A0A087XED7_POEFO Loading...

Prickle planar cell polarity protein 3

AlphaFold DB , UniProt , Accession A0A087XED7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 558 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.1	Very low	34.1	Very low	248 Å²	248	187.1 Å²	187.1	100%	1.222	90%	0.9	S	S	*	*				0	133.2	0	-71.3	173.2	172.8	0	0	108.2
2	F	34.4	Very low	34	Very low	206 Å²	206	185 Å²	185	90%	0.904	90%	0.897	S	S	*	*			trans	-98.4	129.7	-180	-67.6	-94.9	0	0	0	110.5
3	L	33.1	Very low	33.8	Very low	154 Å²	154	187.5 Å²	187.5	81%	0.806	89%	0.891	S	S	*	*			trans	-143.6	110.5	155.5	-76.8	-178	0	0	0	112.7
4	R	33.7	Very low	33.8	Very low	232 Å²	232	180.4 Å²	180.4	88%	0.875	87%	0.871	S	S	*	*				69.2	85.5	128.3	-65.4	-175.1	175.9	-154.1	-0.9	120.3
5	G	31.1	Very low	33.7	Very low	77 Å²	77	180.6 Å²	180.6	79%	0.794	87%	0.871	S	S	*	*			trans	-93.5	131.3	147.5	0	0	0	0	0	111.4	K7	G5-K7 PolarHBondContact O-N 3.24Å
6	S	35.2	Very low	34.2	Very low	124 Å²	124	179 Å²	179	87%	0.867	86%	0.862	S	S	*	*			trans	-69.9	125	-174.5	-61.5	0	0	0	0	113.4	K8	S6-K8 PolarHBondContact O-N 3.02Å
7	K	36	Very low	35.3	Very low	215 Å²	215	179.4 Å²	179.4	94%	0.935	86%	0.862	S	S	*	*			trans	-68.1	97.6	174.1	-76.3	-179.9	175.7	176.1	0	111.2	G5 R9	G5-K7 PolarHBondContact O-N 3.24Å; K7-R9 PolarHBondContact O-N 3.02Å
8	K	37	Very low	36.8	Very low	203 Å²	203	177.4 Å²	177.4	88%	0.883	85%	0.851	S	S	*	*			trans	-71.6	107.2	166	-149	171.5	-171.2	177.1	0	108.1	S6 R10	S6-K8 PolarHBondContact O-N 3.02Å; K8-R10 PolarHBondContact O-N 3.11Å; K8-R10 VanDerWaalsContact O-N 3.08Å
9	R	32.2	Very low	38.5	Very low	244 Å²	244	169.8 Å²	169.8	92%	0.921	82%	0.816	S	S	*	*			trans	-54.8	114.3	172.9	-90.7	179.2	164.3	174	-5.9	108.3	K7 S11	K7-R9 PolarHBondContact O-N 3.02Å; R9-S11 PolarHBondContact O-N 3.4Å; R9-S11 VanDerWaalsContact O-N 3.17Å
10	R	33	Very low	40.1	Very low	245 Å²	245	166.5 Å²	166.5	93%	0.925	81%	0.809	S	S	*	*			trans	-67.7	109.8	162.4	-83.4	-176.9	169.1	174.3	-4.2	106.8	K8 N12	K8-R10 PolarHBondContact O-N 3.11Å; K8-R10 VanDerWaalsContact O-N 3.08Å; R10-N12 PolarHBondContact O-N 3.22Å
11	S	32.5	Very low	41.7	Very low	110 Å²	110	159 Å²	159	77%	0.769	77%	0.772	S	S	*	*			trans	-62.5	126.6	165.8	-175.3	0	0	0	0	107.7	R9 R13	R9-S11 PolarHBondContact O-N 3.4Å; R9-S11 VanDerWaalsContact O-N 3.17Å; S11-R13 PolarHBondContact O-N 3.47Å
12	N	32.7	Very low	43.9	Very low	162 Å²	162	152.9 Å²	152.9	87%	0.866	74%	0.736	S	S	*	*			trans	-79.7	73.5	177.7	-156	45.1	0	0	0	108.1	R10 S14	R10-N12 PolarHBondContact O-N 3.22Å; N12-S14 PolarHBondContact O-N 3.31Å
13	R	32.2	Very low	46.3	Very low	217 Å²	217	145.2 Å²	145.2	82%	0.819	72%	0.715	S	S	*	*			trans	-67.4	102.1	175.4	-178	176.2	176.2	-163.2	-3.4	107.3	S11 Q15	S11-R13 PolarHBondContact O-N 3.47Å; R13-Q15 PolarHBondContact O-N 2.87Å
14	S	33.4	Very low	48.9	Very low	88 Å²	88	140 Å²	140	62%	0.615	69%	0.686	S	S	*	*			trans	-48.2	127.2	163.8	40.8	0	0	0	0	108.4	N12 E16	N12-S14 PolarHBondContact O-N 3.31Å; S14-E16 VanDerWaalsContact C-N 3.26Å; S14-E16 PolarHBondContact O-N 3.27Å
15	Q	31.7	Very low	51.6	Low	184 Å²	184	131.9 Å²	131.9	86%	0.86	66%	0.664	S	S	*	*			trans	-75.5	87.5	177.6	-164.3	169.9	-26.8	0	0	107	R13 E17	R13-Q15 PolarHBondContact O-N 2.87Å; Q15-E17 PolarHBondContact O-N 2.94Å; Q15-E17 VanDerWaalsContact O-N 3.09Å
16	E	42.3	Very low	54.4	Low	155 Å²	155	128.3 Å²	128.3	72%	0.724	63%	0.626	S	S	*	*			trans	-57.1	110.3	162.5	-66.5	170.1	149.6	0	0	106.1	S14 E18	S14-E16 VanDerWaalsContact C-N 3.26Å; S14-E16 PolarHBondContact O-N 3.27Å; E16-E18 PolarHBondContact O-N 3.09Å; E16-E18 VanDerWaalsContact O-N 3.13Å
17	E	53.5	Low	57	Low	186 Å²	186	127.4 Å²	127.4	87%	0.869	61%	0.61	S	S	*	*			trans	-60.2	115.5	165.8	-68.5	-170	146.1	0	0	106.3	Q15 D19	Q15-E17 PolarHBondContact O-N 2.94Å; Q15-E17 VanDerWaalsContact O-N 3.09Å; E17-D19 PolarHBondContact O-N 3.11Å
18	E	60.8	Low	59.5	Low	144 Å²	144	126.1 Å²	126.1	67%	0.673	60%	0.599	S	S	*	*			trans	-61.7	129.3	178.3	-75.6	-150.2	89.6	0	0	109.5	E16 P20 R22	E16-E18 PolarHBondContact O-N 3.09Å; E16-E18 VanDerWaalsContact O-N 3.13Å; E18-P20 WeakPolarHBondContact O-CD 3.19Å; E18-P20 VanDerWaalsContact O-N 3.15Å; E18-R22 VanDerWaalsContact OE1-CD 3.24Å; E18-R22 WeakPolarHBondContact OE1-CD 3.38Å; E18-R22 IonicContact OE1-NE 3.67Å; E18-R22 PolarHBondContact OE1-NE 3.38Å
19	D	69.8	Low	62.1	Low	32 Å²	32	117.8 Å²	117.8	17%	0.171	57%	0.566	C	S	.	*			trans	-53.5	118.7	175.4	-171.6	-28.5	0	0	0	109	E17 D21 R22 R52	E17-D19 PolarHBondContact O-N 3.11Å; D19-D21 PolarHBondContact O-N 2.68Å; D19-D21 PolarHBondContact OD1-N 3.41Å; D19-D21 VanDerWaalsContact OD1-N 3.14Å; D19-R22 WeakPolarHBondContact O-CB 3.23Å; D19-R22 PolarHBondContact O-N 3.27Å; D19-R52 IonicContact OD1-CZ 2.73Å; D19-R52 IonicContact OD1-NH1 3.18Å; D19-R52 PolarHBondContact OD1-NH1 3.04Å; D19-R52 IonicContact OD1-NH2 3.63Å; D19-R52 IonicContact OD2-CZ 2.67Å; D19-R52 IonicContact OD2-NH1 2.74Å; D19-R52 PolarHBondContact OD2-NH1 3.23Å; D19-R52 IonicContact OD2-NH2 3.6Å; D19-R52 PolarHBondContact OD2-NH2 3.47Å
20	P	70.2	Confident	64.8	Low	104 Å²	104	107.8 Å²	107.8	68%	0.675	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-18	-174	26	-35.7	0	0	0	113	E18	E18-P20 WeakPolarHBondContact O-CD 3.19Å; E18-P20 VanDerWaalsContact O-N 3.15Å
21	D	73.9	Confident	67.5	Low	8 Å²	8	104.3 Å²	104.3	4%	0.043	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	2.7	175.4	-59.3	-42.4	0	0	0	113.1	D19 G23 Q24 F36 R52 V57	D19-D21 PolarHBondContact O-N 2.68Å; D19-D21 PolarHBondContact OD1-N 3.41Å; D19-D21 VanDerWaalsContact OD1-N 3.14Å; D21-G23 PolarHBondContact O-N 3.23Å; D21-Q24 HydrophobicContact CB-CG 4.15Å; D21-Q24 WeakPolarHBondContact O-CB 3.26Å; D21-Q24 VanDerWaalsContact O-CG 3.27Å; D21-Q24 WeakPolarHBondContact O-CG 3.34Å; D21-Q24 PolarHBondContact O-N 3.33Å; D21-F36 HydrophobicContact CB-CD1 3.99Å; D21-F36 HydrophobicContact CB-CE1 4.44Å; D21-F36 WeakPolarHBondContact O-CB 3.41Å; D21-R52 IonicContact OD2-CZ 2.73Å; D21-R52 IonicContact OD2-NH1 3.34Å; D21-R52 PolarHBondContact OD2-NH1 3.12Å; D21-V57 HydrophobicContact CB-CG2 4.49Å
22	R	82.8	Confident	70.4	Confident	121 Å²	121	107.2 Å²	107.2	46%	0.457	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	126.8	176.9	-179.8	-173.9	-80	-71.8	-4.8	109.8	E18 D19 F36 H37	E18-R22 VanDerWaalsContact OE1-CD 3.24Å; E18-R22 WeakPolarHBondContact OE1-CD 3.38Å; E18-R22 IonicContact OE1-NE 3.67Å; E18-R22 PolarHBondContact OE1-NE 3.38Å; D19-R22 WeakPolarHBondContact O-CB 3.23Å; D19-R22 PolarHBondContact O-N 3.27Å; R22-F36 WeakPolarHBondContact CA-O 3.38Å; R22-H37 VanDerWaalsContact CZ-CD2 3.48Å; R22-H37 PolarHBondContact NH1-CD2 3.4Å; R22-H37 PolarHBondContact NH1-NE2 2.87Å; R22-H37 VanDerWaalsContact NH1-NE2 3.14Å; R22-H37 PolarHBondContact NH2-CD2 3.18Å; R22-H37 PolarHBondContact NH2-NE2 2.84Å; R22-H37 VanDerWaalsContact NH2-NE2 3.14Å
23	G	86.1	Confident	73.2	Confident	45 Å²	45	99.9 Å²	99.9	46%	0.464	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-5.7	179.8	0	0	0	0	0	115.6	D21 G35 F36	D21-G23 PolarHBondContact O-N 3.23Å; G23-G35 VanDerWaalsContact O-CA 3.28Å; G23-G35 WeakPolarHBondContact O-CA 3.11Å; G23-F36 PolarHBondContact N-O 2.76Å
24	Q	87.4	Confident	76.1	Confident	45 Å²	45	94.4 Å²	94.4	21%	0.21	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-63.1	133.5	-179.5	-67	-61.9	-15.4	0	0	112	D21 G35 F36 H55 A56	D21-Q24 HydrophobicContact CB-CG 4.15Å; D21-Q24 WeakPolarHBondContact O-CB 3.26Å; D21-Q24 VanDerWaalsContact O-CG 3.27Å; D21-Q24 WeakPolarHBondContact O-CG 3.34Å; D21-Q24 PolarHBondContact O-N 3.33Å; Q24-G35 CarbonylContact O-C 3.52Å; Q24-G35 WeakPolarHBondContact O-CA 3.21Å; Q24-F36 HydrophobicContact CB-CB 4.4Å; Q24-F36 PolarHBondContact O-N 2.93Å; Q24-H55 HydrophobicContact CB-CB 4.44Å; Q24-H55 PolarHBondContact O-ND1 3.19Å; Q24-A56 PolarHBondContact OE1-O 2.94Å
25	P	89.6	Confident	78.9	Confident	61 Å²	61	90.5 Å²	90.5	40%	0.396	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-65.9	147.3	-174	26.1	-34.3	0	0	0	112	H55 A56	P25-H55 CarbonylContact O-C 3.57Å; P25-H55 WeakPolarHBondContact O-CA 3.25Å; P25-A56 HydrophobicContact CG-CB 3.85Å; P25-A56 PolarHBondContact O-N 3.44Å
26	C	91	Very high	81.7	Confident	2 Å²	2	81.9 Å²	81.9	1%	0.014	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-81.9	118.9	176.8	-173.8	0	0	0	0	110.2	R28 C29 G30 C33	C26-R28 VanDerWaalsContact C-N 3.25Å; C26-R28 PolarHBondContact O-N 3.47Å; C26-C29 HydrophobicContact CB-CB 3.92Å; C26-C29 PolarHBondContact O-N 2.98Å; C26-C29 PolarHBondContact SG-N 3.44Å; C26-C29 VanDerWaalsContact SG-N 3.39Å; C26-C29 VanDerWaalsContact SG-SG 3.63Å; C26-G30 WeakPolarHBondContact O-CA 3.38Å; C26-G30 PolarHBondContact O-N 3.37Å; C26-C33 HydrophobicContact CB-CB 3.55Å
27	M	88.5	Confident	84	Confident	104 Å²	104	77.3 Å²	77.3	51%	0.512	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-24.7	177.5	-64	-54	-58.7	0	0	113	E54 A56 R125	M27-E54 WeakPolarHBondContact CB-O 3.47Å; M27-E54 PolarHBondContact N-O 2.91Å; M27-A56 HydrophobicContact CG-CB 4.27Å; M27-A56 HydrophobicContact SD-CB 4Å; M27-R125 PolarHBondContact SD-NH2 3.04Å
28	R	89.6	Confident	85.7	Confident	189 Å²	189	70.7 Å²	70.7	71%	0.713	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-33	177.1	-176.2	174.3	178.9	132.8	1.5	113.6	C26 E54	C26-R28 VanDerWaalsContact C-N 3.25Å; C26-R28 PolarHBondContact O-N 3.47Å; R28-E54 HydrophobicContact CB-CB 4.38Å
29	C	91.1	Very high	87.1	Confident	27 Å²	27	65 Å²	65	18%	0.182	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-18.4	-173.2	-60	0	0	0	0	113.7	C26 D31 Q32 C33 C48 C50	C26-C29 HydrophobicContact CB-CB 3.92Å; C26-C29 PolarHBondContact O-N 2.98Å; C26-C29 PolarHBondContact SG-N 3.44Å; C26-C29 VanDerWaalsContact SG-N 3.39Å; C26-C29 VanDerWaalsContact SG-SG 3.63Å; C29-D31 PolarHBondContact O-N 2.88Å; C29-Q32 HydrophobicContact CB-CB 4.24Å; C29-Q32 WeakPolarHBondContact O-CB 3.39Å; C29-Q32 PolarHBondContact O-N 2.9Å; C29-Q32 PolarHBondContact O-NE2 3.39Å; C29-C33 HydrophobicContact CB-CB 4.09Å; C29-C48 HydrophobicContact CB-CB 4.38Å; C29-C50 VanDerWaalsContact SG-SG 3.66Å
30	G	89.1	Confident	87.8	Confident	35 Å²	35	66.8 Å²	66.8	36%	0.361	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	55.5	-136.3	-169.5	0	0	0	0	0	111	C26 Q32 C33	C26-G30 WeakPolarHBondContact O-CA 3.38Å; C26-G30 PolarHBondContact O-N 3.37Å; G30-Q32 PolarHBondContact O-N 3.43Å; G30-Q32 VanDerWaalsContact O-N 3.09Å; G30-C33 PolarHBondContact O-N 2.9Å; G30-C33 VanDerWaalsContact O-N 3.12Å
31	D	90.1	Very high	88.7	Confident	171 Å²	171	63.9 Å²	63.9	91%	0.914	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-12	-175.6	-50.9	-41.8	0	0	0	114.3	C29 C33	C29-D31 PolarHBondContact O-N 2.88Å; D31-C33 PolarHBondContact O-N 2.78Å
32	Q	92.1	Very high	89.5	Confident	172 Å²	172	64 Å²	64	80%	0.804	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.3	172.6	-62.4	170	96.5	0	0	112.8	C29 G30	C29-Q32 HydrophobicContact CB-CB 4.24Å; C29-Q32 WeakPolarHBondContact O-CB 3.39Å; C29-Q32 PolarHBondContact O-N 2.9Å; C29-Q32 PolarHBondContact O-NE2 3.39Å; G30-Q32 PolarHBondContact O-N 3.43Å; G30-Q32 VanDerWaalsContact O-N 3.09Å
33	C	92.7	Very high	89.9	Confident	7 Å²	7	60.5 Å²	60.5	5%	0.047	34%	0.34	C	S	.	.	S	Bend	trans	-113.8	121.2	172.5	-167.8	0	0	0	0	110	C26 C29 G30 D31 G35 C48	C26-C33 HydrophobicContact CB-CB 3.55Å; C29-C33 HydrophobicContact CB-CB 4.09Å; G30-C33 PolarHBondContact O-N 2.9Å; G30-C33 VanDerWaalsContact O-N 3.12Å; D31-C33 PolarHBondContact O-N 2.78Å; C33-G35 PolarHBondContact O-N 2.99Å; C33-G35 PolarHBondContact SG-O 3.22Å; C33-C48 HydrophobicContact CB-CB 3.91Å
34	P	92.7	Very high	90.2	Very high	103 Å²	103	59.3 Å²	59.3	67%	0.669	32%	0.323	S	S	*	.			trans	-73.5	24.4	-179.1	34	-38.7	0	0	0	113.8	H47	P34-H47 HydrophobicContact CG-CB 4.21Å
35	G	91.1	Very high	90.4	Very high	5 Å²	5	57.1 Å²	57.1	5%	0.052	31%	0.313	C	S	.	.	S	Bend	trans	104.4	166	-170.6	0	0	0	0	0	114.1	G23 Q24 C33	G23-G35 VanDerWaalsContact O-CA 3.28Å; G23-G35 WeakPolarHBondContact O-CA 3.11Å; Q24-G35 CarbonylContact O-C 3.52Å; Q24-G35 WeakPolarHBondContact O-CA 3.21Å; C33-G35 PolarHBondContact O-N 2.99Å; C33-G35 PolarHBondContact SG-O 3.22Å
36	F	91.1	Very high	90.6	Very high	3 Å²	3	56.1 Å²	56.1	1%	0.013	31%	0.306	C	S	.	.			trans	-71.1	134.9	178.2	-176.7	-112.2	0	0	0	111.4	D21 R22 G23 Q24 V38 C45 R52 H55	D21-F36 HydrophobicContact CB-CD1 3.99Å; D21-F36 HydrophobicContact CB-CE1 4.44Å; D21-F36 WeakPolarHBondContact O-CB 3.41Å; R22-F36 WeakPolarHBondContact CA-O 3.38Å; G23-F36 PolarHBondContact N-O 2.76Å; Q24-F36 HydrophobicContact CB-CB 4.4Å; Q24-F36 PolarHBondContact O-N 2.93Å; F36-V38 HydrophobicContact CE1-CB 3.9Å; F36-V38 HydrophobicContact CZ-CB 3.78Å; F36-V38 HydrophobicContact CZ-CG2 4.15Å; F36-C45 HydrophobicContact CD2-CB 3.85Å; F36-C45 HydrophobicContact CE2-CB 4.09Å; F36-R52 HydrophobicContact CE1-CG 4.45Å; F36-R52 HydrophobicContact CE2-CB 4.19Å; F36-R52 HydrophobicContact CE2-CG 4.46Å; F36-R52 HydrophobicContact CZ-CB 4.07Å; F36-R52 HydrophobicContact CZ-CG 4.11Å; F36-H55 HydrophobicContact CB-CB 4.22Å; F36-H55 WeakPolarHBondContact CB-ND1 3.36Å; F36-H55 HydrophobicContact CD2-CB 4.35Å; F36-H55 AromaticContact CD2-CD2 3.57Å; F36-H55 AromaticContact CD2-CE1 3.88Å; F36-H55 AromaticContact CD2-CG 3.7Å; F36-H55 AromaticContact CD2-ND1 3.92Å; F36-H55 AromaticContact CD2-NE2 3.69Å
37	H	90.8	Very high	90.7	Very high	60 Å²	60	60.8 Å²	60.8	28%	0.278	33%	0.327	S	S	.	.			trans	-146.6	112.4	166	179.2	-138.5	0	0	0	108.8	R22 C45 V46	R22-H37 VanDerWaalsContact CZ-CD2 3.48Å; R22-H37 PolarHBondContact NH1-CD2 3.4Å; R22-H37 PolarHBondContact NH1-NE2 2.87Å; R22-H37 VanDerWaalsContact NH1-NE2 3.14Å; R22-H37 PolarHBondContact NH2-CD2 3.18Å; R22-H37 PolarHBondContact NH2-NE2 2.84Å; R22-H37 VanDerWaalsContact NH2-NE2 3.14Å; H37-C45 CarbonylContact O-C 3.52Å; H37-C45 VanDerWaalsContact O-CA 3.27Å; H37-C45 WeakPolarHBondContact O-CA 3.28Å; H37-V46 HydrophobicContact CB-CG2 4Å; H37-V46 VanDerWaalsContact ND1-CG2 3.34Å; H37-V46 WeakPolarHBondContact ND1-CG2 3.4Å; H37-V46 PolarHBondContact O-N 2.93Å
38	V	88.4	Confident	90.9	Very high	46 Å²	46	57 Å²	57	28%	0.279	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-63.2	137.3	-175.1	71.1	0	0	0	0	111.5	F36	F36-V38 HydrophobicContact CE1-CB 3.9Å; F36-V38 HydrophobicContact CZ-CB 3.78Å; F36-V38 HydrophobicContact CZ-CG2 4.15Å
39	H	90.7	Very high	91	Very high	25 Å²	25	51.4 Å²	51.4	12%	0.116	29%	0.291	C	S	.	.			trans	-71.7	143	171.6	-167.6	-57.1	0	0	0	109.9	W41 R42 I44 V46 E281	H39-W41 AromaticContact CE1-CD1 3.92Å; H39-W41 AromaticContact CE1-NE1 3.52Å; H39-W41 AromaticContact ND1-CD1 3.9Å; H39-W41 AromaticContact ND1-NE1 3.96Å; H39-W41 PolarHBondContact O-N 2.84Å; H39-R42 HydrophobicContact CB-CB 4.01Å; H39-R42 WeakPolarHBondContact CB-O 3.26Å; H39-R42 PolarHBondContact NE2-NH1 2.83Å; H39-R42 VanDerWaalsContact O-O 3.13Å; H39-I44 HydrophobicContact CB-CG1 4.31Å; H39-I44 WeakPolarHBondContact CB-O 3.33Å; H39-I44 PolarHBondContact N-O 2.93Å; H39-V46 VanDerWaalsContact CA-CG1 3.44Å; H39-V46 HydrophobicContact CB-CG1 3.74Å; H39-E281 IonicContact CE1-OE1 3.5Å; H39-E281 PolarHBondContact CE1-OE1 3.08Å; H39-E281 IonicContact NE2-OE1 3.15Å; H39-E281 PolarHBondContact NE2-OE1 3.32Å
40	G	85.6	Confident	91.1	Very high	69 Å²	69	50.8 Å²	50.8	71%	0.711	29%	0.288	S	S	*	.	S	Bend	trans	-64.3	5.7	-172	0	0	0	0	0	117.2
41	W	88.9	Confident	91.1	Very high	44 Å²	44	52.1 Å²	52.1	17%	0.167	29%	0.288	C	S	.	.	S	Bend	trans	-161.3	-34.6	170.9	60.9	-93.4	0	0	0	112.7	H39 N146 A252 C253 H274	H39-W41 AromaticContact CE1-CD1 3.92Å; H39-W41 AromaticContact CE1-NE1 3.52Å; H39-W41 AromaticContact ND1-CD1 3.9Å; H39-W41 AromaticContact ND1-NE1 3.96Å; H39-W41 PolarHBondContact O-N 2.84Å; W41-N146 PolarHBondContact O-ND2 3.45Å; W41-A252 HydrophobicContact CH2-CB 4.23Å; W41-A252 HydrophobicContact CZ3-CB 3.84Å; W41-C253 HydrophobicContact CE3-CB 3.98Å; W41-C253 HydrophobicContact CZ3-CB 4.35Å; W41-C253 WeakPolarHBondContact O-CB 3.22Å; W41-H274 HydrophobicContact CE3-CB 4.48Å; W41-H274 AromaticContact CE3-CD2 3.49Å; W41-H274 VanDerWaalsContact CE3-CD2 3.49Å; W41-H274 AromaticContact CE3-CE1 3.97Å; W41-H274 AromaticContact CE3-CG 3.78Å; W41-H274 AromaticContact CE3-NE2 3.65Å; W41-H274 HydrophobicContact CH2-CB 4.15Å; W41-H274 HydrophobicContact CZ3-CB 3.67Å; W41-H274 AromaticContact CZ3-CD2 3.48Å; W41-H274 VanDerWaalsContact CZ3-CD2 3.48Å; W41-H274 WeakPolarHBondContact CZ3-CD2 3.48Å; W41-H274 AromaticContact CZ3-CG 3.44Å; W41-H274 VanDerWaalsContact CZ3-CG 3.44Å
42	R	90.8	Very high	91	Very high	9 Å²	9	46.4 Å²	46.4	3%	0.034	25%	0.254	C	S	.	.	S	Bend	trans	-72.5	136.7	170.5	-57.2	-175.6	176.9	118.3	-5.8	110.2	H39 I44 A252 C277 E281	H39-R42 HydrophobicContact CB-CB 4.01Å; H39-R42 WeakPolarHBondContact CB-O 3.26Å; H39-R42 PolarHBondContact NE2-NH1 2.83Å; H39-R42 VanDerWaalsContact O-O 3.13Å; R42-I44 HydrophobicContact CB-CD1 4.04Å; R42-I44 HydrophobicContact CB-CG1 3.77Å; R42-I44 PolarHBondContact O-N 3.36Å; R42-A252 WeakPolarHBondContact CB-O 3.41Å; R42-A252 WeakPolarHBondContact CG-O 3.16Å; R42-C277 PolarHBondContact NH2-O 3.27Å; R42-E281 IonicContact CZ-OE1 2.87Å; R42-E281 IonicContact NH1-OE1 3.24Å; R42-E281 PolarHBondContact NH1-OE1 3.38Å; R42-E281 IonicContact NH2-OE1 3.78Å
43	K	90.1	Very high	90.6	Very high	48 Å²	48	40.1 Å²	40.1	21%	0.209	23%	0.225	C	C	.	.	S	Bend	trans	-81.4	44.7	177.7	-53.4	-67.3	-177.1	-168.5	0	112.5	Y144 N146 C253 D254 E255	K43-Y144 PolarHBondContact NZ-O 3.08Å; K43-N146 PolarHBondContact NZ-ND2 2.68Å; K43-N146 VanDerWaalsContact NZ-ND2 3.14Å; K43-C253 WeakPolarHBondContact CG-O 3.32Å; K43-D254 HydrophobicContact CB-CB 4.17Å; K43-D254 HydrophobicContact CG-CB 3.97Å; K43-E255 WeakPolarHBondContact CE-OE1 3.49Å; K43-E255 IonicContact NZ-OE1 2.69Å; K43-E255 PolarHBondContact NZ-OE1 2.92Å
