A0A061IIB3_CRIGR Loading...

Tripartite motif-containing 35

AlphaFold DB , UniProt , Accession A0A061IIB3, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Trim35, Length 524 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	36.7	Very low	35.1	Very low	253 Å²	253	134.9 Å²	134.9	100%	1.246	84%	0.835	S	S	*	*				0	110.8	0	-82.9	163.5	155.5	0	0	108
2	K	34.3	Very low	35.4	Very low	215 Å²	215	130.7 Å²	130.7	94%	0.935	82%	0.823	S	S	*	*			trans	-96	130.3	175.5	-85.6	174.9	167.6	177.7	0	108
3	A	27.6	Very low	35.5	Very low	105 Å²	105	126 Å²	126	87%	0.868	80%	0.804	S	S	*	*			trans	173.7	142.2	163	0	0	0	0	0	105.6
4	A	28.2	Very low	35.8	Very low	97 Å²	97	121.6 Å²	121.6	80%	0.802	79%	0.785	S	S	*	*			cis	-165.7	141.8	1.4	0	0	0	0	0	105.8
5	S	28.8	Very low	35.9	Very low	117 Å²	117	118.6 Å²	118.6	82%	0.818	78%	0.775	S	S	*	*			trans	179.2	71.1	156.3	171.9	0	0	0	0	110
6	V	31.6	Very low	36	Very low	133 Å²	133	115.9 Å²	115.9	81%	0.806	77%	0.766	S	S	*	*			trans	-147	83.2	157.6	-175.2	0	0	0	0	107
7	V	37.9	Very low	35.9	Very low	124 Å²	124	113.2 Å²	113.2	75%	0.752	76%	0.755	S	S	*	*			trans	-140	72.6	170.3	-172.2	0	0	0	0	108.4
8	T	38.9	Very low	35.9	Very low	149 Å²	149	111.3 Å²	111.3	91%	0.914	75%	0.749	S	S	*	*	S	Bend	trans	-159.8	37	161.9	40.2	0	0	0	0	111.8
9	S	42.8	Very low	35.8	Very low	92 Å²	92	110.3 Å²	110.3	64%	0.643	75%	0.749	S	S	*	*	S	Bend	trans	-127.5	-4.2	175.6	174.1	0	0	0	0	114.2
10	T	41	Very low	35.8	Very low	114 Å²	114	109.3 Å²	109.3	70%	0.699	75%	0.749	S	S	*	*	S	Bend	trans	-93.8	-8.1	-174.5	42.7	0	0	0	0	114.6
11	A	38.7	Very low	35.6	Very low	85 Å²	85	108.3 Å²	108.3	70%	0.702	75%	0.748	S	S	*	*	H	α-helix	trans	-85.2	-26.4	-179.6	0	0	0	0	0	113.9
12	A	37.9	Very low	35.6	Very low	84 Å²	84	101 Å²	101	69%	0.694	73%	0.728	S	S	*	*	H	α-helix	trans	-82.5	-24.4	179.2	0	0	0	0	0	113.3
13	A	37.8	Very low	35.6	Very low	70 Å²	70	95.3 Å²	95.3	58%	0.579	72%	0.722	S	S	*	*	H	α-helix	trans	-78.9	-23.6	176.6	0	0	0	0	0	113
14	A	38.8	Very low	35.7	Very low	65 Å²	65	99.5 Å²	99.5	54%	0.537	73%	0.726	S	S	.	*	H	α-helix	trans	-78.1	-24.9	-179.9	0	0	0	0	0	113.4
15	A	37.4	Very low	35.9	Very low	76 Å²	76	103.1 Å²	103.1	63%	0.628	73%	0.726	S	S	*	*	H	α-helix	trans	-80	-23.9	178.3	0	0	0	0	0	113.5
16	A	37.1	Very low	36.1	Very low	76 Å²	76	103 Å²	103	63%	0.628	72%	0.722	S	S	*	*	H	α-helix	trans	-82.4	-21.9	175.7	0	0	0	0	0	113.2
17	A	35.7	Very low	36.1	Very low	70 Å²	70	99.8 Å²	99.8	58%	0.579	72%	0.716	S	S	*	*	H	α-helix	trans	-82.2	-20.9	179.3	0	0	0	0	0	113.6
18	A	35	Very low	35.7	Very low	79 Å²	79	99.9 Å²	99.9	65%	0.653	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-13.8	-178.9	0	0	0	0	0	114.2
19	A	34.8	Very low	35.4	Very low	91 Å²	91	97.7 Å²	97.7	75%	0.752	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-5.6	178.5	0	0	0	0	0	114.1
20	A	34.2	Very low	35	Very low	90 Å²	90	100.2 Å²	100.2	74%	0.744	72%	0.721	S	S	*	*	S	Bend	trans	-100.8	1.2	-180	0	0	0	0	0	114.2
21	A	33.2	Very low	34.7	Very low	89 Å²	89	99.3 Å²	99.3	74%	0.736	72%	0.719	S	S	*	*	S	Bend	trans	-103.2	11.5	-171.6	0	0	0	0	0	115.4
22	A	35.7	Very low	34.5	Very low	99 Å²	99	101.4 Å²	101.4	82%	0.818	73%	0.726	S	S	*	*	S	Bend	trans	-126	63.2	-179.5	0	0	0	0	0	112.2
23	A	33.6	Very low	34.3	Very low	97 Å²	97	100.2 Å²	100.2	80%	0.802	72%	0.722	S	S	*	*			trans	-165.5	67.7	160.2	0	0	0	0	0	109.8
24	M	30	Very low	34.2	Very low	193 Å²	193	102.7 Å²	102.7	95%	0.951	73%	0.732	S	S	*	*			trans	-100.1	90.9	164.2	-90.9	179.8	70.9	0	0	108.5
25	E	33.7	Very low	34.3	Very low	172 Å²	172	105.3 Å²	105.3	80%	0.804	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-72.3	146.5	154.6	-76.5	-70.8	140.5	0	0	108.7	G27	E25-G27 PolarHBondContact O-N 3.22Å
26	P	32.8	Very low	34.6	Very low	115 Å²	115	110.6 Å²	110.6	75%	0.747	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-69.5	122.8	-174.6	29.2	-31.6	0	0	0	110.1
27	G	30.8	Very low	35.8	Very low	65 Å²	65	110 Å²	110	67%	0.67	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-60.6	144.9	175.2	0	0	0	0	0	111.7	E25	E25-G27 PolarHBondContact O-N 3.22Å
28	P	30.7	Very low	37.3	Very low	126 Å²	126	111.8 Å²	111.8	82%	0.818	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-64.6	139.5	179.1	27.3	-32.5	0	0	0	110.3	V30	P28-V30 PolarHBondContact O-N 3.07Å
29	S	30.8	Very low	38.9	Very low	104 Å²	104	111.7 Å²	111.7	73%	0.727	72%	0.721	S	S	*	*			trans	-45	131.5	172.5	51.6	0	0	0	0	112	S31	S29-S31 PolarHBondContact O-N 2.8Å
30	V	36.2	Very low	40.8	Very low	145 Å²	145	112.2 Å²	112.2	88%	0.879	71%	0.708	S	S	*	*			trans	-60.1	104.6	171.3	178.3	0	0	0	0	109.1	P28	P28-V30 PolarHBondContact O-N 3.07Å
31	S	32.9	Very low	43	Very low	94 Å²	94	113.6 Å²	113.6	66%	0.657	70%	0.699	S	S	*	*			trans	-91.1	135.1	160.8	-60.6	0	0	0	0	108.2	S29 G33	S29-S31 PolarHBondContact O-N 2.8Å; S31-G33 PolarHBondContact O-N 2.71Å; S31-G33 VanDerWaalsContact O-N 3.14Å
32	P	35.4	Very low	45.5	Very low	129 Å²	129	109.8 Å²	109.8	84%	0.838	67%	0.666	S	S	*	*			trans	-69.3	114.2	178.6	27.6	-28	0	0	0	108.6
33	G	33.1	Very low	48	Very low	59 Å²	59	108.1 Å²	108.1	61%	0.608	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-65.8	163	175.6	0	0	0	0	0	112.3	S31 S35	S31-G33 PolarHBondContact O-N 2.71Å; S31-G33 VanDerWaalsContact O-N 3.14Å; G33-S35 PolarHBondContact O-N 3.14Å
34	P	37.3	Very low	50.7	Low	122 Å²	122	103.5 Å²	103.5	79%	0.792	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-62.4	130.5	179.7	27.2	-32.5	0	0	0	109.6	R36	P34-R36 PolarHBondContact O-N 3.37Å; P34-R36 VanDerWaalsContact O-N 3.16Å
35	S	39	Very low	53.4	Low	121 Å²	121	96.6 Å²	96.6	85%	0.846	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-47.6	116.9	-179.2	-39.6	0	0	0	0	111	G33 S37	G33-S35 PolarHBondContact O-N 3.14Å; S35-S37 PolarHBondContact O-N 3.48Å
36	R	44.5	Very low	56	Low	186 Å²	186	90.8 Å²	90.8	70%	0.702	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-54.6	139	166.6	-76.3	-177.2	174.3	171.8	-0.5	108.3	P34 F38 E41	P34-R36 PolarHBondContact O-N 3.37Å; P34-R36 VanDerWaalsContact O-N 3.16Å; R36-F38 PolarHBondContact O-N 3.49Å; R36-E41 HydrophobicContact CB-CG 4.39Å
37	S	61.5	Low	58.6	Low	63 Å²	63	87.4 Å²	87.4	44%	0.441	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-57.1	128.4	171.2	171	0	0	0	0	107.9	S35 K39 E40	S35-S37 PolarHBondContact O-N 3.48Å; S37-K39 PolarHBondContact O-N 3.49Å; S37-E40 WeakPolarHBondContact O-CB 3.48Å; S37-E40 PolarHBondContact O-N 2.93Å
38	F	68.6	Low	61.2	Low	108 Å²	108	92.5 Å²	92.5	47%	0.474	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-24.5	179.2	176.4	-111.4	0	0	0	113.7	R36 L42 L101 L105	R36-F38 PolarHBondContact O-N 3.49Å; F38-L42 HydrophobicContact CD1-CD1 4.43Å; F38-L42 HydrophobicContact CE1-CD1 3.96Å; F38-L42 HydrophobicContact CZ-CD1 4.04Å; F38-L101 HydrophobicContact CZ-CD2 4.36Å; F38-L105 HydrophobicContact CD1-CD1 3.83Å; F38-L105 HydrophobicContact CD1-CD2 4.17Å; F38-L105 HydrophobicContact CD1-CG 4.39Å; F38-L105 HydrophobicContact CE1-CD1 3.56Å; F38-L105 HydrophobicContact CE1-CD2 4.26Å; F38-L105 HydrophobicContact CE1-CG 4.06Å
39	K	68.8	Low	63.8	Low	77 Å²	77	91.3 Å²	91.3	34%	0.335	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-32.7	176.7	-63.6	-176.6	177.5	-174.4	0	114.1	S37 E41 L42 L105 E109	S37-K39 PolarHBondContact O-N 3.49Å; K39-E41 VanDerWaalsContact C-N 3.32Å; K39-L42 PolarHBondContact O-N 3.05Å; K39-L105 HydrophobicContact CG-CD2 4.22Å; K39-E109 WeakPolarHBondContact CE-OE1 3.19Å; K39-E109 IonicContact NZ-OE1 2.64Å; K39-E109 PolarHBondContact NZ-OE1 3.24Å
40	E	73.4	Confident	66.5	Low	102 Å²	102	88.9 Å²	88.9	48%	0.477	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-73.9	-26.8	180	-64.5	179.8	165.2	0	0	112	S37 L42 L43	S37-E40 WeakPolarHBondContact O-CB 3.48Å; S37-E40 PolarHBondContact O-N 2.93Å; E40-L42 PolarHBondContact O-N 3.19Å; E40-L43 PolarHBondContact O-N 3.14Å
41	E	80.4	Confident	69	Low	119 Å²	119	82.4 Å²	82.4	56%	0.556	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-72.6	-11.3	176	-60.8	-172.2	170.6	0	0	113	R36 K39	R36-E41 HydrophobicContact CB-CG 4.39Å; K39-E41 VanDerWaalsContact C-N 3.32Å
42	L	87	Confident	71.6	Confident	10 Å²	10	84.9 Å²	84.9	5%	0.052	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-107	14.8	-178.8	-64.2	173.1	0	0	0	113.4	F38 K39 E40 P50 F51 L98 L101 V102 L105	F38-L42 HydrophobicContact CD1-CD1 4.43Å; F38-L42 HydrophobicContact CE1-CD1 3.96Å; F38-L42 HydrophobicContact CZ-CD1 4.04Å; K39-L42 PolarHBondContact O-N 3.05Å; E40-L42 PolarHBondContact O-N 3.19Å; L42-P50 WeakPolarHBondContact O-CA 3.41Å; L42-F51 VanDerWaalsContact C-CD2 3.46Å; L42-F51 VanDerWaalsContact C-CE2 3.44Å; L42-F51 WeakPolarHBondContact O-CD2 3.37Å; L42-F51 PolarHBondContact O-N 3.25Å; L42-L98 HydrophobicContact CD2-CD2 3.72Å; L42-L101 HydrophobicContact CD1-CB 4.27Å; L42-L101 HydrophobicContact CD2-CB 4.32Å; L42-V102 HydrophobicContact CB-CG2 3.97Å; L42-V102 HydrophobicContact CD1-CG2 4.5Å; L42-V102 HydrophobicContact CD2-CG2 4.46Å; L42-L105 HydrophobicContact CD1-CD1 3.1Å
43	L	88.1	Confident	74.2	Confident	64 Å²	64	81.2 Å²	81.2	34%	0.335	44%	0.436	S	S	.	.	B	Isolated β-bridge	trans	-96.2	141.4	176.6	-56.8	179.4	0	0	0	111.7	E40 D49 P50 F51	E40-L43 PolarHBondContact O-N 3.14Å; L43-D49 WeakPolarHBondContact CA-O 3.38Å; L43-P50 HydrophobicContact CD2-CB 4.48Å; L43-P50 HydrophobicContact CD2-CG 3.97Å; L43-F51 WeakPolarHBondContact O-CZ 3.5Å
44	C	90.2	Very high	77	Confident	0 Å²	0	78.4 Å²	78.4	0%	0	41%	0.407	C	S	.	.			trans	-73.3	126.7	173.4	175.8	0	0	0	0	111.3	V46 C47 Y48 D49 F51 C64	C44-V46 PolarHBondContact O-N 3.12Å; C44-C47 VanDerWaalsContact CB-SG 3.53Å; C44-Y48 WeakPolarHBondContact O-CA 3.45Å; C44-Y48 PolarHBondContact O-N 3.33Å; C44-D49 PolarHBondContact N-O 3.19Å; C44-F51 HydrophobicContact CB-CD1 3.8Å; C44-F51 HydrophobicContact CB-CE1 3.81Å; C44-C64 WeakPolarHBondContact CB-SG 3.21Å; C44-C64 PolarHBondContact SG-N 3.4Å
45	A	86.6	Confident	79.6	Confident	47 Å²	47	72.6 Å²	72.6	39%	0.388	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-3.8	-179.8	0	0	0	0	0	115.1	F63 V82	A45-F63 HydrophobicContact CB-CE1 4.08Å; A45-V82 HydrophobicContact CB-CG2 4.05Å
46	V	87.5	Confident	82.1	Confident	50 Å²	50	69.1 Å²	69.1	30%	0.303	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-51.6	177.4	177	0	0	0	0	111.6	C44 F63 C67 P81	C44-V46 PolarHBondContact O-N 3.12Å; V46-F63 HydrophobicContact CG2-CD1 3.71Å; V46-F63 HydrophobicContact CG2-CE1 4.06Å; V46-C67 HydrophobicContact CB-CB 3.71Å; V46-C67 HydrophobicContact CG1-CB 3.69Å; V46-C67 HydrophobicContact CG2-CB 4.28Å; V46-P81 HydrophobicContact CG2-CB 4.08Å; V46-P81 HydrophobicContact CG2-CG 4.1Å
47	C	87.8	Confident	84.2	Confident	44 Å²	44	60.8 Å²	60.8	30%	0.297	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-12	-180	63.9	0	0	0	0	114	C44 D49 C67	C44-C47 VanDerWaalsContact CB-SG 3.53Å; C47-D49 PolarHBondContact O-N 3.42Å; C47-D49 VanDerWaalsContact O-N 3.15Å; C47-C67 VanDerWaalsContact SG-SG 3.67Å
48	Y	84.8	Confident	85.3	Confident	172 Å²	172	66.3 Å²	66.3	68%	0.675	32%	0.324	S	S	*	.			trans	60.6	12.3	-176.1	-59.2	-90.5	0	0	0	115.1	C44	C44-Y48 WeakPolarHBondContact O-CA 3.45Å; C44-Y48 PolarHBondContact O-N 3.33Å
49	D	86.3	Confident	86.3	Confident	101 Å²	101	62.6 Å²	62.6	54%	0.54	31%	0.311	S	S	.	.	S	Bend	trans	-94.3	160.7	172.6	-63.6	-46.3	0	0	0	111.2	L43 C44 C47 F51	L43-D49 WeakPolarHBondContact CA-O 3.38Å; C44-D49 PolarHBondContact N-O 3.19Å; C47-D49 PolarHBondContact O-N 3.42Å; C47-D49 VanDerWaalsContact O-N 3.15Å; D49-F51 PolarHBondContact O-N 3.25Å
50	P	86.6	Confident	87.1	Confident	53 Å²	53	61.1 Å²	61.1	34%	0.344	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-50.8	141.2	169.7	-25.3	34.1	0	0	0	111.5	L42 L43 H52 V102	L42-P50 WeakPolarHBondContact O-CA 3.41Å; L43-P50 HydrophobicContact CD2-CB 4.48Å; L43-P50 HydrophobicContact CD2-CG 3.97Å; P50-H52 PolarHBondContact O-N 3.28Å; P50-H52 VanDerWaalsContact O-N 3.11Å; P50-V102 HydrophobicContact CB-CG1 3.65Å; P50-V102 HydrophobicContact CB-CG2 4.47Å
51	F	89	Confident	87.9	Confident	10 Å²	10	59.4 Å²	59.4	4%	0.044	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-56.4	122.4	-176	-65.9	-68.9	0	0	0	112	L42 L43 C44 D49 A54 N62 L98 V102	L42-F51 VanDerWaalsContact C-CD2 3.46Å; L42-F51 VanDerWaalsContact C-CE2 3.44Å; L42-F51 WeakPolarHBondContact O-CD2 3.37Å; L42-F51 PolarHBondContact O-N 3.25Å; L43-F51 WeakPolarHBondContact O-CZ 3.5Å; C44-F51 HydrophobicContact CB-CD1 3.8Å; C44-F51 HydrophobicContact CB-CE1 3.81Å; D49-F51 PolarHBondContact O-N 3.25Å; F51-A54 HydrophobicContact CB-CB 3.68Å; F51-A54 HydrophobicContact CD1-CB 4.41Å; F51-A54 HydrophobicContact CG-CB 4.05Å; F51-N62 VanDerWaalsContact CE1-C 3.46Å; F51-N62 HydrophobicContact CE1-CB 3.86Å; F51-N62 VanDerWaalsContact CE1-O 3.31Å; F51-N62 WeakPolarHBondContact CE1-O 3.49Å; F51-N62 HydrophobicContact CE2-CB 4.24Å; F51-N62 HydrophobicContact CZ-CB 3.59Å; F51-L98 HydrophobicContact CE2-CD1 4.47Å; F51-V102 HydrophobicContact CB-CG2 4.17Å
52	H	86.8	Confident	88.5	Confident	146 Å²	146	56 Å²	56	68%	0.676	30%	0.295	S	S	*	.	S	Bend	trans	-110.5	117	169.5	-175.4	-63.6	0	0	0	108.5	P50 C64	P50-H52 PolarHBondContact O-N 3.28Å; P50-H52 VanDerWaalsContact O-N 3.11Å; H52-C64 PolarHBondContact N-SG 3.29Å; H52-C64 WeakPolarHBondContact O-CB 3.36Å
53	D	90.3	Very high	88.8	Confident	51 Å²	51	55.6 Å²	55.6	27%	0.273	29%	0.293	S	S	.	.	S	Bend	trans	52.2	60.7	-170.4	-171.8	22.8	0	0	0	110.3	V55 R65 T94 N99	D53-V55 PolarHBondContact O-N 3.23Å; D53-R65 HydrophobicContact CB-CB 4.25Å; D53-R65 WeakPolarHBondContact O-CB 3.25Å; D53-R65 PolarHBondContact O-N 3.28Å; D53-R65 VanDerWaalsContact OD2-CB 3.32Å; D53-R65 WeakPolarHBondContact OD2-CB 3.44Å; D53-R65 WeakPolarHBondContact OD2-CD 3.39Å; D53-T94 WeakPolarHBondContact OD1-CG2 3.34Å; D53-T94 PolarHBondContact OD1-OG1 3.31Å; D53-N99 WeakPolarHBondContact CA-OD1 3.4Å; D53-N99 PolarHBondContact N-OD1 3.25Å
54	A	92	Very high	89	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54	135	179.3	0	0	0	0	0	110.3	F51 F63 T94 N95 L98 N99	F51-A54 HydrophobicContact CB-CB 3.68Å; F51-A54 HydrophobicContact CD1-CB 4.41Å; F51-A54 HydrophobicContact CG-CB 4.05Å; A54-F63 CarbonylContact C-O 3.6Å; A54-F63 WeakPolarHBondContact CA-O 3.46Å; A54-T94 CarbonylContact O-C 3.57Å; A54-T94 WeakPolarHBondContact O-CA 3.41Å; A54-N95 HydrophobicContact CB-CB 4.2Å; A54-N95 PolarHBondContact O-N 3.36Å; A54-L98 HydrophobicContact CB-CB 3.73Å; A54-L98 HydrophobicContact CB-CD1 4.25Å; A54-N99 WeakPolarHBondContact CB-OD1 3.11Å; A54-N99 PolarHBondContact N-OD1 2.85Å
55	V	92.6	Very high	89.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	142.8	171.1	-65	0	0	0	0	109.4	D53 N62 F63 R65 V68 L92	D53-V55 PolarHBondContact O-N 3.23Å; V55-N62 VanDerWaalsContact O-CA 3.31Å; V55-N62 WeakPolarHBondContact O-CA 3.42Å; V55-F63 WeakPolarHBondContact CG2-O 3.43Å; V55-F63 PolarHBondContact N-O 3.37Å; V55-F63 PolarHBondContact O-N 3.47Å; V55-R65 HydrophobicContact CG1-CB 3.88Å; V55-R65 HydrophobicContact CG1-CG 4.12Å; V55-V68 HydrophobicContact CG2-CG1 3.66Å; V55-L92 HydrophobicContact CB-CD2 4.13Å; V55-L92 HydrophobicContact CG1-CB 4.48Å; V55-L92 HydrophobicContact CG2-CD2 3.95Å
56	T	91.1	Very high	89.3	Confident	49 Å²	49	65 Å²	65	30%	0.301	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.2	178.4	-51.2	0	0	0	0	109.2	N62 N95	T56-N62 VanDerWaalsContact CB-OD1 3.29Å; T56-N62 WeakPolarHBondContact CB-OD1 3.45Å; T56-N62 VanDerWaalsContact CG2-OD1 3.3Å; T56-N62 WeakPolarHBondContact CG2-OD1 3.31Å; T56-N62 PolarHBondContact OG1-OD1 3.07Å; T56-N95 PolarHBondContact OG1-ND2 2.94Å
57	L	88.9	Confident	89.4	Confident	11 Å²	11	63.7 Å²	63.7	6%	0.058	31%	0.308	C	S	.	.			trans	-77.2	163	173	-61.7	-172.3	0	0	0	110.7	C59 G60 H61 F63 V68 W72 C80 A87 L92	L57-C59 PolarHBondContact O-N 3Å; L57-C59 VanDerWaalsContact O-N 3.15Å; L57-G60 WeakPolarHBondContact O-CA 3.41Å; L57-G60 PolarHBondContact O-N 3.25Å; L57-H61 PolarHBondContact N-O 3.43Å; L57-F63 HydrophobicContact CD1-CD2 4.01Å; L57-F63 HydrophobicContact CD1-CE2 3.65Å; L57-F63 HydrophobicContact CG-CD2 4.07Å; L57-F63 HydrophobicContact CG-CE2 4.06Å; L57-V68 HydrophobicContact CD1-CG2 4.25Å; L57-V68 HydrophobicContact CD2-CG2 4.24Å; L57-W72 HydrophobicContact CD1-CZ2 4.45Å; L57-W72 HydrophobicContact CD2-CH2 3.94Å; L57-W72 HydrophobicContact CD2-CZ2 3.76Å; L57-C80 HydrophobicContact CD1-CB 3.79Å; L57-A87 HydrophobicContact CD1-CB 4.45Å; L57-L92 HydrophobicContact CD2-CD2 3.52Å
58	R	85.4	Confident	89.6	Confident	178 Å²	178	61.6 Å²	61.6	67%	0.672	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-33.4	177	-70.5	-175.4	173.1	-147.5	2	113.6	G60 E91	R58-G60 PolarHBondContact O-N 3Å; R58-G60 VanDerWaalsContact O-N 3.16Å; R58-E91 IonicContact CZ-OE1 3.56Å; R58-E91 IonicContact CZ-OE2 2.88Å; R58-E91 IonicContact NE-OE2 2.79Å; R58-E91 PolarHBondContact NE-OE2 2.99Å; R58-E91 IonicContact NH2-OE1 3.26Å; R58-E91 PolarHBondContact NH2-OE1 3.17Å; R58-E91 IonicContact NH2-OE2 3.18Å; R58-E91 PolarHBondContact NH2-OE2 2.94Å
59	C	88.4	Confident	89.7	Confident	31 Å²	31	55.8 Å²	55.8	21%	0.209	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	0.4	174.7	65.9	0	0	0	0	114.2	L57 H61 C80 C83 E85	L57-C59 PolarHBondContact O-N 3Å; L57-C59 VanDerWaalsContact O-N 3.15Å; C59-H61 VanDerWaalsContact C-N 3.32Å; C59-H61 PolarHBondContact O-N 3.48Å; C59-H61 PolarHBondContact SG-ND1 3.18Å; C59-H61 VanDerWaalsContact SG-ND1 3.37Å; C59-C80 PolarHBondContact SG-SG 2.95Å; C59-C83 VanDerWaalsContact CB-SG 3.56Å; C59-E85 HydrophobicContact CB-CB 4.11Å; C59-E85 WeakPolarHBondContact CB-OE2 3.48Å
60	G	85.8	Confident	89.8	Confident	45 Å²	45	53.9 Å²	53.9	46%	0.464	27%	0.271	S	S	.	.	S	Bend	trans	84.4	-8.5	179.5	0	0	0	0	0	115.6	L57 R58 N62	L57-G60 WeakPolarHBondContact O-CA 3.41Å; L57-G60 PolarHBondContact O-N 3.25Å; R58-G60 PolarHBondContact O-N 3Å; R58-G60 VanDerWaalsContact O-N 3.16Å; G60-N62 PolarHBondContact O-ND2 3.43Å
61	H	91.2	Very high	89.7	Confident	67 Å²	67	52.7 Å²	52.7	31%	0.31	26%	0.263	S	S	.	.			trans	-75.7	142.1	178.3	-67.9	96.9	0	0	0	112.4	L57 C59 F63 V82	L57-H61 PolarHBondContact N-O 3.43Å; C59-H61 VanDerWaalsContact C-N 3.32Å; C59-H61 PolarHBondContact O-N 3.48Å; C59-H61 PolarHBondContact SG-ND1 3.18Å; C59-H61 VanDerWaalsContact SG-ND1 3.37Å; H61-F63 HydrophobicContact CB-CE2 3.56Å; H61-F63 HydrophobicContact CB-CZ 3.76Å; H61-V82 WeakPolarHBondContact NE2-CG1 3.19Å
62	N	91.7	Very high	89.7	Confident	47 Å²	47	53.2 Å²	53.2	25%	0.251	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.2	-175.1	-57.2	-70.4	0	0	0	111.5	F51 V55 T56 G60 L98	F51-N62 VanDerWaalsContact CE1-C 3.46Å; F51-N62 HydrophobicContact CE1-CB 3.86Å; F51-N62 VanDerWaalsContact CE1-O 3.31Å; F51-N62 WeakPolarHBondContact CE1-O 3.49Å; F51-N62 HydrophobicContact CE2-CB 4.24Å; F51-N62 HydrophobicContact CZ-CB 3.59Å; V55-N62 VanDerWaalsContact O-CA 3.31Å; V55-N62 WeakPolarHBondContact O-CA 3.42Å; T56-N62 VanDerWaalsContact CB-OD1 3.29Å; T56-N62 WeakPolarHBondContact CB-OD1 3.45Å; T56-N62 VanDerWaalsContact CG2-OD1 3.3Å; T56-N62 WeakPolarHBondContact CG2-OD1 3.31Å; T56-N62 PolarHBondContact OG1-OD1 3.07Å; G60-N62 PolarHBondContact O-ND2 3.43Å; N62-L98 HydrophobicContact CB-CD1 3.77Å; N62-L98 WeakPolarHBondContact OD1-CD1 3.48Å
63	F	93.1	Very high	89.6	Confident	1 Å²	1	53.3 Å²	53.3	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	161.3	-179.9	-55.5	-80.3	0	0	0	110.7	A45 V46 A54 V55 L57 H61 V68 P81 V82	A45-F63 HydrophobicContact CB-CE1 4.08Å; V46-F63 HydrophobicContact CG2-CD1 3.71Å; V46-F63 HydrophobicContact CG2-CE1 4.06Å; A54-F63 CarbonylContact C-O 3.6Å; A54-F63 WeakPolarHBondContact CA-O 3.46Å; V55-F63 WeakPolarHBondContact CG2-O 3.43Å; V55-F63 PolarHBondContact N-O 3.37Å; V55-F63 PolarHBondContact O-N 3.47Å; L57-F63 HydrophobicContact CD1-CD2 4.01Å; L57-F63 HydrophobicContact CD1-CE2 3.65Å; L57-F63 HydrophobicContact CG-CD2 4.07Å; L57-F63 HydrophobicContact CG-CE2 4.06Å; H61-F63 HydrophobicContact CB-CE2 3.56Å; H61-F63 HydrophobicContact CB-CZ 3.76Å; F63-V68 HydrophobicContact CB-CB 4.04Å; F63-V68 HydrophobicContact CD2-CG2 4.42Å; F63-V68 HydrophobicContact CG-CB 4.4Å; F63-P81 HydrophobicContact CD1-CG 4.38Å; F63-P81 HydrophobicContact CE1-CB 3.97Å; F63-P81 HydrophobicContact CE1-CG 3.95Å; F63-P81 HydrophobicContact CE2-CG 4.48Å; F63-P81 HydrophobicContact CZ-CB 4.15Å; F63-P81 HydrophobicContact CZ-CG 4.02Å; F63-V82 HydrophobicContact CE1-CG2 3.84Å; F63-V82 HydrophobicContact CZ-CB 4.38Å; F63-V82 HydrophobicContact CZ-CG2 3.72Å
64	C	92.9	Very high	89	Confident	8 Å²	8	56.8 Å²	56.8	5%	0.054	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	138.2	161.7	-57.1	0	0	0	0	109.1	C44 H52 R66 C67 V68	C44-C64 WeakPolarHBondContact CB-SG 3.21Å; C44-C64 PolarHBondContact SG-N 3.4Å; H52-C64 PolarHBondContact N-SG 3.29Å; H52-C64 WeakPolarHBondContact O-CB 3.36Å; C64-R66 VanDerWaalsContact C-N 3.26Å; C64-R66 PolarHBondContact O-N 3.14Å; C64-C67 HydrophobicContact CB-CB 4.11Å; C64-C67 WeakPolarHBondContact O-CB 3.33Å; C64-C67 PolarHBondContact O-N 3.22Å; C64-V68 PolarHBondContact O-N 3.46Å; C64-V68 VanDerWaalsContact O-N 3.15Å
65	R	91.4	Very high	88.4	Confident	96 Å²	96	59.6 Å²	59.6	36%	0.362	30%	0.301	S	S	.	.	H	α-helix	trans	-50.6	-45.5	179.4	-172.1	178.8	-174.4	90.8	4	112.5	D53 V55 C67 V68 T69 L92	D53-R65 HydrophobicContact CB-CB 4.25Å; D53-R65 WeakPolarHBondContact O-CB 3.25Å; D53-R65 PolarHBondContact O-N 3.28Å; D53-R65 VanDerWaalsContact OD2-CB 3.32Å; D53-R65 WeakPolarHBondContact OD2-CB 3.44Å; D53-R65 WeakPolarHBondContact OD2-CD 3.39Å; V55-R65 HydrophobicContact CG1-CB 3.88Å; V55-R65 HydrophobicContact CG1-CG 4.12Å; R65-C67 PolarHBondContact O-N 2.91Å; R65-V68 WeakPolarHBondContact O-CG1 3.36Å; R65-T69 WeakPolarHBondContact O-CB 3.39Å; R65-T69 PolarHBondContact O-N 3.16Å; R65-T69 VanDerWaalsContact O-N 3.12Å; R65-T69 PolarHBondContact O-OG1 2.74Å; R65-L92 PolarHBondContact NH1-O 2.99Å
66	R	91.1	Very high	87.6	Confident	206 Å²	206	66.7 Å²	66.7	78%	0.777	35%	0.345	S	S	*	.	H	α-helix	trans	-61.9	-44.3	178.5	-67.4	-176.1	68.1	155.2	1.4	112.3	C64 T69 S70	C64-R66 VanDerWaalsContact C-N 3.26Å; C64-R66 PolarHBondContact O-N 3.14Å; R66-T69 PolarHBondContact O-N 2.84Å; R66-S70 WeakPolarHBondContact O-CB 3.22Å; R66-S70 PolarHBondContact O-N 2.69Å; R66-S70 PolarHBondContact O-OG 3.1Å
67	C	91.1	Very high	87.1	Confident	22 Å²	22	68.3 Å²	68.3	15%	0.149	36%	0.355	C	S	.	.	H	α-helix	trans	-62.4	-46.1	-177.3	-69	0	0	0	0	112.2	V46 C47 C64 R65 C71	V46-C67 HydrophobicContact CB-CB 3.71Å; V46-C67 HydrophobicContact CG1-CB 3.69Å; V46-C67 HydrophobicContact CG2-CB 4.28Å; C47-C67 VanDerWaalsContact SG-SG 3.67Å; C64-C67 HydrophobicContact CB-CB 4.11Å; C64-C67 WeakPolarHBondContact O-CB 3.33Å; C64-C67 PolarHBondContact O-N 3.22Å; R65-C67 PolarHBondContact O-N 2.91Å; C67-C71 PolarHBondContact O-N 3.36Å; C67-C71 VanDerWaalsContact O-N 3.08Å; C67-C71 PolarHBondContact O-SG 2.91Å
68	V	90.3	Very high	87	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-70.1	-37.6	179.7	70.8	0	0	0	0	111.9	V55 L57 F63 C64 R65 C71 W72 L92	V55-V68 HydrophobicContact CG2-CG1 3.66Å; L57-V68 HydrophobicContact CD1-CG2 4.25Å; L57-V68 HydrophobicContact CD2-CG2 4.24Å; F63-V68 HydrophobicContact CB-CB 4.04Å; F63-V68 HydrophobicContact CD2-CG2 4.42Å; F63-V68 HydrophobicContact CG-CB 4.4Å; C64-V68 PolarHBondContact O-N 3.46Å; C64-V68 VanDerWaalsContact O-N 3.15Å; R65-V68 WeakPolarHBondContact O-CG1 3.36Å; V68-C71 WeakPolarHBondContact O-CB 3.49Å; V68-C71 PolarHBondContact O-N 3.4Å; V68-W72 HydrophobicContact CG2-CD2 4.23Å; V68-W72 HydrophobicContact CG2-CH2 4.1Å; V68-W72 HydrophobicContact CG2-CZ2 3.53Å; V68-W72 PolarHBondContact O-N 2.66Å; V68-W72 VanDerWaalsContact O-N 3.11Å; V68-L92 HydrophobicContact CG1-CD1 3.87Å; V68-L92 HydrophobicContact CG1-CD2 4.28Å
69	T	88.4	Confident	87.3	Confident	50 Å²	50	61.8 Å²	61.8	31%	0.307	34%	0.337	S	S	.	.	H	α-helix	trans	-63.4	-46.9	175.9	-58	0	0	0	0	111.6	R65 R66 C71 W72 E73	R65-T69 WeakPolarHBondContact O-CB 3.39Å; R65-T69 PolarHBondContact O-N 3.16Å; R65-T69 VanDerWaalsContact O-N 3.12Å; R65-T69 PolarHBondContact O-OG1 2.74Å; R66-T69 PolarHBondContact O-N 2.84Å; T69-C71 VanDerWaalsContact C-N 3.28Å; T69-C71 PolarHBondContact O-N 2.77Å; T69-W72 PolarHBondContact O-N 3.07Å; T69-E73 PolarHBondContact O-N 3.22Å
70	S	87.3	Confident	87.3	Confident	61 Å²	61	60.4 Å²	60.4	43%	0.427	33%	0.327	S	S	.	.	H	α-helix	trans	-63.7	-32.6	176.2	-64.1	0	0	0	0	112.8	R66 W72	R66-S70 WeakPolarHBondContact O-CB 3.22Å; R66-S70 PolarHBondContact O-N 2.69Å; R66-S70 PolarHBondContact O-OG 3.1Å; S70-W72 VanDerWaalsContact C-N 3.29Å; S70-W72 PolarHBondContact O-N 2.98Å
71	C	85.4	Confident	87.4	Confident	27 Å²	27	59.4 Å²	59.4	18%	0.182	31%	0.313	C	S	.	.	H	α-helix	trans	-65.1	-32.1	171.5	-73.1	0	0	0	0	112.7	C67 V68 T69 V74 Q75 P81	C67-C71 PolarHBondContact O-N 3.36Å; C67-C71 VanDerWaalsContact O-N 3.08Å; C67-C71 PolarHBondContact O-SG 2.91Å; V68-C71 WeakPolarHBondContact O-CB 3.49Å; V68-C71 PolarHBondContact O-N 3.4Å; T69-C71 VanDerWaalsContact C-N 3.28Å; T69-C71 PolarHBondContact O-N 2.77Å; C71-V74 VanDerWaalsContact O-CG2 3.26Å; C71-V74 WeakPolarHBondContact O-CG2 3.47Å; C71-Q75 VanDerWaalsContact O-CG 3.23Å; C71-Q75 WeakPolarHBondContact O-CG 3.47Å; C71-Q75 PolarHBondContact O-NE2 2.91Å; C71-P81 HydrophobicContact CB-CG 4.31Å
72	W	89.3	Confident	87.3	Confident	21 Å²	21	59.8 Å²	59.8	8%	0.08	32%	0.319	C	S	.	.	H	α-helix	trans	-81.1	-27.2	178.5	-65.1	-19.4	0	0	0	113.6	L57 V68 T69 S70 V74 Q75 P78 S79 A87 P89 L92	L57-W72 HydrophobicContact CD1-CZ2 4.45Å; L57-W72 HydrophobicContact CD2-CH2 3.94Å; L57-W72 HydrophobicContact CD2-CZ2 3.76Å; V68-W72 HydrophobicContact CG2-CD2 4.23Å; V68-W72 HydrophobicContact CG2-CH2 4.1Å; V68-W72 HydrophobicContact CG2-CZ2 3.53Å; V68-W72 PolarHBondContact O-N 2.66Å; V68-W72 VanDerWaalsContact O-N 3.11Å; T69-W72 PolarHBondContact O-N 3.07Å; S70-W72 VanDerWaalsContact C-N 3.29Å; S70-W72 PolarHBondContact O-N 2.98Å; W72-V74 PolarHBondContact O-N 3.23Å; W72-Q75 PolarHBondContact O-N 3.42Å; W72-P78 HydrophobicContact CB-CB 4.33Å; W72-P78 HydrophobicContact CD2-CB 3.89Å; W72-P78 HydrophobicContact CG-CB 3.76Å; W72-P78 HydrophobicContact CG-CG 4.48Å; W72-S79 PolarHBondContact NE1-O 2.96Å; W72-A87 HydrophobicContact CH2-CB 4.15Å; W72-A87 HydrophobicContact CZ2-CB 3.34Å; W72-P89 HydrophobicContact CD2-CG 4.4Å; W72-P89 HydrophobicContact CE3-CB 3.82Å; W72-P89 HydrophobicContact CE3-CG 3.78Å; W72-P89 HydrophobicContact CZ3-CB 3.66Å; W72-P89 HydrophobicContact CZ3-CG 3.93Å; W72-L92 HydrophobicContact CE3-CD1 4.39Å; W72-L92 HydrophobicContact CH2-CD1 3.77Å; W72-L92 HydrophobicContact CH2-CD2 3.57Å; W72-L92 HydrophobicContact CH2-CG 3.67Å; W72-L92 HydrophobicContact CZ3-CD1 3.39Å; W72-L92 HydrophobicContact CZ3-CD2 4.11Å; W72-L92 HydrophobicContact CZ3-CG 3.71Å
73	E	84.2	Confident	87.1	Confident	148 Å²	148	60.3 Å²	60.3	69%	0.692	33%	0.326	S	S	*	.	H	α-helix	trans	-59.9	-30	174.2	-73.3	168	-176.6	0	0	112.7	T69	T69-E73 PolarHBondContact O-N 3.22Å
74	V	78.1	Confident	86.9	Confident	124 Å²	124	66.9 Å²	66.9	75%	0.752	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-3.9	-179.6	-61	0	0	0	0	113.8	C71 W72	C71-V74 VanDerWaalsContact O-CG2 3.26Å; C71-V74 WeakPolarHBondContact O-CG2 3.47Å; W72-V74 PolarHBondContact O-N 3.23Å
75	Q	79.6	Confident	86.7	Confident	60 Å²	60	71.7 Å²	71.7	28%	0.28	38%	0.376	S	S	.	.			trans	-105.8	136.3	-178.3	-73.3	173.7	41.5	0	0	111	C71 W72 T77 S79	C71-Q75 VanDerWaalsContact O-CG 3.23Å; C71-Q75 WeakPolarHBondContact O-CG 3.47Å; C71-Q75 PolarHBondContact O-NE2 2.91Å; W72-Q75 PolarHBondContact O-N 3.42Å; Q75-T77 PolarHBondContact O-N 3.25Å; Q75-T77 PolarHBondContact OE1-O 2.99Å; Q75-S79 PolarHBondContact OE1-OG 3.48Å
76	T	74.8	Confident	86.4	Confident	148 Å²	148	76.8 Å²	76.8	91%	0.908	40%	0.395	S	S	*	.	S	Bend	trans	-66.1	-27.9	173.5	47.3	0	0	0	0	112.7
77	T	81.8	Confident	86	Confident	83 Å²	83	67.4 Å²	67.4	51%	0.509	36%	0.362	S	S	.	.	S	Bend	trans	-132.5	123.7	173.2	55	0	0	0	0	109.8	Q75 S79	Q75-T77 PolarHBondContact O-N 3.25Å; Q75-T77 PolarHBondContact OE1-O 2.99Å; T77-S79 PolarHBondContact O-N 3.23Å
78	P	86.3	Confident	85.5	Confident	35 Å²	35	69.6 Å²	69.6	23%	0.227	38%	0.375	C	S	.	.			trans	-60.1	121.9	178.9	-25.4	34.4	0	0	0	111.5	W72 A87 P89	W72-P78 HydrophobicContact CB-CB 4.33Å; W72-P78 HydrophobicContact CD2-CB 3.89Å; W72-P78 HydrophobicContact CG-CB 3.76Å; W72-P78 HydrophobicContact CG-CG 4.48Å; P78-A87 PolarHBondContact O-N 2.92Å; P78-P89 HydrophobicContact CB-CG 3.89Å; P78-P89 HydrophobicContact CG-CG 3.63Å
79	S	90.7	Very high	84.7	Confident	18 Å²	18	72.7 Å²	72.7	13%	0.126	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-135.6	160.3	178.8	72.1	0	0	0	0	111.9	W72 Q75 T77 P81 E85	W72-S79 PolarHBondContact NE1-O 2.96Å; Q75-S79 PolarHBondContact OE1-OG 3.48Å; T77-S79 PolarHBondContact O-N 3.23Å; S79-P81 WeakPolarHBondContact O-CD 3.39Å; S79-E85 CarbonylContact C-O 3.39Å; S79-E85 WeakPolarHBondContact CA-O 3.45Å
80	C	89.3	Confident	83.9	Confident	1 Å²	1	74 Å²	74	1%	0.007	42%	0.419	C	S	.	.			trans	-63.9	126.8	172.4	177.2	0	0	0	0	110.3	L57 C59 V82 C83 K84 E85	L57-C80 HydrophobicContact CD1-CB 3.79Å; C59-C80 PolarHBondContact SG-SG 2.95Å; C80-V82 PolarHBondContact O-N 3.34Å; C80-V82 VanDerWaalsContact O-N 3.1Å; C80-V82 PolarHBondContact SG-N 3.45Å; C80-C83 VanDerWaalsContact CB-SG 3.57Å; C80-K84 VanDerWaalsContact O-CA 3.27Å; C80-K84 WeakPolarHBondContact O-CA 3.4Å; C80-K84 PolarHBondContact O-N 3.37Å; C80-E85 PolarHBondContact N-O 3.15Å
81	P	87.8	Confident	83	Confident	25 Å²	25	75.5 Å²	75.5	16%	0.162	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.8	177.8	-28.2	35.2	0	0	0	114.3	V46 F63 C71 S79 K84	V46-P81 HydrophobicContact CG2-CB 4.08Å; V46-P81 HydrophobicContact CG2-CG 4.1Å; F63-P81 HydrophobicContact CD1-CG 4.38Å; F63-P81 HydrophobicContact CE1-CB 3.97Å; F63-P81 HydrophobicContact CE1-CG 3.95Å; F63-P81 HydrophobicContact CE2-CG 4.48Å; F63-P81 HydrophobicContact CZ-CB 4.15Å; F63-P81 HydrophobicContact CZ-CG 4.02Å; C71-P81 HydrophobicContact CB-CG 4.31Å; S79-P81 WeakPolarHBondContact O-CD 3.39Å; P81-K84 PolarHBondContact O-NZ 2.98Å
82	V	88.4	Confident	82.7	Confident	74 Å²	74	75.1 Å²	75.1	45%	0.448	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-65.9	-175.4	178.6	0	0	0	0	112	A45 H61 F63 C80	A45-V82 HydrophobicContact CB-CG2 4.05Å; H61-V82 WeakPolarHBondContact NE2-CG1 3.19Å; F63-V82 HydrophobicContact CE1-CG2 3.84Å; F63-V82 HydrophobicContact CZ-CB 4.38Å; F63-V82 HydrophobicContact CZ-CG2 3.72Å; C80-V82 PolarHBondContact O-N 3.34Å; C80-V82 VanDerWaalsContact O-N 3.1Å; C80-V82 PolarHBondContact SG-N 3.45Å
83	C	88.4	Confident	82.4	Confident	58 Å²	58	84.2 Å²	84.2	39%	0.392	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-1.9	-173	65.7	0	0	0	0	114.9	C59 C80 E85	C59-C83 VanDerWaalsContact CB-SG 3.56Å; C80-C83 VanDerWaalsContact CB-SG 3.57Å; C83-E85 PolarHBondContact O-N 3.42Å
84	K	88	Confident	82.5	Confident	140 Å²	140	79 Å²	79	61%	0.609	43%	0.428	S	S	*	.			trans	61.5	9	-178.6	-49.1	-55.4	-177.7	-163.7	0	115.8	C80 P81	C80-K84 VanDerWaalsContact O-CA 3.27Å; C80-K84 WeakPolarHBondContact O-CA 3.4Å; C80-K84 PolarHBondContact O-N 3.37Å; P81-K84 PolarHBondContact O-NZ 2.98Å
85	E	88.3	Confident	83.1	Confident	108 Å²	108	74.7 Å²	74.7	51%	0.505	40%	0.401	S	S	.	.			trans	-62.7	138.9	173.2	-165.8	175.9	165.6	0	0	110.8	C59 S79 C80 C83 A87	C59-E85 HydrophobicContact CB-CB 4.11Å; C59-E85 WeakPolarHBondContact CB-OE2 3.48Å; S79-E85 CarbonylContact C-O 3.39Å; S79-E85 WeakPolarHBondContact CA-O 3.45Å; C80-E85 PolarHBondContact N-O 3.15Å; C83-E85 PolarHBondContact O-N 3.42Å; E85-A87 PolarHBondContact O-N 3.31Å
86	R	85.8	Confident	83.4	Confident	203 Å²	203	77.8 Å²	77.8	77%	0.766	42%	0.415	S	S	*	.	B	Isolated β-bridge	trans	-60.9	130.6	-177.2	-171.6	177.2	-177.8	177	1.7	110.3
87	A	83.4	Confident	84	Confident	10 Å²	10	75.4 Å²	75.4	8%	0.083	40%	0.4	C	S	.	.			trans	-111.8	157.4	179.6	0	0	0	0	0	111.3	L57 W72 P78 E85	L57-A87 HydrophobicContact CD1-CB 4.45Å; W72-A87 HydrophobicContact CH2-CB 4.15Å; W72-A87 HydrophobicContact CZ2-CB 3.34Å; P78-A87 PolarHBondContact O-N 2.92Å; E85-A87 PolarHBondContact O-N 3.31Å
88	V	79.2	Confident	84.3	Confident	67 Å²	67	72.6 Å²	72.6	41%	0.406	38%	0.382	S	S	.	.			trans	-117.7	113.4	178.7	-175.8	0	0	0	0	108.5	G90 E91	V88-G90 VanDerWaalsContact C-N 3.29Å; V88-G90 PolarHBondContact O-N 3.15Å; V88-E91 HydrophobicContact CB-CG 4.35Å; V88-E91 HydrophobicContact CG1-CG 4.18Å; V88-E91 PolarHBondContact O-N 2.92Å
89	P	74.8	Confident	84.3	Confident	65 Å²	65	72.4 Å²	72.4	42%	0.422	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-61.7	-31.5	-173.7	-26.8	34.5	0	0	0	115.8	W72 P78 E91	W72-P89 HydrophobicContact CD2-CG 4.4Å; W72-P89 HydrophobicContact CE3-CB 3.82Å; W72-P89 HydrophobicContact CE3-CG 3.78Å; W72-P89 HydrophobicContact CZ3-CB 3.66Å; W72-P89 HydrophobicContact CZ3-CG 3.93Å; P78-P89 HydrophobicContact CB-CG 3.89Å; P78-P89 HydrophobicContact CG-CG 3.63Å; P89-E91 PolarHBondContact O-N 3.08Å; P89-E91 VanDerWaalsContact O-N 3.16Å
90	G	70.1	Confident	84.1	Confident	79 Å²	79	75.8 Å²	75.8	81%	0.814	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-69.6	-4.8	-179.6	0	0	0	0	0	115.4	V88	V88-G90 VanDerWaalsContact C-N 3.29Å; V88-G90 PolarHBondContact O-N 3.15Å
91	E	68.6	Low	84	Confident	91 Å²	91	79.3 Å²	79.3	43%	0.425	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-112.6	9.1	-174.2	-63.5	-177.2	179.7	0	0	114	R58 V88 P89 R93	R58-E91 IonicContact CZ-OE1 3.56Å; R58-E91 IonicContact CZ-OE2 2.88Å; R58-E91 IonicContact NE-OE2 2.79Å; R58-E91 PolarHBondContact NE-OE2 2.99Å; R58-E91 IonicContact NH2-OE1 3.26Å; R58-E91 PolarHBondContact NH2-OE1 3.17Å; R58-E91 IonicContact NH2-OE2 3.18Å; R58-E91 PolarHBondContact NH2-OE2 2.94Å; V88-E91 HydrophobicContact CB-CG 4.35Å; V88-E91 HydrophobicContact CG1-CG 4.18Å; V88-E91 PolarHBondContact O-N 2.92Å; P89-E91 PolarHBondContact O-N 3.08Å; P89-E91 VanDerWaalsContact O-N 3.16Å; E91-R93 PolarHBondContact O-N 2.98Å
92	L	80.1	Confident	83.9	Confident	20 Å²	20	78.5 Å²	78.5	11%	0.105	41%	0.409	C	S	.	.			trans	-66.1	96.4	177.6	-74.3	-175.2	0	0	0	111.5	V55 L57 R65 V68 W72	V55-L92 HydrophobicContact CB-CD2 4.13Å; V55-L92 HydrophobicContact CG1-CB 4.48Å; V55-L92 HydrophobicContact CG2-CD2 3.95Å; L57-L92 HydrophobicContact CD2-CD2 3.52Å; R65-L92 PolarHBondContact NH1-O 2.99Å; V68-L92 HydrophobicContact CG1-CD1 3.87Å; V68-L92 HydrophobicContact CG1-CD2 4.28Å; W72-L92 HydrophobicContact CE3-CD1 4.39Å; W72-L92 HydrophobicContact CH2-CD1 3.77Å; W72-L92 HydrophobicContact CH2-CD2 3.57Å; W72-L92 HydrophobicContact CH2-CG 3.67Å; W72-L92 HydrophobicContact CZ3-CD1 3.39Å; W72-L92 HydrophobicContact CZ3-CD2 4.11Å; W72-L92 HydrophobicContact CZ3-CG 3.71Å
93	R	82.5	Confident	83.7	Confident	211 Å²	211	80.8 Å²	80.8	80%	0.796	41%	0.414	S	S	*	.			trans	-90.8	134.7	170.3	-64.3	-174.4	179.5	-168.3	-0.3	110.1	E91 N95	E91-R93 PolarHBondContact O-N 2.98Å; R93-N95 PolarHBondContact O-N 3.5Å
94	T	87.4	Confident	83.4	Confident	39 Å²	39	80.4 Å²	80.4	24%	0.239	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-66.5	129	172.7	-62.4	0	0	0	0	109.6	D53 A54 H96 N99	D53-T94 WeakPolarHBondContact OD1-CG2 3.34Å; D53-T94 PolarHBondContact OD1-OG1 3.31Å; A54-T94 CarbonylContact O-C 3.57Å; A54-T94 WeakPolarHBondContact O-CA 3.41Å; T94-H96 PolarHBondContact O-CD2 2.94Å; T94-H96 PolarHBondContact O-N 2.7Å; T94-N99 WeakPolarHBondContact CG2-ND2 3.42Å
