-F513 HydrophobicContact CG-CE1 4.13Å; M425-F513 HydrophobicContact SD-CE1 3.72Å; M425-F513 HydrophobicContact SD-CZ 4.32Å; Q509-F513 PolarHBondContact O-N 3.42Å; M510-F513 PolarHBondContact O-N 3.08Å; M510-F513 HydrophobicContact SD-CD1 3.97Å; F513-E515 VanDerWaalsContact C-N 3.35Å; F513-E515 PolarHBondContact O-N 3.37Å; F513-G516 PolarHBondContact O-N 3.21Å; F513-F517 WeakPolarHBondContact O-CB 3.22Å; F513-F517 PolarHBondContact O-N 3.25Å; F513-M538 HydrophobicContact CZ-CE 4.27Å
514	L	98	Very high	96.5	Very high	31 Å²	31	45.3 Å²	45.3	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-65.9	-34.6	177.4	-79.2	174.4	0	0	0	113	M425 M510 N511 F517 T518 I523	M425-L514 HydrophobicContact CB-CD2 4.18Å; M425-L514 HydrophobicContact CG-CD2 4.08Å; M510-L514 HydrophobicContact CG-CD1 4.07Å; M510-L514 HydrophobicContact CG-CG 4.45Å; M510-L514 WeakPolarHBondContact O-CB 3.31Å; M510-L514 PolarHBondContact O-N 2.88Å; M510-L514 HydrophobicContact SD-CD1 4.04Å; M510-L514 HydrophobicContact SD-CG 3.92Å; N511-L514 PolarHBondContact O-N 3.45Å; L514-F517 PolarHBondContact O-N 2.73Å; L514-T518 VanDerWaalsContact O-CB 3.31Å; L514-T518 WeakPolarHBondContact O-CB 3.38Å; L514-T518 VanDerWaalsContact O-CG2 3.28Å; L514-T518 WeakPolarHBondContact O-CG2 3.39Å; L514-T518 PolarHBondContact O-N 3.44Å; L514-T518 PolarHBondContact O-OG1 2.88Å; L514-I523 HydrophobicContact CD2-CD1 4.13Å
515	E	97.8	Very high	96.5	Very high	100 Å²	100	42.2 Å²	42.2	47%	0.467	21%	0.214	S	C	.	.	H	α-helix	trans	-58.4	-51.4	172.1	-170.4	-169.8	158.9	0	0	110.6	K397 N511 A512 F513 F517 T518 E519	K397-E515 HydrophobicContact CD-CG 4.37Å; K397-E515 IonicContact NZ-OE1 2.76Å; K397-E515 PolarHBondContact NZ-OE1 3.31Å; N511-E515 WeakPolarHBondContact O-CB 3.43Å; N511-E515 PolarHBondContact O-N 3.48Å; A512-E515 WeakPolarHBondContact O-CB 3.5Å; A512-E515 PolarHBondContact O-N 3.34Å; F513-E515 VanDerWaalsContact C-N 3.35Å; F513-E515 PolarHBondContact O-N 3.37Å; E515-F517 PolarHBondContact O-N 3.29Å; E515-T518 PolarHBondContact O-N 2.83Å; E515-T518 PolarHBondContact O-OG1 3.17Å; E515-E519 WeakPolarHBondContact O-CG 3.29Å; E515-E519 PolarHBondContact O-N 2.83Å
516	G	97.8	Very high	96.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-38.7	176.9	0	0	0	0	0	113.9	K397 G400 R401 A512 F513	K397-G516 WeakPolarHBondContact O-CA 3.42Å; G400-G516 VanDerWaalsContact C-C 3.41Å; R401-G516 WeakPolarHBondContact CA-O 3.38Å; A512-G516 PolarHBondContact O-N 2.97Å; A512-G516 VanDerWaalsContact O-N 3.09Å; F513-G516 PolarHBondContact O-N 3.21Å
517	F	97.9	Very high	96.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.7	-44.4	179.1	-173.3	-88.5	0	0	0	112	G400 A403 V407 M425 F513 L514 E515 E519 L520 I521 I526 M538	G400-F517 VanDerWaalsContact O-CA 3.24Å; G400-F517 WeakPolarHBondContact O-CA 3.43Å; G400-F517 PolarHBondContact O-N 2.94Å; A403-F517 HydrophobicContact CB-CD2 3.84Å; A403-F517 HydrophobicContact CB-CE2 4.18Å; V407-F517 HydrophobicContact CG2-CE2 4.09Å; V407-F517 HydrophobicContact CG2-CZ 4.26Å; M425-F517 HydrophobicContact CE-CD1 4.45Å; M425-F517 HydrophobicContact CE-CD2 4.24Å; M425-F517 HydrophobicContact CE-CE1 4.27Å; M425-F517 HydrophobicContact CE-CE2 4.06Å; M425-F517 HydrophobicContact CE-CG 4.44Å; M425-F517 HydrophobicContact CE-CZ 4.07Å; F513-F517 WeakPolarHBondContact O-CB 3.22Å; F513-F517 PolarHBondContact O-N 3.25Å; L514-F517 PolarHBondContact O-N 2.73Å; E515-F517 PolarHBondContact O-N 3.29Å; F517-E519 PolarHBondContact O-N 3.44Å; F517-L520 PolarHBondContact O-N 2.79Å; F517-L520 VanDerWaalsContact O-N 3.1Å; F517-I521 HydrophobicContact CD1-CB 4.09Å; F517-I521 HydrophobicContact CE1-CB 3.59Å; F517-I521 HydrophobicContact CE1-CG1 4.16Å; F517-I521 HydrophobicContact CE1-CG2 3.75Å; F517-I521 HydrophobicContact CZ-CB 4.03Å; F517-I521 HydrophobicContact CZ-CG1 4.1Å; F517-I521 HydrophobicContact CZ-CG2 4.14Å; F517-I521 PolarHBondContact O-N 2.9Å; F517-I526 HydrophobicContact CE1-CD1 4.01Å; F517-I526 HydrophobicContact CE1-CG2 3.91Å; F517-I526 HydrophobicContact CZ-CG2 4.11Å; F517-M538 HydrophobicContact CE2-SD 4.42Å
518	T	96.6	Very high	96.1	Very high	57 Å²	57	43.4 Å²	43.4	35%	0.35	22%	0.22	S	C	.	.	H	α-helix	trans	-78	-17.1	-173.5	56.4	0	0	0	0	114.7	L514 E515 L520 I521 I523	L514-T518 VanDerWaalsContact O-CB 3.31Å; L514-T518 WeakPolarHBondContact O-CB 3.38Å; L514-T518 VanDerWaalsContact O-CG2 3.28Å; L514-T518 WeakPolarHBondContact O-CG2 3.39Å; L514-T518 PolarHBondContact O-N 3.44Å; L514-T518 PolarHBondContact O-OG1 2.88Å; E515-T518 PolarHBondContact O-N 2.83Å; E515-T518 PolarHBondContact O-OG1 3.17Å; T518-L520 PolarHBondContact O-N 3.44Å; T518-I521 WeakPolarHBondContact CA-O 3.38Å; T518-I523 HydrophobicContact CG2-CB 4.03Å; T518-I523 HydrophobicContact CG2-CD1 3.76Å; T518-I523 HydrophobicContact CG2-CG1 4.47Å
519	E	95.4	Very high	95.6	Very high	50 Å²	50	36.3 Å²	36.3	23%	0.234	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.2	163.5	-76.6	176.2	175.1	0	0	112.2	P327 K331 K397 R401 E515 F517	P327-E519 HydrophobicContact CB-CB 3.87Å; P327-E519 HydrophobicContact CB-CG 4.3Å; P327-E519 WeakPolarHBondContact CB-OE2 3.41Å; P327-E519 HydrophobicContact CG-CB 4.21Å; P327-E519 VanDerWaalsContact CG-CD 3.46Å; P327-E519 HydrophobicContact CG-CG 4.06Å; P327-E519 WeakPolarHBondContact CG-OE2 3.46Å; K331-E519 PolarHBondContact NZ-O 2.93Å; K397-E519 WeakPolarHBondContact CE-OE1 3.16Å; K397-E519 IonicContact NZ-OE1 3.17Å; K397-E519 PolarHBondContact NZ-OE1 2.86Å; R401-E519 IonicContact CZ-OE1 2.81Å; R401-E519 IonicContact CZ-OE2 3.97Å; R401-E519 IonicContact NE-OE2 3.71Å; R401-E519 PolarHBondContact NE-OE2 3.4Å; R401-E519 VanDerWaalsContact NH2-CD 3.35Å; R401-E519 IonicContact NH2-OE1 2.7Å; R401-E519 PolarHBondContact NH2-OE1 2.76Å; R401-E519 IonicContact NH2-OE2 3.01Å; R401-E519 PolarHBondContact NH2-OE2 3.45Å; E515-E519 WeakPolarHBondContact O-CG 3.29Å; E515-E519 PolarHBondContact O-N 2.83Å; F517-E519 PolarHBondContact O-N 3.44Å
520	L	95	Very high	94.8	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-43.1	-177.7	-59.7	179.3	0	0	0	113.7	P327 L330 K331 R401 M405 F517 T518	P327-L520 HydrophobicContact CB-CD2 4.42Å; P327-L520 WeakPolarHBondContact O-CD2 3.49Å; L330-L520 HydrophobicContact CB-CD1 4.25Å; L330-L520 HydrophobicContact CB-CD2 4.01Å; L330-L520 HydrophobicContact CD1-CD1 4.12Å; L330-L520 HydrophobicContact CD1-CD2 4.39Å; K331-L520 WeakPolarHBondContact CE-O 3.34Å; K331-L520 HydrophobicContact CG-CD2 4.11Å; K331-L520 PolarHBondContact NZ-O 3.5Å; R401-L520 VanDerWaalsContact O-CD1 3.3Å; R401-L520 WeakPolarHBondContact O-CD1 3.42Å; M405-L520 HydrophobicContact CB-CD1 4.34Å; M405-L520 HydrophobicContact CG-CD1 3.49Å; M405-L520 VanDerWaalsContact CG-CD1 3.49Å; F517-L520 PolarHBondContact O-N 2.79Å; F517-L520 VanDerWaalsContact O-N 3.1Å; T518-L520 PolarHBondContact O-N 3.44Å
521	I	96.4	Very high	93.9	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	-117	111.9	-175.7	-55.6	-61.2	0	0	0	110	F290 L294 V407 F408 F517 T518 I523 I526	F290-I521 HydrophobicContact CE2-CG2 3.95Å; F290-I521 HydrophobicContact CZ-CD1 4.36Å; F290-I521 HydrophobicContact CZ-CG2 3.94Å; L294-I521 HydrophobicContact CD1-CD1 4.01Å; L294-I521 HydrophobicContact CD2-CD1 3.84Å; V407-I521 HydrophobicContact CB-CD1 4.34Å; V407-I521 HydrophobicContact CB-CG1 4.28Å; V407-I521 HydrophobicContact CG1-CD1 3.99Å; V407-I521 HydrophobicContact CG1-CG1 4.12Å; F408-I521 HydrophobicContact CB-CD1 3.83Å; F408-I521 HydrophobicContact CD2-CD1 4.2Å; F517-I521 HydrophobicContact CD1-CB 4.09Å; F517-I521 HydrophobicContact CE1-CB 3.59Å; F517-I521 HydrophobicContact CE1-CG1 4.16Å; F517-I521 HydrophobicContact CE1-CG2 3.75Å; F517-I521 HydrophobicContact CZ-CB 4.03Å; F517-I521 HydrophobicContact CZ-CG1 4.1Å; F517-I521 HydrophobicContact CZ-CG2 4.14Å; F517-I521 PolarHBondContact O-N 2.9Å; T518-I521 WeakPolarHBondContact CA-O 3.38Å; I521-I523 PolarHBondContact O-N 3.4Å; I521-I526 HydrophobicContact CG2-CG2 3.66Å
522	P	94.8	Very high	92.7	Very high	67 Å²	67	38 Å²	38	44%	0.435	20%	0.198	S	C	.	.			trans	-55.7	129.8	175.7	-25.5	33.2	0	0	0	112.3	D524 L525	P522-D524 VanDerWaalsContact C-N 3.26Å; P522-D524 PolarHBondContact O-N 2.99Å; P522-L525 HydrophobicContact CB-CD1 4.23Å; P522-L525 HydrophobicContact CB-CG 4.18Å; P522-L525 HydrophobicContact CG-CD1 4.06Å; P522-L525 WeakPolarHBondContact O-CB 3.37Å; P522-L525 PolarHBondContact O-N 3.39Å
523	I	93.4	Very high	91.9	Very high	48 Å²	48	38.1 Å²	38.1	25%	0.246	20%	0.197	C	C	.	.	H	α-helix	trans	-57.7	-36.2	-172.8	-162.7	76.6	0	0	0	113.1	L514 T518 I521 L525 I526 K527	L514-I523 HydrophobicContact CD2-CD1 4.13Å; T518-I523 HydrophobicContact CG2-CB 4.03Å; T518-I523 HydrophobicContact CG2-CD1 3.76Å; T518-I523 HydrophobicContact CG2-CG1 4.47Å; I521-I523 PolarHBondContact O-N 3.4Å; I523-L525 PolarHBondContact O-N 3.05Å; I523-I526 HydrophobicContact CD1-CD1 3.86Å; I523-I526 HydrophobicContact CD1-CG1 4.16Å; I523-I526 WeakPolarHBondContact O-CG1 3.26Å; I523-I526 PolarHBondContact O-N 3.34Å; I523-I526 VanDerWaalsContact O-N 3.13Å; I523-K527 PolarHBondContact O-N 2.99Å
524	D	94.4	Very high	91.4	Very high	111 Å²	111	38 Å²	38	59%	0.594	20%	0.197	S	C	*	.	H	α-helix	trans	-69.1	-20.3	-180	-56.2	-42.1	0	0	0	113	P522	P522-D524 VanDerWaalsContact C-N 3.26Å; P522-D524 PolarHBondContact O-N 2.99Å
525	L	94.8	Very high	90.6	Very high	24 Å²	24	38.8 Å²	38.8	13%	0.126	20%	0.199	C	C	.	.	H	α-helix	trans	-78.3	-25.2	174	-66	-176.2	0	0	0	112.4	Y289 F290 K293 L294 P522 I523 I528	Y289-L525 HydrophobicContact CE1-CD2 4.4Å; F290-L525 HydrophobicContact CD2-CB 3.75Å; F290-L525 VanDerWaalsContact CD2-O 3.3Å; F290-L525 WeakPolarHBondContact CD2-O 3.42Å; F290-L525 HydrophobicContact CE2-CB 3.76Å; K293-L525 HydrophobicContact CB-CD1 3.77Å; K293-L525 HydrophobicContact CB-CD2 3.72Å; K293-L525 HydrophobicContact CB-CG 4.44Å; K293-L525 HydrophobicContact CG-CD2 3.98Å; L294-L525 HydrophobicContact CD2-CD1 4.03Å; P522-L525 HydrophobicContact CB-CD1 4.23Å; P522-L525 HydrophobicContact CB-CG 4.18Å; P522-L525 HydrophobicContact CG-CD1 4.06Å; P522-L525 WeakPolarHBondContact O-CB 3.37Å; P522-L525 PolarHBondContact O-N 3.39Å; I523-L525 PolarHBondContact O-N 3.05Å; L525-I528 WeakPolarHBondContact O-CG1 3.46Å
526	I	93.7	Very high	89.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-85.3	-27.2	172.2	64.3	160.5	0	0	0	112.8	F290 M425 L426 F517 I521 I523 I528 F529 L534	F290-I526 HydrophobicContact CE2-CG2 4.18Å; M425-I526 HydrophobicContact CB-CD1 4.47Å; M425-I526 HydrophobicContact CE-CD1 4.28Å; L426-I526 HydrophobicContact CD2-CD1 4.4Å; L426-I526 HydrophobicContact CD2-CG1 4.39Å; L426-I526 WeakPolarHBondContact CD2-O 3.38Å; F517-I526 HydrophobicContact CE1-CD1 4.01Å; F517-I526 HydrophobicContact CE1-CG2 3.91Å; F517-I526 HydrophobicContact CZ-CG2 4.11Å; I521-I526 HydrophobicContact CG2-CG2 3.66Å; I523-I526 HydrophobicContact CD1-CD1 3.86Å; I523-I526 HydrophobicContact CD1-CG1 4.16Å; I523-I526 WeakPolarHBondContact O-CG1 3.26Å; I523-I526 PolarHBondContact O-N 3.34Å; I523-I526 VanDerWaalsContact O-N 3.13Å; I526-I528 PolarHBondContact O-N 2.96Å; I526-F529 WeakPolarHBondContact O-CB 3.26Å; I526-F529 WeakPolarHBondContact O-CD2 3.42Å; I526-F529 PolarHBondContact O-N 3.43Å; I526-L534 HydrophobicContact CB-CD1 4.35Å; I526-L534 HydrophobicContact CD1-CD2 4.37Å; I526-L534 HydrophobicContact CG2-CD1 4.4Å
527	K	93.3	Very high	89.1	Confident	106 Å²	106	36.1 Å²	36.1	46%	0.461	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-8.2	179.5	-76.2	178	177.1	173.8	0	115.6	I523 F529	I523-K527 PolarHBondContact O-N 2.99Å; K527-F529 VanDerWaalsContact C-N 3.28Å
528	I	90.7	Very high	88.7	Confident	53 Å²	53	36.2 Å²	36.2	27%	0.272	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-19	171	73.4	-176.7	0	0	0	112.7	K286 Y289 F290 L525 I526	K286-I528 HydrophobicContact CB-CD1 4.09Å; K286-I528 HydrophobicContact CB-CG1 4.33Å; K286-I528 WeakPolarHBondContact CD-O 3.34Å; K286-I528 VanDerWaalsContact CE-O 3.24Å; K286-I528 WeakPolarHBondContact CE-O 3.27Å; Y289-I528 HydrophobicContact CD1-CD1 3.8Å; Y289-I528 HydrophobicContact CE1-CD1 4.35Å; F290-I528 HydrophobicContact CB-CD1 4.23Å; L525-I528 WeakPolarHBondContact O-CG1 3.46Å; I526-I528 PolarHBondContact O-N 2.96Å
529	F	85.5	Confident	88.2	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.018	17%	0.172	C	C	.	.	S	Bend	trans	-92.8	151.2	178.5	-59.3	-73.9	0	0	0	110.7	F283 K286 F290 I526 K527 E533 L537	F283-F529 AromaticContact CD2-CD1 3.9Å; F283-F529 HydrophobicContact CD2-CD1 3.9Å; F283-F529 AromaticContact CD2-CE1 3.88Å; F283-F529 HydrophobicContact CD2-CE1 3.88Å; F283-F529 AromaticContact CE2-CD1 3.76Å; F283-F529 HydrophobicContact CE2-CD1 3.76Å; F283-F529 AromaticContact CE2-CE1 3.62Å; F283-F529 HydrophobicContact CE2-CE1 3.62Å; F283-F529 HydrophobicContact CZ-CE1 4.42Å; K286-F529 HydrophobicContact CB-CD1 3.96Å; K286-F529 HydrophobicContact CB-CE1 3.47Å; K286-F529 VanDerWaalsContact CB-CE1 3.47Å; K286-F529 HydrophobicContact CB-CZ 4.11Å; K286-F529 HydrophobicContact CD-CD1 4.06Å; K286-F529 HydrophobicContact CD-CE1 4.41Å; F290-F529 HydrophobicContact CB-CE2 4.1Å; F290-F529 HydrophobicContact CB-CZ 3.9Å; F290-F529 AromaticContact CD2-CE2 3.84Å; F290-F529 HydrophobicContact CD2-CE2 3.84Å; F290-F529 HydrophobicContact CD2-CZ 4.45Å; F290-F529 HydrophobicContact CE2-CE2 4.41Å; F290-F529 AromaticContact CG-CE2 3.94Å; F290-F529 HydrophobicContact CG-CE2 3.94Å; F290-F529 HydrophobicContact CG-CZ 4.09Å; I526-F529 WeakPolarHBondContact O-CB 3.26Å; I526-F529 WeakPolarHBondContact O-CD2 3.42Å; I526-F529 PolarHBondContact O-N 3.43Å; K527-F529 VanDerWaalsContact C-N 3.28Å; F529-E533 VanDerWaalsContact CA-OE2 3.24Å; F529-E533 WeakPolarHBondContact CA-OE2 3.39Å; F529-E533 HydrophobicContact CB-CB 3.83Å; F529-E533 HydrophobicContact CD1-CB 3.95Å; F529-E533 HydrophobicContact CG-CB 4.32Å; F529-L537 HydrophobicContact CD2-CD2 3.97Å; F529-L537 HydrophobicContact CE2-CD2 3.69Å; F529-L537 HydrophobicContact CZ-CD2 4.19Å
