A0A087YGE1_POEFO Loading...

Scm polycomb group protein like 2

AlphaFold DB , UniProt , Accession A0A087YGE1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 683 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.3	Very low	35.5	Very low	256 Å²	256	169 Å²	169	100%	1.261	86%	0.859	S	S	*	*				0	146.9	0	-69.6	-170.2	-73.9	0	0	108.7
2	G	33.3	Very low	34.8	Very low	81 Å²	81	171.8 Å²	171.8	84%	0.835	87%	0.866	S	S	*	*			trans	177.9	131.7	175.2	0	0	0	0	0	109.7
3	R	37	Very low	34.5	Very low	253 Å²	253	172.8 Å²	172.8	96%	0.955	86%	0.861	S	S	*	*			trans	-98.4	164	178.8	-77.5	-177.6	172	179.3	-2.7	110.9
4	T	38	Very low	34.3	Very low	135 Å²	135	173.5 Å²	173.5	83%	0.828	86%	0.856	S	S	*	*			trans	-57.2	163.8	173.1	49.6	0	0	0	0	113
5	P	44.3	Very low	33.8	Very low	128 Å²	128	170.7 Å²	170.7	83%	0.831	84%	0.84	S	S	*	*				-137.5	145.2	108.1	37.1	-26.5	0	0	0	116.7
6	Q	34.2	Very low	33.6	Very low	171 Å²	171	173.5 Å²	173.5	80%	0.799	84%	0.838	S	S	*	*			trans	-37.3	148	161.6	176	-175.6	13.4	0	0	117.3
7	R	30.7	Very low	33.4	Very low	240 Å²	240	177.2 Å²	177.2	91%	0.906	84%	0.842	S	S	*	*			trans	-154.5	123.6	154.4	-99.6	-173.1	-176.1	-179.5	1.3	112.7
8	D	31.7	Very low	33.3	Very low	143 Å²	143	172.9 Å²	172.9	77%	0.765	83%	0.834	S	S	*	*			trans	-111.4	152.5	146.6	-67.7	-69.5	0	0	0	106.1
9	P	38.2	Very low	32.9	Very low	116 Å²	116	169.6 Å²	169.6	75%	0.753	83%	0.83	S	S	*	*				-154	158.4	86.5	40	-21.1	0	0	0	117.9
10	K	31	Very low	33.1	Very low	181 Å²	181	169.6 Å²	169.6	79%	0.787	83%	0.832	S	S	*	*			trans	40.4	128.5	144.6	-77.8	-166.7	166.8	-163.6	0	123.4
11	E	30.6	Very low	32.9	Very low	155 Å²	155	167.3 Å²	167.3	72%	0.724	83%	0.828	S	S	*	*				30.8	118.4	129.1	-61.2	-177.4	99.7	0	0	120.4
12	E	27.2	Very low	32.7	Very low	203 Å²	203	159.6 Å²	159.6	95%	0.949	81%	0.805	S	S	*	*			trans	-131.5	153.8	141.4	-154	167	-142	0	0	109.9
13	K	31.4	Very low	32.5	Very low	184 Å²	184	159.1 Å²	159.1	80%	0.8	80%	0.801	S	S	*	*			trans	-149.3	153	-160.9	-173.6	176.2	-176.8	173.6	0	112
14	K	30.9	Very low	32.2	Very low	183 Å²	183	151.6 Å²	151.6	80%	0.796	79%	0.787	S	S	*	*			trans	78.5	150	-161.2	-69.5	-179.8	161	-169.4	0	111.8
15	E	27.3	Very low	32.3	Very low	131 Å²	131	150.2 Å²	150.2	61%	0.612	79%	0.789	S	S	*	*			cis	-149.4	152.2	2.3	-135.6	-178.7	-129.2	0	0	106.1
16	R	29.8	Very low	32	Very low	216 Å²	216	151.5 Å²	151.5	82%	0.815	79%	0.788	S	S	*	*			cis	-158.5	139.1	44	-68.8	-173.1	163	158.8	-0.2	114.5
17	R	31.4	Very low	32.1	Very low	236 Å²	236	149.8 Å²	149.8	89%	0.891	78%	0.784	S	S	*	*			trans	10.2	131.9	139.6	-151.1	177.5	-177.7	157	-0.7	120.9
18	S	30.8	Very low	32.7	Very low	101 Å²	101	145.1 Å²	145.1	71%	0.706	77%	0.771	S	S	*	*			trans	64	106.4	145.9	61.1	0	0	0	0	122
19	S	26.3	Very low	33.2	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	76%	0.764	S	S	*	*				-135.4	105	124.4	47.5	0	0	0	0	109.6	T21	S19-T21 PolarHBondContact O-N 3.47Å
20	I	36.1	Very low	33.5	Very low	169 Å²	169	139.9 Å²	139.9	87%	0.867	74%	0.743	S	S	*	*			trans	-88	87.5	168.5	-59.9	176.4	0	0	0	106.7
21	T	29.2	Very low	35.1	Very low	122 Å²	122	138 Å²	138	75%	0.748	74%	0.737	S	S	*	*			trans	-83.8	113.5	169.5	-50.1	0	0	0	0	108	S19 G23	S19-T21 PolarHBondContact O-N 3.47Å; T21-G23 PolarHBondContact O-N 3.29Å
22	A	36.3	Very low	37.4	Very low	95 Å²	95	135 Å²	135	79%	0.785	73%	0.731	S	S	*	*			trans	-71	91.3	174.5	0	0	0	0	0	109.7	S24	A22-S24 PolarHBondContact O-N 3.23Å
23	G	29.9	Very low	40.3	Very low	71 Å²	71	127.1 Å²	127.1	73%	0.732	69%	0.694	S	S	*	*			trans	-60	121.7	174.1	0	0	0	0	0	110.5	T21	T21-G23 PolarHBondContact O-N 3.29Å
24	S	31.9	Very low	43.3	Very low	95 Å²	95	120.5 Å²	120.5	66%	0.664	67%	0.671	S	S	*	*			trans	-66.7	133.6	-178.5	56.5	0	0	0	0	111.2	A22 L26	A22-S24 PolarHBondContact O-N 3.23Å; S24-L26 PolarHBondContact O-N 2.88Å
25	A	38.5	Very low	46.3	Very low	106 Å²	106	113 Å²	113	88%	0.876	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	36.5	-178	0	0	0	0	0	114.3
26	L	38.4	Very low	49.6	Very low	155 Å²	155	113.9 Å²	113.9	81%	0.812	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.8	0	-163.2	-124.3	122	0	0	0	115.6	S24	S24-L26 PolarHBondContact O-N 2.88Å
27	D	36.6	Very low	52.6	Low	134 Å²	134	106.4 Å²	106.4	72%	0.717	62%	0.617	S	S	*	*			trans	-117.5	17.3	-174.8	-153.1	19.1	0	0	0	114	S29	D27-S29 PolarHBondContact O-N 3.46Å
28	K	42.7	Very low	55.6	Low	143 Å²	143	96.5 Å²	96.5	62%	0.622	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-74.6	-1.5	177.7	-97.8	-162.4	168.3	-162	0	114.7	N30 E41	K28-N30 PolarHBondContact O-N 3.09Å; K28-E41 IonicContact NZ-OE1 2.93Å; K28-E41 PolarHBondContact NZ-OE1 3.28Å
29	S	42.5	Very low	58.7	Low	90 Å²	90	93.1 Å²	93.1	63%	0.629	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-83.8	-2.1	-164.2	57.2	0	0	0	0	115.8	D27	D27-S29 PolarHBondContact O-N 3.46Å
30	N	44.3	Very low	62.1	Low	59 Å²	59	94.8 Å²	94.8	32%	0.316	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-127.1	-0.5	-175.4	-103.2	-12.4	0	0	0	115	K28 S383 N384 G385	K28-N30 PolarHBondContact O-N 3.09Å; N30-S383 WeakPolarHBondContact ND2-CB 3.47Å; N30-N384 WeakPolarHBondContact CB-O 3.39Å; N30-N384 PolarHBondContact OD1-O 3.41Å; N30-G385 VanDerWaalsContact OD1-CA 3.25Å; N30-G385 WeakPolarHBondContact OD1-CA 3.4Å
31	E	65.5	Low	64.9	Low	142 Å²	142	92 Å²	92	66%	0.664	53%	0.527	S	S	*	.	S	Bend	trans	-69.6	139.2	174.6	-66.6	-156.5	111	0	0	111
32	P	78.3	Confident	67.9	Low	90 Å²	90	88.4 Å²	88.4	58%	0.584	51%	0.505	S	S	*	.			trans	-64	146.8	174.7	28.9	-34.8	0	0	0	110.1	S34	P32-S34 PolarHBondContact O-N 3.44Å
33	F	89.1	Confident	70.8	Confident	39 Å²	39	89.4 Å²	89.4	17%	0.171	51%	0.506	C	S	.	.			trans	-54.9	115.3	-178.2	172.4	-94.1	0	0	0	111.8	W35 Y38 P191 L237 P239 P240 F243	F33-W35 AromaticContact CE1-CD1 4Å; F33-W35 AromaticContact CE1-CD2 3.71Å; F33-W35 HydrophobicContact CE1-CD2 3.71Å; F33-W35 AromaticContact CE1-CE2 3.85Å; F33-W35 HydrophobicContact CE1-CE3 4.24Å; F33-W35 AromaticContact CE1-CG 3.84Å; F33-W35 HydrophobicContact CE1-CG 3.84Å; F33-W35 HydrophobicContact CE1-CZ2 4.46Å; F33-W35 AromaticContact CZ-CD2 3.99Å; F33-W35 HydrophobicContact CZ-CD2 3.99Å; F33-W35 HydrophobicContact CZ-CE3 4.03Å; F33-W35 HydrophobicContact CZ-CG 4.44Å; F33-W35 HydrophobicContact CZ-CZ3 4.4Å; F33-Y38 AromaticContact CE2-CD1 3.79Å; F33-Y38 HydrophobicContact CE2-CD1 3.79Å; F33-Y38 HydrophobicContact CE2-CD2 4.09Å; F33-Y38 HydrophobicContact CE2-CE1 4.45Å; F33-Y38 AromaticContact CE2-CG 3.59Å; F33-Y38 HydrophobicContact CE2-CG 3.59Å; F33-Y38 AromaticContact CZ-CD1 3.63Å; F33-Y38 HydrophobicContact CZ-CD1 3.63Å; F33-Y38 HydrophobicContact CZ-CE1 4.39Å; F33-Y38 AromaticContact CZ-CG 3.83Å; F33-Y38 HydrophobicContact CZ-CG 3.83Å; F33-P191 HydrophobicContact CE1-CG 3.73Å; F33-P191 HydrophobicContact CE2-CG 4.28Å; F33-P191 HydrophobicContact CZ-CB 4.31Å; F33-P191 HydrophobicContact CZ-CG 3.59Å; F33-L237 HydrophobicContact CD1-CD2 3.76Å; F33-L237 HydrophobicContact CE1-CD2 3.75Å; F33-P239 HydrophobicContact CB-CB 4.31Å; F33-P239 HydrophobicContact CD2-CB 4.45Å; F33-P240 HydrophobicContact CD2-CG 4.4Å; F33-P240 VanDerWaalsContact CE2-CD 3.41Å; F33-P240 HydrophobicContact CE2-CG 3.79Å; F33-P240 HydrophobicContact CZ-CG 4.46Å; F33-F243 HydrophobicContact CD2-CD2 4.43Å; F33-F243 HydrophobicContact CD2-CE1 4.07Å; F33-F243 AromaticContact CD2-CE2 3.9Å; F33-F243 HydrophobicContact CD2-CE2 3.9Å; F33-F243 AromaticContact CD2-CZ 3.71Å; F33-F243 HydrophobicContact CD2-CZ 3.71Å; F33-F243 AromaticContact CE2-CE2 3.99Å; F33-F243 HydrophobicContact CE2-CE2 3.99Å; F33-F243 HydrophobicContact CE2-CZ 4.13Å
34	S	93.2	Very high	73.9	Confident	45 Å²	45	87.7 Å²	87.7	32%	0.315	48%	0.483	S	S	.	.			trans	-103.4	121.5	178.5	173	0	0	0	0	110.5	P32 E36 D37 Y38	P32-S34 PolarHBondContact O-N 3.44Å; S34-E36 VanDerWaalsContact C-N 3.35Å; S34-E36 PolarHBondContact O-N 3.37Å; S34-D37 WeakPolarHBondContact CB-OD2 3.41Å; S34-D37 PolarHBondContact OG-OD2 2.65Å; S34-Y38 VanDerWaalsContact O-CB 3.26Å; S34-Y38 WeakPolarHBondContact O-CB 3.42Å; S34-Y38 PolarHBondContact O-N 3.04Å
35	W	95	Very high	77.1	Confident	24 Å²	24	88 Å²	88	9%	0.091	48%	0.481	C	S	.	.	H	α-helix	trans	-65.1	-35.8	177.6	-95.4	125.1	0	0	0	113.2	F33 Y38 L39 K177 E179 P191 V227 L237	F33-W35 AromaticContact CE1-CD1 4Å; F33-W35 AromaticContact CE1-CD2 3.71Å; F33-W35 HydrophobicContact CE1-CD2 3.71Å; F33-W35 AromaticContact CE1-CE2 3.85Å; F33-W35 HydrophobicContact CE1-CE3 4.24Å; F33-W35 AromaticContact CE1-CG 3.84Å; F33-W35 HydrophobicContact CE1-CG 3.84Å; F33-W35 HydrophobicContact CE1-CZ2 4.46Å; F33-W35 AromaticContact CZ-CD2 3.99Å; F33-W35 HydrophobicContact CZ-CD2 3.99Å; F33-W35 HydrophobicContact CZ-CE3 4.03Å; F33-W35 HydrophobicContact CZ-CG 4.44Å; F33-W35 HydrophobicContact CZ-CZ3 4.4Å; W35-Y38 HydrophobicContact CE3-CD1 4.07Å; W35-Y38 AromaticContact CZ3-CD1 3.89Å; W35-Y38 HydrophobicContact CZ3-CD1 3.89Å; W35-Y38 HydrophobicContact CZ3-CE1 4.35Å; W35-Y38 PolarHBondContact O-N 3.22Å; W35-L39 HydrophobicContact CE3-CG 4.29Å; W35-L39 WeakPolarHBondContact O-CB 3.26Å; W35-L39 WeakPolarHBondContact O-CD1 3.21Å; W35-L39 WeakPolarHBondContact O-CG 3.43Å; W35-L39 PolarHBondContact O-N 3.12Å; W35-K177 HydrophobicContact CH2-CB 4.34Å; W35-K177 HydrophobicContact CZ3-CB 4.04Å; W35-K177 HydrophobicContact CZ3-CD 4.05Å; W35-E179 HydrophobicContact CZ2-CG 3.59Å; W35-E179 PolarHBondContact NE1-OE1 2.77Å; W35-P191 HydrophobicContact CH2-CB 3.54Å; W35-P191 HydrophobicContact CH2-CG 4.05Å; W35-P191 HydrophobicContact CZ2-CB 3.84Å; W35-P191 HydrophobicContact CZ2-CG 3.87Å; W35-P191 HydrophobicContact CZ3-CB 4.3Å; W35-V227 HydrophobicContact CB-CG1 3.74Å; W35-V227 HydrophobicContact CD2-CB 4.33Å; W35-V227 HydrophobicContact CD2-CG1 3.57Å; W35-V227 HydrophobicContact CD2-CG2 4.07Å; W35-V227 HydrophobicContact CE3-CG1 3.99Å; W35-V227 HydrophobicContact CE3-CG2 3.99Å; W35-V227 HydrophobicContact CG-CG1 3.48Å; W35-V227 VanDerWaalsContact CG-CG1 3.48Å; W35-V227 HydrophobicContact CH2-CG2 3.9Å; W35-V227 HydrophobicContact CZ2-CG2 3.98Å; W35-V227 HydrophobicContact CZ3-CG2 3.91Å; W35-L237 VanDerWaalsContact NE1-CD2 3.28Å
36	E	94.9	Very high	79.9	Confident	150 Å²	150	84.5 Å²	84.5	70%	0.701	45%	0.452	S	S	*	.	H	α-helix	trans	-70.7	-42.3	-177.7	-173.9	169.1	158	0	0	111.3	S34 R40	S34-E36 VanDerWaalsContact C-N 3.35Å; S34-E36 PolarHBondContact O-N 3.37Å; E36-R40 VanDerWaalsContact O-CB 3.3Å; E36-R40 WeakPolarHBondContact O-CB 3.48Å; E36-R40 PolarHBondContact O-N 3.23Å; E36-R40 VanDerWaalsContact O-N 3.11Å
37	D	94	Very high	82.8	Confident	59 Å²	59	77.3 Å²	77.3	32%	0.316	42%	0.415	S	S	.	.	H	α-helix	trans	-67.6	-41.4	174.5	-56.8	-63	0	0	0	111	S34 R40 E41	S34-D37 WeakPolarHBondContact CB-OD2 3.41Å; S34-D37 PolarHBondContact OG-OD2 2.65Å; D37-R40 PolarHBondContact O-N 2.91Å; D37-R40 IonicContact OD1-CZ 3.6Å; D37-R40 IonicContact OD1-NH1 3.91Å; D37-R40 PolarHBondContact OD1-NH1 3.34Å; D37-R40 IonicContact OD1-NH2 2.63Å; D37-R40 PolarHBondContact OD1-NH2 2.98Å; D37-E41 WeakPolarHBondContact O-CB 3.5Å; D37-E41 WeakPolarHBondContact O-CG 2.82Å; D37-E41 PolarHBondContact O-N 2.98Å
38	Y	95.2	Very high	85.6	Confident	28 Å²	28	73.5 Å²	73.5	11%	0.11	40%	0.399	C	S	.	.	H	α-helix	trans	-65.4	-42	177.9	-173.3	-120.3	0	0	0	113.4	F33 S34 W35 R40 T42 K177 D207 P240 F243	F33-Y38 AromaticContact CE2-CD1 3.79Å; F33-Y38 HydrophobicContact CE2-CD1 3.79Å; F33-Y38 HydrophobicContact CE2-CD2 4.09Å; F33-Y38 HydrophobicContact CE2-CE1 4.45Å; F33-Y38 AromaticContact CE2-CG 3.59Å; F33-Y38 HydrophobicContact CE2-CG 3.59Å; F33-Y38 AromaticContact CZ-CD1 3.63Å; F33-Y38 HydrophobicContact CZ-CD1 3.63Å; F33-Y38 HydrophobicContact CZ-CE1 4.39Å; F33-Y38 AromaticContact CZ-CG 3.83Å; F33-Y38 HydrophobicContact CZ-CG 3.83Å; S34-Y38 VanDerWaalsContact O-CB 3.26Å; S34-Y38 WeakPolarHBondContact O-CB 3.42Å; S34-Y38 PolarHBondContact O-N 3.04Å; W35-Y38 HydrophobicContact CE3-CD1 4.07Å; W35-Y38 AromaticContact CZ3-CD1 3.89Å; W35-Y38 HydrophobicContact CZ3-CD1 3.89Å; W35-Y38 HydrophobicContact CZ3-CE1 4.35Å; W35-Y38 PolarHBondContact O-N 3.22Å; Y38-R40 VanDerWaalsContact C-N 3.31Å; Y38-R40 PolarHBondContact O-N 3.07Å; Y38-T42 HydrophobicContact CD2-CG2 3.91Å; Y38-T42 HydrophobicContact CE1-CG2 4.34Å; Y38-T42 HydrophobicContact CE2-CG2 3.45Å; Y38-T42 VanDerWaalsContact CE2-CG2 3.45Å; Y38-T42 WeakPolarHBondContact O-CB 3.35Å; Y38-T42 WeakPolarHBondContact O-CG2 3.25Å; Y38-T42 PolarHBondContact O-N 3.31Å; Y38-T42 PolarHBondContact O-OG1 3.33Å; Y38-K177 HydrophobicContact CD1-CD 4.26Å; Y38-K177 HydrophobicContact CE1-CD 3.91Å; Y38-D207 WeakPolarHBondContact CE1-OD2 3.17Å; Y38-D207 PolarHBondContact OH-OD2 3.02Å; Y38-P240 HydrophobicContact CE1-CG 4.06Å; Y38-P240 HydrophobicContact CE2-CG 4Å; Y38-F243 AromaticContact CD2-CE2 3.8Å; Y38-F243 HydrophobicContact CD2-CE2 3.8Å; Y38-F243 HydrophobicContact CE2-CE2 4.08Å
39	L	95.9	Very high	88.2	Confident	31 Å²	31	70.1 Å²	70.1	16%	0.162	39%	0.392	C	S	.	.	H	α-helix	trans	-61.7	-41.1	174	-76.3	164.4	0	0	0	111.4	W35 S43 S44 A46 K177 V227	W35-L39 HydrophobicContact CE3-CG 4.29Å; W35-L39 WeakPolarHBondContact O-CB 3.26Å; W35-L39 WeakPolarHBondContact O-CD1 3.21Å; W35-L39 WeakPolarHBondContact O-CG 3.43Å; W35-L39 PolarHBondContact O-N 3.12Å; L39-S43 WeakPolarHBondContact O-CA 3.44Å; L39-S43 PolarHBondContact O-N 3.42Å; L39-S44 WeakPolarHBondContact CD2-O 3.44Å; L39-S44 PolarHBondContact O-N 2.92Å; L39-A46 HydrophobicContact CD1-CB 4.14Å; L39-A46 HydrophobicContact CD2-CB 4.36Å; L39-K177 HydrophobicContact CD2-CB 4.13Å; L39-K177 HydrophobicContact CD2-CD 4.06Å; L39-K177 HydrophobicContact CD2-CG 4.39Å; L39-V227 HydrophobicContact CD1-CG1 4.24Å
40	R	96.1	Very high	90.8	Very high	143 Å²	143	68.3 Å²	68.3	54%	0.54	38%	0.379	S	S	.	.	H	α-helix	trans	-68.4	-46.6	179.2	-166.7	172.8	70.8	-110	-2.2	112.1	E36 D37 Y38 S43	E36-R40 VanDerWaalsContact O-CB 3.3Å; E36-R40 WeakPolarHBondContact O-CB 3.48Å; E36-R40 PolarHBondContact O-N 3.23Å; E36-R40 VanDerWaalsContact O-N 3.11Å; D37-R40 PolarHBondContact O-N 2.91Å; D37-R40 IonicContact OD1-CZ 3.6Å; D37-R40 IonicContact OD1-NH1 3.91Å; D37-R40 PolarHBondContact OD1-NH1 3.34Å; D37-R40 IonicContact OD1-NH2 2.63Å; D37-R40 PolarHBondContact OD1-NH2 2.98Å; Y38-R40 VanDerWaalsContact C-N 3.31Å; Y38-R40 PolarHBondContact O-N 3.07Å; R40-S43 PolarHBondContact O-N 2.84Å
41	E	94.6	Very high	93.3	Very high	111 Å²	111	65.7 Å²	65.7	52%	0.519	37%	0.365	S	S	.	.	H	α-helix	trans	-67.2	-35.1	177.5	-72	-177	169.3	0	0	112.4	K28 D37 S43	K28-E41 IonicContact NZ-OE1 2.93Å; K28-E41 PolarHBondContact NZ-OE1 3.28Å; D37-E41 WeakPolarHBondContact O-CB 3.5Å; D37-E41 WeakPolarHBondContact O-CG 2.82Å; D37-E41 PolarHBondContact O-N 2.98Å; E41-S43 VanDerWaalsContact C-N 3.34Å
42	T	93.8	Very high	94.9	Very high	47 Å²	47	59.2 Å²	59.2	29%	0.288	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	4	175	59.8	0	0	0	0	114.4	Y38 S44 K177	Y38-T42 HydrophobicContact CD2-CG2 3.91Å; Y38-T42 HydrophobicContact CE1-CG2 4.34Å; Y38-T42 HydrophobicContact CE2-CG2 3.45Å; Y38-T42 VanDerWaalsContact CE2-CG2 3.45Å; Y38-T42 WeakPolarHBondContact O-CB 3.35Å; Y38-T42 WeakPolarHBondContact O-CG2 3.25Å; Y38-T42 PolarHBondContact O-N 3.31Å; Y38-T42 PolarHBondContact O-OG1 3.33Å; T42-S44 PolarHBondContact O-N 3.47Å; T42-S44 PolarHBondContact O-OG 3.34Å; T42-S44 WeakPolarHBondContact OG1-CB 3.31Å; T42-S44 PolarHBondContact OG1-OG 3.02Å; T42-K177 VanDerWaalsContact OG1-CE 3.24Å; T42-K177 WeakPolarHBondContact OG1-CE 3.13Å
43	S	95.8	Very high	95.8	Very high	115 Å²	115	56.2 Å²	56.2	80%	0.804	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.3	37.1	-176.4	-60.3	0	0	0	0	113.6	L39 R40 E41	L39-S43 WeakPolarHBondContact O-CA 3.44Å; L39-S43 PolarHBondContact O-N 3.42Å; R40-S43 PolarHBondContact O-N 2.84Å; E41-S43 VanDerWaalsContact C-N 3.34Å
44	S	96.2	Very high	96.2	Very high	35 Å²	35	55.1 Å²	55.1	25%	0.245	31%	0.308	C	S	.	.			trans	-114.4	160.3	-167.7	-67.8	0	0	0	0	112.1	L39 T42 K177	L39-S44 WeakPolarHBondContact CD2-O 3.44Å; L39-S44 PolarHBondContact O-N 2.92Å; T42-S44 PolarHBondContact O-N 3.47Å; T42-S44 PolarHBondContact O-OG 3.34Å; T42-S44 WeakPolarHBondContact OG1-CB 3.31Å; T42-S44 PolarHBondContact OG1-OG 3.02Å; S44-K177 WeakPolarHBondContact OG-CE 3.16Å
45	V	97.5	Very high	96.3	Very high	102 Å²	102	55.2 Å²	55.2	62%	0.618	31%	0.308	S	S	*	.			trans	-114	134	-176.9	-177.4	0	0	0	0	110.2	M176 K177	V45-M176 CarbonylContact O-C 3.54Å; V45-M176 WeakPolarHBondContact O-CA 3.02Å; V45-K177 PolarHBondContact O-N 2.65Å
46	A	98.3	Very high	96.2	Very high	33 Å²	33	64.3 Å²	64.3	27%	0.273	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-70	139.9	172.4	0	0	0	0	0	111.1	L39 S48 K177 V227	L39-A46 HydrophobicContact CD1-CB 4.14Å; L39-A46 HydrophobicContact CD2-CB 4.36Å; A46-S48 PolarHBondContact O-N 2.86Å; A46-K177 WeakPolarHBondContact CA-O 3.24Å; A46-V227 HydrophobicContact CB-CB 3.85Å; A46-V227 HydrophobicContact CB-CG1 4.38Å; A46-V227 HydrophobicContact CB-CG2 3.64Å
47	A	98.3	Very high	96.1	Very high	3 Å²	3	63.7 Å²	63.7	3%	0.025	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-60.8	133.1	169	0	0	0	0	0	110.3	F52 F172 M176 K177	A47-F52 HydrophobicContact CB-CE2 3.72Å; A47-F52 HydrophobicContact CB-CZ 3.72Å; A47-F172 HydrophobicContact CB-CD1 3.81Å; A47-F172 HydrophobicContact CB-CE1 3.6Å; A47-M176 HydrophobicContact CB-CB 4.09Å; A47-M176 HydrophobicContact CB-SD 4.13Å; A47-K177 PolarHBondContact N-O 3.11Å
48	S	97.4	Very high	96.1	Very high	55 Å²	55	62.5 Å²	62.5	39%	0.385	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-57.1	140.7	177.3	173.2	0	0	0	0	111	A46 S50 C51 F52	A46-S48 PolarHBondContact O-N 2.86Å; S48-S50 WeakPolarHBondContact CB-OG 3.46Å; S48-S50 PolarHBondContact O-N 3.05Å; S48-S50 PolarHBondContact OG-N 3.01Å; S48-S50 PolarHBondContact OG-OG 2.97Å; S48-C51 VanDerWaalsContact O-CB 3.31Å; S48-C51 WeakPolarHBondContact O-CB 3.4Å; S48-C51 PolarHBondContact O-N 3.29Å; S48-C51 PolarHBondContact O-SG 2.99Å; S48-F52 VanDerWaalsContact O-CD2 3.31Å; S48-F52 WeakPolarHBondContact O-CD2 3.44Å; S48-F52 WeakPolarHBondContact O-CE2 3.09Å
49	P	96.7	Very high	96.1	Very high	72 Å²	72	62.2 Å²	62.2	47%	0.468	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-53.4	-21.9	171	-28.4	36.3	0	0	0	114.4	C51 F52 P226	P49-C51 PolarHBondContact O-N 2.78Å; P49-F52 PolarHBondContact O-N 2.8Å; P49-P226 HydrophobicContact CB-CB 4.4Å; P49-P226 HydrophobicContact CG-CB 4.2Å
50	S	96.3	Very high	96.1	Very high	52 Å²	52	63.8 Å²	63.8	36%	0.364	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-70.2	-11.1	173.5	63.1	0	0	0	0	114.9	S48 F52	S48-S50 WeakPolarHBondContact CB-OG 3.46Å; S48-S50 PolarHBondContact O-N 3.05Å; S48-S50 PolarHBondContact OG-N 3.01Å; S48-S50 PolarHBondContact OG-OG 2.97Å; S50-F52 VanDerWaalsContact C-N 3.33Å
51	C	97.5	Very high	96.1	Very high	3 Å²	3	59 Å²	59	2%	0.02	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-80.2	-14.9	177.1	-55	0	0	0	0	113	S48 P49 Y171 F172	S48-C51 VanDerWaalsContact O-CB 3.31Å; S48-C51 WeakPolarHBondContact O-CB 3.4Å; S48-C51 PolarHBondContact O-N 3.29Å; S48-C51 PolarHBondContact O-SG 2.99Å; P49-C51 PolarHBondContact O-N 2.78Å; C51-Y171 VanDerWaalsContact SG-CB 3.52Å; C51-F172 HydrophobicContact CB-CD1 4Å; C51-F172 HydrophobicContact CB-CD2 4.01Å; C51-F172 HydrophobicContact CB-CE1 3.69Å; C51-F172 HydrophobicContact CB-CE2 3.7Å; C51-F172 HydrophobicContact CB-CG 4.16Å; C51-F172 HydrophobicContact CB-CZ 3.52Å; C51-F172 WeakPolarHBondContact O-CE2 3.4Å
52	F	98.3	Very high	96.2	Very high	7 Å²	7	57.4 Å²	57.4	3%	0.031	33%	0.333	C	S	.	.	S	Bend	trans	-111.1	144.3	-165.8	-59.5	-94.8	0	0	0	112.8	A47 S48 P49 S50 Q54 F172 L178 I224 F225 P226	A47-F52 HydrophobicContact CB-CE2 3.72Å; A47-F52 HydrophobicContact CB-CZ 3.72Å; S48-F52 VanDerWaalsContact O-CD2 3.31Å; S48-F52 WeakPolarHBondContact O-CD2 3.44Å; S48-F52 WeakPolarHBondContact O-CE2 3.09Å; P49-F52 PolarHBondContact O-N 2.8Å; S50-F52 VanDerWaalsContact C-N 3.33Å; F52-Q54 HydrophobicContact CB-CB 4.29Å; F52-Q54 HydrophobicContact CB-CG 3.95Å; F52-Q54 PolarHBondContact O-N 2.85Å; F52-F172 HydrophobicContact CD1-CE1 4.4Å; F52-F172 AromaticContact CD1-CZ 3.77Å; F52-F172 HydrophobicContact CD1-CZ 3.77Å; F52-F172 HydrophobicContact CD2-CZ 4.31Å; F52-F172 AromaticContact CE1-CE1 3.79Å; F52-F172 HydrophobicContact CE1-CE1 3.79Å; F52-F172 AromaticContact CE1-CZ 3.58Å; F52-F172 HydrophobicContact CE1-CZ 3.58Å; F52-F172 HydrophobicContact CE2-CE1 4.03Å; F52-F172 HydrophobicContact CE2-CZ 4.15Å; F52-F172 HydrophobicContact CG-CZ 4.14Å; F52-F172 AromaticContact CZ-CE1 3.59Å; F52-F172 HydrophobicContact CZ-CE1 3.59Å; F52-F172 AromaticContact CZ-CZ 3.8Å; F52-F172 HydrophobicContact CZ-CZ 3.8Å; F52-L178 HydrophobicContact CE1-CB 4Å; F52-L178 HydrophobicContact CE1-CD2 4.29Å; F52-L178 HydrophobicContact CZ-CB 3.73Å; F52-L178 HydrophobicContact CZ-CD2 4.42Å; F52-I224 HydrophobicContact CD1-CB 4.31Å; F52-I224 HydrophobicContact CD1-CD1 4.37Å; F52-I224 HydrophobicContact CD1-CG1 4.08Å; F52-I224 HydrophobicContact CE1-CB 4.2Å; F52-I224 HydrophobicContact CE1-CG1 4.38Å; F52-F225 WeakPolarHBondContact CE1-O 3.33Å; F52-F225 VanDerWaalsContact CZ-C 3.49Å; F52-F225 WeakPolarHBondContact CZ-O 3.47Å; F52-P226 HydrophobicContact CD2-CB 4.01Å; F52-P226 HydrophobicContact CD2-CG 4.47Å; F52-P226 HydrophobicContact CE2-CB 3.79Å; F52-P226 HydrophobicContact CZ-CB 4.31Å
53	K	98.1	Very high	96.4	Very high	27 Å²	27	55.5 Å²	55.5	12%	0.117	32%	0.321	C	S	.	.	S	Bend	trans	-79.1	65.2	164.5	-167.2	-179.2	-173.2	-160.9	0	110.5	E163 P164 S166 D220 R222	K53-E163 WeakPolarHBondContact CE-OE1 3.43Å; K53-E163 IonicContact NZ-OE1 2.94Å; K53-E163 PolarHBondContact NZ-OE1 2.76Å; K53-E163 IonicContact NZ-OE2 2.76Å; K53-E163 PolarHBondContact NZ-OE2 2.94Å; K53-P164 WeakPolarHBondContact CE-O 3.39Å; K53-P164 HydrophobicContact CG-CG 4.39Å; K53-S166 VanDerWaalsContact CD-OG 3.27Å; K53-S166 WeakPolarHBondContact CD-OG 3.41Å; K53-S166 WeakPolarHBondContact CE-OG 3.3Å; K53-D220 HydrophobicContact CB-CB 4Å; K53-D220 VanDerWaalsContact CB-O 3.25Å; K53-D220 WeakPolarHBondContact CB-O 3.48Å; K53-D220 HydrophobicContact CD-CB 4.14Å; K53-D220 VanDerWaalsContact CD-O 3.3Å; K53-D220 WeakPolarHBondContact CD-O 3.15Å; K53-R222 PolarHBondContact O-NE 3.25Å; K53-R222 PolarHBondContact O-NH2 2.94Å
54	Q	97.6	Very high	96.5	Very high	16 Å²	16	55.3 Å²	55.3	8%	0.075	31%	0.306	C	S	.	.	S	Bend	trans	-137.2	145.5	178.7	-55.5	-64.2	-2.6	0	0	109.6	F52 R222 I224 F225 W229	F52-Q54 HydrophobicContact CB-CB 4.29Å; F52-Q54 HydrophobicContact CB-CG 3.95Å; F52-Q54 PolarHBondContact O-N 2.85Å; Q54-R222 PolarHBondContact NE2-O 3.06Å; Q54-R222 VanDerWaalsContact NE2-O 3.08Å; Q54-I224 PolarHBondContact NE2-O 2.78Å; Q54-F225 HydrophobicContact CG-CD1 3.96Å; Q54-F225 VanDerWaalsContact NE2-CD1 3.26Å; Q54-W229 HydrophobicContact CB-CH2 4.09Å; Q54-W229 HydrophobicContact CB-CZ2 4.44Å; Q54-W229 HydrophobicContact CB-CZ3 4.33Å
55	S	95.1	Very high	96.6	Very high	47 Å²	47	56.6 Å²	56.6	33%	0.329	32%	0.319	S	S	.	.			trans	-66.4	141	174.4	177.6	0	0	0	0	110.7	I57 W229	S55-I57 VanDerWaalsContact CB-O 3.26Å; S55-I57 WeakPolarHBondContact CB-O 3.42Å; S55-I57 PolarHBondContact O-N 2.89Å; S55-I57 PolarHBondContact OG-N 2.71Å; S55-I57 PolarHBondContact OG-O 3.17Å; S55-W229 WeakPolarHBondContact O-CH2 3.45Å; S55-W229 WeakPolarHBondContact O-CZ3 3.29Å
56	R	92.1	Very high	96.6	Very high	214 Å²	214	53.7 Å²	53.7	81%	0.808	31%	0.31	S	S	*	.	S	Bend	trans	-63.5	-28.6	176.1	-70.1	-171.5	179.1	-141.3	2.1	113.5
57	I	93.6	Very high	96.6	Very high	138 Å²	138	52.5 Å²	52.5	71%	0.708	30%	0.298	S	S	*	.	S	Bend	trans	-112.1	118.2	171.9	-59.2	174.9	0	0	0	105.8	S55	S55-I57 VanDerWaalsContact CB-O 3.26Å; S55-I57 WeakPolarHBondContact CB-O 3.42Å; S55-I57 PolarHBondContact O-N 2.89Å; S55-I57 PolarHBondContact OG-N 2.71Å; S55-I57 PolarHBondContact OG-O 3.17Å
58	P	94.5	Very high	96.6	Very high	33 Å²	33	53.7 Å²	53.7	21%	0.214	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-59.3	140.9	-177.8	-21.9	30.2	0	0	0	112.4	T91 W229 L232 T233	P58-T91 HydrophobicContact CB-CG2 4.05Å; P58-W229 HydrophobicContact CB-CH2 3.88Å; P58-W229 HydrophobicContact CB-CZ2 4.03Å; P58-W229 HydrophobicContact CB-CZ3 4.38Å; P58-W229 HydrophobicContact CG-CE3 4.2Å; P58-W229 HydrophobicContact CG-CH2 3.79Å; P58-W229 HydrophobicContact CG-CZ2 4.22Å; P58-W229 HydrophobicContact CG-CZ3 3.77Å; P58-L232 HydrophobicContact CG-CB 4.18Å; P58-T233 HydrophobicContact CB-CG2 3.56Å; P58-T233 HydrophobicContact CG-CG2 3.78Å
59	P	94.9	Very high	96.7	Very high	22 Å²	22	51.1 Å²	51.1	14%	0.143	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-63.1	150.4	179.9	23.2	-32.8	0	0	0	112.6	T91 V110 D111 K161	P59-T91 HydrophobicContact CG-CG2 4.12Å; P59-T91 WeakPolarHBondContact O-CG2 3.3Å; P59-V110 HydrophobicContact CB-CG2 3.74Å; P59-V110 HydrophobicContact CG-CG2 3.59Å; P59-D111 HydrophobicContact CG-CB 4.34Å; P59-K161 HydrophobicContact CB-CB 4.13Å; P59-K161 HydrophobicContact CB-CG 3.86Å
60	S	95.6	Very high	96.7	Very high	64 Å²	64	47.8 Å²	47.8	45%	0.448	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-67.6	144.1	167.7	75.7	0	0	0	0	110.6	D62 K161	S60-D62 VanDerWaalsContact CB-OD1 3.23Å; S60-D62 WeakPolarHBondContact CB-OD1 3.23Å; S60-D62 PolarHBondContact OG-OD1 3.04Å; S60-D62 PolarHBondContact OG-OD2 3.09Å; S60-K161 WeakPolarHBondContact O-CE 3.45Å; S60-K161 VanDerWaalsContact OG-CE 3.31Å; S60-K161 WeakPolarHBondContact OG-CE 3.4Å; S60-K161 PolarHBondContact OG-NZ 2.75Å
61	N	96.8	Very high	96.8	Very high	44 Å²	44	45.3 Å²	45.3	24%	0.235	25%	0.246	C	C	.	.			trans	-107.8	102.5	174.2	-175.7	-0.7	0	0	0	109.2	F63 G90 V110	N61-F63 PolarHBondContact OD1-N 2.88Å; N61-G90 PolarHBondContact ND2-O 2.93Å; N61-V110 HydrophobicContact CB-CG1 4.06Å; N61-V110 WeakPolarHBondContact OD1-CG1 3.3Å
62	D	96.4	Very high	96.8	Very high	76 Å²	76	49.6 Å²	49.6	41%	0.406	26%	0.262	S	S	.	.			trans	-106.2	10.9	-173.7	-42.6	-21.5	0	0	0	112	S60 A159 K161	S60-D62 VanDerWaalsContact CB-OD1 3.23Å; S60-D62 WeakPolarHBondContact CB-OD1 3.23Å; S60-D62 PolarHBondContact OG-OD1 3.04Å; S60-D62 PolarHBondContact OG-OD2 3.09Å; D62-A159 HydrophobicContact CB-CB 4.26Å; D62-K161 IonicContact OD2-NZ 2.78Å; D62-K161 PolarHBondContact OD2-NZ 3.07Å
63	F	98.1	Very high	96.7	Very high	8 Å²	8	49.3 Å²	49.3	4%	0.035	26%	0.261	C	S	.	.			trans	-76.5	168.8	176.3	-70.5	-97.8	0	0	0	111.5	N61 M67 L69 V85 M88 L93 V110 I115 A155 A159 F160	N61-F63 PolarHBondContact OD1-N 2.88Å; F63-M67 HydrophobicContact CB-SD 4.48Å; F63-M67 HydrophobicContact CD1-SD 4.48Å; F63-L69 HydrophobicContact CD1-CD2 4.25Å; F63-L69 HydrophobicContact CE1-CD2 3.68Å; F63-L69 HydrophobicContact CZ-CD2 4.47Å; F63-V85 HydrophobicContact CD1-CG2 4.14Å; F63-M88 VanDerWaalsContact C-SD 3.58Å; F63-M88 HydrophobicContact CB-SD 3.87Å; F63-M88 WeakPolarHBondContact O-CE 3.43Å; F63-L93 HydrophobicContact CB-CD2 3.79Å; F63-L93 HydrophobicContact CD1-CD1 3.88Å; F63-L93 HydrophobicContact CD2-CD1 3.81Å; F63-L93 HydrophobicContact CD2-CD2 3.92Å; F63-L93 HydrophobicContact CD2-CG 4.42Å; F63-L93 HydrophobicContact CE1-CD1 3.92Å; F63-L93 HydrophobicContact CE2-CD1 3.87Å; F63-L93 HydrophobicContact CG-CD1 3.82Å; F63-L93 HydrophobicContact CG-CD2 3.88Å; F63-L93 HydrophobicContact CZ-CD1 3.92Å; F63-V110 HydrophobicContact CD2-CB 4.41Å; F63-V110 HydrophobicContact CD2-CG1 3.67Å; F63-V110 HydrophobicContact CE2-CB 4Å; F63-V110 HydrophobicContact CE2-CG1 3.73Å; F63-I115 HydrophobicContact CZ-CD1 4.35Å; F63-A155 HydrophobicContact CD1-CB 3.86Å; F63-A155 HydrophobicContact CE1-CB 3.6Å; F63-A159 HydrophobicContact CD1-CB 4.34Å; F63-A159 HydrophobicContact CD2-CB 3.89Å; F63-A159 HydrophobicContact CE1-CB 4.18Å; F63-A159 HydrophobicContact CE2-CB 3.71Å; F63-A159 VanDerWaalsContact CE2-O 3.27Å; F63-A159 WeakPolarHBondContact CE2-O 3.36Å; F63-A159 HydrophobicContact CG-CB 4.2Å; F63-A159 HydrophobicContact CZ-CB 3.87Å; F63-F160 HydrophobicContact CE1-CE1 4.07Å; F63-F160 HydrophobicContact CE1-CE2 4.06Å; F63-F160 AromaticContact CE1-CZ 3.83Å; F63-F160 HydrophobicContact CE1-CZ 3.83Å; F63-F160 AromaticContact CZ-CD1 3.89Å; F63-F160 HydrophobicContact CZ-CD1 3.89Å; F63-F160 HydrophobicContact CZ-CD2 4.09Å; F63-F160 AromaticContact CZ-CE1 3.87Å; F63-F160 HydrophobicContact CZ-CE1 3.87Å; F63-F160 HydrophobicContact CZ-CE2 4.09Å; F63-F160 AromaticContact CZ-CG 4Å; F63-F160 HydrophobicContact CZ-CG 4Å; F63-F160 AromaticContact CZ-CZ 3.98Å; F63-F160 HydrophobicContact CZ-CZ 3.98Å
64	K	97.8	Very high	96.6	Very high	110 Å²	110	51.2 Å²	51.2	48%	0.478	28%	0.276	S	S	.	.			trans	-134.4	154.7	170.4	-54.2	-179.6	-151.7	146.1	0	110.3	M67 V85 E153	K64-M67 HydrophobicContact CB-CE 4.12Å; K64-M67 HydrophobicContact CB-CG 4.16Å; K64-M67 HydrophobicContact CB-SD 4.1Å; K64-M67 HydrophobicContact CD-CE 3.97Å; K64-M67 HydrophobicContact CG-CE 3.83Å; K64-M67 HydrophobicContact CG-SD 4.32Å; K64-M67 PolarHBondContact N-SD 3.46Å; K64-M67 WeakPolarHBondContact O-CB 3.39Å; K64-M67 PolarHBondContact O-N 2.83Å; K64-V85 WeakPolarHBondContact O-CB 3.48Å; K64-V85 WeakPolarHBondContact O-CG1 3.45Å; K64-E153 IonicContact NZ-OE1 2.84Å; K64-E153 PolarHBondContact NZ-OE1 3.47Å
65	A	97.4	Very high	96.3	Very high	63 Å²	63	54 Å²	54	52%	0.521	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	138.5	168.7	0	0	0	0	0	110.5	V85	A65-V85 CarbonylContact C-O 3.58Å; A65-V85 WeakPolarHBondContact CA-O 3.33Å
66	G	97.4	Very high	96.2	Very high	41 Å²	41	54.5 Å²	54.5	42%	0.423	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	-21.4	-174.2	0	0	0	0	0	114.7	V85	G66-V85 PolarHBondContact N-O 3.23Å
67	M	98.6	Very high	96.2	Very high	7 Å²	7	48 Å²	48	3%	0.034	27%	0.272	C	S	.	.			trans	-62.2	140.9	176.5	-74.8	-177.1	166.4	0	0	112.2	F63 K64 T84 V85 E153 A155	F63-M67 HydrophobicContact CB-SD 4.48Å; F63-M67 HydrophobicContact CD1-SD 4.48Å; K64-M67 HydrophobicContact CB-CE 4.12Å; K64-M67 HydrophobicContact CB-CG 4.16Å; K64-M67 HydrophobicContact CB-SD 4.1Å; K64-M67 HydrophobicContact CD-CE 3.97Å; K64-M67 HydrophobicContact CG-CE 3.83Å; K64-M67 HydrophobicContact CG-SD 4.32Å; K64-M67 PolarHBondContact N-SD 3.46Å; K64-M67 WeakPolarHBondContact O-CB 3.39Å; K64-M67 PolarHBondContact O-N 2.83Å; M67-T84 WeakPolarHBondContact O-CA 3.37Å; M67-V85 HydrophobicContact CB-CG2 4.32Å; M67-V85 PolarHBondContact O-N 2.85Å; M67-E153 CarbonylContact C-O 3.6Å; M67-E153 WeakPolarHBondContact CA-O 3.37Å; M67-E153 HydrophobicContact CE-CG 4.36Å; M67-E153 VanDerWaalsContact CE-OE1 3.23Å; M67-E153 WeakPolarHBondContact CE-OE1 3.43Å; M67-E153 HydrophobicContact CG-CG 4.04Å; M67-A155 HydrophobicContact CB-CB 4.2Å; M67-A155 HydrophobicContact SD-CB 4.24Å
68	K	98.6	Very high	96	Very high	29 Å²	29	48.1 Å²	48.1	13%	0.126	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	144.5	174.2	-60	-167.2	-174.1	-68.7	0	112.6	I82 A83 T84 D98 I118 T148 L149 A152 E153 A155	K68-I82 HydrophobicContact CB-CG2 4.43Å; K68-I82 HydrophobicContact CD-CG2 4.15Å; K68-A83 CarbonylContact C-O 3.59Å; K68-A83 WeakPolarHBondContact CA-O 3.42Å; K68-T84 PolarHBondContact NZ-OG1 2.84Å; K68-D98 IonicContact NZ-OD1 2.83Å; K68-D98 PolarHBondContact NZ-OD1 3.44Å; K68-D98 IonicContact NZ-OD2 3.25Å; K68-I118 HydrophobicContact CB-CD1 3.67Å; K68-T148 HydrophobicContact CD-CG2 4.06Å; K68-T148 WeakPolarHBondContact CE-O 3.43Å; K68-L149 HydrophobicContact CD-CD2 4.48Å; K68-A152 HydrophobicContact CD-CB 3.73Å; K68-A152 HydrophobicContact CG-CB 4.3Å; K68-E153 PolarHBondContact N-O 2.92Å; K68-A155 WeakPolarHBondContact O-CB 3.4Å; K68-A155 PolarHBondContact O-N 3.18Å
69	L	98.8	Very high	96	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	169.5	178.5	56.8	79.8	0	0	0	111.2	F63 A71 A83 V85 L93 L95 I115 A155 F160	F63-L69 HydrophobicContact CD1-CD2 4.25Å; F63-L69 HydrophobicContact CE1-CD2 3.68Å; F63-L69 HydrophobicContact CZ-CD2 4.47Å; L69-A71 HydrophobicContact CD1-CB 3.8Å; L69-A83 HydrophobicContact CD1-CB 3.98Å; L69-A83 PolarHBondContact N-O 3.12Å; L69-A83 PolarHBondContact O-N 2.84Å; L69-V85 HydrophobicContact CD2-CG2 3.95Å; L69-L93 HydrophobicContact CD2-CD1 4.14Å; L69-L95 HydrophobicContact CD1-CD1 4.28Å; L69-L95 HydrophobicContact CD1-CD2 4.35Å; L69-L95 HydrophobicContact CD2-CD2 4.01Å; L69-L95 HydrophobicContact CG-CD2 4.47Å; L69-I115 HydrophobicContact CD1-CB 4.24Å; L69-I115 HydrophobicContact CD1-CG2 4.12Å; L69-A155 HydrophobicContact CB-CB 4.31Å; L69-F160 HydrophobicContact CB-CE1 4.05Å; L69-F160 HydrophobicContact CB-CZ 3.68Å; L69-F160 HydrophobicContact CD2-CE1 4.25Å; L69-F160 HydrophobicContact CD2-CZ 4.35Å
70	E	98.5	Very high	96.2	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.009	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	134.7	168.3	-71.6	175.1	-172.5	0	0	109.6	V80 C81 I82 I115 Q116 I118 G119 T120 C121 L128	E70-V80 HydrophobicContact CB-CG1 3.91Å; E70-V80 HydrophobicContact CG-CG1 4.45Å; E70-C81 WeakPolarHBondContact CA-O 3.45Å; E70-I82 HydrophobicContact CG-CD1 4.14Å; E70-I115 CarbonylContact O-C 3.55Å; E70-I115 WeakPolarHBondContact O-CA 3.39Å; E70-Q116 HydrophobicContact CB-CB 4.21Å; E70-Q116 PolarHBondContact N-O 3.48Å; E70-Q116 PolarHBondContact O-N 3.22Å; E70-I118 HydrophobicContact CG-CG1 4.03Å; E70-I118 WeakPolarHBondContact OE1-CA 3.3Å; E70-G119 PolarHBondContact OE1-N 2.96Å; E70-T120 PolarHBondContact OE1-N 3.44Å; E70-T120 PolarHBondContact OE2-N 3.16Å; E70-C121 WeakPolarHBondContact OE2-CB 3.13Å; E70-C121 PolarHBondContact OE2-N 2.8Å; E70-L128 HydrophobicContact CG-CD2 3.81Å
71	A	98.4	Very high	96.3	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	147.3	177.2	0	0	0	0	0	112.5	L69 C81 A83 F106 D114 I115	L69-A71 HydrophobicContact CD1-CB 3.8Å; A71-C81 PolarHBondContact N-O 2.91Å; A71-C81 PolarHBondContact O-N 3.02Å; A71-A83 HydrophobicContact CB-CB 3.93Å; A71-F106 HydrophobicContact CB-CE2 4.41Å; A71-F106 HydrophobicContact CB-CZ 3.98Å; A71-D114 VanDerWaalsContact CA-O 3.29Å; A71-D114 WeakPolarHBondContact CA-O 3.34Å; A71-I115 HydrophobicContact CB-CG2 4.15Å
72	R	97.3	Very high	96.4	Very high	93 Å²	93	42.4 Å²	42.4	35%	0.351	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	135.6	169	-67.1	-179.1	178.5	136.5	-4.7	111	P74 S77 S79 V80 D114	R72-P74 WeakPolarHBondContact O-CD 3.22Å; R72-S77 WeakPolarHBondContact CD-O 3.16Å; R72-S79 WeakPolarHBondContact CA-O 3.37Å; R72-V80 HydrophobicContact CG-CG2 4.39Å; R72-D114 WeakPolarHBondContact CD-OD1 3.35Å; R72-D114 IonicContact CZ-OD1 3.51Å; R72-D114 PolarHBondContact N-O 3.06Å; R72-D114 VanDerWaalsContact N-O 3.12Å; R72-D114 IonicContact NE-OD1 3.32Å; R72-D114 IonicContact NH1-OD1 2.82Å; R72-D114 PolarHBondContact NH1-OD1 3.25Å
73	D	96.6	Very high	96.5	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	120.8	172	-170.6	-32	0	0	0	109.4	R75 N76 S77 S79 L97 L132	D73-R75 PolarHBondContact O-N 3.02Å; D73-R75 VanDerWaalsContact OD1-CB 3.24Å; D73-R75 WeakPolarHBondContact OD1-CB 3.2Å; D73-R75 WeakPolarHBondContact OD1-CG 3.48Å; D73-R75 IonicContact OD1-CZ 3.95Å; D73-R75 PolarHBondContact OD1-N 3.49Å; D73-R75 IonicContact OD1-NE 3.87Å; D73-R75 PolarHBondContact OD1-NE 3.08Å; D73-R75 IonicContact OD1-NH2 3.71Å; D73-R75 IonicContact OD2-CZ 2.72Å; D73-R75 IonicContact OD2-NE 3.25Å; D73-R75 PolarHBondContact OD2-NE 3.29Å; D73-R75 IonicContact OD2-NH2 2.69Å; D73-R75 PolarHBondContact OD2-NH2 3.44Å; D73-N76 CarbonylContact O-C 3.56Å; D73-N76 PolarHBondContact O-N 3.49Å; D73-S77 PolarHBondContact O-N 2.82Å; D73-S79 PolarHBondContact N-O 2.74Å; D73-L97 HydrophobicContact CB-CD1 3.57Å; D73-L97 WeakPolarHBondContact OD2-CD1 3.41Å; D73-L132 PolarHBondContact OD2-N 2.89Å
74	P	94.1	Very high	96.5	Very high	67 Å²	67	39.2 Å²	39.2	44%	0.435	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-16.8	178.1	-23.1	33.8	0	0	0	114.4	R72 F106	R72-P74 WeakPolarHBondContact O-CD 3.22Å; P74-F106 HydrophobicContact CG-CB 3.75Å; P74-F106 HydrophobicContact CG-CD1 3.91Å; P74-F106 HydrophobicContact CG-CD2 3.49Å; P74-F106 VanDerWaalsContact CG-CD2 3.49Å; P74-F106 HydrophobicContact CG-CE1 4.38Å; P74-F106 HydrophobicContact CG-CE2 3.98Å; P74-F106 HydrophobicContact CG-CG 3.44Å; P74-F106 VanDerWaalsContact CG-CG 3.44Å; P74-F106 HydrophobicContact CG-CZ 4.4Å
75	R	93	Very high	96.5	Very high	75 Å²	75	34 Å²	34	28%	0.283	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-13.7	177	-50.2	165.5	-66.2	-166.6	3.2	112.5	D73 S100 D101 L132	D73-R75 PolarHBondContact O-N 3.02Å; D73-R75 VanDerWaalsContact OD1-CB 3.24Å; D73-R75 WeakPolarHBondContact OD1-CB 3.2Å; D73-R75 WeakPolarHBondContact OD1-CG 3.48Å; D73-R75 IonicContact OD1-CZ 3.95Å; D73-R75 PolarHBondContact OD1-N 3.49Å; D73-R75 IonicContact OD1-NE 3.87Å; D73-R75 PolarHBondContact OD1-NE 3.08Å; D73-R75 IonicContact OD1-NH2 3.71Å; D73-R75 IonicContact OD2-CZ 2.72Å; D73-R75 IonicContact OD2-NE 3.25Å; D73-R75 PolarHBondContact OD2-NE 3.29Å; D73-R75 IonicContact OD2-NH2 2.69Å; D73-R75 PolarHBondContact OD2-NH2 3.44Å; R75-S100 PolarHBondContact NH1-OG 3.32Å; R75-S100 PolarHBondContact NH2-OG 2.95Å; R75-S100 VanDerWaalsContact NH2-OG 3.14Å; R75-D101 IonicContact NH1-OD2 2.65Å; R75-D101 PolarHBondContact NH1-OD2 3.06Å; R75-L132 HydrophobicContact CB-CB 4.28Å; R75-L132 HydrophobicContact CB-CD2 3.65Å
76	N	92.8	Very high	96.5	Very high	57 Å²	57	34.7 Å²	34.7	31%	0.305	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	90.7	173.6	-177.8	5.7	0	0	0	109.7	D73 N78 S79	D73-N76 CarbonylContact O-C 3.56Å; D73-N76 PolarHBondContact O-N 3.49Å; N76-N78 PolarHBondContact O-N 3.27Å; N76-N78 PolarHBondContact OD1-N 2.94Å; N76-S79 PolarHBondContact ND2-OG 2.8Å; N76-S79 PolarHBondContact O-N 3.41Å
77	S	90.5	Very high	96.5	Very high	77 Å²	77	33.6 Å²	33.6	54%	0.538	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	-19.4	-175.1	53	0	0	0	0	114.9	R72 D73	R72-S77 WeakPolarHBondContact CD-O 3.16Å; D73-S77 PolarHBondContact O-N 2.82Å
78	N	90.9	Very high	96.3	Very high	140 Å²	140	37.2 Å²	37.2	75%	0.749	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	-9.6	-178.2	-58.6	2.7	0	0	0	112.3	N76	N76-N78 PolarHBondContact O-N 3.27Å; N76-N78 PolarHBondContact OD1-N 2.94Å
79	S	94.7	Very high	96.1	Very high	12 Å²	12	38.5 Å²	38.5	8%	0.084	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	107.3	179.3	-72.5	0	0	0	0	111.3	R72 D73 N76	R72-S79 WeakPolarHBondContact CA-O 3.37Å; D73-S79 PolarHBondContact N-O 2.74Å; N76-S79 PolarHBondContact ND2-OG 2.8Å; N76-S79 PolarHBondContact O-N 3.41Å