95	N	89.3	Confident	83	Confident	34 Å²	34	74.9 Å²	74.9	18%	0.182	39%	0.387	C	S	.	.			trans	-86.5	89.3	173	-172.7	-41	0	0	0	108.8	A54 T56 R93 T97 L98 N99	A54-N95 HydrophobicContact CB-CB 4.2Å; A54-N95 PolarHBondContact O-N 3.36Å; T56-N95 PolarHBondContact OG1-ND2 2.94Å; R93-N95 PolarHBondContact O-N 3.5Å; N95-T97 PolarHBondContact O-N 3.49Å; N95-T97 PolarHBondContact OD1-N 3.01Å; N95-T97 PolarHBondContact OD1-OG1 3.47Å; N95-L98 HydrophobicContact CB-CB 4.38Å; N95-L98 HydrophobicContact CB-CD1 4.2Å; N95-L98 HydrophobicContact CB-CG 4.48Å; N95-L98 PolarHBondContact O-N 2.96Å; N95-L98 WeakPolarHBondContact OD1-CG 3.33Å; N95-L98 PolarHBondContact OD1-N 3.2Å; N95-N99 PolarHBondContact O-N 3.27Å; N95-N99 PolarHBondContact O-ND2 3.39Å
96	H	86.8	Confident	82.6	Confident	125 Å²	125	73.8 Å²	73.8	58%	0.579	38%	0.384	S	S	*	.	H	α-helix	trans	-61.8	-31.1	179.9	-63.9	-74.8	0	0	0	112.8	T94 N99 N100	T94-H96 PolarHBondContact O-CD2 2.94Å; T94-H96 PolarHBondContact O-N 2.7Å; H96-N99 PolarHBondContact O-N 2.89Å; H96-N100 WeakPolarHBondContact O-CB 3.31Å; H96-N100 PolarHBondContact O-N 2.97Å; H96-N100 PolarHBondContact O-ND2 3.25Å; H96-N100 PolarHBondContact O-OD1 3.43Å
97	T	87.8	Confident	82.1	Confident	97 Å²	97	70.6 Å²	70.6	60%	0.595	37%	0.372	S	S	*	.	H	α-helix	trans	-64.7	-44.4	178.1	42.1	0	0	0	0	112.3	N95 N100 L101	N95-T97 PolarHBondContact O-N 3.49Å; N95-T97 PolarHBondContact OD1-N 3.01Å; N95-T97 PolarHBondContact OD1-OG1 3.47Å; T97-N100 PolarHBondContact O-N 2.98Å; T97-L101 VanDerWaalsContact O-CG 3.27Å; T97-L101 WeakPolarHBondContact O-CG 3.47Å; T97-L101 PolarHBondContact O-N 3.23Å
98	L	87.8	Confident	81.4	Confident	25 Å²	25	75.6 Å²	75.6	13%	0.131	39%	0.394	C	S	.	.	H	α-helix	trans	-66.5	-40.3	176.1	-72.9	175.7	0	0	0	111.6	L42 F51 A54 N62 N95 N100 L101 V102	L42-L98 HydrophobicContact CD2-CD2 3.72Å; F51-L98 HydrophobicContact CE2-CD1 4.47Å; A54-L98 HydrophobicContact CB-CB 3.73Å; A54-L98 HydrophobicContact CB-CD1 4.25Å; N62-L98 HydrophobicContact CB-CD1 3.77Å; N62-L98 WeakPolarHBondContact OD1-CD1 3.48Å; N95-L98 HydrophobicContact CB-CB 4.38Å; N95-L98 HydrophobicContact CB-CD1 4.2Å; N95-L98 HydrophobicContact CB-CG 4.48Å; N95-L98 PolarHBondContact O-N 2.96Å; N95-L98 WeakPolarHBondContact OD1-CG 3.33Å; N95-L98 PolarHBondContact OD1-N 3.2Å; L98-N100 PolarHBondContact O-N 3.16Å; L98-L101 PolarHBondContact O-N 2.96Å; L98-V102 WeakPolarHBondContact O-CG2 3.33Å; L98-V102 PolarHBondContact O-N 2.69Å
99	N	86.9	Confident	80.9	Confident	31 Å²	31	76.7 Å²	76.7	17%	0.166	40%	0.395	C	S	.	.	H	α-helix	trans	-61.3	-44.6	175.4	-71.5	-31.8	0	0	0	111.9	D53 A54 T94 N95 H96 L101 V102 E103	D53-N99 WeakPolarHBondContact CA-OD1 3.4Å; D53-N99 PolarHBondContact N-OD1 3.25Å; A54-N99 WeakPolarHBondContact CB-OD1 3.11Å; A54-N99 PolarHBondContact N-OD1 2.85Å; T94-N99 WeakPolarHBondContact CG2-ND2 3.42Å; N95-N99 PolarHBondContact O-N 3.27Å; N95-N99 PolarHBondContact O-ND2 3.39Å; H96-N99 PolarHBondContact O-N 2.89Å; N99-L101 VanDerWaalsContact C-N 3.33Å; N99-L101 PolarHBondContact O-N 3.17Å; N99-V102 PolarHBondContact O-N 3.4Å; N99-E103 WeakPolarHBondContact O-CB 3.42Å; N99-E103 PolarHBondContact O-N 3.06Å
100	N	86.3	Confident	80.4	Confident	88 Å²	88	76.4 Å²	76.4	47%	0.471	40%	0.397	S	S	.	.	H	α-helix	trans	-65.2	-36.9	179.1	-68.4	-9.4	0	0	0	112.1	H96 T97 L98 E103 T104	H96-N100 WeakPolarHBondContact O-CB 3.31Å; H96-N100 PolarHBondContact O-N 2.97Å; H96-N100 PolarHBondContact O-ND2 3.25Å; H96-N100 PolarHBondContact O-OD1 3.43Å; T97-N100 PolarHBondContact O-N 2.98Å; L98-N100 PolarHBondContact O-N 3.16Å; N100-E103 PolarHBondContact O-N 3.45Å; N100-T104 WeakPolarHBondContact O-CB 3.26Å; N100-T104 PolarHBondContact O-N 3.01Å; N100-T104 PolarHBondContact O-OG1 3.41Å
101	L	86.7	Confident	79.8	Confident	75 Å²	75	78.4 Å²	78.4	39%	0.393	39%	0.386	S	S	.	.	H	α-helix	trans	-67	-44	175.8	-71	172.4	0	0	0	111.5	F38 L42 T97 L98 N99 T104 L105	F38-L101 HydrophobicContact CZ-CD2 4.36Å; L42-L101 HydrophobicContact CD1-CB 4.27Å; L42-L101 HydrophobicContact CD2-CB 4.32Å; T97-L101 VanDerWaalsContact O-CG 3.27Å; T97-L101 WeakPolarHBondContact O-CG 3.47Å; T97-L101 PolarHBondContact O-N 3.23Å; L98-L101 PolarHBondContact O-N 2.96Å; N99-L101 VanDerWaalsContact C-N 3.33Å; N99-L101 PolarHBondContact O-N 3.17Å; L101-T104 PolarHBondContact O-N 2.95Å; L101-L105 WeakPolarHBondContact O-CB 3.47Å; L101-L105 PolarHBondContact O-N 3.39Å
102	V	86.3	Confident	79.1	Confident	9 Å²	9	76.7 Å²	76.7	6%	0.055	39%	0.393	C	S	.	.	H	α-helix	trans	-61.1	-45.3	173.5	170.1	0	0	0	0	110.7	L42 P50 F51 L98 N99 T104 L105 L106	L42-V102 HydrophobicContact CB-CG2 3.97Å; L42-V102 HydrophobicContact CD1-CG2 4.5Å; L42-V102 HydrophobicContact CD2-CG2 4.46Å; P50-V102 HydrophobicContact CB-CG1 3.65Å; P50-V102 HydrophobicContact CB-CG2 4.47Å; F51-V102 HydrophobicContact CB-CG2 4.17Å; L98-V102 WeakPolarHBondContact O-CG2 3.33Å; L98-V102 PolarHBondContact O-N 2.69Å; N99-V102 PolarHBondContact O-N 3.4Å; V102-T104 PolarHBondContact O-N 3.44Å; V102-L105 PolarHBondContact O-N 2.81Å; V102-L106 HydrophobicContact CG1-CD1 3.7Å; V102-L106 HydrophobicContact CG1-CG 4.23Å; V102-L106 WeakPolarHBondContact O-CB 3.48Å; V102-L106 VanDerWaalsContact O-CG 3.23Å; V102-L106 WeakPolarHBondContact O-CG 3.48Å; V102-L106 PolarHBondContact O-N 2.99Å
103	E	84	Confident	77.6	Confident	122 Å²	122	77.9 Å²	77.9	57%	0.57	41%	0.405	S	S	*	.	H	α-helix	trans	-63.6	-41.9	179	-171.9	177.6	-174.4	0	0	112.3	N99 N100 L106 R107	N99-E103 WeakPolarHBondContact O-CB 3.42Å; N99-E103 PolarHBondContact O-N 3.06Å; N100-E103 PolarHBondContact O-N 3.45Å; E103-L106 PolarHBondContact O-N 2.89Å; E103-R107 WeakPolarHBondContact O-CB 3.48Å; E103-R107 PolarHBondContact O-N 2.84Å
104	T	81.6	Confident	75.8	Confident	50 Å²	50	78.6 Å²	78.6	31%	0.307	41%	0.408	S	S	.	.	H	α-helix	trans	-63.5	-44.4	177.2	-56.4	0	0	0	0	111	N100 L101 V102 R107 E108	N100-T104 WeakPolarHBondContact O-CB 3.26Å; N100-T104 PolarHBondContact O-N 3.01Å; N100-T104 PolarHBondContact O-OG1 3.41Å; L101-T104 PolarHBondContact O-N 2.95Å; V102-T104 PolarHBondContact O-N 3.44Å; T104-R107 PolarHBondContact O-N 2.99Å; T104-E108 WeakPolarHBondContact O-CG 3.49Å; T104-E108 PolarHBondContact O-N 3.3Å
105	L	79.9	Confident	73.8	Confident	24 Å²	24	88.3 Å²	88.3	13%	0.126	44%	0.44	C	S	.	.	H	α-helix	trans	-64	-43.9	175.4	-86.2	165.5	0	0	0	112.9	F38 K39 L42 L101 V102 R107 E108 E109	F38-L105 HydrophobicContact CD1-CD1 3.83Å; F38-L105 HydrophobicContact CD1-CD2 4.17Å; F38-L105 HydrophobicContact CD1-CG 4.39Å; F38-L105 HydrophobicContact CE1-CD1 3.56Å; F38-L105 HydrophobicContact CE1-CD2 4.26Å; F38-L105 HydrophobicContact CE1-CG 4.06Å; K39-L105 HydrophobicContact CG-CD2 4.22Å; L42-L105 HydrophobicContact CD1-CD1 3.1Å; L101-L105 WeakPolarHBondContact O-CB 3.47Å; L101-L105 PolarHBondContact O-N 3.39Å; V102-L105 PolarHBondContact O-N 2.81Å; L105-R107 VanDerWaalsContact C-N 3.26Å; L105-R107 PolarHBondContact O-N 3.07Å; L105-E108 PolarHBondContact O-N 2.97Å; L105-E109 WeakPolarHBondContact O-CB 3.29Å; L105-E109 VanDerWaalsContact O-CG 3.32Å; L105-E109 WeakPolarHBondContact O-CG 3.23Å; L105-E109 PolarHBondContact O-N 2.52Å
106	L	79.3	Confident	71.6	Confident	84 Å²	84	90.6 Å²	90.6	44%	0.44	46%	0.455	S	S	.	.	H	α-helix	trans	-63.8	-35.1	177.1	-71.7	172.9	0	0	0	111.1	V102 E103 A110	V102-L106 HydrophobicContact CG1-CD1 3.7Å; V102-L106 HydrophobicContact CG1-CG 4.23Å; V102-L106 WeakPolarHBondContact O-CB 3.48Å; V102-L106 VanDerWaalsContact O-CG 3.23Å; V102-L106 WeakPolarHBondContact O-CG 3.48Å; V102-L106 PolarHBondContact O-N 2.99Å; E103-L106 PolarHBondContact O-N 2.89Å; L106-A110 VanDerWaalsContact O-CB 3.23Å; L106-A110 WeakPolarHBondContact O-CB 2.96Å; L106-A110 PolarHBondContact O-N 2.84Å
107	R	74.9	Confident	69.4	Low	137 Å²	137	88.4 Å²	88.4	52%	0.517	47%	0.467	S	S	.	.	H	α-helix	trans	-67.8	-46.5	174.3	-171.2	176.8	70	-147.4	-1.9	111.9	E103 T104 L105 E109 A110 E111	E103-R107 WeakPolarHBondContact O-CB 3.48Å; E103-R107 PolarHBondContact O-N 2.84Å; T104-R107 PolarHBondContact O-N 2.99Å; L105-R107 VanDerWaalsContact C-N 3.26Å; L105-R107 PolarHBondContact O-N 3.07Å; R107-E109 VanDerWaalsContact C-N 3.31Å; R107-E109 PolarHBondContact O-N 2.94Å; R107-A110 PolarHBondContact O-N 3.3Å; R107-E111 WeakPolarHBondContact O-CB 3.45Å; R107-E111 WeakPolarHBondContact O-CG 3.12Å; R107-E111 PolarHBondContact O-N 3.39Å
108	E	70.1	Confident	67.2	Low	114 Å²	114	94.5 Å²	94.5	53%	0.533	48%	0.479	S	S	.	.	H	α-helix	trans	-61.8	-38.5	174.9	-73.4	177.5	176.3	0	0	111.9	T104 L105 G112	T104-E108 WeakPolarHBondContact O-CG 3.49Å; T104-E108 PolarHBondContact O-N 3.3Å; L105-E108 PolarHBondContact O-N 2.97Å; E108-G112 PolarHBondContact O-N 3.4Å
109	E	68.6	Low	65.3	Low	91 Å²	91	105.7 Å²	105.7	43%	0.425	52%	0.519	S	S	.	.	H	α-helix	trans	-68	-38.9	173.7	-75.5	-170.1	154.9	0	0	112.6	K39 L105 R107 G112 A113	K39-E109 WeakPolarHBondContact CE-OE1 3.19Å; K39-E109 IonicContact NZ-OE1 2.64Å; K39-E109 PolarHBondContact NZ-OE1 3.24Å; L105-E109 WeakPolarHBondContact O-CB 3.29Å; L105-E109 VanDerWaalsContact O-CG 3.32Å; L105-E109 WeakPolarHBondContact O-CG 3.23Å; L105-E109 PolarHBondContact O-N 2.52Å; R107-E109 VanDerWaalsContact C-N 3.31Å; R107-E109 PolarHBondContact O-N 2.94Å; E109-G112 CarbonylContact O-C 3.56Å; E109-G112 PolarHBondContact O-N 3.3Å; E109-A113 WeakPolarHBondContact O-CB 3.33Å; E109-A113 PolarHBondContact O-N 3.33Å
110	A	62.7	Low	63.6	Low	58 Å²	58	108.2 Å²	108.2	48%	0.479	54%	0.54	S	S	.	.	H	α-helix	trans	-68.8	-37	176.4	0	0	0	0	0	112.4	L106 R107 A113 R114	L106-A110 VanDerWaalsContact O-CB 3.23Å; L106-A110 WeakPolarHBondContact O-CB 2.96Å; L106-A110 PolarHBondContact O-N 2.84Å; R107-A110 PolarHBondContact O-N 3.3Å; A110-A113 PolarHBondContact O-N 2.71Å; A110-R114 PolarHBondContact O-N 2.89Å
111	E	58.2	Low	62.3	Low	122 Å²	122	109.5 Å²	109.5	57%	0.57	55%	0.552	S	S	*	*	H	α-helix	trans	-67.7	-39	173.4	-73.9	172	-173.3	0	0	111.3	R107 A113	R107-E111 WeakPolarHBondContact O-CB 3.45Å; R107-E111 WeakPolarHBondContact O-CG 3.12Å; R107-E111 PolarHBondContact O-N 3.39Å; E111-A113 VanDerWaalsContact C-N 3.33Å
112	G	55.1	Low	61.4	Low	55 Å²	55	113.5 Å²	113.5	57%	0.567	56%	0.563	S	S	*	*	H	α-helix	trans	-69.7	-24	169.3	0	0	0	0	0	114.5	E108 E109	E108-G112 PolarHBondContact O-N 3.4Å; E109-G112 CarbonylContact O-C 3.56Å; E109-G112 PolarHBondContact O-N 3.3Å
113	A	48.2	Very low	61	Low	45 Å²	45	116.2 Å²	116.2	37%	0.372	58%	0.58	S	S	.	*	H	α-helix	trans	-84	-11.3	-179.4	0	0	0	0	0	114.3	E109 A110 E111 W115 T116	E109-A113 WeakPolarHBondContact O-CB 3.33Å; E109-A113 PolarHBondContact O-N 3.33Å; A110-A113 PolarHBondContact O-N 2.71Å; E111-A113 VanDerWaalsContact C-N 3.33Å; A113-W115 PolarHBondContact O-N 2.69Å; A113-T116 PolarHBondContact O-N 2.81Å; A113-T116 VanDerWaalsContact O-N 3.11Å
114	R	45.2	Very low	60.9	Low	226 Å²	226	111 Å²	111	85%	0.853	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-11.5	174.9	-79.1	-175	175.2	-153.4	0.1	113.9	A110	A110-R114 PolarHBondContact O-N 2.89Å
115	W	44.2	Very low	60.7	Low	243 Å²	243	118.8 Å²	118.8	92%	0.92	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	7.6	177.1	-113.9	73.5	0	0	0	115.6	A113	A113-W115 PolarHBondContact O-N 2.69Å
116	T	42.4	Very low	60.6	Low	81 Å²	81	121 Å²	121	50%	0.497	60%	0.603	S	S	.	*			trans	-134	62.6	-175	61.5	0	0	0	0	113.8	A113 R118	A113-T116 PolarHBondContact O-N 2.81Å; A113-T116 VanDerWaalsContact O-N 3.11Å; T116-R118 PolarHBondContact O-N 2.67Å
117	G	41	Very low	60.7	Low	79 Å²	79	120.8 Å²	120.8	81%	0.814	60%	0.599	S	S	*	*			trans	-89.8	59.8	164.8	0	0	0	0	0	112.4
118	R	42	Very low	60.8	Low	226 Å²	226	124.8 Å²	124.8	85%	0.853	61%	0.614	S	S	*	*	S	Bend	trans	-165	133	163.7	-111.4	170.9	-152.7	-100.6	1.6	109.9	T116 S120	T116-R118 PolarHBondContact O-N 2.67Å; R118-S120 PolarHBondContact O-N 3.37Å
119	R	48.3	Very low	61.4	Low	259 Å²	259	120.4 Å²	120.4	98%	0.977	60%	0.598	S	S	*	*			trans	-66.4	75.5	174.9	-60.1	174.9	-152.3	-110.6	-0.3	110.3
120	S	51.8	Low	62	Low	85 Å²	85	120.4 Å²	120.4	59%	0.594	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-99.4	142.6	160.6	55	0	0	0	0	108.9	R118 R122	R118-S120 PolarHBondContact O-N 3.37Å; S120-R122 PolarHBondContact O-N 3.28Å; S120-R122 VanDerWaalsContact O-N 3.1Å
121	P	57.1	Low	63.1	Low	114 Å²	114	119.7 Å²	119.7	74%	0.74	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-55.4	120.3	170.8	-19.3	30.2	0	0	0	108.2	P123	P121-P123 WeakPolarHBondContact O-CD 3.04Å; P121-P123 VanDerWaalsContact O-N 3.16Å
122	R	68.3	Low	64.5	Low	160 Å²	160	117.2 Å²	117.2	60%	0.604	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-58.8	122.5	177.8	-77.7	-174.5	168.6	-179.1	-4.7	107.7	S120 L131	S120-R122 PolarHBondContact O-N 3.28Å; S120-R122 VanDerWaalsContact O-N 3.1Å; R122-L131 VanDerWaalsContact O-CD1 3.27Å; R122-L131 WeakPolarHBondContact O-CD1 3.35Å
123	P	78.3	Confident	66.1	Low	66 Å²	66	115.8 Å²	115.8	43%	0.429	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-67.2	158.3	174.2	28.4	-33.1	0	0	0	109.6	P121 R125 A129	P121-P123 WeakPolarHBondContact O-CD 3.04Å; P121-P123 VanDerWaalsContact O-N 3.16Å; P123-R125 PolarHBondContact O-N 2.97Å; P123-A129 CarbonylContact C-O 3.57Å; P123-A129 WeakPolarHBondContact CA-O 3.44Å
124	C	81.4	Confident	68.1	Low	13 Å²	13	115.3 Å²	115.3	9%	0.088	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-51.3	129.8	172.1	175.3	0	0	0	0	109.9	A126 H127 R128 A129 L131 C143	C124-A126 VanDerWaalsContact C-N 3.29Å; C124-A126 PolarHBondContact O-N 2.91Å; C124-H127 HydrophobicContact CB-CB 4.32Å; C124-H127 PolarHBondContact SG-N 3.42Å; C124-R128 WeakPolarHBondContact O-CA 3.44Å; C124-R128 PolarHBondContact O-N 3.09Å; C124-A129 PolarHBondContact N-O 3.34Å; C124-L131 HydrophobicContact CB-CD2 3.77Å; C124-C143 HydrophobicContact CB-CB 3.86Å; C124-C143 VanDerWaalsContact CB-SG 3.56Å; C124-C143 VanDerWaalsContact SG-SG 3.67Å
125	R	77.6	Confident	70.2	Confident	212 Å²	212	104.5 Å²	104.5	80%	0.8	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-35.6	-177.7	-64.8	-175.4	-179.1	-146.4	1	112.6	P123	P123-R125 PolarHBondContact O-N 2.97Å
126	A	78.3	Confident	72.2	Confident	71 Å²	71	95.2 Å²	95.2	59%	0.587	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-43.8	-179.4	0	0	0	0	0	112.5	C124	C124-A126 VanDerWaalsContact C-N 3.29Å; C124-A126 PolarHBondContact O-N 2.91Å
127	H	80.3	Confident	74.3	Confident	79 Å²	79	95.8 Å²	95.8	37%	0.366	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-5.6	-168.5	-55	116.9	0	0	0	114.4	C124 A129 C143 A145 C146	C124-H127 HydrophobicContact CB-CB 4.32Å; C124-H127 PolarHBondContact SG-N 3.42Å; H127-A129 HydrophobicContact CB-CB 4.28Å; H127-A129 PolarHBondContact O-N 3.49Å; H127-C143 PolarHBondContact ND1-SG 3.2Å; H127-C143 VanDerWaalsContact ND1-SG 3.38Å; H127-A145 HydrophobicContact CB-CB 4.22Å; H127-C146 PolarHBondContact CE1-SG 3.02Å; H127-C146 PolarHBondContact ND1-SG 3.31Å
128	R	78.5	Confident	76.3	Confident	221 Å²	221	94.6 Å²	94.6	83%	0.834	46%	0.455	S	S	*	.			trans	52	18.6	-173.7	-59	-173	177.7	-177	0.1	114.5	C124	C124-R128 WeakPolarHBondContact O-CA 3.44Å; C124-R128 PolarHBondContact O-N 3.09Å
129	A	81.2	Confident	78.2	Confident	22 Å²	22	91.4 Å²	91.4	18%	0.182	45%	0.447	C	S	.	.			trans	-94.6	155.3	-179.6	0	0	0	0	0	111.7	P123 C124 H127 L131 C143	P123-A129 CarbonylContact C-O 3.57Å; P123-A129 WeakPolarHBondContact CA-O 3.44Å; C124-A129 PolarHBondContact N-O 3.34Å; H127-A129 HydrophobicContact CB-CB 4.28Å; H127-A129 PolarHBondContact O-N 3.49Å; A129-L131 PolarHBondContact O-N 2.92Å; A129-C143 HydrophobicContact CB-CB 3.8Å
130	P	83.2	Confident	79.9	Confident	91 Å²	91	83.2 Å²	83.2	59%	0.591	42%	0.42	S	S	*	.			trans	-62.4	137.2	177.2	25.2	-33	0	0	0	111.4	T132 C143	P130-T132 HydrophobicContact CB-CG2 4.38Å; P130-T132 PolarHBondContact O-N 3.35Å; P130-C143 VanDerWaalsContact O-CB 3.27Å; P130-C143 WeakPolarHBondContact O-CB 2.91Å
131	L	85.4	Confident	81.6	Confident	43 Å²	43	83.5 Å²	83.5	23%	0.225	42%	0.415	C	S	.	.			trans	-78.3	112.6	173.2	-60.8	173.1	0	0	0	108.5	R122 C124 A129 L141 L142 C143 I160	R122-L131 VanDerWaalsContact O-CD1 3.27Å; R122-L131 WeakPolarHBondContact O-CD1 3.35Å; C124-L131 HydrophobicContact CB-CD2 3.77Å; A129-L131 PolarHBondContact O-N 2.92Å; L131-L141 HydrophobicContact CB-CB 4.23Å; L131-L141 HydrophobicContact CD1-CB 3.88Å; L131-L141 HydrophobicContact CD1-CD1 4.39Å; L131-L141 HydrophobicContact CD2-CB 4.47Å; L131-L141 WeakPolarHBondContact CD2-O 3.12Å; L131-L141 HydrophobicContact CG-CB 4.42Å; L131-L142 CarbonylContact C-O 3.59Å; L131-L142 WeakPolarHBondContact CA-O 3.31Å; L131-C143 HydrophobicContact CD2-CB 4.33Å; L131-I160 HydrophobicContact CB-CD1 4.42Å; L131-I160 WeakPolarHBondContact O-CD1 3.49Å
132	T	86.2	Confident	83	Confident	71 Å²	71	78.3 Å²	78.3	44%	0.436	38%	0.38	S	S	.	.			trans	-122.9	-11.1	-176.5	54.3	0	0	0	0	112.9	P130 L142 I160	P130-T132 HydrophobicContact CB-CG2 4.38Å; P130-T132 PolarHBondContact O-N 3.35Å; T132-L142 PolarHBondContact N-O 2.75Å; T132-I160 VanDerWaalsContact C-CD1 3.43Å; T132-I160 WeakPolarHBondContact O-CG1 3.49Å; T132-I160 PolarHBondContact O-N 2.97Å
133	L	88.8	Confident	83.9	Confident	24 Å²	24	70.7 Å²	70.7	13%	0.126	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	157.7	-174	-62.6	174	0	0	0	111.1	L141 L142 Q147 V157 Q158 I160	L133-L141 CarbonylContact O-C 3.56Å; L133-L141 WeakPolarHBondContact O-CA 3.49Å; L133-L142 HydrophobicContact CB-CB 4.08Å; L133-L142 PolarHBondContact N-O 2.83Å; L133-L142 PolarHBondContact O-N 3.13Å; L133-Q147 HydrophobicContact CD1-CB 4.14Å; L133-Q147 VanDerWaalsContact CD1-OE1 3.29Å; L133-V157 HydrophobicContact CB-CG1 3.59Å; L133-V157 HydrophobicContact CD1-CG1 3.97Å; L133-V157 HydrophobicContact CD2-CG1 4.3Å; L133-V157 HydrophobicContact CG-CG1 4.16Å; L133-Q158 CarbonylContact C-O 3.51Å; L133-Q158 WeakPolarHBondContact CA-O 3.32Å; L133-I160 WeakPolarHBondContact O-CG1 3.41Å
134	F	90.3	Very high	84.1	Confident	35 Å²	35	71.6 Å²	71.6	15%	0.154	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	130.6	175.7	-175.3	-90.4	0	0	0	109.6	L136 K139 E140 L141 V157 Q158 I160 T163 F167	F134-L136 HydrophobicContact CD1-CD2 4.03Å; F134-L136 HydrophobicContact CE1-CD2 4.13Å; F134-K139 WeakPolarHBondContact CE2-O 3.42Å; F134-K139 VanDerWaalsContact CZ-CA 3.47Å; F134-K139 HydrophobicContact CZ-CB 4Å; F134-E140 WeakPolarHBondContact CA-O 3.22Å; F134-L141 HydrophobicContact CD2-CD2 3.83Å; F134-L141 HydrophobicContact CD2-CG 4.42Å; F134-V157 WeakPolarHBondContact O-CA 3.22Å; F134-Q158 PolarHBondContact N-O 3.13Å; F134-Q158 PolarHBondContact O-N 3.24Å; F134-I160 HydrophobicContact CB-CG1 4.34Å; F134-T163 HydrophobicContact CB-CG2 4.24Å; F134-T163 HydrophobicContact CD1-CG2 3.51Å; F134-T163 HydrophobicContact CE1-CG2 4.06Å; F134-T163 HydrophobicContact CG-CG2 4.03Å; F134-F167 HydrophobicContact CE1-CE2 4.18Å
135	C	89	Confident	84.2	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	122.8	174.1	-167.8	0	0	0	0	109.5	D138 K139 E140 L142 H155 V157	C135-D138 HydrophobicContact CB-CB 4.24Å; C135-D138 PolarHBondContact SG-OD2 3.01Å; C135-K139 WeakPolarHBondContact O-CA 3.36Å; C135-K139 PolarHBondContact O-N 2.79Å; C135-E140 PolarHBondContact N-O 3.48Å; C135-L142 HydrophobicContact CB-CD1 3.87Å; C135-L142 HydrophobicContact CB-CG 4.3Å; C135-H155 WeakPolarHBondContact SG-CB 3.47Å; C135-V157 HydrophobicContact CB-CG2 4.45Å
136	L	86.3	Confident	84.5	Confident	47 Å²	47	63.5 Å²	63.5	25%	0.246	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-34.1	-176.1	-68.4	179.1	0	0	0	113.3	F134 R156 T163 F167	F134-L136 HydrophobicContact CD1-CD2 4.03Å; F134-L136 HydrophobicContact CE1-CD2 4.13Å; L136-R156 HydrophobicContact CD1-CB 4.16Å; L136-R156 HydrophobicContact CD1-CG 3.87Å; L136-R156 PolarHBondContact N-O 3.37Å; L136-T163 HydrophobicContact CD2-CG2 3.7Å; L136-F167 HydrophobicContact CD2-CE2 4.12Å
137	E	87.4	Confident	84.6	Confident	94 Å²	94	64.7 Å²	64.7	44%	0.439	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-53.9	-178.2	-66.6	74.1	-168.3	0	0	110.6	K139 H155 R156	E137-K139 VanDerWaalsContact C-N 3.33Å; E137-H155 HydrophobicContact CB-CB 4.43Å; E137-H155 HydrophobicContact CG-CB 4.45Å; E137-H155 WeakPolarHBondContact OE2-CB 3.47Å; E137-R156 VanDerWaalsContact CD-N 3.28Å; E137-R156 VanDerWaalsContact OE1-CB 3.3Å; E137-R156 WeakPolarHBondContact OE1-CB 3.38Å; E137-R156 PolarHBondContact OE1-N 3.48Å; E137-R156 PolarHBondContact OE2-N 3.12Å
138	D	82.1	Confident	84.6	Confident	54 Å²	54	65 Å²	65	29%	0.289	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-16	-178.8	-56.2	-42.8	0	0	0	113.3	C135 E140 H152 H155	C135-D138 HydrophobicContact CB-CB 4.24Å; C135-D138 PolarHBondContact SG-OD2 3.01Å; D138-E140 HydrophobicContact CB-CB 4.4Å; D138-E140 HydrophobicContact CB-CG 4.05Å; D138-E140 PolarHBondContact O-N 3.15Å; D138-H152 IonicContact OD2-CE1 3.06Å; D138-H152 PolarHBondContact OD2-CE1 2.75Å; D138-H152 IonicContact OD2-ND1 3.14Å; D138-H152 PolarHBondContact OD2-ND1 3.36Å; D138-H155 VanDerWaalsContact CG-CE1 3.49Å; D138-H155 VanDerWaalsContact CG-ND1 3.31Å; D138-H155 IonicContact OD1-CE1 2.78Å; D138-H155 PolarHBondContact OD1-CE1 2.99Å; D138-H155 IonicContact OD1-ND1 3.26Å; D138-H155 PolarHBondContact OD1-ND1 2.91Å; D138-H155 IonicContact OD2-CE1 3.68Å; D138-H155 PolarHBondContact OD2-CE1 2.95Å; D138-H155 IonicContact OD2-CG 2.72Å; D138-H155 IonicContact OD2-ND1 3.18Å; D138-H155 PolarHBondContact OD2-ND1 3.31Å
139	K	83.2	Confident	84.8	Confident	159 Å²	159	56.7 Å²	56.7	69%	0.691	32%	0.319	S	S	*	.			trans	59.4	31.4	-175.7	-53.3	173.1	-174.1	169.9	0	113.6	F134 C135 E137	F134-K139 WeakPolarHBondContact CE2-O 3.42Å; F134-K139 VanDerWaalsContact CZ-CA 3.47Å; F134-K139 HydrophobicContact CZ-CB 4Å; C135-K139 WeakPolarHBondContact O-CA 3.36Å; C135-K139 PolarHBondContact O-N 2.79Å; E137-K139 VanDerWaalsContact C-N 3.33Å
140	E	83.5	Confident	84.8	Confident	87 Å²	87	59.4 Å²	59.4	41%	0.407	34%	0.342	S	S	.	.			trans	-108.6	153.2	-177.5	-64.5	-167.9	153.5	0	0	112.9	F134 C135 D138 L142 H152	F134-E140 WeakPolarHBondContact CA-O 3.22Å; C135-E140 PolarHBondContact N-O 3.48Å; D138-E140 HydrophobicContact CB-CB 4.4Å; D138-E140 HydrophobicContact CB-CG 4.05Å; D138-E140 PolarHBondContact O-N 3.15Å; E140-L142 HydrophobicContact CB-CD2 4.43Å; E140-H152 IonicContact OE2-CE1 3.23Å
141	L	87.2	Confident	84.6	Confident	91 Å²	91	62.2 Å²	62.2	48%	0.476	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	129.3	171.7	-65	169.4	0	0	0	109.9	L131 L133 F134 I160	L131-L141 HydrophobicContact CB-CB 4.23Å; L131-L141 HydrophobicContact CD1-CB 3.88Å; L131-L141 HydrophobicContact CD1-CD1 4.39Å; L131-L141 HydrophobicContact CD2-CB 4.47Å; L131-L141 WeakPolarHBondContact CD2-O 3.12Å; L131-L141 HydrophobicContact CG-CB 4.42Å; L133-L141 CarbonylContact O-C 3.56Å; L133-L141 WeakPolarHBondContact O-CA 3.49Å; F134-L141 HydrophobicContact CD2-CD2 3.83Å; F134-L141 HydrophobicContact CD2-CG 4.42Å; L141-I160 HydrophobicContact CD2-CD1 3.56Å; L141-I160 HydrophobicContact CD2-CG1 3.62Å; L141-I160 HydrophobicContact CD2-CG2 4.39Å
142	L	86.9	Confident	84.4	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.021	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	149.8	-176	-55.7	-176	0	0	0	111.6	L131 T132 L133 C135 E140 C146 H152 V157	L131-L142 CarbonylContact C-O 3.59Å; L131-L142 WeakPolarHBondContact CA-O 3.31Å; T132-L142 PolarHBondContact N-O 2.75Å; L133-L142 HydrophobicContact CB-CB 4.08Å; L133-L142 PolarHBondContact N-O 2.83Å; L133-L142 PolarHBondContact O-N 3.13Å; C135-L142 HydrophobicContact CB-CD1 3.87Å; C135-L142 HydrophobicContact CB-CG 4.3Å; E140-L142 HydrophobicContact CB-CD2 4.43Å; L142-C146 HydrophobicContact CB-CB 3.97Å; L142-C146 HydrophobicContact CD2-CB 3.97Å; L142-C146 HydrophobicContact CG-CB 4.39Å; L142-H152 HydrophobicContact CD1-CB 4.2Å; L142-H152 WeakPolarHBondContact CD2-NE2 3.23Å; L142-V157 HydrophobicContact CD1-CG1 4.2Å; L142-V157 HydrophobicContact CD1-CG2 3.92Å
143	C	86.6	Confident	84.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.344	C	S	.	.			trans	-93.1	168	160.4	68.9	0	0	0	0	109.8	C124 H127 A129 P130 L131 A145 C146 Q147	C124-C143 HydrophobicContact CB-CB 3.86Å; C124-C143 VanDerWaalsContact CB-SG 3.56Å; C124-C143 VanDerWaalsContact SG-SG 3.67Å; H127-C143 PolarHBondContact ND1-SG 3.2Å; H127-C143 VanDerWaalsContact ND1-SG 3.38Å; A129-C143 HydrophobicContact CB-CB 3.8Å; P130-C143 VanDerWaalsContact O-CB 3.27Å; P130-C143 WeakPolarHBondContact O-CB 2.91Å; L131-C143 HydrophobicContact CD2-CB 4.33Å; C143-A145 VanDerWaalsContact C-N 3.26Å; C143-A145 PolarHBondContact O-N 3.43Å; C143-C146 WeakPolarHBondContact O-CB 3.48Å; C143-C146 PolarHBondContact O-N 3.16Å; C143-C146 VanDerWaalsContact SG-SG 3.62Å; C143-Q147 PolarHBondContact O-N 3.34Å
144	C	82.9	Confident	83.7	Confident	86 Å²	86	72.2 Å²	72.2	58%	0.581	38%	0.381	S	S	*	.	H	α-helix	trans	-54.2	-37.8	-179.7	54.3	0	0	0	0	114	C146 Q147	C144-C146 PolarHBondContact O-N 3.46Å; C144-Q147 WeakPolarHBondContact O-CB 3.29Å; C144-Q147 PolarHBondContact O-N 2.86Å
145	A	83.4	Confident	83.7	Confident	46 Å²	46	73.7 Å²	73.7	38%	0.38	39%	0.388	S	S	.	.	H	α-helix	trans	-68.5	-29.7	177.2	0	0	0	0	0	113.8	H127 C143 Q147 A148	H127-A145 HydrophobicContact CB-CB 4.22Å; C143-A145 VanDerWaalsContact C-N 3.26Å; C143-A145 PolarHBondContact O-N 3.43Å; A145-Q147 VanDerWaalsContact C-N 3.3Å; A145-Q147 PolarHBondContact O-N 3.46Å; A145-A148 PolarHBondContact O-N 3.28Å
146	C	83.6	Confident	83.5	Confident	9 Å²	9	81 Å²	81	6%	0.061	42%	0.415	C	S	.	.	H	α-helix	trans	-71.2	-25.5	176.7	-73.7	0	0	0	0	112.6	H127 L142 C143 C144 A148 D149 H152	H127-C146 PolarHBondContact CE1-SG 3.02Å; H127-C146 PolarHBondContact ND1-SG 3.31Å; L142-C146 HydrophobicContact CB-CB 3.97Å; L142-C146 HydrophobicContact CD2-CB 3.97Å; L142-C146 HydrophobicContact CG-CB 4.39Å; C143-C146 WeakPolarHBondContact O-CB 3.48Å; C143-C146 PolarHBondContact O-N 3.16Å; C143-C146 VanDerWaalsContact SG-SG 3.62Å; C144-C146 PolarHBondContact O-N 3.46Å; C146-A148 PolarHBondContact O-N 3.25Å; C146-D149 VanDerWaalsContact O-CB 3.23Å; C146-D149 WeakPolarHBondContact O-CB 3.45Å; C146-D149 PolarHBondContact O-N 3.03Å; C146-H152 PolarHBondContact O-CD2 2.87Å
147	Q	81.4	Confident	83.7	Confident	95 Å²	95	80 Å²	80	44%	0.444	41%	0.412	S	S	.	.	H	α-helix	trans	-64.6	-31	178.6	-175.1	-177.8	-2	0	0	112.1	L133 C143 C144 A145 D149 V157	L133-Q147 HydrophobicContact CD1-CB 4.14Å; L133-Q147 VanDerWaalsContact CD1-OE1 3.29Å; C143-Q147 PolarHBondContact O-N 3.34Å; C144-Q147 WeakPolarHBondContact O-CB 3.29Å; C144-Q147 PolarHBondContact O-N 2.86Å; A145-Q147 VanDerWaalsContact C-N 3.3Å; A145-Q147 PolarHBondContact O-N 3.46Å; Q147-D149 VanDerWaalsContact C-N 3.34Å; Q147-V157 HydrophobicContact CG-CB 4.49Å; Q147-V157 HydrophobicContact CG-CG1 4.49Å
148	A	79.7	Confident	83.7	Confident	87 Å²	87	77.5 Å²	77.5	72%	0.719	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-0.8	178.5	0	0	0	0	0	113.3	A145 C146	A145-A148 PolarHBondContact O-N 3.28Å; C146-A148 PolarHBondContact O-N 3.25Å
149	D	82.8	Confident	84.1	Confident	45 Å²	45	77.7 Å²	77.7	24%	0.241	40%	0.404	C	S	.	.	S	Bend	trans	-69.5	139.4	174.1	-167.4	-37.6	0	0	0	108.8	C146 Q147 R151 H152 Q153	C146-D149 VanDerWaalsContact O-CB 3.23Å; C146-D149 WeakPolarHBondContact O-CB 3.45Å; C146-D149 PolarHBondContact O-N 3.03Å; Q147-D149 VanDerWaalsContact C-N 3.34Å; D149-R151 PolarHBondContact O-N 3.09Å; D149-R151 WeakPolarHBondContact OD1-CG 3.25Å; D149-R151 PolarHBondContact OD1-N 2.75Å; D149-R151 VanDerWaalsContact OD1-N 3.16Å; D149-R151 IonicContact OD1-NE 3.94Å; D149-R151 PolarHBondContact OD1-NE 3.43Å; D149-R151 IonicContact OD2-CZ 3.69Å; D149-R151 IonicContact OD2-NE 2.89Å; D149-R151 PolarHBondContact OD2-NE 2.85Å; D149-R151 IonicContact OD2-NH2 2.74Å; D149-R151 PolarHBondContact OD2-NH2 3.24Å; D149-H152 PolarHBondContact O-N 2.89Å; D149-Q153 PolarHBondContact O-N 3.46Å
150	A	80.8	Confident	84.4	Confident	79 Å²	79	72.7 Å²	72.7	65%	0.653	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-53.1	-26.5	178.1	0	0	0	0	0	112.2	H152	A150-H152 VanDerWaalsContact C-N 3.28Å; A150-H152 PolarHBondContact O-N 3.3Å
151	R	78.1	Confident	84.5	Confident	150 Å²	150	76.5 Å²	76.5	57%	0.566	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-63.8	-24.6	177.1	-66.6	-176.8	-67.9	154.1	2.2	115	D149	D149-R151 PolarHBondContact O-N 3.09Å; D149-R151 WeakPolarHBondContact OD1-CG 3.25Å; D149-R151 PolarHBondContact OD1-N 2.75Å; D149-R151 VanDerWaalsContact OD1-N 3.16Å; D149-R151 IonicContact OD1-NE 3.94Å; D149-R151 PolarHBondContact OD1-NE 3.43Å; D149-R151 IonicContact OD2-CZ 3.69Å; D149-R151 IonicContact OD2-NE 2.89Å; D149-R151 PolarHBondContact OD2-NE 2.85Å; D149-R151 IonicContact OD2-NH2 2.74Å; D149-R151 PolarHBondContact OD2-NH2 3.24Å
152	H	81.3	Confident	84.5	Confident	9 Å²	9	75.9 Å²	75.9	4%	0.042	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-125.8	10.4	-177.7	-54.7	-71.6	0	0	0	113.1	D138 E140 L142 C146 D149 A150 E154 H155	D138-H152 IonicContact OD2-CE1 3.06Å; D138-H152 PolarHBondContact OD2-CE1 2.75Å; D138-H152 IonicContact OD2-ND1 3.14Å; D138-H152 PolarHBondContact OD2-ND1 3.36Å; E140-H152 IonicContact OE2-CE1 3.23Å; L142-H152 HydrophobicContact CD1-CB 4.2Å; L142-H152 WeakPolarHBondContact CD2-NE2 3.23Å; C146-H152 PolarHBondContact O-CD2 2.87Å; D149-H152 PolarHBondContact O-N 2.89Å; A150-H152 VanDerWaalsContact C-N 3.28Å; A150-H152 PolarHBondContact O-N 3.3Å; H152-E154 PolarHBondContact O-N 2.8Å; H152-H155 AromaticContact ND1-ND1 3.98Å; H152-H155 PolarHBondContact O-N 3.07Å; H152-H155 VanDerWaalsContact O-N 3.14Å
153	Q	79.8	Confident	84.6	Confident	149 Å²	149	75.9 Å²	75.9	70%	0.696	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.7	-172.5	-171	172.1	2.4	0	0	113.5	D149	D149-Q153 PolarHBondContact O-N 3.46Å
154	E	81.8	Confident	84.7	Confident	191 Å²	191	77.4 Å²	77.4	89%	0.893	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	0.7	178.5	-61.4	-172	168	0	0	113.6	H152	H152-E154 PolarHBondContact O-N 2.8Å
155	H	88.9	Confident	85	Confident	66 Å²	66	79.2 Å²	79.2	31%	0.306	41%	0.409	S	S	.	.	S	Bend	trans	-90.3	150.9	-176.2	-68.3	179.1	0	0	0	112.2	C135 E137 D138 H152 V157	C135-H155 WeakPolarHBondContact SG-CB 3.47Å; E137-H155 HydrophobicContact CB-CB 4.43Å; E137-H155 HydrophobicContact CG-CB 4.45Å; E137-H155 WeakPolarHBondContact OE2-CB 3.47Å; D138-H155 VanDerWaalsContact CG-CE1 3.49Å; D138-H155 VanDerWaalsContact CG-ND1 3.31Å; D138-H155 IonicContact OD1-CE1 2.78Å; D138-H155 PolarHBondContact OD1-CE1 2.99Å; D138-H155 IonicContact OD1-ND1 3.26Å; D138-H155 PolarHBondContact OD1-ND1 2.91Å; D138-H155 IonicContact OD2-CE1 3.68Å; D138-H155 PolarHBondContact OD2-CE1 2.95Å; D138-H155 IonicContact OD2-CG 2.72Å; D138-H155 IonicContact OD2-ND1 3.18Å; D138-H155 PolarHBondContact OD2-ND1 3.31Å; H152-H155 AromaticContact ND1-ND1 3.98Å; H152-H155 PolarHBondContact O-N 3.07Å; H152-H155 VanDerWaalsContact O-N 3.14Å; H155-V157 PolarHBondContact O-N 3.4Å
156	R	86.4	Confident	85.2	Confident	152 Å²	152	80.9 Å²	80.9	57%	0.574	41%	0.412	S	S	*	.			trans	-80.4	107.8	177.3	-170.9	170.3	172.5	-167.7	-0.6	109.7	L136 E137	L136-R156 HydrophobicContact CD1-CB 4.16Å; L136-R156 HydrophobicContact CD1-CG 3.87Å; L136-R156 PolarHBondContact N-O 3.37Å; E137-R156 VanDerWaalsContact CD-N 3.28Å; E137-R156 VanDerWaalsContact OE1-CB 3.3Å; E137-R156 WeakPolarHBondContact OE1-CB 3.38Å; E137-R156 PolarHBondContact OE1-N 3.48Å; E137-R156 PolarHBondContact OE2-N 3.12Å
157	V	89.1	Confident	85.4	Confident	28 Å²	28	84.9 Å²	84.9	17%	0.17	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.7	179.3	-176.5	0	0	0	0	110.5	L133 F134 C135 L142 Q147 H155	L133-V157 HydrophobicContact CB-CG1 3.59Å; L133-V157 HydrophobicContact CD1-CG1 3.97Å; L133-V157 HydrophobicContact CD2-CG1 4.3Å; L133-V157 HydrophobicContact CG-CG1 4.16Å; F134-V157 WeakPolarHBondContact O-CA 3.22Å; C135-V157 HydrophobicContact CB-CG2 4.45Å; L142-V157 HydrophobicContact CD1-CG1 4.2Å; L142-V157 HydrophobicContact CD1-CG2 3.92Å; Q147-V157 HydrophobicContact CG-CB 4.49Å; Q147-V157 HydrophobicContact CG-CG1 4.49Å; H155-V157 PolarHBondContact O-N 3.4Å
158	Q	88.9	Confident	85.9	Confident	40 Å²	40	88.8 Å²	88.8	19%	0.187	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	158.4	179.5	-69.4	-174.3	-80.9	0	0	111.5	L133 F134 I160 T163	L133-Q158 CarbonylContact C-O 3.51Å; L133-Q158 WeakPolarHBondContact CA-O 3.32Å; F134-Q158 PolarHBondContact N-O 3.13Å; F134-Q158 PolarHBondContact O-N 3.24Å; Q158-I160 PolarHBondContact O-N 2.83Å; Q158-T163 VanDerWaalsContact CB-OG1 3.28Å; Q158-T163 WeakPolarHBondContact CB-OG1 3.26Å
159	P	90.8	Very high	86.6	Confident	59 Å²	59	86.9 Å²	86.9	38%	0.383	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	141.1	171.9	-24.6	35	0	0	0	111.8	K161 D162 T163	P159-K161 PolarHBondContact O-N 3.31Å; P159-D162 PolarHBondContact O-N 3.29Å; P159-T163 WeakPolarHBondContact O-CB 3.41Å; P159-T163 PolarHBondContact O-N 3.08Å; P159-T163 PolarHBondContact O-OG1 3.34Å
160	I	89	Confident	86.9	Confident	53 Å²	53	91.1 Å²	91.1	27%	0.272	44%	0.44	S	S	.	.	H	α-helix	trans	-57.3	-39.7	-179.5	-68.6	163.8	0	0	0	111.2	L131 T132 L133 F134 L141 Q158 D162 A164	L131-I160 HydrophobicContact CB-CD1 4.42Å; L131-I160 WeakPolarHBondContact O-CD1 3.49Å; T132-I160 VanDerWaalsContact C-CD1 3.43Å; T132-I160 WeakPolarHBondContact O-CG1 3.49Å; T132-I160 PolarHBondContact O-N 2.97Å; L133-I160 WeakPolarHBondContact O-CG1 3.41Å; F134-I160 HydrophobicContact CB-CG1 4.34Å; L141-I160 HydrophobicContact CD2-CD1 3.56Å; L141-I160 HydrophobicContact CD2-CG1 3.62Å; L141-I160 HydrophobicContact CD2-CG2 4.39Å; Q158-I160 PolarHBondContact O-N 2.83Å; I160-D162 PolarHBondContact O-N 3.45Å; I160-A164 WeakPolarHBondContact O-CB 3.13Å; I160-A164 PolarHBondContact O-N 3.09Å
161	K	85.2	Confident	87.5	Confident	168 Å²	168	91.3 Å²	91.3	73%	0.73	44%	0.435	S	S	*	.	H	α-helix	trans	-61.1	-47.6	-177	-172.8	-177.4	175.7	-171.7	0	111.5	P159 Q165	P159-K161 PolarHBondContact O-N 3.31Å; K161-Q165 WeakPolarHBondContact O-CB 3.41Å; K161-Q165 PolarHBondContact O-N 3.38Å
162	D	87.8	Confident	88.1	Confident	77 Å²	77	91 Å²	91	41%	0.412	44%	0.438	S	S	.	.	H	α-helix	trans	-71.6	-45.2	-176.7	-54.9	-18	0	0	0	110	P159 I160 A164 Q165 D166	P159-D162 PolarHBondContact O-N 3.29Å; I160-D162 PolarHBondContact O-N 3.45Å; D162-A164 PolarHBondContact O-N 3.08Å; D162-Q165 WeakPolarHBondContact O-CB 3.44Å; D162-Q165 PolarHBondContact O-N 3.28Å; D162-Q165 VanDerWaalsContact O-N 3.09Å; D162-D166 PolarHBondContact O-N 3.42Å
163	T	87.9	Confident	88.7	Confident	4 Å²	4	96 Å²	96	3%	0.025	47%	0.465	C	S	.	.	H	α-helix	trans	-60.5	-45.6	176.3	-48	0	0	0	0	111.4	F134 L136 Q158 P159 Q165 D166 F167	F134-T163 HydrophobicContact CB-CG2 4.24Å; F134-T163 HydrophobicContact CD1-CG2 3.51Å; F134-T163 HydrophobicContact CE1-CG2 4.06Å; F134-T163 HydrophobicContact CG-CG2 4.03Å; L136-T163 HydrophobicContact CD2-CG2 3.7Å; Q158-T163 VanDerWaalsContact CB-OG1 3.28Å; Q158-T163 WeakPolarHBondContact CB-OG1 3.26Å; P159-T163 WeakPolarHBondContact O-CB 3.41Å; P159-T163 PolarHBondContact O-N 3.08Å; P159-T163 PolarHBondContact O-OG1 3.34Å; T163-Q165 VanDerWaalsContact C-N 3.27Å; T163-Q165 PolarHBondContact O-N 2.93Å; T163-D166 PolarHBondContact O-N 2.91Å; T163-F167 HydrophobicContact CG2-CD2 3.69Å; T163-F167 HydrophobicContact CG2-CE2 3.66Å; T163-F167 VanDerWaalsContact O-CD2 3.31Å; T163-F167 WeakPolarHBondContact O-CD2 3.41Å; T163-F167 PolarHBondContact O-N 2.86Å
