D4A274_RAT Loading...

Transcription factor COE3

Transcriptional activator. Recognizes variations of the palindromic sequence 5'-ATTCCCNNGGGAATT-3'.

AlphaFold DB , UniProt , Accession D4A274, Species RAT (Rattus norvegicus, Rat), Gene Ebf3, Length 596 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	42.7	Very low	40.5	Very low	227 Å²	227	161.7 Å²	161.7	100%	1.118	86%	0.857	S	S	*	*				0	118	0	-143.2	162.8	-179.8	0	0	106.1
2	F	43.1	Very low	40	Very low	201 Å²	201	154.3 Å²	154.3	88%	0.882	85%	0.848	S	S	*	*			trans	55.1	104	-176	-55.8	-72.6	0	0	0	117.5
3	G	34.2	Very low	39.9	Very low	76 Å²	76	152 Å²	152	78%	0.784	84%	0.841	S	S	*	*			trans	-127.8	159.8	147.8	0	0	0	0	0	108.2
4	I	51.2	Low	39.6	Very low	176 Å²	176	150.1 Å²	150.1	90%	0.903	84%	0.836	S	S	*	*			trans	-133.9	142.7	161.8	-77.3	166.5	0	0	0	106.6
5	Q	34.2	Very low	39.4	Very low	172 Å²	172	151.8 Å²	151.8	80%	0.804	84%	0.838	S	S	*	*			trans	-138.3	126.1	-172.1	171.1	-170.8	23.4	0	0	106.5
6	E	48.1	Very low	39.6	Very low	195 Å²	195	155 Å²	155	91%	0.911	84%	0.841	S	S	*	*			trans	-136.2	157.6	162.8	-74.2	-157.7	146.2	0	0	110.7
7	N	35.5	Very low	39.5	Very low	132 Å²	132	156.1 Å²	156.1	71%	0.706	84%	0.839	S	S	*	*			trans	-152.3	175.3	-151	-174.1	17.5	0	0	0	109.9
8	I	40.5	Very low	39.4	Very low	149 Å²	149	156.6 Å²	156.6	76%	0.764	84%	0.835	S	S	*	*			trans	99.1	117.8	161.2	-52.6	157	0	0	0	117.5
9	P	38.8	Very low	39.4	Very low	111 Å²	111	152.9 Å²	152.9	72%	0.721	82%	0.821	S	S	*	*			trans	-119.1	163.4	164.1	39.8	-29.9	0	0	0	114
10	R	37.7	Very low	39.2	Very low	256 Å²	256	153.9 Å²	153.9	97%	0.966	83%	0.825	S	S	*	*			trans	-179.9	144.8	155.1	-110.8	168.5	-178.4	172.7	0.9	116.9
11	G	39.6	Very low	39.1	Very low	84 Å²	84	150.4 Å²	150.4	87%	0.866	83%	0.825	S	S	*	*			trans	76.6	152.9	161.4	0	0	0	0	0	116.9
12	G	34.3	Very low	38.7	Very low	73 Å²	73	146 Å²	146	75%	0.753	82%	0.817	S	S	*	*			cis	116.8	137.4	-0.5	0	0	0	0	0	113.4
13	T	38.5	Very low	38.5	Very low	124 Å²	124	139.8 Å²	139.8	76%	0.761	81%	0.81	S	S	*	*			cis	-163.6	169	-4.4	48.5	0	0	0	0	110.5
14	T	36.5	Very low	38.7	Very low	126 Å²	126	145 Å²	145	77%	0.773	82%	0.816	S	S	*	*			trans	62.1	148.8	156.3	49.1	0	0	0	0	119.6
15	M	36.6	Very low	38	Very low	175 Å²	175	144 Å²	144	86%	0.862	81%	0.812	S	S	*	*			cis	-163.5	160.5	-8.9	-98.5	-135.2	-74	0	0	109
16	K	42.2	Very low	38.2	Very low	203 Å²	203	140.7 Å²	140.7	88%	0.883	81%	0.806	S	S	*	*			trans	142.1	131.1	130.5	-158.1	173.9	-175.3	-177.7	0	115.8
17	E	37.4	Very low	37.7	Very low	173 Å²	173	137.9 Å²	137.9	81%	0.808	80%	0.802	S	S	*	*			trans	-72.8	-180	171.7	-62.7	154.4	101.6	0	0	112.4
18	E	37.2	Very low	37.6	Very low	166 Å²	166	143.3 Å²	143.3	78%	0.776	81%	0.812	S	S	*	*			cis	-156.3	-161.9	22.2	-139.3	-147.3	126	0	0	109.9
19	P	39.7	Very low	37.3	Very low	87 Å²	87	140.5 Å²	140.5	57%	0.565	81%	0.806	S	S	*	*				-135.7	-158	-127	43.8	-20.4	0	0	0	116.4
20	L	36.2	Very low	37.1	Very low	172 Å²	172	147.9 Å²	147.9	90%	0.901	82%	0.819	S	S	*	*			trans	71.3	113.2	159.8	-71.8	163.2	0	0	0	119.2
21	G	37.6	Very low	37	Very low	80 Å²	80	144 Å²	144	83%	0.825	82%	0.815	S	S	*	*			trans	-168.7	102.2	164.4	0	0	0	0	0	111.4
22	S	34.4	Very low	37.1	Very low	135 Å²	135	148.2 Å²	148.2	94%	0.944	81%	0.811	S	S	*	*			trans	-74	133.3	-178.6	71.6	0	0	0	0	112.1
23	G	38.2	Very low	37.4	Very low	71 Å²	71	151.6 Å²	151.6	73%	0.732	82%	0.818	S	S	*	*			trans	-164.7	128.4	171.2	0	0	0	0	0	111.4
24	M	38.4	Very low	38.4	Very low	184 Å²	184	148.1 Å²	148.1	91%	0.906	80%	0.802	S	S	*	*			trans	-70.2	134.9	-172.8	-59.9	89.6	81.9	0	0	113.2
25	N	36	Very low	40.6	Very low	156 Å²	156	144.6 Å²	144.6	83%	0.834	79%	0.79	S	S	*	*			trans	-162.3	128.2	135.3	-115.6	-22.8	0	0	0	111.5
26	P	38.5	Very low	43.2	Very low	103 Å²	103	139.7 Å²	139.7	67%	0.669	77%	0.77	S	S	*	*			trans	-73.4	170.2	164.9	33.8	-33.5	0	0	0	110.2
27	V	37.1	Very low	45.7	Very low	135 Å²	135	132.4 Å²	132.4	82%	0.818	74%	0.742	S	S	*	*			trans	74.7	74	178.9	-163.9	0	0	0	0	115.1
28	R	34.5	Very low	48.3	Very low	246 Å²	246	127.5 Å²	127.5	93%	0.928	72%	0.722	S	S	*	*			trans	170.1	96.3	135.6	-94.7	166.9	-172.6	-140.6	3.3	112
29	S	33.1	Very low	51	Low	91 Å²	91	120.5 Å²	120.5	64%	0.636	69%	0.692	S	S	*	*			trans	-162	71.6	152.1	-164.2	0	0	0	0	110.7	M31	S29-M31 VanDerWaalsContact C-N 3.3Å; S29-M31 PolarHBondContact O-N 3.17Å
30	W	34.4	Very low	53.5	Low	265 Å²	265	122.4 Å²	122.4	100%	1.004	70%	0.698	S	S	*	*			trans	-97.2	41.4	176.1	-92.4	51.9	0	0	0	111.2
31	M	36.7	Very low	56.3	Low	176 Å²	176	117.1 Å²	117.1	87%	0.867	67%	0.673	S	S	*	*			trans	-137.5	51.8	-178.9	-81	-174.6	159.3	0	0	111.9	S29 T33	S29-M31 VanDerWaalsContact C-N 3.3Å; S29-M31 PolarHBondContact O-N 3.17Å; M31-T33 PolarHBondContact O-N 3.4Å
32	H	40.9	Very low	58.9	Low	172 Å²	172	113.5 Å²	113.5	80%	0.796	64%	0.635	S	S	*	*			trans	-79.6	108	154.1	-79	-73.6	0	0	0	108.6	A34	H32-A34 VanDerWaalsContact C-N 3.29Å; H32-A34 PolarHBondContact O-N 3.34Å
33	T	41	Very low	61.6	Low	144 Å²	144	108.5 Å²	108.5	88%	0.883	60%	0.602	S	S	*	*			trans	-59.9	94.5	162.9	-53.8	0	0	0	0	107.8	M31 G35	M31-T33 PolarHBondContact O-N 3.4Å; T33-G35 PolarHBondContact O-N 3.01Å
34	A	59	Low	64.2	Low	51 Å²	51	112.9 Å²	112.9	42%	0.421	60%	0.603	S	S	.	*			trans	-63.4	105.9	-173.9	0	0	0	0	0	110.3	H32	H32-A34 VanDerWaalsContact C-N 3.29Å; H32-A34 PolarHBondContact O-N 3.34Å
35	G	83.3	Confident	66.7	Low	52 Å²	52	108.9 Å²	108.9	54%	0.536	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-63.4	158.2	176.4	0	0	0	0	0	112.1	T33	T33-G35 PolarHBondContact O-N 3.01Å
36	V	91.3	Very high	69.3	Low	71 Å²	71	103 Å²	103	43%	0.43	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76	125.1	171.5	-173.9	0	0	0	0	108.2	Q113 R121 E123	V36-Q113 HydrophobicContact CG2-CG 4.49Å; V36-R121 HydrophobicContact CG2-CB 4.18Å; V36-E123 HydrophobicContact CG1-CB 3.94Å
37	V	94	Very high	72	Confident	51 Å²	51	98.9 Å²	98.9	31%	0.309	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	150.2	179.9	-175.1	0	0	0	0	109.3	T41 A42 R121 T122 E123	V37-T41 HydrophobicContact CG1-CG2 3.62Å; V37-A42 HydrophobicContact CG1-CB 4.41Å; V37-R121 PolarHBondContact N-O 2.92Å; V37-T122 CarbonylContact O-C 3.52Å; V37-T122 WeakPolarHBondContact O-CA 3.24Å; V37-E123 PolarHBondContact O-N 3.36Å
38	D	93.3	Very high	74.7	Confident	70 Å²	70	92.8 Å²	92.8	37%	0.374	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	155.4	171.8	71.5	91.4	0	0	0	111.7	N40 T41 A42	D38-N40 VanDerWaalsContact C-N 3.26Å; D38-N40 PolarHBondContact O-N 3.38Å; D38-N40 WeakPolarHBondContact OD1-CA 3.47Å; D38-N40 WeakPolarHBondContact OD1-CB 3.39Å; D38-N40 PolarHBondContact OD1-N 3.35Å; D38-T41 PolarHBondContact O-N 3.47Å; D38-T41 PolarHBondContact OD1-N 2.82Å; D38-T41 PolarHBondContact OD1-OG1 3.26Å; D38-T41 WeakPolarHBondContact OD2-CB 3.41Å; D38-T41 PolarHBondContact OD2-OG1 3.43Å; D38-A42 WeakPolarHBondContact O-CB 3.5Å; D38-A42 PolarHBondContact O-N 3.23Å
39	A	93.1	Very high	77.7	Confident	19 Å²	19	81.8 Å²	81.8	16%	0.157	47%	0.466	C	S	.	.	H	α-helix	trans	-58.6	-30.5	-178.4	0	0	0	0	0	114.5	A43 E123	A39-A43 WeakPolarHBondContact O-CB 3.28Å; A39-A43 PolarHBondContact O-N 3.07Å; A39-E123 PolarHBondContact N-O 2.72Å; A39-E123 VanDerWaalsContact N-O 3.13Å
40	N	92.9	Very high	80.7	Confident	127 Å²	127	78.9 Å²	78.9	68%	0.679	45%	0.448	S	S	*	.	H	α-helix	trans	-75.5	-44.6	-178.6	-64.8	-44.1	0	0	0	111.1	D38 A42 A43 Q44	D38-N40 VanDerWaalsContact C-N 3.26Å; D38-N40 PolarHBondContact O-N 3.38Å; D38-N40 WeakPolarHBondContact OD1-CA 3.47Å; D38-N40 WeakPolarHBondContact OD1-CB 3.39Å; D38-N40 PolarHBondContact OD1-N 3.35Å; N40-A42 VanDerWaalsContact C-N 3.34Å; N40-A43 PolarHBondContact O-N 2.98Å; N40-Q44 WeakPolarHBondContact O-CG 3.41Å; N40-Q44 PolarHBondContact O-N 3.21Å; N40-Q44 VanDerWaalsContact O-N 3.17Å
41	T	94	Very high	83.7	Confident	61 Å²	61	71.7 Å²	71.7	37%	0.374	42%	0.42	S	S	.	.	H	α-helix	trans	-63.8	-39.4	174.5	-58.1	0	0	0	0	111.3	V37 D38 Q44	V37-T41 HydrophobicContact CG1-CG2 3.62Å; D38-T41 PolarHBondContact O-N 3.47Å; D38-T41 PolarHBondContact OD1-N 2.82Å; D38-T41 PolarHBondContact OD1-OG1 3.26Å; D38-T41 WeakPolarHBondContact OD2-CB 3.41Å; D38-T41 PolarHBondContact OD2-OG1 3.43Å; T41-Q44 PolarHBondContact O-N 2.93Å
42	A	93.1	Very high	86.6	Confident	3 Å²	3	63.8 Å²	63.8	3%	0.025	38%	0.383	C	S	.	.	H	α-helix	trans	-63.1	-41.1	172.9	0	0	0	0	0	112.3	V37 D38 N40 Q44 S45 G46 V47 T122	V37-A42 HydrophobicContact CG1-CB 4.41Å; D38-A42 WeakPolarHBondContact O-CB 3.5Å; D38-A42 PolarHBondContact O-N 3.23Å; N40-A42 VanDerWaalsContact C-N 3.34Å; A42-Q44 VanDerWaalsContact C-N 3.29Å; A42-Q44 PolarHBondContact O-N 2.96Å; A42-S45 CarbonylContact O-C 3.49Å; A42-S45 WeakPolarHBondContact O-CA 3.33Å; A42-S45 WeakPolarHBondContact O-CB 3.22Å; A42-S45 PolarHBondContact O-N 3Å; A42-G46 PolarHBondContact O-N 3.35Å; A42-V47 CarbonylContact C-O 3.51Å; A42-V47 HydrophobicContact CB-CB 4.29Å; A42-V47 PolarHBondContact O-N 3.38Å; A42-V47 VanDerWaalsContact O-O 3.13Å; A42-T122 HydrophobicContact CB-CG2 3.43Å; A42-T122 VanDerWaalsContact CB-CG2 3.43Å
43	A	91.9	Very high	89.4	Confident	31 Å²	31	59.9 Å²	59.9	26%	0.256	37%	0.365	S	S	.	.	H	α-helix	trans	-65.7	-27.8	179.8	0	0	0	0	0	113.7	A39 N40 S45 G46 V47	A39-A43 WeakPolarHBondContact O-CB 3.28Å; A39-A43 PolarHBondContact O-N 3.07Å; N40-A43 PolarHBondContact O-N 2.98Å; A43-S45 VanDerWaalsContact C-N 3.28Å; A43-G46 PolarHBondContact O-N 2.62Å; A43-V47 VanDerWaalsContact CA-O 3.26Å; A43-V47 WeakPolarHBondContact CA-O 3.41Å; A43-V47 PolarHBondContact N-O 3.25Å; A43-V47 VanDerWaalsContact N-O 3.13Å
44	Q	91.7	Very high	92.1	Very high	163 Å²	163	53.7 Å²	53.7	76%	0.762	33%	0.326	S	S	*	.	H	α-helix	trans	-63.9	-34.2	170.1	-66.7	172.6	13.8	0	0	111.8	N40 T41 A42 G46	N40-Q44 WeakPolarHBondContact O-CG 3.41Å; N40-Q44 PolarHBondContact O-N 3.21Å; N40-Q44 VanDerWaalsContact O-N 3.17Å; T41-Q44 PolarHBondContact O-N 2.93Å; A42-Q44 VanDerWaalsContact C-N 3.29Å; A42-Q44 PolarHBondContact O-N 2.96Å; Q44-G46 PolarHBondContact O-N 2.89Å
45	S	90.6	Very high	94	Very high	99 Å²	99	55.4 Å²	55.4	69%	0.692	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	7.9	172.6	-54.6	0	0	0	0	113.2	A42 A43 V47	A42-S45 CarbonylContact O-C 3.49Å; A42-S45 WeakPolarHBondContact O-CA 3.33Å; A42-S45 WeakPolarHBondContact O-CB 3.22Å; A42-S45 PolarHBondContact O-N 3Å; A43-S45 VanDerWaalsContact C-N 3.28Å; S45-V47 PolarHBondContact O-N 3.34Å
46	G	91.7	Very high	94.7	Very high	33 Å²	33	58.3 Å²	58.3	34%	0.34	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	6.3	-176.4	0	0	0	0	0	115	A42 A43 Q44 R77	A42-G46 PolarHBondContact O-N 3.35Å; A43-G46 PolarHBondContact O-N 2.62Å; Q44-G46 PolarHBondContact O-N 2.89Å; G46-R77 WeakPolarHBondContact O-CD 3.48Å
47	V	94	Very high	95	Very high	16 Å²	16	58.1 Å²	58.1	10%	0.097	32%	0.318	C	S	.	.			trans	-93.9	124.3	179.6	-177.3	0	0	0	0	109.5	A42 A43 S45 Y116 N118 V120	A42-V47 CarbonylContact C-O 3.51Å; A42-V47 HydrophobicContact CB-CB 4.29Å; A42-V47 PolarHBondContact O-N 3.38Å; A42-V47 VanDerWaalsContact O-O 3.13Å; A43-V47 VanDerWaalsContact CA-O 3.26Å; A43-V47 WeakPolarHBondContact CA-O 3.41Å; A43-V47 PolarHBondContact N-O 3.25Å; A43-V47 VanDerWaalsContact N-O 3.13Å; S45-V47 PolarHBondContact O-N 3.34Å; V47-Y116 HydrophobicContact CG1-CD1 3.62Å; V47-Y116 HydrophobicContact CG1-CD2 3.6Å; V47-Y116 HydrophobicContact CG1-CE1 3.85Å; V47-Y116 HydrophobicContact CG1-CE2 3.85Å; V47-Y116 HydrophobicContact CG1-CG 3.48Å; V47-Y116 VanDerWaalsContact CG1-CG 3.48Å; V47-N118 WeakPolarHBondContact CG2-ND2 3.47Å; V47-V120 HydrophobicContact CG1-CB 4.49Å; V47-V120 HydrophobicContact CG1-CG1 4.41Å
48	G	95.1	Very high	95.2	Very high	7 Å²	7	56 Å²	56	7%	0.072	31%	0.305	C	S	.	.	S	Bend	trans	173.4	161.7	179.7	0	0	0	0	0	112.3	D76 R77 Y116	G48-D76 VanDerWaalsContact O-CA 3.31Å; G48-D76 WeakPolarHBondContact O-CA 3.43Å; G48-R77 PolarHBondContact O-N 2.78Å; G48-Y116 WeakPolarHBondContact CA-OH 3.15Å
49	L	97	Very high	95.5	Very high	15 Å²	15	55.1 Å²	55.1	8%	0.079	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	136.7	172.4	-62.4	-175.7	0	0	0	110.6	L74 V82 L114 Y116 Q124 L126 T217 L226	L49-L74 HydrophobicContact CD1-CD1 4.21Å; L49-L74 HydrophobicContact CD1-CD2 4.44Å; L49-L74 HydrophobicContact CD2-CB 4.01Å; L49-L74 HydrophobicContact CD2-CD1 4.39Å; L49-V82 HydrophobicContact CD2-CB 4.25Å; L49-V82 HydrophobicContact CD2-CG1 4.33Å; L49-V82 HydrophobicContact CD2-CG2 3.98Å; L49-L114 HydrophobicContact CD1-CD1 4.01Å; L49-L114 HydrophobicContact CD2-CD1 3.93Å; L49-L114 HydrophobicContact CG-CD1 3.95Å; L49-Y116 PolarHBondContact N-OH 3.13Å; L49-Q124 HydrophobicContact CD1-CG 3.96Å; L49-L126 HydrophobicContact CD1-CD1 4.47Å; L49-T217 HydrophobicContact CB-CG2 4.41Å; L49-T217 HydrophobicContact CD1-CG2 4.36Å; L49-L226 HydrophobicContact CB-CD1 4.26Å; L49-L226 HydrophobicContact CB-CD2 3.8Å; L49-L226 HydrophobicContact CD1-CD1 3.81Å
50	A	96.2	Very high	95.7	Very high	30 Å²	30	57.6 Å²	57.6	25%	0.248	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	-37.4	174.2	0	0	0	0	0	112.5	Y75 D76 R77 H224	A50-Y75 PolarHBondContact N-O 3.36Å; A50-D76 WeakPolarHBondContact CB-O 3.42Å; A50-R77 HydrophobicContact CB-CB 4.44Å; A50-R77 HydrophobicContact CB-CG 4.01Å; A50-H224 PolarHBondContact O-CE1 3.09Å
51	R	97	Very high	95.8	Very high	114 Å²	114	54.5 Å²	54.5	43%	0.43	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	155.5	178.4	65.5	-176.9	-175.6	104.4	7	111.4	Y75	R51-Y75 HydrophobicContact CG-CD2 4.07Å; R51-Y75 HydrophobicContact CG-CG 4.29Å; R51-Y75 PolarHBondContact N-O 3.19Å; R51-Y75 PolarHBondContact O-N 2.97Å
52	A	98.3	Very high	96	Very high	11 Å²	11	52 Å²	52	9%	0.091	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	161.4	164.2	0	0	0	0	0	109.4	A73 L74 L226 A227	A52-A73 CarbonylContact C-O 3.54Å; A52-A73 VanDerWaalsContact CA-O 3.25Å; A52-A73 WeakPolarHBondContact CA-O 3.33Å; A52-L74 HydrophobicContact CB-CD2 3.82Å; A52-L226 HydrophobicContact CB-CB 3.91Å; A52-L226 PolarHBondContact N-O 3.43Å; A52-A227 HydrophobicContact CB-CB 3.89Å
53	H	98.2	Very high	96.2	Very high	89 Å²	89	56.4 Å²	56.4	41%	0.412	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.4	175.6	-178.8	-112.4	0	0	0	110.7	E55 L72 A73 Y75	H53-E55 IonicContact CE1-OE1 3.92Å; H53-E55 IonicContact CG-OE1 3.78Å; H53-E55 IonicContact ND1-OE1 2.87Å; H53-E55 PolarHBondContact ND1-OE1 3.19Å; H53-E55 PolarHBondContact O-N 3.08Å; H53-E55 VanDerWaalsContact O-N 3.09Å; H53-L72 CarbonylContact O-C 3.59Å; H53-L72 VanDerWaalsContact O-CA 3.24Å; H53-L72 WeakPolarHBondContact O-CA 3.45Å; H53-A73 PolarHBondContact N-O 3Å; H53-A73 PolarHBondContact O-N 3.38Å; H53-Y75 HydrophobicContact CB-CE2 3.93Å
54	F	98.5	Very high	96.4	Very high	14 Å²	14	56.8 Å²	56.8	6%	0.061	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	78.4	177.8	-79	-89	0	0	0	111.2	K56 Q57 F70 V71 L72 V213 V215 A227	F54-K56 PolarHBondContact O-N 2.94Å; F54-K56 VanDerWaalsContact O-N 3.12Å; F54-Q57 HydrophobicContact CB-CG 4.28Å; F54-F70 HydrophobicContact CD1-CB 4.08Å; F54-F70 HydrophobicContact CD1-CD2 4.08Å; F54-F70 HydrophobicContact CD1-CG 4.32Å; F54-F70 HydrophobicContact CE1-CB 4.1Å; F54-F70 AromaticContact CE1-CD2 3.58Å; F54-F70 HydrophobicContact CE1-CD2 3.58Å; F54-F70 HydrophobicContact CE1-CE2 4.14Å; F54-F70 AromaticContact CE1-CG 3.87Å; F54-F70 HydrophobicContact CE1-CG 3.87Å; F54-V71 CarbonylContact C-O 3.03Å; F54-V71 WeakPolarHBondContact CA-O 3.26Å; F54-L72 HydrophobicContact CD1-CD2 3.6Å; F54-L72 HydrophobicContact CD2-CD2 4.13Å; F54-L72 HydrophobicContact CE1-CD2 3.63Å; F54-L72 HydrophobicContact CE2-CD2 4.15Å; F54-L72 HydrophobicContact CG-CD2 3.86Å; F54-L72 HydrophobicContact CZ-CD2 3.91Å; F54-V213 HydrophobicContact CE1-CB 4.45Å; F54-V213 HydrophobicContact CZ-CB 4.16Å; F54-V213 HydrophobicContact CZ-CG1 4.22Å; F54-V215 HydrophobicContact CE2-CG2 4.35Å; F54-V215 HydrophobicContact CZ-CG2 3.82Å; F54-A227 HydrophobicContact CD2-CB 3.92Å; F54-A227 HydrophobicContact CE2-CB 3.59Å
55	E	98.1	Very high	96.6	Very high	88 Å²	88	51.1 Å²	51.1	41%	0.411	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.6	-33.1	170.1	-65.8	-55.1	138.9	0	0	112.7	H53 V71 A73 F187	H53-E55 IonicContact CE1-OE1 3.92Å; H53-E55 IonicContact CG-OE1 3.78Å; H53-E55 IonicContact ND1-OE1 2.87Å; H53-E55 PolarHBondContact ND1-OE1 3.19Å; H53-E55 PolarHBondContact O-N 3.08Å; H53-E55 VanDerWaalsContact O-N 3.09Å; E55-V71 HydrophobicContact CB-CB 4.29Å; E55-V71 HydrophobicContact CB-CG1 4.12Å; E55-V71 PolarHBondContact N-O 3.47Å; E55-A73 HydrophobicContact CG-CB 3.9Å; E55-F187 HydrophobicContact CG-CD1 3.79Å; E55-F187 HydrophobicContact CG-CE1 3.75Å
56	K	98.4	Very high	96.9	Very high	113 Å²	113	50.2 Å²	50.2	49%	0.491	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	107.6	166.9	-172.5	164.8	-172.2	150.3	0	110.2	F54 F70 V71	F54-K56 PolarHBondContact O-N 2.94Å; F54-K56 VanDerWaalsContact O-N 3.12Å; K56-F70 CarbonylContact O-C 3.6Å; K56-F70 WeakPolarHBondContact O-CA 3.26Å; K56-F70 WeakPolarHBondContact O-CB 3.43Å; K56-V71 HydrophobicContact CB-CB 3.76Å; K56-V71 HydrophobicContact CB-CG2 3.81Å; K56-V71 HydrophobicContact CD-CG2 4.48Å; K56-V71 PolarHBondContact N-O 3.34Å; K56-V71 PolarHBondContact O-N 3.08Å
57	Q	98.5	Very high	97.2	Very high	66 Å²	66	51.6 Å²	51.6	31%	0.308	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-57.4	147.6	171.7	-67.7	-75.8	13.9	0	0	111.7	F54 D230	F54-Q57 HydrophobicContact CB-CG 4.28Å; Q57-D230 VanDerWaalsContact CD-CG 3.42Å; Q57-D230 HydrophobicContact CG-CB 4.32Å; Q57-D230 VanDerWaalsContact CG-OD2 3.32Å; Q57-D230 WeakPolarHBondContact CG-OD2 3.27Å; Q57-D230 PolarHBondContact NE2-OD1 2.9Å; Q57-D230 PolarHBondContact NE2-OD2 3.28Å
58	P	98.4	Very high	97.4	Very high	7 Å²	7	51 Å²	51	5%	0.045	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-68.1	160.9	171.3	32.8	-35.6	0	0	0	110.8	S60 F68 F70 V213 M232	P58-S60 PolarHBondContact O-N 2.88Å; P58-F68 HydrophobicContact CB-CD2 3.96Å; P58-F68 HydrophobicContact CB-CE2 4.23Å; P58-F70 HydrophobicContact CB-CB 4.25Å; P58-F70 HydrophobicContact CB-CD1 4.48Å; P58-V213 HydrophobicContact CB-CG2 4.39Å; P58-V213 HydrophobicContact CG-CG2 3.96Å; P58-M232 HydrophobicContact CB-CE 3.93Å; P58-M232 HydrophobicContact CB-CG 4.08Å; P58-M232 HydrophobicContact CB-SD 3.55Å; P58-M232 VanDerWaalsContact CB-SD 3.55Å; P58-M232 HydrophobicContact CG-CG 3.81Å; P58-M232 HydrophobicContact CG-SD 3.66Å
59	P	98.1	Very high	97.6	Very high	51 Å²	51	53.6 Å²	53.6	33%	0.331	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-66.5	129.1	-174.5	26.5	-34.8	0	0	0	112.4	N61 L62 F68 M232	P59-N61 PolarHBondContact O-N 2.98Å; P59-N61 VanDerWaalsContact O-N 3.09Å; P59-L62 HydrophobicContact CG-CB 4.43Å; P59-L62 HydrophobicContact CG-CD1 4.32Å; P59-F68 HydrophobicContact CG-CB 3.74Å; P59-M232 HydrophobicContact CG-CE 4.2Å
60	S	97.5	Very high	97.6	Very high	71 Å²	71	52.9 Å²	52.9	50%	0.497	26%	0.264	S	S	.	.	S	Bend	trans	-60.6	-20.9	-179.4	61.5	0	0	0	0	114.6	P58 N231 F233	P58-S60 PolarHBondContact O-N 2.88Å; S60-N231 WeakPolarHBondContact CA-O 3.49Å; S60-F233 PolarHBondContact O-N 3.3Å
61	N	96.5	Very high	97.8	Very high	62 Å²	62	52.3 Å²	52.3	33%	0.332	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	129.4	169.6	-56.8	-86	0	0	0	108.8	P59 F233 H240	P59-N61 PolarHBondContact O-N 2.98Å; P59-N61 VanDerWaalsContact O-N 3.09Å; N61-F233 WeakPolarHBondContact CA-O 3.45Å; N61-H240 VanDerWaalsContact CG-NE2 3.33Å; N61-H240 PolarHBondContact OD1-NE2 3.02Å; N61-H240 VanDerWaalsContact OD1-NE2 3.16Å
62	L	97.8	Very high	97.8	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.042	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.7	-175.3	177.2	61.4	0	0	0	110.7	P59 N66 F68 C194 M232 F233 V234 H235	P59-L62 HydrophobicContact CG-CB 4.43Å; P59-L62 HydrophobicContact CG-CD1 4.32Å; L62-N66 HydrophobicContact CD1-CB 4.3Å; L62-F68 HydrophobicContact CD1-CB 3.94Å; L62-F68 HydrophobicContact CD2-CB 3.94Å; L62-F68 HydrophobicContact CD2-CD1 3.43Å; L62-F68 VanDerWaalsContact CD2-CD1 3.43Å; L62-F68 HydrophobicContact CD2-CE1 4.09Å; L62-F68 HydrophobicContact CD2-CG 3.84Å; L62-C194 HydrophobicContact CD2-CB 4.17Å; L62-M232 HydrophobicContact CB-CE 4.25Å; L62-M232 HydrophobicContact CD2-CE 3.76Å; L62-F233 PolarHBondContact N-O 2.97Å; L62-V234 HydrophobicContact CB-CG2 4.39Å; L62-V234 HydrophobicContact CD2-CG2 4.34Å; L62-V234 CarbonylContact O-C 3.58Å; L62-V234 WeakPolarHBondContact O-CA 3.44Å; L62-H235 PolarHBondContact O-CD2 3.13Å; L62-H235 PolarHBondContact O-N 3.15Å
63	R	97.7	Very high	97.8	Very high	96 Å²	96	46.6 Å²	46.6	36%	0.362	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	121.1	165.6	-167.5	-177.1	176	-162.1	-4.3	109.7	S65 N66 H235	R63-S65 VanDerWaalsContact CD-OG 3.25Å; R63-S65 WeakPolarHBondContact CD-OG 3.34Å; R63-S65 WeakPolarHBondContact CG-OG 3.31Å; R63-S65 PolarHBondContact NE-OG 2.98Å; R63-S65 PolarHBondContact O-N 3.12Å; R63-N66 WeakPolarHBondContact O-CB 3.48Å; R63-N66 PolarHBondContact O-N 2.89Å; R63-H235 CarbonylContact C-O 3.5Å; R63-H235 VanDerWaalsContact CA-O 3.25Å; R63-H235 WeakPolarHBondContact CA-O 3.44Å
64	K	95.8	Very high	97.9	Very high	40 Å²	40	42.5 Å²	42.5	17%	0.174	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-28.1	178.9	165.4	167.5	170.7	167.5	0	115.8	N66 K193 N195 N197 V234 H235	K64-N66 PolarHBondContact O-N 3.1Å; K64-K193 WeakPolarHBondContact O-CE 3.13Å; K64-N195 WeakPolarHBondContact CE-O 3.43Å; K64-N195 WeakPolarHBondContact CE-OD1 3.44Å; K64-N195 PolarHBondContact NZ-O 3.49Å; K64-N197 WeakPolarHBondContact CD-OD1 3.32Å; K64-N197 PolarHBondContact NZ-OD1 3.34Å; K64-V234 HydrophobicContact CB-CG1 4.16Å; K64-H235 PolarHBondContact N-O 3.42Å
65	S	94.4	Very high	97.8	Very high	44 Å²	44	44 Å²	44	31%	0.308	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-21.9	174.9	54	0	0	0	0	114.1	R63	R63-S65 VanDerWaalsContact CD-OG 3.25Å; R63-S65 WeakPolarHBondContact CD-OG 3.34Å; R63-S65 WeakPolarHBondContact CG-OG 3.31Å; R63-S65 PolarHBondContact NE-OG 2.98Å; R63-S65 PolarHBondContact O-N 3.12Å
66	N	97.4	Very high	97.8	Very high	79 Å²	79	40.3 Å²	40.3	42%	0.422	20%	0.204	S	C	.	.	S	Bend	trans	-100.9	151.8	-168.1	-58.4	10.8	0	0	0	111	L62 R63 K64	L62-N66 HydrophobicContact CD1-CB 4.3Å; R63-N66 WeakPolarHBondContact O-CB 3.48Å; R63-N66 PolarHBondContact O-N 2.89Å; K64-N66 PolarHBondContact O-N 3.1Å
67	F	97.9	Very high	97.6	Very high	63 Å²	63	42.1 Å²	42.1	28%	0.276	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	156.1	163.3	-68.8	-93	0	0	0	110.8	H157 M160 T176 L192 K193	F67-H157 HydrophobicContact CE1-CB 3.85Å; F67-H157 HydrophobicContact CZ-CB 3.78Å; F67-H157 AromaticContact CZ-ND1 3.89Å; F67-M160 HydrophobicContact CE1-CE 3.87Å; F67-M160 HydrophobicContact CE2-CE 4.44Å; F67-M160 HydrophobicContact CZ-CE 3.49Å; F67-M160 VanDerWaalsContact CZ-CE 3.49Å; F67-T176 HydrophobicContact CB-CG2 4.05Å; F67-T176 HydrophobicContact CD1-CG2 4.19Å; F67-T176 HydrophobicContact CD2-CG2 4.3Å; F67-T176 HydrophobicContact CG-CG2 3.92Å; F67-L192 CarbonylContact C-O 3.53Å; F67-L192 WeakPolarHBondContact CA-O 3.4Å; F67-K193 HydrophobicContact CD1-CB 3.92Å; F67-K193 HydrophobicContact CE1-CB 3.97Å; F67-K193 HydrophobicContact CG-CB 4.43Å
68	F	98.5	Very high	97.4	Very high	4 Å²	4	46 Å²	46	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	160.8	168.3	72.7	-79.8	0	0	0	109.5	P58 P59 L62 F70 L154 L192 C194 V213 M232	P58-F68 HydrophobicContact CB-CD2 3.96Å; P58-F68 HydrophobicContact CB-CE2 4.23Å; P59-F68 HydrophobicContact CG-CB 3.74Å; L62-F68 HydrophobicContact CD1-CB 3.94Å; L62-F68 HydrophobicContact CD2-CB 3.94Å; L62-F68 HydrophobicContact CD2-CD1 3.43Å; L62-F68 VanDerWaalsContact CD2-CD1 3.43Å; L62-F68 HydrophobicContact CD2-CE1 4.09Å; L62-F68 HydrophobicContact CD2-CG 3.84Å; F68-F70 HydrophobicContact CD2-CD1 4.35Å; F68-F70 AromaticContact CE2-CD1 3.97Å; F68-F70 HydrophobicContact CE2-CD1 3.97Å; F68-F70 HydrophobicContact CE2-CE1 4.13Å; F68-L154 HydrophobicContact CE1-CD2 4.15Å; F68-L154 HydrophobicContact CZ-CD2 3.98Å; F68-L192 HydrophobicContact CD1-CB 4.14Å; F68-L192 WeakPolarHBondContact CD1-O 3.32Å; F68-L192 HydrophobicContact CE1-CB 3.55Å; F68-L192 HydrophobicContact CE2-CB 4.33Å; F68-L192 HydrophobicContact CZ-CB 3.67Å; F68-L192 HydrophobicContact CZ-CD1 4.14Å; F68-L192 HydrophobicContact CZ-CG 4.49Å; F68-L192 PolarHBondContact N-O 2.78Å; F68-L192 PolarHBondContact O-N 2.83Å; F68-C194 HydrophobicContact CE1-CB 4.14Å; F68-V213 HydrophobicContact CE2-CG2 4.2Å; F68-M232 HydrophobicContact CD1-CE 4.39Å; F68-M232 HydrophobicContact CD2-CE 3.67Å; F68-M232 HydrophobicContact CD2-SD 4.38Å; F68-M232 HydrophobicContact CE2-CE 3.84Å; F68-M232 HydrophobicContact CE2-SD 4.07Å; F68-M232 HydrophobicContact CG-CE 3.95Å; F68-M232 HydrophobicContact CZ-CE 4.27Å
69	H	98.5	Very high	97.2	Very high	60 Å²	60	47.3 Å²	47.3	28%	0.278	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	155.7	175.5	62.9	-90.7	0	0	0	110.6	F190 F191	H69-F190 WeakPolarHBondContact CA-O 3.4Å; H69-F190 WeakPolarHBondContact CB-O 3.37Å; H69-F191 HydrophobicContact CB-CD1 3.91Å; H69-F191 HydrophobicContact CB-CE1 4.24Å; H69-F191 HydrophobicContact CB-CG 4.48Å
70	F	98.7	Very high	97.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	162.5	169.8	56	-92.6	0	0	0	108.3	F54 K56 P58 F68 L72 V128 K189 F190 L192 V213	F54-F70 HydrophobicContact CD1-CB 4.08Å; F54-F70 HydrophobicContact CD1-CD2 4.08Å; F54-F70 HydrophobicContact CD1-CG 4.32Å; F54-F70 HydrophobicContact CE1-CB 4.1Å; F54-F70 AromaticContact CE1-CD2 3.58Å; F54-F70 HydrophobicContact CE1-CD2 3.58Å; F54-F70 HydrophobicContact CE1-CE2 4.14Å; F54-F70 AromaticContact CE1-CG 3.87Å; F54-F70 HydrophobicContact CE1-CG 3.87Å; K56-F70 CarbonylContact O-C 3.6Å; K56-F70 WeakPolarHBondContact O-CA 3.26Å; K56-F70 WeakPolarHBondContact O-CB 3.43Å; P58-F70 HydrophobicContact CB-CB 4.25Å; P58-F70 HydrophobicContact CB-CD1 4.48Å; F68-F70 HydrophobicContact CD2-CD1 4.35Å; F68-F70 AromaticContact CE2-CD1 3.97Å; F68-F70 HydrophobicContact CE2-CD1 3.97Å; F68-F70 HydrophobicContact CE2-CE1 4.13Å; F70-L72 HydrophobicContact CD2-CD2 4Å; F70-L72 HydrophobicContact CD2-CG 3.99Å; F70-L72 HydrophobicContact CE2-CD1 4.09Å; F70-L72 HydrophobicContact CE2-CD2 4.24Å; F70-L72 HydrophobicContact CE2-CG 3.98Å; F70-V128 HydrophobicContact CE1-CG1 4.26Å; F70-V128 HydrophobicContact CZ-CG1 3.8Å; F70-V128 HydrophobicContact CZ-CG2 4.22Å; F70-K189 WeakPolarHBondContact O-CA 3.2Å; F70-F190 HydrophobicContact CD1-CB 4.41Å; F70-F190 HydrophobicContact CD2-CB 4.32Å; F70-F190 AromaticContact CD2-CD2 3.94Å; F70-F190 HydrophobicContact CD2-CD2 3.94Å; F70-F190 HydrophobicContact CD2-CG 4.39Å; F70-F190 HydrophobicContact CE1-CB 3.88Å; F70-F190 HydrophobicContact CE1-CG 4.46Å; F70-F190 HydrophobicContact CE2-CB 3.78Å; F70-F190 HydrophobicContact CE2-CD1 4.44Å; F70-F190 AromaticContact CE2-CD2 3.33Å; F70-F190 HydrophobicContact CE2-CD2 3.33Å; F70-F190 HydrophobicContact CE2-CE2 4.03Å; F70-F190 AromaticContact CE2-CG 3.59Å; F70-F190 HydrophobicContact CE2-CG 3.59Å; F70-F190 HydrophobicContact CZ-CB 3.53Å; F70-F190 HydrophobicContact CZ-CD1 4.24Å; F70-F190 AromaticContact CZ-CD2 3.9Å; F70-F190 HydrophobicContact CZ-CD2 3.9Å; F70-F190 AromaticContact CZ-CG 3.63Å; F70-F190 HydrophobicContact CZ-CG 3.63Å; F70-F190 PolarHBondContact O-N 2.87Å; F70-F190 VanDerWaalsContact O-N 3.1Å; F70-L192 HydrophobicContact CE1-CD1 4.01Å; F70-L192 HydrophobicContact CZ-CD1 4.47Å; F70-V213 HydrophobicContact CE1-CG1 3.92Å; F70-V213 HydrophobicContact CE1-CG2 4.46Å; F70-V213 HydrophobicContact CZ-CG1 3.95Å
71	V	98.7	Very high	97.2	Very high	19 Å²	19	48.7 Å²	48.7	12%	0.115	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.6	178	-177	0	0	0	0	108.8	F54 E55 K56 F187 L188 K189	F54-V71 CarbonylContact C-O 3.03Å; F54-V71 WeakPolarHBondContact CA-O 3.26Å; E55-V71 HydrophobicContact CB-CB 4.29Å; E55-V71 HydrophobicContact CB-CG1 4.12Å; E55-V71 PolarHBondContact N-O 3.47Å; K56-V71 HydrophobicContact CB-CB 3.76Å; K56-V71 HydrophobicContact CB-CG2 3.81Å; K56-V71 HydrophobicContact CD-CG2 4.48Å; K56-V71 PolarHBondContact N-O 3.34Å; K56-V71 PolarHBondContact O-N 3.08Å; V71-F187 HydrophobicContact CG1-CB 3.9Å; V71-L188 CarbonylContact C-O 3.53Å; V71-L188 VanDerWaalsContact CA-O 3.29Å; V71-L188 WeakPolarHBondContact CA-O 3.38Å; V71-K189 HydrophobicContact CG2-CB 4.05Å; V71-K189 HydrophobicContact CG2-CD 4.39Å; V71-K189 HydrophobicContact CG2-CG 3.95Å
72	L	98.6	Very high	97.2	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.4	177	-58.9	-177.9	0	0	0	111.7	H53 F54 F70 F187 L188 F190 V215	H53-L72 CarbonylContact O-C 3.59Å; H53-L72 VanDerWaalsContact O-CA 3.24Å; H53-L72 WeakPolarHBondContact O-CA 3.45Å; F54-L72 HydrophobicContact CD1-CD2 3.6Å; F54-L72 HydrophobicContact CD2-CD2 4.13Å; F54-L72 HydrophobicContact CE1-CD2 3.63Å; F54-L72 HydrophobicContact CE2-CD2 4.15Å; F54-L72 HydrophobicContact CG-CD2 3.86Å; F54-L72 HydrophobicContact CZ-CD2 3.91Å; F70-L72 HydrophobicContact CD2-CD2 4Å; F70-L72 HydrophobicContact CD2-CG 3.99Å; F70-L72 HydrophobicContact CE2-CD1 4.09Å; F70-L72 HydrophobicContact CE2-CD2 4.24Å; F70-L72 HydrophobicContact CE2-CG 3.98Å; L72-F187 CarbonylContact O-C 3.58Å; L72-F187 VanDerWaalsContact O-CA 3.29Å; L72-F187 WeakPolarHBondContact O-CA 3.45Å; L72-L188 PolarHBondContact N-O 3.04Å; L72-L188 PolarHBondContact O-N 3.35Å; L72-F190 HydrophobicContact CB-CE2 4.46Å; L72-F190 HydrophobicContact CD1-CD2 4.35Å; L72-F190 HydrophobicContact CD1-CE2 3.62Å; L72-F190 HydrophobicContact CD1-CZ 4.19Å; L72-F190 HydrophobicContact CG-CD2 4.4Å; L72-F190 HydrophobicContact CG-CE2 3.99Å; L72-V215 HydrophobicContact CD1-CB 4.34Å; L72-V215 HydrophobicContact CD1-CG1 3.79Å; L72-V215 HydrophobicContact CD1-CG2 3.76Å; L72-V215 HydrophobicContact CD2-CG2 4.27Å
73	A	98.4	Very high	97.2	Very high	5 Å²	5	46.7 Å²	46.7	4%	0.041	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	144.9	154.2	0	0	0	0	0	109.4	A52 H53 E55 Y75 F187	A52-A73 CarbonylContact C-O 3.54Å; A52-A73 VanDerWaalsContact CA-O 3.25Å; A52-A73 WeakPolarHBondContact CA-O 3.33Å; H53-A73 PolarHBondContact N-O 3Å; H53-A73 PolarHBondContact O-N 3.38Å; E55-A73 HydrophobicContact CG-CB 3.9Å; A73-Y75 HydrophobicContact CB-CE2 3.96Å; A73-F187 HydrophobicContact CB-CD1 3.98Å; A73-F187 HydrophobicContact CB-CE1 4.06Å
74	L	98.4	Very high	97.3	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.4	-179.2	-60.8	-177.9	0	0	0	111	L49 A52 V82 I84 L112 L114 L188	L49-L74 HydrophobicContact CD1-CD1 4.21Å; L49-L74 HydrophobicContact CD1-CD2 4.44Å; L49-L74 HydrophobicContact CD2-CB 4.01Å; L49-L74 HydrophobicContact CD2-CD1 4.39Å; A52-L74 HydrophobicContact CB-CD2 3.82Å; L74-V82 HydrophobicContact CB-CB 4.3Å; L74-V82 PolarHBondContact O-N 2.71Å; L74-I84 HydrophobicContact CD1-CD1 4.4Å; L74-I84 HydrophobicContact CD1-CG1 4.13Å; L74-L112 HydrophobicContact CD1-CD1 3.92Å; L74-L114 HydrophobicContact CD1-CD2 4.01Å; L74-L188 HydrophobicContact CD1-CD1 4.13Å
75	Y	98.1	Very high	97.3	Very high	47 Å²	47	43.2 Å²	43.2	18%	0.184	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	143.2	178.8	-57.4	-88.6	0	0	0	112.4	A50 R51 H53 A73 G79 Q80 P81	A50-Y75 PolarHBondContact N-O 3.36Å; R51-Y75 HydrophobicContact CG-CD2 4.07Å; R51-Y75 HydrophobicContact CG-CG 4.29Å; R51-Y75 PolarHBondContact N-O 3.19Å; R51-Y75 PolarHBondContact O-N 2.97Å; H53-Y75 HydrophobicContact CB-CE2 3.93Å; A73-Y75 HydrophobicContact CB-CE2 3.96Å; Y75-G79 WeakPolarHBondContact CD1-O 3.46Å; Y75-Q80 VanDerWaalsContact CA-O 3.26Å; Y75-Q80 WeakPolarHBondContact CA-O 3.25Å; Y75-P81 HydrophobicContact CE1-CB 4.39Å