530	D	82	Confident	87.4	Confident	51 Å²	51	31.2 Å²	31.2	27%	0.273	16%	0.162	S	C	.	.			trans	-81.9	174.6	160.2	75.2	53.7	0	0	0	112.7	N532 E533 L534	D530-N532 VanDerWaalsContact C-N 3.3Å; D530-N532 PolarHBondContact O-N 3.25Å; D530-N532 WeakPolarHBondContact OD1-CB 3.16Å; D530-N532 PolarHBondContact OD1-N 3.47Å; D530-N532 PolarHBondContact OD1-ND2 2.99Å; D530-E533 PolarHBondContact N-OE2 3.39Å; D530-E533 PolarHBondContact O-N 2.87Å; D530-E533 PolarHBondContact OD1-N 2.68Å; D530-L534 WeakPolarHBondContact O-CB 3.44Å; D530-L534 PolarHBondContact O-N 2.88Å
531	E	79.3	Confident	86.1	Confident	14 Å²	14	32.9 Å²	32.9	7%	0.065	17%	0.171	C	C	.	.	H	α-helix	trans	-64.6	-30.5	-174.9	54.7	-90.7	-149.2	0	0	113.7	R419 K423 L426 K428 E535	R419-E531 HydrophobicContact CG-CB 4.44Å; R419-E531 HydrophobicContact CG-CG 3.84Å; R419-E531 IonicContact CZ-OE1 3.01Å; R419-E531 IonicContact NE-OE1 3.19Å; R419-E531 PolarHBondContact NE-OE1 3.22Å; R419-E531 VanDerWaalsContact NE-OE1 3.11Å; R419-E531 IonicContact NH2-OE1 3.23Å; R419-E531 PolarHBondContact NH2-OE1 2.89Å; K423-E531 WeakPolarHBondContact CE-OE1 3.34Å; K423-E531 HydrophobicContact CG-CB 4.08Å; K423-E531 HydrophobicContact CG-CG 4.15Å; L426-E531 HydrophobicContact CD1-CB 4.15Å; K428-E531 WeakPolarHBondContact CD-OE2 3.1Å; K428-E531 IonicContact NZ-OE2 3.29Å; K428-E531 PolarHBondContact NZ-OE2 3.18Å; E531-E535 PolarHBondContact O-N 2.86Å; E531-E535 VanDerWaalsContact O-N 3.15Å
532	N	73.5	Confident	84.6	Confident	68 Å²	68	33.8 Å²	33.8	36%	0.364	18%	0.18	S	C	.	.	H	α-helix	trans	-79.8	-39.2	175.9	-33.7	-79	0	0	0	109.8	D530 L534 E535 L536	D530-N532 VanDerWaalsContact C-N 3.3Å; D530-N532 PolarHBondContact O-N 3.25Å; D530-N532 WeakPolarHBondContact OD1-CB 3.16Å; D530-N532 PolarHBondContact OD1-N 3.47Å; D530-N532 PolarHBondContact OD1-ND2 2.99Å; N532-L534 VanDerWaalsContact C-N 3.29Å; N532-L534 PolarHBondContact O-N 3.1Å; N532-E535 WeakPolarHBondContact O-CB 3.29Å; N532-E535 PolarHBondContact O-N 2.69Å; N532-L536 WeakPolarHBondContact O-CB 3.35Å; N532-L536 WeakPolarHBondContact O-CD1 3.35Å; N532-L536 WeakPolarHBondContact O-CG 3.43Å; N532-L536 PolarHBondContact O-N 3.23Å
533	E	81.3	Confident	83.3	Confident	11 Å²	11	35.4 Å²	35.4	5%	0.051	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-33.9	172.6	-69	179.9	138.7	0	0	112.4	F283 K286 F529 D530 L536 L537	F283-E533 HydrophobicContact CD2-CB 3.77Å; F283-E533 HydrophobicContact CD2-CG 3.73Å; F283-E533 HydrophobicContact CE2-CB 3.93Å; F283-E533 HydrophobicContact CE2-CG 4.39Å; F283-E533 WeakPolarHBondContact CE2-O 3.48Å; K286-E533 WeakPolarHBondContact CD-OE1 3.5Å; K286-E533 IonicContact NZ-OE1 3.75Å; K286-E533 PolarHBondContact NZ-OE1 3.36Å; K286-E533 IonicContact NZ-OE2 2.67Å; K286-E533 PolarHBondContact NZ-OE2 3.16Å; F529-E533 VanDerWaalsContact CA-OE2 3.24Å; F529-E533 WeakPolarHBondContact CA-OE2 3.39Å; F529-E533 HydrophobicContact CB-CB 3.83Å; F529-E533 HydrophobicContact CD1-CB 3.95Å; F529-E533 HydrophobicContact CG-CB 4.32Å; D530-E533 PolarHBondContact N-OE2 3.39Å; D530-E533 PolarHBondContact O-N 2.87Å; D530-E533 PolarHBondContact OD1-N 2.68Å; E533-L536 PolarHBondContact O-N 3.47Å; E533-L537 WeakPolarHBondContact O-CB 3.13Å; E533-L537 PolarHBondContact O-N 3.17Å
534	L	86.9	Confident	82.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-71.7	-41	175.8	179.6	59.6	0	0	0	112	Y422 M425 L426 I526 D530 N532 L536 L537 M538	Y422-L534 HydrophobicContact CD1-CD2 4.38Å; Y422-L534 HydrophobicContact CD1-CG 4.23Å; M425-L534 HydrophobicContact CB-CD2 3.96Å; M425-L534 HydrophobicContact CE-CD2 4.11Å; M425-L534 HydrophobicContact SD-CD2 4.08Å; L426-L534 HydrophobicContact CD1-CB 4.49Å; L426-L534 HydrophobicContact CD1-CD2 4.16Å; L426-L534 HydrophobicContact CD2-CD2 3.93Å; L426-L534 HydrophobicContact CG-CD2 3.78Å; I526-L534 HydrophobicContact CB-CD1 4.35Å; I526-L534 HydrophobicContact CD1-CD2 4.37Å; I526-L534 HydrophobicContact CG2-CD1 4.4Å; D530-L534 WeakPolarHBondContact O-CB 3.44Å; D530-L534 PolarHBondContact O-N 2.88Å; N532-L534 VanDerWaalsContact C-N 3.29Å; N532-L534 PolarHBondContact O-N 3.1Å; L534-L536 VanDerWaalsContact C-N 3.32Å; L534-L536 PolarHBondContact O-N 3.36Å; L534-L537 HydrophobicContact CD1-CD2 4.26Å; L534-L537 WeakPolarHBondContact O-CB 3.34Å; L534-L537 PolarHBondContact O-N 2.96Å; L534-M538 HydrophobicContact CD1-CG 4.32Å; L534-M538 HydrophobicContact CD1-SD 4.05Å; L534-M538 HydrophobicContact CG-SD 4.24Å; L534-M538 PolarHBondContact O-N 3.03Å
535	E	83	Confident	82.2	Confident	48 Å²	48	28.9 Å²	28.9	22%	0.224	15%	0.151	C	C	.	.	H	α-helix	trans	-54.3	-49.9	168	170.6	155.8	-121.2	0	0	111.2	Y422 E531 N532 L537 M538 C539 G540	Y422-E535 HydrophobicContact CD1-CB 4.48Å; Y422-E535 HydrophobicContact CD2-CB 4.11Å; Y422-E535 HydrophobicContact CE1-CB 3.99Å; Y422-E535 HydrophobicContact CE2-CB 3.58Å; Y422-E535 HydrophobicContact CE2-CG 3.96Å; Y422-E535 WeakPolarHBondContact CE2-OE1 3.5Å; Y422-E535 VanDerWaalsContact CZ-CB 3.48Å; Y422-E535 WeakPolarHBondContact OH-CG 3.28Å; Y422-E535 PolarHBondContact OH-OE1 2.87Å; E531-E535 PolarHBondContact O-N 2.86Å; E531-E535 VanDerWaalsContact O-N 3.15Å; N532-E535 WeakPolarHBondContact O-CB 3.29Å; N532-E535 PolarHBondContact O-N 2.69Å; E535-L537 VanDerWaalsContact C-N 3.26Å; E535-L537 PolarHBondContact O-N 2.73Å; E535-M538 PolarHBondContact O-N 3.29Å; E535-M538 VanDerWaalsContact O-N 3.15Å; E535-C539 PolarHBondContact O-N 3.42Å; E535-G540 PolarHBondContact O-N 2.92Å
536	L	76.6	Confident	81.8	Confident	32 Å²	32	27.7 Å²	27.7	17%	0.168	15%	0.145	C	C	.	.	H	α-helix	trans	-67.9	-26	-178.7	-67.5	164	0	0	0	112.7	N532 E533 L534 G540 L541 M596	N532-L536 WeakPolarHBondContact O-CB 3.35Å; N532-L536 WeakPolarHBondContact O-CD1 3.35Å; N532-L536 WeakPolarHBondContact O-CG 3.43Å; N532-L536 PolarHBondContact O-N 3.23Å; E533-L536 PolarHBondContact O-N 3.47Å; L534-L536 VanDerWaalsContact C-N 3.32Å; L534-L536 PolarHBondContact O-N 3.36Å; L536-G540 WeakPolarHBondContact O-CA 3.41Å; L536-G540 PolarHBondContact O-N 3.45Å; L536-L541 HydrophobicContact CD2-CD2 3.54Å; L536-L541 HydrophobicContact CD2-CG 4.03Å; L536-M596 HydrophobicContact CB-CB 4.12Å; L536-M596 HydrophobicContact CB-CG 4.18Å; L536-M596 HydrophobicContact CB-SD 3.82Å; L536-M596 HydrophobicContact CD1-CE 3.65Å; L536-M596 HydrophobicContact CD1-CG 3.86Å; L536-M596 HydrophobicContact CD1-SD 3.47Å; L536-M596 WeakPolarHBondContact CD1-SD 3.3Å; L536-M596 HydrophobicContact CG-CG 4.41Å; L536-M596 HydrophobicContact CG-SD 4.22Å
537	L	86.8	Confident	81.5	Confident	12 Å²	12	29.7 Å²	29.7	6%	0.063	16%	0.156	C	C	.	.	H	α-helix	trans	-73.2	-35.2	171.9	-179.7	65.1	0	0	0	113.1	Y287 F290 V407 F529 E533 L534 E535	Y287-L537 HydrophobicContact CD2-CD1 3.8Å; Y287-L537 HydrophobicContact CE2-CD1 3.91Å; F290-L537 HydrophobicContact CE1-CD1 4.29Å; F290-L537 HydrophobicContact CE1-CD2 4.26Å; F290-L537 HydrophobicContact CZ-CD2 4.27Å; V407-L537 HydrophobicContact CG1-CD1 4.46Å; V407-L537 HydrophobicContact CG1-CD2 4.02Å; V407-L537 HydrophobicContact CG1-CG 4.12Å; V407-L537 HydrophobicContact CG2-CG 4.41Å; F529-L537 HydrophobicContact CD2-CD2 3.97Å; F529-L537 HydrophobicContact CE2-CD2 3.69Å; F529-L537 HydrophobicContact CZ-CD2 4.19Å; E533-L537 WeakPolarHBondContact O-CB 3.13Å; E533-L537 PolarHBondContact O-N 3.17Å; L534-L537 HydrophobicContact CD1-CD2 4.26Å; L534-L537 WeakPolarHBondContact O-CB 3.34Å; L534-L537 PolarHBondContact O-N 2.96Å; E535-L537 VanDerWaalsContact C-N 3.26Å; E535-L537 PolarHBondContact O-N 2.73Å
538	M	90.4	Very high	81.3	Confident	3 Å²	3	25.5 Å²	25.5	2%	0.015	14%	0.139	C	C	.	.	H	α-helix	trans	-91.5	-42.9	-175.9	-74.6	177.9	52.4	0	0	113.5	A403 V407 L412 L413 M425 F513 F517 L534 E535	A403-M538 HydrophobicContact CB-CE 4.13Å; V407-M538 HydrophobicContact CG2-CG 3.62Å; L412-M538 WeakPolarHBondContact CA-O 3.47Å; L413-M538 PolarHBondContact N-O 3.44Å; M425-M538 HydrophobicContact CE-CE 4.46Å; M425-M538 HydrophobicContact CE-SD 3.71Å; M425-M538 HydrophobicContact SD-CE 4.44Å; M425-M538 HydrophobicContact SD-SD 4Å; F513-M538 HydrophobicContact CZ-CE 4.27Å; F517-M538 HydrophobicContact CE2-SD 4.42Å; L534-M538 HydrophobicContact CD1-CG 4.32Å; L534-M538 HydrophobicContact CD1-SD 4.05Å; L534-M538 HydrophobicContact CG-SD 4.24Å; L534-M538 PolarHBondContact O-N 3.03Å; E535-M538 PolarHBondContact O-N 3.29Å; E535-M538 VanDerWaalsContact O-N 3.15Å
539	C	84.4	Confident	81.4	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-22.6	-169.9	-56.1	0	0	0	0	112.3	L413 G415 E535 R593	L413-C539 WeakPolarHBondContact O-CA 3.39Å; G415-C539 WeakPolarHBondContact O-CB 3.27Å; G415-C539 PolarHBondContact O-SG 3.32Å; E535-C539 PolarHBondContact O-N 3.42Å; C539-R593 VanDerWaalsContact O-CB 3.31Å; C539-R593 WeakPolarHBondContact O-CB 3.28Å; C539-R593 VanDerWaalsContact O-CG 3.23Å; C539-R593 WeakPolarHBondContact O-CG 3.31Å; C539-R593 PolarHBondContact O-NE 2.72Å
540	G	78.8	Confident	81.7	Confident	2 Å²	2	24.9 Å²	24.9	2%	0.021	13%	0.133	C	C	.	.			trans	66.7	-171.4	-176.2	0	0	0	0	0	113.1	E535 L536 R593	E535-G540 PolarHBondContact O-N 2.92Å; L536-G540 WeakPolarHBondContact O-CA 3.41Å; L536-G540 PolarHBondContact O-N 3.45Å; G540-R593 PolarHBondContact O-NH2 2.96Å
541	L	68.8	Low	82.1	Confident	36 Å²	36	28.2 Å²	28.2	19%	0.188	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-72.7	138.9	179.2	-61.6	167.2	0	0	0	111	V277 L536 R593 V594 P595	V277-L541 HydrophobicContact CB-CD1 4.41Å; V277-L541 HydrophobicContact CG1-CD1 3.65Å; V277-L541 HydrophobicContact CG2-CD1 3.8Å; L536-L541 HydrophobicContact CD2-CD2 3.54Å; L536-L541 HydrophobicContact CD2-CG 4.03Å; L541-R593 PolarHBondContact O-NE 3.3Å; L541-V594 HydrophobicContact CB-CB 4.17Å; L541-V594 HydrophobicContact CD1-CB 4.38Å; L541-V594 HydrophobicContact CD1-CG1 4.36Å; L541-V594 PolarHBondContact N-O 3.17Å; L541-V594 PolarHBondContact O-N 3.04Å; L541-P595 VanDerWaalsContact CD1-O 3.31Å; L541-P595 WeakPolarHBondContact CD1-O 3.43Å
542	G	63.3	Low	82.8	Confident	20 Å²	20	30.4 Å²	30.4	21%	0.206	16%	0.156	C	C	.	.	S	Bend	trans	-85.9	-30	172.3	0	0	0	0	0	113.9
543	D	69.4	Low	83.8	Confident	101 Å²	101	27.7 Å²	27.7	54%	0.54	14%	0.143	S	C	.	.	S	Bend	trans	-89	144.6	177.8	-71.2	-40.4	0	0	0	111.8	P275	P275-D543 HydrophobicContact CG-CB 3.86Å
544	V	78.4	Confident	84.5	Confident	12 Å²	12	29.9 Å²	29.9	7%	0.073	16%	0.156	C	C	.	.			trans	-107.4	109.1	177.2	177.1	0	0	0	0	109.3	V546 W549 I582 L585 V594 F599	V544-V546 PolarHBondContact O-N 3.4Å; V544-W549 HydrophobicContact CG1-CD2 4.48Å; V544-W549 HydrophobicContact CG1-CE3 3.44Å; V544-W549 VanDerWaalsContact CG1-CE3 3.44Å; V544-W549 HydrophobicContact CG1-CZ3 3.73Å; V544-I582 HydrophobicContact CG2-CG1 4.07Å; V544-L585 HydrophobicContact CG2-CD2 4.13Å; V544-V594 HydrophobicContact CG2-CG2 4.04Å; V544-F599 HydrophobicContact CG1-CE2 4.1Å; V544-F599 HydrophobicContact CG1-CZ 4.05Å
545	D	84.7	Confident	84.9	Confident	9 Å²	9	31.6 Å²	31.6	5%	0.048	16%	0.163	C	C	.	.			trans	-76.8	106.2	165.6	-178.7	-1.7	0	0	0	109.9	T273 A276 V277 N547 D548 W549	T273-D545 WeakPolarHBondContact O-CA 3.48Å; A276-D545 WeakPolarHBondContact CA-OD2 3.25Å; V277-D545 HydrophobicContact CG2-CB 4Å; D545-N547 VanDerWaalsContact C-N 3.26Å; D545-N547 PolarHBondContact O-N 3.28Å; D545-N547 WeakPolarHBondContact OD1-CA 3.4Å; D545-N547 WeakPolarHBondContact OD1-CB 3.34Å; D545-N547 PolarHBondContact OD1-N 3.39Å; D545-D548 HydrophobicContact CB-CB 3.86Å; D545-D548 PolarHBondContact O-N 2.86Å; D545-D548 PolarHBondContact OD1-N 3.34Å; D545-D548 WeakPolarHBondContact OD2-CB 3.29Å; D545-W549 WeakPolarHBondContact O-CB 3.15Å; D545-W549 PolarHBondContact O-N 3.46Å
546	V	86.8	Confident	85.5	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-28.7	179	178.1	0	0	0	0	112.2	T273 V544 R550 W570 V573 L574	T273-V546 PolarHBondContact O-N 2.95Å; V544-V546 PolarHBondContact O-N 3.4Å; V546-R550 WeakPolarHBondContact O-CB 3.41Å; V546-R550 PolarHBondContact O-N 3.03Å; V546-W570 HydrophobicContact CG1-CE3 3.99Å; V546-W570 HydrophobicContact CG1-CZ3 4.14Å; V546-V573 HydrophobicContact CG1-CB 4.49Å; V546-V573 HydrophobicContact CG1-CG1 3.78Å; V546-V573 HydrophobicContact CG2-CG1 3.96Å; V546-L574 HydrophobicContact CB-CD2 4.33Å; V546-L574 HydrophobicContact CG1-CD2 3.8Å; V546-L574 HydrophobicContact CG1-CG 4.22Å
547	N	87.7	Confident	86.1	Confident	42 Å²	42	36.4 Å²	36.4	23%	0.225	19%	0.187	C	C	.	.	H	α-helix	trans	-74.3	-44	177.7	175.3	48.2	0	0	0	110.7	T273 D545 R550 Q551	T273-N547 HydrophobicContact CG2-CB 4.1Å; D545-N547 VanDerWaalsContact C-N 3.26Å; D545-N547 PolarHBondContact O-N 3.28Å; D545-N547 WeakPolarHBondContact OD1-CA 3.4Å; D545-N547 WeakPolarHBondContact OD1-CB 3.34Å; D545-N547 PolarHBondContact OD1-N 3.39Å; N547-R550 PolarHBondContact O-N 3.06Å; N547-Q551 VanDerWaalsContact CG-NE2 3.3Å; N547-Q551 PolarHBondContact ND2-NE2 3.32Å; N547-Q551 WeakPolarHBondContact O-CB 3.4Å; N547-Q551 VanDerWaalsContact O-CG 3.28Å; N547-Q551 WeakPolarHBondContact O-CG 3.36Å; N547-Q551 PolarHBondContact O-N 2.97Å; N547-Q551 PolarHBondContact OD1-NE2 3.41Å
548	D	89.3	Confident	86.1	Confident	18 Å²	18	38.3 Å²	38.3	10%	0.096	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-44	171.2	178.6	52.9	0	0	0	112.1	D545 R550 Q551 H552 G598 F599	D545-D548 HydrophobicContact CB-CB 3.86Å; D545-D548 PolarHBondContact O-N 2.86Å; D545-D548 PolarHBondContact OD1-N 3.34Å; D545-D548 WeakPolarHBondContact OD2-CB 3.29Å; D548-R550 PolarHBondContact O-N 2.87Å; D548-Q551 PolarHBondContact O-N 3.37Å; D548-H552 PolarHBondContact O-N 2.71Å; D548-H552 PolarHBondContact O-ND1 2.73Å; D548-H552 IonicContact OD1-CE1 3.92Å; D548-H552 PolarHBondContact OD1-CE1 3.43Å; D548-H552 IonicContact OD1-ND1 2.82Å; D548-H552 PolarHBondContact OD1-ND1 2.9Å; D548-G598 WeakPolarHBondContact OD2-CA 3.44Å; D548-F599 WeakPolarHBondContact OD2-CD2 3.28Å; D548-F599 PolarHBondContact OD2-N 2.85Å