44	I	92.1	Very high	90.4	Very high	20 Å²	20	42 Å²	42	10%	0.103	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-128.9	159	-178.4	67.9	-175.6	0	0	0	110.4	H39 R42 K49 C50 V51 F278	H39-I44 HydrophobicContact CB-CG1 4.31Å; H39-I44 WeakPolarHBondContact CB-O 3.33Å; H39-I44 PolarHBondContact N-O 2.93Å; R42-I44 HydrophobicContact CB-CD1 4.04Å; R42-I44 HydrophobicContact CB-CG1 3.77Å; R42-I44 PolarHBondContact O-N 3.36Å; I44-K49 HydrophobicContact CD1-CB 4.24Å; I44-K49 HydrophobicContact CD1-CD 4.41Å; I44-C50 CarbonylContact C-O 3.44Å; I44-C50 VanDerWaalsContact CA-O 3.24Å; I44-C50 WeakPolarHBondContact CA-O 3.24Å; I44-C50 WeakPolarHBondContact CB-O 3.35Å; I44-V51 HydrophobicContact CG2-CG1 4.07Å; I44-F278 HydrophobicContact CD1-CE2 4.15Å; I44-F278 HydrophobicContact CD1-CZ 4.13Å
45	C	93.3	Very high	90.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-67.6	133.7	170.6	-177.4	0	0	0	0	111	F36 H37 H47 C48 K49 C50 H55	F36-C45 HydrophobicContact CD2-CB 3.85Å; F36-C45 HydrophobicContact CE2-CB 4.09Å; H37-C45 CarbonylContact O-C 3.52Å; H37-C45 VanDerWaalsContact O-CA 3.27Å; H37-C45 WeakPolarHBondContact O-CA 3.28Å; C45-H47 PolarHBondContact O-N 3.05Å; C45-H47 PolarHBondContact SG-N 3.41Å; C45-C48 VanDerWaalsContact CB-SG 3.5Å; C45-K49 WeakPolarHBondContact O-CA 3.48Å; C45-K49 PolarHBondContact O-N 3.33Å; C45-C50 PolarHBondContact N-O 3.44Å; C45-H55 WeakPolarHBondContact CB-NE2 3.41Å
46	V	92.7	Very high	89.3	Confident	40 Å²	40	37.4 Å²	37.4	24%	0.242	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.7	176.5	-60	0	0	0	0	112.7	H37 H39 K49	H37-V46 HydrophobicContact CB-CG2 4Å; H37-V46 VanDerWaalsContact ND1-CG2 3.34Å; H37-V46 WeakPolarHBondContact ND1-CG2 3.4Å; H37-V46 PolarHBondContact O-N 2.93Å; H39-V46 VanDerWaalsContact CA-CG1 3.44Å; H39-V46 HydrophobicContact CB-CG1 3.74Å; V46-K49 PolarHBondContact O-NZ 3.07Å
47	H	93.1	Very high	88.2	Confident	99 Å²	99	37.7 Å²	37.7	46%	0.458	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-55	-173.8	-57.8	-67	0	0	0	112.4	P34 C45	P34-H47 HydrophobicContact CG-CB 4.21Å; C45-H47 PolarHBondContact O-N 3.05Å; C45-H47 PolarHBondContact SG-N 3.41Å
48	C	93.2	Very high	86.8	Confident	26 Å²	26	43.5 Å²	43.5	18%	0.176	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-4.5	-175.1	64.9	0	0	0	0	114.8	C29 C33 C45 C50 H55	C29-C48 HydrophobicContact CB-CB 4.38Å; C33-C48 HydrophobicContact CB-CB 3.91Å; C45-C48 VanDerWaalsContact CB-SG 3.5Å; C48-C50 PolarHBondContact O-N 2.8Å; C48-H55 PolarHBondContact SG-NE2 3.3Å
49	K	92.4	Very high	85.5	Confident	70 Å²	70	47.8 Å²	47.8	30%	0.304	24%	0.244	S	C	.	.			trans	58.3	13.1	-175.9	-42.7	-55.4	-174.4	-168	0	115.3	I44 C45 V46 F278	I44-K49 HydrophobicContact CD1-CB 4.24Å; I44-K49 HydrophobicContact CD1-CD 4.41Å; C45-K49 WeakPolarHBondContact O-CA 3.48Å; C45-K49 PolarHBondContact O-N 3.33Å; V46-K49 PolarHBondContact O-NZ 3.07Å; K49-F278 HydrophobicContact CB-CE1 4.4Å; K49-F278 HydrophobicContact CB-CZ 4.03Å; K49-F278 HydrophobicContact CD-CZ 4.48Å; K49-F278 HydrophobicContact CG-CE1 4.13Å; K49-F278 HydrophobicContact CG-CZ 4.16Å
50	C	91.5	Very high	83.9	Confident	15 Å²	15	47.8 Å²	47.8	10%	0.101	25%	0.246	C	C	.	.			trans	-77.2	153.3	171.4	-58.6	0	0	0	0	111.3	C29 I44 C45 C48 E54	C29-C50 VanDerWaalsContact SG-SG 3.66Å; I44-C50 CarbonylContact C-O 3.44Å; I44-C50 VanDerWaalsContact CA-O 3.24Å; I44-C50 WeakPolarHBondContact CA-O 3.24Å; I44-C50 WeakPolarHBondContact CB-O 3.35Å; C45-C50 PolarHBondContact N-O 3.44Å; C48-C50 PolarHBondContact O-N 2.8Å; C50-E54 HydrophobicContact CB-CB 3.92Å; C50-E54 HydrophobicContact CB-CG 4.28Å
51	V	89.6	Confident	82.7	Confident	62 Å²	62	46.1 Å²	46.1	38%	0.376	22%	0.222	S	C	.	.	B	Isolated β-bridge	trans	-70.4	161.1	173.5	-61.6	0	0	0	0	111	I44 E53 E54	I44-V51 HydrophobicContact CG2-CG1 4.07Å; V51-E53 WeakPolarHBondContact CB-OE2 3.02Å; V51-E53 HydrophobicContact CG2-CB 4.37Å; V51-E53 WeakPolarHBondContact CG2-OE2 3.24Å; V51-E53 PolarHBondContact O-N 3.35Å; V51-E53 VanDerWaalsContact O-N 3.15Å; V51-E54 HydrophobicContact CG2-CG 3.85Å; V51-E54 PolarHBondContact O-N 3.26Å; V51-E54 VanDerWaalsContact O-N 3.08Å
52	R	87.4	Confident	81.2	Confident	52 Å²	52	45.7 Å²	45.7	20%	0.196	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-54.2	-36.5	-177	-178.8	-178.4	-65.6	-97.5	-5.8	112.1	D19 D21 F36 E54 H55 V57	D19-R52 IonicContact OD1-CZ 2.73Å; D19-R52 IonicContact OD1-NH1 3.18Å; D19-R52 PolarHBondContact OD1-NH1 3.04Å; D19-R52 IonicContact OD1-NH2 3.63Å; D19-R52 IonicContact OD2-CZ 2.67Å; D19-R52 IonicContact OD2-NH1 2.74Å; D19-R52 PolarHBondContact OD2-NH1 3.23Å; D19-R52 IonicContact OD2-NH2 3.6Å; D19-R52 PolarHBondContact OD2-NH2 3.47Å; D21-R52 IonicContact OD2-CZ 2.73Å; D21-R52 IonicContact OD2-NH1 3.34Å; D21-R52 PolarHBondContact OD2-NH1 3.12Å; F36-R52 HydrophobicContact CE1-CG 4.45Å; F36-R52 HydrophobicContact CE2-CB 4.19Å; F36-R52 HydrophobicContact CE2-CG 4.46Å; F36-R52 HydrophobicContact CZ-CB 4.07Å; F36-R52 HydrophobicContact CZ-CG 4.11Å; R52-E54 PolarHBondContact O-N 2.75Å; R52-H55 WeakPolarHBondContact O-CB 3.48Å; R52-H55 PolarHBondContact O-N 2.76Å; R52-V57 HydrophobicContact CG-CG2 3.89Å
53	E	85.6	Confident	79.6	Confident	40 Å²	40	49.5 Å²	49.5	19%	0.187	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-70.9	-11.7	-176.4	-56	74.9	-163.2	0	0	114.2	V51 K129 L132	V51-E53 WeakPolarHBondContact CB-OE2 3.02Å; V51-E53 HydrophobicContact CG2-CB 4.37Å; V51-E53 WeakPolarHBondContact CG2-OE2 3.24Å; V51-E53 PolarHBondContact O-N 3.35Å; V51-E53 VanDerWaalsContact O-N 3.15Å; E53-K129 HydrophobicContact CB-CB 4.39Å; E53-K129 HydrophobicContact CB-CD 4.28Å; E53-K129 HydrophobicContact CB-CG 3.93Å; E53-L132 HydrophobicContact CG-CB 3.67Å; E53-L132 HydrophobicContact CG-CD1 4.05Å
54	E	87.8	Confident	78.1	Confident	46 Å²	46	47.5 Å²	47.5	22%	0.215	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-90.9	-2.6	170.5	-57.6	-60	170.4	0	0	112.5	M27 R28 C50 V51 R52 K129	M27-E54 WeakPolarHBondContact CB-O 3.47Å; M27-E54 PolarHBondContact N-O 2.91Å; R28-E54 HydrophobicContact CB-CB 4.38Å; C50-E54 HydrophobicContact CB-CB 3.92Å; C50-E54 HydrophobicContact CB-CG 4.28Å; V51-E54 HydrophobicContact CG2-CG 3.85Å; V51-E54 PolarHBondContact O-N 3.26Å; V51-E54 VanDerWaalsContact O-N 3.08Å; R52-E54 PolarHBondContact O-N 2.75Å; E54-K129 IonicContact OE1-NZ 3.5Å; E54-K129 PolarHBondContact OE1-NZ 3Å; E54-K129 IonicContact OE2-NZ 3.46Å; E54-K129 PolarHBondContact OE2-NZ 2.97Å
55	H	87.2	Confident	76.7	Confident	6 Å²	6	52.1 Å²	52.1	3%	0.028	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-94	155.9	169.3	-70.8	-105.8	0	0	0	110.5	Q24 P25 F36 C45 C48 R52 V57	Q24-H55 HydrophobicContact CB-CB 4.44Å; Q24-H55 PolarHBondContact O-ND1 3.19Å; P25-H55 CarbonylContact O-C 3.57Å; P25-H55 WeakPolarHBondContact O-CA 3.25Å; F36-H55 HydrophobicContact CB-CB 4.22Å; F36-H55 WeakPolarHBondContact CB-ND1 3.36Å; F36-H55 HydrophobicContact CD2-CB 4.35Å; F36-H55 AromaticContact CD2-CD2 3.57Å; F36-H55 AromaticContact CD2-CE1 3.88Å; F36-H55 AromaticContact CD2-CG 3.7Å; F36-H55 AromaticContact CD2-ND1 3.92Å; F36-H55 AromaticContact CD2-NE2 3.69Å; C45-H55 WeakPolarHBondContact CB-NE2 3.41Å; C48-H55 PolarHBondContact SG-NE2 3.3Å; R52-H55 WeakPolarHBondContact O-CB 3.48Å; R52-H55 PolarHBondContact O-N 2.76Å; H55-V57 PolarHBondContact O-N 3.01Å
56	A	74.2	Confident	75.3	Confident	5 Å²	5	58.4 Å²	58.4	4%	0.041	29%	0.29	C	S	.	.			trans	-74	60	-179.4	0	0	0	0	0	112.2	Q24 P25 M27 R58	Q24-A56 PolarHBondContact OE1-O 2.94Å; P25-A56 HydrophobicContact CG-CB 3.85Å; P25-A56 PolarHBondContact O-N 3.44Å; M27-A56 HydrophobicContact CG-CB 4.27Å; M27-A56 HydrophobicContact SD-CB 4Å; A56-R58 WeakPolarHBondContact O-CG 3.49Å; A56-R58 PolarHBondContact O-N 2.84Å
57	V	67.4	Low	73.9	Confident	9 Å²	9	57.5 Å²	57.5	6%	0.055	28%	0.283	C	S	.	.			trans	-60.2	102.6	170.3	179.3	0	0	0	0	107.8	D21 R52 H55 L59 I128 L132	D21-V57 HydrophobicContact CB-CG2 4.49Å; R52-V57 HydrophobicContact CG-CG2 3.89Å; H55-V57 PolarHBondContact O-N 3.01Å; V57-L59 WeakPolarHBondContact CG1-O 3.37Å; V57-I128 HydrophobicContact CB-CG2 4.32Å; V57-I128 HydrophobicContact CG1-CG2 4.01Å; V57-L132 HydrophobicContact CB-CD1 4.44Å; V57-L132 HydrophobicContact CG1-CD1 4.23Å; V57-L132 HydrophobicContact CG2-CD1 4.34Å
58	R	60.4	Low	72.4	Confident	182 Å²	182	53.6 Å²	53.6	69%	0.687	27%	0.265	S	S	*	.			trans	-82.7	-17.3	-173.5	-61.5	-166.7	-177.3	-165.3	-2.5	113.6	A56	A56-R58 WeakPolarHBondContact O-CG 3.49Å; A56-R58 PolarHBondContact O-N 2.84Å
59	L	61.7	Low	70.8	Confident	136 Å²	136	56.3 Å²	56.3	71%	0.712	28%	0.281	S	S	*	.	S	Bend	trans	-130.8	136.7	-177.3	-66.6	171.1	0	0	0	108	V57 P61	V57-L59 WeakPolarHBondContact CG1-O 3.37Å; L59-P61 WeakPolarHBondContact O-CD 3.25Å
60	V	57	Low	69.3	Low	26 Å²	26	59 Å²	59	16%	0.158	29%	0.293	C	S	.	.			trans	-54.4	124.1	162	179.4	0	0	0	0	106.4	G62 L64 E65 I128 L131	V60-G62 PolarHBondContact O-N 3.1Å; V60-G62 VanDerWaalsContact O-N 3.1Å; V60-L64 HydrophobicContact CG1-CB 3.84Å; V60-L64 HydrophobicContact CG1-CD2 4.12Å; V60-L64 HydrophobicContact CG1-CG 3.92Å; V60-E65 HydrophobicContact CG1-CB 4.23Å; V60-I128 HydrophobicContact CG2-CG1 4.1Å; V60-L131 HydrophobicContact CG1-CD1 4.41Å; V60-L131 HydrophobicContact CG2-CD1 3.49Å; V60-L131 VanDerWaalsContact CG2-CD1 3.49Å
61	P	60.1	Low	67.9	Low	33 Å²	33	59.2 Å²	59.2	21%	0.214	29%	0.293	C	S	.	.			trans	-53.9	126	178.1	-27.2	35	0	0	0	108.3	L59 Q63 L64 E65 L132	L59-P61 WeakPolarHBondContact O-CD 3.25Å; P61-Q63 CarbonylContact O-C 3.5Å; P61-Q63 PolarHBondContact O-N 2.9Å; P61-L64 WeakPolarHBondContact O-CA 3.26Å; P61-L64 PolarHBondContact O-N 3.48Å; P61-E65 PolarHBondContact O-N 2.79Å; P61-L132 HydrophobicContact CG-CD2 3.95Å
62	G	58.5	Low	66.1	Low	35 Å²	35	57.8 Å²	57.8	36%	0.361	28%	0.284	S	S	.	.	H	α-helix	trans	-59.8	-5.6	-166.4	0	0	0	0	0	115.4	V60 K66	V60-G62 PolarHBondContact O-N 3.1Å; V60-G62 VanDerWaalsContact O-N 3.1Å; G62-K66 WeakPolarHBondContact O-CB 3.37Å; G62-K66 VanDerWaalsContact O-CD 3.29Å; G62-K66 WeakPolarHBondContact O-CD 3.48Å; G62-K66 WeakPolarHBondContact O-CG 3.48Å; G62-K66 PolarHBondContact O-N 2.92Å; G62-K66 VanDerWaalsContact O-N 3.07Å
63	Q	56.2	Low	64.6	Low	89 Å²	89	57.7 Å²	57.7	42%	0.416	29%	0.292	S	S	.	.	H	α-helix	trans	-86.7	-33.4	171.8	-63.7	-78.8	13.6	0	0	112.8	P61 M67 Y144	P61-Q63 CarbonylContact O-C 3.5Å; P61-Q63 PolarHBondContact O-N 2.9Å; Q63-M67 WeakPolarHBondContact O-CB 3.21Å; Q63-M67 PolarHBondContact O-N 3.13Å; Q63-Y144 WeakPolarHBondContact CB-OH 3.14Å; Q63-Y144 WeakPolarHBondContact CG-OH 3.38Å
64	L	59.3	Low	63	Low	7 Å²	7	60 Å²	60	4%	0.037	31%	0.305	C	S	.	.	H	α-helix	trans	-71.4	-36	167.1	-178.6	55.8	0	0	0	110.5	V60 P61 M67 M68 L131 L132 L135	V60-L64 HydrophobicContact CG1-CB 3.84Å; V60-L64 HydrophobicContact CG1-CD2 4.12Å; V60-L64 HydrophobicContact CG1-CG 3.92Å; P61-L64 WeakPolarHBondContact O-CA 3.26Å; P61-L64 PolarHBondContact O-N 3.48Å; L64-M67 HydrophobicContact CD1-CB 4.47Å; L64-M67 HydrophobicContact CD1-SD 4.43Å; L64-M67 CarbonylContact O-C 3.49Å; L64-M67 WeakPolarHBondContact O-CB 3.45Å; L64-M67 PolarHBondContact O-N 3.46Å; L64-M68 HydrophobicContact CD1-CE 4.48Å; L64-M68 WeakPolarHBondContact O-CG 3.5Å; L64-M68 PolarHBondContact O-N 3.29Å; L64-L131 HydrophobicContact CD2-CB 3.98Å; L64-L132 HydrophobicContact CD2-CD2 4.15Å; L64-L135 HydrophobicContact CD1-CB 4.23Å
65	E	61.2	Low	61.1	Low	116 Å²	116	62.1 Å²	62.1	54%	0.542	31%	0.314	S	S	.	.	H	α-helix	trans	-62.2	-49.1	169.6	-171.8	-178.7	-157.7	0	0	111.5	V60 P61 M67 M68 T69	V60-E65 HydrophobicContact CG1-CB 4.23Å; P61-E65 PolarHBondContact O-N 2.79Å; E65-M67 VanDerWaalsContact C-N 3.26Å; E65-M67 PolarHBondContact O-N 2.88Å; E65-M68 WeakPolarHBondContact O-CB 3.37Å; E65-M68 PolarHBondContact O-N 2.85Å; E65-M68 VanDerWaalsContact O-N 3.12Å; E65-T69 PolarHBondContact O-N 3.04Å; E65-T69 PolarHBondContact O-OG1 3.04Å; E65-T69 VanDerWaalsContact O-OG1 3.13Å
66	K	64.2	Low	59.1	Low	132 Å²	132	67.8 Å²	67.8	57%	0.574	34%	0.34	S	S	*	.	H	α-helix	trans	-57.2	-37.9	170.8	-76.1	164.3	-169.6	175.7	0	112.7	G62 K70	G62-K66 WeakPolarHBondContact O-CB 3.37Å; G62-K66 VanDerWaalsContact O-CD 3.29Å; G62-K66 WeakPolarHBondContact O-CD 3.48Å; G62-K66 WeakPolarHBondContact O-CG 3.48Å; G62-K66 PolarHBondContact O-N 2.92Å; G62-K66 VanDerWaalsContact O-N 3.07Å; K66-K70 VanDerWaalsContact O-CB 3.23Å; K66-K70 WeakPolarHBondContact O-CB 3.37Å; K66-K70 PolarHBondContact O-N 3.08Å
67	M	63.5	Low	57.6	Low	21 Å²	21	77.4 Å²	77.4	10%	0.103	38%	0.376	C	S	.	.	H	α-helix	trans	-64.4	-45.5	175.2	-167.8	-175.6	-57.2	0	0	110.7	Q63 L64 E65 K70 L71 A137 E141	Q63-M67 WeakPolarHBondContact O-CB 3.21Å; Q63-M67 PolarHBondContact O-N 3.13Å; L64-M67 HydrophobicContact CD1-CB 4.47Å; L64-M67 HydrophobicContact CD1-SD 4.43Å; L64-M67 CarbonylContact O-C 3.49Å; L64-M67 WeakPolarHBondContact O-CB 3.45Å; L64-M67 PolarHBondContact O-N 3.46Å; E65-M67 VanDerWaalsContact C-N 3.26Å; E65-M67 PolarHBondContact O-N 2.88Å; M67-K70 PolarHBondContact O-N 2.85Å; M67-L71 HydrophobicContact CG-CD1 3.94Å; M67-L71 HydrophobicContact CG-CG 4.37Å; M67-L71 WeakPolarHBondContact O-CB 3.33Å; M67-L71 WeakPolarHBondContact O-CD1 3.28Å; M67-L71 WeakPolarHBondContact O-CG 3.42Å; M67-L71 PolarHBondContact O-N 3.02Å; M67-A137 HydrophobicContact CE-CB 4.47Å; M67-E141 HydrophobicContact CE-CG 4.19Å
68	M	61.6	Low	56.2	Low	17 Å²	17	85.1 Å²	85.1	8%	0.084	41%	0.41	C	S	.	.	H	α-helix	trans	-56.9	-55	173.9	-63.4	-110.8	131.5	0	0	110.9	L64 E65 K70 L71 V72 L131 L135 D226 I228	L64-M68 HydrophobicContact CD1-CE 4.48Å; L64-M68 WeakPolarHBondContact O-CG 3.5Å; L64-M68 PolarHBondContact O-N 3.29Å; E65-M68 WeakPolarHBondContact O-CB 3.37Å; E65-M68 PolarHBondContact O-N 2.85Å; E65-M68 VanDerWaalsContact O-N 3.12Å; M68-K70 VanDerWaalsContact C-N 3.26Å; M68-K70 PolarHBondContact O-N 3Å; M68-L71 WeakPolarHBondContact O-CB 3.35Å; M68-L71 PolarHBondContact O-N 3.14Å; M68-L71 VanDerWaalsContact O-N 3.12Å; M68-V72 VanDerWaalsContact O-CG2 3.29Å; M68-V72 WeakPolarHBondContact O-CG2 3.44Å; M68-V72 PolarHBondContact O-N 2.65Å; M68-L131 HydrophobicContact CE-CD2 3.25Å; M68-L131 HydrophobicContact SD-CD2 3.6Å; M68-L135 HydrophobicContact CE-CD1 3.18Å; M68-D226 HydrophobicContact SD-CB 4.22Å; M68-D226 VanDerWaalsContact SD-OD2 3.42Å; M68-I228 HydrophobicContact CE-CD1 3.36Å; M68-I228 HydrophobicContact SD-CD1 3.96Å
69	T	59.1	Low	55.1	Low	83 Å²	83	81.2 Å²	81.2	51%	0.509	41%	0.411	S	S	.	.	H	α-helix	trans	-59.3	-37.9	-179.4	-56.7	0	0	0	0	111.6	E65 V72 S73	E65-T69 PolarHBondContact O-N 3.04Å; E65-T69 PolarHBondContact O-OG1 3.04Å; E65-T69 VanDerWaalsContact O-OG1 3.13Å; T69-V72 PolarHBondContact O-N 3.45Å; T69-S73 VanDerWaalsContact O-CB 3.31Å; T69-S73 WeakPolarHBondContact O-CB 3.05Å; T69-S73 PolarHBondContact O-N 3.14Å; T69-S73 PolarHBondContact O-OG 2.85Å
70	K	62.8	Low	54.1	Low	127 Å²	127	82.9 Å²	82.9	55%	0.552	42%	0.419	S	S	*	.	H	α-helix	trans	-66.8	-47.9	173.5	-176.1	177.3	179.5	-178.9	0	112.4	K66 M67 M68 V72 S73 D74	K66-K70 VanDerWaalsContact O-CB 3.23Å; K66-K70 WeakPolarHBondContact O-CB 3.37Å; K66-K70 PolarHBondContact O-N 3.08Å; M67-K70 PolarHBondContact O-N 2.85Å; M68-K70 VanDerWaalsContact C-N 3.26Å; M68-K70 PolarHBondContact O-N 3Å; K70-V72 PolarHBondContact O-N 2.77Å; K70-S73 PolarHBondContact O-N 3.48Å; K70-D74 PolarHBondContact O-N 3.37Å
71	L	61.7	Low	53.3	Low	20 Å²	20	86.3 Å²	86.3	11%	0.105	44%	0.444	C	S	.	.	H	α-helix	trans	-56.1	-40.2	175.6	-70.5	162.4	0	0	0	111	M67 M68 F75 K164 L168	M67-L71 HydrophobicContact CG-CD1 3.94Å; M67-L71 HydrophobicContact CG-CG 4.37Å; M67-L71 WeakPolarHBondContact O-CB 3.33Å; M67-L71 WeakPolarHBondContact O-CD1 3.28Å; M67-L71 WeakPolarHBondContact O-CG 3.42Å; M67-L71 PolarHBondContact O-N 3.02Å; M68-L71 WeakPolarHBondContact O-CB 3.35Å; M68-L71 PolarHBondContact O-N 3.14Å; M68-L71 VanDerWaalsContact O-N 3.12Å; L71-F75 WeakPolarHBondContact O-CD2 3.23Å; L71-K164 HydrophobicContact CD2-CD 4.45Å; L71-L168 HydrophobicContact CD2-CD2 3.41Å; L71-L168 VanDerWaalsContact CD2-CD2 3.41Å
72	V	51.6	Low	52.7	Low	31 Å²	31	93.2 Å²	93.2	19%	0.188	48%	0.479	C	S	.	.	H	α-helix	trans	-70.9	-44.8	176.9	173.5	0	0	0	0	111.9	M68 T69 K70 D74 F75 Q76	M68-V72 VanDerWaalsContact O-CG2 3.29Å; M68-V72 WeakPolarHBondContact O-CG2 3.44Å; M68-V72 PolarHBondContact O-N 2.65Å; T69-V72 PolarHBondContact O-N 3.45Å; K70-V72 PolarHBondContact O-N 2.77Å; V72-D74 VanDerWaalsContact C-N 3.29Å; V72-D74 PolarHBondContact O-N 3.49Å; V72-F75 PolarHBondContact O-N 2.98Å; V72-F75 VanDerWaalsContact O-N 3.13Å; V72-Q76 PolarHBondContact O-N 3.15Å; V72-Q76 VanDerWaalsContact O-N 3.15Å
73	S	55.6	Low	52.1	Low	51 Å²	51	98.2 Å²	98.2	36%	0.357	50%	0.498	S	S	.	.	H	α-helix	trans	-59	-38.1	177.9	-62	0	0	0	0	112.7	T69 K70 F75 Q76 R77	T69-S73 VanDerWaalsContact O-CB 3.31Å; T69-S73 WeakPolarHBondContact O-CB 3.05Å; T69-S73 PolarHBondContact O-N 3.14Å; T69-S73 PolarHBondContact O-OG 2.85Å; K70-S73 PolarHBondContact O-N 3.48Å; S73-F75 VanDerWaalsContact C-N 3.27Å; S73-F75 PolarHBondContact O-N 3Å; S73-Q76 PolarHBondContact O-N 3.24Å; S73-R77 PolarHBondContact O-N 3.13Å
74	D	52	Low	52	Low	88 Å²	88	100.8 Å²	100.8	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-67	-27	179.8	-72	-24.3	0	0	0	112.3	K70 V72	K70-D74 PolarHBondContact O-N 3.37Å; V72-D74 VanDerWaalsContact C-N 3.29Å; V72-D74 PolarHBondContact O-N 3.49Å