76	D	96.7	Very high	97.5	Very high	10 Å²	10	49.1 Å²	49.1	5%	0.053	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	179.2	177.5	72.2	14.9	0	0	0	113.4	G48 A50 Q78 G79 Q80 V82 Y116	G48-D76 VanDerWaalsContact O-CA 3.31Å; G48-D76 WeakPolarHBondContact O-CA 3.43Å; A50-D76 WeakPolarHBondContact CB-O 3.42Å; D76-Q78 PolarHBondContact O-N 2.78Å; D76-Q78 VanDerWaalsContact OD1-C 3.29Å; D76-Q78 VanDerWaalsContact OD1-CA 3.28Å; D76-Q78 WeakPolarHBondContact OD1-CA 3.4Å; D76-Q78 WeakPolarHBondContact OD1-CB 3.13Å; D76-Q78 PolarHBondContact OD1-N 2.9Å; D76-G79 PolarHBondContact O-N 3.27Å; D76-G79 PolarHBondContact OD1-N 2.86Å; D76-Q80 PolarHBondContact N-O 3.13Å; D76-Q80 PolarHBondContact OD1-N 2.99Å; D76-V82 HydrophobicContact CB-CG2 3.81Å; D76-Y116 HydrophobicContact CB-CD1 3.66Å; D76-Y116 HydrophobicContact CB-CE1 3.66Å
77	R	94.5	Very high	97.5	Very high	150 Å²	150	46.8 Å²	46.8	57%	0.566	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-16.6	175.6	-69.3	-176.9	179.7	178.9	2.6	114.9	G46 G48 A50	G46-R77 WeakPolarHBondContact O-CD 3.48Å; G48-R77 PolarHBondContact O-N 2.78Å; A50-R77 HydrophobicContact CB-CB 4.44Å; A50-R77 HydrophobicContact CB-CG 4.01Å
78	Q	94.4	Very high	97.5	Very high	149 Å²	149	45.7 Å²	45.7	70%	0.696	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.8	2.4	175.2	-56.8	-177	7.3	0	0	111.9	D76 Q80	D76-Q78 PolarHBondContact O-N 2.78Å; D76-Q78 VanDerWaalsContact OD1-C 3.29Å; D76-Q78 VanDerWaalsContact OD1-CA 3.28Å; D76-Q78 WeakPolarHBondContact OD1-CA 3.4Å; D76-Q78 WeakPolarHBondContact OD1-CB 3.13Å; D76-Q78 PolarHBondContact OD1-N 2.9Å; Q78-Q80 VanDerWaalsContact C-N 3.28Å; Q78-Q80 HydrophobicContact CB-CG 4.31Å; Q78-Q80 PolarHBondContact O-N 2.94Å
79	G	94.9	Very high	97.5	Very high	33 Å²	33	48.1 Å²	48.1	34%	0.34	23%	0.234	S	C	.	.	S	Bend	trans	77.6	7.1	-178.2	0	0	0	0	0	114.4	Y75 D76	Y75-G79 WeakPolarHBondContact CD1-O 3.46Å; D76-G79 PolarHBondContact O-N 3.27Å; D76-G79 PolarHBondContact OD1-N 2.86Å
80	Q	96.9	Very high	97.5	Very high	92 Å²	92	48.2 Å²	48.2	43%	0.43	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-78	147.2	179.1	-59.4	-58.2	-39.7	0	0	111	Y75 D76 Q78	Y75-Q80 VanDerWaalsContact CA-O 3.26Å; Y75-Q80 WeakPolarHBondContact CA-O 3.25Å; D76-Q80 PolarHBondContact N-O 3.13Å; D76-Q80 PolarHBondContact OD1-N 2.99Å; Q78-Q80 VanDerWaalsContact C-N 3.28Å; Q78-Q80 HydrophobicContact CB-CG 4.31Å; Q78-Q80 PolarHBondContact O-N 2.94Å
81	P	97.3	Very high	97.4	Very high	60 Å²	60	49.8 Å²	49.8	39%	0.39	25%	0.247	S	C	.	.	B	Isolated β-bridge	trans	-67.1	135.8	175.5	29.6	-34.9	0	0	0	110.4	Y75 F186	Y75-P81 HydrophobicContact CE1-CB 4.39Å; P81-F186 HydrophobicContact CB-CD1 3.86Å; P81-F186 HydrophobicContact CB-CE1 4.14Å; P81-F186 HydrophobicContact CG-CE1 4.39Å
82	V	98.1	Very high	97.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-101.3	125.8	179.2	-176.4	0	0	0	0	109.2	L49 L74 D76 L114 Y116	L49-V82 HydrophobicContact CD2-CB 4.25Å; L49-V82 HydrophobicContact CD2-CG1 4.33Å; L49-V82 HydrophobicContact CD2-CG2 3.98Å; L74-V82 HydrophobicContact CB-CB 4.3Å; L74-V82 PolarHBondContact O-N 2.71Å; D76-V82 HydrophobicContact CB-CG2 3.81Å; V82-L114 HydrophobicContact CG1-CB 3.84Å; V82-L114 HydrophobicContact CG1-CD1 4.27Å; V82-L114 HydrophobicContact CG1-CD2 4.18Å; V82-L114 HydrophobicContact CG1-CG 4.32Å; V82-Y116 HydrophobicContact CG1-CD1 4.25Å; V82-Y116 HydrophobicContact CG1-CD2 4.41Å; V82-Y116 HydrophobicContact CG1-CE1 4.13Å; V82-Y116 HydrophobicContact CG1-CE2 4.27Å; V82-Y116 HydrophobicContact CG1-CG 4.39Å; V82-Y116 HydrophobicContact CG2-CD1 3.83Å; V82-Y116 HydrophobicContact CG2-CE1 3.72Å
83	E	98.1	Very high	97.2	Very high	27 Å²	27	49.7 Å²	49.7	13%	0.126	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	144	176.7	167.7	166.8	-170.7	0	0	110.5	L114 L115 R185 F186	E83-L114 CarbonylContact O-C 3.52Å; E83-L114 WeakPolarHBondContact O-CA 3.46Å; E83-L115 HydrophobicContact CB-CB 4.13Å; E83-L115 HydrophobicContact CG-CB 4.28Å; E83-L115 PolarHBondContact N-O 3.29Å; E83-L115 PolarHBondContact O-N 2.87Å; E83-R185 VanDerWaalsContact CD-NE 3.34Å; E83-R185 HydrophobicContact CG-CB 4.18Å; E83-R185 IonicContact OE1-CZ 3.39Å; E83-R185 IonicContact OE1-NE 3.78Å; E83-R185 PolarHBondContact OE1-NE 2.95Å; E83-R185 IonicContact OE1-NH2 2.64Å; E83-R185 PolarHBondContact OE1-NH2 2.96Å; E83-R185 IonicContact OE2-CZ 3.59Å; E83-R185 IonicContact OE2-NE 3.47Å; E83-R185 IonicContact OE2-NH2 2.66Å; E83-R185 PolarHBondContact OE2-NH2 2.88Å; E83-F186 HydrophobicContact CB-CD1 4.21Å; E83-F186 HydrophobicContact CB-CE1 3.72Å; E83-F186 HydrophobicContact CB-CZ 4.26Å
84	I	98	Very high	96.9	Very high	4 Å²	4	51 Å²	51	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.6	174.4	-47	91.5	0	0	0	109.4	L74 R86 T87 L114 I182 R185 L188	L74-I84 HydrophobicContact CD1-CD1 4.4Å; L74-I84 HydrophobicContact CD1-CG1 4.13Å; I84-R86 WeakPolarHBondContact CG2-O 3.26Å; I84-T87 HydrophobicContact CG2-CG2 3.84Å; I84-L114 HydrophobicContact CB-CD2 4.36Å; I84-L114 HydrophobicContact CG1-CD2 3.79Å; I84-L114 HydrophobicContact CG2-CD2 4.21Å; I84-I182 HydrophobicContact CB-CD1 4.5Å; I84-I182 HydrophobicContact CB-CG1 4.33Å; I84-I182 HydrophobicContact CG2-CD1 4.15Å; I84-I182 HydrophobicContact CG2-CG1 4.16Å; I84-R185 PolarHBondContact N-O 2.89Å; I84-L188 HydrophobicContact CB-CD2 4.19Å; I84-L188 HydrophobicContact CD1-CD1 4.46Å; I84-L188 HydrophobicContact CD1-CD2 4.26Å; I84-L188 HydrophobicContact CD1-CG 3.92Å; I84-L188 HydrophobicContact CG1-CD1 4.08Å; I84-L188 HydrophobicContact CG1-CD2 4.1Å; I84-L188 HydrophobicContact CG1-CG 3.95Å; I84-L188 HydrophobicContact CG2-CD2 4.05Å
85	E	97.3	Very high	96.5	Very high	59 Å²	59	58.5 Å²	58.5	28%	0.276	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-34.8	178.9	-65.9	-175.1	139.2	0	0	112.2	Q113 L115 R121	E85-Q113 HydrophobicContact CB-CB 4.5Å; E85-Q113 HydrophobicContact CB-CG 4.33Å; E85-Q113 PolarHBondContact N-O 2.73Å; E85-Q113 PolarHBondContact OE2-NE2 3.43Å; E85-L115 HydrophobicContact CG-CB 4.22Å; E85-R121 VanDerWaalsContact CD-NE 3.29Å; E85-R121 IonicContact OE1-CZ 2.78Å; E85-R121 VanDerWaalsContact OE1-CZ 3.24Å; E85-R121 IonicContact OE1-NE 2.71Å; E85-R121 PolarHBondContact OE1-NE 2.9Å; E85-R121 IonicContact OE1-NH2 2.81Å; E85-R121 PolarHBondContact OE1-NH2 2.72Å; E85-R121 WeakPolarHBondContact OE2-CD 3.22Å; E85-R121 IonicContact OE2-CZ 2.75Å; E85-R121 IonicContact OE2-NE 3.48Å; E85-R121 PolarHBondContact OE2-NE 2.95Å
86	R	97.6	Very high	96.2	Very high	169 Å²	169	64.8 Å²	64.8	64%	0.638	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.1	153.7	178.7	-58.4	-174.7	177.1	168.2	-2.9	112.3	I84 L112 Q113	I84-R86 WeakPolarHBondContact CG2-O 3.26Å; R86-L112 WeakPolarHBondContact O-CA 3.25Å; R86-Q113 HydrophobicContact CB-CB 3.82Å; R86-Q113 HydrophobicContact CG-CB 4.32Å; R86-Q113 PolarHBondContact N-O 2.92Å; R86-Q113 PolarHBondContact O-N 2.87Å
87	T	98.2	Very high	95.9	Very high	30 Å²	30	68.5 Å²	68.5	18%	0.184	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	149	174.7	63.1	0	0	0	0	109.4	I84 K111 L112 P180 I182 L188	I84-T87 HydrophobicContact CG2-CG2 3.84Å; T87-K111 CarbonylContact C-O 3.54Å; T87-K111 WeakPolarHBondContact CA-O 3.47Å; T87-L112 HydrophobicContact CG2-CD2 3.79Å; T87-P180 WeakPolarHBondContact CB-O 3.36Å; T87-P180 HydrophobicContact CG2-CB 4.26Å; T87-P180 WeakPolarHBondContact CG2-O 3.48Å; T87-P180 PolarHBondContact OG1-O 3.39Å; T87-I182 HydrophobicContact CG2-CD1 4.08Å; T87-I182 HydrophobicContact CG2-CG1 3.75Å; T87-L188 HydrophobicContact CG2-CD2 3.58Å
88	A	98.3	Very high	95.6	Very high	39 Å²	39	62 Å²	62	32%	0.322	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	135.4	171.7	0	0	0	0	0	110.4	Y110 K111 D179	A88-Y110 CarbonylContact O-C 3.58Å; A88-Y110 VanDerWaalsContact O-CA 3.26Å; A88-Y110 WeakPolarHBondContact O-CA 3.28Å; A88-K111 PolarHBondContact N-O 2.86Å; A88-K111 PolarHBondContact O-N 3.42Å; A88-D179 WeakPolarHBondContact CA-OD1 2.99Å
89	F	98.2	Very high	95.1	Very high	55 Å²	55	55.9 Å²	55.9	24%	0.241	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	130.2	157.5	166.6	-91.9	0	0	0	109	D91 F92 I108 Y110 T156 D179	F89-D91 WeakPolarHBondContact CE2-O 3.48Å; F89-F92 HydrophobicContact CE2-CD2 4.46Å; F89-F92 HydrophobicContact CE2-CE1 4.3Å; F89-F92 HydrophobicContact CE2-CE2 4.09Å; F89-F92 AromaticContact CE2-CZ 3.98Å; F89-F92 HydrophobicContact CE2-CZ 3.98Å; F89-F92 AromaticContact CZ-CD2 3.99Å; F89-F92 HydrophobicContact CZ-CD2 3.99Å; F89-F92 AromaticContact CZ-CE2 3.6Å; F89-F92 HydrophobicContact CZ-CE2 3.6Å; F89-F92 AromaticContact CZ-CZ 3.93Å; F89-F92 HydrophobicContact CZ-CZ 3.93Å; F89-I108 HydrophobicContact CD2-CG2 3.57Å; F89-I108 HydrophobicContact CE2-CG2 3.65Å; F89-Y110 HydrophobicContact CB-CD1 4.27Å; F89-Y110 HydrophobicContact CB-CE1 4.11Å; F89-Y110 HydrophobicContact CD2-CE1 4.24Å; F89-T156 HydrophobicContact CD2-CG2 3.77Å; F89-T156 HydrophobicContact CE2-CG2 3.74Å; F89-D179 PolarHBondContact N-OD1 2.97Å
90	V	97.5	Very high	94.6	Very high	63 Å²	63	60 Å²	60	38%	0.382	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-62.3	178.5	-168.5	0	0	0	0	109.8	H109 K111	V90-H109 HydrophobicContact CB-CB 4.5Å; V90-H109 PolarHBondContact N-O 2.91Å; V90-K111 HydrophobicContact CG2-CB 3.75Å
91	D	96.6	Very high	93.7	Very high	32 Å²	32	62.8 Å²	62.8	17%	0.171	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	-172.3	-174	55.9	63.6	0	0	0	112.8	F89 K97 H109	F89-D91 WeakPolarHBondContact CE2-O 3.48Å; D91-K97 IonicContact OD1-NZ 3.41Å; D91-K97 IonicContact OD2-NZ 3.52Å; D91-K97 PolarHBondContact OD2-NZ 3.19Å; D91-H109 PolarHBondContact N-O 2.97Å; D91-H109 PolarHBondContact O-N 2.97Å; D91-H109 VanDerWaalsContact OD1-CB 3.3Å; D91-H109 WeakPolarHBondContact OD1-CB 3.23Å; D91-H109 IonicContact OD1-CG 3.58Å; D91-H109 IonicContact OD1-ND1 2.72Å; D91-H109 PolarHBondContact OD1-ND1 2.86Å; D91-H109 IonicContact OD2-ND1 2.82Å; D91-H109 PolarHBondContact OD2-ND1 2.76Å
92	F	97.2	Very high	93.2	Very high	15 Å²	15	62.9 Å²	62.9	7%	0.066	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	148.9	174	-65	-82.7	0	0	0	110.7	F89 E94 G107 I108 T156 I159	F89-F92 HydrophobicContact CE2-CD2 4.46Å; F89-F92 HydrophobicContact CE2-CE1 4.3Å; F89-F92 HydrophobicContact CE2-CE2 4.09Å; F89-F92 AromaticContact CE2-CZ 3.98Å; F89-F92 HydrophobicContact CE2-CZ 3.98Å; F89-F92 AromaticContact CZ-CD2 3.99Å; F89-F92 HydrophobicContact CZ-CD2 3.99Å; F89-F92 AromaticContact CZ-CE2 3.6Å; F89-F92 HydrophobicContact CZ-CE2 3.6Å; F89-F92 AromaticContact CZ-CZ 3.93Å; F89-F92 HydrophobicContact CZ-CZ 3.93Å; F92-E94 HydrophobicContact CB-CG 4.49Å; F92-E94 PolarHBondContact O-N 2.88Å; F92-E94 VanDerWaalsContact O-N 3.11Å; F92-G107 WeakPolarHBondContact CA-O 3.41Å; F92-I108 HydrophobicContact CD1-CD1 4.44Å; F92-I108 HydrophobicContact CD1-CG1 3.64Å; F92-I108 HydrophobicContact CE1-CD1 3.99Å; F92-I108 HydrophobicContact CE1-CG1 3.67Å; F92-T156 HydrophobicContact CE1-CG2 4.39Å; F92-T156 HydrophobicContact CZ-CG2 4.2Å; F92-I159 HydrophobicContact CE2-CB 4.21Å; F92-I159 HydrophobicContact CE2-CG1 4.11Å; F92-I159 HydrophobicContact CE2-CG2 4.19Å; F92-I159 HydrophobicContact CZ-CB 4.27Å; F92-I159 HydrophobicContact CZ-CG2 3.81Å
93	V	96.1	Very high	92.9	Very high	2 Å²	2	71.5 Å²	71.5	1%	0.012	34%	0.344	C	S	.	.	S	Bend	trans	-74.8	99.8	169.4	179.8	0	0	0	0	108.4	E98 G107 Y127 V219	V93-E98 HydrophobicContact CG1-CG 4.13Å; V93-E98 WeakPolarHBondContact CG1-OE2 3.29Å; V93-G107 PolarHBondContact N-O 3.36Å; V93-Y127 HydrophobicContact CG2-CD1 3.99Å; V93-Y127 HydrophobicContact CG2-CE1 4.44Å; V93-V219 HydrophobicContact CB-CG1 4.28Å; V93-V219 HydrophobicContact CG1-CG1 3.39Å; V93-V219 HydrophobicContact CG2-CG1 3.84Å
94	E	93.2	Very high	92.7	Very high	33 Å²	33	70.3 Å²	70.3	15%	0.154	34%	0.338	C	S	.	.			trans	-155	163.7	177.9	63.3	179.5	-133.1	0	0	110.6	F92 E96 K97 R152	F92-E94 HydrophobicContact CB-CG 4.49Å; F92-E94 PolarHBondContact O-N 2.88Å; F92-E94 VanDerWaalsContact O-N 3.11Å; E94-E96 PolarHBondContact O-N 3.44Å; E94-K97 PolarHBondContact O-N 2.92Å; E94-K97 VanDerWaalsContact O-N 3.16Å; E94-R152 IonicContact OE1-NH2 2.77Å; E94-R152 PolarHBondContact OE1-NH2 3.48Å; E94-R152 IonicContact OE2-CZ 2.64Å; E94-R152 IonicContact OE2-NE 3.75Å; E94-R152 PolarHBondContact OE2-NE 2.81Å; E94-R152 IonicContact OE2-NH2 3.15Å; E94-R152 PolarHBondContact OE2-NH2 3.25Å
95	K	90.6	Very high	92.6	Very high	160 Å²	160	72.5 Å²	72.5	70%	0.696	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	55.8	-126.4	175.2	-54.9	166.8	-177.1	135.7	0	111.4	K97 E98	K95-K97 PolarHBondContact O-N 2.73Å; K95-E98 PolarHBondContact O-N 3.34Å
96	E	90.4	Very high	92.6	Very high	179 Å²	179	69.7 Å²	69.7	84%	0.836	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-64.7	-12	-179	68.3	-158.8	-179.3	0	0	114.9	E94	E94-E96 PolarHBondContact O-N 3.44Å
97	K	89.9	Confident	92.6	Very high	88 Å²	88	61.7 Å²	61.7	38%	0.383	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-91.7	-6.3	179.3	-65	178.9	178.4	172.6	0	113.5	D91 E94 K95 V219	D91-K97 IonicContact OD1-NZ 3.41Å; D91-K97 IonicContact OD2-NZ 3.52Å; D91-K97 PolarHBondContact OD2-NZ 3.19Å; E94-K97 PolarHBondContact O-N 2.92Å; E94-K97 VanDerWaalsContact O-N 3.16Å; K95-K97 PolarHBondContact O-N 2.73Å; K97-V219 WeakPolarHBondContact O-CG1 3.32Å
98	E	88.2	Confident	92.6	Very high	13 Å²	13	60.3 Å²	60.3	6%	0.061	30%	0.299	C	S	.	.	S	Bend	trans	-75.7	139.1	176.2	-71.5	-94.4	-144	0	0	111.1	V93 K95 E102 T104 N105 R129	V93-E98 HydrophobicContact CG1-CG 4.13Å; V93-E98 WeakPolarHBondContact CG1-OE2 3.29Å; K95-E98 PolarHBondContact O-N 3.34Å; E98-E102 WeakPolarHBondContact CB-O 3.37Å; E98-E102 VanDerWaalsContact CG-O 3.3Å; E98-E102 WeakPolarHBondContact CG-O 3.25Å; E98-T104 VanDerWaalsContact OE1-CA 3.29Å; E98-T104 WeakPolarHBondContact OE1-CA 3.24Å; E98-T104 WeakPolarHBondContact OE1-CB 3.42Å; E98-T104 PolarHBondContact OE1-N 2.82Å; E98-T104 PolarHBondContact OE1-OG1 2.71Å; E98-T104 PolarHBondContact OE2-OG1 2.81Å; E98-N105 PolarHBondContact OE1-N 2.98Å; E98-R129 IonicContact OE2-CZ 2.67Å; E98-R129 IonicContact OE2-NH2 2.7Å; E98-R129 PolarHBondContact OE2-NH2 2.78Å
99	P	84.7	Confident	92.6	Very high	21 Å²	21	59.3 Å²	59.3	14%	0.136	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-67.4	151.3	173.4	31.4	-33.3	0	0	0	109.9	N101 E102 V219	P99-N101 PolarHBondContact O-N 2.92Å; P99-E102 WeakPolarHBondContact O-CB 3.16Å; P99-E102 PolarHBondContact O-N 2.9Å; P99-V219 HydrophobicContact CG-CG1 4.5Å
100	N	83.6	Confident	92.6	Very high	119 Å²	119	56.7 Å²	56.7	64%	0.636	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	55.8	20.9	169.3	-50.4	-25.9	0	0	0	115.9	E102	N100-E102 HydrophobicContact CB-CG 4.36Å; N100-E102 PolarHBondContact O-N 2.9Å
101	N	79.7	Confident	92.7	Very high	151 Å²	151	56.9 Å²	56.9	81%	0.807	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	58.9	24.2	-170.9	-66.8	-36.6	0	0	0	114.7	P99	P99-N101 PolarHBondContact O-N 2.92Å
102	E	85.6	Confident	92.8	Very high	61 Å²	61	55.4 Å²	55.4	29%	0.285	26%	0.264	S	S	.	.			trans	-66.5	152.9	172.8	-68.1	175.8	-157.9	0	0	111.6	E98 P99 N100 T104	E98-E102 WeakPolarHBondContact CB-O 3.37Å; E98-E102 VanDerWaalsContact CG-O 3.3Å; E98-E102 WeakPolarHBondContact CG-O 3.25Å; P99-E102 WeakPolarHBondContact O-CB 3.16Å; P99-E102 PolarHBondContact O-N 2.9Å; N100-E102 HydrophobicContact CB-CG 4.36Å; N100-E102 PolarHBondContact O-N 2.9Å; E102-T104 HydrophobicContact CB-CG2 3.89Å
103	K	91.2	Very high	92.8	Very high	182 Å²	182	56.4 Å²	56.4	79%	0.791	27%	0.269	S	S	*	.			trans	-119.1	64.2	176.8	-67.4	-176.1	-179.8	177.3	0	109.8
104	T	95.1	Very high	92.9	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.006	27%	0.268	C	S	.	.			trans	-81.6	-31.7	-177.7	77.3	0	0	0	0	112.1	E98 E102 N106 R129 A138 V140 Y141	E98-T104 VanDerWaalsContact OE1-CA 3.29Å; E98-T104 WeakPolarHBondContact OE1-CA 3.24Å; E98-T104 WeakPolarHBondContact OE1-CB 3.42Å; E98-T104 PolarHBondContact OE1-N 2.82Å; E98-T104 PolarHBondContact OE1-OG1 2.71Å; E98-T104 PolarHBondContact OE2-OG1 2.81Å; E102-T104 HydrophobicContact CB-CG2 3.89Å; T104-N106 PolarHBondContact O-N 3.1Å; T104-N106 WeakPolarHBondContact OG1-CB 3.45Å; T104-N106 PolarHBondContact OG1-N 3.2Å; T104-N106 VanDerWaalsContact OG1-N 3.12Å; T104-R129 PolarHBondContact OG1-NH2 2.87Å; T104-A138 HydrophobicContact CG2-CB 4.07Å; T104-V140 HydrophobicContact CG2-CG2 4.35Å; T104-Y141 PolarHBondContact O-N 2.8Å
105	N	96.3	Very high	93.1	Very high	50 Å²	50	56 Å²	56	27%	0.267	27%	0.267	S	S	.	.			trans	46.5	42.1	-165.7	-64.1	-17.1	0	0	0	111.4	E98 C151 R152 V153	E98-N105 PolarHBondContact OE1-N 2.98Å; N105-C151 VanDerWaalsContact CB-O 3.24Å; N105-C151 WeakPolarHBondContact CB-O 3.45Å; N105-C151 PolarHBondContact ND2-O 2.86Å; N105-R152 HydrophobicContact CB-CG 4.44Å; N105-R152 CarbonylContact O-C 3.48Å; N105-R152 VanDerWaalsContact O-CA 3.23Å; N105-R152 WeakPolarHBondContact O-CA 3.43Å; N105-R152 WeakPolarHBondContact O-CB 3.24Å; N105-V153 PolarHBondContact O-N 2.97Å
106	N	97.5	Very high	93.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.235	C	C	.	.			trans	-131.5	96	-170.4	173.9	16.2	0	0	0	110.5	T104 R129 L130 I139 V153	T104-N106 PolarHBondContact O-N 3.1Å; T104-N106 WeakPolarHBondContact OG1-CB 3.45Å; T104-N106 PolarHBondContact OG1-N 3.2Å; T104-N106 VanDerWaalsContact OG1-N 3.12Å; N106-R129 PolarHBondContact O-NE 3.12Å; N106-R129 PolarHBondContact O-NH2 2.97Å; N106-L130 PolarHBondContact ND2-O 2.86Å; N106-L130 PolarHBondContact OD1-N 2.91Å; N106-I139 WeakPolarHBondContact CB-O 3.41Å; N106-I139 PolarHBondContact ND2-N 2.98Å; N106-I139 VanDerWaalsContact ND2-N 3.13Å; N106-I139 PolarHBondContact ND2-O 2.93Å; N106-V153 HydrophobicContact CB-CB 3.66Å; N106-V153 HydrophobicContact CB-CG1 4.33Å; N106-V153 HydrophobicContact CB-CG2 3.64Å
107	G	97.2	Very high	93.6	Very high	2 Å²	2	43.6 Å²	43.6	2%	0.021	22%	0.22	C	C	.	.			trans	161.7	156.7	165.7	0	0	0	0	0	111.2	F92 V93 V128	F92-G107 WeakPolarHBondContact CA-O 3.41Å; V93-G107 PolarHBondContact N-O 3.36Å; G107-V128 CarbonylContact C-O 3.56Å; G107-V128 VanDerWaalsContact CA-O 3.25Å; G107-V128 WeakPolarHBondContact CA-O 3.34Å
108	I	98.3	Very high	93.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.9	171.3	-64.4	165.5	0	0	0	108.1	F89 F92 Y110 Y127 V128 L154 T156 L192	F89-I108 HydrophobicContact CD2-CG2 3.57Å; F89-I108 HydrophobicContact CE2-CG2 3.65Å; F92-I108 HydrophobicContact CD1-CD1 4.44Å; F92-I108 HydrophobicContact CD1-CG1 3.64Å; F92-I108 HydrophobicContact CE1-CD1 3.99Å; F92-I108 HydrophobicContact CE1-CG1 3.67Å; I108-Y110 HydrophobicContact CB-CE2 3.9Å; I108-Y110 HydrophobicContact CG2-CD1 4.44Å; I108-Y110 HydrophobicContact CG2-CD2 4.04Å; I108-Y110 HydrophobicContact CG2-CE1 3.85Å; I108-Y110 HydrophobicContact CG2-CE2 3.42Å; I108-Y110 VanDerWaalsContact CG2-CE2 3.42Å; I108-Y127 WeakPolarHBondContact O-CA 3.29Å; I108-V128 PolarHBondContact N-O 2.76Å; I108-V128 PolarHBondContact O-N 2.77Å; I108-L154 HydrophobicContact CD1-CB 3.8Å; I108-L154 HydrophobicContact CG1-CB 4.16Å; I108-T156 HydrophobicContact CD1-CG2 3.94Å; I108-L192 HydrophobicContact CD1-CD1 4.34Å; I108-L192 HydrophobicContact CD1-CD2 3.28Å; I108-L192 HydrophobicContact CD1-CG 4.41Å
109	H	98.2	Very high	94	Very high	18 Å²	18	44.8 Å²	44.8	8%	0.083	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126.6	179.3	178.1	-150.9	0	0	0	109.6	V90 D91 D125 Y127	V90-H109 HydrophobicContact CB-CB 4.5Å; V90-H109 PolarHBondContact N-O 2.91Å; D91-H109 PolarHBondContact N-O 2.97Å; D91-H109 PolarHBondContact O-N 2.97Å; D91-H109 VanDerWaalsContact OD1-CB 3.3Å; D91-H109 WeakPolarHBondContact OD1-CB 3.23Å; D91-H109 IonicContact OD1-CG 3.58Å; D91-H109 IonicContact OD1-ND1 2.72Å; D91-H109 PolarHBondContact OD1-ND1 2.86Å; D91-H109 IonicContact OD2-ND1 2.82Å; D91-H109 PolarHBondContact OD2-ND1 2.76Å; H109-D125 IonicContact NE2-OD1 3.44Å; H109-D125 PolarHBondContact NE2-OD1 2.84Å; H109-Y127 HydrophobicContact CB-CD1 4.03Å; H109-Y127 HydrophobicContact CB-CE1 3.72Å; H109-Y127 AromaticContact CD2-CE1 3.37Å; H109-Y127 WeakPolarHBondContact CD2-CE1 3.47Å; H109-Y127 AromaticContact CD2-CZ 3.38Å; H109-Y127 AromaticContact CG-CE1 3.54Å; H109-Y127 AromaticContact CG-CZ 3.96Å; H109-Y127 AromaticContact NE2-CZ 3.7Å; H109-Y127 PolarHBondContact NE2-OH 3.31Å
110	Y	98.6	Very high	94.5	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	151.9	178.4	-63.5	-75.8	0	0	0	110.4	A88 F89 I108 D125 L126 V128 S178 P180 F190 L192	A88-Y110 CarbonylContact O-C 3.58Å; A88-Y110 VanDerWaalsContact O-CA 3.26Å; A88-Y110 WeakPolarHBondContact O-CA 3.28Å; F89-Y110 HydrophobicContact CB-CD1 4.27Å; F89-Y110 HydrophobicContact CB-CE1 4.11Å; F89-Y110 HydrophobicContact CD2-CE1 4.24Å; I108-Y110 HydrophobicContact CB-CE2 3.9Å; I108-Y110 HydrophobicContact CG2-CD1 4.44Å; I108-Y110 HydrophobicContact CG2-CD2 4.04Å; I108-Y110 HydrophobicContact CG2-CE1 3.85Å; I108-Y110 HydrophobicContact CG2-CE2 3.42Å; I108-Y110 VanDerWaalsContact CG2-CE2 3.42Å; Y110-D125 CarbonylContact O-C 3.49Å; Y110-D125 WeakPolarHBondContact O-CA 3.32Å; Y110-L126 PolarHBondContact N-O 3.34Å; Y110-L126 PolarHBondContact O-N 2.63Å; Y110-V128 HydrophobicContact CD2-CG2 4.06Å; Y110-V128 HydrophobicContact CE2-CB 4.22Å; Y110-V128 HydrophobicContact CE2-CG2 3.79Å; Y110-S178 WeakPolarHBondContact CE1-O 3.23Å; Y110-P180 HydrophobicContact CD1-CG 3.59Å; Y110-P180 HydrophobicContact CE1-CG 3.68Å; Y110-P180 HydrophobicContact CG-CG 4.1Å; Y110-F190 HydrophobicContact CD2-CD1 4.26Å; Y110-F190 AromaticContact CD2-CE1 3.77Å; Y110-F190 HydrophobicContact CD2-CE1 3.77Å; Y110-F190 AromaticContact CE2-CD1 3.69Å; Y110-F190 HydrophobicContact CE2-CD1 3.69Å; Y110-F190 AromaticContact CE2-CE1 3.69Å; Y110-F190 HydrophobicContact CE2-CE1 3.69Å; Y110-F190 HydrophobicContact CG-CE1 4.24Å; Y110-F190 AromaticContact CZ-CD1 3.85Å; Y110-L192 WeakPolarHBondContact OH-CD2 3.45Å
111	K	98.2	Very high	95.1	Very high	67 Å²	67	43.7 Å²	43.7	29%	0.291	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.5	170.3	-144.6	167.8	-165.5	-153.5	0	110.1	T87 A88 V90 E123 D125	T87-K111 CarbonylContact C-O 3.54Å; T87-K111 WeakPolarHBondContact CA-O 3.47Å; A88-K111 PolarHBondContact N-O 2.86Å; A88-K111 PolarHBondContact O-N 3.42Å; V90-K111 HydrophobicContact CG2-CB 3.75Å; K111-E123 HydrophobicContact CD-CG 4.09Å; K111-E123 VanDerWaalsContact CD-OE1 3.28Å; K111-E123 WeakPolarHBondContact CD-OE1 3.07Å; K111-E123 VanDerWaalsContact CE-OE1 3.23Å; K111-E123 WeakPolarHBondContact CE-OE1 3.45Å; K111-E123 WeakPolarHBondContact CE-OE2 3.12Å; K111-E123 HydrophobicContact CG-CG 4.03Å; K111-E123 IonicContact NZ-OE1 2.71Å; K111-E123 PolarHBondContact NZ-OE1 2.72Å; K111-E123 IonicContact NZ-OE2 3.15Å; K111-E123 PolarHBondContact NZ-OE2 3.35Å; K111-D125 WeakPolarHBondContact CE-OD1 3.38Å
112	L	98.2	Very high	95.9	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	135.1	-177.9	-52.4	-179.4	0	0	0	109.9	L74 R86 T87 L114 E123 Q124 L126 L188	L74-L112 HydrophobicContact CD1-CD1 3.92Å; R86-L112 WeakPolarHBondContact O-CA 3.25Å; T87-L112 HydrophobicContact CG2-CD2 3.79Å; L112-L114 HydrophobicContact CB-CD2 3.84Å; L112-L114 HydrophobicContact CB-CG 4.07Å; L112-L114 HydrophobicContact CD1-CD2 4.12Å; L112-E123 WeakPolarHBondContact O-CA 3.37Å; L112-Q124 PolarHBondContact N-O 3.31Å; L112-Q124 PolarHBondContact O-N 3.19Å; L112-L126 HydrophobicContact CD1-CB 4.06Å; L112-L126 HydrophobicContact CD1-CD1 4.36Å; L112-L126 HydrophobicContact CD1-CD2 4.16Å; L112-L126 HydrophobicContact CD1-CG 4.41Å; L112-L126 HydrophobicContact CG-CB 4.28Å; L112-L188 HydrophobicContact CD1-CD1 3.83Å; L112-L188 HydrophobicContact CD2-CD1 3.83Å
113	Q	98	Very high	96.5	Very high	36 Å²	36	37.7 Å²	37.7	17%	0.168	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	114.2	162.5	-172.6	178.1	-38.7	0	0	107.8	V36 E85 R86 T122	V36-Q113 HydrophobicContact CG2-CG 4.49Å; E85-Q113 HydrophobicContact CB-CB 4.5Å; E85-Q113 HydrophobicContact CB-CG 4.33Å; E85-Q113 PolarHBondContact N-O 2.73Å; E85-Q113 PolarHBondContact OE2-NE2 3.43Å; R86-Q113 HydrophobicContact CB-CB 3.82Å; R86-Q113 HydrophobicContact CG-CB 4.32Å; R86-Q113 PolarHBondContact N-O 2.92Å; R86-Q113 PolarHBondContact O-N 2.87Å; Q113-T122 WeakPolarHBondContact CA-O 3.31Å
114	L	97.8	Very high	96.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	145.4	-174.1	-58.9	178.5	0	0	0	110.7	L49 L74 V82 E83 I84 L112 Y116 R121 T122 Q124	L49-L114 HydrophobicContact CD1-CD1 4.01Å; L49-L114 HydrophobicContact CD2-CD1 3.93Å; L49-L114 HydrophobicContact CG-CD1 3.95Å; L74-L114 HydrophobicContact CD1-CD2 4.01Å; V82-L114 HydrophobicContact CG1-CB 3.84Å; V82-L114 HydrophobicContact CG1-CD1 4.27Å; V82-L114 HydrophobicContact CG1-CD2 4.18Å; V82-L114 HydrophobicContact CG1-CG 4.32Å; E83-L114 CarbonylContact O-C 3.52Å; E83-L114 WeakPolarHBondContact O-CA 3.46Å; I84-L114 HydrophobicContact CB-CD2 4.36Å; I84-L114 HydrophobicContact CG1-CD2 3.79Å; I84-L114 HydrophobicContact CG2-CD2 4.21Å; L112-L114 HydrophobicContact CB-CD2 3.84Å; L112-L114 HydrophobicContact CB-CG 4.07Å; L112-L114 HydrophobicContact CD1-CD2 4.12Å; L114-Y116 HydrophobicContact CB-CE2 3.99Å; L114-Y116 HydrophobicContact CD1-CE2 4.44Å; L114-R121 CarbonylContact O-C 3.59Å; L114-R121 VanDerWaalsContact O-CA 3.22Å; L114-R121 WeakPolarHBondContact O-CA 3.46Å; L114-T122 PolarHBondContact N-O 2.82Å; L114-T122 PolarHBondContact O-N 2.71Å; L114-Q124 HydrophobicContact CD1-CB 3.59Å; L114-Q124 HydrophobicContact CD1-CG 3.88Å; L114-Q124 HydrophobicContact CG-CB 4.22Å
115	L	97.4	Very high	96.9	Very high	26 Å²	26	32.4 Å²	32.4	14%	0.136	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119	171	175.2	63.5	0	0	0	108.9	E83 E85 R121	E83-L115 HydrophobicContact CB-CB 4.13Å; E83-L115 HydrophobicContact CG-CB 4.28Å; E83-L115 PolarHBondContact N-O 3.29Å; E83-L115 PolarHBondContact O-N 2.87Å; E85-L115 HydrophobicContact CG-CB 4.22Å; L115-R121 HydrophobicContact CD1-CG 3.81Å
116	Y	96.7	Very high	97	Very high	7 Å²	7	30 Å²	30	3%	0.027	16%	0.163	C	C	.	.			trans	-87.5	161.1	179.2	-70.2	-98.9	0	0	0	111.5	V47 G48 L49 D76 V82 L114 N118 G119 V120 T122	V47-Y116 HydrophobicContact CG1-CD1 3.62Å; V47-Y116 HydrophobicContact CG1-CD2 3.6Å; V47-Y116 HydrophobicContact CG1-CE1 3.85Å; V47-Y116 HydrophobicContact CG1-CE2 3.85Å; V47-Y116 HydrophobicContact CG1-CG 3.48Å; V47-Y116 VanDerWaalsContact CG1-CG 3.48Å; G48-Y116 WeakPolarHBondContact CA-OH 3.15Å; L49-Y116 PolarHBondContact N-OH 3.13Å; D76-Y116 HydrophobicContact CB-CD1 3.66Å; D76-Y116 HydrophobicContact CB-CE1 3.66Å; V82-Y116 HydrophobicContact CG1-CD1 4.25Å; V82-Y116 HydrophobicContact CG1-CD2 4.41Å; V82-Y116 HydrophobicContact CG1-CE1 4.13Å; V82-Y116 HydrophobicContact CG1-CE2 4.27Å; V82-Y116 HydrophobicContact CG1-CG 4.39Å; V82-Y116 HydrophobicContact CG2-CD1 3.83Å; V82-Y116 HydrophobicContact CG2-CE1 3.72Å; L114-Y116 HydrophobicContact CB-CE2 3.99Å; L114-Y116 HydrophobicContact CD1-CE2 4.44Å; Y116-N118 VanDerWaalsContact CB-OD1 3.32Å; Y116-N118 WeakPolarHBondContact CB-OD1 3.35Å; Y116-N118 PolarHBondContact O-N 3.27Å; Y116-N118 VanDerWaalsContact O-N 3.1Å; Y116-G119 PolarHBondContact O-N 3.09Å; Y116-V120 PolarHBondContact N-O 2.89Å; Y116-T122 HydrophobicContact CD2-CG2 4.02Å; Y116-T122 HydrophobicContact CE2-CG2 3.54Å; Y116-T122 WeakPolarHBondContact CE2-OG1 3.3Å
117	S	94.7	Very high	97	Very high	73 Å²	73	31.5 Å²	31.5	51%	0.51	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-28.2	179	57.9	0	0	0	0	114.1	G119	S117-G119 VanDerWaalsContact C-N 3.32Å
118	N	93	Very high	97.1	Very high	89 Å²	89	31.4 Å²	31.4	48%	0.476	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	4.2	176.3	66.7	0.9	0	0	0	114.5	V47 Y116 V120	V47-N118 WeakPolarHBondContact CG2-ND2 3.47Å; Y116-N118 VanDerWaalsContact CB-OD1 3.32Å; Y116-N118 WeakPolarHBondContact CB-OD1 3.35Å; Y116-N118 PolarHBondContact O-N 3.27Å; Y116-N118 VanDerWaalsContact O-N 3.1Å; N118-V120 VanDerWaalsContact C-N 3.33Å; N118-V120 PolarHBondContact O-N 3.12Å; N118-V120 WeakPolarHBondContact OD1-CB 3.32Å; N118-V120 WeakPolarHBondContact OD1-CG2 3.32Å; N118-V120 PolarHBondContact OD1-N 3.06Å; N118-V120 VanDerWaalsContact OD1-N 3.08Å
119	G	93.8	Very high	97.1	Very high	37 Å²	37	31.4 Å²	31.4	38%	0.381	17%	0.168	S	C	.	.	S	Bend	trans	83.2	-2.3	-179.9	0	0	0	0	0	115.6	Y116 S117	Y116-G119 PolarHBondContact O-N 3.09Å; S117-G119 VanDerWaalsContact C-N 3.32Å
120	V	95	Very high	97.1	Very high	46 Å²	46	30.6 Å²	30.6	28%	0.279	16%	0.164	S	C	.	.			trans	-70.8	133.4	175.1	177.5	0	0	0	0	109.7	V47 Y116 N118 T122	V47-V120 HydrophobicContact CG1-CB 4.49Å; V47-V120 HydrophobicContact CG1-CG1 4.41Å; Y116-V120 PolarHBondContact N-O 2.89Å; N118-V120 VanDerWaalsContact C-N 3.33Å; N118-V120 PolarHBondContact O-N 3.12Å; N118-V120 WeakPolarHBondContact OD1-CB 3.32Å; N118-V120 WeakPolarHBondContact OD1-CG2 3.32Å; N118-V120 PolarHBondContact OD1-N 3.06Å; N118-V120 VanDerWaalsContact OD1-N 3.08Å; V120-T122 HydrophobicContact CG1-CG2 4.18Å
121	R	97.3	Very high	97	Very high	70 Å²	70	31 Å²	31	26%	0.264	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	135	171.2	-73.4	-179.3	172.4	74	9.9	110.7	V36 V37 E85 L114 L115	V36-R121 HydrophobicContact CG2-CB 4.18Å; V37-R121 PolarHBondContact N-O 2.92Å; E85-R121 VanDerWaalsContact CD-NE 3.29Å; E85-R121 IonicContact OE1-CZ 2.78Å; E85-R121 VanDerWaalsContact OE1-CZ 3.24Å; E85-R121 IonicContact OE1-NE 2.71Å; E85-R121 PolarHBondContact OE1-NE 2.9Å; E85-R121 IonicContact OE1-NH2 2.81Å; E85-R121 PolarHBondContact OE1-NH2 2.72Å; E85-R121 WeakPolarHBondContact OE2-CD 3.22Å; E85-R121 IonicContact OE2-CZ 2.75Å; E85-R121 IonicContact OE2-NE 3.48Å; E85-R121 PolarHBondContact OE2-NE 2.95Å; L114-R121 CarbonylContact O-C 3.59Å; L114-R121 VanDerWaalsContact O-CA 3.22Å; L114-R121 WeakPolarHBondContact O-CA 3.46Å; L115-R121 HydrophobicContact CD1-CG 3.81Å
122	T	96.9	Very high	97	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.9	174.3	77	0	0	0	0	113.2	V37 A42 Q113 L114 Y116 V120	V37-T122 CarbonylContact O-C 3.52Å; V37-T122 WeakPolarHBondContact O-CA 3.24Å; A42-T122 HydrophobicContact CB-CG2 3.43Å; A42-T122 VanDerWaalsContact CB-CG2 3.43Å; Q113-T122 WeakPolarHBondContact CA-O 3.31Å; L114-T122 PolarHBondContact N-O 2.82Å; L114-T122 PolarHBondContact O-N 2.71Å; Y116-T122 HydrophobicContact CD2-CG2 4.02Å; Y116-T122 HydrophobicContact CE2-CG2 3.54Å; Y116-T122 WeakPolarHBondContact CE2-OG1 3.3Å; V120-T122 HydrophobicContact CG1-CG2 4.18Å
123	E	97.1	Very high	96.9	Very high	86 Å²	86	29 Å²	29	40%	0.402	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	120.2	162.1	-150.4	-176	-167.4	0	0	109.1	V36 V37 A39 K111 L112	V36-E123 HydrophobicContact CG1-CB 3.94Å; V37-E123 PolarHBondContact O-N 3.36Å; A39-E123 PolarHBondContact N-O 2.72Å; A39-E123 VanDerWaalsContact N-O 3.13Å; K111-E123 HydrophobicContact CD-CG 4.09Å; K111-E123 VanDerWaalsContact CD-OE1 3.28Å; K111-E123 WeakPolarHBondContact CD-OE1 3.07Å; K111-E123 VanDerWaalsContact CE-OE1 3.23Å; K111-E123 WeakPolarHBondContact CE-OE1 3.45Å; K111-E123 WeakPolarHBondContact CE-OE2 3.12Å; K111-E123 HydrophobicContact CG-CG 4.03Å; K111-E123 IonicContact NZ-OE1 2.71Å; K111-E123 PolarHBondContact NZ-OE1 2.72Å; K111-E123 IonicContact NZ-OE2 3.15Å; K111-E123 PolarHBondContact NZ-OE2 3.35Å; L112-E123 WeakPolarHBondContact O-CA 3.37Å