549	W	91.6	Very high	86.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-56.7	-47.9	173.7	-167.2	-4.3	0	0	0	111.8	V544 D545 H552 T553 W570 V573 L584 L585 F599 F611	V544-W549 HydrophobicContact CG1-CD2 4.48Å; V544-W549 HydrophobicContact CG1-CE3 3.44Å; V544-W549 VanDerWaalsContact CG1-CE3 3.44Å; V544-W549 HydrophobicContact CG1-CZ3 3.73Å; D545-W549 WeakPolarHBondContact O-CB 3.15Å; D545-W549 PolarHBondContact O-N 3.46Å; W549-H552 PolarHBondContact O-N 2.58Å; W549-T553 PolarHBondContact O-N 2.95Å; W549-T553 PolarHBondContact O-OG1 3.34Å; W549-W570 HydrophobicContact CB-CH2 4.09Å; W549-W570 HydrophobicContact CB-CZ3 4.19Å; W549-W570 AromaticContact CD1-CH2 3.64Å; W549-W570 HydrophobicContact CD2-CH2 4.09Å; W549-W570 HydrophobicContact CD2-CZ3 4.14Å; W549-W570 AromaticContact CG-CH2 3.66Å; W549-W570 HydrophobicContact CG-CH2 3.66Å; W549-W570 AromaticContact CG-CZ3 3.97Å; W549-W570 HydrophobicContact CG-CZ3 3.97Å; W549-V573 HydrophobicContact CE3-CG1 4.33Å; W549-V573 HydrophobicContact CZ3-CG1 4.21Å; W549-L584 HydrophobicContact CH2-CB 4.37Å; W549-L584 HydrophobicContact CH2-CD2 4.05Å; W549-L584 HydrophobicContact CH2-CG 4Å; W549-L584 HydrophobicContact CZ2-CG 4.46Å; W549-L585 HydrophobicContact CH2-CB 3.87Å; W549-L585 HydrophobicContact CH2-CD1 4.25Å; W549-L585 HydrophobicContact CZ2-CB 4.36Å; W549-L585 HydrophobicContact CZ2-CD1 3.99Å; W549-L585 HydrophobicContact CZ3-CB 4.46Å; W549-F599 HydrophobicContact CB-CD1 3.96Å; W549-F599 HydrophobicContact CB-CD2 3.69Å; W549-F599 HydrophobicContact CB-CE1 3.91Å; W549-F599 HydrophobicContact CB-CE2 3.61Å; W549-F599 HydrophobicContact CB-CG 3.88Å; W549-F599 HydrophobicContact CB-CZ 3.74Å; W549-F599 AromaticContact CD1-CD1 3.27Å; W549-F599 AromaticContact CD1-CE1 3.23Å; W549-F599 AromaticContact CD1-CZ 3.91Å; W549-F599 HydrophobicContact CD2-CD1 4.25Å; W549-F599 AromaticContact CD2-CE1 3.45Å; W549-F599 HydrophobicContact CD2-CE1 3.45Å; W549-F599 VanDerWaalsContact CD2-CE1 3.45Å; W549-F599 HydrophobicContact CD2-CE2 4.23Å; W549-F599 AromaticContact CD2-CZ 3.44Å; W549-F599 HydrophobicContact CD2-CZ 3.44Å; W549-F599 VanDerWaalsContact CD2-CZ 3.44Å; W549-F599 AromaticContact CE2-CE1 3.55Å; W549-F599 AromaticContact CE2-CZ 3.96Å; W549-F599 HydrophobicContact CE3-CE1 4.24Å; W549-F599 HydrophobicContact CE3-CE2 4.5Å; W549-F599 AromaticContact CE3-CZ 3.79Å; W549-F599 HydrophobicContact CE3-CZ 3.79Å; W549-F599 AromaticContact CG-CD1 3.57Å; W549-F599 HydrophobicContact CG-CD1 3.57Å; W549-F599 HydrophobicContact CG-CD2 4.15Å; W549-F599 AromaticContact CG-CE1 3.26Å; W549-F599 HydrophobicContact CG-CE1 3.26Å; W549-F599 AromaticContact CG-CE2 3.88Å; W549-F599 HydrophobicContact CG-CE2 3.88Å; W549-F599 HydrophobicContact CG-CG 4.03Å; W549-F599 AromaticContact CG-CZ 3.43Å; W549-F599 HydrophobicContact CG-CZ 3.43Å; W549-F599 VanDerWaalsContact CG-CZ 3.43Å; W549-F599 HydrophobicContact CZ2-CE1 4.37Å; W549-F599 AromaticContact NE1-CD1 3.83Å; W549-F599 AromaticContact NE1-CE1 3.43Å; W549-F611 AromaticContact CD1-CG 3.92Å; W549-F611 AromaticContact CE2-CD2 3.98Å; W549-F611 AromaticContact CE2-CE2 3.7Å; W549-F611 AromaticContact CE2-CZ 3.87Å; W549-F611 HydrophobicContact CZ2-CD2 4.16Å; W549-F611 HydrophobicContact CZ2-CE1 4.49Å; W549-F611 AromaticContact CZ2-CE2 3.48Å; W549-F611 HydrophobicContact CZ2-CE2 3.48Å; W549-F611 VanDerWaalsContact CZ2-CE2 3.48Å; W549-F611 AromaticContact CZ2-CZ 3.69Å; W549-F611 HydrophobicContact CZ2-CZ 3.69Å; W549-F611 AromaticContact NE1-CD1 3.38Å; W549-F611 AromaticContact NE1-CD2 3.21Å; W549-F611 AromaticContact NE1-CE1 3.51Å; W549-F611 AromaticContact NE1-CE2 3.32Å; W549-F611 VanDerWaalsContact NE1-CE2 3.32Å; W549-F611 AromaticContact NE1-CG 3.24Å; W549-F611 AromaticContact NE1-CZ 3.48Å
550	R	91.8	Very high	86.7	Confident	44 Å²	44	41.4 Å²	41.4	17%	0.166	23%	0.229	C	C	.	.	H	α-helix	trans	-63.3	-42	178.1	178.9	174.6	174.8	-100	-0.8	112.5	E263 V546 N547 D548 H552 T553 W570	E263-R550 IonicContact OE1-NH2 3.93Å; E263-R550 PolarHBondContact OE1-NH2 2.87Å; E263-R550 VanDerWaalsContact OE1-NH2 3.16Å; V546-R550 WeakPolarHBondContact O-CB 3.41Å; V546-R550 PolarHBondContact O-N 3.03Å; N547-R550 PolarHBondContact O-N 3.06Å; D548-R550 PolarHBondContact O-N 2.87Å; R550-H552 VanDerWaalsContact C-N 3.34Å; R550-T553 PolarHBondContact O-N 3.48Å; R550-W570 HydrophobicContact CB-CD2 3.94Å; R550-W570 HydrophobicContact CB-CE3 4.03Å; R550-W570 HydrophobicContact CB-CH2 4.05Å; R550-W570 HydrophobicContact CB-CZ2 3.94Å; R550-W570 HydrophobicContact CB-CZ3 4.08Å; R550-W570 HydrophobicContact CG-CD2 4Å; R550-W570 HydrophobicContact CG-CG 4.25Å; R550-W570 HydrophobicContact CG-CZ2 4.28Å
551	Q	91.2	Very high	87.2	Confident	121 Å²	121	44.1 Å²	44.1	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-66.1	-36.1	-179.5	-74.6	178.7	34.8	0	0	112.5	N547 D548	N547-Q551 VanDerWaalsContact CG-NE2 3.3Å; N547-Q551 PolarHBondContact ND2-NE2 3.32Å; N547-Q551 WeakPolarHBondContact O-CB 3.4Å; N547-Q551 VanDerWaalsContact O-CG 3.28Å; N547-Q551 WeakPolarHBondContact O-CG 3.36Å; N547-Q551 PolarHBondContact O-N 2.97Å; N547-Q551 PolarHBondContact OD1-NE2 3.41Å; D548-Q551 PolarHBondContact O-N 3.37Å
552	H	93.3	Very high	88	Confident	59 Å²	59	45.3 Å²	45.3	27%	0.273	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	19.7	-178.9	-62.1	107.1	0	0	0	113.9	D548 W549 R550 F599 L610	D548-H552 PolarHBondContact O-N 2.71Å; D548-H552 PolarHBondContact O-ND1 2.73Å; D548-H552 IonicContact OD1-CE1 3.92Å; D548-H552 PolarHBondContact OD1-CE1 3.43Å; D548-H552 IonicContact OD1-ND1 2.82Å; D548-H552 PolarHBondContact OD1-ND1 2.9Å; W549-H552 PolarHBondContact O-N 2.58Å; R550-H552 VanDerWaalsContact C-N 3.34Å; H552-F599 HydrophobicContact CB-CB 3.78Å; H552-L610 HydrophobicContact CB-CD2 4.46Å
553	T	95.4	Very high	89.3	Confident	12 Å²	12	46.3 Å²	46.3	7%	0.074	25%	0.253	C	S	.	.			trans	-93.6	132.4	173.9	-69.6	0	0	0	0	112.3	W549 R550 Y555 W570 F611 I613	W549-T553 PolarHBondContact O-N 2.95Å; W549-T553 PolarHBondContact O-OG1 3.34Å; R550-T553 PolarHBondContact O-N 3.48Å; T553-Y555 HydrophobicContact CG2-CD1 4.26Å; T553-Y555 HydrophobicContact CG2-CE1 3.65Å; T553-Y555 HydrophobicContact CG2-CE2 4.08Å; T553-Y555 WeakPolarHBondContact O-CE2 3.46Å; T553-W570 HydrophobicContact CG2-CZ2 4.16Å; T553-W570 WeakPolarHBondContact OG1-CZ2 3.37Å; T553-F611 WeakPolarHBondContact CA-O 3.32Å; T553-F611 HydrophobicContact CG2-CD1 3.82Å; T553-F611 HydrophobicContact CG2-CE1 4.43Å; T553-F611 WeakPolarHBondContact OG1-CD1 3.34Å; T553-I613 HydrophobicContact CG2-CD1 4.18Å; T553-I613 HydrophobicContact CG2-CG1 3.98Å
554	V	95.4	Very high	90.2	Very high	56 Å²	56	43.2 Å²	43.2	34%	0.339	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	140.3	173.8	-179.8	0	0	0	0	110.4	L610 F611 T612 I613	V554-L610 HydrophobicContact CG2-CB 4Å; V554-L610 HydrophobicContact CG2-CD1 3.88Å; V554-F611 PolarHBondContact N-O 3.42Å; V554-T612 HydrophobicContact CB-CG2 4.49Å; V554-T612 CarbonylContact O-C 3.55Å; V554-T612 VanDerWaalsContact O-CA 3.26Å; V554-T612 WeakPolarHBondContact O-CA 3.08Å; V554-I613 PolarHBondContact O-N 3.36Å
555	Y	96.9	Very high	90.9	Very high	36 Å²	36	42.8 Å²	42.8	14%	0.141	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.5	178.8	-52.7	-84.6	0	0	0	111.2	T553 Y559 P561 I566 W570 I613	T553-Y555 HydrophobicContact CG2-CD1 4.26Å; T553-Y555 HydrophobicContact CG2-CE1 3.65Å; T553-Y555 HydrophobicContact CG2-CE2 4.08Å; T553-Y555 WeakPolarHBondContact O-CE2 3.46Å; Y555-Y559 VanDerWaalsContact CB-O 3.26Å; Y555-Y559 WeakPolarHBondContact CB-O 3.27Å; Y555-P561 HydrophobicContact CD2-CG 3.93Å; Y555-P561 HydrophobicContact CE2-CB 4.38Å; Y555-P561 HydrophobicContact CE2-CG 3.76Å; Y555-I566 HydrophobicContact CD1-CD1 3.71Å; Y555-I566 HydrophobicContact CD1-CG1 3.92Å; Y555-I566 HydrophobicContact CD1-CG2 3.96Å; Y555-I566 HydrophobicContact CE1-CB 4.36Å; Y555-I566 HydrophobicContact CE1-CD1 3.89Å; Y555-I566 HydrophobicContact CE1-CG1 4.12Å; Y555-I566 HydrophobicContact CE1-CG2 3.33Å; Y555-W570 AromaticContact CZ-NE1 3.95Å; Y555-W570 PolarHBondContact OH-NE1 3.46Å; Y555-I613 CarbonylContact C-O 3.55Å; Y555-I613 WeakPolarHBondContact CA-O 3.38Å; Y555-I613 HydrophobicContact CD1-CB 4.21Å; Y555-I613 HydrophobicContact CE1-CD1 4.13Å
556	K	94.1	Very high	91.4	Very high	78 Å²	78	42.3 Å²	42.3	34%	0.339	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	164.8	-174.7	-70.2	-176.4	-177.7	175.8	0	114	G558 Y559 T612 I613 E614 Q615	K556-G558 VanDerWaalsContact C-N 3.27Å; K556-G558 PolarHBondContact O-N 2.85Å; K556-Y559 PolarHBondContact O-N 2.9Å; K556-T612 HydrophobicContact CD-CG2 3.73Å; K556-T612 HydrophobicContact CG-CG2 4.07Å; K556-I613 PolarHBondContact N-O 2.55Å; K556-E614 HydrophobicContact CB-CB 4.08Å; K556-E614 HydrophobicContact CB-CG 3.78Å; K556-E614 VanDerWaalsContact CD-OE2 3.28Å; K556-E614 WeakPolarHBondContact CD-OE2 3.39Å; K556-Q615 PolarHBondContact O-N 3.07Å
557	N	90.3	Very high	91.6	Very high	103 Å²	103	43.7 Å²	43.7	55%	0.551	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	23.2	172.6	-61.3	-1.9	0	0	0	116.7	E614 Q615	N557-E614 HydrophobicContact CB-CG 4.14Å; N557-E614 VanDerWaalsContact ND2-CD 3.34Å; N557-E614 WeakPolarHBondContact ND2-CG 3.26Å; N557-E614 PolarHBondContact ND2-OE1 3.29Å; N557-Q615 HydrophobicContact CB-CB 4Å; N557-Q615 WeakPolarHBondContact CB-O 3.5Å; N557-Q615 PolarHBondContact ND2-O 2.92Å; N557-Q615 PolarHBondContact O-OE1 3.22Å
558	G	85.6	Confident	91.8	Very high	53 Å²	53	43.8 Å²	43.8	55%	0.546	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	123.1	-21.9	-179.5	0	0	0	0	0	112.9	K556	K556-G558 VanDerWaalsContact C-N 3.27Å; K556-G558 PolarHBondContact O-N 2.85Å
559	Y	95.1	Very high	92.1	Very high	11 Å²	11	43 Å²	43	4%	0.043	23%	0.232	C	C	.	.			trans	-72.8	144.5	171.3	-68.2	-20.2	0	0	0	113.3	Y555 K556 H563 V565 I566 I613 Q615 L634 P635 S636	Y555-Y559 VanDerWaalsContact CB-O 3.26Å; Y555-Y559 WeakPolarHBondContact CB-O 3.27Å; K556-Y559 PolarHBondContact O-N 2.9Å; Y559-H563 HydrophobicContact CD1-CB 4.38Å; Y559-H563 AromaticContact CD1-CE1 3.72Å; Y559-H563 AromaticContact CD1-CG 3.74Å; Y559-H563 AromaticContact CD1-ND1 3.49Å; Y559-H563 WeakPolarHBondContact CD1-ND1 3.21Å; Y559-H563 AromaticContact CE1-CE1 3.5Å; Y559-H563 AromaticContact CE1-ND1 3.56Å; Y559-V565 HydrophobicContact CE1-CB 4.12Å; Y559-V565 HydrophobicContact CE1-CG1 4.31Å; Y559-V565 HydrophobicContact CE1-CG2 4.45Å; Y559-I566 HydrophobicContact CD1-CG1 4.32Å; Y559-I566 HydrophobicContact CD2-CD1 3.71Å; Y559-I566 HydrophobicContact CD2-CG1 4.29Å; Y559-I566 HydrophobicContact CE2-CD1 4.31Å; Y559-I566 HydrophobicContact CG-CD1 3.86Å; Y559-I566 HydrophobicContact CG-CG1 3.91Å; Y559-I613 HydrophobicContact CD2-CG2 4.03Å; Y559-I613 HydrophobicContact CE2-CG2 4.28Å; Y559-Q615 HydrophobicContact CD1-CB 3.94Å; Y559-Q615 HydrophobicContact CD1-CG 4.2Å; Y559-Q615 HydrophobicContact CD2-CB 3.72Å; Y559-Q615 HydrophobicContact CE1-CB 3.82Å; Y559-Q615 HydrophobicContact CE1-CG 3.68Å; Y559-Q615 HydrophobicContact CE2-CB 3.59Å; Y559-Q615 HydrophobicContact CE2-CG 4.1Å; Y559-Q615 HydrophobicContact CG-CB 3.89Å; Y559-L634 HydrophobicContact CE2-CB 4.04Å; Y559-L634 HydrophobicContact CE2-CD2 4.32Å; Y559-L634 HydrophobicContact CE2-CG 4.36Å; Y559-L634 VanDerWaalsContact CE2-O 3.27Å; Y559-L634 WeakPolarHBondContact CE2-O 3.36Å; Y559-L634 PolarHBondContact OH-O 2.83Å; Y559-P635 PolarHBondContact OH-O 3.08Å; Y559-P635 VanDerWaalsContact OH-O 3.07Å; Y559-S636 VanDerWaalsContact OH-CA 3.27Å; Y559-S636 WeakPolarHBondContact OH-CA 3.45Å; Y559-S636 PolarHBondContact OH-N 2.84Å
560	C	92.4	Very high	92.1	Very high	56 Å²	56	43.3 Å²	43.3	38%	0.378	23%	0.233	S	C	.	.			trans	-148	168.1	173.9	71.5	0	0	0	0	108.4	N562 H563	C560-N562 PolarHBondContact O-N 3.11Å; C560-H563 WeakPolarHBondContact O-CB 3.33Å; C560-H563 PolarHBondContact O-N 2.66Å
561	P	88.9	Confident	91.9	Very high	60 Å²	60	43.1 Å²	43.1	39%	0.39	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-25	-177.8	-27.1	34.6	0	0	0	115.4	Y555	Y555-P561 HydrophobicContact CD2-CG 3.93Å; Y555-P561 HydrophobicContact CE2-CB 4.38Å; Y555-P561 HydrophobicContact CE2-CG 3.76Å
562	N	86.1	Confident	91.9	Very high	60 Å²	60	37.5 Å²	37.5	32%	0.321	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	8.8	-175.6	-61	-12.6	0	0	0	113.4	R249 C560	R249-N562 WeakPolarHBondContact CD-O 3.45Å; C560-N562 PolarHBondContact O-N 3.11Å
563	H	90.3	Very high	91.7	Very high	42 Å²	42	34.7 Å²	34.7	19%	0.194	20%	0.195	C	C	.	.	S	Bend	trans	-75.2	136.8	176	-168.6	-86.5	0	0	0	109.8	Y559 C560 V565 I566 Q567	Y559-H563 HydrophobicContact CD1-CB 4.38Å; Y559-H563 AromaticContact CD1-CE1 3.72Å; Y559-H563 AromaticContact CD1-CG 3.74Å; Y559-H563 AromaticContact CD1-ND1 3.49Å; Y559-H563 WeakPolarHBondContact CD1-ND1 3.21Å; Y559-H563 AromaticContact CE1-CE1 3.5Å; Y559-H563 AromaticContact CE1-ND1 3.56Å; C560-H563 WeakPolarHBondContact O-CB 3.33Å; C560-H563 PolarHBondContact O-N 2.66Å; H563-V565 VanDerWaalsContact C-N 3.34Å; H563-V565 PolarHBondContact ND1-N 3.2Å; H563-V565 PolarHBondContact O-N 2.88Å; H563-I566 HydrophobicContact CB-CB 4.28Å; H563-I566 HydrophobicContact CB-CG1 4.07Å; H563-I566 WeakPolarHBondContact O-CA 3.49Å; H563-I566 WeakPolarHBondContact O-CB 3.39Å; H563-I566 PolarHBondContact O-N 3.2Å; H563-Q567 PolarHBondContact O-N 2.59Å
564	P	89.4	Confident	91.3	Very high	35 Å²	35	34.5 Å²	34.5	23%	0.227	19%	0.193	C	C	.	.	H	α-helix	trans	-51.5	-49.6	-175.5	-26	31.1	0	0	0	113.4	R249 I566 Q567 W568	R249-P564 HydrophobicContact CG-CG 3.87Å; P564-I566 PolarHBondContact O-N 3.21Å; P564-Q567 WeakPolarHBondContact O-CB 3.44Å; P564-Q567 PolarHBondContact O-N 3.35Å; P564-Q567 VanDerWaalsContact O-N 3.08Å; P564-W568 HydrophobicContact CB-CH2 4.29Å; P564-W568 HydrophobicContact CB-CZ2 3.99Å; P564-W568 PolarHBondContact O-N 3.37Å
565	V	92.9	Very high	90.6	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.018	19%	0.186	C	C	.	.	H	α-helix	trans	-57	-33.6	177.6	-174.1	0	0	0	0	112.6	Y559 H563 W568 F569 L634 L643	Y559-V565 HydrophobicContact CE1-CB 4.12Å; Y559-V565 HydrophobicContact CE1-CG1 4.31Å; Y559-V565 HydrophobicContact CE1-CG2 4.45Å; H563-V565 VanDerWaalsContact C-N 3.34Å; H563-V565 PolarHBondContact ND1-N 3.2Å; H563-V565 PolarHBondContact O-N 2.88Å; V565-W568 HydrophobicContact CG2-CE3 4.36Å; V565-W568 HydrophobicContact CG2-CZ3 4.28Å; V565-F569 WeakPolarHBondContact O-CB 3.34Å; V565-F569 PolarHBondContact O-N 3.22Å; V565-L634 HydrophobicContact CG1-CD2 3.93Å; V565-L634 HydrophobicContact CG1-CG 4.27Å; V565-L643 HydrophobicContact CG1-CD1 3.65Å; V565-L643 VanDerWaalsContact O-CD1 3.31Å; V565-L643 WeakPolarHBondContact O-CD1 3.5Å