164	A	88.6	Confident	89.4	Confident	32 Å²	32	94.6 Å²	94.6	26%	0.264	46%	0.46	S	S	.	.	H	α-helix	trans	-63	-34.2	176.4	0	0	0	0	0	112.1	I160 D162 R168	I160-A164 WeakPolarHBondContact O-CB 3.13Å; I160-A164 PolarHBondContact O-N 3.09Å; D162-A164 PolarHBondContact O-N 3.08Å; A164-R168 VanDerWaalsContact O-CB 3.24Å; A164-R168 WeakPolarHBondContact O-CB 3.31Å; A164-R168 WeakPolarHBondContact O-CD 3.44Å; A164-R168 WeakPolarHBondContact O-CG 3.48Å; A164-R168 PolarHBondContact O-N 3.42Å
165	Q	90.4	Very high	90	Very high	124 Å²	124	89.7 Å²	89.7	58%	0.579	44%	0.437	S	S	*	.	H	α-helix	trans	-64.9	-45	174.5	-178	172	-13.6	0	0	111.4	K161 D162 T163 R168 A169	K161-Q165 WeakPolarHBondContact O-CB 3.41Å; K161-Q165 PolarHBondContact O-N 3.38Å; D162-Q165 WeakPolarHBondContact O-CB 3.44Å; D162-Q165 PolarHBondContact O-N 3.28Å; D162-Q165 VanDerWaalsContact O-N 3.09Å; T163-Q165 VanDerWaalsContact C-N 3.27Å; T163-Q165 PolarHBondContact O-N 2.93Å; Q165-R168 PolarHBondContact O-N 2.84Å; Q165-A169 PolarHBondContact O-N 2.82Å
166	D	87.8	Confident	90.3	Very high	82 Å²	82	91.9 Å²	91.9	44%	0.439	45%	0.447	S	S	.	.	H	α-helix	trans	-63.5	-46.1	177.2	-71.7	-15.5	0	0	0	112.2	D162 T163 R168 A169 K170	D162-D166 PolarHBondContact O-N 3.42Å; T163-D166 PolarHBondContact O-N 2.91Å; D166-R168 PolarHBondContact O-N 3.27Å; D166-A169 PolarHBondContact O-N 3.4Å; D166-K170 WeakPolarHBondContact O-CG 3.4Å; D166-K170 PolarHBondContact O-N 3.43Å
167	F	87.9	Confident	90.6	Very high	92 Å²	92	87.8 Å²	87.8	40%	0.404	44%	0.439	S	S	.	.	H	α-helix	trans	-63.6	-40	175.5	-85.6	-83.4	0	0	0	111.8	F134 L136 T163 A169 K170 C171	F134-F167 HydrophobicContact CE1-CE2 4.18Å; L136-F167 HydrophobicContact CD2-CE2 4.12Å; T163-F167 HydrophobicContact CG2-CD2 3.69Å; T163-F167 HydrophobicContact CG2-CE2 3.66Å; T163-F167 VanDerWaalsContact O-CD2 3.31Å; T163-F167 WeakPolarHBondContact O-CD2 3.41Å; T163-F167 PolarHBondContact O-N 2.86Å; F167-A169 VanDerWaalsContact C-N 3.33Å; F167-A169 PolarHBondContact O-N 2.95Å; F167-K170 PolarHBondContact O-N 2.8Å; F167-C171 WeakPolarHBondContact O-CB 3.44Å; F167-C171 PolarHBondContact O-N 3.48Å; F167-C171 PolarHBondContact O-SG 3.04Å
168	R	91.9	Very high	90.9	Very high	178 Å²	178	91.3 Å²	91.3	67%	0.672	46%	0.456	S	S	*	.	H	α-helix	trans	-61.9	-40	173.5	-76	167.2	-175.7	-174.3	1.9	111.8	A164 Q165 D166 C171 K172	A164-R168 VanDerWaalsContact O-CB 3.24Å; A164-R168 WeakPolarHBondContact O-CB 3.31Å; A164-R168 WeakPolarHBondContact O-CD 3.44Å; A164-R168 WeakPolarHBondContact O-CG 3.48Å; A164-R168 PolarHBondContact O-N 3.42Å; Q165-R168 PolarHBondContact O-N 2.84Å; D166-R168 PolarHBondContact O-N 3.27Å; R168-C171 PolarHBondContact O-N 3.17Å; R168-K172 WeakPolarHBondContact O-CG 3.31Å; R168-K172 PolarHBondContact O-N 3.03Å
169	A	93.1	Very high	91.1	Very high	47 Å²	47	96.7 Å²	96.7	39%	0.388	48%	0.475	S	S	.	.	H	α-helix	trans	-64.4	-44.9	175.9	0	0	0	0	0	111.6	Q165 D166 F167 C171 K172 N173	Q165-A169 PolarHBondContact O-N 2.82Å; D166-A169 PolarHBondContact O-N 3.4Å; F167-A169 VanDerWaalsContact C-N 3.33Å; F167-A169 PolarHBondContact O-N 2.95Å; A169-C171 PolarHBondContact O-N 3.27Å; A169-K172 PolarHBondContact O-N 2.85Å; A169-N173 PolarHBondContact O-N 2.89Å
170	K	90	Very high	91.3	Very high	134 Å²	134	97.6 Å²	97.6	58%	0.583	47%	0.474	S	S	*	.	H	α-helix	trans	-58.9	-44.2	173.3	-70.7	175.2	-177.1	175.2	0	112.1	D166 F167 N173 M174	D166-K170 WeakPolarHBondContact O-CG 3.4Å; D166-K170 PolarHBondContact O-N 3.43Å; F167-K170 PolarHBondContact O-N 2.8Å; K170-N173 PolarHBondContact O-N 3.34Å; K170-M174 PolarHBondContact O-N 2.68Å
171	C	92.3	Very high	91.5	Very high	83 Å²	83	100.7 Å²	100.7	56%	0.561	49%	0.485	S	S	*	.	H	α-helix	trans	-62.6	-42.2	175.9	-70.7	0	0	0	0	112.2	F167 R168 A169 N173 M174 E175	F167-C171 WeakPolarHBondContact O-CB 3.44Å; F167-C171 PolarHBondContact O-N 3.48Å; F167-C171 PolarHBondContact O-SG 3.04Å; R168-C171 PolarHBondContact O-N 3.17Å; A169-C171 PolarHBondContact O-N 3.27Å; C171-N173 VanDerWaalsContact C-N 3.33Å; C171-N173 PolarHBondContact O-N 2.81Å; C171-M174 PolarHBondContact O-N 2.96Å; C171-E175 WeakPolarHBondContact O-CB 3.48Å; C171-E175 PolarHBondContact O-N 3.44Å
172	K	91.9	Very high	91.9	Very high	144 Å²	144	94.8 Å²	94.8	63%	0.626	47%	0.468	S	S	*	.	H	α-helix	trans	-61.2	-40.2	174.7	-76.4	179	177.4	-174.2	0	112.3	R168 A169 E175 H176	R168-K172 WeakPolarHBondContact O-CG 3.31Å; R168-K172 PolarHBondContact O-N 3.03Å; A169-K172 PolarHBondContact O-N 2.85Å; K172-E175 PolarHBondContact O-N 2.8Å; K172-H176 WeakPolarHBondContact O-CB 3.31Å; K172-H176 PolarHBondContact O-N 3.38Å
173	N	93.8	Very high	92.3	Very high	113 Å²	113	97.1 Å²	97.1	60%	0.604	48%	0.475	S	S	*	.	H	α-helix	trans	-64.8	-43.9	175.5	-70.7	-11.8	0	0	0	111.5	A169 K170 C171 H176 V177	A169-N173 PolarHBondContact O-N 2.89Å; K170-N173 PolarHBondContact O-N 3.34Å; C171-N173 VanDerWaalsContact C-N 3.33Å; C171-N173 PolarHBondContact O-N 2.81Å; N173-H176 WeakPolarHBondContact O-CB 3.27Å; N173-H176 PolarHBondContact O-N 3Å; N173-V177 WeakPolarHBondContact O-CG2 3.44Å; N173-V177 PolarHBondContact O-N 2.86Å
174	M	93.4	Very high	92.6	Very high	120 Å²	120	99.9 Å²	99.9	59%	0.591	50%	0.498	S	S	*	.	H	α-helix	trans	-62.2	-43.8	175.5	-171.8	64	70.7	0	0	111.6	K170 C171 H176 V177 L178	K170-M174 PolarHBondContact O-N 2.68Å; C171-M174 PolarHBondContact O-N 2.96Å; M174-H176 VanDerWaalsContact C-N 3.33Å; M174-H176 PolarHBondContact O-N 2.7Å; M174-V177 PolarHBondContact O-N 3.38Å; M174-L178 HydrophobicContact CG-CD1 4.36Å; M174-L178 WeakPolarHBondContact O-CG 3.34Å; M174-L178 PolarHBondContact O-N 3.45Å
175	E	94.9	Very high	92.8	Very high	88 Å²	88	105.4 Å²	105.4	41%	0.411	52%	0.516	S	S	.	.	H	α-helix	trans	-57.8	-45.8	174.9	-173	-162.6	161.9	0	0	111.2	C171 K172 L178 R179	C171-E175 WeakPolarHBondContact O-CB 3.48Å; C171-E175 PolarHBondContact O-N 3.44Å; K172-E175 PolarHBondContact O-N 2.8Å; E175-L178 PolarHBondContact O-N 2.93Å; E175-R179 WeakPolarHBondContact O-CG 3.42Å; E175-R179 PolarHBondContact O-N 3.42Å; E175-R179 IonicContact OE1-CZ 3.35Å; E175-R179 IonicContact OE1-NE 2.66Å; E175-R179 PolarHBondContact OE1-NE 3.01Å; E175-R179 IonicContact OE1-NH2 3.41Å; E175-R179 PolarHBondContact OE1-NH2 3.36Å
176	H	94.6	Very high	93	Very high	112 Å²	112	106.6 Å²	106.6	52%	0.519	52%	0.515	S	S	.	.	H	α-helix	trans	-59.2	-47.8	176.2	-178.1	-85.2	0	0	0	111.7	K172 N173 M174 L178 R179 E180	K172-H176 WeakPolarHBondContact O-CB 3.31Å; K172-H176 PolarHBondContact O-N 3.38Å; N173-H176 WeakPolarHBondContact O-CB 3.27Å; N173-H176 PolarHBondContact O-N 3Å; M174-H176 VanDerWaalsContact C-N 3.33Å; M174-H176 PolarHBondContact O-N 2.7Å; H176-L178 VanDerWaalsContact C-N 3.3Å; H176-L178 PolarHBondContact O-N 3.38Å; H176-R179 WeakPolarHBondContact O-CB 3.48Å; H176-R179 PolarHBondContact O-N 2.86Å; H176-R179 VanDerWaalsContact O-N 3.15Å; H176-E180 PolarHBondContact O-N 3.34Å
177	V	94.6	Very high	93.2	Very high	66 Å²	66	104.9 Å²	104.9	40%	0.4	51%	0.512	S	S	.	.	H	α-helix	trans	-59.5	-41.3	176.6	172.1	0	0	0	0	111.5	N173 M174 E180 K181	N173-V177 WeakPolarHBondContact O-CG2 3.44Å; N173-V177 PolarHBondContact O-N 2.86Å; M174-V177 PolarHBondContact O-N 3.38Å; V177-E180 PolarHBondContact O-N 2.92Å; V177-K181 HydrophobicContact CG1-CD 4.39Å; V177-K181 WeakPolarHBondContact O-CG 3.49Å; V177-K181 PolarHBondContact O-N 2.76Å
178	L	93.9	Very high	93.4	Very high	102 Å²	102	104.6 Å²	104.6	53%	0.534	52%	0.515	S	S	.	.	H	α-helix	trans	-66.3	-37.9	176.4	-69.9	174	0	0	0	112.2	M174 E175 H176 K181 A182	M174-L178 HydrophobicContact CG-CD1 4.36Å; M174-L178 WeakPolarHBondContact O-CG 3.34Å; M174-L178 PolarHBondContact O-N 3.45Å; E175-L178 PolarHBondContact O-N 2.93Å; H176-L178 VanDerWaalsContact C-N 3.3Å; H176-L178 PolarHBondContact O-N 3.38Å; L178-K181 PolarHBondContact O-N 3.18Å; L178-A182 WeakPolarHBondContact O-CB 3.38Å; L178-A182 PolarHBondContact O-N 3.15Å
179	R	94.4	Very high	93.5	Very high	152 Å²	152	101.8 Å²	101.8	57%	0.574	50%	0.504	S	S	*	.	H	α-helix	trans	-63.3	-44	174.1	-73.6	175.6	179.5	-136.3	2.7	111.6	E175 H176 A182 K183	E175-R179 WeakPolarHBondContact O-CG 3.42Å; E175-R179 PolarHBondContact O-N 3.42Å; E175-R179 IonicContact OE1-CZ 3.35Å; E175-R179 IonicContact OE1-NE 2.66Å; E175-R179 PolarHBondContact OE1-NE 3.01Å; E175-R179 IonicContact OE1-NH2 3.41Å; E175-R179 PolarHBondContact OE1-NH2 3.36Å; H176-R179 WeakPolarHBondContact O-CB 3.48Å; H176-R179 PolarHBondContact O-N 2.86Å; H176-R179 VanDerWaalsContact O-N 3.15Å; R179-A182 PolarHBondContact O-N 3.12Å; R179-K183 WeakPolarHBondContact O-CG 3.44Å; R179-K183 PolarHBondContact O-N 3.27Å
180	E	94.8	Very high	93.4	Very high	78 Å²	78	107.6 Å²	107.6	36%	0.364	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-42.1	176.3	-66.6	-49.4	111.2	0	0	111.9	H176 V177 A182 K183 A184	H176-E180 PolarHBondContact O-N 3.34Å; V177-E180 PolarHBondContact O-N 2.92Å; E180-A182 VanDerWaalsContact C-N 3.34Å; E180-A182 PolarHBondContact O-N 2.9Å; E180-K183 WeakPolarHBondContact O-CB 3.39Å; E180-K183 PolarHBondContact O-N 2.85Å; E180-K183 WeakPolarHBondContact OE1-CE 3.41Å; E180-K183 IonicContact OE1-NZ 3.33Å; E180-K183 PolarHBondContact OE1-NZ 2.78Å; E180-K183 IonicContact OE2-NZ 3.41Å; E180-A184 PolarHBondContact O-N 3.44Å
181	K	93.4	Very high	93.5	Very high	118 Å²	118	104.3 Å²	104.3	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-58.2	-46.5	171.9	-75.9	-179.9	178.5	-177.4	0	111.5	V177 L178 K183 A184 F185	V177-K181 HydrophobicContact CG1-CD 4.39Å; V177-K181 WeakPolarHBondContact O-CG 3.49Å; V177-K181 PolarHBondContact O-N 2.76Å; L178-K181 PolarHBondContact O-N 3.18Å; K181-K183 VanDerWaalsContact C-N 3.33Å; K181-K183 PolarHBondContact O-N 2.97Å; K181-A184 WeakPolarHBondContact O-CB 3.29Å; K181-A184 PolarHBondContact O-N 3.28Å; K181-A184 VanDerWaalsContact O-N 3.16Å; K181-F185 WeakPolarHBondContact O-CD2 3.38Å; K181-F185 PolarHBondContact O-N 3.4Å
182	A	93.7	Very high	93.5	Very high	44 Å²	44	107.5 Å²	107.5	36%	0.364	51%	0.508	S	S	.	.	H	α-helix	trans	-58.4	-45.8	177.2	0	0	0	0	0	111.2	L178 R179 E180 A184 F185 W186	L178-A182 WeakPolarHBondContact O-CB 3.38Å; L178-A182 PolarHBondContact O-N 3.15Å; R179-A182 PolarHBondContact O-N 3.12Å; E180-A182 VanDerWaalsContact C-N 3.34Å; E180-A182 PolarHBondContact O-N 2.9Å; A182-A184 VanDerWaalsContact C-N 3.32Å; A182-A184 PolarHBondContact O-N 2.8Å; A182-F185 PolarHBondContact O-N 2.83Å; A182-W186 PolarHBondContact O-N 3.39Å
183	K	94.9	Very high	93.5	Very high	127 Å²	127	105.3 Å²	105.3	55%	0.552	50%	0.5	S	S	*	.	H	α-helix	trans	-57.7	-42.9	174.9	-70.5	173.5	-175.4	171.2	0	112.3	R179 E180 K181 W186 A187	R179-K183 WeakPolarHBondContact O-CG 3.44Å; R179-K183 PolarHBondContact O-N 3.27Å; E180-K183 WeakPolarHBondContact O-CB 3.39Å; E180-K183 PolarHBondContact O-N 2.85Å; E180-K183 WeakPolarHBondContact OE1-CE 3.41Å; E180-K183 IonicContact OE1-NZ 3.33Å; E180-K183 PolarHBondContact OE1-NZ 2.78Å; E180-K183 IonicContact OE2-NZ 3.41Å; K181-K183 VanDerWaalsContact C-N 3.33Å; K181-K183 PolarHBondContact O-N 2.97Å; K183-W186 PolarHBondContact O-N 3.34Å; K183-A187 PolarHBondContact O-N 2.97Å
184	A	94.1	Very high	93.4	Very high	62 Å²	62	101.7 Å²	101.7	51%	0.512	49%	0.487	S	S	.	.	H	α-helix	trans	-62.7	-45.1	176.5	0	0	0	0	0	112.1	E180 K181 A182 W186 A187 L188	E180-A184 PolarHBondContact O-N 3.44Å; K181-A184 WeakPolarHBondContact O-CB 3.29Å; K181-A184 PolarHBondContact O-N 3.28Å; K181-A184 VanDerWaalsContact O-N 3.16Å; A182-A184 VanDerWaalsContact C-N 3.32Å; A182-A184 PolarHBondContact O-N 2.8Å; A184-W186 VanDerWaalsContact C-N 3.32Å; A184-W186 PolarHBondContact O-N 2.92Å; A184-A187 PolarHBondContact O-N 3.49Å; A184-L188 WeakPolarHBondContact O-CB 3.43Å; A184-L188 PolarHBondContact O-N 3.49Å
185	F	92.7	Very high	93.4	Very high	148 Å²	148	98.6 Å²	98.6	65%	0.649	47%	0.472	S	S	*	.	H	α-helix	trans	-59.8	-41.4	173.6	-82.2	-72.7	0	0	0	112.2	K181 A182 L188 R189	K181-F185 WeakPolarHBondContact O-CD2 3.38Å; K181-F185 PolarHBondContact O-N 3.4Å; A182-F185 PolarHBondContact O-N 2.83Å; F185-L188 PolarHBondContact O-N 2.95Å; F185-R189 WeakPolarHBondContact O-CB 3.25Å; F185-R189 PolarHBondContact O-N 2.98Å
186	W	95.1	Very high	93.3	Very high	149 Å²	149	97.2 Å²	97.2	56%	0.564	48%	0.476	S	S	*	.	H	α-helix	trans	-64.2	-41	175.5	-83.3	106.4	0	0	0	112.6	A182 K183 A184 R189 R190	A182-W186 PolarHBondContact O-N 3.39Å; K183-W186 PolarHBondContact O-N 3.34Å; A184-W186 VanDerWaalsContact C-N 3.32Å; A184-W186 PolarHBondContact O-N 2.92Å; W186-R189 VanDerWaalsContact CH2-NH1 3.29Å; W186-R189 VanDerWaalsContact CZ3-NH1 3.27Å; W186-R189 PolarHBondContact O-N 2.91Å; W186-R190 WeakPolarHBondContact O-CG 3.48Å; W186-R190 PolarHBondContact O-N 2.76Å; W186-R190 VanDerWaalsContact O-N 3.12Å
187	A	91.8	Very high	93.3	Very high	45 Å²	45	98.9 Å²	98.9	37%	0.372	48%	0.481	S	S	.	.	H	α-helix	trans	-64.2	-42.4	175.3	0	0	0	0	0	112	K183 A184 R190 T191	K183-A187 PolarHBondContact O-N 2.97Å; A184-A187 PolarHBondContact O-N 3.49Å; A187-R190 PolarHBondContact O-N 3.3Å; A187-T191 PolarHBondContact O-N 3.3Å; A187-T191 VanDerWaalsContact O-N 3.16Å; A187-T191 PolarHBondContact O-OG1 3.25Å; A187-T191 VanDerWaalsContact O-OG1 3.07Å
188	L	91.4	Very high	93.1	Very high	87 Å²	87	98.2 Å²	98.2	46%	0.455	47%	0.473	S	S	.	.	H	α-helix	trans	-64.3	-40	175.7	-175.1	60.1	0	0	0	111.9	A184 F185 R190 T191 Y192	A184-L188 WeakPolarHBondContact O-CB 3.43Å; A184-L188 PolarHBondContact O-N 3.49Å; F185-L188 PolarHBondContact O-N 2.95Å; L188-R190 PolarHBondContact O-N 3.28Å; L188-T191 VanDerWaalsContact C-OG1 3.29Å; L188-T191 VanDerWaalsContact CA-OG1 3.27Å; L188-T191 WeakPolarHBondContact CA-OG1 3.49Å; L188-T191 PolarHBondContact O-N 2.9Å; L188-T191 PolarHBondContact O-OG1 3.21Å; L188-Y192 HydrophobicContact CD1-CD2 4.06Å; L188-Y192 HydrophobicContact CD1-CE2 3.62Å; L188-Y192 HydrophobicContact CD2-CE2 4.24Å; L188-Y192 HydrophobicContact CG-CD2 3.98Å; L188-Y192 HydrophobicContact CG-CE2 3.72Å; L188-Y192 VanDerWaalsContact O-CD2 3.24Å; L188-Y192 WeakPolarHBondContact O-CD2 3.42Å; L188-Y192 PolarHBondContact O-N 3.01Å; L188-Y192 VanDerWaalsContact O-N 3.12Å
189	R	93.9	Very high	93.1	Very high	119 Å²	119	97.3 Å²	97.3	45%	0.449	47%	0.469	S	S	.	.	H	α-helix	trans	-63.1	-43.2	176.9	-158.9	-177.4	82.1	-168.6	8.1	112.1	F185 W186 T191 Y192 E193	F185-R189 WeakPolarHBondContact O-CB 3.25Å; F185-R189 PolarHBondContact O-N 2.98Å; W186-R189 VanDerWaalsContact CH2-NH1 3.29Å; W186-R189 VanDerWaalsContact CZ3-NH1 3.27Å; W186-R189 PolarHBondContact O-N 2.91Å; R189-T191 VanDerWaalsContact C-N 3.31Å; R189-T191 PolarHBondContact O-N 2.89Å; R189-Y192 PolarHBondContact O-N 2.88Å; R189-E193 IonicContact CZ-OE1 3.93Å; R189-E193 IonicContact NE-OE1 3.07Å; R189-E193 PolarHBondContact NE-OE1 3.1Å; R189-E193 IonicContact NH2-OE1 2.73Å; R189-E193 PolarHBondContact NH2-OE1 3.01Å; R189-E193 WeakPolarHBondContact O-CG 3.45Å; R189-E193 PolarHBondContact O-N 2.81Å
190	R	92.6	Very high	93.1	Very high	168 Å²	168	96.5 Å²	96.5	63%	0.634	47%	0.472	S	S	*	.	H	α-helix	trans	-62.4	-36.4	177	-73.3	-166.3	-57.7	158.5	3.1	112.9	W186 A187 L188 E193 A194	W186-R190 WeakPolarHBondContact O-CG 3.48Å; W186-R190 PolarHBondContact O-N 2.76Å; W186-R190 VanDerWaalsContact O-N 3.12Å; A187-R190 PolarHBondContact O-N 3.3Å; L188-R190 PolarHBondContact O-N 3.28Å; R190-E193 PolarHBondContact O-N 2.9Å; R190-A194 WeakPolarHBondContact O-CB 3.32Å; R190-A194 PolarHBondContact O-N 3.07Å
191	T	90.5	Very high	93	Very high	66 Å²	66	97 Å²	97	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-66.6	-43.8	175.9	32.9	0	0	0	0	111	A187 L188 R189 E193 A194 I195	A187-T191 PolarHBondContact O-N 3.3Å; A187-T191 VanDerWaalsContact O-N 3.16Å; A187-T191 PolarHBondContact O-OG1 3.25Å; A187-T191 VanDerWaalsContact O-OG1 3.07Å; L188-T191 VanDerWaalsContact C-OG1 3.29Å; L188-T191 VanDerWaalsContact CA-OG1 3.27Å; L188-T191 WeakPolarHBondContact CA-OG1 3.49Å; L188-T191 PolarHBondContact O-N 2.9Å; L188-T191 PolarHBondContact O-OG1 3.21Å; R189-T191 VanDerWaalsContact C-N 3.31Å; R189-T191 PolarHBondContact O-N 2.89Å; T191-E193 PolarHBondContact O-N 2.78Å; T191-A194 PolarHBondContact O-N 3.26Å; T191-I195 VanDerWaalsContact O-CG1 3.32Å; T191-I195 WeakPolarHBondContact O-CG1 3.38Å; T191-I195 PolarHBondContact O-N 2.91Å
192	Y	92.1	Very high	92.9	Very high	149 Å²	149	94.7 Å²	94.7	58%	0.584	47%	0.471	S	S	*	.	H	α-helix	trans	-61.9	-42	172.4	-79.9	-68.2	0	0	0	113.4	L188 R189 A194 I195 A196	L188-Y192 HydrophobicContact CD1-CD2 4.06Å; L188-Y192 HydrophobicContact CD1-CE2 3.62Å; L188-Y192 HydrophobicContact CD2-CE2 4.24Å; L188-Y192 HydrophobicContact CG-CD2 3.98Å; L188-Y192 HydrophobicContact CG-CE2 3.72Å; L188-Y192 VanDerWaalsContact O-CD2 3.24Å; L188-Y192 WeakPolarHBondContact O-CD2 3.42Å; L188-Y192 PolarHBondContact O-N 3.01Å; L188-Y192 VanDerWaalsContact O-N 3.12Å; R189-Y192 PolarHBondContact O-N 2.88Å; Y192-A194 VanDerWaalsContact C-N 3.31Å; Y192-A194 PolarHBondContact O-N 3.35Å; Y192-I195 PolarHBondContact O-N 2.91Å; Y192-A196 WeakPolarHBondContact O-CB 3.4Å; Y192-A196 PolarHBondContact O-N 2.95Å
193	E	93.8	Very high	93	Very high	98 Å²	98	95.9 Å²	95.9	46%	0.458	47%	0.474	S	S	.	.	H	α-helix	trans	-60.4	-40.8	174.9	-72.6	166.2	-169.9	0	0	111.3	R189 R190 T191 A196 K197	R189-E193 IonicContact CZ-OE1 3.93Å; R189-E193 IonicContact NE-OE1 3.07Å; R189-E193 PolarHBondContact NE-OE1 3.1Å; R189-E193 IonicContact NH2-OE1 2.73Å; R189-E193 PolarHBondContact NH2-OE1 3.01Å; R189-E193 WeakPolarHBondContact O-CG 3.45Å; R189-E193 PolarHBondContact O-N 2.81Å; R190-E193 PolarHBondContact O-N 2.9Å; T191-E193 PolarHBondContact O-N 2.78Å; E193-A196 PolarHBondContact O-N 3.18Å; E193-K197 PolarHBondContact O-N 3.46Å; E193-K197 VanDerWaalsContact O-N 3.11Å
194	A	91.4	Very high	93.1	Very high	38 Å²	38	94.4 Å²	94.4	31%	0.314	48%	0.476	S	S	.	.	H	α-helix	trans	-66.2	-43.9	176.3	0	0	0	0	0	112.4	R190 T191 Y192 K197 H198 V356	R190-A194 WeakPolarHBondContact O-CB 3.32Å; R190-A194 PolarHBondContact O-N 3.07Å; T191-A194 PolarHBondContact O-N 3.26Å; Y192-A194 VanDerWaalsContact C-N 3.31Å; Y192-A194 PolarHBondContact O-N 3.35Å; A194-K197 PolarHBondContact O-N 2.99Å; A194-H198 WeakPolarHBondContact O-CB 3.34Å; A194-H198 PolarHBondContact O-N 2.79Å; A194-V356 HydrophobicContact CB-CG2 4.11Å
195	I	92.1	Very high	93.1	Very high	55 Å²	55	95.9 Å²	95.9	28%	0.282	47%	0.468	S	S	.	.	H	α-helix	trans	-60	-46	174.9	-68.7	164.6	0	0	0	110.6	T191 Y192 K197 H198 N199 V356	T191-I195 VanDerWaalsContact O-CG1 3.32Å; T191-I195 WeakPolarHBondContact O-CG1 3.38Å; T191-I195 PolarHBondContact O-N 2.91Å; Y192-I195 PolarHBondContact O-N 2.91Å; I195-K197 VanDerWaalsContact C-N 3.35Å; I195-K197 PolarHBondContact O-N 3.38Å; I195-H198 PolarHBondContact O-N 3.11Å; I195-N199 WeakPolarHBondContact O-CB 3.46Å; I195-N199 VanDerWaalsContact O-CG 3.26Å; I195-N199 PolarHBondContact O-N 2.87Å; I195-N199 PolarHBondContact O-OD1 3.08Å; I195-V356 HydrophobicContact CB-CG1 4.33Å; I195-V356 HydrophobicContact CG1-CG1 3.47Å; I195-V356 VanDerWaalsContact CG1-CG1 3.47Å
196	A	94.1	Very high	93.2	Very high	59 Å²	59	92.8 Å²	92.8	49%	0.488	46%	0.458	S	S	.	.	H	α-helix	trans	-58.7	-47	178.9	0	0	0	0	0	111.6	Y192 E193 H198 N199 E200	Y192-A196 WeakPolarHBondContact O-CB 3.4Å; Y192-A196 PolarHBondContact O-N 2.95Å; E193-A196 PolarHBondContact O-N 3.18Å; A196-H198 PolarHBondContact O-N 3.41Å; A196-N199 PolarHBondContact O-N 2.8Å; A196-E200 PolarHBondContact O-N 3.31Å; A196-E200 VanDerWaalsContact O-N 3.09Å
197	K	93.3	Very high	93.4	Very high	147 Å²	147	90.1 Å²	90.1	64%	0.639	45%	0.452	S	S	*	.	H	α-helix	trans	-63.8	-40.9	177	-174.3	175.9	-178.4	178.8	0	112.4	E193 A194 I195 E200 V201	E193-K197 PolarHBondContact O-N 3.46Å; E193-K197 VanDerWaalsContact O-N 3.11Å; A194-K197 PolarHBondContact O-N 2.99Å; I195-K197 VanDerWaalsContact C-N 3.35Å; I195-K197 PolarHBondContact O-N 3.38Å; K197-E200 PolarHBondContact O-N 3.42Å; K197-V201 WeakPolarHBondContact O-CG2 3.47Å; K197-V201 PolarHBondContact O-N 2.92Å
198	H	91.4	Very high	93.6	Very high	51 Å²	51	89.6 Å²	89.6	24%	0.236	45%	0.45	C	S	.	.	H	α-helix	trans	-62.6	-44.5	176.2	174.8	83.8	0	0	0	111.7	A194 I195 A196 E200 V201 Q202 V356	A194-H198 WeakPolarHBondContact O-CB 3.34Å; A194-H198 PolarHBondContact O-N 2.79Å; I195-H198 PolarHBondContact O-N 3.11Å; A196-H198 PolarHBondContact O-N 3.41Å; H198-E200 VanDerWaalsContact C-N 3.3Å; H198-E200 PolarHBondContact O-N 3.43Å; H198-V201 PolarHBondContact O-N 3.48Å; H198-Q202 VanDerWaalsContact NE2-CG 3.34Å; H198-Q202 WeakPolarHBondContact NE2-CG 3.47Å; H198-Q202 WeakPolarHBondContact O-CB 3.48Å; H198-Q202 WeakPolarHBondContact O-CG 3.47Å; H198-Q202 PolarHBondContact O-N 2.91Å; H198-V356 HydrophobicContact CB-CB 4.31Å; H198-V356 HydrophobicContact CB-CG2 3.58Å
199	N	93.1	Very high	93.8	Very high	83 Å²	83	88.1 Å²	88.1	44%	0.444	44%	0.439	S	S	.	.	H	α-helix	trans	-61.8	-37.7	177.9	-71.4	-6.7	0	0	0	112.1	I195 A196 T203	I195-N199 WeakPolarHBondContact O-CB 3.46Å; I195-N199 VanDerWaalsContact O-CG 3.26Å; I195-N199 PolarHBondContact O-N 2.87Å; I195-N199 PolarHBondContact O-OD1 3.08Å; A196-N199 PolarHBondContact O-N 2.8Å; N199-T203 VanDerWaalsContact O-CB 3.28Å; N199-T203 WeakPolarHBondContact O-CB 3.18Å; N199-T203 PolarHBondContact O-N 2.9Å; N199-T203 PolarHBondContact O-OG1 3.15Å
200	E	95.4	Very high	93.9	Very high	135 Å²	135	87.2 Å²	87.2	63%	0.631	44%	0.442	S	S	*	.	H	α-helix	trans	-62.4	-47.5	175.4	-173.8	-178	-176.1	0	0	111.9	A196 K197 H198 T203 T204	A196-E200 PolarHBondContact O-N 3.31Å; A196-E200 VanDerWaalsContact O-N 3.09Å; K197-E200 PolarHBondContact O-N 3.42Å; H198-E200 VanDerWaalsContact C-N 3.3Å; H198-E200 PolarHBondContact O-N 3.43Å; E200-T203 PolarHBondContact O-N 2.97Å; E200-T204 PolarHBondContact O-N 3.49Å; E200-T204 PolarHBondContact O-OG1 3.38Å; E200-T204 VanDerWaalsContact O-OG1 3.08Å
201	V	92.4	Very high	94.2	Very high	88 Å²	88	85.8 Å²	85.8	53%	0.533	44%	0.436	S	S	.	.	H	α-helix	trans	-64.9	-46.1	177.5	175	0	0	0	0	111	K197 H198 T203 T204 W205	K197-V201 WeakPolarHBondContact O-CG2 3.47Å; K197-V201 PolarHBondContact O-N 2.92Å; H198-V201 PolarHBondContact O-N 3.48Å; V201-T203 PolarHBondContact O-N 3.27Å; V201-T204 PolarHBondContact O-N 3.01Å; V201-W205 WeakPolarHBondContact O-CB 3.46Å; V201-W205 PolarHBondContact O-N 3.06Å
202	Q	91.8	Very high	94.4	Very high	70 Å²	70	88.4 Å²	88.4	33%	0.327	44%	0.44	S	S	.	.	H	α-helix	trans	-61.6	-41.7	177.8	-80.8	-65.8	-49.2	0	0	112	H198 T204 W205 L206	H198-Q202 VanDerWaalsContact NE2-CG 3.34Å; H198-Q202 WeakPolarHBondContact NE2-CG 3.47Å; H198-Q202 WeakPolarHBondContact O-CB 3.48Å; H198-Q202 WeakPolarHBondContact O-CG 3.47Å; H198-Q202 PolarHBondContact O-N 2.91Å; Q202-T204 PolarHBondContact O-N 3.38Å; Q202-W205 PolarHBondContact O-N 3.43Å; Q202-L206 VanDerWaalsContact O-CB 3.31Å; Q202-L206 WeakPolarHBondContact O-CB 3.26Å; Q202-L206 VanDerWaalsContact O-CG 3.28Å; Q202-L206 WeakPolarHBondContact O-CG 3.46Å; Q202-L206 PolarHBondContact O-N 2.89Å
203	T	96.1	Very high	94.5	Very high	70 Å²	70	84.5 Å²	84.5	43%	0.429	43%	0.427	S	S	.	.	H	α-helix	trans	-59.3	-49.6	177.4	-60.7	0	0	0	0	110.6	N199 E200 V201 W205 L206 E207	N199-T203 VanDerWaalsContact O-CB 3.28Å; N199-T203 WeakPolarHBondContact O-CB 3.18Å; N199-T203 PolarHBondContact O-N 2.9Å; N199-T203 PolarHBondContact O-OG1 3.15Å; E200-T203 PolarHBondContact O-N 2.97Å; V201-T203 PolarHBondContact O-N 3.27Å; T203-W205 VanDerWaalsContact C-N 3.32Å; T203-W205 PolarHBondContact O-N 3.44Å; T203-L206 PolarHBondContact O-N 3.44Å; T203-E207 WeakPolarHBondContact O-CG 3.35Å; T203-E207 PolarHBondContact O-N 3.4Å
204	T	96.6	Very high	94.6	Very high	95 Å²	95	85.8 Å²	85.8	58%	0.583	43%	0.431	S	S	*	.	H	α-helix	trans	-60.7	-42.5	178.7	-55	0	0	0	0	111.6	E200 V201 Q202 G208	E200-T204 PolarHBondContact O-N 3.49Å; E200-T204 PolarHBondContact O-OG1 3.38Å; E200-T204 VanDerWaalsContact O-OG1 3.08Å; V201-T204 PolarHBondContact O-N 3.01Å; Q202-T204 PolarHBondContact O-N 3.38Å; T204-G208 PolarHBondContact O-N 2.97Å; T204-G208 VanDerWaalsContact O-N 3.14Å
205	W	94	Very high	94.9	Very high	94 Å²	94	86.7 Å²	86.7	36%	0.356	43%	0.431	S	S	.	.	H	α-helix	trans	-65.1	-46.4	177	177.1	85.9	0	0	0	112.1	V201 Q202 T203 E207 G208 R209 D342	V201-W205 WeakPolarHBondContact O-CB 3.46Å; V201-W205 PolarHBondContact O-N 3.06Å; Q202-W205 PolarHBondContact O-N 3.43Å; T203-W205 VanDerWaalsContact C-N 3.32Å; T203-W205 PolarHBondContact O-N 3.44Å; W205-E207 PolarHBondContact O-N 2.87Å; W205-G208 PolarHBondContact O-N 3.25Å; W205-R209 PolarHBondContact O-N 2.88Å; W205-D342 HydrophobicContact CZ2-CB 4.02Å
206	L	95.4	Very high	95	Very high	83 Å²	83	88.2 Å²	88.2	44%	0.435	44%	0.435	S	S	.	.	H	α-helix	trans	-60	-45.9	177.6	-78.5	171.3	0	0	0	111.5	Q202 T203 G208 R209 I210	Q202-L206 VanDerWaalsContact O-CB 3.31Å; Q202-L206 WeakPolarHBondContact O-CB 3.26Å; Q202-L206 VanDerWaalsContact O-CG 3.28Å; Q202-L206 WeakPolarHBondContact O-CG 3.46Å; Q202-L206 PolarHBondContact O-N 2.89Å; T203-L206 PolarHBondContact O-N 3.44Å; L206-G208 VanDerWaalsContact C-N 3.31Å; L206-G208 PolarHBondContact O-N 2.96Å; L206-R209 PolarHBondContact O-N 2.88Å; L206-I210 VanDerWaalsContact O-CG1 3.28Å; L206-I210 WeakPolarHBondContact O-CG1 3.42Å; L206-I210 PolarHBondContact O-N 3.43Å
207	E	97.6	Very high	95	Very high	93 Å²	93	88.7 Å²	88.7	44%	0.435	43%	0.429	S	S	.	.	H	α-helix	trans	-58.8	-44.3	175.9	-74.5	-176.7	-176.2	0	0	111.9	T203 W205 R209 R211	T203-E207 WeakPolarHBondContact O-CG 3.35Å; T203-E207 PolarHBondContact O-N 3.4Å; W205-E207 PolarHBondContact O-N 2.87Å; E207-R209 VanDerWaalsContact C-N 3.33Å; E207-R211 WeakPolarHBondContact O-CB 3.42Å; E207-R211 VanDerWaalsContact O-CG 3.27Å; E207-R211 WeakPolarHBondContact O-CG 3.4Å; E207-R211 PolarHBondContact O-N 2.97Å; E207-R211 PolarHBondContact O-NE 3.36Å; E207-R211 IonicContact OE2-NH2 3.44Å; E207-R211 PolarHBondContact OE2-NH2 2.98Å
208	G	97.4	Very high	95.2	Very high	33 Å²	33	86.5 Å²	86.5	34%	0.34	42%	0.417	S	S	.	.	H	α-helix	trans	-60.9	-43	175.8	0	0	0	0	0	112	T204 W205 L206 R211 Y212	T204-G208 PolarHBondContact O-N 2.97Å; T204-G208 VanDerWaalsContact O-N 3.14Å; W205-G208 PolarHBondContact O-N 3.25Å; L206-G208 VanDerWaalsContact C-N 3.31Å; L206-G208 PolarHBondContact O-N 2.96Å; G208-R211 PolarHBondContact O-N 2.75Å; G208-Y212 WeakPolarHBondContact O-CB 3.36Å; G208-Y212 PolarHBondContact O-N 2.99Å
209	R	95.3	Very high	95.4	Very high	57 Å²	57	87.7 Å²	87.7	22%	0.215	43%	0.425	C	S	.	.	H	α-helix	trans	-68	-43.2	-179.9	-169.9	66.9	-167.2	-165.9	2.6	112.5	W205 L206 E207 R211 Y212 E213 D342	W205-R209 PolarHBondContact O-N 2.88Å; L206-R209 PolarHBondContact O-N 2.88Å; E207-R209 VanDerWaalsContact C-N 3.33Å; R209-R211 VanDerWaalsContact C-N 3.35Å; R209-R211 PolarHBondContact O-N 2.83Å; R209-Y212 WeakPolarHBondContact O-CB 3.3Å; R209-Y212 PolarHBondContact O-N 3.3Å; R209-E213 IonicContact CZ-OE1 3.18Å; R209-E213 VanDerWaalsContact CZ-OE1 3.26Å; R209-E213 IonicContact NE-OE1 2.93Å; R209-E213 PolarHBondContact NE-OE1 3.18Å; R209-E213 IonicContact NH2-OE1 3.14Å; R209-E213 PolarHBondContact NH2-OE1 2.79Å; R209-E213 PolarHBondContact O-N 3.25Å; R209-D342 IonicContact NH1-OD2 3.67Å
210	I	96	Very high	95.6	Very high	99 Å²	99	85.6 Å²	85.6	51%	0.508	41%	0.412	S	S	.	.	H	α-helix	trans	-58.3	-49.8	174.4	-69.2	166.1	0	0	0	109.5	L206 Y212 E213 F214	L206-I210 VanDerWaalsContact O-CG1 3.28Å; L206-I210 WeakPolarHBondContact O-CG1 3.42Å; L206-I210 PolarHBondContact O-N 3.43Å; I210-Y212 VanDerWaalsContact C-N 3.3Å; I210-Y212 PolarHBondContact O-N 3.34Å; I210-E213 PolarHBondContact O-N 3.08Å; I210-F214 HydrophobicContact CG2-CD2 3.94Å; I210-F214 HydrophobicContact CG2-CE2 4Å; I210-F214 VanDerWaalsContact O-CD2 3.31Å; I210-F214 WeakPolarHBondContact O-CD2 3.32Å; I210-F214 PolarHBondContact O-N 3.15Å
211	R	97.9	Very high	95.7	Very high	139 Å²	139	83 Å²	83	53%	0.525	40%	0.402	S	S	.	.	H	α-helix	trans	-56.8	-45.3	177.7	-72.8	177.8	-124.2	162	-3.6	111.8	E207 G208 R209 F214 D215 R218	E207-R211 WeakPolarHBondContact O-CB 3.42Å; E207-R211 VanDerWaalsContact O-CG 3.27Å; E207-R211 WeakPolarHBondContact O-CG 3.4Å; E207-R211 PolarHBondContact O-N 2.97Å; E207-R211 PolarHBondContact O-NE 3.36Å; E207-R211 IonicContact OE2-NH2 3.44Å; E207-R211 PolarHBondContact OE2-NH2 2.98Å; G208-R211 PolarHBondContact O-N 2.75Å; R209-R211 VanDerWaalsContact C-N 3.35Å; R209-R211 PolarHBondContact O-N 2.83Å; R211-F214 CarbonylContact O-C 3.51Å; R211-F214 PolarHBondContact O-N 2.93Å; R211-D215 PolarHBondContact O-N 3.04Å; R211-D215 VanDerWaalsContact O-OD2 3.14Å; R211-R218 PolarHBondContact O-NH2 2.78Å
212	Y	95.8	Very high	95.9	Very high	121 Å²	121	84.6 Å²	84.6	48%	0.475	40%	0.399	S	S	.	.	H	α-helix	trans	-59.1	-46.6	178.6	176.5	-107.2	0	0	0	113.1	G208 R209 I210 F214 D215 K216	G208-Y212 WeakPolarHBondContact O-CB 3.36Å; G208-Y212 PolarHBondContact O-N 2.99Å; R209-Y212 WeakPolarHBondContact O-CB 3.3Å; R209-Y212 PolarHBondContact O-N 3.3Å; I210-Y212 VanDerWaalsContact C-N 3.3Å; I210-Y212 PolarHBondContact O-N 3.34Å; Y212-F214 VanDerWaalsContact C-N 3.34Å; Y212-F214 PolarHBondContact O-N 2.95Å; Y212-D215 PolarHBondContact O-N 3.09Å; Y212-K216 HydrophobicContact CE1-CD 4.43Å; Y212-K216 VanDerWaalsContact CZ-CE 3.4Å; Y212-K216 PolarHBondContact O-N 3.37Å; Y212-K216 VanDerWaalsContact O-N 3.13Å; Y212-K216 WeakPolarHBondContact OH-CE 3.45Å
213	E	93.9	Very high	96.2	Very high	66 Å²	66	85.5 Å²	85.5	31%	0.308	41%	0.409	S	S	.	.	H	α-helix	trans	-64.8	-37.9	176.7	-63.6	-57.3	157.8	0	0	111.8	R209 I210 K216 L217	R209-E213 IonicContact CZ-OE1 3.18Å; R209-E213 VanDerWaalsContact CZ-OE1 3.26Å; R209-E213 IonicContact NE-OE1 2.93Å; R209-E213 PolarHBondContact NE-OE1 3.18Å; R209-E213 IonicContact NH2-OE1 3.14Å; R209-E213 PolarHBondContact NH2-OE1 2.79Å; R209-E213 PolarHBondContact O-N 3.25Å; I210-E213 PolarHBondContact O-N 3.08Å; E213-K216 VanDerWaalsContact CD-NZ 3.34Å; E213-K216 PolarHBondContact O-N 3.44Å; E213-K216 IonicContact OE1-NZ 2.67Å; E213-K216 PolarHBondContact OE1-NZ 3.15Å; E213-K216 VanDerWaalsContact OE1-NZ 3.14Å; E213-K216 WeakPolarHBondContact OE2-CD 3.45Å; E213-K216 WeakPolarHBondContact OE2-CE 3.17Å; E213-K216 IonicContact OE2-NZ 2.65Å; E213-K216 PolarHBondContact OE2-NZ 2.9Å; E213-L217 PolarHBondContact O-N 3.27Å
214	F	95.9	Very high	96.2	Very high	125 Å²	125	83.7 Å²	83.7	55%	0.548	40%	0.395	S	S	.	.	H	α-helix	trans	-68.8	-31.3	173.3	-87.8	-96.7	0	0	0	113.3	I210 R211 Y212 R218	I210-F214 HydrophobicContact CG2-CD2 3.94Å; I210-F214 HydrophobicContact CG2-CE2 4Å; I210-F214 VanDerWaalsContact O-CD2 3.31Å; I210-F214 WeakPolarHBondContact O-CD2 3.32Å; I210-F214 PolarHBondContact O-N 3.15Å; R211-F214 CarbonylContact O-C 3.51Å; R211-F214 PolarHBondContact O-N 2.93Å; Y212-F214 VanDerWaalsContact C-N 3.34Å; Y212-F214 PolarHBondContact O-N 2.95Å; F214-R218 WeakPolarHBondContact O-CG 3.22Å; F214-R218 PolarHBondContact O-N 2.96Å; F214-R218 VanDerWaalsContact O-N 3.08Å; F214-R218 PolarHBondContact O-NE 3.01Å
215	D	96.7	Very high	96.2	Very high	57 Å²	57	85.1 Å²	85.1	31%	0.305	40%	0.395	S	S	.	.	H	α-helix	trans	-65	-42.1	174	-83.1	-47.5	0	0	0	111	R211 Y212 L217 R218 D219	R211-D215 PolarHBondContact O-N 3.04Å; R211-D215 VanDerWaalsContact O-OD2 3.14Å; Y212-D215 PolarHBondContact O-N 3.09Å; D215-L217 VanDerWaalsContact C-N 3.3Å; D215-L217 PolarHBondContact O-N 3.21Å; D215-R218 PolarHBondContact O-N 3.08Å; D215-R218 VanDerWaalsContact O-N 3.12Å; D215-R218 IonicContact OD1-CZ 2.81Å; D215-R218 IonicContact OD1-NE 2.7Å; D215-R218 PolarHBondContact OD1-NE 3.47Å; D215-R218 IonicContact OD1-NH1 3.63Å; D215-R218 PolarHBondContact OD1-NH1 3.35Å; D215-R218 IonicContact OD1-NH2 2.96Å; D215-R218 PolarHBondContact OD1-NH2 3.32Å; D215-R218 IonicContact OD2-NH2 3.75Å; D215-R218 PolarHBondContact OD2-NH2 3.38Å; D215-D219 WeakPolarHBondContact O-CB 3.49Å; D215-D219 PolarHBondContact O-N 2.79Å
216	K	94.1	Very high	96.4	Very high	88 Å²	88	87 Å²	87	38%	0.383	41%	0.408	S	S	.	.	H	α-helix	trans	-55	-45.1	174.7	-67.6	-178.4	-170.3	161.4	0	112.5	Y212 E213 D219 F220	Y212-K216 HydrophobicContact CE1-CD 4.43Å; Y212-K216 VanDerWaalsContact CZ-CE 3.4Å; Y212-K216 PolarHBondContact O-N 3.37Å; Y212-K216 VanDerWaalsContact O-N 3.13Å; Y212-K216 WeakPolarHBondContact OH-CE 3.45Å; E213-K216 VanDerWaalsContact CD-NZ 3.34Å; E213-K216 PolarHBondContact O-N 3.44Å; E213-K216 IonicContact OE1-NZ 2.67Å; E213-K216 PolarHBondContact OE1-NZ 3.15Å; E213-K216 VanDerWaalsContact OE1-NZ 3.14Å; E213-K216 WeakPolarHBondContact OE2-CD 3.45Å; E213-K216 WeakPolarHBondContact OE2-CE 3.17Å; E213-K216 IonicContact OE2-NZ 2.65Å; E213-K216 PolarHBondContact OE2-NZ 2.9Å; K216-D219 PolarHBondContact O-N 3.31Å; K216-F220 PolarHBondContact O-N 2.66Å
217	L	95.4	Very high	96.5	Very high	68 Å²	68	85.8 Å²	85.8	36%	0.356	41%	0.41	S	S	.	.	H	α-helix	trans	-66.6	-41.4	178.4	-60.8	-179.5	0	0	0	111.7	E213 D215 F220 L221 M318 V322	E213-L217 PolarHBondContact O-N 3.27Å; D215-L217 VanDerWaalsContact C-N 3.3Å; D215-L217 PolarHBondContact O-N 3.21Å; L217-F220 PolarHBondContact O-N 2.71Å; L217-L221 WeakPolarHBondContact O-CG 3.16Å; L217-L221 PolarHBondContact O-N 3.24Å; L217-L221 VanDerWaalsContact O-N 3.08Å; L217-M318 HydrophobicContact CD2-CG 4.36Å; L217-M318 HydrophobicContact CD2-SD 4.15Å; L217-V322 HydrophobicContact CD2-CG2 3.98Å
218	R	96.6	Very high	96.4	Very high	102 Å²	102	83 Å²	83	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-63.7	-41.4	175.9	-77.5	175.1	-73.8	169.3	-2.7	111.9	R211 F214 D215 L221 R222	R211-R218 PolarHBondContact O-NH2 2.78Å; F214-R218 WeakPolarHBondContact O-CG 3.22Å; F214-R218 PolarHBondContact O-N 2.96Å; F214-R218 VanDerWaalsContact O-N 3.08Å; F214-R218 PolarHBondContact O-NE 3.01Å; D215-R218 PolarHBondContact O-N 3.08Å; D215-R218 VanDerWaalsContact O-N 3.12Å; D215-R218 IonicContact OD1-CZ 2.81Å; D215-R218 IonicContact OD1-NE 2.7Å; D215-R218 PolarHBondContact OD1-NE 3.47Å; D215-R218 IonicContact OD1-NH1 3.63Å; D215-R218 PolarHBondContact OD1-NH1 3.35Å; D215-R218 IonicContact OD1-NH2 2.96Å; D215-R218 PolarHBondContact OD1-NH2 3.32Å; D215-R218 IonicContact OD2-NH2 3.75Å; D215-R218 PolarHBondContact OD2-NH2 3.38Å; R218-L221 PolarHBondContact O-N 3.4Å; R218-R222 WeakPolarHBondContact O-CG 3.46Å; R218-R222 PolarHBondContact O-N 3.08Å
219	D	96.4	Very high	96.4	Very high	76 Å²	76	85.6 Å²	85.6	41%	0.406	41%	0.405	S	S	.	.	H	α-helix	trans	-66	-41.7	177.8	-73.5	-19.7	0	0	0	111.6	D215 K216 L221 R222 V223	D215-D219 WeakPolarHBondContact O-CB 3.49Å; D215-D219 PolarHBondContact O-N 2.79Å; K216-D219 PolarHBondContact O-N 3.31Å; D219-L221 VanDerWaalsContact C-N 3.33Å; D219-L221 PolarHBondContact O-N 3.21Å; D219-R222 PolarHBondContact O-N 3.12Å; D219-R222 IonicContact OD1-CZ 3.75Å; D219-R222 IonicContact OD1-NH1 3.75Å; D219-R222 PolarHBondContact OD1-NH1 3.17Å; D219-V223 WeakPolarHBondContact O-CG2 3.35Å; D219-V223 PolarHBondContact O-N 2.89Å