124	Q	97.2	Very high	96.8	Very high	16 Å²	16	34.5 Å²	34.5	8%	0.075	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.9	-170.9	176.2	65.4	80.1	0	0	110.9	L49 L112 L114 T217	L49-Q124 HydrophobicContact CD1-CG 3.96Å; L112-Q124 PolarHBondContact N-O 3.31Å; L112-Q124 PolarHBondContact O-N 3.19Å; L114-Q124 HydrophobicContact CD1-CB 3.59Å; L114-Q124 HydrophobicContact CD1-CG 3.88Å; L114-Q124 HydrophobicContact CG-CB 4.22Å; Q124-T217 HydrophobicContact CG-CG2 4.44Å
125	D	97.5	Very high	96.6	Very high	57 Å²	57	38.8 Å²	38.8	31%	0.305	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	137.2	168.9	-56.1	-42.3	0	0	0	110	H109 Y110 K111 Y127	H109-D125 IonicContact NE2-OD1 3.44Å; H109-D125 PolarHBondContact NE2-OD1 2.84Å; Y110-D125 CarbonylContact O-C 3.49Å; Y110-D125 WeakPolarHBondContact O-CA 3.32Å; K111-D125 WeakPolarHBondContact CE-OD1 3.38Å; D125-Y127 HydrophobicContact CB-CE2 3.96Å
126	L	97.9	Very high	96.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	130.8	179.6	-169.1	92.3	0	0	0	109.9	L49 Y110 L112 F190 V215 L226	L49-L126 HydrophobicContact CD1-CD1 4.47Å; Y110-L126 PolarHBondContact N-O 3.34Å; Y110-L126 PolarHBondContact O-N 2.63Å; L112-L126 HydrophobicContact CD1-CB 4.06Å; L112-L126 HydrophobicContact CD1-CD1 4.36Å; L112-L126 HydrophobicContact CD1-CD2 4.16Å; L112-L126 HydrophobicContact CD1-CG 4.41Å; L112-L126 HydrophobicContact CG-CB 4.28Å; L126-F190 HydrophobicContact CD2-CE1 4.03Å; L126-F190 HydrophobicContact CD2-CZ 3.6Å; L126-V215 HydrophobicContact CD1-CG1 3.8Å; L126-V215 HydrophobicContact CD2-CG1 4.08Å; L126-V215 HydrophobicContact CG-CG1 4.09Å; L126-L226 HydrophobicContact CD1-CD1 3.72Å
127	Y	98.2	Very high	96.5	Very high	30 Å²	30	46.1 Å²	46.1	12%	0.118	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135	-178.6	-62.3	-89.3	0	0	0	110.6	V93 I108 H109 D125 V215 S216 T218 V219	V93-Y127 HydrophobicContact CG2-CD1 3.99Å; V93-Y127 HydrophobicContact CG2-CE1 4.44Å; I108-Y127 WeakPolarHBondContact O-CA 3.29Å; H109-Y127 HydrophobicContact CB-CD1 4.03Å; H109-Y127 HydrophobicContact CB-CE1 3.72Å; H109-Y127 AromaticContact CD2-CE1 3.37Å; H109-Y127 WeakPolarHBondContact CD2-CE1 3.47Å; H109-Y127 AromaticContact CD2-CZ 3.38Å; H109-Y127 AromaticContact CG-CE1 3.54Å; H109-Y127 AromaticContact CG-CZ 3.96Å; H109-Y127 AromaticContact NE2-CZ 3.7Å; H109-Y127 PolarHBondContact NE2-OH 3.31Å; D125-Y127 HydrophobicContact CB-CE2 3.96Å; Y127-V215 WeakPolarHBondContact O-CA 3.35Å; Y127-S216 PolarHBondContact N-O 3.14Å; Y127-S216 PolarHBondContact O-N 2.9Å; Y127-S216 VanDerWaalsContact O-N 3.1Å; Y127-T218 WeakPolarHBondContact CD2-O 3.43Å; Y127-V219 HydrophobicContact CD1-CB 4.49Å; Y127-V219 HydrophobicContact CD1-CG2 4.03Å; Y127-V219 HydrophobicContact CE1-CB 4.5Å; Y127-V219 HydrophobicContact CE1-CG2 3.58Å; Y127-V219 HydrophobicContact CE2-CG2 4.38Å
128	V	98.5	Very high	96.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	116.6	171.5	-179.3	0	0	0	0	108.6	F70 G107 I108 Y110 L154 F190 L192 V213 V214	F70-V128 HydrophobicContact CE1-CG1 4.26Å; F70-V128 HydrophobicContact CZ-CG1 3.8Å; F70-V128 HydrophobicContact CZ-CG2 4.22Å; G107-V128 CarbonylContact C-O 3.56Å; G107-V128 VanDerWaalsContact CA-O 3.25Å; G107-V128 WeakPolarHBondContact CA-O 3.34Å; I108-V128 PolarHBondContact N-O 2.76Å; I108-V128 PolarHBondContact O-N 2.77Å; Y110-V128 HydrophobicContact CD2-CG2 4.06Å; Y110-V128 HydrophobicContact CE2-CB 4.22Å; Y110-V128 HydrophobicContact CE2-CG2 3.79Å; V128-L154 HydrophobicContact CG1-CD1 4.33Å; V128-L154 WeakPolarHBondContact O-CD1 3.47Å; V128-F190 HydrophobicContact CG2-CD1 4.14Å; V128-F190 HydrophobicContact CG2-CE1 4.01Å; V128-L192 HydrophobicContact CG1-CD1 3.83Å; V128-V213 HydrophobicContact CG1-CG1 3.62Å; V128-V214 WeakPolarHBondContact CA-O 3.13Å
129	R	98	Very high	96.8	Very high	1 Å²	1	38.9 Å²	38.9	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	160	-179.9	-54.6	-171.5	70.8	-169.9	6	110.3	E98 T104 N106 V214 V219 V221	E98-R129 IonicContact OE2-CZ 2.67Å; E98-R129 IonicContact OE2-NH2 2.7Å; E98-R129 PolarHBondContact OE2-NH2 2.78Å; T104-R129 PolarHBondContact OG1-NH2 2.87Å; N106-R129 PolarHBondContact O-NE 3.12Å; N106-R129 PolarHBondContact O-NH2 2.97Å; R129-V214 PolarHBondContact N-O 2.9Å; R129-V214 VanDerWaalsContact N-O 3.09Å; R129-V214 PolarHBondContact O-N 2.67Å; R129-V219 WeakPolarHBondContact CD-O 3.44Å; R129-V219 PolarHBondContact NH1-O 2.82Å; R129-V221 HydrophobicContact CB-CG1 4.12Å; R129-V221 HydrophobicContact CG-CG1 4.37Å
130	L	98.4	Very high	96.9	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	137.2	167.4	-61.3	-169.8	0	0	0	111.3	N106 I139 V153 L154 C194 F211 Q212 V213	N106-L130 PolarHBondContact ND2-O 2.86Å; N106-L130 PolarHBondContact OD1-N 2.91Å; L130-I139 HydrophobicContact CB-CB 4.27Å; L130-I139 HydrophobicContact CB-CG1 3.87Å; L130-I139 PolarHBondContact O-N 2.83Å; L130-V153 HydrophobicContact CB-CG1 4.14Å; L130-V153 HydrophobicContact CD1-CG1 3.72Å; L130-V153 HydrophobicContact CG-CG1 4.11Å; L130-L154 HydrophobicContact CD1-CD2 3.96Å; L130-L154 HydrophobicContact CD1-CG 4.46Å; L130-L154 HydrophobicContact CD2-CD2 4.24Å; L130-L154 HydrophobicContact CG-CD1 4.17Å; L130-L154 HydrophobicContact CG-CD2 3.9Å; L130-L154 HydrophobicContact CG-CG 4.08Å; L130-C194 HydrophobicContact CD1-CB 4.32Å; L130-C194 VanDerWaalsContact CD1-SG 3.54Å; L130-F211 HydrophobicContact CD1-CB 4.36Å; L130-F211 HydrophobicContact CD1-CD2 3.8Å; L130-F211 HydrophobicContact CD1-CG 4.4Å; L130-Q212 CarbonylContact C-O 3.46Å; L130-Q212 WeakPolarHBondContact CA-O 3.25Å; L130-V213 HydrophobicContact CD2-CB 4.31Å; L130-V213 HydrophobicContact CD2-CG2 3.72Å
131	I	98	Very high	97	Very high	9 Å²	9	39.1 Å²	39.1	5%	0.046	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	162.4	169.6	66.4	173.3	0	0	0	111.5	K136 Q137 F211 Q212 V214 V221 V228	I131-K136 WeakPolarHBondContact CB-O 3.46Å; I131-K136 HydrophobicContact CD1-CB 4.35Å; I131-K136 HydrophobicContact CD1-CD 3.95Å; I131-K136 WeakPolarHBondContact CG2-O 3.46Å; I131-Q137 CarbonylContact C-O 3.06Å; I131-Q137 VanDerWaalsContact CA-O 3.29Å; I131-Q137 WeakPolarHBondContact CA-O 3.48Å; I131-F211 CarbonylContact O-C 3.46Å; I131-F211 VanDerWaalsContact O-CA 3.24Å; I131-F211 WeakPolarHBondContact O-CA 3.3Å; I131-Q212 HydrophobicContact CD1-CB 4.5Å; I131-Q212 HydrophobicContact CG1-CB 3.98Å; I131-Q212 PolarHBondContact N-O 3.16Å; I131-Q212 PolarHBondContact O-N 3.11Å; I131-V214 HydrophobicContact CB-CG2 4.11Å; I131-V214 HydrophobicContact CD1-CG2 3.48Å; I131-V214 VanDerWaalsContact CD1-CG2 3.48Å; I131-V214 HydrophobicContact CG1-CG2 3.61Å; I131-V214 HydrophobicContact CG2-CB 4.44Å; I131-V214 HydrophobicContact CG2-CG2 3.48Å; I131-V214 VanDerWaalsContact CG2-CG2 3.48Å; I131-V221 HydrophobicContact CG2-CB 4.02Å; I131-V221 HydrophobicContact CG2-CG1 4.2Å; I131-V221 HydrophobicContact CG2-CG2 4Å; I131-V228 HydrophobicContact CD1-CG1 4.17Å
132	D	97.1	Very high	96.8	Very high	13 Å²	13	39.6 Å²	39.6	7%	0.07	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	132.3	169	-161.3	-74.5	0	0	0	110.9	M134 T135 K136 Q137 I139 R209	D132-M134 PolarHBondContact O-N 2.98Å; D132-M134 PolarHBondContact OD1-N 2.73Å; D132-T135 VanDerWaalsContact CB-OG1 3.32Å; D132-T135 WeakPolarHBondContact CB-OG1 3.43Å; D132-T135 PolarHBondContact OD1-N 2.94Å; D132-K136 VanDerWaalsContact O-CA 3.26Å; D132-K136 WeakPolarHBondContact O-CA 3.26Å; D132-K136 PolarHBondContact O-N 3.43Å; D132-Q137 PolarHBondContact N-O 3Å; D132-I139 HydrophobicContact CB-CD1 3.89Å; D132-I139 VanDerWaalsContact N-CD1 3.35Å; D132-R209 VanDerWaalsContact OD2-CG 3.25Å; D132-R209 WeakPolarHBondContact OD2-CG 3.21Å; D132-R209 IonicContact OD2-CZ 2.72Å; D132-R209 IonicContact OD2-NE 3.75Å; D132-R209 PolarHBondContact OD2-NE 2.64Å; D132-R209 IonicContact OD2-NH2 3.18Å
133	S	96.5	Very high	96.5	Very high	11 Å²	11	41 Å²	41	8%	0.077	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-26.6	-179.3	62.2	0	0	0	0	113.5	K136 R210 N231	S133-K136 PolarHBondContact O-NZ 3.38Å; S133-R210 WeakPolarHBondContact CB-O 3.28Å; S133-R210 PolarHBondContact N-O 2.79Å; S133-R210 WeakPolarHBondContact OG-CB 3.5Å; S133-R210 PolarHBondContact OG-O 3.13Å; S133-N231 WeakPolarHBondContact CB-OD1 3.37Å
134	M	95	Very high	96.1	Very high	153 Å²	153	46.5 Å²	46.5	75%	0.754	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-55	-178.1	-64.7	-58.4	-63	0	0	111.9	D132	D132-M134 PolarHBondContact O-N 2.98Å; D132-M134 PolarHBondContact OD1-N 2.73Å
135	T	95.4	Very high	95.8	Very high	90 Å²	90	49 Å²	49	55%	0.552	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-11.5	-174	67.4	0	0	0	0	113.8	D132 Q137	D132-T135 VanDerWaalsContact CB-OG1 3.32Å; D132-T135 WeakPolarHBondContact CB-OG1 3.43Å; D132-T135 PolarHBondContact OD1-N 2.94Å; T135-Q137 PolarHBondContact O-N 3.19Å
136	K	95.7	Very high	95.5	Very high	98 Å²	98	56.2 Å²	56.2	43%	0.426	28%	0.282	S	S	.	.			trans	60.1	-0.2	-173.7	-51.7	-50.7	-171	-165.9	0	116	I131 D132 S133	I131-K136 WeakPolarHBondContact CB-O 3.46Å; I131-K136 HydrophobicContact CD1-CB 4.35Å; I131-K136 HydrophobicContact CD1-CD 3.95Å; I131-K136 WeakPolarHBondContact CG2-O 3.46Å; D132-K136 VanDerWaalsContact O-CA 3.26Å; D132-K136 WeakPolarHBondContact O-CA 3.26Å; D132-K136 PolarHBondContact O-N 3.43Å; S133-K136 PolarHBondContact O-NZ 3.38Å
137	Q	95.1	Very high	95.2	Very high	88 Å²	88	59 Å²	59	41%	0.411	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-70.4	150.5	176.5	-65.1	-65.3	-75	0	0	111.9	I131 D132 T135 I139 D222	I131-Q137 CarbonylContact C-O 3.06Å; I131-Q137 VanDerWaalsContact CA-O 3.29Å; I131-Q137 WeakPolarHBondContact CA-O 3.48Å; D132-Q137 PolarHBondContact N-O 3Å; T135-Q137 PolarHBondContact O-N 3.19Å; Q137-I139 PolarHBondContact O-N 2.84Å; Q137-D222 PolarHBondContact NE2-OD1 3.09Å; Q137-D222 VanDerWaalsContact NE2-OD1 3.12Å
138	A	96.4	Very high	94.8	Very high	11 Å²	11	62.4 Å²	62.4	9%	0.091	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-58.9	135.8	175.1	0	0	0	0	0	111.5	T104 V140 V221	T104-A138 HydrophobicContact CG2-CB 4.07Å; A138-V140 PolarHBondContact O-N 2.92Å; A138-V221 HydrophobicContact CB-CG2 4.26Å
139	I	97.1	Very high	94.4	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-68.1	126.3	175	-57.2	-56.7	0	0	0	109.4	N106 L130 D132 Q137 V153 Q196 F211	N106-I139 WeakPolarHBondContact CB-O 3.41Å; N106-I139 PolarHBondContact ND2-N 2.98Å; N106-I139 VanDerWaalsContact ND2-N 3.13Å; N106-I139 PolarHBondContact ND2-O 2.93Å; L130-I139 HydrophobicContact CB-CB 4.27Å; L130-I139 HydrophobicContact CB-CG1 3.87Å; L130-I139 PolarHBondContact O-N 2.83Å; D132-I139 HydrophobicContact CB-CD1 3.89Å; D132-I139 VanDerWaalsContact N-CD1 3.35Å; Q137-I139 PolarHBondContact O-N 2.84Å; I139-V153 HydrophobicContact CB-CG1 4.25Å; I139-V153 HydrophobicContact CB-CG2 4.48Å; I139-V153 HydrophobicContact CG2-CG1 4.06Å; I139-V153 HydrophobicContact CG2-CG2 4.04Å; I139-V153 WeakPolarHBondContact O-CG2 3.45Å; I139-Q196 HydrophobicContact CG2-CB 4.4Å; I139-Q196 HydrophobicContact CG2-CG 3.78Å; I139-F211 HydrophobicContact CD1-CD1 3.37Å; I139-F211 HydrophobicContact CD1-CE1 3.42Å; I139-F211 VanDerWaalsContact CD1-CE1 3.42Å; I139-F211 HydrophobicContact CD1-CG 4.25Å; I139-F211 HydrophobicContact CD1-CZ 4.29Å; I139-F211 HydrophobicContact CG1-CD1 3.69Å; I139-F211 HydrophobicContact CG1-CE1 3.86Å; I139-F211 HydrophobicContact CG1-CG 4.08Å; I139-F211 HydrophobicContact CG1-CZ 4.35Å; I139-F211 HydrophobicContact CG2-CE1 4.06Å; I139-F211 HydrophobicContact CG2-CE2 4.33Å; I139-F211 HydrophobicContact CG2-CZ 3.85Å
140	V	96.6	Very high	94	Very high	62 Å²	62	67.4 Å²	67.4	38%	0.376	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-84.6	140.4	170.8	179	0	0	0	0	110	T104 A138 E142	T104-V140 HydrophobicContact CG2-CG2 4.35Å; A138-V140 PolarHBondContact O-N 2.92Å; V140-E142 HydrophobicContact CG1-CG 4.39Å
141	Y	96.8	Very high	93.9	Very high	26 Å²	26	68.6 Å²	68.6	10%	0.102	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-75	119.8	167.5	-178.8	-96.2	0	0	0	110.6	T104 G143 M150 C151 R152 N195	T104-Y141 PolarHBondContact O-N 2.8Å; Y141-G143 WeakPolarHBondContact CE1-O 3.19Å; Y141-M150 PolarHBondContact OH-O 2.88Å; Y141-C151 HydrophobicContact CD1-CB 4.2Å; Y141-C151 HydrophobicContact CE1-CB 3.78Å; Y141-R152 VanDerWaalsContact CD2-O 3.23Å; Y141-R152 WeakPolarHBondContact CD2-O 3.02Å; Y141-N195 HydrophobicContact CE2-CB 4.39Å
142	E	94.3	Very high	93.9	Very high	80 Å²	80	69.3 Å²	69.3	37%	0.374	36%	0.356	S	S	.	.			trans	-115.9	10.3	-174.8	-60.3	174.1	140.7	0	0	112.2	V140 K200 R209	V140-E142 HydrophobicContact CG1-CG 4.39Å; E142-K200 WeakPolarHBondContact OE1-CE 3.45Å; E142-K200 IonicContact OE1-NZ 3.24Å; E142-K200 PolarHBondContact OE1-NZ 3.15Å; E142-K200 WeakPolarHBondContact OE2-CD 3.48Å; E142-K200 WeakPolarHBondContact OE2-CE 2.94Å; E142-K200 IonicContact OE2-NZ 2.92Å; E142-K200 PolarHBondContact OE2-NZ 3.24Å; E142-R209 IonicContact OE2-NH1 2.71Å
143	G	90.3	Very high	93.9	Very high	28 Å²	28	68.7 Å²	68.7	29%	0.289	35%	0.353	S	S	.	.			trans	-77.9	155.9	-178.6	0	0	0	0	0	113.5	Y141	Y141-G143 WeakPolarHBondContact CE1-O 3.19Å
144	Q	89.1	Confident	94	Very high	202 Å²	202	68.2 Å²	68.2	94%	0.944	35%	0.349	S	S	*	.			trans	-113.5	75.7	170.9	-66.3	179.4	-9.1	0	0	108.7
145	D	90.1	Very high	94.1	Very high	70 Å²	70	60.9 Å²	60.9	37%	0.374	31%	0.314	S	S	.	.			trans	-89.1	148.6	171.4	-152.4	-51.6	0	0	0	110.3	N147 M150	D145-N147 PolarHBondContact OD1-N 3.33Å; D145-M150 HydrophobicContact CB-CB 3.94Å; D145-M150 VanDerWaalsContact CG-CB 3.5Å; D145-M150 VanDerWaalsContact OD2-CB 3.32Å; D145-M150 WeakPolarHBondContact OD2-CB 3.29Å
146	K	92	Very high	94.2	Very high	208 Å²	208	56.7 Å²	56.7	90%	0.904	29%	0.288	S	S	*	.	S	Bend	trans	-82.4	-23.1	175.7	-65.7	-171.8	178.9	-173	0	112
147	N	90	Very high	94.2	Very high	59 Å²	59	52.7 Å²	52.7	32%	0.316	27%	0.27	S	S	.	.	S	Bend	trans	-89.4	116.1	172.9	-177.7	0.5	0	0	0	109.6	D145 E149 M150	D145-N147 PolarHBondContact OD1-N 3.33Å; N147-E149 PolarHBondContact ND2-OE2 2.85Å; N147-E149 PolarHBondContact O-N 2.86Å; N147-E149 VanDerWaalsContact O-N 3.15Å; N147-E149 WeakPolarHBondContact OD1-CB 3.29Å; N147-E149 PolarHBondContact OD1-N 2.92Å; N147-M150 HydrophobicContact CB-CB 4.36Å; N147-M150 HydrophobicContact CB-CG 3.86Å; N147-M150 WeakPolarHBondContact O-CB 3.41Å; N147-M150 PolarHBondContact O-N 3.37Å
148	P	91.4	Very high	94.3	Very high	101 Å²	101	50.3 Å²	50.3	66%	0.656	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-58.4	-27	177.1	25.1	-35.4	0	0	0	113.4	M150 C151	P148-M150 PolarHBondContact O-N 2.77Å; P148-C151 WeakPolarHBondContact O-CB 3.4Å; P148-C151 PolarHBondContact O-N 3.17Å; P148-C151 VanDerWaalsContact O-N 3.15Å
149	E	89.3	Confident	94.1	Very high	75 Å²	75	51.8 Å²	51.8	35%	0.35	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-66.9	-23.2	176.9	-61.3	174.7	142.6	0	0	113.2	N147 R152 L155 I159	N147-E149 PolarHBondContact ND2-OE2 2.85Å; N147-E149 PolarHBondContact O-N 2.86Å; N147-E149 VanDerWaalsContact O-N 3.15Å; N147-E149 WeakPolarHBondContact OD1-CB 3.29Å; N147-E149 PolarHBondContact OD1-N 2.92Å; E149-R152 PolarHBondContact O-NH1 3.41Å; E149-L155 WeakPolarHBondContact O-CD2 3.47Å; E149-I159 HydrophobicContact CB-CG1 4.23Å; E149-I159 HydrophobicContact CG-CD1 4.45Å; E149-I159 HydrophobicContact CG-CG1 4.45Å
150	M	90.7	Very high	93.9	Very high	30 Å²	30	54.4 Å²	54.4	15%	0.148	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-86.3	-9.4	177.4	-62.4	-64.2	-59.7	0	0	112.6	Y141 D145 N147 P148 R152 L155 M160 N195	Y141-M150 PolarHBondContact OH-O 2.88Å; D145-M150 HydrophobicContact CB-CB 3.94Å; D145-M150 VanDerWaalsContact CG-CB 3.5Å; D145-M150 VanDerWaalsContact OD2-CB 3.32Å; D145-M150 WeakPolarHBondContact OD2-CB 3.29Å; N147-M150 HydrophobicContact CB-CB 4.36Å; N147-M150 HydrophobicContact CB-CG 3.86Å; N147-M150 WeakPolarHBondContact O-CB 3.41Å; N147-M150 PolarHBondContact O-N 3.37Å; P148-M150 PolarHBondContact O-N 2.77Å; M150-R152 PolarHBondContact O-N 2.87Å; M150-L155 HydrophobicContact CE-CD1 3.69Å; M150-L155 HydrophobicContact SD-CD1 3.96Å; M150-M160 HydrophobicContact CE-SD 4.09Å; M150-M160 HydrophobicContact SD-CG 3.78Å; M150-M160 HydrophobicContact SD-SD 4Å; M150-N195 PolarHBondContact O-ND2 3.49Å
151	C	95.6	Very high	93.8	Very high	27 Å²	27	52.3 Å²	52.3	18%	0.182	27%	0.266	C	S	.	.			trans	-80.2	45.6	-172.8	-67.1	0	0	0	0	114	N105 Y141 P148	N105-C151 VanDerWaalsContact CB-O 3.24Å; N105-C151 WeakPolarHBondContact CB-O 3.45Å; N105-C151 PolarHBondContact ND2-O 2.86Å; Y141-C151 HydrophobicContact CD1-CB 4.2Å; Y141-C151 HydrophobicContact CE1-CB 3.78Å; P148-C151 WeakPolarHBondContact O-CB 3.4Å; P148-C151 PolarHBondContact O-N 3.17Å; P148-C151 VanDerWaalsContact O-N 3.15Å
152	R	96.9	Very high	93.7	Very high	24 Å²	24	55.3 Å²	55.3	9%	0.091	29%	0.291	C	S	.	.	S	Bend	trans	-135	150.2	-174.5	-55	-176.9	175.9	108.3	-4.2	111.8	E94 N105 Y141 E149 M150 L154 L155 N195	E94-R152 IonicContact OE1-NH2 2.77Å; E94-R152 PolarHBondContact OE1-NH2 3.48Å; E94-R152 IonicContact OE2-CZ 2.64Å; E94-R152 IonicContact OE2-NE 3.75Å; E94-R152 PolarHBondContact OE2-NE 2.81Å; E94-R152 IonicContact OE2-NH2 3.15Å; E94-R152 PolarHBondContact OE2-NH2 3.25Å; N105-R152 HydrophobicContact CB-CG 4.44Å; N105-R152 CarbonylContact O-C 3.48Å; N105-R152 VanDerWaalsContact O-CA 3.23Å; N105-R152 WeakPolarHBondContact O-CA 3.43Å; N105-R152 WeakPolarHBondContact O-CB 3.24Å; Y141-R152 VanDerWaalsContact CD2-O 3.23Å; Y141-R152 WeakPolarHBondContact CD2-O 3.02Å; E149-R152 PolarHBondContact O-NH1 3.41Å; M150-R152 PolarHBondContact O-N 2.87Å; R152-L154 WeakPolarHBondContact CB-O 3.37Å; R152-L155 HydrophobicContact CB-CD2 3.86Å; R152-L155 HydrophobicContact CG-CD2 4.24Å; R152-N195 WeakPolarHBondContact O-CB 3.28Å
153	V	98	Very high	93.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.3	C	S	.	.	S	Bend	trans	-68.9	-38.6	174.3	174.9	0	0	0	0	111.7	N105 N106 L130 I139 C194 N195 Q196	N105-V153 PolarHBondContact O-N 2.97Å; N106-V153 HydrophobicContact CB-CB 3.66Å; N106-V153 HydrophobicContact CB-CG1 4.33Å; N106-V153 HydrophobicContact CB-CG2 3.64Å; L130-V153 HydrophobicContact CB-CG1 4.14Å; L130-V153 HydrophobicContact CD1-CG1 3.72Å; L130-V153 HydrophobicContact CG-CG1 4.11Å; I139-V153 HydrophobicContact CB-CG1 4.25Å; I139-V153 HydrophobicContact CB-CG2 4.48Å; I139-V153 HydrophobicContact CG2-CG1 4.06Å; I139-V153 HydrophobicContact CG2-CG2 4.04Å; I139-V153 WeakPolarHBondContact O-CG2 3.45Å; V153-C194 CarbonylContact O-C 3.56Å; V153-C194 VanDerWaalsContact O-CA 3.26Å; V153-C194 WeakPolarHBondContact O-CA 3.21Å; V153-C194 PolarHBondContact O-SG 2.99Å; V153-C194 VanDerWaalsContact O-SG 3.39Å; V153-N195 PolarHBondContact O-N 2.86Å; V153-Q196 HydrophobicContact CB-CB 4.42Å; V153-Q196 HydrophobicContact CG1-CB 4.11Å; V153-Q196 HydrophobicContact CG2-CB 4.12Å
154	L	98.3	Very high	94	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.8	177.7	-68.8	175	0	0	0	110.6	F68 I108 V128 L130 R152 L192 C194	F68-L154 HydrophobicContact CE1-CD2 4.15Å; F68-L154 HydrophobicContact CZ-CD2 3.98Å; I108-L154 HydrophobicContact CD1-CB 3.8Å; I108-L154 HydrophobicContact CG1-CB 4.16Å; V128-L154 HydrophobicContact CG1-CD1 4.33Å; V128-L154 WeakPolarHBondContact O-CD1 3.47Å; L130-L154 HydrophobicContact CD1-CD2 3.96Å; L130-L154 HydrophobicContact CD1-CG 4.46Å; L130-L154 HydrophobicContact CD2-CD2 4.24Å; L130-L154 HydrophobicContact CG-CD1 4.17Å; L130-L154 HydrophobicContact CG-CD2 3.9Å; L130-L154 HydrophobicContact CG-CG 4.08Å; R152-L154 WeakPolarHBondContact CB-O 3.37Å; L154-L192 HydrophobicContact CD1-CD1 4.25Å; L154-L192 HydrophobicContact CD2-CD1 4.21Å; L154-C194 HydrophobicContact CD2-CB 4.49Å
155	L	97.5	Very high	94.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	143.8	179.3	-63.9	172.8	0	0	0	110.3	E149 M150 R152 I159 M160 K193 N195	E149-L155 WeakPolarHBondContact O-CD2 3.47Å; M150-L155 HydrophobicContact CE-CD1 3.69Å; M150-L155 HydrophobicContact SD-CD1 3.96Å; R152-L155 HydrophobicContact CB-CD2 3.86Å; R152-L155 HydrophobicContact CG-CD2 4.24Å; L155-I159 HydrophobicContact CD2-CG2 4.42Å; L155-M160 HydrophobicContact CB-CE 4.05Å; L155-M160 HydrophobicContact CB-SD 4.25Å; L155-M160 HydrophobicContact CD1-CG 4.28Å; L155-M160 HydrophobicContact CD1-SD 3.77Å; L155-K193 HydrophobicContact CB-CB 4.43Å; L155-K193 PolarHBondContact N-O 2.91Å; L155-K193 PolarHBondContact O-N 2.85Å; L155-N195 HydrophobicContact CD1-CB 3.76Å; L155-N195 HydrophobicContact CG-CB 4.35Å
156	T	97.7	Very high	94.5	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.006	27%	0.272	C	S	.	.			trans	-89.6	167.9	166.7	61.6	0	0	0	0	110.6	F89 F92 I108 M160 S178	F89-T156 HydrophobicContact CD2-CG2 3.77Å; F89-T156 HydrophobicContact CE2-CG2 3.74Å; F92-T156 HydrophobicContact CE1-CG2 4.39Å; F92-T156 HydrophobicContact CZ-CG2 4.2Å; I108-T156 HydrophobicContact CD1-CG2 3.94Å; T156-M160 WeakPolarHBondContact O-CE 3.44Å; T156-S178 WeakPolarHBondContact CB-OG 3.23Å
157	H	96.1	Very high	94.6	Very high	14 Å²	14	51.6 Å²	51.6	7%	0.065	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-42.5	176	173.2	58.1	0	0	0	112.4	F67 I159 M160 C161 C170 N172 T176	F67-H157 HydrophobicContact CE1-CB 3.85Å; F67-H157 HydrophobicContact CZ-CB 3.78Å; F67-H157 AromaticContact CZ-ND1 3.89Å; H157-I159 PolarHBondContact O-N 2.94Å; H157-M160 PolarHBondContact O-N 2.71Å; H157-M160 VanDerWaalsContact O-N 3.14Å; H157-C161 VanDerWaalsContact CE1-CB 3.49Å; H157-C161 WeakPolarHBondContact CE1-CB 3.5Å; H157-C161 WeakPolarHBondContact O-CB 3.48Å; H157-C161 PolarHBondContact O-N 2.99Å; H157-C170 PolarHBondContact NE2-SG 2.89Å; H157-C170 VanDerWaalsContact NE2-SG 3.4Å; H157-N172 WeakPolarHBondContact CE1-CB 3.19Å; H157-N172 VanDerWaalsContact NE2-CB 3.27Å; H157-N172 WeakPolarHBondContact NE2-CB 3.03Å; H157-T176 WeakPolarHBondContact CB-O 3.45Å
158	E	95.6	Very high	94.9	Very high	39 Å²	39	54.3 Å²	54.3	18%	0.182	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-71.7	-35.5	-164	-65.3	177.3	-108.3	0	0	112.3	M160 C161 C164 C165 R173 S178	E158-M160 PolarHBondContact O-N 2.75Å; E158-C161 PolarHBondContact O-N 3.39Å; E158-C161 VanDerWaalsContact O-N 3.14Å; E158-C164 HydrophobicContact CB-CB 3.66Å; E158-C164 HydrophobicContact CG-CB 3.74Å; E158-C165 PolarHBondContact O-SG 3.38Å; E158-C165 VanDerWaalsContact O-SG 3.39Å; E158-R173 HydrophobicContact CG-CG 4.08Å; E158-R173 WeakPolarHBondContact OE2-CD 3.24Å; E158-R173 IonicContact OE2-NH1 2.74Å; E158-R173 PolarHBondContact OE2-NH1 3Å; E158-S178 WeakPolarHBondContact CB-OG 3.2Å; E158-S178 VanDerWaalsContact CD-OG 3.24Å; E158-S178 VanDerWaalsContact CG-OG 3.28Å; E158-S178 WeakPolarHBondContact CG-OG 3.11Å; E158-S178 WeakPolarHBondContact OE1-CB 3.33Å; E158-S178 PolarHBondContact OE1-N 3.15Å; E158-S178 PolarHBondContact OE1-OG 3.29Å
159	I	93.2	Very high	95.1	Very high	41 Å²	41	54.4 Å²	54.4	21%	0.21	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-63.9	-27.6	174	-164	62.7	0	0	0	112.9	F92 E149 L155 H157	F92-I159 HydrophobicContact CE2-CB 4.21Å; F92-I159 HydrophobicContact CE2-CG1 4.11Å; F92-I159 HydrophobicContact CE2-CG2 4.19Å; F92-I159 HydrophobicContact CZ-CB 4.27Å; F92-I159 HydrophobicContact CZ-CG2 3.81Å; E149-I159 HydrophobicContact CB-CG1 4.23Å; E149-I159 HydrophobicContact CG-CD1 4.45Å; E149-I159 HydrophobicContact CG-CG1 4.45Å; L155-I159 HydrophobicContact CD2-CG2 4.42Å; H157-I159 PolarHBondContact O-N 2.94Å
160	M	91.9	Very high	95.5	Very high	55 Å²	55	51.2 Å²	51.2	27%	0.271	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-89.9	-8.5	177.6	-64.1	-174.4	-79.3	0	0	113.1	F67 M150 L155 T156 H157 E158 K193	F67-M160 HydrophobicContact CE1-CE 3.87Å; F67-M160 HydrophobicContact CE2-CE 4.44Å; F67-M160 HydrophobicContact CZ-CE 3.49Å; F67-M160 VanDerWaalsContact CZ-CE 3.49Å; M150-M160 HydrophobicContact CE-SD 4.09Å; M150-M160 HydrophobicContact SD-CG 3.78Å; M150-M160 HydrophobicContact SD-SD 4Å; L155-M160 HydrophobicContact CB-CE 4.05Å; L155-M160 HydrophobicContact CB-SD 4.25Å; L155-M160 HydrophobicContact CD1-CG 4.28Å; L155-M160 HydrophobicContact CD1-SD 3.77Å; T156-M160 WeakPolarHBondContact O-CE 3.44Å; H157-M160 PolarHBondContact O-N 2.71Å; H157-M160 VanDerWaalsContact O-N 3.14Å; E158-M160 PolarHBondContact O-N 2.75Å; M160-K193 HydrophobicContact CE-CB 4.17Å; M160-K193 HydrophobicContact CE-CD 3.52Å; M160-K193 HydrophobicContact SD-CD 3.77Å
161	C	94.7	Very high	95.7	Very high	19 Å²	19	52.2 Å²	52.2	13%	0.128	28%	0.284	C	S	.	.			trans	-111.6	107.7	-166.4	-172.9	0	0	0	0	111.4	H157 E158 R163 C164 C165	H157-C161 VanDerWaalsContact CE1-CB 3.49Å; H157-C161 WeakPolarHBondContact CE1-CB 3.5Å; H157-C161 WeakPolarHBondContact O-CB 3.48Å; H157-C161 PolarHBondContact O-N 2.99Å; E158-C161 PolarHBondContact O-N 3.39Å; E158-C161 VanDerWaalsContact O-N 3.14Å; C161-R163 PolarHBondContact O-N 2.85Å; C161-C164 HydrophobicContact CB-CB 4.01Å; C161-C164 WeakPolarHBondContact O-CA 3.36Å; C161-C164 WeakPolarHBondContact O-CB 3.41Å; C161-C164 PolarHBondContact O-N 2.91Å; C161-C164 VanDerWaalsContact SG-SG 3.66Å; C161-C165 PolarHBondContact O-N 3.21Å; C161-C165 PolarHBondContact O-SG 3.39Å; C161-C165 VanDerWaalsContact O-SG 3.37Å
162	S	94.3	Very high	95.7	Very high	89 Å²	89	55.4 Å²	55.4	62%	0.622	30%	0.3	S	S	*	.	H	α-helix	trans	-50.9	-35.6	177.5	55.1	0	0	0	0	114.1	D166	S162-D166 VanDerWaalsContact O-CB 3.27Å; S162-D166 WeakPolarHBondContact O-CB 3.25Å; S162-D166 PolarHBondContact O-N 3.48Å
163	R	96.9	Very high	95.7	Very high	148 Å²	148	58.9 Å²	58.9	56%	0.558	31%	0.313	S	S	*	.	H	α-helix	trans	-64.7	-38.2	174.3	-69.5	-179.1	176.5	-107.4	-2.8	112.8	C161 K167 K168 C170	C161-R163 PolarHBondContact O-N 2.85Å; R163-K167 PolarHBondContact O-N 2.86Å; R163-K168 WeakPolarHBondContact O-CA 3.45Å; R163-K168 WeakPolarHBondContact O-CB 3.26Å; R163-K168 PolarHBondContact O-N 3.45Å; R163-C170 HydrophobicContact CB-CB 4.09Å
164	C	95.7	Very high	95.6	Very high	10 Å²	10	65 Å²	65	7%	0.068	35%	0.346	C	S	.	.	H	α-helix	trans	-75.6	-40.5	179.4	-55.9	0	0	0	0	111	E158 C161 D166 K167 C170	E158-C164 HydrophobicContact CB-CB 3.66Å; E158-C164 HydrophobicContact CG-CB 3.74Å; C161-C164 HydrophobicContact CB-CB 4.01Å; C161-C164 WeakPolarHBondContact O-CA 3.36Å; C161-C164 WeakPolarHBondContact O-CB 3.41Å; C161-C164 PolarHBondContact O-N 2.91Å; C161-C164 VanDerWaalsContact SG-SG 3.66Å; C164-D166 VanDerWaalsContact C-N 3.3Å; C164-D166 PolarHBondContact O-N 2.89Å; C164-K167 WeakPolarHBondContact O-CA 3.17Å; C164-K167 PolarHBondContact O-N 3.44Å; C164-C170 WeakPolarHBondContact SG-CB 3.34Å
165	C	93.4	Very high	95.5	Very high	69 Å²	69	71.8 Å²	71.8	47%	0.466	38%	0.377	S	S	.	.	H	α-helix	trans	-58.2	-42.4	171.6	-55.7	0	0	0	0	111.7	E158 C161 K167	E158-C165 PolarHBondContact O-SG 3.38Å; E158-C165 VanDerWaalsContact O-SG 3.39Å; C161-C165 PolarHBondContact O-N 3.21Å; C161-C165 PolarHBondContact O-SG 3.39Å; C161-C165 VanDerWaalsContact O-SG 3.37Å; C165-K167 PolarHBondContact O-N 2.93Å; C165-K167 VanDerWaalsContact O-N 3.13Å
166	D	95.4	Very high	95.4	Very high	91 Å²	91	72.6 Å²	72.6	49%	0.487	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-0.7	172.9	-74.4	-1.4	0	0	0	114.1	S162 C164 K168	S162-D166 VanDerWaalsContact O-CB 3.27Å; S162-D166 WeakPolarHBondContact O-CB 3.25Å; S162-D166 PolarHBondContact O-N 3.48Å; C164-D166 VanDerWaalsContact C-N 3.3Å; C164-D166 PolarHBondContact O-N 2.89Å; D166-K168 HydrophobicContact CB-CB 4.44Å; D166-K168 HydrophobicContact CB-CD 3.64Å; D166-K168 HydrophobicContact CB-CG 3.88Å; D166-K168 PolarHBondContact O-N 2.76Å; D166-K168 VanDerWaalsContact O-N 3.15Å; D166-K168 WeakPolarHBondContact OD2-CE 3.34Å; D166-K168 IonicContact OD2-NZ 3.53Å; D166-K168 PolarHBondContact OD2-NZ 3.16Å
167	K	94.2	Very high	95.4	Very high	192 Å²	192	73.5 Å²	73.5	84%	0.835	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	25.2	-171.9	-55.6	-172.6	179.4	-174.3	0	114.4	R163 C164 C165	R163-K167 PolarHBondContact O-N 2.86Å; C164-K167 WeakPolarHBondContact O-CA 3.17Å; C164-K167 PolarHBondContact O-N 3.44Å; C165-K167 PolarHBondContact O-N 2.93Å; C165-K167 VanDerWaalsContact O-N 3.13Å
168	K	96.4	Very high	95.5	Very high	115 Å²	115	73 Å²	73	50%	0.5	39%	0.387	S	S	.	.			trans	-85.5	158.9	175.7	-66.9	165.7	-173.1	159.7	0	110.5	R163 D166 C170	R163-K168 WeakPolarHBondContact O-CA 3.45Å; R163-K168 WeakPolarHBondContact O-CB 3.26Å; R163-K168 PolarHBondContact O-N 3.45Å; D166-K168 HydrophobicContact CB-CB 4.44Å; D166-K168 HydrophobicContact CB-CD 3.64Å; D166-K168 HydrophobicContact CB-CG 3.88Å; D166-K168 PolarHBondContact O-N 2.76Å; D166-K168 VanDerWaalsContact O-N 3.15Å; D166-K168 WeakPolarHBondContact OD2-CE 3.34Å; D166-K168 IonicContact OD2-NZ 3.53Å; D166-K168 PolarHBondContact OD2-NZ 3.16Å; K168-C170 PolarHBondContact O-N 2.87Å
169	S	95.9	Very high	95.6	Very high	103 Å²	103	74.6 Å²	74.6	72%	0.72	40%	0.396	S	S	*	.			trans	-61.9	133.4	173.5	54	0	0	0	0	111.3
170	C	96.3	Very high	95.9	Very high	8 Å²	8	72.7 Å²	72.7	5%	0.054	39%	0.387	C	S	.	.			trans	-134.1	117.6	-178.4	-173.3	0	0	0	0	110.1	H157 R163 C164 K168 N172 R173	H157-C170 PolarHBondContact NE2-SG 2.89Å; H157-C170 VanDerWaalsContact NE2-SG 3.4Å; R163-C170 HydrophobicContact CB-CB 4.09Å; C164-C170 WeakPolarHBondContact SG-CB 3.34Å; K168-C170 PolarHBondContact O-N 2.87Å; C170-N172 PolarHBondContact O-N 3.16Å; C170-R173 HydrophobicContact CB-CB 4.09Å; C170-R173 WeakPolarHBondContact O-CB 3.1Å; C170-R173 PolarHBondContact O-N 2.9Å; C170-R173 VanDerWaalsContact O-N 3.09Å
171	G	96	Very high	96.2	Very high	51 Å²	51	72.8 Å²	72.8	53%	0.526	39%	0.39	S	S	.	.	H	α-helix	trans	-61	-33	177.8	0	0	0	0	0	113	R173 N174	G171-R173 VanDerWaalsContact C-N 3.31Å; G171-R173 PolarHBondContact O-N 2.88Å; G171-N174 WeakPolarHBondContact O-CB 3.45Å; G171-N174 PolarHBondContact O-N 3.4Å
172	N	96.1	Very high	96.4	Very high	94 Å²	94	74.7 Å²	74.7	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-67.9	-27.3	175.8	-70.5	83.2	0	0	0	113.3	H157 C170 N174 E175 T176	H157-N172 WeakPolarHBondContact CE1-CB 3.19Å; H157-N172 VanDerWaalsContact NE2-CB 3.27Å; H157-N172 WeakPolarHBondContact NE2-CB 3.03Å; C170-N172 PolarHBondContact O-N 3.16Å; N172-N174 VanDerWaalsContact C-N 3.27Å; N172-N174 PolarHBondContact O-N 3.09Å; N172-E175 PolarHBondContact O-N 3.1Å; N172-T176 PolarHBondContact O-N 2.66Å; N172-T176 PolarHBondContact O-OG1 3.44Å
173	R	96.5	Very high	96.5	Very high	97 Å²	97	73.3 Å²	73.3	37%	0.366	38%	0.383	S	S	.	.	H	α-helix	trans	-67.1	-29.7	173.7	-173.4	177	69.5	174.3	5.2	112.1	E158 C170 G171 E175 T176 P177	E158-R173 HydrophobicContact CG-CG 4.08Å; E158-R173 WeakPolarHBondContact OE2-CD 3.24Å; E158-R173 IonicContact OE2-NH1 2.74Å; E158-R173 PolarHBondContact OE2-NH1 3Å; C170-R173 HydrophobicContact CB-CB 4.09Å; C170-R173 WeakPolarHBondContact O-CB 3.1Å; C170-R173 PolarHBondContact O-N 2.9Å; C170-R173 VanDerWaalsContact O-N 3.09Å; G171-R173 VanDerWaalsContact C-N 3.31Å; G171-R173 PolarHBondContact O-N 2.88Å; R173-E175 VanDerWaalsContact C-N 3.31Å; R173-T176 CarbonylContact O-C 3.56Å; R173-P177 VanDerWaalsContact O-CA 3.29Å; R173-P177 WeakPolarHBondContact O-CA 3.14Å; R173-P177 WeakPolarHBondContact O-CB 3.42Å; R173-P177 VanDerWaalsContact O-CD 3.28Å; R173-P177 WeakPolarHBondContact O-CD 3.06Å
174	N	94.9	Very high	96.5	Very high	129 Å²	129	72.1 Å²	72.1	69%	0.69	39%	0.388	S	S	*	.	H	α-helix	trans	-69.6	-31.9	176.4	-57.9	-1.6	0	0	0	111.7	G171 N172	G171-N174 WeakPolarHBondContact O-CB 3.45Å; G171-N174 PolarHBondContact O-N 3.4Å; N172-N174 VanDerWaalsContact C-N 3.27Å; N172-N174 PolarHBondContact O-N 3.09Å