566	I	95.3	Very high	89.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-77.8	-38.5	177.3	-64.6	-54.9	0	0	0	111.6	Y555 Y559 H563 P564 W568 F569 W570 I613 L634	Y555-I566 HydrophobicContact CD1-CD1 3.71Å; Y555-I566 HydrophobicContact CD1-CG1 3.92Å; Y555-I566 HydrophobicContact CD1-CG2 3.96Å; Y555-I566 HydrophobicContact CE1-CB 4.36Å; Y555-I566 HydrophobicContact CE1-CD1 3.89Å; Y555-I566 HydrophobicContact CE1-CG1 4.12Å; Y555-I566 HydrophobicContact CE1-CG2 3.33Å; Y559-I566 HydrophobicContact CD1-CG1 4.32Å; Y559-I566 HydrophobicContact CD2-CD1 3.71Å; Y559-I566 HydrophobicContact CD2-CG1 4.29Å; Y559-I566 HydrophobicContact CE2-CD1 4.31Å; Y559-I566 HydrophobicContact CG-CD1 3.86Å; Y559-I566 HydrophobicContact CG-CG1 3.91Å; H563-I566 HydrophobicContact CB-CB 4.28Å; H563-I566 HydrophobicContact CB-CG1 4.07Å; H563-I566 WeakPolarHBondContact O-CA 3.49Å; H563-I566 WeakPolarHBondContact O-CB 3.39Å; H563-I566 PolarHBondContact O-N 3.2Å; P564-I566 PolarHBondContact O-N 3.21Å; I566-W568 VanDerWaalsContact C-N 3.31Å; I566-F569 PolarHBondContact O-N 2.93Å; I566-W570 PolarHBondContact O-N 3.07Å; I566-W570 VanDerWaalsContact O-N 3.13Å; I566-I613 HydrophobicContact CD1-CB 4.23Å; I566-I613 HydrophobicContact CD1-CD1 4.21Å; I566-I613 HydrophobicContact CD1-CG2 3.78Å; I566-L634 HydrophobicContact CD1-CD2 4.41Å
567	Q	89.9	Confident	88.8	Confident	28 Å²	28	31.4 Å²	31.4	13%	0.131	18%	0.18	C	C	.	.	H	α-helix	trans	-61.6	-42.5	171.5	-64.4	-175.5	-51.7	0	0	110.7	T250 H563 P564 W570 K571	T250-Q567 PolarHBondContact O-NE2 3.24Å; H563-Q567 PolarHBondContact O-N 2.59Å; P564-Q567 WeakPolarHBondContact O-CB 3.44Å; P564-Q567 PolarHBondContact O-N 3.35Å; P564-Q567 VanDerWaalsContact O-N 3.08Å; Q567-W570 PolarHBondContact O-N 2.91Å; Q567-K571 WeakPolarHBondContact O-CB 3.49Å; Q567-K571 PolarHBondContact O-N 3.43Å
568	W	92.3	Very high	87.7	Confident	45 Å²	45	29.4 Å²	29.4	17%	0.17	18%	0.178	C	C	.	.	H	α-helix	trans	-63.5	-44.9	175.2	-63	-15.8	0	0	0	112.4	P564 V565 I566 W570 K571 V572 Y637 E638 S639 F640 L643	P564-W568 HydrophobicContact CB-CH2 4.29Å; P564-W568 HydrophobicContact CB-CZ2 3.99Å; P564-W568 PolarHBondContact O-N 3.37Å; V565-W568 HydrophobicContact CG2-CE3 4.36Å; V565-W568 HydrophobicContact CG2-CZ3 4.28Å; I566-W568 VanDerWaalsContact C-N 3.31Å; W568-W570 PolarHBondContact O-N 2.96Å; W568-K571 WeakPolarHBondContact O-CB 2.99Å; W568-K571 PolarHBondContact O-N 3.12Å; W568-K571 VanDerWaalsContact O-N 3.17Å; W568-V572 WeakPolarHBondContact O-CG2 3.36Å; W568-V572 PolarHBondContact O-N 3.19Å; W568-Y637 WeakPolarHBondContact CZ3-O 3.39Å; W568-E638 WeakPolarHBondContact CH2-O 3.48Å; W568-S639 VanDerWaalsContact CZ3-C 3.44Å; W568-F640 HydrophobicContact CB-CD2 3.89Å; W568-F640 HydrophobicContact CD2-CB 4.19Å; W568-F640 HydrophobicContact CG-CB 4.05Å; W568-F640 HydrophobicContact CG-CD2 4.09Å; W568-L643 HydrophobicContact CB-CD1 4Å
569	F	95.2	Very high	86.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-52.4	-53.8	173.7	175	-92.9	0	0	0	111.4	V565 I566 K571 V572 V573 L584 F611 I613 L632 L634 L643 L647	V565-F569 WeakPolarHBondContact O-CB 3.34Å; V565-F569 PolarHBondContact O-N 3.22Å; I566-F569 PolarHBondContact O-N 2.93Å; F569-K571 VanDerWaalsContact C-N 3.33Å; F569-K571 PolarHBondContact O-N 3.09Å; F569-V572 WeakPolarHBondContact O-CB 3.42Å; F569-V572 PolarHBondContact O-N 2.95Å; F569-V572 VanDerWaalsContact O-N 3.12Å; F569-V573 HydrophobicContact CD1-CG2 4.2Å; F569-V573 HydrophobicContact CE1-CG2 3.75Å; F569-V573 HydrophobicContact CE2-CG2 4.3Å; F569-V573 HydrophobicContact CZ-CG2 3.81Å; F569-V573 WeakPolarHBondContact O-CG2 3.2Å; F569-V573 PolarHBondContact O-N 3.22Å; F569-L584 HydrophobicContact CE2-CD2 4.16Å; F569-L584 HydrophobicContact CZ-CD2 4Å; F569-F611 HydrophobicContact CZ-CE1 4.39Å; F569-F611 HydrophobicContact CZ-CZ 4.36Å; F569-I613 HydrophobicContact CD1-CD1 3.56Å; F569-I613 HydrophobicContact CD2-CD1 4.39Å; F569-I613 HydrophobicContact CE1-CD1 3.49Å; F569-I613 VanDerWaalsContact CE1-CD1 3.49Å; F569-I613 HydrophobicContact CE2-CD1 4.34Å; F569-I613 HydrophobicContact CG-CD1 4.03Å; F569-I613 HydrophobicContact CZ-CD1 3.9Å; F569-L632 HydrophobicContact CD2-CD2 4.1Å; F569-L632 HydrophobicContact CE2-CD2 3.44Å; F569-L632 VanDerWaalsContact CE2-CD2 3.44Å; F569-L632 HydrophobicContact CZ-CD2 4.11Å; F569-L634 HydrophobicContact CB-CD2 4.29Å; F569-L634 HydrophobicContact CD2-CD2 4.21Å; F569-L634 HydrophobicContact CG-CD2 4.49Å; F569-L643 HydrophobicContact CB-CD1 4.4Å; F569-L647 HydrophobicContact CD2-CD2 3.78Å; F569-L647 HydrophobicContact CE2-CD1 4.4Å; F569-L647 HydrophobicContact CE2-CD2 3.84Å
570	W	93.4	Very high	85.7	Confident	8 Å²	8	33.4 Å²	33.4	3%	0.03	18%	0.183	C	C	.	.	H	α-helix	trans	-66.5	-32.6	179.3	-69.7	113.3	0	0	0	113.3	V546 W549 R550 T553 Y555 I566 Q567 W568 V572 V573 L574	V546-W570 HydrophobicContact CG1-CE3 3.99Å; V546-W570 HydrophobicContact CG1-CZ3 4.14Å; W549-W570 HydrophobicContact CB-CH2 4.09Å; W549-W570 HydrophobicContact CB-CZ3 4.19Å; W549-W570 AromaticContact CD1-CH2 3.64Å; W549-W570 HydrophobicContact CD2-CH2 4.09Å; W549-W570 HydrophobicContact CD2-CZ3 4.14Å; W549-W570 AromaticContact CG-CH2 3.66Å; W549-W570 HydrophobicContact CG-CH2 3.66Å; W549-W570 AromaticContact CG-CZ3 3.97Å; W549-W570 HydrophobicContact CG-CZ3 3.97Å; R550-W570 HydrophobicContact CB-CD2 3.94Å; R550-W570 HydrophobicContact CB-CE3 4.03Å; R550-W570 HydrophobicContact CB-CH2 4.05Å; R550-W570 HydrophobicContact CB-CZ2 3.94Å; R550-W570 HydrophobicContact CB-CZ3 4.08Å; R550-W570 HydrophobicContact CG-CD2 4Å; R550-W570 HydrophobicContact CG-CG 4.25Å; R550-W570 HydrophobicContact CG-CZ2 4.28Å; T553-W570 HydrophobicContact CG2-CZ2 4.16Å; T553-W570 WeakPolarHBondContact OG1-CZ2 3.37Å; Y555-W570 AromaticContact CZ-NE1 3.95Å; Y555-W570 PolarHBondContact OH-NE1 3.46Å; I566-W570 PolarHBondContact O-N 3.07Å; I566-W570 VanDerWaalsContact O-N 3.13Å; Q567-W570 PolarHBondContact O-N 2.91Å; W568-W570 PolarHBondContact O-N 2.96Å; W570-V572 VanDerWaalsContact C-N 3.33Å; W570-V572 PolarHBondContact O-N 3.2Å; W570-V573 HydrophobicContact CE3-CB 4.09Å; W570-V573 HydrophobicContact CE3-CG1 4.24Å; W570-V573 HydrophobicContact CE3-CG2 4.28Å; W570-V573 HydrophobicContact CZ3-CB 4.44Å; W570-V573 HydrophobicContact CZ3-CG1 4.18Å; W570-V573 HydrophobicContact CZ3-CG2 4.45Å; W570-V573 PolarHBondContact O-N 2.92Å; W570-L574 VanDerWaalsContact O-CG 3.3Å; W570-L574 WeakPolarHBondContact O-CG 3.44Å; W570-L574 PolarHBondContact O-N 3.13Å
571	K	87.2	Confident	85.2	Confident	39 Å²	39	32 Å²	32	17%	0.17	17%	0.169	C	C	.	.	H	α-helix	trans	-62.2	-39.4	171.4	-172.6	168.8	-177.4	165.3	0	111.5	L233 E242 Q567 W568 F569 L575 F640	L233-K571 HydrophobicContact CD1-CG 4.48Å; E242-K571 IonicContact OE1-NZ 3.3Å; E242-K571 PolarHBondContact OE1-NZ 3.39Å; Q567-K571 WeakPolarHBondContact O-CB 3.49Å; Q567-K571 PolarHBondContact O-N 3.43Å; W568-K571 WeakPolarHBondContact O-CB 2.99Å; W568-K571 PolarHBondContact O-N 3.12Å; W568-K571 VanDerWaalsContact O-N 3.17Å; F569-K571 VanDerWaalsContact C-N 3.33Å; F569-K571 PolarHBondContact O-N 3.09Å; K571-L575 HydrophobicContact CG-CD1 4.4Å; K571-L575 WeakPolarHBondContact O-CD1 3.3Å; K571-L575 WeakPolarHBondContact O-CG 3.42Å; K571-L575 PolarHBondContact O-N 2.95Å; K571-L575 VanDerWaalsContact O-N 3.15Å; K571-F640 HydrophobicContact CB-CE2 3.91Å; K571-F640 HydrophobicContact CD-CD2 4.33Å; K571-F640 HydrophobicContact CD-CE2 3.97Å; K571-F640 HydrophobicContact CD-CZ 4.45Å; K571-F640 HydrophobicContact CG-CE2 3.74Å; K571-F640 HydrophobicContact CG-CZ 4.22Å
572	V	90.4	Very high	84.5	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.024	16%	0.163	C	C	.	.	H	α-helix	trans	-66.2	-46	172.7	176.5	0	0	0	0	111.4	W568 F569 W570 L574 L575 M576 F640 L643 R644 L647	W568-V572 WeakPolarHBondContact O-CG2 3.36Å; W568-V572 PolarHBondContact O-N 3.19Å; F569-V572 WeakPolarHBondContact O-CB 3.42Å; F569-V572 PolarHBondContact O-N 2.95Å; F569-V572 VanDerWaalsContact O-N 3.12Å; W570-V572 VanDerWaalsContact C-N 3.33Å; W570-V572 PolarHBondContact O-N 3.2Å; V572-L574 VanDerWaalsContact C-N 3.29Å; V572-L574 PolarHBondContact O-N 3.4Å; V572-L575 WeakPolarHBondContact O-CB 3.38Å; V572-L575 PolarHBondContact O-N 2.96Å; V572-L575 VanDerWaalsContact O-N 3.07Å; V572-M576 HydrophobicContact CG1-CE 4.08Å; V572-M576 WeakPolarHBondContact O-CG 3.2Å; V572-M576 PolarHBondContact O-N 3.17Å; V572-F640 HydrophobicContact CG2-CD2 4.25Å; V572-F640 HydrophobicContact CG2-CE2 3.49Å; V572-F640 VanDerWaalsContact CG2-CE2 3.49Å; V572-F640 HydrophobicContact CG2-CZ 3.94Å; V572-L643 HydrophobicContact CB-CD2 4.37Å; V572-L643 HydrophobicContact CG2-CD2 3.71Å; V572-R644 HydrophobicContact CG1-CG 4.38Å; V572-R644 HydrophobicContact CG2-CB 3.7Å; V572-R644 HydrophobicContact CG2-CG 4.04Å; V572-L647 HydrophobicContact CG1-CD2 4.12Å
573	V	89.8	Confident	83.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-36	178.5	179.3	0	0	0	0	112.3	V546 W549 F569 W570 M576 R581 L584	V546-V573 HydrophobicContact CG1-CB 4.49Å; V546-V573 HydrophobicContact CG1-CG1 3.78Å; V546-V573 HydrophobicContact CG2-CG1 3.96Å; W549-V573 HydrophobicContact CE3-CG1 4.33Å; W549-V573 HydrophobicContact CZ3-CG1 4.21Å; F569-V573 HydrophobicContact CD1-CG2 4.2Å; F569-V573 HydrophobicContact CE1-CG2 3.75Å; F569-V573 HydrophobicContact CE2-CG2 4.3Å; F569-V573 HydrophobicContact CZ-CG2 3.81Å; F569-V573 WeakPolarHBondContact O-CG2 3.2Å; F569-V573 PolarHBondContact O-N 3.22Å; W570-V573 HydrophobicContact CE3-CB 4.09Å; W570-V573 HydrophobicContact CE3-CG1 4.24Å; W570-V573 HydrophobicContact CE3-CG2 4.28Å; W570-V573 HydrophobicContact CZ3-CB 4.44Å; W570-V573 HydrophobicContact CZ3-CG1 4.18Å; W570-V573 HydrophobicContact CZ3-CG2 4.45Å; W570-V573 PolarHBondContact O-N 2.92Å; V573-M576 WeakPolarHBondContact O-CB 3.37Å; V573-M576 PolarHBondContact O-N 2.94Å; V573-R581 HydrophobicContact CG1-CG 4.37Å; V573-R581 PolarHBondContact O-NE 2.89Å; V573-R581 VanDerWaalsContact O-NE 3.08Å; V573-L584 HydrophobicContact CG2-CD2 3.58Å
574	L	85.4	Confident	83.3	Confident	8 Å²	8	31.5 Å²	31.5	4%	0.042	16%	0.156	C	C	.	.	H	α-helix	trans	-67.6	-38.1	173.5	-71.1	167.9	0	0	0	112.3	L233 L267 I272 T273 V546 W570 V572 M576 R581	L233-L574 HydrophobicContact CD1-CB 4.37Å; L233-L574 HydrophobicContact CD2-CB 3.67Å; L267-L574 HydrophobicContact CD2-CD1 3.97Å; L267-L574 HydrophobicContact CD2-CD2 3.93Å; L267-L574 HydrophobicContact CD2-CG 4.36Å; L267-L574 HydrophobicContact CG-CD1 4.16Å; I272-L574 HydrophobicContact CG2-CD2 4.04Å; T273-L574 HydrophobicContact CG2-CD2 4.14Å; V546-L574 HydrophobicContact CB-CD2 4.33Å; V546-L574 HydrophobicContact CG1-CD2 3.8Å; V546-L574 HydrophobicContact CG1-CG 4.22Å; W570-L574 VanDerWaalsContact O-CG 3.3Å; W570-L574 WeakPolarHBondContact O-CG 3.44Å; W570-L574 PolarHBondContact O-N 3.13Å; V572-L574 VanDerWaalsContact C-N 3.29Å; V572-L574 PolarHBondContact O-N 3.4Å; L574-M576 VanDerWaalsContact C-N 3.33Å; L574-R581 PolarHBondContact O-NH2 2.92Å
575	L	82.2	Confident	83	Confident	37 Å²	37	29.9 Å²	29.9	19%	0.194	15%	0.146	C	C	.	.	H	α-helix	trans	-71.2	-26.3	177.4	-77.4	164	0	0	0	113.3	L233 K571 V572 F640	L233-L575 HydrophobicContact CD1-CG 4.4Å; L233-L575 HydrophobicContact CD2-CD2 3.87Å; L233-L575 HydrophobicContact CD2-CG 3.9Å; L233-L575 HydrophobicContact CG-CD2 3.71Å; L233-L575 HydrophobicContact CG-CG 3.97Å; K571-L575 HydrophobicContact CG-CD1 4.4Å; K571-L575 WeakPolarHBondContact O-CD1 3.3Å; K571-L575 WeakPolarHBondContact O-CG 3.42Å; K571-L575 PolarHBondContact O-N 2.95Å; K571-L575 VanDerWaalsContact O-N 3.15Å; V572-L575 WeakPolarHBondContact O-CB 3.38Å; V572-L575 PolarHBondContact O-N 2.96Å; V572-L575 VanDerWaalsContact O-N 3.07Å; L575-F640 HydrophobicContact CD1-CZ 3.7Å
576	M	80.8	Confident	81.8	Confident	7 Å²	7	31.7 Å²	31.7	3%	0.034	15%	0.154	C	C	.	.	S	Bend	trans	-61.4	138.9	172.8	-74	174.1	166.5	0	0	111.4	V572 V573 L574 K580 R581 L584 L648	V572-M576 HydrophobicContact CG1-CE 4.08Å; V572-M576 WeakPolarHBondContact O-CG 3.2Å; V572-M576 PolarHBondContact O-N 3.17Å; V573-M576 WeakPolarHBondContact O-CB 3.37Å; V573-M576 PolarHBondContact O-N 2.94Å; L574-M576 VanDerWaalsContact C-N 3.33Å; M576-K580 HydrophobicContact CB-CB 3.74Å; M576-K580 HydrophobicContact CG-CB 3.68Å; M576-K580 HydrophobicContact SD-CB 4.1Å; M576-R581 HydrophobicContact CB-CG 3.77Å; M576-R581 PolarHBondContact O-NE 3.15Å; M576-R581 PolarHBondContact O-NH2 3.07Å; M576-L584 HydrophobicContact CE-CB 4.42Å; M576-L584 HydrophobicContact CE-CD2 4.19Å; M576-L584 HydrophobicContact SD-CB 4.34Å; M576-L584 HydrophobicContact SD-CD2 3.98Å; M576-L648 HydrophobicContact CE-CD2 3.66Å
577	D	72.8	Confident	80.9	Confident	60 Å²	60	32.8 Å²	32.8	32%	0.321	16%	0.159	S	C	.	.			trans	-69.3	170.3	162.2	50.6	46.9	0	0	0	111.6	E579 K580 R581	D577-E579 PolarHBondContact O-N 3.5Å; D577-E579 PolarHBondContact OD1-N 3.32Å; D577-K580 PolarHBondContact O-N 2.9Å; D577-K580 WeakPolarHBondContact OD1-CB 3.38Å; D577-K580 VanDerWaalsContact OD1-CG 3.29Å; D577-K580 WeakPolarHBondContact OD1-CG 3.09Å; D577-K580 PolarHBondContact OD1-N 3.1Å; D577-K580 IonicContact OD1-NZ 3.29Å; D577-K580 PolarHBondContact OD1-NZ 2.92Å; D577-K580 IonicContact OD2-NZ 3.03Å; D577-K580 PolarHBondContact OD2-NZ 2.94Å; D577-R581 WeakPolarHBondContact O-CG 3.4Å; D577-R581 PolarHBondContact O-N 3.22Å
578	A	66.3	Low	80.4	Confident	62 Å²	62	31.5 Å²	31.5	51%	0.512	15%	0.153	S	C	.	.	H	α-helix	trans	-56.1	-38.3	-178.7	0	0	0	0	0	112.5	R581 I582	A578-R581 PolarHBondContact O-N 3.49Å; A578-I582 WeakPolarHBondContact O-CB 3.48Å; A578-I582 WeakPolarHBondContact O-CD1 3.11Å; A578-I582 VanDerWaalsContact O-CG1 3.25Å; A578-I582 WeakPolarHBondContact O-CG1 3.49Å; A578-I582 PolarHBondContact O-N 3.12Å
579	E	66.1	Low	79.4	Confident	104 Å²	104	29.4 Å²	29.4	49%	0.486	15%	0.145	S	C	.	.	H	α-helix	trans	-61.4	-50.8	177.5	-174.8	-173.5	-176.8	0	0	111.7	D577 R581 I582 R583	D577-E579 PolarHBondContact O-N 3.5Å; D577-E579 PolarHBondContact OD1-N 3.32Å; E579-R581 PolarHBondContact O-N 3.16Å; E579-I582 PolarHBondContact O-N 2.97Å; E579-R583 WeakPolarHBondContact O-CG 3.43Å; E579-R583 PolarHBondContact O-N 2.86Å; E579-R583 IonicContact OE1-CZ 3.72Å; E579-R583 VanDerWaalsContact OE1-CZ 3.28Å; E579-R583 IonicContact OE1-NE 2.72Å; E579-R583 PolarHBondContact OE1-NE 3.11Å; E579-R583 IonicContact OE1-NH2 2.68Å; E579-R583 PolarHBondContact OE1-NH2 3.08Å