220	F	96.8	Very high	96.5	Very high	38 Å²	38	84.7 Å²	84.7	17%	0.167	41%	0.413	C	S	.	.	H	α-helix	trans	-54.5	-49.6	171.4	176.5	-87.5	0	0	0	111.6	K216 L217 R222 V223 E224 V314 K317 M318	K216-F220 PolarHBondContact O-N 2.66Å; L217-F220 PolarHBondContact O-N 2.71Å; F220-R222 PolarHBondContact O-N 3Å; F220-V223 PolarHBondContact O-N 2.88Å; F220-E224 HydrophobicContact CD1-CG 4.32Å; F220-E224 HydrophobicContact CE1-CG 3.7Å; F220-E224 HydrophobicContact CE2-CG 4.22Å; F220-E224 HydrophobicContact CZ-CG 3.64Å; F220-E224 PolarHBondContact O-N 2.72Å; F220-V314 HydrophobicContact CE1-CG1 4.22Å; F220-K317 HydrophobicContact CZ-CB 3.9Å; F220-M318 HydrophobicContact CD1-CB 3.91Å; F220-M318 HydrophobicContact CD1-CG 3.77Å; F220-M318 HydrophobicContact CD1-SD 4.26Å; F220-M318 HydrophobicContact CE1-CB 3.45Å; F220-M318 VanDerWaalsContact CE1-CB 3.45Å; F220-M318 HydrophobicContact CE1-CG 3.88Å; F220-M318 HydrophobicContact CG-CG 4.37Å; F220-M318 VanDerWaalsContact CZ-CA 3.47Å; F220-M318 HydrophobicContact CZ-CB 3.91Å
221	L	96.8	Very high	96.6	Very high	82 Å²	82	82.5 Å²	82.5	43%	0.429	41%	0.41	S	S	.	.	H	α-helix	trans	-62.3	-41.3	179.7	-68.9	172.7	0	0	0	112.3	L217 R218 D219 V223 E224 E225 V314	L217-L221 WeakPolarHBondContact O-CG 3.16Å; L217-L221 PolarHBondContact O-N 3.24Å; L217-L221 VanDerWaalsContact O-N 3.08Å; R218-L221 PolarHBondContact O-N 3.4Å; D219-L221 VanDerWaalsContact C-N 3.33Å; D219-L221 PolarHBondContact O-N 3.21Å; L221-V223 VanDerWaalsContact C-N 3.35Å; L221-V223 PolarHBondContact O-N 3.14Å; L221-E224 PolarHBondContact O-N 3.02Å; L221-E225 WeakPolarHBondContact O-CB 3.39Å; L221-E225 PolarHBondContact O-N 2.73Å; L221-V314 HydrophobicContact CD2-CG1 3.67Å
222	R	97.7	Very high	96.5	Very high	121 Å²	121	79.4 Å²	79.4	46%	0.457	40%	0.402	S	S	.	.	H	α-helix	trans	-61	-43.7	175.7	-72.6	170.9	-174.2	151	-1.8	111.6	R218 D219 F220 Q226	R218-R222 WeakPolarHBondContact O-CG 3.46Å; R218-R222 PolarHBondContact O-N 3.08Å; D219-R222 PolarHBondContact O-N 3.12Å; D219-R222 IonicContact OD1-CZ 3.75Å; D219-R222 IonicContact OD1-NH1 3.75Å; D219-R222 PolarHBondContact OD1-NH1 3.17Å; F220-R222 PolarHBondContact O-N 3Å; R222-Q226 WeakPolarHBondContact O-CB 3.43Å; R222-Q226 VanDerWaalsContact O-CG 3.25Å; R222-Q226 WeakPolarHBondContact O-CG 3.36Å; R222-Q226 PolarHBondContact O-N 3.18Å
223	V	97	Very high	96.6	Very high	89 Å²	89	80.5 Å²	80.5	54%	0.539	41%	0.41	S	S	.	.	H	α-helix	trans	-65.1	-45.9	179.4	171.2	0	0	0	0	110.8	D219 F220 L221 Q226 A227	D219-V223 WeakPolarHBondContact O-CG2 3.35Å; D219-V223 PolarHBondContact O-N 2.89Å; F220-V223 PolarHBondContact O-N 2.88Å; L221-V223 VanDerWaalsContact C-N 3.35Å; L221-V223 PolarHBondContact O-N 3.14Å; V223-Q226 PolarHBondContact O-N 2.72Å; V223-A227 WeakPolarHBondContact O-CB 3.44Å; V223-A227 PolarHBondContact O-N 3.14Å
224	E	96.6	Very high	96.8	Very high	32 Å²	32	80.8 Å²	80.8	15%	0.15	41%	0.411	C	S	.	.	H	α-helix	trans	-65.7	-38.1	178	-78.2	-68.1	139.4	0	0	112.8	F220 L221 A227 T228 V314 K317	F220-E224 HydrophobicContact CD1-CG 4.32Å; F220-E224 HydrophobicContact CE1-CG 3.7Å; F220-E224 HydrophobicContact CE2-CG 4.22Å; F220-E224 HydrophobicContact CZ-CG 3.64Å; F220-E224 PolarHBondContact O-N 2.72Å; L221-E224 PolarHBondContact O-N 3.02Å; E224-A227 PolarHBondContact O-N 2.88Å; E224-T228 WeakPolarHBondContact O-CB 3.18Å; E224-T228 PolarHBondContact O-N 3.3Å; E224-T228 PolarHBondContact O-OG1 3.44Å; E224-V314 HydrophobicContact CB-CG1 4.39Å; E224-K317 IonicContact OE1-NZ 2.99Å; E224-K317 PolarHBondContact OE1-NZ 2.92Å; E224-K317 WeakPolarHBondContact OE2-CD 3.32Å; E224-K317 IonicContact OE2-NZ 3.8Å; E224-K317 PolarHBondContact OE2-NZ 3.23Å
225	E	97.4	Very high	96.8	Very high	124 Å²	124	75.9 Å²	75.9	58%	0.579	39%	0.39	S	S	*	.	H	α-helix	trans	-60.8	-50.5	173.4	179.3	-178.6	-148.8	0	0	110.9	L221 A227 T228 L229	L221-E225 WeakPolarHBondContact O-CB 3.39Å; L221-E225 PolarHBondContact O-N 2.73Å; E225-A227 PolarHBondContact O-N 2.8Å; E225-T228 PolarHBondContact O-N 3.41Å; E225-L229 HydrophobicContact CG-CD1 3.99Å; E225-L229 WeakPolarHBondContact O-CB 3.32Å; E225-L229 WeakPolarHBondContact O-CG 3.25Å; E225-L229 PolarHBondContact O-N 2.78Å
226	Q	98.1	Very high	96.8	Very high	135 Å²	135	75.7 Å²	75.7	63%	0.631	39%	0.392	S	S	*	.	H	α-helix	trans	-62.2	-41.6	179.2	-72.9	175.3	15.3	0	0	112.1	R222 V223 G230	R222-Q226 WeakPolarHBondContact O-CB 3.43Å; R222-Q226 VanDerWaalsContact O-CG 3.25Å; R222-Q226 WeakPolarHBondContact O-CG 3.36Å; R222-Q226 PolarHBondContact O-N 3.18Å; V223-Q226 PolarHBondContact O-N 2.72Å; Q226-G230 PolarHBondContact O-N 2.79Å
227	A	96.8	Very high	97	Very high	57 Å²	57	77.4 Å²	77.4	47%	0.471	40%	0.396	S	S	.	.	H	α-helix	trans	-62.3	-44.1	176.6	0	0	0	0	0	111.6	V223 E224 E225 G230 A231	V223-A227 WeakPolarHBondContact O-CB 3.44Å; V223-A227 PolarHBondContact O-N 3.14Å; E224-A227 PolarHBondContact O-N 2.88Å; E225-A227 PolarHBondContact O-N 2.8Å; A227-G230 PolarHBondContact O-N 2.92Å; A227-A231 WeakPolarHBondContact O-CB 3.26Å; A227-A231 PolarHBondContact O-N 3.45Å
228	T	96.1	Very high	97	Very high	35 Å²	35	80.1 Å²	80.1	22%	0.215	41%	0.405	C	S	.	.	H	α-helix	trans	-65.2	-47	179	-57.2	0	0	0	0	111.4	E224 E225 G230 A231 M232 Y306 L310	E224-T228 WeakPolarHBondContact O-CB 3.18Å; E224-T228 PolarHBondContact O-N 3.3Å; E224-T228 PolarHBondContact O-OG1 3.44Å; E225-T228 PolarHBondContact O-N 3.41Å; T228-G230 PolarHBondContact O-N 3.05Å; T228-A231 PolarHBondContact O-N 3.13Å; T228-M232 PolarHBondContact O-N 3.03Å; T228-M232 VanDerWaalsContact O-N 3.09Å; T228-Y306 HydrophobicContact CG2-CD1 4.28Å; T228-L310 HydrophobicContact CG2-CD1 4.49Å
229	L	97.6	Very high	96.9	Very high	87 Å²	87	77.1 Å²	77.1	46%	0.455	40%	0.395	S	S	.	.	H	α-helix	trans	-64.1	-39	176	-71.3	174.8	0	0	0	112.2	E225 M232 K233	E225-L229 HydrophobicContact CG-CD1 3.99Å; E225-L229 WeakPolarHBondContact O-CB 3.32Å; E225-L229 WeakPolarHBondContact O-CG 3.25Å; E225-L229 PolarHBondContact O-N 2.78Å; L229-M232 PolarHBondContact O-N 3.16Å; L229-K233 WeakPolarHBondContact O-CG 3.41Å; L229-K233 PolarHBondContact O-N 2.81Å
230	G	97.8	Very high	96.9	Very high	37 Å²	37	79.5 Å²	79.5	38%	0.381	40%	0.404	S	S	.	.	H	α-helix	trans	-61.2	-46.4	175.9	0	0	0	0	0	112.1	Q226 A227 T228 M232 K233 E234	Q226-G230 PolarHBondContact O-N 2.79Å; A227-G230 PolarHBondContact O-N 2.92Å; T228-G230 PolarHBondContact O-N 3.05Å; G230-M232 VanDerWaalsContact C-N 3.32Å; G230-M232 PolarHBondContact O-N 2.67Å; G230-K233 PolarHBondContact O-N 3.49Å; G230-E234 PolarHBondContact O-N 2.93Å
231	A	96.6	Very high	96.9	Very high	53 Å²	53	81.8 Å²	81.8	44%	0.438	42%	0.417	S	S	.	.	H	α-helix	trans	-63.1	-36.6	176.4	0	0	0	0	0	112.8	A227 T228 E235 Y306	A227-A231 WeakPolarHBondContact O-CB 3.26Å; A227-A231 PolarHBondContact O-N 3.45Å; T228-A231 PolarHBondContact O-N 3.13Å; A231-E235 PolarHBondContact O-N 2.81Å; A231-Y306 HydrophobicContact CB-CE1 4.23Å; A231-Y306 PolarHBondContact O-OH 3.27Å; A231-Y306 VanDerWaalsContact O-OH 3.08Å
232	M	97.5	Very high	96.8	Very high	75 Å²	75	82 Å²	82	37%	0.369	42%	0.419	S	S	.	.	H	α-helix	trans	-66	-47.5	174.8	-176.6	-76.8	-171	0	0	111.7	T228 L229 G230 E234 E235 S236 M301 Y306	T228-M232 PolarHBondContact O-N 3.03Å; T228-M232 VanDerWaalsContact O-N 3.09Å; L229-M232 PolarHBondContact O-N 3.16Å; G230-M232 VanDerWaalsContact C-N 3.32Å; G230-M232 PolarHBondContact O-N 2.67Å; M232-E234 VanDerWaalsContact C-N 3.32Å; M232-E234 PolarHBondContact O-N 3.16Å; M232-E235 PolarHBondContact O-N 3.11Å; M232-S236 PolarHBondContact O-N 3.45Å; M232-M301 HydrophobicContact CE-CE 3.92Å; M232-M301 HydrophobicContact CG-CE 3.75Å; M232-M301 HydrophobicContact SD-CE 3.99Å; M232-Y306 WeakPolarHBondContact CA-OH 3.36Å; M232-Y306 HydrophobicContact CB-CD1 4.07Å; M232-Y306 HydrophobicContact CB-CE1 3.79Å; M232-Y306 HydrophobicContact CB-CE2 4.29Å; M232-Y306 HydrophobicContact CB-CG 4.42Å; M232-Y306 HydrophobicContact CG-CD2 4.29Å; M232-Y306 HydrophobicContact CG-CE2 4.24Å
233	K	97.6	Very high	96.6	Very high	144 Å²	144	78.9 Å²	78.9	63%	0.626	41%	0.413	S	S	*	.	H	α-helix	trans	-60.9	-40.9	178.7	-74.3	174.7	-179.1	178.8	0	112.1	L229 G230 S236 R237	L229-K233 WeakPolarHBondContact O-CG 3.41Å; L229-K233 PolarHBondContact O-N 2.81Å; G230-K233 PolarHBondContact O-N 3.49Å; K233-S236 PolarHBondContact O-N 3.03Å; K233-R237 WeakPolarHBondContact O-CB 3.42Å; K233-R237 PolarHBondContact O-N 2.86Å
234	E	97.1	Very high	96.6	Very high	72 Å²	72	79.9 Å²	79.9	34%	0.336	41%	0.411	S	S	.	.	H	α-helix	trans	-68.1	-39	178.4	-179.6	58.6	-170.1	0	0	112.3	G230 M232 R237 K238	G230-E234 PolarHBondContact O-N 2.93Å; M232-E234 VanDerWaalsContact C-N 3.32Å; M232-E234 PolarHBondContact O-N 3.16Å; E234-R237 PolarHBondContact O-N 3.42Å; E234-R237 IonicContact OE1-CZ 3.46Å; E234-R237 IonicContact OE1-NE 3.3Å; E234-R237 IonicContact OE1-NH2 2.85Å; E234-R237 PolarHBondContact OE1-NH2 2.86Å; E234-R237 IonicContact OE2-CZ 2.71Å; E234-R237 IonicContact OE2-NE 3.59Å; E234-R237 PolarHBondContact OE2-NE 3.45Å; E234-R237 IonicContact OE2-NH2 2.69Å; E234-R237 PolarHBondContact OE2-NH2 3.25Å; E234-K238 WeakPolarHBondContact O-CG 3.47Å; E234-K238 PolarHBondContact O-N 2.96Å; E234-K238 WeakPolarHBondContact OE1-CE 3.34Å; E234-K238 IonicContact OE1-NZ 2.69Å
235	E	96.3	Very high	96.5	Very high	22 Å²	22	82.7 Å²	82.7	10%	0.103	43%	0.425	C	S	.	.	H	α-helix	trans	-61	-48.2	171.6	179.6	176.6	139.9	0	0	111.3	A231 M232 R237 K238 K239 M301 D302 K305 Y306	A231-E235 PolarHBondContact O-N 2.81Å; M232-E235 PolarHBondContact O-N 3.11Å; E235-R237 VanDerWaalsContact C-N 3.3Å; E235-R237 PolarHBondContact O-N 3.36Å; E235-K238 PolarHBondContact O-N 3.03Å; E235-K239 HydrophobicContact CG-CD 3.9Å; E235-K239 HydrophobicContact CG-CG 4.45Å; E235-K239 WeakPolarHBondContact O-CG 3.28Å; E235-K239 PolarHBondContact O-N 3.3Å; E235-K239 WeakPolarHBondContact OE1-CE 3.45Å; E235-K239 IonicContact OE1-NZ 3.66Å; E235-K239 PolarHBondContact OE1-NZ 3.07Å; E235-M301 HydrophobicContact CB-CE 4.22Å; E235-M301 HydrophobicContact CG-CE 4.12Å; E235-M301 HydrophobicContact CG-SD 4.05Å; E235-D302 PolarHBondContact OE1-N 3.19Å; E235-K305 IonicContact OE2-NZ 3.77Å; E235-K305 PolarHBondContact OE2-NZ 2.91Å; E235-Y306 WeakPolarHBondContact CB-OH 3.49Å; E235-Y306 PolarHBondContact OE2-OH 3.37Å
236	S	96.8	Very high	96.3	Very high	52 Å²	52	81.7 Å²	81.7	36%	0.364	42%	0.418	S	S	.	.	H	α-helix	trans	-57.4	-43.9	177.8	-174.3	0	0	0	0	111.5	M232 K233 K239 H240 M301	M232-S236 PolarHBondContact O-N 3.45Å; K233-S236 PolarHBondContact O-N 3.03Å; S236-K239 PolarHBondContact O-N 3.3Å; S236-H240 VanDerWaalsContact O-CB 3.26Å; S236-H240 WeakPolarHBondContact O-CB 3.43Å; S236-H240 PolarHBondContact O-N 2.86Å; S236-M301 VanDerWaalsContact CA-SD 3.59Å
237	R	97.3	Very high	96.1	Very high	124 Å²	124	81.4 Å²	81.4	47%	0.468	42%	0.419	S	S	.	.	H	α-helix	trans	-63	-47.2	178.7	-171.2	-170.6	68.9	78.6	-0.1	111.7	K233 E234 E235 H240 L241	K233-R237 WeakPolarHBondContact O-CB 3.42Å; K233-R237 PolarHBondContact O-N 2.86Å; E234-R237 PolarHBondContact O-N 3.42Å; E234-R237 IonicContact OE1-CZ 3.46Å; E234-R237 IonicContact OE1-NE 3.3Å; E234-R237 IonicContact OE1-NH2 2.85Å; E234-R237 PolarHBondContact OE1-NH2 2.86Å; E234-R237 IonicContact OE2-CZ 2.71Å; E234-R237 IonicContact OE2-NE 3.59Å; E234-R237 PolarHBondContact OE2-NE 3.45Å; E234-R237 IonicContact OE2-NH2 2.69Å; E234-R237 PolarHBondContact OE2-NH2 3.25Å; E235-R237 VanDerWaalsContact C-N 3.3Å; E235-R237 PolarHBondContact O-N 3.36Å; R237-H240 PolarHBondContact O-N 2.8Å; R237-L241 HydrophobicContact CG-CD1 4.45Å; R237-L241 VanDerWaalsContact NH1-CD1 3.34Å; R237-L241 WeakPolarHBondContact O-CG 3.33Å; R237-L241 PolarHBondContact O-N 3.46Å; R237-L241 VanDerWaalsContact O-N 3.09Å
238	K	95.9	Very high	96.1	Very high	125 Å²	125	84.4 Å²	84.4	54%	0.543	42%	0.421	S	S	.	.	H	α-helix	trans	-61.3	-45	178.4	-72.7	178.8	-171.7	178.5	0	111.9	E234 E235 L242	E234-K238 WeakPolarHBondContact O-CG 3.47Å; E234-K238 PolarHBondContact O-N 2.96Å; E234-K238 WeakPolarHBondContact OE1-CE 3.34Å; E234-K238 IonicContact OE1-NZ 2.69Å; E235-K238 PolarHBondContact O-N 3.03Å; K238-L242 PolarHBondContact O-N 3.49Å; K238-L242 VanDerWaalsContact O-N 3.15Å
239	K	95.2	Very high	96	Very high	40 Å²	40	85.8 Å²	85.8	17%	0.174	43%	0.425	C	S	.	.	H	α-helix	trans	-67.1	-40.3	179.5	-71.8	179.5	175.8	-179.8	0	111.7	E235 S236 L242 V243 G298 L300 M301	E235-K239 HydrophobicContact CG-CD 3.9Å; E235-K239 HydrophobicContact CG-CG 4.45Å; E235-K239 WeakPolarHBondContact O-CG 3.28Å; E235-K239 PolarHBondContact O-N 3.3Å; E235-K239 WeakPolarHBondContact OE1-CE 3.45Å; E235-K239 IonicContact OE1-NZ 3.66Å; E235-K239 PolarHBondContact OE1-NZ 3.07Å; S236-K239 PolarHBondContact O-N 3.3Å; K239-L242 PolarHBondContact O-N 3.35Å; K239-V243 WeakPolarHBondContact O-CG2 3.3Å; K239-V243 PolarHBondContact O-N 2.65Å; K239-G298 WeakPolarHBondContact CE-O 3.47Å; K239-G298 PolarHBondContact NZ-O 2.91Å; K239-L300 PolarHBondContact NZ-O 3.26Å; K239-M301 HydrophobicContact CD-SD 4.29Å
240	H	96.1	Very high	95.8	Very high	126 Å²	126	85.5 Å²	85.5	58%	0.583	42%	0.423	S	S	*	.	H	α-helix	trans	-60.3	-50	176.4	-172.9	71.6	0	0	0	112.2	S236 R237 L242 V243 E244	S236-H240 VanDerWaalsContact O-CB 3.26Å; S236-H240 WeakPolarHBondContact O-CB 3.43Å; S236-H240 PolarHBondContact O-N 2.86Å; R237-H240 PolarHBondContact O-N 2.8Å; H240-L242 VanDerWaalsContact C-N 3.29Å; H240-L242 PolarHBondContact O-N 3.21Å; H240-V243 PolarHBondContact O-N 3.31Å; H240-E244 WeakPolarHBondContact O-CB 3.35Å; H240-E244 PolarHBondContact O-N 3.23Å
241	L	96.2	Very high	95.6	Very high	85 Å²	85	86 Å²	86	45%	0.445	42%	0.424	S	S	.	.	H	α-helix	trans	-59.6	-39.6	177.7	-71.8	171.6	0	0	0	112.5	R237 E244 E245	R237-L241 HydrophobicContact CG-CD1 4.45Å; R237-L241 VanDerWaalsContact NH1-CD1 3.34Å; R237-L241 WeakPolarHBondContact O-CG 3.33Å; R237-L241 PolarHBondContact O-N 3.46Å; R237-L241 VanDerWaalsContact O-N 3.09Å; L241-E244 PolarHBondContact O-N 3.49Å; L241-E245 WeakPolarHBondContact O-CB 3.42Å; L241-E245 PolarHBondContact O-N 3.43Å
242	L	94.8	Very high	95.5	Very high	88 Å²	88	88.3 Å²	88.3	46%	0.461	43%	0.426	S	S	.	.	H	α-helix	trans	-65.2	-43.3	177.6	-179.9	62.1	0	0	0	111.8	K238 K239 H240 K246 L299	K238-L242 PolarHBondContact O-N 3.49Å; K238-L242 VanDerWaalsContact O-N 3.15Å; K239-L242 PolarHBondContact O-N 3.35Å; H240-L242 VanDerWaalsContact C-N 3.29Å; H240-L242 PolarHBondContact O-N 3.21Å; L242-K246 HydrophobicContact CD1-CG 4.49Å; L242-K246 WeakPolarHBondContact O-CB 3.24Å; L242-K246 VanDerWaalsContact O-CG 3.26Å; L242-K246 WeakPolarHBondContact O-CG 3.33Å; L242-K246 PolarHBondContact O-N 3.23Å; L242-L299 HydrophobicContact CD2-CD2 3.82Å; L242-L299 HydrophobicContact CG-CD2 4.34Å
243	V	94.8	Very high	95.3	Very high	55 Å²	55	88.4 Å²	88.4	33%	0.333	43%	0.426	S	S	.	.	H	α-helix	trans	-64.9	-43.7	177.3	171.1	0	0	0	0	110.6	K239 H240 K246 M247 L299	K239-V243 WeakPolarHBondContact O-CG2 3.3Å; K239-V243 PolarHBondContact O-N 2.65Å; H240-V243 PolarHBondContact O-N 3.31Å; V243-K246 PolarHBondContact O-N 2.92Å; V243-M247 HydrophobicContact CG1-CG 4.31Å; V243-M247 HydrophobicContact CG1-SD 4.03Å; V243-M247 WeakPolarHBondContact O-CG 3.36Å; V243-M247 PolarHBondContact O-N 3.08Å; V243-L299 HydrophobicContact CG2-CD2 4.16Å
244	E	96.1	Very high	95.1	Very high	110 Å²	110	86 Å²	86	51%	0.514	42%	0.423	S	S	.	.	H	α-helix	trans	-60.4	-47.2	178.6	-172.4	176	-168.6	0	0	111.9	H240 L241 K246 M247 K248	H240-E244 WeakPolarHBondContact O-CB 3.35Å; H240-E244 PolarHBondContact O-N 3.23Å; L241-E244 PolarHBondContact O-N 3.49Å; E244-K246 VanDerWaalsContact C-N 3.32Å; E244-K246 PolarHBondContact O-N 3.4Å; E244-M247 PolarHBondContact O-N 3.34Å; E244-K248 PolarHBondContact O-N 2.71Å
245	E	94.7	Very high	95	Very high	91 Å²	91	87.9 Å²	87.9	43%	0.425	43%	0.432	S	S	.	.	H	α-helix	trans	-61.4	-40.8	176	179.7	57.3	-154	0	0	111.7	L241 K248 Q249	L241-E245 WeakPolarHBondContact O-CB 3.42Å; L241-E245 PolarHBondContact O-N 3.43Å; E245-K248 PolarHBondContact O-N 3.38Å; E245-Q249 VanDerWaalsContact O-CG 3.29Å; E245-Q249 WeakPolarHBondContact O-CG 3.37Å; E245-Q249 PolarHBondContact O-N 3.3Å; E245-Q249 PolarHBondContact OE1-NE2 2.88Å
246	K	92.9	Very high	94.8	Very high	103 Å²	103	89 Å²	89	45%	0.448	45%	0.445	S	S	.	.	H	α-helix	trans	-66.9	-39.3	176.4	-71.9	-67.7	172.3	-161.7	0	112.7	L242 V243 E244 K248 Q249 L250	L242-K246 HydrophobicContact CD1-CG 4.49Å; L242-K246 WeakPolarHBondContact O-CB 3.24Å; L242-K246 VanDerWaalsContact O-CG 3.26Å; L242-K246 WeakPolarHBondContact O-CG 3.33Å; L242-K246 PolarHBondContact O-N 3.23Å; V243-K246 PolarHBondContact O-N 2.92Å; E244-K246 VanDerWaalsContact C-N 3.32Å; E244-K246 PolarHBondContact O-N 3.4Å; K246-K248 VanDerWaalsContact C-N 3.34Å; K246-Q249 VanDerWaalsContact NZ-OE1 3.09Å; K246-Q249 PolarHBondContact O-N 3.39Å; K246-L250 WeakPolarHBondContact O-CB 3.39Å; K246-L250 WeakPolarHBondContact O-CG 3.18Å; K246-L250 PolarHBondContact O-N 3.12Å
247	M	94.4	Very high	94.7	Very high	129 Å²	129	89.8 Å²	89.8	64%	0.635	45%	0.445	S	S	*	.	H	α-helix	trans	-62.2	-43.1	174.7	-74.4	-179.4	68.5	0	0	111.2	V243 E244 L250 A251	V243-M247 HydrophobicContact CG1-CG 4.31Å; V243-M247 HydrophobicContact CG1-SD 4.03Å; V243-M247 WeakPolarHBondContact O-CG 3.36Å; V243-M247 PolarHBondContact O-N 3.08Å; E244-M247 PolarHBondContact O-N 3.34Å; M247-L250 PolarHBondContact O-N 2.95Å; M247-A251 WeakPolarHBondContact O-CB 3.34Å; M247-A251 PolarHBondContact O-N 3.22Å
248	K	95.9	Very high	94.5	Very high	120 Å²	120	86 Å²	86	52%	0.522	44%	0.439	S	S	.	.	H	α-helix	trans	-62.9	-47.2	176.7	-173.3	-178.1	174.5	-170.5	0	112.1	E244 E245 K246 L250 A251 E252	E244-K248 PolarHBondContact O-N 2.71Å; E245-K248 PolarHBondContact O-N 3.38Å; K246-K248 VanDerWaalsContact C-N 3.34Å; K248-L250 VanDerWaalsContact C-N 3.32Å; K248-L250 PolarHBondContact O-N 3.25Å; K248-A251 WeakPolarHBondContact O-CB 3.26Å; K248-A251 PolarHBondContact O-N 3.32Å; K248-A251 VanDerWaalsContact O-N 3.17Å; K248-E252 VanDerWaalsContact CE-OE1 3.23Å; K248-E252 WeakPolarHBondContact CE-OE1 3.22Å; K248-E252 WeakPolarHBondContact O-CG 3.26Å; K248-E252 PolarHBondContact O-N 2.74Å
249	Q	93.6	Very high	94.5	Very high	64 Å²	64	86.1 Å²	86.1	30%	0.299	44%	0.436	S	S	.	.	H	α-helix	trans	-57.4	-44.5	176.4	-73.6	172.8	4.8	0	0	111.8	E245 K246 E252 Q253	E245-Q249 VanDerWaalsContact O-CG 3.29Å; E245-Q249 WeakPolarHBondContact O-CG 3.37Å; E245-Q249 PolarHBondContact O-N 3.3Å; E245-Q249 PolarHBondContact OE1-NE2 2.88Å; K246-Q249 VanDerWaalsContact NZ-OE1 3.09Å; K246-Q249 PolarHBondContact O-N 3.39Å; Q249-E252 PolarHBondContact O-N 2.92Å; Q249-Q253 WeakPolarHBondContact O-CB 3.2Å; Q249-Q253 VanDerWaalsContact O-CG 3.31Å; Q249-Q253 WeakPolarHBondContact O-CG 3.41Å; Q249-Q253 PolarHBondContact O-N 3.25Å
250	L	93.3	Very high	94.4	Very high	80 Å²	80	85.4 Å²	85.4	42%	0.419	43%	0.434	S	S	.	.	H	α-helix	trans	-66.7	-37	177.7	-73.3	170.3	0	0	0	112.3	K246 M247 K248 Q253 T254 P292	K246-L250 WeakPolarHBondContact O-CB 3.39Å; K246-L250 WeakPolarHBondContact O-CG 3.18Å; K246-L250 PolarHBondContact O-N 3.12Å; M247-L250 PolarHBondContact O-N 2.95Å; K248-L250 VanDerWaalsContact C-N 3.32Å; K248-L250 PolarHBondContact O-N 3.25Å; L250-Q253 PolarHBondContact O-N 2.96Å; L250-T254 WeakPolarHBondContact O-CB 3.23Å; L250-T254 PolarHBondContact O-N 3.2Å; L250-T254 PolarHBondContact O-OG1 2.95Å; L250-P292 HydrophobicContact CD2-CB 4.31Å
251	A	95.1	Very high	94.3	Very high	49 Å²	49	84 Å²	84	41%	0.405	43%	0.43	S	S	.	.	H	α-helix	trans	-62.9	-47.7	174.8	0	0	0	0	0	111.4	M247 K248 Q253 T254 E255	M247-A251 WeakPolarHBondContact O-CB 3.34Å; M247-A251 PolarHBondContact O-N 3.22Å; K248-A251 WeakPolarHBondContact O-CB 3.26Å; K248-A251 PolarHBondContact O-N 3.32Å; K248-A251 VanDerWaalsContact O-N 3.17Å; A251-Q253 PolarHBondContact O-N 3.04Å; A251-T254 PolarHBondContact O-N 2.84Å; A251-E255 WeakPolarHBondContact O-CG 3.49Å; A251-E255 PolarHBondContact O-N 2.82Å
252	E	94.1	Very high	94.2	Very high	101 Å²	101	85.7 Å²	85.7	47%	0.472	44%	0.435	S	S	.	.	H	α-helix	trans	-61.2	-41.7	177.3	-70.4	174	-175.3	0	0	112.3	K248 Q249 A256	K248-E252 VanDerWaalsContact CE-OE1 3.23Å; K248-E252 WeakPolarHBondContact CE-OE1 3.22Å; K248-E252 WeakPolarHBondContact O-CG 3.26Å; K248-E252 PolarHBondContact O-N 2.74Å; Q249-E252 PolarHBondContact O-N 2.92Å; E252-A256 WeakPolarHBondContact O-CB 3.27Å; E252-A256 PolarHBondContact O-N 3.02Å
253	Q	92.4	Very high	94.2	Very high	77 Å²	77	87.6 Å²	87.6	36%	0.36	44%	0.436	S	S	.	.	H	α-helix	trans	-64.4	-42.3	174.7	-74.5	179.2	-20.5	0	0	111.9	Q249 L250 A251 A256 L257	Q249-Q253 WeakPolarHBondContact O-CB 3.2Å; Q249-Q253 VanDerWaalsContact O-CG 3.31Å; Q249-Q253 WeakPolarHBondContact O-CG 3.41Å; Q249-Q253 PolarHBondContact O-N 3.25Å; L250-Q253 PolarHBondContact O-N 2.96Å; A251-Q253 PolarHBondContact O-N 3.04Å; Q253-A256 PolarHBondContact O-N 2.91Å; Q253-L257 WeakPolarHBondContact O-CG 3.16Å; Q253-L257 PolarHBondContact O-N 2.9Å
254	T	93.8	Very high	94.1	Very high	93 Å²	93	86.6 Å²	86.6	57%	0.571	43%	0.429	S	S	*	.	H	α-helix	trans	-62.5	-44.6	178	-58.4	0	0	0	0	111	L250 A251 A256 L257 A258	L250-T254 WeakPolarHBondContact O-CB 3.23Å; L250-T254 PolarHBondContact O-N 3.2Å; L250-T254 PolarHBondContact O-OG1 2.95Å; A251-T254 PolarHBondContact O-N 2.84Å; T254-A256 PolarHBondContact O-N 2.8Å; T254-L257 PolarHBondContact O-N 2.92Å; T254-A258 PolarHBondContact O-N 3.14Å
255	E	94.9	Very high	94	Very high	112 Å²	112	86.5 Å²	86.5	52%	0.523	43%	0.429	S	S	.	.	H	α-helix	trans	-64.7	-38.3	174.9	-71.2	-176.6	-172.8	0	0	112.8	A251 L257 A258 R259	A251-E255 WeakPolarHBondContact O-CG 3.49Å; A251-E255 PolarHBondContact O-N 2.82Å; E255-L257 VanDerWaalsContact C-N 3.33Å; E255-A258 PolarHBondContact O-N 3.43Å; E255-R259 WeakPolarHBondContact O-CG 3.35Å; E255-R259 PolarHBondContact O-N 3.03Å; E255-R259 IonicContact OE2-NH1 2.84Å; E255-R259 PolarHBondContact OE2-NH1 3.14Å
256	A	92.6	Very high	94	Very high	46 Å²	46	88.2 Å²	88.2	38%	0.38	44%	0.438	S	S	.	.	H	α-helix	trans	-62.8	-41.6	176.5	0	0	0	0	0	111.7	E252 Q253 T254 R259 E260	E252-A256 WeakPolarHBondContact O-CB 3.27Å; E252-A256 PolarHBondContact O-N 3.02Å; Q253-A256 PolarHBondContact O-N 2.91Å; T254-A256 PolarHBondContact O-N 2.8Å; A256-R259 PolarHBondContact O-N 2.99Å; A256-E260 PolarHBondContact O-N 3.2Å; A256-E260 VanDerWaalsContact O-N 3.15Å
257	L	93.9	Very high	94	Very high	68 Å²	68	83.9 Å²	83.9	36%	0.356	42%	0.419	S	S	.	.	H	α-helix	trans	-64.6	-43.2	173.6	-69.6	173.4	0	0	0	111.6	Q253 T254 E255 R259 E260 I261 T289	Q253-L257 WeakPolarHBondContact O-CG 3.16Å; Q253-L257 PolarHBondContact O-N 2.9Å; T254-L257 PolarHBondContact O-N 2.92Å; E255-L257 VanDerWaalsContact C-N 3.33Å; L257-R259 VanDerWaalsContact C-N 3.35Å; L257-R259 PolarHBondContact O-N 3.27Å; L257-E260 PolarHBondContact O-N 3.46Å; L257-E260 VanDerWaalsContact O-N 3.15Å; L257-I261 WeakPolarHBondContact O-CG1 3.41Å; L257-I261 PolarHBondContact O-N 3.07Å; L257-T289 HydrophobicContact CD2-CG2 3.83Å
258	A	94.7	Very high	94	Very high	43 Å²	43	83.3 Å²	83.3	36%	0.355	42%	0.418	S	S	.	.	H	α-helix	trans	-58	-45.3	176.1	0	0	0	0	0	112	T254 E255 E260 I261 E262	T254-A258 PolarHBondContact O-N 3.14Å; E255-A258 PolarHBondContact O-N 3.43Å; A258-E260 VanDerWaalsContact C-N 3.32Å; A258-E260 PolarHBondContact O-N 3.41Å; A258-I261 WeakPolarHBondContact O-CB 3.5Å; A258-I261 PolarHBondContact O-N 3.24Å; A258-E262 PolarHBondContact O-N 3.46Å
259	R	94.2	Very high	93.9	Very high	128 Å²	128	85.5 Å²	85.5	48%	0.483	43%	0.427	S	S	.	.	H	α-helix	trans	-61.1	-37.2	175.5	-72.7	-174.5	-68.5	-95.6	1	112.9	E255 A256 L257 R263	E255-R259 WeakPolarHBondContact O-CG 3.35Å; E255-R259 PolarHBondContact O-N 3.03Å; E255-R259 IonicContact OE2-NH1 2.84Å; E255-R259 PolarHBondContact OE2-NH1 3.14Å; A256-R259 PolarHBondContact O-N 2.99Å; L257-R259 VanDerWaalsContact C-N 3.35Å; L257-R259 PolarHBondContact O-N 3.27Å; R259-R263 WeakPolarHBondContact O-CB 3.37Å; R259-R263 PolarHBondContact O-N 3.47Å; R259-R263 VanDerWaalsContact O-N 3.08Å
260	E	93.3	Very high	93.9	Very high	26 Å²	26	85.6 Å²	85.6	12%	0.121	43%	0.428	C	S	.	.	H	α-helix	trans	-73.5	-35.6	176.5	-168.3	62.3	-167.9	0	0	111.7	A256 L257 A258 R263 L264 R285	A256-E260 PolarHBondContact O-N 3.2Å; A256-E260 VanDerWaalsContact O-N 3.15Å; L257-E260 PolarHBondContact O-N 3.46Å; L257-E260 VanDerWaalsContact O-N 3.15Å; A258-E260 VanDerWaalsContact C-N 3.32Å; A258-E260 PolarHBondContact O-N 3.41Å; E260-R263 PolarHBondContact O-N 3.38Å; E260-R263 WeakPolarHBondContact OE2-CD 3.33Å; E260-R263 IonicContact OE2-NE 3.16Å; E260-R263 PolarHBondContact OE2-NE 2.81Å; E260-L264 VanDerWaalsContact O-CG 3.25Å; E260-L264 WeakPolarHBondContact O-CG 3.05Å; E260-L264 PolarHBondContact O-N 3.49Å; E260-R285 IonicContact OE1-CZ 2.65Å; E260-R285 IonicContact OE1-NE 3.49Å; E260-R285 PolarHBondContact OE1-NE 2.91Å; E260-R285 IonicContact OE1-NH2 3.31Å; E260-R285 PolarHBondContact OE1-NH2 3.19Å; E260-R285 VanDerWaalsContact OE1-NH2 3.16Å; E260-R285 IonicContact OE2-NE 3.46Å
261	I	93.8	Very high	93.9	Very high	96 Å²	96	86 Å²	86	49%	0.492	43%	0.43	S	S	.	.	H	α-helix	trans	-59.4	-49.5	172.4	-68.7	165.3	0	0	0	110.5	L257 A258 R263 L264 Q265	L257-I261 WeakPolarHBondContact O-CG1 3.41Å; L257-I261 PolarHBondContact O-N 3.07Å; A258-I261 WeakPolarHBondContact O-CB 3.5Å; A258-I261 PolarHBondContact O-N 3.24Å; I261-R263 VanDerWaalsContact C-N 3.32Å; I261-R263 PolarHBondContact O-N 3.35Å; I261-L264 PolarHBondContact O-N 3.37Å; I261-Q265 WeakPolarHBondContact O-CG 3.43Å; I261-Q265 PolarHBondContact O-N 3.04Å
262	E	95.6	Very high	93.9	Very high	121 Å²	121	90.1 Å²	90.1	57%	0.565	45%	0.446	S	S	*	.	H	α-helix	trans	-59.3	-43	176.8	-73.1	176	-175.6	0	0	111.7	A258 L264 Q265 M266	A258-E262 PolarHBondContact O-N 3.46Å; E262-L264 PolarHBondContact O-N 3.1Å; E262-Q265 WeakPolarHBondContact O-CB 3.36Å; E262-Q265 PolarHBondContact O-N 3.24Å; E262-M266 WeakPolarHBondContact O-CG 3.34Å; E262-M266 PolarHBondContact O-N 3.14Å
263	R	93.3	Very high	93.8	Very high	127 Å²	127	92 Å²	92	48%	0.479	46%	0.456	S	S	.	.	H	α-helix	trans	-59.5	-45.8	176.1	-169.7	-167.8	-53.7	-76	-6.6	111.6	R259 E260 I261 Q265 M266 E267	R259-R263 WeakPolarHBondContact O-CB 3.37Å; R259-R263 PolarHBondContact O-N 3.47Å; R259-R263 VanDerWaalsContact O-N 3.08Å; E260-R263 PolarHBondContact O-N 3.38Å; E260-R263 WeakPolarHBondContact OE2-CD 3.33Å; E260-R263 IonicContact OE2-NE 3.16Å; E260-R263 PolarHBondContact OE2-NE 2.81Å; I261-R263 VanDerWaalsContact C-N 3.32Å; I261-R263 PolarHBondContact O-N 3.35Å; R263-Q265 VanDerWaalsContact C-N 3.33Å; R263-Q265 PolarHBondContact O-N 3.1Å; R263-M266 PolarHBondContact O-N 2.94Å; R263-E267 WeakPolarHBondContact O-CG 3.34Å; R263-E267 PolarHBondContact O-N 2.79Å
264	L	93.7	Very high	93.8	Very high	35 Å²	35	90.4 Å²	90.4	18%	0.183	45%	0.451	C	S	.	.	H	α-helix	trans	-61.7	-42.1	176.8	-68.4	165.4	0	0	0	111.4	E260 I261 E262 M266 E267 I268 R282 L286	E260-L264 VanDerWaalsContact O-CG 3.25Å; E260-L264 WeakPolarHBondContact O-CG 3.05Å; E260-L264 PolarHBondContact O-N 3.49Å; I261-L264 PolarHBondContact O-N 3.37Å; E262-L264 PolarHBondContact O-N 3.1Å; L264-M266 VanDerWaalsContact C-N 3.28Å; L264-M266 PolarHBondContact O-N 2.79Å; L264-E267 PolarHBondContact O-N 3.35Å; L264-I268 WeakPolarHBondContact O-CB 3.42Å; L264-I268 WeakPolarHBondContact O-CD1 3.46Å; L264-I268 WeakPolarHBondContact O-CG1 3.46Å; L264-I268 PolarHBondContact O-N 3.07Å; L264-R282 HydrophobicContact CD2-CG 3.61Å; L264-L286 HydrophobicContact CD1-CD2 3.7Å; L264-L286 HydrophobicContact CD2-CD1 4.22Å; L264-L286 HydrophobicContact CD2-CD2 4.41Å
265	Q	95	Very high	93.8	Very high	108 Å²	108	89 Å²	89	51%	0.505	44%	0.438	S	S	.	.	H	α-helix	trans	-61.8	-36.1	176.9	-72.3	175.9	-8	0	0	112.4	I261 E262 R263 K269	I261-Q265 WeakPolarHBondContact O-CG 3.43Å; I261-Q265 PolarHBondContact O-N 3.04Å; E262-Q265 WeakPolarHBondContact O-CB 3.36Å; E262-Q265 PolarHBondContact O-N 3.24Å; R263-Q265 VanDerWaalsContact C-N 3.33Å; R263-Q265 PolarHBondContact O-N 3.1Å; Q265-K269 WeakPolarHBondContact O-CG 3.24Å
266	M	93.8	Very high	93.7	Very high	127 Å²	127	89.2 Å²	89.2	63%	0.626	44%	0.442	S	S	*	.	H	α-helix	trans	-71	-45.8	174.2	-66.7	-62.5	-77.8	0	0	111.5	E262 R263 L264 I268 K269	E262-M266 WeakPolarHBondContact O-CG 3.34Å; E262-M266 PolarHBondContact O-N 3.14Å; R263-M266 PolarHBondContact O-N 2.94Å; L264-M266 VanDerWaalsContact C-N 3.28Å; L264-M266 PolarHBondContact O-N 2.79Å; M266-I268 VanDerWaalsContact C-N 3.3Å; M266-I268 PolarHBondContact O-N 3.36Å; M266-K269 PolarHBondContact O-N 3.29Å; M266-K269 VanDerWaalsContact O-N 3.1Å
267	E	93.1	Very high	93.7	Very high	11 Å²	11	94.4 Å²	94.4	5%	0.051	46%	0.46	C	S	.	.	H	α-helix	trans	-60.8	-37	177.8	-72.6	-177.2	-158.4	0	0	112.2	R263 L264 K269 E270 F275 K278 R282 R285	R263-E267 WeakPolarHBondContact O-CG 3.34Å; R263-E267 PolarHBondContact O-N 2.79Å; L264-E267 PolarHBondContact O-N 3.35Å; E267-K269 PolarHBondContact O-N 3.06Å; E267-E270 WeakPolarHBondContact O-CB 3.45Å; E267-E270 PolarHBondContact O-N 2.66Å; E267-E270 VanDerWaalsContact O-N 3.14Å; E267-F275 WeakPolarHBondContact O-CD2 3.3Å; E267-K278 HydrophobicContact CG-CD 4.45Å; E267-R282 IonicContact OE2-CZ 3.16Å; E267-R282 IonicContact OE2-NE 2.71Å; E267-R282 PolarHBondContact OE2-NE 3.28Å; E267-R282 IonicContact OE2-NH2 2.8Å; E267-R282 PolarHBondContact OE2-NH2 2.99Å; E267-R285 IonicContact OE1-CZ 2.71Å; E267-R285 IonicContact OE1-NH1 3.57Å; E267-R285 IonicContact OE1-NH2 2.74Å; E267-R285 PolarHBondContact OE1-NH2 2.9Å; E267-R285 IonicContact OE2-NH2 3.8Å
268	I	93.3	Very high	93.6	Very high	118 Å²	118	94.3 Å²	94.3	61%	0.605	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-25	177.2	-72.6	162.9	0	0	0	112.6	L264 M266 F275	L264-I268 WeakPolarHBondContact O-CB 3.42Å; L264-I268 WeakPolarHBondContact O-CD1 3.46Å; L264-I268 WeakPolarHBondContact O-CG1 3.46Å; L264-I268 PolarHBondContact O-N 3.07Å; M266-I268 VanDerWaalsContact C-N 3.3Å; M266-I268 PolarHBondContact O-N 3.36Å; I268-F275 HydrophobicContact CG1-CE2 4.33Å
269	K	93.9	Very high	93.4	Very high	166 Å²	166	97 Å²	97	72%	0.722	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.6	179.8	-63.2	173.1	-174.2	175.1	0	113.4	Q265 M266 E267	Q265-K269 WeakPolarHBondContact O-CG 3.24Å; M266-K269 PolarHBondContact O-N 3.29Å; M266-K269 VanDerWaalsContact O-N 3.1Å; E267-K269 PolarHBondContact O-N 3.06Å
270	E	94	Very high	93.2	Very high	65 Å²	65	99.1 Å²	99.1	30%	0.304	48%	0.475	S	S	.	.	S	Bend	trans	-75	166.1	178.7	-64.4	-179.3	163.5	0	0	111.9	E267 T274 K278	E267-E270 WeakPolarHBondContact O-CB 3.45Å; E267-E270 PolarHBondContact O-N 2.66Å; E267-E270 VanDerWaalsContact O-N 3.14Å; E270-T274 WeakPolarHBondContact OE2-CG2 3.46Å; E270-K278 IonicContact OE1-NZ 3.1Å; E270-K278 PolarHBondContact OE1-NZ 3.38Å; E270-K278 IonicContact OE2-NZ 2.78Å; E270-K278 PolarHBondContact OE2-NZ 3.41Å
271	D	94.6	Very high	93	Very high	88 Å²	88	100.5 Å²	100.5	47%	0.471	49%	0.487	S	S	.	.			trans	-66.1	154.8	173.7	69.8	94.5	0	0	0	112.3	M273 T274 F275	D271-M273 VanDerWaalsContact C-N 3.26Å; D271-M273 PolarHBondContact O-N 3.19Å; D271-M273 VanDerWaalsContact O-N 3.14Å; D271-M273 WeakPolarHBondContact OD1-CB 3.42Å; D271-M273 PolarHBondContact OD1-N 2.81Å; D271-T274 VanDerWaalsContact CG-OG1 3.28Å; D271-T274 PolarHBondContact O-N 2.87Å; D271-T274 PolarHBondContact OD1-N 2.91Å; D271-T274 PolarHBondContact OD1-OG1 3.44Å; D271-T274 WeakPolarHBondContact OD2-CB 3.49Å; D271-T274 PolarHBondContact OD2-OG1 3.18Å; D271-F275 WeakPolarHBondContact O-CB 3.41Å; D271-F275 PolarHBondContact O-N 2.89Å
272	D	93.7	Very high	93	Very high	137 Å²	137	97.1 Å²	97.1	73%	0.733	47%	0.468	S	S	*	.	H	α-helix	trans	-54.2	-38.7	-172.9	-66.8	-22.3	0	0	0	113.4	L276	D272-L276 WeakPolarHBondContact O-CB 3.4Å; D272-L276 WeakPolarHBondContact O-CD1 3.1Å; D272-L276 WeakPolarHBondContact O-CG 3.32Å; D272-L276 PolarHBondContact O-N 3.27Å; D272-L276 VanDerWaalsContact O-N 3.14Å
273	M	93	Very high	92.8	Very high	139 Å²	139	98.3 Å²	98.3	69%	0.685	47%	0.471	S	S	*	.	H	α-helix	trans	-70.8	-48.9	-178.3	-171.7	-173.6	69.9	0	0	111	D271 F275 L276 M277	D271-M273 VanDerWaalsContact C-N 3.26Å; D271-M273 PolarHBondContact O-N 3.19Å; D271-M273 VanDerWaalsContact O-N 3.14Å; D271-M273 WeakPolarHBondContact OD1-CB 3.42Å; D271-M273 PolarHBondContact OD1-N 2.81Å; M273-F275 VanDerWaalsContact C-N 3.35Å; M273-F275 PolarHBondContact O-N 3.25Å; M273-L276 PolarHBondContact O-N 3.49Å; M273-M277 VanDerWaalsContact O-CG 3.31Å; M273-M277 WeakPolarHBondContact O-CG 3.11Å; M273-M277 PolarHBondContact O-N 3.48Å; M273-M277 VanDerWaalsContact O-N 3.07Å
274	T	91.9	Very high	92.5	Very high	44 Å²	44	101.5 Å²	101.5	27%	0.27	48%	0.483	S	S	.	.	H	α-helix	trans	-63.8	-40.9	179	-54.2	0	0	0	0	111.7	E270 D271 L276 M277 K278	E270-T274 WeakPolarHBondContact OE2-CG2 3.46Å; D271-T274 VanDerWaalsContact CG-OG1 3.28Å; D271-T274 PolarHBondContact O-N 2.87Å; D271-T274 PolarHBondContact OD1-N 2.91Å; D271-T274 PolarHBondContact OD1-OG1 3.44Å; D271-T274 WeakPolarHBondContact OD2-CB 3.49Å; D271-T274 PolarHBondContact OD2-OG1 3.18Å; T274-L276 PolarHBondContact O-N 2.67Å; T274-M277 PolarHBondContact O-N 3.37Å; T274-K278 PolarHBondContact O-N 3.39Å
275	F	94.2	Very high	92.4	Very high	65 Å²	65	103.6 Å²	103.6	29%	0.285	49%	0.489	S	S	.	.	H	α-helix	trans	-58.6	-46.8	176.1	175.6	-94.9	0	0	0	112.1	E267 I268 D271 M273 K278 R282	E267-F275 WeakPolarHBondContact O-CD2 3.3Å; I268-F275 HydrophobicContact CG1-CE2 4.33Å; D271-F275 WeakPolarHBondContact O-CB 3.41Å; D271-F275 PolarHBondContact O-N 2.89Å; M273-F275 VanDerWaalsContact C-N 3.35Å; M273-F275 PolarHBondContact O-N 3.25Å; F275-K278 PolarHBondContact O-N 2.97Å; F275-R282 VanDerWaalsContact CD2-NH2 3.33Å
276	L	92.9	Very high	92.1	Very high	115 Å²	115	101.9 Å²	101.9	60%	0.602	48%	0.483	S	S	*	.	H	α-helix	trans	-69.6	-38.3	-178.9	-72.3	172.9	0	0	0	112.5	D272 M273 T274 K278 H279	D272-L276 WeakPolarHBondContact O-CB 3.4Å; D272-L276 WeakPolarHBondContact O-CD1 3.1Å; D272-L276 WeakPolarHBondContact O-CG 3.32Å; D272-L276 PolarHBondContact O-N 3.27Å; D272-L276 VanDerWaalsContact O-N 3.14Å; M273-L276 PolarHBondContact O-N 3.49Å; T274-L276 PolarHBondContact O-N 2.67Å; L276-K278 PolarHBondContact O-N 2.85Å; L276-H279 WeakPolarHBondContact O-CB 3.35Å; L276-H279 PolarHBondContact O-N 3.18Å; L276-H279 VanDerWaalsContact O-N 3.07Å
277	M	92.1	Very high	91.7	Very high	156 Å²	156	104.4 Å²	104.4	77%	0.768	49%	0.491	S	S	*	.	H	α-helix	trans	-60.6	-30.4	178.9	-74.5	-66.1	-78.9	0	0	112.8	M273 T274	M273-M277 VanDerWaalsContact O-CG 3.31Å; M273-M277 WeakPolarHBondContact O-CG 3.11Å; M273-M277 PolarHBondContact O-N 3.48Å; M273-M277 VanDerWaalsContact O-N 3.07Å; T274-M277 PolarHBondContact O-N 3.37Å
278	K	92.6	Very high	91.2	Very high	65 Å²	65	108.5 Å²	108.5	28%	0.283	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-3.3	178.5	-65.5	173.7	-174.7	169	0	114.1	E267 E270 T274 F275 L276 K280 S281 R282	E267-K278 HydrophobicContact CG-CD 4.45Å; E270-K278 IonicContact OE1-NZ 3.1Å; E270-K278 PolarHBondContact OE1-NZ 3.38Å; E270-K278 IonicContact OE2-NZ 2.78Å; E270-K278 PolarHBondContact OE2-NZ 3.41Å; T274-K278 PolarHBondContact O-N 3.39Å; F275-K278 PolarHBondContact O-N 2.97Å; L276-K278 PolarHBondContact O-N 2.85Å; K278-K280 PolarHBondContact O-N 3.29Å; K278-S281 PolarHBondContact O-N 3.45Å; K278-S281 PolarHBondContact O-OG 3.48Å; K278-R282 WeakPolarHBondContact O-CB 3.33Å; K278-R282 PolarHBondContact O-N 3.47Å
279	H	89.9	Confident	90.8	Very high	101 Å²	101	105.5 Å²	105.5	47%	0.468	51%	0.506	S	S	.	.	H	α-helix	trans	-54.8	-46.3	-173.5	178.9	77.5	0	0	0	113.6	L276 S281 K283	L276-H279 WeakPolarHBondContact O-CB 3.35Å; L276-H279 PolarHBondContact O-N 3.18Å; L276-H279 VanDerWaalsContact O-N 3.07Å; H279-S281 PolarHBondContact O-N 3.49Å; H279-K283 WeakPolarHBondContact O-CB 3.21Å; H279-K283 PolarHBondContact O-N 2.82Å