75	F	47.1	Very low	51.5	Low	91 Å²	91	105.6 Å²	105.6	40%	0.399	55%	0.549	S	S	.	.	H	α-helix	trans	-83.4	-29.8	172.1	-68.7	-66.7	0	0	0	113.3	L71 V72 S73 R77 L168 R170	L71-F75 WeakPolarHBondContact O-CD2 3.23Å; V72-F75 PolarHBondContact O-N 2.98Å; V72-F75 VanDerWaalsContact O-N 3.13Å; S73-F75 VanDerWaalsContact C-N 3.27Å; S73-F75 PolarHBondContact O-N 3Å; F75-R77 VanDerWaalsContact C-N 3.34Å; F75-R77 PolarHBondContact O-N 2.86Å; F75-L168 HydrophobicContact CE2-CD2 4.31Å; F75-L168 HydrophobicContact CE2-CG 4.46Å; F75-L168 HydrophobicContact CZ-CD2 4.3Å; F75-L168 HydrophobicContact CZ-CG 4.25Å; F75-R170 HydrophobicContact CD2-CB 4.43Å; F75-R170 HydrophobicContact CE2-CB 4.46Å
76	Q	46.2	Very low	50.8	Low	125 Å²	125	103 Å²	103	58%	0.584	55%	0.553	S	S	*	*	H	α-helix	trans	-74	-17.3	-179	-84.1	171.7	-53.8	0	0	114.6	V72 S73 H78 S79	V72-Q76 PolarHBondContact O-N 3.15Å; V72-Q76 VanDerWaalsContact O-N 3.15Å; S73-Q76 PolarHBondContact O-N 3.24Å; Q76-H78 PolarHBondContact O-N 3.38Å; Q76-S79 PolarHBondContact O-N 3.34Å
77	R	41.6	Very low	49.9	Very low	207 Å²	207	101.9 Å²	101.9	78%	0.781	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-6.3	177.5	-72.9	-174.5	-177.1	-138.9	-1.2	115.9	S73 F75	S73-R77 PolarHBondContact O-N 3.13Å; F75-R77 VanDerWaalsContact C-N 3.34Å; F75-R77 PolarHBondContact O-N 2.86Å
78	H	39.2	Very low	49.2	Very low	170 Å²	170	103.6 Å²	103.6	79%	0.787	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	0.9	175.9	-66	98.7	0	0	0	114.6	Q76	Q76-H78 PolarHBondContact O-N 3.38Å
79	S	37	Very low	48.9	Very low	101 Å²	101	104.7 Å²	104.7	71%	0.706	59%	0.587	S	S	*	*	S	Bend	trans	-141.4	88.5	-179.6	-64.4	0	0	0	0	111.3	Q76	Q76-S79 PolarHBondContact O-N 3.34Å
80	I	40.4	Very low	49.2	Very low	171 Å²	171	109.4 Å²	109.4	88%	0.877	60%	0.604	S	S	*	*			trans	-81.3	115.2	177.6	34.6	167.8	0	0	0	112.6
81	S	40.6	Very low	50.3	Low	97 Å²	97	108.7 Å²	108.7	68%	0.678	60%	0.602	S	S	*	*			trans	-166.2	129.7	136.1	54.3	0	0	0	0	109.6	D83	S81-D83 PolarHBondContact O-N 2.88Å
82	D	46.6	Very low	51.5	Low	178 Å²	178	108.6 Å²	108.6	95%	0.952	60%	0.601	S	S	*	*			trans	-74.1	61.9	173.8	-70.4	-51.5	0	0	0	111.2	D84	D82-D84 VanDerWaalsContact C-N 3.33Å; D82-D84 PolarHBondContact O-N 3.22Å; D82-D84 VanDerWaalsContact O-N 3.11Å
83	D	47	Very low	53.2	Low	140 Å²	140	108.6 Å²	108.6	75%	0.749	60%	0.604	S	S	*	*			trans	-82.1	87.3	169.6	-122.5	-11.5	0	0	0	108.5	S81 S85	S81-D83 PolarHBondContact O-N 2.88Å; D83-S85 PolarHBondContact O-N 2.84Å; D83-S85 VanDerWaalsContact O-N 3.07Å
84	D	53.5	Low	54.8	Low	144 Å²	144	107.9 Å²	107.9	77%	0.77	59%	0.593	S	S	*	*			trans	-59.3	105.5	168	-179.8	16	0	0	0	109.4	D82 G86	D82-D84 VanDerWaalsContact C-N 3.33Å; D82-D84 PolarHBondContact O-N 3.22Å; D82-D84 VanDerWaalsContact O-N 3.11Å; D84-G86 PolarHBondContact OD1-N 3.1Å
85	S	49.7	Very low	56.7	Low	108 Å²	108	105 Å²	105	76%	0.755	58%	0.579	S	S	*	*			trans	-132.3	59	167.4	-73.1	0	0	0	0	108.7	D83 C87	D83-S85 PolarHBondContact O-N 2.84Å; D83-S85 VanDerWaalsContact O-N 3.07Å; S85-C87 PolarHBondContact O-N 3.04Å; S85-C87 VanDerWaalsContact O-N 3.12Å
86	G	45.3	Very low	58.7	Low	62 Å²	62	100.8 Å²	100.8	64%	0.639	56%	0.561	S	S	*	*			trans	-59.9	108.2	168.4	0	0	0	0	0	111.9	D84	D84-G86 PolarHBondContact OD1-N 3.1Å
87	C	45.2	Very low	60.7	Low	107 Å²	107	98 Å²	98	72%	0.723	55%	0.553	S	S	*	*				-170.7	107.8	119.7	-104.4	0	0	0	0	108.4	S85 S89	S85-C87 PolarHBondContact O-N 3.04Å; S85-C87 VanDerWaalsContact O-N 3.12Å; C87-S89 PolarHBondContact O-N 3.3Å
88	A	48.7	Very low	62.8	Low	57 Å²	57	92.1 Å²	92.1	47%	0.471	56%	0.558	S	S	.	*			trans	-59.4	120.6	151.1	0	0	0	0	0	105.6	E90 V95	A88-E90 PolarHBondContact O-N 3.34Å; A88-V95 HydrophobicContact CB-CG1 4.48Å; A88-V95 HydrophobicContact CB-CG2 3.98Å
89	S	56.4	Low	65.1	Low	40 Å²	40	85.3 Å²	85.3	28%	0.28	53%	0.527	S	S	.	.			trans	-48.7	128.2	-179.8	21.8	0	0	0	0	109.3	C87 E91 Y92	C87-S89 PolarHBondContact O-N 3.3Å; S89-E91 PolarHBondContact O-N 3.31Å; S89-Y92 PolarHBondContact O-N 2.7Å; S89-Y92 VanDerWaalsContact OG-CD2 3.3Å; S89-Y92 WeakPolarHBondContact OG-CD2 3.35Å
90	E	65.6	Low	67.6	Low	183 Å²	183	87 Å²	87	86%	0.855	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-15.5	-169.7	-58.9	-178.5	145.4	0	0	114.2	A88	A88-E90 PolarHBondContact O-N 3.34Å
91	E	84.4	Confident	69.9	Low	112 Å²	112	83 Å²	83	52%	0.523	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-25.6	176.7	-152.3	-168.6	-176.2	0	0	114.6	S89 Y118 V119	S89-E91 PolarHBondContact O-N 3.31Å; E91-Y118 HydrophobicContact CG-CD1 3.86Å; E91-Y118 HydrophobicContact CG-CE1 4.15Å; E91-Y118 CarbonylContact O-C 3.53Å; E91-Y118 VanDerWaalsContact O-CA 3.25Å; E91-Y118 WeakPolarHBondContact O-CA 3.19Å; E91-V119 PolarHBondContact O-N 2.98Å
92	Y	88.2	Confident	72.3	Confident	17 Å²	17	84.3 Å²	84.3	7%	0.067	50%	0.502	C	S	.	.	B	Isolated β-bridge	trans	-115.7	130.7	-171.5	-57.5	-96.9	0	0	0	113.4	S89 W94 V95 F108 V116 P117 Y118	S89-Y92 PolarHBondContact O-N 2.7Å; S89-Y92 VanDerWaalsContact OG-CD2 3.3Å; S89-Y92 WeakPolarHBondContact OG-CD2 3.35Å; Y92-W94 PolarHBondContact O-N 3.2Å; Y92-V95 HydrophobicContact CD2-CG1 4.5Å; Y92-V95 HydrophobicContact CG-CG1 4.19Å; Y92-F108 AromaticContact CD1-CD2 3.7Å; Y92-F108 HydrophobicContact CD1-CD2 3.7Å; Y92-F108 AromaticContact CD1-CE2 3.54Å; Y92-F108 HydrophobicContact CD1-CE2 3.54Å; Y92-F108 HydrophobicContact CD1-CG 4.48Å; Y92-F108 HydrophobicContact CD1-CZ 4.24Å; Y92-F108 HydrophobicContact CE1-CB 4.45Å; Y92-F108 AromaticContact CE1-CD2 3.4Å; Y92-F108 HydrophobicContact CE1-CD2 3.4Å; Y92-F108 VanDerWaalsContact CE1-CD2 3.4Å; Y92-F108 AromaticContact CE1-CE2 3.78Å; Y92-F108 HydrophobicContact CE1-CE2 3.78Å; Y92-F108 HydrophobicContact CE1-CG 4.04Å; Y92-F108 HydrophobicContact CG-CE2 4.24Å; Y92-V116 HydrophobicContact CD1-CG1 4.17Å; Y92-V116 HydrophobicContact CE1-CG1 3.73Å; Y92-P117 CarbonylContact C-O 3.54Å; Y92-P117 WeakPolarHBondContact CA-O 3.27Å; Y92-Y118 HydrophobicContact CD1-CD1 4.01Å; Y92-Y118 HydrophobicContact CD1-CE1 4.14Å; Y92-Y118 AromaticContact CE1-CD1 3.73Å; Y92-Y118 HydrophobicContact CE1-CD1 3.73Å; Y92-Y118 AromaticContact CE1-CE1 3.38Å; Y92-Y118 HydrophobicContact CE1-CE1 3.38Å; Y92-Y118 HydrophobicContact CE2-CE1 4.33Å; Y92-Y118 AromaticContact CZ-CE1 3.48Å; Y92-Y118 VanDerWaalsContact CZ-CE1 3.48Å; Y92-Y118 WeakPolarHBondContact OH-CE1 3.4Å
93	A	87.3	Confident	74.5	Confident	31 Å²	31	77.8 Å²	77.8	26%	0.256	47%	0.466	S	S	.	.	S	Bend	trans	-71.6	-13.1	174.1	0	0	0	0	0	113.7	P117 V119 E124	A93-P117 WeakPolarHBondContact CB-O 3.43Å; A93-P117 PolarHBondContact N-O 2.76Å; A93-V119 HydrophobicContact CB-CG2 4.28Å; A93-E124 HydrophobicContact CB-CB 4.17Å; A93-E124 HydrophobicContact CB-CG 3.76Å; A93-E124 WeakPolarHBondContact CB-OE1 3.21Å
94	W	89.6	Confident	76.6	Confident	36 Å²	36	71.5 Å²	71.5	14%	0.136	43%	0.432	C	S	.	.			trans	-163.5	143.7	172.1	179.2	91.5	0	0	0	111.2	Y92 P96 F108 R127 D226 L227	Y92-W94 PolarHBondContact O-N 3.2Å; W94-P96 HydrophobicContact CH2-CB 4.07Å; W94-P96 HydrophobicContact CH2-CG 3.8Å; W94-P96 HydrophobicContact CZ3-CB 4.5Å; W94-P96 HydrophobicContact CZ3-CG 3.77Å; W94-F108 HydrophobicContact CE3-CZ 4.31Å; W94-F108 HydrophobicContact CZ3-CZ 4.49Å; W94-F108 WeakPolarHBondContact O-CZ 3.43Å; W94-R127 VanDerWaalsContact CB-NE 3.34Å; W94-R127 VanDerWaalsContact CD1-NH2 3.28Å; W94-D226 VanDerWaalsContact CD1-OD2 3.31Å; W94-D226 VanDerWaalsContact CZ2-CA 3.49Å; W94-D226 HydrophobicContact CZ2-CB 3.9Å; W94-D226 VanDerWaalsContact NE1-CG 3.3Å; W94-D226 PolarHBondContact NE1-OD2 3.45Å; W94-L227 HydrophobicContact CH2-CD1 4Å; W94-L227 HydrophobicContact CH2-CG 3.96Å
95	V	90.6	Very high	78.4	Confident	29 Å²	29	71.8 Å²	71.8	18%	0.176	42%	0.424	C	S	.	.			trans	-132.3	150.6	173.2	-56.6	0	0	0	0	110.2	A88 Y92 V104 F108	A88-V95 HydrophobicContact CB-CG1 4.48Å; A88-V95 HydrophobicContact CB-CG2 3.98Å; Y92-V95 HydrophobicContact CD2-CG1 4.5Å; Y92-V95 HydrophobicContact CG-CG1 4.19Å; V95-V104 HydrophobicContact CB-CG1 4.18Å; V95-V104 HydrophobicContact CB-CG2 4.28Å; V95-V104 HydrophobicContact CG1-CG1 3.77Å; V95-F108 HydrophobicContact CG1-CE2 4.28Å
96	P	90.5	Very high	80.5	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.013	41%	0.408	C	S	.	.			trans	-61	136	170.3	-19	30.2	0	0	0	111.1	W94 L99 Y107 V173 L227	W94-P96 HydrophobicContact CH2-CB 4.07Å; W94-P96 HydrophobicContact CH2-CG 3.8Å; W94-P96 HydrophobicContact CZ3-CB 4.5Å; W94-P96 HydrophobicContact CZ3-CG 3.77Å; P96-L99 HydrophobicContact CB-CD1 3.76Å; P96-L99 HydrophobicContact CB-CG 4.24Å; P96-L99 HydrophobicContact CG-CD1 3.91Å; P96-Y107 HydrophobicContact CG-CD1 3.64Å; P96-Y107 HydrophobicContact CG-CD2 4.23Å; P96-Y107 HydrophobicContact CG-CE1 3.66Å; P96-Y107 HydrophobicContact CG-CE2 4.22Å; P96-Y107 HydrophobicContact CG-CG 3.94Å; P96-V173 HydrophobicContact CB-CB 4.06Å; P96-V173 HydrophobicContact CB-CG2 3.6Å; P96-V173 HydrophobicContact CG-CG2 4.02Å; P96-L227 HydrophobicContact CB-CD1 4.12Å
97	P	87.2	Confident	82.9	Confident	65 Å²	65	68.7 Å²	68.7	42%	0.422	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	146.5	-176.5	32	-38.8	0	0	0	112
98	G	85.6	Confident	85.3	Confident	85 Å²	85	64 Å²	64	88%	0.876	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	11.3	174.3	0	0	0	0	0	115.4
99	L	88.3	Confident	87.4	Confident	27 Å²	27	64.9 Å²	64.9	14%	0.141	35%	0.35	C	S	.	.			trans	-94.5	146.8	173.5	-64.6	-172.6	0	0	0	112	P96 Q103 V104 V173	P96-L99 HydrophobicContact CB-CD1 3.76Å; P96-L99 HydrophobicContact CB-CG 4.24Å; P96-L99 HydrophobicContact CG-CD1 3.91Å; L99-Q103 HydrophobicContact CB-CB 4.12Å; L99-Q103 HydrophobicContact CD2-CB 4.15Å; L99-V104 HydrophobicContact CB-CG2 3.74Å; L99-V104 HydrophobicContact CD1-CG2 4.3Å; L99-V173 HydrophobicContact CD1-CB 4.09Å; L99-V173 HydrophobicContact CD1-CG1 3.87Å; L99-V173 HydrophobicContact CD2-CB 4.1Å; L99-V173 HydrophobicContact CD2-CG1 4.05Å; L99-V173 WeakPolarHBondContact CD2-O 3.4Å; L99-V173 HydrophobicContact CG-CB 4.35Å; L99-V173 HydrophobicContact CG-CG1 4.46Å
100	K	90	Very high	89.2	Confident	135 Å²	135	65.3 Å²	65.3	59%	0.587	35%	0.353	S	S	*	.			trans	-76.7	157.1	165.8	-61.2	-174.3	177.5	-172.1	0	111	E102 Q103 V104	K100-E102 VanDerWaalsContact C-N 3.26Å; K100-E102 PolarHBondContact O-N 2.86Å; K100-E102 VanDerWaalsContact O-N 3.15Å; K100-Q103 HydrophobicContact CB-CG 4.27Å; K100-Q103 WeakPolarHBondContact O-CA 3.36Å; K100-Q103 WeakPolarHBondContact O-CB 3.17Å; K100-Q103 PolarHBondContact O-N 3.49Å; K100-V104 PolarHBondContact O-N 3.05Å
101	P	88.6	Confident	90.6	Very high	88 Å²	88	57.6 Å²	57.6	57%	0.571	32%	0.317	S	S	*	.	H	α-helix	trans	-51.5	-40.4	-178.9	-29.1	36.9	0	0	0	114.5	Q103 V104 Y105	P101-Q103 VanDerWaalsContact C-N 3.31Å; P101-Q103 PolarHBondContact O-N 3.09Å; P101-V104 WeakPolarHBondContact O-CB 3.32Å; P101-V104 PolarHBondContact O-N 3.35Å; P101-Y105 PolarHBondContact O-N 2.91Å; P101-Y105 VanDerWaalsContact O-N 3.13Å
102	E	89.5	Confident	91	Very high	125 Å²	125	55.1 Å²	55.1	58%	0.584	31%	0.311	S	S	*	.	H	α-helix	trans	-67.6	-33.5	178.7	-53.2	73.7	-159.1	0	0	111.8	K100 Y105 Q106	K100-E102 VanDerWaalsContact C-N 3.26Å; K100-E102 PolarHBondContact O-N 2.86Å; K100-E102 VanDerWaalsContact O-N 3.15Å; E102-Y105 PolarHBondContact O-N 3.11Å; E102-Q106 VanDerWaalsContact O-CG 3.32Å; E102-Q106 WeakPolarHBondContact O-CG 3.42Å; E102-Q106 PolarHBondContact O-N 3.41Å
103	Q	92.9	Very high	91.2	Very high	41 Å²	41	62.1 Å²	62.1	19%	0.192	34%	0.344	C	S	.	.	H	α-helix	trans	-76.2	-30.6	177.1	-61.8	171.8	-24.4	0	0	111.8	L99 K100 P101 Q106 Y107 P175 I197	L99-Q103 HydrophobicContact CB-CB 4.12Å; L99-Q103 HydrophobicContact CD2-CB 4.15Å; K100-Q103 HydrophobicContact CB-CG 4.27Å; K100-Q103 WeakPolarHBondContact O-CA 3.36Å; K100-Q103 WeakPolarHBondContact O-CB 3.17Å; K100-Q103 PolarHBondContact O-N 3.49Å; P101-Q103 VanDerWaalsContact C-N 3.31Å; P101-Q103 PolarHBondContact O-N 3.09Å; Q103-Q106 PolarHBondContact O-N 3.24Å; Q103-Y107 WeakPolarHBondContact O-CB 3.34Å; Q103-Y107 PolarHBondContact O-N 3Å; Q103-P175 HydrophobicContact CG-CG 4.46Å; Q103-I197 HydrophobicContact CB-CD1 4.11Å; Q103-I197 HydrophobicContact CG-CD1 4.4Å
104	V	92.3	Very high	91.5	Very high	7 Å²	7	65.2 Å²	65.2	4%	0.042	36%	0.356	C	S	.	.	H	α-helix	trans	-62.6	-45.7	170.6	174.5	0	0	0	0	109.9	V95 L99 K100 P101 Y107 F108	V95-V104 HydrophobicContact CB-CG1 4.18Å; V95-V104 HydrophobicContact CB-CG2 4.28Å; V95-V104 HydrophobicContact CG1-CG1 3.77Å; L99-V104 HydrophobicContact CB-CG2 3.74Å; L99-V104 HydrophobicContact CD1-CG2 4.3Å; K100-V104 PolarHBondContact O-N 3.05Å; P101-V104 WeakPolarHBondContact O-CB 3.32Å; P101-V104 PolarHBondContact O-N 3.35Å; V104-Y107 PolarHBondContact O-N 3.36Å; V104-F108 HydrophobicContact CG1-CD2 3.69Å; V104-F108 HydrophobicContact CG1-CE2 3.64Å; V104-F108 WeakPolarHBondContact O-CD2 3.31Å; V104-F108 PolarHBondContact O-N 3.36Å
105	Y	91.8	Very high	91.7	Very high	151 Å²	151	66.6 Å²	66.6	59%	0.592	36%	0.362	S	S	*	.	H	α-helix	trans	-61	-46.2	174.1	-177.3	-96	0	0	0	112.3	P101 E102 Y107 F108 S109	P101-Y105 PolarHBondContact O-N 2.91Å; P101-Y105 VanDerWaalsContact O-N 3.13Å; E102-Y105 PolarHBondContact O-N 3.11Å; Y105-Y107 VanDerWaalsContact C-N 3.29Å; Y105-Y107 PolarHBondContact O-N 2.92Å; Y105-F108 PolarHBondContact O-N 3.12Å; Y105-S109 WeakPolarHBondContact O-CB 3.48Å; Y105-S109 PolarHBondContact O-N 3.04Å; Y105-S109 PolarHBondContact O-OG 2.9Å
106	Q	93.1	Very high	92	Very high	89 Å²	89	65.4 Å²	65.4	42%	0.416	36%	0.355	S	S	.	.	H	α-helix	trans	-61.2	-33.2	175.5	-72.6	172.7	-15.4	0	0	113.5	E102 Q103 S109 C110 I197	E102-Q106 VanDerWaalsContact O-CG 3.32Å; E102-Q106 WeakPolarHBondContact O-CG 3.42Å; E102-Q106 PolarHBondContact O-N 3.41Å; Q103-Q106 PolarHBondContact O-N 3.24Å; Q106-S109 PolarHBondContact O-OG 3.26Å; Q106-C110 PolarHBondContact O-SG 3.19Å; Q106-I197 HydrophobicContact CB-CD1 4.46Å; Q106-I197 HydrophobicContact CB-CG1 3.63Å
107	Y	95.1	Very high	92.1	Very high	16 Å²	16	65.6 Å²	65.6	6%	0.063	36%	0.355	C	S	.	.	H	α-helix	trans	-68.9	-47.5	174.9	174.1	-94.7	0	0	0	111.5	P96 Q103 V104 Y105 C110 L111 V173 I197 V199 P212	P96-Y107 HydrophobicContact CG-CD1 3.64Å; P96-Y107 HydrophobicContact CG-CD2 4.23Å; P96-Y107 HydrophobicContact CG-CE1 3.66Å; P96-Y107 HydrophobicContact CG-CE2 4.22Å; P96-Y107 HydrophobicContact CG-CG 3.94Å; Q103-Y107 WeakPolarHBondContact O-CB 3.34Å; Q103-Y107 PolarHBondContact O-N 3Å; V104-Y107 PolarHBondContact O-N 3.36Å; Y105-Y107 VanDerWaalsContact C-N 3.29Å; Y105-Y107 PolarHBondContact O-N 2.92Å; Y107-C110 WeakPolarHBondContact O-CB 3.41Å; Y107-C110 PolarHBondContact O-N 3.49Å; Y107-L111 HydrophobicContact CE1-CD1 3.97Å; Y107-V173 HydrophobicContact CD2-CG1 3.68Å; Y107-V173 HydrophobicContact CD2-CG2 4.1Å; Y107-V173 HydrophobicContact CE2-CG1 4.28Å; Y107-V173 HydrophobicContact CE2-CG2 3.91Å; Y107-V173 HydrophobicContact CG-CG1 4.47Å; Y107-I197 HydrophobicContact CD2-CG2 3.96Å; Y107-V199 HydrophobicContact CE2-CG2 4.24Å; Y107-P212 HydrophobicContact CD2-CB 3.89Å; Y107-P212 HydrophobicContact CD2-CG 3.78Å; Y107-P212 HydrophobicContact CE2-CB 3.67Å; Y107-P212 HydrophobicContact CE2-CG 3.99Å
108	F	95.4	Very high	92.3	Very high	8 Å²	8	65.6 Å²	65.6	4%	0.035	35%	0.348	C	S	.	.	H	α-helix	trans	-76.2	-28.2	-176.5	-73.8	-56.6	0	0	0	114.1	Y92 W94 V95 V104 Y105 C110 L111 V116 P117	Y92-F108 AromaticContact CD1-CD2 3.7Å; Y92-F108 HydrophobicContact CD1-CD2 3.7Å; Y92-F108 AromaticContact CD1-CE2 3.54Å; Y92-F108 HydrophobicContact CD1-CE2 3.54Å; Y92-F108 HydrophobicContact CD1-CG 4.48Å; Y92-F108 HydrophobicContact CD1-CZ 4.24Å; Y92-F108 HydrophobicContact CE1-CB 4.45Å; Y92-F108 AromaticContact CE1-CD2 3.4Å; Y92-F108 HydrophobicContact CE1-CD2 3.4Å; Y92-F108 VanDerWaalsContact CE1-CD2 3.4Å; Y92-F108 AromaticContact CE1-CE2 3.78Å; Y92-F108 HydrophobicContact CE1-CE2 3.78Å; Y92-F108 HydrophobicContact CE1-CG 4.04Å; Y92-F108 HydrophobicContact CG-CE2 4.24Å; W94-F108 HydrophobicContact CE3-CZ 4.31Å; W94-F108 HydrophobicContact CZ3-CZ 4.49Å; W94-F108 WeakPolarHBondContact O-CZ 3.43Å; V95-F108 HydrophobicContact CG1-CE2 4.28Å; V104-F108 HydrophobicContact CG1-CD2 3.69Å; V104-F108 HydrophobicContact CG1-CE2 3.64Å; V104-F108 WeakPolarHBondContact O-CD2 3.31Å; V104-F108 PolarHBondContact O-N 3.36Å; Y105-F108 PolarHBondContact O-N 3.12Å; F108-C110 PolarHBondContact O-N 2.76Å; F108-C110 VanDerWaalsContact O-N 3.16Å; F108-L111 HydrophobicContact CD1-CD1 4Å; F108-L111 HydrophobicContact CE1-CD1 4.36Å; F108-L111 PolarHBondContact O-N 3.25Å; F108-V116 HydrophobicContact CB-CG1 3.95Å; F108-V116 HydrophobicContact CB-CG2 4.21Å; F108-V116 HydrophobicContact CD1-CB 4.49Å; F108-V116 HydrophobicContact CD1-CG1 3.86Å; F108-V116 HydrophobicContact CD1-CG2 4.31Å; F108-V116 HydrophobicContact CD2-CG1 4.49Å; F108-V116 HydrophobicContact CG-CG1 3.87Å; F108-P117 HydrophobicContact CE1-CG 3.83Å; F108-P117 HydrophobicContact CZ-CG 3.8Å
109	S	93.9	Very high	92.4	Very high	76 Å²	76	64.8 Å²	64.8	53%	0.531	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-15.8	172.8	66.3	0	0	0	0	113.6	Y105 Q106 L111	Y105-S109 WeakPolarHBondContact O-CB 3.48Å; Y105-S109 PolarHBondContact O-N 3.04Å; Y105-S109 PolarHBondContact O-OG 2.9Å; Q106-S109 PolarHBondContact O-OG 3.26Å; S109-L111 VanDerWaalsContact C-N 3.34Å
110	C	93.4	Very high	92.3	Very high	48 Å²	48	70.3 Å²	70.3	32%	0.324	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-3.5	172.6	-62.1	0	0	0	0	113.3	Q106 Y107 F108 P212	Q106-C110 PolarHBondContact O-SG 3.19Å; Y107-C110 WeakPolarHBondContact O-CB 3.41Å; Y107-C110 PolarHBondContact O-N 3.49Å; F108-C110 PolarHBondContact O-N 2.76Å; F108-C110 VanDerWaalsContact O-N 3.16Å; C110-P212 HydrophobicContact CB-CB 3.93Å; C110-P212 HydrophobicContact CB-CG 3.92Å