580	K	72.6	Confident	77.8	Confident	44 Å²	44	29.4 Å²	29.4	19%	0.191	15%	0.146	C	C	.	.	H	α-helix	trans	-66.5	-35.4	179.4	-71.3	168.9	-169.7	64.5	0	112.3	M576 D577 R583 L584 L648	M576-K580 HydrophobicContact CB-CB 3.74Å; M576-K580 HydrophobicContact CG-CB 3.68Å; M576-K580 HydrophobicContact SD-CB 4.1Å; D577-K580 PolarHBondContact O-N 2.9Å; D577-K580 WeakPolarHBondContact OD1-CB 3.38Å; D577-K580 VanDerWaalsContact OD1-CG 3.29Å; D577-K580 WeakPolarHBondContact OD1-CG 3.09Å; D577-K580 PolarHBondContact OD1-N 3.1Å; D577-K580 IonicContact OD1-NZ 3.29Å; D577-K580 PolarHBondContact OD1-NZ 2.92Å; D577-K580 IonicContact OD2-NZ 3.03Å; D577-K580 PolarHBondContact OD2-NZ 2.94Å; K580-R583 PolarHBondContact O-N 3.08Å; K580-L584 WeakPolarHBondContact O-CB 3.45Å; K580-L584 PolarHBondContact O-N 2.68Å; K580-L648 HydrophobicContact CD-CD2 4.3Å
581	R	82.6	Confident	76.3	Confident	26 Å²	26	29.7 Å²	29.7	10%	0.098	15%	0.148	C	C	.	.	H	α-helix	trans	-61.4	-45.6	172.4	-68.4	173.8	-169.2	-175.1	3.6	111.5	I272 V573 L574 M576 D577 A578 E579 L584 L585	I272-R581 VanDerWaalsContact O-CZ 3.31Å; I272-R581 PolarHBondContact O-NH1 3.08Å; I272-R581 PolarHBondContact O-NH2 3.38Å; V573-R581 HydrophobicContact CG1-CG 4.37Å; V573-R581 PolarHBondContact O-NE 2.89Å; V573-R581 VanDerWaalsContact O-NE 3.08Å; L574-R581 PolarHBondContact O-NH2 2.92Å; M576-R581 HydrophobicContact CB-CG 3.77Å; M576-R581 PolarHBondContact O-NE 3.15Å; M576-R581 PolarHBondContact O-NH2 3.07Å; D577-R581 WeakPolarHBondContact O-CG 3.4Å; D577-R581 PolarHBondContact O-N 3.22Å; A578-R581 PolarHBondContact O-N 3.49Å; E579-R581 PolarHBondContact O-N 3.16Å; R581-L584 PolarHBondContact O-N 3.27Å; R581-L585 WeakPolarHBondContact O-CB 3.28Å; R581-L585 PolarHBondContact O-N 2.77Å
582	I	73	Confident	75.2	Confident	49 Å²	49	28 Å²	28	25%	0.251	14%	0.141	S	C	.	.	H	α-helix	trans	-65.1	-41.3	177.3	-71.7	167.2	0	0	0	111.1	V544 A578 E579 L585 Q586 S592	V544-I582 HydrophobicContact CG2-CG1 4.07Å; A578-I582 WeakPolarHBondContact O-CB 3.48Å; A578-I582 WeakPolarHBondContact O-CD1 3.11Å; A578-I582 VanDerWaalsContact O-CG1 3.25Å; A578-I582 WeakPolarHBondContact O-CG1 3.49Å; A578-I582 PolarHBondContact O-N 3.12Å; E579-I582 PolarHBondContact O-N 2.97Å; I582-L585 WeakPolarHBondContact O-CB 2.99Å; I582-L585 PolarHBondContact O-N 3.18Å; I582-Q586 WeakPolarHBondContact O-CB 3.26Å; I582-Q586 PolarHBondContact O-N 2.99Å; I582-S592 VanDerWaalsContact CG2-CB 3.47Å
583	R	68.8	Low	74.5	Confident	102 Å²	102	28.2 Å²	28.2	39%	0.385	14%	0.141	S	C	.	.	H	α-helix	trans	-64.1	-41.9	174.8	-70.5	-176.5	-173.4	-170.6	1.3	112.4	E579 K580 Q586 F587 V651	E579-R583 WeakPolarHBondContact O-CG 3.43Å; E579-R583 PolarHBondContact O-N 2.86Å; E579-R583 IonicContact OE1-CZ 3.72Å; E579-R583 VanDerWaalsContact OE1-CZ 3.28Å; E579-R583 IonicContact OE1-NE 2.72Å; E579-R583 PolarHBondContact OE1-NE 3.11Å; E579-R583 IonicContact OE1-NH2 2.68Å; E579-R583 PolarHBondContact OE1-NH2 3.08Å; K580-R583 PolarHBondContact O-N 3.08Å; R583-Q586 PolarHBondContact O-N 3.06Å; R583-F587 WeakPolarHBondContact O-CB 3.28Å; R583-F587 PolarHBondContact O-N 3.16Å; R583-V651 HydrophobicContact CB-CG1 3.56Å
584	L	82.6	Confident	73.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.4	-41.3	174.2	174.5	63.6	0	0	0	111.6	W549 F569 V573 M576 K580 R581 Q586 F587 V588 L647 V651	W549-L584 HydrophobicContact CH2-CB 4.37Å; W549-L584 HydrophobicContact CH2-CD2 4.05Å; W549-L584 HydrophobicContact CH2-CG 4Å; W549-L584 HydrophobicContact CZ2-CG 4.46Å; F569-L584 HydrophobicContact CE2-CD2 4.16Å; F569-L584 HydrophobicContact CZ-CD2 4Å; V573-L584 HydrophobicContact CG2-CD2 3.58Å; M576-L584 HydrophobicContact CE-CB 4.42Å; M576-L584 HydrophobicContact CE-CD2 4.19Å; M576-L584 HydrophobicContact SD-CB 4.34Å; M576-L584 HydrophobicContact SD-CD2 3.98Å; K580-L584 WeakPolarHBondContact O-CB 3.45Å; K580-L584 PolarHBondContact O-N 2.68Å; R581-L584 PolarHBondContact O-N 3.27Å; L584-Q586 VanDerWaalsContact C-N 3.33Å; L584-F587 HydrophobicContact CD1-CD1 4.45Å; L584-F587 PolarHBondContact O-N 3.47Å; L584-V588 HydrophobicContact CD1-CG2 4.18Å; L584-V588 WeakPolarHBondContact O-CG2 3.29Å; L584-V588 PolarHBondContact O-N 3.25Å; L584-V588 VanDerWaalsContact O-N 3.14Å; L584-L647 HydrophobicContact CD1-CD1 3.92Å; L584-L647 HydrophobicContact CD1-CG 4.49Å; L584-V651 HydrophobicContact CB-CG1 4.5Å; L584-V651 HydrophobicContact CB-CG2 4.18Å; L584-V651 HydrophobicContact CD1-CG2 3.65Å
585	L	83.1	Confident	73.3	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-60.5	-45.2	174.5	-177.9	63	0	0	0	110.9	V544 W549 R581 I582 V588 T589 T591 V594 F599	V544-L585 HydrophobicContact CG2-CD2 4.13Å; W549-L585 HydrophobicContact CH2-CB 3.87Å; W549-L585 HydrophobicContact CH2-CD1 4.25Å; W549-L585 HydrophobicContact CZ2-CB 4.36Å; W549-L585 HydrophobicContact CZ2-CD1 3.99Å; W549-L585 HydrophobicContact CZ3-CB 4.46Å; R581-L585 WeakPolarHBondContact O-CB 3.28Å; R581-L585 PolarHBondContact O-N 2.77Å; I582-L585 WeakPolarHBondContact O-CB 2.99Å; I582-L585 PolarHBondContact O-N 3.18Å; L585-V588 PolarHBondContact O-N 2.57Å; L585-T589 HydrophobicContact CD1-CG2 3.78Å; L585-T589 WeakPolarHBondContact O-CB 3.47Å; L585-T589 WeakPolarHBondContact O-CG2 3.27Å; L585-T589 PolarHBondContact O-N 3.01Å; L585-T589 PolarHBondContact O-OG1 3.41Å; L585-T591 CarbonylContact C-O 3.47Å; L585-V594 HydrophobicContact CD2-CG2 3.64Å; L585-F599 HydrophobicContact CD1-CE1 3.5Å; L585-F599 HydrophobicContact CD1-CZ 3.78Å; L585-F599 HydrophobicContact CD2-CZ 4.26Å
586	Q	67.6	Low	72.6	Confident	41 Å²	41	28.8 Å²	28.8	19%	0.192	15%	0.146	C	C	.	.	H	α-helix	trans	-64	-43.5	177.2	-170.3	-164.4	-26.8	0	0	112	F355 I582 R583 L584 V588 G590 T591	F355-Q586 VanDerWaalsContact CE1-CD 3.46Å; I582-Q586 WeakPolarHBondContact O-CB 3.26Å; I582-Q586 PolarHBondContact O-N 2.99Å; R583-Q586 PolarHBondContact O-N 3.06Å; L584-Q586 VanDerWaalsContact C-N 3.33Å; Q586-V588 VanDerWaalsContact C-N 3.31Å; Q586-V588 PolarHBondContact O-N 2.92Å; Q586-G590 WeakPolarHBondContact O-CA 3.49Å; Q586-G590 PolarHBondContact O-N 2.87Å; Q586-T591 VanDerWaalsContact CA-O 3.23Å; Q586-T591 WeakPolarHBondContact CA-O 3.45Å; Q586-T591 PolarHBondContact N-O 2.96Å
587	F	77.3	Confident	72.5	Confident	24 Å²	24	29 Å²	29	11%	0.105	15%	0.147	C	C	.	.	H	α-helix	trans	-55.3	-46.2	176.2	175.8	-118.2	0	0	0	111.5	R583 L584 A625 T627 L632 A650 V651 A654	R583-F587 WeakPolarHBondContact O-CB 3.28Å; R583-F587 PolarHBondContact O-N 3.16Å; L584-F587 HydrophobicContact CD1-CD1 4.45Å; L584-F587 PolarHBondContact O-N 3.47Å; F587-A625 HydrophobicContact CD1-CB 4.05Å; F587-A625 HydrophobicContact CD2-CB 4.2Å; F587-A625 HydrophobicContact CE1-CB 3.88Å; F587-A625 HydrophobicContact CE2-CB 4.05Å; F587-A625 HydrophobicContact CG-CB 4.21Å; F587-A625 HydrophobicContact CZ-CB 3.89Å; F587-A625 WeakPolarHBondContact O-CB 3.36Å; F587-T627 WeakPolarHBondContact O-CG2 3.35Å; F587-L632 HydrophobicContact CD1-CD1 4.37Å; F587-L632 HydrophobicContact CE1-CD1 3.85Å; F587-A650 HydrophobicContact CE1-CB 4.41Å; F587-A650 HydrophobicContact CZ-CB 4.07Å; F587-V651 HydrophobicContact CB-CG2 4.21Å; F587-V651 HydrophobicContact CD1-CG2 3.91Å; F587-V651 HydrophobicContact CG-CG2 4.17Å; F587-A654 HydrophobicContact CD2-CB 3.51Å; F587-A654 HydrophobicContact CE2-CB 3.82Å
588	V	78.7	Confident	72.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-86.6	-26.9	-174.4	-177.3	0	0	0	0	114.2	L584 L585 Q586 F611 T627 L632	L584-V588 HydrophobicContact CD1-CG2 4.18Å; L584-V588 WeakPolarHBondContact O-CG2 3.29Å; L584-V588 PolarHBondContact O-N 3.25Å; L584-V588 VanDerWaalsContact O-N 3.14Å; L585-V588 PolarHBondContact O-N 2.57Å; Q586-V588 VanDerWaalsContact C-N 3.31Å; Q586-V588 PolarHBondContact O-N 2.92Å; V588-F611 HydrophobicContact CB-CE2 3.6Å; V588-F611 HydrophobicContact CB-CZ 4.14Å; V588-F611 HydrophobicContact CG1-CD2 3.92Å; V588-F611 HydrophobicContact CG1-CE2 3.29Å; V588-F611 HydrophobicContact CG1-CZ 3.77Å; V588-F611 HydrophobicContact CG2-CE2 4.09Å; V588-F611 HydrophobicContact CG2-CZ 4.14Å; V588-T627 WeakPolarHBondContact O-CA 3.28Å; V588-L632 HydrophobicContact CG1-CB 4.09Å; V588-L632 HydrophobicContact CG2-CB 3.97Å; V588-L632 HydrophobicContact CG2-CD1 3.96Å; V588-L632 HydrophobicContact CG2-CG 4.39Å
589	T	71.8	Confident	73.8	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.006	11%	0.107	C	C	.	.	H	α-helix	trans	-116.1	-14.7	-174.2	71.4	0	0	0	0	114.4	R351 L585 T591 F611 N630	R351-T589 VanDerWaalsContact CD-O 3.31Å; R351-T589 WeakPolarHBondContact CD-O 3.36Å; R351-T589 VanDerWaalsContact CZ-O 3.28Å; R351-T589 PolarHBondContact NH1-O 2.7Å; L585-T589 HydrophobicContact CD1-CG2 3.78Å; L585-T589 WeakPolarHBondContact O-CB 3.47Å; L585-T589 WeakPolarHBondContact O-CG2 3.27Å; L585-T589 PolarHBondContact O-N 3.01Å; L585-T589 PolarHBondContact O-OG1 3.41Å; T589-T591 VanDerWaalsContact C-N 3.34Å; T589-T591 WeakPolarHBondContact OG1-CG2 3.48Å; T589-T591 PolarHBondContact OG1-N 3.08Å; T589-T591 PolarHBondContact OG1-O 2.86Å; T589-F611 HydrophobicContact CG2-CD2 4.22Å; T589-N630 HydrophobicContact CG2-CB 4.21Å
590	G	60.3	Low	74.8	Confident	1 Å²	1	20.1 Å²	20.1	1%	0.01	10%	0.1	C	C	.	.	S	Bend	trans	77.6	11.6	-173.1	0	0	0	0	0	114.6	R351 Q586	R351-G590 CarbonylContact C-O 3.56Å; R351-G590 VanDerWaalsContact CB-O 3.22Å; R351-G590 WeakPolarHBondContact CB-O 3.3Å; Q586-G590 WeakPolarHBondContact O-CA 3.49Å; Q586-G590 PolarHBondContact O-N 2.87Å
591	T	62.5	Low	75.2	Confident	14 Å²	14	19.9 Å²	19.9	9%	0.086	10%	0.1	C	C	.	.			trans	-144.4	146.9	176.6	-176.2	0	0	0	0	112.2	L585 Q586 T589 R593	L585-T591 CarbonylContact C-O 3.47Å; Q586-T591 VanDerWaalsContact CA-O 3.23Å; Q586-T591 WeakPolarHBondContact CA-O 3.45Å; Q586-T591 PolarHBondContact N-O 2.96Å; T589-T591 VanDerWaalsContact C-N 3.34Å; T589-T591 WeakPolarHBondContact OG1-CG2 3.48Å; T589-T591 PolarHBondContact OG1-N 3.08Å; T589-T591 PolarHBondContact OG1-O 2.86Å; T591-R593 VanDerWaalsContact C-N 3.26Å; T591-R593 PolarHBondContact OG1-N 2.99Å
592	S	65.4	Low	74.8	Confident	3 Å²	3	19 Å²	19	2%	0.021	10%	0.097	C	C	.	.	S	Bend	trans	-76.6	-7.9	174.4	48.2	0	0	0	0	114.1	F355 D414 I582	F355-S592 WeakPolarHBondContact CD2-OG 3.4Å; F355-S592 WeakPolarHBondContact CE2-OG 3.42Å; D414-S592 PolarHBondContact OD1-OG 3.09Å; I582-S592 VanDerWaalsContact CG2-CB 3.47Å
593	R	73.7	Confident	74.5	Confident	8 Å²	8	19.5 Å²	19.5	3%	0.03	10%	0.096	C	C	.	.			trans	-117	142.8	-161.1	-53.1	-61.1	-68.9	-152.5	-1.5	112.4	L412 C539 G540 L541 T591	L412-R593 HydrophobicContact CB-CB 3.99Å; L412-R593 HydrophobicContact CB-CG 4.21Å; L412-R593 HydrophobicContact CD1-CB 3.54Å; L412-R593 HydrophobicContact CG-CB 4.39Å; C539-R593 VanDerWaalsContact O-CB 3.31Å; C539-R593 WeakPolarHBondContact O-CB 3.28Å; C539-R593 VanDerWaalsContact O-CG 3.23Å; C539-R593 WeakPolarHBondContact O-CG 3.31Å; C539-R593 PolarHBondContact O-NE 2.72Å; G540-R593 PolarHBondContact O-NH2 2.96Å; L541-R593 PolarHBondContact O-NE 3.3Å; T591-R593 VanDerWaalsContact C-N 3.26Å; T591-R593 PolarHBondContact OG1-N 2.99Å
594	V	78.6	Confident	74.2	Confident	3 Å²	3	15.1 Å²	15.1	2%	0.018	8%	0.082	C	C	.	.	B	Isolated β-bridge	trans	-98.2	139.7	177.6	-173.9	0	0	0	0	110	L541 V544 L585 F599	L541-V594 HydrophobicContact CB-CB 4.17Å; L541-V594 HydrophobicContact CD1-CB 4.38Å; L541-V594 HydrophobicContact CD1-CG1 4.36Å; L541-V594 PolarHBondContact N-O 3.17Å; L541-V594 PolarHBondContact O-N 3.04Å; V544-V594 HydrophobicContact CG2-CG2 4.04Å; L585-V594 HydrophobicContact CD2-CG2 3.64Å; V594-F599 HydrophobicContact CB-CE2 4.31Å; V594-F599 HydrophobicContact CG1-CD2 3.72Å; V594-F599 HydrophobicContact CG1-CE2 3.65Å; V594-F599 HydrophobicContact CG1-CG 4.43Å; V594-F599 HydrophobicContact CG1-CZ 4.31Å; V594-F599 HydrophobicContact CG2-CD2 4.48Å; V594-F599 HydrophobicContact CG2-CE2 3.58Å; V594-F599 HydrophobicContact CG2-CZ 3.71Å
595	P	72.4	Confident	72.8	Confident	26 Å²	26	16.9 Å²	16.9	17%	0.169	9%	0.094	C	C	.	.			trans	-58.9	155.1	172.5	-23.3	34.3	0	0	0	112.7	L541 N597 G598 E601 L602	L541-P595 VanDerWaalsContact CD1-O 3.31Å; L541-P595 WeakPolarHBondContact CD1-O 3.43Å; P595-N597 VanDerWaalsContact C-N 3.28Å; P595-N597 PolarHBondContact O-N 3.27Å; P595-N597 VanDerWaalsContact O-N 3.15Å; P595-G598 WeakPolarHBondContact O-CA 3.49Å; P595-G598 PolarHBondContact O-N 3.1Å; P595-E601 HydrophobicContact CB-CB 4.34Å; P595-E601 WeakPolarHBondContact CG-O 3.49Å; P595-L602 HydrophobicContact CG-CD2 4.13Å
596	M	68.4	Low	71.6	Confident	29 Å²	29	23.6 Å²	23.6	14%	0.143	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-38.5	-175.3	-178.4	167.1	177.2	0	0	115	V277 F283 L536 G598	V277-M596 WeakPolarHBondContact CG1-O 3.28Å; F283-M596 HydrophobicContact CB-CE 3.9Å; F283-M596 HydrophobicContact CB-SD 3.81Å; F283-M596 HydrophobicContact CD1-CB 4.04Å; F283-M596 HydrophobicContact CD1-CE 4.44Å; F283-M596 HydrophobicContact CD1-CG 4Å; F283-M596 HydrophobicContact CD1-SD 3.29Å; F283-M596 WeakPolarHBondContact CD1-SD 3.42Å; F283-M596 HydrophobicContact CD2-CE 4.33Å; F283-M596 HydrophobicContact CD2-SD 3.45Å; F283-M596 WeakPolarHBondContact CD2-SD 3.37Å; F283-M596 HydrophobicContact CE1-CB 3.72Å; F283-M596 HydrophobicContact CE1-CG 4.14Å; F283-M596 HydrophobicContact CE1-SD 3.59Å; F283-M596 VanDerWaalsContact CE1-SD 3.59Å; F283-M596 HydrophobicContact CE2-SD 3.72Å; F283-M596 HydrophobicContact CG-CE 3.98Å; F283-M596 HydrophobicContact CG-CG 4.44Å; F283-M596 HydrophobicContact CG-SD 3.2Å; F283-M596 WeakPolarHBondContact CG-SD 3.26Å; F283-M596 HydrophobicContact CZ-CB 4.3Å; F283-M596 HydrophobicContact CZ-SD 3.78Å; L536-M596 HydrophobicContact CB-CB 4.12Å; L536-M596 HydrophobicContact CB-CG 4.18Å; L536-M596 HydrophobicContact CB-SD 3.82Å; L536-M596 HydrophobicContact CD1-CE 3.65Å; L536-M596 HydrophobicContact CD1-CG 3.86Å; L536-M596 HydrophobicContact CD1-SD 3.47Å; L536-M596 WeakPolarHBondContact CD1-SD 3.3Å; L536-M596 HydrophobicContact CG-CG 4.41Å; L536-M596 HydrophobicContact CG-SD 4.22Å; M596-G598 PolarHBondContact O-N 2.67Å