80	V	97.6	Very high	95.8	Very high	31 Å²	31	39.7 Å²	39.7	19%	0.188	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.2	164.5	-174.9	0	0	0	0	108.8	E70 R72 C121 L128 Q129	E70-V80 HydrophobicContact CB-CG1 3.91Å; E70-V80 HydrophobicContact CG-CG1 4.45Å; R72-V80 HydrophobicContact CG-CG2 4.39Å; V80-C121 HydrophobicContact CG1-CB 4.27Å; V80-L128 HydrophobicContact CB-CD2 4.47Å; V80-L128 HydrophobicContact CG1-CD2 3.91Å; V80-L128 WeakPolarHBondContact O-CA 3.41Å; V80-Q129 PolarHBondContact O-N 2.91Å
81	C	97.9	Very high	95.7	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	161.2	-173.3	-57.7	0	0	0	0	110.2	E70 A71 L97 Q129	E70-C81 WeakPolarHBondContact CA-O 3.45Å; A71-C81 PolarHBondContact N-O 2.91Å; A71-C81 PolarHBondContact O-N 3.02Å; C81-L97 HydrophobicContact CB-CD2 4.09Å; C81-Q129 PolarHBondContact SG-O 2.88Å
82	I	98.3	Very high	95.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	135.2	164.3	-62.4	-58.3	0	0	0	109.4	K68 E70 D98 I118 L128 L145 T148 L149	K68-I82 HydrophobicContact CB-CG2 4.43Å; K68-I82 HydrophobicContact CD-CG2 4.15Å; E70-I82 HydrophobicContact CG-CD1 4.14Å; I82-D98 HydrophobicContact CB-CB 4.39Å; I82-D98 HydrophobicContact CG2-CB 4.11Å; I82-D98 PolarHBondContact O-N 2.89Å; I82-I118 HydrophobicContact CD1-CD1 4.05Å; I82-I118 HydrophobicContact CD1-CG1 3.92Å; I82-L128 HydrophobicContact CD1-CD1 3.69Å; I82-L128 HydrophobicContact CD1-CD2 4.44Å; I82-L128 HydrophobicContact CG1-CD1 4.08Å; I82-L145 HydrophobicContact CB-CD2 4.44Å; I82-L145 HydrophobicContact CG1-CD2 3.53Å; I82-T148 HydrophobicContact CG2-CG2 4.18Å; I82-L149 HydrophobicContact CD1-CD1 4.45Å; I82-L149 HydrophobicContact CD1-CD2 4.01Å; I82-L149 HydrophobicContact CG1-CD2 4.21Å; I82-L149 HydrophobicContact CG2-CD2 4.29Å
83	A	98.6	Very high	95.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	147.4	175.1	0	0	0	0	0	111.7	K68 L69 A71 R96 L97	K68-A83 CarbonylContact C-O 3.59Å; K68-A83 WeakPolarHBondContact CA-O 3.42Å; L69-A83 HydrophobicContact CD1-CB 3.98Å; L69-A83 PolarHBondContact N-O 3.12Å; L69-A83 PolarHBondContact O-N 2.84Å; A71-A83 HydrophobicContact CB-CB 3.93Å; A83-R96 CarbonylContact C-O 3.29Å; A83-R96 WeakPolarHBondContact CA-O 3.45Å; A83-R96 WeakPolarHBondContact CB-O 3.24Å; A83-L97 HydrophobicContact CB-CD2 3.85Å
84	T	98.7	Very high	95.7	Very high	17 Å²	17	40.4 Å²	40.4	10%	0.104	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137.1	174.7	-61.6	0	0	0	0	110.5	M67 K68 M86 L95 R96 D98	M67-T84 WeakPolarHBondContact O-CA 3.37Å; K68-T84 PolarHBondContact NZ-OG1 2.84Å; T84-M86 HydrophobicContact CG2-SD 4.12Å; T84-M86 PolarHBondContact O-N 2.84Å; T84-L95 WeakPolarHBondContact O-CA 3.47Å; T84-R96 PolarHBondContact N-O 2.86Å; T84-R96 PolarHBondContact O-N 3.29Å; T84-D98 PolarHBondContact N-OD2 3.16Å; T84-D98 VanDerWaalsContact N-OD2 3.16Å; T84-D98 PolarHBondContact OG1-OD1 2.69Å; T84-D98 PolarHBondContact OG1-OD2 2.62Å
85	V	98.6	Very high	95.9	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	107	170.3	-178.7	0	0	0	0	108.9	F63 K64 A65 G66 M67 L69 M88 L93 L95	F63-V85 HydrophobicContact CD1-CG2 4.14Å; K64-V85 WeakPolarHBondContact O-CB 3.48Å; K64-V85 WeakPolarHBondContact O-CG1 3.45Å; A65-V85 CarbonylContact C-O 3.58Å; A65-V85 WeakPolarHBondContact CA-O 3.33Å; G66-V85 PolarHBondContact N-O 3.23Å; M67-V85 HydrophobicContact CB-CG2 4.32Å; M67-V85 PolarHBondContact O-N 2.85Å; L69-V85 HydrophobicContact CD2-CG2 3.95Å; V85-M88 HydrophobicContact CG1-CG 4.03Å; V85-L93 HydrophobicContact CG1-CD2 4.47Å; V85-L93 HydrophobicContact CG2-CD1 4.41Å; V85-L95 HydrophobicContact CB-CD2 4.48Å; V85-L95 HydrophobicContact CG2-CD2 3.89Å
86	M	97.6	Very high	96.2	Very high	77 Å²	77	36.6 Å²	36.6	38%	0.379	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-16.8	179.5	-60.6	-53.7	-47.9	0	0	113.2	T84 R94 R96	T84-M86 HydrophobicContact CG2-SD 4.12Å; T84-M86 PolarHBondContact O-N 2.84Å; M86-R94 HydrophobicContact CB-CG 4.26Å; M86-R94 PolarHBondContact N-O 3.15Å; M86-R96 HydrophobicContact CG-CB 3.49Å; M86-R96 VanDerWaalsContact CG-CB 3.49Å; M86-R96 HydrophobicContact SD-CB 3.89Å
87	G	96.1	Very high	96.4	Very high	19 Å²	19	34.1 Å²	34.1	20%	0.196	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.8	174.6	-177.2	0	0	0	0	0	111.5	R94	G87-R94 PolarHBondContact N-O 3.02Å; G87-R94 PolarHBondContact O-N 3.06Å
88	M	95	Very high	96.8	Very high	83 Å²	83	31.6 Å²	31.6	41%	0.409	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	146.5	-174.4	-56.2	-178.9	-67.2	0	0	109.9	F63 V85 R92 L93	F63-M88 VanDerWaalsContact C-SD 3.58Å; F63-M88 HydrophobicContact CB-SD 3.87Å; F63-M88 WeakPolarHBondContact O-CE 3.43Å; V85-M88 HydrophobicContact CG1-CG 4.03Å; M88-R92 CarbonylContact C-O 3.56Å; M88-R92 WeakPolarHBondContact CA-O 3.42Å; M88-L93 HydrophobicContact CG-CD2 3.85Å; M88-L93 HydrophobicContact SD-CD2 4.13Å
89	M	93.5	Very high	96.9	Very high	56 Å²	56	25.9 Å²	25.9	28%	0.276	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	113.1	171.2	-164.6	-179.3	-57.4	0	0	109.2	T91 R92 W107 H235	M89-T91 PolarHBondContact O-N 3.1Å; M89-R92 PolarHBondContact N-O 2.85Å; M89-R92 PolarHBondContact O-N 2.81Å; M89-W107 HydrophobicContact CB-CH2 3.95Å; M89-W107 HydrophobicContact CB-CZ3 3.77Å; M89-W107 HydrophobicContact CE-CH2 4.3Å; M89-H235 HydrophobicContact CG-CB 4.48Å; M89-H235 PolarHBondContact O-CD2 3.34Å; M89-H235 PolarHBondContact SD-CE1 2.84Å
90	G	92.9	Very high	97	Very high	24 Å²	24	26 Å²	26	25%	0.247	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	-122.9	-168.5	0	0	0	0	0	112.1	N61 R92 T233	N61-G90 PolarHBondContact ND2-O 2.93Å; G90-R92 VanDerWaalsContact C-N 3.34Å; G90-T233 WeakPolarHBondContact CA-O 3.35Å
91	T	96	Very high	96.7	Very high	8 Å²	8	26 Å²	26	5%	0.049	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	5.7	179.1	56.7	0	0	0	0	114.5	P58 P59 M89 L109 V110 T233	P58-T91 HydrophobicContact CB-CG2 4.05Å; P59-T91 HydrophobicContact CG-CG2 4.12Å; P59-T91 WeakPolarHBondContact O-CG2 3.3Å; M89-T91 PolarHBondContact O-N 3.1Å; T91-L109 WeakPolarHBondContact O-CA 3.34Å; T91-L109 WeakPolarHBondContact OG1-CD2 3.37Å; T91-V110 PolarHBondContact O-N 3.18Å; T91-T233 HydrophobicContact CG2-CG2 3.74Å
92	R	97.3	Very high	96.3	Very high	5 Å²	5	30.6 Å²	30.6	2%	0.019	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	135.6	-179	-61	172.3	79	-131.8	4.5	111.3	M88 M89 G90 W107 R108 L109 P186 H235	M88-R92 CarbonylContact C-O 3.56Å; M88-R92 WeakPolarHBondContact CA-O 3.42Å; M89-R92 PolarHBondContact N-O 2.85Å; M89-R92 PolarHBondContact O-N 2.81Å; G90-R92 VanDerWaalsContact C-N 3.34Å; R92-W107 HydrophobicContact CB-CE3 3.86Å; R92-W107 HydrophobicContact CB-CZ3 4.34Å; R92-R108 CarbonylContact C-O 3.59Å; R92-R108 WeakPolarHBondContact CA-O 3.22Å; R92-L109 HydrophobicContact CG-CD2 3.48Å; R92-L109 VanDerWaalsContact CG-CD2 3.48Å; R92-L109 HydrophobicContact CG-CG 4.15Å; R92-P186 PolarHBondContact NH1-O 3.18Å; R92-P186 PolarHBondContact NH2-O 2.98Å; R92-H235 PolarHBondContact NH1-NE2 2.67Å; R92-H235 VanDerWaalsContact NH1-NE2 3.17Å
93	L	98.3	Very high	95.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	136.6	173.2	-52.2	-179.7	0	0	0	109.5	F63 L69 V85 M88 L95 W107 R108 V110 I115	F63-L93 HydrophobicContact CB-CD2 3.79Å; F63-L93 HydrophobicContact CD1-CD1 3.88Å; F63-L93 HydrophobicContact CD2-CD1 3.81Å; F63-L93 HydrophobicContact CD2-CD2 3.92Å; F63-L93 HydrophobicContact CD2-CG 4.42Å; F63-L93 HydrophobicContact CE1-CD1 3.92Å; F63-L93 HydrophobicContact CE2-CD1 3.87Å; F63-L93 HydrophobicContact CG-CD1 3.82Å; F63-L93 HydrophobicContact CG-CD2 3.88Å; F63-L93 HydrophobicContact CZ-CD1 3.92Å; L69-L93 HydrophobicContact CD2-CD1 4.14Å; V85-L93 HydrophobicContact CG1-CD2 4.47Å; V85-L93 HydrophobicContact CG2-CD1 4.41Å; M88-L93 HydrophobicContact CG-CD2 3.85Å; M88-L93 HydrophobicContact SD-CD2 4.13Å; L93-L95 HydrophobicContact CB-CD2 3.88Å; L93-L95 HydrophobicContact CB-CG 4.17Å; L93-L95 HydrophobicContact CD1-CD2 4.36Å; L93-W107 VanDerWaalsContact O-CA 3.26Å; L93-W107 WeakPolarHBondContact O-CA 3.14Å; L93-R108 PolarHBondContact N-O 2.94Å; L93-R108 PolarHBondContact O-N 3.47Å; L93-R108 VanDerWaalsContact O-N 3.08Å; L93-V110 HydrophobicContact CD1-CG1 4.26Å; L93-V110 HydrophobicContact CD2-CG1 3.88Å; L93-V110 HydrophobicContact CG-CG1 3.95Å; L93-I115 HydrophobicContact CD1-CD1 3.92Å
94	R	97.9	Very high	95.6	Very high	99 Å²	99	39.7 Å²	39.7	37%	0.374	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.5	165	-178	-177.3	173.1	155.5	1.1	108.2	M86 G87 D105 W107	M86-R94 HydrophobicContact CB-CG 4.26Å; M86-R94 PolarHBondContact N-O 3.15Å; G87-R94 PolarHBondContact N-O 3.02Å; G87-R94 PolarHBondContact O-N 3.06Å; R94-D105 HydrophobicContact CG-CB 4.33Å; R94-D105 IonicContact CZ-OD2 2.79Å; R94-D105 IonicContact NE-OD2 3.31Å; R94-D105 PolarHBondContact NE-OD2 3.28Å; R94-D105 IonicContact NH2-OD2 3.2Å; R94-D105 PolarHBondContact NH2-OD2 2.92Å; R94-W107 HydrophobicContact CB-CD2 4.01Å; R94-W107 HydrophobicContact CB-CE3 4Å; R94-W107 HydrophobicContact CB-CH2 3.86Å; R94-W107 HydrophobicContact CB-CZ2 3.82Å; R94-W107 HydrophobicContact CB-CZ3 3.94Å; R94-W107 HydrophobicContact CG-CZ2 4.09Å
95	L	98.4	Very high	95.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	145.8	-172.4	-57.6	177.2	0	0	0	110.9	L69 T84 V85 L93 D105 F106 R108 I115	L69-L95 HydrophobicContact CD1-CD1 4.28Å; L69-L95 HydrophobicContact CD1-CD2 4.35Å; L69-L95 HydrophobicContact CD2-CD2 4.01Å; L69-L95 HydrophobicContact CG-CD2 4.47Å; T84-L95 WeakPolarHBondContact O-CA 3.47Å; V85-L95 HydrophobicContact CB-CD2 4.48Å; V85-L95 HydrophobicContact CG2-CD2 3.89Å; L93-L95 HydrophobicContact CB-CD2 3.88Å; L93-L95 HydrophobicContact CB-CG 4.17Å; L93-L95 HydrophobicContact CD1-CD2 4.36Å; L95-D105 WeakPolarHBondContact O-CA 3.49Å; L95-F106 HydrophobicContact CB-CD1 4.12Å; L95-F106 HydrophobicContact CB-CD2 4.36Å; L95-F106 HydrophobicContact CB-CE1 3.68Å; L95-F106 HydrophobicContact CB-CE2 3.98Å; L95-F106 HydrophobicContact CB-CG 4.44Å; L95-F106 HydrophobicContact CB-CZ 3.61Å; L95-F106 HydrophobicContact CD1-CD2 4.46Å; L95-F106 HydrophobicContact CD1-CE2 3.73Å; L95-F106 HydrophobicContact CD1-CZ 3.93Å; L95-F106 HydrophobicContact CG-CE2 4.45Å; L95-F106 HydrophobicContact CG-CZ 4.42Å; L95-F106 PolarHBondContact N-O 3.31Å; L95-F106 WeakPolarHBondContact O-CD1 3.32Å; L95-F106 PolarHBondContact O-N 3.01Å; L95-R108 HydrophobicContact CD1-CB 4.06Å; L95-R108 HydrophobicContact CD1-CG 4.17Å; L95-I115 HydrophobicContact CD1-CG2 3.68Å
96	R	98.3	Very high	95.4	Very high	63 Å²	63	40.8 Å²	40.8	24%	0.238	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	134.7	169.3	178.8	175	-60.9	153.7	9.2	109.3	A83 T84 M86 D101 D105	A83-R96 CarbonylContact C-O 3.29Å; A83-R96 WeakPolarHBondContact CA-O 3.45Å; A83-R96 WeakPolarHBondContact CB-O 3.24Å; T84-R96 PolarHBondContact N-O 2.86Å; T84-R96 PolarHBondContact O-N 3.29Å; M86-R96 HydrophobicContact CG-CB 3.49Å; M86-R96 VanDerWaalsContact CG-CB 3.49Å; M86-R96 HydrophobicContact SD-CB 3.89Å; R96-D101 WeakPolarHBondContact CD-O 3.41Å; R96-D105 IonicContact CZ-OD1 3.94Å; R96-D105 VanDerWaalsContact CZ-OD1 3.25Å; R96-D105 IonicContact CZ-OD2 3.01Å; R96-D105 IonicContact NE-OD1 3.25Å; R96-D105 PolarHBondContact NE-OD1 2.83Å; R96-D105 IonicContact NE-OD2 2.83Å; R96-D105 VanDerWaalsContact NH2-CG 3.27Å; R96-D105 IonicContact NH2-OD1 2.87Å; R96-D105 PolarHBondContact NH2-OD1 3.11Å; R96-D105 IonicContact NH2-OD2 2.73Å; R96-D105 PolarHBondContact NH2-OD2 3.42Å
97	L	98.2	Very high	95.4	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	127.9	176.2	-53.5	-180	0	0	0	110.3	D73 C81 A83 G99 S100 F106 P131	D73-L97 HydrophobicContact CB-CD1 3.57Å; D73-L97 WeakPolarHBondContact OD2-CD1 3.41Å; C81-L97 HydrophobicContact CB-CD2 4.09Å; A83-L97 HydrophobicContact CB-CD2 3.85Å; L97-G99 PolarHBondContact O-N 3.28Å; L97-S100 VanDerWaalsContact O-CB 3.27Å; L97-S100 WeakPolarHBondContact O-CB 3.38Å; L97-S100 PolarHBondContact O-N 2.83Å; L97-S100 VanDerWaalsContact O-N 3.09Å; L97-F106 HydrophobicContact CD2-CE1 3.5Å; L97-F106 VanDerWaalsContact CD2-CE1 3.5Å; L97-F106 HydrophobicContact CD2-CZ 3.69Å; L97-F106 HydrophobicContact CG-CE1 3.8Å; L97-F106 HydrophobicContact CG-CZ 4.46Å; L97-P131 HydrophobicContact CB-CB 3.74Å; L97-P131 HydrophobicContact CB-CG 4.15Å; L97-P131 HydrophobicContact CD1-CB 3.65Å; L97-P131 HydrophobicContact CG-CB 4.34Å
98	D	97.6	Very high	95.5	Very high	24 Å²	24	39.8 Å²	39.8	13%	0.128	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	126.8	-175.9	-84.3	-107.3	0	0	0	111.1	K68 I82 T84 S100 F144 T148	K68-D98 IonicContact NZ-OD1 2.83Å; K68-D98 PolarHBondContact NZ-OD1 3.44Å; K68-D98 IonicContact NZ-OD2 3.25Å; I82-D98 HydrophobicContact CB-CB 4.39Å; I82-D98 HydrophobicContact CG2-CB 4.11Å; I82-D98 PolarHBondContact O-N 2.89Å; T84-D98 PolarHBondContact N-OD2 3.16Å; T84-D98 VanDerWaalsContact N-OD2 3.16Å; T84-D98 PolarHBondContact OG1-OD1 2.69Å; T84-D98 PolarHBondContact OG1-OD2 2.62Å; D98-S100 VanDerWaalsContact C-N 3.34Å; D98-F144 HydrophobicContact CB-CE1 4.06Å; D98-F144 HydrophobicContact CB-CZ 4.19Å; D98-F144 WeakPolarHBondContact O-CE1 3.39Å; D98-T148 HydrophobicContact CB-CG2 3.89Å; D98-T148 VanDerWaalsContact OD1-CG2 3.31Å; D98-T148 WeakPolarHBondContact OD1-CG2 3.41Å
99	G	94.7	Very high	95.6	Very high	21 Å²	21	36.1 Å²	36.1	22%	0.216	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	-1.9	-175.9	0	0	0	0	0	114.8	L97 R135 F144	L97-G99 PolarHBondContact O-N 3.28Å; G99-R135 WeakPolarHBondContact O-CB 3.35Å; G99-R135 WeakPolarHBondContact O-CG 3.37Å; G99-R135 PolarHBondContact O-N 3.48Å; G99-F144 VanDerWaalsContact CA-CZ 3.44Å
100	S	94.8	Very high	95.8	Very high	15 Å²	15	33.5 Å²	33.5	11%	0.105	18%	0.177	C	C	.	.	S	Bend	trans	-81	-178.1	167.1	-150.8	0	0	0	0	111.4	R75 L97 D98 R135	R75-S100 PolarHBondContact NH1-OG 3.32Å; R75-S100 PolarHBondContact NH2-OG 2.95Å; R75-S100 VanDerWaalsContact NH2-OG 3.14Å; L97-S100 VanDerWaalsContact O-CB 3.27Å; L97-S100 WeakPolarHBondContact O-CB 3.38Å; L97-S100 PolarHBondContact O-N 2.83Å; L97-S100 VanDerWaalsContact O-N 3.09Å; D98-S100 VanDerWaalsContact C-N 3.34Å; S100-R135 WeakPolarHBondContact O-CD 3.49Å
101	D	91.8	Very high	96.1	Very high	31 Å²	31	32.6 Å²	32.6	17%	0.166	17%	0.166	C	C	.	.			trans	-66.6	-175.3	162.5	62.7	92.3	0	0	0	114.2	R75 R96 T103 N104	R75-D101 IonicContact NH1-OD2 2.65Å; R75-D101 PolarHBondContact NH1-OD2 3.06Å; R96-D101 WeakPolarHBondContact CD-O 3.41Å; D101-T103 PolarHBondContact OD1-N 2.83Å; D101-T103 PolarHBondContact OD1-OG1 3.48Å; D101-N104 WeakPolarHBondContact OD1-CB 3.28Å; D101-N104 PolarHBondContact OD1-N 2.64Å; D101-N104 PolarHBondContact OD1-ND2 3.26Å; D101-N104 PolarHBondContact OD2-ND2 3.02Å
102	N	90.6	Very high	96.1	Very high	95 Å²	95	32.7 Å²	32.7	51%	0.508	17%	0.167	S	C	.	.	S	Bend	trans	-113.8	11	177.3	66.6	-23.5	0	0	0	114.2
103	T	89.6	Confident	96.1	Very high	116 Å²	116	35 Å²	35	71%	0.712	18%	0.184	S	C	*	.	S	Bend	trans	-101.1	-22.8	179.3	61.1	0	0	0	0	112.3	D101 D105	D101-T103 PolarHBondContact OD1-N 2.83Å; D101-T103 PolarHBondContact OD1-OG1 3.48Å; T103-D105 VanDerWaalsContact C-N 3.34Å; T103-D105 PolarHBondContact O-N 2.93Å
104	N	91.9	Very high	96	Very high	75 Å²	75	36.5 Å²	36.5	40%	0.401	19%	0.192	S	C	.	.			trans	-95.1	38.8	176.7	-64.5	-92.8	0	0	0	112.8	D101	D101-N104 WeakPolarHBondContact OD1-CB 3.28Å; D101-N104 PolarHBondContact OD1-N 2.64Å; D101-N104 PolarHBondContact OD1-ND2 3.26Å; D101-N104 PolarHBondContact OD2-ND2 3.02Å
105	D	95.7	Very high	96	Very high	26 Å²	26	32.2 Å²	32.2	14%	0.139	18%	0.177	C	C	.	.			trans	-67	135.8	169.2	-72.8	4.2	0	0	0	109.8	R94 L95 R96 T103	R94-D105 HydrophobicContact CG-CB 4.33Å; R94-D105 IonicContact CZ-OD2 2.79Å; R94-D105 IonicContact NE-OD2 3.31Å; R94-D105 PolarHBondContact NE-OD2 3.28Å; R94-D105 IonicContact NH2-OD2 3.2Å; R94-D105 PolarHBondContact NH2-OD2 2.92Å; L95-D105 WeakPolarHBondContact O-CA 3.49Å; R96-D105 IonicContact CZ-OD1 3.94Å; R96-D105 VanDerWaalsContact CZ-OD1 3.25Å; R96-D105 IonicContact CZ-OD2 3.01Å; R96-D105 IonicContact NE-OD1 3.25Å; R96-D105 PolarHBondContact NE-OD1 2.83Å; R96-D105 IonicContact NE-OD2 2.83Å; R96-D105 VanDerWaalsContact NH2-CG 3.27Å; R96-D105 IonicContact NH2-OD1 2.87Å; R96-D105 PolarHBondContact NH2-OD1 3.11Å; R96-D105 IonicContact NH2-OD2 2.73Å; R96-D105 PolarHBondContact NH2-OD2 3.42Å; T103-D105 VanDerWaalsContact C-N 3.34Å; T103-D105 PolarHBondContact O-N 2.93Å
106	F	96.6	Very high	96	Very high	15 Å²	15	34.7 Å²	34.7	7%	0.066	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	165.2	-176.7	66.5	-76.3	0	0	0	111.6	A71 P74 L95 L97 R108	A71-F106 HydrophobicContact CB-CE2 4.41Å; A71-F106 HydrophobicContact CB-CZ 3.98Å; P74-F106 HydrophobicContact CG-CB 3.75Å; P74-F106 HydrophobicContact CG-CD1 3.91Å; P74-F106 HydrophobicContact CG-CD2 3.49Å; P74-F106 VanDerWaalsContact CG-CD2 3.49Å; P74-F106 HydrophobicContact CG-CE1 4.38Å; P74-F106 HydrophobicContact CG-CE2 3.98Å; P74-F106 HydrophobicContact CG-CG 3.44Å; P74-F106 VanDerWaalsContact CG-CG 3.44Å; P74-F106 HydrophobicContact CG-CZ 4.4Å; L95-F106 HydrophobicContact CB-CD1 4.12Å; L95-F106 HydrophobicContact CB-CD2 4.36Å; L95-F106 HydrophobicContact CB-CE1 3.68Å; L95-F106 HydrophobicContact CB-CE2 3.98Å; L95-F106 HydrophobicContact CB-CG 4.44Å; L95-F106 HydrophobicContact CB-CZ 3.61Å; L95-F106 HydrophobicContact CD1-CD2 4.46Å; L95-F106 HydrophobicContact CD1-CE2 3.73Å; L95-F106 HydrophobicContact CD1-CZ 3.93Å; L95-F106 HydrophobicContact CG-CE2 4.45Å; L95-F106 HydrophobicContact CG-CZ 4.42Å; L95-F106 PolarHBondContact N-O 3.31Å; L95-F106 WeakPolarHBondContact O-CD1 3.32Å; L95-F106 PolarHBondContact O-N 3.01Å; L97-F106 HydrophobicContact CD2-CE1 3.5Å; L97-F106 VanDerWaalsContact CD2-CE1 3.5Å; L97-F106 HydrophobicContact CD2-CZ 3.69Å; L97-F106 HydrophobicContact CG-CE1 3.8Å; L97-F106 HydrophobicContact CG-CZ 4.46Å; F106-R108 HydrophobicContact CD2-CG 4.14Å; F106-R108 HydrophobicContact CE2-CG 4.06Å
107	W	97.6	Very high	95.9	Very high	23 Å²	23	33.3 Å²	33.3	9%	0.087	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.4	-177.7	-66.3	79.1	0	0	0	111.8	M89 R92 L93 R94	M89-W107 HydrophobicContact CB-CH2 3.95Å; M89-W107 HydrophobicContact CB-CZ3 3.77Å; M89-W107 HydrophobicContact CE-CH2 4.3Å; R92-W107 HydrophobicContact CB-CE3 3.86Å; R92-W107 HydrophobicContact CB-CZ3 4.34Å; L93-W107 VanDerWaalsContact O-CA 3.26Å; L93-W107 WeakPolarHBondContact O-CA 3.14Å; R94-W107 HydrophobicContact CB-CD2 4.01Å; R94-W107 HydrophobicContact CB-CE3 4Å; R94-W107 HydrophobicContact CB-CH2 3.86Å; R94-W107 HydrophobicContact CB-CZ2 3.82Å; R94-W107 HydrophobicContact CB-CZ3 3.94Å; R94-W107 HydrophobicContact CG-CZ2 4.09Å
108	R	98.1	Very high	95.9	Very high	53 Å²	53	34.7 Å²	34.7	20%	0.2	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	149.5	173.7	-72.9	-61.8	-176.8	-93.7	11.2	110.8	R92 L93 L95 F106 D114 I115	R92-R108 CarbonylContact C-O 3.59Å; R92-R108 WeakPolarHBondContact CA-O 3.22Å; L93-R108 PolarHBondContact N-O 2.94Å; L93-R108 PolarHBondContact O-N 3.47Å; L93-R108 VanDerWaalsContact O-N 3.08Å; L95-R108 HydrophobicContact CD1-CB 4.06Å; L95-R108 HydrophobicContact CD1-CG 4.17Å; F106-R108 HydrophobicContact CD2-CG 4.14Å; F106-R108 HydrophobicContact CE2-CG 4.06Å; R108-D114 IonicContact CZ-OD2 3.61Å; R108-D114 IonicContact NE-OD2 2.68Å; R108-D114 PolarHBondContact NE-OD2 3.14Å; R108-D114 IonicContact NH2-OD2 3.15Å; R108-D114 PolarHBondContact NH2-OD2 2.84Å; R108-I115 HydrophobicContact CB-CG2 3.98Å; R108-I115 HydrophobicContact CG-CG2 4.05Å
109	L	98.1	Very high	95.7	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	151.6	171.1	-69.3	159.3	0	0	0	110.3	T91 R92 D111 S112 I115 R222 F225	T91-L109 WeakPolarHBondContact O-CA 3.34Å; T91-L109 WeakPolarHBondContact OG1-CD2 3.37Å; R92-L109 HydrophobicContact CG-CD2 3.48Å; R92-L109 VanDerWaalsContact CG-CD2 3.48Å; R92-L109 HydrophobicContact CG-CG 4.15Å; L109-D111 WeakPolarHBondContact CB-OD1 3.44Å; L109-D111 PolarHBondContact O-N 3.21Å; L109-D111 VanDerWaalsContact O-N 3.11Å; L109-S112 WeakPolarHBondContact O-CB 3.19Å; L109-S112 PolarHBondContact O-N 3.08Å; L109-I115 WeakPolarHBondContact O-CD1 3.3Å; L109-R222 HydrophobicContact CD1-CB 4.16Å; L109-F225 HydrophobicContact CD1-CE1 3.89Å; L109-F225 HydrophobicContact CD1-CZ 4.25Å; L109-F225 HydrophobicContact CD2-CE1 4.12Å; L109-F225 HydrophobicContact CD2-CZ 4.36Å
110	V	98.1	Very high	95.8	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-12.4	174.5	-65	0	0	0	0	114.5	P59 N61 F63 T91 L93 K161	P59-V110 HydrophobicContact CB-CG2 3.74Å; P59-V110 HydrophobicContact CG-CG2 3.59Å; N61-V110 HydrophobicContact CB-CG1 4.06Å; N61-V110 WeakPolarHBondContact OD1-CG1 3.3Å; F63-V110 HydrophobicContact CD2-CB 4.41Å; F63-V110 HydrophobicContact CD2-CG1 3.67Å; F63-V110 HydrophobicContact CE2-CB 4Å; F63-V110 HydrophobicContact CE2-CG1 3.73Å; T91-V110 PolarHBondContact O-N 3.18Å; L93-V110 HydrophobicContact CD1-CG1 4.26Å; L93-V110 HydrophobicContact CD2-CG1 3.88Å; L93-V110 HydrophobicContact CG-CG1 3.95Å; V110-K161 HydrophobicContact CB-CG 4.41Å; V110-K161 HydrophobicContact CG2-CG 4.1Å; V110-K161 PolarHBondContact O-N 3.43Å
111	D	97.8	Very high	95.7	Very high	4 Å²	4	34 Å²	34	2%	0.021	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	15.2	176.2	70.7	3	0	0	0	113.2	P59 L109 K161 E163 P164 R222	P59-D111 HydrophobicContact CG-CB 4.34Å; L109-D111 WeakPolarHBondContact CB-OD1 3.44Å; L109-D111 PolarHBondContact O-N 3.21Å; L109-D111 VanDerWaalsContact O-N 3.11Å; D111-K161 WeakPolarHBondContact CA-O 3.38Å; D111-K161 HydrophobicContact CB-CB 3.91Å; D111-E163 VanDerWaalsContact O-CA 3.23Å; D111-E163 WeakPolarHBondContact O-CA 3.2Å; D111-E163 VanDerWaalsContact O-CB 3.27Å; D111-E163 WeakPolarHBondContact O-CB 3.49Å; D111-E163 WeakPolarHBondContact O-CG 3.43Å; D111-P164 VanDerWaalsContact OD2-CD 3.31Å; D111-P164 WeakPolarHBondContact OD2-CD 3.49Å; D111-R222 PolarHBondContact O-NH1 3.31Å; D111-R222 IonicContact OD1-CZ 2.75Å; D111-R222 VanDerWaalsContact OD1-CZ 3.25Å; D111-R222 IonicContact OD1-NH1 3.75Å; D111-R222 PolarHBondContact OD1-NH1 3.34Å; D111-R222 IonicContact OD1-NH2 2.8Å; D111-R222 PolarHBondContact OD1-NH2 3.08Å; D111-R222 IonicContact OD2-CZ 3.7Å; D111-R222 IonicContact OD2-NH2 3.34Å; D111-R222 PolarHBondContact OD2-NH2 3.26Å
112	S	97.8	Very high	95.8	Very high	10 Å²	10	40.1 Å²	40.1	7%	0.07	22%	0.217	C	C	.	.			trans	-83.3	131.2	-177.2	-174.2	0	0	0	0	111.9	L109 D114 I115	L109-S112 WeakPolarHBondContact O-CB 3.19Å; L109-S112 PolarHBondContact O-N 3.08Å; S112-D114 PolarHBondContact O-N 3.5Å; S112-D114 VanDerWaalsContact O-N 3.14Å; S112-D114 PolarHBondContact OG-N 2.63Å; S112-I115 VanDerWaalsContact O-CG1 3.25Å; S112-I115 WeakPolarHBondContact O-CG1 3.35Å; S112-I115 PolarHBondContact O-N 2.87Å; S112-I115 VanDerWaalsContact O-N 3.14Å
113	S	95.7	Very high	95.9	Very high	53 Å²	53	43.9 Å²	43.9	37%	0.371	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-7.7	174.8	46.1	0	0	0	0	114.6	I115 E163	S113-I115 VanDerWaalsContact C-N 3.33Å; S113-E163 WeakPolarHBondContact CB-OE2 3.19Å; S113-E163 PolarHBondContact OG-OE2 3.13Å
114	D	96.4	Very high	96.1	Very high	33 Å²	33	42.7 Å²	42.7	18%	0.176	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-12.3	171.5	-81.6	-1.5	0	0	0	113.9	A71 R72 R108 S112	A71-D114 VanDerWaalsContact CA-O 3.29Å; A71-D114 WeakPolarHBondContact CA-O 3.34Å; R72-D114 WeakPolarHBondContact CD-OD1 3.35Å; R72-D114 IonicContact CZ-OD1 3.51Å; R72-D114 PolarHBondContact N-O 3.06Å; R72-D114 VanDerWaalsContact N-O 3.12Å; R72-D114 IonicContact NE-OD1 3.32Å; R72-D114 IonicContact NH1-OD1 2.82Å; R72-D114 PolarHBondContact NH1-OD1 3.25Å; R108-D114 IonicContact CZ-OD2 3.61Å; R108-D114 IonicContact NE-OD2 2.68Å; R108-D114 PolarHBondContact NE-OD2 3.14Å; R108-D114 IonicContact NH2-OD2 3.15Å; R108-D114 PolarHBondContact NH2-OD2 2.84Å; S112-D114 PolarHBondContact O-N 3.5Å; S112-D114 VanDerWaalsContact O-N 3.14Å; S112-D114 PolarHBondContact OG-N 2.63Å
115	I	98.3	Very high	96	Very high	9 Å²	9	42.4 Å²	42.4	5%	0.046	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	138.7	179.2	62.9	166.2	0	0	0	111.7	F63 L69 E70 A71 L93 L95 R108 L109 S112 S113 F160	F63-I115 HydrophobicContact CZ-CD1 4.35Å; L69-I115 HydrophobicContact CD1-CB 4.24Å; L69-I115 HydrophobicContact CD1-CG2 4.12Å; E70-I115 CarbonylContact O-C 3.55Å; E70-I115 WeakPolarHBondContact O-CA 3.39Å; A71-I115 HydrophobicContact CB-CG2 4.15Å; L93-I115 HydrophobicContact CD1-CD1 3.92Å; L95-I115 HydrophobicContact CD1-CG2 3.68Å; R108-I115 HydrophobicContact CB-CG2 3.98Å; R108-I115 HydrophobicContact CG-CG2 4.05Å; L109-I115 WeakPolarHBondContact O-CD1 3.3Å; S112-I115 VanDerWaalsContact O-CG1 3.25Å; S112-I115 WeakPolarHBondContact O-CG1 3.35Å; S112-I115 PolarHBondContact O-N 2.87Å; S112-I115 VanDerWaalsContact O-N 3.14Å; S113-I115 VanDerWaalsContact C-N 3.33Å; I115-F160 HydrophobicContact CB-CE1 4.3Å; I115-F160 HydrophobicContact CD1-CD1 4.24Å; I115-F160 HydrophobicContact CD1-CE1 4.36Å; I115-F160 HydrophobicContact CG1-CD1 4.18Å; I115-F160 HydrophobicContact CG1-CE1 4.34Å
116	Q	97.6	Very high	95.8	Very high	52 Å²	52	46.1 Å²	46.1	24%	0.243	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	155	-171.8	-56.4	-176.8	16.6	0	0	112.1	E70 T120 F160	E70-Q116 HydrophobicContact CB-CB 4.21Å; E70-Q116 PolarHBondContact N-O 3.48Å; E70-Q116 PolarHBondContact O-N 3.22Å; Q116-T120 HydrophobicContact CB-CG2 4.39Å; Q116-F160 VanDerWaalsContact C-CZ 3.43Å; Q116-F160 VanDerWaalsContact O-CE1 3.32Å; Q116-F160 WeakPolarHBondContact O-CE1 3.48Å; Q116-F160 VanDerWaalsContact O-CZ 3.32Å; Q116-F160 WeakPolarHBondContact O-CZ 3.31Å
117	P	97.9	Very high	95.6	Very high	33 Å²	33	52 Å²	52	21%	0.214	28%	0.281	C	S	.	.			trans	-64.1	146.8	172.2	-15.2	27.9	0	0	0	111.1	T120 A157 F160	P117-T120 VanDerWaalsContact O-CB 3.27Å; P117-T120 WeakPolarHBondContact O-CB 3.43Å; P117-T120 PolarHBondContact O-N 2.82Å; P117-T120 PolarHBondContact O-OG1 3.26Å; P117-A157 HydrophobicContact CB-CB 4.32Å; P117-A157 HydrophobicContact CG-CB 4.03Å; P117-F160 HydrophobicContact CB-CD2 4.31Å; P117-F160 HydrophobicContact CB-CE2 3.97Å; P117-F160 HydrophobicContact CB-CZ 4.39Å; P117-F160 HydrophobicContact CG-CD2 3.69Å; P117-F160 HydrophobicContact CG-CE2 3.84Å; P117-F160 HydrophobicContact CG-CG 4.09Å; P117-F160 HydrophobicContact CG-CZ 4.35Å
118	I	97.2	Very high	95.5	Very high	33 Å²	33	52 Å²	52	17%	0.169	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	140.6	177.8	-72.7	165.3	0	0	0	111.5	K68 E70 I82 L149 I154	K68-I118 HydrophobicContact CB-CD1 3.67Å; E70-I118 HydrophobicContact CG-CG1 4.03Å; E70-I118 WeakPolarHBondContact OE1-CA 3.3Å; I82-I118 HydrophobicContact CD1-CD1 4.05Å; I82-I118 HydrophobicContact CD1-CG1 3.92Å; I118-L149 HydrophobicContact CD1-CD2 3.84Å; I118-L149 HydrophobicContact CG2-CD2 4.46Å; I118-I154 HydrophobicContact CB-CD1 4.45Å; I118-I154 HydrophobicContact CB-CG2 3.99Å; I118-I154 HydrophobicContact CD1-CD1 4.44Å; I118-I154 HydrophobicContact CD1-CG1 4.04Å; I118-I154 HydrophobicContact CD1-CG2 4.13Å; I118-I154 HydrophobicContact CG1-CG2 4.43Å; I118-I154 HydrophobicContact CG2-CD1 4.22Å
119	G	94	Very high	95.4	Very high	17 Å²	17	52.6 Å²	52.6	18%	0.175	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	20	-171.2	0	0	0	0	0	113.2	E70 R123	E70-G119 PolarHBondContact OE1-N 2.96Å; G119-R123 WeakPolarHBondContact O-CB 3.18Å; G119-R123 PolarHBondContact O-NH1 3.5Å; G119-R123 PolarHBondContact O-NH2 3.39Å
120	T	95.6	Very high	95.4	Very high	24 Å²	24	54.1 Å²	54.1	15%	0.147	30%	0.298	C	S	.	.	S	Bend	trans	-93.6	-43.7	177.5	-57	0	0	0	0	111.8	E70 Q116 P117 E122 R123 T124	E70-T120 PolarHBondContact OE1-N 3.44Å; E70-T120 PolarHBondContact OE2-N 3.16Å; Q116-T120 HydrophobicContact CB-CG2 4.39Å; P117-T120 VanDerWaalsContact O-CB 3.27Å; P117-T120 WeakPolarHBondContact O-CB 3.43Å; P117-T120 PolarHBondContact O-N 2.82Å; P117-T120 PolarHBondContact O-OG1 3.26Å; T120-E122 VanDerWaalsContact C-N 3.34Å; T120-E122 PolarHBondContact O-N 3.38Å; T120-R123 WeakPolarHBondContact O-CA 3.46Å; T120-R123 WeakPolarHBondContact O-CB 3.43Å; T120-R123 PolarHBondContact O-N 2.89Å; T120-R123 PolarHBondContact OG1-NH1 2.99Å; T120-T124 PolarHBondContact O-N 3.37Å
121	C	93.5	Very high	95.3	Very high	6 Å²	6	54.3 Å²	54.3	4%	0.041	30%	0.299	C	S	.	.	H	α-helix	trans	-52.7	-48.2	168.6	-174.5	0	0	0	0	112	E70 V80 R123 T124 G125 D126 M127 L128	E70-C121 WeakPolarHBondContact OE2-CB 3.13Å; E70-C121 PolarHBondContact OE2-N 2.8Å; V80-C121 HydrophobicContact CG1-CB 4.27Å; C121-R123 VanDerWaalsContact C-N 3.28Å; C121-R123 PolarHBondContact O-N 3.29Å; C121-T124 PolarHBondContact O-N 2.92Å; C121-T124 PolarHBondContact O-OG1 3.47Å; C121-G125 PolarHBondContact O-N 3.46Å; C121-D126 CarbonylContact C-O 3.46Å; C121-D126 CarbonylContact O-C 3.54Å; C121-D126 WeakPolarHBondContact O-CA 3.27Å; C121-D126 WeakPolarHBondContact O-CB 3.25Å; C121-D126 PolarHBondContact O-N 3.02Å; C121-D126 VanDerWaalsContact SG-CB 3.51Å; C121-M127 VanDerWaalsContact SG-C 3.51Å; C121-L128 HydrophobicContact CB-CD2 3.75Å; C121-L128 HydrophobicContact CB-CG 4.24Å
122	E	92.9	Very high	95.1	Very high	159 Å²	159	59.6 Å²	59.6	74%	0.743	33%	0.327	S	S	*	.	H	α-helix	trans	-61	-36.7	175.3	-177	176.8	-160.3	0	0	112.4	T120 G125	T120-E122 VanDerWaalsContact C-N 3.34Å; T120-E122 PolarHBondContact O-N 3.38Å; E122-G125 PolarHBondContact O-N 3.3Å; E122-G125 VanDerWaalsContact O-N 3.16Å
123	R	94.3	Very high	94.8	Very high	174 Å²	174	60.3 Å²	60.3	66%	0.657	34%	0.336	S	S	*	.	H	α-helix	trans	-74.2	-24.2	-179.1	-164.8	-174.2	-54.8	103.5	8.4	113.2	G119 T120 C121 G125	G119-R123 WeakPolarHBondContact O-CB 3.18Å; G119-R123 PolarHBondContact O-NH1 3.5Å; G119-R123 PolarHBondContact O-NH2 3.39Å; T120-R123 WeakPolarHBondContact O-CA 3.46Å; T120-R123 WeakPolarHBondContact O-CB 3.43Å; T120-R123 PolarHBondContact O-N 2.89Å; T120-R123 PolarHBondContact OG1-NH1 2.99Å; C121-R123 VanDerWaalsContact C-N 3.28Å; C121-R123 PolarHBondContact O-N 3.29Å; R123-G125 VanDerWaalsContact C-N 3.27Å
124	T	92.6	Very high	94.8	Very high	90 Å²	90	59.1 Å²	59.1	55%	0.552	32%	0.324	S	S	*	.	H	α-helix	trans	-81.4	-7.2	170.4	55.3	0	0	0	0	112.9	T120 C121 D126	T120-T124 PolarHBondContact O-N 3.37Å; C121-T124 PolarHBondContact O-N 2.92Å; C121-T124 PolarHBondContact O-OG1 3.47Å; T124-D126 WeakPolarHBondContact CB-OD2 3.39Å; T124-D126 PolarHBondContact OG1-OD2 3.07Å
125	G	90.4	Very high	94.7	Very high	69 Å²	69	66.7 Å²	66.7	71%	0.711	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	6.4	-174.5	0	0	0	0	0	113.7	C121 E122 R123	C121-G125 PolarHBondContact O-N 3.46Å; E122-G125 PolarHBondContact O-N 3.3Å; E122-G125 VanDerWaalsContact O-N 3.16Å; R123-G125 VanDerWaalsContact C-N 3.27Å
126	D	91.8	Very high	94.4	Very high	105 Å²	105	71.5 Å²	71.5	56%	0.561	37%	0.374	S	S	*	.			trans	-87	170.1	175.1	-64.7	-69.7	0	0	0	111.4	C121 T124	C121-D126 CarbonylContact C-O 3.46Å; C121-D126 CarbonylContact O-C 3.54Å; C121-D126 WeakPolarHBondContact O-CA 3.27Å; C121-D126 WeakPolarHBondContact O-CB 3.25Å; C121-D126 PolarHBondContact O-N 3.02Å; C121-D126 VanDerWaalsContact SG-CB 3.51Å; T124-D126 WeakPolarHBondContact CB-OD2 3.39Å; T124-D126 PolarHBondContact OG1-OD2 3.07Å
127	M	91.6	Very high	94.1	Very high	137 Å²	137	73.9 Å²	73.9	68%	0.675	39%	0.388	S	S	*	.			trans	-124.7	135	176.7	-175.2	179	66.7	0	0	110.9	C121 Q129	C121-M127 VanDerWaalsContact SG-C 3.51Å; M127-Q129 PolarHBondContact O-N 3.41Å; M127-Q129 PolarHBondContact O-NE2 2.87Å
128	L	96	Very high	93.6	Very high	23 Å²	23	76 Å²	76	12%	0.12	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-58.7	127.2	175.1	-66.3	171.2	0	0	0	111.4	E70 V80 I82 C121 W141 L145	E70-L128 HydrophobicContact CG-CD2 3.81Å; V80-L128 HydrophobicContact CB-CD2 4.47Å; V80-L128 HydrophobicContact CG1-CD2 3.91Å; V80-L128 WeakPolarHBondContact O-CA 3.41Å; I82-L128 HydrophobicContact CD1-CD1 3.69Å; I82-L128 HydrophobicContact CD1-CD2 4.44Å; I82-L128 HydrophobicContact CG1-CD1 4.08Å; C121-L128 HydrophobicContact CB-CD2 3.75Å; C121-L128 HydrophobicContact CB-CG 4.24Å; L128-W141 HydrophobicContact CB-CZ2 4.45Å; L128-W141 PolarHBondContact O-NE1 2.84Å; L128-L145 HydrophobicContact CB-CD1 4.09Å; L128-L145 HydrophobicContact CD1-CD2 4.33Å
129	Q	96.5	Very high	93.4	Very high	67 Å²	67	79.4 Å²	79.4	31%	0.313	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-98.2	148.5	-176.2	-61.6	-56.2	-53	0	0	111.3	V80 C81 M127 W141	V80-Q129 PolarHBondContact O-N 2.91Å; C81-Q129 PolarHBondContact SG-O 2.88Å; M127-Q129 PolarHBondContact O-N 3.41Å; M127-Q129 PolarHBondContact O-NE2 2.87Å; Q129-W141 VanDerWaalsContact C-CE2 3.48Å; Q129-W141 WeakPolarHBondContact O-CH2 3.21Å; Q129-W141 WeakPolarHBondContact O-CZ2 3.26Å
130	P	96.5	Very high	93.4	Very high	38 Å²	38	79.9 Å²	79.9	25%	0.247	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-63.4	141.7	168.7	27.8	-32.9	0	0	0	109.6	F134 W141	P130-F134 HydrophobicContact CB-CB 4.02Å; P130-F134 HydrophobicContact CB-CD1 4.03Å; P130-F134 HydrophobicContact CB-CG 4.01Å; P130-W141 HydrophobicContact CB-CD2 3.69Å; P130-W141 HydrophobicContact CB-CE3 3.78Å; P130-W141 HydrophobicContact CB-CG 4.01Å; P130-W141 HydrophobicContact CB-CZ3 4.28Å; P130-W141 HydrophobicContact CG-CD2 4.41Å; P130-W141 HydrophobicContact CG-CG 4.31Å; P130-W141 VanDerWaalsContact N-CE2 3.32Å
131	P	96.3	Very high	93.3	Very high	4 Å²	4	79.4 Å²	79.4	3%	0.026	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-63.4	154.2	175	26.8	-34.3	0	0	0	111.1	L97 G133 F134	L97-P131 HydrophobicContact CB-CB 3.74Å; L97-P131 HydrophobicContact CB-CG 4.15Å; L97-P131 HydrophobicContact CD1-CB 3.65Å; L97-P131 HydrophobicContact CG-CB 4.34Å; P131-G133 PolarHBondContact O-N 3.2Å; P131-G133 VanDerWaalsContact O-N 3.09Å; P131-F134 HydrophobicContact CG-CB 4.02Å; P131-F134 HydrophobicContact CG-CD2 4.28Å; P131-F134 WeakPolarHBondContact O-CB 3.37Å; P131-F134 PolarHBondContact O-N 3.22Å
132	L	93.4	Very high	93.3	Very high	115 Å²	115	82 Å²	82	60%	0.602	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.6	-175.9	-170.6	69	0	0	0	112.6	D73 R75	D73-L132 PolarHBondContact OD2-N 2.89Å; R75-L132 HydrophobicContact CB-CB 4.28Å; R75-L132 HydrophobicContact CB-CD2 3.65Å
133	G	91.9	Very high	93.2	Very high	25 Å²	25	79.1 Å²	79.1	26%	0.258	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	20.5	173.9	0	0	0	0	0	115.3	P131 R135	P131-G133 PolarHBondContact O-N 3.2Å; P131-G133 VanDerWaalsContact O-N 3.09Å; G133-R135 WeakPolarHBondContact O-CG 3.37Å; G133-R135 PolarHBondContact O-N 3.02Å
134	F	96.5	Very high	93.3	Very high	29 Å²	29	72.3 Å²	72.3	13%	0.127	41%	0.411	C	S	.	.			trans	-58	123	-176.9	-174.3	-122	0	0	0	111.8	P130 P131 M136 W141 F144	P130-F134 HydrophobicContact CB-CB 4.02Å; P130-F134 HydrophobicContact CB-CD1 4.03Å; P130-F134 HydrophobicContact CB-CG 4.01Å; P131-F134 HydrophobicContact CG-CB 4.02Å; P131-F134 HydrophobicContact CG-CD2 4.28Å; P131-F134 WeakPolarHBondContact O-CB 3.37Å; P131-F134 PolarHBondContact O-N 3.22Å; F134-M136 VanDerWaalsContact C-N 3.29Å; F134-M136 HydrophobicContact CD1-CB 4.37Å; F134-M136 VanDerWaalsContact CD1-O 3.26Å; F134-M136 WeakPolarHBondContact CD1-O 3.38Å; F134-M136 HydrophobicContact CE1-CB 3.7Å; F134-M136 HydrophobicContact CZ-CB 3.79Å; F134-M136 HydrophobicContact CZ-CG 4.23Å; F134-M136 HydrophobicContact CZ-SD 4.47Å; F134-M136 PolarHBondContact O-N 3.4Å; F134-W141 HydrophobicContact CD2-CE3 4.1Å; F134-W141 HydrophobicContact CD2-CZ3 4.15Å; F134-W141 HydrophobicContact CE1-CB 4.31Å; F134-W141 HydrophobicContact CE1-CE3 4.22Å; F134-W141 AromaticContact CE2-CE3 3.7Å; F134-W141 HydrophobicContact CE2-CE3 3.7Å; F134-W141 AromaticContact CE2-CZ3 3.95Å; F134-W141 HydrophobicContact CE2-CZ3 3.95Å; F134-W141 AromaticContact CZ-CE3 3.77Å; F134-W141 HydrophobicContact CZ-CE3 3.77Å; F134-W141 HydrophobicContact CZ-CZ3 4.47Å; F134-F144 HydrophobicContact CE2-CB 4.31Å; F134-F144 AromaticContact CE2-CD1 3.69Å; F134-F144 HydrophobicContact CE2-CD1 3.69Å; F134-F144 HydrophobicContact CE2-CD2 4Å; F134-F144 HydrophobicContact CE2-CE1 4.01Å; F134-F144 HydrophobicContact CE2-CE2 4.31Å; F134-F144 AromaticContact CE2-CG 3.7Å; F134-F144 HydrophobicContact CE2-CG 3.7Å; F134-F144 HydrophobicContact CE2-CZ 4.33Å; F134-F144 HydrophobicContact CZ-CB 3.91Å; F134-F144 HydrophobicContact CZ-CD1 4.14Å; F134-F144 HydrophobicContact CZ-CD2 4.23Å; F134-F144 AromaticContact CZ-CG 3.81Å; F134-F144 HydrophobicContact CZ-CG 3.81Å
135	R	93.8	Very high	93.4	Very high	192 Å²	192	69.2 Å²	69.2	73%	0.725	39%	0.391	S	S	*	.	S	Bend	trans	-86.1	7.7	-167.2	-62.8	178.4	64.3	-168	0.7	114.7	G99 S100 G133	G99-R135 WeakPolarHBondContact O-CB 3.35Å; G99-R135 WeakPolarHBondContact O-CG 3.37Å; G99-R135 PolarHBondContact O-N 3.48Å; S100-R135 WeakPolarHBondContact O-CD 3.49Å; G133-R135 WeakPolarHBondContact O-CG 3.37Å; G133-R135 PolarHBondContact O-N 3.02Å
136	M	91.5	Very high	93.5	Very high	109 Å²	109	69.6 Å²	69.6	54%	0.537	38%	0.376	S	S	.	.	S	Bend	trans	-126.9	170.8	177.5	-52.3	-174.3	-172	0	0	110.2	F134 S140 F144	F134-M136 VanDerWaalsContact C-N 3.29Å; F134-M136 HydrophobicContact CD1-CB 4.37Å; F134-M136 VanDerWaalsContact CD1-O 3.26Å; F134-M136 WeakPolarHBondContact CD1-O 3.38Å; F134-M136 HydrophobicContact CE1-CB 3.7Å; F134-M136 HydrophobicContact CZ-CB 3.79Å; F134-M136 HydrophobicContact CZ-CG 4.23Å; F134-M136 HydrophobicContact CZ-SD 4.47Å; F134-M136 PolarHBondContact O-N 3.4Å; M136-S140 WeakPolarHBondContact CB-OG 3.23Å; M136-F144 HydrophobicContact CE-CD2 3.99Å; M136-F144 HydrophobicContact CE-CE2 4.21Å; M136-F144 HydrophobicContact SD-CD2 4.11Å
137	N	91.9	Very high	93.5	Very high	102 Å²	102	74 Å²	74	55%	0.545	39%	0.385	S	S	.	.			trans	-66.7	149.4	176	57.8	39.2	0	0	0	111.6	S139 S140	N137-S139 PolarHBondContact O-N 2.87Å; N137-S139 PolarHBondContact OD1-OG 3.07Å; N137-S140 PolarHBondContact O-N 3.43Å; N137-S140 PolarHBondContact O-OG 3.13Å; N137-S140 WeakPolarHBondContact OD1-CB 3.49Å; N137-S140 PolarHBondContact OD1-N 2.91Å; N137-S140 PolarHBondContact OD1-OG 3.39Å
138	A	88.3	Confident	93.7	Very high	78 Å²	78	68.4 Å²	68.4	65%	0.645	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-58.6	-32.3	-177.4	0	0	0	0	0	113.2	S140 W141	A138-S140 PolarHBondContact O-N 2.99Å; A138-W141 VanDerWaalsContact O-CB 3.25Å; A138-W141 WeakPolarHBondContact O-CB 3.34Å; A138-W141 PolarHBondContact O-N 2.89Å; A138-W141 VanDerWaalsContact O-N 3.11Å
139	S	91.8	Very high	93.6	Very high	105 Å²	105	69.6 Å²	69.6	73%	0.734	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-65.8	-20.1	176.3	45.1	0	0	0	0	114.2	N137	N137-S139 PolarHBondContact O-N 2.87Å; N137-S139 PolarHBondContact OD1-OG 3.07Å