280	K	89.2	Confident	90.4	Very high	172 Å²	172	102 Å²	102	75%	0.748	50%	0.499	S	S	*	.	H	α-helix	trans	-65.5	-38.3	-178.5	-74.6	-175.4	179.5	176.4	0	112.7	K278 R284	K278-K280 PolarHBondContact O-N 3.29Å; K280-R284 WeakPolarHBondContact O-CG 3.18Å; K280-R284 PolarHBondContact O-N 3.44Å
281	S	89.8	Confident	90	Very high	55 Å²	55	106.2 Å²	106.2	39%	0.385	52%	0.518	S	S	.	.	H	α-helix	trans	-75.2	-42.1	179.2	61.9	0	0	0	0	111	K278 H279 K283 R284 R285	K278-S281 PolarHBondContact O-N 3.45Å; K278-S281 PolarHBondContact O-OG 3.48Å; H279-S281 PolarHBondContact O-N 3.49Å; S281-K283 PolarHBondContact O-N 3.48Å; S281-R284 PolarHBondContact O-N 2.97Å; S281-R285 WeakPolarHBondContact O-CG 3.34Å; S281-R285 PolarHBondContact O-N 2.78Å
282	R	93.6	Very high	89.5	Confident	25 Å²	25	106 Å²	106	9%	0.094	52%	0.522	C	S	.	.	H	α-helix	trans	-55.4	-51.3	173.5	-174.1	-171.4	-58	156.9	7.9	112	L264 E267 F275 K278 R284 R285 L286	L264-R282 HydrophobicContact CD2-CG 3.61Å; E267-R282 IonicContact OE2-CZ 3.16Å; E267-R282 IonicContact OE2-NE 2.71Å; E267-R282 PolarHBondContact OE2-NE 3.28Å; E267-R282 IonicContact OE2-NH2 2.8Å; E267-R282 PolarHBondContact OE2-NH2 2.99Å; F275-R282 VanDerWaalsContact CD2-NH2 3.33Å; K278-R282 WeakPolarHBondContact O-CB 3.33Å; K278-R282 PolarHBondContact O-N 3.47Å; R282-R284 VanDerWaalsContact C-N 3.27Å; R282-R284 PolarHBondContact O-N 3.47Å; R282-R285 PolarHBondContact O-N 2.88Å; R282-R285 VanDerWaalsContact O-N 3.17Å; R282-L286 HydrophobicContact CG-CD1 3.97Å; R282-L286 HydrophobicContact CG-CG 4.46Å; R282-L286 WeakPolarHBondContact O-CG 2.99Å; R282-L286 PolarHBondContact O-N 3.04Å
283	K	90.4	Very high	89	Confident	146 Å²	146	103.3 Å²	103.3	64%	0.635	52%	0.519	S	S	*	.	H	α-helix	trans	-58.4	-38.6	179.7	-171.7	175.4	-178.9	176.5	0	112.2	H279 S281 F287	H279-K283 WeakPolarHBondContact O-CB 3.21Å; H279-K283 PolarHBondContact O-N 2.82Å; S281-K283 PolarHBondContact O-N 3.48Å; K283-F287 WeakPolarHBondContact O-CB 3.21Å; K283-F287 PolarHBondContact O-N 2.88Å; K283-F287 VanDerWaalsContact O-N 3.12Å
284	R	88.8	Confident	88.7	Confident	194 Å²	194	101.7 Å²	101.7	73%	0.732	52%	0.519	S	S	*	.	H	α-helix	trans	-67.6	-44.2	175.7	-74.8	179.2	-175.2	-110.1	2.6	112.5	K280 S281 R282 F287 C288	K280-R284 WeakPolarHBondContact O-CG 3.18Å; K280-R284 PolarHBondContact O-N 3.44Å; S281-R284 PolarHBondContact O-N 2.97Å; R282-R284 VanDerWaalsContact C-N 3.27Å; R282-R284 PolarHBondContact O-N 3.47Å; R284-F287 PolarHBondContact O-N 3.09Å; R284-C288 PolarHBondContact O-N 3.48Å; R284-C288 PolarHBondContact O-SG 2.91Å
285	R	91.6	Very high	88.4	Confident	78 Å²	78	107 Å²	107	29%	0.294	55%	0.545	S	S	.	.	H	α-helix	trans	-63.1	-45.7	179.2	-66.5	-169.8	-45.4	-101.4	2.1	112	E260 E267 S281 R282 F287 C288	E260-R285 IonicContact OE1-CZ 2.65Å; E260-R285 IonicContact OE1-NE 3.49Å; E260-R285 PolarHBondContact OE1-NE 2.91Å; E260-R285 IonicContact OE1-NH2 3.31Å; E260-R285 PolarHBondContact OE1-NH2 3.19Å; E260-R285 VanDerWaalsContact OE1-NH2 3.16Å; E260-R285 IonicContact OE2-NE 3.46Å; E267-R285 IonicContact OE1-CZ 2.71Å; E267-R285 IonicContact OE1-NH1 3.57Å; E267-R285 IonicContact OE1-NH2 2.74Å; E267-R285 PolarHBondContact OE1-NH2 2.9Å; E267-R285 IonicContact OE2-NH2 3.8Å; S281-R285 WeakPolarHBondContact O-CG 3.34Å; S281-R285 PolarHBondContact O-N 2.78Å; R282-R285 PolarHBondContact O-N 2.88Å; R282-R285 VanDerWaalsContact O-N 3.17Å; R285-F287 VanDerWaalsContact C-N 3.29Å; R285-F287 PolarHBondContact O-N 3.39Å; R285-C288 PolarHBondContact O-N 3.4Å
286	L	87.8	Confident	88	Confident	72 Å²	72	109.3 Å²	109.3	38%	0.377	56%	0.556	S	S	.	*	H	α-helix	trans	-62.8	-35.1	176.9	-73.1	175.6	0	0	0	112.7	L264 R282 C288 T289	L264-L286 HydrophobicContact CD1-CD2 3.7Å; L264-L286 HydrophobicContact CD2-CD1 4.22Å; L264-L286 HydrophobicContact CD2-CD2 4.41Å; R282-L286 HydrophobicContact CG-CD1 3.97Å; R282-L286 HydrophobicContact CG-CG 4.46Å; R282-L286 WeakPolarHBondContact O-CG 2.99Å; R282-L286 PolarHBondContact O-N 3.04Å; L286-C288 PolarHBondContact O-N 3.42Å; L286-T289 PolarHBondContact O-N 3.23Å; L286-T289 PolarHBondContact O-OG1 3.34Å
287	F	86.3	Confident	87.8	Confident	181 Å²	181	109.6 Å²	109.6	79%	0.794	57%	0.565	S	S	*	*	H	α-helix	trans	-69.1	-23.7	175.5	-173.1	-95.7	0	0	0	112.8	K283 R284 R285	K283-F287 WeakPolarHBondContact O-CB 3.21Å; K283-F287 PolarHBondContact O-N 2.88Å; K283-F287 VanDerWaalsContact O-N 3.12Å; R284-F287 PolarHBondContact O-N 3.09Å; R285-F287 VanDerWaalsContact C-N 3.29Å; R285-F287 PolarHBondContact O-N 3.39Å
288	C	81.4	Confident	87.5	Confident	96 Å²	96	105 Å²	105	65%	0.649	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	4.5	-179.8	-64.7	0	0	0	0	113.9	R284 R285 L286	R284-C288 PolarHBondContact O-N 3.48Å; R284-C288 PolarHBondContact O-SG 2.91Å; R285-C288 PolarHBondContact O-N 3.4Å; L286-C288 PolarHBondContact O-N 3.42Å
289	T	85.2	Confident	87.4	Confident	55 Å²	55	104.1 Å²	104.1	34%	0.337	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-69.1	137.9	174.1	53.8	0	0	0	0	110.1	L257 L286	L257-T289 HydrophobicContact CD2-CG2 3.83Å; L286-T289 PolarHBondContact O-N 3.23Å; L286-T289 PolarHBondContact O-OG1 3.34Å
290	V	84.9	Confident	87.6	Confident	93 Å²	93	106.5 Å²	106.5	56%	0.564	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-91.9	132.9	-175.8	-172.7	0	0	0	0	109.5
291	E	85.6	Confident	87.9	Confident	153 Å²	153	101.6 Å²	101.6	72%	0.715	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-80.2	142.6	170.4	-68.9	-62.3	149.3	0	0	110.7	A293	E291-A293 PolarHBondContact O-N 3.5Å
292	P	84.5	Confident	88	Confident	84 Å²	84	102.4 Å²	102.4	55%	0.545	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-64.8	131	179.2	25.2	-31.4	0	0	0	110.8	L250	L250-P292 HydrophobicContact CD2-CB 4.31Å
293	A	84	Confident	88	Confident	81 Å²	81	104.1 Å²	104.1	67%	0.669	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-66.7	145.7	175.3	0	0	0	0	0	111	E291	E291-A293 PolarHBondContact O-N 3.5Å
294	P	86.3	Confident	88.2	Confident	104 Å²	104	101.4 Å²	101.4	68%	0.675	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-65.1	153.9	177.2	27.3	-34.1	0	0	0	111.8	Q296	P294-Q296 PolarHBondContact O-N 3.08Å; P294-Q296 PolarHBondContact O-NE2 2.93Å
295	L	86.6	Confident	88.4	Confident	156 Å²	156	97.3 Å²	97.3	82%	0.817	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-56.9	129.2	177.1	-165.8	84.5	0	0	0	110.3	L299	L295-L299 HydrophobicContact CD1-CD1 3.97Å; L295-L299 HydrophobicContact CG-CD1 4.1Å
296	Q	85.6	Confident	88.5	Confident	113 Å²	113	94.8 Å²	94.8	53%	0.528	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-81.8	138.9	-179.7	-60.2	-61	-59.4	0	0	110.8	P294 L299	P294-Q296 PolarHBondContact O-N 3.08Å; P294-Q296 PolarHBondContact O-NE2 2.93Å; Q296-L299 WeakPolarHBondContact O-CD1 3.33Å; Q296-L299 WeakPolarHBondContact O-CG 3.42Å
297	P	87.3	Confident	88.9	Confident	122 Å²	122	97.3 Å²	97.3	79%	0.792	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	157.7	171.1	-22.3	33.2	0	0	0	112.9
298	G	85.9	Confident	89.3	Confident	59 Å²	59	93.4 Å²	93.4	61%	0.608	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	8.7	171.6	0	0	0	0	0	116.2	K239 L300	K239-G298 WeakPolarHBondContact CE-O 3.47Å; K239-G298 PolarHBondContact NZ-O 2.91Å; G298-L300 VanDerWaalsContact C-N 3.35Å
299	L	90.9	Very high	89.9	Confident	46 Å²	46	92 Å²	92	24%	0.241	54%	0.539	C	S	.	.			trans	-74.4	-21.8	177.9	-66.4	171.7	0	0	0	113.9	L242 V243 L295 Q296	L242-L299 HydrophobicContact CD2-CD2 3.82Å; L242-L299 HydrophobicContact CG-CD2 4.34Å; V243-L299 HydrophobicContact CG2-CD2 4.16Å; L295-L299 HydrophobicContact CD1-CD1 3.97Å; L295-L299 HydrophobicContact CG-CD1 4.1Å; Q296-L299 WeakPolarHBondContact O-CD1 3.33Å; Q296-L299 WeakPolarHBondContact O-CG 3.42Å
300	L	93.6	Very high	90.4	Very high	152 Å²	152	92 Å²	92	80%	0.796	54%	0.537	S	S	*	.	S	Bend	trans	-83.7	152.2	177.9	-61.4	179.9	0	0	0	111.3	K239 G298	K239-L300 PolarHBondContact NZ-O 3.26Å; G298-L300 VanDerWaalsContact C-N 3.35Å
301	M	95.6	Very high	90.8	Very high	68 Å²	68	96 Å²	96	34%	0.335	55%	0.55	S	S	.	.			trans	-60.3	135.9	171.8	-71.4	-59.4	-62.7	0	0	111.1	M232 E235 S236 K239 A303 Y306	M232-M301 HydrophobicContact CE-CE 3.92Å; M232-M301 HydrophobicContact CG-CE 3.75Å; M232-M301 HydrophobicContact SD-CE 3.99Å; E235-M301 HydrophobicContact CB-CE 4.22Å; E235-M301 HydrophobicContact CG-CE 4.12Å; E235-M301 HydrophobicContact CG-SD 4.05Å; S236-M301 VanDerWaalsContact CA-SD 3.59Å; K239-M301 HydrophobicContact CD-SD 4.29Å; M301-A303 PolarHBondContact O-N 3.38Å; M301-Y306 HydrophobicContact CE-CE2 4.05Å
302	D	91.9	Very high	91.2	Very high	72 Å²	72	92.4 Å²	92.4	39%	0.385	53%	0.53	S	S	.	.			trans	-87.5	87.9	177	-174.1	-12.8	0	0	0	110.5	E235 C304 K305 Y306	E235-D302 PolarHBondContact OE1-N 3.19Å; D302-C304 PolarHBondContact O-N 3.47Å; D302-C304 PolarHBondContact OD1-N 3.12Å; D302-C304 VanDerWaalsContact OD1-N 3.16Å; D302-K305 HydrophobicContact CB-CB 3.91Å; D302-K305 HydrophobicContact CB-CD 4.38Å; D302-K305 PolarHBondContact O-N 3.12Å; D302-K305 PolarHBondContact OD1-N 3.29Å; D302-K305 WeakPolarHBondContact OD2-CB 3.28Å; D302-Y306 WeakPolarHBondContact O-CD2 3.31Å
303	A	93.9	Very high	91.7	Very high	61 Å²	61	93 Å²	93	50%	0.504	52%	0.521	S	S	.	.	H	α-helix	trans	-61	-34.2	179.6	0	0	0	0	0	112.6	M301 Y306 L307	M301-A303 PolarHBondContact O-N 3.38Å; A303-Y306 PolarHBondContact O-N 3.49Å; A303-L307 WeakPolarHBondContact O-CB 3.32Å; A303-L307 PolarHBondContact O-N 2.76Å
304	C	93.8	Very high	92.2	Very high	90 Å²	90	90.2 Å²	90.2	61%	0.608	50%	0.496	S	S	*	.	H	α-helix	trans	-65.5	-45.1	-179.2	-64.9	0	0	0	0	110.5	D302 Y306 L307 D308	D302-C304 PolarHBondContact O-N 3.47Å; D302-C304 PolarHBondContact OD1-N 3.12Å; D302-C304 VanDerWaalsContact OD1-N 3.16Å; C304-Y306 PolarHBondContact O-N 3.46Å; C304-L307 PolarHBondContact O-N 3.32Å; C304-D308 WeakPolarHBondContact O-CA 3.44Å; C304-D308 WeakPolarHBondContact O-CB 3.28Å; C304-D308 PolarHBondContact O-N 3.34Å
305	K	93.3	Very high	92.6	Very high	108 Å²	108	90.8 Å²	90.8	47%	0.47	49%	0.485	S	S	.	.	H	α-helix	trans	-51.4	-34.9	175.7	173.5	-176	173.5	-169	0	114.2	E235 D302	E235-K305 IonicContact OE2-NZ 3.77Å; E235-K305 PolarHBondContact OE2-NZ 2.91Å; D302-K305 HydrophobicContact CB-CB 3.91Å; D302-K305 HydrophobicContact CB-CD 4.38Å; D302-K305 PolarHBondContact O-N 3.12Å; D302-K305 PolarHBondContact OD1-N 3.29Å; D302-K305 WeakPolarHBondContact OD2-CB 3.28Å
306	Y	95	Very high	92.8	Very high	25 Å²	25	87.8 Å²	87.8	10%	0.098	47%	0.466	C	S	.	.	H	α-helix	trans	-94.4	-39.3	-176.9	-62.8	-71.9	0	0	0	113.4	T228 A231 M232 E235 M301 D302 A303 C304 R313	T228-Y306 HydrophobicContact CG2-CD1 4.28Å; A231-Y306 HydrophobicContact CB-CE1 4.23Å; A231-Y306 PolarHBondContact O-OH 3.27Å; A231-Y306 VanDerWaalsContact O-OH 3.08Å; M232-Y306 WeakPolarHBondContact CA-OH 3.36Å; M232-Y306 HydrophobicContact CB-CD1 4.07Å; M232-Y306 HydrophobicContact CB-CE1 3.79Å; M232-Y306 HydrophobicContact CB-CE2 4.29Å; M232-Y306 HydrophobicContact CB-CG 4.42Å; M232-Y306 HydrophobicContact CG-CD2 4.29Å; M232-Y306 HydrophobicContact CG-CE2 4.24Å; E235-Y306 WeakPolarHBondContact CB-OH 3.49Å; E235-Y306 PolarHBondContact OE2-OH 3.37Å; M301-Y306 HydrophobicContact CE-CE2 4.05Å; D302-Y306 WeakPolarHBondContact O-CD2 3.31Å; A303-Y306 PolarHBondContact O-N 3.49Å; C304-Y306 PolarHBondContact O-N 3.46Å; Y306-R313 PolarHBondContact O-NH2 2.7Å
307	L	95.5	Very high	93.2	Very high	124 Å²	124	87.7 Å²	87.7	65%	0.649	46%	0.463	S	S	*	.	H	α-helix	trans	-96.7	-21.3	-173.6	-67.2	176	0	0	0	114.2	A303 C304 S309 L310	A303-L307 WeakPolarHBondContact O-CB 3.32Å; A303-L307 PolarHBondContact O-N 2.76Å; C304-L307 PolarHBondContact O-N 3.32Å; L307-S309 PolarHBondContact O-N 3.11Å; L307-S309 VanDerWaalsContact O-N 3.09Å; L307-L310 PolarHBondContact O-N 3.45Å
308	D	93.6	Very high	93.4	Very high	99 Å²	99	83.7 Å²	83.7	53%	0.529	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	120.5	-178	-178.8	23.8	0	0	0	110.2	C304 L310 R313	C304-D308 WeakPolarHBondContact O-CA 3.44Å; C304-D308 WeakPolarHBondContact O-CB 3.28Å; C304-D308 PolarHBondContact O-N 3.34Å; D308-L310 PolarHBondContact O-N 3.37Å; D308-R313 PolarHBondContact O-NE 3.07Å; D308-R313 PolarHBondContact O-NH2 3.38Å
309	S	94.7	Very high	93.6	Very high	66 Å²	66	83 Å²	83	46%	0.462	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.1	36.7	178.1	-56.3	0	0	0	0	113.1	L307 Q311 Y312 R313	L307-S309 PolarHBondContact O-N 3.11Å; L307-S309 VanDerWaalsContact O-N 3.09Å; S309-Q311 VanDerWaalsContact C-N 3.34Å; S309-Q311 PolarHBondContact O-N 3.16Å; S309-Y312 WeakPolarHBondContact O-CB 3.41Å; S309-Y312 PolarHBondContact O-N 2.73Å; S309-Y312 VanDerWaalsContact O-N 3.07Å; S309-R313 PolarHBondContact O-N 2.82Å
310	L	95.3	Very high	93.3	Very high	55 Å²	55	84.4 Å²	84.4	29%	0.288	44%	0.442	S	S	.	.	H	α-helix	trans	-57.2	-46.9	-168.8	174.8	61.7	0	0	0	111.8	T228 L307 D308 Y312 R313 V314	T228-L310 HydrophobicContact CG2-CD1 4.49Å; L307-L310 PolarHBondContact O-N 3.45Å; D308-L310 PolarHBondContact O-N 3.37Å; L310-Y312 VanDerWaalsContact C-N 3.32Å; L310-Y312 PolarHBondContact O-N 2.71Å; L310-R313 PolarHBondContact O-N 3.02Å; L310-V314 HydrophobicContact CD1-CG2 3.86Å; L310-V314 HydrophobicContact CG-CG2 4.43Å; L310-V314 VanDerWaalsContact O-CG2 3.32Å; L310-V314 WeakPolarHBondContact O-CG2 3.35Å; L310-V314 PolarHBondContact O-N 3.25Å
311	Q	94.8	Very high	92.8	Very high	177 Å²	177	81.2 Å²	81.2	83%	0.827	43%	0.432	S	S	*	.	H	α-helix	trans	-57.1	-46.3	177.6	-67.7	-179.5	-12.6	0	0	111.4	S309 W315	S309-Q311 VanDerWaalsContact C-N 3.34Å; S309-Q311 PolarHBondContact O-N 3.16Å; Q311-W315 VanDerWaalsContact O-CB 3.22Å; Q311-W315 WeakPolarHBondContact O-CB 3.47Å; Q311-W315 PolarHBondContact O-N 2.93Å
312	Y	93.4	Very high	92.4	Very high	79 Å²	79	81.1 Å²	81.1	31%	0.31	44%	0.436	S	S	.	.	H	α-helix	trans	-64.4	-46	178.4	179	-109.8	0	0	0	112.1	S309 L310 V314 W315 K316 E520	S309-Y312 WeakPolarHBondContact O-CB 3.41Å; S309-Y312 PolarHBondContact O-N 2.73Å; S309-Y312 VanDerWaalsContact O-N 3.07Å; L310-Y312 VanDerWaalsContact C-N 3.32Å; L310-Y312 PolarHBondContact O-N 2.71Å; Y312-V314 PolarHBondContact O-N 2.69Å; Y312-W315 AromaticContact CD2-CE3 3.83Å; Y312-W315 HydrophobicContact CD2-CE3 3.83Å; Y312-W315 HydrophobicContact CD2-CZ3 4.06Å; Y312-W315 AromaticContact CE2-CE3 3.82Å; Y312-W315 HydrophobicContact CE2-CE3 3.82Å; Y312-W315 AromaticContact CE2-CZ3 3.58Å; Y312-W315 HydrophobicContact CE2-CZ3 3.58Å; Y312-W315 PolarHBondContact O-N 3.07Å; Y312-K316 HydrophobicContact CE1-CD 3.92Å; Y312-K316 VanDerWaalsContact O-CB 3.23Å; Y312-K316 WeakPolarHBondContact O-CB 3.2Å; Y312-K316 PolarHBondContact O-N 3.37Å; Y312-E520 PolarHBondContact OH-OE1 2.85Å
313	R	93.8	Very high	92.2	Very high	95 Å²	95	84.3 Å²	84.3	36%	0.358	45%	0.448	S	S	.	.	H	α-helix	trans	-61.3	-44	178.6	-72	-170.5	-67.2	127.7	0.8	112.1	Y306 D308 S309 L310 K317	Y306-R313 PolarHBondContact O-NH2 2.7Å; D308-R313 PolarHBondContact O-NE 3.07Å; D308-R313 PolarHBondContact O-NH2 3.38Å; S309-R313 PolarHBondContact O-N 2.82Å; L310-R313 PolarHBondContact O-N 3.02Å; R313-K317 WeakPolarHBondContact O-CG 3.37Å; R313-K317 PolarHBondContact O-N 3.28Å; R313-K317 VanDerWaalsContact O-N 3.08Å
314	V	95.6	Very high	92	Very high	23 Å²	23	83.7 Å²	83.7	14%	0.139	44%	0.44	C	S	.	.	H	α-helix	trans	-65.9	-46.6	177.6	174.1	0	0	0	0	110.5	F220 L221 E224 L310 Y312 K316 K317 M318	F220-V314 HydrophobicContact CE1-CG1 4.22Å; L221-V314 HydrophobicContact CD2-CG1 3.67Å; E224-V314 HydrophobicContact CB-CG1 4.39Å; L310-V314 HydrophobicContact CD1-CG2 3.86Å; L310-V314 HydrophobicContact CG-CG2 4.43Å; L310-V314 VanDerWaalsContact O-CG2 3.32Å; L310-V314 WeakPolarHBondContact O-CG2 3.35Å; L310-V314 PolarHBondContact O-N 3.25Å; Y312-V314 PolarHBondContact O-N 2.69Å; V314-K316 PolarHBondContact O-N 3.21Å; V314-K317 PolarHBondContact O-N 2.93Å; V314-M318 WeakPolarHBondContact O-CB 3.22Å; V314-M318 PolarHBondContact O-N 3.42Å
315	W	93.6	Very high	91.9	Very high	116 Å²	116	80.9 Å²	80.9	44%	0.439	42%	0.42	S	S	.	.	H	α-helix	trans	-59.8	-43.7	176.2	171.4	82.2	0	0	0	112.5	Q311 Y312 K317 M318 L319 I518	Q311-W315 VanDerWaalsContact O-CB 3.22Å; Q311-W315 WeakPolarHBondContact O-CB 3.47Å; Q311-W315 PolarHBondContact O-N 2.93Å; Y312-W315 AromaticContact CD2-CE3 3.83Å; Y312-W315 HydrophobicContact CD2-CE3 3.83Å; Y312-W315 HydrophobicContact CD2-CZ3 4.06Å; Y312-W315 AromaticContact CE2-CE3 3.82Å; Y312-W315 HydrophobicContact CE2-CE3 3.82Å; Y312-W315 AromaticContact CE2-CZ3 3.58Å; Y312-W315 HydrophobicContact CE2-CZ3 3.58Å; Y312-W315 PolarHBondContact O-N 3.07Å; W315-K317 VanDerWaalsContact C-N 3.33Å; W315-K317 PolarHBondContact O-N 3.24Å; W315-M318 WeakPolarHBondContact O-CB 3.46Å; W315-M318 PolarHBondContact O-N 3.43Å; W315-M318 VanDerWaalsContact O-N 3.12Å; W315-L319 PolarHBondContact O-N 3.16Å; W315-I518 HydrophobicContact CE3-CD1 4.41Å; W315-I518 HydrophobicContact CH2-CD1 3.66Å; W315-I518 HydrophobicContact CH2-CG1 3.99Å; W315-I518 HydrophobicContact CZ3-CD1 3.44Å; W315-I518 VanDerWaalsContact CZ3-CD1 3.44Å; W315-I518 HydrophobicContact CZ3-CG1 4.22Å
316	K	92.3	Very high	92	Very high	94 Å²	94	77 Å²	77	41%	0.409	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-37.9	177.9	-173.4	170.1	-170.8	167.1	0	112.1	Y312 V314 L319 I518 E520	Y312-K316 HydrophobicContact CE1-CD 3.92Å; Y312-K316 VanDerWaalsContact O-CB 3.23Å; Y312-K316 WeakPolarHBondContact O-CB 3.2Å; Y312-K316 PolarHBondContact O-N 3.37Å; V314-K316 PolarHBondContact O-N 3.21Å; K316-L319 WeakPolarHBondContact O-CB 3.21Å; K316-I518 HydrophobicContact CD-CD1 4.47Å; K316-I518 HydrophobicContact CG-CD1 3.98Å; K316-E520 IonicContact NZ-OE1 3.75Å; K316-E520 PolarHBondContact NZ-OE1 2.83Å
317	K	92.5	Very high	92	Very high	111 Å²	111	76 Å²	76	48%	0.483	40%	0.402	S	S	.	.	H	α-helix	trans	-66.5	-43.5	171.1	-72.5	-178.8	-179.5	-174.1	0	111.8	F220 E224 R313 V314 W315 L319 G320	F220-K317 HydrophobicContact CZ-CB 3.9Å; E224-K317 IonicContact OE1-NZ 2.99Å; E224-K317 PolarHBondContact OE1-NZ 2.92Å; E224-K317 WeakPolarHBondContact OE2-CD 3.32Å; E224-K317 IonicContact OE2-NZ 3.8Å; E224-K317 PolarHBondContact OE2-NZ 3.23Å; R313-K317 WeakPolarHBondContact O-CG 3.37Å; R313-K317 PolarHBondContact O-N 3.28Å; R313-K317 VanDerWaalsContact O-N 3.08Å; V314-K317 PolarHBondContact O-N 2.93Å; W315-K317 VanDerWaalsContact C-N 3.33Å; W315-K317 PolarHBondContact O-N 3.24Å; K317-L319 PolarHBondContact O-N 2.9Å; K317-G320 PolarHBondContact O-N 3.28Å
318	M	92.3	Very high	92	Very high	37 Å²	37	71.8 Å²	71.8	18%	0.182	38%	0.383	C	S	.	.	H	α-helix	trans	-57.9	-36.8	179.1	-169.5	176.1	62.5	0	0	111.5	L217 F220 V314 W315 G320 S321 V322	L217-M318 HydrophobicContact CD2-CG 4.36Å; L217-M318 HydrophobicContact CD2-SD 4.15Å; F220-M318 HydrophobicContact CD1-CB 3.91Å; F220-M318 HydrophobicContact CD1-CG 3.77Å; F220-M318 HydrophobicContact CD1-SD 4.26Å; F220-M318 HydrophobicContact CE1-CB 3.45Å; F220-M318 VanDerWaalsContact CE1-CB 3.45Å; F220-M318 HydrophobicContact CE1-CG 3.88Å; F220-M318 HydrophobicContact CG-CG 4.37Å; F220-M318 VanDerWaalsContact CZ-CA 3.47Å; F220-M318 HydrophobicContact CZ-CB 3.91Å; V314-M318 WeakPolarHBondContact O-CB 3.22Å; V314-M318 PolarHBondContact O-N 3.42Å; W315-M318 WeakPolarHBondContact O-CB 3.46Å; W315-M318 PolarHBondContact O-N 3.43Å; W315-M318 VanDerWaalsContact O-N 3.12Å; M318-G320 PolarHBondContact O-N 3.41Å; M318-S321 WeakPolarHBondContact O-CA 3.12Å; M318-S321 PolarHBondContact O-N 3.46Å; M318-V322 HydrophobicContact CG-CG2 4.42Å; M318-V322 WeakPolarHBondContact O-CG2 3.35Å; M318-V322 PolarHBondContact O-N 2.85Å
319	L	89.7	Confident	92.2	Very high	46 Å²	46	67.1 Å²	67.1	24%	0.241	36%	0.358	C	S	.	.	H	α-helix	trans	-56.1	-34.8	175.9	-174.2	63.9	0	0	0	112.6	W315 K316 K317 S321 V322 V516 I518	W315-L319 PolarHBondContact O-N 3.16Å; K316-L319 WeakPolarHBondContact O-CB 3.21Å; K317-L319 PolarHBondContact O-N 2.9Å; L319-S321 PolarHBondContact O-N 3.41Å; L319-V322 PolarHBondContact O-N 2.91Å; L319-V516 HydrophobicContact CD1-CB 4.27Å; L319-V516 HydrophobicContact CD1-CG1 4.04Å; L319-V516 HydrophobicContact CD2-CB 4.39Å; L319-V516 HydrophobicContact CD2-CG1 3.97Å; L319-V516 HydrophobicContact CG-CG1 4.46Å; L319-I518 HydrophobicContact CD2-CD1 3.51Å; L319-I518 HydrophobicContact CD2-CG1 3.73Å
320	G	84.9	Confident	92.2	Very high	75 Å²	75	65.1 Å²	65.1	77%	0.773	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-14	175.9	0	0	0	0	0	114.4	K317 M318	K317-G320 PolarHBondContact O-N 3.28Å; M318-G320 PolarHBondContact O-N 3.41Å
321	S	84.4	Confident	92	Very high	84 Å²	84	65.1 Å²	65.1	59%	0.587	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-3.4	176.8	-56.5	0	0	0	0	113.2	M318 L319	M318-S321 WeakPolarHBondContact O-CA 3.12Å; M318-S321 PolarHBondContact O-N 3.46Å; L319-S321 PolarHBondContact O-N 3.41Å
322	V	86.4	Confident	91.9	Very high	67 Å²	67	60.4 Å²	60.4	41%	0.406	33%	0.326	S	S	.	.			trans	-102.3	122	179.6	176.6	0	0	0	0	109.4	L217 M318 L319	L217-V322 HydrophobicContact CD2-CG2 3.98Å; M318-V322 HydrophobicContact CG-CG2 4.42Å; M318-V322 WeakPolarHBondContact O-CG2 3.35Å; M318-V322 PolarHBondContact O-N 2.85Å; L319-V322 PolarHBondContact O-N 2.91Å
323	E	87.1	Confident	91.8	Very high	139 Å²	139	56.6 Å²	56.6	65%	0.65	31%	0.311	S	S	*	.			trans	-85.2	131.7	171.8	-72.3	173.5	-175.2	0	0	109.7	H513	E323-H513 IonicContact OE2-CE1 2.75Å; E323-H513 PolarHBondContact OE2-CE1 3.11Å; E323-H513 IonicContact OE2-NE2 3.29Å
324	S	90.3	Very high	91.7	Very high	48 Å²	48	52.2 Å²	52.2	34%	0.336	30%	0.295	S	S	.	.			trans	-123.3	140.4	177.1	-178.2	0	0	0	0	109.4	H513 L514	S324-H513 CarbonylContact O-C 3.5Å; S324-H513 WeakPolarHBondContact O-CA 3.28Å; S324-H513 WeakPolarHBondContact O-CB 3.31Å; S324-L514 PolarHBondContact O-N 3.41Å
325	V	92.7	Very high	91.3	Very high	31 Å²	31	51.1 Å²	51.1	19%	0.188	29%	0.288	C	S	.	.			trans	-124.6	151.8	175.2	-70.1	0	0	0	0	109.2	F327 T345 I511	V325-F327 VanDerWaalsContact C-N 3.25Å; V325-F327 VanDerWaalsContact CG2-O 3.28Å; V325-F327 WeakPolarHBondContact CG2-O 3.27Å; V325-F327 PolarHBondContact O-N 2.96Å; V325-T345 HydrophobicContact CG1-CG2 3.7Å; V325-T345 HydrophobicContact CG2-CG2 4.16Å; V325-I511 HydrophobicContact CB-CG2 4.23Å; V325-I511 HydrophobicContact CG1-CG2 4.34Å
326	P	93.8	Very high	91	Very high	25 Å²	25	46.1 Å²	46.1	16%	0.162	27%	0.272	C	S	.	.	S	Bend	trans	-64.5	-32.1	-178.9	23.5	-31.1	0	0	0	112.6	Q372 W381 I511 L514	P326-Q372 PolarHBondContact O-NE2 3.08Å; P326-Q372 VanDerWaalsContact O-NE2 3.15Å; P326-W381 HydrophobicContact CB-CB 4.22Å; P326-W381 HydrophobicContact CG-CB 3.5Å; P326-I511 HydrophobicContact CG-CG2 4.02Å; P326-L514 HydrophobicContact CB-CD1 4.41Å; P326-L514 HydrophobicContact CB-CD2 4.19Å; P326-L514 HydrophobicContact CG-CD2 4.25Å
327	F	95.8	Very high	90.6	Very high	5 Å²	5	45 Å²	45	2%	0.022	27%	0.266	C	S	.	.			trans	-159.5	171.7	173.4	54.1	-94.4	0	0	0	109.3	V325 Q372 F374 W381 P493 F495 I511	V325-F327 VanDerWaalsContact C-N 3.25Å; V325-F327 VanDerWaalsContact CG2-O 3.28Å; V325-F327 WeakPolarHBondContact CG2-O 3.27Å; V325-F327 PolarHBondContact O-N 2.96Å; F327-Q372 HydrophobicContact CB-CB 4.04Å; F327-Q372 HydrophobicContact CB-CG 3.76Å; F327-F374 HydrophobicContact CD1-CE2 4.34Å; F327-F374 AromaticContact CD1-CZ 3.96Å; F327-F374 HydrophobicContact CD1-CZ 3.96Å; F327-F374 HydrophobicContact CE1-CE2 4.43Å; F327-F374 HydrophobicContact CE1-CZ 4.4Å; F327-W381 HydrophobicContact CE1-CB 3.9Å; F327-W381 AromaticContact CE1-CD1 3.9Å; F327-W381 AromaticContact CE1-CD2 3.61Å; F327-W381 HydrophobicContact CE1-CD2 3.61Å; F327-W381 HydrophobicContact CE1-CE3 4.07Å; F327-W381 AromaticContact CE1-CG 3.54Å; F327-W381 HydrophobicContact CE1-CG 3.54Å; F327-W381 HydrophobicContact CZ-CB 4.43Å; F327-W381 AromaticContact CZ-CD1 3.67Å; F327-W381 HydrophobicContact CZ-CD2 4.04Å; F327-W381 AromaticContact CZ-CG 3.82Å; F327-W381 HydrophobicContact CZ-CG 3.82Å; F327-W381 AromaticContact CZ-NE1 3.79Å; F327-P493 HydrophobicContact CD1-CG 4.02Å; F327-P493 HydrophobicContact CD2-CB 4.41Å; F327-P493 HydrophobicContact CD2-CG 4.05Å; F327-P493 HydrophobicContact CE1-CB 4.25Å; F327-P493 HydrophobicContact CE1-CG 3.61Å; F327-P493 HydrophobicContact CE2-CB 3.64Å; F327-P493 HydrophobicContact CE2-CG 3.65Å; F327-P493 HydrophobicContact CG-CG 4.24Å; F327-P493 HydrophobicContact CZ-CB 3.55Å; F327-P493 HydrophobicContact CZ-CG 3.42Å; F327-P493 VanDerWaalsContact CZ-CG 3.42Å; F327-F495 AromaticContact CE2-CE2 3.86Å; F327-F495 HydrophobicContact CE2-CE2 3.86Å; F327-F495 AromaticContact CE2-CZ 3.74Å; F327-F495 HydrophobicContact CE2-CZ 3.74Å; F327-F495 HydrophobicContact CZ-CE2 4.39Å; F327-F495 AromaticContact CZ-CZ 3.89Å; F327-F495 HydrophobicContact CZ-CZ 3.89Å; F327-I511 HydrophobicContact CD2-CD1 3.67Å; F327-I511 HydrophobicContact CE2-CD1 3.43Å; F327-I511 VanDerWaalsContact CE2-CD1 3.43Å; F327-I511 HydrophobicContact CE2-CG1 4.21Å; F327-I511 HydrophobicContact CZ-CD1 4.33Å; F327-I511 WeakPolarHBondContact O-CD1 3.49Å
328	S	96.1	Very high	90.4	Very high	35 Å²	35	40.1 Å²	40.1	25%	0.245	25%	0.245	C	C	.	.			trans	-106	160.5	177.2	-58.3	0	0	0	0	110.7	G370 S371	S328-G370 CarbonylContact O-C 3.58Å; S328-G370 WeakPolarHBondContact O-CA 3.37Å; S328-S371 PolarHBondContact N-OG 3.12Å; S328-S371 VanDerWaalsContact N-OG 3.14Å; S328-S371 WeakPolarHBondContact O-CB 3.01Å; S328-S371 PolarHBondContact O-N 3.4Å; S328-S371 PolarHBondContact O-OG 3.29Å
329	L	96.8	Very high	90.3	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-78.2	137.8	168.4	-63.5	171.3	0	0	0	109.5	P331 V340 L344 V347 L368 F495 I511	L329-P331 VanDerWaalsContact O-CD 3.28Å; L329-P331 WeakPolarHBondContact O-CD 3.49Å; L329-V340 HydrophobicContact CB-CG1 3.95Å; L329-L344 PolarHBondContact N-O 2.91Å; L329-V347 HydrophobicContact CD1-CB 3.82Å; L329-V347 HydrophobicContact CD1-CG1 3.67Å; L329-L368 HydrophobicContact CB-CD1 3.91Å; L329-L368 HydrophobicContact CD1-CD1 4.21Å; L329-L368 HydrophobicContact CD2-CD1 4Å; L329-L368 HydrophobicContact CD2-CG 4.34Å; L329-L368 HydrophobicContact CG-CD1 4.26Å; L329-F495 HydrophobicContact CD2-CD2 3.62Å; L329-F495 HydrophobicContact CD2-CE2 3.63Å; L329-F495 HydrophobicContact CD2-CG 4.39Å; L329-F495 HydrophobicContact CD2-CZ 4.4Å; L329-I511 HydrophobicContact CD2-CD1 3.8Å; L329-I511 HydrophobicContact CD2-CG1 4.34Å; L329-I511 HydrophobicContact CG-CD1 3.74Å; L329-I511 HydrophobicContact CG-CG1 4.39Å
330	D	94.7	Very high	90.5	Very high	24 Å²	24	42.4 Å²	42.4	13%	0.128	25%	0.254	C	S	.	.			trans	-94.2	107.4	-176.7	-176.5	-9.8	0	0	0	111.6	N332 T333 A334 L369 R492	D330-N332 PolarHBondContact O-N 3.12Å; D330-N332 WeakPolarHBondContact OD1-CB 3.41Å; D330-N332 PolarHBondContact OD1-N 2.84Å; D330-T333 HydrophobicContact CB-CG2 4.23Å; D330-T333 PolarHBondContact O-N 3.16Å; D330-T333 PolarHBondContact O-OG1 3.37Å; D330-T333 WeakPolarHBondContact OD2-CG2 3.38Å; D330-A334 PolarHBondContact O-N 3.46Å; D330-L369 WeakPolarHBondContact CB-O 3.44Å; D330-L369 PolarHBondContact N-O 2.9Å; D330-R492 IonicContact OD2-CZ 3.47Å; D330-R492 IonicContact OD2-NH1 3.27Å; D330-R492 IonicContact OD2-NH2 2.95Å; D330-R492 PolarHBondContact OD2-NH2 2.81Å
331	P	92.4	Very high	90.8	Very high	56 Å²	56	40.3 Å²	40.3	36%	0.364	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.1	-178.4	-19.4	34.3	0	0	0	114.3	L329 T333 A334 V340 L344 R361	L329-P331 VanDerWaalsContact O-CD 3.28Å; L329-P331 WeakPolarHBondContact O-CD 3.49Å; P331-T333 VanDerWaalsContact C-N 3.29Å; P331-A334 PolarHBondContact O-N 3.15Å; P331-V340 HydrophobicContact CB-CG2 4.39Å; P331-V340 HydrophobicContact CG-CB 4.31Å; P331-V340 HydrophobicContact CG-CG1 4.35Å; P331-V340 HydrophobicContact CG-CG2 4.38Å; P331-L344 HydrophobicContact CG-CD2 3.8Å; P331-R361 PolarHBondContact O-NH1 2.95Å
332	N	91.3	Very high	91.2	Very high	77 Å²	77	40 Å²	40	41%	0.412	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-27.7	178.9	-68.8	-24.3	0	0	0	111.7	D330 N358 R361	D330-N332 PolarHBondContact O-N 3.12Å; D330-N332 WeakPolarHBondContact OD1-CB 3.41Å; D330-N332 PolarHBondContact OD1-N 2.84Å; N332-N358 PolarHBondContact O-ND2 3.47Å; N332-R361 WeakPolarHBondContact O-CA 3.5Å
333	T	91.7	Very high	91.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-24	175.6	68.4	0	0	0	0	112.6	D330 P331 A335 E360 F362 L369	D330-T333 HydrophobicContact CB-CG2 4.23Å; D330-T333 PolarHBondContact O-N 3.16Å; D330-T333 PolarHBondContact O-OG1 3.37Å; D330-T333 WeakPolarHBondContact OD2-CG2 3.38Å; P331-T333 VanDerWaalsContact C-N 3.29Å; T333-A335 PolarHBondContact O-N 3.26Å; T333-E360 WeakPolarHBondContact CA-O 3.42Å; T333-F362 WeakPolarHBondContact O-CD2 3.45Å; T333-F362 PolarHBondContact O-N 3Å; T333-L369 HydrophobicContact CG2-CB 4.17Å; T333-L369 HydrophobicContact CG2-CD1 4.14Å; T333-L369 HydrophobicContact CG2-CG 4.19Å; T333-L369 PolarHBondContact OG1-N 3.39Å
334	A	90.9	Very high	91.7	Very high	3 Å²	3	35.8 Å²	35.8	3%	0.025	20%	0.2	C	C	.	.	S	Bend	trans	-62.6	130.8	-171.4	0	0	0	0	0	112.8	D330 P331 L338 V340 R361 L368	D330-A334 PolarHBondContact O-N 3.46Å; P331-A334 PolarHBondContact O-N 3.15Å; A334-L338 HydrophobicContact CB-CB 4.38Å; A334-V340 HydrophobicContact CB-CG2 4.13Å; A334-R361 VanDerWaalsContact O-CG 3.29Å; A334-R361 WeakPolarHBondContact O-CG 3.49Å; A334-R361 PolarHBondContact O-NH1 2.96Å; A334-L368 HydrophobicContact CB-CB 3.74Å; A334-L368 HydrophobicContact CB-CD1 4.17Å
335	A	88.9	Confident	92	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.			trans	-55.7	151.3	178.8	0	0	0	0	0	112.8	T333 W337 L338 F362 A365 C367	T333-A335 PolarHBondContact O-N 3.26Å; A335-W337 HydrophobicContact CB-CZ2 4.31Å; A335-W337 PolarHBondContact O-N 3.46Å; A335-L338 HydrophobicContact CB-CD1 4.23Å; A335-L338 HydrophobicContact CB-CG 4.23Å; A335-L338 WeakPolarHBondContact O-CB 3.49Å; A335-L338 PolarHBondContact O-N 3.26Å; A335-F362 VanDerWaalsContact CA-O 3.23Å; A335-F362 WeakPolarHBondContact CA-O 3.21Å; A335-F362 HydrophobicContact CB-CB 4.12Å; A335-F362 WeakPolarHBondContact CB-O 3.32Å; A335-A365 WeakPolarHBondContact CB-O 3.48Å; A335-C367 PolarHBondContact N-O 2.99Å
336	G	85.4	Confident	92.1	Very high	10 Å²	10	32.9 Å²	32.9	10%	0.103	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-11.3	-168.7	0	0	0	0	0	116.1	Y352 R353 V354	G336-Y352 CarbonylContact C-O 3.49Å; G336-Y352 CarbonylContact O-C 3.49Å; G336-R353 CarbonylContact O-C 3.55Å; G336-R353 WeakPolarHBondContact O-CA 3.38Å; G336-V354 WeakPolarHBondContact O-CG2 3.34Å; G336-V354 PolarHBondContact O-N 3.16Å
337	W	84.4	Confident	92.1	Very high	71 Å²	71	31.8 Å²	31.8	27%	0.269	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	5.3	177.8	45.1	75.9	0	0	0	114.2	A335 H350 G351 Y352 S363	A335-W337 HydrophobicContact CB-CZ2 4.31Å; A335-W337 PolarHBondContact O-N 3.46Å; W337-H350 PolarHBondContact O-N 3.26Å; W337-G351 PolarHBondContact O-N 2.92Å; W337-Y352 VanDerWaalsContact CA-O 3.29Å; W337-Y352 WeakPolarHBondContact CA-O 3.23Å; W337-S363 WeakPolarHBondContact CH2-O 3.29Å
338	L	89.6	Confident	91.9	Very high	9 Å²	9	33.3 Å²	33.3	5%	0.047	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	143	173.3	-61.8	-176	0	0	0	110.6	A334 A335 V347 N349 P366 L368 L497	A334-L338 HydrophobicContact CB-CB 4.38Å; A335-L338 HydrophobicContact CB-CD1 4.23Å; A335-L338 HydrophobicContact CB-CG 4.23Å; A335-L338 WeakPolarHBondContact O-CB 3.49Å; A335-L338 PolarHBondContact O-N 3.26Å; L338-V347 HydrophobicContact CB-CG2 3.94Å; L338-V347 HydrophobicContact CD1-CG2 4.34Å; L338-V347 HydrophobicContact CD2-CG2 4.45Å; L338-V347 HydrophobicContact CG-CG2 4.49Å; L338-N349 HydrophobicContact CD2-CB 3.84Å; L338-P366 HydrophobicContact CD2-CB 4.01Å; L338-P366 HydrophobicContact CG-CB 4.49Å; L338-L368 HydrophobicContact CD1-CB 4.27Å; L338-L368 HydrophobicContact CD1-CD2 3.9Å; L338-L497 HydrophobicContact CD2-CB 4.28Å
339	K	90.3	Very high	91.6	Very high	110 Å²	110	32.9 Å²	32.9	48%	0.478	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	113.2	172.8	-178.4	-178.6	178.2	-175.8	0	109.3	V347 I348	K339-V347 WeakPolarHBondContact O-CA 3.43Å; K339-I348 HydrophobicContact CB-CD1 4.5Å; K339-I348 HydrophobicContact CB-CG1 3.93Å; K339-I348 HydrophobicContact CD-CD1 4.37Å; K339-I348 PolarHBondContact N-O 2.92Å; K339-I348 PolarHBondContact O-N 3.44Å
340	V	92.4	Very high	90.5	Very high	21 Å²	21	38 Å²	38	13%	0.127	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	138.6	170.8	-174.3	0	0	0	0	108.5	L329 P331 A334 L344 S346 V347 L368	L329-V340 HydrophobicContact CB-CG1 3.95Å; P331-V340 HydrophobicContact CB-CG2 4.39Å; P331-V340 HydrophobicContact CG-CB 4.31Å; P331-V340 HydrophobicContact CG-CG1 4.35Å; P331-V340 HydrophobicContact CG-CG2 4.38Å; A334-V340 HydrophobicContact CB-CG2 4.13Å; V340-L344 HydrophobicContact CG1-CD2 3.96Å; V340-S346 CarbonylContact C-O 3.56Å; V340-S346 WeakPolarHBondContact CA-O 3.07Å; V340-V347 HydrophobicContact CG2-CG2 4.34Å; V340-L368 HydrophobicContact CG2-CD1 3.93Å
341	A	92.6	Very high	89.3	Confident	30 Å²	30	39.5 Å²	39.5	25%	0.248	22%	0.222	C	C	.	.			trans	-69.9	159.6	176.1	0	0	0	0	0	111.9	D343 L344 S346	A341-D343 VanDerWaalsContact CB-OD1 3.3Å; A341-D343 WeakPolarHBondContact CB-OD1 3.39Å; A341-D343 PolarHBondContact O-N 3.1Å; A341-L344 WeakPolarHBondContact O-CA 3.29Å; A341-L344 PolarHBondContact O-N 2.89Å; A341-S346 WeakPolarHBondContact CB-OG 3.38Å; A341-S346 PolarHBondContact N-O 3.27Å
342	D	91.2	Very high	88	Confident	78 Å²	78	43.1 Å²	43.1	42%	0.417	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.2	-175	-65.1	-1.2	0	0	0	114	W205 R209 L344	W205-D342 HydrophobicContact CZ2-CB 4.02Å; R209-D342 IonicContact NH1-OD2 3.67Å; D342-L344 VanDerWaalsContact C-N 3.27Å
343	D	91.1	Very high	86.7	Confident	61 Å²	61	49 Å²	49	33%	0.326	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.3	175.5	67.8	-10	0	0	0	112.9	A341 T345	A341-D343 VanDerWaalsContact CB-OD1 3.3Å; A341-D343 WeakPolarHBondContact CB-OD1 3.39Å; A341-D343 PolarHBondContact O-N 3.1Å; D343-T345 HydrophobicContact CB-CG2 4.17Å; D343-T345 WeakPolarHBondContact O-CG2 3.28Å; D343-T345 PolarHBondContact O-N 3.01Å; D343-T345 VanDerWaalsContact O-N 3.16Å; D343-T345 PolarHBondContact OD1-N 3.11Å; D343-T345 PolarHBondContact OD1-OG1 3Å; D343-T345 PolarHBondContact OD2-OG1 3.03Å
344	L	94.4	Very high	85.3	Confident	56 Å²	56	50.7 Å²	50.7	29%	0.293	26%	0.256	S	S	.	.	S	Bend	trans	59.6	17.2	-177.4	-48	176.3	0	0	0	114.3	L329 P331 V340 A341 D342	L329-L344 PolarHBondContact N-O 2.91Å; P331-L344 HydrophobicContact CG-CD2 3.8Å; V340-L344 HydrophobicContact CG1-CD2 3.96Å; A341-L344 WeakPolarHBondContact O-CA 3.29Å; A341-L344 PolarHBondContact O-N 2.89Å; D342-L344 VanDerWaalsContact C-N 3.27Å
345	T	95.6	Very high	83.9	Confident	7 Å²	7	58.4 Å²	58.4	4%	0.043	29%	0.291	C	S	.	.	S	Bend	trans	-97.5	-18.5	-177.9	74.4	0	0	0	0	112.9	V325 D343 R510 I511	V325-T345 HydrophobicContact CG1-CG2 3.7Å; V325-T345 HydrophobicContact CG2-CG2 4.16Å; D343-T345 HydrophobicContact CB-CG2 4.17Å; D343-T345 WeakPolarHBondContact O-CG2 3.28Å; D343-T345 PolarHBondContact O-N 3.01Å; D343-T345 VanDerWaalsContact O-N 3.16Å; D343-T345 PolarHBondContact OD1-N 3.11Å; D343-T345 PolarHBondContact OD1-OG1 3Å; D343-T345 PolarHBondContact OD2-OG1 3.03Å; T345-R510 WeakPolarHBondContact O-CA 3.47Å; T345-I511 PolarHBondContact O-N 3.46Å