175	E	96.2	Very high	96.6	Very high	142 Å²	142	78.6 Å²	78.6	66%	0.664	41%	0.411	S	S	*	.	H	α-helix	trans	-85.1	-36.4	178.9	-62.9	-65.7	149.3	0	0	112.8	N172 R173 F191	N172-E175 PolarHBondContact O-N 3.1Å; R173-E175 VanDerWaalsContact C-N 3.31Å; E175-F191 WeakPolarHBondContact O-CE1 3.22Å; E175-F191 WeakPolarHBondContact O-CZ 3.29Å
176	T	97	Very high	96.8	Very high	17 Å²	17	78.7 Å²	78.7	10%	0.104	40%	0.404	C	S	.	.	S	Bend	trans	-138.3	73.5	-177.6	58.1	0	0	0	0	110.1	F67 H157 N172 R173 F191	F67-T176 HydrophobicContact CB-CG2 4.05Å; F67-T176 HydrophobicContact CD1-CG2 4.19Å; F67-T176 HydrophobicContact CD2-CG2 4.3Å; F67-T176 HydrophobicContact CG-CG2 3.92Å; H157-T176 WeakPolarHBondContact CB-O 3.45Å; N172-T176 PolarHBondContact O-N 2.66Å; N172-T176 PolarHBondContact O-OG1 3.44Å; R173-T176 CarbonylContact O-C 3.56Å; T176-F191 HydrophobicContact CG2-CB 4.29Å; T176-F191 HydrophobicContact CG2-CD1 3.92Å; T176-F191 HydrophobicContact CG2-CG 4.41Å
177	P	97.5	Very high	96.9	Very high	21 Å²	21	77.3 Å²	77.3	14%	0.136	39%	0.394	C	S	.	.			trans	-67.6	156.2	174.4	28.2	-34.9	0	0	0	111.2	R173 V181 F191	R173-P177 VanDerWaalsContact O-CA 3.29Å; R173-P177 WeakPolarHBondContact O-CA 3.14Å; R173-P177 WeakPolarHBondContact O-CB 3.42Å; R173-P177 VanDerWaalsContact O-CD 3.28Å; R173-P177 WeakPolarHBondContact O-CD 3.06Å; P177-V181 HydrophobicContact CG-CG2 3.56Å; P177-F191 HydrophobicContact CG-CD2 4.05Å; P177-F191 HydrophobicContact CG-CE2 4.2Å
178	S	97.8	Very high	97.1	Very high	4 Å²	4	68.2 Å²	68.2	3%	0.028	35%	0.354	C	S	.	.	S	Bend	trans	-73	-40.7	170.6	-47.9	0	0	0	0	110.8	Y110 T156 E158	Y110-S178 WeakPolarHBondContact CE1-O 3.23Å; T156-S178 WeakPolarHBondContact CB-OG 3.23Å; E158-S178 WeakPolarHBondContact CB-OG 3.2Å; E158-S178 VanDerWaalsContact CD-OG 3.24Å; E158-S178 VanDerWaalsContact CG-OG 3.28Å; E158-S178 WeakPolarHBondContact CG-OG 3.11Å; E158-S178 WeakPolarHBondContact OE1-CB 3.33Å; E158-S178 PolarHBondContact OE1-N 3.15Å; E158-S178 PolarHBondContact OE1-OG 3.29Å
179	D	98	Very high	97.2	Very high	71 Å²	71	65.3 Å²	65.3	38%	0.38	34%	0.341	S	S	.	.	S	Bend	trans	-67.1	129.1	176.4	-58.7	-32.8	0	0	0	110.8	A88 F89 V181	A88-D179 WeakPolarHBondContact CA-OD1 2.99Å; F89-D179 PolarHBondContact N-OD1 2.97Å; D179-V181 PolarHBondContact O-N 2.7Å
180	P	98.3	Very high	97.3	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.013	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-60.4	130.3	176.8	-24.4	33.2	0	0	0	111.9	T87 Y110 L188 K189 F190	T87-P180 WeakPolarHBondContact CB-O 3.36Å; T87-P180 HydrophobicContact CG2-CB 4.26Å; T87-P180 WeakPolarHBondContact CG2-O 3.48Å; T87-P180 PolarHBondContact OG1-O 3.39Å; Y110-P180 HydrophobicContact CD1-CG 3.59Å; Y110-P180 HydrophobicContact CE1-CG 3.68Å; Y110-P180 HydrophobicContact CG-CG 4.1Å; P180-L188 HydrophobicContact CB-CD2 4.38Å; P180-K189 WeakPolarHBondContact CA-O 3.25Å; P180-F190 HydrophobicContact CB-CD1 4.03Å; P180-F190 HydrophobicContact CB-CE1 3.84Å; P180-F190 HydrophobicContact CB-CE2 4.37Å; P180-F190 HydrophobicContact CB-CG 4.38Å; P180-F190 HydrophobicContact CB-CZ 4.01Å; P180-F190 HydrophobicContact CG-CD1 3.63Å; P180-F190 HydrophobicContact CG-CE1 3.34Å; P180-F190 HydrophobicContact CG-CG 4.44Å; P180-F190 HydrophobicContact CG-CZ 3.95Å
181	V	98.3	Very high	97.4	Very high	57 Å²	57	61 Å²	61	35%	0.345	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122.4	-177.7	178.7	0	0	0	0	110	P177 D179 I183 K189 F191	P177-V181 HydrophobicContact CG-CG2 3.56Å; D179-V181 PolarHBondContact O-N 2.7Å; V181-I183 HydrophobicContact CG1-CG1 4.3Å; V181-K189 HydrophobicContact CB-CB 4.41Å; V181-K189 PolarHBondContact N-O 3.34Å; V181-K189 PolarHBondContact O-N 3.4Å; V181-F191 HydrophobicContact CB-CE2 4.45Å; V181-F191 HydrophobicContact CG2-CE2 3.85Å
182	I	98.3	Very high	97.6	Very high	58 Å²	58	58.7 Å²	58.7	30%	0.297	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	129.9	172.9	-54.2	161.7	0	0	0	108.9	I84 T87 F187 L188	I84-I182 HydrophobicContact CB-CD1 4.5Å; I84-I182 HydrophobicContact CB-CG1 4.33Å; I84-I182 HydrophobicContact CG2-CD1 4.15Å; I84-I182 HydrophobicContact CG2-CG1 4.16Å; T87-I182 HydrophobicContact CG2-CD1 4.08Å; T87-I182 HydrophobicContact CG2-CG1 3.75Å; I182-F187 CarbonylContact C-O 3.56Å; I182-F187 WeakPolarHBondContact CA-O 3.28Å; I182-L188 HydrophobicContact CB-CD2 4.48Å; I182-L188 HydrophobicContact CG1-CD2 3.82Å
183	I	97.7	Very high	97.6	Very high	60 Å²	60	55.1 Å²	55.1	31%	0.308	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	131.5	176.6	-57.1	171.8	0	0	0	107.4	V181 R185 F186 F187 K189	V181-I183 HydrophobicContact CG1-CG1 4.3Å; I183-R185 PolarHBondContact O-N 2.79Å; I183-F186 PolarHBondContact O-N 2.86Å; I183-F187 HydrophobicContact CB-CB 4.16Å; I183-F187 PolarHBondContact N-O 2.64Å; I183-F187 WeakPolarHBondContact O-CB 3.49Å; I183-F187 PolarHBondContact O-N 2.89Å; I183-K189 HydrophobicContact CD1-CB 3.87Å; I183-K189 HydrophobicContact CD1-CD 4Å
184	D	97.1	Very high	97.7	Very high	124 Å²	124	50.5 Å²	50.5	66%	0.663	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.2	35.7	178.4	-52	-36.4	0	0	0	114.7	F186 F187	D184-F186 VanDerWaalsContact O-CD2 3.31Å; D184-F186 WeakPolarHBondContact O-CD2 3.07Å; D184-F186 PolarHBondContact O-N 2.87Å; D184-F187 HydrophobicContact CB-CD2 4.1Å; D184-F187 HydrophobicContact CB-CE2 4.26Å
185	R	96.8	Very high	97.8	Very high	145 Å²	145	44.9 Å²	44.9	55%	0.547	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	-25.4	-179.5	-56.1	167.7	71.4	-176.2	-1.6	116.2	E83 I84 I183	E83-R185 VanDerWaalsContact CD-NE 3.34Å; E83-R185 HydrophobicContact CG-CB 4.18Å; E83-R185 IonicContact OE1-CZ 3.39Å; E83-R185 IonicContact OE1-NE 3.78Å; E83-R185 PolarHBondContact OE1-NE 2.95Å; E83-R185 IonicContact OE1-NH2 2.64Å; E83-R185 PolarHBondContact OE1-NH2 2.96Å; E83-R185 IonicContact OE2-CZ 3.59Å; E83-R185 IonicContact OE2-NE 3.47Å; E83-R185 IonicContact OE2-NH2 2.66Å; E83-R185 PolarHBondContact OE2-NH2 2.88Å; I84-R185 PolarHBondContact N-O 2.89Å; I183-R185 PolarHBondContact O-N 2.79Å
186	F	97.7	Very high	97.9	Very high	71 Å²	71	38.5 Å²	38.5	31%	0.311	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-9.3	-172.4	-63.7	-76.2	0	0	0	115.1	P81 E83 I183 D184	P81-F186 HydrophobicContact CB-CD1 3.86Å; P81-F186 HydrophobicContact CB-CE1 4.14Å; P81-F186 HydrophobicContact CG-CE1 4.39Å; E83-F186 HydrophobicContact CB-CD1 4.21Å; E83-F186 HydrophobicContact CB-CE1 3.72Å; E83-F186 HydrophobicContact CB-CZ 4.26Å; I183-F186 PolarHBondContact O-N 2.86Å; D184-F186 VanDerWaalsContact O-CD2 3.31Å; D184-F186 WeakPolarHBondContact O-CD2 3.07Å; D184-F186 PolarHBondContact O-N 2.87Å
187	F	98.3	Very high	97.8	Very high	63 Å²	63	39.5 Å²	39.5	28%	0.276	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	140.3	-177	-52.6	-65.7	0	0	0	112.4	E55 V71 L72 A73 I182 I183 D184	E55-F187 HydrophobicContact CG-CD1 3.79Å; E55-F187 HydrophobicContact CG-CE1 3.75Å; V71-F187 HydrophobicContact CG1-CB 3.9Å; L72-F187 CarbonylContact O-C 3.58Å; L72-F187 VanDerWaalsContact O-CA 3.29Å; L72-F187 WeakPolarHBondContact O-CA 3.45Å; A73-F187 HydrophobicContact CB-CD1 3.98Å; A73-F187 HydrophobicContact CB-CE1 4.06Å; I182-F187 CarbonylContact C-O 3.56Å; I182-F187 WeakPolarHBondContact CA-O 3.28Å; I183-F187 HydrophobicContact CB-CB 4.16Å; I183-F187 PolarHBondContact N-O 2.64Å; I183-F187 WeakPolarHBondContact O-CB 3.49Å; I183-F187 PolarHBondContact O-N 2.89Å; D184-F187 HydrophobicContact CB-CD2 4.1Å; D184-F187 HydrophobicContact CB-CE2 4.26Å
188	L	98	Very high	97.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.9	175.6	-72.4	-175.2	0	0	0	111.9	V71 L72 L74 I84 T87 L112 P180 I182 F190	V71-L188 CarbonylContact C-O 3.53Å; V71-L188 VanDerWaalsContact CA-O 3.29Å; V71-L188 WeakPolarHBondContact CA-O 3.38Å; L72-L188 PolarHBondContact N-O 3.04Å; L72-L188 PolarHBondContact O-N 3.35Å; L74-L188 HydrophobicContact CD1-CD1 4.13Å; I84-L188 HydrophobicContact CB-CD2 4.19Å; I84-L188 HydrophobicContact CD1-CD1 4.46Å; I84-L188 HydrophobicContact CD1-CD2 4.26Å; I84-L188 HydrophobicContact CD1-CG 3.92Å; I84-L188 HydrophobicContact CG1-CD1 4.08Å; I84-L188 HydrophobicContact CG1-CD2 4.1Å; I84-L188 HydrophobicContact CG1-CG 3.95Å; I84-L188 HydrophobicContact CG2-CD2 4.05Å; T87-L188 HydrophobicContact CG2-CD2 3.58Å; L112-L188 HydrophobicContact CD1-CD1 3.83Å; L112-L188 HydrophobicContact CD2-CD1 3.83Å; P180-L188 HydrophobicContact CB-CD2 4.38Å; I182-L188 HydrophobicContact CB-CD2 4.48Å; I182-L188 HydrophobicContact CG1-CD2 3.82Å; L188-F190 HydrophobicContact CB-CD2 4.39Å; L188-F190 HydrophobicContact CB-CE2 3.6Å; L188-F190 HydrophobicContact CB-CZ 4.2Å; L188-F190 HydrophobicContact CD1-CE2 4.34Å; L188-F190 HydrophobicContact CD1-CZ 4.14Å
189	K	98.5	Very high	97.6	Very high	55 Å²	55	40.5 Å²	40.5	24%	0.239	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	118.4	176.2	-173.8	178.8	178.5	-166.1	0	111.3	F70 V71 P180 V181 I183 F191	F70-K189 WeakPolarHBondContact O-CA 3.2Å; V71-K189 HydrophobicContact CG2-CB 4.05Å; V71-K189 HydrophobicContact CG2-CD 4.39Å; V71-K189 HydrophobicContact CG2-CG 3.95Å; P180-K189 WeakPolarHBondContact CA-O 3.25Å; V181-K189 HydrophobicContact CB-CB 4.41Å; V181-K189 PolarHBondContact N-O 3.34Å; V181-K189 PolarHBondContact O-N 3.4Å; I183-K189 HydrophobicContact CD1-CB 3.87Å; I183-K189 HydrophobicContact CD1-CD 4Å; K189-F191 HydrophobicContact CD-CE1 4.36Å; K189-F191 HydrophobicContact CD-CE2 3.93Å; K189-F191 HydrophobicContact CD-CZ 3.64Å; K189-F191 HydrophobicContact CG-CE2 3.9Å; K189-F191 HydrophobicContact CG-CZ 4.03Å
190	F	98.7	Very high	97.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	143.3	-179.4	-65	-101.9	0	0	0	110.6	H69 F70 L72 Y110 L126 V128 P180 L188	H69-F190 WeakPolarHBondContact CA-O 3.4Å; H69-F190 WeakPolarHBondContact CB-O 3.37Å; F70-F190 HydrophobicContact CD1-CB 4.41Å; F70-F190 HydrophobicContact CD2-CB 4.32Å; F70-F190 AromaticContact CD2-CD2 3.94Å; F70-F190 HydrophobicContact CD2-CD2 3.94Å; F70-F190 HydrophobicContact CD2-CG 4.39Å; F70-F190 HydrophobicContact CE1-CB 3.88Å; F70-F190 HydrophobicContact CE1-CG 4.46Å; F70-F190 HydrophobicContact CE2-CB 3.78Å; F70-F190 HydrophobicContact CE2-CD1 4.44Å; F70-F190 AromaticContact CE2-CD2 3.33Å; F70-F190 HydrophobicContact CE2-CD2 3.33Å; F70-F190 HydrophobicContact CE2-CE2 4.03Å; F70-F190 AromaticContact CE2-CG 3.59Å; F70-F190 HydrophobicContact CE2-CG 3.59Å; F70-F190 HydrophobicContact CZ-CB 3.53Å; F70-F190 HydrophobicContact CZ-CD1 4.24Å; F70-F190 AromaticContact CZ-CD2 3.9Å; F70-F190 HydrophobicContact CZ-CD2 3.9Å; F70-F190 AromaticContact CZ-CG 3.63Å; F70-F190 HydrophobicContact CZ-CG 3.63Å; F70-F190 PolarHBondContact O-N 2.87Å; F70-F190 VanDerWaalsContact O-N 3.1Å; L72-F190 HydrophobicContact CB-CE2 4.46Å; L72-F190 HydrophobicContact CD1-CD2 4.35Å; L72-F190 HydrophobicContact CD1-CE2 3.62Å; L72-F190 HydrophobicContact CD1-CZ 4.19Å; L72-F190 HydrophobicContact CG-CD2 4.4Å; L72-F190 HydrophobicContact CG-CE2 3.99Å; Y110-F190 HydrophobicContact CD2-CD1 4.26Å; Y110-F190 AromaticContact CD2-CE1 3.77Å; Y110-F190 HydrophobicContact CD2-CE1 3.77Å; Y110-F190 AromaticContact CE2-CD1 3.69Å; Y110-F190 HydrophobicContact CE2-CD1 3.69Å; Y110-F190 AromaticContact CE2-CE1 3.69Å; Y110-F190 HydrophobicContact CE2-CE1 3.69Å; Y110-F190 HydrophobicContact CG-CE1 4.24Å; Y110-F190 AromaticContact CZ-CD1 3.85Å; L126-F190 HydrophobicContact CD2-CE1 4.03Å; L126-F190 HydrophobicContact CD2-CZ 3.6Å; V128-F190 HydrophobicContact CG2-CD1 4.14Å; V128-F190 HydrophobicContact CG2-CE1 4.01Å; P180-F190 HydrophobicContact CB-CD1 4.03Å; P180-F190 HydrophobicContact CB-CE1 3.84Å; P180-F190 HydrophobicContact CB-CE2 4.37Å; P180-F190 HydrophobicContact CB-CG 4.38Å; P180-F190 HydrophobicContact CB-CZ 4.01Å; P180-F190 HydrophobicContact CG-CD1 3.63Å; P180-F190 HydrophobicContact CG-CE1 3.34Å; P180-F190 HydrophobicContact CG-CG 4.44Å; P180-F190 HydrophobicContact CG-CZ 3.95Å; L188-F190 HydrophobicContact CB-CD2 4.39Å; L188-F190 HydrophobicContact CB-CE2 3.6Å; L188-F190 HydrophobicContact CB-CZ 4.2Å; L188-F190 HydrophobicContact CD1-CE2 4.34Å; L188-F190 HydrophobicContact CD1-CZ 4.14Å
191	F	98.5	Very high	96.8	Very high	21 Å²	21	50.1 Å²	50.1	9%	0.092	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	107.6	178	-65	-91.4	0	0	0	111.3	H69 E175 T176 P177 V181 K189	H69-F191 HydrophobicContact CB-CD1 3.91Å; H69-F191 HydrophobicContact CB-CE1 4.24Å; H69-F191 HydrophobicContact CB-CG 4.48Å; E175-F191 WeakPolarHBondContact O-CE1 3.22Å; E175-F191 WeakPolarHBondContact O-CZ 3.29Å; T176-F191 HydrophobicContact CG2-CB 4.29Å; T176-F191 HydrophobicContact CG2-CD1 3.92Å; T176-F191 HydrophobicContact CG2-CG 4.41Å; P177-F191 HydrophobicContact CG-CD2 4.05Å; P177-F191 HydrophobicContact CG-CE2 4.2Å; V181-F191 HydrophobicContact CB-CE2 4.45Å; V181-F191 HydrophobicContact CG2-CE2 3.85Å; K189-F191 HydrophobicContact CD-CE1 4.36Å; K189-F191 HydrophobicContact CD-CE2 3.93Å; K189-F191 HydrophobicContact CD-CZ 3.64Å; K189-F191 HydrophobicContact CG-CE2 3.9Å; K189-F191 HydrophobicContact CG-CZ 4.03Å
192	L	98.4	Very high	96.4	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	161.7	-170.1	-62.2	-173.3	0	0	0	111.8	F67 F68 F70 I108 Y110 V128 L154	F67-L192 CarbonylContact C-O 3.53Å; F67-L192 WeakPolarHBondContact CA-O 3.4Å; F68-L192 HydrophobicContact CD1-CB 4.14Å; F68-L192 WeakPolarHBondContact CD1-O 3.32Å; F68-L192 HydrophobicContact CE1-CB 3.55Å; F68-L192 HydrophobicContact CE2-CB 4.33Å; F68-L192 HydrophobicContact CZ-CB 3.67Å; F68-L192 HydrophobicContact CZ-CD1 4.14Å; F68-L192 HydrophobicContact CZ-CG 4.49Å; F68-L192 PolarHBondContact N-O 2.78Å; F68-L192 PolarHBondContact O-N 2.83Å; F70-L192 HydrophobicContact CE1-CD1 4.01Å; F70-L192 HydrophobicContact CZ-CD1 4.47Å; I108-L192 HydrophobicContact CD1-CD1 4.34Å; I108-L192 HydrophobicContact CD1-CD2 3.28Å; I108-L192 HydrophobicContact CD1-CG 4.41Å; Y110-L192 WeakPolarHBondContact OH-CD2 3.45Å; V128-L192 HydrophobicContact CG1-CD1 3.83Å; L154-L192 HydrophobicContact CD1-CD1 4.25Å; L154-L192 HydrophobicContact CD2-CD1 4.21Å
193	K	97.9	Very high	96	Very high	20 Å²	20	53.1 Å²	53.1	9%	0.087	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.1	167.7	-179.4	-176.1	176.7	-169.8	0	109.2	K64 F67 L155 M160	K64-K193 WeakPolarHBondContact O-CE 3.13Å; F67-K193 HydrophobicContact CD1-CB 3.92Å; F67-K193 HydrophobicContact CE1-CB 3.97Å; F67-K193 HydrophobicContact CG-CB 4.43Å; L155-K193 HydrophobicContact CB-CB 4.43Å; L155-K193 PolarHBondContact N-O 2.91Å; L155-K193 PolarHBondContact O-N 2.85Å; M160-K193 HydrophobicContact CE-CB 4.17Å; M160-K193 HydrophobicContact CE-CD 3.52Å; M160-K193 HydrophobicContact SD-CD 3.77Å
194	C	98.1	Very high	95.4	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.2	173.8	-175.4	0	0	0	0	110.1	L62 F68 L130 V153 L154 Q196 V234	L62-C194 HydrophobicContact CD2-CB 4.17Å; F68-C194 HydrophobicContact CE1-CB 4.14Å; L130-C194 HydrophobicContact CD1-CB 4.32Å; L130-C194 VanDerWaalsContact CD1-SG 3.54Å; V153-C194 CarbonylContact O-C 3.56Å; V153-C194 VanDerWaalsContact O-CA 3.26Å; V153-C194 WeakPolarHBondContact O-CA 3.21Å; V153-C194 PolarHBondContact O-SG 2.99Å; V153-C194 VanDerWaalsContact O-SG 3.39Å; L154-C194 HydrophobicContact CD2-CB 4.49Å; C194-Q196 PolarHBondContact SG-O 3.01Å; C194-Q196 VanDerWaalsContact SG-O 3.38Å; C194-V234 HydrophobicContact CB-CG1 4.17Å; C194-V234 HydrophobicContact CB-CG2 4.24Å
195	N	97.3	Very high	94.8	Very high	10 Å²	10	54.6 Å²	54.6	5%	0.053	30%	0.298	C	S	.	.			trans	-102	8.6	179	-153.3	38.7	0	0	0	113.4	K64 Y141 M150 R152 V153 L155	K64-N195 WeakPolarHBondContact CE-O 3.43Å; K64-N195 WeakPolarHBondContact CE-OD1 3.44Å; K64-N195 PolarHBondContact NZ-O 3.49Å; Y141-N195 HydrophobicContact CE2-CB 4.39Å; M150-N195 PolarHBondContact O-ND2 3.49Å; R152-N195 WeakPolarHBondContact O-CB 3.28Å; V153-N195 PolarHBondContact O-N 2.86Å; L155-N195 HydrophobicContact CD1-CB 3.76Å; L155-N195 HydrophobicContact CG-CB 4.35Å
196	Q	97	Very high	94.1	Very high	9 Å²	9	58.6 Å²	58.6	4%	0.042	31%	0.314	C	S	.	.	S	Bend	trans	-108.2	137.3	172.3	-178.2	54.1	41.9	0	0	110.3	I139 V153 C194 F211 V234	I139-Q196 HydrophobicContact CG2-CB 4.4Å; I139-Q196 HydrophobicContact CG2-CG 3.78Å; V153-Q196 HydrophobicContact CB-CB 4.42Å; V153-Q196 HydrophobicContact CG1-CB 4.11Å; V153-Q196 HydrophobicContact CG2-CB 4.12Å; C194-Q196 PolarHBondContact SG-O 3.01Å; C194-Q196 VanDerWaalsContact SG-O 3.38Å; Q196-F211 HydrophobicContact CB-CE2 4.43Å; Q196-F211 HydrophobicContact CG-CE2 4.33Å; Q196-F211 HydrophobicContact CG-CZ 4.05Å; Q196-V234 VanDerWaalsContact O-CG1 3.25Å; Q196-V234 WeakPolarHBondContact O-CG1 3.4Å
197	N	96.4	Very high	93.2	Very high	38 Å²	38	61.4 Å²	61.4	20%	0.203	33%	0.332	C	S	.	.			trans	-84.5	147.2	172.2	-68.7	40.7	0	0	0	109.6	K64 L199 F211	K64-N197 WeakPolarHBondContact CD-OD1 3.32Å; K64-N197 PolarHBondContact NZ-OD1 3.34Å; N197-L199 VanDerWaalsContact C-N 3.28Å; N197-L199 WeakPolarHBondContact CB-O 3.35Å; N197-F211 WeakPolarHBondContact O-CZ 3.1Å
198	C	96	Very high	92.5	Very high	3 Å²	3	65 Å²	65	2%	0.02	35%	0.351	C	S	.	.	S	Bend	trans	-64.1	-36.9	166.1	-66.6	0	0	0	0	111.7	R209 F211 F233 V234	C198-R209 HydrophobicContact CB-CB 4.4Å; C198-R209 VanDerWaalsContact CB-O 3.24Å; C198-R209 WeakPolarHBondContact CB-O 3.17Å; C198-R209 VanDerWaalsContact O-CD 3.28Å; C198-R209 WeakPolarHBondContact O-CD 3.36Å; C198-F211 HydrophobicContact CB-CE1 4.23Å; C198-F211 HydrophobicContact CB-CZ 4.19Å; C198-F233 HydrophobicContact CB-CD2 3.89Å; C198-F233 HydrophobicContact CB-CE2 3.98Å; C198-V234 PolarHBondContact N-O 2.99Å; C198-V234 PolarHBondContact SG-N 2.98Å
199	L	93.7	Very high	92.3	Very high	42 Å²	42	67.5 Å²	67.5	22%	0.22	36%	0.36	C	S	.	.			trans	-101.5	123.7	176.6	-54.4	177.8	0	0	0	110.3	N197 P205 D207 F233	N197-L199 VanDerWaalsContact C-N 3.28Å; N197-L199 WeakPolarHBondContact CB-O 3.35Å; L199-P205 HydrophobicContact CD1-CB 3.68Å; L199-P205 HydrophobicContact CD1-CG 3.49Å; L199-P205 VanDerWaalsContact CD1-CG 3.49Å; L199-P205 HydrophobicContact CD2-CB 4.38Å; L199-D207 WeakPolarHBondContact CD2-O 3.38Å; L199-F233 HydrophobicContact CD1-CE2 4.09Å; L199-F233 HydrophobicContact CD1-CZ 3.8Å; L199-F233 HydrophobicContact CD2-CE2 4.41Å; L199-F233 HydrophobicContact CG-CE2 3.95Å; L199-F233 HydrophobicContact CG-CZ 4.14Å
200	K	90.5	Very high	92.3	Very high	135 Å²	135	67.9 Å²	67.9	59%	0.587	36%	0.36	S	S	*	.			trans	-71.3	-43.4	-179.5	-49.6	-170.6	-169.6	-165.5	0	112.1	E142	E142-K200 WeakPolarHBondContact OE1-CE 3.45Å; E142-K200 IonicContact OE1-NZ 3.24Å; E142-K200 PolarHBondContact OE1-NZ 3.15Å; E142-K200 WeakPolarHBondContact OE2-CD 3.48Å; E142-K200 WeakPolarHBondContact OE2-CE 2.94Å; E142-K200 IonicContact OE2-NZ 2.92Å; E142-K200 PolarHBondContact OE2-NZ 3.24Å
201	N	89.6	Confident	92.2	Very high	141 Å²	141	67.9 Å²	67.9	75%	0.754	36%	0.36	S	S	*	.	S	Bend	trans	-109.1	159.1	-169.8	-62.1	-19.9	0	0	0	112.4
202	A	90.2	Very high	92.2	Very high	109 Å²	109	68 Å²	68	90%	0.901	36%	0.361	S	S	*	.	S	Bend	trans	-73.5	157.2	165.8	0	0	0	0	0	111.1
203	G	88.7	Confident	92.2	Very high	68 Å²	68	68 Å²	68	70%	0.701	36%	0.361	S	S	*	.	S	Bend	trans	133	-177.7	-179.5	0	0	0	0	0	112.1
204	N	86.2	Confident	92.3	Very high	148 Å²	148	67 Å²	67	79%	0.791	36%	0.357	S	S	*	.	S	Bend	trans	-73.3	125.8	169.3	-170.2	39.1	0	0	0	109	R206	N204-R206 PolarHBondContact O-N 3.37Å
205	P	83.7	Confident	92.3	Very high	67 Å²	67	67 Å²	67	44%	0.435	36%	0.357	S	S	.	.			trans	-60.2	122.9	179.6	-20.9	32.6	0	0	0	110.9	L199	L199-P205 HydrophobicContact CD1-CB 3.68Å; L199-P205 HydrophobicContact CD1-CG 3.49Å; L199-P205 VanDerWaalsContact CD1-CG 3.49Å; L199-P205 HydrophobicContact CD2-CB 4.38Å
206	R	81.8	Confident	92.3	Very high	230 Å²	230	66.6 Å²	66.6	87%	0.868	36%	0.355	S	S	*	.			trans	-99	-48.9	167	-65	-174.3	179.8	-172.3	-0.2	110	N204	N204-R206 PolarHBondContact O-N 3.37Å
207	D	79.2	Confident	92.3	Very high	129 Å²	129	68 Å²	68	69%	0.69	36%	0.364	S	S	*	.	S	Bend	trans	-84.1	121.5	178.2	-48.1	-51.9	0	0	0	110.7	L199 R209	L199-D207 WeakPolarHBondContact CD2-O 3.38Å; D207-R209 VanDerWaalsContact C-N 3.28Å; D207-R209 PolarHBondContact O-N 3.41Å
208	M	83.9	Confident	92.2	Very high	139 Å²	139	69.5 Å²	69.5	69%	0.685	38%	0.375	S	S	*	.			trans	-90.8	49.9	-179.2	-68.2	-174.6	61.6	0	0	112.5	R210	M208-R210 PolarHBondContact O-N 3.39Å
209	R	94.5	Very high	92.1	Very high	52 Å²	52	70.7 Å²	70.7	20%	0.196	38%	0.382	C	S	.	.			trans	-55.1	131.9	174	-165.7	-179.5	-170.7	-165.2	5.3	109.7	D132 E142 C198 D207 F211	D132-R209 VanDerWaalsContact OD2-CG 3.25Å; D132-R209 WeakPolarHBondContact OD2-CG 3.21Å; D132-R209 IonicContact OD2-CZ 2.72Å; D132-R209 IonicContact OD2-NE 3.75Å; D132-R209 PolarHBondContact OD2-NE 2.64Å; D132-R209 IonicContact OD2-NH2 3.18Å; E142-R209 IonicContact OE2-NH1 2.71Å; C198-R209 HydrophobicContact CB-CB 4.4Å; C198-R209 VanDerWaalsContact CB-O 3.24Å; C198-R209 WeakPolarHBondContact CB-O 3.17Å; C198-R209 VanDerWaalsContact O-CD 3.28Å; C198-R209 WeakPolarHBondContact O-CD 3.36Å; D207-R209 VanDerWaalsContact C-N 3.28Å; D207-R209 PolarHBondContact O-N 3.41Å; R209-F211 HydrophobicContact CG-CE1 4.24Å
210	R	97	Very high	92.1	Very high	63 Å²	63	71.3 Å²	71.3	24%	0.238	39%	0.386	C	S	.	.			trans	-136.1	155	175.8	-71.4	169.8	173.7	-82	-3.1	108.7	S133 M208 N231 M232 F233	S133-R210 WeakPolarHBondContact CB-O 3.28Å; S133-R210 PolarHBondContact N-O 2.79Å; S133-R210 WeakPolarHBondContact OG-CB 3.5Å; S133-R210 PolarHBondContact OG-O 3.13Å; M208-R210 PolarHBondContact O-N 3.39Å; R210-N231 HydrophobicContact CB-CB 4.23Å; R210-M232 WeakPolarHBondContact CA-O 3.42Å; R210-F233 HydrophobicContact CG-CB 4.46Å
211	F	98.3	Very high	92.1	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	152.9	179.7	-56.5	-21.7	0	0	0	110.3	L130 I131 I139 Q196 N197 C198 R209 M232 V234	L130-F211 HydrophobicContact CD1-CB 4.36Å; L130-F211 HydrophobicContact CD1-CD2 3.8Å; L130-F211 HydrophobicContact CD1-CG 4.4Å; I131-F211 CarbonylContact O-C 3.46Å; I131-F211 VanDerWaalsContact O-CA 3.24Å; I131-F211 WeakPolarHBondContact O-CA 3.3Å; I139-F211 HydrophobicContact CD1-CD1 3.37Å; I139-F211 HydrophobicContact CD1-CE1 3.42Å; I139-F211 VanDerWaalsContact CD1-CE1 3.42Å; I139-F211 HydrophobicContact CD1-CG 4.25Å; I139-F211 HydrophobicContact CD1-CZ 4.29Å; I139-F211 HydrophobicContact CG1-CD1 3.69Å; I139-F211 HydrophobicContact CG1-CE1 3.86Å; I139-F211 HydrophobicContact CG1-CG 4.08Å; I139-F211 HydrophobicContact CG1-CZ 4.35Å; I139-F211 HydrophobicContact CG2-CE1 4.06Å; I139-F211 HydrophobicContact CG2-CE2 4.33Å; I139-F211 HydrophobicContact CG2-CZ 3.85Å; Q196-F211 HydrophobicContact CB-CE2 4.43Å; Q196-F211 HydrophobicContact CG-CE2 4.33Å; Q196-F211 HydrophobicContact CG-CZ 4.05Å; N197-F211 WeakPolarHBondContact O-CZ 3.1Å; C198-F211 HydrophobicContact CB-CE1 4.23Å; C198-F211 HydrophobicContact CB-CZ 4.19Å; R209-F211 HydrophobicContact CG-CE1 4.24Å; F211-M232 PolarHBondContact N-O 3.22Å; F211-M232 PolarHBondContact O-N 3.14Å; F211-V234 HydrophobicContact CD2-CB 4.29Å; F211-V234 HydrophobicContact CD2-CG2 3.68Å; F211-V234 HydrophobicContact CE2-CB 4.18Å; F211-V234 HydrophobicContact CE2-CG2 4.06Å
212	Q	98.5	Very high	92	Very high	24 Å²	24	63.1 Å²	63.1	11%	0.112	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	145.4	165.8	-60.7	-178.7	-85.9	0	0	108.7	L130 I131 V228 S229 N231	L130-Q212 CarbonylContact C-O 3.46Å; L130-Q212 WeakPolarHBondContact CA-O 3.25Å; I131-Q212 HydrophobicContact CD1-CB 4.5Å; I131-Q212 HydrophobicContact CG1-CB 3.98Å; I131-Q212 PolarHBondContact N-O 3.16Å; I131-Q212 PolarHBondContact O-N 3.11Å; Q212-V228 HydrophobicContact CB-CG1 3.68Å; Q212-V228 HydrophobicContact CG-CG1 4.29Å; Q212-S229 PolarHBondContact NE2-O 3.31Å; Q212-N231 VanDerWaalsContact CG-OD1 3.25Å; Q212-N231 WeakPolarHBondContact CG-OD1 3.25Å
213	V	98.6	Very high	91.7	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.6	171.2	-176.5	0	0	0	0	108.1	F54 P58 F68 F70 V128 L130 V228 S229 M232	F54-V213 HydrophobicContact CE1-CB 4.45Å; F54-V213 HydrophobicContact CZ-CB 4.16Å; F54-V213 HydrophobicContact CZ-CG1 4.22Å; P58-V213 HydrophobicContact CB-CG2 4.39Å; P58-V213 HydrophobicContact CG-CG2 3.96Å; F68-V213 HydrophobicContact CE2-CG2 4.2Å; F70-V213 HydrophobicContact CE1-CG1 3.92Å; F70-V213 HydrophobicContact CE1-CG2 4.46Å; F70-V213 HydrophobicContact CZ-CG1 3.95Å; V128-V213 HydrophobicContact CG1-CG1 3.62Å; L130-V213 HydrophobicContact CD2-CB 4.31Å; L130-V213 HydrophobicContact CD2-CG2 3.72Å; V213-V228 CarbonylContact O-C 3.53Å; V213-V228 WeakPolarHBondContact O-CA 3.4Å; V213-S229 PolarHBondContact N-OG 3.46Å; V213-S229 PolarHBondContact O-N 3.23Å; V213-M232 HydrophobicContact CG2-SD 3.77Å
214	V	98.4	Very high	91.8	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	138	170.1	176.3	0	0	0	0	109.1	V128 R129 I131 V221 V225 V228	V128-V214 WeakPolarHBondContact CA-O 3.13Å; R129-V214 PolarHBondContact N-O 2.9Å; R129-V214 VanDerWaalsContact N-O 3.09Å; R129-V214 PolarHBondContact O-N 2.67Å; I131-V214 HydrophobicContact CB-CG2 4.11Å; I131-V214 HydrophobicContact CD1-CG2 3.48Å; I131-V214 VanDerWaalsContact CD1-CG2 3.48Å; I131-V214 HydrophobicContact CG1-CG2 3.61Å; I131-V214 HydrophobicContact CG2-CB 4.44Å; I131-V214 HydrophobicContact CG2-CG2 3.48Å; I131-V214 VanDerWaalsContact CG2-CG2 3.48Å; V214-V221 HydrophobicContact CB-CG1 4.4Å; V214-V221 HydrophobicContact CG1-CG1 4.1Å; V214-V225 HydrophobicContact CG1-CB 3.88Å; V214-V225 HydrophobicContact CG1-CG1 3.5Å; V214-V228 HydrophobicContact CG2-CG1 4.47Å; V214-V228 HydrophobicContact CG2-CG2 4.33Å
215	V	98.4	Very high	92.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.4	172.3	-174.5	0	0	0	0	108.2	F54 L72 L126 Y127 L226 A227	F54-V215 HydrophobicContact CE2-CG2 4.35Å; F54-V215 HydrophobicContact CZ-CG2 3.82Å; L72-V215 HydrophobicContact CD1-CB 4.34Å; L72-V215 HydrophobicContact CD1-CG1 3.79Å; L72-V215 HydrophobicContact CD1-CG2 3.76Å; L72-V215 HydrophobicContact CD2-CG2 4.27Å; L126-V215 HydrophobicContact CD1-CG1 3.8Å; L126-V215 HydrophobicContact CD2-CG1 4.08Å; L126-V215 HydrophobicContact CG-CG1 4.09Å; Y127-V215 WeakPolarHBondContact O-CA 3.35Å; V215-L226 HydrophobicContact CG1-CB 4.46Å; V215-L226 HydrophobicContact CG1-CD1 4.37Å; V215-L226 WeakPolarHBondContact O-CA 3.34Å; V215-L226 WeakPolarHBondContact O-CB 3.14Å; V215-L226 PolarHBondContact O-N 3.47Å; V215-A227 PolarHBondContact N-O 3.17Å; V215-A227 PolarHBondContact O-N 3.07Å
216	S	97.5	Very high	93	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	161.7	-175.7	50.9	0	0	0	0	111.8	Y127 T218	Y127-S216 PolarHBondContact N-O 3.14Å; Y127-S216 PolarHBondContact O-N 2.9Å; Y127-S216 VanDerWaalsContact O-N 3.1Å; S216-T218 VanDerWaalsContact C-N 3.35Å; S216-T218 WeakPolarHBondContact CB-O 3.35Å; S216-T218 PolarHBondContact OG-O 2.91Å
217	T	96.6	Very high	93.7	Very high	40 Å²	40	45.1 Å²	45.1	25%	0.245	25%	0.245	C	C	.	.	S	Bend	trans	-88.9	-1.9	172.2	51.4	0	0	0	0	113.2	L49 Q124 L226	L49-T217 HydrophobicContact CB-CG2 4.41Å; L49-T217 HydrophobicContact CD1-CG2 4.36Å; Q124-T217 HydrophobicContact CG-CG2 4.44Å; T217-L226 HydrophobicContact CG2-CD1 3.91Å; T217-L226 HydrophobicContact CG2-CD2 4.42Å; T217-L226 HydrophobicContact CG2-CG 4.32Å
218	T	95.2	Very high	94.7	Very high	69 Å²	69	41.7 Å²	41.7	42%	0.423	23%	0.228	S	C	.	.	S	Bend	trans	-132	162.1	175.5	80.8	0	0	0	0	109.8	Y127 S216 N220	Y127-T218 WeakPolarHBondContact CD2-O 3.43Å; S216-T218 VanDerWaalsContact C-N 3.35Å; S216-T218 WeakPolarHBondContact CB-O 3.35Å; S216-T218 PolarHBondContact OG-O 2.91Å; T218-N220 PolarHBondContact O-N 3.24Å; T218-N220 PolarHBondContact OG1-N 3.29Å
219	V	94.5	Very high	95.3	Very high	27 Å²	27	35.2 Å²	35.2	16%	0.164	20%	0.196	C	C	.	.	S	Bend	trans	-64.7	-27.9	176.2	-162.4	0	0	0	0	112.3	V93 K97 P99 Y127 R129	V93-V219 HydrophobicContact CB-CG1 4.28Å; V93-V219 HydrophobicContact CG1-CG1 3.39Å; V93-V219 HydrophobicContact CG2-CG1 3.84Å; K97-V219 WeakPolarHBondContact O-CG1 3.32Å; P99-V219 HydrophobicContact CG-CG1 4.5Å; Y127-V219 HydrophobicContact CD1-CB 4.49Å; Y127-V219 HydrophobicContact CD1-CG2 4.03Å; Y127-V219 HydrophobicContact CE1-CB 4.5Å; Y127-V219 HydrophobicContact CE1-CG2 3.58Å; Y127-V219 HydrophobicContact CE2-CG2 4.38Å; R129-V219 WeakPolarHBondContact CD-O 3.44Å; R129-V219 PolarHBondContact NH1-O 2.82Å
220	N	93	Very high	95.5	Very high	56 Å²	56	37.3 Å²	37.3	30%	0.299	21%	0.212	S	C	.	.			trans	-73.9	137.3	-174.9	-165.5	-2.8	0	0	0	111.4	T218 D222	T218-N220 PolarHBondContact O-N 3.24Å; T218-N220 PolarHBondContact OG1-N 3.29Å; N220-D222 PolarHBondContact OD1-N 2.98Å; N220-D222 VanDerWaalsContact OD1-N 3.08Å
221	V	90.8	Very high	95.6	Very high	17 Å²	17	37.6 Å²	37.6	10%	0.103	22%	0.218	C	C	.	.	S	Bend	trans	-106.6	-14.5	-179.3	-61.3	0	0	0	0	113.5	R129 I131 A138 V214 G223	R129-V221 HydrophobicContact CB-CG1 4.12Å; R129-V221 HydrophobicContact CG-CG1 4.37Å; I131-V221 HydrophobicContact CG2-CB 4.02Å; I131-V221 HydrophobicContact CG2-CG1 4.2Å; I131-V221 HydrophobicContact CG2-CG2 4Å; A138-V221 HydrophobicContact CB-CG2 4.26Å; V214-V221 HydrophobicContact CB-CG1 4.4Å; V214-V221 HydrophobicContact CG1-CG1 4.1Å; V221-G223 VanDerWaalsContact C-N 3.26Å; V221-G223 PolarHBondContact O-N 2.83Å
222	D	87	Confident	95.6	Very high	87 Å²	87	37.6 Å²	37.6	47%	0.465	22%	0.218	S	C	.	.	S	Bend	trans	-80.5	-6.9	-178.9	-59.5	-45.8	0	0	0	113.2	Q137 N220	Q137-D222 PolarHBondContact NE2-OD1 3.09Å; Q137-D222 VanDerWaalsContact NE2-OD1 3.12Å; N220-D222 PolarHBondContact OD1-N 2.98Å; N220-D222 VanDerWaalsContact OD1-N 3.08Å
223	G	84.4	Confident	95.5	Very high	48 Å²	48	37.6 Å²	37.6	50%	0.495	22%	0.218	S	C	.	.	S	Bend	trans	-107.6	-148	-176.6	0	0	0	0	0	114	V221 V225	V221-G223 VanDerWaalsContact C-N 3.26Å; V221-G223 PolarHBondContact O-N 2.83Å; G223-V225 PolarHBondContact O-N 3.04Å
224	H	90.8	Very high	95.4	Very high	135 Å²	135	37.6 Å²	37.6	63%	0.625	22%	0.218	S	C	*	.			trans	-70.2	114.9	176.1	-179.4	-77.9	0	0	0	111.3	A50	A50-H224 PolarHBondContact O-CE1 3.09Å
225	V	96.3	Very high	95.3	Very high	38 Å²	38	38.5 Å²	38.5	23%	0.23	22%	0.222	C	C	.	.			trans	-109.9	148.2	175.8	-60.3	0	0	0	0	110.4	V214 G223 V228	V214-V225 HydrophobicContact CG1-CB 3.88Å; V214-V225 HydrophobicContact CG1-CG1 3.5Å; G223-V225 PolarHBondContact O-N 3.04Å; V225-V228 HydrophobicContact CG2-CG2 3.81Å
226	L	97.7	Very high	95.2	Very high	8 Å²	8	43 Å²	43	4%	0.042	25%	0.246	C	C	.	.	S	Bend	trans	-73.3	-37.7	179.6	-66.5	176.6	0	0	0	112.2	L49 A52 L126 V215 T217	L49-L226 HydrophobicContact CB-CD1 4.26Å; L49-L226 HydrophobicContact CB-CD2 3.8Å; L49-L226 HydrophobicContact CD1-CD1 3.81Å; A52-L226 HydrophobicContact CB-CB 3.91Å; A52-L226 PolarHBondContact N-O 3.43Å; L126-L226 HydrophobicContact CD1-CD1 3.72Å; V215-L226 HydrophobicContact CG1-CB 4.46Å; V215-L226 HydrophobicContact CG1-CD1 4.37Å; V215-L226 WeakPolarHBondContact O-CA 3.34Å; V215-L226 WeakPolarHBondContact O-CB 3.14Å; V215-L226 PolarHBondContact O-N 3.47Å; T217-L226 HydrophobicContact CG2-CD1 3.91Å; T217-L226 HydrophobicContact CG2-CD2 4.42Å; T217-L226 HydrophobicContact CG2-CG 4.32Å
227	A	98	Very high	95	Very high	14 Å²	14	46.7 Å²	46.7	12%	0.116	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	157.6	177.6	0	0	0	0	0	112.2	A52 F54 V215	A52-A227 HydrophobicContact CB-CB 3.89Å; F54-A227 HydrophobicContact CD2-CB 3.92Å; F54-A227 HydrophobicContact CE2-CB 3.59Å; V215-A227 PolarHBondContact N-O 3.17Å; V215-A227 PolarHBondContact O-N 3.07Å