111	L	94.6	Very high	92.3	Very high	21 Å²	21	64.8 Å²	64.8	11%	0.11	33%	0.333	C	S	.	.	S	Bend	trans	-111.6	153.7	-178.6	-57.6	-171.1	0	0	0	111.5	Y107 F108 S109 V116 P212 Q213 L223	Y107-L111 HydrophobicContact CE1-CD1 3.97Å; F108-L111 HydrophobicContact CD1-CD1 4Å; F108-L111 HydrophobicContact CE1-CD1 4.36Å; F108-L111 PolarHBondContact O-N 3.25Å; S109-L111 VanDerWaalsContact C-N 3.34Å; L111-V116 HydrophobicContact CB-CG2 4.32Å; L111-P212 HydrophobicContact CD2-CB 3.93Å; L111-Q213 HydrophobicContact CD2-CB 4.29Å; L111-L223 HydrophobicContact CD1-CD1 4.33Å; L111-L223 HydrophobicContact CD2-CD1 4.05Å
112	P	94.3	Very high	92.4	Very high	61 Å²	61	65.2 Å²	65.2	40%	0.396	34%	0.336	S	S	.	.			trans	-58.2	136.6	169	-24.6	35.8	0	0	0	111.9	D114 R115 V116	P112-D114 VanDerWaalsContact C-N 3.26Å; P112-D114 WeakPolarHBondContact CB-OD1 3.5Å; P112-D114 PolarHBondContact O-N 2.85Å; P112-R115 HydrophobicContact CB-CG 4.23Å; P112-R115 WeakPolarHBondContact O-CA 3.37Å; P112-R115 WeakPolarHBondContact O-CB 3.38Å; P112-R115 PolarHBondContact O-N 2.86Å; P112-V116 PolarHBondContact O-N 2.68Å
113	E	92.2	Very high	92.5	Very high	164 Å²	164	59.3 Å²	59.3	77%	0.766	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-56.8	-36.9	-176.1	-171.5	179	179.5	0	0	112.7	R115 V116	E113-R115 PolarHBondContact O-N 2.88Å; E113-R115 VanDerWaalsContact O-N 3.11Å; E113-V116 PolarHBondContact O-N 3.13Å
114	D	93	Very high	92.3	Very high	95 Å²	95	59 Å²	59	51%	0.508	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-65.7	-10.5	175.9	69.1	-56.7	0	0	0	114.1	P112 G123	P112-D114 VanDerWaalsContact C-N 3.26Å; P112-D114 WeakPolarHBondContact CB-OD1 3.5Å; P112-D114 PolarHBondContact O-N 2.85Å; D114-G123 WeakPolarHBondContact O-CA 3.46Å; D114-G123 PolarHBondContact O-N 2.91Å
115	R	94.5	Very high	92.1	Very high	66 Å²	66	63.9 Å²	63.9	25%	0.249	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-112.4	-6	179.4	-57.3	-178.3	-178.7	-130.3	-5.3	113.4	P112 E113 Y126 E222	P112-R115 HydrophobicContact CB-CG 4.23Å; P112-R115 WeakPolarHBondContact O-CA 3.37Å; P112-R115 WeakPolarHBondContact O-CB 3.38Å; P112-R115 PolarHBondContact O-N 2.86Å; E113-R115 PolarHBondContact O-N 2.88Å; E113-R115 VanDerWaalsContact O-N 3.11Å; R115-Y126 HydrophobicContact CB-CD1 4.01Å; R115-Y126 HydrophobicContact CB-CE1 3.99Å; R115-Y126 HydrophobicContact CG-CD1 4.12Å; R115-Y126 HydrophobicContact CG-CE1 3.99Å; R115-Y126 HydrophobicContact CG-CE2 4.38Å; R115-Y126 HydrophobicContact CG-CG 4.4Å; R115-Y126 PolarHBondContact NH1-OH 3.09Å; R115-E222 IonicContact CZ-OE2 3.42Å; R115-E222 IonicContact NH1-OE2 2.66Å; R115-E222 PolarHBondContact NH1-OE2 3.32Å; R115-E222 IonicContact NH2-OE2 3.67Å
116	V	94.9	Very high	92.1	Very high	4 Å²	4	58.6 Å²	58.6	2%	0.024	30%	0.304	C	S	.	.	S	Bend	trans	-76.1	122.9	177.3	179.8	0	0	0	0	109.2	Y92 F108 L111 P112 E113 Y118 G123	Y92-V116 HydrophobicContact CD1-CG1 4.17Å; Y92-V116 HydrophobicContact CE1-CG1 3.73Å; F108-V116 HydrophobicContact CB-CG1 3.95Å; F108-V116 HydrophobicContact CB-CG2 4.21Å; F108-V116 HydrophobicContact CD1-CB 4.49Å; F108-V116 HydrophobicContact CD1-CG1 3.86Å; F108-V116 HydrophobicContact CD1-CG2 4.31Å; F108-V116 HydrophobicContact CD2-CG1 4.49Å; F108-V116 HydrophobicContact CG-CG1 3.87Å; L111-V116 HydrophobicContact CB-CG2 4.32Å; P112-V116 PolarHBondContact O-N 2.68Å; E113-V116 PolarHBondContact O-N 3.13Å; V116-Y118 HydrophobicContact CB-CD2 3.94Å; V116-Y118 HydrophobicContact CB-CE2 3.64Å; V116-Y118 HydrophobicContact CG1-CD1 4.36Å; V116-Y118 HydrophobicContact CG1-CD2 3.69Å; V116-Y118 HydrophobicContact CG1-CE1 4.08Å; V116-Y118 HydrophobicContact CG1-CE2 3.32Å; V116-Y118 HydrophobicContact CG1-CG 4.2Å; V116-Y118 PolarHBondContact O-N 3.41Å; V116-G123 WeakPolarHBondContact O-CA 3.4Å
117	P	92.7	Very high	92	Very high	5 Å²	5	56 Å²	56	3%	0.032	29%	0.291	C	S	.	.			trans	-81.5	58.2	-168.9	36	-37.7	0	0	0	112.5	Y92 A93 F108 R127	Y92-P117 CarbonylContact C-O 3.54Å; Y92-P117 WeakPolarHBondContact CA-O 3.27Å; A93-P117 WeakPolarHBondContact CB-O 3.43Å; A93-P117 PolarHBondContact N-O 2.76Å; F108-P117 HydrophobicContact CE1-CG 3.83Å; F108-P117 HydrophobicContact CZ-CG 3.8Å; P117-R127 HydrophobicContact CB-CB 4.33Å
118	Y	91.9	Very high	91.6	Very high	66 Å²	66	55.6 Å²	55.6	26%	0.259	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-63.6	144.5	170.2	-62.2	-70.4	0	0	0	110.7	E91 Y92 V116 N120 S121 E124	E91-Y118 HydrophobicContact CG-CD1 3.86Å; E91-Y118 HydrophobicContact CG-CE1 4.15Å; E91-Y118 CarbonylContact O-C 3.53Å; E91-Y118 VanDerWaalsContact O-CA 3.25Å; E91-Y118 WeakPolarHBondContact O-CA 3.19Å; Y92-Y118 HydrophobicContact CD1-CD1 4.01Å; Y92-Y118 HydrophobicContact CD1-CE1 4.14Å; Y92-Y118 AromaticContact CE1-CD1 3.73Å; Y92-Y118 HydrophobicContact CE1-CD1 3.73Å; Y92-Y118 AromaticContact CE1-CE1 3.38Å; Y92-Y118 HydrophobicContact CE1-CE1 3.38Å; Y92-Y118 HydrophobicContact CE2-CE1 4.33Å; Y92-Y118 AromaticContact CZ-CE1 3.48Å; Y92-Y118 VanDerWaalsContact CZ-CE1 3.48Å; Y92-Y118 WeakPolarHBondContact OH-CE1 3.4Å; V116-Y118 HydrophobicContact CB-CD2 3.94Å; V116-Y118 HydrophobicContact CB-CE2 3.64Å; V116-Y118 HydrophobicContact CG1-CD1 4.36Å; V116-Y118 HydrophobicContact CG1-CD2 3.69Å; V116-Y118 HydrophobicContact CG1-CE1 4.08Å; V116-Y118 HydrophobicContact CG1-CE2 3.32Å; V116-Y118 HydrophobicContact CG1-CG 4.2Å; V116-Y118 PolarHBondContact O-N 3.41Å; Y118-N120 PolarHBondContact O-N 2.86Å; Y118-S121 PolarHBondContact N-OG 3.05Å; Y118-S121 WeakPolarHBondContact O-CB 3.47Å; Y118-S121 PolarHBondContact O-N 2.9Å; Y118-S121 PolarHBondContact O-OG 3.36Å; Y118-E124 VanDerWaalsContact O-CB 3.32Å; Y118-E124 WeakPolarHBondContact O-CB 3.27Å
119	V	88.8	Confident	91.3	Very high	67 Å²	67	58.3 Å²	58.3	41%	0.406	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	130.7	-178.5	177.1	0	0	0	0	111	E91 A93 S121	E91-V119 PolarHBondContact O-N 2.98Å; A93-V119 HydrophobicContact CB-CG2 4.28Å; V119-S121 PolarHBondContact O-N 3.14Å
120	N	84.8	Confident	91.3	Very high	143 Å²	143	55.4 Å²	55.4	77%	0.765	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	13.6	-173	-60.9	-68.6	0	0	0	116.2	Y118 E124	Y118-N120 PolarHBondContact O-N 2.86Å; N120-E124 VanDerWaalsContact CA-OE2 3.23Å; N120-E124 WeakPolarHBondContact CA-OE2 3.46Å; N120-E124 PolarHBondContact N-OE2 3.38Å
121	S	90.1	Very high	91.1	Very high	19 Å²	19	53.1 Å²	53.1	13%	0.133	26%	0.264	C	S	.	.	S	Bend	trans	-90.3	168.8	-175.8	76.5	0	0	0	0	114.5	Y118 V119 G123 E124 R125	Y118-S121 PolarHBondContact N-OG 3.05Å; Y118-S121 WeakPolarHBondContact O-CB 3.47Å; Y118-S121 PolarHBondContact O-N 2.9Å; Y118-S121 PolarHBondContact O-OG 3.36Å; V119-S121 PolarHBondContact O-N 3.14Å; S121-G123 PolarHBondContact O-N 2.99Å; S121-G123 PolarHBondContact OG-N 3.02Å; S121-E124 PolarHBondContact O-N 2.82Å; S121-E124 PolarHBondContact OG-N 3.03Å; S121-R125 VanDerWaalsContact O-CG 3.32Å; S121-R125 WeakPolarHBondContact O-CG 3.47Å; S121-R125 PolarHBondContact O-N 2.78Å
122	P	90.5	Very high	90.8	Very high	97 Å²	97	53.1 Å²	53.1	63%	0.63	26%	0.264	S	S	*	.	H	α-helix	trans	-54.9	-35.5	166.9	-25.7	36.2	0	0	0	113.5	R125 Y126	P122-R125 PolarHBondContact O-N 2.99Å; P122-Y126 PolarHBondContact O-N 3.3Å
123	G	91.9	Very high	90.7	Very high	1 Å²	1	53 Å²	53	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-73.5	-31.5	-178.4	0	0	0	0	0	114	D114 V116 S121 R125 Y126 R127	D114-G123 WeakPolarHBondContact O-CA 3.46Å; D114-G123 PolarHBondContact O-N 2.91Å; V116-G123 WeakPolarHBondContact O-CA 3.4Å; S121-G123 PolarHBondContact O-N 2.99Å; S121-G123 PolarHBondContact OG-N 3.02Å; G123-R125 VanDerWaalsContact C-N 3.33Å; G123-Y126 PolarHBondContact O-N 3.46Å; G123-R127 PolarHBondContact O-N 2.8Å
124	E	89.5	Confident	90.8	Very high	34 Å²	34	45.3 Å²	45.3	16%	0.159	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-43.1	168.7	172.1	-179.7	-136.9	0	0	110.2	A93 Y118 N120 S121 Y126 R127 I128	A93-E124 HydrophobicContact CB-CB 4.17Å; A93-E124 HydrophobicContact CB-CG 3.76Å; A93-E124 WeakPolarHBondContact CB-OE1 3.21Å; Y118-E124 VanDerWaalsContact O-CB 3.32Å; Y118-E124 WeakPolarHBondContact O-CB 3.27Å; N120-E124 VanDerWaalsContact CA-OE2 3.23Å; N120-E124 WeakPolarHBondContact CA-OE2 3.46Å; N120-E124 PolarHBondContact N-OE2 3.38Å; S121-E124 PolarHBondContact O-N 2.82Å; S121-E124 PolarHBondContact OG-N 3.03Å; E124-Y126 PolarHBondContact O-N 2.91Å; E124-R127 WeakPolarHBondContact O-CB 3.45Å; E124-R127 PolarHBondContact O-N 3.05Å; E124-R127 VanDerWaalsContact O-N 3.12Å; E124-I128 HydrophobicContact CG-CD1 4.02Å; E124-I128 WeakPolarHBondContact O-CG1 3.47Å; E124-I128 PolarHBondContact O-N 2.86Å
125	R	87	Confident	90.8	Very high	111 Å²	111	41.6 Å²	41.6	42%	0.419	20%	0.202	S	C	.	.	H	α-helix	trans	-66.9	-38.5	179.3	-58.7	169.6	94.2	178.7	9.5	111.1	M27 S121 P122 G123 I128 K129	M27-R125 PolarHBondContact SD-NH2 3.04Å; S121-R125 VanDerWaalsContact O-CG 3.32Å; S121-R125 WeakPolarHBondContact O-CG 3.47Å; S121-R125 PolarHBondContact O-N 2.78Å; P122-R125 PolarHBondContact O-N 2.99Å; G123-R125 VanDerWaalsContact C-N 3.33Å; R125-I128 PolarHBondContact O-N 3.25Å; R125-K129 VanDerWaalsContact O-CB 3.32Å; R125-K129 WeakPolarHBondContact O-CB 3.24Å; R125-K129 PolarHBondContact O-N 2.07Å
126	Y	91.9	Very high	90.6	Very high	39 Å²	39	38.8 Å²	38.8	15%	0.153	19%	0.192	C	C	.	.	H	α-helix	trans	-58.4	-48.1	168.1	168.5	-93.3	0	0	0	111	R115 P122 G123 E124 I128 K129 Q130 E222	R115-Y126 HydrophobicContact CB-CD1 4.01Å; R115-Y126 HydrophobicContact CB-CE1 3.99Å; R115-Y126 HydrophobicContact CG-CD1 4.12Å; R115-Y126 HydrophobicContact CG-CE1 3.99Å; R115-Y126 HydrophobicContact CG-CE2 4.38Å; R115-Y126 HydrophobicContact CG-CG 4.4Å; R115-Y126 PolarHBondContact NH1-OH 3.09Å; P122-Y126 PolarHBondContact O-N 3.3Å; G123-Y126 PolarHBondContact O-N 3.46Å; E124-Y126 PolarHBondContact O-N 2.91Å; Y126-I128 PolarHBondContact O-N 3.38Å; Y126-K129 WeakPolarHBondContact O-CB 3.47Å; Y126-K129 PolarHBondContact O-N 3.3Å; Y126-Q130 HydrophobicContact CD1-CG 4.28Å; Y126-Q130 HydrophobicContact CD2-CG 4.22Å; Y126-Q130 HydrophobicContact CE1-CG 3.83Å; Y126-Q130 HydrophobicContact CE2-CG 3.77Å; Y126-Q130 HydrophobicContact CG-CG 4.45Å; Y126-Q130 WeakPolarHBondContact O-CG 3.35Å; Y126-Q130 PolarHBondContact O-N 3.12Å; Y126-E222 PolarHBondContact OH-OE2 2.82Å
127	R	91.8	Very high	90.2	Very high	34 Å²	34	39.8 Å²	39.8	13%	0.128	20%	0.201	C	C	.	.	H	α-helix	trans	-58.1	-48.5	176.3	176.6	-179.5	166.8	-103.5	-4.4	111.7	W94 P117 G123 E124 K129 Q130 L131 V225 D226	W94-R127 VanDerWaalsContact CB-NE 3.34Å; W94-R127 VanDerWaalsContact CD1-NH2 3.28Å; P117-R127 HydrophobicContact CB-CB 4.33Å; G123-R127 PolarHBondContact O-N 2.8Å; E124-R127 WeakPolarHBondContact O-CB 3.45Å; E124-R127 PolarHBondContact O-N 3.05Å; E124-R127 VanDerWaalsContact O-N 3.12Å; R127-K129 VanDerWaalsContact C-N 3.34Å; R127-K129 PolarHBondContact O-N 2.71Å; R127-Q130 CarbonylContact O-C 3.55Å; R127-Q130 PolarHBondContact O-N 2.7Å; R127-L131 HydrophobicContact CG-CD1 4.17Å; R127-L131 HydrophobicContact CG-CG 4.34Å; R127-L131 WeakPolarHBondContact O-CB 3.44Å; R127-L131 WeakPolarHBondContact O-CG 3.34Å; R127-L131 PolarHBondContact O-N 2.72Å; R127-V225 HydrophobicContact CG-CG2 4.14Å; R127-D226 IonicContact CZ-OD1 3.46Å; R127-D226 IonicContact CZ-OD2 3.95Å; R127-D226 IonicContact NE-OD1 2.71Å; R127-D226 PolarHBondContact NE-OD1 3.42Å; R127-D226 IonicContact NE-OD2 2.68Å; R127-D226 IonicContact NH2-OD1 2.77Å; R127-D226 PolarHBondContact NH2-OD1 3.47Å; R127-D226 IonicContact NH2-OD2 3.59Å; R127-D226 PolarHBondContact NH2-OD2 3.45Å
128	I	87.1	Confident	90.1	Very high	8 Å²	8	40.5 Å²	40.5	4%	0.041	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-42.5	178.7	-64.9	169.5	0	0	0	111	V57 V60 E124 R125 Y126 Q130 L131 L132	V57-I128 HydrophobicContact CB-CG2 4.32Å; V57-I128 HydrophobicContact CG1-CG2 4.01Å; V60-I128 HydrophobicContact CG2-CG1 4.1Å; E124-I128 HydrophobicContact CG-CD1 4.02Å; E124-I128 WeakPolarHBondContact O-CG1 3.47Å; E124-I128 PolarHBondContact O-N 2.86Å; R125-I128 PolarHBondContact O-N 3.25Å; Y126-I128 PolarHBondContact O-N 3.38Å; I128-Q130 PolarHBondContact O-N 3.43Å; I128-L131 WeakPolarHBondContact O-CB 3.17Å; I128-L131 PolarHBondContact O-N 3.23Å; I128-L132 HydrophobicContact CG2-CD1 4.26Å; I128-L132 WeakPolarHBondContact O-CG 3.43Å; I128-L132 PolarHBondContact O-N 3.3Å
129	K	89.3	Confident	90.2	Very high	65 Å²	65	37.6 Å²	37.6	28%	0.283	19%	0.193	S	C	.	.	H	α-helix	trans	-59	-45.5	173.1	169.7	157.3	-164.3	174.4	0	112.2	E53 E54 R125 Y126 R127 H133	E53-K129 HydrophobicContact CB-CB 4.39Å; E53-K129 HydrophobicContact CB-CD 4.28Å; E53-K129 HydrophobicContact CB-CG 3.93Å; E54-K129 IonicContact OE1-NZ 3.5Å; E54-K129 PolarHBondContact OE1-NZ 3Å; E54-K129 IonicContact OE2-NZ 3.46Å; E54-K129 PolarHBondContact OE2-NZ 2.97Å; R125-K129 VanDerWaalsContact O-CB 3.32Å; R125-K129 WeakPolarHBondContact O-CB 3.24Å; R125-K129 PolarHBondContact O-N 2.07Å; Y126-K129 WeakPolarHBondContact O-CB 3.47Å; Y126-K129 PolarHBondContact O-N 3.3Å; R127-K129 VanDerWaalsContact C-N 3.34Å; R127-K129 PolarHBondContact O-N 2.71Å; K129-H133 VanDerWaalsContact O-CB 3.28Å; K129-H133 WeakPolarHBondContact O-CB 3.43Å; K129-H133 PolarHBondContact O-N 3.06Å
130	Q	93	Very high	90.1	Very high	15 Å²	15	35.1 Å²	35.1	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-67.7	-36.1	175.9	-66.8	-57.7	-29.6	0	0	112.3	Y126 R127 I128 H133 Q134 V225	Y126-Q130 HydrophobicContact CD1-CG 4.28Å; Y126-Q130 HydrophobicContact CD2-CG 4.22Å; Y126-Q130 HydrophobicContact CE1-CG 3.83Å; Y126-Q130 HydrophobicContact CE2-CG 3.77Å; Y126-Q130 HydrophobicContact CG-CG 4.45Å; Y126-Q130 WeakPolarHBondContact O-CG 3.35Å; Y126-Q130 PolarHBondContact O-N 3.12Å; R127-Q130 CarbonylContact O-C 3.55Å; R127-Q130 PolarHBondContact O-N 2.7Å; I128-Q130 PolarHBondContact O-N 3.43Å; Q130-H133 PolarHBondContact O-N 3.39Å; Q130-Q134 WeakPolarHBondContact O-CA 3.17Å; Q130-Q134 WeakPolarHBondContact O-CB 3.28Å; Q130-Q134 VanDerWaalsContact O-CG 3.27Å; Q130-Q134 WeakPolarHBondContact O-CG 3.05Å; Q130-Q134 PolarHBondContact O-N 3.05Å; Q130-V225 HydrophobicContact CB-CB 4Å; Q130-V225 HydrophobicContact CB-CG2 3.9Å
131	L	90.1	Very high	90.2	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-59	-53	175.2	-77.9	173.2	0	0	0	111.4	V60 L64 M68 R127 I128 L135 V225	V60-L131 HydrophobicContact CG1-CD1 4.41Å; V60-L131 HydrophobicContact CG2-CD1 3.49Å; V60-L131 VanDerWaalsContact CG2-CD1 3.49Å; L64-L131 HydrophobicContact CD2-CB 3.98Å; M68-L131 HydrophobicContact CE-CD2 3.25Å; M68-L131 HydrophobicContact SD-CD2 3.6Å; R127-L131 HydrophobicContact CG-CD1 4.17Å; R127-L131 HydrophobicContact CG-CG 4.34Å; R127-L131 WeakPolarHBondContact O-CB 3.44Å; R127-L131 WeakPolarHBondContact O-CG 3.34Å; R127-L131 PolarHBondContact O-N 2.72Å; I128-L131 WeakPolarHBondContact O-CB 3.17Å; I128-L131 PolarHBondContact O-N 3.23Å; L131-L135 PolarHBondContact O-N 2.87Å; L131-L135 VanDerWaalsContact O-N 3.07Å; L131-V225 HydrophobicContact CB-CG2 4.47Å; L131-V225 HydrophobicContact CD2-CB 4.42Å; L131-V225 HydrophobicContact CD2-CG1 3.96Å; L131-V225 HydrophobicContact CD2-CG2 3.62Å; L131-V225 HydrophobicContact CG-CG2 3.63Å
132	L	87.9	Confident	90.2	Very high	21 Å²	21	31.5 Å²	31.5	11%	0.11	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-45.5	178.8	-68.5	171.8	0	0	0	112	E53 V57 P61 L64 I128	E53-L132 HydrophobicContact CG-CB 3.67Å; E53-L132 HydrophobicContact CG-CD1 4.05Å; V57-L132 HydrophobicContact CB-CD1 4.44Å; V57-L132 HydrophobicContact CG1-CD1 4.23Å; V57-L132 HydrophobicContact CG2-CD1 4.34Å; P61-L132 HydrophobicContact CG-CD2 3.95Å; L64-L132 HydrophobicContact CD2-CD2 4.15Å; I128-L132 HydrophobicContact CG2-CD1 4.26Å; I128-L132 WeakPolarHBondContact O-CG 3.43Å; I128-L132 PolarHBondContact O-N 3.3Å
133	H	92	Very high	90	Very high	58 Å²	58	33.2 Å²	33.2	27%	0.269	16%	0.156	S	C	.	.	H	α-helix	trans	-73	-45.3	-177.3	-177.6	74.4	0	0	0	113.2	K129 Q130 P136 R240	K129-H133 VanDerWaalsContact O-CB 3.28Å; K129-H133 WeakPolarHBondContact O-CB 3.43Å; K129-H133 PolarHBondContact O-N 3.06Å; Q130-H133 PolarHBondContact O-N 3.39Å; H133-P136 WeakPolarHBondContact O-CG 3.44Å; H133-R240 VanDerWaalsContact CE1-CD 3.43Å; H133-R240 WeakPolarHBondContact CE1-CD 3.24Å; H133-R240 WeakPolarHBondContact O-CB 3.28Å; H133-R240 VanDerWaalsContact O-CD 3.24Å; H133-R240 WeakPolarHBondContact O-CD 3.33Å
134	Q	94.7	Very high	89.8	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.009	17%	0.169	C	C	.	.	H	α-helix	trans	-79.4	-24.1	-175.2	-67.2	-170.5	31	0	0	113.3	Q130 L223 V225 C238 G239 R240	Q130-Q134 WeakPolarHBondContact O-CA 3.17Å; Q130-Q134 WeakPolarHBondContact O-CB 3.28Å; Q130-Q134 VanDerWaalsContact O-CG 3.27Å; Q130-Q134 WeakPolarHBondContact O-CG 3.05Å; Q130-Q134 PolarHBondContact O-N 3.05Å; Q134-L223 PolarHBondContact NE2-O 2.93Å; Q134-V225 HydrophobicContact CB-CG1 3.9Å; Q134-V225 HydrophobicContact CG-CG1 4.39Å; Q134-V225 VanDerWaalsContact OE1-N 3.16Å; Q134-C238 HydrophobicContact CB-CB 3.84Å; Q134-C238 HydrophobicContact CG-CB 3.78Å; Q134-G239 CarbonylContact O-C 3.53Å; Q134-G239 WeakPolarHBondContact O-CA 3.49Å; Q134-G239 PolarHBondContact O-N 2.91Å; Q134-G239 VanDerWaalsContact O-N 3.11Å; Q134-R240 PolarHBondContact O-N 2.9Å
135	L	91.8	Very high	89.8	Confident	18 Å²	18	35.9 Å²	35.9	9%	0.094	17%	0.167	C	C	.	.	S	Bend	trans	-132.1	64	-178.7	-61.5	167.8	0	0	0	111.1	L64 M68 L131 A137 V225 I228 F230	L64-L135 HydrophobicContact CD1-CB 4.23Å; M68-L135 HydrophobicContact CE-CD1 3.18Å; L131-L135 PolarHBondContact O-N 2.87Å; L131-L135 VanDerWaalsContact O-N 3.07Å; L135-A137 PolarHBondContact O-N 2.87Å; L135-V225 HydrophobicContact CD1-CG1 4.14Å; L135-I228 HydrophobicContact CD1-CB 4.3Å; L135-I228 HydrophobicContact CD1-CD1 3.91Å; L135-I228 HydrophobicContact CD1-CG2 4.06Å; L135-I228 HydrophobicContact CD2-CG2 4.04Å; L135-F230 HydrophobicContact CD2-CE2 4.26Å