346	S	95.1	Very high	83.6	Confident	12 Å²	12	59 Å²	59	8%	0.084	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	157.7	-175.8	59.5	0	0	0	0	113.3	V340 A341 L509	V340-S346 CarbonylContact C-O 3.56Å; V340-S346 WeakPolarHBondContact CA-O 3.07Å; A341-S346 WeakPolarHBondContact CB-OG 3.38Å; A341-S346 PolarHBondContact N-O 3.27Å; S346-L509 CarbonylContact C-O 3.55Å; S346-L509 WeakPolarHBondContact CA-O 3.4Å; S346-L509 WeakPolarHBondContact CB-O 3.38Å
347	V	93.9	Very high	83.4	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.006	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	139.5	-179	55.9	0	0	0	0	110.3	L329 L338 K339 V340 L368 L497 P508 L509	L329-V347 HydrophobicContact CD1-CB 3.82Å; L329-V347 HydrophobicContact CD1-CG1 3.67Å; L338-V347 HydrophobicContact CB-CG2 3.94Å; L338-V347 HydrophobicContact CD1-CG2 4.34Å; L338-V347 HydrophobicContact CD2-CG2 4.45Å; L338-V347 HydrophobicContact CG-CG2 4.49Å; K339-V347 WeakPolarHBondContact O-CA 3.43Å; V340-V347 HydrophobicContact CG2-CG2 4.34Å; V347-L368 HydrophobicContact CB-CD1 4.09Å; V347-L368 HydrophobicContact CG1-CD1 4.1Å; V347-L368 HydrophobicContact CG1-CD2 4.04Å; V347-L368 HydrophobicContact CG2-CD1 3.98Å; V347-L368 HydrophobicContact CG2-CD2 4.43Å; V347-L497 HydrophobicContact CG1-CD1 3.58Å; V347-L497 HydrophobicContact CG1-CD2 3.87Å; V347-L497 HydrophobicContact CG1-CG 4.38Å; V347-L497 HydrophobicContact CG2-CD1 4.42Å; V347-L497 WeakPolarHBondContact O-CD2 3.32Å; V347-P508 WeakPolarHBondContact O-CA 3.42Å; V347-L509 HydrophobicContact CG1-CB 4.11Å; V347-L509 HydrophobicContact CG1-CD2 4.32Å; V347-L509 PolarHBondContact N-O 3.24Å; V347-L509 PolarHBondContact O-N 3.21Å
348	I	91.8	Very high	83.4	Confident	37 Å²	37	62.6 Å²	62.6	19%	0.19	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.5	172.8	57.3	173.2	0	0	0	110.1	K339 H350 P506 P508	K339-I348 HydrophobicContact CB-CD1 4.5Å; K339-I348 HydrophobicContact CB-CG1 3.93Å; K339-I348 HydrophobicContact CD-CD1 4.37Å; K339-I348 PolarHBondContact N-O 2.92Å; K339-I348 PolarHBondContact O-N 3.44Å; I348-H350 HydrophobicContact CD1-CB 3.89Å; I348-H350 HydrophobicContact CG1-CB 4.08Å; I348-H350 PolarHBondContact O-N 2.95Å; I348-P506 HydrophobicContact CB-CB 4.38Å; I348-P506 HydrophobicContact CB-CG 4.41Å; I348-P506 HydrophobicContact CD1-CG 4.16Å; I348-P508 HydrophobicContact CG2-CB 3.65Å
349	N	88.2	Confident	83.2	Confident	26 Å²	26	67.5 Å²	67.5	14%	0.139	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	101.1	166.3	-172.9	-16.3	0	0	0	108.2	L338 L497 S499	L338-N349 HydrophobicContact CD2-CB 3.84Å; N349-L497 HydrophobicContact CB-CB 4.35Å; N349-L497 PolarHBondContact ND2-O 3.36Å; N349-S499 PolarHBondContact ND2-OG 2.88Å
350	H	75.1	Confident	83	Confident	108 Å²	108	66.9 Å²	66.9	50%	0.5	34%	0.344	S	S	.	.			trans	-116.4	6	-170.9	-165.1	20.1	0	0	0	113.2	W337 I348 Y352	W337-H350 PolarHBondContact O-N 3.26Å; I348-H350 HydrophobicContact CD1-CB 3.89Å; I348-H350 HydrophobicContact CG1-CB 4.08Å; I348-H350 PolarHBondContact O-N 2.95Å; H350-Y352 PolarHBondContact O-N 3.37Å
351	G	68.8	Low	82.8	Confident	57 Å²	57	66.9 Å²	66.9	59%	0.588	34%	0.342	S	S	*	.			trans	65.5	4.1	177.4	0	0	0	0	0	115.1	W337 R353	W337-G351 PolarHBondContact O-N 2.92Å; G351-R353 PolarHBondContact O-N 3.42Å
352	Y	66	Low	82.5	Confident	132 Å²	132	65.9 Å²	65.9	52%	0.518	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-73.7	121	176.8	175	-94.3	0	0	0	109.9	G336 W337 H350	G336-Y352 CarbonylContact C-O 3.49Å; G336-Y352 CarbonylContact O-C 3.49Å; W337-Y352 VanDerWaalsContact CA-O 3.29Å; W337-Y352 WeakPolarHBondContact CA-O 3.23Å; H350-Y352 PolarHBondContact O-N 3.37Å
353	R	62.8	Low	82	Confident	201 Å²	201	65.6 Å²	65.6	76%	0.758	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-80.5	124.5	175.9	-88.2	-176	173.6	-174.8	-2.9	112.5	G336 G351	G336-R353 CarbonylContact O-C 3.55Å; G336-R353 WeakPolarHBondContact O-CA 3.38Å; G351-R353 PolarHBondContact O-N 3.42Å
354	V	63.2	Low	81.5	Confident	35 Å²	35	66.7 Å²	66.7	21%	0.212	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-57.9	144.5	170.4	179.9	0	0	0	0	111.2	G336 V356	G336-V354 WeakPolarHBondContact O-CG2 3.34Å; G336-V354 PolarHBondContact O-N 3.16Å; V354-V356 WeakPolarHBondContact CG1-O 3.42Å
355	Q	60.9	Low	80.9	Confident	164 Å²	164	64.4 Å²	64.4	77%	0.766	34%	0.337	S	S	*	.	S	Bend	trans	-82.3	-17.5	-177.4	-71.7	-177.6	-12.2	0	0	114.3
356	V	82.4	Confident	80.6	Confident	13 Å²	13	64.7 Å²	64.7	8%	0.079	34%	0.339	C	S	.	.			trans	-133.6	126.5	-174.1	-178.6	0	0	0	0	111.4	A194 I195 H198 V354	A194-V356 HydrophobicContact CB-CG2 4.11Å; I195-V356 HydrophobicContact CB-CG1 4.33Å; I195-V356 HydrophobicContact CG1-CG1 3.47Å; I195-V356 VanDerWaalsContact CG1-CG1 3.47Å; H198-V356 HydrophobicContact CB-CB 4.31Å; H198-V356 HydrophobicContact CB-CG2 3.58Å; V354-V356 WeakPolarHBondContact CG1-O 3.42Å
357	E	80.8	Confident	80.4	Confident	122 Å²	122	64.2 Å²	64.2	57%	0.57	34%	0.336	S	S	*	.			trans	-82.5	138.4	171.5	-64.3	-60.9	154.5	0	0	110.2
358	N	86.2	Confident	80.4	Confident	35 Å²	35	64.2 Å²	64.2	19%	0.187	34%	0.336	C	S	.	.			trans	-138	147.8	173	63.4	-52.9	0	0	0	109	N332 E360 R361	N332-N358 PolarHBondContact O-ND2 3.47Å; N358-E360 PolarHBondContact O-N 3.44Å; N358-E360 VanDerWaalsContact O-N 3.14Å; N358-R361 VanDerWaalsContact O-CB 3.32Å; N358-R361 WeakPolarHBondContact O-CB 3.34Å; N358-R361 PolarHBondContact O-N 2.68Å; N358-R361 VanDerWaalsContact O-N 3.1Å; N358-R361 WeakPolarHBondContact OD1-CB 3.46Å; N358-R361 VanDerWaalsContact OD1-CZ 3.28Å; N358-R361 PolarHBondContact OD1-NE 3.4Å; N358-R361 PolarHBondContact OD1-NH2 3.3Å
359	P	84.5	Confident	80.6	Confident	111 Å²	111	62.5 Å²	62.5	72%	0.721	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-32.2	-173.3	-27.2	35.6	0	0	0	114.4	R361 Q405	P359-R361 PolarHBondContact O-N 3.23Å; P359-Q405 PolarHBondContact O-NE2 3.49Å; P359-Q405 PolarHBondContact O-OE1 2.92Å
360	E	86.9	Confident	81	Confident	98 Å²	98	61.2 Å²	61.2	46%	0.458	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-8.3	-178	-61.8	171	-165.5	0	0	114	T333 N358 Q405	T333-E360 WeakPolarHBondContact CA-O 3.42Å; N358-E360 PolarHBondContact O-N 3.44Å; N358-E360 VanDerWaalsContact O-N 3.14Å; E360-Q405 PolarHBondContact O-NE2 3.23Å
361	R	87.6	Confident	82	Confident	20 Å²	20	58.8 Å²	58.8	8%	0.075	32%	0.316	C	S	.	.	S	Bend	trans	-81.6	138.3	-175	-172.6	174.7	-55	-75.9	-7.4	112.7	P331 N332 A334 N358 P359 S363 Q405	P331-R361 PolarHBondContact O-NH1 2.95Å; N332-R361 WeakPolarHBondContact O-CA 3.5Å; A334-R361 VanDerWaalsContact O-CG 3.29Å; A334-R361 WeakPolarHBondContact O-CG 3.49Å; A334-R361 PolarHBondContact O-NH1 2.96Å; N358-R361 VanDerWaalsContact O-CB 3.32Å; N358-R361 WeakPolarHBondContact O-CB 3.34Å; N358-R361 PolarHBondContact O-N 2.68Å; N358-R361 VanDerWaalsContact O-N 3.1Å; N358-R361 WeakPolarHBondContact OD1-CB 3.46Å; N358-R361 VanDerWaalsContact OD1-CZ 3.28Å; N358-R361 PolarHBondContact OD1-NE 3.4Å; N358-R361 PolarHBondContact OD1-NH2 3.3Å; P359-R361 PolarHBondContact O-N 3.23Å; R361-S363 PolarHBondContact O-N 2.92Å; R361-Q405 VanDerWaalsContact C-NE2 3.25Å; R361-Q405 PolarHBondContact O-NE2 2.94Å; R361-Q405 VanDerWaalsContact O-NE2 3.07Å
362	F	86.3	Confident	83.2	Confident	10 Å²	10	60.2 Å²	60.2	4%	0.044	31%	0.307	C	S	.	.			trans	-68.6	118.3	165.8	-72.7	-73.2	0	0	0	111.7	T333 A335 C367 L369 H401 Y494	T333-F362 WeakPolarHBondContact O-CD2 3.45Å; T333-F362 PolarHBondContact O-N 3Å; A335-F362 VanDerWaalsContact CA-O 3.23Å; A335-F362 WeakPolarHBondContact CA-O 3.21Å; A335-F362 HydrophobicContact CB-CB 4.12Å; A335-F362 WeakPolarHBondContact CB-O 3.32Å; F362-C367 WeakPolarHBondContact CD1-SG 3.42Å; F362-C367 HydrophobicContact CD2-CB 4.15Å; F362-C367 WeakPolarHBondContact CD2-O 3.24Å; F362-C367 VanDerWaalsContact CD2-SG 3.53Å; F362-C367 HydrophobicContact CE2-CB 4.26Å; F362-C367 HydrophobicContact CG-CB 4.41Å; F362-C367 WeakPolarHBondContact CG-SG 3.47Å; F362-L369 HydrophobicContact CE2-CD2 3.81Å; F362-L369 HydrophobicContact CE2-CG 3.86Å; F362-L369 HydrophobicContact CZ-CD2 3.95Å; F362-L369 HydrophobicContact CZ-CG 4.31Å; F362-H401 AromaticContact CE1-CD2 3.61Å; F362-H401 AromaticContact CE1-NE2 3.96Å; F362-H401 AromaticContact CE2-NE2 3.9Å; F362-H401 AromaticContact CZ-CD2 3.32Å; F362-H401 WeakPolarHBondContact CZ-CD2 3.3Å; F362-H401 AromaticContact CZ-NE2 3.66Å; F362-Y494 HydrophobicContact CZ-CE2 4.31Å
363	S	80.8	Confident	84.7	Confident	71 Å²	71	57.5 Å²	57.5	50%	0.497	30%	0.304	S	S	.	.	S	Bend	trans	-95.5	-23.8	-177.5	57.6	0	0	0	0	114.2	W337 R361	W337-S363 WeakPolarHBondContact CH2-O 3.29Å; R361-S363 PolarHBondContact O-N 2.92Å
364	S	79.5	Confident	86.3	Confident	85 Å²	85	48.3 Å²	48.3	59%	0.594	27%	0.269	S	S	*	.	S	Bend	trans	-108.1	-17.4	-167.5	59	0	0	0	0	115.4
365	A	83.1	Confident	87.8	Confident	7 Å²	7	49.5 Å²	49.5	6%	0.058	28%	0.28	C	S	.	.	S	Bend	trans	-145.8	150.3	-175.9	0	0	0	0	0	112.1	A335 C367 C419 Y496	A335-A365 WeakPolarHBondContact CB-O 3.48Å; A365-C367 PolarHBondContact O-N 2.87Å; A365-C419 HydrophobicContact CB-CB 4.44Å; A365-Y496 HydrophobicContact CB-CE2 4.29Å
366	P	88.1	Confident	89.4	Confident	13 Å²	13	49.1 Å²	49.1	8%	0.084	28%	0.275	C	S	.	.	S	Bend	trans	-69.9	68	175	28.8	-35.5	0	0	0	112.2	L338 Y496 L497	L338-P366 HydrophobicContact CD2-CB 4.01Å; L338-P366 HydrophobicContact CG-CB 4.49Å; P366-Y496 HydrophobicContact CG-CD2 3.96Å; P366-Y496 HydrophobicContact CG-CE1 4.36Å; P366-Y496 HydrophobicContact CG-CE2 3.41Å; P366-Y496 VanDerWaalsContact CG-CE2 3.41Å; P366-Y496 VanDerWaalsContact O-CA 3.32Å; P366-Y496 WeakPolarHBondContact O-CA 3.33Å; P366-L497 WeakPolarHBondContact CB-O 3.23Å; P366-L497 WeakPolarHBondContact CG-O 3.27Å; P366-L497 PolarHBondContact O-N 3.4Å
367	C	91.1	Very high	90	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.02	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	163.9	175.6	48.7	0	0	0	0	113	A335 F362 A365 Y494 F495 Y496	A335-C367 PolarHBondContact N-O 2.99Å; F362-C367 WeakPolarHBondContact CD1-SG 3.42Å; F362-C367 HydrophobicContact CD2-CB 4.15Å; F362-C367 WeakPolarHBondContact CD2-O 3.24Å; F362-C367 VanDerWaalsContact CD2-SG 3.53Å; F362-C367 HydrophobicContact CE2-CB 4.26Å; F362-C367 HydrophobicContact CG-CB 4.41Å; F362-C367 WeakPolarHBondContact CG-SG 3.47Å; A365-C367 PolarHBondContact O-N 2.87Å; C367-Y494 HydrophobicContact CB-CE2 3.65Å; C367-F495 CarbonylContact C-O 3.57Å; C367-F495 WeakPolarHBondContact CA-O 3.27Å; C367-F495 WeakPolarHBondContact CB-O 3.19Å; C367-Y496 HydrophobicContact CB-CD2 4.46Å
368	L	93.9	Very high	90.7	Very high	0 Å²	0	48 Å²	48	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	164.1	178.2	75.8	168.8	0	0	0	109.6	L329 A334 L338 V340 V347 F495 L497	L329-L368 HydrophobicContact CB-CD1 3.91Å; L329-L368 HydrophobicContact CD1-CD1 4.21Å; L329-L368 HydrophobicContact CD2-CD1 4Å; L329-L368 HydrophobicContact CD2-CG 4.34Å; L329-L368 HydrophobicContact CG-CD1 4.26Å; A334-L368 HydrophobicContact CB-CB 3.74Å; A334-L368 HydrophobicContact CB-CD1 4.17Å; L338-L368 HydrophobicContact CD1-CB 4.27Å; L338-L368 HydrophobicContact CD1-CD2 3.9Å; V340-L368 HydrophobicContact CG2-CD1 3.93Å; V347-L368 HydrophobicContact CB-CD1 4.09Å; V347-L368 HydrophobicContact CG1-CD1 4.1Å; V347-L368 HydrophobicContact CG1-CD2 4.04Å; V347-L368 HydrophobicContact CG2-CD1 3.98Å; V347-L368 HydrophobicContact CG2-CD2 4.43Å; L368-F495 HydrophobicContact CD2-CB 3.59Å; L368-F495 HydrophobicContact CG-CB 4.36Å; L368-F495 PolarHBondContact N-O 3.14Å; L368-F495 PolarHBondContact O-N 3.5Å; L368-L497 HydrophobicContact CD2-CD1 3.72Å
369	L	96.1	Very high	91.1	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	157.3	178.4	-53.5	-175	0	0	0	112.2	D330 T333 F362 V396 R492 P493 Y494	D330-L369 WeakPolarHBondContact CB-O 3.44Å; D330-L369 PolarHBondContact N-O 2.9Å; T333-L369 HydrophobicContact CG2-CB 4.17Å; T333-L369 HydrophobicContact CG2-CD1 4.14Å; T333-L369 HydrophobicContact CG2-CG 4.19Å; T333-L369 PolarHBondContact OG1-N 3.39Å; F362-L369 HydrophobicContact CE2-CD2 3.81Å; F362-L369 HydrophobicContact CE2-CG 3.86Å; F362-L369 HydrophobicContact CZ-CD2 3.95Å; F362-L369 HydrophobicContact CZ-CG 4.31Å; L369-V396 HydrophobicContact CD1-CG1 4.34Å; L369-V396 HydrophobicContact CD2-CG1 3.49Å; L369-V396 VanDerWaalsContact CD2-CG1 3.49Å; L369-R492 HydrophobicContact CB-CB 4.46Å; L369-R492 HydrophobicContact CD1-CB 4.41Å; L369-P493 CarbonylContact C-O 3.51Å; L369-P493 VanDerWaalsContact CA-O 3.24Å; L369-P493 WeakPolarHBondContact CA-O 3.45Å; L369-Y494 HydrophobicContact CD2-CD2 3.9Å
370	G	96.9	Very high	91.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-73.6	153.9	162.9	0	0	0	0	0	111.5	S328 Q372 R492 P493	S328-G370 CarbonylContact O-C 3.58Å; S328-G370 WeakPolarHBondContact O-CA 3.37Å; G370-Q372 VanDerWaalsContact C-N 3.31Å; G370-Q372 PolarHBondContact O-N 3.15Å; G370-R492 PolarHBondContact O-NE 2.84Å; G370-R492 PolarHBondContact O-NH2 2.93Å; G370-P493 PolarHBondContact N-O 3.38Å
371	S	95.4	Very high	92.1	Very high	56 Å²	56	41.9 Å²	41.9	39%	0.392	25%	0.253	S	S	.	.	S	Bend	trans	-71.6	-20.6	-174.5	61.5	0	0	0	0	114.2	S328	S328-S371 PolarHBondContact N-OG 3.12Å; S328-S371 VanDerWaalsContact N-OG 3.14Å; S328-S371 WeakPolarHBondContact O-CB 3.01Å; S328-S371 PolarHBondContact O-N 3.4Å; S328-S371 PolarHBondContact O-OG 3.29Å
372	Q	95.1	Very high	92.6	Very high	88 Å²	88	43 Å²	43	41%	0.411	26%	0.259	S	S	.	.			trans	-96	147.9	-178.3	-69.9	-165.3	7	0	0	113	P326 F327 G370 F374 R492 P493	P326-Q372 PolarHBondContact O-NE2 3.08Å; P326-Q372 VanDerWaalsContact O-NE2 3.15Å; F327-Q372 HydrophobicContact CB-CB 4.04Å; F327-Q372 HydrophobicContact CB-CG 3.76Å; G370-Q372 VanDerWaalsContact C-N 3.31Å; G370-Q372 PolarHBondContact O-N 3.15Å; Q372-F374 HydrophobicContact CB-CE1 4.19Å; Q372-F374 HydrophobicContact CB-CZ 4.1Å; Q372-R492 WeakPolarHBondContact O-CG 3.39Å; Q372-P493 WeakPolarHBondContact O-CD 3.27Å
373	V	96.6	Very high	93.1	Very high	74 Å²	74	42.6 Å²	42.6	45%	0.448	26%	0.257	S	S	.	.			trans	-106.7	125.9	169.8	-179.9	0	0	0	0	107.9	V398 E490 V491 R492	V373-V398 HydrophobicContact CG1-CG2 3.96Å; V373-V398 HydrophobicContact CG2-CG2 4.29Å; V373-E490 HydrophobicContact CG1-CB 3.96Å; V373-V491 CarbonylContact C-O 3.55Å; V373-V491 WeakPolarHBondContact CA-O 3.42Å; V373-R492 HydrophobicContact CB-CG 4.46Å; V373-R492 HydrophobicContact CG2-CG 3.75Å
374	F	96.3	Very high	93.8	Very high	8 Å²	8	41.3 Å²	41.3	4%	0.035	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-103.2	135	175.5	-57.5	-59.5	0	0	0	110	F327 Q372 H379 W381 L463 E490 V491 P493	F327-F374 HydrophobicContact CD1-CE2 4.34Å; F327-F374 AromaticContact CD1-CZ 3.96Å; F327-F374 HydrophobicContact CD1-CZ 3.96Å; F327-F374 HydrophobicContact CE1-CE2 4.43Å; F327-F374 HydrophobicContact CE1-CZ 4.4Å; Q372-F374 HydrophobicContact CB-CE1 4.19Å; Q372-F374 HydrophobicContact CB-CZ 4.1Å; F374-H379 HydrophobicContact CD1-CB 4.33Å; F374-H379 AromaticContact CD1-CD2 3.7Å; F374-H379 AromaticContact CD1-CE1 3.55Å; F374-H379 AromaticContact CD1-CG 3.54Å; F374-H379 AromaticContact CD1-ND1 3.45Å; F374-H379 WeakPolarHBondContact CD1-ND1 3.47Å; F374-H379 AromaticContact CD1-NE2 3.69Å; F374-H379 HydrophobicContact CE1-CB 4.26Å; F374-H379 AromaticContact CE1-CE1 3.91Å; F374-H379 AromaticContact CE1-CG 3.73Å; F374-H379 AromaticContact CE1-ND1 3.42Å; F374-H379 WeakPolarHBondContact CE1-ND1 3.47Å; F374-H379 HydrophobicContact CZ-CB 4.48Å; F374-W381 HydrophobicContact CD2-CZ3 4.38Å; F374-W381 HydrophobicContact CE2-CE3 4.42Å; F374-W381 HydrophobicContact CE2-CH2 4.27Å; F374-W381 AromaticContact CE2-CZ3 3.91Å; F374-W381 HydrophobicContact CE2-CZ3 3.91Å; F374-L463 HydrophobicContact CB-CD2 3.71Å; F374-L463 HydrophobicContact CD2-CD2 3.96Å; F374-L463 HydrophobicContact CG-CD2 4.09Å; F374-E490 WeakPolarHBondContact O-CA 3.38Å; F374-V491 HydrophobicContact CB-CG2 4.16Å; F374-V491 PolarHBondContact N-O 3.44Å; F374-V491 PolarHBondContact O-N 2.98Å; F374-P493 HydrophobicContact CD2-CG 4.36Å; F374-P493 HydrophobicContact CE2-CG 3.65Å
375	S	94.9	Very high	94.4	Very high	61 Å²	61	37.3 Å²	37.3	43%	0.427	22%	0.216	S	C	.	.			trans	-141.9	-18	179.6	62.8	0	0	0	0	114.3
376	K	94.6	Very high	94.6	Very high	155 Å²	155	37.5 Å²	37.5	67%	0.674	22%	0.22	S	C	*	.	S	Bend	trans	-151.6	153.4	-178.2	-62.4	-172.7	-177.9	-177.8	0	110.5	H379	K376-H379 PolarHBondContact O-NE2 3.24Å
377	G	94.6	Very high	94.4	Very high	27 Å²	27	38.5 Å²	38.5	28%	0.278	23%	0.232	S	C	.	.	S	Bend	trans	78.6	179	179.4	0	0	0	0	0	114.5	H379 C465 E466	G377-H379 PolarHBondContact O-CD2 3.19Å; G377-H379 VanDerWaalsContact O-CD2 3.31Å; G377-C465 PolarHBondContact O-N 3.16Å; G377-C465 PolarHBondContact O-SG 3.49Å; G377-E466 VanDerWaalsContact CA-OE2 3.25Å; G377-E466 WeakPolarHBondContact CA-OE2 3.38Å; G377-E466 PolarHBondContact N-OE1 2.97Å; G377-E466 PolarHBondContact N-OE2 3.41Å
378	S	95.4	Very high	94.2	Very high	84 Å²	84	38.8 Å²	38.8	59%	0.587	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	129	176.5	-147.7	0	0	0	0	111	L463 E464	S378-L463 CarbonylContact C-O 3.58Å; S378-L463 WeakPolarHBondContact CA-O 3.23Å; S378-E464 WeakPolarHBondContact CB-OE2 3.45Å; S378-E464 PolarHBondContact OG-OE2 2.85Å
379	H	96.1	Very high	93.6	Very high	53 Å²	53	40 Å²	40	25%	0.245	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	137	-179.9	-57.9	-80.7	0	0	0	110.2	F374 K376 G377 W381 E462 L463	F374-H379 HydrophobicContact CD1-CB 4.33Å; F374-H379 AromaticContact CD1-CD2 3.7Å; F374-H379 AromaticContact CD1-CE1 3.55Å; F374-H379 AromaticContact CD1-CG 3.54Å; F374-H379 AromaticContact CD1-ND1 3.45Å; F374-H379 WeakPolarHBondContact CD1-ND1 3.47Å; F374-H379 AromaticContact CD1-NE2 3.69Å; F374-H379 HydrophobicContact CE1-CB 4.26Å; F374-H379 AromaticContact CE1-CE1 3.91Å; F374-H379 AromaticContact CE1-CG 3.73Å; F374-H379 AromaticContact CE1-ND1 3.42Å; F374-H379 WeakPolarHBondContact CE1-ND1 3.47Å; F374-H379 HydrophobicContact CZ-CB 4.48Å; K376-H379 PolarHBondContact O-NE2 3.24Å; G377-H379 PolarHBondContact O-CD2 3.19Å; G377-H379 VanDerWaalsContact O-CD2 3.31Å; H379-W381 HydrophobicContact CB-CE3 4.46Å; H379-W381 HydrophobicContact CB-CZ3 4.13Å; H379-E462 CarbonylContact O-C 3.53Å; H379-E462 WeakPolarHBondContact O-CA 3.17Å; H379-L463 HydrophobicContact CB-CB 4.45Å; H379-L463 PolarHBondContact N-O 3.35Å; H379-L463 PolarHBondContact O-N 2.73Å
380	S	95.6	Very high	93.2	Very high	59 Å²	59	41.3 Å²	41.3	41%	0.413	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.6	176.5	174.1	0	0	0	0	110.9	V461	S380-V461 VanDerWaalsContact CA-O 3.27Å; S380-V461 WeakPolarHBondContact CA-O 3.34Å
381	W	97	Very high	92.9	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.015	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	156.9	173	63.4	95.3	0	0	0	111.4	P326 F327 F374 H379 V395 R460 V461 L463 P493	P326-W381 HydrophobicContact CB-CB 4.22Å; P326-W381 HydrophobicContact CG-CB 3.5Å; F327-W381 HydrophobicContact CE1-CB 3.9Å; F327-W381 AromaticContact CE1-CD1 3.9Å; F327-W381 AromaticContact CE1-CD2 3.61Å; F327-W381 HydrophobicContact CE1-CD2 3.61Å; F327-W381 HydrophobicContact CE1-CE3 4.07Å; F327-W381 AromaticContact CE1-CG 3.54Å; F327-W381 HydrophobicContact CE1-CG 3.54Å; F327-W381 HydrophobicContact CZ-CB 4.43Å; F327-W381 AromaticContact CZ-CD1 3.67Å; F327-W381 HydrophobicContact CZ-CD2 4.04Å; F327-W381 AromaticContact CZ-CG 3.82Å; F327-W381 HydrophobicContact CZ-CG 3.82Å; F327-W381 AromaticContact CZ-NE1 3.79Å; F374-W381 HydrophobicContact CD2-CZ3 4.38Å; F374-W381 HydrophobicContact CE2-CE3 4.42Å; F374-W381 HydrophobicContact CE2-CH2 4.27Å; F374-W381 AromaticContact CE2-CZ3 3.91Å; F374-W381 HydrophobicContact CE2-CZ3 3.91Å; H379-W381 HydrophobicContact CB-CE3 4.46Å; H379-W381 HydrophobicContact CB-CZ3 4.13Å; W381-V395 HydrophobicContact CH2-CG1 3.71Å; W381-V395 HydrophobicContact CZ2-CG1 3.93Å; W381-R460 WeakPolarHBondContact O-CA 3.5Å; W381-V461 HydrophobicContact CD2-CB 4.02Å; W381-V461 HydrophobicContact CD2-CG1 4.47Å; W381-V461 HydrophobicContact CG-CB 4.46Å; W381-V461 HydrophobicContact CH2-CB 4.34Å; W381-V461 HydrophobicContact CH2-CG1 3.75Å; W381-V461 HydrophobicContact CZ2-CB 3.77Å; W381-V461 HydrophobicContact CZ2-CG1 3.41Å; W381-V461 VanDerWaalsContact CZ2-CG1 3.41Å; W381-V461 HydrophobicContact CZ2-CG2 4.35Å; W381-V461 HydrophobicContact CZ3-CG1 4.4Å; W381-V461 PolarHBondContact N-O 3.4Å; W381-V461 PolarHBondContact O-N 3.45Å; W381-L463 HydrophobicContact CH2-CB 4.18Å; W381-L463 HydrophobicContact CH2-CD2 4.46Å; W381-L463 HydrophobicContact CZ3-CB 4.03Å; W381-P493 HydrophobicContact CZ2-CB 4.44Å; W381-P493 HydrophobicContact CZ2-CG 4.42Å
382	E	96.8	Very high	92.8	Very high	45 Å²	45	39.6 Å²	39.6	21%	0.21	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	143.4	174.8	-70.3	-171.8	173.3	0	0	110.8	R458 L459 R460 S475 C512	E382-R458 HydrophobicContact CB-CG 4.49Å; E382-R458 WeakPolarHBondContact OE2-CD 3.47Å; E382-L459 CarbonylContact C-O 3.57Å; E382-L459 VanDerWaalsContact CA-O 3.26Å; E382-L459 WeakPolarHBondContact CA-O 3.48Å; E382-R460 HydrophobicContact CG-CB 3.97Å; E382-R460 HydrophobicContact CG-CG 4.11Å; E382-R460 IonicContact OE1-CZ 3.79Å; E382-R460 VanDerWaalsContact OE1-CZ 3.29Å; E382-R460 IonicContact OE1-NE 2.89Å; E382-R460 PolarHBondContact OE1-NE 3.02Å; E382-R460 IonicContact OE1-NH2 2.74Å; E382-R460 PolarHBondContact OE1-NH2 3.06Å; E382-S475 PolarHBondContact OE1-OG 3.25Å; E382-C512 HydrophobicContact CB-CB 3.74Å; E382-C512 PolarHBondContact O-N 3.28Å
383	V	96.8	Very high	92.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	118.6	-178.1	-171.4	0	0	0	0	108.3	V385 V393 R458 L459 F495 L509 R510	V383-V385 HydrophobicContact CG1-CG1 4.07Å; V383-V385 PolarHBondContact O-N 2.97Å; V383-V393 HydrophobicContact CB-CG1 4.32Å; V383-V393 HydrophobicContact CG1-CG2 4.16Å; V383-V393 HydrophobicContact CG2-CG1 3.88Å; V383-R458 WeakPolarHBondContact O-CA 3.26Å; V383-L459 PolarHBondContact N-O 3.33Å; V383-L459 PolarHBondContact O-N 3.32Å; V383-F495 HydrophobicContact CG1-CE1 4.2Å; V383-F495 HydrophobicContact CG2-CE1 3.88Å; V383-L509 HydrophobicContact CG1-CD1 4.17Å; V383-L509 HydrophobicContact CG1-CD2 3.61Å; V383-L509 HydrophobicContact CG1-CG 3.77Å; V383-R510 CarbonylContact C-O 3.58Å; V383-R510 WeakPolarHBondContact CA-O 3.47Å
384	D	95.4	Very high	92.8	Very high	45 Å²	45	31.9 Å²	31.9	24%	0.241	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	111.9	169.6	-155.8	-41.3	0	0	0	108.6	G386 R458 R510	D384-G386 PolarHBondContact OD1-N 3.26Å; D384-R458 IonicContact OD2-CZ 2.69Å; D384-R458 IonicContact OD2-NE 3.8Å; D384-R458 IonicContact OD2-NH2 2.67Å; D384-R458 PolarHBondContact OD2-NH2 2.82Å; D384-R510 HydrophobicContact CB-CB 4.29Å; D384-R510 PolarHBondContact N-O 2.84Å; D384-R510 PolarHBondContact O-N 2.95Å
385	V	92.1	Very high	92.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.192	C	C	.	.			trans	-101.3	-3.5	176.7	-63.4	0	0	0	0	111.5	V383 G387 L388 W391 V393 P456 R457 L459 L509	V383-V385 HydrophobicContact CG1-CG1 4.07Å; V383-V385 PolarHBondContact O-N 2.97Å; V385-G387 PolarHBondContact O-N 3.42Å; V385-L388 VanDerWaalsContact O-CB 3.22Å; V385-L388 WeakPolarHBondContact O-CB 3.39Å; V385-L388 WeakPolarHBondContact O-CD1 3.4Å; V385-L388 VanDerWaalsContact O-CG 3.27Å; V385-L388 WeakPolarHBondContact O-CG 3.39Å; V385-L388 PolarHBondContact O-N 3.45Å; V385-L388 VanDerWaalsContact O-N 3.09Å; V385-W391 HydrophobicContact CB-CD2 4.3Å; V385-W391 HydrophobicContact CB-CG 4.27Å; V385-W391 HydrophobicContact CG1-CD2 4.12Å; V385-W391 HydrophobicContact CG1-CE3 4.43Å; V385-W391 HydrophobicContact CG1-CG 4.29Å; V385-W391 HydrophobicContact CG2-CZ2 4.12Å; V385-V393 HydrophobicContact CG1-CG2 3.88Å; V385-P456 VanDerWaalsContact CG2-O 3.32Å; V385-P456 WeakPolarHBondContact CG2-O 3.41Å; V385-R457 WeakPolarHBondContact CG2-O 3.42Å; V385-R457 PolarHBondContact N-O 3.03Å; V385-L459 HydrophobicContact CG1-CD1 4.28Å; V385-L509 HydrophobicContact CG1-CD1 4.32Å
386	G	86.8	Confident	92.8	Very high	12 Å²	12	28.6 Å²	28.6	12%	0.124	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	-129.8	173.6	0	0	0	0	0	113.6	D384 R457	D384-G386 PolarHBondContact OD1-N 3.26Å; G386-R457 PolarHBondContact N-O 2.91Å; G386-R457 VanDerWaalsContact N-O 3.11Å
387	G	84.2	Confident	92.8	Very high	33 Å²	33	25.3 Å²	25.3	34%	0.34	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	9.5	174.2	0	0	0	0	0	113.5	V385 R432 E507	V385-G387 PolarHBondContact O-N 3.42Å; G387-R432 PolarHBondContact O-NH1 3.28Å; G387-R432 VanDerWaalsContact O-NH1 3.08Å; G387-E507 WeakPolarHBondContact CA-OE2 3.19Å; G387-E507 PolarHBondContact N-OE2 3.42Å
388	L	86.6	Confident	92.6	Very high	9 Å²	9	26.2 Å²	26.2	5%	0.047	16%	0.156	C	C	.	.			trans	-49.2	124.8	-171.4	-77.8	172.2	0	0	0	112	V385 S390 W391 R432 L497 E507 L509	V385-L388 VanDerWaalsContact O-CB 3.22Å; V385-L388 WeakPolarHBondContact O-CB 3.39Å; V385-L388 WeakPolarHBondContact O-CD1 3.4Å; V385-L388 VanDerWaalsContact O-CG 3.27Å; V385-L388 WeakPolarHBondContact O-CG 3.39Å; V385-L388 PolarHBondContact O-N 3.45Å; V385-L388 VanDerWaalsContact O-N 3.09Å; L388-S390 VanDerWaalsContact C-N 3.29Å; L388-S390 PolarHBondContact O-N 3.28Å; L388-W391 VanDerWaalsContact O-CD1 3.28Å; L388-R432 VanDerWaalsContact O-CD 3.23Å; L388-R432 WeakPolarHBondContact O-CD 3.41Å; L388-R432 PolarHBondContact O-NH1 3.34Å; L388-L497 HydrophobicContact CD1-CD2 4.47Å; L388-E507 HydrophobicContact CD2-CB 4Å; L388-E507 WeakPolarHBondContact CD2-O 3.18Å; L388-E507 HydrophobicContact CG-CB 4.39Å; L388-E507 PolarHBondContact N-OE2 3.31Å; L388-L509 HydrophobicContact CD1-CB 3.93Å
389	P	82	Confident	92	Very high	27 Å²	27	28.5 Å²	28.5	18%	0.175	16%	0.157	C	C	.	.	S	Bend	trans	-71.5	-23.3	-171.5	27.8	-35.1	0	0	0	113.2	R432	P389-R432 WeakPolarHBondContact O-CD 3.5Å; P389-R432 PolarHBondContact O-NE 3.5Å
390	S	87.6	Confident	91.1	Very high	27 Å²	27	26.4 Å²	26.4	19%	0.189	15%	0.149	C	C	.	.	S	Bend	trans	-150.4	130.4	173.7	178.6	0	0	0	0	110.4	L388 R432 G498	L388-S390 VanDerWaalsContact C-N 3.29Å; L388-S390 PolarHBondContact O-N 3.28Å; S390-R432 WeakPolarHBondContact CA-O 3.49Å; S390-R432 PolarHBondContact OG-O 3.11Å; S390-G498 PolarHBondContact O-N 3.29Å
391	W	91.2	Very high	90.2	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.008	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	159.6	-179.6	50.7	-101.2	0	0	0	110.6	V385 L388 V393 L430 C431 R432 M455 P456 L459 Y496	V385-W391 HydrophobicContact CB-CD2 4.3Å; V385-W391 HydrophobicContact CB-CG 4.27Å; V385-W391 HydrophobicContact CG1-CD2 4.12Å; V385-W391 HydrophobicContact CG1-CE3 4.43Å; V385-W391 HydrophobicContact CG1-CG 4.29Å; V385-W391 HydrophobicContact CG2-CZ2 4.12Å; L388-W391 VanDerWaalsContact O-CD1 3.28Å; W391-V393 HydrophobicContact CE3-CB 4.49Å; W391-V393 HydrophobicContact CE3-CG2 3.98Å; W391-V393 HydrophobicContact CZ3-CG2 4.42Å; W391-L430 HydrophobicContact CH2-CD2 3.48Å; W391-L430 VanDerWaalsContact CH2-CD2 3.48Å; W391-L430 HydrophobicContact CZ3-CD2 3.66Å; W391-L430 WeakPolarHBondContact CZ3-O 3.3Å; W391-C431 CarbonylContact O-C 3.56Å; W391-C431 WeakPolarHBondContact O-CA 3.35Å; W391-C431 VanDerWaalsContact O-CB 3.26Å; W391-C431 WeakPolarHBondContact O-CB 3.38Å; W391-R432 HydrophobicContact CD2-CB 3.95Å; W391-R432 HydrophobicContact CG-CB 4.18Å; W391-R432 HydrophobicContact CZ2-CB 3.88Å; W391-R432 PolarHBondContact N-O 3.3Å; W391-R432 PolarHBondContact O-N 3.31Å; W391-M455 HydrophobicContact CZ2-CE 3.87Å; W391-P456 HydrophobicContact CH2-CG 4.29Å; W391-P456 HydrophobicContact CZ2-CG 4.29Å; W391-L459 HydrophobicContact CE3-CD1 4.18Å; W391-L459 HydrophobicContact CH2-CD1 3.49Å; W391-L459 VanDerWaalsContact CH2-CD1 3.49Å; W391-L459 HydrophobicContact CH2-CG 4.4Å; W391-L459 HydrophobicContact CZ2-CD1 4.28Å; W391-L459 HydrophobicContact CZ3-CD1 3.41Å; W391-L459 VanDerWaalsContact CZ3-CD1 3.41Å; W391-Y496 CarbonylContact C-O 3.52Å; W391-Y496 WeakPolarHBondContact CA-O 3.43Å
392	R	92.8	Very high	89.1	Confident	18 Å²	18	27 Å²	27	7%	0.068	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	136.4	165.5	-45.3	173	174.7	170.4	-2.3	108.2	C419 Y429 L430 C431 Y494 F495 Y496	R392-C419 PolarHBondContact NH1-O 3.15Å; R392-Y429 HydrophobicContact CB-CD2 3.87Å; R392-Y429 HydrophobicContact CB-CE2 4.31Å; R392-Y429 HydrophobicContact CB-CG 4.12Å; R392-Y429 HydrophobicContact CG-CD2 4.13Å; R392-Y429 HydrophobicContact CG-CE2 4.07Å; R392-L430 WeakPolarHBondContact CA-O 3.48Å; R392-C431 HydrophobicContact CB-CB 4.12Å; R392-C431 HydrophobicContact CG-CB 3.65Å; R392-Y494 HydrophobicContact CB-CE1 4.09Å; R392-F495 CarbonylContact O-C 3.45Å; R392-F495 WeakPolarHBondContact O-CA 3.48Å; R392-Y496 HydrophobicContact CB-CG 4.43Å; R392-Y496 HydrophobicContact CG-CD1 3.85Å; R392-Y496 HydrophobicContact CG-CG 3.89Å; R392-Y496 PolarHBondContact N-O 2.99Å; R392-Y496 PolarHBondContact O-N 2.88Å
393	V	96.2	Very high	87.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	128.8	177.6	177.1	0	0	0	0	108.1	V383 V385 W391 Y429 L430 L459 V461 F472 F495 L509	V383-V393 HydrophobicContact CB-CG1 4.32Å; V383-V393 HydrophobicContact CG1-CG2 4.16Å; V383-V393 HydrophobicContact CG2-CG1 3.88Å; V385-V393 HydrophobicContact CG1-CG2 3.88Å; W391-V393 HydrophobicContact CE3-CB 4.49Å; W391-V393 HydrophobicContact CE3-CG2 3.98Å; W391-V393 HydrophobicContact CZ3-CG2 4.42Å; V393-Y429 WeakPolarHBondContact O-CA 2.98Å; V393-Y429 WeakPolarHBondContact O-CB 3.11Å; V393-L430 PolarHBondContact N-O 3.03Å; V393-L430 PolarHBondContact O-N 3.49Å; V393-L459 HydrophobicContact CB-CD1 3.98Å; V393-L459 HydrophobicContact CG1-CD1 4.39Å; V393-L459 HydrophobicContact CG2-CD1 4.04Å; V393-V461 HydrophobicContact CG1-CG2 3.89Å; V393-F472 VanDerWaalsContact O-CE1 3.3Å; V393-F472 WeakPolarHBondContact O-CE1 3.48Å; V393-F495 HydrophobicContact CG1-CD1 4.42Å; V393-F495 HydrophobicContact CG1-CE1 4.17Å; V393-F495 HydrophobicContact CG2-CD1 4.32Å; V393-L509 HydrophobicContact CG2-CD1 4.23Å
394	G	96.3	Very high	86.5	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.8	-144.3	178.5	0	0	0	0	0	112.8	W428 P493 Y494	G394-W428 CarbonylContact C-O 3.56Å; G394-W428 VanDerWaalsContact CA-O 3.24Å; G394-W428 WeakPolarHBondContact CA-O 3.42Å; G394-P493 WeakPolarHBondContact O-CA 3.39Å; G394-Y494 PolarHBondContact N-O 2.98Å; G394-Y494 PolarHBondContact O-N 2.92Å
395	V	96.5	Very high	85.2	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	153.6	178.3	-55.7	0	0	0	0	111.4	W381 W428 L470 V491 R492	W381-V395 HydrophobicContact CH2-CG1 3.71Å; W381-V395 HydrophobicContact CZ2-CG1 3.93Å; V395-W428 HydrophobicContact CG2-CB 4.2Å; V395-W428 HydrophobicContact CG2-CE3 4.11Å; V395-W428 PolarHBondContact N-O 3.38Å; V395-W428 PolarHBondContact O-N 3.32Å; V395-L470 HydrophobicContact CG1-CD1 4.18Å; V395-L470 HydrophobicContact CG2-CD1 4.46Å; V395-L470 HydrophobicContact CG2-CD2 3.68Å; V395-V491 HydrophobicContact CB-CB 4.12Å; V395-V491 HydrophobicContact CB-CG2 4.24Å; V395-V491 HydrophobicContact CG2-CB 4.3Å; V395-V491 HydrophobicContact CG2-CG1 4.33Å; V395-V491 HydrophobicContact CG2-CG2 4.38Å; V395-R492 CarbonylContact C-O 3.57Å; V395-R492 VanDerWaalsContact CA-O 3.26Å; V395-R492 WeakPolarHBondContact CA-O 3.27Å
396	V	94.8	Very high	83.8	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.3	175.2	63.8	0	0	0	0	110.3	L369 A400 G426 F427 V491 R492 Y494	L369-V396 HydrophobicContact CD1-CG1 4.34Å; L369-V396 HydrophobicContact CD2-CG1 3.49Å; L369-V396 VanDerWaalsContact CD2-CG1 3.49Å; V396-A400 HydrophobicContact CG2-CB 4.42Å; V396-G426 WeakPolarHBondContact CA-O 3.31Å; V396-F427 HydrophobicContact CB-CD1 4.01Å; V396-F427 HydrophobicContact CB-CE1 4.05Å; V396-F427 HydrophobicContact CB-CG 4.46Å; V396-F427 HydrophobicContact CG2-CD1 3.65Å; V396-F427 HydrophobicContact CG2-CD2 3.89Å; V396-F427 HydrophobicContact CG2-CE1 3.42Å; V396-F427 VanDerWaalsContact CG2-CE1 3.42Å; V396-F427 HydrophobicContact CG2-CE2 3.68Å; V396-F427 HydrophobicContact CG2-CG 3.9Å; V396-F427 HydrophobicContact CG2-CZ 3.45Å; V396-F427 VanDerWaalsContact CG2-CZ 3.45Å; V396-V491 CarbonylContact O-C 3.53Å; V396-V491 WeakPolarHBondContact O-CA 3.4Å; V396-V491 WeakPolarHBondContact O-CB 3.34Å; V396-R492 HydrophobicContact CG1-CB 4.47Å; V396-R492 PolarHBondContact N-O 3.21Å; V396-R492 PolarHBondContact O-N 2.85Å; V396-Y494 HydrophobicContact CB-CG 4.47Å; V396-Y494 HydrophobicContact CG1-CD2 4.45Å
397	R	94.5	Very high	82.5	Confident	87 Å²	87	40.5 Å²	40.5	33%	0.328	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	132.1	171.5	-171	178.2	-70.4	-179.8	3.5	110.8	Q399 A400 H401 G426 W428 H487 F488 E490	R397-Q399 VanDerWaalsContact C-N 3.29Å; R397-Q399 PolarHBondContact O-N 2.79Å; R397-A400 HydrophobicContact CB-CB 4.03Å; R397-A400 WeakPolarHBondContact O-CB 3.4Å; R397-A400 PolarHBondContact O-N 2.74Å; R397-H401 PolarHBondContact O-N 2.88Å; R397-H401 VanDerWaalsContact O-N 3.17Å; R397-G426 PolarHBondContact N-O 2.81Å; R397-W428 HydrophobicContact CB-CH2 4.44Å; R397-W428 HydrophobicContact CB-CZ3 4.08Å; R397-H487 PolarHBondContact NH2-O 3.01Å; R397-F488 PolarHBondContact NE-O 3.49Å; R397-E490 WeakPolarHBondContact CA-O 3.32Å
398	V	90.1	Very high	81.2	Confident	46 Å²	46	41.2 Å²	41.2	28%	0.279	23%	0.231	S	C	.	.	H	α-helix	trans	-55.3	-43.9	-177.4	173.5	0	0	0	0	112	V373 A400 H401 A402 E490 R492	V373-V398 HydrophobicContact CG1-CG2 3.96Å; V373-V398 HydrophobicContact CG2-CG2 4.29Å; V398-A400 VanDerWaalsContact C-N 3.34Å; V398-A400 PolarHBondContact O-N 3.29Å; V398-H401 WeakPolarHBondContact O-CB 3.47Å; V398-H401 PolarHBondContact O-N 2.58Å; V398-A402 PolarHBondContact O-N 2.97Å; V398-E490 HydrophobicContact CB-CB 4.43Å; V398-E490 HydrophobicContact CG2-CB 4.07Å; V398-E490 WeakPolarHBondContact CG2-O 3.23Å; V398-E490 PolarHBondContact N-O 3.4Å; V398-R492 HydrophobicContact CG2-CG 4.02Å
399	Q	82.1	Confident	79.5	Confident	132 Å²	132	47.7 Å²	47.7	62%	0.617	27%	0.266	S	S	*	.	H	α-helix	trans	-66.5	-34.3	178.4	-66.8	-179	-12.4	0	0	113	R397 H401 A402 Q403	R397-Q399 VanDerWaalsContact C-N 3.29Å; R397-Q399 PolarHBondContact O-N 2.79Å; Q399-H401 VanDerWaalsContact C-N 3.34Å; Q399-A402 PolarHBondContact O-N 3.47Å; Q399-Q403 WeakPolarHBondContact O-CG 3.29Å; Q399-Q403 PolarHBondContact O-N 3.45Å
400	A	78.5	Confident	78	Confident	9 Å²	9	52.3 Å²	52.3	7%	0.074	29%	0.293	C	S	.	.	H	α-helix	trans	-66.5	-38.8	178	0	0	0	0	0	111.6	V396 R397 V398 Q403 A404 S425 F427	V396-A400 HydrophobicContact CG2-CB 4.42Å; R397-A400 HydrophobicContact CB-CB 4.03Å; R397-A400 WeakPolarHBondContact O-CB 3.4Å; R397-A400 PolarHBondContact O-N 2.74Å; V398-A400 VanDerWaalsContact C-N 3.34Å; V398-A400 PolarHBondContact O-N 3.29Å; A400-Q403 PolarHBondContact O-N 3Å; A400-A404 WeakPolarHBondContact O-CB 3.46Å; A400-A404 PolarHBondContact O-N 3.2Å; A400-S425 WeakPolarHBondContact CB-O 3.31Å; A400-F427 HydrophobicContact CB-CE2 4.18Å
401	H	76.3	Confident	75.8	Confident	17 Å²	17	54.1 Å²	54.1	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-58.8	-48.9	172.8	174.8	-107.9	0	0	0	111.9	F362 R397 V398 Q399 Q403 A404 Q405	F362-H401 AromaticContact CE1-CD2 3.61Å; F362-H401 AromaticContact CE1-NE2 3.96Å; F362-H401 AromaticContact CE2-NE2 3.9Å; F362-H401 AromaticContact CZ-CD2 3.32Å; F362-H401 WeakPolarHBondContact CZ-CD2 3.3Å; F362-H401 AromaticContact CZ-NE2 3.66Å; R397-H401 PolarHBondContact O-N 2.88Å; R397-H401 VanDerWaalsContact O-N 3.17Å; V398-H401 WeakPolarHBondContact O-CB 3.47Å; V398-H401 PolarHBondContact O-N 2.58Å; Q399-H401 VanDerWaalsContact C-N 3.34Å; H401-Q403 VanDerWaalsContact C-N 3.32Å; H401-Q403 PolarHBondContact O-N 2.74Å; H401-A404 PolarHBondContact O-N 2.81Å; H401-Q405 PolarHBondContact CE1-NE2 3.34Å; H401-Q405 PolarHBondContact CE1-OE1 3.33Å; H401-Q405 PolarHBondContact NE2-NE2 2.91Å; H401-Q405 PolarHBondContact O-N 2.8Å; H401-Q405 VanDerWaalsContact O-N 3.12Å