228	V	98.3	Very high	94.9	Very high	58 Å²	58	48.1 Å²	48.1	35%	0.352	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.2	170.2	-173.1	0	0	0	0	108.7	I131 Q212 V213 V214 V225	I131-V228 HydrophobicContact CD1-CG1 4.17Å; Q212-V228 HydrophobicContact CB-CG1 3.68Å; Q212-V228 HydrophobicContact CG-CG1 4.29Å; V213-V228 CarbonylContact O-C 3.53Å; V213-V228 WeakPolarHBondContact O-CA 3.4Å; V214-V228 HydrophobicContact CG2-CG1 4.47Å; V214-V228 HydrophobicContact CG2-CG2 4.33Å; V225-V228 HydrophobicContact CG2-CG2 3.81Å
229	S	98.5	Very high	94.8	Very high	2 Å²	2	52 Å²	52	1%	0.014	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-78.8	170.7	-177.1	80.4	0	0	0	0	113.8	Q212 V213	Q212-S229 PolarHBondContact NE2-O 3.31Å; V213-S229 PolarHBondContact N-OG 3.46Å; V213-S229 PolarHBondContact O-N 3.23Å
230	D	98.4	Very high	94.5	Very high	97 Å²	97	54.1 Å²	54.1	52%	0.519	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-60.7	161.9	162.1	-72.3	-18.9	0	0	0	112.1	Q57 M232	Q57-D230 VanDerWaalsContact CD-CG 3.42Å; Q57-D230 HydrophobicContact CG-CB 4.32Å; Q57-D230 VanDerWaalsContact CG-OD2 3.32Å; Q57-D230 WeakPolarHBondContact CG-OD2 3.27Å; Q57-D230 PolarHBondContact NE2-OD1 2.9Å; Q57-D230 PolarHBondContact NE2-OD2 3.28Å; D230-M232 PolarHBondContact O-N 3.44Å
231	N	98	Very high	94.3	Very high	68 Å²	68	55 Å²	55	36%	0.364	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-68.3	122.6	-176.9	-74.9	-25.2	0	0	0	113.5	S60 S133 R210 Q212	S60-N231 WeakPolarHBondContact CA-O 3.49Å; S133-N231 WeakPolarHBondContact CB-OD1 3.37Å; R210-N231 HydrophobicContact CB-CB 4.23Å; Q212-N231 VanDerWaalsContact CG-OD1 3.25Å; Q212-N231 WeakPolarHBondContact CG-OD1 3.25Å
232	M	97.9	Very high	94.2	Very high	1 Å²	1	63 Å²	63	1%	0.005	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-98.7	136.8	170.5	-57.4	-178.6	70.4	0	0	111.7	P58 P59 L62 F68 R210 F211 V213 D230	P58-M232 HydrophobicContact CB-CE 3.93Å; P58-M232 HydrophobicContact CB-CG 4.08Å; P58-M232 HydrophobicContact CB-SD 3.55Å; P58-M232 VanDerWaalsContact CB-SD 3.55Å; P58-M232 HydrophobicContact CG-CG 3.81Å; P58-M232 HydrophobicContact CG-SD 3.66Å; P59-M232 HydrophobicContact CG-CE 4.2Å; L62-M232 HydrophobicContact CB-CE 4.25Å; L62-M232 HydrophobicContact CD2-CE 3.76Å; F68-M232 HydrophobicContact CD1-CE 4.39Å; F68-M232 HydrophobicContact CD2-CE 3.67Å; F68-M232 HydrophobicContact CD2-SD 4.38Å; F68-M232 HydrophobicContact CE2-CE 3.84Å; F68-M232 HydrophobicContact CE2-SD 4.07Å; F68-M232 HydrophobicContact CG-CE 3.95Å; F68-M232 HydrophobicContact CZ-CE 4.27Å; R210-M232 WeakPolarHBondContact CA-O 3.42Å; F211-M232 PolarHBondContact N-O 3.22Å; F211-M232 PolarHBondContact O-N 3.14Å; V213-M232 HydrophobicContact CG2-SD 3.77Å; D230-M232 PolarHBondContact O-N 3.44Å
233	F	97.1	Very high	94.2	Very high	23 Å²	23	70.3 Å²	70.3	10%	0.101	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	106.1	168.4	178.9	-114.9	0	0	0	110.9	S60 N61 L62 C198 L199 R210 H235 H240	S60-F233 PolarHBondContact O-N 3.3Å; N61-F233 WeakPolarHBondContact CA-O 3.45Å; L62-F233 PolarHBondContact N-O 2.97Å; C198-F233 HydrophobicContact CB-CD2 3.89Å; C198-F233 HydrophobicContact CB-CE2 3.98Å; L199-F233 HydrophobicContact CD1-CE2 4.09Å; L199-F233 HydrophobicContact CD1-CZ 3.8Å; L199-F233 HydrophobicContact CD2-CE2 4.41Å; L199-F233 HydrophobicContact CG-CE2 3.95Å; L199-F233 HydrophobicContact CG-CZ 4.14Å; R210-F233 HydrophobicContact CG-CB 4.46Å; F233-H235 HydrophobicContact CD1-CB 4.39Å; F233-H235 AromaticContact CD1-CD2 3.78Å; F233-H235 HydrophobicContact CE1-CB 3.89Å; F233-H235 AromaticContact CE1-CD2 3.99Å; F233-H235 HydrophobicContact CZ-CB 4.36Å; F233-H235 PolarHBondContact O-CD2 2.95Å; F233-H240 AromaticContact CD1-CE1 3.88Å; F233-H240 AromaticContact CE1-CE1 3.91Å
234	V	97.4	Very high	94	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	117.4	-178.6	-169.5	0	0	0	0	110.8	L62 K64 C194 Q196 C198 F211	L62-V234 HydrophobicContact CB-CG2 4.39Å; L62-V234 HydrophobicContact CD2-CG2 4.34Å; L62-V234 CarbonylContact O-C 3.58Å; L62-V234 WeakPolarHBondContact O-CA 3.44Å; K64-V234 HydrophobicContact CB-CG1 4.16Å; C194-V234 HydrophobicContact CB-CG1 4.17Å; C194-V234 HydrophobicContact CB-CG2 4.24Å; Q196-V234 VanDerWaalsContact O-CG1 3.25Å; Q196-V234 WeakPolarHBondContact O-CG1 3.4Å; C198-V234 PolarHBondContact N-O 2.99Å; C198-V234 PolarHBondContact SG-N 2.98Å; F211-V234 HydrophobicContact CD2-CB 4.29Å; F211-V234 HydrophobicContact CD2-CG2 3.68Å; F211-V234 HydrophobicContact CE2-CB 4.18Å; F211-V234 HydrophobicContact CE2-CG2 4.06Å
235	H	95.6	Very high	93.3	Very high	21 Å²	21	76.6 Å²	76.6	10%	0.097	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	164.9	-176.4	59.9	84.1	0	0	0	112.1	L62 R63 K64 F233 N237 H240	L62-H235 PolarHBondContact O-CD2 3.13Å; L62-H235 PolarHBondContact O-N 3.15Å; R63-H235 CarbonylContact C-O 3.5Å; R63-H235 VanDerWaalsContact CA-O 3.25Å; R63-H235 WeakPolarHBondContact CA-O 3.44Å; K64-H235 PolarHBondContact N-O 3.42Å; F233-H235 HydrophobicContact CD1-CB 4.39Å; F233-H235 AromaticContact CD1-CD2 3.78Å; F233-H235 HydrophobicContact CE1-CB 3.89Å; F233-H235 AromaticContact CE1-CD2 3.99Å; F233-H235 HydrophobicContact CZ-CB 4.36Å; F233-H235 PolarHBondContact O-CD2 2.95Å; H235-N237 PolarHBondContact CE1-O 3.42Å; H235-N237 VanDerWaalsContact CE1-O 3.24Å; H235-N237 PolarHBondContact ND1-N 2.81Å; H235-N237 PolarHBondContact ND1-O 3.06Å; H235-H240 AromaticContact CD2-CG 3.92Å; H235-H240 VanDerWaalsContact CE1-CB 3.4Å; H235-H240 WeakPolarHBondContact CE1-CB 3.19Å; H235-H240 AromaticContact CE1-CG 3.7Å; H235-H240 AromaticContact NE2-CD2 3.49Å; H235-H240 PolarHBondContact NE2-CD2 3.31Å; H235-H240 AromaticContact NE2-CG 3.5Å
236	N	95.8	Very high	91.8	Very high	93 Å²	93	83.1 Å²	83.1	50%	0.497	41%	0.413	S	S	.	.			trans	-110.3	17.2	168.3	-158.9	12.7	0	0	0	113.6
237	N	94.6	Very high	90.4	Very high	79 Å²	79	90.9 Å²	90.9	42%	0.422	45%	0.454	S	S	.	.			trans	-86.6	120.5	178.3	-175.3	2.8	0	0	0	112	H235 K239 H240	H235-N237 PolarHBondContact CE1-O 3.42Å; H235-N237 VanDerWaalsContact CE1-O 3.24Å; H235-N237 PolarHBondContact ND1-N 2.81Å; H235-N237 PolarHBondContact ND1-O 3.06Å; N237-K239 VanDerWaalsContact C-N 3.34Å; N237-K239 WeakPolarHBondContact OD1-CA 3.42Å; N237-K239 WeakPolarHBondContact OD1-CB 3.27Å; N237-K239 PolarHBondContact OD1-N 2.83Å; N237-H240 HydrophobicContact CB-CB 4.3Å
238	S	93.7	Very high	88.5	Confident	70 Å²	70	91.5 Å²	91.5	49%	0.49	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.4	174	59.8	0	0	0	0	114.2
239	K	92.3	Very high	86.9	Confident	151 Å²	151	91.9 Å²	91.9	66%	0.657	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	0.7	176.7	-54.5	176.7	-176.7	174.9	0	112.7	N237 R242	N237-K239 VanDerWaalsContact C-N 3.34Å; N237-K239 WeakPolarHBondContact OD1-CA 3.42Å; N237-K239 WeakPolarHBondContact OD1-CB 3.27Å; N237-K239 PolarHBondContact OD1-N 2.83Å; K239-R242 WeakPolarHBondContact O-CB 3.29Å; K239-R242 PolarHBondContact O-N 3.4Å; K239-R242 VanDerWaalsContact O-N 3.07Å
240	H	89.7	Confident	85	Confident	70 Å²	70	92.7 Å²	92.7	32%	0.324	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	141.8	178.3	-177.4	86.7	0	0	0	111.1	N61 F233 H235 N237 R242	N61-H240 VanDerWaalsContact CG-NE2 3.33Å; N61-H240 PolarHBondContact OD1-NE2 3.02Å; N61-H240 VanDerWaalsContact OD1-NE2 3.16Å; F233-H240 AromaticContact CD1-CE1 3.88Å; F233-H240 AromaticContact CE1-CE1 3.91Å; H235-H240 AromaticContact CD2-CG 3.92Å; H235-H240 VanDerWaalsContact CE1-CB 3.4Å; H235-H240 WeakPolarHBondContact CE1-CB 3.19Å; H235-H240 AromaticContact CE1-CG 3.7Å; H235-H240 AromaticContact NE2-CD2 3.49Å; H235-H240 PolarHBondContact NE2-CD2 3.31Å; H235-H240 AromaticContact NE2-CG 3.5Å; N237-H240 HydrophobicContact CB-CB 4.3Å; H240-R242 PolarHBondContact O-N 3.4Å
241	G	87.9	Confident	83	Confident	76 Å²	76	90.7 Å²	90.7	78%	0.784	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	-10.8	-174	0	0	0	0	0	115.7
242	R	89.5	Confident	80.6	Confident	183 Å²	183	90.2 Å²	90.2	69%	0.691	46%	0.464	S	S	*	.	S	Bend	trans	-89.7	135.2	176.1	-56.1	-175.6	-179.7	-170.2	-3.5	110.2	K239 H240	K239-R242 WeakPolarHBondContact O-CB 3.29Å; K239-R242 PolarHBondContact O-N 3.4Å; K239-R242 VanDerWaalsContact O-N 3.07Å; H240-R242 PolarHBondContact O-N 3.4Å
243	R	85.4	Confident	78.2	Confident	241 Å²	241	96.5 Å²	96.5	91%	0.909	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-60	147.2	167.3	-67	-176.2	178.3	-174.5	-1	109.6	R245	R243-R245 PolarHBondContact O-N 3.26Å
244	A	80.6	Confident	75.7	Confident	100 Å²	100	99 Å²	99	83%	0.826	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-57.8	129.1	173.4	0	0	0	0	0	109.4
245	R	76.1	Confident	73.1	Confident	215 Å²	215	103 Å²	103	81%	0.811	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-67.6	133.2	168.4	-67.6	-175.8	176.3	-172.5	-4.2	107.3	R243 L247	R243-R245 PolarHBondContact O-N 3.26Å; R245-L247 PolarHBondContact O-N 2.66Å
246	R	65.3	Low	70.2	Confident	175 Å²	175	107.6 Å²	107.6	66%	0.66	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-58	128	166.8	-72.4	-171.7	177.2	-178.2	0.9	107	D248 E251	R246-D248 PolarHBondContact O-N 3.39Å; R246-E251 WeakPolarHBondContact CD-OE2 3.14Å; R246-E251 IonicContact CZ-OE2 2.78Å; R246-E251 IonicContact NE-OE2 2.97Å; R246-E251 IonicContact NH1-OE1 2.72Å; R246-E251 PolarHBondContact NH1-OE1 3.25Å; R246-E251 IonicContact NH1-OE2 3.44Å; R246-E251 PolarHBondContact NH1-OE2 2.9Å
247	L	67.6	Low	67.6	Low	172 Å²	172	112.2 Å²	112.2	90%	0.901	60%	0.6	S	S	*	*			trans	-79.5	11.4	175.7	-69.1	171	0	0	0	111.7	R245 P249	R245-L247 PolarHBondContact O-N 2.66Å; L247-P249 WeakPolarHBondContact O-CD 3.47Å
248	D	59.6	Low	64.9	Low	26 Å²	26	116 Å²	116	14%	0.139	62%	0.619	C	S	.	*			trans	-84.8	114.4	-176.8	-154.3	-61.3	0	0	0	109.8	R246 S250 E251 Y330 K331	R246-D248 PolarHBondContact O-N 3.39Å; D248-S250 PolarHBondContact O-N 2.64Å; D248-S250 WeakPolarHBondContact OD1-CB 3.5Å; D248-S250 PolarHBondContact OD1-N 2.7Å; D248-S250 PolarHBondContact OD1-OG 3.26Å; D248-E251 HydrophobicContact CB-CB 4.27Å; D248-E251 CarbonylContact O-C 3.55Å; D248-E251 PolarHBondContact O-N 2.67Å; D248-E251 VanDerWaalsContact O-N 3.15Å; D248-Y330 WeakPolarHBondContact OD1-CE1 3.34Å; D248-K331 WeakPolarHBondContact OD2-CD 3.45Å; D248-K331 WeakPolarHBondContact OD2-CE 3.37Å; D248-K331 IonicContact OD2-NZ 2.72Å; D248-K331 PolarHBondContact OD2-NZ 3.01Å
249	P	63.1	Low	62.1	Low	66 Å²	66	120.9 Å²	120.9	43%	0.429	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-61.8	-28.6	178.9	-20.6	33.8	0	0	0	112	L247 E251 F289	L247-P249 WeakPolarHBondContact O-CD 3.47Å; P249-E251 VanDerWaalsContact C-N 3.33Å; P249-F289 HydrophobicContact CB-CD1 4.11Å; P249-F289 HydrophobicContact CB-CD2 4.37Å; P249-F289 HydrophobicContact CB-CE1 4.39Å; P249-F289 HydrophobicContact CB-CG 4.1Å; P249-F289 HydrophobicContact CG-CD2 4.28Å; P249-F289 HydrophobicContact CG-CG 4.4Å
250	S	59.5	Low	60.1	Low	20 Å²	20	119.8 Å²	119.8	14%	0.14	64%	0.635	C	S	.	*	G	3₁₀ helix	trans	-79.7	-11.2	-180	77.3	0	0	0	0	114.2	D248	D248-S250 PolarHBondContact O-N 2.64Å; D248-S250 WeakPolarHBondContact OD1-CB 3.5Å; D248-S250 PolarHBondContact OD1-N 2.7Å; D248-S250 PolarHBondContact OD1-OG 3.26Å
251	E	57.2	Low	59	Low	54 Å²	54	118.8 Å²	118.8	25%	0.252	64%	0.639	S	S	.	*	G	3₁₀ helix	trans	-123.6	63.5	173.3	-69.1	-169.3	146.2	0	0	111.2	R246 D248 P249 T253 K333	R246-E251 WeakPolarHBondContact CD-OE2 3.14Å; R246-E251 IonicContact CZ-OE2 2.78Å; R246-E251 IonicContact NE-OE2 2.97Å; R246-E251 IonicContact NH1-OE1 2.72Å; R246-E251 PolarHBondContact NH1-OE1 3.25Å; R246-E251 IonicContact NH1-OE2 3.44Å; R246-E251 PolarHBondContact NH1-OE2 2.9Å; D248-E251 HydrophobicContact CB-CB 4.27Å; D248-E251 CarbonylContact O-C 3.55Å; D248-E251 PolarHBondContact O-N 2.67Å; D248-E251 VanDerWaalsContact O-N 3.15Å; P249-E251 VanDerWaalsContact C-N 3.33Å; E251-T253 PolarHBondContact O-N 2.58Å; E251-K333 IonicContact OE1-NZ 2.68Å; E251-K333 PolarHBondContact OE1-NZ 3.09Å
252	G	47.4	Very low	59.1	Low	59 Å²	59	119.4 Å²	119.4	61%	0.608	63%	0.628	S	S	*	*			trans	-66	67.8	165.7	0	0	0	0	0	112.6	A254	G252-A254 PolarHBondContact O-N 3.04Å
253	T	46.8	Very low	59.3	Low	132 Å²	132	110.8 Å²	110.8	81%	0.81	60%	0.596	S	S	*	*			trans	-72.8	68	170.9	-40.6	0	0	0	0	110.3	E251	E251-T253 PolarHBondContact O-N 2.58Å
254	A	44.3	Very low	59.7	Low	76 Å²	76	101.2 Å²	101.2	63%	0.628	57%	0.565	S	S	*	*			trans	-104.7	153	167.2	0	0	0	0	0	108.9	G252 S256	G252-A254 PolarHBondContact O-N 3.04Å; A254-S256 PolarHBondContact O-N 3.15Å
255	P	44.2	Very low	60.5	Low	83 Å²	83	97.4 Å²	97.4	54%	0.539	53%	0.531	S	S	.	.			trans	-71.8	120.1	-168.3	27.3	-34.2	0	0	0	113	Y257	P255-Y257 VanDerWaalsContact C-N 3.32Å; P255-Y257 HydrophobicContact CB-CE1 4.45Å; P255-Y257 HydrophobicContact CG-CE1 4.16Å; P255-Y257 WeakPolarHBondContact O-CD1 3.39Å; P255-Y257 WeakPolarHBondContact O-CE1 3.38Å; P255-Y257 PolarHBondContact O-N 3.24Å
256	S	34	Very low	61.4	Low	118 Å²	118	93.6 Å²	93.6	83%	0.825	52%	0.52	S	S	*	.	S	Bend	trans	43	26.2	141.4	73.2	0	0	0	0	121.4	A254	A254-S256 PolarHBondContact O-N 3.15Å
257	Y	40.7	Very low	62.9	Low	190 Å²	190	87.4 Å²	87.4	75%	0.745	51%	0.506	S	S	*	.	S	Bend	trans	-151.5	20	170	43.7	-101.7	0	0	0	114.4	P255	P255-Y257 VanDerWaalsContact C-N 3.32Å; P255-Y257 HydrophobicContact CB-CE1 4.45Å; P255-Y257 HydrophobicContact CG-CE1 4.16Å; P255-Y257 WeakPolarHBondContact O-CD1 3.39Å; P255-Y257 WeakPolarHBondContact O-CE1 3.38Å; P255-Y257 PolarHBondContact O-N 3.24Å
258	L	38.4	Very low	64.3	Low	159 Å²	159	80 Å²	80	83%	0.832	47%	0.468	S	S	*	.			trans	-140.6	82.8	169.3	-155.5	74	0	0	0	110.5
259	E	35	Very low	66.1	Low	173 Å²	173	82.1 Å²	82.1	81%	0.808	48%	0.484	S	S	*	.			trans	-55.7	154	156	-112.9	167.1	132.1	0	0	109.9
260	N	49.4	Very low	67.7	Low	127 Å²	127	81.9 Å²	81.9	68%	0.679	48%	0.483	S	S	*	.			trans	78.8	59.5	166.9	-50.6	-4.5	0	0	0	118.4	N287	N260-N287 PolarHBondContact O-ND2 2.85Å; N260-N287 PolarHBondContact O-OD1 3.49Å
261	A	68.3	Low	69.5	Low	49 Å²	49	84.1 Å²	84.1	41%	0.405	50%	0.499	S	S	.	.			trans	-111.3	7.2	154.9	0	0	0	0	0	113.8
262	T	88.2	Confident	71.3	Confident	90 Å²	90	87.3 Å²	87.3	55%	0.552	51%	0.513	S	S	*	.	S	Bend	trans	-72.1	129	173.4	-51	0	0	0	0	109.4	C264 N287 F335	T262-C264 PolarHBondContact O-N 3.28Å; T262-N287 PolarHBondContact O-ND2 3.44Å; T262-F335 HydrophobicContact CG2-CD1 3.9Å
263	P	93.7	Very high	73.6	Confident	2 Å²	2	85.2 Å²	85.2	1%	0.013	49%	0.491	C	S	.	.			trans	-65.5	130.8	175.2	27.9	-34.6	0	0	0	110.4	D286 F288 F289 L292 L328 F335	P263-D286 WeakPolarHBondContact CA-O 3.43Å; P263-F288 HydrophobicContact CB-CD1 4.23Å; P263-F289 HydrophobicContact CG-CE1 4.22Å; P263-L292 HydrophobicContact CB-CD1 4.49Å; P263-L292 HydrophobicContact CB-CD2 3.99Å; P263-L292 HydrophobicContact CG-CD1 4.26Å; P263-L328 HydrophobicContact CB-CD1 3.84Å; P263-L328 HydrophobicContact CG-CD1 4.49Å; P263-F335 HydrophobicContact CG-CB 4.21Å; P263-F335 HydrophobicContact CG-CD1 3.92Å; P263-F335 HydrophobicContact CG-CD2 3.68Å; P263-F335 HydrophobicContact CG-CE1 4.19Å; P263-F335 HydrophobicContact CG-CE2 3.97Å; P263-F335 HydrophobicContact CG-CG 3.66Å; P263-F335 HydrophobicContact CG-CZ 4.22Å
264	C	93.9	Very high	75.8	Confident	39 Å²	39	84.6 Å²	84.6	26%	0.264	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145.9	-178.4	75.5	0	0	0	0	111.9	T262 G285 D286 F288	T262-C264 PolarHBondContact O-N 3.28Å; C264-G285 WeakPolarHBondContact O-CA 3.18Å; C264-D286 PolarHBondContact N-O 2.81Å; C264-D286 VanDerWaalsContact N-O 3.08Å; C264-D286 PolarHBondContact O-N 3.14Å; C264-F288 WeakPolarHBondContact O-CE1 3.34Å; C264-F288 WeakPolarHBondContact O-CZ 3.43Å
265	I	97	Very high	78.2	Confident	20 Å²	20	82.2 Å²	82.2	10%	0.103	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	132.9	171.4	-60	176.1	0	0	0	108.2	I268 I283 V326 L328 C336	I265-I268 HydrophobicContact CG2-CD1 4.31Å; I265-I268 HydrophobicContact CG2-CG1 4Å; I265-I283 HydrophobicContact CB-CG2 4.45Å; I265-I283 HydrophobicContact CD1-CG2 4.3Å; I265-I283 HydrophobicContact CG1-CG2 3.93Å; I265-I283 HydrophobicContact CG2-CG2 3.95Å; I265-V326 HydrophobicContact CD1-CG1 4.15Å; I265-V326 WeakPolarHBondContact CD1-O 3.13Å; I265-L328 HydrophobicContact CD1-CD1 4.48Å; I265-L328 HydrophobicContact CD1-CD2 3.88Å; I265-L328 HydrophobicContact CD1-CG 3.92Å; I265-L328 HydrophobicContact CG1-CD1 3.85Å; I265-L328 HydrophobicContact CG1-CD2 3.93Å; I265-L328 HydrophobicContact CG1-CG 3.84Å; I265-C336 HydrophobicContact CD1-CB 4.49Å; I265-C336 PolarHBondContact N-SG 2.96Å; I265-C336 VanDerWaalsContact N-SG 3.38Å
266	K	96	Very high	80.5	Confident	135 Å²	135	82.5 Å²	82.5	59%	0.587	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	-40.2	171.3	-71.8	176	176.9	166.2	0	112.4	I284 D286	K266-I284 PolarHBondContact N-O 2.78Å; K266-D286 WeakPolarHBondContact CE-OD2 3.38Å; K266-D286 IonicContact NZ-OD1 2.7Å; K266-D286 PolarHBondContact NZ-OD1 3Å; K266-D286 IonicContact NZ-OD2 3.54Å; K266-D286 PolarHBondContact NZ-OD2 3.02Å
267	A	96.9	Very high	83.4	Confident	45 Å²	45	77.6 Å²	77.6	37%	0.372	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	161.2	179.6	0	0	0	0	0	111.7	I284	A267-I284 HydrophobicContact CB-CB 4.32Å; A267-I284 PolarHBondContact N-O 2.89Å; A267-I284 PolarHBondContact O-N 3.23Å
268	I	97.7	Very high	85.9	Confident	18 Å²	18	71.3 Å²	71.3	9%	0.092	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125	176.2	-58.3	-168	0	0	0	107.2	I265 V281 I283 V326 F343	I265-I268 HydrophobicContact CG2-CD1 4.31Å; I265-I268 HydrophobicContact CG2-CG1 4Å; I268-V281 HydrophobicContact CG2-CG1 3.35Å; I268-I283 HydrophobicContact CD1-CD1 4.39Å; I268-I283 HydrophobicContact CD1-CG1 4.29Å; I268-I283 HydrophobicContact CG1-CG1 4.12Å; I268-I283 HydrophobicContact CG1-CG2 4.38Å; I268-I283 HydrophobicContact CG2-CG1 4.28Å; I268-V326 HydrophobicContact CD1-CB 3.45Å; I268-V326 VanDerWaalsContact CD1-CB 3.45Å; I268-V326 HydrophobicContact CD1-CG1 3.66Å; I268-V326 HydrophobicContact CD1-CG2 3.65Å; I268-F343 HydrophobicContact CG2-CD2 4.21Å
269	S	96.8	Very high	88.6	Confident	69 Å²	69	65.4 Å²	65.4	48%	0.483	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	123.2	-175.1	-170.9	0	0	0	0	111.6	I282	S269-I282 PolarHBondContact N-O 3.08Å; S269-I282 PolarHBondContact O-N 3.47Å
270	P	97.1	Very high	91.5	Very high	62 Å²	62	60.5 Å²	60.5	40%	0.403	37%	0.369	S	S	.	.	S	Bend	cis	-62.9	154.9	-9.7	28.5	-35.9	0	0	0	112.2	E272 V281 F343	P270-E272 VanDerWaalsContact C-N 3.32Å; P270-V281 HydrophobicContact CG-CG2 4.22Å; P270-F343 WeakPolarHBondContact O-CE2 3.34Å
271	S	96.6	Very high	93.8	Very high	67 Å²	67	54.5 Å²	54.5	47%	0.469	34%	0.337	S	S	.	.	S	Bend	trans	-86.9	-0.7	178.1	54.2	0	0	0	0	113.8	F343 V344	S271-F343 CarbonylContact O-C 3.58Å; S271-F343 WeakPolarHBondContact O-CA 3.39Å; S271-V344 PolarHBondContact O-N 2.97Å
272	E	95.4	Very high	95.2	Very high	121 Å²	121	54.5 Å²	54.5	57%	0.565	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.9	161.1	-178.8	62.7	178.9	-154.6	0	0	111.8	P270 F343 V344	P270-E272 VanDerWaalsContact C-N 3.32Å; E272-F343 WeakPolarHBondContact O-CZ 3.29Å; E272-V344 CarbonylContact C-O 3.47Å; E272-V344 WeakPolarHBondContact CA-O 3.22Å; E272-V344 HydrophobicContact CB-CB 4.01Å
273	G	94.7	Very high	95.7	Very high	14 Å²	14	50.2 Å²	50.2	14%	0.144	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.9	176.9	175.8	0	0	0	0	0	113.5	F343 V344 Y345 T346	G273-F343 VanDerWaalsContact N-CZ 3.33Å; G273-V344 PolarHBondContact N-O 2.72Å; G273-Y345 WeakPolarHBondContact O-CA 3.44Å; G273-T346 PolarHBondContact O-N 2.78Å
274	W	94.1	Very high	95.9	Very high	119 Å²	119	53.8 Å²	53.8	45%	0.451	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	144.6	-173.5	-58.3	114.8	0	0	0	113.4	T276 G277 T346 L348	W274-T276 WeakPolarHBondContact CB-OG1 3.47Å; W274-T276 PolarHBondContact O-N 2.84Å; W274-G277 PolarHBondContact O-N 3.13Å; W274-T346 WeakPolarHBondContact CA-O 3.38Å; W274-T346 HydrophobicContact CE3-CG2 4.46Å; W274-T346 HydrophobicContact CZ3-CG2 3.93Å; W274-L348 HydrophobicContact CD2-CD2 4.01Å; W274-L348 HydrophobicContact CD2-CG 4.07Å; W274-L348 HydrophobicContact CE3-CD2 3.72Å; W274-L348 HydrophobicContact CE3-CG 3.66Å; W274-L348 HydrophobicContact CH2-CD2 3.62Å; W274-L348 HydrophobicContact CH2-CG 4.46Å; W274-L348 HydrophobicContact CZ2-CD2 3.9Å; W274-L348 HydrophobicContact CZ3-CD2 3.51Å; W274-L348 HydrophobicContact CZ3-CG 3.88Å
275	T	93.9	Very high	96	Very high	26 Å²	26	52 Å²	52	16%	0.16	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-19	170.9	41.5	0	0	0	0	114.7	G277 R318 P321 T346 A347	T275-G277 PolarHBondContact O-N 3.47Å; T275-R318 WeakPolarHBondContact CA-O 3.46Å; T275-R318 WeakPolarHBondContact CB-O 3.42Å; T275-R318 VanDerWaalsContact CG2-O 3.24Å; T275-R318 WeakPolarHBondContact CG2-O 3.4Å; T275-R318 PolarHBondContact O-N 2.85Å; T275-R318 VanDerWaalsContact O-O 3.09Å; T275-P321 HydrophobicContact CG2-CB 4.38Å; T275-T346 PolarHBondContact N-O 2.78Å; T275-T346 PolarHBondContact OG1-O 3.28Å; T275-A347 HydrophobicContact CG2-CB 4.07Å
276	T	93.3	Very high	95.9	Very high	90 Å²	90	52.9 Å²	52.9	55%	0.552	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.8	174.1	54.9	0	0	0	0	113.9	W274 P317	W274-T276 WeakPolarHBondContact CB-OG1 3.47Å; W274-T276 PolarHBondContact O-N 2.84Å; T276-P317 WeakPolarHBondContact O-CB 3.18Å; T276-P317 WeakPolarHBondContact O-CG 3.17Å
277	G	93.6	Very high	95.7	Very high	14 Å²	14	49 Å²	49	14%	0.144	30%	0.3	C	S	.	.			trans	71.2	-169.9	-168.4	0	0	0	0	0	113	W274 T275 A279 T315	W274-G277 PolarHBondContact O-N 3.13Å; T275-G277 PolarHBondContact O-N 3.47Å; G277-A279 VanDerWaalsContact C-N 3.33Å; G277-T315 CarbonylContact C-O 3.53Å; G277-T315 WeakPolarHBondContact CA-O 3.36Å; G277-T315 WeakPolarHBondContact CA-OG1 3.44Å
278	G	94	Very high	95.7	Very high	58 Å²	58	47.1 Å²	47.1	60%	0.598	28%	0.284	S	S	*	.			trans	80.4	5.4	178.6	0	0	0	0	0	115.4	Q314 T315	G278-Q314 PolarHBondContact O-OE1 3Å; G278-T315 PolarHBondContact N-O 2.94Å; G278-T315 PolarHBondContact N-OG1 2.85Å
279	A	94.9	Very high	95.5	Very high	35 Å²	35	47.7 Å²	47.7	29%	0.289	29%	0.286	S	S	.	.			trans	-84	135	175.8	0	0	0	0	0	110.5	G277 V281 Q314 T315	G277-A279 VanDerWaalsContact C-N 3.33Å; A279-V281 PolarHBondContact O-N 3.5Å; A279-Q314 VanDerWaalsContact C-OE1 3.29Å; A279-Q314 WeakPolarHBondContact O-CA 3.46Å; A279-Q314 PolarHBondContact O-OE1 3.34Å; A279-T315 HydrophobicContact CB-CG2 4.34Å; A279-T315 WeakPolarHBondContact CB-OG1 3.26Å; A279-T315 PolarHBondContact N-OG1 2.8Å; A279-T315 PolarHBondContact O-N 3.37Å; A279-T315 PolarHBondContact O-OG1 2.81Å
280	T	96.7	Very high	95.2	Very high	71 Å²	71	50.6 Å²	50.6	44%	0.436	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	123	176.9	-58	0	0	0	0	110.3	R312 Q314	T280-R312 HydrophobicContact CG2-CG 3.84Å; T280-Q314 VanDerWaalsContact CA-OE1 3.31Å; T280-Q314 PolarHBondContact OG1-NE2 2.8Å; T280-Q314 PolarHBondContact OG1-OE1 2.88Å
281	V	97.4	Very high	95	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	135.1	180	172.3	0	0	0	0	109.7	I268 P270 A279 I283 V313 T315 F343	I268-V281 HydrophobicContact CG2-CG1 3.35Å; P270-V281 HydrophobicContact CG-CG2 4.22Å; A279-V281 PolarHBondContact O-N 3.5Å; V281-I283 HydrophobicContact CG1-CG1 4.37Å; V281-V313 PolarHBondContact N-O 3.06Å; V281-V313 PolarHBondContact O-N 3.35Å; V281-T315 HydrophobicContact CB-CG2 4.47Å; V281-T315 HydrophobicContact CG2-CG2 3.52Å; V281-F343 HydrophobicContact CG2-CD2 4.43Å; V281-F343 HydrophobicContact CG2-CE2 3.69Å; V281-F343 HydrophobicContact CG2-CZ 4.31Å
282	I	97.8	Very high	94.9	Very high	49 Å²	49	46.2 Å²	46.2	25%	0.251	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	123.1	172.7	-52.3	-53.9	0	0	0	108.6	S269 I284 I306 A310 I311 R312	S269-I282 PolarHBondContact N-O 3.08Å; S269-I282 PolarHBondContact O-N 3.47Å; I282-I284 HydrophobicContact CG2-CG1 4.28Å; I282-I306 HydrophobicContact CD1-CD1 3.87Å; I282-A310 HydrophobicContact CG2-CB 4.3Å; I282-I311 WeakPolarHBondContact CA-O 3.28Å; I282-R312 HydrophobicContact CD1-CB 3.81Å; I282-R312 HydrophobicContact CD1-CG 4.02Å
283	I	97.9	Very high	94.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	125.9	172.9	-61.2	177.1	0	0	0	107.4	I265 I268 V281 F288 V294 A310 I311 V313 V326	I265-I283 HydrophobicContact CB-CG2 4.45Å; I265-I283 HydrophobicContact CD1-CG2 4.3Å; I265-I283 HydrophobicContact CG1-CG2 3.93Å; I265-I283 HydrophobicContact CG2-CG2 3.95Å; I268-I283 HydrophobicContact CD1-CD1 4.39Å; I268-I283 HydrophobicContact CD1-CG1 4.29Å; I268-I283 HydrophobicContact CG1-CG1 4.12Å; I268-I283 HydrophobicContact CG1-CG2 4.38Å; I268-I283 HydrophobicContact CG2-CG1 4.28Å; V281-I283 HydrophobicContact CG1-CG1 4.37Å; I283-F288 HydrophobicContact CG2-CE2 4.44Å; I283-F288 HydrophobicContact CG2-CZ 4.06Å; I283-F288 WeakPolarHBondContact O-CE2 3.43Å; I283-V294 HydrophobicContact CD1-CB 4.35Å; I283-V294 HydrophobicContact CD1-CG1 3.49Å; I283-V294 VanDerWaalsContact CD1-CG1 3.49Å; I283-V294 HydrophobicContact CD1-CG2 3.92Å; I283-A310 WeakPolarHBondContact O-CA 3.19Å; I283-I311 HydrophobicContact CB-CD1 4.23Å; I283-I311 HydrophobicContact CB-CG1 3.73Å; I283-I311 HydrophobicContact CG2-CD1 4.38Å; I283-I311 HydrophobicContact CG2-CG1 4.3Å; I283-I311 PolarHBondContact N-O 2.67Å; I283-I311 PolarHBondContact O-N 2.89Å; I283-V313 HydrophobicContact CD1-CG2 4.01Å; I283-V313 HydrophobicContact CG1-CG2 4.49Å; I283-V326 HydrophobicContact CD1-CG1 3.86Å
284	I	97.6	Very high	95	Very high	77 Å²	77	42 Å²	42	40%	0.395	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	138.1	-178.3	-57.5	172	0	0	0	108.3	K266 A267 I282 H309	K266-I284 PolarHBondContact N-O 2.78Å; A267-I284 HydrophobicContact CB-CB 4.32Å; A267-I284 PolarHBondContact N-O 2.89Å; A267-I284 PolarHBondContact O-N 3.23Å; I282-I284 HydrophobicContact CG2-CG1 4.28Å; I284-H309 CarbonylContact C-O 3.49Å; I284-H309 VanDerWaalsContact CA-O 3.31Å; I284-H309 WeakPolarHBondContact CA-O 3.3Å
285	G	96.1	Very high	95.1	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177	-151.2	-173.9	0	0	0	0	0	113.2	C264 H309	C264-G285 WeakPolarHBondContact O-CA 3.18Å; G285-H309 PolarHBondContact N-O 3.18Å; G285-H309 WeakPolarHBondContact O-CA 3.33Å; G285-H309 VanDerWaalsContact O-CB 3.25Å; G285-H309 WeakPolarHBondContact O-CB 3.18Å; G285-H309 PolarHBondContact O-ND1 2.82Å; G285-H309 VanDerWaalsContact O-ND1 3.1Å
286	D	94.9	Very high	95.2	Very high	39 Å²	39	36 Å²	36	21%	0.209	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	160.9	172.2	-55	-39.1	0	0	0	111.2	P263 C264 K266 F288 P308 H309	P263-D286 WeakPolarHBondContact CA-O 3.43Å; C264-D286 PolarHBondContact N-O 2.81Å; C264-D286 VanDerWaalsContact N-O 3.08Å; C264-D286 PolarHBondContact O-N 3.14Å; K266-D286 WeakPolarHBondContact CE-OD2 3.38Å; K266-D286 IonicContact NZ-OD1 2.7Å; K266-D286 PolarHBondContact NZ-OD1 3Å; K266-D286 IonicContact NZ-OD2 3.54Å; K266-D286 PolarHBondContact NZ-OD2 3.02Å; D286-F288 VanDerWaalsContact C-N 3.27Å; D286-F288 WeakPolarHBondContact O-CD1 3.4Å; D286-F288 PolarHBondContact O-N 3.45Å; D286-P308 CarbonylContact C-O 3.58Å; D286-H309 IonicContact OD1-CE1 2.64Å; D286-H309 PolarHBondContact OD1-CE1 3.47Å; D286-H309 IonicContact OD1-ND1 3.57Å; D286-H309 PolarHBondContact OD1-ND1 3.08Å
287	N	93.3	Very high	95.3	Very high	53 Å²	53	33.3 Å²	33.3	28%	0.283	22%	0.215	S	C	.	.	S	Bend	trans	58.8	32.1	172.3	-55.1	-44.1	0	0	0	114.4	N260 T262 F289 P308	N260-N287 PolarHBondContact O-ND2 2.85Å; N260-N287 PolarHBondContact O-OD1 3.49Å; T262-N287 PolarHBondContact O-ND2 3.44Å; N287-F289 WeakPolarHBondContact O-CD1 3.4Å; N287-P308 PolarHBondContact N-O 3.31Å; N287-P308 VanDerWaalsContact N-O 3.09Å
288	F	95.4	Very high	95.2	Very high	7 Å²	7	39.6 Å²	39.6	3%	0.031	25%	0.25	C	S	.	.			trans	-73.8	145.5	170.1	-56.3	-26.8	0	0	0	111	P263 C264 I283 D286 L292 L305 P308 I311 L328	P263-F288 HydrophobicContact CB-CD1 4.23Å; C264-F288 WeakPolarHBondContact O-CE1 3.34Å; C264-F288 WeakPolarHBondContact O-CZ 3.43Å; I283-F288 HydrophobicContact CG2-CE2 4.44Å; I283-F288 HydrophobicContact CG2-CZ 4.06Å; I283-F288 WeakPolarHBondContact O-CE2 3.43Å; D286-F288 VanDerWaalsContact C-N 3.27Å; D286-F288 WeakPolarHBondContact O-CD1 3.4Å; D286-F288 PolarHBondContact O-N 3.45Å; F288-L292 HydrophobicContact CB-CD2 4.16Å; F288-L292 HydrophobicContact CD1-CD2 3.64Å; F288-L292 HydrophobicContact CE1-CD2 4.46Å; F288-L292 HydrophobicContact CG-CD2 4.2Å; F288-L305 HydrophobicContact CB-CD1 3.62Å; F288-P308 PolarHBondContact N-O 2.77Å; F288-I311 HydrophobicContact CB-CG2 3.77Å; F288-I311 HydrophobicContact CD2-CB 4.34Å; F288-I311 HydrophobicContact CD2-CD1 4.36Å; F288-I311 HydrophobicContact CD2-CG1 4.13Å; F288-I311 HydrophobicContact CD2-CG2 3.69Å; F288-I311 HydrophobicContact CE2-CD1 4.31Å; F288-I311 HydrophobicContact CE2-CG1 4.07Å; F288-I311 HydrophobicContact CE2-CG2 4.47Å; F288-I311 HydrophobicContact CG-CD1 4.47Å; F288-I311 HydrophobicContact CG-CG2 3.86Å; F288-I311 HydrophobicContact CZ-CD1 4.37Å; F288-L328 HydrophobicContact CD1-CD1 4.26Å; F288-L328 HydrophobicContact CE1-CD1 3.65Å
289	F	93.4	Very high	95.2	Very high	29 Å²	29	41.3 Å²	41.3	13%	0.127	24%	0.244	C	C	.	.			trans	-147.5	163.7	-177.6	55.5	-97.5	0	0	0	110.2	P249 P263 N287 L292 Y330	P249-F289 HydrophobicContact CB-CD1 4.11Å; P249-F289 HydrophobicContact CB-CD2 4.37Å; P249-F289 HydrophobicContact CB-CE1 4.39Å; P249-F289 HydrophobicContact CB-CG 4.1Å; P249-F289 HydrophobicContact CG-CD2 4.28Å; P249-F289 HydrophobicContact CG-CG 4.4Å; P263-F289 HydrophobicContact CG-CE1 4.22Å; N287-F289 WeakPolarHBondContact O-CD1 3.4Å; F289-L292 HydrophobicContact CD2-CB 4.38Å; F289-L292 HydrophobicContact CE1-CD1 4.34Å; F289-L292 HydrophobicContact CE2-CB 4.26Å; F289-L292 HydrophobicContact CE2-CD1 4.37Å; F289-L292 HydrophobicContact CZ-CD1 3.94Å; F289-L292 WeakPolarHBondContact O-CB 3.48Å; F289-L292 PolarHBondContact O-N 3.4Å; F289-Y330 AromaticContact CE2-CD1 3.78Å; F289-Y330 HydrophobicContact CE2-CD1 3.78Å; F289-Y330 AromaticContact CE2-CD2 3.67Å; F289-Y330 HydrophobicContact CE2-CD2 3.67Å; F289-Y330 AromaticContact CE2-CE1 3.89Å; F289-Y330 HydrophobicContact CE2-CE1 3.89Å; F289-Y330 AromaticContact CE2-CE2 3.78Å; F289-Y330 HydrophobicContact CE2-CE2 3.78Å; F289-Y330 AromaticContact CE2-CG 3.66Å; F289-Y330 HydrophobicContact CE2-CG 3.66Å; F289-Y330 AromaticContact CE2-CZ 3.89Å; F289-Y330 AromaticContact CZ-CD1 3.86Å; F289-Y330 HydrophobicContact CZ-CD1 3.86Å; F289-Y330 HydrophobicContact CZ-CD2 4.33Å; F289-Y330 HydrophobicContact CZ-CE1 4.3Å; F289-Y330 AromaticContact CZ-CG 3.86Å; F289-Y330 HydrophobicContact CZ-CG 3.86Å
290	D	92.2	Very high	95.2	Very high	131 Å²	131	44.3 Å²	44.3	70%	0.701	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	139.6	-174.8	-170.8	21.4	0	0	0	112.4	L292	D290-L292 VanDerWaalsContact C-N 3.31Å
291	G	91.5	Very high	95.2	Very high	36 Å²	36	42 Å²	42	37%	0.371	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	4.7	-172.1	0	0	0	0	0	115.8	Q293 Y330	G291-Q293 PolarHBondContact O-N 3.05Å; G291-Y330 WeakPolarHBondContact O-CD2 3.34Å
292	L	94.4	Very high	94.9	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	28%	0.278	C	S	.	.			trans	-65.1	128.4	168.3	-173.7	64.3	0	0	0	109.9	P263 F288 F289 D290 S303 L328 F335	P263-L292 HydrophobicContact CB-CD1 4.49Å; P263-L292 HydrophobicContact CB-CD2 3.99Å; P263-L292 HydrophobicContact CG-CD1 4.26Å; F288-L292 HydrophobicContact CB-CD2 4.16Å; F288-L292 HydrophobicContact CD1-CD2 3.64Å; F288-L292 HydrophobicContact CE1-CD2 4.46Å; F288-L292 HydrophobicContact CG-CD2 4.2Å; F289-L292 HydrophobicContact CD2-CB 4.38Å; F289-L292 HydrophobicContact CE1-CD1 4.34Å; F289-L292 HydrophobicContact CE2-CB 4.26Å; F289-L292 HydrophobicContact CE2-CD1 4.37Å; F289-L292 HydrophobicContact CZ-CD1 3.94Å; F289-L292 WeakPolarHBondContact O-CB 3.48Å; F289-L292 PolarHBondContact O-N 3.4Å; D290-L292 VanDerWaalsContact C-N 3.31Å; L292-S303 PolarHBondContact O-OG 2.9Å; L292-L328 HydrophobicContact CD1-CB 4.21Å; L292-L328 HydrophobicContact CD2-CD1 4.32Å; L292-F335 HydrophobicContact CD1-CE2 4.42Å