140	S	93.9	Very high	93.5	Very high	27 Å²	27	71 Å²	71	19%	0.189	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-80.7	-14.6	172.5	68.8	0	0	0	0	114.2	M136 N137 A138 M143 F144	M136-S140 WeakPolarHBondContact CB-OG 3.23Å; N137-S140 PolarHBondContact O-N 3.43Å; N137-S140 PolarHBondContact O-OG 3.13Å; N137-S140 WeakPolarHBondContact OD1-CB 3.49Å; N137-S140 PolarHBondContact OD1-N 2.91Å; N137-S140 PolarHBondContact OD1-OG 3.39Å; A138-S140 PolarHBondContact O-N 2.99Å; S140-M143 PolarHBondContact O-N 2.99Å; S140-M143 VanDerWaalsContact O-N 3.11Å; S140-F144 WeakPolarHBondContact O-CB 2.87Å; S140-F144 PolarHBondContact O-N 2.99Å
141	W	94.4	Very high	93.2	Very high	14 Å²	14	73.4 Å²	73.4	5%	0.053	41%	0.414	C	S	.	.	H	α-helix	trans	-53.2	-44.1	-173.4	176.8	-118.1	0	0	0	114.6	L128 Q129 P130 F134 A138 M143 F144 L145	L128-W141 HydrophobicContact CB-CZ2 4.45Å; L128-W141 PolarHBondContact O-NE1 2.84Å; Q129-W141 VanDerWaalsContact C-CE2 3.48Å; Q129-W141 WeakPolarHBondContact O-CH2 3.21Å; Q129-W141 WeakPolarHBondContact O-CZ2 3.26Å; P130-W141 HydrophobicContact CB-CD2 3.69Å; P130-W141 HydrophobicContact CB-CE3 3.78Å; P130-W141 HydrophobicContact CB-CG 4.01Å; P130-W141 HydrophobicContact CB-CZ3 4.28Å; P130-W141 HydrophobicContact CG-CD2 4.41Å; P130-W141 HydrophobicContact CG-CG 4.31Å; P130-W141 VanDerWaalsContact N-CE2 3.32Å; F134-W141 HydrophobicContact CD2-CE3 4.1Å; F134-W141 HydrophobicContact CD2-CZ3 4.15Å; F134-W141 HydrophobicContact CE1-CB 4.31Å; F134-W141 HydrophobicContact CE1-CE3 4.22Å; F134-W141 AromaticContact CE2-CE3 3.7Å; F134-W141 HydrophobicContact CE2-CE3 3.7Å; F134-W141 AromaticContact CE2-CZ3 3.95Å; F134-W141 HydrophobicContact CE2-CZ3 3.95Å; F134-W141 AromaticContact CZ-CE3 3.77Å; F134-W141 HydrophobicContact CZ-CE3 3.77Å; F134-W141 HydrophobicContact CZ-CZ3 4.47Å; A138-W141 VanDerWaalsContact O-CB 3.25Å; A138-W141 WeakPolarHBondContact O-CB 3.34Å; A138-W141 PolarHBondContact O-N 2.89Å; A138-W141 VanDerWaalsContact O-N 3.11Å; W141-M143 PolarHBondContact O-N 3.33Å; W141-F144 AromaticContact CE3-CD1 3.77Å; W141-F144 HydrophobicContact CE3-CD1 3.77Å; W141-F144 HydrophobicContact CE3-CG 4.48Å; W141-F144 AromaticContact CZ3-CD1 3.53Å; W141-F144 HydrophobicContact CZ3-CD1 3.53Å; W141-F144 AromaticContact CZ3-CE1 3.9Å; W141-F144 HydrophobicContact CZ3-CE1 3.9Å; W141-F144 WeakPolarHBondContact O-CB 3.42Å; W141-F144 PolarHBondContact O-N 2.85Å; W141-L145 HydrophobicContact CD2-CD1 4.25Å; W141-L145 HydrophobicContact CD2-CG 4.05Å; W141-L145 VanDerWaalsContact CE2-CD1 3.49Å; W141-L145 HydrophobicContact CE3-CG 4.38Å; W141-L145 HydrophobicContact CH2-CD2 3.64Å; W141-L145 HydrophobicContact CH2-CG 3.93Å; W141-L145 HydrophobicContact CZ2-CD1 3.65Å; W141-L145 HydrophobicContact CZ2-CD2 3.49Å; W141-L145 VanDerWaalsContact CZ2-CD2 3.49Å; W141-L145 HydrophobicContact CZ2-CG 3.53Å; W141-L145 HydrophobicContact CZ3-CD2 4.36Å; W141-L145 HydrophobicContact CZ3-CG 4.34Å; W141-L145 PolarHBondContact O-N 3.09Å
142	P	92.1	Very high	93.2	Very high	60 Å²	60	74.7 Å²	74.7	39%	0.39	43%	0.425	S	S	.	.	H	α-helix	trans	-64	-39.5	178.6	-22.3	34.6	0	0	0	113.1	L146 L665	P142-L146 WeakPolarHBondContact O-CB 3.33Å; P142-L146 PolarHBondContact O-N 2.85Å; P142-L665 HydrophobicContact CB-CD2 4.04Å
143	M	91.7	Very high	93.3	Very high	98 Å²	98	73.4 Å²	73.4	48%	0.483	42%	0.416	S	S	.	.	H	α-helix	trans	-74.3	-29.8	176.9	-68.2	-58.2	-61.9	0	0	112.2	S140 W141 L146 R147	S140-M143 PolarHBondContact O-N 2.99Å; S140-M143 VanDerWaalsContact O-N 3.11Å; W141-M143 PolarHBondContact O-N 3.33Å; M143-L146 HydrophobicContact CE-CD2 4.5Å; M143-L146 HydrophobicContact SD-CD2 4.43Å; M143-R147 WeakPolarHBondContact O-CB 3.05Å; M143-R147 PolarHBondContact O-N 3Å; M143-R147 VanDerWaalsContact O-N 3.14Å
144	F	95.9	Very high	93.6	Very high	31 Å²	31	76 Å²	76	14%	0.136	42%	0.423	C	S	.	.	H	α-helix	trans	-66.2	-50.1	171.5	179.6	-90.2	0	0	0	110.8	D98 G99 F134 M136 S140 W141 L146 R147 T148	D98-F144 HydrophobicContact CB-CE1 4.06Å; D98-F144 HydrophobicContact CB-CZ 4.19Å; D98-F144 WeakPolarHBondContact O-CE1 3.39Å; G99-F144 VanDerWaalsContact CA-CZ 3.44Å; F134-F144 HydrophobicContact CE2-CB 4.31Å; F134-F144 AromaticContact CE2-CD1 3.69Å; F134-F144 HydrophobicContact CE2-CD1 3.69Å; F134-F144 HydrophobicContact CE2-CD2 4Å; F134-F144 HydrophobicContact CE2-CE1 4.01Å; F134-F144 HydrophobicContact CE2-CE2 4.31Å; F134-F144 AromaticContact CE2-CG 3.7Å; F134-F144 HydrophobicContact CE2-CG 3.7Å; F134-F144 HydrophobicContact CE2-CZ 4.33Å; F134-F144 HydrophobicContact CZ-CB 3.91Å; F134-F144 HydrophobicContact CZ-CD1 4.14Å; F134-F144 HydrophobicContact CZ-CD2 4.23Å; F134-F144 AromaticContact CZ-CG 3.81Å; F134-F144 HydrophobicContact CZ-CG 3.81Å; M136-F144 HydrophobicContact CE-CD2 3.99Å; M136-F144 HydrophobicContact CE-CE2 4.21Å; M136-F144 HydrophobicContact SD-CD2 4.11Å; S140-F144 WeakPolarHBondContact O-CB 2.87Å; S140-F144 PolarHBondContact O-N 2.99Å; W141-F144 AromaticContact CE3-CD1 3.77Å; W141-F144 HydrophobicContact CE3-CD1 3.77Å; W141-F144 HydrophobicContact CE3-CG 4.48Å; W141-F144 AromaticContact CZ3-CD1 3.53Å; W141-F144 HydrophobicContact CZ3-CD1 3.53Å; W141-F144 AromaticContact CZ3-CE1 3.9Å; W141-F144 HydrophobicContact CZ3-CE1 3.9Å; W141-F144 WeakPolarHBondContact O-CB 3.42Å; W141-F144 PolarHBondContact O-N 2.85Å; F144-L146 PolarHBondContact O-N 3.42Å; F144-R147 PolarHBondContact O-N 3.5Å; F144-T148 HydrophobicContact CE1-CG2 4.41Å; F144-T148 WeakPolarHBondContact CE1-OG1 3.37Å; F144-T148 VanDerWaalsContact CZ-OG1 3.29Å; F144-T148 WeakPolarHBondContact CZ-OG1 3.34Å; F144-T148 VanDerWaalsContact O-CB 3.23Å; F144-T148 WeakPolarHBondContact O-CB 3.32Å; F144-T148 PolarHBondContact O-N 3.38Å; F144-T148 PolarHBondContact O-OG1 3.09Å
145	L	94.4	Very high	93.7	Very high	26 Å²	26	74.7 Å²	74.7	14%	0.136	42%	0.418	C	S	.	.	H	α-helix	trans	-55.2	-52	174.9	-83.7	177.6	0	0	0	111.8	I82 L128 W141 R147 T148 L149	I82-L145 HydrophobicContact CB-CD2 4.44Å; I82-L145 HydrophobicContact CG1-CD2 3.53Å; L128-L145 HydrophobicContact CB-CD1 4.09Å; L128-L145 HydrophobicContact CD1-CD2 4.33Å; W141-L145 HydrophobicContact CD2-CD1 4.25Å; W141-L145 HydrophobicContact CD2-CG 4.05Å; W141-L145 VanDerWaalsContact CE2-CD1 3.49Å; W141-L145 HydrophobicContact CE3-CG 4.38Å; W141-L145 HydrophobicContact CH2-CD2 3.64Å; W141-L145 HydrophobicContact CH2-CG 3.93Å; W141-L145 HydrophobicContact CZ2-CD1 3.65Å; W141-L145 HydrophobicContact CZ2-CD2 3.49Å; W141-L145 VanDerWaalsContact CZ2-CD2 3.49Å; W141-L145 HydrophobicContact CZ2-CG 3.53Å; W141-L145 HydrophobicContact CZ3-CD2 4.36Å; W141-L145 HydrophobicContact CZ3-CG 4.34Å; W141-L145 PolarHBondContact O-N 3.09Å; L145-R147 VanDerWaalsContact C-N 3.29Å; L145-R147 PolarHBondContact O-N 2.79Å; L145-T148 PolarHBondContact O-N 2.88Å; L145-T148 VanDerWaalsContact O-N 3.13Å; L145-L149 WeakPolarHBondContact O-CG 3.25Å; L145-L149 PolarHBondContact O-N 2.85Å
146	L	92.5	Very high	93.8	Very high	77 Å²	77	68.3 Å²	68.3	40%	0.403	40%	0.401	S	S	.	.	H	α-helix	trans	-56.1	-43.7	-179.8	-179.8	61.6	0	0	0	111.9	P142 M143 F144 S150	P142-L146 WeakPolarHBondContact O-CB 3.33Å; P142-L146 PolarHBondContact O-N 2.85Å; M143-L146 HydrophobicContact CE-CD2 4.5Å; M143-L146 HydrophobicContact SD-CD2 4.43Å; F144-L146 PolarHBondContact O-N 3.42Å; L146-S150 VanDerWaalsContact O-CB 3.22Å; L146-S150 WeakPolarHBondContact O-CB 3.39Å; L146-S150 PolarHBondContact O-N 3.48Å; L146-S150 VanDerWaalsContact O-N 3.09Å
147	R	93.6	Very high	94.1	Very high	196 Å²	196	66.5 Å²	66.5	74%	0.74	40%	0.403	S	S	*	.	H	α-helix	trans	-70.5	-37.7	177.3	-173.4	179.8	-62.9	167.7	2.1	113	M143 F144 L145	M143-R147 WeakPolarHBondContact O-CB 3.05Å; M143-R147 PolarHBondContact O-N 3Å; M143-R147 VanDerWaalsContact O-N 3.14Å; F144-R147 PolarHBondContact O-N 3.5Å; L145-R147 VanDerWaalsContact C-N 3.29Å; L145-R147 PolarHBondContact O-N 2.79Å
148	T	94.8	Very high	94.3	Very high	21 Å²	21	66 Å²	66	13%	0.129	41%	0.408	C	S	.	.	H	α-helix	trans	-72	-28.8	-177.9	-69.2	0	0	0	0	112.7	K68 I82 D98 F144 L145 A152	K68-T148 HydrophobicContact CD-CG2 4.06Å; K68-T148 WeakPolarHBondContact CE-O 3.43Å; I82-T148 HydrophobicContact CG2-CG2 4.18Å; D98-T148 HydrophobicContact CB-CG2 3.89Å; D98-T148 VanDerWaalsContact OD1-CG2 3.31Å; D98-T148 WeakPolarHBondContact OD1-CG2 3.41Å; F144-T148 HydrophobicContact CE1-CG2 4.41Å; F144-T148 WeakPolarHBondContact CE1-OG1 3.37Å; F144-T148 VanDerWaalsContact CZ-OG1 3.29Å; F144-T148 WeakPolarHBondContact CZ-OG1 3.34Å; F144-T148 VanDerWaalsContact O-CB 3.23Å; F144-T148 WeakPolarHBondContact O-CB 3.32Å; F144-T148 PolarHBondContact O-N 3.38Å; F144-T148 PolarHBondContact O-OG1 3.09Å; L145-T148 PolarHBondContact O-N 2.88Å; L145-T148 VanDerWaalsContact O-N 3.13Å; T148-A152 WeakPolarHBondContact O-CB 3.49Å
149	L	94.1	Very high	94.8	Very high	47 Å²	47	62.3 Å²	62.3	25%	0.246	38%	0.377	C	S	.	.	H	α-helix	trans	-94	-25.2	178.4	-62.8	178.9	0	0	0	113.3	K68 I82 I118 L145 G151 A152	K68-L149 HydrophobicContact CD-CD2 4.48Å; I82-L149 HydrophobicContact CD1-CD1 4.45Å; I82-L149 HydrophobicContact CD1-CD2 4.01Å; I82-L149 HydrophobicContact CG1-CD2 4.21Å; I82-L149 HydrophobicContact CG2-CD2 4.29Å; I118-L149 HydrophobicContact CD1-CD2 3.84Å; I118-L149 HydrophobicContact CG2-CD2 4.46Å; L145-L149 WeakPolarHBondContact O-CG 3.25Å; L145-L149 PolarHBondContact O-N 2.85Å; L149-G151 PolarHBondContact O-N 3.16Å; L149-G151 VanDerWaalsContact O-N 3.07Å; L149-A152 PolarHBondContact O-N 3.12Å
150	S	94.4	Very high	95	Very high	98 Å²	98	58.7 Å²	58.7	69%	0.685	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	109.4	177.4	-174.4	0	0	0	0	111.5	L146	L146-S150 VanDerWaalsContact O-CB 3.22Å; L146-S150 WeakPolarHBondContact O-CB 3.39Å; L146-S150 PolarHBondContact O-N 3.48Å; L146-S150 VanDerWaalsContact O-N 3.09Å
151	G	90.5	Very high	95.2	Very high	88 Å²	88	60 Å²	60	91%	0.907	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	13.3	178.8	0	0	0	0	0	115.5	L149	L149-G151 PolarHBondContact O-N 3.16Å; L149-G151 VanDerWaalsContact O-N 3.07Å
152	A	95	Very high	95.3	Very high	30 Å²	30	69 Å²	69	25%	0.248	39%	0.39	C	S	.	.			trans	-80.3	146.8	177.8	0	0	0	0	0	113	K68 T148 L149 I154	K68-A152 HydrophobicContact CD-CB 3.73Å; K68-A152 HydrophobicContact CG-CB 4.3Å; T148-A152 WeakPolarHBondContact O-CB 3.49Å; L149-A152 PolarHBondContact O-N 3.12Å; A152-I154 PolarHBondContact O-N 3.38Å
153	E	96.9	Very high	95.5	Very high	89 Å²	89	68.5 Å²	68.5	42%	0.416	38%	0.383	S	S	.	.			trans	-70.7	110.8	165.9	-167.5	178.2	-179.2	0	0	108.5	K64 M67 K68	K64-E153 IonicContact NZ-OE1 2.84Å; K64-E153 PolarHBondContact NZ-OE1 3.47Å; M67-E153 CarbonylContact C-O 3.6Å; M67-E153 WeakPolarHBondContact CA-O 3.37Å; M67-E153 HydrophobicContact CE-CG 4.36Å; M67-E153 VanDerWaalsContact CE-OE1 3.23Å; M67-E153 WeakPolarHBondContact CE-OE1 3.43Å; M67-E153 HydrophobicContact CG-CG 4.04Å; K68-E153 PolarHBondContact N-O 2.92Å
154	I	97.6	Very high	95.7	Very high	79 Å²	79	64.8 Å²	64.8	41%	0.405	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-88.9	136.1	176.8	-66.4	176.2	0	0	0	108.8	I118 A152	I118-I154 HydrophobicContact CB-CD1 4.45Å; I118-I154 HydrophobicContact CB-CG2 3.99Å; I118-I154 HydrophobicContact CD1-CD1 4.44Å; I118-I154 HydrophobicContact CD1-CG1 4.04Å; I118-I154 HydrophobicContact CD1-CG2 4.13Å; I118-I154 HydrophobicContact CG1-CG2 4.43Å; I118-I154 HydrophobicContact CG2-CD1 4.22Å; A152-I154 PolarHBondContact O-N 3.38Å
155	A	98.2	Very high	95.7	Very high	2 Å²	2	68.4 Å²	68.4	2%	0.017	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-61.8	124.4	174	0	0	0	0	0	110.4	F63 M67 K68 L69 F160	F63-A155 HydrophobicContact CD1-CB 3.86Å; F63-A155 HydrophobicContact CE1-CB 3.6Å; M67-A155 HydrophobicContact CB-CB 4.2Å; M67-A155 HydrophobicContact SD-CB 4.24Å; K68-A155 WeakPolarHBondContact O-CB 3.4Å; K68-A155 PolarHBondContact O-N 3.18Å; L69-A155 HydrophobicContact CB-CB 4.31Å; A155-F160 HydrophobicContact CB-CE2 3.73Å; A155-F160 HydrophobicContact CB-CZ 3.82Å
156	P	97.4	Very high	95.7	Very high	58 Å²	58	69.3 Å²	69.3	38%	0.377	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-69.8	145.7	-177.7	29.1	-34.7	0	0	0	110.8	S158 A159 F160	P156-S158 PolarHBondContact O-N 2.87Å; P156-A159 HydrophobicContact CG-CB 4.2Å; P156-A159 WeakPolarHBondContact O-CB 3.41Å; P156-A159 PolarHBondContact O-N 2.92Å; P156-F160 WeakPolarHBondContact O-CD2 3.24Å
157	A	96.7	Very high	95.9	Very high	71 Å²	71	66.5 Å²	66.5	59%	0.587	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-25	-177.1	0	0	0	0	0	114.1	P117 A159	P117-A157 HydrophobicContact CB-CB 4.32Å; P117-A157 HydrophobicContact CG-CB 4.03Å; A157-A159 VanDerWaalsContact C-N 3.34Å
158	S	96.8	Very high	95.9	Very high	91 Å²	91	64.6 Å²	64.6	64%	0.636	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-19.3	175.4	50.1	0	0	0	0	114.9	P156 K161	P156-S158 PolarHBondContact O-N 2.87Å; S158-K161 PolarHBondContact O-NZ 2.89Å
159	A	97.4	Very high	96	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-31.3	176.4	0	0	0	0	0	111.9	D62 F63 P156 A157 K161	D62-A159 HydrophobicContact CB-CB 4.26Å; F63-A159 HydrophobicContact CD1-CB 4.34Å; F63-A159 HydrophobicContact CD2-CB 3.89Å; F63-A159 HydrophobicContact CE1-CB 4.18Å; F63-A159 HydrophobicContact CE2-CB 3.71Å; F63-A159 VanDerWaalsContact CE2-O 3.27Å; F63-A159 WeakPolarHBondContact CE2-O 3.36Å; F63-A159 HydrophobicContact CG-CB 4.2Å; F63-A159 HydrophobicContact CZ-CB 3.87Å; P156-A159 HydrophobicContact CG-CB 4.2Å; P156-A159 WeakPolarHBondContact O-CB 3.41Å; P156-A159 PolarHBondContact O-N 2.92Å; A157-A159 VanDerWaalsContact C-N 3.34Å; A159-K161 WeakPolarHBondContact O-CE 3.26Å
160	F	97.8	Very high	96.2	Very high	29 Å²	29	68.4 Å²	68.4	13%	0.127	41%	0.408	C	S	.	.	S	Bend	trans	-73	129.2	176	-58.4	-98.9	0	0	0	109.9	F63 L69 I115 Q116 P117 A155 P156	F63-F160 HydrophobicContact CE1-CE1 4.07Å; F63-F160 HydrophobicContact CE1-CE2 4.06Å; F63-F160 AromaticContact CE1-CZ 3.83Å; F63-F160 HydrophobicContact CE1-CZ 3.83Å; F63-F160 AromaticContact CZ-CD1 3.89Å; F63-F160 HydrophobicContact CZ-CD1 3.89Å; F63-F160 HydrophobicContact CZ-CD2 4.09Å; F63-F160 AromaticContact CZ-CE1 3.87Å; F63-F160 HydrophobicContact CZ-CE1 3.87Å; F63-F160 HydrophobicContact CZ-CE2 4.09Å; F63-F160 AromaticContact CZ-CG 4Å; F63-F160 HydrophobicContact CZ-CG 4Å; F63-F160 AromaticContact CZ-CZ 3.98Å; F63-F160 HydrophobicContact CZ-CZ 3.98Å; L69-F160 HydrophobicContact CB-CE1 4.05Å; L69-F160 HydrophobicContact CB-CZ 3.68Å; L69-F160 HydrophobicContact CD2-CE1 4.25Å; L69-F160 HydrophobicContact CD2-CZ 4.35Å; I115-F160 HydrophobicContact CB-CE1 4.3Å; I115-F160 HydrophobicContact CD1-CD1 4.24Å; I115-F160 HydrophobicContact CD1-CE1 4.36Å; I115-F160 HydrophobicContact CG1-CD1 4.18Å; I115-F160 HydrophobicContact CG1-CE1 4.34Å; Q116-F160 VanDerWaalsContact C-CZ 3.43Å; Q116-F160 VanDerWaalsContact O-CE1 3.32Å; Q116-F160 WeakPolarHBondContact O-CE1 3.48Å; Q116-F160 VanDerWaalsContact O-CZ 3.32Å; Q116-F160 WeakPolarHBondContact O-CZ 3.31Å; P117-F160 HydrophobicContact CB-CD2 4.31Å; P117-F160 HydrophobicContact CB-CE2 3.97Å; P117-F160 HydrophobicContact CB-CZ 4.39Å; P117-F160 HydrophobicContact CG-CD2 3.69Å; P117-F160 HydrophobicContact CG-CE2 3.84Å; P117-F160 HydrophobicContact CG-CG 4.09Å; P117-F160 HydrophobicContact CG-CZ 4.35Å; A155-F160 HydrophobicContact CB-CE2 3.73Å; A155-F160 HydrophobicContact CB-CZ 3.82Å; P156-F160 WeakPolarHBondContact O-CD2 3.24Å
161	K	97.4	Very high	96.3	Very high	55 Å²	55	68 Å²	68	24%	0.239	39%	0.392	C	S	.	.			trans	-105.9	154.9	-176.4	-50.4	-53.8	179.9	-173.9	0	110.4	P59 S60 D62 V110 D111 S158 A159	P59-K161 HydrophobicContact CB-CB 4.13Å; P59-K161 HydrophobicContact CB-CG 3.86Å; S60-K161 WeakPolarHBondContact O-CE 3.45Å; S60-K161 VanDerWaalsContact OG-CE 3.31Å; S60-K161 WeakPolarHBondContact OG-CE 3.4Å; S60-K161 PolarHBondContact OG-NZ 2.75Å; D62-K161 IonicContact OD2-NZ 2.78Å; D62-K161 PolarHBondContact OD2-NZ 3.07Å; V110-K161 HydrophobicContact CB-CG 4.41Å; V110-K161 HydrophobicContact CG2-CG 4.1Å; V110-K161 PolarHBondContact O-N 3.43Å; D111-K161 WeakPolarHBondContact CA-O 3.38Å; D111-K161 HydrophobicContact CB-CB 3.91Å; S158-K161 PolarHBondContact O-NZ 2.89Å; A159-K161 WeakPolarHBondContact O-CE 3.26Å
162	K	96.1	Very high	96.7	Very high	202 Å²	202	64.3 Å²	64.3	88%	0.878	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-71.9	130.6	179.7	-176.1	179.7	177.4	-178.2	0	110
163	E	96.4	Very high	96.8	Very high	51 Å²	51	68.7 Å²	68.7	24%	0.238	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-60.4	134.6	177.3	-167.5	171.9	-152.5	0	0	111.7	K53 D111 S113 R222	K53-E163 WeakPolarHBondContact CE-OE1 3.43Å; K53-E163 IonicContact NZ-OE1 2.94Å; K53-E163 PolarHBondContact NZ-OE1 2.76Å; K53-E163 IonicContact NZ-OE2 2.76Å; K53-E163 PolarHBondContact NZ-OE2 2.94Å; D111-E163 VanDerWaalsContact O-CA 3.23Å; D111-E163 WeakPolarHBondContact O-CA 3.2Å; D111-E163 VanDerWaalsContact O-CB 3.27Å; D111-E163 WeakPolarHBondContact O-CB 3.49Å; D111-E163 WeakPolarHBondContact O-CG 3.43Å; S113-E163 WeakPolarHBondContact CB-OE2 3.19Å; S113-E163 PolarHBondContact OG-OE2 3.13Å; E163-R222 WeakPolarHBondContact OE1-CD 3.3Å; E163-R222 IonicContact OE1-NH1 2.66Å; E163-R222 PolarHBondContact OE1-NH1 3.49Å
164	P	96.5	Very high	96.9	Very high	20 Å²	20	68.5 Å²	68.5	13%	0.13	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-64.6	150.9	172.7	25.4	-34.7	0	0	0	112.4	K53 D111	K53-P164 WeakPolarHBondContact CE-O 3.39Å; K53-P164 HydrophobicContact CG-CG 4.39Å; D111-P164 VanDerWaalsContact OD2-CD 3.31Å; D111-P164 WeakPolarHBondContact OD2-CD 3.49Å
165	S	95.1	Very high	96.9	Very high	106 Å²	106	66.7 Å²	66.7	74%	0.741	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-61.8	134.6	174	48.8	0	0	0	0	111.8
166	S	95.1	Very high	96.9	Very high	46 Å²	46	68 Å²	68	32%	0.322	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-60.6	143.9	165.1	-54.9	0	0	0	0	109.8	K53 D220	K53-S166 VanDerWaalsContact CD-OG 3.27Å; K53-S166 WeakPolarHBondContact CD-OG 3.41Å; K53-S166 WeakPolarHBondContact CE-OG 3.3Å; S166-D220 WeakPolarHBondContact CB-OD2 3.43Å; S166-D220 PolarHBondContact OG-OD2 3.07Å
167	P	95.9	Very high	97	Very high	18 Å²	18	65.7 Å²	65.7	12%	0.117	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-63.9	151.4	170.4	-13.9	25.8	0	0	0	111.4	K169 Y171 F219	P167-K169 PolarHBondContact O-N 3.3Å; P167-K169 VanDerWaalsContact O-N 3.1Å; P167-Y171 HydrophobicContact CB-CD2 4.13Å; P167-Y171 HydrophobicContact CB-CE2 4.18Å; P167-F219 HydrophobicContact CB-CE2 3.94Å; P167-F219 HydrophobicContact CG-CD2 4.34Å; P167-F219 HydrophobicContact CG-CE2 4.04Å; P167-F219 WeakPolarHBondContact O-CE2 3.4Å; P167-F219 WeakPolarHBondContact O-CZ 3.48Å
168	D	94.5	Very high	97.1	Very high	155 Å²	155	62.3 Å²	62.3	83%	0.829	34%	0.336	S	S	*	.	S	Bend	trans	-63.5	-21.8	-173.4	-47.8	-76.3	0	0	0	114.2
169	K	96.1	Very high	97.2	Very high	121 Å²	121	58 Å²	58	53%	0.526	31%	0.306	S	S	.	.	S	Bend	trans	-159.4	168.6	179	60.9	-178.1	177.8	-177.3	0	110.4	P167 Y171 F219	P167-K169 PolarHBondContact O-N 3.3Å; P167-K169 VanDerWaalsContact O-N 3.1Å; K169-Y171 HydrophobicContact CD-CE1 4.36Å; K169-Y171 VanDerWaalsContact CE-CZ 3.45Å; K169-Y171 WeakPolarHBondContact CE-OH 3.37Å; K169-Y171 HydrophobicContact CG-CD2 4.14Å; K169-Y171 HydrophobicContact CG-CE1 4.12Å; K169-Y171 HydrophobicContact CG-CE2 3.63Å; K169-Y171 WeakPolarHBondContact O-CD2 3.22Å; K169-Y171 WeakPolarHBondContact O-CE2 3.44Å; K169-Y171 PolarHBondContact O-N 3.27Å; K169-F219 VanDerWaalsContact C-CE2 3.47Å; K169-F219 VanDerWaalsContact O-CE2 3.3Å; K169-F219 WeakPolarHBondContact O-CE2 3.45Å
170	N	97.9	Very high	97.2	Very high	28 Å²	28	58 Å²	58	15%	0.15	31%	0.306	C	S	.	.			trans	-67.1	122.4	170.1	-167.2	-11.3	0	0	0	110.5	F172 V197 G199 F219	N170-F172 WeakPolarHBondContact OD1-CD2 3.38Å; N170-F172 PolarHBondContact OD1-N 2.99Å; N170-F172 VanDerWaalsContact OD1-N 3.09Å; N170-V197 WeakPolarHBondContact ND2-CG1 3.39Å; N170-G199 VanDerWaalsContact CB-O 3.27Å; N170-G199 WeakPolarHBondContact CB-O 3.31Å; N170-G199 PolarHBondContact ND2-O 3.26Å; N170-F219 HydrophobicContact CB-CB 3.99Å; N170-F219 HydrophobicContact CB-CD1 4.01Å; N170-F219 HydrophobicContact CB-CD2 4.36Å; N170-F219 HydrophobicContact CB-CG 3.85Å
171	Y	97.6	Very high	97.2	Very high	89 Å²	89	56.7 Å²	56.7	35%	0.349	30%	0.301	S	S	.	.			trans	-110.3	-2.8	178.6	-72.2	-83	0	0	0	113.3	C51 P167 K169	C51-Y171 VanDerWaalsContact SG-CB 3.52Å; P167-Y171 HydrophobicContact CB-CD2 4.13Å; P167-Y171 HydrophobicContact CB-CE2 4.18Å; K169-Y171 HydrophobicContact CD-CE1 4.36Å; K169-Y171 VanDerWaalsContact CE-CZ 3.45Å; K169-Y171 WeakPolarHBondContact CE-OH 3.37Å; K169-Y171 HydrophobicContact CG-CD2 4.14Å; K169-Y171 HydrophobicContact CG-CE1 4.12Å; K169-Y171 HydrophobicContact CG-CE2 3.63Å; K169-Y171 WeakPolarHBondContact O-CD2 3.22Å; K169-Y171 WeakPolarHBondContact O-CE2 3.44Å; K169-Y171 PolarHBondContact O-N 3.27Å
172	F	98.4	Very high	97.1	Very high	10 Å²	10	54.5 Å²	54.5	4%	0.044	29%	0.291	C	S	.	.			trans	-70.8	154.5	178.9	-68.5	-81.2	0	0	0	112	A47 C51 F52 N170 L178 V194 V197 I202 F219 I224	A47-F172 HydrophobicContact CB-CD1 3.81Å; A47-F172 HydrophobicContact CB-CE1 3.6Å; C51-F172 HydrophobicContact CB-CD1 4Å; C51-F172 HydrophobicContact CB-CD2 4.01Å; C51-F172 HydrophobicContact CB-CE1 3.69Å; C51-F172 HydrophobicContact CB-CE2 3.7Å; C51-F172 HydrophobicContact CB-CG 4.16Å; C51-F172 HydrophobicContact CB-CZ 3.52Å; C51-F172 WeakPolarHBondContact O-CE2 3.4Å; F52-F172 HydrophobicContact CD1-CE1 4.4Å; F52-F172 AromaticContact CD1-CZ 3.77Å; F52-F172 HydrophobicContact CD1-CZ 3.77Å; F52-F172 HydrophobicContact CD2-CZ 4.31Å; F52-F172 AromaticContact CE1-CE1 3.79Å; F52-F172 HydrophobicContact CE1-CE1 3.79Å; F52-F172 AromaticContact CE1-CZ 3.58Å; F52-F172 HydrophobicContact CE1-CZ 3.58Å; F52-F172 HydrophobicContact CE2-CE1 4.03Å; F52-F172 HydrophobicContact CE2-CZ 4.15Å; F52-F172 HydrophobicContact CG-CZ 4.14Å; F52-F172 AromaticContact CZ-CE1 3.59Å; F52-F172 HydrophobicContact CZ-CE1 3.59Å; F52-F172 AromaticContact CZ-CZ 3.8Å; F52-F172 HydrophobicContact CZ-CZ 3.8Å; N170-F172 WeakPolarHBondContact OD1-CD2 3.38Å; N170-F172 PolarHBondContact OD1-N 2.99Å; N170-F172 VanDerWaalsContact OD1-N 3.09Å; F172-L178 HydrophobicContact CD1-CD2 4.22Å; F172-L178 HydrophobicContact CE1-CD2 3.69Å; F172-L178 HydrophobicContact CZ-CD2 4.38Å; F172-V194 HydrophobicContact CB-CG2 4.43Å; F172-V194 HydrophobicContact CD1-CG2 3.91Å; F172-V194 HydrophobicContact CG-CG2 4.45Å; F172-V197 HydrophobicContact CB-CG2 4.37Å; F172-I202 HydrophobicContact CB-CG2 3.83Å; F172-I202 HydrophobicContact CD1-CD1 4.36Å; F172-I202 HydrophobicContact CD2-CD1 4.01Å; F172-I202 HydrophobicContact CD2-CG2 3.9Å; F172-I202 HydrophobicContact CE1-CD1 4.4Å; F172-I202 HydrophobicContact CE2-CD1 4.05Å; F172-I202 HydrophobicContact CG-CD1 4.17Å; F172-I202 HydrophobicContact CG-CG2 4.08Å; F172-I202 HydrophobicContact CZ-CD1 4.26Å; F172-F219 HydrophobicContact CD2-CB 4.09Å; F172-F219 HydrophobicContact CE2-CB 4.21Å; F172-I224 HydrophobicContact CE2-CD1 4.05Å; F172-I224 HydrophobicContact CZ-CD1 3.9Å
173	Q	98.1	Very high	96.9	Very high	123 Å²	123	50.2 Å²	50.2	58%	0.575	27%	0.269	S	S	*	.			trans	-135.2	149.5	174.4	-57.5	179.6	2.9	0	0	109.2	M176	Q173-M176 HydrophobicContact CB-CE 3.89Å; Q173-M176 HydrophobicContact CB-CG 4.26Å; Q173-M176 HydrophobicContact CB-SD 4.07Å; Q173-M176 HydrophobicContact CG-CE 3.81Å; Q173-M176 HydrophobicContact CG-SD 4.4Å; Q173-M176 PolarHBondContact N-SD 3.03Å; Q173-M176 VanDerWaalsContact N-SD 3.38Å; Q173-M176 WeakPolarHBondContact O-CB 3.3Å; Q173-M176 WeakPolarHBondContact O-CG 3.33Å; Q173-M176 PolarHBondContact O-N 3.5Å
174	P	98.3	Very high	96.6	Very high	85 Å²	85	54.2 Å²	54.2	55%	0.552	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	140.5	172.3	-25.9	35.9	0	0	0	112.1	M176 V194 V197	P174-M176 VanDerWaalsContact C-N 3.34Å; P174-V194 CarbonylContact C-O 2.99Å; P174-V194 WeakPolarHBondContact CA-O 3.39Å; P174-V197 HydrophobicContact CG-CG2 4.29Å
175	G	97.4	Very high	96.3	Very high	41 Å²	41	55.9 Å²	55.9	42%	0.423	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	-10.1	-176.2	0	0	0	0	0	115.4	V194	G175-V194 PolarHBondContact N-O 3.14Å
176	M	98.6	Very high	96.2	Very high	29 Å²	29	53 Å²	53	14%	0.143	27%	0.273	C	S	.	.			trans	-69	136.3	173.7	-71.7	-176.7	169.6	0	0	111.6	V45 A47 Q173 P174 T193 V194	V45-M176 CarbonylContact O-C 3.54Å; V45-M176 WeakPolarHBondContact O-CA 3.02Å; A47-M176 HydrophobicContact CB-CB 4.09Å; A47-M176 HydrophobicContact CB-SD 4.13Å; Q173-M176 HydrophobicContact CB-CE 3.89Å; Q173-M176 HydrophobicContact CB-CG 4.26Å; Q173-M176 HydrophobicContact CB-SD 4.07Å; Q173-M176 HydrophobicContact CG-CE 3.81Å; Q173-M176 HydrophobicContact CG-SD 4.4Å; Q173-M176 PolarHBondContact N-SD 3.03Å; Q173-M176 VanDerWaalsContact N-SD 3.38Å; Q173-M176 WeakPolarHBondContact O-CB 3.3Å; Q173-M176 WeakPolarHBondContact O-CG 3.33Å; Q173-M176 PolarHBondContact O-N 3.5Å; P174-M176 VanDerWaalsContact C-N 3.34Å; M176-T193 WeakPolarHBondContact O-CA 3.35Å; M176-V194 HydrophobicContact CB-CG2 4.33Å; M176-V194 PolarHBondContact O-N 3.41Å
177	K	98.6	Very high	96	Very high	10 Å²	10	55.7 Å²	55.7	4%	0.043	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	146.3	175.1	-66.8	-164	178.4	-67.5	0	113	W35 Y38 L39 T42 S44 V45 A46 A47 A192 T193 D207	W35-K177 HydrophobicContact CH2-CB 4.34Å; W35-K177 HydrophobicContact CZ3-CB 4.04Å; W35-K177 HydrophobicContact CZ3-CD 4.05Å; Y38-K177 HydrophobicContact CD1-CD 4.26Å; Y38-K177 HydrophobicContact CE1-CD 3.91Å; L39-K177 HydrophobicContact CD2-CB 4.13Å; L39-K177 HydrophobicContact CD2-CD 4.06Å; L39-K177 HydrophobicContact CD2-CG 4.39Å; T42-K177 VanDerWaalsContact OG1-CE 3.24Å; T42-K177 WeakPolarHBondContact OG1-CE 3.13Å; S44-K177 WeakPolarHBondContact OG-CE 3.16Å; V45-K177 PolarHBondContact O-N 2.65Å; A46-K177 WeakPolarHBondContact CA-O 3.24Å; A47-K177 PolarHBondContact N-O 3.11Å; K177-A192 CarbonylContact C-O 3.59Å; K177-A192 WeakPolarHBondContact CA-O 3.43Å; K177-T193 PolarHBondContact NZ-OG1 3.39Å; K177-D207 IonicContact NZ-OD1 2.82Å; K177-D207 IonicContact NZ-OD2 2.71Å; K177-D207 PolarHBondContact NZ-OD2 3.31Å
178	L	98.8	Very high	95.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	173.9	-178.9	59.5	80.8	0	0	0	111.5	F52 F172 A180 A192 V194 I202 V204 I224	F52-L178 HydrophobicContact CE1-CB 4Å; F52-L178 HydrophobicContact CE1-CD2 4.29Å; F52-L178 HydrophobicContact CZ-CB 3.73Å; F52-L178 HydrophobicContact CZ-CD2 4.42Å; F172-L178 HydrophobicContact CD1-CD2 4.22Å; F172-L178 HydrophobicContact CE1-CD2 3.69Å; F172-L178 HydrophobicContact CZ-CD2 4.38Å; L178-A180 HydrophobicContact CD1-CB 3.76Å; L178-A192 HydrophobicContact CD1-CB 3.98Å; L178-A192 PolarHBondContact N-O 3.36Å; L178-A192 PolarHBondContact O-N 3.43Å; L178-V194 HydrophobicContact CD2-CG2 3.65Å; L178-I202 HydrophobicContact CD2-CD1 4.2Å; L178-V204 HydrophobicContact CD1-CG1 4.45Å; L178-I224 HydrophobicContact CD1-CB 4.46Å; L178-I224 HydrophobicContact CD1-CG2 4.2Å
179	E	98.6	Very high	96	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	131.1	169.8	-73.3	179.1	-162.6	0	0	109.7	W35 I189 I224 F225 G228 W229 C230 L237	W35-E179 HydrophobicContact CZ2-CG 3.59Å; W35-E179 PolarHBondContact NE1-OE1 2.77Å; E179-I189 HydrophobicContact CB-CG2 3.83Å; E179-I224 CarbonylContact O-C 3.55Å; E179-I224 WeakPolarHBondContact O-CA 3.45Å; E179-F225 HydrophobicContact CB-CB 4.07Å; E179-F225 PolarHBondContact N-O 3.03Å; E179-F225 PolarHBondContact O-N 2.95Å; E179-G228 WeakPolarHBondContact OE1-CA 3.31Å; E179-G228 PolarHBondContact OE1-N 3.03Å; E179-W229 PolarHBondContact OE1-N 2.56Å; E179-W229 PolarHBondContact OE2-N 3.37Å; E179-C230 WeakPolarHBondContact OE2-CB 3.47Å; E179-C230 PolarHBondContact OE2-N 2.94Å; E179-C230 PolarHBondContact OE2-SG 2.98Å; E179-L237 HydrophobicContact CG-CD1 3.84Å
180	A	98.6	Very high	96	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	145.7	-176	0	0	0	0	0	113.1	L178 I189 C190 A192 V204 F206 I224	L178-A180 HydrophobicContact CD1-CB 3.76Å; A180-I189 CarbonylContact O-C 3.58Å; A180-I189 VanDerWaalsContact O-CA 3.32Å; A180-I189 WeakPolarHBondContact O-CA 3.48Å; A180-C190 PolarHBondContact N-O 2.83Å; A180-C190 PolarHBondContact O-N 3.21Å; A180-A192 HydrophobicContact CB-CB 3.89Å; A180-V204 HydrophobicContact CB-CG1 3.62Å; A180-F206 HydrophobicContact CB-CE1 3.88Å; A180-F206 HydrophobicContact CB-CZ 3.92Å; A180-I224 HydrophobicContact CB-CG2 4.3Å
181	V	97.9	Very high	96	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	127.4	172.2	-179.3	0	0	0	0	110.2	R183 P186 L188 I189 Y215 D223 F225	V181-R183 PolarHBondContact O-N 3.35Å; V181-R183 VanDerWaalsContact O-N 3.12Å; V181-P186 HydrophobicContact CG1-CB 4.03Å; V181-L188 WeakPolarHBondContact CA-O 3.32Å; V181-I189 HydrophobicContact CG2-CG1 4.07Å; V181-Y215 WeakPolarHBondContact O-CE1 3.45Å; V181-Y215 PolarHBondContact O-OH 2.83Å; V181-Y215 VanDerWaalsContact O-OH 3.09Å; V181-D223 HydrophobicContact CB-CB 4.03Å; V181-D223 HydrophobicContact CG2-CB 3.92Å; V181-D223 WeakPolarHBondContact CG2-O 3.48Å; V181-D223 PolarHBondContact N-O 3.37Å; V181-F225 HydrophobicContact CG2-CE2 3.88Å
182	D	95.3	Very high	96	Very high	8 Å²	8	38 Å²	38	4%	0.043	19%	0.194	C	C	.	.			trans	-68.3	111.3	167	177	2.8	0	0	0	109.6	K184 N185 P186 L188 F213	D182-K184 PolarHBondContact O-N 3.02Å; D182-K184 VanDerWaalsContact O-N 3.16Å; D182-K184 WeakPolarHBondContact OD1-CA 3.16Å; D182-K184 WeakPolarHBondContact OD1-CB 3.31Å; D182-K184 PolarHBondContact OD1-N 3.37Å; D182-N185 HydrophobicContact CB-CB 4.26Å; D182-N185 CarbonylContact O-C 3.49Å; D182-N185 PolarHBondContact O-N 3.27Å; D182-N185 PolarHBondContact OD1-N 3.35Å; D182-N185 WeakPolarHBondContact OD2-CB 3.48Å; D182-N185 PolarHBondContact OD2-N 3.42Å; D182-N185 PolarHBondContact OD2-ND2 3.42Å; D182-P186 VanDerWaalsContact O-CA 3.23Å; D182-P186 WeakPolarHBondContact O-CA 3.34Å; D182-P186 VanDerWaalsContact O-N 3.07Å; D182-L188 HydrophobicContact CB-CB 4.38Å; D182-L188 PolarHBondContact N-O 3.18Å; D182-F213 WeakPolarHBondContact OD2-CD1 3.22Å
183	R	92.1	Very high	96	Very high	112 Å²	112	38.3 Å²	38.3	42%	0.423	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.1	178.4	-73.9	-178.5	175.1	167.7	0.8	113.9	V181 Y215 W216 C217	V181-R183 PolarHBondContact O-N 3.35Å; V181-R183 VanDerWaalsContact O-N 3.12Å; R183-Y215 HydrophobicContact CB-CD1 4.33Å; R183-Y215 HydrophobicContact CB-CE1 4.4Å; R183-Y215 HydrophobicContact CG-CD1 3.86Å; R183-Y215 HydrophobicContact CG-CE1 3.7Å; R183-Y215 HydrophobicContact CG-CG 4.47Å; R183-W216 PolarHBondContact NH1-O 2.99Å; R183-W216 PolarHBondContact NH2-O 2.82Å; R183-C217 VanDerWaalsContact NH2-CB 3.3Å
184	K	89.4	Confident	96	Very high	135 Å²	135	32.5 Å²	32.5	59%	0.587	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-26.7	173.9	-65.2	179.9	173.9	179.5	0	112.4	D182 A212 F213	D182-K184 PolarHBondContact O-N 3.02Å; D182-K184 VanDerWaalsContact O-N 3.16Å; D182-K184 WeakPolarHBondContact OD1-CA 3.16Å; D182-K184 WeakPolarHBondContact OD1-CB 3.31Å; D182-K184 PolarHBondContact OD1-N 3.37Å; K184-A212 PolarHBondContact NZ-O 2.9Å; K184-F213 HydrophobicContact CB-CD1 4.36Å; K184-F213 HydrophobicContact CB-CE1 4.48Å; K184-F213 HydrophobicContact CD-CD1 3.87Å; K184-F213 HydrophobicContact CD-CE1 4.05Å
185	N	91.3	Very high	96	Very high	55 Å²	55	29.7 Å²	29.7	29%	0.294	16%	0.156	S	C	.	.	S	Bend	trans	-131.8	68.8	178.8	-61.5	-74.1	0	0	0	110.7	D182 Y187 L188	D182-N185 HydrophobicContact CB-CB 4.26Å; D182-N185 CarbonylContact O-C 3.49Å; D182-N185 PolarHBondContact O-N 3.27Å; D182-N185 PolarHBondContact OD1-N 3.35Å; D182-N185 WeakPolarHBondContact OD2-CB 3.48Å; D182-N185 PolarHBondContact OD2-N 3.42Å; D182-N185 PolarHBondContact OD2-ND2 3.42Å; N185-Y187 HydrophobicContact CB-CD1 4.14Å; N185-Y187 HydrophobicContact CB-CE1 3.63Å; N185-Y187 PolarHBondContact O-N 3.16Å; N185-L188 HydrophobicContact CB-CD1 3.81Å; N185-L188 HydrophobicContact CB-CG 4.02Å; N185-L188 WeakPolarHBondContact O-CB 3.32Å; N185-L188 PolarHBondContact O-N 2.85Å
186	P	91.5	Very high	96	Very high	47 Å²	47	31.3 Å²	31.3	31%	0.305	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-2.8	-163.7	-24.5	36.4	0	0	0	116.7	R92 V181 D182 L188	R92-P186 PolarHBondContact NH1-O 3.18Å; R92-P186 PolarHBondContact NH2-O 2.98Å; V181-P186 HydrophobicContact CG1-CB 4.03Å; D182-P186 VanDerWaalsContact O-CA 3.23Å; D182-P186 WeakPolarHBondContact O-CA 3.34Å; D182-P186 VanDerWaalsContact O-N 3.07Å; P186-L188 VanDerWaalsContact C-N 3.32Å
187	Y	90.9	Very high	96	Very high	102 Å²	102	32 Å²	32	40%	0.4	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-16	168.9	69.6	-85.1	0	0	0	113.1	N185	N185-Y187 HydrophobicContact CB-CD1 4.14Å; N185-Y187 HydrophobicContact CB-CE1 3.63Å; N185-Y187 PolarHBondContact O-N 3.16Å
188	L	93.9	Very high	96	Very high	27 Å²	27	38.1 Å²	38.1	14%	0.141	18%	0.181	C	C	.	.			trans	-91.5	143	175.8	-58.1	-176.4	0	0	0	111.1	V181 D182 N185 P186 Q238	V181-L188 WeakPolarHBondContact CA-O 3.32Å; D182-L188 HydrophobicContact CB-CB 4.38Å; D182-L188 PolarHBondContact N-O 3.18Å; N185-L188 HydrophobicContact CB-CD1 3.81Å; N185-L188 HydrophobicContact CB-CG 4.02Å; N185-L188 WeakPolarHBondContact O-CB 3.32Å; N185-L188 PolarHBondContact O-N 2.85Å; P186-L188 VanDerWaalsContact C-N 3.32Å; L188-Q238 HydrophobicContact CB-CG 4.29Å; L188-Q238 HydrophobicContact CD1-CG 4.38Å; L188-Q238 HydrophobicContact CD2-CG 3.71Å; L188-Q238 HydrophobicContact CG-CG 4.35Å
189	I	96.4	Very high	95.8	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.6	157.9	-62.4	175	0	0	0	106.7	E179 A180 V181 F225 C230 L237 Q238	E179-I189 HydrophobicContact CB-CG2 3.83Å; A180-I189 CarbonylContact O-C 3.58Å; A180-I189 VanDerWaalsContact O-CA 3.32Å; A180-I189 WeakPolarHBondContact O-CA 3.48Å; V181-I189 HydrophobicContact CG2-CG1 4.07Å; I189-F225 HydrophobicContact CD1-CD2 4.08Å; I189-F225 HydrophobicContact CD1-CE2 3.62Å; I189-F225 HydrophobicContact CD1-CZ 4.32Å; I189-F225 HydrophobicContact CG1-CE2 4.36Å; I189-F225 HydrophobicContact CG2-CD2 4.42Å; I189-C230 VanDerWaalsContact CG2-SG 3.51Å; I189-L237 HydrophobicContact CG2-CD1 4.07Å; I189-Q238 PolarHBondContact O-N 2.93Å
190	C	96.4	Very high	95.7	Very high	10 Å²	10	46.7 Å²	46.7	7%	0.068	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	152.1	-171.9	-56.9	0	0	0	0	111	A180 A192 F206	A180-C190 PolarHBondContact N-O 2.83Å; A180-C190 PolarHBondContact O-N 3.21Å; C190-A192 PolarHBondContact O-N 2.92Å; C190-F206 HydrophobicContact CB-CD1 3.73Å; C190-F206 HydrophobicContact CB-CE1 3.9Å
191	P	97.8	Very high	95.7	Very high	1 Å²	1	51 Å²	51	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	131.3	160.7	-28.7	37.8	0	0	0	111.5	F33 W35 D207 L237 Q238 P240	F33-P191 HydrophobicContact CE1-CG 3.73Å; F33-P191 HydrophobicContact CE2-CG 4.28Å; F33-P191 HydrophobicContact CZ-CB 4.31Å; F33-P191 HydrophobicContact CZ-CG 3.59Å; W35-P191 HydrophobicContact CH2-CB 3.54Å; W35-P191 HydrophobicContact CH2-CG 4.05Å; W35-P191 HydrophobicContact CZ2-CB 3.84Å; W35-P191 HydrophobicContact CZ2-CG 3.87Å; W35-P191 HydrophobicContact CZ3-CB 4.3Å; P191-D207 HydrophobicContact CB-CB 4.34Å; P191-D207 PolarHBondContact O-N 2.91Å; P191-D207 VanDerWaalsContact O-N 3.15Å; P191-L237 HydrophobicContact CG-CD1 4.44Å; P191-L237 HydrophobicContact CG-CD2 4.47Å; P191-L237 HydrophobicContact CG-CG 4.49Å; P191-Q238 WeakPolarHBondContact CD-O 3.21Å; P191-P240 HydrophobicContact CB-CG 4.23Å; P191-P240 HydrophobicContact CG-CG 4.23Å
192	A	98.3	Very high	95.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	157	178.4	0	0	0	0	0	110.7	K177 L178 A180 C190 V204 M205 F206	K177-A192 CarbonylContact C-O 3.59Å; K177-A192 WeakPolarHBondContact CA-O 3.43Å; L178-A192 HydrophobicContact CD1-CB 3.98Å; L178-A192 PolarHBondContact N-O 3.36Å; L178-A192 PolarHBondContact O-N 3.43Å; A180-A192 HydrophobicContact CB-CB 3.89Å; C190-A192 PolarHBondContact O-N 2.92Å; A192-V204 HydrophobicContact CB-CG1 3.74Å; A192-M205 CarbonylContact C-O 3.54Å; A192-M205 WeakPolarHBondContact CA-O 3.44Å; A192-M205 WeakPolarHBondContact CB-O 3.46Å; A192-F206 HydrophobicContact CB-CD1 4.29Å; A192-F206 HydrophobicContact CB-CE1 4.45Å
193	T	98.4	Very high	95.9	Very high	17 Å²	17	52.8 Å²	52.8	10%	0.104	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138	177.9	-56.9	0	0	0	0	109.6	M176 K177 G195 M205 D207	M176-T193 WeakPolarHBondContact O-CA 3.35Å; K177-T193 PolarHBondContact NZ-OG1 3.39Å; T193-G195 PolarHBondContact O-N 2.9Å; T193-M205 PolarHBondContact N-O 3.02Å; T193-M205 PolarHBondContact O-N 2.62Å; T193-D207 WeakPolarHBondContact CB-OD1 3.49Å; T193-D207 PolarHBondContact N-OD1 3.35Å; T193-D207 PolarHBondContact OG1-OD1 3.43Å; T193-D207 PolarHBondContact OG1-OD2 2.8Å
194	V	98.7	Very high	96.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	110.1	169.5	179.6	0	0	0	0	108.3	F172 P174 G175 M176 L178 V197 I202 F203	F172-V194 HydrophobicContact CB-CG2 4.43Å; F172-V194 HydrophobicContact CD1-CG2 3.91Å; F172-V194 HydrophobicContact CG-CG2 4.45Å; P174-V194 CarbonylContact C-O 2.99Å; P174-V194 WeakPolarHBondContact CA-O 3.39Å; G175-V194 PolarHBondContact N-O 3.14Å; M176-V194 HydrophobicContact CB-CG2 4.33Å; M176-V194 PolarHBondContact O-N 3.41Å; L178-V194 HydrophobicContact CD2-CG2 3.65Å; V194-V197 HydrophobicContact CG1-CG2 3.65Å; V194-I202 HydrophobicContact CG1-CB 4.37Å; V194-I202 HydrophobicContact CG2-CD1 4.3Å; V194-F203 CarbonylContact C-O 3.57Å; V194-F203 WeakPolarHBondContact CA-O 3.11Å
195	G	97.3	Very high	96.6	Very high	26 Å²	26	44.2 Å²	44.2	27%	0.268	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-39.6	179	0	0	0	0	0	113.3	T193 F203 M205	T193-G195 PolarHBondContact O-N 2.9Å; G195-F203 PolarHBondContact N-O 2.9Å; G195-M205 VanDerWaalsContact CA-CE 3.45Å
196	E	97.9	Very high	96.8	Very high	75 Å²	75	41.9 Å²	41.9	35%	0.35	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	158.2	-176.2	-158.7	-170.9	153.8	0	0	110.1	R198 F203 W216	E196-R198 IonicContact OE1-CZ 3.22Å; E196-R198 IonicContact OE1-NE 2.71Å; E196-R198 PolarHBondContact OE1-NE 3.37Å; E196-R198 IonicContact OE1-NH2 2.89Å; E196-R198 PolarHBondContact OE1-NH2 2.9Å; E196-R198 IonicContact OE2-CZ 3.49Å; E196-R198 IonicContact OE2-NE 3.63Å; E196-R198 IonicContact OE2-NH2 2.76Å; E196-R198 PolarHBondContact OE2-NH2 3.15Å; E196-F203 HydrophobicContact CB-CB 4.03Å; E196-F203 PolarHBondContact O-N 3.19Å; E196-W216 HydrophobicContact CB-CH2 3.73Å; E196-W216 HydrophobicContact CB-CZ2 4.23Å; E196-W216 HydrophobicContact CG-CH2 3.99Å