136	P	90.6	Very high	89.8	Confident	6 Å²	6	32.7 Å²	32.7	4%	0.039	16%	0.159	C	C	.	.			trans	-61.9	130.9	-177.1	-18.5	31.8	0	0	0	111.1	H133 H138 D139 R240	H133-P136 WeakPolarHBondContact O-CG 3.44Å; P136-H138 PolarHBondContact O-N 3.49Å; P136-D139 WeakPolarHBondContact O-CB 2.92Å; P136-D139 PolarHBondContact O-N 3.27Å; P136-R240 HydrophobicContact CG-CB 4.43Å
137	A	87.9	Confident	89.2	Confident	25 Å²	25	36.7 Å²	36.7	21%	0.207	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-62.4	-31.8	-174.7	0	0	0	0	0	112.7	M67 L135 D139 S140 E141 Y144	M67-A137 HydrophobicContact CE-CB 4.47Å; L135-A137 PolarHBondContact O-N 2.87Å; A137-D139 VanDerWaalsContact C-N 3.26Å; A137-D139 PolarHBondContact O-N 3.12Å; A137-S140 PolarHBondContact O-N 3.07Å; A137-S140 VanDerWaalsContact O-N 3.15Å; A137-E141 PolarHBondContact O-N 2.83Å; A137-Y144 HydrophobicContact CB-CD2 3.48Å; A137-Y144 VanDerWaalsContact CB-CD2 3.48Å; A137-Y144 HydrophobicContact CB-CE2 3.9Å; A137-Y144 HydrophobicContact CB-CG 3.96Å
138	H	90.5	Very high	89	Confident	21 Å²	21	36.1 Å²	36.1	10%	0.097	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-69.5	-12.8	174.5	53.8	-98.4	0	0	0	114.7	P136 S140 C145 D254 E255	P136-H138 PolarHBondContact O-N 3.49Å; H138-S140 PolarHBondContact O-N 3.31Å; H138-C145 PolarHBondContact O-SG 2.93Å; H138-D254 IonicContact CE1-OD2 2.88Å; H138-D254 PolarHBondContact NE2-O 3.31Å; H138-D254 IonicContact NE2-OD2 3.31Å; H138-E255 HydrophobicContact CB-CG 4.17Å
139	D	92.6	Very high	89.2	Confident	5 Å²	5	39 Å²	39	3%	0.027	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-78.6	-4.4	170.1	-73.6	15.5	0	0	0	112.6	P136 A137 A243 R249	P136-D139 WeakPolarHBondContact O-CB 2.92Å; P136-D139 PolarHBondContact O-N 3.27Å; A137-D139 VanDerWaalsContact C-N 3.26Å; A137-D139 PolarHBondContact O-N 3.12Å; D139-A243 VanDerWaalsContact OD2-CB 3.25Å; D139-A243 WeakPolarHBondContact OD2-CB 3.17Å; D139-R249 IonicContact OD1-CZ 2.68Å; D139-R249 IonicContact OD1-NH1 3.65Å; D139-R249 PolarHBondContact OD1-NH1 2.91Å; D139-R249 IonicContact OD1-NH2 3.71Å; D139-R249 PolarHBondContact OD1-NH2 2.78Å; D139-R249 IonicContact OD2-CZ 3.76Å; D139-R249 IonicContact OD2-NH1 3.77Å; D139-R249 IonicContact OD2-NH2 3.49Å; D139-R249 PolarHBondContact OD2-NH2 3.25Å
140	S	87.8	Confident	89.4	Confident	14 Å²	14	40.9 Å²	40.9	10%	0.098	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.5	-44.4	-176.4	-71.6	0	0	0	0	114.7	A137 H138 S160 K164	A137-S140 PolarHBondContact O-N 3.07Å; A137-S140 VanDerWaalsContact O-N 3.15Å; H138-S140 PolarHBondContact O-N 3.31Å; S140-S160 WeakPolarHBondContact CA-OG 3.33Å; S140-S160 WeakPolarHBondContact CB-OG 3.44Å; S140-S160 PolarHBondContact OG-OG 2.99Å; S140-S160 VanDerWaalsContact OG-OG 3.05Å; S140-K164 VanDerWaalsContact CB-NZ 3.34Å; S140-K164 PolarHBondContact OG-NZ 3.32Å
141	E	86.4	Confident	89.5	Confident	68 Å²	68	46.9 Å²	46.9	32%	0.318	25%	0.249	S	C	.	.			trans	-115.6	115.6	-170.4	-60.4	-59.8	160.6	0	0	110	M67 A137 Q143 Y144	M67-E141 HydrophobicContact CE-CG 4.19Å; A137-E141 PolarHBondContact O-N 2.83Å; E141-Q143 HydrophobicContact CB-CG 4.32Å; E141-Q143 PolarHBondContact O-N 2.85Å; E141-Y144 HydrophobicContact CB-CD2 3.8Å; E141-Y144 HydrophobicContact CB-CE2 3.87Å; E141-Y144 HydrophobicContact CG-CE2 4.46Å; E141-Y144 PolarHBondContact O-N 3.36Å; E141-Y144 VanDerWaalsContact O-N 3.15Å
142	P	89.3	Confident	89.6	Confident	19 Å²	19	48.4 Å²	48.4	12%	0.123	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-61	-18.5	-173.5	-21.2	28.6	0	0	0	115.1	Y144 C145 L148 K153 L156 R157	P142-Y144 PolarHBondContact O-N 2.92Å; P142-C145 WeakPolarHBondContact O-CB 3.46Å; P142-C145 PolarHBondContact O-N 2.81Å; P142-C145 VanDerWaalsContact O-N 3.15Å; P142-L148 HydrophobicContact CB-CD1 4.28Å; P142-K153 HydrophobicContact CB-CB 4.08Å; P142-K153 HydrophobicContact CB-CG 3.8Å; P142-K153 HydrophobicContact CG-CB 4.19Å; P142-K153 HydrophobicContact CG-CG 4.46Å; P142-L156 HydrophobicContact CB-CD2 4.18Å; P142-L156 HydrophobicContact CG-CD2 4.02Å; P142-R157 HydrophobicContact CG-CG 3.96Å
143	Q	87.4	Confident	90	Very high	132 Å²	132	50.5 Å²	50.5	62%	0.617	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-66.8	-17.5	178	71.9	-167.6	17.8	0	0	114.2	E141	E141-Q143 HydrophobicContact CB-CG 4.32Å; E141-Q143 PolarHBondContact O-N 2.85Å
144	Y	87.1	Confident	90.1	Very high	72 Å²	72	54.7 Å²	54.7	28%	0.282	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-96.1	-2	174.3	-56.9	-64	0	0	0	113.6	K43 Q63 A137 E141 P142	K43-Y144 PolarHBondContact NZ-O 3.08Å; Q63-Y144 WeakPolarHBondContact CB-OH 3.14Å; Q63-Y144 WeakPolarHBondContact CG-OH 3.38Å; A137-Y144 HydrophobicContact CB-CD2 3.48Å; A137-Y144 VanDerWaalsContact CB-CD2 3.48Å; A137-Y144 HydrophobicContact CB-CE2 3.9Å; A137-Y144 HydrophobicContact CB-CG 3.96Å; E141-Y144 HydrophobicContact CB-CD2 3.8Å; E141-Y144 HydrophobicContact CB-CE2 3.87Å; E141-Y144 HydrophobicContact CG-CE2 4.46Å; E141-Y144 PolarHBondContact O-N 3.36Å; E141-Y144 VanDerWaalsContact O-N 3.15Å; P142-Y144 PolarHBondContact O-N 2.92Å
145	C	88.9	Confident	90.1	Very high	19 Å²	19	57.9 Å²	57.9	13%	0.128	30%	0.296	C	S	.	.	S	Bend	trans	-91.5	150.8	179.5	-54.8	0	0	0	0	110.8	H138 P142 L148 L156 E255	H138-C145 PolarHBondContact O-SG 2.93Å; P142-C145 WeakPolarHBondContact O-CB 3.46Å; P142-C145 PolarHBondContact O-N 2.81Å; P142-C145 VanDerWaalsContact O-N 3.15Å; C145-L148 HydrophobicContact CB-CD1 3.44Å; C145-L148 VanDerWaalsContact CB-CD1 3.44Å; C145-L148 HydrophobicContact CB-CD2 4.37Å; C145-L148 HydrophobicContact CB-CG 3.63Å; C145-L156 WeakPolarHBondContact SG-CD2 3.49Å; C145-E255 WeakPolarHBondContact CA-OE2 3.41Å; C145-E255 WeakPolarHBondContact CB-OE2 3.37Å
146	N	86.9	Confident	90.3	Very high	44 Å²	44	57.1 Å²	57.1	24%	0.235	29%	0.292	C	S	.	.	S	Bend	trans	-89.2	118.2	178.2	-72.6	-74.6	0	0	0	110.8	W41 K43 L148 E255	W41-N146 PolarHBondContact O-ND2 3.45Å; K43-N146 PolarHBondContact NZ-ND2 2.68Å; K43-N146 VanDerWaalsContact NZ-ND2 3.14Å; N146-L148 PolarHBondContact O-N 3.23Å; N146-E255 VanDerWaalsContact N-CD 3.34Å; N146-E255 PolarHBondContact N-OE1 3.01Å; N146-E255 PolarHBondContact N-OE2 3.28Å; N146-E255 PolarHBondContact ND2-OE1 2.93Å
147	S	79.7	Confident	90.4	Very high	124 Å²	124	61.9 Å²	61.9	87%	0.867	31%	0.309	S	S	*	.	S	Bend	trans	60.1	30.7	164.3	-53.1	0	0	0	0	117.1
148	L	88.6	Confident	90.8	Very high	21 Å²	21	64.4 Å²	64.4	11%	0.11	32%	0.323	C	S	.	.			trans	-64	141.3	171.7	-60.5	-176	0	0	0	111.9	P142 C145 N146 E152 K153 L156 L258	P142-L148 HydrophobicContact CB-CD1 4.28Å; C145-L148 HydrophobicContact CB-CD1 3.44Å; C145-L148 VanDerWaalsContact CB-CD1 3.44Å; C145-L148 HydrophobicContact CB-CD2 4.37Å; C145-L148 HydrophobicContact CB-CG 3.63Å; N146-L148 PolarHBondContact O-N 3.23Å; L148-E152 WeakPolarHBondContact CA-OE2 3.29Å; L148-E152 HydrophobicContact CB-CB 4.12Å; L148-E152 HydrophobicContact CD2-CB 4.18Å; L148-K153 HydrophobicContact CB-CG 3.85Å; L148-K153 HydrophobicContact CD1-CG 4.42Å; L148-K153 WeakPolarHBondContact O-CE 3.46Å; L148-L156 HydrophobicContact CD1-CD2 3.87Å; L148-L258 HydrophobicContact CD1-CD1 4.4Å; L148-L258 HydrophobicContact CD2-CD1 4.41Å
149	N	91.6	Very high	91	Very high	70 Å²	70	64.6 Å²	64.6	37%	0.374	32%	0.323	S	S	.	.			trans	-78.3	173.3	166.5	67.7	48.6	0	0	0	111.6	E151 E152 K153	N149-E151 WeakPolarHBondContact OD1-CB 3.3Å; N149-E151 PolarHBondContact OD1-N 3.15Å; N149-E151 PolarHBondContact OD1-OE2 2.98Å; N149-E152 VanDerWaalsContact CG-OE2 3.25Å; N149-E152 PolarHBondContact N-OE2 2.91Å; N149-E152 PolarHBondContact ND2-OE2 3.32Å; N149-E152 VanDerWaalsContact ND2-OE2 3.08Å; N149-E152 PolarHBondContact O-N 3.28Å; N149-E152 WeakPolarHBondContact OD1-CB 3.11Å; N149-E152 VanDerWaalsContact OD1-CG 3.32Å; N149-E152 WeakPolarHBondContact OD1-CG 3.45Å; N149-E152 PolarHBondContact OD1-N 2.94Å; N149-K153 WeakPolarHBondContact O-CG 3.4Å; N149-K153 PolarHBondContact O-N 2.9Å
150	D	93.3	Very high	91	Very high	103 Å²	103	64.6 Å²	64.6	55%	0.551	32%	0.324	S	S	*	.	H	α-helix	trans	-73.4	-29	-171.9	-73.9	-30.2	0	0	0	113.2	K153 K154	D150-K153 WeakPolarHBondContact OD1-CD 3.35Å; D150-K153 WeakPolarHBondContact OD1-CE 3.45Å; D150-K153 IonicContact OD1-NZ 3.93Å; D150-K153 PolarHBondContact OD1-NZ 3.35Å; D150-K154 WeakPolarHBondContact O-CB 3.32Å; D150-K154 PolarHBondContact O-N 2.9Å
151	E	93.6	Very high	91.3	Very high	141 Å²	141	69.9 Å²	69.9	66%	0.659	35%	0.347	S	S	*	.	H	α-helix	trans	-64.2	-50.7	170.6	-65.2	67	-152.7	0	0	110.9	N149 K153 K154 E155	N149-E151 WeakPolarHBondContact OD1-CB 3.3Å; N149-E151 PolarHBondContact OD1-N 3.15Å; N149-E151 PolarHBondContact OD1-OE2 2.98Å; E151-K153 PolarHBondContact O-N 3.33Å; E151-K154 WeakPolarHBondContact O-CA 3.38Å; E151-K154 WeakPolarHBondContact O-CB 3.45Å; E151-K154 PolarHBondContact O-N 3.49Å; E151-K154 VanDerWaalsContact O-N 3.09Å; E151-E155 PolarHBondContact O-N 3.25Å
152	E	94.1	Very high	91.6	Very high	34 Å²	34	69.1 Å²	69.1	16%	0.159	34%	0.343	C	S	.	.	H	α-helix	trans	-61.2	-43.3	175.6	-73.6	168.5	157.1	0	0	111.6	L148 N149 K154 E155 L156 L258	L148-E152 WeakPolarHBondContact CA-OE2 3.29Å; L148-E152 HydrophobicContact CB-CB 4.12Å; L148-E152 HydrophobicContact CD2-CB 4.18Å; N149-E152 VanDerWaalsContact CG-OE2 3.25Å; N149-E152 PolarHBondContact N-OE2 2.91Å; N149-E152 PolarHBondContact ND2-OE2 3.32Å; N149-E152 VanDerWaalsContact ND2-OE2 3.08Å; N149-E152 PolarHBondContact O-N 3.28Å; N149-E152 WeakPolarHBondContact OD1-CB 3.11Å; N149-E152 VanDerWaalsContact OD1-CG 3.32Å; N149-E152 WeakPolarHBondContact OD1-CG 3.45Å; N149-E152 PolarHBondContact OD1-N 2.94Å; E152-K154 PolarHBondContact O-N 2.84Å; E152-E155 PolarHBondContact O-N 3.44Å; E152-L156 WeakPolarHBondContact O-CB 3.38Å; E152-L156 PolarHBondContact O-N 2.87Å; E152-L258 HydrophobicContact CB-CD1 4.16Å; E152-L258 HydrophobicContact CG-CB 4.3Å; E152-L258 WeakPolarHBondContact O-CD1 3.32Å
153	K	94.4	Very high	91.9	Very high	64 Å²	64	68.6 Å²	68.6	28%	0.278	34%	0.339	S	S	.	.	H	α-helix	trans	-59.6	-37.3	174	-68.3	168.4	-153	160.8	0	111.4	P142 L148 N149 D150 E151 R157	P142-K153 HydrophobicContact CB-CB 4.08Å; P142-K153 HydrophobicContact CB-CG 3.8Å; P142-K153 HydrophobicContact CG-CB 4.19Å; P142-K153 HydrophobicContact CG-CG 4.46Å; L148-K153 HydrophobicContact CB-CG 3.85Å; L148-K153 HydrophobicContact CD1-CG 4.42Å; L148-K153 WeakPolarHBondContact O-CE 3.46Å; N149-K153 WeakPolarHBondContact O-CG 3.4Å; N149-K153 PolarHBondContact O-N 2.9Å; D150-K153 WeakPolarHBondContact OD1-CD 3.35Å; D150-K153 WeakPolarHBondContact OD1-CE 3.45Å; D150-K153 IonicContact OD1-NZ 3.93Å; D150-K153 PolarHBondContact OD1-NZ 3.35Å; E151-K153 PolarHBondContact O-N 3.33Å; K153-R157 VanDerWaalsContact C-NH2 3.33Å; K153-R157 WeakPolarHBondContact O-CG 3.23Å; K153-R157 VanDerWaalsContact O-CZ 3.28Å; K153-R157 PolarHBondContact O-N 2.9Å; K153-R157 PolarHBondContact O-NE 3.18Å; K153-R157 PolarHBondContact O-NH2 3.28Å
154	K	94.8	Very high	92.1	Very high	146 Å²	146	64.9 Å²	64.9	64%	0.635	32%	0.32	S	S	*	.	H	α-helix	trans	-68.9	-46	176.2	-176.3	-176	176.4	-173.8	0	110.4	D150 E151 E152 R157 T158	D150-K154 WeakPolarHBondContact O-CB 3.32Å; D150-K154 PolarHBondContact O-N 2.9Å; E151-K154 WeakPolarHBondContact O-CA 3.38Å; E151-K154 WeakPolarHBondContact O-CB 3.45Å; E151-K154 PolarHBondContact O-N 3.49Å; E151-K154 VanDerWaalsContact O-N 3.09Å; E152-K154 PolarHBondContact O-N 2.84Å; K154-R157 PolarHBondContact O-N 3.49Å; K154-T158 PolarHBondContact O-N 3.49Å; K154-T158 PolarHBondContact O-OG1 3.34Å
155	E	95.3	Very high	92.3	Very high	69 Å²	69	68.3 Å²	68.3	32%	0.322	33%	0.333	S	S	.	.	H	α-helix	trans	-59	-48.3	176.6	-167.2	-172.4	156.7	0	0	111.9	E151 E152 R157 T158 F159 K247 L258	E151-E155 PolarHBondContact O-N 3.25Å; E152-E155 PolarHBondContact O-N 3.44Å; E155-R157 VanDerWaalsContact C-N 3.29Å; E155-R157 PolarHBondContact O-N 3.05Å; E155-T158 CarbonylContact O-C 3.59Å; E155-T158 PolarHBondContact O-N 3.13Å; E155-T158 VanDerWaalsContact O-N 3.1Å; E155-F159 WeakPolarHBondContact O-CB 3.2Å; E155-F159 PolarHBondContact O-N 3.26Å; E155-K247 VanDerWaalsContact OE1-CE 3.23Å; E155-K247 WeakPolarHBondContact OE1-CE 3.42Å; E155-K247 IonicContact OE1-NZ 3.53Å; E155-K247 PolarHBondContact OE1-NZ 3.42Å; E155-L258 HydrophobicContact CG-CD2 4.36Å
156	L	95.2	Very high	92.5	Very high	2 Å²	2	70 Å²	70	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-55.7	-43.9	177.8	-176.4	55.8	0	0	0	112.2	P142 C145 L148 E152 F159 S160 L258	P142-L156 HydrophobicContact CB-CD2 4.18Å; P142-L156 HydrophobicContact CG-CD2 4.02Å; C145-L156 WeakPolarHBondContact SG-CD2 3.49Å; L148-L156 HydrophobicContact CD1-CD2 3.87Å; E152-L156 WeakPolarHBondContact O-CB 3.38Å; E152-L156 PolarHBondContact O-N 2.87Å; L156-F159 HydrophobicContact CD1-CD1 4.5Å; L156-F159 PolarHBondContact O-N 3.15Å; L156-S160 VanDerWaalsContact O-CB 3.3Å; L156-S160 WeakPolarHBondContact O-CB 3.47Å; L156-S160 PolarHBondContact O-N 3.5Å; L156-L258 HydrophobicContact CB-CD1 3.77Å; L156-L258 HydrophobicContact CD1-CD1 4.45Å
157	R	94.1	Very high	92.9	Very high	106 Å²	106	68.7 Å²	68.7	40%	0.4	33%	0.334	S	S	.	.	H	α-helix	trans	-64	-44.6	177.2	-76	176.8	-71.4	-131.3	1.8	111.3	P142 K153 K154 E155 Q161	P142-R157 HydrophobicContact CG-CG 3.96Å; K153-R157 VanDerWaalsContact C-NH2 3.33Å; K153-R157 WeakPolarHBondContact O-CG 3.23Å; K153-R157 VanDerWaalsContact O-CZ 3.28Å; K153-R157 PolarHBondContact O-N 2.9Å; K153-R157 PolarHBondContact O-NE 3.18Å; K153-R157 PolarHBondContact O-NH2 3.28Å; K154-R157 PolarHBondContact O-N 3.49Å; E155-R157 VanDerWaalsContact C-N 3.29Å; E155-R157 PolarHBondContact O-N 3.05Å; R157-Q161 VanDerWaalsContact O-CB 3.32Å; R157-Q161 WeakPolarHBondContact O-CB 3.32Å; R157-Q161 WeakPolarHBondContact O-CG 3.47Å; R157-Q161 PolarHBondContact O-N 2.95Å
158	T	95	Very high	93.6	Very high	79 Å²	79	63.1 Å²	63.1	49%	0.485	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-45.9	175.6	-63.5	0	0	0	0	111.7	K154 E155 Q161 Q162	K154-T158 PolarHBondContact O-N 3.49Å; K154-T158 PolarHBondContact O-OG1 3.34Å; E155-T158 CarbonylContact O-C 3.59Å; E155-T158 PolarHBondContact O-N 3.13Å; E155-T158 VanDerWaalsContact O-N 3.1Å; T158-Q161 PolarHBondContact O-N 3.15Å; T158-Q162 VanDerWaalsContact O-CB 3.28Å; T158-Q162 WeakPolarHBondContact O-CB 3.23Å; T158-Q162 PolarHBondContact O-N 3.34Å
159	F	95.3	Very high	93.8	Very high	25 Å²	25	62.1 Å²	62.1	11%	0.11	29%	0.289	C	S	.	.	H	α-helix	trans	-58.9	-48.7	176.7	175.4	-107.6	0	0	0	112.1	E155 L156 Q162 R163 L246 K247 I256	E155-F159 WeakPolarHBondContact O-CB 3.2Å; E155-F159 PolarHBondContact O-N 3.26Å; L156-F159 HydrophobicContact CD1-CD1 4.5Å; L156-F159 PolarHBondContact O-N 3.15Å; F159-Q162 PolarHBondContact O-N 2.73Å; F159-R163 VanDerWaalsContact O-CG 3.28Å; F159-R163 WeakPolarHBondContact O-CG 3.41Å; F159-R163 PolarHBondContact O-N 2.73Å; F159-R163 VanDerWaalsContact O-N 3.14Å; F159-L246 HydrophobicContact CE2-CB 4.5Å; F159-L246 HydrophobicContact CE2-CD1 3.94Å; F159-L246 HydrophobicContact CZ-CD1 4.43Å; F159-K247 HydrophobicContact CD2-CG 4.25Å; F159-K247 HydrophobicContact CE2-CB 4.32Å; F159-K247 HydrophobicContact CE2-CG 3.76Å; F159-K247 HydrophobicContact CZ-CB 4.02Å; F159-K247 HydrophobicContact CZ-CG 3.92Å; F159-I256 HydrophobicContact CE1-CG2 4.47Å
160	S	92.8	Very high	93.9	Very high	5 Å²	5	61.1 Å²	61.1	4%	0.035	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-47.1	177.1	-171.3	0	0	0	0	111.7	S140 L156 R163 K164	S140-S160 WeakPolarHBondContact CA-OG 3.33Å; S140-S160 WeakPolarHBondContact CB-OG 3.44Å; S140-S160 PolarHBondContact OG-OG 2.99Å; S140-S160 VanDerWaalsContact OG-OG 3.05Å; L156-S160 VanDerWaalsContact O-CB 3.3Å; L156-S160 WeakPolarHBondContact O-CB 3.47Å; L156-S160 PolarHBondContact O-N 3.5Å; S160-R163 PolarHBondContact O-N 3.05Å; S160-K164 WeakPolarHBondContact O-CB 3.42Å; S160-K164 WeakPolarHBondContact O-CG 3.48Å; S160-K164 PolarHBondContact O-N 3.08Å; S160-K164 WeakPolarHBondContact OG-CE 3.43Å; S160-K164 PolarHBondContact OG-NZ 3.28Å
161	Q	92.7	Very high	93.9	Very high	125 Å²	125	56.3 Å²	56.3	58%	0.584	26%	0.255	S	S	*	.	H	α-helix	trans	-64.4	-42.6	179.2	-72.6	171.5	17.3	0	0	112.6	R157 T158 K164 R165	R157-Q161 VanDerWaalsContact O-CB 3.32Å; R157-Q161 WeakPolarHBondContact O-CB 3.32Å; R157-Q161 WeakPolarHBondContact O-CG 3.47Å; R157-Q161 PolarHBondContact O-N 2.95Å; T158-Q161 PolarHBondContact O-N 3.15Å; Q161-K164 PolarHBondContact O-N 3.45Å; Q161-R165 WeakPolarHBondContact O-CB 3.28Å; Q161-R165 PolarHBondContact O-N 2.82Å
162	Q	93.9	Very high	93.9	Very high	52 Å²	52	53.6 Å²	53.6	24%	0.243	25%	0.248	C	C	.	.	H	α-helix	trans	-56.3	-54.1	176.7	-171.8	80	8.4	0	0	110.4	T158 F159 K164 R165 D166 M523	T158-Q162 VanDerWaalsContact O-CB 3.28Å; T158-Q162 WeakPolarHBondContact O-CB 3.23Å; T158-Q162 PolarHBondContact O-N 3.34Å; F159-Q162 PolarHBondContact O-N 2.73Å; Q162-K164 VanDerWaalsContact C-N 3.34Å; Q162-K164 PolarHBondContact O-N 2.94Å; Q162-R165 PolarHBondContact O-N 2.84Å; Q162-D166 VanDerWaalsContact CD-OD2 3.31Å; Q162-D166 PolarHBondContact NE2-OD2 3.07Å; Q162-D166 WeakPolarHBondContact O-CB 3.36Å; Q162-D166 PolarHBondContact O-N 3.11Å; Q162-M523 HydrophobicContact CG-SD 3.98Å