293	Q	95	Very high	94.7	Very high	47 Å²	47	50.4 Å²	50.4	22%	0.22	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	155.8	178.2	-63	173.3	-30.2	0	0	110.5	G291 L300 L328 S329	G291-Q293 PolarHBondContact O-N 3.05Å; Q293-L300 HydrophobicContact CB-CD2 3.99Å; Q293-L328 CarbonylContact O-C 3.55Å; Q293-L328 WeakPolarHBondContact O-CA 3.49Å; Q293-S329 WeakPolarHBondContact CA-O 3.06Å; Q293-S329 WeakPolarHBondContact CB-O 3.49Å; Q293-S329 PolarHBondContact N-O 2.96Å; Q293-S329 PolarHBondContact O-N 3.21Å
294	V	96.9	Very high	94.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	139.8	176.7	173.8	0	0	0	0	108.6	I283 F296 V301 I311 V313 V326 L328	I283-V294 HydrophobicContact CD1-CB 4.35Å; I283-V294 HydrophobicContact CD1-CG1 3.49Å; I283-V294 VanDerWaalsContact CD1-CG1 3.49Å; I283-V294 HydrophobicContact CD1-CG2 3.92Å; V294-F296 HydrophobicContact CG1-CD2 3.93Å; V294-F296 HydrophobicContact CG1-CE2 3.64Å; V294-V301 PolarHBondContact N-O 2.86Å; V294-V301 VanDerWaalsContact N-O 3.08Å; V294-V301 PolarHBondContact O-N 3.37Å; V294-I311 HydrophobicContact CG2-CD1 3.44Å; V294-I311 VanDerWaalsContact CG2-CD1 3.44Å; V294-I311 HydrophobicContact CG2-CG1 4.43Å; V294-V313 HydrophobicContact CB-CG1 4.42Å; V294-V313 HydrophobicContact CB-CG2 4.1Å; V294-V313 HydrophobicContact CG1-CG2 4.29Å; V294-V313 HydrophobicContact CG2-CG2 3.79Å; V294-V326 HydrophobicContact CG1-CG1 3.66Å; V294-L328 HydrophobicContact CG2-CD2 3.89Å
295	V	96.9	Very high	94.6	Very high	9 Å²	9	54.5 Å²	54.5	6%	0.055	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	118.8	178.8	-155.2	0	0	0	0	108.9	G297 M299 L300 V326 T327	V295-G297 WeakPolarHBondContact CG1-O 3.45Å; V295-M299 CarbonylContact C-O 3.59Å; V295-M299 WeakPolarHBondContact CA-O 3.46Å; V295-L300 HydrophobicContact CG1-CG 4.48Å; V295-L300 HydrophobicContact CG2-CD2 3.8Å; V295-V326 VanDerWaalsContact O-CA 3.29Å; V295-V326 WeakPolarHBondContact O-CA 3.47Å; V295-T327 WeakPolarHBondContact CB-OG1 3.44Å; V295-T327 PolarHBondContact N-O 3.08Å; V295-T327 PolarHBondContact O-N 3.01Å
296	F	96.7	Very high	94.6	Very high	9 Å²	9	58.9 Å²	58.9	4%	0.039	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	98.9	168.7	-77.3	-105.1	0	0	0	108.1	V294 T298 M299 V301 V313 T315 P316 V324 V326 F343 Y345	V294-F296 HydrophobicContact CG1-CD2 3.93Å; V294-F296 HydrophobicContact CG1-CE2 3.64Å; F296-T298 PolarHBondContact O-N 3.38Å; F296-M299 PolarHBondContact N-O 2.83Å; F296-M299 PolarHBondContact O-N 2.88Å; F296-V301 HydrophobicContact CD2-CG2 3.81Å; F296-V301 HydrophobicContact CE2-CG2 4.42Å; F296-V313 HydrophobicContact CE2-CB 4.48Å; F296-V313 HydrophobicContact CE2-CG1 3.86Å; F296-T315 HydrophobicContact CE1-CG2 4.25Å; F296-T315 HydrophobicContact CZ-CG2 4.38Å; F296-P316 HydrophobicContact CB-CG 3.78Å; F296-P316 HydrophobicContact CD2-CG 4.31Å; F296-P316 HydrophobicContact CG-CG 4.08Å; F296-V324 HydrophobicContact CB-CG1 4.28Å; F296-V326 HydrophobicContact CD1-CG2 3.75Å; F296-V326 HydrophobicContact CE1-CG2 3.85Å; F296-V326 HydrophobicContact CE2-CG1 4.45Å; F296-V326 HydrophobicContact CG-CG2 4.28Å; F296-V326 HydrophobicContact CZ-CG2 4.42Å; F296-F343 HydrophobicContact CD1-CB 4.25Å; F296-F343 HydrophobicContact CD1-CD1 4.3Å; F296-F343 HydrophobicContact CD1-CG 4.29Å; F296-F343 HydrophobicContact CE1-CB 3.95Å; F296-F343 HydrophobicContact CE1-CD1 4.07Å; F296-F343 HydrophobicContact CE1-CD2 4.15Å; F296-F343 AromaticContact CE1-CG 3.78Å; F296-F343 HydrophobicContact CE1-CG 3.78Å; F296-Y345 HydrophobicContact CD1-CE2 4.38Å
297	G	93.8	Very high	94.7	Very high	34 Å²	34	59.8 Å²	59.8	35%	0.351	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	-100.2	-171.8	0	0	0	0	0	110.6	V295 E325	V295-G297 WeakPolarHBondContact CG1-O 3.45Å; G297-E325 WeakPolarHBondContact CA-O 3.39Å; G297-E325 PolarHBondContact N-O 3.14Å
298	T	92.3	Very high	94.8	Very high	145 Å²	145	60.9 Å²	60.9	89%	0.89	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-10.5	175.5	53.3	0	0	0	0	113.5	F296	F296-T298 PolarHBondContact O-N 3.38Å
299	M	95	Very high	94.8	Very high	94 Å²	94	65.1 Å²	65.1	46%	0.463	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	116.5	-173.2	-169.5	150.1	173.8	0	0	111.3	V295 F296 P316	V295-M299 CarbonylContact C-O 3.59Å; V295-M299 WeakPolarHBondContact CA-O 3.46Å; F296-M299 PolarHBondContact N-O 2.83Å; F296-M299 PolarHBondContact O-N 2.88Å; M299-P316 HydrophobicContact CB-CB 4.45Å; M299-P316 HydrophobicContact CB-CG 4.3Å; M299-P316 HydrophobicContact CE-CB 3.67Å; M299-P316 HydrophobicContact CG-CB 3.83Å; M299-P316 HydrophobicContact CG-CG 4.17Å; M299-P316 HydrophobicContact SD-CB 3.55Å; M299-P316 VanDerWaalsContact SD-CB 3.55Å; M299-P316 HydrophobicContact SD-CG 4.34Å
300	L	94.3	Very high	95	Very high	99 Å²	99	64.5 Å²	64.5	52%	0.518	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	138	174.4	-84.4	161.8	0	0	0	111.2	Q293 V295	Q293-L300 HydrophobicContact CB-CD2 3.99Å; V295-L300 HydrophobicContact CG1-CG 4.48Å; V295-L300 HydrophobicContact CG2-CD2 3.8Å
301	V	95.9	Very high	95.3	Very high	22 Å²	22	58.3 Å²	58.3	13%	0.133	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	140.1	179.7	-161.3	0	0	0	0	109.5	V294 F296 V313 Q314 P316	V294-V301 PolarHBondContact N-O 2.86Å; V294-V301 VanDerWaalsContact N-O 3.08Å; V294-V301 PolarHBondContact O-N 3.37Å; F296-V301 HydrophobicContact CD2-CG2 3.81Å; F296-V301 HydrophobicContact CE2-CG2 4.42Å; V301-V313 HydrophobicContact CB-CG1 3.79Å; V301-V313 HydrophobicContact CG1-CG1 3.44Å; V301-V313 VanDerWaalsContact CG1-CG1 3.44Å; V301-V313 HydrophobicContact CG2-CG1 4.48Å; V301-Q314 WeakPolarHBondContact CG1-O 3.29Å; V301-P316 HydrophobicContact CG2-CB 4.34Å; V301-P316 HydrophobicContact CG2-CG 3.86Å
302	W	91.4	Very high	95.6	Very high	205 Å²	205	61.1 Å²	61.1	78%	0.777	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	133.3	169.5	-63.3	101	0	0	0	109.9
303	S	94.2	Very high	95.7	Very high	21 Å²	21	61.2 Å²	61.2	15%	0.147	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	152.1	171.8	90.5	0	0	0	0	110.4	L292 R312	L292-S303 PolarHBondContact O-OG 2.9Å; S303-R312 CarbonylContact C-O 3.56Å; S303-R312 WeakPolarHBondContact CA-O 3.5Å
304	E	96.6	Very high	95.8	Very high	99 Å²	99	63 Å²	63	46%	0.463	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.7	176.8	-177.6	-171.9	173.4	0	0	108.7	I306 I311 R312	E304-I306 PolarHBondContact O-N 3.1Å; E304-I311 CarbonylContact O-C 3.54Å; E304-I311 WeakPolarHBondContact O-CA 3.37Å; E304-R312 HydrophobicContact CB-CB 4.35Å; E304-R312 PolarHBondContact N-O 2.77Å; E304-R312 PolarHBondContact O-N 2.92Å; E304-R312 IonicContact OE1-CZ 3.34Å; E304-R312 IonicContact OE1-NH2 2.91Å; E304-R312 PolarHBondContact OE1-NH2 2.78Å; E304-R312 IonicContact OE2-CZ 2.63Å; E304-R312 IonicContact OE2-NE 3.92Å; E304-R312 PolarHBondContact OE2-NE 2.74Å; E304-R312 IonicContact OE2-NH2 3.47Å; E304-R312 PolarHBondContact OE2-NH2 3.09Å
305	L	96.8	Very high	95.8	Very high	64 Å²	64	63.2 Å²	63.2	34%	0.335	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	116.6	-179.2	-171.4	73	0	0	0	110.7	F288 T307 I311	F288-L305 HydrophobicContact CB-CD1 3.62Å; L305-T307 WeakPolarHBondContact CD1-O 3.33Å; L305-I311 HydrophobicContact CD1-CG2 3.81Å
306	I	96.7	Very high	95.8	Very high	93 Å²	93	63.3 Å²	63.3	48%	0.477	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-51.3	168.6	-52.1	177	0	0	0	109.1	I282 E304 A310 R312	I282-I306 HydrophobicContact CD1-CD1 3.87Å; E304-I306 PolarHBondContact O-N 3.1Å; I306-A310 HydrophobicContact CB-CB 4.28Å; I306-A310 WeakPolarHBondContact CB-O 3.44Å; I306-A310 PolarHBondContact N-O 2.91Å; I306-R312 HydrophobicContact CD1-CB 4.05Å; I306-R312 HydrophobicContact CG1-CB 4.24Å
307	T	96.3	Very high	95.7	Very high	58 Å²	58	67 Å²	67	36%	0.356	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	168	176.4	75.3	0	0	0	0	109.7	L305 H309 A310	L305-T307 WeakPolarHBondContact CD1-O 3.33Å; T307-H309 PolarHBondContact O-N 3.01Å; T307-H309 PolarHBondContact OG1-N 2.96Å; T307-H309 VanDerWaalsContact OG1-N 3.12Å; T307-A310 PolarHBondContact N-O 2.64Å; T307-A310 PolarHBondContact O-N 2.89Å; T307-A310 PolarHBondContact OG1-N 2.78Å; T307-A310 VanDerWaalsContact OG1-N 3.12Å
308	P	94.8	Very high	95.7	Very high	75 Å²	75	69.1 Å²	69.1	49%	0.487	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-8.5	170.6	-26	36.3	0	0	0	115.5	D286 N287 F288	D286-P308 CarbonylContact C-O 3.58Å; N287-P308 PolarHBondContact N-O 3.31Å; N287-P308 VanDerWaalsContact N-O 3.09Å; F288-P308 PolarHBondContact N-O 2.77Å
309	H	96.7	Very high	95.6	Very high	97 Å²	97	70.5 Å²	70.5	45%	0.449	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-2.7	178	-57.8	-79.2	0	0	0	113.9	I284 G285 D286 T307	I284-H309 CarbonylContact C-O 3.49Å; I284-H309 VanDerWaalsContact CA-O 3.31Å; I284-H309 WeakPolarHBondContact CA-O 3.3Å; G285-H309 PolarHBondContact N-O 3.18Å; G285-H309 WeakPolarHBondContact O-CA 3.33Å; G285-H309 VanDerWaalsContact O-CB 3.25Å; G285-H309 WeakPolarHBondContact O-CB 3.18Å; G285-H309 PolarHBondContact O-ND1 2.82Å; G285-H309 VanDerWaalsContact O-ND1 3.1Å; D286-H309 IonicContact OD1-CE1 2.64Å; D286-H309 PolarHBondContact OD1-CE1 3.47Å; D286-H309 IonicContact OD1-ND1 3.57Å; D286-H309 PolarHBondContact OD1-ND1 3.08Å; T307-H309 PolarHBondContact O-N 3.01Å; T307-H309 PolarHBondContact OG1-N 2.96Å; T307-H309 VanDerWaalsContact OG1-N 3.12Å
310	A	97.3	Very high	95.4	Very high	16 Å²	16	70.1 Å²	70.1	13%	0.132	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	125.5	-178.1	0	0	0	0	0	112.8	I282 I283 I306 T307	I282-A310 HydrophobicContact CG2-CB 4.3Å; I283-A310 WeakPolarHBondContact O-CA 3.19Å; I306-A310 HydrophobicContact CB-CB 4.28Å; I306-A310 WeakPolarHBondContact CB-O 3.44Å; I306-A310 PolarHBondContact N-O 2.91Å; T307-A310 PolarHBondContact N-O 2.64Å; T307-A310 PolarHBondContact O-N 2.89Å; T307-A310 PolarHBondContact OG1-N 2.78Å; T307-A310 VanDerWaalsContact OG1-N 3.12Å
311	I	97.8	Very high	95.3	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	141.3	171.1	58.1	-173	0	0	0	110.5	I282 I283 F288 V294 E304 L305 L328	I282-I311 WeakPolarHBondContact CA-O 3.28Å; I283-I311 HydrophobicContact CB-CD1 4.23Å; I283-I311 HydrophobicContact CB-CG1 3.73Å; I283-I311 HydrophobicContact CG2-CD1 4.38Å; I283-I311 HydrophobicContact CG2-CG1 4.3Å; I283-I311 PolarHBondContact N-O 2.67Å; I283-I311 PolarHBondContact O-N 2.89Å; F288-I311 HydrophobicContact CB-CG2 3.77Å; F288-I311 HydrophobicContact CD2-CB 4.34Å; F288-I311 HydrophobicContact CD2-CD1 4.36Å; F288-I311 HydrophobicContact CD2-CG1 4.13Å; F288-I311 HydrophobicContact CD2-CG2 3.69Å; F288-I311 HydrophobicContact CE2-CD1 4.31Å; F288-I311 HydrophobicContact CE2-CG1 4.07Å; F288-I311 HydrophobicContact CE2-CG2 4.47Å; F288-I311 HydrophobicContact CG-CD1 4.47Å; F288-I311 HydrophobicContact CG-CG2 3.86Å; F288-I311 HydrophobicContact CZ-CD1 4.37Å; V294-I311 HydrophobicContact CG2-CD1 3.44Å; V294-I311 VanDerWaalsContact CG2-CD1 3.44Å; V294-I311 HydrophobicContact CG2-CG1 4.43Å; E304-I311 CarbonylContact O-C 3.54Å; E304-I311 WeakPolarHBondContact O-CA 3.37Å; L305-I311 HydrophobicContact CD1-CG2 3.81Å; I311-L328 HydrophobicContact CD1-CD2 3.99Å
312	R	97.8	Very high	95.2	Very high	96 Å²	96	68.7 Å²	68.7	36%	0.362	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	138.4	174.3	174.9	162.8	67.7	-170.3	2.9	110.3	T280 I282 S303 E304 I306	T280-R312 HydrophobicContact CG2-CG 3.84Å; I282-R312 HydrophobicContact CD1-CB 3.81Å; I282-R312 HydrophobicContact CD1-CG 4.02Å; S303-R312 CarbonylContact C-O 3.56Å; S303-R312 WeakPolarHBondContact CA-O 3.5Å; E304-R312 HydrophobicContact CB-CB 4.35Å; E304-R312 PolarHBondContact N-O 2.77Å; E304-R312 PolarHBondContact O-N 2.92Å; E304-R312 IonicContact OE1-CZ 3.34Å; E304-R312 IonicContact OE1-NH2 2.91Å; E304-R312 PolarHBondContact OE1-NH2 2.78Å; E304-R312 IonicContact OE2-CZ 2.63Å; E304-R312 IonicContact OE2-NE 3.92Å; E304-R312 PolarHBondContact OE2-NE 2.74Å; E304-R312 IonicContact OE2-NH2 3.47Å; E304-R312 PolarHBondContact OE2-NH2 3.09Å; I306-R312 HydrophobicContact CD1-CB 4.05Å; I306-R312 HydrophobicContact CG1-CB 4.24Å
313	V	97.4	Very high	95.4	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.012	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	153.5	-180	-164.4	0	0	0	0	109.6	V281 I283 V294 F296 V301	V281-V313 PolarHBondContact N-O 3.06Å; V281-V313 PolarHBondContact O-N 3.35Å; I283-V313 HydrophobicContact CD1-CG2 4.01Å; I283-V313 HydrophobicContact CG1-CG2 4.49Å; V294-V313 HydrophobicContact CB-CG1 4.42Å; V294-V313 HydrophobicContact CB-CG2 4.1Å; V294-V313 HydrophobicContact CG1-CG2 4.29Å; V294-V313 HydrophobicContact CG2-CG2 3.79Å; F296-V313 HydrophobicContact CE2-CB 4.48Å; F296-V313 HydrophobicContact CE2-CG1 3.86Å; V301-V313 HydrophobicContact CB-CG1 3.79Å; V301-V313 HydrophobicContact CG1-CG1 3.44Å; V301-V313 VanDerWaalsContact CG1-CG1 3.44Å; V301-V313 HydrophobicContact CG2-CG1 4.48Å
314	Q	97	Very high	95.5	Very high	85 Å²	85	62.2 Å²	62.2	40%	0.397	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	131.7	167.3	-60.3	-59.1	-21.1	0	0	109.6	G278 A279 T280 V301	G278-Q314 PolarHBondContact O-OE1 3Å; A279-Q314 VanDerWaalsContact C-OE1 3.29Å; A279-Q314 WeakPolarHBondContact O-CA 3.46Å; A279-Q314 PolarHBondContact O-OE1 3.34Å; T280-Q314 VanDerWaalsContact CA-OE1 3.31Å; T280-Q314 PolarHBondContact OG1-NE2 2.8Å; T280-Q314 PolarHBondContact OG1-OE1 2.88Å; V301-Q314 WeakPolarHBondContact CG1-O 3.29Å
315	T	96.7	Very high	95.6	Very high	4 Å²	4	62 Å²	62	3%	0.025	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-64.4	132	-178.4	52.2	0	0	0	0	111.4	G277 G278 A279 V281 F296 F343	G277-T315 CarbonylContact C-O 3.53Å; G277-T315 WeakPolarHBondContact CA-O 3.36Å; G277-T315 WeakPolarHBondContact CA-OG1 3.44Å; G278-T315 PolarHBondContact N-O 2.94Å; G278-T315 PolarHBondContact N-OG1 2.85Å; A279-T315 HydrophobicContact CB-CG2 4.34Å; A279-T315 WeakPolarHBondContact CB-OG1 3.26Å; A279-T315 PolarHBondContact N-OG1 2.8Å; A279-T315 PolarHBondContact O-N 3.37Å; A279-T315 PolarHBondContact O-OG1 2.81Å; V281-T315 HydrophobicContact CB-CG2 4.47Å; V281-T315 HydrophobicContact CG2-CG2 3.52Å; F296-T315 HydrophobicContact CE1-CG2 4.25Å; F296-T315 HydrophobicContact CZ-CG2 4.38Å; T315-F343 HydrophobicContact CG2-CE1 3.94Å; T315-F343 HydrophobicContact CG2-CE2 4.05Å; T315-F343 HydrophobicContact CG2-CZ 3.54Å
316	P	96.7	Very high	95.6	Very high	11 Å²	11	59 Å²	59	7%	0.071	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-72.4	148.8	174.8	26.1	-32	0	0	0	111.3	F296 M299 V301 Y345	F296-P316 HydrophobicContact CB-CG 3.78Å; F296-P316 HydrophobicContact CD2-CG 4.31Å; F296-P316 HydrophobicContact CG-CG 4.08Å; M299-P316 HydrophobicContact CB-CB 4.45Å; M299-P316 HydrophobicContact CB-CG 4.3Å; M299-P316 HydrophobicContact CE-CB 3.67Å; M299-P316 HydrophobicContact CG-CB 3.83Å; M299-P316 HydrophobicContact CG-CG 4.17Å; M299-P316 HydrophobicContact SD-CB 3.55Å; M299-P316 VanDerWaalsContact SD-CB 3.55Å; M299-P316 HydrophobicContact SD-CG 4.34Å; V301-P316 HydrophobicContact CG2-CB 4.34Å; V301-P316 HydrophobicContact CG2-CG 3.86Å; P316-Y345 VanDerWaalsContact CD-OH 3.3Å; P316-Y345 WeakPolarHBondContact CD-OH 3.34Å; P316-Y345 PolarHBondContact O-OH 3.35Å; P316-Y345 VanDerWaalsContact O-OH 3.1Å
317	P	95.3	Very high	95.6	Very high	88 Å²	88	54.9 Å²	54.9	57%	0.571	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-60.1	138.2	171.2	-20.9	32.1	0	0	0	111.6	T276	T276-P317 WeakPolarHBondContact O-CB 3.18Å; T276-P317 WeakPolarHBondContact O-CG 3.17Å
318	R	93.5	Very high	95.6	Very high	78 Å²	78	52.1 Å²	52.1	29%	0.294	28%	0.276	S	S	.	.			trans	-142.1	125.5	179.8	-169.2	-177.6	-170.8	-120.5	9.5	111.2	T275 I320 P321 Y345	T275-R318 WeakPolarHBondContact CA-O 3.46Å; T275-R318 WeakPolarHBondContact CB-O 3.42Å; T275-R318 VanDerWaalsContact CG2-O 3.24Å; T275-R318 WeakPolarHBondContact CG2-O 3.4Å; T275-R318 PolarHBondContact O-N 2.85Å; T275-R318 VanDerWaalsContact O-O 3.09Å; R318-I320 WeakPolarHBondContact CD-O 3.02Å; R318-I320 PolarHBondContact NH1-O 3.47Å; R318-P321 PolarHBondContact NH1-O 3.43Å; R318-Y345 HydrophobicContact CB-CD1 4.18Å; R318-Y345 HydrophobicContact CB-CD2 4.31Å; R318-Y345 HydrophobicContact CB-CE1 4.2Å; R318-Y345 HydrophobicContact CB-CE2 4.33Å; R318-Y345 HydrophobicContact CB-CG 4.23Å
319	H	88.6	Confident	95.6	Very high	173 Å²	173	49.2 Å²	49.2	80%	0.801	26%	0.257	S	S	*	.	S	Bend	trans	-79	-20.8	-175.7	61.9	-81.9	0	0	0	114.8
320	I	91.6	Very high	95.4	Very high	87 Å²	87	46.6 Å²	46.6	45%	0.446	24%	0.243	S	C	.	.	S	Bend	trans	-101.3	126.5	177.8	-68.3	156	0	0	0	109.1	R318	R318-I320 WeakPolarHBondContact CD-O 3.02Å; R318-I320 PolarHBondContact NH1-O 3.47Å
321	P	92.4	Very high	94.9	Very high	60 Å²	60	51.5 Å²	51.5	39%	0.39	26%	0.262	S	S	.	.			trans	-71.9	172.2	169.9	29.6	-33.5	0	0	0	112.5	T275 R318 Y345 A347	T275-P321 HydrophobicContact CG2-CB 4.38Å; R318-P321 PolarHBondContact NH1-O 3.43Å; P321-Y345 CarbonylContact C-O 3.59Å; P321-Y345 WeakPolarHBondContact CA-O 3.22Å; P321-Y345 VanDerWaalsContact CB-O 3.29Å; P321-Y345 WeakPolarHBondContact CB-O 3.45Å; P321-A347 HydrophobicContact CB-CB 4.14Å; P321-A347 HydrophobicContact CG-CB 4.33Å
322	G	93.5	Very high	94.3	Very high	30 Å²	30	57.7 Å²	57.7	31%	0.309	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	106.3	-175.3	178.1	0	0	0	0	0	114.5	Y345	G322-Y345 PolarHBondContact N-O 2.79Å; G322-Y345 PolarHBondContact O-N 3.43Å
323	V	96.2	Very high	93.9	Very high	84 Å²	84	57.1 Å²	57.1	51%	0.509	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	136	-173.2	-170.6	0	0	0	0	111.5	R342 V344	V323-R342 HydrophobicContact CG1-CB 4.19Å; V323-R342 HydrophobicContact CG1-CG 4.34Å; V323-V344 HydrophobicContact CG2-CG2 4.34Å
324	V	96.7	Very high	93.6	Very high	7 Å²	7	60.4 Å²	60.4	4%	0.042	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.7	175.1	173.9	0	0	0	0	109.6	F296 R342 F343 Y345	F296-V324 HydrophobicContact CB-CG1 4.28Å; V324-R342 WeakPolarHBondContact O-CA 3.5Å; V324-F343 PolarHBondContact N-O 3.44Å; V324-F343 PolarHBondContact O-N 3.1Å; V324-Y345 HydrophobicContact CB-CD2 4.27Å; V324-Y345 HydrophobicContact CB-CE2 4.31Å; V324-Y345 HydrophobicContact CG2-CD2 3.66Å; V324-Y345 HydrophobicContact CG2-CE2 4Å
325	E	97	Very high	93.4	Very high	95 Å²	95	57.6 Å²	57.6	44%	0.444	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	133.9	172.6	-65.6	-170	158.9	0	0	110.6	G297 P340 G341	G297-E325 WeakPolarHBondContact CA-O 3.39Å; G297-E325 PolarHBondContact N-O 3.14Å; E325-P340 HydrophobicContact CB-CB 3.88Å; E325-P340 HydrophobicContact CB-CG 4.08Å; E325-P340 HydrophobicContact CG-CB 4.3Å; E325-P340 HydrophobicContact CG-CG 3.94Å; E325-G341 CarbonylContact C-O 3.49Å; E325-G341 WeakPolarHBondContact CA-O 3.4Å
326	V	97.6	Very high	93.1	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.1	178.6	-175.6	0	0	0	0	109.1	I265 I268 I283 V294 V295 F296 P340 G341 F343	I265-V326 HydrophobicContact CD1-CG1 4.15Å; I265-V326 WeakPolarHBondContact CD1-O 3.13Å; I268-V326 HydrophobicContact CD1-CB 3.45Å; I268-V326 VanDerWaalsContact CD1-CB 3.45Å; I268-V326 HydrophobicContact CD1-CG1 3.66Å; I268-V326 HydrophobicContact CD1-CG2 3.65Å; I283-V326 HydrophobicContact CD1-CG1 3.86Å; V294-V326 HydrophobicContact CG1-CG1 3.66Å; V295-V326 VanDerWaalsContact O-CA 3.29Å; V295-V326 WeakPolarHBondContact O-CA 3.47Å; F296-V326 HydrophobicContact CD1-CG2 3.75Å; F296-V326 HydrophobicContact CE1-CG2 3.85Å; F296-V326 HydrophobicContact CE2-CG1 4.45Å; F296-V326 HydrophobicContact CG-CG2 4.28Å; F296-V326 HydrophobicContact CZ-CG2 4.42Å; V326-P340 CarbonylContact O-C 3.55Å; V326-P340 WeakPolarHBondContact O-CA 3.45Å; V326-P340 WeakPolarHBondContact O-CB 3.46Å; V326-G341 PolarHBondContact N-O 2.85Å; V326-G341 PolarHBondContact O-N 2.81Å; V326-F343 HydrophobicContact CG2-CB 3.82Å
327	T	97	Very high	92.7	Very high	7 Å²	7	64.4 Å²	64.4	4%	0.043	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	172.7	-178.8	54.3	0	0	0	0	110.7	V295 Q334 F335 P340	V295-T327 WeakPolarHBondContact CB-OG1 3.44Å; V295-T327 PolarHBondContact N-O 3.08Å; V295-T327 PolarHBondContact O-N 3.01Å; T327-Q334 PolarHBondContact OG1-NE2 2.87Å; T327-F335 WeakPolarHBondContact CB-O 3.19Å; T327-P340 HydrophobicContact CG2-CB 3.92Å
328	L	96.4	Very high	92.5	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	151.6	-178.8	-51.3	171.9	0	0	0	109.7	P263 I265 F288 L292 Q293 V294 I311 Q334 F335	P263-L328 HydrophobicContact CB-CD1 3.84Å; P263-L328 HydrophobicContact CG-CD1 4.49Å; I265-L328 HydrophobicContact CD1-CD1 4.48Å; I265-L328 HydrophobicContact CD1-CD2 3.88Å; I265-L328 HydrophobicContact CD1-CG 3.92Å; I265-L328 HydrophobicContact CG1-CD1 3.85Å; I265-L328 HydrophobicContact CG1-CD2 3.93Å; I265-L328 HydrophobicContact CG1-CG 3.84Å; F288-L328 HydrophobicContact CD1-CD1 4.26Å; F288-L328 HydrophobicContact CE1-CD1 3.65Å; L292-L328 HydrophobicContact CD1-CB 4.21Å; L292-L328 HydrophobicContact CD2-CD1 4.32Å; Q293-L328 CarbonylContact O-C 3.55Å; Q293-L328 WeakPolarHBondContact O-CA 3.49Å; V294-L328 HydrophobicContact CG2-CD2 3.89Å; I311-L328 HydrophobicContact CD1-CD2 3.99Å; L328-Q334 CarbonylContact O-C 3.56Å; L328-Q334 VanDerWaalsContact O-CA 3.26Å; L328-Q334 WeakPolarHBondContact O-CA 3.25Å; L328-Q334 WeakPolarHBondContact O-CG 3.21Å; L328-F335 HydrophobicContact CB-CB 4.26Å; L328-F335 HydrophobicContact CB-CD2 4.19Å; L328-F335 PolarHBondContact N-O 3.02Å; L328-F335 PolarHBondContact O-N 2.92Å
329	S	93.9	Very high	92.4	Very high	14 Å²	14	64 Å²	64	10%	0.098	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	139.1	-178.5	176.3	0	0	0	0	112.1	Q293 K333	Q293-S329 WeakPolarHBondContact CA-O 3.06Å; Q293-S329 WeakPolarHBondContact CB-O 3.49Å; Q293-S329 PolarHBondContact N-O 2.96Å; Q293-S329 PolarHBondContact O-N 3.21Å; S329-K333 CarbonylContact C-O 3.43Å; S329-K333 VanDerWaalsContact CA-O 3.28Å; S329-K333 WeakPolarHBondContact CA-O 3.31Å
330	Y	92.3	Very high	92.7	Very high	41 Å²	41	56.9 Å²	56.9	16%	0.161	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	129.2	171.3	-175.1	-114	0	0	0	110.2	D248 F289 G291 S332 K333	D248-Y330 WeakPolarHBondContact OD1-CE1 3.34Å; F289-Y330 AromaticContact CE2-CD1 3.78Å; F289-Y330 HydrophobicContact CE2-CD1 3.78Å; F289-Y330 AromaticContact CE2-CD2 3.67Å; F289-Y330 HydrophobicContact CE2-CD2 3.67Å; F289-Y330 AromaticContact CE2-CE1 3.89Å; F289-Y330 HydrophobicContact CE2-CE1 3.89Å; F289-Y330 AromaticContact CE2-CE2 3.78Å; F289-Y330 HydrophobicContact CE2-CE2 3.78Å; F289-Y330 AromaticContact CE2-CG 3.66Å; F289-Y330 HydrophobicContact CE2-CG 3.66Å; F289-Y330 AromaticContact CE2-CZ 3.89Å; F289-Y330 AromaticContact CZ-CD1 3.86Å; F289-Y330 HydrophobicContact CZ-CD1 3.86Å; F289-Y330 HydrophobicContact CZ-CD2 4.33Å; F289-Y330 HydrophobicContact CZ-CE1 4.3Å; F289-Y330 AromaticContact CZ-CG 3.86Å; F289-Y330 HydrophobicContact CZ-CG 3.86Å; G291-Y330 WeakPolarHBondContact O-CD2 3.34Å; Y330-S332 VanDerWaalsContact C-N 3.33Å; Y330-S332 PolarHBondContact O-N 3.12Å; Y330-K333 PolarHBondContact N-O 3.03Å; Y330-K333 WeakPolarHBondContact O-CB 3.24Å; Y330-K333 PolarHBondContact O-N 2.9Å
331	K	87.4	Confident	92.9	Very high	120 Å²	120	53.2 Å²	53.2	52%	0.522	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.5	52.9	179.5	-67.5	170.7	177.4	149.9	0	113.6	D248 K333	D248-K331 WeakPolarHBondContact OD2-CD 3.45Å; D248-K331 WeakPolarHBondContact OD2-CE 3.37Å; D248-K331 IonicContact OD2-NZ 2.72Å; D248-K331 PolarHBondContact OD2-NZ 3.01Å; K331-K333 PolarHBondContact O-N 2.89Å; K331-K333 VanDerWaalsContact O-N 3.09Å
332	S	84.6	Confident	93.2	Very high	130 Å²	130	57.6 Å²	57.6	91%	0.909	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	7.8	-179	-47.9	0	0	0	0	116	Y330	Y330-S332 VanDerWaalsContact C-N 3.33Å; Y330-S332 PolarHBondContact O-N 3.12Å
333	K	89.6	Confident	93.4	Very high	83 Å²	83	56.1 Å²	56.1	36%	0.361	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	134.8	166.8	-63.1	-175.1	175.4	-170.5	0	109.9	E251 S329 Y330 K331 F335	E251-K333 IonicContact OE1-NZ 2.68Å; E251-K333 PolarHBondContact OE1-NZ 3.09Å; S329-K333 CarbonylContact C-O 3.43Å; S329-K333 VanDerWaalsContact CA-O 3.28Å; S329-K333 WeakPolarHBondContact CA-O 3.31Å; Y330-K333 PolarHBondContact N-O 3.03Å; Y330-K333 WeakPolarHBondContact O-CB 3.24Å; Y330-K333 PolarHBondContact O-N 2.9Å; K331-K333 PolarHBondContact O-N 2.89Å; K331-K333 VanDerWaalsContact O-N 3.09Å; K333-F335 HydrophobicContact CB-CE2 4.38Å; K333-F335 HydrophobicContact CB-CZ 4.01Å
334	Q	91.3	Very high	93.4	Very high	72 Å²	72	54.5 Å²	54.5	34%	0.336	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129	178.8	-176.9	-177.6	19.3	0	0	109.6	T327 L328 K337	T327-Q334 PolarHBondContact OG1-NE2 2.87Å; L328-Q334 CarbonylContact O-C 3.56Å; L328-Q334 VanDerWaalsContact O-CA 3.26Å; L328-Q334 WeakPolarHBondContact O-CA 3.25Å; L328-Q334 WeakPolarHBondContact O-CG 3.21Å; Q334-K337 HydrophobicContact CG-CD 4.49Å; Q334-K337 HydrophobicContact CG-CG 4.11Å
335	F	92.6	Very high	93.3	Very high	25 Å²	25	54.3 Å²	54.3	11%	0.11	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	171.9	-177.5	-44.1	-90.1	0	0	0	110.5	T262 P263 L292 T327 L328 K333 K337	T262-F335 HydrophobicContact CG2-CD1 3.9Å; P263-F335 HydrophobicContact CG-CB 4.21Å; P263-F335 HydrophobicContact CG-CD1 3.92Å; P263-F335 HydrophobicContact CG-CD2 3.68Å; P263-F335 HydrophobicContact CG-CE1 4.19Å; P263-F335 HydrophobicContact CG-CE2 3.97Å; P263-F335 HydrophobicContact CG-CG 3.66Å; P263-F335 HydrophobicContact CG-CZ 4.22Å; L292-F335 HydrophobicContact CD1-CE2 4.42Å; T327-F335 WeakPolarHBondContact CB-O 3.19Å; L328-F335 HydrophobicContact CB-CB 4.26Å; L328-F335 HydrophobicContact CB-CD2 4.19Å; L328-F335 PolarHBondContact N-O 3.02Å; L328-F335 PolarHBondContact O-N 2.92Å; K333-F335 HydrophobicContact CB-CE2 4.38Å; K333-F335 HydrophobicContact CB-CZ 4.01Å; F335-K337 PolarHBondContact O-N 3.02Å; F335-K337 VanDerWaalsContact O-N 3.08Å
336	C	91.3	Very high	93.1	Very high	24 Å²	24	51.4 Å²	51.4	16%	0.162	29%	0.291	C	S	.	.			trans	60.3	10.2	179.9	-57.6	0	0	0	0	116.8	I265 G338 A339 P340	I265-C336 HydrophobicContact CD1-CB 4.49Å; I265-C336 PolarHBondContact N-SG 2.96Å; I265-C336 VanDerWaalsContact N-SG 3.38Å; C336-G338 PolarHBondContact O-N 3.12Å; C336-G338 VanDerWaalsContact O-N 3.14Å; C336-A339 CarbonylContact O-C 3.56Å; C336-A339 PolarHBondContact O-N 2.73Å; C336-P340 WeakPolarHBondContact O-CA 3.34Å; C336-P340 WeakPolarHBondContact O-CD 3.48Å
337	K	88.9	Confident	92.6	Very high	135 Å²	135	51.7 Å²	51.7	59%	0.587	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-32.6	179.6	-57	-156.3	-158	-145.5	0	114.4	Q334 F335	Q334-K337 HydrophobicContact CG-CD 4.49Å; Q334-K337 HydrophobicContact CG-CG 4.11Å; F335-K337 PolarHBondContact O-N 3.02Å; F335-K337 VanDerWaalsContact O-N 3.08Å
338	G	89.2	Confident	91.7	Very high	85 Å²	85	55.4 Å²	55.4	88%	0.876	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-11.5	178	0	0	0	0	0	114.7	C336	C336-G338 PolarHBondContact O-N 3.12Å; C336-G338 VanDerWaalsContact O-N 3.14Å
339	A	92.5	Very high	90.7	Very high	71 Å²	71	60.9 Å²	60.9	59%	0.587	34%	0.342	S	S	*	.	S	Bend	trans	-148.5	66.9	177.8	0	0	0	0	0	108.9	C336	C336-A339 CarbonylContact O-C 3.56Å; C336-A339 PolarHBondContact O-N 2.73Å
340	P	95.7	Very high	89.7	Confident	25 Å²	25	64 Å²	64	16%	0.162	35%	0.354	C	S	.	.			trans	-72.4	150.4	-178.2	29.8	-34.4	0	0	0	110.2	E325 V326 T327 C336	E325-P340 HydrophobicContact CB-CB 3.88Å; E325-P340 HydrophobicContact CB-CG 4.08Å; E325-P340 HydrophobicContact CG-CB 4.3Å; E325-P340 HydrophobicContact CG-CG 3.94Å; V326-P340 CarbonylContact O-C 3.55Å; V326-P340 WeakPolarHBondContact O-CA 3.45Å; V326-P340 WeakPolarHBondContact O-CB 3.46Å; T327-P340 HydrophobicContact CG2-CB 3.92Å; C336-P340 WeakPolarHBondContact O-CA 3.34Å; C336-P340 WeakPolarHBondContact O-CD 3.48Å
341	G	95.7	Very high	88.9	Confident	10 Å²	10	67.1 Å²	67.1	10%	0.103	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	162.7	161.2	0	0	0	0	0	110.2	E325 V326	E325-G341 CarbonylContact C-O 3.49Å; E325-G341 WeakPolarHBondContact CA-O 3.4Å; V326-G341 PolarHBondContact N-O 2.85Å; V326-G341 PolarHBondContact O-N 2.81Å
342	R	97	Very high	88.4	Confident	151 Å²	151	65.7 Å²	65.7	57%	0.57	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	134.7	176.3	-66.3	179.8	-177.7	-85	-9.4	109.4	V323 V324	V323-R342 HydrophobicContact CG1-CB 4.19Å; V323-R342 HydrophobicContact CG1-CG 4.34Å; V324-R342 WeakPolarHBondContact O-CA 3.5Å
343	F	97.8	Very high	88.1	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	134.2	174.3	-173.9	-91.1	0	0	0	109.5	I268 P270 S271 E272 G273 V281 F296 T315 V324 V326 Y345	I268-F343 HydrophobicContact CG2-CD2 4.21Å; P270-F343 WeakPolarHBondContact O-CE2 3.34Å; S271-F343 CarbonylContact O-C 3.58Å; S271-F343 WeakPolarHBondContact O-CA 3.39Å; E272-F343 WeakPolarHBondContact O-CZ 3.29Å; G273-F343 VanDerWaalsContact N-CZ 3.33Å; V281-F343 HydrophobicContact CG2-CD2 4.43Å; V281-F343 HydrophobicContact CG2-CE2 3.69Å; V281-F343 HydrophobicContact CG2-CZ 4.31Å; F296-F343 HydrophobicContact CD1-CB 4.25Å; F296-F343 HydrophobicContact CD1-CD1 4.3Å; F296-F343 HydrophobicContact CD1-CG 4.29Å; F296-F343 HydrophobicContact CE1-CB 3.95Å; F296-F343 HydrophobicContact CE1-CD1 4.07Å; F296-F343 HydrophobicContact CE1-CD2 4.15Å; F296-F343 AromaticContact CE1-CG 3.78Å; F296-F343 HydrophobicContact CE1-CG 3.78Å; T315-F343 HydrophobicContact CG2-CE1 3.94Å; T315-F343 HydrophobicContact CG2-CE2 4.05Å; T315-F343 HydrophobicContact CG2-CZ 3.54Å; V324-F343 PolarHBondContact N-O 3.44Å; V324-F343 PolarHBondContact O-N 3.1Å; V326-F343 HydrophobicContact CG2-CB 3.82Å; F343-Y345 AromaticContact CD1-CD2 3.89Å; F343-Y345 HydrophobicContact CD1-CD2 3.89Å; F343-Y345 HydrophobicContact CD1-CE1 4.38Å; F343-Y345 AromaticContact CD1-CE2 3.63Å; F343-Y345 HydrophobicContact CD1-CE2 3.63Å; F343-Y345 HydrophobicContact CD1-CG 4.38Å; F343-Y345 AromaticContact CD1-CZ 3.88Å; F343-Y345 HydrophobicContact CE1-CD1 4.07Å; F343-Y345 HydrophobicContact CE1-CD2 4.17Å; F343-Y345 AromaticContact CE1-CE1 3.83Å; F343-Y345 HydrophobicContact CE1-CE1 3.83Å; F343-Y345 AromaticContact CE1-CE2 3.93Å; F343-Y345 HydrophobicContact CE1-CE2 3.93Å; F343-Y345 HydrophobicContact CE1-CG 4.24Å; F343-Y345 AromaticContact CE1-CZ 3.74Å
344	V	96.9	Very high	87.7	Confident	50 Å²	50	60 Å²	60	30%	0.303	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	122.9	-177.4	-171.6	0	0	0	0	110.2	S271 E272 G273 V323	S271-V344 PolarHBondContact O-N 2.97Å; E272-V344 CarbonylContact C-O 3.47Å; E272-V344 WeakPolarHBondContact CA-O 3.22Å; E272-V344 HydrophobicContact CB-CB 4.01Å; G273-V344 PolarHBondContact N-O 2.72Å; V323-V344 HydrophobicContact CG2-CG2 4.34Å