197	V	98.3	Very high	96.9	Very high	44 Å²	44	40.3 Å²	40.3	27%	0.267	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127.2	178.9	179.3	0	0	0	0	109.2	N170 F172 P174 V194 I202	N170-V197 WeakPolarHBondContact ND2-CG1 3.39Å; F172-V197 HydrophobicContact CB-CG2 4.37Å; P174-V197 HydrophobicContact CG-CG2 4.29Å; V194-V197 HydrophobicContact CG1-CG2 3.65Å; V197-I202 HydrophobicContact CG1-CG2 4.32Å; V197-I202 HydrophobicContact CG2-CG2 4.14Å
198	R	97.4	Very high	96.8	Very high	139 Å²	139	36.9 Å²	36.9	53%	0.525	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	86.7	-178.4	-72.8	-179.3	-171.9	166.5	9.8	110.7	E196 L200 E201 W216	E196-R198 IonicContact OE1-CZ 3.22Å; E196-R198 IonicContact OE1-NE 2.71Å; E196-R198 PolarHBondContact OE1-NE 3.37Å; E196-R198 IonicContact OE1-NH2 2.89Å; E196-R198 PolarHBondContact OE1-NH2 2.9Å; E196-R198 IonicContact OE2-CZ 3.49Å; E196-R198 IonicContact OE2-NE 3.63Å; E196-R198 IonicContact OE2-NH2 2.76Å; E196-R198 PolarHBondContact OE2-NH2 3.15Å; R198-L200 PolarHBondContact O-N 3.09Å; R198-E201 PolarHBondContact N-O 3.47Å; R198-E201 PolarHBondContact O-N 2.86Å; R198-W216 HydrophobicContact CB-CH2 4.11Å; R198-W216 HydrophobicContact CB-CZ3 3.81Å; R198-W216 HydrophobicContact CG-CH2 3.53Å; R198-W216 HydrophobicContact CG-CZ2 4.48Å; R198-W216 HydrophobicContact CG-CZ3 3.79Å; R198-W216 VanDerWaalsContact CZ-CZ2 3.48Å
199	G	95.6	Very high	96.7	Very high	59 Å²	59	41.8 Å²	41.8	61%	0.608	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.9	-106	178.8	0	0	0	0	0	111.7	N170	N170-G199 VanDerWaalsContact CB-O 3.27Å; N170-G199 WeakPolarHBondContact CB-O 3.31Å; N170-G199 PolarHBondContact ND2-O 3.26Å
200	L	96.5	Very high	96.2	Very high	121 Å²	121	51.4 Å²	51.4	63%	0.634	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-6.7	178.8	-52.2	-174.6	0	0	0	113.5	R198 P218 F219	R198-L200 PolarHBondContact O-N 3.09Å; L200-P218 CarbonylContact O-C 3.59Å; L200-P218 WeakPolarHBondContact O-CA 3.47Å; L200-F219 HydrophobicContact CB-CD1 4.26Å; L200-F219 HydrophobicContact CB-CE1 4.45Å; L200-F219 HydrophobicContact CD2-CD1 4.45Å; L200-F219 HydrophobicContact CD2-CE1 4.04Å; L200-F219 WeakPolarHBondContact O-CD1 3.48Å; L200-F219 PolarHBondContact O-N 2.79Å
201	E	98.1	Very high	95.7	Very high	89 Å²	89	52.6 Å²	52.6	42%	0.416	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	152.5	179.1	-59.3	-167.1	105.7	0	0	112.9	R198 W216 C217	R198-E201 PolarHBondContact N-O 3.47Å; R198-E201 PolarHBondContact O-N 2.86Å; E201-W216 HydrophobicContact CB-CE3 3.83Å; E201-W216 HydrophobicContact CB-CZ3 4.35Å; E201-C217 CarbonylContact C-O 3.6Å; E201-C217 VanDerWaalsContact CA-O 3.25Å; E201-C217 WeakPolarHBondContact CA-O 3.41Å
202	I	98.6	Very high	95.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	148	171	65	164	0	0	0	110	F172 L178 V194 V197 V204 W216 C217 I224	F172-I202 HydrophobicContact CB-CG2 3.83Å; F172-I202 HydrophobicContact CD1-CD1 4.36Å; F172-I202 HydrophobicContact CD2-CD1 4.01Å; F172-I202 HydrophobicContact CD2-CG2 3.9Å; F172-I202 HydrophobicContact CE1-CD1 4.4Å; F172-I202 HydrophobicContact CE2-CD1 4.05Å; F172-I202 HydrophobicContact CG-CD1 4.17Å; F172-I202 HydrophobicContact CG-CG2 4.08Å; F172-I202 HydrophobicContact CZ-CD1 4.26Å; L178-I202 HydrophobicContact CD2-CD1 4.2Å; V194-I202 HydrophobicContact CG1-CB 4.37Å; V194-I202 HydrophobicContact CG2-CD1 4.3Å; V197-I202 HydrophobicContact CG1-CG2 4.32Å; V197-I202 HydrophobicContact CG2-CG2 4.14Å; I202-V204 HydrophobicContact CD1-CG2 4.06Å; I202-V204 HydrophobicContact CG1-CG2 4.24Å; I202-W216 VanDerWaalsContact C-CE3 3.44Å; I202-W216 WeakPolarHBondContact O-CA 3.2Å; I202-C217 VanDerWaalsContact CG1-SG 3.57Å; I202-C217 PolarHBondContact N-O 2.82Å; I202-C217 PolarHBondContact O-N 2.93Å; I202-I224 HydrophobicContact CD1-CD1 3.82Å
203	F	98.6	Very high	94.9	Very high	49 Å²	49	57.8 Å²	57.8	22%	0.215	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	115	173	-171.3	-122.9	0	0	0	109.6	V194 G195 E196 M205 D214 W216	V194-F203 CarbonylContact C-O 3.57Å; V194-F203 WeakPolarHBondContact CA-O 3.11Å; G195-F203 PolarHBondContact N-O 2.9Å; E196-F203 HydrophobicContact CB-CB 4.03Å; E196-F203 PolarHBondContact O-N 3.19Å; F203-M205 HydrophobicContact CD1-CG 3.63Å; F203-M205 HydrophobicContact CD1-SD 4.08Å; F203-M205 HydrophobicContact CE1-CG 3.53Å; F203-M205 HydrophobicContact CE1-SD 3.92Å; F203-M205 HydrophobicContact CZ-CG 4.45Å; F203-D214 HydrophobicContact CE1-CB 4.26Å; F203-D214 HydrophobicContact CE2-CB 3.92Å; F203-D214 HydrophobicContact CZ-CB 3.53Å; F203-W216 HydrophobicContact CB-CD2 3.94Å; F203-W216 HydrophobicContact CB-CE3 3.98Å; F203-W216 HydrophobicContact CB-CH2 3.76Å; F203-W216 HydrophobicContact CB-CZ2 3.7Å; F203-W216 HydrophobicContact CB-CZ3 3.9Å; F203-W216 AromaticContact CD2-CD1 3.6Å; F203-W216 AromaticContact CD2-CD2 3.97Å; F203-W216 HydrophobicContact CD2-CD2 3.97Å; F203-W216 AromaticContact CD2-CE2 3.65Å; F203-W216 AromaticContact CD2-CG 3.95Å; F203-W216 HydrophobicContact CD2-CG 3.95Å; F203-W216 HydrophobicContact CD2-CZ2 4.25Å; F203-W216 AromaticContact CD2-NE1 3.38Å; F203-W216 AromaticContact CE2-NE1 3.9Å; F203-W216 HydrophobicContact CG-CD2 4.37Å; F203-W216 AromaticContact CG-CE2 3.94Å; F203-W216 HydrophobicContact CG-CZ2 4.09Å
204	V	98.6	Very high	94.7	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116.3	-179	177.8	0	0	0	0	108.7	L178 A180 A192 I202 F206 D214 Y215 I224	L178-V204 HydrophobicContact CD1-CG1 4.45Å; A180-V204 HydrophobicContact CB-CG1 3.62Å; A192-V204 HydrophobicContact CB-CG1 3.74Å; I202-V204 HydrophobicContact CD1-CG2 4.06Å; I202-V204 HydrophobicContact CG1-CG2 4.24Å; V204-F206 HydrophobicContact CG1-CE2 4.29Å; V204-F206 HydrophobicContact CG1-CZ 4.32Å; V204-D214 WeakPolarHBondContact O-CA 3.41Å; V204-D214 VanDerWaalsContact O-CB 3.3Å; V204-D214 WeakPolarHBondContact O-CB 3.11Å; V204-Y215 HydrophobicContact CB-CD2 4.15Å; V204-Y215 HydrophobicContact CB-CE2 3.88Å; V204-Y215 HydrophobicContact CG1-CE2 4.33Å; V204-Y215 HydrophobicContact CG2-CD2 4.34Å; V204-Y215 HydrophobicContact CG2-CE2 3.84Å; V204-Y215 PolarHBondContact N-O 2.93Å; V204-Y215 PolarHBondContact O-N 3.37Å; V204-Y215 VanDerWaalsContact O-N 3.1Å; V204-I224 HydrophobicContact CG2-CG2 4.15Å
205	M	97.8	Very high	94.7	Very high	66 Å²	66	59.6 Å²	59.6	33%	0.325	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.1	176.9	-54	-174.1	-50	0	0	111	A192 T193 G195 F203 D214	A192-M205 CarbonylContact C-O 3.54Å; A192-M205 WeakPolarHBondContact CA-O 3.44Å; A192-M205 WeakPolarHBondContact CB-O 3.46Å; T193-M205 PolarHBondContact N-O 3.02Å; T193-M205 PolarHBondContact O-N 2.62Å; G195-M205 VanDerWaalsContact CA-CE 3.45Å; F203-M205 HydrophobicContact CD1-CG 3.63Å; F203-M205 HydrophobicContact CD1-SD 4.08Å; F203-M205 HydrophobicContact CE1-CG 3.53Å; F203-M205 HydrophobicContact CE1-SD 3.92Å; F203-M205 HydrophobicContact CZ-CG 4.45Å; M205-D214 VanDerWaalsContact CA-CG 3.46Å; M205-D214 WeakPolarHBondContact CB-OD2 3.47Å; M205-D214 WeakPolarHBondContact CG-OD2 3.34Å
206	F	96.6	Very high	94.7	Very high	7 Å²	7	61.5 Å²	61.5	3%	0.031	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	123.2	-176.2	-75.3	-83.9	0	0	0	112.9	A180 C190 A192 V204 G208 W209 F213 D214 Y215	A180-F206 HydrophobicContact CB-CE1 3.88Å; A180-F206 HydrophobicContact CB-CZ 3.92Å; C190-F206 HydrophobicContact CB-CD1 3.73Å; C190-F206 HydrophobicContact CB-CE1 3.9Å; A192-F206 HydrophobicContact CB-CD1 4.29Å; A192-F206 HydrophobicContact CB-CE1 4.45Å; V204-F206 HydrophobicContact CG1-CE2 4.29Å; V204-F206 HydrophobicContact CG1-CZ 4.32Å; F206-G208 PolarHBondContact O-N 2.72Å; F206-W209 HydrophobicContact CB-CB 4.11Å; F206-W209 HydrophobicContact CB-CG 4.23Å; F206-W209 PolarHBondContact O-N 3.17Å; F206-F213 HydrophobicContact CD2-CB 3.69Å; F206-F213 HydrophobicContact CE2-CB 4.26Å; F206-F213 WeakPolarHBondContact CE2-O 3.38Å; F206-F213 HydrophobicContact CG-CB 4.27Å; F206-D214 PolarHBondContact N-OD1 3.16Å; F206-Y215 AromaticContact CE2-CD1 3.98Å; F206-Y215 HydrophobicContact CE2-CD1 3.98Å; F206-Y215 AromaticContact CE2-CE1 3.64Å; F206-Y215 HydrophobicContact CE2-CE1 3.64Å; F206-Y215 AromaticContact CZ-CE1 3.74Å; F206-Y215 HydrophobicContact CZ-CE1 3.74Å
207	D	93.6	Very high	94.7	Very high	13 Å²	13	57.9 Å²	57.9	7%	0.07	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	126.3	-170	-74.5	-0.1	0	0	0	111.5	Y38 K177 P191 T193 W209 P240 G241	Y38-D207 WeakPolarHBondContact CE1-OD2 3.17Å; Y38-D207 PolarHBondContact OH-OD2 3.02Å; K177-D207 IonicContact NZ-OD1 2.82Å; K177-D207 IonicContact NZ-OD2 2.71Å; K177-D207 PolarHBondContact NZ-OD2 3.31Å; P191-D207 HydrophobicContact CB-CB 4.34Å; P191-D207 PolarHBondContact O-N 2.91Å; P191-D207 VanDerWaalsContact O-N 3.15Å; T193-D207 WeakPolarHBondContact CB-OD1 3.49Å; T193-D207 PolarHBondContact N-OD1 3.35Å; T193-D207 PolarHBondContact OG1-OD1 3.43Å; T193-D207 PolarHBondContact OG1-OD2 2.8Å; D207-W209 VanDerWaalsContact C-N 3.31Å; D207-W209 PolarHBondContact O-N 3.2Å; D207-P240 HydrophobicContact CB-CB 4.05Å; D207-P240 HydrophobicContact CB-CG 4.36Å; D207-P240 CarbonylContact O-C 3.5Å; D207-P240 WeakPolarHBondContact O-CA 3.38Å; D207-P240 WeakPolarHBondContact O-CB 3.36Å; D207-G241 PolarHBondContact O-N 3.21Å
208	G	88.9	Confident	94.7	Very high	30 Å²	30	58.6 Å²	58.6	31%	0.309	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	-8.6	-175.9	0	0	0	0	0	115.6	F206 R210 N242	F206-G208 PolarHBondContact O-N 2.72Å; G208-R210 PolarHBondContact O-NH1 2.8Å; G208-N242 PolarHBondContact O-OD1 2.98Å
209	W	90.1	Very high	94.8	Very high	130 Å²	130	52.8 Å²	52.8	49%	0.492	28%	0.282	S	S	.	.	S	Bend	trans	-92.9	156.5	-179.8	-65.4	90	0	0	0	112.5	F206 D207 G211 F213	F206-W209 HydrophobicContact CB-CB 4.11Å; F206-W209 HydrophobicContact CB-CG 4.23Å; F206-W209 PolarHBondContact O-N 3.17Å; D207-W209 VanDerWaalsContact C-N 3.31Å; D207-W209 PolarHBondContact O-N 3.2Å; W209-G211 PolarHBondContact O-N 3.02Å; W209-G211 VanDerWaalsContact O-N 3.09Å; W209-F213 HydrophobicContact CB-CD2 4.24Å; W209-F213 HydrophobicContact CD2-CD2 4.24Å; W209-F213 HydrophobicContact CD2-CE2 4.17Å; W209-F213 AromaticContact CE3-CD2 3.99Å; W209-F213 HydrophobicContact CE3-CD2 3.99Å; W209-F213 AromaticContact CE3-CE2 3.5Å; W209-F213 HydrophobicContact CE3-CE2 3.5Å; W209-F213 VanDerWaalsContact CE3-CE2 3.5Å; W209-F213 HydrophobicContact CE3-CZ 4.27Å; W209-F213 HydrophobicContact CG-CD2 4.37Å; W209-F213 AromaticContact CZ3-CE2 3.92Å; W209-F213 HydrophobicContact CZ3-CE2 3.92Å; W209-F213 HydrophobicContact CZ3-CZ 4.27Å
210	R	85.8	Confident	94.9	Very high	203 Å²	203	52.3 Å²	52.3	77%	0.766	27%	0.265	S	S	*	.			trans	-85.9	44.5	-176.3	-63.6	-64.3	-173	-78.8	-3.9	112.9	G208 A212	G208-R210 PolarHBondContact O-NH1 2.8Å; R210-A212 PolarHBondContact O-N 2.91Å
211	G	86.5	Confident	94.9	Very high	35 Å²	35	47.4 Å²	47.4	36%	0.361	24%	0.241	S	C	.	.	S	Bend	trans	66.5	-10.7	177.8	0	0	0	0	0	117	W209 F213 D214	W209-G211 PolarHBondContact O-N 3.02Å; W209-G211 VanDerWaalsContact O-N 3.09Å; G211-F213 PolarHBondContact O-N 3.45Å; G211-D214 VanDerWaalsContact CA-CG 3.49Å; G211-D214 VanDerWaalsContact CA-OD2 3.31Å; G211-D214 WeakPolarHBondContact CA-OD2 3.47Å; G211-D214 WeakPolarHBondContact O-CB 3.37Å; G211-D214 PolarHBondContact O-N 2.86Å
212	A	87.6	Confident	94.9	Very high	60 Å²	60	44.6 Å²	44.6	50%	0.496	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-4.9	-173.5	0	0	0	0	0	114.9	K184 R210	K184-A212 PolarHBondContact NZ-O 2.9Å; R210-A212 PolarHBondContact O-N 2.91Å
213	F	91.4	Very high	94.9	Very high	51 Å²	51	46.8 Å²	46.8	22%	0.224	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-9.6	178.9	-62.5	-92.2	0	0	0	112.4	D182 K184 F206 W209 G211	D182-F213 WeakPolarHBondContact OD2-CD1 3.22Å; K184-F213 HydrophobicContact CB-CD1 4.36Å; K184-F213 HydrophobicContact CB-CE1 4.48Å; K184-F213 HydrophobicContact CD-CD1 3.87Å; K184-F213 HydrophobicContact CD-CE1 4.05Å; F206-F213 HydrophobicContact CD2-CB 3.69Å; F206-F213 HydrophobicContact CE2-CB 4.26Å; F206-F213 WeakPolarHBondContact CE2-O 3.38Å; F206-F213 HydrophobicContact CG-CB 4.27Å; W209-F213 HydrophobicContact CB-CD2 4.24Å; W209-F213 HydrophobicContact CD2-CD2 4.24Å; W209-F213 HydrophobicContact CD2-CE2 4.17Å; W209-F213 AromaticContact CE3-CD2 3.99Å; W209-F213 HydrophobicContact CE3-CD2 3.99Å; W209-F213 AromaticContact CE3-CE2 3.5Å; W209-F213 HydrophobicContact CE3-CE2 3.5Å; W209-F213 VanDerWaalsContact CE3-CE2 3.5Å; W209-F213 HydrophobicContact CE3-CZ 4.27Å; W209-F213 HydrophobicContact CG-CD2 4.37Å; W209-F213 AromaticContact CZ3-CE2 3.92Å; W209-F213 HydrophobicContact CZ3-CE2 3.92Å; W209-F213 HydrophobicContact CZ3-CZ 4.27Å; G211-F213 PolarHBondContact O-N 3.45Å
214	D	95.1	Very high	94.9	Very high	37 Å²	37	44.4 Å²	44.4	20%	0.198	23%	0.228	C	C	.	.			trans	-68.3	150.3	-171.4	-58.8	4.7	0	0	0	111.7	F203 V204 M205 F206 G211	F203-D214 HydrophobicContact CE1-CB 4.26Å; F203-D214 HydrophobicContact CE2-CB 3.92Å; F203-D214 HydrophobicContact CZ-CB 3.53Å; V204-D214 WeakPolarHBondContact O-CA 3.41Å; V204-D214 VanDerWaalsContact O-CB 3.3Å; V204-D214 WeakPolarHBondContact O-CB 3.11Å; M205-D214 VanDerWaalsContact CA-CG 3.46Å; M205-D214 WeakPolarHBondContact CB-OD2 3.47Å; M205-D214 WeakPolarHBondContact CG-OD2 3.34Å; F206-D214 PolarHBondContact N-OD1 3.16Å; G211-D214 VanDerWaalsContact CA-CG 3.49Å; G211-D214 VanDerWaalsContact CA-OD2 3.31Å; G211-D214 WeakPolarHBondContact CA-OD2 3.47Å; G211-D214 WeakPolarHBondContact O-CB 3.37Å; G211-D214 PolarHBondContact O-N 2.86Å
215	Y	97.9	Very high	94.9	Very high	17 Å²	17	44.4 Å²	44.4	7%	0.067	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	156.9	-178	59.8	-106.8	0	0	0	114	V181 R183 V204 F206 C217	V181-Y215 WeakPolarHBondContact O-CE1 3.45Å; V181-Y215 PolarHBondContact O-OH 2.83Å; V181-Y215 VanDerWaalsContact O-OH 3.09Å; R183-Y215 HydrophobicContact CB-CD1 4.33Å; R183-Y215 HydrophobicContact CB-CE1 4.4Å; R183-Y215 HydrophobicContact CG-CD1 3.86Å; R183-Y215 HydrophobicContact CG-CE1 3.7Å; R183-Y215 HydrophobicContact CG-CG 4.47Å; V204-Y215 HydrophobicContact CB-CD2 4.15Å; V204-Y215 HydrophobicContact CB-CE2 3.88Å; V204-Y215 HydrophobicContact CG1-CE2 4.33Å; V204-Y215 HydrophobicContact CG2-CD2 4.34Å; V204-Y215 HydrophobicContact CG2-CE2 3.84Å; V204-Y215 PolarHBondContact N-O 2.93Å; V204-Y215 PolarHBondContact O-N 3.37Å; V204-Y215 VanDerWaalsContact O-N 3.1Å; F206-Y215 AromaticContact CE2-CD1 3.98Å; F206-Y215 HydrophobicContact CE2-CD1 3.98Å; F206-Y215 AromaticContact CE2-CE1 3.64Å; F206-Y215 HydrophobicContact CE2-CE1 3.64Å; F206-Y215 AromaticContact CZ-CE1 3.74Å; F206-Y215 HydrophobicContact CZ-CE1 3.74Å; Y215-C217 HydrophobicContact CD2-CB 4.03Å; Y215-C217 HydrophobicContact CE2-CB 3.89Å
216	W	98.4	Very high	94.9	Very high	66 Å²	66	42 Å²	42	25%	0.25	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	140	163.1	-70.1	90.5	0	0	0	110.8	R183 E196 R198 E201 I202 F203	R183-W216 PolarHBondContact NH1-O 2.99Å; R183-W216 PolarHBondContact NH2-O 2.82Å; E196-W216 HydrophobicContact CB-CH2 3.73Å; E196-W216 HydrophobicContact CB-CZ2 4.23Å; E196-W216 HydrophobicContact CG-CH2 3.99Å; R198-W216 HydrophobicContact CB-CH2 4.11Å; R198-W216 HydrophobicContact CB-CZ3 3.81Å; R198-W216 HydrophobicContact CG-CH2 3.53Å; R198-W216 HydrophobicContact CG-CZ2 4.48Å; R198-W216 HydrophobicContact CG-CZ3 3.79Å; R198-W216 VanDerWaalsContact CZ-CZ2 3.48Å; E201-W216 HydrophobicContact CB-CE3 3.83Å; E201-W216 HydrophobicContact CB-CZ3 4.35Å; I202-W216 VanDerWaalsContact C-CE3 3.44Å; I202-W216 WeakPolarHBondContact O-CA 3.2Å; F203-W216 HydrophobicContact CB-CD2 3.94Å; F203-W216 HydrophobicContact CB-CE3 3.98Å; F203-W216 HydrophobicContact CB-CH2 3.76Å; F203-W216 HydrophobicContact CB-CZ2 3.7Å; F203-W216 HydrophobicContact CB-CZ3 3.9Å; F203-W216 AromaticContact CD2-CD1 3.6Å; F203-W216 AromaticContact CD2-CD2 3.97Å; F203-W216 HydrophobicContact CD2-CD2 3.97Å; F203-W216 AromaticContact CD2-CE2 3.65Å; F203-W216 AromaticContact CD2-CG 3.95Å; F203-W216 HydrophobicContact CD2-CG 3.95Å; F203-W216 HydrophobicContact CD2-CZ2 4.25Å; F203-W216 AromaticContact CD2-NE1 3.38Å; F203-W216 AromaticContact CE2-NE1 3.9Å; F203-W216 HydrophobicContact CG-CD2 4.37Å; F203-W216 AromaticContact CG-CE2 3.94Å; F203-W216 HydrophobicContact CG-CZ2 4.09Å
217	C	98.3	Very high	95	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	155.5	169.8	66.1	0	0	0	0	112	R183 E201 I202 Y215	R183-C217 VanDerWaalsContact NH2-CB 3.3Å; E201-C217 CarbonylContact C-O 3.6Å; E201-C217 VanDerWaalsContact CA-O 3.25Å; E201-C217 WeakPolarHBondContact CA-O 3.41Å; I202-C217 VanDerWaalsContact CG1-SG 3.57Å; I202-C217 PolarHBondContact N-O 2.82Å; I202-C217 PolarHBondContact O-N 2.93Å; Y215-C217 HydrophobicContact CD2-CB 4.03Å; Y215-C217 HydrophobicContact CE2-CB 3.89Å
218	P	98.3	Very high	95.1	Very high	58 Å²	58	43.7 Å²	43.7	38%	0.377	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	145.3	165.2	-23.9	34.7	0	0	0	111.8	L200 D220 S221	L200-P218 CarbonylContact O-C 3.59Å; L200-P218 WeakPolarHBondContact O-CA 3.47Å; P218-D220 PolarHBondContact O-N 3.47Å; P218-S221 WeakPolarHBondContact O-CB 3.43Å; P218-S221 PolarHBondContact O-N 2.77Å
219	F	97.8	Very high	95.5	Very high	18 Å²	18	42.5 Å²	42.5	8%	0.079	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-23.8	178.5	79.4	-85.1	0	0	0	113.7	P167 K169 N170 F172 L200	P167-F219 HydrophobicContact CB-CE2 3.94Å; P167-F219 HydrophobicContact CG-CD2 4.34Å; P167-F219 HydrophobicContact CG-CE2 4.04Å; P167-F219 WeakPolarHBondContact O-CE2 3.4Å; P167-F219 WeakPolarHBondContact O-CZ 3.48Å; K169-F219 VanDerWaalsContact C-CE2 3.47Å; K169-F219 VanDerWaalsContact O-CE2 3.3Å; K169-F219 WeakPolarHBondContact O-CE2 3.45Å; N170-F219 HydrophobicContact CB-CB 3.99Å; N170-F219 HydrophobicContact CB-CD1 4.01Å; N170-F219 HydrophobicContact CB-CD2 4.36Å; N170-F219 HydrophobicContact CB-CG 3.85Å; F172-F219 HydrophobicContact CD2-CB 4.09Å; F172-F219 HydrophobicContact CE2-CB 4.21Å; L200-F219 HydrophobicContact CB-CD1 4.26Å; L200-F219 HydrophobicContact CB-CE1 4.45Å; L200-F219 HydrophobicContact CD2-CD1 4.45Å; L200-F219 HydrophobicContact CD2-CE1 4.04Å; L200-F219 WeakPolarHBondContact O-CD1 3.48Å; L200-F219 PolarHBondContact O-N 2.79Å
220	D	97.8	Very high	95.7	Very high	48 Å²	48	36.4 Å²	36.4	26%	0.257	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	15.4	177.7	85.2	-38.7	0	0	0	113.3	K53 S166 P218	K53-D220 HydrophobicContact CB-CB 4Å; K53-D220 VanDerWaalsContact CB-O 3.25Å; K53-D220 WeakPolarHBondContact CB-O 3.48Å; K53-D220 HydrophobicContact CD-CB 4.14Å; K53-D220 VanDerWaalsContact CD-O 3.3Å; K53-D220 WeakPolarHBondContact CD-O 3.15Å; S166-D220 WeakPolarHBondContact CB-OD2 3.43Å; S166-D220 PolarHBondContact OG-OD2 3.07Å; P218-D220 PolarHBondContact O-N 3.47Å
221	S	98.1	Very high	96.1	Very high	19 Å²	19	30.7 Å²	30.7	13%	0.133	19%	0.192	C	C	.	.			trans	-58.3	138.7	176	-177.8	0	0	0	0	112.4	P218 D223 I224	P218-S221 WeakPolarHBondContact O-CB 3.43Å; P218-S221 PolarHBondContact O-N 2.77Å; S221-D223 VanDerWaalsContact C-N 3.27Å; S221-D223 PolarHBondContact O-N 3.28Å; S221-D223 PolarHBondContact OG-N 3.32Å; S221-I224 VanDerWaalsContact O-CG1 3.27Å; S221-I224 WeakPolarHBondContact O-CG1 3.27Å
222	R	97.8	Very high	96.5	Very high	29 Å²	29	34.8 Å²	34.8	11%	0.109	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.6	177.8	-54.7	-48.9	-51.6	-68.4	-2.5	114.2	K53 Q54 L109 D111 E163 F225	K53-R222 PolarHBondContact O-NE 3.25Å; K53-R222 PolarHBondContact O-NH2 2.94Å; Q54-R222 PolarHBondContact NE2-O 3.06Å; Q54-R222 VanDerWaalsContact NE2-O 3.08Å; L109-R222 HydrophobicContact CD1-CB 4.16Å; D111-R222 PolarHBondContact O-NH1 3.31Å; D111-R222 IonicContact OD1-CZ 2.75Å; D111-R222 VanDerWaalsContact OD1-CZ 3.25Å; D111-R222 IonicContact OD1-NH1 3.75Å; D111-R222 PolarHBondContact OD1-NH1 3.34Å; D111-R222 IonicContact OD1-NH2 2.8Å; D111-R222 PolarHBondContact OD1-NH2 3.08Å; D111-R222 IonicContact OD2-CZ 3.7Å; D111-R222 IonicContact OD2-NH2 3.34Å; D111-R222 PolarHBondContact OD2-NH2 3.26Å; E163-R222 WeakPolarHBondContact OE1-CD 3.3Å; E163-R222 IonicContact OE1-NH1 2.66Å; E163-R222 PolarHBondContact OE1-NH1 3.49Å; R222-F225 WeakPolarHBondContact O-CZ 3.25Å
223	D	98.1	Very high	96.8	Very high	46 Å²	46	32.6 Å²	32.6	25%	0.246	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	7.7	-179.3	-72.9	-41.6	0	0	0	113.6	V181 S221	V181-D223 HydrophobicContact CB-CB 4.03Å; V181-D223 HydrophobicContact CG2-CB 3.92Å; V181-D223 WeakPolarHBondContact CG2-O 3.48Å; V181-D223 PolarHBondContact N-O 3.37Å; S221-D223 VanDerWaalsContact C-N 3.27Å; S221-D223 PolarHBondContact O-N 3.28Å; S221-D223 PolarHBondContact OG-N 3.32Å
224	I	98.6	Very high	96.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	144.2	173.6	55.4	174.1	0	0	0	110.5	F52 Q54 F172 L178 E179 A180 I202 V204 S221	F52-I224 HydrophobicContact CD1-CB 4.31Å; F52-I224 HydrophobicContact CD1-CD1 4.37Å; F52-I224 HydrophobicContact CD1-CG1 4.08Å; F52-I224 HydrophobicContact CE1-CB 4.2Å; F52-I224 HydrophobicContact CE1-CG1 4.38Å; Q54-I224 PolarHBondContact NE2-O 2.78Å; F172-I224 HydrophobicContact CE2-CD1 4.05Å; F172-I224 HydrophobicContact CZ-CD1 3.9Å; L178-I224 HydrophobicContact CD1-CB 4.46Å; L178-I224 HydrophobicContact CD1-CG2 4.2Å; E179-I224 CarbonylContact O-C 3.55Å; E179-I224 WeakPolarHBondContact O-CA 3.45Å; A180-I224 HydrophobicContact CB-CG2 4.3Å; I202-I224 HydrophobicContact CD1-CD1 3.82Å; V204-I224 HydrophobicContact CG2-CG2 4.15Å; S221-I224 VanDerWaalsContact O-CG1 3.27Å; S221-I224 WeakPolarHBondContact O-CG1 3.27Å
225	F	98.4	Very high	96.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	151.6	-171	-50.9	-83.9	0	0	0	111.7	F52 Q54 L109 E179 V181 I189 R222 W229	F52-F225 WeakPolarHBondContact CE1-O 3.33Å; F52-F225 VanDerWaalsContact CZ-C 3.49Å; F52-F225 WeakPolarHBondContact CZ-O 3.47Å; Q54-F225 HydrophobicContact CG-CD1 3.96Å; Q54-F225 VanDerWaalsContact NE2-CD1 3.26Å; L109-F225 HydrophobicContact CD1-CE1 3.89Å; L109-F225 HydrophobicContact CD1-CZ 4.25Å; L109-F225 HydrophobicContact CD2-CE1 4.12Å; L109-F225 HydrophobicContact CD2-CZ 4.36Å; E179-F225 HydrophobicContact CB-CB 4.07Å; E179-F225 PolarHBondContact N-O 3.03Å; E179-F225 PolarHBondContact O-N 2.95Å; V181-F225 HydrophobicContact CG2-CE2 3.88Å; I189-F225 HydrophobicContact CD1-CD2 4.08Å; I189-F225 HydrophobicContact CD1-CE2 3.62Å; I189-F225 HydrophobicContact CD1-CZ 4.32Å; I189-F225 HydrophobicContact CG1-CE2 4.36Å; I189-F225 HydrophobicContact CG2-CD2 4.42Å; R222-F225 WeakPolarHBondContact O-CZ 3.25Å; F225-W229 HydrophobicContact CB-CB 3.66Å; F225-W229 HydrophobicContact CB-CD2 4.39Å; F225-W229 HydrophobicContact CB-CG 3.65Å; F225-W229 AromaticContact CD1-CD1 3.26Å; F225-W229 HydrophobicContact CD1-CD2 4.08Å; F225-W229 AromaticContact CD1-CE2 3.7Å; F225-W229 AromaticContact CD1-CG 3.83Å; F225-W229 HydrophobicContact CD1-CG 3.83Å; F225-W229 HydrophobicContact CD1-CZ2 4.45Å; F225-W229 AromaticContact CD1-NE1 3.16Å; F225-W229 AromaticContact CE1-CD1 3.89Å; F225-W229 AromaticContact CE1-NE1 3.46Å; F225-W229 HydrophobicContact CG-CB 4.41Å; F225-W229 AromaticContact CG-CD1 3.5Å; F225-W229 VanDerWaalsContact CG-CD1 3.5Å; F225-W229 AromaticContact CG-CG 3.95Å; F225-W229 HydrophobicContact CG-CG 3.95Å; F225-W229 AromaticContact CG-NE1 3.91Å
226	P	98.2	Very high	96.2	Very high	14 Å²	14	39.3 Å²	39.3	9%	0.091	22%	0.219	C	C	.	.			trans	-64.8	155.8	173	28.3	-34.8	0	0	0	111.6	P49 F52 G228 W229	P49-P226 HydrophobicContact CB-CB 4.4Å; P49-P226 HydrophobicContact CG-CB 4.2Å; F52-P226 HydrophobicContact CD2-CB 4.01Å; F52-P226 HydrophobicContact CD2-CG 4.47Å; F52-P226 HydrophobicContact CE2-CB 3.79Å; F52-P226 HydrophobicContact CZ-CB 4.31Å; P226-G228 PolarHBondContact O-N 2.87Å; P226-W229 HydrophobicContact CG-CB 4.44Å; P226-W229 HydrophobicContact CG-CE3 3.99Å; P226-W229 WeakPolarHBondContact O-CB 3.4Å; P226-W229 PolarHBondContact O-N 2.91Å; P226-W229 VanDerWaalsContact O-N 3.16Å
227	V	98.1	Very high	95.9	Very high	38 Å²	38	38 Å²	38	23%	0.23	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	129.8	173.1	162.6	0	0	0	0	111	W35 L39 A46	W35-V227 HydrophobicContact CB-CG1 3.74Å; W35-V227 HydrophobicContact CD2-CB 4.33Å; W35-V227 HydrophobicContact CD2-CG1 3.57Å; W35-V227 HydrophobicContact CD2-CG2 4.07Å; W35-V227 HydrophobicContact CE3-CG1 3.99Å; W35-V227 HydrophobicContact CE3-CG2 3.99Å; W35-V227 HydrophobicContact CG-CG1 3.48Å; W35-V227 VanDerWaalsContact CG-CG1 3.48Å; W35-V227 HydrophobicContact CH2-CG2 3.9Å; W35-V227 HydrophobicContact CZ2-CG2 3.98Å; W35-V227 HydrophobicContact CZ3-CG2 3.91Å; L39-V227 HydrophobicContact CD1-CG1 4.24Å; A46-V227 HydrophobicContact CB-CB 3.85Å; A46-V227 HydrophobicContact CB-CG1 4.38Å; A46-V227 HydrophobicContact CB-CG2 3.64Å
228	G	95.7	Very high	95.7	Very high	18 Å²	18	40 Å²	40	19%	0.186	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.2	-2.2	-178.9	0	0	0	0	0	114.6	E179 P226 C230 A231 L232	E179-G228 WeakPolarHBondContact OE1-CA 3.31Å; E179-G228 PolarHBondContact OE1-N 3.03Å; P226-G228 PolarHBondContact O-N 2.87Å; G228-C230 PolarHBondContact O-N 3.24Å; G228-A231 PolarHBondContact O-N 3.17Å; G228-L232 WeakPolarHBondContact O-CG 3.33Å; G228-L232 PolarHBondContact O-N 2.82Å
229	W	96.8	Very high	95.2	Very high	6 Å²	6	39.2 Å²	39.2	2%	0.023	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-41.9	-176.9	-174.9	-98.4	0	0	0	113.4	Q54 S55 P58 E179 F225 P226 A231 L232 T233	Q54-W229 HydrophobicContact CB-CH2 4.09Å; Q54-W229 HydrophobicContact CB-CZ2 4.44Å; Q54-W229 HydrophobicContact CB-CZ3 4.33Å; S55-W229 WeakPolarHBondContact O-CH2 3.45Å; S55-W229 WeakPolarHBondContact O-CZ3 3.29Å; P58-W229 HydrophobicContact CB-CH2 3.88Å; P58-W229 HydrophobicContact CB-CZ2 4.03Å; P58-W229 HydrophobicContact CB-CZ3 4.38Å; P58-W229 HydrophobicContact CG-CE3 4.2Å; P58-W229 HydrophobicContact CG-CH2 3.79Å; P58-W229 HydrophobicContact CG-CZ2 4.22Å; P58-W229 HydrophobicContact CG-CZ3 3.77Å; E179-W229 PolarHBondContact OE1-N 2.56Å; E179-W229 PolarHBondContact OE2-N 3.37Å; F225-W229 HydrophobicContact CB-CB 3.66Å; F225-W229 HydrophobicContact CB-CD2 4.39Å; F225-W229 HydrophobicContact CB-CG 3.65Å; F225-W229 AromaticContact CD1-CD1 3.26Å; F225-W229 HydrophobicContact CD1-CD2 4.08Å; F225-W229 AromaticContact CD1-CE2 3.7Å; F225-W229 AromaticContact CD1-CG 3.83Å; F225-W229 HydrophobicContact CD1-CG 3.83Å; F225-W229 HydrophobicContact CD1-CZ2 4.45Å; F225-W229 AromaticContact CD1-NE1 3.16Å; F225-W229 AromaticContact CE1-CD1 3.89Å; F225-W229 AromaticContact CE1-NE1 3.46Å; F225-W229 HydrophobicContact CG-CB 4.41Å; F225-W229 AromaticContact CG-CD1 3.5Å; F225-W229 VanDerWaalsContact CG-CD1 3.5Å; F225-W229 AromaticContact CG-CG 3.95Å; F225-W229 HydrophobicContact CG-CG 3.95Å; F225-W229 AromaticContact CG-NE1 3.91Å; P226-W229 HydrophobicContact CG-CB 4.44Å; P226-W229 HydrophobicContact CG-CE3 3.99Å; P226-W229 WeakPolarHBondContact O-CB 3.4Å; P226-W229 PolarHBondContact O-N 2.91Å; P226-W229 VanDerWaalsContact O-N 3.16Å; W229-A231 VanDerWaalsContact C-N 3.33Å; W229-A231 PolarHBondContact O-N 3.1Å; W229-L232 PolarHBondContact O-N 2.84Å; W229-T233 HydrophobicContact CD2-CG2 4.21Å; W229-T233 HydrophobicContact CG-CG2 4.38Å; W229-T233 HydrophobicContact CZ2-CG2 4.22Å; W229-T233 WeakPolarHBondContact O-CB 3.37Å; W229-T233 WeakPolarHBondContact O-CG2 3.38Å; W229-T233 PolarHBondContact O-N 2.81Å; W229-T233 PolarHBondContact O-OG1 2.89Å
230	C	95.8	Very high	94.7	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.007	22%	0.22	C	C	.	.	H	α-helix	trans	-60.9	-41.6	175.7	-76.3	0	0	0	0	112.1	E179 I189 G228 T233 K234 H235 L237	E179-C230 WeakPolarHBondContact OE2-CB 3.47Å; E179-C230 PolarHBondContact OE2-N 2.94Å; E179-C230 PolarHBondContact OE2-SG 2.98Å; I189-C230 VanDerWaalsContact CG2-SG 3.51Å; G228-C230 PolarHBondContact O-N 3.24Å; C230-T233 WeakPolarHBondContact CA-OG1 3.5Å; C230-T233 PolarHBondContact O-N 3.02Å; C230-T233 PolarHBondContact O-OG1 3.08Å; C230-K234 CarbonylContact O-C 3.6Å; C230-K234 WeakPolarHBondContact O-CA 3.45Å; C230-K234 PolarHBondContact O-N 2.95Å; C230-H235 HydrophobicContact CB-CB 4.18Å; C230-H235 PolarHBondContact O-N 2.89Å; C230-L237 HydrophobicContact CB-CB 3.74Å; C230-L237 HydrophobicContact CB-CD1 4.32Å; C230-L237 HydrophobicContact CB-CG 4.47Å
231	A	93.7	Very high	93.7	Very high	84 Å²	84	38 Å²	38	69%	0.694	22%	0.224	S	C	*	.	H	α-helix	trans	-64	-46.4	176.6	0	0	0	0	0	111.6	G228 W229 T233 K234	G228-A231 PolarHBondContact O-N 3.17Å; W229-A231 VanDerWaalsContact C-N 3.33Å; W229-A231 PolarHBondContact O-N 3.1Å; A231-T233 VanDerWaalsContact C-N 3.32Å; A231-T233 PolarHBondContact O-N 3.24Å; A231-K234 PolarHBondContact O-N 3.44Å
232	L	94.1	Very high	92.2	Very high	121 Å²	121	40.8 Å²	40.8	63%	0.634	24%	0.237	S	C	*	.	H	α-helix	trans	-61	-38.5	176.1	-71.1	167.1	0	0	0	112.8	P58 G228 W229	P58-L232 HydrophobicContact CG-CB 4.18Å; G228-L232 WeakPolarHBondContact O-CG 3.33Å; G228-L232 PolarHBondContact O-N 2.82Å; W229-L232 PolarHBondContact O-N 2.84Å
233	T	94.1	Very high	90.3	Very high	13 Å²	13	43.9 Å²	43.9	8%	0.08	25%	0.251	C	S	.	.	H	α-helix	trans	-89.2	-6.7	-178	54.9	0	0	0	0	114.4	P58 G90 T91 W229 C230 A231 H235	P58-T233 HydrophobicContact CB-CG2 3.56Å; P58-T233 HydrophobicContact CG-CG2 3.78Å; G90-T233 WeakPolarHBondContact CA-O 3.35Å; T91-T233 HydrophobicContact CG2-CG2 3.74Å; W229-T233 HydrophobicContact CD2-CG2 4.21Å; W229-T233 HydrophobicContact CG-CG2 4.38Å; W229-T233 HydrophobicContact CZ2-CG2 4.22Å; W229-T233 WeakPolarHBondContact O-CB 3.37Å; W229-T233 WeakPolarHBondContact O-CG2 3.38Å; W229-T233 PolarHBondContact O-N 2.81Å; W229-T233 PolarHBondContact O-OG1 2.89Å; C230-T233 WeakPolarHBondContact CA-OG1 3.5Å; C230-T233 PolarHBondContact O-N 3.02Å; C230-T233 PolarHBondContact O-OG1 3.08Å; A231-T233 VanDerWaalsContact C-N 3.32Å; A231-T233 PolarHBondContact O-N 3.24Å; T233-H235 PolarHBondContact O-N 3.45Å
234	K	90.3	Very high	87.6	Confident	187 Å²	187	48.9 Å²	48.9	81%	0.813	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	32	-168.7	-49.6	179.3	-175.8	179	0	113	C230 A231	C230-K234 CarbonylContact O-C 3.6Å; C230-K234 WeakPolarHBondContact O-CA 3.45Å; C230-K234 PolarHBondContact O-N 2.95Å; A231-K234 PolarHBondContact O-N 3.44Å
235	H	90.6	Very high	84.4	Confident	12 Å²	12	53.4 Å²	53.4	6%	0.056	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-82.9	148.4	167.1	-164.3	-71.3	0	0	0	109.4	M89 R92 C230 T233 L237	M89-H235 HydrophobicContact CG-CB 4.48Å; M89-H235 PolarHBondContact O-CD2 3.34Å; M89-H235 PolarHBondContact SD-CE1 2.84Å; R92-H235 PolarHBondContact NH1-NE2 2.67Å; R92-H235 VanDerWaalsContact NH1-NE2 3.17Å; C230-H235 HydrophobicContact CB-CB 4.18Å; C230-H235 PolarHBondContact O-N 2.89Å; T233-H235 PolarHBondContact O-N 3.45Å; H235-L237 PolarHBondContact O-N 3.41Å
236	S	91.1	Very high	81	Confident	47 Å²	47	61.1 Å²	61.1	33%	0.329	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-72.4	122.8	172	-178.9	0	0	0	0	109.7	Q238	S236-Q238 PolarHBondContact OG-NE2 2.92Å
237	L	93.2	Very high	77.8	Confident	39 Å²	39	66.2 Å²	66.2	20%	0.204	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-94.2	132.8	166.7	-173	64.9	0	0	0	108.3	F33 W35 E179 I189 P191 C230 H235	F33-L237 HydrophobicContact CD1-CD2 3.76Å; F33-L237 HydrophobicContact CE1-CD2 3.75Å; W35-L237 VanDerWaalsContact NE1-CD2 3.28Å; E179-L237 HydrophobicContact CG-CD1 3.84Å; I189-L237 HydrophobicContact CG2-CD1 4.07Å; P191-L237 HydrophobicContact CG-CD1 4.44Å; P191-L237 HydrophobicContact CG-CD2 4.47Å; P191-L237 HydrophobicContact CG-CG 4.49Å; C230-L237 HydrophobicContact CB-CB 3.74Å; C230-L237 HydrophobicContact CB-CD1 4.32Å; C230-L237 HydrophobicContact CB-CG 4.47Å; H235-L237 PolarHBondContact O-N 3.41Å
238	Q	92.6	Very high	74.8	Confident	41 Å²	41	68.8 Å²	68.8	19%	0.192	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-81.8	145.9	170.8	-58.9	-55.3	-80.3	0	0	110.6	L188 I189 P191 S236	L188-Q238 HydrophobicContact CB-CG 4.29Å; L188-Q238 HydrophobicContact CD1-CG 4.38Å; L188-Q238 HydrophobicContact CD2-CG 3.71Å; L188-Q238 HydrophobicContact CG-CG 4.35Å; I189-Q238 PolarHBondContact O-N 2.93Å; P191-Q238 WeakPolarHBondContact CD-O 3.21Å; S236-Q238 PolarHBondContact OG-NE2 2.92Å
239	P	88.9	Confident	72.1	Confident	43 Å²	43	71.9 Å²	71.9	28%	0.279	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-68	160.6	167.1	31.5	-35.5	0	0	0	111	F33 F243	F33-P239 HydrophobicContact CB-CB 4.31Å; F33-P239 HydrophobicContact CD2-CB 4.45Å; P239-F243 HydrophobicContact CB-CB 3.84Å; P239-F243 HydrophobicContact CB-CD1 4.29Å; P239-F243 HydrophobicContact CB-CG 4.1Å
240	P	87.3	Confident	69.3	Low	8 Å²	8	79.7 Å²	79.7	5%	0.052	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-52.8	149.2	171.8	-26.5	34.5	0	0	0	112.8	F33 Y38 P191 D207 N242 F243	F33-P240 HydrophobicContact CD2-CG 4.4Å; F33-P240 VanDerWaalsContact CE2-CD 3.41Å; F33-P240 HydrophobicContact CE2-CG 3.79Å; F33-P240 HydrophobicContact CZ-CG 4.46Å; Y38-P240 HydrophobicContact CE1-CG 4.06Å; Y38-P240 HydrophobicContact CE2-CG 4Å; P191-P240 HydrophobicContact CB-CG 4.23Å; P191-P240 HydrophobicContact CG-CG 4.23Å; D207-P240 HydrophobicContact CB-CB 4.05Å; D207-P240 HydrophobicContact CB-CG 4.36Å; D207-P240 CarbonylContact O-C 3.5Å; D207-P240 WeakPolarHBondContact O-CA 3.38Å; D207-P240 WeakPolarHBondContact O-CB 3.36Å; P240-N242 PolarHBondContact O-N 3.3Å; P240-F243 HydrophobicContact CB-CD2 4.11Å; P240-F243 HydrophobicContact CG-CD2 3.78Å; P240-F243 HydrophobicContact CG-CE2 4.15Å; P240-F243 WeakPolarHBondContact O-CB 3.26Å; P240-F243 PolarHBondContact O-N 2.96Å
241	G	76.7	Confident	66.2	Low	33 Å²	33	88 Å²	88	34%	0.34	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.8	-175.3	0	0	0	0	0	115.3	D207	D207-G241 PolarHBondContact O-N 3.21Å
242	N	67.4	Low	63.2	Low	76 Å²	76	88.6 Å²	88.6	41%	0.406	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	1.8	177.3	-100.2	47.6	0	0	0	113.8	G208 P240 F244 T245	G208-N242 PolarHBondContact O-OD1 2.98Å; P240-N242 PolarHBondContact O-N 3.3Å; N242-F244 PolarHBondContact O-N 3.1Å; N242-F244 VanDerWaalsContact O-N 3.12Å; N242-T245 HydrophobicContact CB-CG2 4.48Å
243	F	56.3	Low	60.5	Low	94 Å²	94	88.4 Å²	88.4	41%	0.412	53%	0.526	S	S	.	.	S	Bend	trans	-67.3	-9.9	-179.8	-120.5	-110	0	0	0	113.5	F33 Y38 P239 P240	F33-F243 HydrophobicContact CD2-CD2 4.43Å; F33-F243 HydrophobicContact CD2-CE1 4.07Å; F33-F243 AromaticContact CD2-CE2 3.9Å; F33-F243 HydrophobicContact CD2-CE2 3.9Å; F33-F243 AromaticContact CD2-CZ 3.71Å; F33-F243 HydrophobicContact CD2-CZ 3.71Å; F33-F243 AromaticContact CE2-CE2 3.99Å; F33-F243 HydrophobicContact CE2-CE2 3.99Å; F33-F243 HydrophobicContact CE2-CZ 4.13Å; Y38-F243 AromaticContact CD2-CE2 3.8Å; Y38-F243 HydrophobicContact CD2-CE2 3.8Å; Y38-F243 HydrophobicContact CE2-CE2 4.08Å; P239-F243 HydrophobicContact CB-CB 3.84Å; P239-F243 HydrophobicContact CB-CD1 4.29Å; P239-F243 HydrophobicContact CB-CG 4.1Å; P240-F243 HydrophobicContact CB-CD2 4.11Å; P240-F243 HydrophobicContact CG-CD2 3.78Å; P240-F243 HydrophobicContact CG-CE2 4.15Å; P240-F243 WeakPolarHBondContact O-CB 3.26Å; P240-F243 PolarHBondContact O-N 2.96Å
244	F	42.6	Very low	57.6	Low	152 Å²	152	94.8 Å²	94.8	67%	0.667	56%	0.564	S	S	*	*			trans	-116.9	88.4	165.5	-73.8	-79.5	0	0	0	110.9	N242	N242-F244 PolarHBondContact O-N 3.1Å; N242-F244 VanDerWaalsContact O-N 3.12Å
245	T	30.4	Very low	54.7	Low	94 Å²	94	91.2 Å²	91.2	58%	0.577	56%	0.563	S	S	*	*			trans	-129.1	98.6	166.9	56.9	0	0	0	0	111.9	N242	N242-T245 HydrophobicContact CB-CG2 4.48Å
246	L	27.7	Very low	51.8	Low	163 Å²	163	96.2 Å²	96.2	85%	0.853	60%	0.599	S	S	*	*			trans	42.7	136.7	150.9	-67.3	165.4	0	0	0	120.5	G248	L246-G248 PolarHBondContact O-N 3.42Å
247	P	30.1	Very low	49	Very low	120 Å²	120	100.8 Å²	100.8	78%	0.779	63%	0.626	S	S	*	*			trans	-54.1	131.2	169.7	-24.9	34.6	0	0	0	112.9	A249	P247-A249 VanDerWaalsContact C-N 3.33Å; P247-A249 PolarHBondContact O-N 2.95Å
248	G	34.9	Very low	46	Very low	92 Å²	92	105 Å²	105	95%	0.948	66%	0.658	S	S	*	*	S	Bend	trans	-73.2	76.7	-177.9	0	0	0	0	0	113.5	L246	L246-G248 PolarHBondContact O-N 3.42Å
249	A	40.1	Very low	43	Very low	83 Å²	83	107.2 Å²	107.2	69%	0.686	68%	0.684	S	S	*	*			trans	-143.4	79.9	176.7	0	0	0	0	0	111.9	P247	P247-A249 VanDerWaalsContact C-N 3.33Å; P247-A249 PolarHBondContact O-N 2.95Å
250	L	36.8	Very low	40.2	Very low	171 Å²	171	111.4 Å²	111.4	90%	0.895	71%	0.709	S	S	*	*	S	Bend	trans	-176.7	44.3	148.6	-101.9	-177	0	0	0	113.5
251	L	32.1	Very low	37.4	Very low	176 Å²	176	122.8 Å²	122.8	92%	0.921	75%	0.75	S	S	*	*			trans	-138.3	92.5	162.1	-78.7	-178.3	0	0	0	109.9
252	A	31	Very low	35.2	Very low	96 Å²	96	133 Å²	133	79%	0.793	78%	0.779	S	S	*	*			trans	-86.4	138.6	168.1	0	0	0	0	0	109.9
253	P	37	Very low	33.3	Very low	117 Å²	117	135.3 Å²	135.3	76%	0.76	80%	0.801	S	S	*	*			trans	-79.4	128.8	-179.4	31	-33.6	0	0	0	111.8
254	V	32.8	Very low	32	Very low	146 Å²	146	134.6 Å²	134.6	89%	0.885	81%	0.807	S	S	*	*			trans	-94.9	87.1	165.5	-77.8	0	0	0	0	110.2	S256	V254-S256 PolarHBondContact O-N 3.34Å
255	S	29.5	Very low	31.3	Very low	113 Å²	113	136.2 Å²	136.2	79%	0.79	82%	0.815	S	S	*	*			trans	-72.3	121.2	170	-64.5	0	0	0	0	110.5
256	S	30.4	Very low	31.3	Very low	117 Å²	117	138.5 Å²	138.5	82%	0.818	82%	0.823	S	S	*	*			trans	-127.8	113.5	164.9	59.4	0	0	0	0	110	V254	V254-S256 PolarHBondContact O-N 3.34Å
257	T	30.4	Very low	31.4	Very low	143 Å²	143	135.4 Å²	135.4	88%	0.877	82%	0.815	S	S	*	*			trans	-95.2	126.1	-178.5	33.7	0	0	0	0	112
258	S	30.7	Very low	31.3	Very low	128 Å²	128	134.6 Å²	134.6	90%	0.895	81%	0.812	S	S	*	*			trans	-152.4	154.8	150.7	58.4	0	0	0	0	108.6
259	A	31.1	Very low	31	Very low	87 Å²	87	135.3 Å²	135.3	72%	0.719	80%	0.803	S	S	*	*			trans	-131.8	159.2	-156.2	0	0	0	0	0	114.6
260	T	29.3	Very low	30.4	Very low	131 Å²	131	136.8 Å²	136.8	80%	0.804	81%	0.808	S	S	*	*			trans	61	122.3	162.9	33.2	0	0	0	0	118.9
261	R	29.2	Very low	30	Very low	246 Å²	246	133.2 Å²	133.2	93%	0.928	80%	0.798	S	S	*	*				-163.3	166.4	97.8	-102.3	171.8	-170.7	-137.6	0.8	112.4
262	R	29.3	Very low	29.8	Very low	248 Å²	248	131 Å²	131	94%	0.936	79%	0.792	S	S	*	*			trans	-81.2	144.7	177.5	-58.8	170.7	178	160.7	-3.7	110.9