163	R	94.7	Very high	93.9	Very high	8 Å²	8	52.3 Å²	52.3	3%	0.03	24%	0.242	C	C	.	.	H	α-helix	trans	-62.8	-38.9	-179.4	-66.2	172.6	53.9	-151.6	-7.6	112.8	F159 S160 N167 L168 F230 G239 H242 L246	F159-R163 VanDerWaalsContact O-CG 3.28Å; F159-R163 WeakPolarHBondContact O-CG 3.41Å; F159-R163 PolarHBondContact O-N 2.73Å; F159-R163 VanDerWaalsContact O-N 3.14Å; S160-R163 PolarHBondContact O-N 3.05Å; R163-N167 PolarHBondContact O-N 2.73Å; R163-L168 PolarHBondContact O-N 3.36Å; R163-F230 HydrophobicContact CB-CD1 4.35Å; R163-F230 HydrophobicContact CB-CE1 3.94Å; R163-G239 PolarHBondContact NH2-O 3.2Å; R163-H242 PolarHBondContact NE-ND1 2.99Å; R163-H242 VanDerWaalsContact NE-ND1 3.12Å; R163-L246 HydrophobicContact CG-CD1 3.88Å
164	K	91.8	Very high	93.8	Very high	53 Å²	53	54.1 Å²	54.1	23%	0.23	25%	0.247	C	C	.	.	H	α-helix	trans	-65.7	-36.2	176.1	-74.4	171.2	178.3	161.4	0	112.2	L71 S140 S160 Q161 Q162 L168	L71-K164 HydrophobicContact CD2-CD 4.45Å; S140-K164 VanDerWaalsContact CB-NZ 3.34Å; S140-K164 PolarHBondContact OG-NZ 3.32Å; S160-K164 WeakPolarHBondContact O-CB 3.42Å; S160-K164 WeakPolarHBondContact O-CG 3.48Å; S160-K164 PolarHBondContact O-N 3.08Å; S160-K164 WeakPolarHBondContact OG-CE 3.43Å; S160-K164 PolarHBondContact OG-NZ 3.28Å; Q161-K164 PolarHBondContact O-N 3.45Å; Q162-K164 VanDerWaalsContact C-N 3.34Å; Q162-K164 PolarHBondContact O-N 2.94Å; K164-L168 HydrophobicContact CB-CD2 4.1Å; K164-L168 HydrophobicContact CG-CD2 4.01Å; K164-L168 WeakPolarHBondContact O-CB 3.44Å
165	R	91.8	Very high	93.7	Very high	144 Å²	144	49.2 Å²	49.2	54%	0.543	23%	0.23	S	C	.	.	H	α-helix	trans	-77	-42.1	177	-170.1	-172.9	64.8	-126.6	-11.5	112.2	Q161 Q162 R203	Q161-R165 WeakPolarHBondContact O-CB 3.28Å; Q161-R165 PolarHBondContact O-N 2.82Å; Q162-R165 PolarHBondContact O-N 2.84Å; R165-R203 VanDerWaalsContact O-CZ 3.29Å; R165-R203 PolarHBondContact O-NH1 3.08Å; R165-R203 PolarHBondContact O-NH2 3.48Å
166	D	93	Very high	93.5	Very high	54 Å²	54	46.7 Å²	46.7	29%	0.289	22%	0.218	S	C	.	.	H	α-helix	trans	-98	-25	-163.3	-61.5	-5.9	0	0	0	114	Q162 R203	Q162-D166 VanDerWaalsContact CD-OD2 3.31Å; Q162-D166 PolarHBondContact NE2-OD2 3.07Å; Q162-D166 WeakPolarHBondContact O-CB 3.36Å; Q162-D166 PolarHBondContact O-N 3.11Å; D166-R203 VanDerWaalsContact C-CZ 3.43Å; D166-R203 VanDerWaalsContact O-CZ 3.25Å; D166-R203 PolarHBondContact O-NH2 2.77Å
167	N	95.3	Very high	93.1	Very high	18 Å²	18	48.7 Å²	48.7	10%	0.096	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.6	-34.1	-173.3	-57.4	102.5	0	0	0	114.5	R163 R203 F230 F231 H242	R163-N167 PolarHBondContact O-N 2.73Å; N167-R203 WeakPolarHBondContact O-CD 3.29Å; N167-F230 HydrophobicContact CB-CB 4.25Å; N167-F230 HydrophobicContact CB-CD1 4.06Å; N167-F230 CarbonylContact O-C 3.59Å; N167-F230 WeakPolarHBondContact O-CA 3.43Å; N167-F231 WeakPolarHBondContact CB-O 3.25Å; N167-F231 PolarHBondContact ND2-O 2.97Å; N167-F231 PolarHBondContact O-N 3.14Å; N167-H242 WeakPolarHBondContact CB-NE2 3.21Å; N167-H242 PolarHBondContact OD1-NE2 3.19Å
168	L	94.5	Very high	92.7	Very high	7 Å²	7	49.1 Å²	49.1	4%	0.037	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	134.4	-179.4	170.7	76.8	0	0	0	112.3	L71 F75 R163 K164 R203 I228 Y229 F230	L71-L168 HydrophobicContact CD2-CD2 3.41Å; L71-L168 VanDerWaalsContact CD2-CD2 3.41Å; F75-L168 HydrophobicContact CE2-CD2 4.31Å; F75-L168 HydrophobicContact CE2-CG 4.46Å; F75-L168 HydrophobicContact CZ-CD2 4.3Å; F75-L168 HydrophobicContact CZ-CG 4.25Å; R163-L168 PolarHBondContact O-N 3.36Å; K164-L168 HydrophobicContact CB-CD2 4.1Å; K164-L168 HydrophobicContact CG-CD2 4.01Å; K164-L168 WeakPolarHBondContact O-CB 3.44Å; L168-R203 WeakPolarHBondContact O-CD 3.13Å; L168-R203 PolarHBondContact O-NH1 3.49Å; L168-I228 HydrophobicContact CD1-CG2 3.65Å; L168-Y229 CarbonylContact C-O 3.53Å; L168-Y229 WeakPolarHBondContact CA-O 3.43Å; L168-F230 HydrophobicContact CB-CD1 4.06Å; L168-F230 HydrophobicContact CB-CE1 3.81Å; L168-F230 HydrophobicContact CB-CZ 4.11Å; L168-F230 HydrophobicContact CD1-CD2 4.31Å; L168-F230 HydrophobicContact CD1-CE1 4.4Å; L168-F230 HydrophobicContact CD1-CE2 3.78Å; L168-F230 HydrophobicContact CD1-CZ 3.84Å
169	G	93.2	Very high	92.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	174.9	162	0	0	0	0	0	111.8	Y229	G169-Y229 PolarHBondContact N-O 2.68Å; G169-Y229 WeakPolarHBondContact O-CD1 3.38Å; G169-Y229 PolarHBondContact O-N 2.71Å; G169-Y229 VanDerWaalsContact O-O 3.09Å
170	R	92.6	Very high	91.3	Very high	49 Å²	49	55.2 Å²	55.2	19%	0.185	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133.5	169.2	-167.2	-179.5	-173.2	-162.1	2.3	109.4	F75 D226 L227 I228 Y229	F75-R170 HydrophobicContact CD2-CB 4.43Å; F75-R170 HydrophobicContact CE2-CB 4.46Å; R170-D226 PolarHBondContact NE-O 3.21Å; R170-L227 CarbonylContact C-O 3.55Å; R170-L227 WeakPolarHBondContact CA-O 3.31Å; R170-I228 HydrophobicContact CG-CG1 4.46Å; R170-Y229 VanDerWaalsContact C-CE1 3.45Å
171	G	93.2	Very high	90.6	Very high	2 Å²	2	61.4 Å²	61.4	2%	0.021	32%	0.316	C	S	.	.			trans	-69.3	140.6	176.8	0	0	0	0	0	110.5	F200 L227	G171-F200 WeakPolarHBondContact CA-O 2.97Å; G171-L227 PolarHBondContact N-O 2.93Å
172	V	93.6	Very high	90	Very high	84 Å²	84	56.2 Å²	56.2	51%	0.509	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.2	174.9	179	0	0	0	0	108	F200	V172-F200 PolarHBondContact N-O 3.15Å; V172-F200 PolarHBondContact O-N 3.39Å
173	V	94.6	Very high	89.8	Confident	6 Å²	6	54.8 Å²	54.8	4%	0.036	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	134	175.3	-168.8	0	0	0	0	109	P96 L99 Y107 I197 A198 V199 L227	P96-V173 HydrophobicContact CB-CB 4.06Å; P96-V173 HydrophobicContact CB-CG2 3.6Å; P96-V173 HydrophobicContact CG-CG2 4.02Å; L99-V173 HydrophobicContact CD1-CB 4.09Å; L99-V173 HydrophobicContact CD1-CG1 3.87Å; L99-V173 HydrophobicContact CD2-CB 4.1Å; L99-V173 HydrophobicContact CD2-CG1 4.05Å; L99-V173 WeakPolarHBondContact CD2-O 3.4Å; L99-V173 HydrophobicContact CG-CB 4.35Å; L99-V173 HydrophobicContact CG-CG1 4.46Å; Y107-V173 HydrophobicContact CD2-CG1 3.68Å; Y107-V173 HydrophobicContact CD2-CG2 4.1Å; Y107-V173 HydrophobicContact CE2-CG1 4.28Å; Y107-V173 HydrophobicContact CE2-CG2 3.91Å; Y107-V173 HydrophobicContact CG-CG1 4.47Å; V173-I197 HydrophobicContact CG1-CG2 3.42Å; V173-I197 VanDerWaalsContact CG1-CG2 3.42Å; V173-A198 WeakPolarHBondContact CA-O 3.36Å; V173-V199 HydrophobicContact CG2-CG2 4.33Å; V173-L227 HydrophobicContact CG2-CD1 3.34Å; V173-L227 HydrophobicContact CG2-CD2 4.47Å
174	R	93.3	Very high	89.8	Confident	103 Å²	103	59.2 Å²	59.2	39%	0.389	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	159.1	170.4	59.2	-174.3	-177.8	87.2	-0.8	110.1	A198 F200	R174-A198 PolarHBondContact N-O 3.16Å; R174-A198 VanDerWaalsContact N-O 3.14Å; R174-A198 PolarHBondContact O-N 2.95Å; R174-A198 VanDerWaalsContact O-N 3.09Å; R174-F200 HydrophobicContact CG-CD2 3.67Å; R174-F200 HydrophobicContact CG-CE2 3.41Å; R174-F200 VanDerWaalsContact CG-CE2 3.41Å; R174-F200 HydrophobicContact CG-CZ 4.39Å; R174-F200 VanDerWaalsContact CZ-CZ 3.49Å; R174-F200 VanDerWaalsContact NH2-CZ 3.31Å
175	P	92.5	Very high	90	Very high	42 Å²	42	56.7 Å²	56.7	27%	0.273	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	140	166	-21.9	32.4	0	0	0	111.2	Q103 D196 I197	Q103-P175 HydrophobicContact CG-CG 4.46Å; P175-D196 CarbonylContact C-O 3.38Å; P175-D196 WeakPolarHBondContact CA-O 3.49Å; P175-I197 HydrophobicContact CG-CD1 3.93Å
176	F	89.9	Confident	90.2	Very high	16 Å²	16	55.5 Å²	55.5	7%	0.07	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-70.6	133.9	171	-166	-90.2	0	0	0	109.3	V178 M180 G182 A183 I192 S193 G195 D196 F200	F176-V178 PolarHBondContact O-N 3.34Å; F176-M180 HydrophobicContact CE1-CB 3.65Å; F176-M180 HydrophobicContact CZ-CB 4.14Å; F176-G182 VanDerWaalsContact CE1-C 3.48Å; F176-G182 VanDerWaalsContact CE1-CA 3.49Å; F176-G182 VanDerWaalsContact CZ-C 3.48Å; F176-A183 HydrophobicContact CD2-CB 4.27Å; F176-A183 HydrophobicContact CE1-CB 4.46Å; F176-A183 HydrophobicContact CE2-CB 3.31Å; F176-A183 HydrophobicContact CZ-CB 3.44Å; F176-A183 VanDerWaalsContact CZ-CB 3.44Å; F176-I192 HydrophobicContact CB-CG2 4.03Å; F176-I192 HydrophobicContact CD2-CG2 4.24Å; F176-I192 HydrophobicContact CG-CG2 4.15Å; F176-S193 WeakPolarHBondContact CB-O 3.35Å; F176-G195 PolarHBondContact O-N 3.15Å; F176-D196 WeakPolarHBondContact CB-O 3.44Å; F176-D196 PolarHBondContact N-O 3.29Å; F176-F200 HydrophobicContact CD2-CE1 4.27Å; F176-F200 AromaticContact CD2-CZ 3.76Å; F176-F200 HydrophobicContact CD2-CZ 3.76Å; F176-F200 HydrophobicContact CE2-CE1 4.34Å; F176-F200 HydrophobicContact CE2-CZ 4.27Å
177	P	86.8	Confident	90.3	Very high	45 Å²	45	56.2 Å²	56.2	29%	0.292	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-61.1	124.6	-174.8	-23.6	34.3	0	0	0	112.6	T179 M180	P177-T179 PolarHBondContact O-N 3.12Å; P177-T179 VanDerWaalsContact O-N 3.09Å; P177-M180 HydrophobicContact CB-CG 4Å; P177-M180 HydrophobicContact CG-CG 4.44Å; P177-M180 PolarHBondContact O-N 3.25Å; P177-M180 VanDerWaalsContact O-N 3.11Å
178	V	86.6	Confident	90.4	Very high	114 Å²	114	57.6 Å²	57.6	69%	0.691	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.7	178.3	-64.2	0	0	0	0	114.1	F176	F176-V178 PolarHBondContact O-N 3.34Å
179	T	81.4	Confident	90.4	Very high	123 Å²	123	59.8 Å²	59.8	76%	0.755	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-2.4	179.4	52.3	0	0	0	0	114	P177	P177-T179 PolarHBondContact O-N 3.12Å; P177-T179 VanDerWaalsContact O-N 3.09Å
180	M	79.7	Confident	90.5	Very high	110 Å²	110	67 Å²	67	54%	0.542	37%	0.37	S	S	.	.	S	Bend	trans	-106.1	152.2	179.3	-64.9	-90.4	72.4	0	0	110.6	F176 P177 G182	F176-M180 HydrophobicContact CE1-CB 3.65Å; F176-M180 HydrophobicContact CZ-CB 4.14Å; P177-M180 HydrophobicContact CB-CG 4Å; P177-M180 HydrophobicContact CG-CG 4.44Å; P177-M180 PolarHBondContact O-N 3.25Å; P177-M180 VanDerWaalsContact O-N 3.11Å; M180-G182 PolarHBondContact O-N 3.2Å
181	T	76.9	Confident	90.6	Very high	134 Å²	134	70.2 Å²	70.2	82%	0.822	39%	0.387	S	S	*	.			trans	-71.7	31.4	-177.4	48.6	0	0	0	0	114.4	Q191	T181-Q191 PolarHBondContact O-NE2 3.13Å; T181-Q191 VanDerWaalsContact O-NE2 3.07Å
182	G	80.4	Confident	90.7	Very high	17 Å²	17	70.1 Å²	70.1	18%	0.175	39%	0.386	C	S	.	.			trans	69.2	-179.7	-165.9	0	0	0	0	0	113.3	F176 M180 I192	F176-G182 VanDerWaalsContact CE1-C 3.48Å; F176-G182 VanDerWaalsContact CE1-CA 3.49Å; F176-G182 VanDerWaalsContact CZ-C 3.48Å; M180-G182 PolarHBondContact O-N 3.2Å; G182-I192 CarbonylContact C-O 3.52Å; G182-I192 WeakPolarHBondContact CA-O 3.45Å
183	A	90.4	Very high	90.6	Very high	22 Å²	22	68.9 Å²	68.9	18%	0.182	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	165.7	169.3	0	0	0	0	0	110.6	F176 Q191 I192 C209	F176-A183 HydrophobicContact CD2-CB 4.27Å; F176-A183 HydrophobicContact CE1-CB 4.46Å; F176-A183 HydrophobicContact CE2-CB 3.31Å; F176-A183 HydrophobicContact CZ-CB 3.44Å; F176-A183 VanDerWaalsContact CZ-CB 3.44Å; A183-Q191 CarbonylContact O-C 3.55Å; A183-Q191 WeakPolarHBondContact O-CA 3.06Å; A183-I192 PolarHBondContact N-O 3.39Å; A183-I192 PolarHBondContact O-N 3.15Å; A183-C209 WeakPolarHBondContact CB-SG 3.39Å
184	I	93.8	Very high	90.5	Very high	101 Å²	101	70.3 Å²	70.3	52%	0.518	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	128.2	178.6	-56.4	-55.4	0	0	0	109.7	Q186 G189 Q191	I184-Q186 PolarHBondContact O-N 3Å; I184-G189 WeakPolarHBondContact CG2-O 3.17Å; I184-Q191 HydrophobicContact CD1-CB 4.34Å
185	C	96.3	Very high	90.3	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-67.5	120.7	173.6	174.7	0	0	0	0	110.7	Q187 C188 G189 R190 I192 C209 H211 C214	C185-Q187 PolarHBondContact O-N 3.12Å; C185-Q187 VanDerWaalsContact O-N 3.12Å; C185-C188 PolarHBondContact O-N 3.23Å; C185-C188 PolarHBondContact SG-SG 2.93Å; C185-G189 WeakPolarHBondContact O-CA 3.2Å; C185-G189 PolarHBondContact O-N 2.86Å; C185-R190 WeakPolarHBondContact CB-O 3.39Å; C185-R190 PolarHBondContact N-O 3.07Å; C185-I192 HydrophobicContact CB-CD1 4.08Å; C185-I192 HydrophobicContact CB-CG1 4.17Å; C185-C209 WeakPolarHBondContact CA-O 3.4Å; C185-H211 VanDerWaalsContact CB-CE1 3.4Å; C185-H211 WeakPolarHBondContact CB-CE1 3.34Å; C185-H211 VanDerWaalsContact CB-ND1 3.27Å; C185-H211 WeakPolarHBondContact CB-ND1 3.25Å; C185-H211 PolarHBondContact SG-ND1 3.15Å; C185-C214 VanDerWaalsContact SG-CB 3.58Å
186	Q	95.8	Very high	90.3	Very high	118 Å²	118	68 Å²	68	55%	0.551	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-20.8	-175.3	-77.7	-75.9	34	0	0	114.9	I184 S208 C209 W210	I184-Q186 PolarHBondContact O-N 3Å; Q186-S208 PolarHBondContact NE2-OG 2.81Å; Q186-C209 PolarHBondContact N-O 2.8Å; Q186-W210 HydrophobicContact CB-CD2 4.25Å; Q186-W210 HydrophobicContact CB-CH2 4.29Å; Q186-W210 HydrophobicContact CB-CZ2 3.59Å; Q186-W210 HydrophobicContact CG-CH2 4.25Å; Q186-W210 HydrophobicContact CG-CZ2 4.02Å
187	Q	95.8	Very high	90.5	Very high	70 Å²	70	67.8 Å²	67.8	33%	0.327	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-39	178.6	-176.4	63.5	17.7	0	0	113.8	C185 C214 Q216	C185-Q187 PolarHBondContact O-N 3.12Å; C185-Q187 VanDerWaalsContact O-N 3.12Å; Q187-C214 HydrophobicContact CB-CB 3.84Å; Q187-C214 WeakPolarHBondContact CB-O 3.24Å; Q187-C214 HydrophobicContact CG-CB 4.24Å; Q187-Q216 HydrophobicContact CG-CG 4.26Å
188	C	96.2	Very high	90.9	Very high	47 Å²	47	65.6 Å²	65.6	32%	0.318	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-2.1	-168.4	70.1	0	0	0	0	114.5	C185 R190 C214	C185-C188 PolarHBondContact O-N 3.23Å; C185-C188 PolarHBondContact SG-SG 2.93Å; C188-R190 PolarHBondContact O-N 3.3Å; C188-C214 VanDerWaalsContact SG-SG 3.64Å
189	G	95.1	Very high	91.4	Very high	52 Å²	52	60.2 Å²	60.2	54%	0.536	35%	0.35	S	S	.	.			trans	67.3	-1.3	178.8	0	0	0	0	0	115.4	I184 C185	I184-G189 WeakPolarHBondContact CG2-O 3.17Å; C185-G189 WeakPolarHBondContact O-CA 3.2Å; C185-G189 PolarHBondContact O-N 2.86Å
190	R	95.4	Very high	92.1	Very high	152 Å²	152	55.3 Å²	55.3	57%	0.574	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-82.4	151	178.2	-58.8	-168.6	-63.3	-151.1	3.2	111.4	C185 C188	C185-R190 WeakPolarHBondContact CB-O 3.39Å; C185-R190 PolarHBondContact N-O 3.07Å; C188-R190 PolarHBondContact O-N 3.3Å
191	Q	94.7	Very high	92.8	Very high	117 Å²	117	50.2 Å²	50.2	55%	0.547	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	135.7	178.3	-169.6	173.6	11.8	0	0	111.2	T181 A183 I184	T181-Q191 PolarHBondContact O-NE2 3.13Å; T181-Q191 VanDerWaalsContact O-NE2 3.07Å; A183-Q191 CarbonylContact O-C 3.55Å; A183-Q191 WeakPolarHBondContact O-CA 3.06Å; I184-Q191 HydrophobicContact CD1-CB 4.34Å
192	I	94.9	Very high	93.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	125.8	165.2	-60.6	176.3	0	0	0	106.2	F176 G182 A183 C185 D196 A198 C209	F176-I192 HydrophobicContact CB-CG2 4.03Å; F176-I192 HydrophobicContact CD2-CG2 4.24Å; F176-I192 HydrophobicContact CG-CG2 4.15Å; G182-I192 CarbonylContact C-O 3.52Å; G182-I192 WeakPolarHBondContact CA-O 3.45Å; A183-I192 PolarHBondContact N-O 3.39Å; A183-I192 PolarHBondContact O-N 3.15Å; C185-I192 HydrophobicContact CB-CD1 4.08Å; C185-I192 HydrophobicContact CB-CG1 4.17Å; I192-D196 HydrophobicContact CG2-CB 3.84Å; I192-A198 HydrophobicContact CD1-CB 4.11Å; I192-A198 HydrophobicContact CG2-CB 4.1Å; I192-C209 HydrophobicContact CD1-CB 4.23Å
193	S	92.6	Very high	94	Very high	58 Å²	58	51.6 Å²	51.6	41%	0.406	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-87.1	162.9	-174.4	-49.5	0	0	0	0	112.3	F176 G195 D196	F176-S193 WeakPolarHBondContact CB-O 3.35Å; S193-G195 PolarHBondContact O-N 2.85Å; S193-D196 WeakPolarHBondContact CA-OD2 3.43Å; S193-D196 WeakPolarHBondContact CB-OD2 3.34Å; S193-D196 PolarHBondContact N-OD2 3.41Å; S193-D196 WeakPolarHBondContact O-CB 3.45Å; S193-D196 PolarHBondContact O-N 2.83Å; S193-D196 PolarHBondContact OG-OD2 3.25Å
194	G	91.3	Very high	94.1	Very high	35 Å²	35	51.3 Å²	51.3	36%	0.361	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	120.6	169.6	0	0	0	0	0	111.5
195	G	89.6	Confident	93.8	Very high	32 Å²	32	48.1 Å²	48.1	33%	0.33	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.1	-22.4	-177.2	0	0	0	0	0	114.6	F176 S193	F176-G195 PolarHBondContact O-N 3.15Å; S193-G195 PolarHBondContact O-N 2.85Å
196	D	92.8	Very high	93.1	Very high	66 Å²	66	57.7 Å²	57.7	35%	0.353	33%	0.326	S	S	.	.			trans	-65	143.9	-178	-67.4	-13.3	0	0	0	111.7	P175 F176 I192 S193 A198	P175-D196 CarbonylContact C-O 3.38Å; P175-D196 WeakPolarHBondContact CA-O 3.49Å; F176-D196 WeakPolarHBondContact CB-O 3.44Å; F176-D196 PolarHBondContact N-O 3.29Å; I192-D196 HydrophobicContact CG2-CB 3.84Å; S193-D196 WeakPolarHBondContact CA-OD2 3.43Å; S193-D196 WeakPolarHBondContact CB-OD2 3.34Å; S193-D196 PolarHBondContact N-OD2 3.41Å; S193-D196 WeakPolarHBondContact O-CB 3.45Å; S193-D196 PolarHBondContact O-N 2.83Å; S193-D196 PolarHBondContact OG-OD2 3.25Å; D196-A198 PolarHBondContact O-N 3.19Å
197	I	94.6	Very high	92.5	Very high	10 Å²	10	54.8 Å²	54.8	5%	0.051	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	126.3	171.6	-68.2	-65.4	0	0	0	109.7	Q103 Q106 Y107 V173 P175 P212	Q103-I197 HydrophobicContact CB-CD1 4.11Å; Q103-I197 HydrophobicContact CG-CD1 4.4Å; Q106-I197 HydrophobicContact CB-CD1 4.46Å; Q106-I197 HydrophobicContact CB-CG1 3.63Å; Y107-I197 HydrophobicContact CD2-CG2 3.96Å; V173-I197 HydrophobicContact CG1-CG2 3.42Å; V173-I197 VanDerWaalsContact CG1-CG2 3.42Å; P175-I197 HydrophobicContact CG-CD1 3.93Å; I197-P212 HydrophobicContact CG2-CG 4.02Å; I197-P212 WeakPolarHBondContact O-CD 3.34Å
198	A	95.6	Very high	92.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.3	178	0	0	0	0	0	112.1	V173 R174 I192 D196 F200 W210	V173-A198 WeakPolarHBondContact CA-O 3.36Å; R174-A198 PolarHBondContact N-O 3.16Å; R174-A198 VanDerWaalsContact N-O 3.14Å; R174-A198 PolarHBondContact O-N 2.95Å; R174-A198 VanDerWaalsContact O-N 3.09Å; I192-A198 HydrophobicContact CD1-CB 4.11Å; I192-A198 HydrophobicContact CG2-CB 4.1Å; D196-A198 PolarHBondContact O-N 3.19Å; A198-F200 HydrophobicContact CB-CD2 4.46Å; A198-F200 HydrophobicContact CB-CE2 3.76Å; A198-F200 HydrophobicContact CB-CZ 4.06Å; A198-W210 WeakPolarHBondContact CA-O 3.43Å