597	N	77.3	Confident	71.4	Confident	10 Å²	10	22.8 Å²	22.8	5%	0.053	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	28.4	178	-75.8	-22	0	0	0	111.9	Y279 S280 P595 E601	Y279-N597 HydrophobicContact CD2-CB 3.81Å; Y279-N597 HydrophobicContact CE2-CB 4Å; Y279-N597 WeakPolarHBondContact CE2-ND2 3.2Å; S280-N597 PolarHBondContact N-OD1 3.4Å; S280-N597 PolarHBondContact O-ND2 2.92Å; P595-N597 VanDerWaalsContact C-N 3.28Å; P595-N597 PolarHBondContact O-N 3.27Å; P595-N597 VanDerWaalsContact O-N 3.15Å; N597-E601 HydrophobicContact CB-CB 4.41Å; N597-E601 HydrophobicContact CB-CG 3.88Å
598	G	80.9	Confident	71.2	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	72.9	-159.4	176	0	0	0	0	0	114	D548 P595 M596 A600 E601	D548-G598 WeakPolarHBondContact OD2-CA 3.44Å; P595-G598 WeakPolarHBondContact O-CA 3.49Å; P595-G598 PolarHBondContact O-N 3.1Å; M596-G598 PolarHBondContact O-N 2.67Å; G598-A600 PolarHBondContact O-N 3.4Å; G598-E601 PolarHBondContact O-N 2.96Å
599	F	86.1	Confident	71.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-68.7	-18.2	-177.5	-77.3	-98.8	0	0	0	113.4	V544 D548 W549 H552 L585 V594 E601 L602 L610	V544-F599 HydrophobicContact CG1-CE2 4.1Å; V544-F599 HydrophobicContact CG1-CZ 4.05Å; D548-F599 WeakPolarHBondContact OD2-CD2 3.28Å; D548-F599 PolarHBondContact OD2-N 2.85Å; W549-F599 HydrophobicContact CB-CD1 3.96Å; W549-F599 HydrophobicContact CB-CD2 3.69Å; W549-F599 HydrophobicContact CB-CE1 3.91Å; W549-F599 HydrophobicContact CB-CE2 3.61Å; W549-F599 HydrophobicContact CB-CG 3.88Å; W549-F599 HydrophobicContact CB-CZ 3.74Å; W549-F599 AromaticContact CD1-CD1 3.27Å; W549-F599 AromaticContact CD1-CE1 3.23Å; W549-F599 AromaticContact CD1-CZ 3.91Å; W549-F599 HydrophobicContact CD2-CD1 4.25Å; W549-F599 AromaticContact CD2-CE1 3.45Å; W549-F599 HydrophobicContact CD2-CE1 3.45Å; W549-F599 VanDerWaalsContact CD2-CE1 3.45Å; W549-F599 HydrophobicContact CD2-CE2 4.23Å; W549-F599 AromaticContact CD2-CZ 3.44Å; W549-F599 HydrophobicContact CD2-CZ 3.44Å; W549-F599 VanDerWaalsContact CD2-CZ 3.44Å; W549-F599 AromaticContact CE2-CE1 3.55Å; W549-F599 AromaticContact CE2-CZ 3.96Å; W549-F599 HydrophobicContact CE3-CE1 4.24Å; W549-F599 HydrophobicContact CE3-CE2 4.5Å; W549-F599 AromaticContact CE3-CZ 3.79Å; W549-F599 HydrophobicContact CE3-CZ 3.79Å; W549-F599 AromaticContact CG-CD1 3.57Å; W549-F599 HydrophobicContact CG-CD1 3.57Å; W549-F599 HydrophobicContact CG-CD2 4.15Å; W549-F599 AromaticContact CG-CE1 3.26Å; W549-F599 HydrophobicContact CG-CE1 3.26Å; W549-F599 AromaticContact CG-CE2 3.88Å; W549-F599 HydrophobicContact CG-CE2 3.88Å; W549-F599 HydrophobicContact CG-CG 4.03Å; W549-F599 AromaticContact CG-CZ 3.43Å; W549-F599 HydrophobicContact CG-CZ 3.43Å; W549-F599 VanDerWaalsContact CG-CZ 3.43Å; W549-F599 HydrophobicContact CZ2-CE1 4.37Å; W549-F599 AromaticContact NE1-CD1 3.83Å; W549-F599 AromaticContact NE1-CE1 3.43Å; H552-F599 HydrophobicContact CB-CB 3.78Å; L585-F599 HydrophobicContact CD1-CE1 3.5Å; L585-F599 HydrophobicContact CD1-CZ 3.78Å; L585-F599 HydrophobicContact CD2-CZ 4.26Å; V594-F599 HydrophobicContact CB-CE2 4.31Å; V594-F599 HydrophobicContact CG1-CD2 3.72Å; V594-F599 HydrophobicContact CG1-CE2 3.65Å; V594-F599 HydrophobicContact CG1-CG 4.43Å; V594-F599 HydrophobicContact CG1-CZ 4.31Å; V594-F599 HydrophobicContact CG2-CD2 4.48Å; V594-F599 HydrophobicContact CG2-CE2 3.58Å; V594-F599 HydrophobicContact CG2-CZ 3.71Å; F599-E601 VanDerWaalsContact C-N 3.26Å; F599-E601 PolarHBondContact O-N 2.88Å; F599-L602 HydrophobicContact CB-CD1 4.44Å; F599-L602 HydrophobicContact CD1-CD1 3.57Å; F599-L602 HydrophobicContact CD1-CG 4.26Å; F599-L602 HydrophobicContact CE1-CD1 4.24Å; F599-L602 HydrophobicContact CG-CD1 4.4Å; F599-L602 PolarHBondContact O-N 2.85Å; F599-L610 WeakPolarHBondContact O-CD2 3.34Å
600	A	86.1	Confident	72	Confident	40 Å²	40	32 Å²	32	33%	0.331	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-59.2	-32.6	174.1	0	0	0	0	0	113.7	G598 L610	G598-A600 PolarHBondContact O-N 3.4Å; A600-L610 WeakPolarHBondContact O-CD2 3.42Å
601	E	81.1	Confident	73.5	Confident	40 Å²	40	32 Å²	32	19%	0.187	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-106.9	30.5	-179.2	-70	-83.4	165.6	0	0	111.6	K284 P595 N597 G598 F599 Y603	K284-E601 WeakPolarHBondContact CE-OE1 3.41Å; K284-E601 VanDerWaalsContact NZ-CD 3.28Å; K284-E601 IonicContact NZ-OE1 2.67Å; K284-E601 PolarHBondContact NZ-OE1 2.84Å; K284-E601 IonicContact NZ-OE2 3.55Å; K284-E601 PolarHBondContact NZ-OE2 3.08Å; P595-E601 HydrophobicContact CB-CB 4.34Å; P595-E601 WeakPolarHBondContact CG-O 3.49Å; N597-E601 HydrophobicContact CB-CB 4.41Å; N597-E601 HydrophobicContact CB-CG 3.88Å; G598-E601 PolarHBondContact O-N 2.96Å; F599-E601 VanDerWaalsContact C-N 3.26Å; F599-E601 PolarHBondContact O-N 2.88Å; E601-Y603 WeakPolarHBondContact O-CD2 3.45Å; E601-Y603 WeakPolarHBondContact O-CE2 3.35Å; E601-Y603 PolarHBondContact OE2-OH 2.7Å
602	L	74.3	Confident	74.9	Confident	8 Å²	8	31.4 Å²	31.4	4%	0.042	18%	0.183	C	C	.	.			trans	-62.7	138.2	169.7	-84.7	176.7	0	0	0	111.6	P595 F599 Q609 F611	P595-L602 HydrophobicContact CG-CD2 4.13Å; F599-L602 HydrophobicContact CB-CD1 4.44Å; F599-L602 HydrophobicContact CD1-CD1 3.57Å; F599-L602 HydrophobicContact CD1-CG 4.26Å; F599-L602 HydrophobicContact CE1-CD1 4.24Å; F599-L602 HydrophobicContact CG-CD1 4.4Å; F599-L602 PolarHBondContact O-N 2.85Å; L602-Q609 CarbonylContact C-O 3.48Å; L602-Q609 VanDerWaalsContact CB-O 3.28Å; L602-Q609 WeakPolarHBondContact CB-O 3.44Å; L602-Q609 CarbonylContact O-C 3.22Å; L602-Q609 PolarHBondContact O-N 2.81Å; L602-F611 HydrophobicContact CD1-CB 3.83Å
603	Y	66.6	Low	76.4	Confident	59 Å²	59	31.2 Å²	31.2	23%	0.231	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	134.2	176.8	-77	-100.4	0	0	0	111	R351 E601 G607 P608 N630	R351-Y603 PolarHBondContact NH2-O 2.95Å; E601-Y603 WeakPolarHBondContact O-CD2 3.45Å; E601-Y603 WeakPolarHBondContact O-CE2 3.35Å; E601-Y603 PolarHBondContact OE2-OH 2.7Å; Y603-G607 CarbonylContact C-O 3.59Å; Y603-P608 HydrophobicContact CD1-CG 4.36Å; Y603-P608 HydrophobicContact CE1-CB 4.46Å; Y603-P608 HydrophobicContact CE1-CG 3.72Å; Y603-N630 PolarHBondContact O-ND2 3.07Å; Y603-N630 VanDerWaalsContact O-ND2 3.08Å
604	G	62.8	Low	77.4	Confident	9 Å²	9	32 Å²	32	9%	0.093	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-169.1	167.8	0	0	0	0	0	111.1	R351 N606 G607 C628	R351-G604 VanDerWaalsContact NH2-CA 3.33Å; G604-N606 VanDerWaalsContact C-N 3.28Å; G604-N606 PolarHBondContact O-N 3.05Å; G604-G607 PolarHBondContact N-O 3.01Å; G604-C628 CarbonylContact C-O 3.53Å; G604-C628 VanDerWaalsContact CA-O 3.31Å; G604-C628 WeakPolarHBondContact CA-O 3.21Å
605	S	54.8	Low	78.2	Confident	37 Å²	37	34.5 Å²	34.5	26%	0.259	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-15.6	178.2	-61.2	0	0	0	0	114.2	G347 C628	G347-S605 WeakPolarHBondContact CA-OG 3.05Å; S605-C628 PolarHBondContact N-O 3.23Å; S605-C628 VanDerWaalsContact OG-CA 3.3Å; S605-C628 WeakPolarHBondContact OG-CA 3.37Å; S605-C628 WeakPolarHBondContact OG-CB 3.31Å; S605-C628 PolarHBondContact OG-SG 3.47Å
606	N	56.8	Low	79.2	Confident	143 Å²	143	36.7 Å²	36.7	77%	0.765	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.8	8.9	-176.7	-63.7	-21.3	0	0	0	113.4	G604	G604-N606 VanDerWaalsContact C-N 3.28Å; G604-N606 PolarHBondContact O-N 3.05Å
607	G	64.4	Low	80.1	Confident	24 Å²	24	37.4 Å²	37.4	25%	0.247	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	125.7	-158.6	-174.7	0	0	0	0	0	112.7	Y603 G604 Q609	Y603-G607 CarbonylContact C-O 3.59Å; G604-G607 PolarHBondContact N-O 3.01Å; G607-Q609 PolarHBondContact O-N 2.85Å
608	P	73.4	Confident	80.7	Confident	101 Å²	101	40.1 Å²	40.1	66%	0.656	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-54.6	131.2	176.2	-24.1	33.9	0	0	0	111.9	Y603	Y603-P608 HydrophobicContact CD1-CG 4.36Å; Y603-P608 HydrophobicContact CE1-CB 4.46Å; Y603-P608 HydrophobicContact CE1-CG 3.72Å
609	Q	77.4	Confident	81.1	Confident	63 Å²	63	42 Å²	42	29%	0.294	25%	0.246	S	C	.	.			trans	-157.4	108.9	-177.3	175.9	58.3	68.4	0	0	109.3	L602 G607 F629 N630	L602-Q609 CarbonylContact C-O 3.48Å; L602-Q609 VanDerWaalsContact CB-O 3.28Å; L602-Q609 WeakPolarHBondContact CB-O 3.44Å; L602-Q609 CarbonylContact O-C 3.22Å; L602-Q609 PolarHBondContact O-N 2.81Å; G607-Q609 PolarHBondContact O-N 2.85Å; Q609-F629 WeakPolarHBondContact CG-O 3.28Å; Q609-N630 HydrophobicContact CG-CB 4.44Å; Q609-N630 PolarHBondContact O-ND2 2.82Å
610	L	88.1	Confident	81.2	Confident	55 Å²	55	47.5 Å²	47.5	29%	0.288	28%	0.275	S	S	.	.			trans	-65.9	156.6	177.6	-63.4	-179.3	0	0	0	112.2	H552 V554 F599 A600 T612	H552-L610 HydrophobicContact CB-CD2 4.46Å; V554-L610 HydrophobicContact CG2-CB 4Å; V554-L610 HydrophobicContact CG2-CD1 3.88Å; F599-L610 WeakPolarHBondContact O-CD2 3.34Å; A600-L610 WeakPolarHBondContact O-CD2 3.42Å; L610-T612 PolarHBondContact O-N 3.44Å; L610-T612 PolarHBondContact O-OG1 2.88Å
611	F	92.1	Very high	81.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.275	C	S	.	.			trans	-56.9	132.6	169.1	-169.1	-90.8	0	0	0	109.7	W549 T553 V554 F569 V588 T589 L602 I613 N630	W549-F611 AromaticContact CD1-CG 3.92Å; W549-F611 AromaticContact CE2-CD2 3.98Å; W549-F611 AromaticContact CE2-CE2 3.7Å; W549-F611 AromaticContact CE2-CZ 3.87Å; W549-F611 HydrophobicContact CZ2-CD2 4.16Å; W549-F611 HydrophobicContact CZ2-CE1 4.49Å; W549-F611 AromaticContact CZ2-CE2 3.48Å; W549-F611 HydrophobicContact CZ2-CE2 3.48Å; W549-F611 VanDerWaalsContact CZ2-CE2 3.48Å; W549-F611 AromaticContact CZ2-CZ 3.69Å; W549-F611 HydrophobicContact CZ2-CZ 3.69Å; W549-F611 AromaticContact NE1-CD1 3.38Å; W549-F611 AromaticContact NE1-CD2 3.21Å; W549-F611 AromaticContact NE1-CE1 3.51Å; W549-F611 AromaticContact NE1-CE2 3.32Å; W549-F611 VanDerWaalsContact NE1-CE2 3.32Å; W549-F611 AromaticContact NE1-CG 3.24Å; W549-F611 AromaticContact NE1-CZ 3.48Å; T553-F611 WeakPolarHBondContact CA-O 3.32Å; T553-F611 HydrophobicContact CG2-CD1 3.82Å; T553-F611 HydrophobicContact CG2-CE1 4.43Å; T553-F611 WeakPolarHBondContact OG1-CD1 3.34Å; V554-F611 PolarHBondContact N-O 3.42Å; F569-F611 HydrophobicContact CZ-CE1 4.39Å; F569-F611 HydrophobicContact CZ-CZ 4.36Å; V588-F611 HydrophobicContact CB-CE2 3.6Å; V588-F611 HydrophobicContact CB-CZ 4.14Å; V588-F611 HydrophobicContact CG1-CD2 3.92Å; V588-F611 HydrophobicContact CG1-CE2 3.29Å; V588-F611 HydrophobicContact CG1-CZ 3.77Å; V588-F611 HydrophobicContact CG2-CE2 4.09Å; V588-F611 HydrophobicContact CG2-CZ 4.14Å; T589-F611 HydrophobicContact CG2-CD2 4.22Å; L602-F611 HydrophobicContact CD1-CB 3.83Å; F611-I613 HydrophobicContact CD1-CG1 4.26Å; F611-I613 HydrophobicContact CE1-CD1 4.06Å; F611-I613 HydrophobicContact CE1-CG1 3.7Å; F611-N630 CarbonylContact C-O 3.49Å; F611-N630 WeakPolarHBondContact CA-O 3.31Å
612	T	93.1	Very high	81.6	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	132	-174	-57.5	0	0	0	0	110.7	V554 K556 L610 N630 R631 L632	V554-T612 HydrophobicContact CB-CG2 4.49Å; V554-T612 CarbonylContact O-C 3.55Å; V554-T612 VanDerWaalsContact O-CA 3.26Å; V554-T612 WeakPolarHBondContact O-CA 3.08Å; K556-T612 HydrophobicContact CD-CG2 3.73Å; K556-T612 HydrophobicContact CG-CG2 4.07Å; L610-T612 PolarHBondContact O-N 3.44Å; L610-T612 PolarHBondContact O-OG1 2.88Å; T612-N630 PolarHBondContact N-O 2.77Å; T612-R631 HydrophobicContact CG2-CG 4.08Å; T612-R631 CarbonylContact O-C 3.56Å; T612-R631 VanDerWaalsContact O-CA 3.27Å; T612-R631 WeakPolarHBondContact O-CA 3.33Å; T612-L632 PolarHBondContact O-N 2.86Å
613	I	96.9	Very high	82.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123.2	168.5	-50.6	-178.3	0	0	0	108.8	T553 V554 Y555 K556 Y559 I566 F569 F611 L632 L634	T553-I613 HydrophobicContact CG2-CD1 4.18Å; T553-I613 HydrophobicContact CG2-CG1 3.98Å; V554-I613 PolarHBondContact O-N 3.36Å; Y555-I613 CarbonylContact C-O 3.55Å; Y555-I613 WeakPolarHBondContact CA-O 3.38Å; Y555-I613 HydrophobicContact CD1-CB 4.21Å; Y555-I613 HydrophobicContact CE1-CD1 4.13Å; K556-I613 PolarHBondContact N-O 2.55Å; Y559-I613 HydrophobicContact CD2-CG2 4.03Å; Y559-I613 HydrophobicContact CE2-CG2 4.28Å; I566-I613 HydrophobicContact CD1-CB 4.23Å; I566-I613 HydrophobicContact CD1-CD1 4.21Å; I566-I613 HydrophobicContact CD1-CG2 3.78Å; F569-I613 HydrophobicContact CD1-CD1 3.56Å; F569-I613 HydrophobicContact CD2-CD1 4.39Å; F569-I613 HydrophobicContact CE1-CD1 3.49Å; F569-I613 VanDerWaalsContact CE1-CD1 3.49Å; F569-I613 HydrophobicContact CE2-CD1 4.34Å; F569-I613 HydrophobicContact CG-CD1 4.03Å; F569-I613 HydrophobicContact CZ-CD1 3.9Å; F611-I613 HydrophobicContact CD1-CG1 4.26Å; F611-I613 HydrophobicContact CE1-CD1 4.06Å; F611-I613 HydrophobicContact CE1-CG1 3.7Å; I613-L632 WeakPolarHBondContact CA-O 3.16Å; I613-L634 HydrophobicContact CG2-CB 3.75Å; I613-L634 HydrophobicContact CG2-CD2 3.79Å; I613-L634 HydrophobicContact CG2-CG 4.44Å
614	E	95	Very high	83.2	Confident	24 Å²	24	49 Å²	49	11%	0.112	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.3	-175.2	-171.2	161.1	151.4	0	0	110.2	K556 N557 W616 R631 L632 L634	K556-E614 HydrophobicContact CB-CB 4.08Å; K556-E614 HydrophobicContact CB-CG 3.78Å; K556-E614 VanDerWaalsContact CD-OE2 3.28Å; K556-E614 WeakPolarHBondContact CD-OE2 3.39Å; N557-E614 HydrophobicContact CB-CG 4.14Å; N557-E614 VanDerWaalsContact ND2-CD 3.34Å; N557-E614 WeakPolarHBondContact ND2-CG 3.26Å; N557-E614 PolarHBondContact ND2-OE1 3.29Å; E614-W616 PolarHBondContact O-N 2.88Å; E614-R631 HydrophobicContact CB-CG 4.23Å; E614-R631 IonicContact OE1-NH1 2.73Å; E614-R631 PolarHBondContact OE1-NH1 3.34Å; E614-R631 WeakPolarHBondContact OE2-CD 3.46Å; E614-R631 IonicContact OE2-CZ 2.81Å; E614-R631 IonicContact OE2-NE 2.7Å; E614-R631 IonicContact OE2-NH1 3.6Å; E614-R631 PolarHBondContact OE2-NH1 3.4Å; E614-L632 PolarHBondContact N-O 3.23Å; E614-L634 PolarHBondContact O-N 3.09Å
615	Q	95	Very high	84	Confident	55 Å²	55	49.7 Å²	49.7	26%	0.257	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	122	174.4	-174	169	3.1	0	0	109.7	K556 N557 Y559	K556-Q615 PolarHBondContact O-N 3.07Å; N557-Q615 HydrophobicContact CB-CB 4Å; N557-Q615 WeakPolarHBondContact CB-O 3.5Å; N557-Q615 PolarHBondContact ND2-O 2.92Å; N557-Q615 PolarHBondContact O-OE1 3.22Å; Y559-Q615 HydrophobicContact CD1-CB 3.94Å; Y559-Q615 HydrophobicContact CD1-CG 4.2Å; Y559-Q615 HydrophobicContact CD2-CB 3.72Å; Y559-Q615 HydrophobicContact CE1-CB 3.82Å; Y559-Q615 HydrophobicContact CE1-CG 3.68Å; Y559-Q615 HydrophobicContact CE2-CB 3.59Å; Y559-Q615 HydrophobicContact CE2-CG 4.1Å; Y559-Q615 HydrophobicContact CG-CB 3.89Å