263	S	27.9	Very low	29.6	Very low	124 Å²	124	131.7 Å²	131.7	87%	0.867	79%	0.791	S	S	*	*			trans	-162	169.6	130.1	55.4	0	0	0	0	109.6
264	S	28.5	Very low	29.4	Very low	79 Å²	79	134.7 Å²	134.7	55%	0.552	80%	0.797	S	S	*	*			trans	-129.5	-177.9	-169	46	0	0	0	0	111.7
265	F	29.3	Very low	29.1	Very low	187 Å²	187	136.1 Å²	136.1	82%	0.82	79%	0.794	S	S	*	*			trans	100.2	125.6	160.4	-44.8	-60.2	0	0	0	119.1
266	N	29.5	Very low	29	Very low	141 Å²	141	136.9 Å²	136.9	75%	0.754	79%	0.794	S	S	*	*			trans	68.8	103.1	140.9	-69.4	17.8	0	0	0	123.8
267	S	29	Very low	28.9	Very low	99 Å²	99	135.5 Å²	135.5	69%	0.692	78%	0.784	S	S	*	*				87.1	144	105.4	-58.8	0	0	0	0	123.6
268	S	28.2	Very low	28.9	Very low	102 Å²	102	138.7 Å²	138.7	71%	0.713	78%	0.781	S	S	*	*			trans	71.2	102.9	148.5	43.2	0	0	0	0	121.5
269	S	28.3	Very low	28.8	Very low	107 Å²	107	143.8 Å²	143.8	75%	0.748	78%	0.781	S	S	*	*				37.2	129.9	127	60.1	0	0	0	0	120
270	S	28.4	Very low	29.1	Very low	114 Å²	114	147.5 Å²	147.5	80%	0.797	79%	0.788	S	S	*	*				-178.5	169.2	73.9	43.6	0	0	0	0	114.8
271	S	27.5	Very low	29.4	Very low	97 Å²	97	146.7 Å²	146.7	68%	0.678	79%	0.785	S	S	*	*			trans	-28	168.3	174.6	51.8	0	0	0	0	123.6
272	T	29.1	Very low	29.7	Very low	130 Å²	130	142.8 Å²	142.8	80%	0.798	78%	0.783	S	S	*	*			trans	68.1	151.7	155.7	43.5	0	0	0	0	118.4
273	S	27.2	Very low	30.3	Very low	110 Å²	110	136.7 Å²	136.7	77%	0.769	78%	0.775	S	S	*	*			cis	-167.7	155.3	-26.6	46.8	0	0	0	0	109.4
274	M	31.7	Very low	30.5	Very low	180 Å²	180	138.7 Å²	138.7	89%	0.887	78%	0.775	S	S	*	*			trans	-73.4	148.1	177.8	-68.6	-177	149.8	0	0	114
275	Q	27.5	Very low	30.9	Very low	176 Å²	176	140.4 Å²	140.4	82%	0.822	78%	0.784	S	S	*	*				174.4	160.2	122.7	-98.2	-176.1	11.6	0	0	115.6
276	T	27.4	Very low	31.2	Very low	129 Å²	129	137.5 Å²	137.5	79%	0.791	78%	0.784	S	S	*	*			trans	69.8	148.3	169.7	78.5	0	0	0	0	116.4
277	S	28.2	Very low	31.2	Very low	87 Å²	87	138.6 Å²	138.6	61%	0.608	79%	0.789	S	S	*	*			cis	-158.5	-177.8	-14.2	-92.4	0	0	0	0	107
278	Y	30	Very low	31.5	Very low	210 Å²	210	139.9 Å²	139.9	82%	0.824	80%	0.795	S	S	*	*			cis	-146.5	149.9	21.9	-68.7	-90.8	0	0	0	108.8
279	R	27.9	Very low	31.7	Very low	235 Å²	235	141.4 Å²	141.4	89%	0.887	80%	0.8	S	S	*	*				75.8	110.9	69.6	-142.4	-174.1	-138.5	-106.3	6.3	115.9
280	L	37.3	Very low	31.9	Very low	165 Å²	165	147.4 Å²	147.4	86%	0.864	81%	0.806	S	S	*	*			trans	-92.2	165.4	171.4	-82.5	98.7	0	0	0	113.3
281	P	35.8	Very low	31.9	Very low	115 Å²	115	151.3 Å²	151.3	75%	0.747	81%	0.809	S	S	*	*			trans	-115.7	109.6	167.7	36.6	-23.8	0	0	0	116
282	N	36.9	Very low	32	Very low	164 Å²	164	150.6 Å²	150.6	88%	0.877	82%	0.816	S	S	*	*			trans	69.9	163.2	136.4	-80	21.1	0	0	0	123.3
283	P	40.8	Very low	32	Very low	120 Å²	120	151.4 Å²	151.4	78%	0.779	82%	0.821	S	S	*	*			trans	-122.6	-173.6	-140.2	46.1	-37.1	0	0	0	117.8
284	L	33	Very low	32.2	Very low	165 Å²	165	157.8 Å²	157.8	86%	0.864	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-80.3	157.7	-177.9	-67	169.7	0	0	0	115.3
285	P	35.3	Very low	32.1	Very low	115 Å²	115	152.9 Å²	152.9	75%	0.747	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-88.3	163.9	-177.5	35.8	-37.2	0	0	0	115.4
286	P	36.8	Very low	32.6	Very low	127 Å²	127	156.3 Å²	156.3	83%	0.825	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-90	162.7	-177.2	36.3	-36.7	0	0	0	115
287	L	30.4	Very low	33.2	Very low	164 Å²	164	161.6 Å²	161.6	86%	0.859	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-95.5	150	179.2	-69.9	172.5	0	0	0	113.7
288	P	34.5	Very low	33.4	Very low	125 Å²	125	163 Å²	163	81%	0.812	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-84.9	157.2	-179.5	34.6	-36.1	0	0	0	114.3
289	V	32.8	Very low	33.9	Very low	134 Å²	134	162.1 Å²	162.1	81%	0.812	84%	0.842	S	S	*	*			trans	-119.9	136.2	179.6	175.3	0	0	0	0	110.8
290	R	31	Very low	34.8	Very low	233 Å²	233	155.3 Å²	155.3	88%	0.879	83%	0.831	S	S	*	*			trans	-161.3	124.7	155.8	-113.2	156.7	-163.7	-177.5	3.9	116.2
291	K	28.8	Very low	35.3	Very low	197 Å²	197	155.6 Å²	155.6	86%	0.857	83%	0.828	S	S	*	*			trans	34	119.4	142.7	-62.1	-176	175.1	-175.2	0	119.7
292	G	31	Very low	35.8	Very low	81 Å²	81	154.3 Å²	154.3	84%	0.835	82%	0.817	S	S	*	*			trans	-88.9	173.9	166.2	0	0	0	0	0	114.7
293	V	28.8	Very low	36.5	Very low	147 Å²	147	152.6 Å²	152.6	89%	0.891	81%	0.807	S	S	*	*			trans	-128.4	139.5	-178.5	176.8	0	0	0	0	111.8
294	R	29.9	Very low	36.7	Very low	245 Å²	245	150.1 Å²	150.1	93%	0.925	80%	0.796	S	S	*	*			trans	-43.5	132.9	177.3	-93.9	171	165.3	160.3	-5.6	115
295	G	30.3	Very low	37.5	Very low	77 Å²	77	148.8 Å²	148.8	79%	0.794	79%	0.789	S	S	*	*			trans	-82.1	163.2	158.5	0	0	0	0	0	113.4
296	R	38.8	Very low	38.2	Very low	247 Å²	247	149 Å²	149	93%	0.932	78%	0.784	S	S	*	*			trans	-118.8	148.2	170.1	-69	-173.8	176.8	-160.4	-0	110.3
297	R	38.6	Very low	38.7	Very low	241 Å²	241	149.9 Å²	149.9	91%	0.909	78%	0.775	S	S	*	*			trans	-84.6	141.8	169.7	-77.1	-179	172	167.9	-3	111.1
298	P	33.9	Very low	39.6	Very low	117 Å²	117	144.9 Å²	144.9	76%	0.76	76%	0.757	S	S	*	*			trans	-66.9	168.5	167.7	-20.8	34.2	0	0	0	113.4
299	K	40.5	Very low	40.2	Very low	190 Å²	190	142 Å²	142	83%	0.826	74%	0.744	S	S	*	*			trans	-98.3	175.7	-176.3	-68.2	-174.4	177.6	-177.4	0	113.4	Q301	K299-Q301 PolarHBondContact O-N 2.96Å
300	S	45.1	Very low	40.8	Very low	93 Å²	93	138.7 Å²	138.7	65%	0.65	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48	-18.2	-170	44.9	0	0	0	0	119.2	T302 I303	S300-T302 VanDerWaalsContact C-N 3.28Å; S300-T302 PolarHBondContact O-N 2.94Å; S300-I303 WeakPolarHBondContact O-CB 3.49Å; S300-I303 PolarHBondContact O-N 2.84Å
301	Q	49.6	Very low	41.4	Very low	171 Å²	171	134.2 Å²	134.2	80%	0.799	72%	0.719	S	S	*	*	H	α-helix	trans	-60	-34.8	-175.2	-120.6	172.6	-6.9	0	0	113.5	K299 I303 A304 L305	K299-Q301 PolarHBondContact O-N 2.96Å; Q301-I303 VanDerWaalsContact C-N 3.26Å; Q301-I303 PolarHBondContact O-N 3.03Å; Q301-A304 PolarHBondContact O-N 2.68Å; Q301-L305 PolarHBondContact O-N 2.84Å
302	T	45.7	Very low	42.4	Very low	87 Å²	87	128 Å²	128	53%	0.534	71%	0.705	S	S	.	*	H	α-helix	trans	-63.2	-30.1	176.9	-47.8	0	0	0	0	112.9	S300 L306	S300-T302 VanDerWaalsContact C-N 3.28Å; S300-T302 PolarHBondContact O-N 2.94Å; T302-L306 HydrophobicContact CG2-CD1 4.26Å; T302-L306 WeakPolarHBondContact O-CG 3.4Å; T302-L306 PolarHBondContact O-N 2.98Å
303	I	50.2	Low	43.1	Very low	129 Å²	129	127.2 Å²	127.2	66%	0.662	69%	0.691	S	S	*	*	H	α-helix	trans	-74.3	-37.8	-178.8	-61	173.5	0	0	0	110.6	S300 Q301 L306 K307	S300-I303 WeakPolarHBondContact O-CB 3.49Å; S300-I303 PolarHBondContact O-N 2.84Å; Q301-I303 VanDerWaalsContact C-N 3.26Å; Q301-I303 PolarHBondContact O-N 3.03Å; I303-L306 PolarHBondContact O-N 3.32Å; I303-K307 PolarHBondContact O-N 2.82Å; I303-K307 VanDerWaalsContact O-N 3.16Å
304	A	45.8	Very low	43.9	Very low	67 Å²	67	123.5 Å²	123.5	55%	0.554	68%	0.675	S	S	*	*	H	α-helix	trans	-63.5	-43.2	175	0	0	0	0	0	111.8	Q301 L306 K307 A308	Q301-A304 PolarHBondContact O-N 2.68Å; A304-L306 PolarHBondContact O-N 2.94Å; A304-K307 PolarHBondContact O-N 2.75Å; A304-A308 PolarHBondContact O-N 3.42Å; A304-A308 VanDerWaalsContact O-N 3.17Å
305	L	49.3	Very low	44.6	Very low	137 Å²	137	115.3 Å²	115.3	72%	0.717	66%	0.66	S	S	*	*	H	α-helix	trans	-63.5	-41.6	179.4	-146.4	86.5	0	0	0	112.3	Q301 K307 A309	Q301-L305 PolarHBondContact O-N 2.84Å; L305-K307 VanDerWaalsContact C-N 3.34Å; L305-K307 PolarHBondContact O-N 3.46Å; L305-A309 PolarHBondContact O-N 2.98Å
306	L	50.9	Low	45.4	Very low	121 Å²	121	115 Å²	115	63%	0.634	65%	0.65	S	S	*	*	H	α-helix	trans	-66.6	-32.6	177.4	-74.9	167.9	0	0	0	112.8	T302 I303 A304 A310	T302-L306 HydrophobicContact CG2-CD1 4.26Å; T302-L306 WeakPolarHBondContact O-CG 3.4Å; T302-L306 PolarHBondContact O-N 2.98Å; I303-L306 PolarHBondContact O-N 3.32Å; A304-L306 PolarHBondContact O-N 2.94Å; L306-A310 PolarHBondContact O-N 3.31Å
307	K	46.3	Very low	45.7	Very low	145 Å²	145	107.3 Å²	107.3	63%	0.63	64%	0.639	S	S	*	*	H	α-helix	trans	-69.7	-46.6	176.1	-165.9	-180	178.7	-170.7	0	111.7	I303 A304 L305 A309 A310 E311	I303-K307 PolarHBondContact O-N 2.82Å; I303-K307 VanDerWaalsContact O-N 3.16Å; A304-K307 PolarHBondContact O-N 2.75Å; L305-K307 VanDerWaalsContact C-N 3.34Å; L305-K307 PolarHBondContact O-N 3.46Å; K307-A309 VanDerWaalsContact C-N 3.3Å; K307-A309 PolarHBondContact O-N 3.35Å; K307-A310 PolarHBondContact O-N 2.88Å; K307-E311 PolarHBondContact O-N 2.76Å
308	A	48.8	Very low	45.9	Very low	58 Å²	58	100.2 Å²	100.2	48%	0.479	63%	0.632	S	S	.	*	H	α-helix	trans	-61.4	-36.9	178.7	0	0	0	0	0	112.9	A304 A310 E311 A312	A304-A308 PolarHBondContact O-N 3.42Å; A304-A308 VanDerWaalsContact O-N 3.17Å; A308-A310 VanDerWaalsContact C-N 3.34Å; A308-A310 PolarHBondContact O-N 3.25Å; A308-E311 PolarHBondContact O-N 3.34Å; A308-A312 PolarHBondContact O-N 2.87Å
309	A	47.4	Very low	46.5	Very low	65 Å²	65	98.6 Å²	98.6	54%	0.537	63%	0.629	S	S	.	*	H	α-helix	trans	-64.9	-34.1	177.1	0	0	0	0	0	113.4	L305 K307 A313	L305-A309 PolarHBondContact O-N 2.98Å; K307-A309 VanDerWaalsContact C-N 3.3Å; K307-A309 PolarHBondContact O-N 3.35Å; A309-A313 PolarHBondContact O-N 3.22Å
310	A	46.1	Very low	46.9	Very low	65 Å²	65	95.6 Å²	95.6	54%	0.537	63%	0.626	S	S	.	*	H	α-helix	trans	-71.6	-37.2	177	0	0	0	0	0	112.4	L306 K307 A308 A313 A314	L306-A310 PolarHBondContact O-N 3.31Å; K307-A310 PolarHBondContact O-N 2.88Å; A308-A310 VanDerWaalsContact C-N 3.34Å; A308-A310 PolarHBondContact O-N 3.25Å; A310-A313 PolarHBondContact O-N 3.14Å; A310-A314 PolarHBondContact O-N 3.2Å
311	E	44.2	Very low	46.6	Very low	138 Å²	138	99.5 Å²	99.5	65%	0.645	64%	0.64	S	S	*	*	H	α-helix	trans	-68.8	-39.9	-178.8	-145.2	152.3	-139.8	0	0	111.3	K307 A308 A313 A314 A315	K307-E311 PolarHBondContact O-N 2.76Å; A308-E311 PolarHBondContact O-N 3.34Å; E311-A313 VanDerWaalsContact C-N 3.35Å; E311-A313 PolarHBondContact O-N 3.08Å; E311-A314 PolarHBondContact O-N 2.87Å; E311-A315 PolarHBondContact O-N 3Å
312	A	48.8	Very low	45.7	Very low	67 Å²	67	95.4 Å²	95.4	55%	0.554	64%	0.643	S	S	*	*	H	α-helix	trans	-64.1	-35	173.3	0	0	0	0	0	113.4	A308	A308-A312 PolarHBondContact O-N 2.87Å
313	A	46.2	Very low	45.1	Very low	65 Å²	65	96 Å²	96	54%	0.537	66%	0.657	S	S	.	*	H	α-helix	trans	-69.2	-33.3	178.2	0	0	0	0	0	112.7	A309 A310 E311	A309-A313 PolarHBondContact O-N 3.22Å; A310-A313 PolarHBondContact O-N 3.14Å; E311-A313 VanDerWaalsContact C-N 3.35Å; E311-A313 PolarHBondContact O-N 3.08Å
314	A	44.8	Very low	45	Very low	69 Å²	69	95.6 Å²	95.6	57%	0.57	66%	0.663	S	S	*	*	H	α-helix	trans	-67	-40.2	176.9	0	0	0	0	0	112.3	A310 E311 A316 A317	A310-A314 PolarHBondContact O-N 3.2Å; E311-A314 PolarHBondContact O-N 2.87Å; A314-A316 VanDerWaalsContact C-N 3.31Å; A314-A316 PolarHBondContact O-N 2.85Å; A314-A317 PolarHBondContact O-N 2.79Å
315	A	45.7	Very low	44.3	Very low	72 Å²	72	102 Å²	102	60%	0.595	68%	0.681	S	S	*	*	H	α-helix	trans	-63	-34.8	178.9	0	0	0	0	0	113.1	E311 A317	E311-A315 PolarHBondContact O-N 3Å; A315-A317 VanDerWaalsContact C-N 3.31Å; A315-A317 PolarHBondContact O-N 3.17Å
316	A	47.3	Very low	43.5	Very low	71 Å²	71	100.4 Å²	100.4	59%	0.587	68%	0.682	S	S	*	*	H	α-helix	trans	-68.8	-25.5	179.9	0	0	0	0	0	113.7	A314 A318	A314-A316 VanDerWaalsContact C-N 3.31Å; A314-A316 PolarHBondContact O-N 2.85Å; A316-A318 VanDerWaalsContact C-N 3.34Å; A316-A318 PolarHBondContact O-N 2.8Å
317	A	44.3	Very low	43.4	Very low	86 Å²	86	100 Å²	100	71%	0.711	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-18	-176.3	0	0	0	0	0	114.1	A314 A315	A314-A317 PolarHBondContact O-N 2.79Å; A315-A317 VanDerWaalsContact C-N 3.31Å; A315-A317 PolarHBondContact O-N 3.17Å
318	A	43.5	Very low	42.6	Very low	92 Å²	92	99 Å²	99	76%	0.76	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-8.1	-175.7	0	0	0	0	0	114.5	A316	A316-A318 VanDerWaalsContact C-N 3.34Å; A316-A318 PolarHBondContact O-N 2.8Å
319	A	46.2	Very low	41.6	Very low	83 Å²	83	102.8 Å²	102.8	69%	0.686	71%	0.709	S	S	*	*	S	Bend	trans	-97.4	3.6	-164.3	0	0	0	0	0	115.9
320	V	47.7	Very low	40.5	Very low	126 Å²	126	108 Å²	108	76%	0.764	72%	0.722	S	S	*	*			trans	-128	69.5	-171.8	-167.4	0	0	0	0	112.2
321	N	39.9	Very low	40.7	Very low	176 Å²	176	109.5 Å²	109.5	94%	0.941	73%	0.727	S	S	*	*			trans	-164.7	109.6	156	-98.2	-45.8	0	0	0	109.8
322	G	31.1	Very low	39.8	Very low	84 Å²	84	108 Å²	108	87%	0.866	73%	0.732	S	S	*	*			trans	-179.9	127.2	178.5	0	0	0	0	0	112.3
323	A	33.3	Very low	38.8	Very low	100 Å²	100	112.8 Å²	112.8	83%	0.826	75%	0.747	S	S	*	*			trans	-109.4	165.6	-178.2	0	0	0	0	0	111
324	P	48.1	Very low	38.3	Very low	121 Å²	121	113.6 Å²	113.6	79%	0.786	75%	0.753	S	S	*	*			trans	-95.2	154.1	-151.5	35.9	-36.8	0	0	0	116
325	Q	31.1	Very low	37.8	Very low	200 Å²	200	116.6 Å²	116.6	94%	0.935	77%	0.767	S	S	*	*			trans	-141.5	163.7	150.6	-72.5	-163.2	-2.7	0	0	110.8
326	S	32.4	Very low	37.3	Very low	105 Å²	105	124.6 Å²	124.6	73%	0.734	78%	0.782	S	S	*	*			trans	-138.9	173.1	175.1	67.2	0	0	0	0	107.1
327	P	49	Very low	37.4	Very low	111 Å²	111	126.1 Å²	126.1	72%	0.721	79%	0.786	S	S	*	*			cis	-147.2	-161.3	21.5	32.9	-5.9	0	0	0	116.6
328	V	27.7	Very low	36.7	Very low	124 Å²	124	129.9 Å²	129.9	75%	0.752	79%	0.789	S	S	*	*			trans	85.9	135.9	155.3	-144	0	0	0	0	121
329	T	28	Very low	35.9	Very low	138 Å²	138	134.5 Å²	134.5	85%	0.847	79%	0.791	S	S	*	*			trans	94.6	122.8	150.7	0.5	0	0	0	0	120.9
330	E	24.8	Very low	35.1	Very low	175 Å²	175	139.6 Å²	139.6	82%	0.818	80%	0.798	S	S	*	*			trans	-101.4	-178.7	163.6	-124.4	-163.8	-169.5	0	0	108.7
331	P	49.8	Very low	34.3	Very low	96 Å²	96	145.4 Å²	145.4	62%	0.623	81%	0.806	S	S	*	*			cis	-136.2	-171.5	-13.7	37.2	-17.9	0	0	0	114.8
332	S	26.1	Very low	33.8	Very low	108 Å²	108	140.3 Å²	140.3	76%	0.755	80%	0.795	S	S	*	*			trans	77.5	161.3	159.5	89.5	0	0	0	0	116.5
333	L	28.8	Very low	34.4	Very low	167 Å²	167	143 Å²	143	87%	0.874	80%	0.797	S	S	*	*			cis	-134.1	165.3	9.8	-111.8	172.9	0	0	0	111
334	A	35.5	Very low	34.3	Very low	81 Å²	81	147.7 Å²	147.7	67%	0.669	80%	0.799	S	S	*	*			trans	-132.1	160.7	170.2	0	0	0	0	0	110.7
335	P	33.6	Very low	34.8	Very low	133 Å²	133	147 Å²	147	86%	0.864	79%	0.794	S	S	*	*			trans	-117.1	126.9	153.7	3.1	18.6	0	0	0	113.8
336	R	35.2	Very low	34.8	Very low	240 Å²	240	146.8 Å²	146.8	91%	0.906	79%	0.79	S	S	*	*			trans	-98.9	161.1	155.7	-77.7	177.1	167.9	171.5	-2.6	107.4
337	P	48.4	Very low	34.7	Very low	103 Å²	103	145 Å²	145	67%	0.669	79%	0.789	S	S	*	*				-144.4	178.3	69.9	36.3	-14.2	0	0	0	113.2
338	H	29.8	Very low	33.9	Very low	165 Å²	165	150 Å²	150	76%	0.764	80%	0.799	S	S	*	*			cis	-161.5	130.4	41.4	41.4	-78.1	0	0	0	110.2
339	K	27.2	Very low	34.1	Very low	189 Å²	189	153.7 Å²	153.7	82%	0.822	81%	0.805	S	S	*	*				63	140.7	88.1	-69.4	179.8	-179.9	173.2	0	115.3
340	K	30.2	Very low	34.2	Very low	189 Å²	189	157 Å²	157	82%	0.822	81%	0.807	S	S	*	*			cis	174.4	136.8	-26.9	-127.7	-172.6	-177.8	-177	0	109.7
341	R	29.7	Very low	35.3	Very low	249 Å²	249	154.5 Å²	154.5	94%	0.94	81%	0.806	S	S	*	*			trans	153.8	155.3	132.4	-86.7	169.4	-173.3	-134.8	1.4	114.8
342	G	29.1	Very low	34.2	Very low	68 Å²	68	157.2 Å²	157.2	70%	0.701	82%	0.815	S	S	*	*			trans	-144.2	-159.7	157.7	0	0	0	0	0	107.5
343	P	45.5	Very low	34.3	Very low	140 Å²	140	160.6 Å²	160.6	91%	0.909	82%	0.821	S	S	*	*			trans	-139.6	177.8	146.2	30.9	-12	0	0	0	116.8
344	K	31.2	Very low	34.1	Very low	199 Å²	199	156.2 Å²	156.2	87%	0.865	82%	0.817	S	S	*	*			trans	-146	-158.4	-176.2	-121.7	-178.4	-178.7	174.3	0	107
345	P	56.8	Low	33.8	Very low	106 Å²	106	161.9 Å²	161.9	69%	0.688	83%	0.829	S	S	*	*			cis	-107.4	-145.6	-11	18.6	7.6	0	0	0	111
346	K	31.1	Very low	33.6	Very low	197 Å²	197	161 Å²	161	86%	0.857	83%	0.827	S	S	*	*			cis	-153.4	166	13	-53.6	162.2	-173.5	169.6	0	108.4
347	G	32.1	Very low	34.4	Very low	68 Å²	68	155.9 Å²	155.9	70%	0.701	82%	0.824	S	S	*	*			cis	138.9	124.4	-16.8	0	0	0	0	0	116.1
348	K	30.4	Very low	33.3	Very low	214 Å²	214	154.1 Å²	154.1	93%	0.93	83%	0.825	S	S	*	*			trans	98.5	157.5	168.1	-59.7	176.5	-178.2	-177.1	0	117.8
349	K	33.5	Very low	33.2	Very low	202 Å²	202	152.3 Å²	152.3	88%	0.878	83%	0.831	S	S	*	*			cis	178.7	140.4	-38.3	-142.5	-175.2	-175.1	-168.6	0	109.9
350	K	28.7	Very low	33.2	Very low	207 Å²	207	148.9 Å²	148.9	90%	0.9	83%	0.83	S	S	*	*			trans	-168.6	152	165.7	-118.3	-174.9	-177	-172.6	0	114.6
351	P	48.4	Very low	34	Very low	123 Å²	123	145.2 Å²	145.2	80%	0.799	83%	0.826	S	S	*	*			trans	-140.7	174.2	168.7	42.3	-27.2	0	0	0	117.5
352	L	27.2	Very low	34	Very low	154 Å²	154	139.5 Å²	139.5	81%	0.806	82%	0.818	S	S	*	*			trans	96.1	123.6	147	-151.7	72.6	0	0	0	123
353	M	28.9	Very low	33.9	Very low	178 Å²	178	141.4 Å²	141.4	88%	0.877	82%	0.817	S	S	*	*			trans	41.6	145	151.7	-66	173.6	75.1	0	0	125.2
354	G	24.1	Very low	33.1	Very low	76 Å²	76	140.3 Å²	140.3	78%	0.784	81%	0.808	S	S	*	*			trans	175.4	157.2	164.2	0	0	0	0	0	113.1
355	Q	27.8	Very low	32.9	Very low	199 Å²	199	136.5 Å²	136.5	93%	0.93	80%	0.803	S	S	*	*			trans	-131.5	171.8	178.1	-65.7	-172.3	15	0	0	112.7
356	S	30.3	Very low	32	Very low	116 Å²	116	137 Å²	137	81%	0.811	81%	0.806	S	S	*	*			trans	-70.3	-173.1	178.5	-40.8	0	0	0	0	113.9
357	P	51.4	Low	32.1	Very low	132 Å²	132	133.3 Å²	133.3	86%	0.857	80%	0.802	S	S	*	*			cis	-142.2	-179.9	1.2	43.6	-25.6	0	0	0	117.8
358	G	26	Very low	31.9	Very low	66 Å²	66	139.5 Å²	139.5	68%	0.68	81%	0.813	S	S	*	*			trans	127	146.1	136	0	0	0	0	0	121.6
359	S	27.4	Very low	31.9	Very low	127 Å²	127	135.2 Å²	135.2	89%	0.888	80%	0.804	S	S	*	*			trans	89.5	151.5	161.3	75.2	0	0	0	0	121.9
360	S	28.4	Very low	31.7	Very low	116 Å²	116	135.2 Å²	135.2	81%	0.811	81%	0.805	S	S	*	*			trans	-148	-169.4	-169.5	-43.4	0	0	0	0	108.1
361	P	46.1	Very low	31.5	Very low	113 Å²	113	132.9 Å²	132.9	73%	0.734	80%	0.801	S	S	*	*			cis	-144.4	-155.5	11.5	34.6	-6.9	0	0	0	116
362	V	28.7	Very low	30.5	Very low	128 Å²	128	133.9 Å²	133.9	78%	0.776	80%	0.8	S	S	*	*			trans	79.8	132.4	161.7	172.5	0	0	0	0	117.6
363	T	27	Very low	30.4	Very low	109 Å²	109	133.2 Å²	133.2	67%	0.669	81%	0.805	S	S	*	*			cis	-161.5	138.2	-14.4	-94.4	0	0	0	0	112.2
364	T	29.3	Very low	30.3	Very low	117 Å²	117	129.2 Å²	129.2	72%	0.718	79%	0.794	S	S	*	*			trans	15	149.3	159	70.5	0	0	0	0	123
365	P	28.1	Very low	30.6	Very low	118 Å²	118	133.2 Å²	133.2	77%	0.766	79%	0.792	S	S	*	*				-118	-152.7	86.6	44.3	-40.5	0	0	0	111.9
366	P	36.8	Very low	30.4	Very low	116 Å²	116	130.7 Å²	130.7	75%	0.753	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-96.2	168.8	-132.3	3.6	21.9	0	0	0	114.6
367	P	33.8	Very low	30.5	Very low	120 Å²	120	128.7 Å²	128.7	78%	0.779	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-84.9	134.3	-169.3	32.8	-35	0	0	0	114.7
368	E	28.1	Very low	29.6	Very low	198 Å²	198	128.5 Å²	128.5	93%	0.925	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-75.9	134.7	158.5	-66.6	-173.7	131.4	0	0	110.3
369	V	29.1	Very low	29.5	Very low	124 Å²	124	132.3 Å²	132.3	75%	0.752	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-90	132	179.3	177.5	0	0	0	0	110	L371	V369-L371 PolarHBondContact O-N 2.71Å
370	K	29.6	Very low	30	Very low	203 Å²	203	131.8 Å²	131.8	88%	0.883	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-57.1	119.4	171	-75.5	-178.8	175.2	179	0	110.8
371	L	24.3	Very low	30.5	Very low	157 Å²	157	133.4 Å²	133.4	82%	0.822	77%	0.773	S	S	*	*			trans	-124.6	144.1	160.3	-72.9	174.2	0	0	0	109.7	V369	V369-L371 PolarHBondContact O-N 2.71Å
372	N	29	Very low	29.8	Very low	145 Å²	145	136.1 Å²	136.1	78%	0.775	78%	0.78	S	S	*	*			trans	-69.9	144	174.5	-64.7	-32.1	0	0	0	109.7	S374	N372-S374 VanDerWaalsContact C-N 3.29Å; N372-S374 PolarHBondContact O-N 2.82Å
373	P	24.5	Very low	29.8	Very low	140 Å²	140	134.4 Å²	134.4	91%	0.909	77%	0.774	S	S	*	*			trans	-75.3	81.2	171.6	31.7	-34.2	0	0	0	110.5
374	S	27.2	Very low	30.2	Very low	93 Å²	93	136 Å²	136	65%	0.65	78%	0.778	S	S	*	*			trans	-100.1	129.8	169.1	56.4	0	0	0	0	110.9	N372	N372-S374 VanDerWaalsContact C-N 3.29Å; N372-S374 PolarHBondContact O-N 2.82Å
375	H	29	Very low	30.3	Very low	161 Å²	161	132.1 Å²	132.1	75%	0.745	76%	0.761	S	S	*	*			trans	65.3	102.3	175.2	-74.7	-97.6	0	0	0	117.9	S377	H375-S377 PolarHBondContact ND1-OG 2.93Å
376	V	25.2	Very low	30.7	Very low	145 Å²	145	131.3 Å²	131.3	88%	0.879	76%	0.759	S	S	*	*				-99.8	118.6	116.3	176	0	0	0	0	106.1
377	S	32	Very low	30.7	Very low	75 Å²	75	131 Å²	131	52%	0.524	75%	0.751	S	S	.	*			trans	-76	137.9	178.4	-58.2	0	0	0	0	110.9	H375	H375-S377 PolarHBondContact ND1-OG 2.93Å
378	V	33.1	Very low	31.2	Very low	128 Å²	128	129.5 Å²	129.5	78%	0.776	74%	0.739	S	S	*	*			trans	-124.3	121.8	158.9	180	0	0	0	0	106	S380	V378-S380 PolarHBondContact O-N 3.48Å
379	D	23.3	Very low	32.8	Very low	146 Å²	146	124.7 Å²	124.7	78%	0.781	72%	0.719	S	S	*	*			trans	-68.7	122.7	-162.9	-68.9	-56.4	0	0	0	113.3	N381	D379-N381 PolarHBondContact O-N 2.72Å
380	S	38.4	Very low	35	Very low	116 Å²	116	121.2 Å²	121.2	81%	0.811	70%	0.699	S	S	*	*			trans	-81.6	94.5	-179.5	-63.4	0	0	0	0	110.8	V378	V378-S380 PolarHBondContact O-N 3.48Å
381	N	37.2	Very low	37.7	Very low	149 Å²	149	115.8 Å²	115.8	80%	0.797	68%	0.683	S	S	*	*			trans	-142.4	80.6	173.2	-95.5	-48.3	0	0	0	112.2	D379	D379-N381 PolarHBondContact O-N 2.72Å
382	L	31.4	Very low	40.9	Very low	170 Å²	170	108.8 Å²	108.8	89%	0.89	65%	0.647	S	S	*	*			trans	-138.5	81.1	166.9	-89.4	174.5	0	0	0	111.6
383	S	28.9	Very low	44	Very low	93 Å²	93	103.1 Å²	103.1	65%	0.65	62%	0.619	S	S	*	*			trans	42.7	93.7	130.2	-54.9	0	0	0	0	118	N30 G385	N30-S383 WeakPolarHBondContact ND2-CB 3.47Å; S383-G385 PolarHBondContact O-N 3.31Å
384	N	35.8	Very low	47.3	Very low	142 Å²	142	96.5 Å²	96.5	76%	0.759	58%	0.575	S	S	*	*			trans	-80.2	105	178.8	178.8	66.4	0	0	0	112.7	N30	N30-N384 WeakPolarHBondContact CB-O 3.39Å; N30-N384 PolarHBondContact OD1-O 3.41Å
385	G	30.7	Very low	50.4	Low	35 Å²	35	95 Å²	95	36%	0.361	56%	0.556	S	S	.	*			trans	-141.8	127.4	-179.5	0	0	0	0	0	114	N30 S383 N387	N30-G385 VanDerWaalsContact OD1-CA 3.25Å; N30-G385 WeakPolarHBondContact OD1-CA 3.4Å; S383-G385 PolarHBondContact O-N 3.31Å; G385-N387 VanDerWaalsContact C-N 3.32Å; G385-N387 PolarHBondContact O-N 2.9Å
386	S	37.2	Very low	53.4	Low	102 Å²	102	87.7 Å²	87.7	71%	0.713	52%	0.523	S	S	*	.			trans	-81.7	61.5	-169.4	67.1	0	0	0	0	114.5	V388	S386-V388 PolarHBondContact O-N 2.9Å
387	N	36.9	Very low	56.4	Low	109 Å²	109	81.9 Å²	81.9	58%	0.583	49%	0.487	S	S	*	.			trans	-65.5	124.3	162.3	-95.1	-79.6	0	0	0	109.3	G385 I389	G385-N387 VanDerWaalsContact C-N 3.32Å; G385-N387 PolarHBondContact O-N 2.9Å; N387-I389 HydrophobicContact CB-CG1 3.71Å; N387-I389 PolarHBondContact O-N 3.38Å
388	V	45.5	Very low	58.9	Low	89 Å²	89	79.9 Å²	79.9	54%	0.539	47%	0.469	S	S	.	.			trans	-74.6	77.9	160.8	-178.1	0	0	0	0	106.9	S386 C390	S386-V388 PolarHBondContact O-N 2.9Å; V388-C390 PolarHBondContact O-N 3.45Å
389	I	60.4	Low	61.2	Low	97 Å²	97	80.8 Å²	80.8	50%	0.497	46%	0.464	S	S	.	.			trans	-63.8	112	-178.7	-52.1	171.8	0	0	0	107.4	N387 T391 P422	N387-I389 HydrophobicContact CB-CG1 3.71Å; N387-I389 PolarHBondContact O-N 3.38Å; I389-T391 PolarHBondContact O-N 3.23Å; I389-P422 HydrophobicContact CG2-CB 3.46Å; I389-P422 VanDerWaalsContact CG2-CB 3.46Å; I389-P422 HydrophobicContact CG2-CG 3.7Å
390	C	75.8	Confident	63.7	Low	50 Å²	50	74.8 Å²	74.8	34%	0.338	44%	0.437	S	S	.	.			trans	-57.6	115.6	173.1	-75.3	0	0	0	0	108.3	V388 V423	V388-C390 PolarHBondContact O-N 3.45Å; C390-V423 HydrophobicContact CB-CG1 4Å; C390-V423 HydrophobicContact CB-CG2 3.9Å; C390-V423 WeakPolarHBondContact O-CG1 3.36Å; C390-V423 WeakPolarHBondContact O-CG2 3.4Å; C390-V423 PolarHBondContact O-N 3.14Å
391	T	86.4	Confident	65.5	Low	89 Å²	89	73.6 Å²	73.6	55%	0.546	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	152.1	175.1	54.1	0	0	0	0	110.8	I389 A421	I389-T391 PolarHBondContact O-N 3.23Å; T391-A421 VanDerWaalsContact CA-O 3.22Å; T391-A421 WeakPolarHBondContact CA-O 3.14Å
392	V	91.3	Very high	67.5	Low	11 Å²	11	67.9 Å²	67.9	7%	0.067	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	151	174.4	65.4	0	0	0	0	109.2	V394 P420 A421 V423 V426 A478 V481	V392-V394 HydrophobicContact CG1-CG2 4.45Å; V392-V394 HydrophobicContact CG2-CG2 4.03Å; V392-P420 WeakPolarHBondContact O-CA 3.43Å; V392-A421 PolarHBondContact N-O 3.12Å; V392-A421 PolarHBondContact O-N 3.44Å; V392-V423 HydrophobicContact CB-CG1 4.03Å; V392-V423 HydrophobicContact CG1-CB 4.48Å; V392-V423 HydrophobicContact CG1-CG1 3.86Å; V392-V426 HydrophobicContact CG1-CB 3.68Å; V392-V426 HydrophobicContact CG1-CG1 3.75Å; V392-V426 HydrophobicContact CG1-CG2 3.99Å; V392-A478 HydrophobicContact CB-CB 3.87Å; V392-A478 HydrophobicContact CG2-CB 3.59Å; V392-V481 HydrophobicContact CG1-CG1 4.44Å; V392-V481 HydrophobicContact CG1-CG2 4.4Å
393	C	93.3	Very high	69.9	Low	26 Å²	26	60.8 Å²	60.8	18%	0.176	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	128	166.1	-170.7	0	0	0	0	107.6	Y395 F418 P420	C393-Y395 HydrophobicContact CB-CE2 4.31Å; C393-F418 CarbonylContact C-O 3.58Å; C393-F418 WeakPolarHBondContact CA-O 3.38Å; C393-P420 HydrophobicContact CB-CB 4.48Å
394	V	94	Very high	72.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117	179.5	-179.1	0	0	0	0	108.4	V392 H417 F418 V426 V481 L482 L485 F498	V392-V394 HydrophobicContact CG1-CG2 4.45Å; V392-V394 HydrophobicContact CG2-CG2 4.03Å; V394-H417 CarbonylContact O-C 2.99Å; V394-H417 WeakPolarHBondContact O-CA 3.48Å; V394-H417 WeakPolarHBondContact O-CB 3.43Å; V394-F418 PolarHBondContact N-O 2.9Å; V394-F418 PolarHBondContact O-N 3.34Å; V394-V426 HydrophobicContact CB-CG1 4.24Å; V394-V426 HydrophobicContact CG2-CG1 3.8Å; V394-V481 HydrophobicContact CG2-CG1 4.28Å; V394-L482 HydrophobicContact CG2-CD2 4.28Å; V394-L485 HydrophobicContact CG1-CD1 3.84Å; V394-L485 HydrophobicContact CG2-CD1 4.23Å; V394-F498 HydrophobicContact CG1-CB 3.87Å; V394-F498 HydrophobicContact CG1-CD1 3.65Å; V394-F498 HydrophobicContact CG1-CE1 4.48Å; V394-F498 HydrophobicContact CG1-CG 4.01Å
395	Y	92.5	Very high	74.9	Confident	61 Å²	61	55.4 Å²	55.4	24%	0.239	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	150.2	-178.8	-62.6	-88.8	0	0	0	111.2	C393 D416 H417 F498 S499 P502	C393-Y395 HydrophobicContact CB-CE2 4.31Å; Y395-D416 WeakPolarHBondContact CA-O 3.15Å; Y395-H417 HydrophobicContact CD1-CB 3.66Å; Y395-H417 HydrophobicContact CE1-CB 3.95Å; Y395-H417 HydrophobicContact CG-CB 4.22Å; Y395-F498 WeakPolarHBondContact O-CA 3.35Å; Y395-S499 PolarHBondContact N-O 2.93Å; Y395-S499 PolarHBondContact O-N 3.09Å; Y395-P502 HydrophobicContact CD1-CB 3.74Å; Y395-P502 HydrophobicContact CE1-CB 3.79Å; Y395-P502 HydrophobicContact CE1-CG 4.36Å; Y395-P502 HydrophobicContact CG-CB 4.23Å
396	V	92	Very high	77.6	Confident	8 Å²	8	54 Å²	54	5%	0.048	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.5	-173	-172.9	0	0	0	0	111.4	K398 L414 P415 D416 F418 F498	V396-K398 PolarHBondContact O-N 3.27Å; V396-L414 HydrophobicContact CG1-CB 4.42Å; V396-L414 HydrophobicContact CG1-CD1 4.24Å; V396-P415 WeakPolarHBondContact CB-O 3.43Å; V396-P415 WeakPolarHBondContact CG2-O 2.87Å; V396-D416 PolarHBondContact N-O 2.73Å; V396-F418 HydrophobicContact CG2-CD2 3.75Å; V396-F418 HydrophobicContact CG2-CE2 3.5Å; V396-F498 HydrophobicContact CG2-CD1 4.33Å; V396-F498 HydrophobicContact CG2-CE1 4.11Å
397	N	88.9	Confident	80.1	Confident	23 Å²	23	50.5 Å²	50.5	12%	0.123	28%	0.281	C	S	.	.			trans	-92.1	76.4	-176.4	-161	-6.7	0	0	0	112.9	H399 G400 S496 L497 F503	N397-H399 PolarHBondContact O-N 3.03Å; N397-G400 WeakPolarHBondContact ND2-CA 3.46Å; N397-G400 PolarHBondContact O-N 3.48Å; N397-G400 VanDerWaalsContact O-N 3.08Å; N397-G400 PolarHBondContact OD1-N 3.17Å; N397-S496 WeakPolarHBondContact CB-O 3.43Å; N397-S496 PolarHBondContact ND2-O 3.22Å; N397-L497 WeakPolarHBondContact CB-O 3.41Å; N397-L497 PolarHBondContact N-O 2.92Å; N397-F503 HydrophobicContact CB-CD1 4.18Å; N397-F503 HydrophobicContact CB-CD2 3.94Å; N397-F503 HydrophobicContact CB-CE1 3.83Å; N397-F503 HydrophobicContact CB-CE2 3.57Å; N397-F503 HydrophobicContact CB-CG 4.23Å; N397-F503 HydrophobicContact CB-CZ 3.5Å; N397-F503 WeakPolarHBondContact ND2-CE1 3.4Å
398	K	85	Confident	82.4	Confident	34 Å²	34	52.1 Å²	52.1	15%	0.148	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-12.6	178.6	-64.6	179.2	174.9	178.6	0	115	V396 L414 D416	V396-K398 PolarHBondContact O-N 3.27Å; K398-L414 WeakPolarHBondContact CE-O 3.4Å; K398-L414 PolarHBondContact NZ-O 3.09Å; K398-D416 WeakPolarHBondContact CD-OD1 3.19Å; K398-D416 WeakPolarHBondContact CE-OD1 3.42Å; K398-D416 IonicContact NZ-OD1 2.97Å; K398-D416 PolarHBondContact NZ-OD1 2.88Å; K398-D416 IonicContact NZ-OD2 2.77Å
399	H	80.2	Confident	84.4	Confident	146 Å²	146	55.1 Å²	55.1	68%	0.676	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	2.2	-177.8	-53.5	-63.8	0	0	0	113.4	N397	N397-H399 PolarHBondContact O-N 3.03Å
400	G	74.9	Confident	85.8	Confident	21 Å²	21	53.9 Å²	53.9	22%	0.216	28%	0.278	C	S	.	.	S	Bend	trans	-79.1	-166.6	-179.9	0	0	0	0	0	114.2	N397 Y402	N397-G400 WeakPolarHBondContact ND2-CA 3.46Å; N397-G400 PolarHBondContact O-N 3.48Å; N397-G400 VanDerWaalsContact O-N 3.08Å; N397-G400 PolarHBondContact OD1-N 3.17Å; G400-Y402 WeakPolarHBondContact O-CD1 3.18Å; G400-Y402 WeakPolarHBondContact O-CE1 3.41Å
401	N	78	Confident	86.4	Confident	90 Å²	90	51.5 Å²	51.5	48%	0.481	26%	0.263	S	S	.	.			trans	-95.2	102.9	173	-177.9	24.8	0	0	0	110.1	G403 S494 D495	N401-G403 PolarHBondContact O-N 3.16Å; N401-G403 PolarHBondContact OD1-N 3.49Å; N401-S494 CarbonylContact O-C 3.53Å; N401-S494 VanDerWaalsContact O-C 3.29Å; N401-S494 WeakPolarHBondContact O-CA 3.21Å; N401-D495 PolarHBondContact O-N 3.02Å
402	Y	77.6	Confident	86.4	Confident	30 Å²	30	51.3 Å²	51.3	12%	0.118	26%	0.255	C	S	.	.			trans	-82.4	8	-178.8	10.5	-90.1	0	0	0	114	G400 R408 V411 S494	G400-Y402 WeakPolarHBondContact O-CD1 3.18Å; G400-Y402 WeakPolarHBondContact O-CE1 3.41Å; Y402-R408 HydrophobicContact CD2-CB 4.23Å; Y402-R408 HydrophobicContact CE2-CB 3.72Å; Y402-R408 HydrophobicContact CE2-CG 3.63Å; Y402-R408 WeakPolarHBondContact OH-CD 3.29Å; Y402-R408 PolarHBondContact OH-NE 3.3Å; Y402-R408 VanDerWaalsContact OH-NE 3.17Å; Y402-V411 HydrophobicContact CD1-CG1 3.91Å; Y402-V411 HydrophobicContact CG-CG1 4.45Å; Y402-S494 WeakPolarHBondContact O-CB 3.27Å
403	G	81.8	Confident	86.3	Confident	20 Å²	20	57.7 Å²	57.7	21%	0.206	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	-172	179.5	0	0	0	0	0	113.6	N401 E493	N401-G403 PolarHBondContact O-N 3.16Å; N401-G403 PolarHBondContact OD1-N 3.49Å; G403-E493 VanDerWaalsContact CA-O 3.22Å; G403-E493 WeakPolarHBondContact CA-O 3.31Å
404	P	85.3	Confident	86.2	Confident	79 Å²	79	57.5 Å²	57.5	51%	0.513	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-13.1	-179.8	33.9	-32.5	0	0	0	113.4
405	H	84.9	Confident	86.1	Confident	44 Å²	44	60.4 Å²	60.4	20%	0.204	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-9.5	-169.1	-67.2	-60.9	0	0	0	115.4	T438 Y439 L492	H405-T438 CarbonylContact O-C 3.46Å; H405-T438 VanDerWaalsContact O-CA 3.31Å; H405-T438 WeakPolarHBondContact O-CA 3.49Å; H405-Y439 PolarHBondContact O-N 3.22Å; H405-L492 HydrophobicContact CB-CD2 4.02Å
406	L	88.6	Confident	85.9	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.026	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-114.3	138.5	-175.6	-65.9	172.3	0	0	0	112.6	R408 V411 C437 T438 L497	L406-R408 PolarHBondContact O-N 3.35Å; L406-V411 HydrophobicContact CB-CG2 4.02Å; L406-V411 HydrophobicContact CD1-CG2 4.42Å; L406-C437 CarbonylContact C-O 3.5Å; L406-C437 WeakPolarHBondContact CA-O 3.48Å; L406-C437 HydrophobicContact CD2-CB 3.95Å; L406-T438 HydrophobicContact CD2-CG2 3.59Å; L406-L497 HydrophobicContact CD1-CD2 3.53Å
407	D	88.2	Confident	85.9	Confident	29 Å²	29	65.8 Å²	65.8	16%	0.155	33%	0.33	C	S	.	.			trans	-75.3	117.5	174.5	-173.7	-70.6	0	0	0	111.5	K409 L410 V411 C437 Y439	D407-K409 VanDerWaalsContact C-N 3.29Å; D407-K409 PolarHBondContact O-N 3.21Å; D407-K409 VanDerWaalsContact OD1-CA 3.3Å; D407-K409 WeakPolarHBondContact OD1-CA 3.2Å; D407-K409 VanDerWaalsContact OD1-CB 3.22Å; D407-K409 WeakPolarHBondContact OD1-CB 3.41Å; D407-K409 PolarHBondContact OD1-N 3.24Å; D407-L410 HydrophobicContact CB-CB 4.14Å; D407-L410 HydrophobicContact CB-CD1 3.95Å; D407-L410 HydrophobicContact CB-CG 3.92Å; D407-L410 PolarHBondContact O-N 3.03Å; D407-L410 VanDerWaalsContact O-N 3.15Å; D407-L410 PolarHBondContact OD1-N 2.91Å; D407-V411 WeakPolarHBondContact O-CG2 3.46Å; D407-V411 PolarHBondContact O-N 2.73Å; D407-C437 PolarHBondContact N-O 3.3Å; D407-Y439 VanDerWaalsContact CA-CZ 3.5Å; D407-Y439 WeakPolarHBondContact CA-OH 3.42Å; D407-Y439 HydrophobicContact CB-CD1 4.32Å; D407-Y439 HydrophobicContact CB-CE1 3.6Å; D407-Y439 HydrophobicContact CB-CE2 4.18Å; D407-Y439 WeakPolarHBondContact CB-OH 3.26Å; D407-Y439 WeakPolarHBondContact OD2-CE1 3.34Å; D407-Y439 VanDerWaalsContact OD2-CZ 3.23Å; D407-Y439 PolarHBondContact OD2-OH 3.46Å
408	R	86	Confident	86.1	Confident	143 Å²	143	65.5 Å²	65.5	54%	0.54	33%	0.328	S	S	.	.	H	α-helix	trans	-55.3	-37.9	179.4	176.8	174	-178.4	163.5	5.2	113.9	Y402 L406 Q412	Y402-R408 HydrophobicContact CD2-CB 4.23Å; Y402-R408 HydrophobicContact CE2-CB 3.72Å; Y402-R408 HydrophobicContact CE2-CG 3.63Å; Y402-R408 WeakPolarHBondContact OH-CD 3.29Å; Y402-R408 PolarHBondContact OH-NE 3.3Å; Y402-R408 VanDerWaalsContact OH-NE 3.17Å; L406-R408 PolarHBondContact O-N 3.35Å; R408-Q412 WeakPolarHBondContact O-CB 3.26Å; R408-Q412 WeakPolarHBondContact O-CG 3.2Å; R408-Q412 PolarHBondContact O-N 2.83Å; R408-Q412 VanDerWaalsContact O-N 3.1Å
409	K	87.5	Confident	86.3	Confident	151 Å²	151	64.9 Å²	64.9	66%	0.657	33%	0.331	S	S	*	.	H	α-helix	trans	-73.4	-35.5	-179.2	-57.2	173.6	-179.5	171.2	0	110.8	D407 Q413	D407-K409 VanDerWaalsContact C-N 3.29Å; D407-K409 PolarHBondContact O-N 3.21Å; D407-K409 VanDerWaalsContact OD1-CA 3.3Å; D407-K409 WeakPolarHBondContact OD1-CA 3.2Å; D407-K409 VanDerWaalsContact OD1-CB 3.22Å; D407-K409 WeakPolarHBondContact OD1-CB 3.41Å; D407-K409 PolarHBondContact OD1-N 3.24Å; K409-Q413 WeakPolarHBondContact O-CG 3.34Å; K409-Q413 PolarHBondContact O-N 2.69Å; K409-Q413 PolarHBondContact O-NE2 2.75Å
410	L	88.8	Confident	86.8	Confident	71 Å²	71	62.8 Å²	62.8	37%	0.372	33%	0.33	S	S	.	.	H	α-helix	trans	-72	-44.9	175.4	-58.7	-177.6	0	0	0	111	D407 Q412 Q413 L414 C437	D407-L410 HydrophobicContact CB-CB 4.14Å; D407-L410 HydrophobicContact CB-CD1 3.95Å; D407-L410 HydrophobicContact CB-CG 3.92Å; D407-L410 PolarHBondContact O-N 3.03Å; D407-L410 VanDerWaalsContact O-N 3.15Å; D407-L410 PolarHBondContact OD1-N 2.91Å; L410-Q412 PolarHBondContact O-N 2.99Å; L410-Q413 WeakPolarHBondContact O-CA 3.27Å; L410-Q413 WeakPolarHBondContact O-CB 3.21Å; L410-Q413 PolarHBondContact O-N 3.18Å; L410-L414 PolarHBondContact O-N 2.66Å; L410-C437 HydrophobicContact CB-CB 4.17Å; L410-C437 VanDerWaalsContact CB-SG 3.59Å
411	V	88.8	Confident	87.5	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.006	33%	0.33	C	S	.	.	H	α-helix	trans	-57.7	-35.9	174.2	172.2	0	0	0	0	112.1	Y402 L406 D407 Q413 L414 C437 L497	Y402-V411 HydrophobicContact CD1-CG1 3.91Å; Y402-V411 HydrophobicContact CG-CG1 4.45Å; L406-V411 HydrophobicContact CB-CG2 4.02Å; L406-V411 HydrophobicContact CD1-CG2 4.42Å; D407-V411 WeakPolarHBondContact O-CG2 3.46Å; D407-V411 PolarHBondContact O-N 2.73Å; V411-Q413 VanDerWaalsContact C-N 3.3Å; V411-Q413 PolarHBondContact O-N 2.84Å; V411-L414 WeakPolarHBondContact O-CB 3.31Å; V411-L414 PolarHBondContact O-N 3.01Å; V411-C437 HydrophobicContact CG2-CB 4.08Å; V411-L497 HydrophobicContact CG1-CD1 3.97Å
412	Q	87.1	Confident	88.2	Confident	84 Å²	84	60.9 Å²	60.9	39%	0.393	32%	0.322	S	S	.	.	H	α-helix	trans	-71	-20.5	175.1	-75.8	177.9	-13.2	0	0	114.2	R408 L410	R408-Q412 WeakPolarHBondContact O-CB 3.26Å; R408-Q412 WeakPolarHBondContact O-CG 3.2Å; R408-Q412 PolarHBondContact O-N 2.83Å; R408-Q412 VanDerWaalsContact O-N 3.1Å; L410-Q412 PolarHBondContact O-N 2.99Å
413	Q	90	Very high	88.9	Confident	145 Å²	145	60 Å²	60	68%	0.678	32%	0.319	S	S	*	.	H	α-helix	trans	-88.7	-9.6	176.8	-74.2	168.1	77.8	0	0	113.8	K409 L410 V411	K409-Q413 WeakPolarHBondContact O-CG 3.34Å; K409-Q413 PolarHBondContact O-N 2.69Å; K409-Q413 PolarHBondContact O-NE2 2.75Å; L410-Q413 WeakPolarHBondContact O-CA 3.27Å; L410-Q413 WeakPolarHBondContact O-CB 3.21Å; L410-Q413 PolarHBondContact O-N 3.18Å; V411-Q413 VanDerWaalsContact C-N 3.3Å; V411-Q413 PolarHBondContact O-N 2.84Å
414	L	90.4	Very high	89.4	Confident	23 Å²	23	60.9 Å²	60.9	12%	0.12	32%	0.319	C	S	.	.	S	Bend	trans	-61.1	160.1	174.4	-64.5	-175	0	0	0	111.9	V396 K398 L410 V411 A433	V396-L414 HydrophobicContact CG1-CB 4.42Å; V396-L414 HydrophobicContact CG1-CD1 4.24Å; K398-L414 WeakPolarHBondContact CE-O 3.4Å; K398-L414 PolarHBondContact NZ-O 3.09Å; L410-L414 PolarHBondContact O-N 2.66Å; V411-L414 WeakPolarHBondContact O-CB 3.31Å; V411-L414 PolarHBondContact O-N 3.01Å; L414-A433 HydrophobicContact CD1-CB 4.41Å; L414-A433 HydrophobicContact CD2-CB 3.81Å
415	P	91.3	Very high	89.7	Confident	61 Å²	61	58.3 Å²	58.3	40%	0.396	31%	0.305	S	S	.	.			trans	-64.8	159.8	167.7	30.6	-37.2	0	0	0	111	V396 H417 F418	V396-P415 WeakPolarHBondContact CB-O 3.43Å; V396-P415 WeakPolarHBondContact CG2-O 2.87Å; P415-H417 WeakPolarHBondContact CB-O 3.08Å; P415-H417 PolarHBondContact O-N 3.31Å; P415-F418 HydrophobicContact CG-CD1 3.91Å; P415-F418 HydrophobicContact CG-CE1 3.47Å; P415-F418 VanDerWaalsContact CG-CE1 3.47Å; P415-F418 HydrophobicContact CG-CE2 4.23Å; P415-F418 HydrophobicContact CG-CG 4.46Å; P415-F418 HydrophobicContact CG-CZ 3.64Å
416	D	87.9	Confident	90.1	Very high	99 Å²	99	56.2 Å²	56.2	53%	0.529	30%	0.295	S	S	.	.	S	Bend	trans	-70.8	-17.9	176.2	-56.1	-57.1	0	0	0	112.8	Y395 V396 K398	Y395-D416 WeakPolarHBondContact CA-O 3.15Å; V396-D416 PolarHBondContact N-O 2.73Å; K398-D416 WeakPolarHBondContact CD-OD1 3.19Å; K398-D416 WeakPolarHBondContact CE-OD1 3.42Å; K398-D416 IonicContact NZ-OD1 2.97Å; K398-D416 PolarHBondContact NZ-OD1 2.88Å; K398-D416 IonicContact NZ-OD2 2.77Å
417	H	92.7	Very high	90.4	Very high	82 Å²	82	56.1 Å²	56.1	38%	0.38	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	157.4	175.4	57.7	-72.9	0	0	0	112.1	V394 Y395 P415 G419	V394-H417 CarbonylContact O-C 2.99Å; V394-H417 WeakPolarHBondContact O-CA 3.48Å; V394-H417 WeakPolarHBondContact O-CB 3.43Å; Y395-H417 HydrophobicContact CD1-CB 3.66Å; Y395-H417 HydrophobicContact CE1-CB 3.95Å; Y395-H417 HydrophobicContact CG-CB 4.22Å; P415-H417 WeakPolarHBondContact CB-O 3.08Å; P415-H417 PolarHBondContact O-N 3.31Å; H417-G419 PolarHBondContact CD2-O 2.95Å; H417-G419 VanDerWaalsContact CD2-O 3.3Å