199	V	96.6	Very high	92.3	Very high	0 Å²	0	50 Å²	50	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	127.7	170.6	-170.5	0	0	0	0	108.5	Y107 V173 C209 W210 F215 L227	Y107-V199 HydrophobicContact CE2-CG2 4.24Å; V173-V199 HydrophobicContact CG2-CG2 4.33Å; V199-C209 CarbonylContact O-C 3.54Å; V199-C209 VanDerWaalsContact O-CA 3.24Å; V199-C209 WeakPolarHBondContact O-CA 3.42Å; V199-W210 PolarHBondContact N-O 3.33Å; V199-W210 PolarHBondContact O-N 2.85Å; V199-F215 HydrophobicContact CB-CB 4.36Å; V199-F215 HydrophobicContact CB-CD2 4.11Å; V199-F215 HydrophobicContact CB-CG 4.15Å; V199-F215 HydrophobicContact CG1-CB 4.45Å; V199-F215 HydrophobicContact CG1-CD1 3.94Å; V199-F215 HydrophobicContact CG1-CD2 3.75Å; V199-F215 HydrophobicContact CG1-CE1 4.09Å; V199-F215 HydrophobicContact CG1-CE2 3.91Å; V199-F215 HydrophobicContact CG1-CG 3.77Å; V199-F215 HydrophobicContact CG1-CZ 4.07Å; V199-F215 HydrophobicContact CG2-CB 4.19Å; V199-F215 HydrophobicContact CG2-CG 4.39Å; V199-L227 HydrophobicContact CG1-CD2 3.99Å; V199-L227 HydrophobicContact CG2-CD2 4.18Å
200	F	95.1	Very high	92.4	Very high	21 Å²	21	48 Å²	48	9%	0.092	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.6	177.8	-64.3	-94.4	0	0	0	110.8	G171 V172 R174 F176 A198 C209	G171-F200 WeakPolarHBondContact CA-O 2.97Å; V172-F200 PolarHBondContact N-O 3.15Å; V172-F200 PolarHBondContact O-N 3.39Å; R174-F200 HydrophobicContact CG-CD2 3.67Å; R174-F200 HydrophobicContact CG-CE2 3.41Å; R174-F200 VanDerWaalsContact CG-CE2 3.41Å; R174-F200 HydrophobicContact CG-CZ 4.39Å; R174-F200 VanDerWaalsContact CZ-CZ 3.49Å; R174-F200 VanDerWaalsContact NH2-CZ 3.31Å; F176-F200 HydrophobicContact CD2-CE1 4.27Å; F176-F200 AromaticContact CD2-CZ 3.76Å; F176-F200 HydrophobicContact CD2-CZ 3.76Å; F176-F200 HydrophobicContact CE2-CE1 4.34Å; F176-F200 HydrophobicContact CE2-CZ 4.27Å; A198-F200 HydrophobicContact CB-CD2 4.46Å; A198-F200 HydrophobicContact CB-CE2 3.76Å; A198-F200 HydrophobicContact CB-CZ 4.06Å; F200-C209 HydrophobicContact CD1-CB 3.77Å; F200-C209 HydrophobicContact CE1-CB 3.72Å; F200-C209 HydrophobicContact CG-CB 4.42Å; F200-C209 HydrophobicContact CZ-CB 4.32Å
201	A	94.8	Very high	92.4	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.017	26%	0.257	C	S	.	.			trans	-120.3	101.3	-179.2	0	0	0	0	0	110.8	R203 A204 S208 W210 F215 Y229	A201-R203 VanDerWaalsContact C-N 3.28Å; A201-R203 PolarHBondContact O-N 3.27Å; A201-A204 HydrophobicContact CB-CB 4.15Å; A201-A204 WeakPolarHBondContact O-CB 3.43Å; A201-A204 PolarHBondContact O-N 2.9Å; A201-S208 PolarHBondContact N-O 2.94Å; A201-W210 HydrophobicContact CB-CE3 4.18Å; A201-W210 HydrophobicContact CB-CH2 3.78Å; A201-W210 HydrophobicContact CB-CZ3 3.35Å; A201-F215 HydrophobicContact CB-CE2 4.17Å; A201-F215 HydrophobicContact CB-CZ 4.47Å; A201-Y229 HydrophobicContact CB-CE1 3.86Å; A201-Y229 HydrophobicContact CB-CE2 4.06Å
202	S	91.3	Very high	92.5	Very high	91 Å²	91	36.7 Å²	36.7	64%	0.636	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-54.8	-36.6	-175.1	52.6	0	0	0	0	114.7	A204 G205 Y229	S202-A204 VanDerWaalsContact C-N 3.29Å; S202-A204 PolarHBondContact O-N 3.28Å; S202-G205 PolarHBondContact O-N 3.04Å; S202-Y229 PolarHBondContact N-OH 3.07Å
203	R	92.4	Very high	92.6	Very high	90 Å²	90	41.4 Å²	41.4	34%	0.34	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-74.5	-19.4	-179.4	-56.3	-167.6	81.1	123.1	13	113.7	R165 D166 N167 L168 A201 G205 Y229 F231	R165-R203 VanDerWaalsContact O-CZ 3.29Å; R165-R203 PolarHBondContact O-NH1 3.08Å; R165-R203 PolarHBondContact O-NH2 3.48Å; D166-R203 VanDerWaalsContact C-CZ 3.43Å; D166-R203 VanDerWaalsContact O-CZ 3.25Å; D166-R203 PolarHBondContact O-NH2 2.77Å; N167-R203 WeakPolarHBondContact O-CD 3.29Å; L168-R203 WeakPolarHBondContact O-CD 3.13Å; L168-R203 PolarHBondContact O-NH1 3.49Å; A201-R203 VanDerWaalsContact C-N 3.28Å; A201-R203 PolarHBondContact O-N 3.27Å; R203-G205 PolarHBondContact O-N 3.13Å; R203-Y229 HydrophobicContact CB-CE2 4.17Å; R203-Y229 PolarHBondContact N-OH 3.11Å; R203-F231 HydrophobicContact CB-CB 4.05Å; R203-F231 HydrophobicContact CB-CD1 4.3Å; R203-F231 HydrophobicContact CB-CG 4.42Å; R203-F231 WeakPolarHBondContact O-CD1 3.42Å; R203-F231 VanDerWaalsContact O-CE1 3.26Å; R203-F231 WeakPolarHBondContact O-CE1 3.49Å
204	A	92.1	Very high	92.8	Very high	16 Å²	16	39 Å²	39	13%	0.132	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-83.7	9.4	175.3	0	0	0	0	0	113.2	A201 S202 S208 W210 F231	A201-A204 HydrophobicContact CB-CB 4.15Å; A201-A204 WeakPolarHBondContact O-CB 3.43Å; A201-A204 PolarHBondContact O-N 2.9Å; S202-A204 VanDerWaalsContact C-N 3.29Å; S202-A204 PolarHBondContact O-N 3.28Å; A204-S208 WeakPolarHBondContact O-CB 3.43Å; A204-S208 PolarHBondContact O-OG 2.88Å; A204-W210 HydrophobicContact CB-CH2 3.63Å; A204-W210 HydrophobicContact CB-CZ3 4.43Å; A204-F231 HydrophobicContact CB-CD2 3.75Å; A204-F231 HydrophobicContact CB-CE2 3.55Å; A204-F231 HydrophobicContact CB-CG 4.36Å; A204-F231 HydrophobicContact CB-CZ 4.02Å
205	G	87.7	Confident	93.1	Very high	33 Å²	33	37.4 Å²	37.4	34%	0.34	22%	0.22	S	C	.	.			trans	100.3	156	-179.9	0	0	0	0	0	113.6	S202 R203 G207 S208	S202-G205 PolarHBondContact O-N 3.04Å; R203-G205 PolarHBondContact O-N 3.13Å; G205-G207 PolarHBondContact O-N 3.26Å; G205-S208 PolarHBondContact O-N 3.04Å
206	H	81.4	Confident	93.5	Very high	202 Å²	202	37.7 Å²	37.7	94%	0.935	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	122.6	177.8	-60.9	-70	0	0	0	110.4
207	G	82.1	Confident	93.8	Very high	56 Å²	56	34.5 Å²	34.5	58%	0.577	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	93	-9.3	-179.4	0	0	0	0	0	115.3	G205 C209	G205-G207 PolarHBondContact O-N 3.26Å; G207-C209 PolarHBondContact O-N 2.94Å
208	S	92.9	Very high	93.9	Very high	15 Å²	15	35.9 Å²	35.9	11%	0.105	21%	0.207	C	C	.	.			trans	-63.7	121.9	174.2	-77.2	0	0	0	0	111.3	Q186 A201 A204 G205 W210	Q186-S208 PolarHBondContact NE2-OG 2.81Å; A201-S208 PolarHBondContact N-O 2.94Å; A204-S208 WeakPolarHBondContact O-CB 3.43Å; A204-S208 PolarHBondContact O-OG 2.88Å; G205-S208 PolarHBondContact O-N 3.04Å; S208-W210 VanDerWaalsContact C-CZ3 3.49Å; S208-W210 WeakPolarHBondContact O-CZ3 3.33Å
209	C	94.8	Very high	94	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.007	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	156.5	-173.3	57.5	0	0	0	0	113.5	A183 C185 Q186 I192 V199 F200 G207	A183-C209 WeakPolarHBondContact CB-SG 3.39Å; C185-C209 WeakPolarHBondContact CA-O 3.4Å; Q186-C209 PolarHBondContact N-O 2.8Å; I192-C209 HydrophobicContact CD1-CB 4.23Å; V199-C209 CarbonylContact O-C 3.54Å; V199-C209 VanDerWaalsContact O-CA 3.24Å; V199-C209 WeakPolarHBondContact O-CA 3.42Å; F200-C209 HydrophobicContact CD1-CB 3.77Å; F200-C209 HydrophobicContact CE1-CB 3.72Å; F200-C209 HydrophobicContact CG-CB 4.42Å; F200-C209 HydrophobicContact CZ-CB 4.32Å; G207-C209 PolarHBondContact O-N 2.94Å
210	W	97.1	Very high	94	Very high	10 Å²	10	40.9 Å²	40.9	4%	0.038	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	149.7	179.7	-65.4	-107.9	0	0	0	110.2	Q186 A198 V199 A201 A204 S208 C214 F215 I236	Q186-W210 HydrophobicContact CB-CD2 4.25Å; Q186-W210 HydrophobicContact CB-CH2 4.29Å; Q186-W210 HydrophobicContact CB-CZ2 3.59Å; Q186-W210 HydrophobicContact CG-CH2 4.25Å; Q186-W210 HydrophobicContact CG-CZ2 4.02Å; A198-W210 WeakPolarHBondContact CA-O 3.43Å; V199-W210 PolarHBondContact N-O 3.33Å; V199-W210 PolarHBondContact O-N 2.85Å; A201-W210 HydrophobicContact CB-CE3 4.18Å; A201-W210 HydrophobicContact CB-CH2 3.78Å; A201-W210 HydrophobicContact CB-CZ3 3.35Å; A204-W210 HydrophobicContact CB-CH2 3.63Å; A204-W210 HydrophobicContact CB-CZ3 4.43Å; S208-W210 VanDerWaalsContact C-CZ3 3.49Å; S208-W210 WeakPolarHBondContact O-CZ3 3.33Å; W210-C214 HydrophobicContact CB-CB 4.29Å; W210-C214 VanDerWaalsContact CD1-O 3.31Å; W210-F215 HydrophobicContact CB-CB 4.28Å; W210-F215 HydrophobicContact CB-CD2 3.96Å; W210-F215 AromaticContact CD2-CD2 3.75Å; W210-F215 HydrophobicContact CD2-CD2 3.75Å; W210-F215 HydrophobicContact CD2-CE2 4.04Å; W210-F215 AromaticContact CE3-CD2 3.97Å; W210-F215 HydrophobicContact CE3-CD2 3.97Å; W210-F215 AromaticContact CE3-CE2 3.9Å; W210-F215 HydrophobicContact CE3-CE2 3.9Å; W210-F215 AromaticContact CG-CD2 3.74Å; W210-F215 HydrophobicContact CG-CD2 3.74Å; W210-F215 HydrophobicContact CG-CE2 4.5Å; W210-F215 HydrophobicContact CZ3-CE2 4.39Å; W210-I236 HydrophobicContact CD2-CD1 4.45Å; W210-I236 HydrophobicContact CZ2-CD1 4.02Å; W210-I236 HydrophobicContact CZ2-CG2 4.34Å
211	H	97.1	Very high	94.1	Very high	30 Å²	30	43.4 Å²	43.4	14%	0.139	26%	0.261	C	S	.	.			trans	-61.6	152.5	158.1	-54.9	94.9	0	0	0	109.5	C185 Q213 C214 F215	C185-H211 VanDerWaalsContact CB-CE1 3.4Å; C185-H211 WeakPolarHBondContact CB-CE1 3.34Å; C185-H211 VanDerWaalsContact CB-ND1 3.27Å; C185-H211 WeakPolarHBondContact CB-ND1 3.25Å; C185-H211 PolarHBondContact SG-ND1 3.15Å; H211-Q213 HydrophobicContact CB-CG 4.23Å; H211-Q213 PolarHBondContact O-N 3.03Å; H211-C214 HydrophobicContact CB-CB 3.99Å; H211-C214 WeakPolarHBondContact O-CA 3.18Å; H211-C214 WeakPolarHBondContact O-CB 3.44Å; H211-C214 PolarHBondContact O-N 3.28Å; H211-F215 PolarHBondContact O-N 2.67Å
212	P	96.6	Very high	94.2	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.019	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-49.6	-52	176.5	-31.5	38.2	0	0	0	113.6	Y107 C110 L111 I197 C214 F215	Y107-P212 HydrophobicContact CD2-CB 3.89Å; Y107-P212 HydrophobicContact CD2-CG 3.78Å; Y107-P212 HydrophobicContact CE2-CB 3.67Å; Y107-P212 HydrophobicContact CE2-CG 3.99Å; C110-P212 HydrophobicContact CB-CB 3.93Å; C110-P212 HydrophobicContact CB-CG 3.92Å; L111-P212 HydrophobicContact CD2-CB 3.93Å; I197-P212 HydrophobicContact CG2-CG 4.02Å; I197-P212 WeakPolarHBondContact O-CD 3.34Å; P212-C214 PolarHBondContact O-N 2.87Å; P212-C214 VanDerWaalsContact O-N 3.15Å; P212-F215 PolarHBondContact O-N 3.18Å
213	Q	96.4	Very high	94.5	Very high	98 Å²	98	42.7 Å²	42.7	46%	0.458	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-64.3	-15.2	176.5	63.4	-179.5	110.2	0	0	115.2	L111 H211	L111-Q213 HydrophobicContact CD2-CB 4.29Å; H211-Q213 HydrophobicContact CB-CG 4.23Å; H211-Q213 PolarHBondContact O-N 3.03Å
214	C	97.3	Very high	94.8	Very high	7 Å²	7	38.7 Å²	38.7	5%	0.047	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-96.4	-6.9	-178.2	-77.9	0	0	0	0	112.6	C185 Q187 C188 W210 H211 P212 Q216	C185-C214 VanDerWaalsContact SG-CB 3.58Å; Q187-C214 HydrophobicContact CB-CB 3.84Å; Q187-C214 WeakPolarHBondContact CB-O 3.24Å; Q187-C214 HydrophobicContact CG-CB 4.24Å; C188-C214 VanDerWaalsContact SG-SG 3.64Å; W210-C214 HydrophobicContact CB-CB 4.29Å; W210-C214 VanDerWaalsContact CD1-O 3.31Å; H211-C214 HydrophobicContact CB-CB 3.99Å; H211-C214 WeakPolarHBondContact O-CA 3.18Å; H211-C214 WeakPolarHBondContact O-CB 3.44Å; H211-C214 PolarHBondContact O-N 3.28Å; P212-C214 PolarHBondContact O-N 2.87Å; P212-C214 VanDerWaalsContact O-N 3.15Å; C214-Q216 PolarHBondContact O-N 2.84Å
215	F	97.7	Very high	94.9	Very high	3 Å²	3	38.5 Å²	38.5	1%	0.013	23%	0.231	C	C	.	.			trans	-82.8	66	-179.3	-159.6	-109.9	0	0	0	110.8	V199 A201 W210 H211 P212 L224 L227 Y229 I236	V199-F215 HydrophobicContact CB-CB 4.36Å; V199-F215 HydrophobicContact CB-CD2 4.11Å; V199-F215 HydrophobicContact CB-CG 4.15Å; V199-F215 HydrophobicContact CG1-CB 4.45Å; V199-F215 HydrophobicContact CG1-CD1 3.94Å; V199-F215 HydrophobicContact CG1-CD2 3.75Å; V199-F215 HydrophobicContact CG1-CE1 4.09Å; V199-F215 HydrophobicContact CG1-CE2 3.91Å; V199-F215 HydrophobicContact CG1-CG 3.77Å; V199-F215 HydrophobicContact CG1-CZ 4.07Å; V199-F215 HydrophobicContact CG2-CB 4.19Å; V199-F215 HydrophobicContact CG2-CG 4.39Å; A201-F215 HydrophobicContact CB-CE2 4.17Å; A201-F215 HydrophobicContact CB-CZ 4.47Å; W210-F215 HydrophobicContact CB-CB 4.28Å; W210-F215 HydrophobicContact CB-CD2 3.96Å; W210-F215 AromaticContact CD2-CD2 3.75Å; W210-F215 HydrophobicContact CD2-CD2 3.75Å; W210-F215 HydrophobicContact CD2-CE2 4.04Å; W210-F215 AromaticContact CE3-CD2 3.97Å; W210-F215 HydrophobicContact CE3-CD2 3.97Å; W210-F215 AromaticContact CE3-CE2 3.9Å; W210-F215 HydrophobicContact CE3-CE2 3.9Å; W210-F215 AromaticContact CG-CD2 3.74Å; W210-F215 HydrophobicContact CG-CD2 3.74Å; W210-F215 HydrophobicContact CG-CE2 4.5Å; W210-F215 HydrophobicContact CZ3-CE2 4.39Å; H211-F215 PolarHBondContact O-N 2.67Å; P212-F215 PolarHBondContact O-N 3.18Å; F215-L224 HydrophobicContact CD1-CB 3.8Å; F215-L224 HydrophobicContact CD1-CD1 3.93Å; F215-L224 HydrophobicContact CD1-CG 4.46Å; F215-L224 HydrophobicContact CE1-CB 3.88Å; F215-L224 HydrophobicContact CE1-CD1 3.81Å; F215-L224 HydrophobicContact CG-CD1 4.35Å; F215-L224 HydrophobicContact CZ-CD1 4.13Å; F215-L224 PolarHBondContact O-N 2.74Å; F215-L227 HydrophobicContact CD1-CD2 3.89Å; F215-L227 HydrophobicContact CE1-CB 4.25Å; F215-L227 HydrophobicContact CE1-CD2 4.32Å; F215-Y229 HydrophobicContact CE1-CD1 4.19Å; F215-Y229 AromaticContact CZ-CD1 3.58Å; F215-Y229 HydrophobicContact CZ-CD1 3.58Å; F215-Y229 HydrophobicContact CZ-CE1 4.22Å; F215-Y229 AromaticContact CZ-CG 3.96Å; F215-Y229 HydrophobicContact CZ-CG 3.96Å; F215-I236 HydrophobicContact CD2-CD1 3.85Å; F215-I236 HydrophobicContact CE2-CD1 3.76Å; F215-I236 HydrophobicContact CZ-CD1 4.43Å
216	Q	97.9	Very high	95.1	Very high	37 Å²	37	37.5 Å²	37.5	17%	0.173	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-113	154.9	-171.9	68	-169.1	74.4	0	0	112.2	Q187 C214 S221 E222	Q187-Q216 HydrophobicContact CG-CG 4.26Å; C214-Q216 PolarHBondContact O-N 2.84Å; Q216-S221 PolarHBondContact NE2-OG 2.8Å; Q216-E222 CarbonylContact C-O 3.51Å; Q216-E222 VanDerWaalsContact CA-O 3.23Å; Q216-E222 WeakPolarHBondContact CA-O 3.43Å; Q216-E222 WeakPolarHBondContact CB-O 3.27Å
217	C	98.3	Very high	95.8	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.174	C	C	.	.			trans	-70.4	127.9	174	173.5	0	0	0	0	111	S219 S221 E222 L224 C238	C217-S219 PolarHBondContact O-N 3.49Å; C217-S219 PolarHBondContact SG-N 3.03Å; C217-S221 VanDerWaalsContact O-CA 3.28Å; C217-S221 WeakPolarHBondContact O-CA 3.4Å; C217-S221 PolarHBondContact O-N 2.87Å; C217-E222 PolarHBondContact N-O 3.46Å; C217-L224 HydrophobicContact CB-CD2 3.87Å; C217-L224 HydrophobicContact CB-CG 4.46Å; C217-C238 HydrophobicContact CB-CB 4.11Å; C217-C238 PolarHBondContact SG-N 2.77Å
218	S	97.6	Very high	96.4	Very high	39 Å²	39	25.7 Å²	25.7	27%	0.273	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-4.7	-179.8	-49.3	0	0	0	0	115.1	Q235 I236	S218-Q235 PolarHBondContact OG-OE1 2.73Å; S218-I236 PolarHBondContact N-O 2.69Å; S218-I236 PolarHBondContact OG-O 2.79Å; S218-I236 VanDerWaalsContact OG-O 3.13Å
219	S	97.2	Very high	96.5	Very high	62 Å²	62	25 Å²	25	43%	0.434	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-47.1	176.9	-64.9	0	0	0	0	114	C217 Y237 H241	C217-S219 PolarHBondContact O-N 3.49Å; C217-S219 PolarHBondContact SG-N 3.03Å; S219-Y237 WeakPolarHBondContact OG-CD1 3.1Å; S219-H241 VanDerWaalsContact CB-CG 3.46Å
220	C	96.7	Very high	96.6	Very high	42 Å²	42	25.4 Å²	25.4	28%	0.284	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-7.1	-179.4	55	0	0	0	0	114.5	E222 H241	C220-E222 PolarHBondContact O-N 2.76Å; C220-E222 VanDerWaalsContact O-N 3.08Å; C220-H241 VanDerWaalsContact CB-CE1 3.43Å; C220-H241 WeakPolarHBondContact CB-CE1 3.47Å; C220-H241 PolarHBondContact SG-CE1 3.26Å
221	S	96.8	Very high	96.6	Very high	74 Å²	74	27.1 Å²	27.1	52%	0.517	15%	0.153	S	C	.	.			trans	57.8	12.7	-173.9	-60.2	0	0	0	0	115.8	Q216 C217	Q216-S221 PolarHBondContact NE2-OG 2.8Å; C217-S221 VanDerWaalsContact O-CA 3.28Å; C217-S221 WeakPolarHBondContact O-CA 3.4Å; C217-S221 PolarHBondContact O-N 2.87Å
222	E	97.6	Very high	96.5	Very high	51 Å²	51	27 Å²	27	24%	0.238	15%	0.152	C	C	.	.			trans	-79.4	148.9	170.8	-70.1	-65	172.1	0	0	111.7	R115 Y126 Q216 C217 C220 L224	R115-E222 IonicContact CZ-OE2 3.42Å; R115-E222 IonicContact NH1-OE2 2.66Å; R115-E222 PolarHBondContact NH1-OE2 3.32Å; R115-E222 IonicContact NH2-OE2 3.67Å; Y126-E222 PolarHBondContact OH-OE2 2.82Å; Q216-E222 CarbonylContact C-O 3.51Å; Q216-E222 VanDerWaalsContact CA-O 3.23Å; Q216-E222 WeakPolarHBondContact CA-O 3.43Å; Q216-E222 WeakPolarHBondContact CB-O 3.27Å; C217-E222 PolarHBondContact N-O 3.46Å; C220-E222 PolarHBondContact O-N 2.76Å; C220-E222 VanDerWaalsContact O-N 3.08Å; E222-L224 PolarHBondContact O-N 3.43Å
223	L	97.4	Very high	96.4	Very high	27 Å²	27	32.5 Å²	32.5	14%	0.141	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-58.1	134.4	175.5	-64	175.6	0	0	0	110.4	L111 Q134 V225	L111-L223 HydrophobicContact CD1-CD1 4.33Å; L111-L223 HydrophobicContact CD2-CD1 4.05Å; Q134-L223 PolarHBondContact NE2-O 2.93Å; L223-V225 PolarHBondContact O-N 3.36Å; L223-V225 VanDerWaalsContact O-N 3.15Å
224	L	97.4	Very high	96.2	Very high	7 Å²	7	30.5 Å²	30.5	4%	0.037	19%	0.187	C	C	.	.			trans	-71.9	109.6	-178.4	-71.8	160.4	0	0	0	110	F215 C217 E222 D226 L227 I236 C238	F215-L224 HydrophobicContact CD1-CB 3.8Å; F215-L224 HydrophobicContact CD1-CD1 3.93Å; F215-L224 HydrophobicContact CD1-CG 4.46Å; F215-L224 HydrophobicContact CE1-CB 3.88Å; F215-L224 HydrophobicContact CE1-CD1 3.81Å; F215-L224 HydrophobicContact CG-CD1 4.35Å; F215-L224 HydrophobicContact CZ-CD1 4.13Å; F215-L224 PolarHBondContact O-N 2.74Å; C217-L224 HydrophobicContact CB-CD2 3.87Å; C217-L224 HydrophobicContact CB-CG 4.46Å; E222-L224 PolarHBondContact O-N 3.43Å; L224-D226 PolarHBondContact O-N 3.26Å; L224-L227 WeakPolarHBondContact O-CA 3.37Å; L224-L227 PolarHBondContact O-N 3.08Å; L224-L227 VanDerWaalsContact O-N 3.08Å; L224-I236 HydrophobicContact CD1-CB 4.13Å; L224-I236 HydrophobicContact CD1-CD1 3.62Å; L224-I236 HydrophobicContact CD1-CG1 3.95Å; L224-C238 HydrophobicContact CD2-CB 3.84Å