402	A	73.9	Confident	73.7	Confident	57 Å²	57	57.2 Å²	57.2	47%	0.471	35%	0.348	S	S	.	.	H	α-helix	trans	-62	-39.4	179.2	0	0	0	0	0	112.5	V398 Q399 Q405 A406	V398-A402 PolarHBondContact O-N 2.97Å; Q399-A402 PolarHBondContact O-N 3.47Å; A402-Q405 PolarHBondContact O-N 3.22Å; A402-A406 WeakPolarHBondContact O-CB 3.41Å; A402-A406 PolarHBondContact O-N 3.24Å
403	Q	70.4	Confident	71	Confident	120 Å²	120	65.5 Å²	65.5	56%	0.561	39%	0.388	S	S	*	.	H	α-helix	trans	-68.2	-41.8	176.8	-72.7	172.6	-3.9	0	0	112.4	Q399 A400 H401 Q405 A406 Q407	Q399-Q403 WeakPolarHBondContact O-CG 3.29Å; Q399-Q403 PolarHBondContact O-N 3.45Å; A400-Q403 PolarHBondContact O-N 3Å; H401-Q403 VanDerWaalsContact C-N 3.32Å; H401-Q403 PolarHBondContact O-N 2.74Å; Q403-Q405 VanDerWaalsContact C-N 3.26Å; Q403-Q405 PolarHBondContact O-N 2.86Å; Q403-A406 PolarHBondContact O-N 3.01Å; Q403-Q407 WeakPolarHBondContact O-CG 3.49Å; Q403-Q407 PolarHBondContact O-N 3.41Å; Q403-Q407 VanDerWaalsContact O-N 3.07Å
404	A	69.4	Low	68	Low	26 Å²	26	69.3 Å²	69.3	22%	0.215	43%	0.427	C	S	.	.	H	α-helix	trans	-60.5	-36.7	176.5	0	0	0	0	0	111.8	A400 H401 A408	A400-A404 WeakPolarHBondContact O-CB 3.46Å; A400-A404 PolarHBondContact O-N 3.2Å; H401-A404 PolarHBondContact O-N 2.81Å; A404-A408 PolarHBondContact O-N 3.45Å
405	Q	67.2	Low	65.1	Low	32 Å²	32	76.6 Å²	76.6	15%	0.15	46%	0.461	C	S	.	.	H	α-helix	trans	-73.6	-44.3	176.1	-73.5	-175.8	-24.9	0	0	112.9	P359 E360 R361 H401 A402 Q403 Q407 A408 D409	P359-Q405 PolarHBondContact O-NE2 3.49Å; P359-Q405 PolarHBondContact O-OE1 2.92Å; E360-Q405 PolarHBondContact O-NE2 3.23Å; R361-Q405 VanDerWaalsContact C-NE2 3.25Å; R361-Q405 PolarHBondContact O-NE2 2.94Å; R361-Q405 VanDerWaalsContact O-NE2 3.07Å; H401-Q405 PolarHBondContact CE1-NE2 3.34Å; H401-Q405 PolarHBondContact CE1-OE1 3.33Å; H401-Q405 PolarHBondContact NE2-NE2 2.91Å; H401-Q405 PolarHBondContact O-N 2.8Å; H401-Q405 VanDerWaalsContact O-N 3.12Å; A402-Q405 PolarHBondContact O-N 3.22Å; Q403-Q405 VanDerWaalsContact C-N 3.26Å; Q403-Q405 PolarHBondContact O-N 2.86Å; Q405-Q407 PolarHBondContact O-N 2.88Å; Q405-A408 WeakPolarHBondContact O-CB 3.36Å; Q405-A408 PolarHBondContact O-N 3.27Å; Q405-A408 VanDerWaalsContact O-N 3.1Å; Q405-D409 PolarHBondContact O-N 2.95Å
406	A	62.8	Low	62.3	Low	60 Å²	60	82.7 Å²	82.7	50%	0.496	50%	0.504	S	S	.	.	H	α-helix	trans	-60.7	-31.9	177.9	0	0	0	0	0	112.9	A402 Q403 V410	A402-A406 WeakPolarHBondContact O-CB 3.41Å; A402-A406 PolarHBondContact O-N 3.24Å; Q403-A406 PolarHBondContact O-N 3.01Å; A406-V410 WeakPolarHBondContact O-CG2 3.44Å
407	Q	59.5	Low	59.8	Low	148 Å²	148	90.7 Å²	90.7	69%	0.692	54%	0.541	S	S	*	.	H	α-helix	trans	-77.7	-27.6	177	-72.5	175.6	-6.7	0	0	113.3	Q403 Q405 D409 V410	Q403-Q407 WeakPolarHBondContact O-CG 3.49Å; Q403-Q407 PolarHBondContact O-N 3.41Å; Q403-Q407 VanDerWaalsContact O-N 3.07Å; Q405-Q407 PolarHBondContact O-N 2.88Å; Q407-D409 VanDerWaalsContact C-N 3.31Å; Q407-D409 PolarHBondContact O-N 3.32Å; Q407-V410 PolarHBondContact O-N 3.46Å
408	A	56.9	Low	57.5	Low	49 Å²	49	90.4 Å²	90.4	41%	0.405	55%	0.552	S	S	.	*	H	α-helix	trans	-67.8	-30.1	176.2	0	0	0	0	0	112.7	A404 Q405 V410	A404-A408 PolarHBondContact O-N 3.45Å; Q405-A408 WeakPolarHBondContact O-CB 3.36Å; Q405-A408 PolarHBondContact O-N 3.27Å; Q405-A408 VanDerWaalsContact O-N 3.1Å; A408-V410 VanDerWaalsContact C-N 3.34Å; A408-V410 PolarHBondContact O-N 3.46Å
409	D	51.2	Low	55.7	Low	145 Å²	145	90.4 Å²	90.4	78%	0.775	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-12.1	179.9	-85.1	-14.2	0	0	0	114.5	Q405 Q407	Q405-D409 PolarHBondContact O-N 2.95Å; Q407-D409 VanDerWaalsContact C-N 3.31Å; Q407-D409 PolarHBondContact O-N 3.32Å
410	V	50.3	Low	54.5	Low	124 Å²	124	91.3 Å²	91.3	75%	0.752	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-8.9	-175.6	-172.9	0	0	0	0	112.6	A406 Q407 A408 G412	A406-V410 WeakPolarHBondContact O-CG2 3.44Å; Q407-V410 PolarHBondContact O-N 3.46Å; A408-V410 VanDerWaalsContact C-N 3.34Å; A408-V410 PolarHBondContact O-N 3.46Å; V410-G412 PolarHBondContact O-N 2.91Å; V410-G412 VanDerWaalsContact O-N 3.12Å
411	G	41.7	Very low	54.4	Low	65 Å²	65	93.1 Å²	93.1	67%	0.67	56%	0.559	S	S	*	*			trans	-86.1	76	-171.3	0	0	0	0	0	115.7
412	G	46.1	Very low	54.7	Low	66 Å²	66	93.3 Å²	93.3	68%	0.68	56%	0.561	S	S	*	*			trans	-79.1	125.7	148.9	0	0	0	0	0	109.4	V410	V410-G412 PolarHBondContact O-N 2.91Å; V410-G412 VanDerWaalsContact O-N 3.12Å
413	E	36.1	Very low	55.3	Low	192 Å²	192	92.3 Å²	92.3	90%	0.897	55%	0.549	S	S	*	.	S	Bend	trans	82.8	101.8	170.1	-54.9	-177.6	165.2	0	0	118.3	H415	E413-H415 PolarHBondContact O-N 2.65Å
414	G	34.4	Very low	56	Low	81 Å²	81	96.3 Å²	96.3	84%	0.835	56%	0.559	S	S	*	*				97.1	-5.3	121.5	0	0	0	0	0	120.1
415	H	34.4	Very low	56.7	Low	152 Å²	152	97.8 Å²	97.8	70%	0.704	57%	0.567	S	S	*	*			trans	-114.5	113.5	173.1	-64.9	81	0	0	0	110.3	E413 H417	E413-H415 PolarHBondContact O-N 2.65Å; H415-H417 VanDerWaalsContact C-N 3.27Å; H415-H417 PolarHBondContact O-CD2 3.26Å; H415-H417 PolarHBondContact O-N 2.93Å
416	S	37.4	Very low	57.9	Low	128 Å²	128	96.4 Å²	96.4	90%	0.895	56%	0.562	S	S	*	*			trans	-61.3	91.1	169.9	-174.5	0	0	0	0	108.4	S418	S416-S418 PolarHBondContact O-N 3.32Å
417	H	42.7	Very low	59.3	Low	168 Å²	168	93.7 Å²	93.7	78%	0.778	54%	0.539	S	S	*	.			trans	-69.3	104.8	176.9	-74.8	-76.3	0	0	0	108.3	H415 C419	H415-H417 VanDerWaalsContact C-N 3.27Å; H415-H417 PolarHBondContact O-CD2 3.26Å; H415-H417 PolarHBondContact O-N 2.93Å; H417-C419 PolarHBondContact O-N 2.62Å
418	S	45.7	Very low	61	Low	81 Å²	81	87.1 Å²	87.1	57%	0.566	51%	0.508	S	S	*	.			trans	-46.3	117	173.1	-171.7	0	0	0	0	110.3	S416 Y420	S416-S418 PolarHBondContact O-N 3.32Å; S418-Y420 PolarHBondContact O-N 3.31Å; S418-Y420 WeakPolarHBondContact OG-CD2 3.44Å
419	C	53.2	Low	62.7	Low	46 Å²	46	85.2 Å²	85.2	31%	0.311	49%	0.49	S	S	.	.			trans	-69.9	26	177.7	59.5	0	0	0	0	113.8	A365 R392 H417 H421	A365-C419 HydrophobicContact CB-CB 4.44Å; R392-C419 PolarHBondContact NH1-O 3.15Å; H417-C419 PolarHBondContact O-N 2.62Å; C419-H421 PolarHBondContact O-N 3.41Å
420	Y	57.3	Low	64.7	Low	151 Å²	151	78.3 Å²	78.3	59%	0.592	45%	0.453	S	S	*	.			trans	-100	84.1	-179.1	-69.6	-101	0	0	0	107.9	S418	S418-Y420 PolarHBondContact O-N 3.31Å; S418-Y420 WeakPolarHBondContact OG-CD2 3.44Å
421	H	75.4	Confident	66.6	Low	47 Å²	47	72.7 Å²	72.7	22%	0.218	42%	0.42	C	S	.	.			trans	-76	129.2	168	-58.6	-65.6	0	0	0	109.1	C419 F427 Y429	C419-H421 PolarHBondContact O-N 3.41Å; H421-F427 HydrophobicContact CB-CB 3.89Å; H421-F427 HydrophobicContact CB-CD1 3.78Å; H421-F427 HydrophobicContact CB-CD2 3.36Å; H421-F427 HydrophobicContact CB-CE1 4.07Å; H421-F427 HydrophobicContact CB-CE2 3.68Å; H421-F427 HydrophobicContact CB-CG 3.41Å; H421-F427 VanDerWaalsContact CB-CG 3.41Å; H421-F427 HydrophobicContact CB-CZ 4.01Å; H421-F427 AromaticContact CD2-CE1 3.84Å; H421-F427 AromaticContact CD2-CZ 3.72Å; H421-F427 AromaticContact CG-CD2 3.91Å; H421-F427 AromaticContact CG-CE2 3.66Å; H421-F427 AromaticContact CG-CZ 3.72Å; H421-F427 AromaticContact ND1-CE2 3.95Å; H421-Y429 VanDerWaalsContact O-CE1 3.3Å; H421-Y429 WeakPolarHBondContact O-CE1 3.48Å; H421-Y429 PolarHBondContact O-OH 2.91Å; H421-Y429 VanDerWaalsContact O-OH 3.11Å
422	D	81.9	Confident	68.8	Low	22 Å²	22	71.4 Å²	71.4	12%	0.118	40%	0.395	C	S	.	.			trans	-106.3	-179.6	-179.5	68.5	-2.8	0	0	0	111.7	R424 S425 G426 F427	D422-R424 PolarHBondContact O-N 3.22Å; D422-R424 WeakPolarHBondContact OD1-CB 3.46Å; D422-R424 PolarHBondContact OD1-N 3.5Å; D422-R424 IonicContact OD2-CZ 3.77Å; D422-R424 VanDerWaalsContact OD2-CZ 3.26Å; D422-R424 IonicContact OD2-NE 3.54Å; D422-R424 PolarHBondContact OD2-NE 3.35Å; D422-R424 IonicContact OD2-NH2 2.68Å; D422-R424 PolarHBondContact OD2-NH2 3.35Å; D422-S425 WeakPolarHBondContact O-CB 3.35Å; D422-S425 PolarHBondContact O-N 3.4Å; D422-S425 VanDerWaalsContact O-N 3.08Å; D422-S425 WeakPolarHBondContact OD1-CB 3.35Å; D422-S425 PolarHBondContact OD1-N 3.39Å; D422-S425 PolarHBondContact OD1-OG 3.16Å; D422-G426 PolarHBondContact O-N 3.45Å; D422-F427 CarbonylContact C-O 3.6Å; D422-F427 PolarHBondContact O-N 2.9Å; D422-F427 VanDerWaalsContact O-N 3.15Å
423	T	86.8	Confident	70.2	Confident	35 Å²	35	70.5 Å²	70.5	22%	0.215	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-58.9	-33.7	177.1	55	0	0	0	0	113	S425 G426 F427 W428 S444 D445 F484	T423-S425 VanDerWaalsContact C-N 3.28Å; T423-S425 PolarHBondContact O-N 3.29Å; T423-G426 PolarHBondContact O-N 2.82Å; T423-F427 WeakPolarHBondContact CA-O 3.49Å; T423-F427 PolarHBondContact N-O 2.83Å; T423-W428 HydrophobicContact CG2-CG 4.46Å; T423-S444 WeakPolarHBondContact CG2-OG 3.36Å; T423-D445 HydrophobicContact CG2-CB 4.2Å; T423-F484 HydrophobicContact CG2-CD1 3.98Å; T423-F484 HydrophobicContact CG2-CE1 3.61Å
424	R	84.8	Confident	71.8	Confident	204 Å²	204	66.8 Å²	66.8	77%	0.77	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-66.6	-32.1	176.6	-64.7	178.8	-70.8	-140.1	-4.4	112.4	D422 G426	D422-R424 PolarHBondContact O-N 3.22Å; D422-R424 WeakPolarHBondContact OD1-CB 3.46Å; D422-R424 PolarHBondContact OD1-N 3.5Å; D422-R424 IonicContact OD2-CZ 3.77Å; D422-R424 VanDerWaalsContact OD2-CZ 3.26Å; D422-R424 IonicContact OD2-NE 3.54Å; D422-R424 PolarHBondContact OD2-NE 3.35Å; D422-R424 IonicContact OD2-NH2 2.68Å; D422-R424 PolarHBondContact OD2-NH2 3.35Å; R424-G426 PolarHBondContact O-N 2.96Å
425	S	85.4	Confident	73.1	Confident	57 Å²	57	64.7 Å²	64.7	40%	0.399	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-79.1	1.3	174.6	-51.4	0	0	0	0	112.7	A400 D422 T423 F427	A400-S425 WeakPolarHBondContact CB-O 3.31Å; D422-S425 WeakPolarHBondContact O-CB 3.35Å; D422-S425 PolarHBondContact O-N 3.4Å; D422-S425 VanDerWaalsContact O-N 3.08Å; D422-S425 WeakPolarHBondContact OD1-CB 3.35Å; D422-S425 PolarHBondContact OD1-N 3.39Å; D422-S425 PolarHBondContact OD1-OG 3.16Å; T423-S425 VanDerWaalsContact C-N 3.28Å; T423-S425 PolarHBondContact O-N 3.29Å; S425-F427 WeakPolarHBondContact O-CD2 3.36Å
426	G	90.9	Very high	74	Confident	4 Å²	4	64.6 Å²	64.6	4%	0.041	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	25.4	-180	0	0	0	0	0	114.4	V396 R397 D422 T423 R424 W428	V396-G426 WeakPolarHBondContact CA-O 3.31Å; R397-G426 PolarHBondContact N-O 2.81Å; D422-G426 PolarHBondContact O-N 3.45Å; T423-G426 PolarHBondContact O-N 2.82Å; R424-G426 PolarHBondContact O-N 2.96Å; G426-W428 VanDerWaalsContact C-CZ3 3.45Å; G426-W428 WeakPolarHBondContact O-CZ3 3.32Å
427	F	92.7	Very high	75.1	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.009	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	118.2	177	-70.9	-109.9	0	0	0	110.5	V396 A400 H421 D422 T423 S425 Y429 S444 Y494	V396-F427 HydrophobicContact CB-CD1 4.01Å; V396-F427 HydrophobicContact CB-CE1 4.05Å; V396-F427 HydrophobicContact CB-CG 4.46Å; V396-F427 HydrophobicContact CG2-CD1 3.65Å; V396-F427 HydrophobicContact CG2-CD2 3.89Å; V396-F427 HydrophobicContact CG2-CE1 3.42Å; V396-F427 VanDerWaalsContact CG2-CE1 3.42Å; V396-F427 HydrophobicContact CG2-CE2 3.68Å; V396-F427 HydrophobicContact CG2-CG 3.9Å; V396-F427 HydrophobicContact CG2-CZ 3.45Å; V396-F427 VanDerWaalsContact CG2-CZ 3.45Å; A400-F427 HydrophobicContact CB-CE2 4.18Å; H421-F427 HydrophobicContact CB-CB 3.89Å; H421-F427 HydrophobicContact CB-CD1 3.78Å; H421-F427 HydrophobicContact CB-CD2 3.36Å; H421-F427 HydrophobicContact CB-CE1 4.07Å; H421-F427 HydrophobicContact CB-CE2 3.68Å; H421-F427 HydrophobicContact CB-CG 3.41Å; H421-F427 VanDerWaalsContact CB-CG 3.41Å; H421-F427 HydrophobicContact CB-CZ 4.01Å; H421-F427 AromaticContact CD2-CE1 3.84Å; H421-F427 AromaticContact CD2-CZ 3.72Å; H421-F427 AromaticContact CG-CD2 3.91Å; H421-F427 AromaticContact CG-CE2 3.66Å; H421-F427 AromaticContact CG-CZ 3.72Å; H421-F427 AromaticContact ND1-CE2 3.95Å; D422-F427 CarbonylContact C-O 3.6Å; D422-F427 PolarHBondContact O-N 2.9Å; D422-F427 VanDerWaalsContact O-N 3.15Å; T423-F427 WeakPolarHBondContact CA-O 3.49Å; T423-F427 PolarHBondContact N-O 2.83Å; S425-F427 WeakPolarHBondContact O-CD2 3.36Å; F427-Y429 HydrophobicContact CB-CD1 4.1Å; F427-Y429 HydrophobicContact CB-CE1 4.1Å; F427-S444 WeakPolarHBondContact O-CB 3.19Å; F427-S444 PolarHBondContact O-OG 3.23Å; F427-Y494 HydrophobicContact CD1-CD1 4.44Å; F427-Y494 HydrophobicContact CD1-CD2 4.31Å; F427-Y494 HydrophobicContact CD1-CE1 4.32Å; F427-Y494 HydrophobicContact CD1-CE2 4.19Å; F427-Y494 HydrophobicContact CD1-CG 4.43Å; F427-Y494 HydrophobicContact CE1-CD2 4.13Å; F427-Y494 AromaticContact CE1-CE2 3.87Å; F427-Y494 HydrophobicContact CE1-CE2 3.87Å
428	W	94.9	Very high	76.1	Confident	10 Å²	10	59.3 Å²	59.3	4%	0.038	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	106.2	177.7	-59	-91.5	0	0	0	108.8	G394 V395 R397 T423 G426 S444 L470 F484 A486 F488 V491	G394-W428 CarbonylContact C-O 3.56Å; G394-W428 VanDerWaalsContact CA-O 3.24Å; G394-W428 WeakPolarHBondContact CA-O 3.42Å; V395-W428 HydrophobicContact CG2-CB 4.2Å; V395-W428 HydrophobicContact CG2-CE3 4.11Å; V395-W428 PolarHBondContact N-O 3.38Å; V395-W428 PolarHBondContact O-N 3.32Å; R397-W428 HydrophobicContact CB-CH2 4.44Å; R397-W428 HydrophobicContact CB-CZ3 4.08Å; T423-W428 HydrophobicContact CG2-CG 4.46Å; G426-W428 VanDerWaalsContact C-CZ3 3.45Å; G426-W428 WeakPolarHBondContact O-CZ3 3.32Å; W428-S444 WeakPolarHBondContact CA-OG 3.41Å; W428-L470 HydrophobicContact CB-CD2 3.55Å; W428-F484 HydrophobicContact CB-CD2 4.27Å; W428-F484 HydrophobicContact CB-CE2 4.38Å; W428-F484 HydrophobicContact CB-CG 4.32Å; W428-F484 AromaticContact CD1-CD1 3.66Å; W428-F484 AromaticContact CD1-CG 3.91Å; W428-A486 HydrophobicContact CZ2-CB 4.22Å; W428-F488 HydrophobicContact CB-CE1 4.43Å; W428-F488 AromaticContact CD1-CE1 3.9Å; W428-F488 AromaticContact CD2-CD1 3.67Å; W428-F488 HydrophobicContact CD2-CD1 3.67Å; W428-F488 AromaticContact CD2-CE1 3.74Å; W428-F488 HydrophobicContact CD2-CE1 3.74Å; W428-F488 AromaticContact CE2-CD1 3.78Å; W428-F488 AromaticContact CE2-CE1 3.84Å; W428-F488 AromaticContact CE3-CD1 3.78Å; W428-F488 HydrophobicContact CE3-CD1 3.78Å; W428-F488 HydrophobicContact CE3-CE1 4.28Å; W428-F488 HydrophobicContact CG-CD1 4.21Å; W428-F488 AromaticContact CG-CE1 3.79Å; W428-F488 HydrophobicContact CG-CE1 3.79Å; W428-F488 HydrophobicContact CH2-CD1 4.08Å; W428-F488 HydrophobicContact CZ2-CD1 4Å; W428-F488 HydrophobicContact CZ2-CE1 4.45Å; W428-F488 AromaticContact CZ3-CD1 3.97Å; W428-F488 HydrophobicContact CZ3-CD1 3.97Å; W428-F488 AromaticContact NE1-CE1 3.92Å; W428-V491 HydrophobicContact CZ3-CG1 4.25Å
429	Y	94	Very high	77.4	Confident	9 Å²	9	58.3 Å²	58.3	4%	0.035	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	161.3	-177.4	62.6	-106.7	0	0	0	112.2	R392 V393 H421 F427 C431 T443 S444 Y494	R392-Y429 HydrophobicContact CB-CD2 3.87Å; R392-Y429 HydrophobicContact CB-CE2 4.31Å; R392-Y429 HydrophobicContact CB-CG 4.12Å; R392-Y429 HydrophobicContact CG-CD2 4.13Å; R392-Y429 HydrophobicContact CG-CE2 4.07Å; V393-Y429 WeakPolarHBondContact O-CA 2.98Å; V393-Y429 WeakPolarHBondContact O-CB 3.11Å; H421-Y429 VanDerWaalsContact O-CE1 3.3Å; H421-Y429 WeakPolarHBondContact O-CE1 3.48Å; H421-Y429 PolarHBondContact O-OH 2.91Å; H421-Y429 VanDerWaalsContact O-OH 3.11Å; F427-Y429 HydrophobicContact CB-CD1 4.1Å; F427-Y429 HydrophobicContact CB-CE1 4.1Å; Y429-C431 HydrophobicContact CD2-CB 4Å; Y429-C431 HydrophobicContact CE2-CB 3.98Å; Y429-T443 CarbonylContact O-C 3.6Å; Y429-T443 WeakPolarHBondContact O-CA 3.43Å; Y429-S444 PolarHBondContact N-OG 3.14Å; Y429-S444 VanDerWaalsContact N-OG 3.15Å; Y429-S444 PolarHBondContact O-N 3.23Å; Y429-Y494 HydrophobicContact CD1-CD1 4.06Å; Y429-Y494 AromaticContact CD1-CE1 3.82Å; Y429-Y494 HydrophobicContact CD1-CE1 3.82Å; Y429-Y494 HydrophobicContact CE1-CE1 4.26Å; Y429-Y494 HydrophobicContact CG-CD1 4.47Å; Y429-Y494 HydrophobicContact CG-CE1 4.37Å
430	L	93.3	Very high	78.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	140.9	168	-169.4	137.8	0	0	0	107.9	W391 R392 V393 C441 M442 L451 L459 F472 L481	W391-L430 HydrophobicContact CH2-CD2 3.48Å; W391-L430 VanDerWaalsContact CH2-CD2 3.48Å; W391-L430 HydrophobicContact CZ3-CD2 3.66Å; W391-L430 WeakPolarHBondContact CZ3-O 3.3Å; R392-L430 WeakPolarHBondContact CA-O 3.48Å; V393-L430 PolarHBondContact N-O 3.03Å; V393-L430 PolarHBondContact O-N 3.49Å; L430-C441 WeakPolarHBondContact CD2-SG 3.08Å; L430-M442 CarbonylContact C-O 3.58Å; L430-M442 WeakPolarHBondContact CA-O 3.43Å; L430-L451 HydrophobicContact CD1-CD1 3.64Å; L430-L451 HydrophobicContact CG-CD1 4.36Å; L430-L459 HydrophobicContact CD2-CD1 4.23Å; L430-L459 HydrophobicContact CD2-CD2 4.02Å; L430-F472 HydrophobicContact CB-CD1 3.96Å; L430-F472 HydrophobicContact CB-CD2 4.45Å; L430-F472 HydrophobicContact CB-CE1 4.08Å; L430-F472 HydrophobicContact CB-CG 4.15Å; L430-F472 HydrophobicContact CB-CZ 4.38Å; L430-F472 HydrophobicContact CD1-CB 3.9Å; L430-F472 HydrophobicContact CD1-CD2 4.48Å; L430-F472 HydrophobicContact CD1-CG 4.07Å; L430-L481 HydrophobicContact CD1-CB 4.09Å; L430-L481 HydrophobicContact CD1-CD1 4.31Å; L430-L481 HydrophobicContact CD2-CD1 4.44Å
431	C	90.1	Very high	79.9	Confident	7 Å²	7	52.9 Å²	52.9	5%	0.047	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	153.3	-173.2	71.4	0	0	0	0	113.5	W391 R392 Y429 C441 M442	W391-C431 CarbonylContact O-C 3.56Å; W391-C431 WeakPolarHBondContact O-CA 3.35Å; W391-C431 VanDerWaalsContact O-CB 3.26Å; W391-C431 WeakPolarHBondContact O-CB 3.38Å; R392-C431 HydrophobicContact CB-CB 4.12Å; R392-C431 HydrophobicContact CG-CB 3.65Å; Y429-C431 HydrophobicContact CD2-CB 4Å; Y429-C431 HydrophobicContact CE2-CB 3.98Å; C431-C441 CarbonylContact O-C 3.51Å; C431-C441 VanDerWaalsContact O-CA 3.26Å; C431-C441 WeakPolarHBondContact O-CA 3.41Å; C431-C441 PolarHBondContact O-SG 3.07Å; C431-C441 VanDerWaalsContact O-SG 3.38Å; C431-M442 PolarHBondContact N-O 3.35Å; C431-M442 PolarHBondContact O-N 3.24Å
432	R	88	Confident	80.4	Confident	38 Å²	38	54 Å²	54	14%	0.143	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	123.2	162.2	-178.6	-177.6	-174	176.2	0.1	108.6	G387 L388 P389 S390 W391 D439 M455	G387-R432 PolarHBondContact O-NH1 3.28Å; G387-R432 VanDerWaalsContact O-NH1 3.08Å; L388-R432 VanDerWaalsContact O-CD 3.23Å; L388-R432 WeakPolarHBondContact O-CD 3.41Å; L388-R432 PolarHBondContact O-NH1 3.34Å; P389-R432 WeakPolarHBondContact O-CD 3.5Å; P389-R432 PolarHBondContact O-NE 3.5Å; S390-R432 WeakPolarHBondContact CA-O 3.49Å; S390-R432 PolarHBondContact OG-O 3.11Å; W391-R432 HydrophobicContact CD2-CB 3.95Å; W391-R432 HydrophobicContact CG-CB 4.18Å; W391-R432 HydrophobicContact CZ2-CB 3.88Å; W391-R432 PolarHBondContact N-O 3.3Å; W391-R432 PolarHBondContact O-N 3.31Å; R432-D439 IonicContact CZ-OD2 2.68Å; R432-D439 IonicContact NE-OD2 3.48Å; R432-D439 PolarHBondContact NE-OD2 3.19Å; R432-D439 IonicContact NH2-OD2 3.14Å; R432-D439 PolarHBondContact NH2-OD2 2.67Å; R432-M455 HydrophobicContact CB-CE 3.5Å; R432-M455 VanDerWaalsContact CB-CE 3.5Å; R432-M455 HydrophobicContact CG-CE 3.39Å; R432-M455 HydrophobicContact CG-SD 4.35Å
433	T	74.1	Confident	80.8	Confident	46 Å²	46	53.6 Å²	53.6	28%	0.282	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	128.9	171.8	-45.4	0	0	0	0	108.9	G435 H440 M442	T433-G435 PolarHBondContact O-N 2.96Å; T433-H440 PolarHBondContact N-O 3.44Å; T433-H440 PolarHBondContact O-N 3.18Å; T433-M442 HydrophobicContact CG2-CE 4.33Å; T433-M442 WeakPolarHBondContact OG1-CE 3.47Å
434	Q	69.7	Low	80.9	Confident	114 Å²	114	52.1 Å²	52.1	53%	0.533	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	109.3	175.8	-169.1	172.3	31.8	0	0	108.5	D439	Q434-D439 WeakPolarHBondContact CA-OD1 3.21Å
435	G	61.6	Low	80.9	Confident	37 Å²	37	44.8 Å²	44.8	38%	0.381	26%	0.257	S	S	.	.			trans	-102.5	166.4	-177.2	0	0	0	0	0	113.3	T433 G438	T433-G435 PolarHBondContact O-N 2.96Å; G435-G438 WeakPolarHBondContact CA-O 3.34Å; G435-G438 PolarHBondContact N-O 3.14Å
436	V	54.9	Low	80.2	Confident	150 Å²	150	47.7 Å²	47.7	91%	0.909	27%	0.273	S	S	*	.	S	Bend	trans	-74.5	-31.4	175.7	-177	0	0	0	0	111.5
437	D	59	Low	79.3	Confident	154 Å²	154	51.7 Å²	51.7	82%	0.824	31%	0.306	S	S	*	.	S	Bend	trans	-97.1	11.1	-179.1	-60	-48	0	0	0	113.5
438	G	64.9	Low	78.5	Confident	31 Å²	31	53.9 Å²	53.9	32%	0.32	32%	0.319	S	S	.	.			trans	125.5	167.3	-177.1	0	0	0	0	0	113.1	G435 H440	G435-G438 WeakPolarHBondContact CA-O 3.34Å; G435-G438 PolarHBondContact N-O 3.14Å; G438-H440 PolarHBondContact O-CD2 2.73Å
439	D	73.4	Confident	77.4	Confident	60 Å²	60	57 Å²	57	32%	0.321	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	130.8	173.3	-70.7	-18	0	0	0	109.7	R432 Q434	R432-D439 IonicContact CZ-OD2 2.68Å; R432-D439 IonicContact NE-OD2 3.48Å; R432-D439 PolarHBondContact NE-OD2 3.19Å; R432-D439 IonicContact NH2-OD2 3.14Å; R432-D439 PolarHBondContact NH2-OD2 2.67Å; Q434-D439 WeakPolarHBondContact CA-OD1 3.21Å
440	H	76.6	Confident	76.5	Confident	79 Å²	79	59.6 Å²	59.6	37%	0.366	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	147.6	178.4	-59.4	-59.6	0	0	0	111.5	T433 G438 P450	T433-H440 PolarHBondContact N-O 3.44Å; T433-H440 PolarHBondContact O-N 3.18Å; G438-H440 PolarHBondContact O-CD2 2.73Å; H440-P450 HydrophobicContact CB-CB 4.17Å
441	C	84.7	Confident	75.7	Confident	4 Å²	4	61 Å²	61	3%	0.027	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128	170.4	-164.4	0	0	0	0	109.7	L430 C431 L451 M455	L430-C441 WeakPolarHBondContact CD2-SG 3.08Å; C431-C441 CarbonylContact O-C 3.51Å; C431-C441 VanDerWaalsContact O-CA 3.26Å; C431-C441 WeakPolarHBondContact O-CA 3.41Å; C431-C441 PolarHBondContact O-SG 3.07Å; C431-C441 VanDerWaalsContact O-SG 3.38Å; C441-L451 HydrophobicContact CB-CB 4.2Å; C441-L451 HydrophobicContact CB-CD1 4.34Å; C441-L451 PolarHBondContact O-N 3.09Å; C441-M455 HydrophobicContact CB-CE 3.98Å; C441-M455 HydrophobicContact CB-SD 3.91Å
442	M	87.3	Confident	74.3	Confident	70 Å²	70	67.8 Å²	67.8	35%	0.345	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	163.6	-177.7	-62.2	-168.8	-66	0	0	110.5	L430 C431 T433 P450	L430-M442 CarbonylContact C-O 3.58Å; L430-M442 WeakPolarHBondContact CA-O 3.43Å; C431-M442 PolarHBondContact N-O 3.35Å; C431-M442 PolarHBondContact O-N 3.24Å; T433-M442 HydrophobicContact CG2-CE 4.33Å; T433-M442 WeakPolarHBondContact OG1-CE 3.47Å; M442-P450 HydrophobicContact CG-CB 4.49Å
443	T	89.3	Confident	73.4	Confident	15 Å²	15	69.7 Å²	69.7	9%	0.092	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	164.1	174.9	76.1	0	0	0	0	109.5	Y429 D445 L451 Y482	Y429-T443 CarbonylContact O-C 3.6Å; Y429-T443 WeakPolarHBondContact O-CA 3.43Å; T443-D445 PolarHBondContact O-N 2.98Å; T443-D445 PolarHBondContact OG1-N 2.95Å; T443-D445 PolarHBondContact OG1-O 3.15Å; T443-L451 HydrophobicContact CG2-CD1 4.46Å; T443-Y482 HydrophobicContact CG2-CD1 3.68Å; T443-Y482 HydrophobicContact CG2-CD2 3.88Å; T443-Y482 HydrophobicContact CG2-CE1 3.97Å; T443-Y482 HydrophobicContact CG2-CE2 4.16Å; T443-Y482 HydrophobicContact CG2-CG 3.62Å
444	S	88.8	Confident	73.5	Confident	4 Å²	4	69.5 Å²	69.5	3%	0.028	43%	0.427	C	S	.	.	S	Bend	trans	-71	-3.5	171.3	64.1	0	0	0	0	113.5	T423 F427 W428 Y429	T423-S444 WeakPolarHBondContact CG2-OG 3.36Å; F427-S444 WeakPolarHBondContact O-CB 3.19Å; F427-S444 PolarHBondContact O-OG 3.23Å; W428-S444 WeakPolarHBondContact CA-OG 3.41Å; Y429-S444 PolarHBondContact N-OG 3.14Å; Y429-S444 VanDerWaalsContact N-OG 3.15Å; Y429-S444 PolarHBondContact O-N 3.23Å
445	D	84.6	Confident	74.1	Confident	49 Å²	49	66.3 Å²	66.3	26%	0.262	41%	0.412	S	S	.	.			trans	-87.2	103.8	169.8	-174.2	-5.7	0	0	0	110	T423 T443 A447 T448 F484	T423-D445 HydrophobicContact CG2-CB 4.2Å; T443-D445 PolarHBondContact O-N 2.98Å; T443-D445 PolarHBondContact OG1-N 2.95Å; T443-D445 PolarHBondContact OG1-O 3.15Å; D445-A447 PolarHBondContact O-N 2.97Å; D445-A447 VanDerWaalsContact O-N 3.1Å; D445-A447 WeakPolarHBondContact OD1-CB 3.08Å; D445-A447 PolarHBondContact OD1-N 2.91Å; D445-A447 VanDerWaalsContact OD1-N 3.07Å; D445-T448 WeakPolarHBondContact O-CB 3.37Å; D445-T448 PolarHBondContact O-N 2.86Å; D445-T448 PolarHBondContact O-OG1 3.04Å; D445-F484 HydrophobicContact CB-CE1 4Å
446	T	71.1	Confident	75.4	Confident	118 Å²	118	64.8 Å²	64.8	72%	0.724	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.7	-176.6	54.4	0	0	0	0	114.1	T448	T446-T448 VanDerWaalsContact C-N 3.32Å
447	A	72.7	Confident	77.1	Confident	89 Å²	89	63.8 Å²	63.8	74%	0.736	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-12.1	173.6	0	0	0	0	0	113.1	D445	D445-A447 PolarHBondContact O-N 2.97Å; D445-A447 VanDerWaalsContact O-N 3.1Å; D445-A447 WeakPolarHBondContact OD1-CB 3.08Å; D445-A447 PolarHBondContact OD1-N 2.91Å; D445-A447 VanDerWaalsContact OD1-N 3.07Å
448	T	74.9	Confident	78.8	Confident	48 Å²	48	60.5 Å²	60.5	29%	0.294	35%	0.352	S	S	.	.	S	Bend	trans	-89	134.2	-175.2	-51.6	0	0	0	0	111.1	D445 T446 Y482	D445-T448 WeakPolarHBondContact O-CB 3.37Å; D445-T448 PolarHBondContact O-N 2.86Å; D445-T448 PolarHBondContact O-OG1 3.04Å; T446-T448 VanDerWaalsContact C-N 3.32Å; T448-Y482 HydrophobicContact CG2-CD2 4.4Å; T448-Y482 HydrophobicContact CG2-CE2 3.77Å; T448-Y482 PolarHBondContact OG1-OH 3.42Å
449	A	71.7	Confident	80.2	Confident	74 Å²	74	59 Å²	59	61%	0.612	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-66.2	155.5	173.3	0	0	0	0	0	111.2	L451	A449-L451 PolarHBondContact O-N 3.01Å
450	P	75.4	Confident	81.3	Confident	64 Å²	64	60.2 Å²	60.2	42%	0.416	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-53.5	137.7	173.6	-24.3	33.5	0	0	0	111.8	H440 M442 V452	H440-P450 HydrophobicContact CB-CB 4.17Å; M442-P450 HydrophobicContact CG-CB 4.49Å; P450-V452 PolarHBondContact O-N 3.22Å
451	L	76.6	Confident	82.3	Confident	29 Å²	29	56.5 Å²	56.5	15%	0.152	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-68.7	126	177	-57.9	174.3	0	0	0	108.6	L430 C441 T443 A449 Q453 L481 Y482	L430-L451 HydrophobicContact CD1-CD1 3.64Å; L430-L451 HydrophobicContact CG-CD1 4.36Å; C441-L451 HydrophobicContact CB-CB 4.2Å; C441-L451 HydrophobicContact CB-CD1 4.34Å; C441-L451 PolarHBondContact O-N 3.09Å; T443-L451 HydrophobicContact CG2-CD1 4.46Å; A449-L451 PolarHBondContact O-N 3.01Å; L451-Q453 PolarHBondContact O-N 3.41Å; L451-L481 HydrophobicContact CD1-CB 4.42Å; L451-Y482 HydrophobicContact CD2-CD2 4.47Å
452	V	61.3	Low	82.9	Confident	151 Å²	151	59.1 Å²	59.1	92%	0.915	33%	0.331	S	S	*	.			trans	-80.8	-2.6	-173.1	-173.2	0	0	0	0	112.4	P450	P450-V452 PolarHBondContact O-N 3.22Å
453	Q	68.6	Low	83.4	Confident	78 Å²	78	55.8 Å²	55.8	36%	0.364	32%	0.315	S	S	.	.	S	Bend	trans	-76.8	157.3	179.6	-99.8	160.1	-19	0	0	112.7	L451 C479 H480	L451-Q453 PolarHBondContact O-N 3.41Å; Q453-C479 PolarHBondContact NE2-SG 3.36Å; Q453-H480 PolarHBondContact OE1-O 3.35Å
454	A	75.3	Confident	83.8	Confident	42 Å²	42	57.4 Å²	57.4	35%	0.347	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-62.4	152	172.5	0	0	0	0	0	111.1	P456	A454-P456 WeakPolarHBondContact O-CD 3.38Å
455	M	83.5	Confident	84	Confident	46 Å²	46	58.4 Å²	58.4	23%	0.227	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-63.7	121.2	-176.4	-65.1	-55	-50	0	0	111.6	W391 R432 C441	W391-M455 HydrophobicContact CZ2-CE 3.87Å; R432-M455 HydrophobicContact CB-CE 3.5Å; R432-M455 VanDerWaalsContact CB-CE 3.5Å; R432-M455 HydrophobicContact CG-CE 3.39Å; R432-M455 HydrophobicContact CG-SD 4.35Å; C441-M455 HydrophobicContact CB-CE 3.98Å; C441-M455 HydrophobicContact CB-SD 3.91Å
456	P	88.3	Confident	84.4	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.032	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-70.3	139.1	177.1	27.8	-33.7	0	0	0	110.1	V385 W391 A454 L459 D474 L481	V385-P456 VanDerWaalsContact CG2-O 3.32Å; V385-P456 WeakPolarHBondContact CG2-O 3.41Å; W391-P456 HydrophobicContact CH2-CG 4.29Å; W391-P456 HydrophobicContact CZ2-CG 4.29Å; A454-P456 WeakPolarHBondContact O-CD 3.38Å; P456-L459 HydrophobicContact CB-CD2 3.9Å; P456-L459 HydrophobicContact CB-CG 4.37Å; P456-L459 HydrophobicContact CG-CD2 3.5Å; P456-L459 VanDerWaalsContact CG-CD2 3.5Å; P456-L459 HydrophobicContact CG-CG 4.13Å; P456-D474 HydrophobicContact CB-CB 4.1Å; P456-L481 HydrophobicContact CB-CD1 4.47Å; P456-L481 HydrophobicContact CG-CD1 4.01Å
457	R	90.9	Very high	85.4	Confident	129 Å²	129	62.5 Å²	62.5	49%	0.487	34%	0.337	S	S	.	.	S	Bend	trans	-90.4	-22.8	169.7	-56.7	-172.2	74	-169.6	2.1	112.2	V385 G386	V385-R457 WeakPolarHBondContact CG2-O 3.42Å; V385-R457 PolarHBondContact N-O 3.03Å; G386-R457 PolarHBondContact N-O 2.91Å; G386-R457 VanDerWaalsContact N-O 3.11Å
458	R	94.4	Very high	86.4	Confident	85 Å²	85	58.3 Å²	58.3	32%	0.321	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	126.3	175.6	-172.4	173.2	-62.5	169.9	2.8	110.4	E382 V383 D384 S475 E476	E382-R458 HydrophobicContact CB-CG 4.49Å; E382-R458 WeakPolarHBondContact OE2-CD 3.47Å; V383-R458 WeakPolarHBondContact O-CA 3.26Å; D384-R458 IonicContact OD2-CZ 2.69Å; D384-R458 IonicContact OD2-NE 3.8Å; D384-R458 IonicContact OD2-NH2 2.67Å; D384-R458 PolarHBondContact OD2-NH2 2.82Å; R458-S475 PolarHBondContact O-N 3.3Å; R458-E476 HydrophobicContact CB-CG 4.43Å
459	L	95.3	Very high	87.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.2	179.3	-71.4	166.2	0	0	0	110	E382 V383 V385 W391 V393 L430 P456 Y473 L481	E382-L459 CarbonylContact C-O 3.57Å; E382-L459 VanDerWaalsContact CA-O 3.26Å; E382-L459 WeakPolarHBondContact CA-O 3.48Å; V383-L459 PolarHBondContact N-O 3.33Å; V383-L459 PolarHBondContact O-N 3.32Å; V385-L459 HydrophobicContact CG1-CD1 4.28Å; W391-L459 HydrophobicContact CE3-CD1 4.18Å; W391-L459 HydrophobicContact CH2-CD1 3.49Å; W391-L459 VanDerWaalsContact CH2-CD1 3.49Å; W391-L459 HydrophobicContact CH2-CG 4.4Å; W391-L459 HydrophobicContact CZ2-CD1 4.28Å; W391-L459 HydrophobicContact CZ3-CD1 3.41Å; W391-L459 VanDerWaalsContact CZ3-CD1 3.41Å; V393-L459 HydrophobicContact CB-CD1 3.98Å; V393-L459 HydrophobicContact CG1-CD1 4.39Å; V393-L459 HydrophobicContact CG2-CD1 4.04Å; L430-L459 HydrophobicContact CD2-CD1 4.23Å; L430-L459 HydrophobicContact CD2-CD2 4.02Å; P456-L459 HydrophobicContact CB-CD2 3.9Å; P456-L459 HydrophobicContact CB-CG 4.37Å; P456-L459 HydrophobicContact CG-CD2 3.5Å; P456-L459 VanDerWaalsContact CG-CD2 3.5Å; P456-L459 HydrophobicContact CG-CG 4.13Å; L459-Y473 WeakPolarHBondContact CA-O 3.49Å; L459-L481 HydrophobicContact CD2-CD1 3.43Å; L459-L481 VanDerWaalsContact CD2-CD1 3.43Å
460	R	96.3	Very high	88.7	Confident	86 Å²	86	56.2 Å²	56.2	33%	0.325	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	133.9	159.8	-175.8	178.1	-64.3	177.2	0	109.1	W381 E382 E462 F472 Y473 S475	W381-R460 WeakPolarHBondContact O-CA 3.5Å; E382-R460 HydrophobicContact CG-CB 3.97Å; E382-R460 HydrophobicContact CG-CG 4.11Å; E382-R460 IonicContact OE1-CZ 3.79Å; E382-R460 VanDerWaalsContact OE1-CZ 3.29Å; E382-R460 IonicContact OE1-NE 2.89Å; E382-R460 PolarHBondContact OE1-NE 3.02Å; E382-R460 IonicContact OE1-NH2 2.74Å; E382-R460 PolarHBondContact OE1-NH2 3.06Å; R460-E462 VanDerWaalsContact CD-OE1 3.31Å; R460-E462 WeakPolarHBondContact CD-OE1 3.21Å; R460-E462 HydrophobicContact CG-CG 4.16Å; R460-F472 WeakPolarHBondContact O-CA 3.24Å; R460-Y473 PolarHBondContact N-O 2.8Å; R460-Y473 PolarHBondContact O-N 3.47Å; R460-S475 PolarHBondContact N-OG 3.44Å
461	V	97.4	Very high	89.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.3	173.4	-172.1	0	0	0	0	107.6	S380 W381 V393 L470 S471 F472	S380-V461 VanDerWaalsContact CA-O 3.27Å; S380-V461 WeakPolarHBondContact CA-O 3.34Å; W381-V461 HydrophobicContact CD2-CB 4.02Å; W381-V461 HydrophobicContact CD2-CG1 4.47Å; W381-V461 HydrophobicContact CG-CB 4.46Å; W381-V461 HydrophobicContact CH2-CB 4.34Å; W381-V461 HydrophobicContact CH2-CG1 3.75Å; W381-V461 HydrophobicContact CZ2-CB 3.77Å; W381-V461 HydrophobicContact CZ2-CG1 3.41Å; W381-V461 VanDerWaalsContact CZ2-CG1 3.41Å; W381-V461 HydrophobicContact CZ2-CG2 4.35Å; W381-V461 HydrophobicContact CZ3-CG1 4.4Å; W381-V461 PolarHBondContact N-O 3.4Å; W381-V461 PolarHBondContact O-N 3.45Å; V393-V461 HydrophobicContact CG1-CG2 3.89Å; V461-L470 HydrophobicContact CG1-CD1 3.56Å; V461-S471 WeakPolarHBondContact CA-O 3.07Å; V461-F472 HydrophobicContact CB-CE1 4.5Å; V461-F472 HydrophobicContact CG1-CD1 4.43Å; V461-F472 HydrophobicContact CG1-CE1 4.02Å; V461-F472 HydrophobicContact CG1-CZ 4.37Å; V461-F472 HydrophobicContact CG2-CD1 3.9Å; V461-F472 HydrophobicContact CG2-CE1 3.8Å
462	E	97.6	Very high	90.7	Very high	60 Å²	60	52.1 Å²	52.1	28%	0.28	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121.4	175.7	-65.6	178.1	178.3	0	0	108.1	H379 R460 L470 S471 Y473	H379-E462 CarbonylContact O-C 3.53Å; H379-E462 WeakPolarHBondContact O-CA 3.17Å; R460-E462 VanDerWaalsContact CD-OE1 3.31Å; R460-E462 WeakPolarHBondContact CD-OE1 3.21Å; R460-E462 HydrophobicContact CG-CG 4.16Å; E462-L470 CarbonylContact O-C 3.54Å; E462-L470 WeakPolarHBondContact O-CA 3.37Å; E462-S471 PolarHBondContact N-O 3.36Å; E462-S471 PolarHBondContact O-N 3.48Å; E462-Y473 HydrophobicContact CB-CE2 4.25Å; E462-Y473 VanDerWaalsContact CD-CE2 3.4Å; E462-Y473 HydrophobicContact CG-CD2 4.39Å; E462-Y473 HydrophobicContact CG-CE2 3.95Å; E462-Y473 WeakPolarHBondContact OE2-CE2 3.23Å; E462-Y473 PolarHBondContact OE2-OH 2.76Å; E462-Y473 VanDerWaalsContact OE2-OH 3.13Å
463	L	97.5	Very high	92.3	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	115.1	-179.5	172.2	68.2	0	0	0	108.7	F374 S378 H379 W381 L470 F488 V491	F374-L463 HydrophobicContact CB-CD2 3.71Å; F374-L463 HydrophobicContact CD2-CD2 3.96Å; F374-L463 HydrophobicContact CG-CD2 4.09Å; S378-L463 CarbonylContact C-O 3.58Å; S378-L463 WeakPolarHBondContact CA-O 3.23Å; H379-L463 HydrophobicContact CB-CB 4.45Å; H379-L463 PolarHBondContact N-O 3.35Å; H379-L463 PolarHBondContact O-N 2.73Å; W381-L463 HydrophobicContact CH2-CB 4.18Å; W381-L463 HydrophobicContact CH2-CD2 4.46Å; W381-L463 HydrophobicContact CZ3-CB 4.03Å; L463-L470 HydrophobicContact CB-CD1 4.07Å; L463-L470 HydrophobicContact CD1-CB 4.44Å; L463-L470 HydrophobicContact CD1-CD1 4.08Å; L463-F488 HydrophobicContact CD1-CD2 3.76Å; L463-F488 HydrophobicContact CD1-CE2 3.98Å; L463-F488 HydrophobicContact CD1-CG 4.41Å; L463-V491 HydrophobicContact CD2-CG2 3.72Å
464	E	97.2	Very high	93.4	Very high	49 Å²	49	44.4 Å²	44.4	23%	0.229	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	108	170.2	-172.8	55.4	-107.4	0	0	109	S378 E467 G468 E469	S378-E464 WeakPolarHBondContact CB-OE2 3.45Å; S378-E464 PolarHBondContact OG-OE2 2.85Å; E464-E467 HydrophobicContact CG-CB 3.75Å; E464-E467 HydrophobicContact CG-CG 3.85Å; E464-G468 WeakPolarHBondContact O-CA 3.28Å; E464-G468 PolarHBondContact O-N 3.06Å; E464-G468 VanDerWaalsContact O-N 3.12Å; E464-E469 HydrophobicContact CB-CB 4.29Å; E464-E469 PolarHBondContact N-O 3.37Å; E464-E469 PolarHBondContact O-N 2.9Å; E464-E469 VanDerWaalsContact O-N 3.13Å
465	C	93.7	Very high	94.2	Very high	25 Å²	25	43.1 Å²	43.1	17%	0.169	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-35.5	-170.4	-64.2	0	0	0	0	112.2	G377	G377-C465 PolarHBondContact O-N 3.16Å; G377-C465 PolarHBondContact O-SG 3.49Å