418	F	93.6	Very high	90.6	Very high	18 Å²	18	57.4 Å²	57.4	8%	0.079	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.3	169.2	-62.3	-81.9	0	0	0	109.3	C393 V394 V396 P415 V426 Q429 A430 A433 F498	C393-F418 CarbonylContact C-O 3.58Å; C393-F418 WeakPolarHBondContact CA-O 3.38Å; V394-F418 PolarHBondContact N-O 2.9Å; V394-F418 PolarHBondContact O-N 3.34Å; V396-F418 HydrophobicContact CG2-CD2 3.75Å; V396-F418 HydrophobicContact CG2-CE2 3.5Å; P415-F418 HydrophobicContact CG-CD1 3.91Å; P415-F418 HydrophobicContact CG-CE1 3.47Å; P415-F418 VanDerWaalsContact CG-CE1 3.47Å; P415-F418 HydrophobicContact CG-CE2 4.23Å; P415-F418 HydrophobicContact CG-CG 4.46Å; P415-F418 HydrophobicContact CG-CZ 3.64Å; F418-V426 HydrophobicContact CB-CG1 3.85Å; F418-Q429 HydrophobicContact CD1-CB 3.8Å; F418-Q429 HydrophobicContact CE1-CB 4.29Å; F418-A430 HydrophobicContact CD2-CB 3.96Å; F418-A430 HydrophobicContact CE2-CB 4.32Å; F418-A430 HydrophobicContact CG-CB 4.35Å; F418-A433 HydrophobicContact CE1-CB 4.05Å; F418-A433 HydrophobicContact CE2-CB 4.28Å; F418-A433 HydrophobicContact CZ-CB 3.45Å; F418-A433 VanDerWaalsContact CZ-CB 3.45Å; F418-F498 HydrophobicContact CD2-CE1 4.27Å; F418-F498 HydrophobicContact CE2-CE1 4.05Å
419	G	89.9	Confident	91	Very high	21 Å²	21	54.9 Å²	54.9	22%	0.216	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	93	-166.7	-170.1	0	0	0	0	0	113.5	H417 A421	H417-G419 PolarHBondContact CD2-O 2.95Å; H417-G419 VanDerWaalsContact CD2-O 3.3Å; G419-A421 VanDerWaalsContact CA-N 3.25Å
420	P	89.4	Confident	91.3	Very high	101 Å²	101	47.7 Å²	47.7	66%	0.656	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	cis	-67	112.9	0	28	-34.6	0	0	0	111.9	V392 C393	V392-P420 WeakPolarHBondContact O-CA 3.43Å; C393-P420 HydrophobicContact CB-CB 4.48Å
421	A	90.6	Very high	91.5	Very high	24 Å²	24	44.3 Å²	44.3	20%	0.198	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	174.3	-174.6	0	0	0	0	0	109.9	T391 V392 G419 V426	T391-A421 VanDerWaalsContact CA-O 3.22Å; T391-A421 WeakPolarHBondContact CA-O 3.14Å; V392-A421 PolarHBondContact N-O 3.12Å; V392-A421 PolarHBondContact O-N 3.44Å; G419-A421 VanDerWaalsContact CA-N 3.25Å; A421-V426 HydrophobicContact CB-CG2 3.68Å; A421-V426 WeakPolarHBondContact O-CG2 3.48Å
422	P	92.1	Very high	91.7	Very high	48 Å²	48	45.7 Å²	45.7	31%	0.312	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	137.8	-176.6	-29.4	37.5	0	0	0	113.4	I389 N424 A425 V426	I389-P422 HydrophobicContact CG2-CB 3.46Å; I389-P422 VanDerWaalsContact CG2-CB 3.46Å; I389-P422 HydrophobicContact CG2-CG 3.7Å; P422-N424 VanDerWaalsContact C-N 3.27Å; P422-N424 PolarHBondContact O-N 3.31Å; P422-N424 VanDerWaalsContact O-N 3.16Å; P422-A425 HydrophobicContact CB-CB 4.01Å; P422-A425 HydrophobicContact CG-CB 4.37Å; P422-A425 WeakPolarHBondContact O-CA 3.49Å; P422-A425 PolarHBondContact O-N 2.81Å; P422-V426 PolarHBondContact O-N 2.79Å
423	V	92.3	Very high	91.9	Very high	10 Å²	10	42.3 Å²	42.3	6%	0.061	24%	0.237	C	C	.	.	H	α-helix	trans	-50.3	-42.7	-178.8	-80.5	0	0	0	0	113.8	C390 V392 L427 A475 V481	C390-V423 HydrophobicContact CB-CG1 4Å; C390-V423 HydrophobicContact CB-CG2 3.9Å; C390-V423 WeakPolarHBondContact O-CG1 3.36Å; C390-V423 WeakPolarHBondContact O-CG2 3.4Å; C390-V423 PolarHBondContact O-N 3.14Å; V392-V423 HydrophobicContact CB-CG1 4.03Å; V392-V423 HydrophobicContact CG1-CB 4.48Å; V392-V423 HydrophobicContact CG1-CG1 3.86Å; V423-L427 WeakPolarHBondContact O-CB 3.03Å; V423-L427 PolarHBondContact O-N 3.48Å; V423-A475 HydrophobicContact CB-CB 4.42Å; V423-A475 WeakPolarHBondContact CG2-O 3.23Å; V423-V481 HydrophobicContact CB-CG2 3.69Å; V423-V481 HydrophobicContact CG1-CG2 3.94Å; V423-V481 WeakPolarHBondContact O-CG2 3.32Å
424	N	91.9	Very high	91.9	Very high	39 Å²	39	35.4 Å²	35.4	21%	0.209	21%	0.205	C	C	.	.	H	α-helix	trans	-68.7	-38.7	176.6	-80.5	-15.6	0	0	0	113	P422 Q428 E457 S474 A475	P422-N424 VanDerWaalsContact C-N 3.27Å; P422-N424 PolarHBondContact O-N 3.31Å; P422-N424 VanDerWaalsContact O-N 3.16Å; N424-Q428 WeakPolarHBondContact O-CB 3.47Å; N424-Q428 PolarHBondContact O-N 3.37Å; N424-E457 HydrophobicContact CB-CG 4.15Å; N424-S474 PolarHBondContact ND2-OG 2.69Å; N424-A475 PolarHBondContact OD1-N 3.44Å; N424-A475 PolarHBondContact OD1-O 3.32Å
425	A	92	Very high	91.9	Very high	26 Å²	26	34.5 Å²	34.5	22%	0.215	20%	0.201	C	C	.	.	H	α-helix	trans	-71.7	-40.2	177.9	0	0	0	0	0	112.1	P422 Q428 Q429	P422-A425 HydrophobicContact CB-CB 4.01Å; P422-A425 HydrophobicContact CG-CB 4.37Å; P422-A425 WeakPolarHBondContact O-CA 3.49Å; P422-A425 PolarHBondContact O-N 2.81Å; A425-Q428 PolarHBondContact O-N 2.79Å; A425-Q429 WeakPolarHBondContact O-CB 3.18Å; A425-Q429 VanDerWaalsContact O-CG 3.24Å; A425-Q429 WeakPolarHBondContact O-CG 3.4Å; A425-Q429 PolarHBondContact O-N 3.49Å
426	V	93.6	Very high	91.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.3	-38.1	175.8	177.4	0	0	0	0	111	V392 V394 F418 A421 P422 Q429 A430	V392-V426 HydrophobicContact CG1-CB 3.68Å; V392-V426 HydrophobicContact CG1-CG1 3.75Å; V392-V426 HydrophobicContact CG1-CG2 3.99Å; V394-V426 HydrophobicContact CB-CG1 4.24Å; V394-V426 HydrophobicContact CG2-CG1 3.8Å; F418-V426 HydrophobicContact CB-CG1 3.85Å; A421-V426 HydrophobicContact CB-CG2 3.68Å; A421-V426 WeakPolarHBondContact O-CG2 3.48Å; P422-V426 PolarHBondContact O-N 2.79Å; V426-Q429 PolarHBondContact O-N 2.92Å; V426-A430 VanDerWaalsContact O-CB 3.26Å; V426-A430 WeakPolarHBondContact O-CB 3.25Å; V426-A430 PolarHBondContact O-N 3.04Å
427	L	93.3	Very high	92	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-48.3	171.7	-178.6	63.1	0	0	0	111.2	V423 Q429 V431 L472 A475 V481 F484 L485	V423-L427 WeakPolarHBondContact O-CB 3.03Å; V423-L427 PolarHBondContact O-N 3.48Å; L427-Q429 PolarHBondContact O-N 2.87Å; L427-V431 HydrophobicContact CD1-CG2 3.87Å; L427-V431 HydrophobicContact CG-CG2 4.44Å; L427-V431 WeakPolarHBondContact O-CB 3.2Å; L427-V431 WeakPolarHBondContact O-CG2 3.01Å; L427-V431 PolarHBondContact O-N 2.97Å; L427-L472 HydrophobicContact CG-CD1 4.25Å; L427-A475 HydrophobicContact CD2-CB 4.07Å; L427-V481 HydrophobicContact CB-CG1 4.08Å; L427-V481 HydrophobicContact CB-CG2 4.2Å; L427-V481 HydrophobicContact CD1-CG1 4.09Å; L427-F484 HydrophobicContact CD1-CB 4.12Å; L427-F484 HydrophobicContact CD1-CD1 3.59Å; L427-F484 HydrophobicContact CD1-CE1 4.27Å; L427-F484 HydrophobicContact CD1-CG 4Å; L427-L485 HydrophobicContact CD1-CD2 4.26Å; L427-L485 HydrophobicContact CD1-CG 4.32Å
428	Q	93.6	Very high	91.8	Very high	57 Å²	57	27.7 Å²	27.7	27%	0.266	17%	0.165	S	C	.	.	H	α-helix	trans	-56.8	-48.9	175.3	-173.5	-170.5	38.3	0	0	111.6	N424 A425 Q432 E457 V458 I459 L472	N424-Q428 WeakPolarHBondContact O-CB 3.47Å; N424-Q428 PolarHBondContact O-N 3.37Å; A425-Q428 PolarHBondContact O-N 2.79Å; Q428-Q432 WeakPolarHBondContact O-CB 3.49Å; Q428-Q432 PolarHBondContact O-N 3.36Å; Q428-E457 HydrophobicContact CB-CB 3.88Å; Q428-E457 HydrophobicContact CB-CG 4.22Å; Q428-E457 HydrophobicContact CG-CB 3.92Å; Q428-E457 HydrophobicContact CG-CG 4.48Å; Q428-E457 PolarHBondContact NE2-OE2 2.63Å; Q428-V458 PolarHBondContact NE2-O 3.16Å; Q428-I459 HydrophobicContact CB-CG2 4.48Å; Q428-I459 HydrophobicContact CG-CG2 3.73Å; Q428-L472 HydrophobicContact CB-CD1 4.44Å
429	Q	93.9	Very high	91.4	Very high	89 Å²	89	33.4 Å²	33.4	42%	0.416	19%	0.187	S	C	.	.	H	α-helix	trans	-63	-49.7	179.9	-74.6	173.8	-6.7	0	0	112.6	F418 A425 V426 L427 V431 Q432 A433	F418-Q429 HydrophobicContact CD1-CB 3.8Å; F418-Q429 HydrophobicContact CE1-CB 4.29Å; A425-Q429 WeakPolarHBondContact O-CB 3.18Å; A425-Q429 VanDerWaalsContact O-CG 3.24Å; A425-Q429 WeakPolarHBondContact O-CG 3.4Å; A425-Q429 PolarHBondContact O-N 3.49Å; V426-Q429 PolarHBondContact O-N 2.92Å; L427-Q429 PolarHBondContact O-N 2.87Å; Q429-V431 PolarHBondContact O-N 2.76Å; Q429-Q432 PolarHBondContact O-N 2.85Å; Q429-A433 WeakPolarHBondContact O-CB 3.25Å; Q429-A433 PolarHBondContact O-N 3.08Å
430	A	93.5	Very high	91	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.7	-37.5	-178.1	0	0	0	0	0	112.5	F418 V426 C434 L485 F498	F418-A430 HydrophobicContact CD2-CB 3.96Å; F418-A430 HydrophobicContact CE2-CB 4.32Å; F418-A430 HydrophobicContact CG-CB 4.35Å; V426-A430 VanDerWaalsContact O-CB 3.26Å; V426-A430 WeakPolarHBondContact O-CB 3.25Å; V426-A430 PolarHBondContact O-N 3.04Å; A430-C434 PolarHBondContact O-N 3.11Å; A430-C434 VanDerWaalsContact O-N 3.14Å; A430-C434 PolarHBondContact O-SG 3.48Å; A430-C434 VanDerWaalsContact O-SG 3.41Å; A430-L485 HydrophobicContact CB-CD1 4.01Å; A430-L485 HydrophobicContact CB-CD2 4.02Å; A430-F498 HydrophobicContact CB-CE1 4.06Å; A430-F498 HydrophobicContact CB-CZ 3.95Å
431	V	93.2	Very high	90.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-73.7	-43.7	176.3	179.4	0	0	0	0	111.2	L427 Q429 A433 C434 V435 L448 I459 L472 F484 L485 M488	L427-V431 HydrophobicContact CD1-CG2 3.87Å; L427-V431 HydrophobicContact CG-CG2 4.44Å; L427-V431 WeakPolarHBondContact O-CB 3.2Å; L427-V431 WeakPolarHBondContact O-CG2 3.01Å; L427-V431 PolarHBondContact O-N 2.97Å; Q429-V431 PolarHBondContact O-N 2.76Å; V431-A433 VanDerWaalsContact C-N 3.31Å; V431-A433 PolarHBondContact O-N 3.3Å; V431-C434 WeakPolarHBondContact O-CB 3.27Å; V431-C434 PolarHBondContact O-N 3.09Å; V431-C434 VanDerWaalsContact O-N 3.13Å; V431-V435 HydrophobicContact CG1-CG2 4.41Å; V431-V435 WeakPolarHBondContact O-CG2 3.23Å; V431-V435 PolarHBondContact O-N 2.79Å; V431-L448 HydrophobicContact CG1-CD1 4.48Å; V431-L448 HydrophobicContact CG1-CD2 3.77Å; V431-I459 HydrophobicContact CG1-CD1 3.6Å; V431-L472 HydrophobicContact CB-CD1 4.41Å; V431-L472 HydrophobicContact CG1-CD2 4.23Å; V431-F484 HydrophobicContact CG2-CD1 4.11Å; V431-F484 HydrophobicContact CG2-CE1 3.73Å; V431-L485 HydrophobicContact CG2-CD2 3.74Å; V431-M488 HydrophobicContact CB-SD 4.31Å; V431-M488 HydrophobicContact CG1-SD 3.85Å; V431-M488 HydrophobicContact CG2-CE 4.34Å; V431-M488 HydrophobicContact CG2-SD 3.9Å
432	Q	93.4	Very high	90	Very high	31 Å²	31	36.5 Å²	36.5	15%	0.145	19%	0.193	C	C	.	.	H	α-helix	trans	-59.8	-43.3	175.5	-175.9	66.5	59.9	0	0	110.9	Q428 Q429 C434 V435 D436 I459 R460	Q428-Q432 WeakPolarHBondContact O-CB 3.49Å; Q428-Q432 PolarHBondContact O-N 3.36Å; Q429-Q432 PolarHBondContact O-N 2.85Å; Q432-C434 VanDerWaalsContact C-N 3.32Å; Q432-C434 PolarHBondContact O-N 3.06Å; Q432-V435 PolarHBondContact O-N 2.83Å; Q432-D436 VanDerWaalsContact NE2-CG 3.29Å; Q432-D436 PolarHBondContact NE2-OD1 3.4Å; Q432-D436 PolarHBondContact NE2-OD2 3.41Å; Q432-D436 WeakPolarHBondContact O-CB 3.44Å; Q432-D436 VanDerWaalsContact O-CG 3.29Å; Q432-D436 PolarHBondContact O-N 2.87Å; Q432-I459 HydrophobicContact CB-CG2 4.26Å; Q432-R460 PolarHBondContact NE2-O 2.78Å; Q432-R460 PolarHBondContact OE1-O 2.77Å
433	A	91.8	Very high	89.4	Confident	12 Å²	12	35.9 Å²	35.9	10%	0.099	19%	0.188	C	C	.	.	H	α-helix	trans	-59.8	-38.4	174.2	0	0	0	0	0	113	L414 F418 Q429 V431 C437	L414-A433 HydrophobicContact CD1-CB 4.41Å; L414-A433 HydrophobicContact CD2-CB 3.81Å; F418-A433 HydrophobicContact CE1-CB 4.05Å; F418-A433 HydrophobicContact CE2-CB 4.28Å; F418-A433 HydrophobicContact CZ-CB 3.45Å; F418-A433 VanDerWaalsContact CZ-CB 3.45Å; Q429-A433 WeakPolarHBondContact O-CB 3.25Å; Q429-A433 PolarHBondContact O-N 3.08Å; V431-A433 VanDerWaalsContact C-N 3.31Å; V431-A433 PolarHBondContact O-N 3.3Å; A433-C437 WeakPolarHBondContact O-CB 3.33Å; A433-C437 PolarHBondContact O-N 2.97Å; A433-C437 PolarHBondContact O-SG 3.2Å
434	C	90.3	Very high	89	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-67.2	-47.2	172.5	-75.4	0	0	0	0	112.2	A430 V431 Q432 D436 C437 T438 M488 F498	A430-C434 PolarHBondContact O-N 3.11Å; A430-C434 VanDerWaalsContact O-N 3.14Å; A430-C434 PolarHBondContact O-SG 3.48Å; A430-C434 VanDerWaalsContact O-SG 3.41Å; V431-C434 WeakPolarHBondContact O-CB 3.27Å; V431-C434 PolarHBondContact O-N 3.09Å; V431-C434 VanDerWaalsContact O-N 3.13Å; Q432-C434 VanDerWaalsContact C-N 3.32Å; Q432-C434 PolarHBondContact O-N 3.06Å; C434-D436 VanDerWaalsContact C-N 3.33Å; C434-D436 PolarHBondContact O-N 3.22Å; C434-C437 CarbonylContact O-C 3.51Å; C434-C437 WeakPolarHBondContact O-CA 3.49Å; C434-C437 PolarHBondContact O-N 3.04Å; C434-T438 WeakPolarHBondContact O-CG2 3.2Å; C434-T438 PolarHBondContact O-N 3.36Å; C434-T438 VanDerWaalsContact O-N 3.07Å; C434-M488 HydrophobicContact CB-CE 3.78Å; C434-M488 VanDerWaalsContact SG-CE 3.59Å; C434-F498 WeakPolarHBondContact SG-CE2 3.24Å; C434-F498 WeakPolarHBondContact SG-CZ 3.41Å
435	V	90.8	Very high	88.6	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.018	18%	0.182	C	C	.	.	H	α-helix	trans	-54	-50.6	176.5	169.2	0	0	0	0	110.5	V431 Q432 C437 T438 L444 L448 V461	V431-V435 HydrophobicContact CG1-CG2 4.41Å; V431-V435 WeakPolarHBondContact O-CG2 3.23Å; V431-V435 PolarHBondContact O-N 2.79Å; Q432-V435 PolarHBondContact O-N 2.83Å; V435-C437 PolarHBondContact O-N 2.87Å; V435-T438 PolarHBondContact O-N 3.49Å; V435-T438 PolarHBondContact O-OG1 3.47Å; V435-L444 HydrophobicContact CB-CD2 4.39Å; V435-L444 HydrophobicContact CG2-CD2 3.56Å; V435-L444 HydrophobicContact CG2-CG 4.24Å; V435-L448 HydrophobicContact CG2-CD1 4.05Å; V435-V461 HydrophobicContact CG1-CB 4.29Å; V435-V461 HydrophobicContact CG1-CG1 4.11Å; V435-V461 HydrophobicContact CG1-CG2 4.16Å; V435-V461 HydrophobicContact CG2-CG2 4.32Å
436	D	89.4	Confident	88.1	Confident	78 Å²	78	36.6 Å²	36.6	42%	0.417	19%	0.193	S	C	.	.	H	α-helix	trans	-68.2	-14.4	-179.6	-64.5	-24.3	0	0	0	112.8	Q432 C434 R460	Q432-D436 VanDerWaalsContact NE2-CG 3.29Å; Q432-D436 PolarHBondContact NE2-OD1 3.4Å; Q432-D436 PolarHBondContact NE2-OD2 3.41Å; Q432-D436 WeakPolarHBondContact O-CB 3.44Å; Q432-D436 VanDerWaalsContact O-CG 3.29Å; Q432-D436 PolarHBondContact O-N 2.87Å; C434-D436 VanDerWaalsContact C-N 3.33Å; C434-D436 PolarHBondContact O-N 3.22Å; D436-R460 IonicContact OD2-NH2 2.69Å
437	C	90.3	Very high	87.7	Confident	5 Å²	5	37.2 Å²	37.2	3%	0.034	20%	0.196	C	C	.	.	H	α-helix	trans	-96.1	-6.1	170.7	-67.2	0	0	0	0	114.4	L406 D407 L410 V411 A433 C434 V435	L406-C437 CarbonylContact C-O 3.5Å; L406-C437 WeakPolarHBondContact CA-O 3.48Å; L406-C437 HydrophobicContact CD2-CB 3.95Å; D407-C437 PolarHBondContact N-O 3.3Å; L410-C437 HydrophobicContact CB-CB 4.17Å; L410-C437 VanDerWaalsContact CB-SG 3.59Å; V411-C437 HydrophobicContact CG2-CB 4.08Å; A433-C437 WeakPolarHBondContact O-CB 3.33Å; A433-C437 PolarHBondContact O-N 2.97Å; A433-C437 PolarHBondContact O-SG 3.2Å; C434-C437 CarbonylContact O-C 3.51Å; C434-C437 WeakPolarHBondContact O-CA 3.49Å; C434-C437 PolarHBondContact O-N 3.04Å; V435-C437 PolarHBondContact O-N 2.87Å
438	T	88.2	Confident	87.4	Confident	16 Å²	16	37.2 Å²	37.2	10%	0.098	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-78.9	136.9	-177.6	51.8	0	0	0	0	113.3	H405 L406 C434 V435 Q440 P441 L444 L492	H405-T438 CarbonylContact O-C 3.46Å; H405-T438 VanDerWaalsContact O-CA 3.31Å; H405-T438 WeakPolarHBondContact O-CA 3.49Å; L406-T438 HydrophobicContact CD2-CG2 3.59Å; C434-T438 WeakPolarHBondContact O-CG2 3.2Å; C434-T438 PolarHBondContact O-N 3.36Å; C434-T438 VanDerWaalsContact O-N 3.07Å; V435-T438 PolarHBondContact O-N 3.49Å; V435-T438 PolarHBondContact O-OG1 3.47Å; T438-Q440 VanDerWaalsContact C-N 3.3Å; T438-P441 WeakPolarHBondContact OG1-CA 3.29Å; T438-L444 HydrophobicContact CG2-CD2 4.03Å; T438-L492 HydrophobicContact CG2-CD2 4Å
439	Y	85.5	Confident	86.9	Confident	138 Å²	138	38.8 Å²	38.8	54%	0.541	20%	0.203	S	C	.	.	S	Bend	trans	-68.5	-29.4	169.1	-71.4	-56.1	0	0	0	112.8	H405 D407	H405-Y439 PolarHBondContact O-N 3.22Å; D407-Y439 VanDerWaalsContact CA-CZ 3.5Å; D407-Y439 WeakPolarHBondContact CA-OH 3.42Å; D407-Y439 HydrophobicContact CB-CD1 4.32Å; D407-Y439 HydrophobicContact CB-CE1 3.6Å; D407-Y439 HydrophobicContact CB-CE2 4.18Å; D407-Y439 WeakPolarHBondContact CB-OH 3.26Å; D407-Y439 WeakPolarHBondContact OD2-CE1 3.34Å; D407-Y439 VanDerWaalsContact OD2-CZ 3.23Å; D407-Y439 PolarHBondContact OD2-OH 3.46Å
440	Q	81.2	Confident	86.3	Confident	111 Å²	111	37.8 Å²	37.8	52%	0.519	21%	0.206	S	C	.	.			trans	-134.5	84	-179.2	-69.8	-177	-18.9	0	0	110.5	T438 S442 V443	T438-Q440 VanDerWaalsContact C-N 3.3Å; Q440-S442 PolarHBondContact O-N 3.19Å; Q440-V443 HydrophobicContact CB-CG2 3.96Å; Q440-V443 PolarHBondContact O-N 3.36Å
441	P	81.9	Confident	85.4	Confident	28 Å²	28	41 Å²	41	18%	0.182	22%	0.221	C	C	.	.	H	α-helix	trans	-58.1	-19.4	-179.2	-27	35.7	0	0	0	114.5	T438 L444 L445 V461 C462	T438-P441 WeakPolarHBondContact OG1-CA 3.29Å; P441-L444 PolarHBondContact O-N 2.89Å; P441-L445 VanDerWaalsContact O-CB 3.25Å; P441-L445 WeakPolarHBondContact O-CB 3.33Å; P441-L445 PolarHBondContact O-N 3.35Å; P441-V461 HydrophobicContact CB-CG1 3.77Å; P441-C462 VanDerWaalsContact CB-O 3.23Å; P441-C462 WeakPolarHBondContact CB-O 3.49Å; P441-C462 VanDerWaalsContact CG-O 3.29Å; P441-C462 WeakPolarHBondContact CG-O 3.48Å
442	S	77.6	Confident	84.4	Confident	72 Å²	72	43.1 Å²	43.1	50%	0.503	24%	0.236	S	C	.	.	H	α-helix	trans	-62	-35.9	173.3	49.2	0	0	0	0	114	Q440 L444 L445 S446	Q440-S442 PolarHBondContact O-N 3.19Å; S442-L444 VanDerWaalsContact C-N 3.33Å; S442-L444 PolarHBondContact O-N 2.9Å; S442-L445 PolarHBondContact O-N 2.85Å; S442-S446 PolarHBondContact O-N 2.86Å
443	V	80.6	Confident	82.8	Confident	35 Å²	35	48.2 Å²	48.2	21%	0.212	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-44.3	177.6	177.9	0	0	0	0	110.1	Q440 S446 H491	Q440-V443 HydrophobicContact CB-CG2 3.96Å; Q440-V443 PolarHBondContact O-N 3.36Å; V443-S446 PolarHBondContact O-OG 3.16Å; V443-H491 PolarHBondContact O-NE2 2.68Å
444	L	82.8	Confident	81.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-78.9	-32.5	179.7	-172.8	52.1	0	0	0	112.1	V435 T438 P441 S442 S446 F447 L448 M488 L492	V435-L444 HydrophobicContact CB-CD2 4.39Å; V435-L444 HydrophobicContact CG2-CD2 3.56Å; V435-L444 HydrophobicContact CG2-CG 4.24Å; T438-L444 HydrophobicContact CG2-CD2 4.03Å; P441-L444 PolarHBondContact O-N 2.89Å; S442-L444 VanDerWaalsContact C-N 3.33Å; S442-L444 PolarHBondContact O-N 2.9Å; L444-S446 VanDerWaalsContact C-N 3.31Å; L444-S446 PolarHBondContact O-N 3.19Å; L444-F447 HydrophobicContact CD1-CD1 4.08Å; L444-F447 PolarHBondContact O-N 3.28Å; L444-L448 HydrophobicContact CD1-CD1 4.34Å; L444-L448 HydrophobicContact CD1-CD2 4.49Å; L444-L448 HydrophobicContact CD1-CG 4.12Å; L444-L448 HydrophobicContact CG-CD1 3.82Å; L444-L448 HydrophobicContact CG-CG 4.13Å; L444-L448 WeakPolarHBondContact O-CB 3.31Å; L444-L448 WeakPolarHBondContact O-CG 3.47Å; L444-L448 PolarHBondContact O-N 2.82Å; L444-M488 HydrophobicContact CD1-CG 3.63Å; L444-M488 HydrophobicContact CD1-SD 3.99Å; L444-L492 HydrophobicContact CB-CD2 4.43Å; L444-L492 HydrophobicContact CD1-CD1 4.4Å; L444-L492 HydrophobicContact CD1-CD2 4.48Å; L444-L492 HydrophobicContact CD1-CG 4.48Å; L444-L492 HydrophobicContact CD2-CD1 4.33Å
445	L	83.6	Confident	80.2	Confident	25 Å²	25	55.4 Å²	55.4	13%	0.131	32%	0.316	C	S	.	.	H	α-helix	trans	-56.3	-42.1	176.2	-177.4	61.7	0	0	0	112.6	P441 S442 Q449 V461 R468 V470	P441-L445 VanDerWaalsContact O-CB 3.25Å; P441-L445 WeakPolarHBondContact O-CB 3.33Å; P441-L445 PolarHBondContact O-N 3.35Å; S442-L445 PolarHBondContact O-N 2.85Å; L445-Q449 HydrophobicContact CD1-CG 4.41Å; L445-Q449 VanDerWaalsContact CD1-NE2 3.29Å; L445-Q449 WeakPolarHBondContact O-CB 3.45Å; L445-Q449 VanDerWaalsContact O-CG 3.26Å; L445-Q449 WeakPolarHBondContact O-CG 3.34Å; L445-Q449 PolarHBondContact O-N 2.87Å; L445-V461 HydrophobicContact CB-CG1 4.28Å; L445-V461 HydrophobicContact CD1-CB 4.1Å; L445-V461 HydrophobicContact CD1-CG1 4.13Å; L445-V461 HydrophobicContact CD1-CG2 4.13Å; L445-R468 HydrophobicContact CD1-CB 4.22Å; L445-R468 HydrophobicContact CD2-CG 4.36Å; L445-V470 HydrophobicContact CD1-CG2 3.57Å
446	S	81.3	Confident	79.6	Confident	66 Å²	66	55.6 Å²	55.6	46%	0.462	32%	0.318	S	S	.	.	H	α-helix	trans	-66.9	-43.7	179.2	65.2	0	0	0	0	112.2	S442 V443 L444 Q449 S450	S442-S446 PolarHBondContact O-N 2.86Å; V443-S446 PolarHBondContact O-OG 3.16Å; L444-S446 VanDerWaalsContact C-N 3.31Å; L444-S446 PolarHBondContact O-N 3.19Å; S446-Q449 PolarHBondContact O-N 3.11Å; S446-S450 PolarHBondContact O-N 2.85Å
447	F	85.8	Confident	79.3	Confident	12 Å²	12	55.9 Å²	55.9	5%	0.053	32%	0.317	C	S	.	.	H	α-helix	trans	-58	-53.1	172.4	173.7	-90.1	0	0	0	111.4	L444 Q449 S450 Q451 F484 N487 M488 H491	L444-F447 HydrophobicContact CD1-CD1 4.08Å; L444-F447 PolarHBondContact O-N 3.28Å; F447-Q449 VanDerWaalsContact C-N 3.3Å; F447-Q449 PolarHBondContact O-N 3.01Å; F447-S450 WeakPolarHBondContact O-CB 3.41Å; F447-S450 PolarHBondContact O-N 2.87Å; F447-S450 PolarHBondContact O-OG 2.93Å; F447-Q451 HydrophobicContact CE1-CG 4.24Å; F447-Q451 HydrophobicContact CZ-CG 4.21Å; F447-Q451 PolarHBondContact O-N 2.9Å; F447-F484 HydrophobicContact CE1-CE1 4.28Å; F447-F484 HydrophobicContact CE1-CZ 4.02Å; F447-N487 WeakPolarHBondContact CE2-ND2 3.45Å; F447-N487 HydrophobicContact CZ-CB 4.26Å; F447-M488 HydrophobicContact CD1-CG 4.34Å; F447-M488 HydrophobicContact CE1-CB 3.73Å; F447-M488 HydrophobicContact CE1-CG 3.93Å; F447-M488 HydrophobicContact CZ-CB 3.94Å; F447-H491 HydrophobicContact CD2-CB 3.7Å; F447-H491 AromaticContact CD2-CG 3.6Å; F447-H491 AromaticContact CD2-ND1 3.72Å; F447-H491 HydrophobicContact CE2-CB 4Å; F447-H491 HydrophobicContact CG-CB 4.31Å
448	L	86	Confident	79.2	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-61.1	-37.4	-177.5	-66.4	168.5	0	0	0	112.5	V431 V435 L444 Q451 S452 I459 V461 V470 L472 F484	V431-L448 HydrophobicContact CG1-CD1 4.48Å; V431-L448 HydrophobicContact CG1-CD2 3.77Å; V435-L448 HydrophobicContact CG2-CD1 4.05Å; L444-L448 HydrophobicContact CD1-CD1 4.34Å; L444-L448 HydrophobicContact CD1-CD2 4.49Å; L444-L448 HydrophobicContact CD1-CG 4.12Å; L444-L448 HydrophobicContact CG-CD1 3.82Å; L444-L448 HydrophobicContact CG-CG 4.13Å; L444-L448 WeakPolarHBondContact O-CB 3.31Å; L444-L448 WeakPolarHBondContact O-CG 3.47Å; L444-L448 PolarHBondContact O-N 2.82Å; L448-Q451 PolarHBondContact O-N 2.66Å; L448-S452 PolarHBondContact O-N 3.42Å; L448-S452 PolarHBondContact O-OG 3.27Å; L448-I459 HydrophobicContact CD1-CD1 3.66Å; L448-I459 HydrophobicContact CD2-CD1 4.13Å; L448-I459 HydrophobicContact CG-CD1 4.46Å; L448-V461 HydrophobicContact CD1-CG2 4.08Å; L448-V470 HydrophobicContact CB-CG1 3.92Å; L448-L472 HydrophobicContact CD2-CD2 3.9Å; L448-F484 HydrophobicContact CD2-CE1 4.24Å; L448-F484 HydrophobicContact CD2-CZ 3.91Å
449	Q	83.6	Confident	79.3	Confident	90 Å²	90	58.2 Å²	58.2	42%	0.421	33%	0.33	S	S	.	.	H	α-helix	trans	-66.4	-38.7	173.8	-74.2	173.7	11.8	0	0	112.1	L445 S446 F447 Q451 S452 V470	L445-Q449 HydrophobicContact CD1-CG 4.41Å; L445-Q449 VanDerWaalsContact CD1-NE2 3.29Å; L445-Q449 WeakPolarHBondContact O-CB 3.45Å; L445-Q449 VanDerWaalsContact O-CG 3.26Å; L445-Q449 WeakPolarHBondContact O-CG 3.34Å; L445-Q449 PolarHBondContact O-N 2.87Å; S446-Q449 PolarHBondContact O-N 3.11Å; F447-Q449 VanDerWaalsContact C-N 3.3Å; F447-Q449 PolarHBondContact O-N 3.01Å; Q449-Q451 PolarHBondContact O-N 2.83Å; Q449-S452 WeakPolarHBondContact O-CB 3.46Å; Q449-S452 PolarHBondContact O-N 3.14Å; Q449-V470 HydrophobicContact CG-CG1 4.47Å
450	S	81	Confident	79.4	Confident	68 Å²	68	56.6 Å²	56.6	48%	0.476	32%	0.323	S	S	.	.	H	α-helix	trans	-63.2	-27.7	176	80.6	0	0	0	0	113.7	S446 F447	S446-S450 PolarHBondContact O-N 2.85Å; F447-S450 WeakPolarHBondContact O-CB 3.41Å; F447-S450 PolarHBondContact O-N 2.87Å; F447-S450 PolarHBondContact O-OG 2.93Å
451	Q	75.1	Confident	79.8	Confident	67 Å²	67	51.3 Å²	51.3	31%	0.313	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	4.1	-179.7	-53.8	-55.6	-69.8	0	0	113.3	F447 L448 Q449 H453 F484	F447-Q451 HydrophobicContact CE1-CG 4.24Å; F447-Q451 HydrophobicContact CZ-CG 4.21Å; F447-Q451 PolarHBondContact O-N 2.9Å; L448-Q451 PolarHBondContact O-N 2.66Å; Q449-Q451 PolarHBondContact O-N 2.83Å; Q451-H453 PolarHBondContact O-N 2.68Å; Q451-H453 VanDerWaalsContact O-N 3.12Å; Q451-F484 HydrophobicContact CB-CE2 3.86Å; Q451-F484 HydrophobicContact CG-CE2 4.2Å
452	S	71.9	Confident	79.8	Confident	46 Å²	46	52.5 Å²	52.5	32%	0.322	31%	0.307	S	S	.	.			trans	-74.6	100.9	-178.1	-69.6	0	0	0	0	111	L448 Q449 V470 K471	L448-S452 PolarHBondContact O-N 3.42Å; L448-S452 PolarHBondContact O-OG 3.27Å; Q449-S452 WeakPolarHBondContact O-CB 3.46Å; Q449-S452 PolarHBondContact O-N 3.14Å; S452-V470 WeakPolarHBondContact OG-CG1 3.49Å; S452-K471 PolarHBondContact OG-O 2.98Å; S452-K471 VanDerWaalsContact OG-O 3.11Å
453	H	60.7	Low	80	Confident	138 Å²	138	50.5 Å²	50.5	64%	0.639	29%	0.293	S	S	*	.			trans	-120.1	146.1	170.2	-62	-13.1	0	0	0	109.7	Q451 G455	Q451-H453 PolarHBondContact O-N 2.68Å; Q451-H453 VanDerWaalsContact O-N 3.12Å; H453-G455 PolarHBondContact O-N 3.37Å
454	S	59.4	Low	79.7	Confident	125 Å²	125	58.1 Å²	58.1	87%	0.874	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	92.7	-161.5	56.5	0	0	0	0	113.9
455	G	68.3	Low	79.3	Confident	39 Å²	39	66.3 Å²	66.3	40%	0.402	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	179.1	-20.1	169.6	0	0	0	0	0	119.5	H453 S474	H453-G455 PolarHBondContact O-N 3.37Å; G455-S474 PolarHBondContact O-OG 2.94Å
456	G	77.6	Confident	79	Confident	7 Å²	7	66.9 Å²	66.9	7%	0.072	38%	0.376	C	S	.	.	S	Bend	trans	-93.1	-170.5	-173.9	0	0	0	0	0	115.2	K471 L472	G456-K471 WeakPolarHBondContact O-CE 3.48Å; G456-K471 WeakPolarHBondContact O-CG 3.44Å; G456-L472 WeakPolarHBondContact CA-O 3.27Å; G456-L472 PolarHBondContact N-O 3.42Å
457	E	83.9	Confident	79.2	Confident	84 Å²	84	68.3 Å²	68.3	39%	0.393	38%	0.378	S	S	.	.			trans	-68.8	161	179.2	-75.8	-56.7	147.4	0	0	113.8	N424 Q428 L472	N424-E457 HydrophobicContact CB-CG 4.15Å; Q428-E457 HydrophobicContact CB-CB 3.88Å; Q428-E457 HydrophobicContact CB-CG 4.22Å; Q428-E457 HydrophobicContact CG-CB 3.92Å; Q428-E457 HydrophobicContact CG-CG 4.48Å; Q428-E457 PolarHBondContact NE2-OE2 2.63Å; E457-L472 WeakPolarHBondContact O-CB 3.45Å; E457-L472 PolarHBondContact O-N 3.16Å
458	V	87.3	Confident	79.1	Confident	67 Å²	67	74.1 Å²	74.1	41%	0.406	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	133.9	175	-178	0	0	0	0	110.4	Q428 Y469 V470 K471	Q428-V458 PolarHBondContact NE2-O 3.16Å; V458-Y469 HydrophobicContact CG1-CD1 4.02Å; V458-Y469 HydrophobicContact CG1-CG 4.45Å; V458-V470 WeakPolarHBondContact CA-O 3.32Å; V458-K471 HydrophobicContact CG2-CG 4.3Å
459	I	89.3	Confident	79.2	Confident	2 Å²	2	81.7 Å²	81.7	1%	0.01	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	157.1	171.3	53.6	169.7	0	0	0	111.1	Q428 V431 Q432 L448 Y469 V470 L472	Q428-I459 HydrophobicContact CB-CG2 4.48Å; Q428-I459 HydrophobicContact CG-CG2 3.73Å; V431-I459 HydrophobicContact CG1-CD1 3.6Å; Q432-I459 HydrophobicContact CB-CG2 4.26Å; L448-I459 HydrophobicContact CD1-CD1 3.66Å; L448-I459 HydrophobicContact CD2-CD1 4.13Å; L448-I459 HydrophobicContact CG-CD1 4.46Å; I459-Y469 WeakPolarHBondContact O-CA 3.46Å; I459-V470 HydrophobicContact CG1-CB 4.21Å; I459-V470 WeakPolarHBondContact CG1-O 3.44Å; I459-V470 PolarHBondContact N-O 3.19Å; I459-V470 PolarHBondContact O-N 3.21Å; I459-L472 HydrophobicContact CD1-CD1 4.36Å; I459-L472 HydrophobicContact CD1-CD2 3.71Å; I459-L472 HydrophobicContact CD1-CG 4.09Å; I459-L472 HydrophobicContact CG1-CD1 4.45Å; I459-L472 HydrophobicContact CG1-CD2 4.26Å; I459-L472 HydrophobicContact CG1-CG 4.12Å; I459-L472 HydrophobicContact CG2-CD1 3.72Å; I459-L472 HydrophobicContact CG2-CG 4.28Å
460	R	89.5	Confident	79.4	Confident	104 Å²	104	77.7 Å²	77.7	39%	0.392	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	110.7	-178.2	-179.1	-166.4	61.9	-131	-11.5	109.5	Q432 D436 I467 Y469	Q432-R460 PolarHBondContact NE2-O 2.78Å; Q432-R460 PolarHBondContact OE1-O 2.77Å; D436-R460 IonicContact OD2-NH2 2.69Å; R460-I467 HydrophobicContact CG-CG2 3.51Å; R460-Y469 HydrophobicContact CB-CE1 4.32Å; R460-Y469 HydrophobicContact CG-CE1 4.3Å
461	V	88.6	Confident	79.7	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	103.2	172.4	-172.8	0	0	0	0	108.7	V435 P441 L445 L448 R468 V470	V435-V461 HydrophobicContact CG1-CB 4.29Å; V435-V461 HydrophobicContact CG1-CG1 4.11Å; V435-V461 HydrophobicContact CG1-CG2 4.16Å; V435-V461 HydrophobicContact CG2-CG2 4.32Å; P441-V461 HydrophobicContact CB-CG1 3.77Å; L445-V461 HydrophobicContact CB-CG1 4.28Å; L445-V461 HydrophobicContact CD1-CB 4.1Å; L445-V461 HydrophobicContact CD1-CG1 4.13Å; L445-V461 HydrophobicContact CD1-CG2 4.13Å; L448-V461 HydrophobicContact CD1-CG2 4.08Å; V461-R468 PolarHBondContact N-O 3.4Å; V461-R468 PolarHBondContact O-N 3.34Å; V461-V470 HydrophobicContact CG2-CG2 3.89Å
462	C	82.6	Confident	80.3	Confident	53 Å²	53	76.2 Å²	76.2	36%	0.358	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	131	169.7	-63	0	0	0	0	108.9	P441	P441-C462 VanDerWaalsContact CB-O 3.23Å; P441-C462 WeakPolarHBondContact CB-O 3.49Å; P441-C462 VanDerWaalsContact CG-O 3.29Å; P441-C462 WeakPolarHBondContact CG-O 3.48Å
463	S	80.4	Confident	81.1	Confident	30 Å²	30	75.5 Å²	75.5	21%	0.21	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	166.9	177.8	73	0	0	0	0	110.5	H465 G466	S463-H465 PolarHBondContact O-N 3.38Å; S463-H465 VanDerWaalsContact O-N 3.09Å; S463-H465 PolarHBondContact OG-N 3.21Å; S463-G466 PolarHBondContact N-O 2.86Å; S463-G466 PolarHBondContact O-N 3.3Å; S463-G466 PolarHBondContact OG-O 2.84Å
464	E	74.4	Confident	82.3	Confident	195 Å²	195	71.9 Å²	71.9	91%	0.911	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-25.3	172	-60.3	174.8	150.7	0	0	112.5	G466	E464-G466 VanDerWaalsContact C-N 3.27Å; E464-G466 PolarHBondContact O-N 3.35Å
465	H	74.8	Confident	83.6	Confident	173 Å²	173	66.2 Å²	66.2	80%	0.801	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	19.6	179.3	-60.3	62.5	0	0	0	112.1	S463	S463-H465 PolarHBondContact O-N 3.38Å; S463-H465 VanDerWaalsContact O-N 3.09Å; S463-H465 PolarHBondContact OG-N 3.21Å
466	G	78.8	Confident	84.3	Confident	36 Å²	36	69.2 Å²	69.2	37%	0.371	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	92.5	-172.7	-178	0	0	0	0	0	114.3	S463 E464	S463-G466 PolarHBondContact N-O 2.86Å; S463-G466 PolarHBondContact O-N 3.3Å; S463-G466 PolarHBondContact OG-O 2.84Å; E464-G466 VanDerWaalsContact C-N 3.27Å; E464-G466 PolarHBondContact O-N 3.35Å
467	I	84.7	Confident	84.8	Confident	97 Å²	97	70.9 Å²	70.9	50%	0.497	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127	-177.2	-57.5	178.6	0	0	0	109.9	R460 Y469	R460-I467 HydrophobicContact CG-CG2 3.51Å; I467-Y469 HydrophobicContact CG2-CE2 4.03Å
468	R	83.6	Confident	85	Confident	134 Å²	134	68.5 Å²	68.5	51%	0.506	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.8	174.1	-63.8	-70.2	-68.9	-140.1	-5.3	109.6	L445 V461	L445-R468 HydrophobicContact CD1-CB 4.22Å; L445-R468 HydrophobicContact CD2-CG 4.36Å; V461-R468 PolarHBondContact N-O 3.4Å; V461-R468 PolarHBondContact O-N 3.34Å
469	Y	87.4	Confident	85	Confident	161 Å²	161	68.9 Å²	68.9	63%	0.631	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	133.5	170.9	-64.1	-85.4	0	0	0	109.3	V458 I459 R460 I467	V458-Y469 HydrophobicContact CG1-CD1 4.02Å; V458-Y469 HydrophobicContact CG1-CG 4.45Å; I459-Y469 WeakPolarHBondContact O-CA 3.46Å; R460-Y469 HydrophobicContact CB-CE1 4.32Å; R460-Y469 HydrophobicContact CG-CE1 4.3Å; I467-Y469 HydrophobicContact CG2-CE2 4.03Å
470	V	87.9	Confident	85	Confident	6 Å²	6	71 Å²	71	4%	0.036	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	135.1	179.6	-170.1	0	0	0	0	109	L445 L448 Q449 S452 V458 I459 V461	L445-V470 HydrophobicContact CD1-CG2 3.57Å; L448-V470 HydrophobicContact CB-CG1 3.92Å; Q449-V470 HydrophobicContact CG-CG1 4.47Å; S452-V470 WeakPolarHBondContact OG-CG1 3.49Å; V458-V470 WeakPolarHBondContact CA-O 3.32Å; I459-V470 HydrophobicContact CG1-CB 4.21Å; I459-V470 WeakPolarHBondContact CG1-O 3.44Å; I459-V470 PolarHBondContact N-O 3.19Å; I459-V470 PolarHBondContact O-N 3.21Å; V461-V470 HydrophobicContact CG2-CG2 3.89Å
471	K	86.9	Confident	85.1	Confident	100 Å²	100	66 Å²	66	44%	0.435	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	119	178.3	-164.4	169.7	-169.4	172.6	0	109.7	S452 G456 V458	S452-K471 PolarHBondContact OG-O 2.98Å; S452-K471 VanDerWaalsContact OG-O 3.11Å; G456-K471 WeakPolarHBondContact O-CE 3.48Å; G456-K471 WeakPolarHBondContact O-CG 3.44Å; V458-K471 HydrophobicContact CG2-CG 4.3Å
472	L	89.1	Confident	85.3	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.016	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-69	157.4	175.9	-67	176.3	0	0	0	111.1	L427 Q428 V431 L448 G456 E457 I459 F484	L427-L472 HydrophobicContact CG-CD1 4.25Å; Q428-L472 HydrophobicContact CB-CD1 4.44Å; V431-L472 HydrophobicContact CB-CD1 4.41Å; V431-L472 HydrophobicContact CG1-CD2 4.23Å; L448-L472 HydrophobicContact CD2-CD2 3.9Å; G456-L472 WeakPolarHBondContact CA-O 3.27Å; G456-L472 PolarHBondContact N-O 3.42Å; E457-L472 WeakPolarHBondContact O-CB 3.45Å; E457-L472 PolarHBondContact O-N 3.16Å; I459-L472 HydrophobicContact CD1-CD1 4.36Å; I459-L472 HydrophobicContact CD1-CD2 3.71Å; I459-L472 HydrophobicContact CD1-CG 4.09Å; I459-L472 HydrophobicContact CG1-CD1 4.45Å; I459-L472 HydrophobicContact CG1-CD2 4.26Å; I459-L472 HydrophobicContact CG1-CG 4.12Å; I459-L472 HydrophobicContact CG2-CD1 3.72Å; I459-L472 HydrophobicContact CG2-CG 4.28Å; L472-F484 HydrophobicContact CD2-CE1 4.35Å; L472-F484 HydrophobicContact CD2-CZ 3.99Å
473	P	87.1	Confident	85.7	Confident	31 Å²	31	74.2 Å²	74.2	20%	0.201	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-63.7	148.3	164.7	29	-34.7	0	0	0	110.3	F484	P473-F484 HydrophobicContact CG-CD2 3.64Å; P473-F484 HydrophobicContact CG-CE2 3.49Å; P473-F484 VanDerWaalsContact CG-CE2 3.49Å; P473-F484 HydrophobicContact CG-CZ 4.46Å
474	S	86.2	Confident	86.2	Confident	63 Å²	63	73.7 Å²	73.7	44%	0.441	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-77.8	123.2	173.2	-153	0	0	0	0	109.7	N424 G455	N424-S474 PolarHBondContact ND2-OG 2.69Å; G455-S474 PolarHBondContact O-OG 2.94Å
475	A	86.3	Confident	87.1	Confident	5 Å²	5	64.5 Å²	64.5	4%	0.041	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-91	118.5	177.1	0	0	0	0	0	110.4	V423 N424 L427 V481	V423-A475 HydrophobicContact CB-CB 4.42Å; V423-A475 WeakPolarHBondContact CG2-O 3.23Å; N424-A475 PolarHBondContact OD1-N 3.44Å; N424-A475 PolarHBondContact OD1-O 3.32Å; L427-A475 HydrophobicContact CD2-CB 4.07Å; A475-V481 HydrophobicContact CB-CG2 3.6Å
476	S	83.1	Confident	87.9	Confident	103 Å²	103	61 Å²	61	72%	0.72	32%	0.323	S	S	*	.	S	Bend	trans	-84.9	-4.9	176.5	56.7	0	0	0	0	114.2
477	S	89	Confident	88.4	Confident	42 Å²	42	62.4 Å²	62.4	29%	0.294	32%	0.322	S	S	.	.	S	Bend	trans	-160.4	157.6	-176	61.8	0	0	0	0	112.9	S479 S480 V481	S477-S479 PolarHBondContact O-N 3.04Å; S477-S480 VanDerWaalsContact O-CB 3.32Å; S477-S480 WeakPolarHBondContact O-CB 3.37Å; S477-S480 PolarHBondContact O-N 3.42Å; S477-S480 PolarHBondContact OG-N 2.82Å; S477-V481 PolarHBondContact O-N 2.87Å
478	A	87.3	Confident	88.6	Confident	33 Å²	33	57.8 Å²	57.8	27%	0.273	30%	0.299	S	S	.	.	H	α-helix	trans	-54.5	-40	172.7	0	0	0	0	0	112.4	V392 S480 V481 L482	V392-A478 HydrophobicContact CB-CB 3.87Å; V392-A478 HydrophobicContact CG2-CB 3.59Å; A478-S480 VanDerWaalsContact C-N 3.27Å; A478-S480 PolarHBondContact O-N 3.06Å; A478-V481 PolarHBondContact O-N 3.23Å; A478-L482 WeakPolarHBondContact O-CG 3.39Å; A478-L482 PolarHBondContact O-N 2.74Å
479	S	87.9	Confident	88.9	Confident	75 Å²	75	51.9 Å²	51.9	52%	0.524	28%	0.278	S	S	.	.	H	α-helix	trans	-63.9	-29.5	176.2	-52.6	0	0	0	0	113.3	S477 R483	S477-S479 PolarHBondContact O-N 3.04Å; S479-R483 WeakPolarHBondContact O-CB 3.5Å; S479-R483 PolarHBondContact O-N 3.11Å; S479-R483 VanDerWaalsContact O-N 3.13Å
480	S	90.6	Very high	88.9	Confident	47 Å²	47	51.2 Å²	51.2	33%	0.329	28%	0.28	S	S	.	.	H	α-helix	trans	-73	-40	174	-166.5	0	0	0	0	111.8	S477 A478 F484	S477-S480 VanDerWaalsContact O-CB 3.32Å; S477-S480 WeakPolarHBondContact O-CB 3.37Å; S477-S480 PolarHBondContact O-N 3.42Å; S477-S480 PolarHBondContact OG-N 2.82Å; A478-S480 VanDerWaalsContact C-N 3.27Å; A478-S480 PolarHBondContact O-N 3.06Å; S480-F484 WeakPolarHBondContact O-CB 3.44Å; S480-F484 PolarHBondContact O-N 3.29Å; S480-F484 VanDerWaalsContact O-N 3.08Å
481	V	91.4	Very high	88.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.6	-50.5	173.8	177.6	0	0	0	0	110.1	V392 V394 V423 L427 A475 S477 A478 R483 F484 L485	V392-V481 HydrophobicContact CG1-CG1 4.44Å; V392-V481 HydrophobicContact CG1-CG2 4.4Å; V394-V481 HydrophobicContact CG2-CG1 4.28Å; V423-V481 HydrophobicContact CB-CG2 3.69Å; V423-V481 HydrophobicContact CG1-CG2 3.94Å; V423-V481 WeakPolarHBondContact O-CG2 3.32Å; L427-V481 HydrophobicContact CB-CG1 4.08Å; L427-V481 HydrophobicContact CB-CG2 4.2Å; L427-V481 HydrophobicContact CD1-CG1 4.09Å; A475-V481 HydrophobicContact CB-CG2 3.6Å; S477-V481 PolarHBondContact O-N 2.87Å; A478-V481 PolarHBondContact O-N 3.23Å; V481-R483 PolarHBondContact O-N 3.31Å; V481-F484 PolarHBondContact O-N 3.3Å; V481-L485 HydrophobicContact CG1-CD1 3.96Å; V481-L485 HydrophobicContact CG1-CG 4.46Å; V481-L485 WeakPolarHBondContact O-CG 3.32Å; V481-L485 PolarHBondContact O-N 3.25Å
482	L	91.8	Very high	88.8	Confident	44 Å²	44	49.7 Å²	49.7	23%	0.23	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-42.9	-177.8	-69.4	163.4	0	0	0	112.1	V394 A478 L485 E486	V394-L482 HydrophobicContact CG2-CD2 4.28Å; A478-L482 WeakPolarHBondContact O-CG 3.39Å; A478-L482 PolarHBondContact O-N 2.74Å; L482-L485 PolarHBondContact O-N 2.68Å; L482-E486 VanDerWaalsContact O-CB 3.28Å; L482-E486 WeakPolarHBondContact O-CB 3.19Å; L482-E486 PolarHBondContact O-N 3.3Å
483	R	90.8	Very high	88.6	Confident	181 Å²	181	55.5 Å²	55.5	68%	0.683	30%	0.301	S	S	*	.	H	α-helix	trans	-67.7	-34.4	175.5	-80.5	-175	175.1	142.5	1.4	113.9	S479 V481 N487	S479-R483 WeakPolarHBondContact O-CB 3.5Å; S479-R483 PolarHBondContact O-N 3.11Å; S479-R483 VanDerWaalsContact O-N 3.13Å; V481-R483 PolarHBondContact O-N 3.31Å; R483-N487 WeakPolarHBondContact O-CB 3.32Å; R483-N487 PolarHBondContact O-N 2.95Å