616	W	92.4	Very high	84.9	Confident	73 Å²	73	50.7 Å²	50.7	28%	0.277	28%	0.282	S	S	.	.			trans	-150.7	143	-176.5	179.7	87.2	0	0	0	112.8	E614 K621 D633 L634 P635	E614-W616 PolarHBondContact O-N 2.88Å; W616-K621 HydrophobicContact CH2-CD 3.6Å; W616-K621 HydrophobicContact CZ3-CB 4.32Å; W616-K621 HydrophobicContact CZ3-CD 3.66Å; W616-D633 HydrophobicContact CB-CB 3.91Å; W616-D633 HydrophobicContact CD2-CB 4.43Å; W616-D633 HydrophobicContact CE3-CB 4.43Å; W616-D633 HydrophobicContact CG-CB 4.21Å; W616-L634 PolarHBondContact N-O 2.93Å; W616-P635 WeakPolarHBondContact O-CA 3.42Å
617	G	88.1	Confident	85.3	Confident	44 Å²	44	44 Å²	44	45%	0.454	25%	0.245	S	C	.	.	S	Bend	trans	73.6	-163	170.6	0	0	0	0	0	114.4
618	T	89.4	Confident	85.2	Confident	67 Å²	67	43.4 Å²	43.4	41%	0.411	24%	0.238	S	C	.	.			trans	-116.2	155.7	-175.2	45.1	0	0	0	0	110.4	D620 K621 P635	T618-D620 WeakPolarHBondContact CB-OD1 3.47Å; T618-D620 PolarHBondContact O-N 3.29Å; T618-D620 PolarHBondContact OG1-OD1 3.01Å; T618-K621 PolarHBondContact O-N 2.8Å; T618-P635 WeakPolarHBondContact O-CB 3.41Å
619	P	89.8	Confident	85.2	Confident	40 Å²	40	42.2 Å²	42.2	26%	0.26	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.5	-171.4	-25.7	35.2	0	0	0	115.2	K621 Y637 E638 K646	P619-K621 VanDerWaalsContact C-N 3.27Å; P619-K621 PolarHBondContact O-N 3.42Å; P619-Y637 HydrophobicContact CB-CD1 4.44Å; P619-Y637 WeakPolarHBondContact O-CD1 3.48Å; P619-Y637 WeakPolarHBondContact O-CE1 3.5Å; P619-E638 HydrophobicContact CB-CG 4.49Å; P619-E638 HydrophobicContact CG-CG 4.37Å; P619-K646 PolarHBondContact O-NZ 2.99Å
620	D	88.1	Confident	85.2	Confident	114 Å²	114	39.3 Å²	39.3	61%	0.61	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-23.1	175.2	56.1	-66.9	0	0	0	113.9	T618	T618-D620 WeakPolarHBondContact CB-OD1 3.47Å; T618-D620 PolarHBondContact O-N 3.29Å; T618-D620 PolarHBondContact OG1-OD1 3.01Å
621	K	87.2	Confident	85.2	Confident	76 Å²	76	39.1 Å²	39.1	33%	0.33	20%	0.204	S	C	.	.	S	Bend	trans	-82.3	154.4	-173.4	-57.6	-162.6	175.9	-155.2	0	113.1	W616 T618 P619 P635 Y637	W616-K621 HydrophobicContact CH2-CD 3.6Å; W616-K621 HydrophobicContact CZ3-CB 4.32Å; W616-K621 HydrophobicContact CZ3-CD 3.66Å; T618-K621 PolarHBondContact O-N 2.8Å; P619-K621 VanDerWaalsContact C-N 3.27Å; P619-K621 PolarHBondContact O-N 3.42Å; K621-P635 HydrophobicContact CB-CG 4.24Å; K621-Y637 WeakPolarHBondContact O-CE1 3.36Å; K621-Y637 PolarHBondContact O-OH 2.56Å
622	L	87.8	Confident	85.3	Confident	55 Å²	55	39.1 Å²	39.1	29%	0.288	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-76.6	154.3	168	-64.6	-179.7	0	0	0	111.2	K646 M649	L622-K646 HydrophobicContact CD2-CB 3.8Å; L622-K646 HydrophobicContact CD2-CG 3.85Å; L622-M649 HydrophobicContact CD1-SD 4.43Å; L622-M649 HydrophobicContact CD2-SD 3.98Å
623	P	90.5	Very high	85.2	Confident	5 Å²	5	39.4 Å²	39.4	3%	0.032	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-65.6	148.4	170.6	-16.5	32.5	0	0	0	110.7	L632 D633 L634 Y637 K646 L647	P623-L632 HydrophobicContact CB-CD1 3.88Å; P623-D633 WeakPolarHBondContact CA-O 3.42Å; P623-L634 HydrophobicContact CB-CD1 4.17Å; P623-L634 HydrophobicContact CG-CD1 4.01Å; P623-Y637 WeakPolarHBondContact CD-OH 3.15Å; P623-Y637 HydrophobicContact CG-CE2 4.23Å; P623-Y637 WeakPolarHBondContact CG-OH 3.31Å; P623-K646 WeakPolarHBondContact CD-O 3.1Å; P623-L647 HydrophobicContact CB-CD1 4.38Å; P623-L647 HydrophobicContact CG-CB 4.46Å; P623-L647 HydrophobicContact CG-CD1 4.15Å
624	R	83.6	Confident	85.1	Confident	43 Å²	43	39.4 Å²	39.4	16%	0.162	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	150	-178.4	-53	-167.6	-57.3	165.1	11.1	110.8	D633 V660 D661	R624-D633 HydrophobicContact CB-CB 4.36Å; R624-D633 PolarHBondContact N-O 2.82Å; R624-D633 PolarHBondContact O-N 3.31Å; R624-V660 WeakPolarHBondContact CD-O 3.39Å; R624-V660 PolarHBondContact NH1-O 2.73Å; R624-D661 IonicContact CZ-OD1 3.31Å; R624-D661 IonicContact NH1-OD1 3.86Å; R624-D661 PolarHBondContact NH1-OD1 2.76Å
625	A	79.7	Confident	85.1	Confident	23 Å²	23	38.3 Å²	38.3	19%	0.19	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.9	-175.9	0	0	0	0	0	112.5	F587 R631	F587-A625 HydrophobicContact CD1-CB 4.05Å; F587-A625 HydrophobicContact CD2-CB 4.2Å; F587-A625 HydrophobicContact CE1-CB 3.88Å; F587-A625 HydrophobicContact CE2-CB 4.05Å; F587-A625 HydrophobicContact CG-CB 4.21Å; F587-A625 HydrophobicContact CZ-CB 3.89Å; F587-A625 WeakPolarHBondContact O-CB 3.36Å; A625-R631 WeakPolarHBondContact CA-O 3.45Å
626	H	74.4	Confident	85	Confident	59 Å²	59	37.6 Å²	37.6	27%	0.273	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	88.2	170.8	-53.6	-96.7	0	0	0	109.3	C628 F629 N630 R631 D633	H626-C628 VanDerWaalsContact C-N 3.3Å; H626-C628 PolarHBondContact O-N 2.92Å; H626-F629 HydrophobicContact CB-CD2 3.94Å; H626-F629 CarbonylContact O-C 3.35Å; H626-F629 PolarHBondContact O-N 3.22Å; H626-N630 PolarHBondContact O-N 3.3Å; H626-R631 HydrophobicContact CB-CB 4.34Å; H626-R631 PolarHBondContact N-O 2.96Å; H626-R631 PolarHBondContact O-N 3.39Å; H626-D633 IonicContact CD2-OD1 2.69Å; H626-D633 PolarHBondContact CD2-OD1 2.79Å; H626-D633 IonicContact CD2-OD2 3.09Å; H626-D633 IonicContact CE1-OD2 3.84Å; H626-D633 VanDerWaalsContact NE2-CG 3.3Å; H626-D633 IonicContact NE2-OD1 2.73Å; H626-D633 PolarHBondContact NE2-OD1 3.34Å; H626-D633 IonicContact NE2-OD2 2.84Å; H626-D633 PolarHBondContact NE2-OD2 2.99Å
627	T	66.1	Low	85.1	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.006	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-66.2	-25.8	-170.4	65.2	0	0	0	0	113.9	D345 G348 R351 F587 V588 F629 N630 F657	D345-T627 WeakPolarHBondContact OD2-CA 3.39Å; D345-T627 PolarHBondContact OD2-N 3Å; D345-T627 PolarHBondContact OD2-OG1 3.21Å; G348-T627 WeakPolarHBondContact CA-OG1 3.39Å; R351-T627 PolarHBondContact NH1-O 2.87Å; R351-T627 PolarHBondContact NH2-O 3.31Å; F587-T627 WeakPolarHBondContact O-CG2 3.35Å; V588-T627 WeakPolarHBondContact O-CA 3.28Å; T627-F629 PolarHBondContact O-N 2.8Å; T627-N630 PolarHBondContact O-N 2.9Å; T627-N630 PolarHBondContact O-OD1 3.02Å; T627-F657 HydrophobicContact CG2-CD1 4.49Å; T627-F657 HydrophobicContact CG2-CE1 3.42Å; T627-F657 VanDerWaalsContact CG2-CE1 3.42Å; T627-F657 HydrophobicContact CG2-CZ 3.63Å
628	C	60.9	Low	85.3	Confident	13 Å²	13	40.1 Å²	40.1	9%	0.088	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-57.9	-28.6	170.1	-80.8	0	0	0	0	113.3	D345 G347 G348 G604 S605 H626	D345-C628 VanDerWaalsContact CG-SG 3.52Å; D345-C628 WeakPolarHBondContact OD1-CB 3.48Å; D345-C628 PolarHBondContact OD1-SG 3.39Å; D345-C628 PolarHBondContact OD2-N 2.82Å; G347-C628 VanDerWaalsContact CA-SG 3.52Å; G347-C628 PolarHBondContact N-SG 3.12Å; G348-C628 PolarHBondContact N-SG 2.63Å; G348-C628 VanDerWaalsContact N-SG 3.43Å; G604-C628 CarbonylContact C-O 3.53Å; G604-C628 VanDerWaalsContact CA-O 3.31Å; G604-C628 WeakPolarHBondContact CA-O 3.21Å; S605-C628 PolarHBondContact N-O 3.23Å; S605-C628 VanDerWaalsContact OG-CA 3.3Å; S605-C628 WeakPolarHBondContact OG-CA 3.37Å; S605-C628 WeakPolarHBondContact OG-CB 3.31Å; S605-C628 PolarHBondContact OG-SG 3.47Å; H626-C628 VanDerWaalsContact C-N 3.3Å; H626-C628 PolarHBondContact O-N 2.92Å
629	F	73.3	Confident	85.3	Confident	76 Å²	76	38.9 Å²	38.9	33%	0.333	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-111.1	4.2	-175.1	-53	-69.4	0	0	0	113.3	Q609 H626 T627 R631	Q609-F629 WeakPolarHBondContact CG-O 3.28Å; H626-F629 HydrophobicContact CB-CD2 3.94Å; H626-F629 CarbonylContact O-C 3.35Å; H626-F629 PolarHBondContact O-N 3.22Å; T627-F629 PolarHBondContact O-N 2.8Å; F629-R631 HydrophobicContact CB-CB 4.1Å; F629-R631 PolarHBondContact O-N 3.24Å
630	N	78.4	Confident	85.3	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	42.1	-173.5	-57.2	-24.2	0	0	0	111.5	R351 T589 Y603 Q609 F611 T612 H626 T627	R351-N630 PolarHBondContact NH2-OD1 2.61Å; T589-N630 HydrophobicContact CG2-CB 4.21Å; Y603-N630 PolarHBondContact O-ND2 3.07Å; Y603-N630 VanDerWaalsContact O-ND2 3.08Å; Q609-N630 HydrophobicContact CG-CB 4.44Å; Q609-N630 PolarHBondContact O-ND2 2.82Å; F611-N630 CarbonylContact C-O 3.49Å; F611-N630 WeakPolarHBondContact CA-O 3.31Å; T612-N630 PolarHBondContact N-O 2.77Å; H626-N630 PolarHBondContact O-N 3.3Å; T627-N630 PolarHBondContact O-N 2.9Å; T627-N630 PolarHBondContact O-OD1 3.02Å
631	R	88.1	Confident	85.4	Confident	51 Å²	51	37.3 Å²	37.3	19%	0.192	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	131	-168.4	-169.3	-162.5	-42.8	-163.9	25.1	112.1	T612 E614 A625 H626 F629 D633	T612-R631 HydrophobicContact CG2-CG 4.08Å; T612-R631 CarbonylContact O-C 3.56Å; T612-R631 VanDerWaalsContact O-CA 3.27Å; T612-R631 WeakPolarHBondContact O-CA 3.33Å; E614-R631 HydrophobicContact CB-CG 4.23Å; E614-R631 IonicContact OE1-NH1 2.73Å; E614-R631 PolarHBondContact OE1-NH1 3.34Å; E614-R631 WeakPolarHBondContact OE2-CD 3.46Å; E614-R631 IonicContact OE2-CZ 2.81Å; E614-R631 IonicContact OE2-NE 2.7Å; E614-R631 IonicContact OE2-NH1 3.6Å; E614-R631 PolarHBondContact OE2-NH1 3.4Å; A625-R631 WeakPolarHBondContact CA-O 3.45Å; H626-R631 HydrophobicContact CB-CB 4.34Å; H626-R631 PolarHBondContact N-O 2.96Å; H626-R631 PolarHBondContact O-N 3.39Å; F629-R631 HydrophobicContact CB-CB 4.1Å; F629-R631 PolarHBondContact O-N 3.24Å; R631-D633 WeakPolarHBondContact CD-OD1 3.32Å
632	L	92.9	Very high	85.7	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	114.9	167.1	-179.3	67.5	0	0	0	109.2	F569 F587 V588 T612 I613 E614 P623 L634 L647	F569-L632 HydrophobicContact CD2-CD2 4.1Å; F569-L632 HydrophobicContact CE2-CD2 3.44Å; F569-L632 VanDerWaalsContact CE2-CD2 3.44Å; F569-L632 HydrophobicContact CZ-CD2 4.11Å; F587-L632 HydrophobicContact CD1-CD1 4.37Å; F587-L632 HydrophobicContact CE1-CD1 3.85Å; V588-L632 HydrophobicContact CG1-CB 4.09Å; V588-L632 HydrophobicContact CG2-CB 3.97Å; V588-L632 HydrophobicContact CG2-CD1 3.96Å; V588-L632 HydrophobicContact CG2-CG 4.39Å; T612-L632 PolarHBondContact O-N 2.86Å; I613-L632 WeakPolarHBondContact CA-O 3.16Å; E614-L632 PolarHBondContact N-O 3.23Å; P623-L632 HydrophobicContact CB-CD1 3.88Å; L632-L634 HydrophobicContact CD2-CB 4.41Å; L632-L634 HydrophobicContact CD2-CD1 4.45Å; L632-L634 HydrophobicContact CG-CB 4.29Å; L632-L634 PolarHBondContact O-N 2.68Å; L632-L647 HydrophobicContact CD2-CD1 4.36Å
633	D	90.9	Very high	86	Confident	8 Å²	8	32.9 Å²	32.9	4%	0.043	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	109.4	165.2	-72.7	5.3	0	0	0	107.1	W616 P623 R624 H626 R631	W616-D633 HydrophobicContact CB-CB 3.91Å; W616-D633 HydrophobicContact CD2-CB 4.43Å; W616-D633 HydrophobicContact CE3-CB 4.43Å; W616-D633 HydrophobicContact CG-CB 4.21Å; P623-D633 WeakPolarHBondContact CA-O 3.42Å; R624-D633 HydrophobicContact CB-CB 4.36Å; R624-D633 PolarHBondContact N-O 2.82Å; R624-D633 PolarHBondContact O-N 3.31Å; H626-D633 IonicContact CD2-OD1 2.69Å; H626-D633 PolarHBondContact CD2-OD1 2.79Å; H626-D633 IonicContact CD2-OD2 3.09Å; H626-D633 IonicContact CE1-OD2 3.84Å; H626-D633 VanDerWaalsContact NE2-CG 3.3Å; H626-D633 IonicContact NE2-OD1 2.73Å; H626-D633 PolarHBondContact NE2-OD1 3.34Å; H626-D633 IonicContact NE2-OD2 2.84Å; H626-D633 PolarHBondContact NE2-OD2 2.99Å; R631-D633 WeakPolarHBondContact CD-OD1 3.32Å
634	L	95.6	Very high	86	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	116.3	-173	-178	68.6	0	0	0	110.1	Y559 V565 I566 F569 I613 E614 W616 P623 L632 Y637 L643	Y559-L634 HydrophobicContact CE2-CB 4.04Å; Y559-L634 HydrophobicContact CE2-CD2 4.32Å; Y559-L634 HydrophobicContact CE2-CG 4.36Å; Y559-L634 VanDerWaalsContact CE2-O 3.27Å; Y559-L634 WeakPolarHBondContact CE2-O 3.36Å; Y559-L634 PolarHBondContact OH-O 2.83Å; V565-L634 HydrophobicContact CG1-CD2 3.93Å; V565-L634 HydrophobicContact CG1-CG 4.27Å; I566-L634 HydrophobicContact CD1-CD2 4.41Å; F569-L634 HydrophobicContact CB-CD2 4.29Å; F569-L634 HydrophobicContact CD2-CD2 4.21Å; F569-L634 HydrophobicContact CG-CD2 4.49Å; I613-L634 HydrophobicContact CG2-CB 3.75Å; I613-L634 HydrophobicContact CG2-CD2 3.79Å; I613-L634 HydrophobicContact CG2-CG 4.44Å; E614-L634 PolarHBondContact O-N 3.09Å; W616-L634 PolarHBondContact N-O 2.93Å; P623-L634 HydrophobicContact CB-CD1 4.17Å; P623-L634 HydrophobicContact CG-CD1 4.01Å; L632-L634 HydrophobicContact CD2-CB 4.41Å; L632-L634 HydrophobicContact CD2-CD1 4.45Å; L632-L634 HydrophobicContact CG-CB 4.29Å; L632-L634 PolarHBondContact O-N 2.68Å; L634-Y637 HydrophobicContact CD1-CD2 4.39Å; L634-Y637 HydrophobicContact CD1-CE2 3.82Å; L634-L643 HydrophobicContact CD2-CD1 4.36Å
635	P	95	Very high	86.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.192	C	C	.	.			trans	-62.8	152.4	174.1	-25	35.3	0	0	0	113.9	Y559 W616 T618 K621 Y637	Y559-P635 PolarHBondContact OH-O 3.08Å; Y559-P635 VanDerWaalsContact OH-O 3.07Å; W616-P635 WeakPolarHBondContact O-CA 3.42Å; T618-P635 WeakPolarHBondContact O-CB 3.41Å; K621-P635 HydrophobicContact CB-CG 4.24Å; P635-Y637 HydrophobicContact CB-CD1 4.3Å; P635-Y637 HydrophobicContact CB-CE1 3.75Å; P635-Y637 HydrophobicContact CB-CE2 4.19Å; P635-Y637 WeakPolarHBondContact CD-OH 3.11Å; P635-Y637 HydrophobicContact CG-CE1 4.19Å; P635-Y637 HydrophobicContact CG-CE2 4.43Å; P635-Y637 WeakPolarHBondContact CG-OH 3.49Å; P635-Y637 VanDerWaalsContact O-CD2 3.28Å; P635-Y637 WeakPolarHBondContact O-CD2 3.46Å; P635-Y637 PolarHBondContact O-N 2.77Å
636	S	93.3	Very high	86.8	Confident	40 Å²	40	39.5 Å²	39.5	28%	0.28	19%	0.19	S	C	.	.			trans	-83.2	67.3	-178.4	-175.1	0	0	0	0	110.9	Y559	Y559-S636 VanDerWaalsContact OH-CA 3.27Å; Y559-S636 WeakPolarHBondContact OH-CA 3.45Å; Y559-S636 PolarHBondContact OH-N 2.84Å