345	Y	95.8	Very high	87.4	Confident	3 Å²	3	63 Å²	63	1%	0.012	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	119.3	170.8	-80	-79.7	0	0	0	110.8	G273 F296 P316 R318 P321 G322 V324 F343	G273-Y345 WeakPolarHBondContact O-CA 3.44Å; F296-Y345 HydrophobicContact CD1-CE2 4.38Å; P316-Y345 VanDerWaalsContact CD-OH 3.3Å; P316-Y345 WeakPolarHBondContact CD-OH 3.34Å; P316-Y345 PolarHBondContact O-OH 3.35Å; P316-Y345 VanDerWaalsContact O-OH 3.1Å; R318-Y345 HydrophobicContact CB-CD1 4.18Å; R318-Y345 HydrophobicContact CB-CD2 4.31Å; R318-Y345 HydrophobicContact CB-CE1 4.2Å; R318-Y345 HydrophobicContact CB-CE2 4.33Å; R318-Y345 HydrophobicContact CB-CG 4.23Å; P321-Y345 CarbonylContact C-O 3.59Å; P321-Y345 WeakPolarHBondContact CA-O 3.22Å; P321-Y345 VanDerWaalsContact CB-O 3.29Å; P321-Y345 WeakPolarHBondContact CB-O 3.45Å; G322-Y345 PolarHBondContact N-O 2.79Å; G322-Y345 PolarHBondContact O-N 3.43Å; V324-Y345 HydrophobicContact CB-CD2 4.27Å; V324-Y345 HydrophobicContact CB-CE2 4.31Å; V324-Y345 HydrophobicContact CG2-CD2 3.66Å; V324-Y345 HydrophobicContact CG2-CE2 4Å; F343-Y345 AromaticContact CD1-CD2 3.89Å; F343-Y345 HydrophobicContact CD1-CD2 3.89Å; F343-Y345 HydrophobicContact CD1-CE1 4.38Å; F343-Y345 AromaticContact CD1-CE2 3.63Å; F343-Y345 HydrophobicContact CD1-CE2 3.63Å; F343-Y345 HydrophobicContact CD1-CG 4.38Å; F343-Y345 AromaticContact CD1-CZ 3.88Å; F343-Y345 HydrophobicContact CE1-CD1 4.07Å; F343-Y345 HydrophobicContact CE1-CD2 4.17Å; F343-Y345 AromaticContact CE1-CE1 3.83Å; F343-Y345 HydrophobicContact CE1-CE1 3.83Å; F343-Y345 AromaticContact CE1-CE2 3.93Å; F343-Y345 HydrophobicContact CE1-CE2 3.93Å; F343-Y345 HydrophobicContact CE1-CG 4.24Å; F343-Y345 AromaticContact CE1-CZ 3.74Å
346	T	91.4	Very high	87.1	Confident	34 Å²	34	63.1 Å²	63.1	21%	0.209	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	143.7	175.8	-52.5	0	0	0	0	109.7	G273 W274 T275 I353	G273-T346 PolarHBondContact O-N 2.78Å; W274-T346 WeakPolarHBondContact CA-O 3.38Å; W274-T346 HydrophobicContact CE3-CG2 4.46Å; W274-T346 HydrophobicContact CZ3-CG2 3.93Å; T275-T346 PolarHBondContact N-O 2.78Å; T275-T346 PolarHBondContact OG1-O 3.28Å; T346-I353 HydrophobicContact CG2-CD1 4.35Å
347	A	87.6	Confident	87	Confident	6 Å²	6	63.3 Å²	63.3	5%	0.05	36%	0.36	C	S	.	.			trans	-107.5	136.8	-178.2	0	0	0	0	0	111.9	T275 P321 N349 E350	T275-A347 HydrophobicContact CG2-CB 4.07Å; P321-A347 HydrophobicContact CB-CB 4.14Å; P321-A347 HydrophobicContact CG-CB 4.33Å; A347-N349 WeakPolarHBondContact CB-OD1 3.41Å; A347-N349 PolarHBondContact O-N 2.93Å; A347-E350 PolarHBondContact O-N 3.41Å
348	L	77.4	Confident	86.8	Confident	85 Å²	85	62.3 Å²	62.3	45%	0.445	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-11.5	-178.4	-75.9	167	0	0	0	114.7	W274 K376	W274-L348 HydrophobicContact CD2-CD2 4.01Å; W274-L348 HydrophobicContact CD2-CG 4.07Å; W274-L348 HydrophobicContact CE3-CD2 3.72Å; W274-L348 HydrophobicContact CE3-CG 3.66Å; W274-L348 HydrophobicContact CH2-CD2 3.62Å; W274-L348 HydrophobicContact CH2-CG 4.46Å; W274-L348 HydrophobicContact CZ2-CD2 3.9Å; W274-L348 HydrophobicContact CZ3-CD2 3.51Å; W274-L348 HydrophobicContact CZ3-CG 3.88Å; L348-K376 PolarHBondContact O-NZ 3.31Å
349	N	75.6	Confident	86.8	Confident	115 Å²	115	65.7 Å²	65.7	62%	0.615	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	23	179.7	65.9	-30.9	0	0	0	112.3	A347	A347-N349 WeakPolarHBondContact CB-OD1 3.41Å; A347-N349 PolarHBondContact O-N 2.93Å
350	E	72.9	Confident	86.7	Confident	78 Å²	78	64.7 Å²	64.7	36%	0.364	33%	0.328	S	S	.	.			trans	-64.2	130.7	173.4	-149.1	-180	-126.7	0	0	109.5	A347 T352 I353 D354	A347-E350 PolarHBondContact O-N 3.41Å; E350-T352 VanDerWaalsContact CG-OG1 3.27Å; E350-T352 WeakPolarHBondContact CG-OG1 3.49Å; E350-T352 PolarHBondContact O-N 2.97Å; E350-T352 VanDerWaalsContact O-N 3.11Å; E350-T352 PolarHBondContact OE2-OG1 2.78Å; E350-I353 HydrophobicContact CB-CB 4.35Å; E350-I353 HydrophobicContact CB-CD1 3.96Å; E350-I353 HydrophobicContact CB-CG1 4.09Å; E350-I353 WeakPolarHBondContact O-CA 3.28Å; E350-I353 WeakPolarHBondContact O-CB 3.45Å; E350-I353 PolarHBondContact O-N 2.9Å; E350-D354 PolarHBondContact O-N 2.83Å
351	P	75.5	Confident	86.2	Confident	107 Å²	107	66.8 Å²	66.8	70%	0.695	34%	0.336	S	S	*	.	H	α-helix	trans	-58.3	-30.5	-174.1	-27.8	35.3	0	0	0	114	Y355	P351-Y355 WeakPolarHBondContact O-CB 3.31Å; P351-Y355 PolarHBondContact O-N 2.94Å
352	T	77.1	Confident	85.8	Confident	91 Å²	91	74.8 Å²	74.8	56%	0.558	37%	0.368	S	S	*	.	H	α-helix	trans	-57.8	-48.6	170	39.6	0	0	0	0	112.5	E350 G356	E350-T352 VanDerWaalsContact CG-OG1 3.27Å; E350-T352 WeakPolarHBondContact CG-OG1 3.49Å; E350-T352 PolarHBondContact O-N 2.97Å; E350-T352 VanDerWaalsContact O-N 3.11Å; E350-T352 PolarHBondContact OE2-OG1 2.78Å; T352-G356 PolarHBondContact O-N 3.01Å
353	I	79.1	Confident	85.3	Confident	44 Å²	44	73 Å²	73	23%	0.226	37%	0.373	C	S	.	.	H	α-helix	trans	-68	-47.6	178.8	-65.3	175.9	0	0	0	110	T346 E350 Y355 G356 F357	T346-I353 HydrophobicContact CG2-CD1 4.35Å; E350-I353 HydrophobicContact CB-CB 4.35Å; E350-I353 HydrophobicContact CB-CD1 3.96Å; E350-I353 HydrophobicContact CB-CG1 4.09Å; E350-I353 WeakPolarHBondContact O-CA 3.28Å; E350-I353 WeakPolarHBondContact O-CB 3.45Å; E350-I353 PolarHBondContact O-N 2.9Å; I353-Y355 VanDerWaalsContact C-N 3.34Å; I353-Y355 PolarHBondContact O-N 3.2Å; I353-G356 WeakPolarHBondContact O-CA 3.27Å; I353-G356 PolarHBondContact O-N 3.11Å; I353-G356 VanDerWaalsContact O-N 3.07Å; I353-F357 HydrophobicContact CG2-CD2 3.77Å; I353-F357 HydrophobicContact CG2-CE2 3.64Å; I353-F357 VanDerWaalsContact O-CD2 3.29Å; I353-F357 WeakPolarHBondContact O-CD2 3.41Å; I353-F357 PolarHBondContact O-N 2.97Å
354	D	80.9	Confident	84.8	Confident	49 Å²	49	73.4 Å²	73.4	26%	0.262	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-36.5	179	-80.1	-30.7	0	0	0	112.4	E350 F357 Q358 K376	E350-D354 PolarHBondContact O-N 2.83Å; D354-F357 PolarHBondContact O-N 2.89Å; D354-Q358 VanDerWaalsContact O-CG 3.31Å; D354-Q358 WeakPolarHBondContact O-CG 3.4Å; D354-Q358 PolarHBondContact O-N 2.68Å; D354-K376 VanDerWaalsContact OD1-CE 3.28Å; D354-K376 WeakPolarHBondContact OD1-CE 3.29Å; D354-K376 IonicContact OD1-NZ 3.68Å; D354-K376 PolarHBondContact OD1-NZ 2.9Å
355	Y	85	Confident	84.1	Confident	135 Å²	135	74.2 Å²	74.2	53%	0.529	38%	0.382	S	S	.	.	H	α-helix	trans	-63.6	-39.7	169.6	178.9	-116.6	0	0	0	112.3	P351 I353 Q358 R359	P351-Y355 WeakPolarHBondContact O-CB 3.31Å; P351-Y355 PolarHBondContact O-N 2.94Å; I353-Y355 VanDerWaalsContact C-N 3.34Å; I353-Y355 PolarHBondContact O-N 3.2Å; Y355-Q358 PolarHBondContact O-N 2.97Å; Y355-R359 HydrophobicContact CE1-CG 4.42Å; Y355-R359 HydrophobicContact CE2-CG 4.26Å; Y355-R359 WeakPolarHBondContact O-CG 3.4Å; Y355-R359 PolarHBondContact O-N 3.07Å
356	G	86.7	Confident	83.5	Confident	28 Å²	28	80.4 Å²	80.4	29%	0.289	41%	0.405	S	S	.	.	H	α-helix	trans	-56.9	-47.9	171.3	0	0	0	0	0	112.3	T352 I353 R359 L360	T352-G356 PolarHBondContact O-N 3.01Å; I353-G356 WeakPolarHBondContact O-CA 3.27Å; I353-G356 PolarHBondContact O-N 3.11Å; I353-G356 VanDerWaalsContact O-N 3.07Å; G356-R359 PolarHBondContact O-N 2.9Å; G356-L360 WeakPolarHBondContact O-CG 3.18Å; G356-L360 PolarHBondContact O-N 2.91Å
357	F	87.5	Confident	83.2	Confident	28 Å²	28	83.9 Å²	83.9	12%	0.123	42%	0.419	C	S	.	.	H	α-helix	trans	-63.9	-39.7	175.5	-82.5	-71.8	0	0	0	113.3	I353 D354 R359 L360 Q361 K376 L379 L380	I353-F357 HydrophobicContact CG2-CD2 3.77Å; I353-F357 HydrophobicContact CG2-CE2 3.64Å; I353-F357 VanDerWaalsContact O-CD2 3.29Å; I353-F357 WeakPolarHBondContact O-CD2 3.41Å; I353-F357 PolarHBondContact O-N 2.97Å; D354-F357 PolarHBondContact O-N 2.89Å; F357-R359 VanDerWaalsContact C-N 3.28Å; F357-R359 PolarHBondContact O-N 3.3Å; F357-L360 HydrophobicContact CD1-CD1 4.42Å; F357-L360 PolarHBondContact O-N 2.76Å; F357-Q361 WeakPolarHBondContact O-CB 3.46Å; F357-Q361 PolarHBondContact O-N 3.23Å; F357-K376 HydrophobicContact CD1-CB 4.1Å; F357-K376 HydrophobicContact CD1-CD 4.46Å; F357-K376 HydrophobicContact CD1-CG 3.82Å; F357-K376 HydrophobicContact CD2-CD 3.83Å; F357-K376 HydrophobicContact CD2-CG 4.09Å; F357-K376 HydrophobicContact CE1-CB 3.53Å; F357-K376 HydrophobicContact CE1-CD 4.29Å; F357-K376 HydrophobicContact CE1-CG 3.72Å; F357-K376 WeakPolarHBondContact CE1-O 3.38Å; F357-K376 HydrophobicContact CE2-CB 4.34Å; F357-K376 HydrophobicContact CE2-CD 3.65Å; F357-K376 HydrophobicContact CE2-CG 4.02Å; F357-K376 HydrophobicContact CG-CD 4.25Å; F357-K376 HydrophobicContact CG-CG 4.01Å; F357-K376 HydrophobicContact CZ-CB 3.68Å; F357-K376 HydrophobicContact CZ-CD 3.89Å; F357-K376 HydrophobicContact CZ-CG 3.83Å; F357-L379 HydrophobicContact CD1-CB 4.23Å; F357-L379 HydrophobicContact CD1-CD1 3.95Å; F357-L379 HydrophobicContact CE1-CB 4.35Å; F357-L380 HydrophobicContact CE1-CD1 4.27Å; F357-L380 HydrophobicContact CE1-CD2 4.33Å; F357-L380 HydrophobicContact CE1-CG 3.84Å; F357-L380 HydrophobicContact CZ-CD1 3.88Å; F357-L380 HydrophobicContact CZ-CD2 4.32Å; F357-L380 HydrophobicContact CZ-CG 3.92Å
358	Q	86.4	Confident	83	Confident	113 Å²	113	90.2 Å²	90.2	53%	0.528	46%	0.459	S	S	.	.	H	α-helix	trans	-63.3	-32.9	173.7	-71.7	172.4	28.6	0	0	112.6	D354 Y355 K362	D354-Q358 VanDerWaalsContact O-CG 3.31Å; D354-Q358 WeakPolarHBondContact O-CG 3.4Å; D354-Q358 PolarHBondContact O-N 2.68Å; Y355-Q358 PolarHBondContact O-N 2.97Å; Q358-K362 WeakPolarHBondContact O-CG 3.38Å
359	R	88.8	Confident	83.3	Confident	156 Å²	156	90.2 Å²	90.2	59%	0.589	48%	0.48	S	S	*	.	H	α-helix	trans	-72.4	-45.7	173	-72.3	178.8	67.3	-167	2.2	111.6	Y355 G356 F357 Q361 K362 V363	Y355-R359 HydrophobicContact CE1-CG 4.42Å; Y355-R359 HydrophobicContact CE2-CG 4.26Å; Y355-R359 WeakPolarHBondContact O-CG 3.4Å; Y355-R359 PolarHBondContact O-N 3.07Å; G356-R359 PolarHBondContact O-N 2.9Å; F357-R359 VanDerWaalsContact C-N 3.28Å; F357-R359 PolarHBondContact O-N 3.3Å; R359-Q361 VanDerWaalsContact C-N 3.33Å; R359-Q361 PolarHBondContact O-N 3.33Å; R359-K362 WeakPolarHBondContact O-CB 3.43Å; R359-K362 PolarHBondContact O-N 2.92Å; R359-K362 VanDerWaalsContact O-N 3.1Å; R359-V363 PolarHBondContact O-N 2.93Å
360	L	89.2	Confident	83.7	Confident	51 Å²	51	86.1 Å²	86.1	27%	0.267	46%	0.458	S	S	.	.	H	α-helix	trans	-57.3	-46.2	175.3	-72.1	172.4	0	0	0	111.1	G356 F357 K362 V363 I364 L380 A383	G356-L360 WeakPolarHBondContact O-CG 3.18Å; G356-L360 PolarHBondContact O-N 2.91Å; F357-L360 HydrophobicContact CD1-CD1 4.42Å; F357-L360 PolarHBondContact O-N 2.76Å; L360-K362 PolarHBondContact O-N 3.43Å; L360-V363 PolarHBondContact O-N 3.43Å; L360-I364 HydrophobicContact CB-CG1 4.39Å; L360-I364 WeakPolarHBondContact O-CB 3.39Å; L360-I364 VanDerWaalsContact O-CG1 3.25Å; L360-I364 WeakPolarHBondContact O-CG1 3.43Å; L360-I364 PolarHBondContact O-N 2.92Å; L360-L380 HydrophobicContact CD1-CD2 4.28Å; L360-A383 HydrophobicContact CD2-CB 4.08Å
361	Q	86.7	Confident	84.3	Confident	68 Å²	68	85.9 Å²	85.9	32%	0.318	46%	0.464	S	S	.	.	H	α-helix	trans	-59.1	-18.7	178.4	-168	176	-3.9	0	0	114.1	F357 R359 E372 L379	F357-Q361 WeakPolarHBondContact O-CB 3.46Å; F357-Q361 PolarHBondContact O-N 3.23Å; R359-Q361 VanDerWaalsContact C-N 3.33Å; R359-Q361 PolarHBondContact O-N 3.33Å; Q361-E372 PolarHBondContact NE2-O 3.41Å; Q361-L379 HydrophobicContact CB-CD1 4.19Å; Q361-L379 HydrophobicContact CB-CD2 4.11Å; Q361-L379 HydrophobicContact CG-CD2 4.39Å
362	K	86.3	Confident	84.5	Confident	179 Å²	179	89 Å²	89	78%	0.778	47%	0.469	S	S	*	.	H	α-helix	trans	-90.3	-21	174	-66.6	174	-176.5	-177.2	0	114.2	Q358 R359 L360	Q358-K362 WeakPolarHBondContact O-CG 3.38Å; R359-K362 WeakPolarHBondContact O-CB 3.43Å; R359-K362 PolarHBondContact O-N 2.92Å; R359-K362 VanDerWaalsContact O-N 3.1Å; L360-K362 PolarHBondContact O-N 3.43Å
363	V	87	Confident	84.8	Confident	112 Å²	112	94 Å²	94	68%	0.679	48%	0.477	S	S	*	.	H	α-helix	trans	-102.8	-32.6	-175.5	179.2	0	0	0	0	111.7	R359 L360 P365	R359-V363 PolarHBondContact O-N 2.93Å; L360-V363 PolarHBondContact O-N 3.43Å; V363-P365 WeakPolarHBondContact O-CD 3.22Å
364	I	87.1	Confident	85.1	Confident	9 Å²	9	92.4 Å²	92.4	5%	0.046	47%	0.469	C	S	.	.	S	Bend	trans	-69.8	124	-179.8	-64.4	-57.4	0	0	0	110.6	L360 R366 L379 R382 A383 L386	L360-I364 HydrophobicContact CB-CG1 4.39Å; L360-I364 WeakPolarHBondContact O-CB 3.39Å; L360-I364 VanDerWaalsContact O-CG1 3.25Å; L360-I364 WeakPolarHBondContact O-CG1 3.43Å; L360-I364 PolarHBondContact O-N 2.92Å; I364-R366 PolarHBondContact O-N 3.11Å; I364-L379 HydrophobicContact CB-CD2 4.31Å; I364-L379 HydrophobicContact CG1-CD2 4.28Å; I364-L379 HydrophobicContact CG2-CD2 4.46Å; I364-R382 HydrophobicContact CD1-CB 4.23Å; I364-R382 HydrophobicContact CG2-CB 3.6Å; I364-R382 HydrophobicContact CG2-CG 4.28Å; I364-A383 HydrophobicContact CD1-CB 3.83Å; I364-L386 HydrophobicContact CD1-CD1 3.64Å
365	P	82.1	Confident	85.4	Confident	68 Å²	68	93.2 Å²	93.2	44%	0.442	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-57.5	135.2	172.3	-26	36.1	0	0	0	112.3	V363 R382 L386	V363-P365 WeakPolarHBondContact O-CD 3.22Å; P365-R382 PolarHBondContact O-NH1 3Å; P365-L386 HydrophobicContact CG-CD2 4.36Å
366	R	83.6	Confident	85.5	Confident	133 Å²	133	90.2 Å²	90.2	50%	0.502	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-89.6	138.3	172.8	-63.3	-169.3	67.8	-168.5	-5.1	110	I364 D370 P371	I364-R366 PolarHBondContact O-N 3.11Å; R366-D370 VanDerWaalsContact CA-OD2 3.22Å; R366-D370 WeakPolarHBondContact CA-OD2 3.45Å; R366-D370 PolarHBondContact NH2-O 3.42Å; R366-P371 PolarHBondContact NH2-O 2.88Å
367	H	83.9	Confident	85.6	Confident	106 Å²	106	96.7 Å²	96.7	49%	0.491	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-97.6	151.4	176.7	-65	71.3	0	0	0	109.5	G369 D370 R382	H367-G369 PolarHBondContact O-N 3.05Å; H367-D370 PolarHBondContact N-OD2 3.37Å; H367-D370 WeakPolarHBondContact O-CB 3.4Å; H367-D370 VanDerWaalsContact O-CG 3.26Å; H367-D370 PolarHBondContact O-N 3.04Å; H367-D370 VanDerWaalsContact O-N 3.12Å; H367-R382 VanDerWaalsContact ND1-CZ 3.29Å; H367-R382 PolarHBondContact ND1-NH1 3.38Å
368	P	83.4	Confident	85.6	Confident	139 Å²	139	97.7 Å²	97.7	90%	0.903	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	128.4	172.2	-24.9	34.8	0	0	0	111.1
369	G	83.8	Confident	85.8	Confident	85 Å²	85	92.4 Å²	92.4	88%	0.876	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.1	-2.9	-176.5	0	0	0	0	0	115.8	H367	H367-G369 PolarHBondContact O-N 3.05Å
370	D	85.6	Confident	85.9	Confident	29 Å²	29	89.6 Å²	89.6	16%	0.155	47%	0.469	C	S	.	.			trans	-62.2	133.3	176.9	-82.2	-15.6	0	0	0	113	R366 H367 L374 R382	R366-D370 VanDerWaalsContact CA-OD2 3.22Å; R366-D370 WeakPolarHBondContact CA-OD2 3.45Å; R366-D370 PolarHBondContact NH2-O 3.42Å; H367-D370 PolarHBondContact N-OD2 3.37Å; H367-D370 WeakPolarHBondContact O-CB 3.4Å; H367-D370 VanDerWaalsContact O-CG 3.26Å; H367-D370 PolarHBondContact O-N 3.04Å; H367-D370 VanDerWaalsContact O-N 3.12Å; D370-L374 HydrophobicContact CB-CD2 4.04Å; D370-R382 IonicContact OD1-CZ 3.71Å; D370-R382 IonicContact OD1-NH1 3.49Å; D370-R382 PolarHBondContact OD1-NH1 3.02Å; D370-R382 IonicContact OD1-NH2 3.38Å; D370-R382 PolarHBondContact OD1-NH2 3.16Å; D370-R382 IonicContact OD2-CZ 3.99Å; D370-R382 IonicContact OD2-NH1 2.7Å; D370-R382 PolarHBondContact OD2-NH1 2.92Å; D370-R382 IonicContact OD2-NH2 3.43Å; D370-R382 PolarHBondContact OD2-NH2 3.1Å
371	P	85	Confident	86	Confident	74 Å²	74	93.8 Å²	93.8	48%	0.481	49%	0.485	S	S	.	.			trans	-61.1	150.1	170.5	28.5	-35.6	0	0	0	110.8	R366 R373 L374	R366-P371 PolarHBondContact NH2-O 2.88Å; P371-R373 PolarHBondContact O-N 3.32Å; P371-R373 VanDerWaalsContact O-N 3.11Å; P371-L374 HydrophobicContact CG-CD2 4.39Å
372	E	80.2	Confident	86.2	Confident	172 Å²	172	92.3 Å²	92.3	80%	0.804	48%	0.477	S	S	*	.	S	Bend	trans	-51.1	-38.8	-177.3	-171.9	177.7	-165.3	0	0	112.9	Q361	Q361-E372 PolarHBondContact NE2-O 3.41Å
373	R	83.4	Confident	86.4	Confident	196 Å²	196	84.7 Å²	84.7	74%	0.74	45%	0.448	S	S	*	.	S	Bend	trans	-111.7	109.3	170.6	-169.9	175.1	-174.4	171.1	1	109.9	P371	P371-R373 PolarHBondContact O-N 3.32Å; P371-R373 VanDerWaalsContact O-N 3.11Å
374	L	84.5	Confident	86.6	Confident	10 Å²	10	81.5 Å²	81.5	5%	0.052	43%	0.433	C	S	.	.			trans	-67.6	138.5	173.6	-74.5	170.8	0	0	0	110.9	D370 P371 V378 L379	D370-L374 HydrophobicContact CB-CD2 4.04Å; P371-L374 HydrophobicContact CG-CD2 4.39Å; L374-V378 HydrophobicContact CD2-CG1 4.08Å; L374-L379 HydrophobicContact CB-CD1 4.36Å; L374-L379 HydrophobicContact CB-CD2 3.91Å; L374-L379 HydrophobicContact CB-CG 3.83Å; L374-L379 HydrophobicContact CD1-CD2 3.8Å
375	P	87.9	Confident	86.7	Confident	66 Å²	66	84.7 Å²	84.7	43%	0.429	45%	0.45	S	S	.	.			trans	-58.8	147.6	171.2	-23.7	33.6	0	0	0	112.2	E377 V378 L379	P375-E377 PolarHBondContact O-N 2.95Å; P375-V378 HydrophobicContact CB-CG2 4.14Å; P375-V378 HydrophobicContact CG-CG2 4.11Å; P375-V378 PolarHBondContact O-N 3.19Å; P375-L379 PolarHBondContact O-N 2.96Å
376	K	86.7	Confident	87	Confident	73 Å²	73	84.6 Å²	84.6	32%	0.317	45%	0.445	S	S	.	.	H	α-helix	trans	-53.6	-40.9	178.6	-74.5	-171.8	171.3	-173.9	0	112	L348 D354 F357 L379 L380	L348-K376 PolarHBondContact O-NZ 3.31Å; D354-K376 VanDerWaalsContact OD1-CE 3.28Å; D354-K376 WeakPolarHBondContact OD1-CE 3.29Å; D354-K376 IonicContact OD1-NZ 3.68Å; D354-K376 PolarHBondContact OD1-NZ 2.9Å; F357-K376 HydrophobicContact CD1-CB 4.1Å; F357-K376 HydrophobicContact CD1-CD 4.46Å; F357-K376 HydrophobicContact CD1-CG 3.82Å; F357-K376 HydrophobicContact CD2-CD 3.83Å; F357-K376 HydrophobicContact CD2-CG 4.09Å; F357-K376 HydrophobicContact CE1-CB 3.53Å; F357-K376 HydrophobicContact CE1-CD 4.29Å; F357-K376 HydrophobicContact CE1-CG 3.72Å; F357-K376 WeakPolarHBondContact CE1-O 3.38Å; F357-K376 HydrophobicContact CE2-CB 4.34Å; F357-K376 HydrophobicContact CE2-CD 3.65Å; F357-K376 HydrophobicContact CE2-CG 4.02Å; F357-K376 HydrophobicContact CG-CD 4.25Å; F357-K376 HydrophobicContact CG-CG 4.01Å; F357-K376 HydrophobicContact CZ-CB 3.68Å; F357-K376 HydrophobicContact CZ-CD 3.89Å; F357-K376 HydrophobicContact CZ-CG 3.83Å; K376-L379 PolarHBondContact O-N 3.47Å; K376-L380 PolarHBondContact O-N 2.79Å
377	E	88	Confident	87.2	Confident	164 Å²	164	81.7 Å²	81.7	77%	0.766	44%	0.443	S	S	*	.	H	α-helix	trans	-60	-44.3	176.3	-67.2	159	-153.2	0	0	112.9	P375 L380 K381	P375-E377 PolarHBondContact O-N 2.95Å; E377-L380 PolarHBondContact O-N 2.7Å; E377-K381 WeakPolarHBondContact O-CB 3.4Å; E377-K381 PolarHBondContact O-N 3.12Å
378	V	89	Confident	87.3	Confident	48 Å²	48	83.1 Å²	83.1	29%	0.291	45%	0.449	S	S	.	.	H	α-helix	trans	-69.6	-37.6	179.7	-179.7	0	0	0	0	111	L374 P375 R382	L374-V378 HydrophobicContact CD2-CG1 4.08Å; P375-V378 HydrophobicContact CB-CG2 4.14Å; P375-V378 HydrophobicContact CG-CG2 4.11Å; P375-V378 PolarHBondContact O-N 3.19Å; V378-R382 WeakPolarHBondContact O-CG 3.29Å; V378-R382 PolarHBondContact O-N 2.88Å
379	L	90	Very high	87.4	Confident	3 Å²	3	79.4 Å²	79.4	2%	0.016	43%	0.43	C	S	.	.	H	α-helix	trans	-62.4	-45.6	174.2	-73.2	171.7	0	0	0	111.8	F357 Q361 I364 L374 P375 K376 A383	F357-L379 HydrophobicContact CD1-CB 4.23Å; F357-L379 HydrophobicContact CD1-CD1 3.95Å; F357-L379 HydrophobicContact CE1-CB 4.35Å; Q361-L379 HydrophobicContact CB-CD1 4.19Å; Q361-L379 HydrophobicContact CB-CD2 4.11Å; Q361-L379 HydrophobicContact CG-CD2 4.39Å; I364-L379 HydrophobicContact CB-CD2 4.31Å; I364-L379 HydrophobicContact CG1-CD2 4.28Å; I364-L379 HydrophobicContact CG2-CD2 4.46Å; L374-L379 HydrophobicContact CB-CD1 4.36Å; L374-L379 HydrophobicContact CB-CD2 3.91Å; L374-L379 HydrophobicContact CB-CG 3.83Å; L374-L379 HydrophobicContact CD1-CD2 3.8Å; P375-L379 PolarHBondContact O-N 2.96Å; K376-L379 PolarHBondContact O-N 3.47Å; L379-A383 WeakPolarHBondContact O-CB 3.39Å; L379-A383 PolarHBondContact O-N 2.7Å
380	L	91.3	Very high	87.4	Confident	96 Å²	96	81.7 Å²	81.7	50%	0.503	42%	0.422	S	S	.	.	H	α-helix	trans	-66.2	-43.9	176.8	-76	174.6	0	0	0	112.2	F357 L360 K376 E377 R382 A383 A384	F357-L380 HydrophobicContact CE1-CD1 4.27Å; F357-L380 HydrophobicContact CE1-CD2 4.33Å; F357-L380 HydrophobicContact CE1-CG 3.84Å; F357-L380 HydrophobicContact CZ-CD1 3.88Å; F357-L380 HydrophobicContact CZ-CD2 4.32Å; F357-L380 HydrophobicContact CZ-CG 3.92Å; L360-L380 HydrophobicContact CD1-CD2 4.28Å; K376-L380 PolarHBondContact O-N 2.79Å; E377-L380 PolarHBondContact O-N 2.7Å; L380-R382 PolarHBondContact O-N 3.07Å; L380-A383 WeakPolarHBondContact O-CB 3.45Å; L380-A383 PolarHBondContact O-N 3.49Å; L380-A383 VanDerWaalsContact O-N 3.16Å; L380-A384 PolarHBondContact O-N 3.21Å
381	K	90.7	Very high	87.2	Confident	139 Å²	139	90 Å²	90	60%	0.604	45%	0.452	S	S	*	.	H	α-helix	trans	-56.9	-52.7	177.9	-176.8	177.1	177	179.3	0	111	E377 A383 A384 D385	E377-K381 WeakPolarHBondContact O-CB 3.4Å; E377-K381 PolarHBondContact O-N 3.12Å; K381-A383 VanDerWaalsContact C-N 3.26Å; K381-A383 PolarHBondContact O-N 3.05Å; K381-A384 WeakPolarHBondContact O-CB 3.38Å; K381-A384 PolarHBondContact O-N 3.48Å; K381-A384 VanDerWaalsContact O-N 3.07Å; K381-D385 PolarHBondContact O-N 3.03Å
382	R	90.4	Very high	86.6	Confident	37 Å²	37	89.5 Å²	89.5	14%	0.14	46%	0.46	C	S	.	.	H	α-helix	trans	-64.4	-29.3	178.1	-68	-179.3	-174	176.1	8	113.4	I364 P365 H367 D370 V378 L380 D385 L386	I364-R382 HydrophobicContact CD1-CB 4.23Å; I364-R382 HydrophobicContact CG2-CB 3.6Å; I364-R382 HydrophobicContact CG2-CG 4.28Å; P365-R382 PolarHBondContact O-NH1 3Å; H367-R382 VanDerWaalsContact ND1-CZ 3.29Å; H367-R382 PolarHBondContact ND1-NH1 3.38Å; D370-R382 IonicContact OD1-CZ 3.71Å; D370-R382 IonicContact OD1-NH1 3.49Å; D370-R382 PolarHBondContact OD1-NH1 3.02Å; D370-R382 IonicContact OD1-NH2 3.38Å; D370-R382 PolarHBondContact OD1-NH2 3.16Å; D370-R382 IonicContact OD2-CZ 3.99Å; D370-R382 IonicContact OD2-NH1 2.7Å; D370-R382 PolarHBondContact OD2-NH1 2.92Å; D370-R382 IonicContact OD2-NH2 3.43Å; D370-R382 PolarHBondContact OD2-NH2 3.1Å; V378-R382 WeakPolarHBondContact O-CG 3.29Å; V378-R382 PolarHBondContact O-N 2.88Å; L380-R382 PolarHBondContact O-N 3.07Å; R382-D385 WeakPolarHBondContact CA-OD2 3.25Å; R382-L386 WeakPolarHBondContact O-CB 3.28Å; R382-L386 VanDerWaalsContact O-CG 3.29Å; R382-L386 WeakPolarHBondContact O-CG 3.49Å; R382-L386 PolarHBondContact O-N 3.29Å
383	A	90.8	Very high	85.9	Confident	20 Å²	20	87.7 Å²	87.7	17%	0.165	45%	0.453	C	S	.	.	H	α-helix	trans	-65.1	-42.1	173.1	0	0	0	0	0	111.2	L360 I364 L379 L380 K381 V387	L360-A383 HydrophobicContact CD2-CB 4.08Å; I364-A383 HydrophobicContact CD1-CB 3.83Å; L379-A383 WeakPolarHBondContact O-CB 3.39Å; L379-A383 PolarHBondContact O-N 2.7Å; L380-A383 WeakPolarHBondContact O-CB 3.45Å; L380-A383 PolarHBondContact O-N 3.49Å; L380-A383 VanDerWaalsContact O-N 3.16Å; K381-A383 VanDerWaalsContact C-N 3.26Å; K381-A383 PolarHBondContact O-N 3.05Å; A383-V387 VanDerWaalsContact O-CG2 3.28Å; A383-V387 WeakPolarHBondContact O-CG2 3.5Å; A383-V387 PolarHBondContact O-N 3Å; A383-V387 VanDerWaalsContact O-N 3.15Å
384	A	90.8	Very high	84.6	Confident	45 Å²	45	82.8 Å²	82.8	37%	0.372	45%	0.447	S	S	.	.	H	α-helix	trans	-64.7	-49.9	172.8	0	0	0	0	0	111.1	L380 K381 L386 V387 E388	L380-A384 PolarHBondContact O-N 3.21Å; K381-A384 WeakPolarHBondContact O-CB 3.38Å; K381-A384 PolarHBondContact O-N 3.48Å; K381-A384 VanDerWaalsContact O-N 3.07Å; A384-L386 VanDerWaalsContact C-N 3.26Å; A384-L386 PolarHBondContact O-N 2.93Å; A384-V387 PolarHBondContact O-N 3.29Å; A384-E388 WeakPolarHBondContact O-CG 3.27Å; A384-E388 PolarHBondContact O-N 3.43Å
385	D	89.2	Confident	83.2	Confident	75 Å²	75	88.8 Å²	88.8	40%	0.401	48%	0.475	S	S	.	.	H	α-helix	trans	-53.3	-41.5	179.2	-56.2	-30.2	0	0	0	111.9	K381 R382 A389	K381-D385 PolarHBondContact O-N 3.03Å; R382-D385 WeakPolarHBondContact CA-OD2 3.25Å; D385-A389 WeakPolarHBondContact O-CB 3.47Å; D385-A389 PolarHBondContact O-N 2.88Å
386	L	87.9	Confident	81.4	Confident	66 Å²	66	90 Å²	90	35%	0.346	48%	0.478	S	S	.	.	H	α-helix	trans	-68.6	-41.3	175.4	-73.5	173.9	0	0	0	113.2	I364 P365 R382 A384 A389 L390	I364-L386 HydrophobicContact CD1-CD1 3.64Å; P365-L386 HydrophobicContact CG-CD2 4.36Å; R382-L386 WeakPolarHBondContact O-CB 3.28Å; R382-L386 VanDerWaalsContact O-CG 3.29Å; R382-L386 WeakPolarHBondContact O-CG 3.49Å; R382-L386 PolarHBondContact O-N 3.29Å; A384-L386 VanDerWaalsContact C-N 3.26Å; A384-L386 PolarHBondContact O-N 2.93Å; L386-A389 PolarHBondContact O-N 3.15Å; L386-L390 VanDerWaalsContact O-CG 3.29Å; L386-L390 WeakPolarHBondContact O-CG 3.44Å; L386-L390 PolarHBondContact O-N 3.36Å
387	V	88.2	Confident	79.9	Confident	73 Å²	73	92.4 Å²	92.4	44%	0.442	49%	0.494	S	S	.	.	H	α-helix	trans	-66.6	-43.1	178.6	169.2	0	0	0	0	110	A383 A384 A389 L390 Y391	A383-V387 VanDerWaalsContact O-CG2 3.28Å; A383-V387 WeakPolarHBondContact O-CG2 3.5Å; A383-V387 PolarHBondContact O-N 3Å; A383-V387 VanDerWaalsContact O-N 3.15Å; A384-V387 PolarHBondContact O-N 3.29Å; V387-A389 VanDerWaalsContact C-N 3.34Å; V387-A389 PolarHBondContact O-N 3.25Å; V387-L390 PolarHBondContact O-N 3.45Å; V387-Y391 HydrophobicContact CG1-CD2 3.72Å; V387-Y391 HydrophobicContact CG1-CE2 3.73Å; V387-Y391 VanDerWaalsContact O-CD2 3.27Å; V387-Y391 WeakPolarHBondContact O-CD2 3.29Å; V387-Y391 PolarHBondContact O-N 3.03Å
388	E	87.2	Confident	78.3	Confident	136 Å²	136	90.3 Å²	90.3	64%	0.636	48%	0.484	S	S	*	.	H	α-helix	trans	-59.9	-43.1	173	-70.8	179.7	-172.4	0	0	111.5	A384 L390 Y391 G392	A384-E388 WeakPolarHBondContact O-CG 3.27Å; A384-E388 PolarHBondContact O-N 3.43Å; E388-L390 VanDerWaalsContact C-N 3.35Å; E388-L390 PolarHBondContact O-N 2.98Å; E388-Y391 PolarHBondContact O-N 2.95Å; E388-G392 PolarHBondContact O-N 3.38Å
389	A	85.4	Confident	76.9	Confident	60 Å²	60	94.7 Å²	94.7	50%	0.496	50%	0.502	S	S	.	.	H	α-helix	trans	-62.2	-38.9	174.2	0	0	0	0	0	112.9	D385 L386 V387 G392 M393	D385-A389 WeakPolarHBondContact O-CB 3.47Å; D385-A389 PolarHBondContact O-N 2.88Å; L386-A389 PolarHBondContact O-N 3.15Å; V387-A389 VanDerWaalsContact C-N 3.34Å; V387-A389 PolarHBondContact O-N 3.25Å; A389-G392 PolarHBondContact O-N 3.19Å; A389-M393 WeakPolarHBondContact O-CG 3.46Å; A389-M393 PolarHBondContact O-N 3Å
390	L	83.4	Confident	75.6	Confident	134 Å²	134	99 Å²	99	70%	0.702	52%	0.523	S	S	*	.	H	α-helix	trans	-66.7	-37.9	176.5	-73.8	168.5	0	0	0	112.7	L386 V387 E388	L386-L390 VanDerWaalsContact O-CG 3.29Å; L386-L390 WeakPolarHBondContact O-CG 3.44Å; L386-L390 PolarHBondContact O-N 3.36Å; V387-L390 PolarHBondContact O-N 3.45Å; E388-L390 VanDerWaalsContact C-N 3.35Å; E388-L390 PolarHBondContact O-N 2.98Å
391	Y	80.4	Confident	74.2	Confident	203 Å²	203	100 Å²	100	80%	0.796	53%	0.528	S	S	*	.	H	α-helix	trans	-80.8	-20.6	175.2	-77.2	-71.9	0	0	0	113.5	V387 E388	V387-Y391 HydrophobicContact CG1-CD2 3.72Å; V387-Y391 HydrophobicContact CG1-CE2 3.73Å; V387-Y391 VanDerWaalsContact O-CD2 3.27Å; V387-Y391 WeakPolarHBondContact O-CD2 3.29Å; V387-Y391 PolarHBondContact O-N 3.03Å; E388-Y391 PolarHBondContact O-N 2.95Å
392	G	73.8	Confident	73	Confident	63 Å²	63	99 Å²	99	65%	0.649	53%	0.529	S	S	*	.	H	α-helix	trans	-84.1	-13.1	179	0	0	0	0	0	115.5	E388 A389	E388-G392 PolarHBondContact O-N 3.38Å; A389-G392 PolarHBondContact O-N 3.19Å
393	M	65.3	Low	72	Confident	134 Å²	134	104.1 Å²	104.1	66%	0.66	55%	0.552	S	S	*	*	S	Bend	trans	-74.2	130.9	175	-67.1	-156.5	91.4	0	0	111.4	A389	A389-M393 WeakPolarHBondContact O-CG 3.46Å; A389-M393 PolarHBondContact O-N 3Å
394	P	56	Low	70.9	Confident	94 Å²	94	111.4 Å²	111.4	61%	0.61	58%	0.575	S	S	*	*			trans	-60.5	153.3	169.9	27.6	-34.3	0	0	0	110.5	N396	P394-N396 PolarHBondContact O-N 2.83Å
395	H	54.2	Low	69.7	Low	136 Å²	136	111.9 Å²	111.9	63%	0.63	58%	0.579	S	S	*	*			trans	-70	52.8	-169.2	-69.6	-4.3	0	0	0	115.6	N397 Q398	H395-N397 PolarHBondContact O-N 3.47Å; H395-Q398 HydrophobicContact CB-CB 4.4Å; H395-Q398 HydrophobicContact CB-CG 4.39Å; H395-Q398 PolarHBondContact O-N 2.99Å
396	N	51	Low	68.9	Low	91 Å²	91	110.9 Å²	110.9	49%	0.487	58%	0.581	S	S	.	*	H	α-helix	trans	-61	-20.1	177.4	-71.1	4.8	0	0	0	113.1	P394 I400	P394-N396 PolarHBondContact O-N 2.83Å; N396-I400 WeakPolarHBondContact O-CD1 3.28Å; N396-I400 VanDerWaalsContact O-CG1 3.28Å; N396-I400 WeakPolarHBondContact O-CG1 3.48Å; N396-I400 PolarHBondContact O-N 3.19Å; N396-I400 VanDerWaalsContact O-N 3.11Å
397	N	54.8	Low	68	Low	124 Å²	124	111.9 Å²	111.9	66%	0.663	59%	0.587	S	S	*	*	H	α-helix	trans	-70	-28.4	171.3	-79.8	-16.1	0	0	0	113.3	H395 I401	H395-N397 PolarHBondContact O-N 3.47Å; N397-I401 VanDerWaalsContact O-CB 3.31Å; N397-I401 WeakPolarHBondContact O-CB 3.31Å; N397-I401 VanDerWaalsContact O-CD1 3.32Å; N397-I401 WeakPolarHBondContact O-CD1 3.14Å; N397-I401 WeakPolarHBondContact O-CG1 3.32Å; N397-I401 PolarHBondContact O-N 3.45Å; N397-I401 VanDerWaalsContact O-N 3.09Å
398	Q	55.3	Low	67.1	Low	120 Å²	120	113.2 Å²	113.2	56%	0.561	59%	0.591	S	S	*	*	H	α-helix	trans	-69.6	-44.9	174	-78.1	-174.6	-25	0	0	110.8	H395 I400 I401 L402	H395-Q398 HydrophobicContact CB-CB 4.4Å; H395-Q398 HydrophobicContact CB-CG 4.39Å; H395-Q398 PolarHBondContact O-N 2.99Å; Q398-I400 PolarHBondContact O-N 3.39Å; Q398-I401 PolarHBondContact O-N 3.33Å; Q398-L402 VanDerWaalsContact O-CB 3.27Å; Q398-L402 WeakPolarHBondContact O-CB 3.4Å; Q398-L402 WeakPolarHBondContact O-CD1 3.27Å; Q398-L402 WeakPolarHBondContact O-CG 3.42Å; Q398-L402 PolarHBondContact O-N 3.11Å
399	E	58.6	Low	66.1	Low	140 Å²	140	108.7 Å²	108.7	65%	0.654	58%	0.577	S	S	*	*	H	α-helix	trans	-63.9	-40.5	177	-68.7	-166.7	150.6	0	0	112.8	L402 K403	E399-L402 PolarHBondContact O-N 2.9Å; E399-K403 WeakPolarHBondContact O-CB 3.13Å; E399-K403 PolarHBondContact O-N 3.33Å
400	I	61.9	Low	65.1	Low	93 Å²	93	112.8 Å²	112.8	48%	0.477	59%	0.585	S	S	.	*	H	α-helix	trans	-67.6	-36.7	177.6	-67	166.7	0	0	0	111.5	N396 Q398 R404	N396-I400 WeakPolarHBondContact O-CD1 3.28Å; N396-I400 VanDerWaalsContact O-CG1 3.28Å; N396-I400 WeakPolarHBondContact O-CG1 3.48Å; N396-I400 PolarHBondContact O-N 3.19Å; N396-I400 VanDerWaalsContact O-N 3.11Å; Q398-I400 PolarHBondContact O-N 3.39Å; I400-R404 WeakPolarHBondContact O-CB 3.48Å; I400-R404 PolarHBondContact O-N 2.82Å
401	I	62.8	Low	64	Low	118 Å²	118	109.2 Å²	109.2	61%	0.605	58%	0.575	S	S	*	*	H	α-helix	trans	-72.3	-43.3	176.2	-69	168.2	0	0	0	111	N397 Q398 R404 A405	N397-I401 VanDerWaalsContact O-CB 3.31Å; N397-I401 WeakPolarHBondContact O-CB 3.31Å; N397-I401 VanDerWaalsContact O-CD1 3.32Å; N397-I401 WeakPolarHBondContact O-CD1 3.14Å; N397-I401 WeakPolarHBondContact O-CG1 3.32Å; N397-I401 PolarHBondContact O-N 3.45Å; N397-I401 VanDerWaalsContact O-N 3.09Å; Q398-I401 PolarHBondContact O-N 3.33Å; I401-R404 PolarHBondContact O-N 2.74Å; I401-A405 VanDerWaalsContact O-CB 3.26Å; I401-A405 WeakPolarHBondContact O-CB 3.49Å; I401-A405 PolarHBondContact O-N 3.06Å
402	L	65.8	Low	62.8	Low	118 Å²	118	105.8 Å²	105.8	62%	0.618	57%	0.57	S	S	*	*	H	α-helix	trans	-63.7	-41.1	175.4	-82	158.3	0	0	0	111.7	Q398 E399 A405 A406	Q398-L402 VanDerWaalsContact O-CB 3.27Å; Q398-L402 WeakPolarHBondContact O-CB 3.4Å; Q398-L402 WeakPolarHBondContact O-CD1 3.27Å; Q398-L402 WeakPolarHBondContact O-CG 3.42Å; Q398-L402 PolarHBondContact O-N 3.11Å; E399-L402 PolarHBondContact O-N 2.9Å; L402-A405 PolarHBondContact O-N 3.33Å; L402-A406 WeakPolarHBondContact O-CB 3.24Å; L402-A406 PolarHBondContact O-N 3.48Å
403	K	68.2	Low	61.9	Low	144 Å²	144	112.9 Å²	112.9	63%	0.626	58%	0.579	S	S	*	*	H	α-helix	trans	-66.7	-46.2	176.7	-170.8	166	-176.6	170.7	0	111.6	E399 A405 A406 D407	E399-K403 WeakPolarHBondContact O-CB 3.13Å; E399-K403 PolarHBondContact O-N 3.33Å; K403-A405 VanDerWaalsContact C-N 3.3Å; K403-A405 PolarHBondContact O-N 3.01Å; K403-A406 WeakPolarHBondContact O-CB 3.26Å; K403-A406 PolarHBondContact O-N 3.09Å; K403-A406 VanDerWaalsContact O-N 3.15Å; K403-D407 PolarHBondContact O-N 2.8Å