484	F	92.2	Very high	88.4	Confident	18 Å²	18	54.1 Å²	54.1	8%	0.079	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-46.4	173.7	-175	-81.2	0	0	0	110.6	L427 V431 F447 L448 Q451 L472 P473 S480 V481 N487 M488	L427-F484 HydrophobicContact CD1-CB 4.12Å; L427-F484 HydrophobicContact CD1-CD1 3.59Å; L427-F484 HydrophobicContact CD1-CE1 4.27Å; L427-F484 HydrophobicContact CD1-CG 4Å; V431-F484 HydrophobicContact CG2-CD1 4.11Å; V431-F484 HydrophobicContact CG2-CE1 3.73Å; F447-F484 HydrophobicContact CE1-CE1 4.28Å; F447-F484 HydrophobicContact CE1-CZ 4.02Å; L448-F484 HydrophobicContact CD2-CE1 4.24Å; L448-F484 HydrophobicContact CD2-CZ 3.91Å; Q451-F484 HydrophobicContact CB-CE2 3.86Å; Q451-F484 HydrophobicContact CG-CE2 4.2Å; L472-F484 HydrophobicContact CD2-CE1 4.35Å; L472-F484 HydrophobicContact CD2-CZ 3.99Å; P473-F484 HydrophobicContact CG-CD2 3.64Å; P473-F484 HydrophobicContact CG-CE2 3.49Å; P473-F484 VanDerWaalsContact CG-CE2 3.49Å; P473-F484 HydrophobicContact CG-CZ 4.46Å; S480-F484 WeakPolarHBondContact O-CB 3.44Å; S480-F484 PolarHBondContact O-N 3.29Å; S480-F484 VanDerWaalsContact O-N 3.08Å; V481-F484 PolarHBondContact O-N 3.3Å; F484-N487 PolarHBondContact O-N 3.13Å; F484-M488 HydrophobicContact CE1-SD 4.39Å; F484-M488 VanDerWaalsContact O-CB 3.3Å; F484-M488 WeakPolarHBondContact O-CB 3.42Å; F484-M488 PolarHBondContact O-N 2.88Å
485	L	92.6	Very high	87.8	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-65.5	-38.2	177.7	-66.5	176.9	0	0	0	112.1	V394 L427 A430 V431 V481 L482 M488 C489 F498	V394-L485 HydrophobicContact CG1-CD1 3.84Å; V394-L485 HydrophobicContact CG2-CD1 4.23Å; L427-L485 HydrophobicContact CD1-CD2 4.26Å; L427-L485 HydrophobicContact CD1-CG 4.32Å; A430-L485 HydrophobicContact CB-CD1 4.01Å; A430-L485 HydrophobicContact CB-CD2 4.02Å; V431-L485 HydrophobicContact CG2-CD2 3.74Å; V481-L485 HydrophobicContact CG1-CD1 3.96Å; V481-L485 HydrophobicContact CG1-CG 4.46Å; V481-L485 WeakPolarHBondContact O-CG 3.32Å; V481-L485 PolarHBondContact O-N 3.25Å; L482-L485 PolarHBondContact O-N 2.68Å; L485-M488 HydrophobicContact CD2-CE 3.77Å; L485-M488 PolarHBondContact O-N 2.85Å; L485-C489 VanDerWaalsContact O-CB 3.3Å; L485-C489 WeakPolarHBondContact O-CB 3.21Å; L485-C489 PolarHBondContact O-N 2.88Å; L485-C489 PolarHBondContact O-SG 3.14Å; L485-F498 HydrophobicContact CB-CD2 3.92Å; L485-F498 HydrophobicContact CB-CG 4.48Å; L485-F498 HydrophobicContact CD1-CD2 4.18Å; L485-F498 HydrophobicContact CD1-CG 4.23Å; L485-F498 HydrophobicContact CD2-CD2 4.13Å; L485-F498 HydrophobicContact CD2-CE2 3.9Å; L485-F498 HydrophobicContact CG-CD2 4.3Å
486	E	90.4	Very high	87.5	Confident	99 Å²	99	59.1 Å²	59.1	46%	0.463	32%	0.319	S	S	.	.	H	α-helix	trans	-60.5	-49.3	173.6	-177.3	173.9	-138.6	0	0	111.7	L482 M488 C489 Q490	L482-E486 VanDerWaalsContact O-CB 3.28Å; L482-E486 WeakPolarHBondContact O-CB 3.19Å; L482-E486 PolarHBondContact O-N 3.3Å; E486-M488 PolarHBondContact O-N 3.48Å; E486-C489 PolarHBondContact O-N 2.85Å; E486-Q490 PolarHBondContact O-N 2.95Å
487	N	89.6	Confident	87.8	Confident	67 Å²	67	54.3 Å²	54.3	36%	0.358	29%	0.285	S	S	.	.	H	α-helix	trans	-63.8	-38.5	176.4	-169.7	40.7	0	0	0	112.2	F447 R483 F484 Q490 H491	F447-N487 WeakPolarHBondContact CE2-ND2 3.45Å; F447-N487 HydrophobicContact CZ-CB 4.26Å; R483-N487 WeakPolarHBondContact O-CB 3.32Å; R483-N487 PolarHBondContact O-N 2.95Å; F484-N487 PolarHBondContact O-N 3.13Å; N487-Q490 PolarHBondContact O-N 2.9Å; N487-H491 PolarHBondContact O-N 3.33Å; N487-H491 VanDerWaalsContact O-N 3.08Å
488	M	89.9	Confident	87.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.5	-43	175	-173.1	-174	73.5	0	0	111.9	V431 C434 L444 F447 F484 L485 E486 Q490 H491 L492 F498	V431-M488 HydrophobicContact CB-SD 4.31Å; V431-M488 HydrophobicContact CG1-SD 3.85Å; V431-M488 HydrophobicContact CG2-CE 4.34Å; V431-M488 HydrophobicContact CG2-SD 3.9Å; C434-M488 HydrophobicContact CB-CE 3.78Å; C434-M488 VanDerWaalsContact SG-CE 3.59Å; L444-M488 HydrophobicContact CD1-CG 3.63Å; L444-M488 HydrophobicContact CD1-SD 3.99Å; F447-M488 HydrophobicContact CD1-CG 4.34Å; F447-M488 HydrophobicContact CE1-CB 3.73Å; F447-M488 HydrophobicContact CE1-CG 3.93Å; F447-M488 HydrophobicContact CZ-CB 3.94Å; F484-M488 HydrophobicContact CE1-SD 4.39Å; F484-M488 VanDerWaalsContact O-CB 3.3Å; F484-M488 WeakPolarHBondContact O-CB 3.42Å; F484-M488 PolarHBondContact O-N 2.88Å; L485-M488 HydrophobicContact CD2-CE 3.77Å; L485-M488 PolarHBondContact O-N 2.85Å; E486-M488 PolarHBondContact O-N 3.48Å; M488-Q490 VanDerWaalsContact C-N 3.31Å; M488-Q490 PolarHBondContact O-N 2.66Å; M488-H491 PolarHBondContact O-N 2.82Å; M488-L492 HydrophobicContact CG-CD1 4.14Å; M488-L492 WeakPolarHBondContact O-CG 3.27Å; M488-L492 PolarHBondContact O-N 3.32Å; M488-F498 HydrophobicContact CE-CE2 3.92Å
489	C	89.3	Confident	88	Confident	10 Å²	10	53.4 Å²	53.4	7%	0.068	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-38.5	175.5	-77.3	0	0	0	0	111.7	L485 E486 L492 E493 S494	L485-C489 VanDerWaalsContact O-CB 3.3Å; L485-C489 WeakPolarHBondContact O-CB 3.21Å; L485-C489 PolarHBondContact O-N 2.88Å; L485-C489 PolarHBondContact O-SG 3.14Å; E486-C489 PolarHBondContact O-N 2.85Å; C489-L492 CarbonylContact O-C 3.57Å; C489-L492 PolarHBondContact O-N 3.3Å; C489-L492 VanDerWaalsContact O-N 3.16Å; C489-E493 PolarHBondContact O-N 3.38Å; C489-S494 WeakPolarHBondContact CA-OG 3.19Å; C489-S494 PolarHBondContact O-N 3.3Å; C489-S494 PolarHBondContact O-OG 3.45Å; C489-S494 VanDerWaalsContact O-OG 3.14Å
490	Q	87.8	Confident	87.9	Confident	147 Å²	147	53.3 Å²	53.3	69%	0.687	27%	0.272	S	S	*	.	H	α-helix	trans	-62.6	-40.6	173.8	-169.7	169.9	27.1	0	0	112.1	E486 N487 M488 L492 E493	E486-Q490 PolarHBondContact O-N 2.95Å; N487-Q490 PolarHBondContact O-N 2.9Å; M488-Q490 VanDerWaalsContact C-N 3.31Å; M488-Q490 PolarHBondContact O-N 2.66Å; Q490-L492 VanDerWaalsContact C-N 3.28Å; Q490-L492 PolarHBondContact O-N 3.46Å; Q490-E493 PolarHBondContact O-N 3.25Å
491	H	87.1	Confident	87.6	Confident	73 Å²	73	57 Å²	57	34%	0.338	29%	0.285	S	S	.	.	H	α-helix	trans	-69.4	-22	173.9	-172.7	93.9	0	0	0	113.6	V443 F447 N487 M488	V443-H491 PolarHBondContact O-NE2 2.68Å; F447-H491 HydrophobicContact CD2-CB 3.7Å; F447-H491 AromaticContact CD2-CG 3.6Å; F447-H491 AromaticContact CD2-ND1 3.72Å; F447-H491 HydrophobicContact CE2-CB 4Å; F447-H491 HydrophobicContact CG-CB 4.31Å; N487-H491 PolarHBondContact O-N 3.33Å; N487-H491 VanDerWaalsContact O-N 3.08Å; M488-H491 PolarHBondContact O-N 2.82Å
492	L	85.3	Confident	87.2	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	2.2	174.9	-69.6	170	0	0	0	113.6	H405 T438 L444 M488 C489 Q490 S494	H405-L492 HydrophobicContact CB-CD2 4.02Å; T438-L492 HydrophobicContact CG2-CD2 4Å; L444-L492 HydrophobicContact CB-CD2 4.43Å; L444-L492 HydrophobicContact CD1-CD1 4.4Å; L444-L492 HydrophobicContact CD1-CD2 4.48Å; L444-L492 HydrophobicContact CD1-CG 4.48Å; L444-L492 HydrophobicContact CD2-CD1 4.33Å; M488-L492 HydrophobicContact CG-CD1 4.14Å; M488-L492 WeakPolarHBondContact O-CG 3.27Å; M488-L492 PolarHBondContact O-N 3.32Å; C489-L492 CarbonylContact O-C 3.57Å; C489-L492 PolarHBondContact O-N 3.3Å; C489-L492 VanDerWaalsContact O-N 3.16Å; Q490-L492 VanDerWaalsContact C-N 3.28Å; Q490-L492 PolarHBondContact O-N 3.46Å; L492-S494 WeakPolarHBondContact CB-OG 3.23Å; L492-S494 PolarHBondContact O-N 3.37Å
493	E	85.5	Confident	86.4	Confident	126 Å²	126	62.6 Å²	62.6	59%	0.589	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	30.7	-171.3	-51.8	-174	165.1	0	0	114.1	G403 C489 Q490	G403-E493 VanDerWaalsContact CA-O 3.22Å; G403-E493 WeakPolarHBondContact CA-O 3.31Å; C489-E493 PolarHBondContact O-N 3.38Å; Q490-E493 PolarHBondContact O-N 3.25Å
494	S	82.7	Confident	85	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.007	31%	0.312	C	S	.	.			trans	-106.3	72.2	-171.9	53.1	0	0	0	0	113	N401 Y402 C489 L492 S496 L497	N401-S494 CarbonylContact O-C 3.53Å; N401-S494 VanDerWaalsContact O-C 3.29Å; N401-S494 WeakPolarHBondContact O-CA 3.21Å; Y402-S494 WeakPolarHBondContact O-CB 3.27Å; C489-S494 WeakPolarHBondContact CA-OG 3.19Å; C489-S494 PolarHBondContact O-N 3.3Å; C489-S494 PolarHBondContact O-OG 3.45Å; C489-S494 VanDerWaalsContact O-OG 3.14Å; L492-S494 WeakPolarHBondContact CB-OG 3.23Å; L492-S494 PolarHBondContact O-N 3.37Å; S494-S496 PolarHBondContact O-N 3.26Å; S494-L497 PolarHBondContact O-N 3.33Å
495	D	74.3	Confident	83.2	Confident	105 Å²	105	63.4 Å²	63.4	56%	0.561	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	118.6	-178.9	-87.6	-26.6	0	0	0	113.3	N401 L497	N401-D495 PolarHBondContact O-N 3.02Å; D495-L497 PolarHBondContact O-N 3.17Å
496	S	79.8	Confident	81.1	Confident	69 Å²	69	73.5 Å²	73.5	48%	0.483	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	34.3	173	-52.2	0	0	0	0	115.3	N397 S494 F498	N397-S496 WeakPolarHBondContact CB-O 3.43Å; N397-S496 PolarHBondContact ND2-O 3.22Å; S494-S496 PolarHBondContact O-N 3.26Å; S496-F498 VanDerWaalsContact C-N 3.31Å
497	L	88.1	Confident	78.8	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.01	39%	0.385	C	S	.	.	S	Bend	trans	-63.7	-33.3	172.2	179.8	63.6	0	0	0	113.1	N397 L406 V411 S494 D495	N397-L497 WeakPolarHBondContact CB-O 3.41Å; N397-L497 PolarHBondContact N-O 2.92Å; L406-L497 HydrophobicContact CD1-CD2 3.53Å; V411-L497 HydrophobicContact CG1-CD1 3.97Å; S494-L497 PolarHBondContact O-N 3.33Å; D495-L497 PolarHBondContact O-N 3.17Å
498	F	92.4	Very high	76.4	Confident	26 Å²	26	76.7 Å²	76.7	11%	0.114	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	153	178.8	-67.6	-62.4	0	0	0	112.6	V394 Y395 V396 F418 A430 C434 L485 M488 S496	V394-F498 HydrophobicContact CG1-CB 3.87Å; V394-F498 HydrophobicContact CG1-CD1 3.65Å; V394-F498 HydrophobicContact CG1-CE1 4.48Å; V394-F498 HydrophobicContact CG1-CG 4.01Å; Y395-F498 WeakPolarHBondContact O-CA 3.35Å; V396-F498 HydrophobicContact CG2-CD1 4.33Å; V396-F498 HydrophobicContact CG2-CE1 4.11Å; F418-F498 HydrophobicContact CD2-CE1 4.27Å; F418-F498 HydrophobicContact CE2-CE1 4.05Å; A430-F498 HydrophobicContact CB-CE1 4.06Å; A430-F498 HydrophobicContact CB-CZ 3.95Å; C434-F498 WeakPolarHBondContact SG-CE2 3.24Å; C434-F498 WeakPolarHBondContact SG-CZ 3.41Å; L485-F498 HydrophobicContact CB-CD2 3.92Å; L485-F498 HydrophobicContact CB-CG 4.48Å; L485-F498 HydrophobicContact CD1-CD2 4.18Å; L485-F498 HydrophobicContact CD1-CG 4.23Å; L485-F498 HydrophobicContact CD2-CD2 4.13Å; L485-F498 HydrophobicContact CD2-CE2 3.9Å; L485-F498 HydrophobicContact CG-CD2 4.3Å; M488-F498 HydrophobicContact CE-CE2 3.92Å; S496-F498 VanDerWaalsContact C-N 3.31Å
499	S	87.6	Confident	73.8	Confident	29 Å²	29	83.3 Å²	83.3	20%	0.203	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	155.6	177.5	172.7	0	0	0	0	112.4	Y395 Q501	Y395-S499 PolarHBondContact N-O 2.93Å; Y395-S499 PolarHBondContact O-N 3.09Å; S499-Q501 VanDerWaalsContact C-N 3.27Å; S499-Q501 VanDerWaalsContact CB-O 3.31Å; S499-Q501 WeakPolarHBondContact CB-O 3.03Å; S499-Q501 PolarHBondContact OG-N 3.02Å; S499-Q501 PolarHBondContact OG-O 3.27Å
500	S	87.5	Confident	71.5	Confident	73 Å²	73	88.1 Å²	88.1	51%	0.51	47%	0.471	S	S	.	.	S	Bend	trans	-82.8	-0.6	168.8	58.8	0	0	0	0	113.8
501	Q	84.1	Confident	69.2	Low	125 Å²	125	91.4 Å²	91.4	58%	0.584	48%	0.477	S	S	*	.	S	Bend	trans	-135.9	148	178.9	-65.4	-172.3	-5.4	0	0	111	S499	S499-Q501 VanDerWaalsContact C-N 3.27Å; S499-Q501 VanDerWaalsContact CB-O 3.31Å; S499-Q501 WeakPolarHBondContact CB-O 3.03Å; S499-Q501 PolarHBondContact OG-N 3.02Å; S499-Q501 PolarHBondContact OG-O 3.27Å
502	P	81.8	Confident	66.5	Low	90 Å²	90	97.5 Å²	97.5	58%	0.584	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-62.4	139.5	178.7	25.8	-34.4	0	0	0	111.9	Y395	Y395-P502 HydrophobicContact CD1-CB 3.74Å; Y395-P502 HydrophobicContact CE1-CB 3.79Å; Y395-P502 HydrophobicContact CE1-CG 4.36Å; Y395-P502 HydrophobicContact CG-CB 4.23Å
503	F	75.1	Confident	63.8	Low	72 Å²	72	107.3 Å²	107.3	32%	0.316	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-75.6	130	176.6	-65.4	-81.4	0	0	0	110.8	N397	N397-F503 HydrophobicContact CB-CD1 4.18Å; N397-F503 HydrophobicContact CB-CD2 3.94Å; N397-F503 HydrophobicContact CB-CE1 3.83Å; N397-F503 HydrophobicContact CB-CE2 3.57Å; N397-F503 HydrophobicContact CB-CG 4.23Å; N397-F503 HydrophobicContact CB-CZ 3.5Å; N397-F503 WeakPolarHBondContact ND2-CE1 3.4Å
504	N	62.3	Low	61	Low	109 Å²	109	109.4 Å²	109.4	58%	0.583	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-86.2	119.5	176.7	-174.8	-3	0	0	0	109.7	Y506 S507	N504-Y506 PolarHBondContact O-N 3.07Å; N504-S507 PolarHBondContact O-N 3.22Å; N504-S507 VanDerWaalsContact O-N 3.16Å
505	P	53.9	Low	58.5	Low	106 Å²	106	119.9 Å²	119.9	69%	0.688	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	-15.4	-171.5	-29	36.2	0	0	0	116.7
506	Y	48.3	Very low	56.4	Low	214 Å²	214	121.2 Å²	121.2	84%	0.839	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	3.7	-174.9	-60.7	-79.8	0	0	0	114.6	N504	N504-Y506 PolarHBondContact O-N 3.07Å
507	S	42	Very low	54.2	Low	79 Å²	79	127.1 Å²	127.1	55%	0.552	63%	0.626	S	S	*	*			trans	-115.7	77.1	-168.2	-177.5	0	0	0	0	114.5	N504 N509	N504-S507 PolarHBondContact O-N 3.22Å; N504-S507 VanDerWaalsContact O-N 3.16Å; S507-N509 PolarHBondContact O-N 2.83Å
508	N	38.8	Very low	51.4	Low	155 Å²	155	131.9 Å²	131.9	83%	0.829	66%	0.659	S	S	*	*			trans	-70	106.2	165.1	-84.5	-17.2	0	0	0	110.9
509	N	35.7	Very low	48.3	Very low	138 Å²	138	138.9 Å²	138.9	74%	0.738	69%	0.692	S	S	*	*			trans	-156.6	89.6	164.6	-114.5	-53.5	0	0	0	113.8	S507 R511	S507-N509 PolarHBondContact O-N 2.83Å; N509-R511 PolarHBondContact O-N 3.47Å; N509-R511 VanDerWaalsContact O-N 3.08Å
510	T	42.2	Very low	46.1	Very low	111 Å²	111	142.2 Å²	142.2	68%	0.681	71%	0.713	S	S	*	*			trans	-74	86.1	163.2	30.8	0	0	0	0	110.2
511	R	38.6	Very low	43	Very low	216 Å²	216	146.4 Å²	146.4	82%	0.815	73%	0.729	S	S	*	*			trans	-167.5	73.3	170.7	-113.6	166.1	-156.3	-165.8	6.6	115	N509	N509-R511 PolarHBondContact O-N 3.47Å; N509-R511 VanDerWaalsContact O-N 3.08Å
512	F	30.3	Very low	40.1	Very low	201 Å²	201	145.1 Å²	145.1	88%	0.882	73%	0.734	S	S	*	*			trans	-156.7	83.2	154.8	-103.4	-66.2	0	0	0	112.6
513	Y	28.1	Very low	37.5	Very low	206 Å²	206	148.7 Å²	148.7	81%	0.808	75%	0.746	S	S	*	*			trans	-166.6	89	140.9	-88.3	-48	0	0	0	110.4
514	N	28.1	Very low	35.2	Very low	171 Å²	171	151 Å²	151	91%	0.914	77%	0.766	S	S	*	*			trans	-168.5	114.6	153.6	-114.5	-53.1	0	0	0	111.1
515	R	29	Very low	33.5	Very low	221 Å²	221	153.6 Å²	153.6	83%	0.834	78%	0.775	S	S	*	*			trans	158.1	103.7	134.7	-173.7	168.2	-169.2	160.7	3.8	110.8
516	T	31.6	Very low	32.4	Very low	133 Å²	133	154.9 Å²	154.9	82%	0.816	78%	0.776	S	S	*	*			trans	-81.5	148.6	158.9	35.6	0	0	0	0	110.6
517	K	31.9	Very low	31.3	Very low	193 Å²	193	148.1 Å²	148.1	84%	0.839	77%	0.771	S	S	*	*			trans	64.3	154.2	170.1	-66.9	-173.9	173.8	-176.2	0	117.7
518	S	30	Very low	30.6	Very low	101 Å²	101	150.5 Å²	150.5	71%	0.706	78%	0.782	S	S	*	*			trans	-145.8	149.7	-158.1	50.7	0	0	0	0	110.5
519	E	27	Very low	30.1	Very low	174 Å²	174	148.7 Å²	148.7	81%	0.813	78%	0.782	S	S	*	*			trans	63.1	161	158.7	-66.2	-77.4	104	0	0	118
520	P	41	Very low	29.8	Very low	98 Å²	98	148.9 Å²	148.9	64%	0.636	78%	0.783	S	S	*	*			cis	-115.8	-179.3	-30.9	36.5	-23.2	0	0	0	110.6
521	L	23.6	Very low	29.1	Very low	161 Å²	161	149.4 Å²	149.4	84%	0.843	78%	0.781	S	S	*	*				-176.9	161.2	122.6	-100.8	168.7	0	0	0	113.3
522	S	23.2	Very low	28.8	Very low	99 Å²	99	146 Å²	146	69%	0.692	78%	0.78	S	S	*	*			trans	-58.6	145.8	-175.7	46.5	0	0	0	0	115.8
523	I	26.4	Very low	30	Very low	164 Å²	164	141.5 Å²	141.5	84%	0.841	77%	0.77	S	S	*	*			trans	-75.2	132.2	162.9	-65.5	158.1	0	0	0	110
524	T	27.2	Very low	30.1	Very low	121 Å²	121	137.7 Å²	137.7	74%	0.742	77%	0.769	S	S	*	*			trans	171.9	137	145.6	31.9	0	0	0	0	104.6
525	E	27.4	Very low	30.2	Very low	163 Å²	163	139.1 Å²	139.1	76%	0.762	77%	0.767	S	S	*	*			cis	-165.3	176.9	41.7	-78.4	-153.7	127.5	0	0	108.4
526	N	29.8	Very low	30.2	Very low	134 Å²	134	135.7 Å²	135.7	72%	0.717	77%	0.765	S	S	*	*			cis	-157.2	175.4	-12.2	-113.4	-16.9	0	0	0	111
527	G	26	Very low	31.2	Very low	71 Å²	71	133.9 Å²	133.9	73%	0.732	76%	0.755	S	S	*	*			trans	-136.9	61.3	-179.4	0	0	0	0	0	116.4
528	V	27.4	Very low	31.5	Very low	129 Å²	129	130.8 Å²	130.8	78%	0.782	75%	0.753	S	S	*	*			trans	40.3	122.3	152	-175.7	0	0	0	0	120.5
529	S	27.7	Very low	32.2	Very low	117 Å²	117	131.2 Å²	131.2	82%	0.818	75%	0.753	S	S	*	*			trans	-157.8	166	137.7	-80.8	0	0	0	0	110.7
530	N	28.6	Very low	32.1	Very low	142 Å²	142	128.6 Å²	128.6	76%	0.759	75%	0.754	S	S	*	*			trans	-66.1	172.5	-171.8	-51.5	-11.3	0	0	0	113.1
531	D	28.7	Very low	32.3	Very low	123 Å²	123	129.7 Å²	129.7	66%	0.658	76%	0.761	S	S	*	*			cis	-161.4	147.4	31.9	-123.1	-57	0	0	0	114.2
532	N	31.4	Very low	32.5	Very low	145 Å²	145	133.3 Å²	133.3	78%	0.775	76%	0.764	S	S	*	*			trans	40.5	162.1	154.5	-81.2	-54.8	0	0	0	124.4
533	P	56.7	Low	33.3	Very low	105 Å²	105	134 Å²	134	68%	0.682	77%	0.766	S	S	*	*			trans	-125.8	167.1	-150	43.3	-31.9	0	0	0	118.1
534	T	29.1	Very low	33.4	Very low	127 Å²	127	133.6 Å²	133.6	78%	0.779	77%	0.765	S	S	*	*			trans	-170.4	141.4	135	10.8	0	0	0	0	116.3
535	K	31.6	Very low	33.6	Very low	200 Å²	200	136.2 Å²	136.2	87%	0.87	77%	0.768	S	S	*	*			trans	65.9	114.3	146.9	-69.2	175.5	-178.6	179.1	0	124.2
536	D	27.7	Very low	33.5	Very low	150 Å²	150	134.1 Å²	134.1	80%	0.802	76%	0.762	S	S	*	*			trans	-42.2	179.7	144.4	-99	-40.9	0	0	0	118.2
537	P	53.4	Low	33.4	Very low	94 Å²	94	132.6 Å²	132.6	61%	0.61	76%	0.757	S	S	*	*			cis	-147.8	156.2	-15.9	34.8	-13.1	0	0	0	119.4
538	T	37.1	Very low	33.6	Very low	128 Å²	128	136.3 Å²	136.3	79%	0.785	76%	0.76	S	S	*	*			trans	69.3	-175.9	138.7	65.7	0	0	0	0	122
539	P	46.3	Very low	33.8	Very low	110 Å²	110	136 Å²	136	71%	0.714	75%	0.754	S	S	*	*				-143.3	157.2	-75.1	44.2	-26.9	0	0	0	119.9
540	S	23.7	Very low	33.8	Very low	119 Å²	119	138.9 Å²	138.9	83%	0.832	75%	0.748	S	S	*	*			trans	57.6	179.8	146.2	-117.8	0	0	0	0	121.1
541	P	45.1	Very low	33.8	Very low	122 Å²	122	141.4 Å²	141.4	79%	0.792	75%	0.747	S	S	*	*			cis	-129.3	-161.1	-17.6	33	-10.1	0	0	0	115.7
542	R	28	Very low	33.8	Very low	237 Å²	237	140 Å²	140	89%	0.894	75%	0.752	S	S	*	*			trans	-77.9	-173.8	-177.7	-58.6	178.4	178.1	178.3	-1.5	113.4
543	P	40.1	Very low	33.7	Very low	113 Å²	113	137.7 Å²	137.7	73%	0.734	75%	0.753	S	S	*	*			cis	-156.8	173.9	22.7	46.4	-23.2	0	0	0	123.5
544	L	28.6	Very low	32.3	Very low	156 Å²	156	142.1 Å²	142.1	82%	0.817	76%	0.762	S	S	*	*			trans	17.9	131.4	143.8	-61.9	162.5	0	0	0	124.5
545	H	30.3	Very low	32.4	Very low	176 Å²	176	146.6 Å²	146.6	82%	0.815	77%	0.765	S	S	*	*				170.3	176.8	125.6	-107.4	-119.2	0	0	0	111.3
546	N	26	Very low	32	Very low	119 Å²	119	145.9 Å²	145.9	64%	0.636	76%	0.764	S	S	*	*				-166.5	149.3	-60.3	-164.6	34.4	0	0	0	112.6
547	T	27.8	Very low	32	Very low	101 Å²	101	150.1 Å²	150.1	62%	0.62	77%	0.769	S	S	*	*			trans	63.8	142.8	149.7	40.3	0	0	0	0	127
548	L	31.2	Very low	31.8	Very low	150 Å²	150	151.1 Å²	151.1	79%	0.785	78%	0.776	S	S	*	*			trans	69.9	153	146.6	-90.9	83.2	0	0	0	121
549	D	30.1	Very low	31.1	Very low	122 Å²	122	150.7 Å²	150.7	65%	0.652	78%	0.777	S	S	*	*			cis	-172.4	179.2	-24.2	-145.2	-24.5	0	0	0	113.4
550	Y	28.8	Very low	30.3	Very low	178 Å²	178	155.4 Å²	155.4	70%	0.698	78%	0.782	S	S	*	*			trans	69.3	161.3	162.1	-87.7	-125	0	0	0	120.5
551	R	28.4	Very low	31.2	Very low	194 Å²	194	155.7 Å²	155.7	73%	0.732	78%	0.781	S	S	*	*			cis	-170.5	135.6	-40.1	-162.1	169.9	-172.9	171.4	1.9	113.7
552	A	27.5	Very low	30.5	Very low	93 Å²	93	152.6 Å²	152.6	77%	0.769	77%	0.77	S	S	*	*			trans	47.3	105.7	151.4	0	0	0	0	0	125.8
553	A	30	Very low	30.7	Very low	97 Å²	97	150 Å²	150	80%	0.802	77%	0.768	S	S	*	*			trans	8.5	142.4	135.4	0	0	0	0	0	125.8
554	K	28.6	Very low	30.3	Very low	198 Å²	198	150.1 Å²	150.1	86%	0.861	77%	0.767	S	S	*	*				-174.1	144.5	116.7	-104.9	171.2	-178.9	176.2	0	116.5
555	R	29.3	Very low	30.2	Very low	222 Å²	222	150.9 Å²	150.9	84%	0.838	77%	0.767	S	S	*	*			trans	22.4	142	154.3	-60.2	-178.1	167.9	-168.7	-4.3	123.3
556	E	23.5	Very low	30.2	Very low	184 Å²	184	148.4 Å²	148.4	86%	0.86	76%	0.764	S	S	*	*				-176.7	176.5	101.3	-99.8	-178.7	-165	0	0	116.7
557	R	28.6	Very low	31.3	Very low	239 Å²	239	148.4 Å²	148.4	90%	0.902	77%	0.771	S	S	*	*			trans	-171	167.8	-176.8	-98	-169.2	-179.3	-167.6	1.4	107.5
558	P	48.2	Very low	32.6	Very low	116 Å²	116	148.9 Å²	148.9	75%	0.753	78%	0.775	S	S	*	*			cis	-134.1	-166.1	-13.3	42.3	-24	0	0	0	113.6
559	C	23.6	Very low	33.5	Very low	119 Å²	119	146.6 Å²	146.6	80%	0.804	77%	0.77	S	S	*	*				160.5	178	117.4	-141.8	0	0	0	0	115.4
560	Y	29.3	Very low	33.7	Very low	209 Å²	209	148 Å²	148	82%	0.82	78%	0.776	S	S	*	*			trans	-118	-179.8	-168.2	-72.3	-87.7	0	0	0	114.2
561	P	42.3	Very low	33.8	Very low	125 Å²	125	149.9 Å²	149.9	81%	0.812	78%	0.782	S	S	*	*				-125.7	178	82	38.6	-30.8	0	0	0	113.3
562	G	29.3	Very low	33.8	Very low	56 Å²	56	150.9 Å²	150.9	58%	0.577	79%	0.786	S	S	*	*			cis	159.2	147.7	-10.3	0	0	0	0	0	113.2
563	H	33.7	Very low	33.9	Very low	182 Å²	182	152.6 Å²	152.6	84%	0.843	79%	0.786	S	S	*	*			trans	66.9	163.2	173.2	-48.9	-81.7	0	0	0	115.8
564	T	30.3	Very low	33.9	Very low	117 Å²	117	153.2 Å²	153.2	72%	0.718	79%	0.785	S	S	*	*			cis	-162.5	172.9	-23.9	24.5	0	0	0	0	107
565	Q	27.7	Very low	33.9	Very low	172 Å²	172	149 Å²	149	80%	0.804	78%	0.78	S	S	*	*			cis	-150.1	-173.9	6.1	-139.7	178.2	99	0	0	110.4
566	T	30.9	Very low	34.3	Very low	123 Å²	123	145.7 Å²	145.7	76%	0.755	78%	0.779	S	S	*	*			trans	-161	176.7	-163.5	52	0	0	0	0	112.8
567	P	49.1	Very low	35.5	Very low	120 Å²	120	142.8 Å²	142.8	78%	0.779	78%	0.777	S	S	*	*			cis	-126.7	-108.6	-20.2	21.9	4.9	0	0	0	118
568	P	54.7	Low	36.8	Very low	110 Å²	110	137 Å²	137	71%	0.714	77%	0.77	S	S	*	*				-122.8	-150.3	-129.2	43.7	-22.7	0	0	0	114.3
569	P	49.6	Very low	35.8	Very low	103 Å²	103	139.5 Å²	139.5	67%	0.669	77%	0.771	S	S	*	*			cis	-146.3	171.2	-4.8	43.2	-22.4	0	0	0	121.1
570	L	34.4	Very low	36.3	Very low	152 Å²	152	141.1 Å²	141.1	80%	0.796	77%	0.771	S	S	*	*			trans	64.2	128.4	141.4	-74.3	167.4	0	0	0	127.2
571	R	31.8	Very low	36.3	Very low	217 Å²	217	134.4 Å²	134.4	82%	0.819	77%	0.765	S	S	*	*			trans	83.4	136.5	134.5	-96.6	-179.7	177.2	-179	0.7	125
572	R	28.5	Very low	36.5	Very low	214 Å²	214	134.8 Å²	134.8	81%	0.808	77%	0.768	S	S	*	*				101.7	111.2	128.4	179.3	-178.4	-89.1	-176	-6.3	123.1
573	V	28.7	Very low	36.6	Very low	129 Å²	129	138.5 Å²	138.5	78%	0.782	78%	0.779	S	S	*	*			trans	66.2	117.6	133.9	175.2	0	0	0	0	124.1
574	S	29.2	Very low	36.3	Very low	111 Å²	111	136.8 Å²	136.8	78%	0.776	78%	0.776	S	S	*	*			trans	63.4	159.7	134.8	-153	0	0	0	0	125
575	S	29.7	Very low	36.4	Very low	109 Å²	109	136.1 Å²	136.1	76%	0.762	77%	0.772	S	S	*	*			trans	94.5	140.3	158.7	70.6	0	0	0	0	121.2
576	N	37.5	Very low	36.6	Very low	153 Å²	153	135.7 Å²	135.7	82%	0.818	77%	0.77	S	S	*	*			trans	-89.8	164.9	173.2	-55	-7.9	0	0	0	110.6
577	P	48.4	Very low	36.7	Very low	123 Å²	123	140.8 Å²	140.8	80%	0.799	78%	0.775	S	S	*	*				-147	-151.1	115.8	36.8	-15.2	0	0	0	113.6
578	P	55.3	Low	35.8	Very low	116 Å²	116	146 Å²	146	75%	0.753	78%	0.779	S	S	*	*				-137.6	-154.7	-90.6	47	-28.6	0	0	0	116.3
579	E	28.1	Very low	34.7	Very low	170 Å²	170	146.3 Å²	146.3	79%	0.794	78%	0.779	S	S	*	*			trans	97.4	140.9	172.1	-57.1	-152.4	130.7	0	0	117.4
580	L	34.3	Very low	33.9	Very low	153 Å²	153	149.7 Å²	149.7	80%	0.801	79%	0.786	S	S	*	*			cis	-155.3	172.4	-13.7	-113.2	174.4	0	0	0	111.2
581	G	28	Very low	33.8	Very low	67 Å²	67	147.4 Å²	147.4	69%	0.691	79%	0.789	S	S	*	*			trans	-87.4	-167.8	-176.1	0	0	0	0	0	116.5
582	P	46.8	Very low	33.8	Very low	134 Å²	134	141.4 Å²	141.4	87%	0.87	79%	0.785	S	S	*	*			cis	-142.1	-160.4	44.2	41.7	-20.8	0	0	0	116.7
583	V	32.5	Very low	34	Very low	133 Å²	133	136.8 Å²	136.8	81%	0.806	79%	0.786	S	S	*	*			trans	-142.3	152.5	-164.7	173.6	0	0	0	0	113.9
584	N	25.9	Very low	34.3	Very low	147 Å²	147	136 Å²	136	79%	0.786	79%	0.787	S	S	*	*			trans	-170.8	173	157.8	-100.5	-13.2	0	0	0	111.5
585	T	32.7	Very low	34.5	Very low	103 Å²	103	136.3 Å²	136.3	63%	0.632	78%	0.784	S	S	*	*				-162.3	143.5	-59	26.1	0	0	0	0	113
586	H	33.1	Very low	34.9	Very low	163 Å²	163	138 Å²	138	76%	0.755	79%	0.79	S	S	*	*			trans	52.8	115.2	148.9	-78.1	-57	0	0	0	125.7
587	R	31.5	Very low	34.5	Very low	230 Å²	230	134.2 Å²	134.2	87%	0.868	79%	0.786	S	S	*	*				64.9	129.5	108.8	-165.8	-171.6	-158.4	179.6	6.5	121.5
588	R	30.4	Very low	34.6	Very low	228 Å²	228	134 Å²	134	86%	0.86	79%	0.785	S	S	*	*				170	119	121	178.2	160	-171.7	143.7	5.4	118.5
589	V	32.8	Very low	33.3	Very low	118 Å²	118	135.4 Å²	135.4	72%	0.715	79%	0.786	S	S	*	*			trans	68.9	156.4	143.3	169.6	0	0	0	0	122.6
590	E	32.3	Very low	33.8	Very low	174 Å²	174	135.1 Å²	135.1	81%	0.813	78%	0.784	S	S	*	*			trans	-98.1	175.8	-167.2	-50	148.4	97.8	0	0	115.4
591	A	33.1	Very low	33.7	Very low	104 Å²	104	136 Å²	136	86%	0.86	79%	0.786	S	S	*	*			trans	-147.2	154.4	145.8	0	0	0	0	0	108.6
592	A	31.1	Very low	34.3	Very low	90 Å²	90	141.5 Å²	141.5	74%	0.744	79%	0.792	S	S	*	*			trans	-143.2	149.6	-163	0	0	0	0	0	115.9
593	S	31.7	Very low	33.6	Very low	118 Å²	118	143.8 Å²	143.8	83%	0.825	79%	0.791	S	S	*	*			trans	-175.2	131.8	143.3	-79.6	0	0	0	0	108.1
594	S	35.2	Very low	33.9	Very low	113 Å²	113	143.7 Å²	143.7	79%	0.79	79%	0.785	S	S	*	*				72	129.2	58.6	-157.4	0	0	0	0	111.8
595	T	35.2	Very low	34.3	Very low	116 Å²	116	148 Å²	148	71%	0.712	79%	0.791	S	S	*	*			cis	-155.5	141.3	11.3	161	0	0	0	0	111.6
596	T	38	Very low	34.4	Very low	146 Å²	146	150.7 Å²	150.7	90%	0.896	80%	0.796	S	S	*	*				172.9	150.7	129.2	29.3	0	0	0	0	111.9
597	G	29	Very low	34.5	Very low	72 Å²	72	149.8 Å²	149.8	74%	0.742	80%	0.802	S	S	*	*			trans	-171.9	-172	173.4	0	0	0	0	0	109
598	P	49.1	Very low	34.7	Very low	118 Å²	118	142.8 Å²	142.8	77%	0.766	79%	0.788	S	S	*	*			cis	-117.4	174.2	0.4	42.7	-31.2	0	0	0	112.9
599	D	28.9	Very low	35.6	Very low	146 Å²	146	135.2 Å²	135.2	78%	0.781	78%	0.782	S	S	*	*				175.6	175.4	98.4	-136	-45.5	0	0	0	112.2
600	H	38.3	Very low	36.7	Very low	164 Å²	164	134.8 Å²	134.8	76%	0.759	78%	0.775	S	S	*	*			trans	-70.4	135.1	-175.1	-87.3	-87.9	0	0	0	115.2
601	M	31.3	Very low	38.6	Very low	171 Å²	171	130.4 Å²	130.4	84%	0.842	76%	0.757	S	S	*	*				-153.3	157.7	122.3	-104.2	-48.3	119.1	0	0	111.7
602	K	40.9	Very low	40.8	Very low	184 Å²	184	125.6 Å²	125.6	80%	0.8	72%	0.718	S	S	*	*			trans	-67	134.6	160	-68	177	179	177.6	0	107.7
603	Q	33.7	Very low	43.4	Very low	182 Å²	182	123.5 Å²	123.5	85%	0.85	70%	0.697	S	S	*	*			trans	-105.6	97.7	161.8	-168.5	161.4	44.6	0	0	109	R605	Q603-R605 PolarHBondContact O-N 3.4Å
604	D	36.9	Very low	46	Very low	130 Å²	130	122 Å²	122	70%	0.695	69%	0.687	S	S	*	*			trans	-53.5	127.2	156.5	-69.8	-71.3	0	0	0	108	E606	D604-E606 PolarHBondContact O-N 3.37Å
605	R	35.9	Very low	48.8	Very low	239 Å²	239	118.1 Å²	118.1	90%	0.902	66%	0.655	S	S	*	*			trans	-98.7	76.8	166.4	-141.5	177.2	-165.3	-159.3	1.7	108.8	Q603 T607	Q603-R605 PolarHBondContact O-N 3.4Å; R605-T607 PolarHBondContact O-N 3.39Å
606	E	33.3	Very low	51.5	Low	159 Å²	159	115.3 Å²	115.3	74%	0.743	64%	0.64	S	S	*	*			trans	-40.8	128.3	166.8	-56.2	172.9	122.7	0	0	109.6	D604 S608	D604-E606 PolarHBondContact O-N 3.37Å; E606-S608 PolarHBondContact O-N 3.28Å
607	T	36	Very low	54.1	Low	143 Å²	143	110.2 Å²	110.2	88%	0.877	61%	0.609	S	S	*	*			trans	-71.6	80.7	157.2	48.5	0	0	0	0	107.1	R605	R605-T607 PolarHBondContact O-N 3.39Å
608	S	34.9	Very low	57.1	Low	83 Å²	83	111.5 Å²	111.5	58%	0.58	60%	0.599	S	S	*	*			trans	-50.8	148.3	176.3	49.6	0	0	0	0	110.6	E606 N610	E606-S608 PolarHBondContact O-N 3.28Å; S608-N610 VanDerWaalsContact C-N 3.35Å; S608-N610 PolarHBondContact O-N 2.94Å
609	G	49.8	Very low	59.2	Low	70 Å²	70	108.7 Å²	108.7	72%	0.722	58%	0.575	S	S	*	*			trans	-57.1	86	-163.1	0	0	0	0	0	114.8	N611	G609-N611 PolarHBondContact O-N 3.29Å
610	N	56.8	Low	62.2	Low	109 Å²	109	101.8 Å²	101.8	58%	0.583	54%	0.538	S	S	*	.			trans	-70.5	92	-177	-96.7	-11.6	0	0	0	110.1	S608 A612	S608-N610 VanDerWaalsContact C-N 3.35Å; S608-N610 PolarHBondContact O-N 2.94Å; N610-A612 PolarHBondContact O-N 3.44Å
611	N	72.6	Confident	64.8	Low	81 Å²	81	94.4 Å²	94.4	43%	0.433	50%	0.504	S	S	.	.			trans	-58.5	106.6	172.5	-87.6	-74.3	0	0	0	109.7	G609 S613 S614 K682	G609-N611 PolarHBondContact O-N 3.29Å; N611-S613 PolarHBondContact O-N 2.94Å; N611-S614 PolarHBondContact O-N 3.47Å; N611-S614 PolarHBondContact O-OG 3.01Å; N611-K682 WeakPolarHBondContact OD1-CE 3.46Å; N611-K682 PolarHBondContact OD1-NZ 3.33Å
612	A	79.3	Confident	67.8	Low	3 Å²	3	92.4 Å²	92.4	3%	0.025	49%	0.487	C	S	.	.	G	3₁₀ helix	trans	-49.6	-29.6	177.4	0	0	0	0	0	113.8	N610 S614 W615 G646 M650 L678	N610-A612 PolarHBondContact O-N 3.44Å; A612-S614 PolarHBondContact O-N 2.98Å; A612-W615 HydrophobicContact CB-CD2 4.32Å; A612-W615 HydrophobicContact CB-CE3 4.41Å; A612-W615 HydrophobicContact CB-CZ2 4.43Å; A612-W615 PolarHBondContact O-N 3.33Å; A612-G646 CarbonylContact O-C 3.39Å; A612-G646 WeakPolarHBondContact O-CA 3.42Å; A612-M650 HydrophobicContact CB-CE 4.42Å; A612-M650 HydrophobicContact CB-CG 4.33Å; A612-M650 HydrophobicContact CB-SD 4.1Å; A612-L678 HydrophobicContact CB-CD2 3.52Å; A612-L678 HydrophobicContact CB-CG 3.96Å
613	S	83.9	Confident	70.2	Confident	46 Å²	46	85.5 Å²	85.5	32%	0.322	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-69.7	1.2	174.6	48.9	0	0	0	0	116	N611 K647	N611-S613 PolarHBondContact O-N 2.94Å; S613-K647 VanDerWaalsContact O-CE 3.31Å; S613-K647 WeakPolarHBondContact O-CE 3.07Å; S613-K647 VanDerWaalsContact O-CG 3.22Å; S613-K647 WeakPolarHBondContact O-CG 3.31Å
614	S	86.7	Confident	72.9	Confident	87 Å²	87	76.9 Å²	76.9	61%	0.608	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-120.5	8.6	171.4	63.9	0	0	0	0	113.7	N611 A612	N611-S614 PolarHBondContact O-N 3.47Å; N611-S614 PolarHBondContact O-OG 3.01Å; A612-S614 PolarHBondContact O-N 2.98Å
615	W	93.4	Very high	75.4	Confident	32 Å²	32	75.8 Å²	75.8	12%	0.121	41%	0.408	C	S	.	.			trans	-70.3	138.7	176.3	-67.3	-10.7	0	0	0	112.4	A612 E619 V620 F623 G646 L649 L678	A612-W615 HydrophobicContact CB-CD2 4.32Å; A612-W615 HydrophobicContact CB-CE3 4.41Å; A612-W615 HydrophobicContact CB-CZ2 4.43Å; A612-W615 PolarHBondContact O-N 3.33Å; W615-E619 HydrophobicContact CB-CB 3.96Å; W615-E619 HydrophobicContact CG-CB 4.22Å; W615-V620 HydrophobicContact CB-CG2 4.18Å; W615-V620 HydrophobicContact CE3-CG2 4.26Å; W615-F623 HydrophobicContact CE3-CB 4.42Å; W615-F623 HydrophobicContact CH2-CB 4.11Å; W615-F623 AromaticContact CH2-CD2 3.72Å; W615-F623 HydrophobicContact CH2-CD2 3.72Å; W615-F623 HydrophobicContact CH2-CE2 4.27Å; W615-F623 AromaticContact CH2-CG 3.88Å; W615-F623 HydrophobicContact CH2-CG 3.88Å; W615-F623 HydrophobicContact CZ3-CB 3.64Å; W615-F623 AromaticContact CZ3-CD1 3.89Å; W615-F623 HydrophobicContact CZ3-CD1 3.89Å; W615-F623 AromaticContact CZ3-CD2 3.85Å; W615-F623 HydrophobicContact CZ3-CD2 3.85Å; W615-F623 HydrophobicContact CZ3-CE2 4.47Å; W615-F623 AromaticContact CZ3-CG 3.51Å; W615-F623 HydrophobicContact CZ3-CG 3.51Å; W615-G646 PolarHBondContact O-N 3.24Å; W615-L649 HydrophobicContact CE3-CD2 4.23Å; W615-L649 HydrophobicContact CZ3-CD2 4.18Å; W615-L678 HydrophobicContact CE3-CD2 4.35Å; W615-L678 HydrophobicContact CH2-CD1 3.62Å; W615-L678 HydrophobicContact CH2-CD2 3.45Å; W615-L678 VanDerWaalsContact CH2-CD2 3.45Å; W615-L678 HydrophobicContact CH2-CG 4.18Å; W615-L678 HydrophobicContact CZ2-CD1 4.15Å; W615-L678 HydrophobicContact CZ2-CD2 4.33Å; W615-L678 HydrophobicContact CZ3-CD1 4.46Å; W615-L678 HydrophobicContact CZ3-CD2 3.45Å; W615-L678 VanDerWaalsContact CZ3-CD2 3.45Å
616	S	93.4	Very high	78	Confident	56 Å²	56	70.9 Å²	70.9	39%	0.392	40%	0.395	S	S	.	.			trans	-70.5	166.4	166.3	61.3	0	0	0	0	112.3	D618 E619 V620	S616-D618 VanDerWaalsContact C-N 3.31Å; S616-D618 PolarHBondContact O-N 3.4Å; S616-E619 WeakPolarHBondContact CB-OE2 3.22Å; S616-E619 PolarHBondContact N-OE2 3.5Å; S616-E619 PolarHBondContact O-N 3.23Å; S616-E619 VanDerWaalsContact O-N 3.17Å; S616-E619 VanDerWaalsContact OG-CG 3.32Å; S616-E619 WeakPolarHBondContact OG-CG 3.39Å; S616-E619 PolarHBondContact OG-N 2.9Å; S616-E619 PolarHBondContact OG-OE2 3.35Å; S616-V620 PolarHBondContact O-N 2.99Å
617	V	92.6	Very high	80.6	Confident	39 Å²	39	64.8 Å²	64.8	24%	0.236	37%	0.372	C	S	.	.	H	α-helix	trans	-60.4	-39.5	178.8	-175.9	0	0	0	0	111.4	E619 V620 I621 D645	V617-E619 PolarHBondContact O-N 3.06Å; V617-V620 PolarHBondContact O-N 2.94Å; V617-I621 HydrophobicContact CG1-CD1 3.92Å; V617-I621 HydrophobicContact CG1-CG1 4.5Å; V617-I621 WeakPolarHBondContact O-CB 3.33Å; V617-I621 WeakPolarHBondContact O-CD1 3.42Å; V617-I621 VanDerWaalsContact O-CG1 3.23Å; V617-I621 WeakPolarHBondContact O-CG1 3.34Å; V617-I621 PolarHBondContact O-N 3.2Å; V617-D645 HydrophobicContact CG2-CB 4.34Å
618	D	91.9	Very high	82.9	Confident	100 Å²	100	59.2 Å²	59.2	54%	0.535	34%	0.337	S	S	.	.	H	α-helix	trans	-70.7	-28.2	177.3	-69.5	-65.8	0	0	0	113.3	S616 R622 R640	S616-D618 VanDerWaalsContact C-N 3.31Å; S616-D618 PolarHBondContact O-N 3.4Å; D618-R622 WeakPolarHBondContact O-CB 3.23Å; D618-R622 PolarHBondContact O-N 2.78Å; D618-R640 IonicContact OD1-NH2 3.18Å; D618-R640 PolarHBondContact OD1-NH2 2.89Å
619	E	92.4	Very high	85.5	Confident	59 Å²	59	59.4 Å²	59.4	28%	0.276	34%	0.336	S	S	.	.	H	α-helix	trans	-71.7	-37.8	170.8	-72.6	169.9	112.9	0	0	112.3	W615 S616 V617 R622 F623	W615-E619 HydrophobicContact CB-CB 3.96Å; W615-E619 HydrophobicContact CG-CB 4.22Å; S616-E619 WeakPolarHBondContact CB-OE2 3.22Å; S616-E619 PolarHBondContact N-OE2 3.5Å; S616-E619 PolarHBondContact O-N 3.23Å; S616-E619 VanDerWaalsContact O-N 3.17Å; S616-E619 VanDerWaalsContact OG-CG 3.32Å; S616-E619 WeakPolarHBondContact OG-CG 3.39Å; S616-E619 PolarHBondContact OG-N 2.9Å; S616-E619 PolarHBondContact OG-OE2 3.35Å; V617-E619 PolarHBondContact O-N 3.06Å; E619-R622 PolarHBondContact O-N 2.84Å; E619-F623 WeakPolarHBondContact O-CB 3.42Å; E619-F623 PolarHBondContact O-N 2.96Å
620	V	93.1	Very high	87	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-63.1	-45.3	170.9	169.6	0	0	0	0	111	W615 S616 V617 F623 V624 F639 I644 L649	W615-V620 HydrophobicContact CB-CG2 4.18Å; W615-V620 HydrophobicContact CE3-CG2 4.26Å; S616-V620 PolarHBondContact O-N 2.99Å; V617-V620 PolarHBondContact O-N 2.94Å; V620-F623 PolarHBondContact O-N 2.89Å; V620-V624 HydrophobicContact CG1-CG2 4.35Å; V620-V624 VanDerWaalsContact O-CG2 3.31Å; V620-V624 WeakPolarHBondContact O-CG2 3.18Å; V620-V624 PolarHBondContact O-N 3.45Å; V620-F639 HydrophobicContact CG1-CD1 4.2Å; V620-I644 WeakPolarHBondContact CB-O 3.34Å; V620-I644 HydrophobicContact CG1-CG2 4.2Å; V620-L649 HydrophobicContact CG1-CB 4.44Å; V620-L649 HydrophobicContact CG1-CD1 4.1Å; V620-L649 HydrophobicContact CG1-CD2 4.1Å; V620-L649 HydrophobicContact CG1-CG 4.44Å; V620-L649 HydrophobicContact CG2-CB 4.31Å; V620-L649 HydrophobicContact CG2-CD2 4.06Å
621	I	92.8	Very high	88.4	Confident	9 Å²	9	61.4 Å²	61.4	5%	0.046	33%	0.326	C	S	.	.	H	α-helix	trans	-56.3	-50.5	175.1	-77.7	166.1	0	0	0	110.5	V617 F623 V624 Q625 V636 F639 R640	V617-I621 HydrophobicContact CG1-CD1 3.92Å; V617-I621 HydrophobicContact CG1-CG1 4.5Å; V617-I621 WeakPolarHBondContact O-CB 3.33Å; V617-I621 WeakPolarHBondContact O-CD1 3.42Å; V617-I621 VanDerWaalsContact O-CG1 3.23Å; V617-I621 WeakPolarHBondContact O-CG1 3.34Å; V617-I621 PolarHBondContact O-N 3.2Å; I621-F623 PolarHBondContact O-N 3.38Å; I621-V624 PolarHBondContact O-N 3.04Å; I621-Q625 WeakPolarHBondContact O-CB 3.3Å; I621-Q625 PolarHBondContact O-N 2.79Å; I621-V636 HydrophobicContact CB-CG1 4.12Å; I621-V636 HydrophobicContact CG1-CG1 4.18Å; I621-V636 HydrophobicContact CG2-CG1 3.41Å; I621-V636 VanDerWaalsContact CG2-CG1 3.41Å; I621-F639 HydrophobicContact CG1-CB 4.24Å; I621-R640 HydrophobicContact CD1-CB 3.68Å; I621-R640 HydrophobicContact CD1-CG 4.18Å
622	R	92.5	Very high	89.1	Confident	130 Å²	130	57.5 Å²	57.5	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-58.7	-47.7	176.2	178.2	177	57.7	169.9	-4.9	111.5	D618 E619 V624 Q625 E626	D618-R622 WeakPolarHBondContact O-CB 3.23Å; D618-R622 PolarHBondContact O-N 2.78Å; E619-R622 PolarHBondContact O-N 2.84Å; R622-V624 PolarHBondContact O-N 3.21Å; R622-Q625 PolarHBondContact O-N 2.93Å; R622-E626 VanDerWaalsContact CD-OE1 3.32Å; R622-E626 WeakPolarHBondContact CD-OE1 3.48Å; R622-E626 VanDerWaalsContact CG-CD 3.49Å; R622-E626 HydrophobicContact CG-CG 4.2Å; R622-E626 WeakPolarHBondContact CG-OE1 3.4Å; R622-E626 WeakPolarHBondContact O-CB 3.3Å; R622-E626 WeakPolarHBondContact O-CG 3.46Å; R622-E626 PolarHBondContact O-N 2.85Å
623	F	92.6	Very high	89.4	Confident	39 Å²	39	58.5 Å²	58.5	17%	0.171	32%	0.316	C	S	.	.	H	α-helix	trans	-57.9	-46.4	176.9	167.8	-102.5	0	0	0	112.3	W615 E619 V620 I621 Q625 E626 A627 L649 H674 L678	W615-F623 HydrophobicContact CE3-CB 4.42Å; W615-F623 HydrophobicContact CH2-CB 4.11Å; W615-F623 AromaticContact CH2-CD2 3.72Å; W615-F623 HydrophobicContact CH2-CD2 3.72Å; W615-F623 HydrophobicContact CH2-CE2 4.27Å; W615-F623 AromaticContact CH2-CG 3.88Å; W615-F623 HydrophobicContact CH2-CG 3.88Å; W615-F623 HydrophobicContact CZ3-CB 3.64Å; W615-F623 AromaticContact CZ3-CD1 3.89Å; W615-F623 HydrophobicContact CZ3-CD1 3.89Å; W615-F623 AromaticContact CZ3-CD2 3.85Å; W615-F623 HydrophobicContact CZ3-CD2 3.85Å; W615-F623 HydrophobicContact CZ3-CE2 4.47Å; W615-F623 AromaticContact CZ3-CG 3.51Å; W615-F623 HydrophobicContact CZ3-CG 3.51Å; E619-F623 WeakPolarHBondContact O-CB 3.42Å; E619-F623 PolarHBondContact O-N 2.96Å; V620-F623 PolarHBondContact O-N 2.89Å; I621-F623 PolarHBondContact O-N 3.38Å; F623-Q625 VanDerWaalsContact C-N 3.31Å; F623-Q625 PolarHBondContact O-N 2.61Å; F623-E626 PolarHBondContact O-N 2.87Å; F623-A627 WeakPolarHBondContact O-CB 3.43Å; F623-A627 PolarHBondContact O-N 3.23Å; F623-L649 HydrophobicContact CD1-CD2 4Å; F623-L649 HydrophobicContact CE1-CD2 4.14Å; F623-H674 HydrophobicContact CE1-CB 4.43Å; F623-H674 HydrophobicContact CZ-CB 4.03Å; F623-L678 HydrophobicContact CE1-CD2 4.26Å; F623-L678 HydrophobicContact CE2-CD1 4.13Å; F623-L678 HydrophobicContact CE2-CD2 4.24Å; F623-L678 HydrophobicContact CZ-CB 4.27Å; F623-L678 HydrophobicContact CZ-CD2 3.98Å
624	V	90.6	Very high	89.7	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.9	-37.8	178.4	171.5	0	0	0	0	111.4	V620 I621 R622 L632 V636 F639 L671	V620-V624 HydrophobicContact CG1-CG2 4.35Å; V620-V624 VanDerWaalsContact O-CG2 3.31Å; V620-V624 WeakPolarHBondContact O-CG2 3.18Å; V620-V624 PolarHBondContact O-N 3.45Å; I621-V624 PolarHBondContact O-N 3.04Å; R622-V624 PolarHBondContact O-N 3.21Å; V624-L632 HydrophobicContact CG1-CB 3.86Å; V624-L632 HydrophobicContact CG1-CD1 4.48Å; V624-V636 HydrophobicContact CG1-CG2 4.08Å; V624-F639 HydrophobicContact CG1-CD2 4.11Å; V624-F639 HydrophobicContact CG1-CE2 3.7Å; V624-F639 HydrophobicContact CG1-CZ 3.99Å; V624-F639 HydrophobicContact CG2-CD1 4.1Å; V624-F639 HydrophobicContact CG2-CE1 3.86Å; V624-F639 HydrophobicContact CG2-CE2 4.33Å; V624-F639 HydrophobicContact CG2-CG 4.43Å; V624-F639 HydrophobicContact CG2-CZ 3.98Å; V624-L671 HydrophobicContact CG2-CD1 4.03Å