466	E	93.1	Very high	94.5	Very high	106 Å²	106	45.8 Å²	45.8	50%	0.495	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-48.5	-175.4	-76.3	76.6	-178.9	0	0	112	G377 G468	G377-E466 VanDerWaalsContact CA-OE2 3.25Å; G377-E466 WeakPolarHBondContact CA-OE2 3.38Å; G377-E466 PolarHBondContact N-OE1 2.97Å; G377-E466 PolarHBondContact N-OE2 3.41Å; E466-G468 VanDerWaalsContact C-N 3.25Å; E466-G468 PolarHBondContact O-N 3.19Å
467	E	91.9	Very high	94.5	Very high	146 Å²	146	52.6 Å²	52.6	68%	0.682	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-16.4	177.9	-60.1	-58	140.7	0	0	112.1	E464 E469	E464-E467 HydrophobicContact CG-CB 3.75Å; E464-E467 HydrophobicContact CG-CG 3.85Å; E467-E469 HydrophobicContact CB-CG 4.28Å
468	G	94.4	Very high	94.3	Very high	2 Å²	2	54 Å²	54	2%	0.021	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	36.8	180	0	0	0	0	0	112.5	E464 E466 H485 A486 F488	E464-G468 WeakPolarHBondContact O-CA 3.28Å; E464-G468 PolarHBondContact O-N 3.06Å; E464-G468 VanDerWaalsContact O-N 3.12Å; E466-G468 VanDerWaalsContact C-N 3.25Å; E466-G468 PolarHBondContact O-N 3.19Å; G468-H485 CarbonylContact O-C 3.56Å; G468-H485 VanDerWaalsContact O-CA 3.31Å; G468-H485 WeakPolarHBondContact O-CA 3.48Å; G468-A486 CarbonylContact C-O 3.58Å; G468-A486 WeakPolarHBondContact CA-O 3.5Å; G468-A486 PolarHBondContact O-N 3.17Å; G468-A486 VanDerWaalsContact O-O 3.12Å; G468-F488 VanDerWaalsContact O-CE2 3.31Å; G468-F488 WeakPolarHBondContact O-CE2 3.31Å
469	E	96.9	Very high	94.2	Very high	77 Å²	77	51.4 Å²	51.4	36%	0.36	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	132	177.9	-62.8	-170.8	170.2	0	0	111.7	E464 E467 T483 F484 H485	E464-E469 HydrophobicContact CB-CB 4.29Å; E464-E469 PolarHBondContact N-O 3.37Å; E464-E469 PolarHBondContact O-N 2.9Å; E464-E469 VanDerWaalsContact O-N 3.13Å; E467-E469 HydrophobicContact CB-CG 4.28Å; E469-T483 HydrophobicContact CB-CG2 4.26Å; E469-F484 WeakPolarHBondContact CA-O 3.37Å; E469-H485 IonicContact OE1-CD2 2.77Å; E469-H485 IonicContact OE1-NE2 2.73Å
470	L	97.7	Very high	94	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	106.1	170.2	175.5	73.3	0	0	0	108.9	V395 W428 V461 E462 L463 F472 T483 F484 F488	V395-L470 HydrophobicContact CG1-CD1 4.18Å; V395-L470 HydrophobicContact CG2-CD1 4.46Å; V395-L470 HydrophobicContact CG2-CD2 3.68Å; W428-L470 HydrophobicContact CB-CD2 3.55Å; V461-L470 HydrophobicContact CG1-CD1 3.56Å; E462-L470 CarbonylContact O-C 3.54Å; E462-L470 WeakPolarHBondContact O-CA 3.37Å; L463-L470 HydrophobicContact CB-CD1 4.07Å; L463-L470 HydrophobicContact CD1-CB 4.44Å; L463-L470 HydrophobicContact CD1-CD1 4.08Å; L470-F472 HydrophobicContact CD1-CE2 4.5Å; L470-F472 HydrophobicContact CD1-CZ 4.42Å; L470-F472 HydrophobicContact CD2-CE2 3.71Å; L470-F472 HydrophobicContact CD2-CZ 3.77Å; L470-F472 HydrophobicContact CG-CE2 3.68Å; L470-F472 HydrophobicContact CG-CZ 3.98Å; L470-T483 CarbonylContact O-C 3.47Å; L470-T483 VanDerWaalsContact O-CA 3.31Å; L470-T483 WeakPolarHBondContact O-CA 3.44Å; L470-F484 HydrophobicContact CB-CB 4.31Å; L470-F484 HydrophobicContact CD2-CD2 4.08Å; L470-F484 PolarHBondContact N-O 3.4Å; L470-F484 PolarHBondContact O-N 2.98Å; L470-F488 HydrophobicContact CB-CE1 4.14Å; L470-F488 HydrophobicContact CB-CE2 3.92Å; L470-F488 HydrophobicContact CB-CZ 3.46Å; L470-F488 VanDerWaalsContact CB-CZ 3.46Å
471	S	96.7	Very high	93.8	Very high	8 Å²	8	52.1 Å²	52.1	6%	0.056	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	141.2	-173.2	-65.1	0	0	0	0	111.6	V461 E462 Y482 T483	V461-S471 WeakPolarHBondContact CA-O 3.07Å; E462-S471 PolarHBondContact N-O 3.36Å; E462-S471 PolarHBondContact O-N 3.48Å; S471-Y482 CarbonylContact C-O 3.59Å; S471-Y482 WeakPolarHBondContact CA-O 3.32Å; S471-T483 WeakPolarHBondContact CB-OG1 3.07Å; S471-T483 WeakPolarHBondContact OG-CG2 3.49Å; S471-T483 PolarHBondContact OG-OG1 3.19Å
472	F	96.2	Very high	93.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	136.2	178.5	-64.9	-92.7	0	0	0	110.1	V393 L430 R460 V461 L470 L481 Y482 F484	V393-F472 VanDerWaalsContact O-CE1 3.3Å; V393-F472 WeakPolarHBondContact O-CE1 3.48Å; L430-F472 HydrophobicContact CB-CD1 3.96Å; L430-F472 HydrophobicContact CB-CD2 4.45Å; L430-F472 HydrophobicContact CB-CE1 4.08Å; L430-F472 HydrophobicContact CB-CG 4.15Å; L430-F472 HydrophobicContact CB-CZ 4.38Å; L430-F472 HydrophobicContact CD1-CB 3.9Å; L430-F472 HydrophobicContact CD1-CD2 4.48Å; L430-F472 HydrophobicContact CD1-CG 4.07Å; R460-F472 WeakPolarHBondContact O-CA 3.24Å; V461-F472 HydrophobicContact CB-CE1 4.5Å; V461-F472 HydrophobicContact CG1-CD1 4.43Å; V461-F472 HydrophobicContact CG1-CE1 4.02Å; V461-F472 HydrophobicContact CG1-CZ 4.37Å; V461-F472 HydrophobicContact CG2-CD1 3.9Å; V461-F472 HydrophobicContact CG2-CE1 3.8Å; L470-F472 HydrophobicContact CD1-CE2 4.5Å; L470-F472 HydrophobicContact CD1-CZ 4.42Å; L470-F472 HydrophobicContact CD2-CE2 3.71Å; L470-F472 HydrophobicContact CD2-CZ 3.77Å; L470-F472 HydrophobicContact CG-CE2 3.68Å; L470-F472 HydrophobicContact CG-CZ 3.98Å; F472-L481 HydrophobicContact CB-CB 4.29Å; F472-L481 WeakPolarHBondContact O-CB 3.27Å; F472-L481 PolarHBondContact O-N 2.64Å; F472-Y482 PolarHBondContact N-O 3.48Å; F472-Y482 PolarHBondContact O-N 3.48Å; F472-F484 HydrophobicContact CD2-CD2 4.38Å; F472-F484 HydrophobicContact CD2-CE2 4.28Å; F472-F484 AromaticContact CE2-CD2 3.75Å; F472-F484 HydrophobicContact CE2-CD2 3.75Å; F472-F484 AromaticContact CE2-CE2 3.61Å; F472-F484 HydrophobicContact CE2-CE2 3.61Å; F472-F484 HydrophobicContact CZ-CE2 4.45Å
473	Y	94.4	Very high	93.5	Very high	64 Å²	64	52.6 Å²	52.6	25%	0.251	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	147.9	178.8	-52.8	-101.8	0	0	0	111	L459 R460 E462 S475 C479 H480	L459-Y473 WeakPolarHBondContact CA-O 3.49Å; R460-Y473 PolarHBondContact N-O 2.8Å; R460-Y473 PolarHBondContact O-N 3.47Å; E462-Y473 HydrophobicContact CB-CE2 4.25Å; E462-Y473 VanDerWaalsContact CD-CE2 3.4Å; E462-Y473 HydrophobicContact CG-CD2 4.39Å; E462-Y473 HydrophobicContact CG-CE2 3.95Å; E462-Y473 WeakPolarHBondContact OE2-CE2 3.23Å; E462-Y473 PolarHBondContact OE2-OH 2.76Å; E462-Y473 VanDerWaalsContact OE2-OH 3.13Å; Y473-S475 PolarHBondContact O-N 3.5Å; Y473-C479 CarbonylContact C-O 3.54Å; Y473-C479 VanDerWaalsContact CA-O 3.29Å; Y473-C479 WeakPolarHBondContact CA-O 3.36Å; Y473-C479 WeakPolarHBondContact CB-O 3.36Å; Y473-H480 VanDerWaalsContact CD1-CA 3.49Å; Y473-H480 HydrophobicContact CD1-CB 3.86Å; Y473-H480 HydrophobicContact CE1-CB 3.87Å; Y473-H480 AromaticContact CE1-CD2 3.76Å
474	D	93.4	Very high	93.3	Very high	2 Å²	2	53 Å²	53	1%	0.011	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	111.2	164.5	-176.9	-28.4	0	0	0	108.2	P456 E476 R477 H478 C479 L481	P456-D474 HydrophobicContact CB-CB 4.1Å; D474-E476 VanDerWaalsContact C-N 3.29Å; D474-E476 PolarHBondContact O-N 3.5Å; D474-E476 WeakPolarHBondContact OD1-CA 3.45Å; D474-E476 WeakPolarHBondContact OD1-CB 3.36Å; D474-E476 PolarHBondContact OD1-N 2.92Å; D474-R477 HydrophobicContact CB-CB 4.17Å; D474-R477 PolarHBondContact OD1-N 3.3Å; D474-R477 VanDerWaalsContact OD2-CD 3.25Å; D474-R477 WeakPolarHBondContact OD2-CD 3.47Å; D474-R477 WeakPolarHBondContact OD2-CG 3.41Å; D474-R477 IonicContact OD2-NE 3.83Å; D474-H478 VanDerWaalsContact O-CA 3.29Å; D474-H478 WeakPolarHBondContact O-CA 3.36Å; D474-H478 PolarHBondContact O-N 3.49Å; D474-C479 PolarHBondContact N-O 2.85Å; D474-C479 PolarHBondContact O-N 2.88Å; D474-L481 HydrophobicContact CB-CD1 4.38Å; D474-L481 HydrophobicContact CB-CD2 4.07Å; D474-L481 HydrophobicContact CB-CG 4.36Å
475	S	91.3	Very high	93.2	Very high	15 Å²	15	57 Å²	57	11%	0.105	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-25.3	-178.2	-67.8	0	0	0	0	113.2	E382 R458 R460 Y473 H478	E382-S475 PolarHBondContact OE1-OG 3.25Å; R458-S475 PolarHBondContact O-N 3.3Å; R460-S475 PolarHBondContact N-OG 3.44Å; Y473-S475 PolarHBondContact O-N 3.5Å; S475-H478 PolarHBondContact O-CE1 2.89Å; S475-H478 PolarHBondContact O-ND1 3.42Å
476	E	89.3	Confident	93.1	Very high	103 Å²	103	57.2 Å²	57.2	48%	0.481	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-38.1	179.9	-63.9	-173.3	155	0	0	111.1	R458 D474	R458-E476 HydrophobicContact CB-CG 4.43Å; D474-E476 VanDerWaalsContact C-N 3.29Å; D474-E476 PolarHBondContact O-N 3.5Å; D474-E476 WeakPolarHBondContact OD1-CA 3.45Å; D474-E476 WeakPolarHBondContact OD1-CB 3.36Å; D474-E476 PolarHBondContact OD1-N 2.92Å
477	R	88.1	Confident	93.1	Very high	148 Å²	148	60.2 Å²	60.2	56%	0.558	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-9.7	179.9	-62.3	-176.8	180	-137.7	-8.9	113.6	D474 C479	D474-R477 HydrophobicContact CB-CB 4.17Å; D474-R477 PolarHBondContact OD1-N 3.3Å; D474-R477 VanDerWaalsContact OD2-CD 3.25Å; D474-R477 WeakPolarHBondContact OD2-CD 3.47Å; D474-R477 WeakPolarHBondContact OD2-CG 3.41Å; D474-R477 IonicContact OD2-NE 3.83Å; R477-C479 PolarHBondContact O-N 3.39Å
478	H	88.4	Confident	93	Very high	158 Å²	158	53.4 Å²	53.4	73%	0.731	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	40.6	-174.7	-57	-61.3	0	0	0	112.6	D474 S475	D474-H478 VanDerWaalsContact O-CA 3.29Å; D474-H478 WeakPolarHBondContact O-CA 3.36Å; D474-H478 PolarHBondContact O-N 3.49Å; S475-H478 PolarHBondContact O-CE1 2.89Å; S475-H478 PolarHBondContact O-ND1 3.42Å
479	C	90.8	Very high	92.9	Very high	30 Å²	30	55.7 Å²	55.7	20%	0.203	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	145	-179.5	67.6	0	0	0	0	111.9	Q453 Y473 D474 R477	Q453-C479 PolarHBondContact NE2-SG 3.36Å; Y473-C479 CarbonylContact C-O 3.54Å; Y473-C479 VanDerWaalsContact CA-O 3.29Å; Y473-C479 WeakPolarHBondContact CA-O 3.36Å; Y473-C479 WeakPolarHBondContact CB-O 3.36Å; D474-C479 PolarHBondContact N-O 2.85Å; D474-C479 PolarHBondContact O-N 2.88Å; R477-C479 PolarHBondContact O-N 3.39Å
480	H	92.8	Very high	92.8	Very high	89 Å²	89	57.4 Å²	57.4	41%	0.412	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	139.7	171.1	175.5	-97.7	0	0	0	110.5	Q453 Y473 Y482 T483	Q453-H480 PolarHBondContact OE1-O 3.35Å; Y473-H480 VanDerWaalsContact CD1-CA 3.49Å; Y473-H480 HydrophobicContact CD1-CB 3.86Å; Y473-H480 HydrophobicContact CE1-CB 3.87Å; Y473-H480 AromaticContact CE1-CD2 3.76Å; H480-Y482 PolarHBondContact CE1-N 3.37Å; H480-Y482 VanDerWaalsContact NE2-C 3.27Å; H480-Y482 PolarHBondContact NE2-O 2.74Å; H480-T483 PolarHBondContact NE2-OG1 3.48Å
481	L	91.4	Very high	92.8	Very high	13 Å²	13	57.4 Å²	57.4	7%	0.068	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-53.7	177.5	-59.7	178.8	0	0	0	110.8	L430 L451 P456 L459 F472 D474	L430-L481 HydrophobicContact CD1-CB 4.09Å; L430-L481 HydrophobicContact CD1-CD1 4.31Å; L430-L481 HydrophobicContact CD2-CD1 4.44Å; L451-L481 HydrophobicContact CD1-CB 4.42Å; P456-L481 HydrophobicContact CB-CD1 4.47Å; P456-L481 HydrophobicContact CG-CD1 4.01Å; L459-L481 HydrophobicContact CD2-CD1 3.43Å; L459-L481 VanDerWaalsContact CD2-CD1 3.43Å; F472-L481 HydrophobicContact CB-CB 4.29Å; F472-L481 WeakPolarHBondContact O-CB 3.27Å; F472-L481 PolarHBondContact O-N 2.64Å; D474-L481 HydrophobicContact CB-CD1 4.38Å; D474-L481 HydrophobicContact CB-CD2 4.07Å; D474-L481 HydrophobicContact CB-CG 4.36Å
482	Y	92.6	Very high	92.8	Very high	43 Å²	43	58.7 Å²	58.7	17%	0.169	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	151.2	-174.7	-168.5	-102.7	0	0	0	112.4	T443 T448 L451 S471 F472 H480 F484	T443-Y482 HydrophobicContact CG2-CD1 3.68Å; T443-Y482 HydrophobicContact CG2-CD2 3.88Å; T443-Y482 HydrophobicContact CG2-CE1 3.97Å; T443-Y482 HydrophobicContact CG2-CE2 4.16Å; T443-Y482 HydrophobicContact CG2-CG 3.62Å; T448-Y482 HydrophobicContact CG2-CD2 4.4Å; T448-Y482 HydrophobicContact CG2-CE2 3.77Å; T448-Y482 PolarHBondContact OG1-OH 3.42Å; L451-Y482 HydrophobicContact CD2-CD2 4.47Å; S471-Y482 CarbonylContact C-O 3.59Å; S471-Y482 WeakPolarHBondContact CA-O 3.32Å; F472-Y482 PolarHBondContact N-O 3.48Å; F472-Y482 PolarHBondContact O-N 3.48Å; H480-Y482 PolarHBondContact CE1-N 3.37Å; H480-Y482 VanDerWaalsContact NE2-C 3.27Å; H480-Y482 PolarHBondContact NE2-O 2.74Å; Y482-F484 HydrophobicContact CD1-CD1 4.48Å; Y482-F484 AromaticContact CD1-CD2 3.74Å; Y482-F484 HydrophobicContact CD1-CD2 3.74Å; Y482-F484 HydrophobicContact CD1-CE1 4.41Å; Y482-F484 AromaticContact CD1-CE2 3.66Å; Y482-F484 HydrophobicContact CD1-CE2 3.66Å; Y482-F484 HydrophobicContact CD1-CG 4.19Å; Y482-F484 HydrophobicContact CD1-CZ 4.03Å; Y482-F484 AromaticContact CE1-CD1 3.63Å; Y482-F484 HydrophobicContact CE1-CD1 3.63Å; Y482-F484 AromaticContact CE1-CD2 3.71Å; Y482-F484 HydrophobicContact CE1-CD2 3.71Å; Y482-F484 AromaticContact CE1-CE1 3.66Å; Y482-F484 HydrophobicContact CE1-CE1 3.66Å; Y482-F484 AromaticContact CE1-CE2 3.74Å; Y482-F484 HydrophobicContact CE1-CE2 3.74Å; Y482-F484 AromaticContact CE1-CG 3.69Å; Y482-F484 HydrophobicContact CE1-CG 3.69Å; Y482-F484 AromaticContact CE1-CZ 3.73Å; Y482-F484 HydrophobicContact CE1-CZ 3.73Å
483	T	94.9	Very high	92.9	Very high	26 Å²	26	58.7 Å²	58.7	16%	0.16	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	126.1	171.6	-60.8	0	0	0	0	110.9	E469 L470 S471 H480	E469-T483 HydrophobicContact CB-CG2 4.26Å; L470-T483 CarbonylContact O-C 3.47Å; L470-T483 VanDerWaalsContact O-CA 3.31Å; L470-T483 WeakPolarHBondContact O-CA 3.44Å; S471-T483 WeakPolarHBondContact CB-OG1 3.07Å; S471-T483 WeakPolarHBondContact OG-CG2 3.49Å; S471-T483 PolarHBondContact OG-OG1 3.19Å; H480-T483 PolarHBondContact NE2-OG1 3.48Å
484	F	95.1	Very high	92.9	Very high	8 Å²	8	55.8 Å²	55.8	4%	0.035	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	141.6	166.1	-64.1	-91.2	0	0	0	110.2	T423 W428 D445 E469 L470 F472 Y482 F488	T423-F484 HydrophobicContact CG2-CD1 3.98Å; T423-F484 HydrophobicContact CG2-CE1 3.61Å; W428-F484 HydrophobicContact CB-CD2 4.27Å; W428-F484 HydrophobicContact CB-CE2 4.38Å; W428-F484 HydrophobicContact CB-CG 4.32Å; W428-F484 AromaticContact CD1-CD1 3.66Å; W428-F484 AromaticContact CD1-CG 3.91Å; D445-F484 HydrophobicContact CB-CE1 4Å; E469-F484 WeakPolarHBondContact CA-O 3.37Å; L470-F484 HydrophobicContact CB-CB 4.31Å; L470-F484 HydrophobicContact CD2-CD2 4.08Å; L470-F484 PolarHBondContact N-O 3.4Å; L470-F484 PolarHBondContact O-N 2.98Å; F472-F484 HydrophobicContact CD2-CD2 4.38Å; F472-F484 HydrophobicContact CD2-CE2 4.28Å; F472-F484 AromaticContact CE2-CD2 3.75Å; F472-F484 HydrophobicContact CE2-CD2 3.75Å; F472-F484 AromaticContact CE2-CE2 3.61Å; F472-F484 HydrophobicContact CE2-CE2 3.61Å; F472-F484 HydrophobicContact CZ-CE2 4.45Å; Y482-F484 HydrophobicContact CD1-CD1 4.48Å; Y482-F484 AromaticContact CD1-CD2 3.74Å; Y482-F484 HydrophobicContact CD1-CD2 3.74Å; Y482-F484 HydrophobicContact CD1-CE1 4.41Å; Y482-F484 AromaticContact CD1-CE2 3.66Å; Y482-F484 HydrophobicContact CD1-CE2 3.66Å; Y482-F484 HydrophobicContact CD1-CG 4.19Å; Y482-F484 HydrophobicContact CD1-CZ 4.03Å; Y482-F484 AromaticContact CE1-CD1 3.63Å; Y482-F484 HydrophobicContact CE1-CD1 3.63Å; Y482-F484 AromaticContact CE1-CD2 3.71Å; Y482-F484 HydrophobicContact CE1-CD2 3.71Å; Y482-F484 AromaticContact CE1-CE1 3.66Å; Y482-F484 HydrophobicContact CE1-CE1 3.66Å; Y482-F484 AromaticContact CE1-CE2 3.74Å; Y482-F484 HydrophobicContact CE1-CE2 3.74Å; Y482-F484 AromaticContact CE1-CG 3.69Å; Y482-F484 HydrophobicContact CE1-CG 3.69Å; Y482-F484 AromaticContact CE1-CZ 3.73Å; Y482-F484 HydrophobicContact CE1-CZ 3.73Å; F484-F488 HydrophobicContact CB-CZ 4.34Å
485	H	94.8	Very high	93	Very high	135 Å²	135	55.7 Å²	55.7	63%	0.625	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	110.6	170.5	-61.7	79.1	0	0	0	108.5	G468 E469	G468-H485 CarbonylContact O-C 3.56Å; G468-H485 VanDerWaalsContact O-CA 3.31Å; G468-H485 WeakPolarHBondContact O-CA 3.48Å; E469-H485 IonicContact OE1-CD2 2.77Å; E469-H485 IonicContact OE1-NE2 2.73Å
486	A	91.9	Very high	93.1	Very high	29 Å²	29	56.7 Å²	56.7	24%	0.24	28%	0.276	C	S	.	.	S	Bend	trans	-161.3	158.2	179.8	0	0	0	0	0	112.2	W428 G468 F488	W428-A486 HydrophobicContact CZ2-CB 4.22Å; G468-A486 CarbonylContact C-O 3.58Å; G468-A486 WeakPolarHBondContact CA-O 3.5Å; G468-A486 PolarHBondContact O-N 3.17Å; G468-A486 VanDerWaalsContact O-O 3.12Å; A486-F488 HydrophobicContact CB-CD1 4.18Å; A486-F488 HydrophobicContact CB-CE1 3.78Å; A486-F488 HydrophobicContact CB-CZ 4.24Å; A486-F488 WeakPolarHBondContact O-CD2 3.37Å; A486-F488 WeakPolarHBondContact O-CE2 3.35Å; A486-F488 PolarHBondContact O-N 3.03Å
487	H	91.3	Very high	93.1	Very high	168 Å²	168	51.8 Å²	51.8	78%	0.778	25%	0.254	S	S	*	.			trans	-78.8	100.4	166.4	-57.3	-56.9	0	0	0	109.8	R397	R397-H487 PolarHBondContact NH2-O 3.01Å
488	F	91.4	Very high	92.8	Very high	4 Å²	4	45 Å²	45	2%	0.018	23%	0.23	C	C	.	.			trans	-74.2	-38.5	-173.7	-59.6	-60.1	0	0	0	113.3	R397 W428 L463 G468 L470 F484 A486 V491	R397-F488 PolarHBondContact NE-O 3.49Å; W428-F488 HydrophobicContact CB-CE1 4.43Å; W428-F488 AromaticContact CD1-CE1 3.9Å; W428-F488 AromaticContact CD2-CD1 3.67Å; W428-F488 HydrophobicContact CD2-CD1 3.67Å; W428-F488 AromaticContact CD2-CE1 3.74Å; W428-F488 HydrophobicContact CD2-CE1 3.74Å; W428-F488 AromaticContact CE2-CD1 3.78Å; W428-F488 AromaticContact CE2-CE1 3.84Å; W428-F488 AromaticContact CE3-CD1 3.78Å; W428-F488 HydrophobicContact CE3-CD1 3.78Å; W428-F488 HydrophobicContact CE3-CE1 4.28Å; W428-F488 HydrophobicContact CG-CD1 4.21Å; W428-F488 AromaticContact CG-CE1 3.79Å; W428-F488 HydrophobicContact CG-CE1 3.79Å; W428-F488 HydrophobicContact CH2-CD1 4.08Å; W428-F488 HydrophobicContact CZ2-CD1 4Å; W428-F488 HydrophobicContact CZ2-CE1 4.45Å; W428-F488 AromaticContact CZ3-CD1 3.97Å; W428-F488 HydrophobicContact CZ3-CD1 3.97Å; W428-F488 AromaticContact NE1-CE1 3.92Å; L463-F488 HydrophobicContact CD1-CD2 3.76Å; L463-F488 HydrophobicContact CD1-CE2 3.98Å; L463-F488 HydrophobicContact CD1-CG 4.41Å; G468-F488 VanDerWaalsContact O-CE2 3.31Å; G468-F488 WeakPolarHBondContact O-CE2 3.31Å; L470-F488 HydrophobicContact CB-CE1 4.14Å; L470-F488 HydrophobicContact CB-CE2 3.92Å; L470-F488 HydrophobicContact CB-CZ 3.46Å; L470-F488 VanDerWaalsContact CB-CZ 3.46Å; F484-F488 HydrophobicContact CB-CZ 4.34Å; A486-F488 HydrophobicContact CB-CD1 4.18Å; A486-F488 HydrophobicContact CB-CE1 3.78Å; A486-F488 HydrophobicContact CB-CZ 4.24Å; A486-F488 WeakPolarHBondContact O-CD2 3.37Å; A486-F488 WeakPolarHBondContact O-CE2 3.35Å; A486-F488 PolarHBondContact O-N 3.03Å; F488-V491 HydrophobicContact CB-CG1 3.74Å
489	G	92.1	Very high	92.1	Very high	50 Å²	50	41.5 Å²	41.5	52%	0.515	22%	0.223	S	C	.	.			trans	71	-144.8	-170.3	0	0	0	0	0	111.1	V491	G489-V491 PolarHBondContact O-N 3Å
490	E	95.4	Very high	90.9	Very high	112 Å²	112	43.2 Å²	43.2	52%	0.523	24%	0.235	S	C	.	.	S	Bend	trans	-78.2	119	173.1	-61.9	-174	153.2	0	0	110.6	V373 F374 R397 V398	V373-E490 HydrophobicContact CG1-CB 3.96Å; F374-E490 WeakPolarHBondContact O-CA 3.38Å; R397-E490 WeakPolarHBondContact CA-O 3.32Å; V398-E490 HydrophobicContact CB-CB 4.43Å; V398-E490 HydrophobicContact CG2-CB 4.07Å; V398-E490 WeakPolarHBondContact CG2-O 3.23Å; V398-E490 PolarHBondContact N-O 3.4Å
491	V	96.4	Very high	89.2	Confident	1 Å²	1	50 Å²	50	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	153.9	-178.1	-64.9	0	0	0	0	112.9	V373 F374 V395 V396 W428 L463 F488 G489	V373-V491 CarbonylContact C-O 3.55Å; V373-V491 WeakPolarHBondContact CA-O 3.42Å; F374-V491 HydrophobicContact CB-CG2 4.16Å; F374-V491 PolarHBondContact N-O 3.44Å; F374-V491 PolarHBondContact O-N 2.98Å; V395-V491 HydrophobicContact CB-CB 4.12Å; V395-V491 HydrophobicContact CB-CG2 4.24Å; V395-V491 HydrophobicContact CG2-CB 4.3Å; V395-V491 HydrophobicContact CG2-CG1 4.33Å; V395-V491 HydrophobicContact CG2-CG2 4.38Å; V396-V491 CarbonylContact O-C 3.53Å; V396-V491 WeakPolarHBondContact O-CA 3.4Å; V396-V491 WeakPolarHBondContact O-CB 3.34Å; W428-V491 HydrophobicContact CZ3-CG1 4.25Å; L463-V491 HydrophobicContact CD2-CG2 3.72Å; F488-V491 HydrophobicContact CB-CG1 3.74Å; G489-V491 PolarHBondContact O-N 3Å
492	R	96.9	Very high	87.7	Confident	35 Å²	35	51.8 Å²	51.8	13%	0.132	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	148.6	170	-66.4	-179.6	66.5	176.1	1.2	109.9	D330 L369 G370 Q372 V373 V395 V396 V398 Y494	D330-R492 IonicContact OD2-CZ 3.47Å; D330-R492 IonicContact OD2-NH1 3.27Å; D330-R492 IonicContact OD2-NH2 2.95Å; D330-R492 PolarHBondContact OD2-NH2 2.81Å; L369-R492 HydrophobicContact CB-CB 4.46Å; L369-R492 HydrophobicContact CD1-CB 4.41Å; G370-R492 PolarHBondContact O-NE 2.84Å; G370-R492 PolarHBondContact O-NH2 2.93Å; Q372-R492 WeakPolarHBondContact O-CG 3.39Å; V373-R492 HydrophobicContact CB-CG 4.46Å; V373-R492 HydrophobicContact CG2-CG 3.75Å; V395-R492 CarbonylContact C-O 3.57Å; V395-R492 VanDerWaalsContact CA-O 3.26Å; V395-R492 WeakPolarHBondContact CA-O 3.27Å; V396-R492 HydrophobicContact CG1-CB 4.47Å; V396-R492 PolarHBondContact N-O 3.21Å; V396-R492 PolarHBondContact O-N 2.85Å; V398-R492 HydrophobicContact CG2-CG 4.02Å; R492-Y494 PolarHBondContact O-N 2.87Å
493	P	97.5	Very high	86	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53	134.7	166.3	-26.7	36.2	0	0	0	110.9	F327 L369 G370 Q372 F374 W381 G394 F495	F327-P493 HydrophobicContact CD1-CG 4.02Å; F327-P493 HydrophobicContact CD2-CB 4.41Å; F327-P493 HydrophobicContact CD2-CG 4.05Å; F327-P493 HydrophobicContact CE1-CB 4.25Å; F327-P493 HydrophobicContact CE1-CG 3.61Å; F327-P493 HydrophobicContact CE2-CB 3.64Å; F327-P493 HydrophobicContact CE2-CG 3.65Å; F327-P493 HydrophobicContact CG-CG 4.24Å; F327-P493 HydrophobicContact CZ-CB 3.55Å; F327-P493 HydrophobicContact CZ-CG 3.42Å; F327-P493 VanDerWaalsContact CZ-CG 3.42Å; L369-P493 CarbonylContact C-O 3.51Å; L369-P493 VanDerWaalsContact CA-O 3.24Å; L369-P493 WeakPolarHBondContact CA-O 3.45Å; G370-P493 PolarHBondContact N-O 3.38Å; Q372-P493 WeakPolarHBondContact O-CD 3.27Å; F374-P493 HydrophobicContact CD2-CG 4.36Å; F374-P493 HydrophobicContact CE2-CG 3.65Å; W381-P493 HydrophobicContact CZ2-CB 4.44Å; W381-P493 HydrophobicContact CZ2-CG 4.42Å; G394-P493 WeakPolarHBondContact O-CA 3.39Å; P493-F495 HydrophobicContact CB-CE2 3.57Å; P493-F495 HydrophobicContact CB-CZ 3.79Å
494	Y	96.2	Very high	84.6	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.008	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.2	-177.2	171.2	-103.2	0	0	0	110.1	F362 C367 L369 R392 G394 V396 F427 Y429 R492	F362-Y494 HydrophobicContact CZ-CE2 4.31Å; C367-Y494 HydrophobicContact CB-CE2 3.65Å; L369-Y494 HydrophobicContact CD2-CD2 3.9Å; R392-Y494 HydrophobicContact CB-CE1 4.09Å; G394-Y494 PolarHBondContact N-O 2.98Å; G394-Y494 PolarHBondContact O-N 2.92Å; V396-Y494 HydrophobicContact CB-CG 4.47Å; V396-Y494 HydrophobicContact CG1-CD2 4.45Å; F427-Y494 HydrophobicContact CD1-CD1 4.44Å; F427-Y494 HydrophobicContact CD1-CD2 4.31Å; F427-Y494 HydrophobicContact CD1-CE1 4.32Å; F427-Y494 HydrophobicContact CD1-CE2 4.19Å; F427-Y494 HydrophobicContact CD1-CG 4.43Å; F427-Y494 HydrophobicContact CE1-CD2 4.13Å; F427-Y494 AromaticContact CE1-CE2 3.87Å; F427-Y494 HydrophobicContact CE1-CE2 3.87Å; Y429-Y494 HydrophobicContact CD1-CD1 4.06Å; Y429-Y494 AromaticContact CD1-CE1 3.82Å; Y429-Y494 HydrophobicContact CD1-CE1 3.82Å; Y429-Y494 HydrophobicContact CE1-CE1 4.26Å; Y429-Y494 HydrophobicContact CG-CD1 4.47Å; Y429-Y494 HydrophobicContact CG-CE1 4.37Å; R492-Y494 PolarHBondContact O-N 2.87Å
495	F	95.5	Very high	83.2	Confident	0 Å²	0	65 Å²	65	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	141.8	-178.8	-54.2	-79.3	0	0	0	110.8	F327 L329 C367 L368 V383 R392 V393 P493 L509	F327-F495 AromaticContact CE2-CE2 3.86Å; F327-F495 HydrophobicContact CE2-CE2 3.86Å; F327-F495 AromaticContact CE2-CZ 3.74Å; F327-F495 HydrophobicContact CE2-CZ 3.74Å; F327-F495 HydrophobicContact CZ-CE2 4.39Å; F327-F495 AromaticContact CZ-CZ 3.89Å; F327-F495 HydrophobicContact CZ-CZ 3.89Å; L329-F495 HydrophobicContact CD2-CD2 3.62Å; L329-F495 HydrophobicContact CD2-CE2 3.63Å; L329-F495 HydrophobicContact CD2-CG 4.39Å; L329-F495 HydrophobicContact CD2-CZ 4.4Å; C367-F495 CarbonylContact C-O 3.57Å; C367-F495 WeakPolarHBondContact CA-O 3.27Å; C367-F495 WeakPolarHBondContact CB-O 3.19Å; L368-F495 HydrophobicContact CD2-CB 3.59Å; L368-F495 HydrophobicContact CG-CB 4.36Å; L368-F495 PolarHBondContact N-O 3.14Å; L368-F495 PolarHBondContact O-N 3.5Å; V383-F495 HydrophobicContact CG1-CE1 4.2Å; V383-F495 HydrophobicContact CG2-CE1 3.88Å; R392-F495 CarbonylContact O-C 3.45Å; R392-F495 WeakPolarHBondContact O-CA 3.48Å; V393-F495 HydrophobicContact CG1-CD1 4.42Å; V393-F495 HydrophobicContact CG1-CE1 4.17Å; V393-F495 HydrophobicContact CG2-CD1 4.32Å; P493-F495 HydrophobicContact CB-CE2 3.57Å; P493-F495 HydrophobicContact CB-CZ 3.79Å; F495-L509 HydrophobicContact CD1-CD1 4.19Å; F495-L509 HydrophobicContact CD1-CD2 3.9Å; F495-L509 HydrophobicContact CE1-CD2 4.31Å; F495-L509 HydrophobicContact CG-CD2 4.39Å
496	Y	92	Very high	82.2	Confident	36 Å²	36	60.6 Å²	60.6	14%	0.141	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	138.4	171.6	171.3	-81.6	0	0	0	109.5	A365 P366 C367 W391 R392	A365-Y496 HydrophobicContact CB-CE2 4.29Å; P366-Y496 HydrophobicContact CG-CD2 3.96Å; P366-Y496 HydrophobicContact CG-CE1 4.36Å; P366-Y496 HydrophobicContact CG-CE2 3.41Å; P366-Y496 VanDerWaalsContact CG-CE2 3.41Å; P366-Y496 VanDerWaalsContact O-CA 3.32Å; P366-Y496 WeakPolarHBondContact O-CA 3.33Å; C367-Y496 HydrophobicContact CB-CD2 4.46Å; W391-Y496 CarbonylContact C-O 3.52Å; W391-Y496 WeakPolarHBondContact CA-O 3.43Å; R392-Y496 HydrophobicContact CB-CG 4.43Å; R392-Y496 HydrophobicContact CG-CD1 3.85Å; R392-Y496 HydrophobicContact CG-CG 3.89Å; R392-Y496 PolarHBondContact N-O 2.99Å; R392-Y496 PolarHBondContact O-N 2.88Å
497	L	90	Very high	81.8	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.005	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	104.8	179.1	-70.4	90.1	0	0	0	110.8	L338 V347 N349 P366 L368 L388 L509	L338-L497 HydrophobicContact CD2-CB 4.28Å; V347-L497 HydrophobicContact CG1-CD1 3.58Å; V347-L497 HydrophobicContact CG1-CD2 3.87Å; V347-L497 HydrophobicContact CG1-CG 4.38Å; V347-L497 HydrophobicContact CG2-CD1 4.42Å; V347-L497 WeakPolarHBondContact O-CD2 3.32Å; N349-L497 HydrophobicContact CB-CB 4.35Å; N349-L497 PolarHBondContact ND2-O 3.36Å; P366-L497 WeakPolarHBondContact CB-O 3.23Å; P366-L497 WeakPolarHBondContact CG-O 3.27Å; P366-L497 PolarHBondContact O-N 3.4Å; L368-L497 HydrophobicContact CD2-CD1 3.72Å; L388-L497 HydrophobicContact CD1-CD2 4.47Å; L497-L509 HydrophobicContact CD1-CB 4.33Å; L497-L509 HydrophobicContact CD1-CD1 4.25Å; L497-L509 HydrophobicContact CD2-CB 3.68Å; L497-L509 HydrophobicContact CG-CB 4.09Å; L497-L509 HydrophobicContact CG-CD1 4.3Å
498	G	81.8	Confident	81.8	Confident	5 Å²	5	57.9 Å²	57.9	5%	0.052	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-65.5	151.7	173.8	0	0	0	0	0	111.9	S390	S390-G498 PolarHBondContact O-N 3.29Å
499	S	72.8	Confident	82	Confident	84 Å²	84	57.7 Å²	57.7	59%	0.587	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-68.1	135.6	177	-56	0	0	0	0	111	N349	N349-S499 PolarHBondContact ND2-OG 2.88Å
500	S	65.3	Low	82.2	Confident	67 Å²	67	60.8 Å²	60.8	47%	0.469	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-72.4	135.1	167.6	-176.8	0	0	0	0	109.7	G502	S500-G502 PolarHBondContact OG-N 3.49Å
501	R	58.3	Low	82.2	Confident	231 Å²	231	55.4 Å²	55.4	87%	0.872	31%	0.31	S	S	*	.			trans	-89.7	-0.5	175.4	-73.5	-175	169	-171.3	-1.6	113.4
502	G	59.1	Low	82.2	Confident	50 Å²	50	56.2 Å²	56.2	52%	0.515	32%	0.315	S	S	.	.	S	Bend	trans	-100.6	156.8	-175.2	0	0	0	0	0	114.4	S500 G504	S500-G502 PolarHBondContact OG-N 3.49Å; G502-G504 PolarHBondContact O-N 2.79Å; G502-G504 VanDerWaalsContact O-N 3.14Å
503	D	56.7	Low	81.9	Confident	186 Å²	186	58.3 Å²	58.3	100%	0.995	33%	0.326	S	S	*	.	S	Bend	trans	-70.7	4.7	177.4	-84.5	-23.3	0	0	0	114.8
504	G	65.2	Low	81.5	Confident	47 Å²	47	62 Å²	62	49%	0.485	35%	0.345	S	S	.	.	S	Bend	trans	-81.7	161.9	179	0	0	0	0	0	113.4	G502	G502-G504 PolarHBondContact O-N 2.79Å; G502-G504 VanDerWaalsContact O-N 3.14Å
505	P	67.4	Low	81	Confident	121 Å²	121	73.4 Å²	73.4	79%	0.786	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-58.2	140.2	171.7	26.1	-33.1	0	0	0	110	E507	P505-E507 PolarHBondContact O-N 3.1Å
506	P	72.9	Confident	80.4	Confident	43 Å²	43	77.1 Å²	77.1	28%	0.279	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-63.3	124.7	-178.2	25.1	-33	0	0	0	110.3	I348	I348-P506 HydrophobicContact CB-CB 4.38Å; I348-P506 HydrophobicContact CB-CG 4.41Å; I348-P506 HydrophobicContact CD1-CG 4.16Å
507	E	83.8	Confident	80.1	Confident	92 Å²	92	79.7 Å²	79.7	43%	0.43	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-68.5	138.8	173.2	-70.7	-169.8	174.1	0	0	110.5	G387 L388 P505	G387-E507 WeakPolarHBondContact CA-OE2 3.19Å; G387-E507 PolarHBondContact N-OE2 3.42Å; L388-E507 HydrophobicContact CD2-CB 4Å; L388-E507 WeakPolarHBondContact CD2-O 3.18Å; L388-E507 HydrophobicContact CG-CB 4.39Å; L388-E507 PolarHBondContact N-OE2 3.31Å; P505-E507 PolarHBondContact O-N 3.1Å
508	P	91.1	Very high	79.8	Confident	48 Å²	48	82.4 Å²	82.4	31%	0.312	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-84.9	147	176.3	32.1	-32.7	0	0	0	112.4	V347 I348	V347-P508 WeakPolarHBondContact O-CA 3.42Å; I348-P508 HydrophobicContact CG2-CB 3.65Å
509	L	94.6	Very high	80	Confident	0 Å²	0	90.4 Å²	90.4	0%	0	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	133	153.9	-176.1	151.8	0	0	0	107.6	S346 V347 V383 V385 L388 V393 F495 L497	S346-L509 CarbonylContact C-O 3.55Å; S346-L509 WeakPolarHBondContact CA-O 3.4Å; S346-L509 WeakPolarHBondContact CB-O 3.38Å; V347-L509 HydrophobicContact CG1-CB 4.11Å; V347-L509 HydrophobicContact CG1-CD2 4.32Å; V347-L509 PolarHBondContact N-O 3.24Å; V347-L509 PolarHBondContact O-N 3.21Å; V383-L509 HydrophobicContact CG1-CD1 4.17Å; V383-L509 HydrophobicContact CG1-CD2 3.61Å; V383-L509 HydrophobicContact CG1-CG 3.77Å; V385-L509 HydrophobicContact CG1-CD1 4.32Å; L388-L509 HydrophobicContact CD1-CB 3.93Å; V393-L509 HydrophobicContact CG2-CD1 4.23Å; F495-L509 HydrophobicContact CD1-CD1 4.19Å; F495-L509 HydrophobicContact CD1-CD2 3.9Å; F495-L509 HydrophobicContact CE1-CD2 4.31Å; F495-L509 HydrophobicContact CG-CD2 4.39Å; L497-L509 HydrophobicContact CD1-CB 4.33Å; L497-L509 HydrophobicContact CD1-CD1 4.25Å; L497-L509 HydrophobicContact CD2-CB 3.68Å; L497-L509 HydrophobicContact CG-CB 4.09Å; L497-L509 HydrophobicContact CG-CD1 4.3Å
510	R	96.3	Very high	80.7	Confident	115 Å²	115	92.7 Å²	92.7	43%	0.434	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	134.5	-177	-179	177.4	-66.6	160	0.5	112.1	T345 V383 D384	T345-R510 WeakPolarHBondContact O-CA 3.47Å; V383-R510 CarbonylContact C-O 3.58Å; V383-R510 WeakPolarHBondContact CA-O 3.47Å; D384-R510 HydrophobicContact CB-CB 4.29Å; D384-R510 PolarHBondContact N-O 2.84Å; D384-R510 PolarHBondContact O-N 2.95Å
511	I	97.1	Very high	81.8	Confident	0 Å²	0	97.4 Å²	97.4	0%	0	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	123.3	166.4	-56.9	171.5	0	0	0	107.7	V325 P326 F327 L329 T345	V325-I511 HydrophobicContact CB-CG2 4.23Å; V325-I511 HydrophobicContact CG1-CG2 4.34Å; P326-I511 HydrophobicContact CG-CG2 4.02Å; F327-I511 HydrophobicContact CD2-CD1 3.67Å; F327-I511 HydrophobicContact CE2-CD1 3.43Å; F327-I511 VanDerWaalsContact CE2-CD1 3.43Å; F327-I511 HydrophobicContact CE2-CG1 4.21Å; F327-I511 HydrophobicContact CZ-CD1 4.33Å; F327-I511 WeakPolarHBondContact O-CD1 3.49Å; L329-I511 HydrophobicContact CD2-CD1 3.8Å; L329-I511 HydrophobicContact CD2-CG1 4.34Å; L329-I511 HydrophobicContact CG-CD1 3.74Å; L329-I511 HydrophobicContact CG-CG1 4.39Å; T345-I511 PolarHBondContact O-N 3.46Å
512	C	94.8	Very high	83.1	Confident	17 Å²	17	93.6 Å²	93.6	12%	0.115	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-72.7	147.7	-179.8	-60.9	0	0	0	0	111.5	E382	E382-C512 HydrophobicContact CB-CB 3.74Å; E382-C512 PolarHBondContact O-N 3.28Å
513	H	92.4	Very high	83.9	Confident	79 Å²	79	99.6 Å²	99.6	37%	0.366	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-69.3	145.8	177.3	-54.4	-68	0	0	0	112	E323 S324	E323-H513 IonicContact OE2-CE1 2.75Å; E323-H513 PolarHBondContact OE2-CE1 3.11Å; E323-H513 IonicContact OE2-NE2 3.29Å; S324-H513 CarbonylContact O-C 3.5Å; S324-H513 WeakPolarHBondContact O-CA 3.28Å; S324-H513 WeakPolarHBondContact O-CB 3.31Å
514	L	89.2	Confident	84.4	Confident	77 Å²	77	101.3 Å²	101.3	40%	0.403	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-72.5	140.6	171.6	-62.6	179	0	0	0	110.4	S324 P326 V516	S324-L514 PolarHBondContact O-N 3.41Å; P326-L514 HydrophobicContact CB-CD1 4.41Å; P326-L514 HydrophobicContact CB-CD2 4.19Å; P326-L514 HydrophobicContact CG-CD2 4.25Å; L514-V516 PolarHBondContact O-N 3.41Å
515	R	83.9	Confident	85.3	Confident	243 Å²	243	104.1 Å²	104.1	92%	0.917	52%	0.523	S	S	*	.			trans	-83.4	102.1	165.2	-171.7	178.7	-173.8	178.3	1.8	108.9
516	V	84.8	Confident	86.3	Confident	77 Å²	77	103.2 Å²	103.2	47%	0.467	51%	0.509	S	S	.	.			trans	-81	129.4	175.6	-169.3	0	0	0	0	109.4	L319 L514	L319-V516 HydrophobicContact CD1-CB 4.27Å; L319-V516 HydrophobicContact CD1-CG1 4.04Å; L319-V516 HydrophobicContact CD2-CB 4.39Å; L319-V516 HydrophobicContact CD2-CG1 3.97Å; L319-V516 HydrophobicContact CG-CG1 4.46Å; L514-V516 PolarHBondContact O-N 3.41Å
517	S	83.9	Confident	87	Confident	91 Å²	91	106.5 Å²	106.5	64%	0.636	52%	0.522	S	S	*	.			trans	-126.9	140.6	173.7	62.8	0	0	0	0	109.8
518	I	84.8	Confident	87.2	Confident	58 Å²	58	107.4 Å²	107.4	30%	0.297	53%	0.527	S	S	.	.			trans	-100.6	124.1	178.2	-59.2	158.2	0	0	0	107.4	W315 K316 L319 E520	W315-I518 HydrophobicContact CE3-CD1 4.41Å; W315-I518 HydrophobicContact CH2-CD1 3.66Å; W315-I518 HydrophobicContact CH2-CG1 3.99Å; W315-I518 HydrophobicContact CZ3-CD1 3.44Å; W315-I518 VanDerWaalsContact CZ3-CD1 3.44Å; W315-I518 HydrophobicContact CZ3-CG1 4.22Å; K316-I518 HydrophobicContact CD-CD1 4.47Å; K316-I518 HydrophobicContact CG-CD1 3.98Å; L319-I518 HydrophobicContact CD2-CD1 3.51Å; L319-I518 HydrophobicContact CD2-CG1 3.73Å; I518-E520 HydrophobicContact CG2-CG 4.35Å
519	K	86.3	Confident	86.9	Confident	173 Å²	173	111.1 Å²	111.1	75%	0.752	54%	0.541	S	S	*	.			trans	-99.5	127.6	168.6	-67.4	-178	179.8	179.4	0	108.3
520	E	86.3	Confident	86.4	Confident	132 Å²	132	118.5 Å²	118.5	62%	0.617	58%	0.577	S	S	*	*			trans	-103.4	112.5	177.2	-65.5	170.9	-160.4	0	0	107	Y312 K316 I518	Y312-E520 PolarHBondContact OH-OE1 2.85Å; K316-E520 IonicContact NZ-OE1 3.75Å; K316-E520 PolarHBondContact NZ-OE1 2.83Å; I518-E520 HydrophobicContact CG2-CG 4.35Å
521	E	89.1	Confident	85.7	Confident	166 Å²	166	118.7 Å²	118.7	78%	0.776	59%	0.587	S	S	*	*			trans	-116.2	142.6	177.4	-68.1	176.9	-168	0	0	108.2
522	L	85.1	Confident	84.9	Confident	151 Å²	151	127.8 Å²	127.8	79%	0.791	63%	0.632	S	S	*	*			trans	-78.8	135.2	170.8	-69	166.8	0	0	0	107.5	I524	L522-I524 HydrophobicContact CB-CG1 4.23Å; L522-I524 PolarHBondContact O-N 2.99Å
523	D	75.6	Confident	84	Confident	176 Å²	176	137.1 Å²	137.1	94%	0.941	68%	0.675	S	S	*	*			trans	-66.8	101.7	164.3	-75.4	-24.8	0	0	0	107.1
524	I	67	Low	83.3	Confident	222 Å²	222	142.4 Å²	142.4	100%	1.138	70%	0.703	S	S	*	*			trans	-92.5	0	176.4	-59.1	173.6	0	0	0	109.5	L522	L522-I524 HydrophobicContact CB-CG1 4.23Å; L522-I524 PolarHBondContact O-N 2.99Å

Retrieved 524 of 524 residues in 349.4 ms (Link to these results)

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