404	R	67.5	Low	61.5	Low	173 Å²	173	111.2 Å²	111.2	65%	0.653	58%	0.58	S	S	*	*	H	α-helix	trans	-60.7	-37.1	170.9	-86.9	-176.2	170.5	163.4	-1.3	113	I400 I401 A406 I408	I400-R404 WeakPolarHBondContact O-CB 3.48Å; I400-R404 PolarHBondContact O-N 2.82Å; I401-R404 PolarHBondContact O-N 2.74Å; R404-A406 VanDerWaalsContact C-N 3.34Å; R404-I408 VanDerWaalsContact O-CB 3.27Å; R404-I408 WeakPolarHBondContact O-CB 3.39Å; R404-I408 WeakPolarHBondContact O-CD1 3.27Å; R404-I408 WeakPolarHBondContact O-CG1 3.15Å; R404-I408 PolarHBondContact O-N 3.48Å
405	A	66.2	Low	61.1	Low	55 Å²	55	111.6 Å²	111.6	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-67	-36	176.1	0	0	0	0	0	111.8	I401 L402 K403 A409	I401-A405 VanDerWaalsContact O-CB 3.26Å; I401-A405 WeakPolarHBondContact O-CB 3.49Å; I401-A405 PolarHBondContact O-N 3.06Å; L402-A405 PolarHBondContact O-N 3.33Å; K403-A405 VanDerWaalsContact C-N 3.3Å; K403-A405 PolarHBondContact O-N 3.01Å; A405-A409 VanDerWaalsContact O-CB 3.24Å; A405-A409 WeakPolarHBondContact O-CB 3.44Å; A405-A409 PolarHBondContact O-N 3.39Å
406	A	71.9	Confident	60.4	Low	53 Å²	53	111 Å²	111	44%	0.438	59%	0.588	S	S	.	*	H	α-helix	trans	-69.2	-46.4	172.9	0	0	0	0	0	112.1	L402 K403 R404 I408 A409 E410	L402-A406 WeakPolarHBondContact O-CB 3.24Å; L402-A406 PolarHBondContact O-N 3.48Å; K403-A406 WeakPolarHBondContact O-CB 3.26Å; K403-A406 PolarHBondContact O-N 3.09Å; K403-A406 VanDerWaalsContact O-N 3.15Å; R404-A406 VanDerWaalsContact C-N 3.34Å; A406-I408 VanDerWaalsContact C-N 3.31Å; A406-I408 PolarHBondContact O-N 2.92Å; A406-A409 WeakPolarHBondContact O-CA 3.36Å; A406-A409 WeakPolarHBondContact O-CB 3.46Å; A406-A409 PolarHBondContact O-N 2.81Å; A406-E410 PolarHBondContact O-N 3.49Å
407	D	70.7	Confident	59.6	Low	88 Å²	88	118.5 Å²	118.5	47%	0.471	61%	0.61	S	S	.	*	H	α-helix	trans	-59.5	-41.6	176.2	-60.6	-28.3	0	0	0	111	K403 A411	K403-D407 PolarHBondContact O-N 2.8Å; D407-A411 WeakPolarHBondContact O-CB 3.5Å; D407-A411 PolarHBondContact O-N 2.84Å; D407-A411 VanDerWaalsContact O-N 3.08Å
408	I	69	Low	58.8	Low	101 Å²	101	120.4 Å²	120.4	52%	0.518	62%	0.62	S	S	.	*	H	α-helix	trans	-69.5	-36.1	174.7	-69.3	166.2	0	0	0	111	R404 A406 A411 L412	R404-I408 VanDerWaalsContact O-CB 3.27Å; R404-I408 WeakPolarHBondContact O-CB 3.39Å; R404-I408 WeakPolarHBondContact O-CD1 3.27Å; R404-I408 WeakPolarHBondContact O-CG1 3.15Å; R404-I408 PolarHBondContact O-N 3.48Å; A406-I408 VanDerWaalsContact C-N 3.31Å; A406-I408 PolarHBondContact O-N 2.92Å; I408-A411 PolarHBondContact O-N 3.15Å; I408-L412 HydrophobicContact CG2-CD1 3.72Å; I408-L412 HydrophobicContact CG2-CG 4.3Å; I408-L412 WeakPolarHBondContact O-CB 3.2Å; I408-L412 WeakPolarHBondContact O-CG 3.36Å; I408-L412 PolarHBondContact O-N 2.89Å
409	A	66.1	Low	57.9	Low	41 Å²	41	121.9 Å²	121.9	34%	0.339	63%	0.627	S	S	.	*	H	α-helix	trans	-65.8	-47.9	175.5	0	0	0	0	0	111.7	A405 A406 A411 L412 Y413	A405-A409 VanDerWaalsContact O-CB 3.24Å; A405-A409 WeakPolarHBondContact O-CB 3.44Å; A405-A409 PolarHBondContact O-N 3.39Å; A406-A409 WeakPolarHBondContact O-CA 3.36Å; A406-A409 WeakPolarHBondContact O-CB 3.46Å; A406-A409 PolarHBondContact O-N 2.81Å; A409-A411 VanDerWaalsContact C-N 3.31Å; A409-A411 PolarHBondContact O-N 2.86Å; A409-L412 CarbonylContact O-C 3.48Å; A409-L412 PolarHBondContact O-N 3.08Å; A409-L412 VanDerWaalsContact O-N 3.11Å; A409-Y413 WeakPolarHBondContact O-CD2 3.36Å; A409-Y413 PolarHBondContact O-N 2.83Å
410	E	64.4	Low	57	Low	146 Å²	146	120.8 Å²	120.8	68%	0.682	63%	0.625	S	S	*	*	H	α-helix	trans	-60.7	-39.7	175.2	-76.7	-157.1	143.7	0	0	112.1	A406 L412 Y413 S414	A406-E410 PolarHBondContact O-N 3.49Å; E410-L412 VanDerWaalsContact C-N 3.32Å; E410-L412 PolarHBondContact O-N 2.86Å; E410-Y413 PolarHBondContact O-N 3.37Å; E410-S414 WeakPolarHBondContact O-CB 3.34Å; E410-S414 PolarHBondContact O-N 3.29Å; E410-S414 VanDerWaalsContact O-N 3.11Å; E410-S414 PolarHBondContact O-OG 3.07Å
411	A	59.4	Low	56	Low	59 Å²	59	125.6 Å²	125.6	49%	0.488	65%	0.646	S	S	.	*	H	α-helix	trans	-63.1	-35.2	174.2	0	0	0	0	0	113	D407 I408 A409	D407-A411 WeakPolarHBondContact O-CB 3.5Å; D407-A411 PolarHBondContact O-N 2.84Å; D407-A411 VanDerWaalsContact O-N 3.08Å; I408-A411 PolarHBondContact O-N 3.15Å; A409-A411 VanDerWaalsContact C-N 3.31Å; A409-A411 PolarHBondContact O-N 2.86Å
412	L	56.6	Low	54.9	Low	130 Å²	130	127 Å²	127	68%	0.681	65%	0.653	S	S	*	*	H	α-helix	trans	-81.8	-24.2	177.4	-71.1	171.7	0	0	0	113.8	I408 A409 E410	I408-L412 HydrophobicContact CG2-CD1 3.72Å; I408-L412 HydrophobicContact CG2-CG 4.3Å; I408-L412 WeakPolarHBondContact O-CB 3.2Å; I408-L412 WeakPolarHBondContact O-CG 3.36Å; I408-L412 PolarHBondContact O-N 2.89Å; A409-L412 CarbonylContact O-C 3.48Å; A409-L412 PolarHBondContact O-N 3.08Å; A409-L412 VanDerWaalsContact O-N 3.11Å; E410-L412 VanDerWaalsContact C-N 3.32Å; E410-L412 PolarHBondContact O-N 2.86Å
413	Y	54.7	Low	53.7	Low	213 Å²	213	127 Å²	127	84%	0.835	66%	0.66	S	S	*	*	H	α-helix	trans	-82.5	-14	173.2	-90.5	-88.6	0	0	0	113.3	A409 E410	A409-Y413 WeakPolarHBondContact O-CD2 3.36Å; A409-Y413 PolarHBondContact O-N 2.83Å; E410-Y413 PolarHBondContact O-N 3.37Å
414	S	55.3	Low	52.1	Low	98 Å²	98	125.4 Å²	125.4	69%	0.685	66%	0.663	S	S	*	*	S	Bend	trans	-95.2	7	-177.5	-58.2	0	0	0	0	115	E410	E410-S414 WeakPolarHBondContact O-CB 3.34Å; E410-S414 PolarHBondContact O-N 3.29Å; E410-S414 VanDerWaalsContact O-N 3.11Å; E410-S414 PolarHBondContact O-OG 3.07Å
415	V	48.5	Very low	50.9	Low	103 Å²	103	125.3 Å²	125.3	62%	0.624	67%	0.674	S	S	*	*	S	Bend	trans	-124.8	129.1	-176	-177.6	0	0	0	0	111.3	R417	V415-R417 PolarHBondContact O-N 3.43Å
416	P	39.7	Very low	49.4	Very low	122 Å²	122	125.9 Å²	125.9	79%	0.792	69%	0.685	S	S	*	*			trans	-64.9	132.8	-177.4	-21.5	32.9	0	0	0	113.4	N418	P416-N418 PolarHBondContact O-N 2.95Å
417	R	35	Very low	47.6	Very low	250 Å²	250	130.4 Å²	130.4	94%	0.943	70%	0.702	S	S	*	*			trans	-61.4	131.1	170.6	-80	179	167.6	146.5	-2.9	111	V415	V415-R417 PolarHBondContact O-N 3.43Å
418	N	37.8	Very low	45.9	Very low	164 Å²	164	133 Å²	133	88%	0.877	72%	0.721	S	S	*	*			trans	-109.6	155.1	152.7	-155.2	-14.3	0	0	0	109.7	P416	P416-N418 PolarHBondContact O-N 2.95Å
419	H	36.2	Very low	44.3	Very low	151 Å²	151	134.3 Å²	134.3	70%	0.699	74%	0.736	S	S	*	*			trans	-119.5	153.4	-157.2	177.9	61.9	0	0	0	110.9
420	N	40	Very low	42.9	Very low	117 Å²	117	137.3 Å²	137.3	63%	0.626	76%	0.761	S	S	*	*			trans	70.2	110.2	175.6	-59.4	-33.4	0	0	0	118.2
421	Q	40.2	Very low	41.1	Very low	194 Å²	194	139.4 Å²	139.4	91%	0.907	77%	0.77	S	S	*	*				-169.5	136.6	91.6	-92.4	168.4	37.2	0	0	111.3
422	I	39.8	Very low	40	Very low	147 Å²	147	143.5 Å²	143.5	75%	0.754	79%	0.789	S	S	*	*			trans	-135.8	137.9	176.7	-57.7	167.6	0	0	0	107.3	T424	I422-T424 HydrophobicContact CG2-CG2 3.84Å
423	P	40.1	Very low	38.9	Very low	119 Å²	119	141 Å²	141	77%	0.773	80%	0.796	S	S	*	*				-139.1	133	115.6	26.3	-7.4	0	0	0	111.3
424	T	36.2	Very low	38.2	Very low	110 Å²	110	139.9 Å²	139.9	68%	0.675	80%	0.8	S	S	*	*				47.1	138.6	62.3	63.3	0	0	0	0	113.6	I422	I422-T424 HydrophobicContact CG2-CG2 3.84Å
425	L	40.3	Very low	37.7	Very low	171 Å²	171	144.2 Å²	144.2	90%	0.895	81%	0.812	S	S	*	*			cis	-136.7	174.5	15.2	-78.8	86.8	0	0	0	109.5
426	G	35.9	Very low	37.1	Very low	66 Å²	66	142.4 Å²	142.4	68%	0.68	81%	0.814	S	S	*	*			cis	169.7	151.9	-5.9	0	0	0	0	0	114
427	N	33.7	Very low	37.1	Very low	149 Å²	149	143.6 Å²	143.6	80%	0.797	82%	0.818	S	S	*	*			trans	10.5	134.9	163.4	-62.2	7.1	0	0	0	122.9
428	T	35.8	Very low	37.1	Very low	142 Å²	142	139 Å²	139	87%	0.871	81%	0.813	S	S	*	*				-176.7	135.7	96.1	26	0	0	0	0	112.9
429	P	35.6	Very low	37	Very low	128 Å²	128	137 Å²	137	83%	0.831	81%	0.811	S	S	*	*			trans	-122.4	135.1	171.6	36.9	-24.7	0	0	0	114.1
430	A	35.1	Very low	37	Very low	104 Å²	104	139.7 Å²	139.7	86%	0.86	82%	0.821	S	S	*	*			trans	-158.2	136.3	166	0	0	0	0	0	114.4
431	H	28.2	Very low	36.7	Very low	191 Å²	191	139.1 Å²	139.1	88%	0.884	83%	0.827	S	S	*	*			trans	-45.8	133.4	178.2	-97.4	-109.1	0	0	0	118
432	T	34.6	Very low	36.7	Very low	144 Å²	144	135.3 Å²	135.3	88%	0.883	82%	0.822	S	S	*	*			trans	-153.3	145.3	146.2	49.9	0	0	0	0	108.2
433	G	35	Very low	36.6	Very low	79 Å²	79	137.2 Å²	137.2	81%	0.814	83%	0.827	S	S	*	*			cis	-164.8	146.9	-14	0	0	0	0	0	108.9
434	M	38.9	Very low	36.1	Very low	188 Å²	188	139.6 Å²	139.6	93%	0.926	83%	0.832	S	S	*	*			trans	-133.8	126.8	-176.9	-172.8	176.4	-179	0	0	111.5
435	M	45.8	Very low	36	Very low	189 Å²	189	139 Å²	139	93%	0.931	84%	0.839	S	S	*	*			trans	-112	140.4	165	-57.8	-91.9	-83.6	0	0	105.8
436	G	34.7	Very low	35.6	Very low	65 Å²	65	136.6 Å²	136.6	67%	0.67	83%	0.831	S	S	*	*			cis	148.9	106.5	-0.9	0	0	0	0	0	109.3
437	V	40.9	Very low	35.6	Very low	147 Å²	147	141.6 Å²	141.6	89%	0.891	84%	0.842	S	S	*	*			trans	-158	148	165.6	-95.8	0	0	0	0	110.1
438	N	33.7	Very low	35.5	Very low	155 Å²	155	140.4 Å²	140.4	83%	0.829	84%	0.84	S	S	*	*			trans	-82.4	151.4	-156.9	-60.5	-29.7	0	0	0	115.2
439	S	35.7	Very low	35.5	Very low	120 Å²	120	138.8 Å²	138.8	84%	0.839	84%	0.835	S	S	*	*			trans	-132.7	126.6	159.7	-72.4	0	0	0	0	109.5
440	F	37.7	Very low	35.2	Very low	208 Å²	208	141.5 Å²	141.5	91%	0.912	84%	0.836	S	S	*	*			trans	-75.3	136.1	175.4	-79.5	-94.9	0	0	0	110.2
441	S	32.4	Very low	35	Very low	105 Å²	105	142.1 Å²	142.1	73%	0.734	83%	0.83	S	S	*	*			trans	-117.2	123.6	171.5	-173.1	0	0	0	0	109.6
442	S	40.4	Very low	35.3	Very low	115 Å²	115	137.8 Å²	137.8	80%	0.804	82%	0.821	S	S	*	*			trans	-105.1	107.1	174.6	-56.8	0	0	0	0	108.2	L444	S442-L444 PolarHBondContact O-N 3.11Å
443	Q	37.3	Very low	35.3	Very low	187 Å²	187	140 Å²	140	87%	0.874	82%	0.821	S	S	*	*			trans	-75.6	122.8	179.1	-71.6	-172.5	-16.4	0	0	111.3
444	L	30	Very low	35.2	Very low	168 Å²	168	140.5 Å²	140.5	88%	0.88	82%	0.817	S	S	*	*			trans	-79.4	124.2	159.5	-79.4	157.2	0	0	0	108.7	S442	S442-L444 PolarHBondContact O-N 3.11Å
445	A	34.4	Very low	34.9	Very low	99 Å²	99	138.2 Å²	138.2	82%	0.818	81%	0.809	S	S	*	*			trans	-143	100.4	163.7	0	0	0	0	0	108.8
446	V	31.2	Very low	34.2	Very low	120 Å²	120	135.5 Å²	135.5	73%	0.727	80%	0.798	S	S	*	*			trans	-98.2	129.5	169.4	177.5	0	0	0	0	106.8	V448	V446-V448 HydrophobicContact CG1-CG2 4.13Å
447	N	37.3	Very low	34.2	Very low	170 Å²	170	140.3 Å²	140.3	91%	0.909	80%	0.803	S	S	*	*			trans	-137.1	134.3	165.9	-118.3	-1.6	0	0	0	109.7
448	V	30.1	Very low	33.8	Very low	124 Å²	124	140 Å²	140	75%	0.752	80%	0.802	S	S	*	*			trans	-127	118.1	-171.8	172.9	0	0	0	0	108.9	V446	V446-V448 HydrophobicContact CG1-CG2 4.13Å
449	S	36.2	Very low	33.9	Very low	109 Å²	109	136.2 Å²	136.2	76%	0.762	80%	0.798	S	S	*	*			trans	164.9	148.2	162.1	46.3	0	0	0	0	109
450	E	30.5	Very low	33.6	Very low	184 Å²	184	141.5 Å²	141.5	86%	0.86	80%	0.802	S	S	*	*			cis	-155.2	172.8	-29.1	-145.4	172.3	169.6	0	0	108.3
451	T	30.7	Very low	33.5	Very low	118 Å²	118	137.6 Å²	137.6	72%	0.724	80%	0.8	S	S	*	*			trans	-50.5	145.2	-176.2	45.7	0	0	0	0	117.7
452	S	33.9	Very low	33.6	Very low	99 Å²	99	144.1 Å²	144.1	69%	0.692	81%	0.809	S	S	*	*				168.9	134	108.3	-75.3	0	0	0	0	114.8
453	Q	33.9	Very low	33.3	Very low	192 Å²	192	146.2 Å²	146.2	90%	0.897	81%	0.811	S	S	*	*			trans	51	143	141.9	-61	178.8	17.2	0	0	120.7
454	A	33.5	Very low	33.1	Very low	88 Å²	88	142.8 Å²	142.8	73%	0.727	80%	0.803	S	S	*	*			cis	-165.6	166.8	-10.6	0	0	0	0	0	110.4
455	N	32.6	Very low	33.6	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	80%	0.802	S	S	*	*			trans	67.9	109.6	150.6	-106	40.1	0	0	0	122.9
456	D	31.8	Very low	33.7	Very low	131 Å²	131	141.3 Å²	141.3	70%	0.701	80%	0.801	S	S	*	*				96.5	146.7	115.2	-108.8	-33	0	0	0	123.5
457	Q	34.7	Very low	34.1	Very low	166 Å²	166	141.7 Å²	141.7	78%	0.776	80%	0.803	S	S	*	*			trans	75	91.5	163.9	-64.1	-177.8	18.3	0	0	121.5
458	V	32.7	Very low	34.1	Very low	142 Å²	142	139 Å²	139	86%	0.861	80%	0.797	S	S	*	*				38.4	113.5	113.5	-175.9	0	0	0	0	118.1
459	G	34.7	Very low	34.8	Very low	74 Å²	74	138.8 Å²	138.8	76%	0.763	80%	0.799	S	S	*	*			trans	-171.6	99.2	164.3	0	0	0	0	0	113.9
460	Y	29.3	Very low	35	Very low	231 Å²	231	145.8 Å²	145.8	91%	0.906	81%	0.808	S	S	*	*			trans	-73.4	137.4	170.2	-74.6	-90.7	0	0	0	110.6
461	S	36.4	Very low	35.5	Very low	126 Å²	126	140.8 Å²	140.8	88%	0.881	81%	0.806	S	S	*	*			trans	-150.8	121.2	158.4	-83	0	0	0	0	111.6
462	R	33.7	Very low	35.7	Very low	242 Å²	242	146.4 Å²	146.4	91%	0.913	82%	0.816	S	S	*	*			trans	-80.5	149.7	164.6	-67.8	177.8	176.2	174.6	-1.2	108
463	N	34.8	Very low	35.9	Very low	159 Å²	159	148.5 Å²	148.5	85%	0.85	82%	0.824	S	S	*	*			trans	-129.9	145.8	154.6	-152.7	-4.5	0	0	0	110.1
464	T	31.9	Very low	36	Very low	115 Å²	115	144.5 Å²	144.5	71%	0.706	82%	0.815	S	S	*	*			trans	-132.8	136.2	-168.4	52.4	0	0	0	0	110.2
465	S	41.6	Very low	36.1	Very low	124 Å²	124	145.5 Å²	145.5	87%	0.867	82%	0.816	S	S	*	*			trans	-132.3	111.6	167.4	-56.1	0	0	0	0	109.5
466	S	36.9	Very low	36.4	Very low	113 Å²	113	144.7 Å²	144.7	79%	0.79	82%	0.822	S	S	*	*			trans	-70.8	167.1	166.2	48.5	0	0	0	0	109.8
467	V	39.6	Very low	36.6	Very low	128 Å²	128	145 Å²	145	78%	0.776	83%	0.828	S	S	*	*				-160.7	153.2	69.4	166	0	0	0	0	110.7
468	S	37.7	Very low	36.8	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	83%	0.826	S	S	*	*			trans	-135.4	164.1	165.5	-47.8	0	0	0	0	109.8
469	P	43.7	Very low	37	Very low	121 Å²	121	143.9 Å²	143.9	79%	0.786	82%	0.824	S	S	*	*			trans	-143.4	124.7	139.4	29	-9.8	0	0	0	116.8
470	R	39.7	Very low	37.1	Very low	255 Å²	255	149.1 Å²	149.1	96%	0.962	83%	0.828	S	S	*	*			trans	17.1	142.3	140.3	-69.7	175.8	166	161	-5	122.6
471	G	42.1	Very low	37.3	Very low	79 Å²	79	143 Å²	143	81%	0.814	82%	0.82	S	S	*	*			trans	-170.9	113.7	147.3	0	0	0	0	0	113.7
472	Y	34.1	Very low	37.5	Very low	237 Å²	237	144.8 Å²	144.8	93%	0.929	82%	0.819	S	S	*	*			trans	-133.3	133.3	178.4	-105.9	-86.3	0	0	0	109.1
473	V	38.1	Very low	37.2	Very low	143 Å²	143	143.3 Å²	143.3	87%	0.867	82%	0.815	S	S	*	*			trans	-150.5	146.3	160.7	-175	0	0	0	0	109.9
474	P	36.8	Very low	37.3	Very low	108 Å²	108	143.3 Å²	143.3	70%	0.701	82%	0.815	S	S	*	*			trans	-122.7	176.8	-164.1	43	-31	0	0	0	118
475	S	36	Very low	37.3	Very low	108 Å²	108	144 Å²	144	76%	0.755	82%	0.819	S	S	*	*			trans	70.9	122.2	148.2	64.2	0	0	0	0	122.8
476	S	38	Very low	37.2	Very low	124 Å²	124	144.7 Å²	144.7	87%	0.867	82%	0.818	S	S	*	*				-172.8	145.7	114.6	32.7	0	0	0	0	112
477	T	36.5	Very low	37.1	Very low	137 Å²	137	144.2 Å²	144.2	84%	0.84	81%	0.814	S	S	*	*			trans	-110	160.7	175.5	47.4	0	0	0	0	108.8
478	P	38.8	Very low	36.8	Very low	112 Å²	112	144.4 Å²	144.4	73%	0.727	82%	0.816	S	S	*	*				-150.7	161.8	76.5	37.6	-16.5	0	0	0	118.1
479	Q	36.1	Very low	36.8	Very low	173 Å²	173	144.2 Å²	144.2	81%	0.808	81%	0.814	S	S	*	*			trans	26.4	128.5	142.6	-55.8	178	-9.9	0	0	120.7
480	Q	37.1	Very low	36.5	Very low	185 Å²	185	146.7 Å²	146.7	86%	0.864	82%	0.818	S	S	*	*				-171.5	156.6	92.3	-100.1	-174.8	3.8	0	0	113.7
481	S	34.5	Very low	36.5	Very low	103 Å²	103	142 Å²	142	72%	0.72	81%	0.812	S	S	*	*			trans	-81.8	147.5	-179.5	-38	0	0	0	0	112
482	N	39	Very low	36.1	Very low	162 Å²	162	141.4 Å²	141.4	87%	0.866	81%	0.805	S	S	*	*				-171.1	149.9	123.7	-103.8	-16	0	0	0	115.1
483	Y	28.9	Very low	36.4	Very low	212 Å²	212	141.8 Å²	141.8	83%	0.831	81%	0.807	S	S	*	*			trans	-69.4	147	161.5	-76.5	-110.9	0	0	0	109.9
484	N	36.4	Very low	36.5	Very low	158 Å²	158	138.6 Å²	138.6	85%	0.845	80%	0.803	S	S	*	*				-176.3	147.3	116.1	-94.8	-26.1	0	0	0	114.6
485	T	32.6	Very low	36.4	Very low	129 Å²	129	139.5 Å²	139.5	79%	0.791	81%	0.812	S	S	*	*			trans	-65.4	138.9	169.8	-44.7	0	0	0	0	111.5
486	V	37.9	Very low	36.8	Very low	140 Å²	140	138 Å²	138	85%	0.848	81%	0.814	S	S	*	*			trans	-136.6	133.3	160.2	-177	0	0	0	0	110.9
487	S	35.2	Very low	36.9	Very low	102 Å²	102	136.8 Å²	136.8	71%	0.713	81%	0.811	S	S	*	*			trans	-84.6	166	-178.6	-45.8	0	0	0	0	112.5
488	T	34	Very low	37.2	Very low	132 Å²	132	139.7 Å²	139.7	81%	0.81	82%	0.818	S	S	*	*			trans	-57.2	134.2	171	47.8	0	0	0	0	113.9
489	S	37.5	Very low	37.3	Very low	108 Å²	108	138.9 Å²	138.9	76%	0.755	82%	0.82	S	S	*	*				169.9	155.4	113.8	50.4	0	0	0	0	115.3
490	M	37.5	Very low	37.4	Very low	174 Å²	174	138 Å²	138	86%	0.857	82%	0.821	S	S	*	*			trans	78.4	141.6	154.1	-79.8	178.6	164.7	0	0	123.2
491	N	40.5	Very low	37.6	Very low	157 Å²	157	137.7 Å²	137.7	84%	0.84	83%	0.825	S	S	*	*			trans	87.9	121.5	172.3	-57.2	-13.8	0	0	0	116.5
492	G	32.2	Very low	37.8	Very low	65 Å²	65	136.3 Å²	136.3	67%	0.67	83%	0.827	S	S	*	*			cis	116	95.7	-1.6	0	0	0	0	0	112.8
493	Y	40.1	Very low	38	Very low	245 Å²	245	135.5 Å²	135.5	96%	0.961	83%	0.827	S	S	*	*			trans	-156.2	146.8	173.5	-94.3	-76.6	0	0	0	111.7
494	G	40.7	Very low	38.6	Very low	77 Å²	77	131.4 Å²	131.4	79%	0.794	83%	0.827	S	S	*	*			trans	98.6	87.7	152.7	0	0	0	0	0	117.3
495	S	34.8	Very low	38.8	Very low	126 Å²	126	127.2 Å²	127.2	88%	0.881	82%	0.821	S	S	*	*			trans	-83.1	144.6	166.9	179.3	0	0	0	0	111.6
496	G	44.9	Very low	39.3	Very low	78 Å²	78	127.1 Å²	127.1	80%	0.804	83%	0.825	S	S	*	*			trans	-153.6	109.6	169.4	0	0	0	0	0	110.2
497	A	39.2	Very low	39.5	Very low	97 Å²	97	126 Å²	126	80%	0.802	82%	0.821	S	S	*	*			trans	-99.5	137.2	-173.1	0	0	0	0	0	112.6
498	M	44.1	Very low	39.4	Very low	199 Å²	199	124.7 Å²	124.7	98%	0.98	82%	0.823	S	S	*	*			trans	-136.6	148.7	149.9	-84.6	-158.6	-177.7	0	0	108.9
499	A	40.5	Very low	40.1	Very low	95 Å²	95	128.2 Å²	128.2	79%	0.785	83%	0.828	S	S	*	*			trans	-121.1	162.2	-168	0	0	0	0	0	113
500	N	37.4	Very low	40	Very low	155 Å²	155	131.2 Å²	131.2	83%	0.829	84%	0.835	S	S	*	*			trans	86.4	149.4	149.6	-111.1	3.6	0	0	0	121
501	L	41.7	Very low	39.9	Very low	178 Å²	178	130.7 Å²	130.7	93%	0.932	84%	0.835	S	S	*	*			trans	71.6	128.8	-177.1	-46.4	168	0	0	0	113.3
502	G	39.5	Very low	39.7	Very low	74 Å²	74	126.7 Å²	126.7	76%	0.763	83%	0.831	S	S	*	*			cis	151.8	149	2.2	0	0	0	0	0	107.5
503	V	43.1	Very low	39.9	Very low	144 Å²	144	128.7 Å²	128.7	87%	0.873	84%	0.835	S	S	*	*			cis	-151.5	150	3.4	173	0	0	0	0	106.9
504	P	40.5	Very low	39.9	Very low	127 Å²	127	122.9 Å²	122.9	83%	0.825	83%	0.83	S	S	*	*			trans	-95.5	166.2	-165.3	37.8	-36.2	0	0	0	115.6
505	G	42	Very low	39.9	Very low	70 Å²	70	123 Å²	123	72%	0.722	82%	0.824	S	S	*	*			trans	-174.8	108.3	170.4	0	0	0	0	0	117.9
506	S	41.2	Very low	40.2	Very low	127 Å²	127	124.4 Å²	124.4	89%	0.888	82%	0.821	S	S	*	*			trans	110.2	137.8	143.5	-55.4	0	0	0	0	119.8
507	P	42.1	Very low	40	Very low	117 Å²	117	125.6 Å²	125.6	76%	0.76	82%	0.817	S	S	*	*			trans	-119.6	-177	-161.9	33.6	-12	0	0	0	114.4
508	G	34.2	Very low	40.2	Very low	74 Å²	74	126.1 Å²	126.1	76%	0.763	81%	0.812	S	S	*	*			trans	-80.2	167.3	-179.6	0	0	0	0	0	115.4
509	F	48.8	Very low	40.1	Very low	205 Å²	205	127.8 Å²	127.8	90%	0.899	81%	0.81	S	S	*	*			trans	-113.8	141.9	179	-73.2	-84.1	0	0	0	112.6
510	L	35.5	Very low	40.1	Very low	172 Å²	172	126.4 Å²	126.4	90%	0.901	81%	0.805	S	S	*	*			trans	-129.9	152	167.4	-85.8	171.2	0	0	0	109.3
511	N	35.6	Very low	40.2	Very low	162 Å²	162	126.6 Å²	126.6	87%	0.866	80%	0.804	S	S	*	*			trans	79.2	143.9	154.9	-152	20.1	0	0	0	119.2
512	G	35.7	Very low	40.3	Very low	73 Å²	73	124.7 Å²	124.7	75%	0.753	80%	0.799	S	S	*	*			trans	143.8	110.2	176.3	0	0	0	0	0	113.3
513	S	37.1	Very low	40.7	Very low	107 Å²	107	126.7 Å²	126.7	75%	0.748	80%	0.799	S	S	*	*			trans	-106.5	179.3	-165.4	-49.2	0	0	0	0	115.7
514	S	38.9	Very low	40.7	Very low	124 Å²	124	125.8 Å²	125.8	87%	0.867	80%	0.799	S	S	*	*			trans	85.6	142.6	171.8	80.3	0	0	0	0	116.2
515	A	41.1	Very low	40.6	Very low	80 Å²	80	125.2 Å²	125.2	66%	0.661	80%	0.798	S	S	*	*			cis	-150.2	166.2	11.5	0	0	0	0	0	114.4
516	N	40.4	Very low	40.8	Very low	154 Å²	154	127.2 Å²	127.2	82%	0.824	80%	0.798	S	S	*	*			trans	64.5	145.3	162	-60.7	-3.3	0	0	0	120
517	S	41	Very low	40.6	Very low	103 Å²	103	126.9 Å²	126.9	72%	0.72	79%	0.791	S	S	*	*			cis	-169.3	160	-30.2	46.4	0	0	0	0	108.5
518	P	43.1	Very low	40.4	Very low	108 Å²	108	130 Å²	130	70%	0.701	80%	0.797	S	S	*	*			trans	-111.4	-152.4	-147.2	43.9	-38	0	0	0	116.7
519	Y	43.6	Very low	40.5	Very low	235 Å²	235	131.5 Å²	131.5	92%	0.922	80%	0.803	S	S	*	*			trans	89.2	133.9	-176.7	-55.5	-75.3	0	0	0	115.9
520	G	39.4	Very low	39.8	Very low	66 Å²	66	126.5 Å²	126.5	68%	0.68	80%	0.799	S	S	*	*			cis	162.2	114.6	-12.3	0	0	0	0	0	116.2
521	I	40.3	Very low	39.9	Very low	158 Å²	158	124.6 Å²	124.6	81%	0.81	80%	0.8	S	S	*	*			trans	74.6	122.9	141.7	-40.9	-176.6	0	0	0	121.1
522	V	44.1	Very low	40	Very low	138 Å²	138	122 Å²	122	84%	0.836	80%	0.795	S	S	*	*			trans	68.1	152.1	151.5	-63.9	0	0	0	0	125.4
523	P	46.9	Very low	40.4	Very low	116 Å²	116	125.5 Å²	125.5	75%	0.753	80%	0.802	S	S	*	*			trans	-118	171.3	-166.5	43.2	-30.6	0	0	0	116.1
524	S	43.4	Very low	40.4	Very low	125 Å²	125	125.9 Å²	125.9	87%	0.874	80%	0.799	S	S	*	*			trans	-161.2	144	161.4	-74.1	0	0	0	0	112.3
525	S	38.2	Very low	40.4	Very low	115 Å²	115	127.7 Å²	127.7	80%	0.804	80%	0.799	S	S	*	*			trans	-94.5	-177.6	169.6	-41	0	0	0	0	110.1
526	P	47.2	Very low	40.4	Very low	112 Å²	112	129 Å²	129	73%	0.727	80%	0.8	S	S	*	*			cis	-141.3	-162.6	-1.3	38.6	-15.8	0	0	0	115.7
527	T	37.3	Very low	40.3	Very low	120 Å²	120	127.1 Å²	127.1	74%	0.736	80%	0.799	S	S	*	*			trans	80.9	108.4	150.2	34.5	0	0	0	0	123.8
528	M	37.3	Very low	39.9	Very low	182 Å²	182	128.9 Å²	128.9	90%	0.897	80%	0.801	S	S	*	*				46.7	110.1	124.8	-59.2	-70.5	-87.3	0	0	121.3
529	A	36.3	Very low	39.3	Very low	107 Å²	107	129.4 Å²	129.4	88%	0.884	81%	0.805	S	S	*	*			trans	-153.8	146.4	141.8	0	0	0	0	0	110.5
530	A	33.5	Very low	38.9	Very low	99 Å²	99	122.7 Å²	122.7	82%	0.818	79%	0.793	S	S	*	*			trans	-92.4	155.4	-178.1	0	0	0	0	0	112.7
531	S	38.7	Very low	38.5	Very low	132 Å²	132	124.6 Å²	124.6	92%	0.923	80%	0.796	S	S	*	*			trans	-154	129.7	155.4	-89.6	0	0	0	0	110.2
532	S	37.2	Very low	38.3	Very low	107 Å²	107	124.2 Å²	124.2	75%	0.748	80%	0.801	S	S	*	*			trans	-91.3	147	-177.2	50.9	0	0	0	0	112.6
533	V	44.6	Very low	37.7	Very low	148 Å²	148	126.4 Å²	126.4	90%	0.897	80%	0.801	S	S	*	*			trans	-134.8	129	153.3	-169.6	0	0	0	0	109
534	T	36.5	Very low	37.3	Very low	114 Å²	114	124 Å²	124	70%	0.699	80%	0.798	S	S	*	*			trans	-115.6	154.4	178.1	43.5	0	0	0	0	110
535	L	39.6	Very low	36.7	Very low	163 Å²	163	124.6 Å²	124.6	85%	0.853	79%	0.79	S	S	*	*			trans	170.7	161.2	133.1	-105.3	79	0	0	0	109.9
536	P	40.2	Very low	36.5	Very low	107 Å²	107	128.5 Å²	128.5	70%	0.695	79%	0.793	S	S	*	*			trans	-137.6	-149.6	-142.1	42.3	-20.9	0	0	0	114.5
537	S	37.6	Very low	35.8	Very low	114 Å²	114	127.8 Å²	127.8	80%	0.797	79%	0.791	S	S	*	*			trans	73.2	151.5	162.3	46.7	0	0	0	0	119.2
538	N	33.3	Very low	35.4	Very low	141 Å²	141	131.8 Å²	131.8	75%	0.754	80%	0.798	S	S	*	*			cis	-174.5	128.4	-20.9	174.1	49.4	0	0	0	110.6
539	C	31.3	Very low	35.3	Very low	119 Å²	119	128.9 Å²	128.9	80%	0.804	80%	0.795	S	S	*	*			trans	165.6	123.2	152.8	57.1	0	0	0	0	109.1
540	S	34.3	Very low	35.2	Very low	94 Å²	94	130 Å²	130	66%	0.657	79%	0.794	S	S	*	*			cis	92.3	85.1	44.2	-61.4	0	0	0	0	114.9
541	S	31.2	Very low	35.3	Very low	106 Å²	106	129.5 Å²	129.5	74%	0.741	79%	0.79	S	S	*	*			trans	50.6	125	142	61.6	0	0	0	0	122.3
542	T	35.2	Very low	35.3	Very low	150 Å²	150	130.8 Å²	130.8	92%	0.92	79%	0.786	S	S	*	*			trans	-159.5	151.4	130.8	1.7	0	0	0	0	112.1
543	H	32.9	Very low	35.1	Very low	183 Å²	183	132.8 Å²	132.8	85%	0.847	79%	0.794	S	S	*	*			trans	-94.9	152.6	-176.1	-76.5	-102.5	0	0	0	113.4
544	G	37.8	Very low	34.8	Very low	66 Å²	66	133 Å²	133	68%	0.68	79%	0.788	S	S	*	*			trans	-178.3	110.8	160.4	0	0	0	0	0	107.5
545	I	31.2	Very low	34.6	Very low	137 Å²	137	133.6 Å²	133.6	70%	0.703	80%	0.797	S	S	*	*			cis	55	91	49.2	-39.1	174.3	0	0	0	111.9
546	F	33.2	Very low	34.5	Very low	198 Å²	198	130.4 Å²	130.4	87%	0.868	79%	0.794	S	S	*	*			trans	-163.9	107.6	143	-76.6	-53.6	0	0	0	107
547	S	33.8	Very low	34.3	Very low	97 Å²	97	132.2 Å²	132.2	68%	0.678	80%	0.803	S	S	*	*				89.8	101.1	89.3	-72.5	0	0	0	0	113.2
548	F	28.8	Very low	34.2	Very low	204 Å²	204	135.2 Å²	135.2	90%	0.895	80%	0.802	S	S	*	*			trans	-88.4	134.5	171.3	6.5	-97.6	0	0	0	109.3
549	S	34.7	Very low	34.6	Very low	120 Å²	120	137.5 Å²	137.5	84%	0.839	81%	0.808	S	S	*	*			trans	-138.6	137.4	166.3	-76.8	0	0	0	0	110.3
550	P	34.4	Very low	35	Very low	131 Å²	131	140.7 Å²	140.7	85%	0.851	81%	0.808	S	S	*	*			trans	-106	122.9	-167.3	36.5	-29	0	0	0	113.6
551	A	35.4	Very low	35.4	Very low	89 Å²	89	141.7 Å²	141.7	74%	0.736	82%	0.815	S	S	*	*			trans	-159.3	98.3	162.3	0	0	0	0	0	111.9
552	N	39.1	Very low	35.8	Very low	158 Å²	158	140.6 Å²	140.6	85%	0.845	81%	0.812	S	S	*	*				175.7	114.7	127.5	-91.6	-10.2	0	0	0	111.1	I554	N552-I554 PolarHBondContact O-N 3.49Å
553	V	32.6	Very low	36.1	Very low	150 Å²	150	142.4 Å²	142.4	91%	0.909	81%	0.808	S	S	*	*			trans	-82.9	106.8	173.1	-85.4	0	0	0	0	110
554	I	38.6	Very low	36.5	Very low	153 Å²	153	138 Å²	138	79%	0.785	80%	0.802	S	S	*	*			trans	-128.7	120.7	163.1	-59	-177.8	0	0	0	108.9	N552 A556	N552-I554 PolarHBondContact O-N 3.49Å; I554-A556 PolarHBondContact O-N 3.39Å
555	S	32	Very low	36.8	Very low	126 Å²	126	140.5 Å²	140.5	88%	0.881	81%	0.807	S	S	*	*			trans	-67.5	108.1	-172.1	-57.1	0	0	0	0	112.8
556	A	36.8	Very low	37.4	Very low	95 Å²	95	140.3 Å²	140.3	79%	0.785	81%	0.812	S	S	*	*			trans	-100.7	126	172.4	0	0	0	0	0	111.8	I554 K558	I554-A556 PolarHBondContact O-N 3.39Å; A556-K558 PolarHBondContact O-N 2.85Å
557	V	37.1	Very low	37.8	Very low	145 Å²	145	137 Å²	137	88%	0.879	81%	0.808	S	S	*	*			trans	-66.7	130.8	-176.3	177.9	0	0	0	0	111.7	Q559	V557-Q559 PolarHBondContact O-N 2.73Å; V557-Q559 VanDerWaalsContact O-N 3.14Å
558	K	35.3	Very low	38.4	Very low	178 Å²	178	142.9 Å²	142.9	77%	0.774	82%	0.815	S	S	*	*			trans	-80.3	86.3	-165.2	-171.7	175.4	-173.8	169.2	0	113.8	A556 K560	A556-K558 PolarHBondContact O-N 2.85Å; K558-K560 PolarHBondContact O-N 3.11Å
559	Q	41.5	Very low	39.1	Very low	189 Å²	189	139 Å²	139	88%	0.883	81%	0.811	S	S	*	*			trans	-80.8	108.6	161.8	-76.7	-164.8	-26.1	0	0	110.8	V557 S561	V557-Q559 PolarHBondContact O-N 2.73Å; V557-Q559 VanDerWaalsContact O-N 3.14Å; Q559-S561 PolarHBondContact O-N 3.36Å
560	K	40.3	Very low	39.2	Very low	186 Å²	186	142.6 Å²	142.6	81%	0.809	81%	0.814	S	S	*	*			trans	-68.4	111.7	178.4	-73.2	176.1	175.4	174.6	0	111.2	K558	K558-K560 PolarHBondContact O-N 3.11Å
561	S	42.3	Very low	39.5	Very low	115 Å²	115	141.1 Å²	141.1	80%	0.804	81%	0.813	S	S	*	*			trans	-93.7	112.8	161.7	179.7	0	0	0	0	109.3	Q559	Q559-S561 PolarHBondContact O-N 3.36Å
562	A	39.1	Very low	39.9	Very low	83 Å²	83	142.1 Å²	142.1	69%	0.686	81%	0.814	S	S	*	*			trans	-103.3	59	-170.7	0	0	0	0	0	113.4
563	F	41.7	Very low	40.3	Very low	188 Å²	188	140.1 Å²	140.1	83%	0.825	81%	0.81	S	S	*	*			trans	-149.1	99.9	164	-86.9	-76.4	0	0	0	109.6
564	A	40.9	Very low	41.2	Very low	89 Å²	89	138.6 Å²	138.6	74%	0.736	80%	0.803	S	S	*	*			trans	-116.4	137	165.8	0	0	0	0	0	108
565	P	44.6	Very low	41.8	Very low	119 Å²	119	137.2 Å²	137.2	77%	0.773	80%	0.804	S	S	*	*			trans	-69.5	134.8	-179.5	28.6	-33.6	0	0	0	110.6	V567	P565-V567 PolarHBondContact O-N 3.47Å; P565-V567 VanDerWaalsContact O-N 3.13Å
566	V	42.8	Very low	42	Very low	133 Å²	133	136.9 Å²	136.9	81%	0.806	80%	0.802	S	S	*	*			trans	-73.4	104	174.8	177.4	0	0	0	0	109	R568	V566-R568 PolarHBondContact O-N 3.46Å
567	V	43.2	Very low	42	Very low	129 Å²	129	138.4 Å²	138.4	78%	0.782	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-76	116.2	165.3	-178.9	0	0	0	0	107.6	P565	P565-V567 PolarHBondContact O-N 3.47Å; P565-V567 VanDerWaalsContact O-N 3.13Å
568	R	44.8	Very low	42	Very low	220 Å²	220	137.9 Å²	137.9	83%	0.83	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-75	136.5	171	-72.1	-174.3	-179.5	-178.3	0.5	109.4	V566	V566-R568 PolarHBondContact O-N 3.46Å
569	P	43.3	Very low	42.2	Very low	124 Å²	124	135 Å²	135	81%	0.805	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-60.4	147.2	169.4	-20.9	33	0	0	0	111.4
570	Q	37.9	Very low	42	Very low	194 Å²	194	130.1 Å²	130.1	91%	0.907	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-63.4	142.9	170.6	-74.6	175.6	-80.9	0	0	110.6
571	A	41.5	Very low	41.9	Very low	100 Å²	100	129.4 Å²	129.4	83%	0.826	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-66.9	136	169.2	0	0	0	0	0	110.2
572	S	42.9	Very low	41.7	Very low	110 Å²	110	127.3 Å²	127.3	77%	0.769	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-66.5	151	171.6	33.8	0	0	0	0	111.6
573	P	48.3	Very low	41.9	Very low	116 Å²	116	131.4 Å²	131.4	75%	0.753	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-71.7	150.9	177.4	31.3	-35.1	0	0	0	111.2
574	P	50.7	Low	41.4	Very low	118 Å²	118	126.1 Å²	126.1	77%	0.766	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-74	139	174.8	31.2	-33.6	0	0	0	110.7
575	P	50.6	Low	41.3	Very low	124 Å²	124	129 Å²	129	81%	0.805	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-73.6	132.2	171.5	30.2	-32.5	0	0	0	110.5
576	S	36.2	Very low	41.2	Very low	120 Å²	120	132 Å²	132	84%	0.839	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-73.8	125	173.5	51.7	0	0	0	0	111.5
577	C	36.3	Very low	41.1	Very low	127 Å²	127	130.6 Å²	130.6	86%	0.858	82%	0.815	S	S	*	*			trans	-121	112.6	165.3	51.7	0	0	0	0	111
578	T	37.3	Very low	41	Very low	134 Å²	134	132.8 Å²	132.8	82%	0.822	82%	0.819	S	S	*	*			trans	-85.4	122.7	171.3	42.3	0	0	0	0	110.8
579	S	39.6	Very low	40.9	Very low	117 Å²	117	127.8 Å²	127.8	82%	0.818	82%	0.818	S	S	*	*			trans	-179.1	124.8	132.7	-85.6	0	0	0	0	114.4
580	A	37.6	Very low	40.8	Very low	86 Å²	86	125 Å²	125	71%	0.711	81%	0.812	S	S	*	*			trans	55.6	130	136.4	0	0	0	0	0	123.1
581	N	38.4	Very low	41	Very low	171 Å²	171	123.8 Å²	123.8	91%	0.914	81%	0.811	S	S	*	*			trans	76.3	123.4	147	-67.5	-6.7	0	0	0	121.3
582	G	39.3	Very low	41.1	Very low	71 Å²	71	125 Å²	125	73%	0.732	81%	0.808	S	S	*	*				135.4	79.6	124.9	0	0	0	0	0	117.8
583	N	42.3	Very low	41.5	Very low	170 Å²	170	126 Å²	126	91%	0.909	81%	0.809	S	S	*	*			trans	46.7	113	151.8	-63.7	-6.8	0	0	0	120.2
584	G	32	Very low	41.6	Very low	76 Å²	76	125.5 Å²	125.5	78%	0.784	81%	0.806	S	S	*	*			trans	-109.8	140.2	150.3	0	0	0	0	0	110.7
585	L	38.7	Very low	41.9	Very low	150 Å²	150	125.9 Å²	125.9	79%	0.785	81%	0.808	S	S	*	*			trans	-155	126.4	169.4	-106.8	166.7	0	0	0	110.3
586	Q	42.3	Very low	41.7	Very low	181 Å²	181	132.5 Å²	132.5	85%	0.846	83%	0.832	S	S	*	*			trans	68	147.7	162.7	-59.4	166.7	-5.5	0	0	116.1
587	A	39.9	Very low	41.9	Very low	104 Å²	104	133.1 Å²	133.1	86%	0.86	83%	0.831	S	S	*	*			cis	-138.9	-179.4	14.3	0	0	0	0	0	114.4
588	M	41	Very low	42.2	Very low	175 Å²	175	133.4 Å²	133.4	86%	0.862	83%	0.83	S	S	*	*			trans	-103.5	168.2	-154.9	-152.3	172.5	179.6	0	0	113.7
589	S	43.1	Very low	42.5	Very low	115 Å²	115	133.4 Å²	133.4	80%	0.804	83%	0.83	S	S	*	*			trans	79	136.4	155.1	-54.4	0	0	0	0	119.5
590	G	40.8	Very low	42.7	Very low	67 Å²	67	134.4 Å²	134.4	69%	0.691	83%	0.831	S	S	*	*			cis	175.4	-174.2	-4.2	0	0	0	0	0	114.7
591	L	41.9	Very low	43	Very low	168 Å²	168	137.4 Å²	137.4	88%	0.88	84%	0.838	S	S	*	*			trans	69.6	109.3	171.9	-59.9	158.4	0	0	0	115.5
592	V	44.7	Very low	43.3	Very low	125 Å²	125	135.1 Å²	135.1	76%	0.758	83%	0.833	S	S	*	*				67.1	118.9	50.6	-167.8	0	0	0	0	110.2
593	V	50.2	Low	43.6	Very low	130 Å²	130	139.7 Å²	139.7	79%	0.788	84%	0.841	S	S	*	*				-150.9	144.9	63.7	175	0	0	0	0	112.3
594	P	50.9	Low	43.7	Very low	107 Å²	107	137.4 Å²	137.4	70%	0.695	84%	0.835	S	S	*	*			trans	-95.8	173.8	172.6	39.4	-35.2	0	0	0	114.1
595	P	56	Low	44.6	Very low	125 Å²	125	142.5 Å²	142.5	81%	0.812	84%	0.84	S	S	*	*			trans	-95.7	174.7	-153.8	39.3	-38.7	0	0	0	116.4
596	M	46.4	Very low	45.2	Very low	263 Å²	263	141.8 Å²	141.8	100%	1.296	84%	0.844	S	S	*	*			trans	-97.1	0	147.8	-77.5	-166.5	167.4	0	0	110.1

Retrieved 596 of 596 residues in 130 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).