637	Y	94.2	Very high	87.6	Confident	5 Å²	5	36.7 Å²	36.7	2%	0.02	18%	0.177	C	C	.	.			trans	-53.3	152.7	179.6	-59	-59.9	0	0	0	113.1	W568 P619 K621 P623 L634 P635 D642 L643 K646	W568-Y637 WeakPolarHBondContact CZ3-O 3.39Å; P619-Y637 HydrophobicContact CB-CD1 4.44Å; P619-Y637 WeakPolarHBondContact O-CD1 3.48Å; P619-Y637 WeakPolarHBondContact O-CE1 3.5Å; K621-Y637 WeakPolarHBondContact O-CE1 3.36Å; K621-Y637 PolarHBondContact O-OH 2.56Å; P623-Y637 WeakPolarHBondContact CD-OH 3.15Å; P623-Y637 HydrophobicContact CG-CE2 4.23Å; P623-Y637 WeakPolarHBondContact CG-OH 3.31Å; L634-Y637 HydrophobicContact CD1-CD2 4.39Å; L634-Y637 HydrophobicContact CD1-CE2 3.82Å; P635-Y637 HydrophobicContact CB-CD1 4.3Å; P635-Y637 HydrophobicContact CB-CE1 3.75Å; P635-Y637 HydrophobicContact CB-CE2 4.19Å; P635-Y637 WeakPolarHBondContact CD-OH 3.11Å; P635-Y637 HydrophobicContact CG-CE1 4.19Å; P635-Y637 HydrophobicContact CG-CE2 4.43Å; P635-Y637 WeakPolarHBondContact CG-OH 3.49Å; P635-Y637 VanDerWaalsContact O-CD2 3.28Å; P635-Y637 WeakPolarHBondContact O-CD2 3.46Å; P635-Y637 PolarHBondContact O-N 2.77Å; Y637-D642 WeakPolarHBondContact CD1-OD2 3.44Å; Y637-L643 VanDerWaalsContact CD2-CA 3.47Å; Y637-L643 HydrophobicContact CD2-CB 3.58Å; Y637-L643 HydrophobicContact CD2-CD1 4.09Å; Y637-L643 HydrophobicContact CD2-CG 3.8Å; Y637-L643 HydrophobicContact CE2-CB 4.36Å; Y637-L643 HydrophobicContact CE2-CG 4.31Å; Y637-L643 HydrophobicContact CG-CB 4.11Å; Y637-K646 HydrophobicContact CD1-CD 4.01Å; Y637-K646 HydrophobicContact CE1-CB 4.32Å; Y637-K646 HydrophobicContact CE1-CD 3.31Å; Y637-K646 HydrophobicContact CE1-CG 4.43Å
638	E	91.3	Very high	88.4	Confident	166 Å²	166	37.6 Å²	37.6	78%	0.776	18%	0.181	S	C	*	.	S	Bend	trans	-90.6	-17.8	-174.9	-59.8	-173.5	172.5	0	0	113.1	W568 P619	W568-E638 WeakPolarHBondContact CH2-O 3.48Å; P619-E638 HydrophobicContact CB-CG 4.49Å; P619-E638 HydrophobicContact CG-CG 4.37Å
639	S	91.2	Very high	89.5	Confident	40 Å²	40	40.4 Å²	40.4	28%	0.28	19%	0.194	S	C	.	.	S	Bend	trans	-139.7	164	177	73.2	0	0	0	0	113.1	W568 E641 D642 L643	W568-S639 VanDerWaalsContact CZ3-C 3.44Å; S639-E641 VanDerWaalsContact C-N 3.33Å; S639-D642 WeakPolarHBondContact OG-CB 3.3Å; S639-D642 PolarHBondContact OG-N 3.16Å; S639-D642 VanDerWaalsContact OG-N 3.11Å; S639-L643 PolarHBondContact O-N 3.06Å
640	F	88.9	Confident	89.8	Confident	17 Å²	17	37.3 Å²	37.3	8%	0.075	18%	0.182	C	C	.	.	H	α-helix	trans	-64.9	-39.4	173.6	167.4	-99.7	0	0	0	111.5	W568 K571 V572 L575 R644	W568-F640 HydrophobicContact CB-CD2 3.89Å; W568-F640 HydrophobicContact CD2-CB 4.19Å; W568-F640 HydrophobicContact CG-CB 4.05Å; W568-F640 HydrophobicContact CG-CD2 4.09Å; K571-F640 HydrophobicContact CB-CE2 3.91Å; K571-F640 HydrophobicContact CD-CD2 4.33Å; K571-F640 HydrophobicContact CD-CE2 3.97Å; K571-F640 HydrophobicContact CD-CZ 4.45Å; K571-F640 HydrophobicContact CG-CE2 3.74Å; K571-F640 HydrophobicContact CG-CZ 4.22Å; V572-F640 HydrophobicContact CG2-CD2 4.25Å; V572-F640 HydrophobicContact CG2-CE2 3.49Å; V572-F640 VanDerWaalsContact CG2-CE2 3.49Å; V572-F640 HydrophobicContact CG2-CZ 3.94Å; L575-F640 HydrophobicContact CD1-CZ 3.7Å; F640-R644 WeakPolarHBondContact O-CB 3.36Å; F640-R644 PolarHBondContact O-N 2.8Å
641	E	91.1	Very high	89.7	Confident	105 Å²	105	37.9 Å²	37.9	49%	0.491	19%	0.186	S	C	.	.	H	α-helix	trans	-63.7	-46	179.8	-67.3	66.6	-148.8	0	0	111.2	S639 R644 E645	S639-E641 VanDerWaalsContact C-N 3.33Å; E641-R644 PolarHBondContact O-N 2.88Å; E641-E645 WeakPolarHBondContact O-CB 3.21Å; E641-E645 PolarHBondContact O-N 2.86Å
642	D	91.9	Very high	88.9	Confident	38 Å²	38	39.8 Å²	39.8	20%	0.203	20%	0.197	C	C	.	.	H	α-helix	trans	-65.4	-43.1	-179.8	-169.6	44.4	0	0	0	111.8	Y637 S639 R644 K646	Y637-D642 WeakPolarHBondContact CD1-OD2 3.44Å; S639-D642 WeakPolarHBondContact OG-CB 3.3Å; S639-D642 PolarHBondContact OG-N 3.16Å; S639-D642 VanDerWaalsContact OG-N 3.11Å; D642-R644 PolarHBondContact O-N 2.84Å; D642-K646 WeakPolarHBondContact O-CB 3.5Å; D642-K646 WeakPolarHBondContact O-CG 3.29Å; D642-K646 PolarHBondContact O-N 2.77Å; D642-K646 VanDerWaalsContact O-N 3.11Å; D642-K646 WeakPolarHBondContact OD1-CE 3.17Å; D642-K646 IonicContact OD1-NZ 3.26Å; D642-K646 PolarHBondContact OD1-NZ 2.91Å; D642-K646 IonicContact OD2-NZ 3.89Å; D642-K646 PolarHBondContact OD2-NZ 2.93Å
643	L	94.6	Very high	87.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-48	171.3	-179.3	152.3	0	0	0	111.4	V565 W568 F569 V572 L634 Y637 S639 L647	V565-L643 HydrophobicContact CG1-CD1 3.65Å; V565-L643 VanDerWaalsContact O-CD1 3.31Å; V565-L643 WeakPolarHBondContact O-CD1 3.5Å; W568-L643 HydrophobicContact CB-CD1 4Å; F569-L643 HydrophobicContact CB-CD1 4.4Å; V572-L643 HydrophobicContact CB-CD2 4.37Å; V572-L643 HydrophobicContact CG2-CD2 3.71Å; L634-L643 HydrophobicContact CD2-CD1 4.36Å; Y637-L643 VanDerWaalsContact CD2-CA 3.47Å; Y637-L643 HydrophobicContact CD2-CB 3.58Å; Y637-L643 HydrophobicContact CD2-CD1 4.09Å; Y637-L643 HydrophobicContact CD2-CG 3.8Å; Y637-L643 HydrophobicContact CE2-CB 4.36Å; Y637-L643 HydrophobicContact CE2-CG 4.31Å; Y637-L643 HydrophobicContact CG-CB 4.11Å; S639-L643 PolarHBondContact O-N 3.06Å; L643-L647 HydrophobicContact CD2-CD2 4.23Å; L643-L647 WeakPolarHBondContact O-CB 3.27Å; L643-L647 PolarHBondContact O-N 2.99Å
644	R	90.1	Very high	86	Confident	50 Å²	50	46.9 Å²	46.9	19%	0.189	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-48	-175.4	174.2	-175.9	161.5	-154.9	-2	111.4	M228 V572 F640 E641 D642 L648	M228-R644 VanDerWaalsContact CB-NH2 3.33Å; M228-R644 VanDerWaalsContact CE-NH2 3.3Å; M228-R644 VanDerWaalsContact CG-NH2 3.28Å; M228-R644 PolarHBondContact O-NH1 2.94Å; M228-R644 PolarHBondContact O-NH2 2.85Å; V572-R644 HydrophobicContact CG1-CG 4.38Å; V572-R644 HydrophobicContact CG2-CB 3.7Å; V572-R644 HydrophobicContact CG2-CG 4.04Å; F640-R644 WeakPolarHBondContact O-CB 3.36Å; F640-R644 PolarHBondContact O-N 2.8Å; E641-R644 PolarHBondContact O-N 2.88Å; D642-R644 PolarHBondContact O-N 2.84Å; R644-L648 HydrophobicContact CG-CD1 3.99Å; R644-L648 WeakPolarHBondContact O-CB 3.26Å; R644-L648 VanDerWaalsContact O-CG 3.29Å; R644-L648 WeakPolarHBondContact O-CG 3.37Å; R644-L648 PolarHBondContact O-N 2.81Å
645	E	89.5	Confident	83.6	Confident	124 Å²	124	55.9 Å²	55.9	58%	0.579	28%	0.282	S	S	*	.	H	α-helix	trans	-62.6	-52	-179.9	-174.4	176.2	166.6	0	0	110.7	E641 L647 L648 M649	E641-E645 WeakPolarHBondContact O-CB 3.21Å; E641-E645 PolarHBondContact O-N 2.86Å; E645-L647 PolarHBondContact O-N 3.26Å; E645-L648 PolarHBondContact O-N 2.7Å; E645-M649 HydrophobicContact CG-CE 4.34Å; E645-M649 VanDerWaalsContact O-CB 3.25Å; E645-M649 WeakPolarHBondContact O-CB 3.4Å; E645-M649 PolarHBondContact O-N 2.79Å
646	K	91.4	Very high	81.1	Confident	35 Å²	35	56.6 Å²	56.6	15%	0.152	29%	0.289	C	S	.	.	H	α-helix	trans	-68	-33.6	-177.7	-69.1	175.1	174.6	150.3	0	113.3	P619 L622 P623 Y637 D642 A650	P619-K646 PolarHBondContact O-NZ 2.99Å; L622-K646 HydrophobicContact CD2-CB 3.8Å; L622-K646 HydrophobicContact CD2-CG 3.85Å; P623-K646 WeakPolarHBondContact CD-O 3.1Å; Y637-K646 HydrophobicContact CD1-CD 4.01Å; Y637-K646 HydrophobicContact CE1-CB 4.32Å; Y637-K646 HydrophobicContact CE1-CD 3.31Å; Y637-K646 HydrophobicContact CE1-CG 4.43Å; D642-K646 WeakPolarHBondContact O-CB 3.5Å; D642-K646 WeakPolarHBondContact O-CG 3.29Å; D642-K646 PolarHBondContact O-N 2.77Å; D642-K646 VanDerWaalsContact O-N 3.11Å; D642-K646 WeakPolarHBondContact OD1-CE 3.17Å; D642-K646 IonicContact OD1-NZ 3.26Å; D642-K646 PolarHBondContact OD1-NZ 2.91Å; D642-K646 IonicContact OD2-NZ 3.89Å; D642-K646 PolarHBondContact OD2-NZ 2.93Å; K646-A650 WeakPolarHBondContact O-CB 3.33Å; K646-A650 PolarHBondContact O-N 3.35Å
647	L	90.6	Very high	78.8	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-68.4	-44.4	174.3	-175.7	64.8	0	0	0	112	F569 V572 L584 P623 L632 L643 E645 V651	F569-L647 HydrophobicContact CD2-CD2 3.78Å; F569-L647 HydrophobicContact CE2-CD1 4.4Å; F569-L647 HydrophobicContact CE2-CD2 3.84Å; V572-L647 HydrophobicContact CG1-CD2 4.12Å; L584-L647 HydrophobicContact CD1-CD1 3.92Å; L584-L647 HydrophobicContact CD1-CG 4.49Å; P623-L647 HydrophobicContact CB-CD1 4.38Å; P623-L647 HydrophobicContact CG-CB 4.46Å; P623-L647 HydrophobicContact CG-CD1 4.15Å; L632-L647 HydrophobicContact CD2-CD1 4.36Å; L643-L647 HydrophobicContact CD2-CD2 4.23Å; L643-L647 WeakPolarHBondContact O-CB 3.27Å; L643-L647 PolarHBondContact O-N 2.99Å; E645-L647 PolarHBondContact O-N 3.26Å; L647-V651 WeakPolarHBondContact O-CB 3.18Å; L647-V651 VanDerWaalsContact O-CG2 3.27Å; L647-V651 WeakPolarHBondContact O-CG2 3.47Å; L647-V651 PolarHBondContact O-N 3.15Å; L647-V651 VanDerWaalsContact O-N 3.08Å
648	L	83.3	Confident	76.1	Confident	20 Å²	20	64 Å²	64	11%	0.105	32%	0.319	C	S	.	.	H	α-helix	trans	-64.5	-45.8	175.6	-72.6	169.3	0	0	0	110.9	M228 M576 K580 R644 E645 A650 V651 E652	M228-L648 HydrophobicContact CE-CD1 3.82Å; M576-L648 HydrophobicContact CE-CD2 3.66Å; K580-L648 HydrophobicContact CD-CD2 4.3Å; R644-L648 HydrophobicContact CG-CD1 3.99Å; R644-L648 WeakPolarHBondContact O-CB 3.26Å; R644-L648 VanDerWaalsContact O-CG 3.29Å; R644-L648 WeakPolarHBondContact O-CG 3.37Å; R644-L648 PolarHBondContact O-N 2.81Å; E645-L648 PolarHBondContact O-N 2.7Å; L648-A650 VanDerWaalsContact C-N 3.35Å; L648-A650 PolarHBondContact O-N 3.19Å; L648-V651 PolarHBondContact O-N 2.92Å; L648-E652 WeakPolarHBondContact O-CB 3.32Å; L648-E652 WeakPolarHBondContact O-CG 3.23Å; L648-E652 PolarHBondContact O-N 3.48Å
649	M	82.9	Confident	73.4	Confident	73 Å²	73	59.1 Å²	59.1	36%	0.36	31%	0.313	S	S	.	.	H	α-helix	trans	-57.2	-45	177.1	-172.6	-176.8	-59.6	0	0	112.2	L622 E645 N653	L622-M649 HydrophobicContact CD1-SD 4.43Å; L622-M649 HydrophobicContact CD2-SD 3.98Å; E645-M649 HydrophobicContact CG-CE 4.34Å; E645-M649 VanDerWaalsContact O-CB 3.25Å; E645-M649 WeakPolarHBondContact O-CB 3.4Å; E645-M649 PolarHBondContact O-N 2.79Å; M649-N653 WeakPolarHBondContact CG-ND2 3.23Å; M649-N653 WeakPolarHBondContact O-CB 3.19Å; M649-N653 VanDerWaalsContact O-CG 3.26Å; M649-N653 PolarHBondContact O-N 3.34Å; M649-N653 PolarHBondContact O-ND2 2.82Å
650	A	81.3	Confident	70.6	Confident	10 Å²	10	61.8 Å²	61.8	8%	0.083	33%	0.328	C	S	.	.	H	α-helix	trans	-66.2	-40.1	177	0	0	0	0	0	112.9	F587 K646 L648 A654	F587-A650 HydrophobicContact CE1-CB 4.41Å; F587-A650 HydrophobicContact CZ-CB 4.07Å; K646-A650 WeakPolarHBondContact O-CB 3.33Å; K646-A650 PolarHBondContact O-N 3.35Å; L648-A650 VanDerWaalsContact C-N 3.35Å; L648-A650 PolarHBondContact O-N 3.19Å; A650-A654 VanDerWaalsContact O-CB 3.31Å; A650-A654 WeakPolarHBondContact O-CB 3.36Å; A650-A654 PolarHBondContact O-N 3.27Å
651	V	75.5	Confident	67.8	Low	14 Å²	14	69.7 Å²	69.7	9%	0.085	37%	0.371	C	S	.	.	H	α-helix	trans	-71	-35	178.9	170.8	0	0	0	0	112.4	R583 L584 F587 L647 L648	R583-V651 HydrophobicContact CB-CG1 3.56Å; L584-V651 HydrophobicContact CB-CG1 4.5Å; L584-V651 HydrophobicContact CB-CG2 4.18Å; L584-V651 HydrophobicContact CD1-CG2 3.65Å; F587-V651 HydrophobicContact CB-CG2 4.21Å; F587-V651 HydrophobicContact CD1-CG2 3.91Å; F587-V651 HydrophobicContact CG-CG2 4.17Å; L647-V651 WeakPolarHBondContact O-CB 3.18Å; L647-V651 VanDerWaalsContact O-CG2 3.27Å; L647-V651 WeakPolarHBondContact O-CG2 3.47Å; L647-V651 PolarHBondContact O-N 3.15Å; L647-V651 VanDerWaalsContact O-N 3.08Å; L648-V651 PolarHBondContact O-N 2.92Å
652	E	71.6	Confident	66.6	Low	91 Å²	91	68 Å²	68	43%	0.425	37%	0.365	S	S	.	.	H	α-helix	trans	-79.8	-35	-179.7	-70.6	179.5	174.7	0	0	112.6	L648	L648-E652 WeakPolarHBondContact O-CB 3.32Å; L648-E652 WeakPolarHBondContact O-CG 3.23Å; L648-E652 PolarHBondContact O-N 3.48Å
653	N	65.5	Low	65.3	Low	120 Å²	120	69.5 Å²	69.5	64%	0.642	37%	0.373	S	S	*	.	H	α-helix	trans	-84.1	-7.2	179.4	-67.1	-24.3	0	0	0	114.3	M649 Q655	M649-N653 WeakPolarHBondContact CG-ND2 3.23Å; M649-N653 WeakPolarHBondContact O-CB 3.19Å; M649-N653 VanDerWaalsContact O-CG 3.26Å; M649-N653 PolarHBondContact O-N 3.34Å; M649-N653 PolarHBondContact O-ND2 2.82Å; N653-Q655 PolarHBondContact O-N 3.47Å
654	A	56.3	Low	63.7	Low	37 Å²	37	73.4 Å²	73.4	31%	0.306	39%	0.394	S	S	.	.			trans	-73.5	38.4	-179.7	0	0	0	0	0	114.8	F587 A650 G656	F587-A654 HydrophobicContact CD2-CB 3.51Å; F587-A654 HydrophobicContact CE2-CB 3.82Å; A650-A654 VanDerWaalsContact O-CB 3.31Å; A650-A654 WeakPolarHBondContact O-CB 3.36Å; A650-A654 PolarHBondContact O-N 3.27Å; A654-G656 PolarHBondContact O-N 3.34Å
655	Q	46	Very low	62.1	Low	189 Å²	189	74.8 Å²	74.8	88%	0.883	41%	0.406	S	S	*	.	S	Bend	trans	-76.8	72.1	169.6	-66	-165.8	12.7	0	0	110.2	N653	N653-Q655 PolarHBondContact O-N 3.47Å
656	G	42.9	Very low	60.4	Low	14 Å²	14	71.7 Å²	71.7	14%	0.144	40%	0.395	C	S	.	.	S	Bend	trans	121	139	-175.2	0	0	0	0	0	111.6	A654 E658	A654-G656 PolarHBondContact O-N 3.34Å; G656-E658 PolarHBondContact O-N 2.79Å
657	F	44.5	Very low	58.4	Low	44 Å²	44	74.1 Å²	74.1	19%	0.193	41%	0.412	C	S	.	.			trans	-81	58.2	176.8	-75.2	-84.7	0	0	0	111.8	E352 T627 G659	E352-F657 HydrophobicContact CB-CD2 4.49Å; E352-F657 HydrophobicContact CB-CE2 4.02Å; E352-F657 VanDerWaalsContact CD-CD2 3.43Å; E352-F657 HydrophobicContact CG-CD2 4.4Å; E352-F657 HydrophobicContact CG-CE2 4.04Å; E352-F657 WeakPolarHBondContact OE1-CD2 3.34Å; E352-F657 WeakPolarHBondContact OE2-CD2 3.23Å; T627-F657 HydrophobicContact CG2-CD1 4.49Å; T627-F657 HydrophobicContact CG2-CE1 3.42Å; T627-F657 VanDerWaalsContact CG2-CE1 3.42Å; T627-F657 HydrophobicContact CG2-CZ 3.63Å; F657-G659 PolarHBondContact O-N 2.75Å
658	E	37.6	Very low	56.1	Low	158 Å²	158	79.4 Å²	79.4	74%	0.738	44%	0.441	S	S	*	.			trans	-70.5	107.6	155.5	-68.2	-155.5	143.7	0	0	107.9	G656 V660	G656-E658 PolarHBondContact O-N 2.79Å; E658-V660 PolarHBondContact O-N 2.74Å
659	G	34.4	Very low	54	Low	63 Å²	63	84 Å²	84	65%	0.649	47%	0.467	S	S	*	.			trans	-62.3	107.6	167.6	0	0	0	0	0	108.5	F657 D661	F657-G659 PolarHBondContact O-N 2.75Å; G659-D661 PolarHBondContact O-N 2.91Å
660	V	32.9	Very low	51.6	Low	96 Å²	96	84.9 Å²	84.9	58%	0.582	48%	0.476	S	S	*	.			trans	-71.3	93.1	178.2	-155.8	0	0	0	0	108.6	R624 E658	R624-V660 WeakPolarHBondContact CD-O 3.39Å; R624-V660 PolarHBondContact NH1-O 2.73Å; E658-V660 PolarHBondContact O-N 2.74Å
661	D	30.2	Very low	48.9	Very low	183 Å²	183	91.7 Å²	91.7	98%	0.979	51%	0.511	S	S	*	.			trans	-92.4	0	167.8	-91	-17.9	0	0	0	111	R624 G659	R624-D661 IonicContact CZ-OD1 3.31Å; R624-D661 IonicContact NH1-OD1 3.86Å; R624-D661 PolarHBondContact NH1-OD1 2.76Å; G659-D661 PolarHBondContact O-N 2.91Å

Retrieved 661 of 661 residues in 2098.5 ms (Link to these results)

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