625	Q	89.7	Confident	89.8	Confident	107 Å²	107	59.3 Å²	59.3	50%	0.5	31%	0.313	S	S	.	.	H	α-helix	trans	-71.8	-38.4	178.1	-170	172	-5.3	0	0	112.9	I621 R622 F623 P629 V636	I621-Q625 WeakPolarHBondContact O-CB 3.3Å; I621-Q625 PolarHBondContact O-N 2.79Å; R622-Q625 PolarHBondContact O-N 2.93Å; F623-Q625 VanDerWaalsContact C-N 3.31Å; F623-Q625 PolarHBondContact O-N 2.61Å; Q625-P629 WeakPolarHBondContact O-CA 3.45Å; Q625-P629 VanDerWaalsContact O-CG 3.29Å; Q625-P629 WeakPolarHBondContact O-CG 3.49Å; Q625-V636 HydrophobicContact CB-CG2 3.93Å; Q625-V636 HydrophobicContact CG-CG2 4.43Å
626	E	89.7	Confident	89.7	Confident	137 Å²	137	58.1 Å²	58.1	64%	0.64	31%	0.31	S	S	*	.	H	α-helix	trans	-77.8	-31.1	178	-71.8	173.2	-176.3	0	0	112.7	R622 F623	R622-E626 VanDerWaalsContact CD-OE1 3.32Å; R622-E626 WeakPolarHBondContact CD-OE1 3.48Å; R622-E626 VanDerWaalsContact CG-CD 3.49Å; R622-E626 HydrophobicContact CG-CG 4.2Å; R622-E626 WeakPolarHBondContact CG-OE1 3.4Å; R622-E626 WeakPolarHBondContact O-CB 3.3Å; R622-E626 WeakPolarHBondContact O-CG 3.46Å; R622-E626 PolarHBondContact O-N 2.85Å; F623-E626 PolarHBondContact O-N 2.87Å
627	A	87.4	Confident	89.4	Confident	30 Å²	30	60.5 Å²	60.5	25%	0.248	32%	0.318	C	S	.	.	H	α-helix	trans	-68.8	-42.8	-176	0	0	0	0	0	113.8	F623 H674	F623-A627 WeakPolarHBondContact O-CB 3.43Å; F623-A627 PolarHBondContact O-N 3.23Å; A627-H674 HydrophobicContact CB-CB 4.25Å; A627-H674 PolarHBondContact O-CE1 3.39Å
628	D	85.5	Confident	89.3	Confident	27 Å²	27	60.9 Å²	60.9	14%	0.144	32%	0.318	C	S	.	.			trans	-150.6	86.5	171.4	-168.9	-60.6	0	0	0	110.6	Q630 T631 L632 G633 K670	D628-Q630 PolarHBondContact O-N 2.65Å; D628-Q630 VanDerWaalsContact O-N 3.14Å; D628-Q630 PolarHBondContact OD1-N 2.92Å; D628-T631 PolarHBondContact O-N 3.5Å; D628-T631 WeakPolarHBondContact OD1-CA 3.11Å; D628-T631 WeakPolarHBondContact OD1-CB 3.42Å; D628-T631 PolarHBondContact OD1-N 3.03Å; D628-T631 PolarHBondContact OD1-OG1 3Å; D628-T631 PolarHBondContact OD2-OG1 3.04Å; D628-L632 HydrophobicContact CB-CB 4.3Å; D628-L632 HydrophobicContact CB-CD1 4.03Å; D628-L632 HydrophobicContact CB-CG 4Å; D628-L632 WeakPolarHBondContact O-CA 3.37Å; D628-L632 WeakPolarHBondContact O-CB 3.42Å; D628-L632 PolarHBondContact O-N 3.41Å; D628-G633 PolarHBondContact O-N 2.96Å; D628-K670 IonicContact OD1-NZ 2.66Å; D628-K670 IonicContact OD2-NZ 3.78Å; D628-K670 PolarHBondContact OD2-NZ 2.96Å
629	P	88	Confident	89.2	Confident	87 Å²	87	56.1 Å²	56.1	57%	0.565	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.3	-175.7	-22.9	29.5	0	0	0	114.3	Q625 G633	Q625-P629 WeakPolarHBondContact O-CA 3.45Å; Q625-P629 VanDerWaalsContact O-CG 3.29Å; Q625-P629 WeakPolarHBondContact O-CG 3.49Å; P629-G633 WeakPolarHBondContact O-CA 3.38Å
630	Q	82.8	Confident	89.2	Confident	175 Å²	175	58.8 Å²	58.8	82%	0.818	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-31.6	-173.3	-67.3	-173.4	-5.9	0	0	113.4	D628	D628-Q630 PolarHBondContact O-N 2.65Å; D628-Q630 VanDerWaalsContact O-N 3.14Å; D628-Q630 PolarHBondContact OD1-N 2.92Å
631	T	86.1	Confident	89.1	Confident	45 Å²	45	66.6 Å²	66.6	28%	0.276	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	-14.3	-172.8	65.1	0	0	0	0	114.9	D628 K670	D628-T631 PolarHBondContact O-N 3.5Å; D628-T631 WeakPolarHBondContact OD1-CA 3.11Å; D628-T631 WeakPolarHBondContact OD1-CB 3.42Å; D628-T631 PolarHBondContact OD1-N 3.03Å; D628-T631 PolarHBondContact OD1-OG1 3Å; D628-T631 PolarHBondContact OD2-OG1 3.04Å; T631-K670 WeakPolarHBondContact OG1-CD 3.49Å; T631-K670 PolarHBondContact OG1-NZ 3.38Å
632	L	86.8	Confident	89	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-29.3	167	-62.5	179.9	0	0	0	112.5	V624 D628 H635 V636 P667 L671	V624-L632 HydrophobicContact CG1-CB 3.86Å; V624-L632 HydrophobicContact CG1-CD1 4.48Å; D628-L632 HydrophobicContact CB-CB 4.3Å; D628-L632 HydrophobicContact CB-CD1 4.03Å; D628-L632 HydrophobicContact CB-CG 4Å; D628-L632 WeakPolarHBondContact O-CA 3.37Å; D628-L632 WeakPolarHBondContact O-CB 3.42Å; D628-L632 PolarHBondContact O-N 3.41Å; L632-H635 WeakPolarHBondContact O-CA 3.37Å; L632-H635 WeakPolarHBondContact O-CB 3.32Å; L632-H635 PolarHBondContact O-N 2.91Å; L632-V636 PolarHBondContact O-N 2.92Å; L632-P667 HydrophobicContact CD2-CB 4.19Å; L632-P667 WeakPolarHBondContact CD2-O 3.5Å; L632-L671 HydrophobicContact CD1-CB 4.42Å; L632-L671 HydrophobicContact CD1-CD1 4.24Å; L632-L671 HydrophobicContact CD2-CB 4.06Å
633	G	86.1	Confident	88.9	Confident	23 Å²	23	71.3 Å²	71.3	24%	0.237	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-45.7	-51.1	173.8	0	0	0	0	0	114.7	D628 P629 H635 V636	D628-G633 PolarHBondContact O-N 2.96Å; P629-G633 WeakPolarHBondContact O-CA 3.38Å; G633-H635 PolarHBondContact O-N 3.34Å; G633-V636 WeakPolarHBondContact O-CG2 3.46Å; G633-V636 PolarHBondContact O-N 3.49Å
634	P	89.6	Confident	89	Confident	98 Å²	98	70.1 Å²	70.1	64%	0.636	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-65.7	1.5	176.6	-22.8	35	0	0	0	115.9
635	H	88.9	Confident	89.1	Confident	52 Å²	52	72.4 Å²	72.4	24%	0.241	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-122.8	0.7	-178.4	-63.2	-30.7	0	0	0	113	L632 G633 D637 L638 F639	L632-H635 WeakPolarHBondContact O-CA 3.37Å; L632-H635 WeakPolarHBondContact O-CB 3.32Å; L632-H635 PolarHBondContact O-N 2.91Å; G633-H635 PolarHBondContact O-N 3.34Å; H635-D637 VanDerWaalsContact C-N 3.32Å; H635-D637 PolarHBondContact O-N 3.26Å; H635-L638 HydrophobicContact CB-CD1 4.14Å; H635-L638 VanDerWaalsContact O-CB 3.3Å; H635-L638 WeakPolarHBondContact O-CB 3.34Å; H635-L638 PolarHBondContact O-N 2.93Å; H635-F639 WeakPolarHBondContact O-CD2 3.37Å
636	V	90.1	Very high	89.2	Confident	8 Å²	8	67.3 Å²	67.3	5%	0.048	35%	0.345	C	S	.	.	H	α-helix	trans	-56.1	-41	-178.5	168.8	0	0	0	0	112.7	I621 V624 Q625 L632 G633 L638 F639 R640	I621-V636 HydrophobicContact CB-CG1 4.12Å; I621-V636 HydrophobicContact CG1-CG1 4.18Å; I621-V636 HydrophobicContact CG2-CG1 3.41Å; I621-V636 VanDerWaalsContact CG2-CG1 3.41Å; V624-V636 HydrophobicContact CG1-CG2 4.08Å; Q625-V636 HydrophobicContact CB-CG2 3.93Å; Q625-V636 HydrophobicContact CG-CG2 4.43Å; L632-V636 PolarHBondContact O-N 2.92Å; G633-V636 WeakPolarHBondContact O-CG2 3.46Å; G633-V636 PolarHBondContact O-N 3.49Å; V636-L638 PolarHBondContact O-N 2.66Å; V636-L638 VanDerWaalsContact O-N 3.14Å; V636-F639 WeakPolarHBondContact O-CB 3.49Å; V636-F639 PolarHBondContact O-N 3.22Å; V636-R640 PolarHBondContact O-N 3.14Å
637	D	87.6	Confident	89.1	Confident	106 Å²	106	66.9 Å²	66.9	57%	0.567	34%	0.341	S	S	*	.	H	α-helix	trans	-67.4	-13.9	179.5	-68.9	-52.4	0	0	0	114.1	H635 R640 K641	H635-D637 VanDerWaalsContact C-N 3.32Å; H635-D637 PolarHBondContact O-N 3.26Å; D637-R640 IonicContact OD1-NH1 3.29Å; D637-R640 PolarHBondContact OD1-NH1 3.15Å; D637-K641 WeakPolarHBondContact O-CB 3.29Å; D637-K641 PolarHBondContact O-N 3.22Å
638	L	90.1	Very high	89.2	Confident	46 Å²	46	67 Å²	67	24%	0.241	34%	0.342	C	S	.	.	H	α-helix	trans	-70.9	-35.7	169.4	-60.4	169.4	0	0	0	110.9	H635 V636 K641 H642 M661 L663	H635-L638 HydrophobicContact CB-CD1 4.14Å; H635-L638 VanDerWaalsContact O-CB 3.3Å; H635-L638 WeakPolarHBondContact O-CB 3.34Å; H635-L638 PolarHBondContact O-N 2.93Å; V636-L638 PolarHBondContact O-N 2.66Å; V636-L638 VanDerWaalsContact O-N 3.14Å; L638-K641 PolarHBondContact O-N 3.38Å; L638-H642 WeakPolarHBondContact O-CB 3.49Å; L638-H642 PolarHBondContact O-CD2 2.98Å; L638-H642 PolarHBondContact O-N 3.21Å; L638-M661 HydrophobicContact CB-CE 4.3Å; L638-L663 HydrophobicContact CD1-CD1 3.63Å; L638-L663 HydrophobicContact CD1-CG 4.47Å
639	F	91.6	Very high	89.5	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-68.9	-38.3	175.4	-62.1	-99.7	0	0	0	111.3	V620 I621 V624 H635 V636 E643 I644 L649 L652 M661 L671	V620-F639 HydrophobicContact CG1-CD1 4.2Å; I621-F639 HydrophobicContact CG1-CB 4.24Å; V624-F639 HydrophobicContact CG1-CD2 4.11Å; V624-F639 HydrophobicContact CG1-CE2 3.7Å; V624-F639 HydrophobicContact CG1-CZ 3.99Å; V624-F639 HydrophobicContact CG2-CD1 4.1Å; V624-F639 HydrophobicContact CG2-CE1 3.86Å; V624-F639 HydrophobicContact CG2-CE2 4.33Å; V624-F639 HydrophobicContact CG2-CG 4.43Å; V624-F639 HydrophobicContact CG2-CZ 3.98Å; H635-F639 WeakPolarHBondContact O-CD2 3.37Å; V636-F639 WeakPolarHBondContact O-CB 3.49Å; V636-F639 PolarHBondContact O-N 3.22Å; F639-E643 PolarHBondContact O-N 3.34Å; F639-E643 VanDerWaalsContact O-N 3.12Å; F639-I644 HydrophobicContact CB-CB 4.33Å; F639-I644 HydrophobicContact CB-CG1 4.42Å; F639-I644 HydrophobicContact CD1-CB 4.12Å; F639-I644 HydrophobicContact CD1-CG1 4.18Å; F639-I644 HydrophobicContact CD1-CG2 4.13Å; F639-I644 PolarHBondContact O-N 2.93Å; F639-L649 HydrophobicContact CE1-CD1 4.47Å; F639-L652 HydrophobicContact CE1-CD1 4.3Å; F639-M661 HydrophobicContact CD1-CE 3.88Å; F639-M661 HydrophobicContact CD2-CE 4.19Å; F639-M661 HydrophobicContact CE1-CE 3.89Å; F639-M661 HydrophobicContact CE2-CE 4.19Å; F639-M661 HydrophobicContact CG-CE 4.03Å; F639-M661 HydrophobicContact CZ-CE 4.05Å; F639-L671 HydrophobicContact CE1-CD1 3.91Å; F639-L671 HydrophobicContact CE1-CD2 3.86Å; F639-L671 HydrophobicContact CZ-CD1 3.62Å; F639-L671 HydrophobicContact CZ-CD2 3.52Å; F639-L671 HydrophobicContact CZ-CG 4.21Å
640	R	91.7	Very high	89.5	Confident	115 Å²	115	63.7 Å²	63.7	43%	0.434	32%	0.319	S	S	.	.	H	α-helix	trans	-61.5	-50.3	170.6	-172	169.5	-80.2	129	-4.4	111.6	D618 I621 V636 D637 H642 E643	D618-R640 IonicContact OD1-NH2 3.18Å; D618-R640 PolarHBondContact OD1-NH2 2.89Å; I621-R640 HydrophobicContact CD1-CB 3.68Å; I621-R640 HydrophobicContact CD1-CG 4.18Å; V636-R640 PolarHBondContact O-N 3.14Å; D637-R640 IonicContact OD1-NH1 3.29Å; D637-R640 PolarHBondContact OD1-NH1 3.15Å; R640-H642 VanDerWaalsContact C-N 3.31Å; R640-H642 PolarHBondContact O-N 3.41Å; R640-E643 PolarHBondContact O-N 3.41Å
641	K	90.1	Very high	89.7	Confident	164 Å²	164	61.8 Å²	61.8	71%	0.713	31%	0.314	S	S	*	.	H	α-helix	trans	-65.5	-29.5	-178.8	-178.4	177.3	177.7	-177.9	0	114	D637 L638	D637-K641 WeakPolarHBondContact O-CB 3.29Å; D637-K641 PolarHBondContact O-N 3.22Å; L638-K641 PolarHBondContact O-N 3.38Å
642	H	90.8	Very high	89.8	Confident	78 Å²	78	60.5 Å²	60.5	36%	0.361	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	10.4	177.6	-68.5	-71	0	0	0	113.3	L638 R640 I644 Y660	L638-H642 WeakPolarHBondContact O-CB 3.49Å; L638-H642 PolarHBondContact O-CD2 2.98Å; L638-H642 PolarHBondContact O-N 3.21Å; R640-H642 VanDerWaalsContact C-N 3.31Å; R640-H642 PolarHBondContact O-N 3.41Å; H642-I644 HydrophobicContact CB-CD1 3.85Å; H642-I644 HydrophobicContact CB-CG1 3.92Å; H642-I644 WeakPolarHBondContact O-CD1 3.19Å; H642-I644 PolarHBondContact O-N 3.11Å; H642-Y660 PolarHBondContact CE1-O 3.22Å
643	E	92	Very high	89.7	Confident	160 Å²	160	67.4 Å²	67.4	75%	0.748	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	42	176.6	-58.2	-174	122	0	0	113.6	F639 R640 D645	F639-E643 PolarHBondContact O-N 3.34Å; F639-E643 VanDerWaalsContact O-N 3.12Å; R640-E643 PolarHBondContact O-N 3.41Å; E643-D645 PolarHBondContact O-N 2.96Å
644	I	93.6	Very high	89.5	Confident	15 Å²	15	67.7 Å²	67.7	8%	0.077	33%	0.33	C	S	.	.			trans	-73.7	97.3	-174	-54.9	-62.1	0	0	0	110.2	V620 F639 H642 A648 L649 L652 M661	V620-I644 WeakPolarHBondContact CB-O 3.34Å; V620-I644 HydrophobicContact CG1-CG2 4.2Å; F639-I644 HydrophobicContact CB-CB 4.33Å; F639-I644 HydrophobicContact CB-CG1 4.42Å; F639-I644 HydrophobicContact CD1-CB 4.12Å; F639-I644 HydrophobicContact CD1-CG1 4.18Å; F639-I644 HydrophobicContact CD1-CG2 4.13Å; F639-I644 PolarHBondContact O-N 2.93Å; H642-I644 HydrophobicContact CB-CD1 3.85Å; H642-I644 HydrophobicContact CB-CG1 3.92Å; H642-I644 WeakPolarHBondContact O-CD1 3.19Å; H642-I644 PolarHBondContact O-N 3.11Å; I644-A648 HydrophobicContact CD1-CB 4.44Å; I644-A648 HydrophobicContact CG2-CB 4.01Å; I644-L649 HydrophobicContact CG2-CB 4.18Å; I644-L652 HydrophobicContact CD1-CD1 4.42Å; I644-L652 HydrophobicContact CG2-CD1 3.88Å; I644-M661 HydrophobicContact CD1-SD 4.47Å; I644-M661 HydrophobicContact CG1-CE 4.1Å
645	D	92.6	Very high	88.8	Confident	48 Å²	48	66.5 Å²	66.5	26%	0.257	32%	0.318	S	S	.	.			trans	-75.8	174.1	169.8	91.6	-25.7	0	0	0	112.2	V617 E643 K647 A648 L649	V617-D645 HydrophobicContact CG2-CB 4.34Å; E643-D645 PolarHBondContact O-N 2.96Å; D645-K647 PolarHBondContact O-N 3.14Å; D645-K647 WeakPolarHBondContact OD1-CA 3.36Å; D645-K647 WeakPolarHBondContact OD1-CB 3.42Å; D645-K647 PolarHBondContact OD1-N 3.3Å; D645-A648 PolarHBondContact O-N 3.03Å; D645-A648 WeakPolarHBondContact OD1-CB 3.47Å; D645-A648 PolarHBondContact OD1-N 3.34Å; D645-L649 WeakPolarHBondContact O-CB 3.44Å; D645-L649 PolarHBondContact O-N 3.18Å
646	G	91.5	Very high	88.7	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.4	-22.3	179.3	0	0	0	0	0	115.1	A612 W615 M650	A612-G646 CarbonylContact O-C 3.39Å; A612-G646 WeakPolarHBondContact O-CA 3.42Å; W615-G646 PolarHBondContact O-N 3.24Å; G646-M650 VanDerWaalsContact O-CG 3.29Å; G646-M650 WeakPolarHBondContact O-CG 3.48Å; G646-M650 PolarHBondContact O-N 2.88Å
647	K	87.6	Confident	88.6	Confident	127 Å²	127	65.7 Å²	65.7	55%	0.552	32%	0.317	S	S	*	.	H	α-helix	trans	-81.5	-45.2	176.4	-59.3	167	-170.7	151.4	0	110.2	S613 D645 L649 M650 L651	S613-K647 VanDerWaalsContact O-CE 3.31Å; S613-K647 WeakPolarHBondContact O-CE 3.07Å; S613-K647 VanDerWaalsContact O-CG 3.22Å; S613-K647 WeakPolarHBondContact O-CG 3.31Å; D645-K647 PolarHBondContact O-N 3.14Å; D645-K647 WeakPolarHBondContact OD1-CA 3.36Å; D645-K647 WeakPolarHBondContact OD1-CB 3.42Å; D645-K647 PolarHBondContact OD1-N 3.3Å; K647-L649 VanDerWaalsContact C-N 3.33Å; K647-L649 PolarHBondContact O-N 3.05Å; K647-M650 PolarHBondContact O-N 3.49Å; K647-L651 WeakPolarHBondContact O-CG 3.48Å; K647-L651 PolarHBondContact O-N 3.45Å
648	A	89.8	Confident	88.6	Confident	32 Å²	32	64.1 Å²	64.1	26%	0.264	31%	0.307	S	S	.	.	H	α-helix	trans	-58.4	-45.1	172.6	0	0	0	0	0	110.9	I644 D645 M650 L651 L652	I644-A648 HydrophobicContact CD1-CB 4.44Å; I644-A648 HydrophobicContact CG2-CB 4.01Å; D645-A648 PolarHBondContact O-N 3.03Å; D645-A648 WeakPolarHBondContact OD1-CB 3.47Å; D645-A648 PolarHBondContact OD1-N 3.34Å; A648-M650 VanDerWaalsContact C-N 3.28Å; A648-M650 PolarHBondContact O-N 3.36Å; A648-L651 CarbonylContact O-C 3.47Å; A648-L651 WeakPolarHBondContact O-CA 3.43Å; A648-L651 PolarHBondContact O-N 3.02Å; A648-L652 WeakPolarHBondContact O-CG 3.41Å; A648-L652 PolarHBondContact O-N 3.47Å
649	L	91.5	Very high	88.2	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-55.2	-41.2	176	-174.9	69.9	0	0	0	112.4	W615 V620 F623 F639 I644 D645 K647 L651 L652 I675 L678	W615-L649 HydrophobicContact CE3-CD2 4.23Å; W615-L649 HydrophobicContact CZ3-CD2 4.18Å; V620-L649 HydrophobicContact CG1-CB 4.44Å; V620-L649 HydrophobicContact CG1-CD1 4.1Å; V620-L649 HydrophobicContact CG1-CD2 4.1Å; V620-L649 HydrophobicContact CG1-CG 4.44Å; V620-L649 HydrophobicContact CG2-CB 4.31Å; V620-L649 HydrophobicContact CG2-CD2 4.06Å; F623-L649 HydrophobicContact CD1-CD2 4Å; F623-L649 HydrophobicContact CE1-CD2 4.14Å; F639-L649 HydrophobicContact CE1-CD1 4.47Å; I644-L649 HydrophobicContact CG2-CB 4.18Å; D645-L649 WeakPolarHBondContact O-CB 3.44Å; D645-L649 PolarHBondContact O-N 3.18Å; K647-L649 VanDerWaalsContact C-N 3.33Å; K647-L649 PolarHBondContact O-N 3.05Å; L649-L651 PolarHBondContact O-N 3.12Å; L649-L652 HydrophobicContact CD1-CD1 4.42Å; L649-L652 PolarHBondContact O-N 3.2Å; L649-I675 HydrophobicContact CD1-CD1 3.82Å; L649-I675 HydrophobicContact CD1-CG1 3.89Å; L649-I675 HydrophobicContact CG-CD1 4.38Å; L649-I675 HydrophobicContact CG-CG1 4.13Å; L649-L678 HydrophobicContact CD2-CD2 4.43Å
650	M	89.2	Confident	87.7	Confident	45 Å²	45	76 Å²	76	22%	0.222	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-7.2	177.6	-65.4	-63.4	95.1	0	0	114.3	A612 G646 K647 A648 I675 L678 R679	A612-M650 HydrophobicContact CB-CE 4.42Å; A612-M650 HydrophobicContact CB-CG 4.33Å; A612-M650 HydrophobicContact CB-SD 4.1Å; G646-M650 VanDerWaalsContact O-CG 3.29Å; G646-M650 WeakPolarHBondContact O-CG 3.48Å; G646-M650 PolarHBondContact O-N 2.88Å; K647-M650 PolarHBondContact O-N 3.49Å; A648-M650 VanDerWaalsContact C-N 3.28Å; A648-M650 PolarHBondContact O-N 3.36Å; M650-I675 HydrophobicContact CE-CB 4.48Å; M650-I675 HydrophobicContact CE-CG1 4.45Å; M650-I675 HydrophobicContact CE-CG2 3.88Å; M650-L678 HydrophobicContact CE-CD2 3.74Å; M650-R679 HydrophobicContact SD-CG 3.83Å
651	L	87.3	Confident	87.5	Confident	136 Å²	136	71 Å²	71	71%	0.712	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-7.3	175.4	-63.3	173.9	0	0	0	113	K647 A648 L649 R653	K647-L651 WeakPolarHBondContact O-CG 3.48Å; K647-L651 PolarHBondContact O-N 3.45Å; A648-L651 CarbonylContact O-C 3.47Å; A648-L651 WeakPolarHBondContact O-CA 3.43Å; A648-L651 PolarHBondContact O-N 3.02Å; L649-L651 PolarHBondContact O-N 3.12Å; L651-R653 PolarHBondContact O-N 3.31Å; L651-R653 VanDerWaalsContact O-N 3.15Å
652	L	87.6	Confident	87.2	Confident	18 Å²	18	66 Å²	66	9%	0.094	33%	0.33	C	S	.	.			trans	-67.7	109.7	178.4	-82.5	-177.5	0	0	0	111.3	F639 I644 A648 L649 V656 I657 M661 I675	F639-L652 HydrophobicContact CE1-CD1 4.3Å; I644-L652 HydrophobicContact CD1-CD1 4.42Å; I644-L652 HydrophobicContact CG2-CD1 3.88Å; A648-L652 WeakPolarHBondContact O-CG 3.41Å; A648-L652 PolarHBondContact O-N 3.47Å; L649-L652 HydrophobicContact CD1-CD1 4.42Å; L649-L652 PolarHBondContact O-N 3.2Å; L652-V656 HydrophobicContact CD2-CB 4.46Å; L652-V656 HydrophobicContact CD2-CG1 3.88Å; L652-I657 HydrophobicContact CB-CD1 4.03Å; L652-I657 HydrophobicContact CB-CG1 4.01Å; L652-I657 HydrophobicContact CD1-CG1 4.3Å; L652-I657 HydrophobicContact CD2-CG1 4.14Å; L652-I657 HydrophobicContact CG-CG1 4.38Å; L652-M661 HydrophobicContact CD1-SD 3.98Å; L652-M661 HydrophobicContact CD2-SD 4.06Å; L652-I675 HydrophobicContact CB-CD1 4.26Å
653	R	84.4	Confident	87	Confident	144 Å²	144	62.5 Å²	62.5	54%	0.543	31%	0.314	S	S	.	.			trans	-97.9	155.1	171.2	-60.4	-173.5	-57.2	94.7	12.6	110.5	L651 D655 V656 I657	L651-R653 PolarHBondContact O-N 3.31Å; L651-R653 VanDerWaalsContact O-N 3.15Å; R653-D655 VanDerWaalsContact C-N 3.26Å; R653-D655 WeakPolarHBondContact CB-OD1 3.39Å; R653-D655 IonicContact CZ-OD1 3.72Å; R653-D655 IonicContact CZ-OD2 3.15Å; R653-D655 VanDerWaalsContact CZ-OD2 3.25Å; R653-D655 IonicContact NH1-OD1 3.67Å; R653-D655 PolarHBondContact NH1-OD1 2.93Å; R653-D655 IonicContact NH1-OD2 2.85Å; R653-D655 PolarHBondContact NH1-OD2 3.28Å; R653-D655 IonicContact NH2-OD1 2.65Å; R653-D655 PolarHBondContact NH2-OD1 3.29Å; R653-D655 IonicContact NH2-OD2 3.21Å; R653-D655 PolarHBondContact NH2-OD2 3.23Å; R653-D655 PolarHBondContact O-N 2.94Å; R653-V656 HydrophobicContact CB-CG2 4.48Å; R653-V656 WeakPolarHBondContact O-CA 3.45Å; R653-V656 WeakPolarHBondContact O-CB 3.39Å; R653-V656 PolarHBondContact O-N 3.44Å; R653-I657 WeakPolarHBondContact O-CG1 3.46Å; R653-I657 PolarHBondContact O-N 3.37Å
654	S	81.4	Confident	86.7	Confident	30 Å²	30	62.9 Å²	62.9	21%	0.21	31%	0.313	C	S	.	.	H	α-helix	trans	-57.2	-34.5	-173.4	51.1	0	0	0	0	114.2	M658	S654-M658 WeakPolarHBondContact O-CB 3.23Å; S654-M658 VanDerWaalsContact O-CG 3.24Å; S654-M658 WeakPolarHBondContact O-CG 3.41Å; S654-M658 PolarHBondContact O-N 3.21Å
655	D	76.7	Confident	86.2	Confident	72 Å²	72	65.5 Å²	65.5	39%	0.385	33%	0.327	S	S	.	.	H	α-helix	trans	-67	-36.6	173.3	60	-23.9	0	0	0	113.1	R653 K659	R653-D655 VanDerWaalsContact C-N 3.26Å; R653-D655 WeakPolarHBondContact CB-OD1 3.39Å; R653-D655 IonicContact CZ-OD1 3.72Å; R653-D655 IonicContact CZ-OD2 3.15Å; R653-D655 VanDerWaalsContact CZ-OD2 3.25Å; R653-D655 IonicContact NH1-OD1 3.67Å; R653-D655 PolarHBondContact NH1-OD1 2.93Å; R653-D655 IonicContact NH1-OD2 2.85Å; R653-D655 PolarHBondContact NH1-OD2 3.28Å; R653-D655 IonicContact NH2-OD1 2.65Å; R653-D655 PolarHBondContact NH2-OD1 3.29Å; R653-D655 IonicContact NH2-OD2 3.21Å; R653-D655 PolarHBondContact NH2-OD2 3.23Å; R653-D655 PolarHBondContact O-N 2.94Å; D655-K659 WeakPolarHBondContact O-CB 3.36Å; D655-K659 PolarHBondContact O-N 3.15Å
656	V	85.2	Confident	85.7	Confident	44 Å²	44	65.3 Å²	65.3	27%	0.267	34%	0.336	S	S	.	.	H	α-helix	trans	-68.8	-48.5	174.6	-178.2	0	0	0	0	110.3	L652 R653 M658 K659 Y660	L652-V656 HydrophobicContact CD2-CB 4.46Å; L652-V656 HydrophobicContact CD2-CG1 3.88Å; R653-V656 HydrophobicContact CB-CG2 4.48Å; R653-V656 WeakPolarHBondContact O-CA 3.45Å; R653-V656 WeakPolarHBondContact O-CB 3.39Å; R653-V656 PolarHBondContact O-N 3.44Å; V656-M658 PolarHBondContact O-N 2.99Å; V656-K659 PolarHBondContact O-N 2.97Å; V656-Y660 HydrophobicContact CG1-CD2 4.05Å; V656-Y660 PolarHBondContact O-N 3.29Å
657	I	88.7	Confident	85.6	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-56.8	-50	178.7	-67.1	156.8	0	0	0	110.7	L652 R653 M661 G662 L663 A668 L671 C672	L652-I657 HydrophobicContact CB-CD1 4.03Å; L652-I657 HydrophobicContact CB-CG1 4.01Å; L652-I657 HydrophobicContact CD1-CG1 4.3Å; L652-I657 HydrophobicContact CD2-CG1 4.14Å; L652-I657 HydrophobicContact CG-CG1 4.38Å; R653-I657 WeakPolarHBondContact O-CG1 3.46Å; R653-I657 PolarHBondContact O-N 3.37Å; I657-M661 WeakPolarHBondContact O-CB 3.47Å; I657-M661 PolarHBondContact O-N 2.94Å; I657-G662 PolarHBondContact O-N 3.44Å; I657-L663 HydrophobicContact CG2-CB 3.79Å; I657-L663 HydrophobicContact CG2-CD1 4.31Å; I657-L663 HydrophobicContact CG2-CD2 3.9Å; I657-L663 HydrophobicContact CG2-CG 4.22Å; I657-A668 HydrophobicContact CG2-CB 3.68Å; I657-L671 HydrophobicContact CD1-CD2 3.73Å; I657-L671 HydrophobicContact CD1-CG 4.46Å; I657-L671 HydrophobicContact CG1-CD2 3.98Å; I657-L671 HydrophobicContact CG2-CD2 4Å; I657-C672 VanDerWaalsContact CD1-SG 3.56Å
658	M	86.9	Confident	85.6	Confident	73 Å²	73	60.4 Å²	60.4	36%	0.36	32%	0.317	S	S	.	.	H	α-helix	trans	-72.5	-40.2	-178.7	-68.1	175	65.1	0	0	112.8	S654 V656 L665 A668	S654-M658 WeakPolarHBondContact O-CB 3.23Å; S654-M658 VanDerWaalsContact O-CG 3.24Å; S654-M658 WeakPolarHBondContact O-CG 3.41Å; S654-M658 PolarHBondContact O-N 3.21Å; V656-M658 PolarHBondContact O-N 2.99Å; M658-L665 HydrophobicContact CE-CB 3.94Å; M658-L665 HydrophobicContact CE-CD1 3.93Å; M658-L665 HydrophobicContact SD-CB 4.43Å; M658-L665 HydrophobicContact SD-CD1 3.64Å; M658-A668 HydrophobicContact CG-CB 3.6Å; M658-A668 HydrophobicContact SD-CB 4.23Å
659	K	82.9	Confident	85.5	Confident	150 Å²	150	62.4 Å²	62.4	65%	0.652	32%	0.323	S	S	*	.	H	α-helix	trans	-80.2	-37	-173.3	-171.4	-176.9	173.9	-159.6	0	113.8	D655 V656	D655-K659 WeakPolarHBondContact O-CB 3.36Å; D655-K659 PolarHBondContact O-N 3.15Å; V656-K659 PolarHBondContact O-N 2.97Å
660	Y	80.4	Confident	85.3	Confident	144 Å²	144	66.3 Å²	66.3	57%	0.565	34%	0.34	S	S	*	.	H	α-helix	trans	-112.3	-27.6	-170.8	-57.9	-68.8	0	0	0	114.2	H642 V656	H642-Y660 PolarHBondContact CE1-O 3.22Å; V656-Y660 HydrophobicContact CG1-CD2 4.05Å; V656-Y660 PolarHBondContact O-N 3.29Å
661	M	86.8	Confident	85.4	Confident	11 Å²	11	64.2 Å²	64.2	5%	0.054	33%	0.33	C	S	.	.	S	Bend	trans	-94.4	-11.5	171.3	-52	176	66.8	0	0	112.6	L638 F639 I644 L652 I657 L663	L638-M661 HydrophobicContact CB-CE 4.3Å; F639-M661 HydrophobicContact CD1-CE 3.88Å; F639-M661 HydrophobicContact CD2-CE 4.19Å; F639-M661 HydrophobicContact CE1-CE 3.89Å; F639-M661 HydrophobicContact CE2-CE 4.19Å; F639-M661 HydrophobicContact CG-CE 4.03Å; F639-M661 HydrophobicContact CZ-CE 4.05Å; I644-M661 HydrophobicContact CD1-SD 4.47Å; I644-M661 HydrophobicContact CG1-CE 4.1Å; L652-M661 HydrophobicContact CD1-SD 3.98Å; L652-M661 HydrophobicContact CD2-SD 4.06Å; I657-M661 WeakPolarHBondContact O-CB 3.47Å; I657-M661 PolarHBondContact O-N 2.94Å; M661-L663 VanDerWaalsContact C-N 3.3Å; M661-L663 HydrophobicContact CB-CD1 3.64Å; M661-L663 HydrophobicContact CE-CD1 4.45Å; M661-L663 PolarHBondContact O-N 3.44Å
662	G	83.8	Confident	85.5	Confident	58 Å²	58	59.2 Å²	59.2	60%	0.598	31%	0.306	S	S	*	.			trans	73.6	13	175.9	0	0	0	0	0	115.3	I657	I657-G662 PolarHBondContact O-N 3.44Å
663	L	88.2	Confident	85.6	Confident	6 Å²	6	64.1 Å²	64.1	3%	0.031	33%	0.328	C	S	.	.			trans	-65.3	139.1	177.1	-85.7	77.8	0	0	0	110.9	L638 I657 M661 P667 A668 L671	L638-L663 HydrophobicContact CD1-CD1 3.63Å; L638-L663 HydrophobicContact CD1-CG 4.47Å; I657-L663 HydrophobicContact CG2-CB 3.79Å; I657-L663 HydrophobicContact CG2-CD1 4.31Å; I657-L663 HydrophobicContact CG2-CD2 3.9Å; I657-L663 HydrophobicContact CG2-CG 4.22Å; M661-L663 VanDerWaalsContact C-N 3.3Å; M661-L663 HydrophobicContact CB-CD1 3.64Å; M661-L663 HydrophobicContact CE-CD1 4.45Å; M661-L663 PolarHBondContact O-N 3.44Å; L663-P667 HydrophobicContact CD2-CB 4.13Å; L663-A668 HydrophobicContact CB-CB 4.34Å; L663-L671 HydrophobicContact CD2-CD2 4.34Å
664	K	84.6	Confident	85.8	Confident	168 Å²	168	58.8 Å²	58.8	73%	0.73	31%	0.309	S	S	*	.			trans	-68.6	157.1	171.2	-65.9	178.2	-178.8	175.6	0	110.3	G666 P667 A668	K664-G666 VanDerWaalsContact C-N 3.33Å; K664-G666 PolarHBondContact O-N 2.85Å; K664-P667 WeakPolarHBondContact O-CD 3.48Å; K664-A668 WeakPolarHBondContact O-CB 3.42Å; K664-A668 PolarHBondContact O-N 3.47Å
665	L	82.4	Confident	86.2	Confident	69 Å²	69	57.8 Å²	57.8	36%	0.361	30%	0.301	S	S	.	.	H	α-helix	trans	-52.8	-43.5	-173.9	-179.2	62.3	0	0	0	113.7	P142 M658 A668 L669	P142-L665 HydrophobicContact CB-CD2 4.04Å; M658-L665 HydrophobicContact CE-CB 3.94Å; M658-L665 HydrophobicContact CE-CD1 3.93Å; M658-L665 HydrophobicContact SD-CB 4.43Å; M658-L665 HydrophobicContact SD-CD1 3.64Å; L665-A668 PolarHBondContact O-N 2.94Å; L665-L669 HydrophobicContact CD1-CD1 3.87Å; L665-L669 HydrophobicContact CD1-CD2 4.42Å; L665-L669 HydrophobicContact CD1-CG 3.91Å; L665-L669 HydrophobicContact CG-CD1 3.89Å; L665-L669 HydrophobicContact CG-CG 4.33Å; L665-L669 WeakPolarHBondContact O-CB 3.37Å; L665-L669 VanDerWaalsContact O-CG 3.3Å; L665-L669 WeakPolarHBondContact O-CG 3.4Å; L665-L669 PolarHBondContact O-N 3.41Å
666	G	82.9	Confident	86.6	Confident	44 Å²	44	57.9 Å²	57.9	45%	0.454	30%	0.3	S	S	.	.	H	α-helix	trans	-58.8	-61.1	179	0	0	0	0	0	113.3	K664 A668 L669 K670	K664-G666 VanDerWaalsContact C-N 3.33Å; K664-G666 PolarHBondContact O-N 2.85Å; G666-A668 VanDerWaalsContact C-N 3.29Å; G666-A668 PolarHBondContact O-N 3.32Å; G666-L669 PolarHBondContact O-N 2.88Å; G666-K670 PolarHBondContact O-N 3.01Å
667	P	88.8	Confident	86.6	Confident	24 Å²	24	62 Å²	62	16%	0.156	31%	0.314	C	S	.	.	H	α-helix	trans	-54.1	-40	172.2	-30.1	36.3	0	0	0	114.1	L632 L663 K664 L669 K670 L671	L632-P667 HydrophobicContact CD2-CB 4.19Å; L632-P667 WeakPolarHBondContact CD2-O 3.5Å; L663-P667 HydrophobicContact CD2-CB 4.13Å; K664-P667 WeakPolarHBondContact O-CD 3.48Å; P667-L669 PolarHBondContact O-N 3.3Å; P667-K670 PolarHBondContact O-N 3.49Å; P667-L671 WeakPolarHBondContact O-CB 3.11Å; P667-L671 PolarHBondContact O-N 2.99Å
668	A	89.3	Confident	86.4	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.4	-41.9	178.1	0	0	0	0	0	112.8	I657 M658 L663 K664 L665 G666 L671 C672	I657-A668 HydrophobicContact CG2-CB 3.68Å; M658-A668 HydrophobicContact CG-CB 3.6Å; M658-A668 HydrophobicContact SD-CB 4.23Å; L663-A668 HydrophobicContact CB-CB 4.34Å; K664-A668 WeakPolarHBondContact O-CB 3.42Å; K664-A668 PolarHBondContact O-N 3.47Å; L665-A668 PolarHBondContact O-N 2.94Å; G666-A668 VanDerWaalsContact C-N 3.29Å; G666-A668 PolarHBondContact O-N 3.32Å; A668-L671 PolarHBondContact O-N 2.89Å; A668-C672 PolarHBondContact O-N 3.49Å; A668-C672 PolarHBondContact O-SG 2.87Å; A668-C672 VanDerWaalsContact O-SG 3.38Å
669	L	87.3	Confident	86.1	Confident	74 Å²	74	66.2 Å²	66.2	39%	0.387	33%	0.328	S	S	.	.	H	α-helix	trans	-67	-42.1	176.4	-72.6	172.5	0	0	0	112	L665 G666 P667 C672 H673	L665-L669 HydrophobicContact CD1-CD1 3.87Å; L665-L669 HydrophobicContact CD1-CD2 4.42Å; L665-L669 HydrophobicContact CD1-CG 3.91Å; L665-L669 HydrophobicContact CG-CD1 3.89Å; L665-L669 HydrophobicContact CG-CG 4.33Å; L665-L669 WeakPolarHBondContact O-CB 3.37Å; L665-L669 VanDerWaalsContact O-CG 3.3Å; L665-L669 WeakPolarHBondContact O-CG 3.4Å; L665-L669 PolarHBondContact O-N 3.41Å; G666-L669 PolarHBondContact O-N 2.88Å; P667-L669 PolarHBondContact O-N 3.3Å; L669-C672 PolarHBondContact O-N 3.49Å; L669-H673 PolarHBondContact O-N 2.85Å
670	K	87.6	Confident	85.6	Confident	82 Å²	82	65.3 Å²	65.3	36%	0.357	33%	0.326	S	S	.	.	H	α-helix	trans	-59.6	-48.8	173.7	-78	-172.5	166.5	-161.8	0	111.7	D628 T631 G666 P667 C672 H673 H674	D628-K670 IonicContact OD1-NZ 2.66Å; D628-K670 IonicContact OD2-NZ 3.78Å; D628-K670 PolarHBondContact OD2-NZ 2.96Å; T631-K670 WeakPolarHBondContact OG1-CD 3.49Å; T631-K670 PolarHBondContact OG1-NZ 3.38Å; G666-K670 PolarHBondContact O-N 3.01Å; P667-K670 PolarHBondContact O-N 3.49Å; K670-C672 VanDerWaalsContact C-N 3.32Å; K670-C672 PolarHBondContact O-N 2.88Å; K670-H673 WeakPolarHBondContact O-CA 3.37Å; K670-H673 WeakPolarHBondContact O-CB 3.44Å; K670-H673 PolarHBondContact O-N 3.27Å; K670-H674 PolarHBondContact O-CD2 2.78Å; K670-H674 PolarHBondContact O-N 2.92Å
671	L	89.9	Confident	84.8	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-55.6	-47.2	176.5	-177.5	68.9	0	0	0	111.5	V624 L632 F639 I657 L663 P667 A668 H673 H674 I675	V624-L671 HydrophobicContact CG2-CD1 4.03Å; L632-L671 HydrophobicContact CD1-CB 4.42Å; L632-L671 HydrophobicContact CD1-CD1 4.24Å; L632-L671 HydrophobicContact CD2-CB 4.06Å; F639-L671 HydrophobicContact CE1-CD1 3.91Å; F639-L671 HydrophobicContact CE1-CD2 3.86Å; F639-L671 HydrophobicContact CZ-CD1 3.62Å; F639-L671 HydrophobicContact CZ-CD2 3.52Å; F639-L671 HydrophobicContact CZ-CG 4.21Å; I657-L671 HydrophobicContact CD1-CD2 3.73Å; I657-L671 HydrophobicContact CD1-CG 4.46Å; I657-L671 HydrophobicContact CG1-CD2 3.98Å; I657-L671 HydrophobicContact CG2-CD2 4Å; L663-L671 HydrophobicContact CD2-CD2 4.34Å; P667-L671 WeakPolarHBondContact O-CB 3.11Å; P667-L671 PolarHBondContact O-N 2.99Å; A668-L671 PolarHBondContact O-N 2.89Å; L671-H673 VanDerWaalsContact C-N 3.32Å; L671-H673 PolarHBondContact O-N 3.27Å; L671-H674 PolarHBondContact O-N 3.27Å; L671-I675 HydrophobicContact CD1-CD1 4.35Å; L671-I675 HydrophobicContact CD2-CD1 4.49Å; L671-I675 HydrophobicContact CG-CD1 3.89Å; L671-I675 WeakPolarHBondContact O-CB 3.42Å; L671-I675 VanDerWaalsContact O-CG1 3.32Å; L671-I675 WeakPolarHBondContact O-CG1 3.22Å; L671-I675 PolarHBondContact O-N 3.19Å
672	C	89.2	Confident	83.3	Confident	31 Å²	31	68 Å²	68	21%	0.209	35%	0.35	C	S	.	.	H	α-helix	trans	-60.9	-37.3	175.1	-71.7	0	0	0	0	112.9	I657 A668 L669 K670 I675 E676	I657-C672 VanDerWaalsContact CD1-SG 3.56Å; A668-C672 PolarHBondContact O-N 3.49Å; A668-C672 PolarHBondContact O-SG 2.87Å; A668-C672 VanDerWaalsContact O-SG 3.38Å; L669-C672 PolarHBondContact O-N 3.49Å; K670-C672 VanDerWaalsContact C-N 3.32Å; K670-C672 PolarHBondContact O-N 2.88Å; C672-I675 PolarHBondContact O-N 3.31Å; C672-E676 WeakPolarHBondContact O-CB 3.29Å; C672-E676 PolarHBondContact O-N 3.31Å
673	H	90.1	Very high	81.1	Confident	121 Å²	121	77.1 Å²	77.1	56%	0.56	38%	0.376	S	S	*	.	H	α-helix	trans	-63.4	-44.2	174.4	173.7	80	0	0	0	112.3	L669 K670 L671 E676 K677	L669-H673 PolarHBondContact O-N 2.85Å; K670-H673 WeakPolarHBondContact O-CA 3.37Å; K670-H673 WeakPolarHBondContact O-CB 3.44Å; K670-H673 PolarHBondContact O-N 3.27Å; L671-H673 VanDerWaalsContact C-N 3.32Å; L671-H673 PolarHBondContact O-N 3.27Å; H673-E676 PolarHBondContact O-N 3.48Å; H673-K677 WeakPolarHBondContact O-CB 3.41Å; H673-K677 PolarHBondContact O-N 3.12Å
674	H	88.3	Confident	80.8	Confident	33 Å²	33	80.7 Å²	80.7	15%	0.153	39%	0.393	C	S	.	.	H	α-helix	trans	-68	-38.5	177.2	-65.9	-73.4	0	0	0	112.4	F623 A627 K670 L671 K677 L678	F623-H674 HydrophobicContact CE1-CB 4.43Å; F623-H674 HydrophobicContact CZ-CB 4.03Å; A627-H674 HydrophobicContact CB-CB 4.25Å; A627-H674 PolarHBondContact O-CE1 3.39Å; K670-H674 PolarHBondContact O-CD2 2.78Å; K670-H674 PolarHBondContact O-N 2.92Å; L671-H674 PolarHBondContact O-N 3.27Å; H674-K677 PolarHBondContact O-N 3.45Å; H674-L678 WeakPolarHBondContact O-CB 3.32Å; H674-L678 PolarHBondContact O-N 3.17Å
675	I	89.6	Confident	80.6	Confident	9 Å²	9	76.1 Å²	76.1	5%	0.046	38%	0.376	C	S	.	.	H	α-helix	trans	-59	-45.9	170.9	-72.3	166.5	0	0	0	110.6	L649 M650 L652 L671 C672 L678 R679	L649-I675 HydrophobicContact CD1-CD1 3.82Å; L649-I675 HydrophobicContact CD1-CG1 3.89Å; L649-I675 HydrophobicContact CG-CD1 4.38Å; L649-I675 HydrophobicContact CG-CG1 4.13Å; M650-I675 HydrophobicContact CE-CB 4.48Å; M650-I675 HydrophobicContact CE-CG1 4.45Å; M650-I675 HydrophobicContact CE-CG2 3.88Å; L652-I675 HydrophobicContact CB-CD1 4.26Å; L671-I675 HydrophobicContact CD1-CD1 4.35Å; L671-I675 HydrophobicContact CD2-CD1 4.49Å; L671-I675 HydrophobicContact CG-CD1 3.89Å; L671-I675 WeakPolarHBondContact O-CB 3.42Å; L671-I675 VanDerWaalsContact O-CG1 3.32Å; L671-I675 WeakPolarHBondContact O-CG1 3.22Å; L671-I675 PolarHBondContact O-N 3.19Å; C672-I675 PolarHBondContact O-N 3.31Å; I675-L678 WeakPolarHBondContact O-CB 3.32Å; I675-L678 PolarHBondContact O-N 2.93Å; I675-R679 WeakPolarHBondContact O-CG 3.31Å; I675-R679 PolarHBondContact O-N 2.67Å
676	E	86.6	Confident	80.5	Confident	74 Å²	74	76.5 Å²	76.5	35%	0.346	38%	0.376	S	S	.	.	H	α-helix	trans	-66.8	-41.2	-179.2	-167.4	58.9	-153.3	0	0	112.3	C672 H673 L678 R679 Q680	C672-E676 WeakPolarHBondContact O-CB 3.29Å; C672-E676 PolarHBondContact O-N 3.31Å; H673-E676 PolarHBondContact O-N 3.48Å; E676-L678 VanDerWaalsContact C-N 3.27Å; E676-L678 PolarHBondContact O-N 2.98Å; E676-R679 VanDerWaalsContact CD-NH1 3.32Å; E676-R679 WeakPolarHBondContact O-CB 3.4Å; E676-R679 PolarHBondContact O-N 3.26Å; E676-R679 VanDerWaalsContact O-N 3.15Å; E676-R679 IonicContact OE1-NH1 3.97Å; E676-R679 PolarHBondContact OE1-NH1 2.89Å; E676-R679 IonicContact OE2-CZ 3.99Å; E676-R679 IonicContact OE2-NE 2.98Å; E676-R679 IonicContact OE2-NH1 3.21Å; E676-R679 PolarHBondContact OE2-NH1 2.84Å; E676-Q680 WeakPolarHBondContact O-CG 3.09Å; E676-Q680 PolarHBondContact O-N 3.2Å
677	K	84.6	Confident	80.3	Confident	129 Å²	129	78.4 Å²	78.4	56%	0.561	37%	0.372	S	S	*	.	H	α-helix	trans	-58.9	-39.5	172.5	-172.8	178.1	-179.9	-177.9	0	111.7	H673 H674 Q680 T681	H673-K677 WeakPolarHBondContact O-CB 3.41Å; H673-K677 PolarHBondContact O-N 3.12Å; H674-K677 PolarHBondContact O-N 3.45Å; K677-Q680 PolarHBondContact O-N 2.77Å; K677-T681 PolarHBondContact O-N 2.71Å; K677-T681 PolarHBondContact O-OG1 2.86Å
678	L	84.4	Confident	79.8	Confident	32 Å²	32	81.8 Å²	81.8	17%	0.168	39%	0.385	C	S	.	.	H	α-helix	trans	-67.1	-37.8	176.4	-165.5	68.5	0	0	0	112	A612 W615 F623 L649 M650 H674 I675 E676 Q680 T681	A612-L678 HydrophobicContact CB-CD2 3.52Å; A612-L678 HydrophobicContact CB-CG 3.96Å; W615-L678 HydrophobicContact CE3-CD2 4.35Å; W615-L678 HydrophobicContact CH2-CD1 3.62Å; W615-L678 HydrophobicContact CH2-CD2 3.45Å; W615-L678 VanDerWaalsContact CH2-CD2 3.45Å; W615-L678 HydrophobicContact CH2-CG 4.18Å; W615-L678 HydrophobicContact CZ2-CD1 4.15Å; W615-L678 HydrophobicContact CZ2-CD2 4.33Å; W615-L678 HydrophobicContact CZ3-CD1 4.46Å; W615-L678 HydrophobicContact CZ3-CD2 3.45Å; W615-L678 VanDerWaalsContact CZ3-CD2 3.45Å; F623-L678 HydrophobicContact CE1-CD2 4.26Å; F623-L678 HydrophobicContact CE2-CD1 4.13Å; F623-L678 HydrophobicContact CE2-CD2 4.24Å; F623-L678 HydrophobicContact CZ-CB 4.27Å; F623-L678 HydrophobicContact CZ-CD2 3.98Å; L649-L678 HydrophobicContact CD2-CD2 4.43Å; M650-L678 HydrophobicContact CE-CD2 3.74Å; H674-L678 WeakPolarHBondContact O-CB 3.32Å; H674-L678 PolarHBondContact O-N 3.17Å; I675-L678 WeakPolarHBondContact O-CB 3.32Å; I675-L678 PolarHBondContact O-N 2.93Å; E676-L678 VanDerWaalsContact C-N 3.27Å; E676-L678 PolarHBondContact O-N 2.98Å; L678-Q680 VanDerWaalsContact C-N 3.33Å; L678-Q680 PolarHBondContact O-N 2.84Å; L678-T681 PolarHBondContact O-N 2.97Å
679	R	81.4	Confident	79.2	Confident	131 Å²	131	87.3 Å²	87.3	49%	0.494	41%	0.411	S	S	.	.	H	α-helix	trans	-64.2	-35.4	172.9	-67.4	173.3	72.1	-137.4	-2.9	112.6	M650 I675 E676 T681	M650-R679 HydrophobicContact SD-CG 3.83Å; I675-R679 WeakPolarHBondContact O-CG 3.31Å; I675-R679 PolarHBondContact O-N 2.67Å; E676-R679 VanDerWaalsContact CD-NH1 3.32Å; E676-R679 WeakPolarHBondContact O-CB 3.4Å; E676-R679 PolarHBondContact O-N 3.26Å; E676-R679 VanDerWaalsContact O-N 3.15Å; E676-R679 IonicContact OE1-NH1 3.97Å; E676-R679 PolarHBondContact OE1-NH1 2.89Å; E676-R679 IonicContact OE2-CZ 3.99Å; E676-R679 IonicContact OE2-NE 2.98Å; E676-R679 IonicContact OE2-NH1 3.21Å; E676-R679 PolarHBondContact OE2-NH1 2.84Å; R679-T681 VanDerWaalsContact C-N 3.29Å; R679-T681 PolarHBondContact O-N 3.33Å
680	Q	72.1	Confident	78.6	Confident	130 Å²	130	88.2 Å²	88.2	61%	0.607	41%	0.413	S	S	*	.	H	α-helix	trans	-74.5	-16.6	178.4	-70	172.2	13.5	0	0	113.4	E676 K677 L678 K682	E676-Q680 WeakPolarHBondContact O-CG 3.09Å; E676-Q680 PolarHBondContact O-N 3.2Å; K677-Q680 PolarHBondContact O-N 2.77Å; L678-Q680 VanDerWaalsContact C-N 3.33Å; L678-Q680 PolarHBondContact O-N 2.84Å; Q680-K682 PolarHBondContact O-N 3.43Å; Q680-K682 VanDerWaalsContact O-N 3.12Å
681	T	63	Low	77.9	Confident	107 Å²	107	88.7 Å²	88.7	66%	0.656	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	29.4	177.6	-41.8	0	0	0	0	112.1	K677 L678 R679	K677-T681 PolarHBondContact O-N 2.71Å; K677-T681 PolarHBondContact O-OG1 2.86Å; L678-T681 PolarHBondContact O-N 2.97Å; R679-T681 VanDerWaalsContact C-N 3.29Å; R679-T681 PolarHBondContact O-N 3.33Å
682	K	54.7	Low	76.9	Confident	106 Å²	106	96 Å²	96	46%	0.461	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	13.8	180	-78.5	-156.2	176.6	-159.5	0	114	N611 Q680	N611-K682 WeakPolarHBondContact OD1-CE 3.46Å; N611-K682 PolarHBondContact OD1-NZ 3.33Å; Q680-K682 PolarHBondContact O-N 3.43Å; Q680-K682 VanDerWaalsContact O-N 3.12Å
683	H	39	Very low	75.8	Confident	249 Å²	249	101.9 Å²	101.9	100%	1.153	47%	0.473	S	S	*	.			trans	-130.7	0	178.3	-83.1	-61	0	0	0	111.1

Retrieved 683 of 683 residues in 1155.6 ms (Link to these results)

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