225	V	94.4	Very high	96.1	Very high	11 Å²	11	34.2 Å²	34.2	7%	0.067	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-64.1	135.3	-167.3	72	0	0	0	0	111.7	R127 Q130 L131 Q134 L135 L223 L227 I228	R127-V225 HydrophobicContact CG-CG2 4.14Å; Q130-V225 HydrophobicContact CB-CB 4Å; Q130-V225 HydrophobicContact CB-CG2 3.9Å; L131-V225 HydrophobicContact CB-CG2 4.47Å; L131-V225 HydrophobicContact CD2-CB 4.42Å; L131-V225 HydrophobicContact CD2-CG1 3.96Å; L131-V225 HydrophobicContact CD2-CG2 3.62Å; L131-V225 HydrophobicContact CG-CG2 3.63Å; Q134-V225 HydrophobicContact CB-CG1 3.9Å; Q134-V225 HydrophobicContact CG-CG1 4.39Å; Q134-V225 VanDerWaalsContact OE1-N 3.16Å; L135-V225 HydrophobicContact CD1-CG1 4.14Å; L223-V225 PolarHBondContact O-N 3.36Å; L223-V225 VanDerWaalsContact O-N 3.15Å; V225-L227 PolarHBondContact O-N 3.21Å; V225-I228 WeakPolarHBondContact O-CB 3.4Å; V225-I228 PolarHBondContact O-N 2.87Å
226	D	93.4	Very high	96.1	Very high	13 Å²	13	34.2 Å²	34.2	7%	0.07	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	50.9	23.6	-174	-67.8	21.8	0	0	0	114.7	M68 W94 R127 R170 L224 I228	M68-D226 HydrophobicContact SD-CB 4.22Å; M68-D226 VanDerWaalsContact SD-OD2 3.42Å; W94-D226 VanDerWaalsContact CD1-OD2 3.31Å; W94-D226 VanDerWaalsContact CZ2-CA 3.49Å; W94-D226 HydrophobicContact CZ2-CB 3.9Å; W94-D226 VanDerWaalsContact NE1-CG 3.3Å; W94-D226 PolarHBondContact NE1-OD2 3.45Å; R127-D226 IonicContact CZ-OD1 3.46Å; R127-D226 IonicContact CZ-OD2 3.95Å; R127-D226 IonicContact NE-OD1 2.71Å; R127-D226 PolarHBondContact NE-OD1 3.42Å; R127-D226 IonicContact NE-OD2 2.68Å; R127-D226 IonicContact NH2-OD1 2.77Å; R127-D226 PolarHBondContact NH2-OD1 3.47Å; R127-D226 IonicContact NH2-OD2 3.59Å; R127-D226 PolarHBondContact NH2-OD2 3.45Å; R170-D226 PolarHBondContact NE-O 3.21Å; L224-D226 PolarHBondContact O-N 3.26Å; D226-I228 HydrophobicContact CB-CD1 4.21Å; D226-I228 HydrophobicContact CB-CG1 4.49Å; D226-I228 PolarHBondContact O-N 2.86Å
227	L	94.9	Very high	96.1	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.016	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	63.1	20.3	-174.1	-50	165.2	0	0	0	113.7	W94 P96 R170 G171 V173 V199 F215 L224 V225	W94-L227 HydrophobicContact CH2-CD1 4Å; W94-L227 HydrophobicContact CH2-CG 3.96Å; P96-L227 HydrophobicContact CB-CD1 4.12Å; R170-L227 CarbonylContact C-O 3.55Å; R170-L227 WeakPolarHBondContact CA-O 3.31Å; G171-L227 PolarHBondContact N-O 2.93Å; V173-L227 HydrophobicContact CG2-CD1 3.34Å; V173-L227 HydrophobicContact CG2-CD2 4.47Å; V199-L227 HydrophobicContact CG1-CD2 3.99Å; V199-L227 HydrophobicContact CG2-CD2 4.18Å; F215-L227 HydrophobicContact CD1-CD2 3.89Å; F215-L227 HydrophobicContact CE1-CB 4.25Å; F215-L227 HydrophobicContact CE1-CD2 4.32Å; L224-L227 WeakPolarHBondContact O-CA 3.37Å; L224-L227 PolarHBondContact O-N 3.08Å; L224-L227 VanDerWaalsContact O-N 3.08Å; V225-L227 PolarHBondContact O-N 3.21Å
228	I	94.1	Very high	96.1	Very high	7 Å²	7	33.2 Å²	33.2	4%	0.036	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	124	179.6	-67.1	166.9	0	0	0	109.2	M68 L135 L168 R170 V225 D226	M68-I228 HydrophobicContact CE-CD1 3.36Å; M68-I228 HydrophobicContact SD-CD1 3.96Å; L135-I228 HydrophobicContact CD1-CB 4.3Å; L135-I228 HydrophobicContact CD1-CD1 3.91Å; L135-I228 HydrophobicContact CD1-CG2 4.06Å; L135-I228 HydrophobicContact CD2-CG2 4.04Å; L168-I228 HydrophobicContact CD1-CG2 3.65Å; R170-I228 HydrophobicContact CG-CG1 4.46Å; V225-I228 WeakPolarHBondContact O-CB 3.4Å; V225-I228 PolarHBondContact O-N 2.87Å; D226-I228 HydrophobicContact CB-CD1 4.21Å; D226-I228 HydrophobicContact CB-CG1 4.49Å; D226-I228 PolarHBondContact O-N 2.86Å
229	Y	96.5	Very high	96	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	156.9	-175.5	72	-88.1	0	0	0	111.4	L168 G169 R170 A201 S202 R203 F215 F231 I236	L168-Y229 CarbonylContact C-O 3.53Å; L168-Y229 WeakPolarHBondContact CA-O 3.43Å; G169-Y229 PolarHBondContact N-O 2.68Å; G169-Y229 WeakPolarHBondContact O-CD1 3.38Å; G169-Y229 PolarHBondContact O-N 2.71Å; G169-Y229 VanDerWaalsContact O-O 3.09Å; R170-Y229 VanDerWaalsContact C-CE1 3.45Å; A201-Y229 HydrophobicContact CB-CE1 3.86Å; A201-Y229 HydrophobicContact CB-CE2 4.06Å; S202-Y229 PolarHBondContact N-OH 3.07Å; R203-Y229 HydrophobicContact CB-CE2 4.17Å; R203-Y229 PolarHBondContact N-OH 3.11Å; F215-Y229 HydrophobicContact CE1-CD1 4.19Å; F215-Y229 AromaticContact CZ-CD1 3.58Å; F215-Y229 HydrophobicContact CZ-CD1 3.58Å; F215-Y229 HydrophobicContact CZ-CE1 4.22Å; F215-Y229 AromaticContact CZ-CG 3.96Å; F215-Y229 HydrophobicContact CZ-CG 3.96Å; Y229-F231 HydrophobicContact CD2-CB 4.07Å; Y229-F231 HydrophobicContact CE2-CB 3.84Å; Y229-I236 HydrophobicContact CD2-CG2 3.93Å
230	F	96.7	Very high	96	Very high	10 Å²	10	30 Å²	30	4%	0.044	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.1	167.4	-68.5	-110	0	0	0	108.4	L135 R163 N167 L168 Y237 H242	L135-F230 HydrophobicContact CD2-CE2 4.26Å; R163-F230 HydrophobicContact CB-CD1 4.35Å; R163-F230 HydrophobicContact CB-CE1 3.94Å; N167-F230 HydrophobicContact CB-CB 4.25Å; N167-F230 HydrophobicContact CB-CD1 4.06Å; N167-F230 CarbonylContact O-C 3.59Å; N167-F230 WeakPolarHBondContact O-CA 3.43Å; L168-F230 HydrophobicContact CB-CD1 4.06Å; L168-F230 HydrophobicContact CB-CE1 3.81Å; L168-F230 HydrophobicContact CB-CZ 4.11Å; L168-F230 HydrophobicContact CD1-CD2 4.31Å; L168-F230 HydrophobicContact CD1-CE1 4.4Å; L168-F230 HydrophobicContact CD1-CE2 3.78Å; L168-F230 HydrophobicContact CD1-CZ 3.84Å; F230-Y237 PolarHBondContact N-O 2.7Å; F230-Y237 PolarHBondContact O-N 3.35Å; F230-H242 HydrophobicContact CB-CB 3.78Å; F230-H242 WeakPolarHBondContact CB-CD2 3.47Å; F230-H242 HydrophobicContact CD1-CB 4.39Å; F230-H242 AromaticContact CD1-CG 3.94Å; F230-H242 HydrophobicContact CG-CB 4.02Å; F230-H242 AromaticContact CG-CG 3.92Å
231	F	96.9	Very high	96	Very high	46 Å²	46	29.5 Å²	29.5	20%	0.202	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	126	179.2	-179.6	-102.8	0	0	0	110.9	N167 R203 A204 Y229 G234 Q235 I236	N167-F231 WeakPolarHBondContact CB-O 3.25Å; N167-F231 PolarHBondContact ND2-O 2.97Å; N167-F231 PolarHBondContact O-N 3.14Å; R203-F231 HydrophobicContact CB-CB 4.05Å; R203-F231 HydrophobicContact CB-CD1 4.3Å; R203-F231 HydrophobicContact CB-CG 4.42Å; R203-F231 WeakPolarHBondContact O-CD1 3.42Å; R203-F231 VanDerWaalsContact O-CE1 3.26Å; R203-F231 WeakPolarHBondContact O-CE1 3.49Å; A204-F231 HydrophobicContact CB-CD2 3.75Å; A204-F231 HydrophobicContact CB-CE2 3.55Å; A204-F231 HydrophobicContact CB-CG 4.36Å; A204-F231 HydrophobicContact CB-CZ 4.02Å; Y229-F231 HydrophobicContact CD2-CB 4.07Å; Y229-F231 HydrophobicContact CE2-CB 3.84Å; F231-G234 VanDerWaalsContact CE2-C 3.41Å; F231-Q235 WeakPolarHBondContact CA-O 3.24Å; F231-Q235 VanDerWaalsContact CD2-O 3.25Å; F231-Q235 WeakPolarHBondContact CD2-O 3.48Å; F231-I236 HydrophobicContact CD2-CG2 3.91Å
232	Q	95.6	Very high	96.1	Very high	28 Å²	28	26 Å²	26	13%	0.131	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	139	177.4	-158.4	-170.4	1.4	0	0	109	G234 Q235 Y237	Q232-G234 PolarHBondContact O-N 3.24Å; Q232-G234 VanDerWaalsContact O-N 3.12Å; Q232-Q235 PolarHBondContact N-O 2.75Å; Q232-Q235 PolarHBondContact O-N 3.04Å; Q232-Q235 VanDerWaalsContact O-O 3.14Å; Q232-Y237 HydrophobicContact CB-CD2 4.42Å; Q232-Y237 HydrophobicContact CB-CE2 4.35Å
233	D	93.3	Very high	96	Very high	118 Å²	118	23.6 Å²	23.6	63%	0.631	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	35.8	172.1	-43.1	-40.6	0	0	0	114.8	Q235 R245	D233-Q235 VanDerWaalsContact C-N 3.31Å; D233-Q235 PolarHBondContact O-N 2.74Å; D233-R245 IonicContact OD2-CZ 2.77Å; D233-R245 IonicContact OD2-NH2 2.75Å; D233-R245 PolarHBondContact OD2-NH2 3.44Å
234	G	92.4	Very high	96	Very high	56 Å²	56	25 Å²	25	58%	0.577	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	82	1.1	-178.5	0	0	0	0	0	115.2	F231 Q232	F231-G234 VanDerWaalsContact CE2-C 3.41Å; Q232-G234 PolarHBondContact O-N 3.24Å; Q232-G234 VanDerWaalsContact O-N 3.12Å
235	Q	95.8	Very high	95.8	Very high	84 Å²	84	29 Å²	29	39%	0.393	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	157.4	-172.3	-67.9	-69.9	-16.9	0	0	112	S218 F231 Q232 D233 Y237	S218-Q235 PolarHBondContact OG-OE1 2.73Å; F231-Q235 WeakPolarHBondContact CA-O 3.24Å; F231-Q235 VanDerWaalsContact CD2-O 3.25Å; F231-Q235 WeakPolarHBondContact CD2-O 3.48Å; Q232-Q235 PolarHBondContact N-O 2.75Å; Q232-Q235 PolarHBondContact O-N 3.04Å; Q232-Q235 VanDerWaalsContact O-O 3.14Å; D233-Q235 VanDerWaalsContact C-N 3.31Å; D233-Q235 PolarHBondContact O-N 2.74Å; Q235-Y237 HydrophobicContact CB-CD2 4.47Å; Q235-Y237 HydrophobicContact CB-CE1 4.5Å; Q235-Y237 HydrophobicContact CB-CE2 3.54Å; Q235-Y237 VanDerWaalsContact CB-OH 3.27Å; Q235-Y237 WeakPolarHBondContact CB-OH 3.25Å
236	I	97.6	Very high	95.8	Very high	4 Å²	4	29 Å²	29	2%	0.021	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.2	178	55.5	178.8	0	0	0	111.3	W210 F215 S218 L224 Y229 F231	W210-I236 HydrophobicContact CD2-CD1 4.45Å; W210-I236 HydrophobicContact CZ2-CD1 4.02Å; W210-I236 HydrophobicContact CZ2-CG2 4.34Å; F215-I236 HydrophobicContact CD2-CD1 3.85Å; F215-I236 HydrophobicContact CE2-CD1 3.76Å; F215-I236 HydrophobicContact CZ-CD1 4.43Å; S218-I236 PolarHBondContact N-O 2.69Å; S218-I236 PolarHBondContact OG-O 2.79Å; S218-I236 VanDerWaalsContact OG-O 3.13Å; L224-I236 HydrophobicContact CD1-CB 4.13Å; L224-I236 HydrophobicContact CD1-CD1 3.62Å; L224-I236 HydrophobicContact CD1-CG1 3.95Å; Y229-I236 HydrophobicContact CD2-CG2 3.93Å; F231-I236 HydrophobicContact CD2-CG2 3.91Å
237	Y	98.3	Very high	95.9	Very high	15 Å²	15	29.1 Å²	29.1	6%	0.059	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.3	-176.2	-60.5	-76.2	0	0	0	110.8	S219 F230 Q232 Q235 R245	S219-Y237 WeakPolarHBondContact OG-CD1 3.1Å; F230-Y237 PolarHBondContact N-O 2.7Å; F230-Y237 PolarHBondContact O-N 3.35Å; Q232-Y237 HydrophobicContact CB-CD2 4.42Å; Q232-Y237 HydrophobicContact CB-CE2 4.35Å; Q235-Y237 HydrophobicContact CB-CD2 4.47Å; Q235-Y237 HydrophobicContact CB-CE1 4.5Å; Q235-Y237 HydrophobicContact CB-CE2 3.54Å; Q235-Y237 VanDerWaalsContact CB-OH 3.27Å; Q235-Y237 WeakPolarHBondContact CB-OH 3.25Å; Y237-R245 PolarHBondContact OH-NH1 3.47Å
238	C	97.6	Very high	95.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.154	C	C	.	.			trans	-71.7	163.7	165.3	75.8	0	0	0	0	110.4	Q134 C217 L224 R240 H241 H242	Q134-C238 HydrophobicContact CB-CB 3.84Å; Q134-C238 HydrophobicContact CG-CB 3.78Å; C217-C238 HydrophobicContact CB-CB 4.11Å; C217-C238 PolarHBondContact SG-N 2.77Å; L224-C238 HydrophobicContact CD2-CB 3.84Å; C238-R240 VanDerWaalsContact C-N 3.27Å; C238-R240 PolarHBondContact O-N 2.67Å; C238-H241 PolarHBondContact O-N 3.24Å; C238-H241 PolarHBondContact SG-ND1 3.46Å; C238-H242 WeakPolarHBondContact O-CB 3.3Å; C238-H242 PolarHBondContact O-N 2.84Å
239	G	95.4	Very high	96	Very high	3 Å²	3	30.4 Å²	30.4	3%	0.031	16%	0.156	C	C	.	.	H	α-helix	trans	-56.7	-40.4	-178.1	0	0	0	0	0	113.2	Q134 R163 A243	Q134-G239 CarbonylContact O-C 3.53Å; Q134-G239 WeakPolarHBondContact O-CA 3.49Å; Q134-G239 PolarHBondContact O-N 2.91Å; Q134-G239 VanDerWaalsContact O-N 3.11Å; R163-G239 PolarHBondContact NH2-O 3.2Å; G239-A243 WeakPolarHBondContact O-CB 3.4Å; G239-A243 PolarHBondContact O-N 3.5Å
240	R	96.5	Very high	96	Very high	30 Å²	30	30.4 Å²	30.4	11%	0.113	16%	0.156	C	C	.	.	H	α-helix	trans	-61.3	-54.7	176.7	179.5	178.4	-176.2	115.4	2.5	113.3	H133 Q134 P136 C238 H242 A243 E244 D254	H133-R240 VanDerWaalsContact CE1-CD 3.43Å; H133-R240 WeakPolarHBondContact CE1-CD 3.24Å; H133-R240 WeakPolarHBondContact O-CB 3.28Å; H133-R240 VanDerWaalsContact O-CD 3.24Å; H133-R240 WeakPolarHBondContact O-CD 3.33Å; Q134-R240 PolarHBondContact O-N 2.9Å; P136-R240 HydrophobicContact CG-CB 4.43Å; C238-R240 VanDerWaalsContact C-N 3.27Å; C238-R240 PolarHBondContact O-N 2.67Å; R240-H242 PolarHBondContact O-N 3.2Å; R240-A243 CarbonylContact O-C 3.58Å; R240-A243 WeakPolarHBondContact O-CA 3.49Å; R240-A243 WeakPolarHBondContact O-CB 2.96Å; R240-A243 PolarHBondContact O-N 3.19Å; R240-E244 VanDerWaalsContact CG-OE1 3.25Å; R240-E244 WeakPolarHBondContact CG-OE1 3.19Å; R240-E244 IonicContact CZ-OE1 3.77Å; R240-E244 IonicContact NE-OE1 3.67Å; R240-E244 PolarHBondContact NE-OE1 3.44Å; R240-E244 IonicContact NH2-OE1 3.62Å; R240-E244 PolarHBondContact NH2-OE1 3.28Å; R240-E244 WeakPolarHBondContact O-CG 3.1Å; R240-E244 PolarHBondContact O-N 2.85Å; R240-D254 IonicContact CZ-OD1 2.7Å; R240-D254 IonicContact CZ-OD2 2.73Å; R240-D254 IonicContact NH1-OD1 2.7Å; R240-D254 PolarHBondContact NH1-OD1 3.1Å; R240-D254 IonicContact NH1-OD2 3.65Å; R240-D254 PolarHBondContact NH1-OD2 3.11Å; R240-D254 IonicContact NH2-OD1 3.72Å; R240-D254 PolarHBondContact NH2-OD1 3.27Å; R240-D254 IonicContact NH2-OD2 3.34Å
241	H	97.9	Very high	95.9	Very high	33 Å²	33	33.4 Å²	33.4	15%	0.153	17%	0.17	C	C	.	.	H	α-helix	trans	-70.9	-31	-176.4	-69.3	108.1	0	0	0	112.7	S219 C220 C238 A243 E244 R245	S219-H241 VanDerWaalsContact CB-CG 3.46Å; C220-H241 VanDerWaalsContact CB-CE1 3.43Å; C220-H241 WeakPolarHBondContact CB-CE1 3.47Å; C220-H241 PolarHBondContact SG-CE1 3.26Å; C238-H241 PolarHBondContact O-N 3.24Å; C238-H241 PolarHBondContact SG-ND1 3.46Å; H241-A243 VanDerWaalsContact C-N 3.28Å; H241-A243 PolarHBondContact O-N 3.36Å; H241-E244 IonicContact CD2-OE2 3.43Å; H241-E244 PolarHBondContact CD2-OE2 2.95Å; H241-E244 IonicContact NE2-OE2 2.76Å; H241-E244 PolarHBondContact O-N 2.88Å; H241-R245 WeakPolarHBondContact O-CG 3.08Å; H241-R245 PolarHBondContact O-N 3.05Å
242	H	97.4	Very high	95.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-67.1	-30.6	168.1	-171.1	-66.8	0	0	0	112.2	R163 N167 F230 C238 R240 L246	R163-H242 PolarHBondContact NE-ND1 2.99Å; R163-H242 VanDerWaalsContact NE-ND1 3.12Å; N167-H242 WeakPolarHBondContact CB-NE2 3.21Å; N167-H242 PolarHBondContact OD1-NE2 3.19Å; F230-H242 HydrophobicContact CB-CB 3.78Å; F230-H242 WeakPolarHBondContact CB-CD2 3.47Å; F230-H242 HydrophobicContact CD1-CB 4.39Å; F230-H242 AromaticContact CD1-CG 3.94Å; F230-H242 HydrophobicContact CG-CB 4.02Å; F230-H242 AromaticContact CG-CG 3.92Å; C238-H242 WeakPolarHBondContact O-CB 3.3Å; C238-H242 PolarHBondContact O-N 2.84Å; R240-H242 PolarHBondContact O-N 3.2Å; H242-L246 PolarHBondContact O-N 2.87Å
243	A	96.9	Very high	95.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.8	-43.2	171.3	0	0	0	0	0	110.5	D139 G239 R240 H241 L246 K247 I256	D139-A243 VanDerWaalsContact OD2-CB 3.25Å; D139-A243 WeakPolarHBondContact OD2-CB 3.17Å; G239-A243 WeakPolarHBondContact O-CB 3.4Å; G239-A243 PolarHBondContact O-N 3.5Å; R240-A243 CarbonylContact O-C 3.58Å; R240-A243 WeakPolarHBondContact O-CA 3.49Å; R240-A243 WeakPolarHBondContact O-CB 2.96Å; R240-A243 PolarHBondContact O-N 3.19Å; H241-A243 VanDerWaalsContact C-N 3.28Å; H241-A243 PolarHBondContact O-N 3.36Å; A243-L246 CarbonylContact O-C 3.59Å; A243-L246 VanDerWaalsContact O-C 3.3Å; A243-L246 WeakPolarHBondContact O-CA 3.43Å; A243-L246 PolarHBondContact O-N 3.12Å; A243-K247 PolarHBondContact O-N 3.5Å; A243-K247 VanDerWaalsContact O-O 3.09Å; A243-I256 HydrophobicContact CB-CD1 3.77Å; A243-I256 HydrophobicContact CB-CG1 4.29Å
244	E	96.1	Very high	95.7	Very high	57 Å²	57	27 Å²	27	27%	0.266	14%	0.142	S	C	.	.	H	α-helix	trans	-72.4	-30.5	-175.6	-71.4	164.4	-176.8	0	0	113.8	R240 H241 K247 R249	R240-E244 VanDerWaalsContact CG-OE1 3.25Å; R240-E244 WeakPolarHBondContact CG-OE1 3.19Å; R240-E244 IonicContact CZ-OE1 3.77Å; R240-E244 IonicContact NE-OE1 3.67Å; R240-E244 PolarHBondContact NE-OE1 3.44Å; R240-E244 IonicContact NH2-OE1 3.62Å; R240-E244 PolarHBondContact NH2-OE1 3.28Å; R240-E244 WeakPolarHBondContact O-CG 3.1Å; R240-E244 PolarHBondContact O-N 2.85Å; H241-E244 IonicContact CD2-OE2 3.43Å; H241-E244 PolarHBondContact CD2-OE2 2.95Å; H241-E244 IonicContact NE2-OE2 2.76Å; H241-E244 PolarHBondContact O-N 2.88Å; E244-K247 WeakPolarHBondContact CA-O 3.48Å; E244-R249 HydrophobicContact CG-CB 3.99Å; E244-R249 WeakPolarHBondContact OE1-CD 3.21Å; E244-R249 IonicContact OE1-CZ 2.65Å; E244-R249 IonicContact OE1-NE 3.83Å; E244-R249 PolarHBondContact OE1-NE 2.78Å; E244-R249 IonicContact OE1-NH2 3.18Å
245	R	94.3	Very high	95.9	Very high	91 Å²	91	24.5 Å²	24.5	34%	0.343	12%	0.115	S	C	.	.	H	α-helix	trans	-59.8	-41.4	161.7	-68.1	168.7	73.4	89.8	-7.4	110.9	D233 Y237 H241	D233-R245 IonicContact OD2-CZ 2.77Å; D233-R245 IonicContact OD2-NH2 2.75Å; D233-R245 PolarHBondContact OD2-NH2 3.44Å; Y237-R245 PolarHBondContact OH-NH1 3.47Å; H241-R245 WeakPolarHBondContact O-CG 3.08Å; H241-R245 PolarHBondContact O-N 3.05Å
246	L	94.2	Very high	95.8	Very high	11 Å²	11	20.8 Å²	20.8	6%	0.058	10%	0.098	C	C	.	.	H	α-helix	trans	-75.7	-36	-172.2	71	76.9	0	0	0	117.8	F159 R163 H242 A243 W515 T519 M523	F159-L246 HydrophobicContact CE2-CB 4.5Å; F159-L246 HydrophobicContact CE2-CD1 3.94Å; F159-L246 HydrophobicContact CZ-CD1 4.43Å; R163-L246 HydrophobicContact CG-CD1 3.88Å; H242-L246 PolarHBondContact O-N 2.87Å; A243-L246 CarbonylContact O-C 3.59Å; A243-L246 VanDerWaalsContact O-C 3.3Å; A243-L246 WeakPolarHBondContact O-CA 3.43Å; A243-L246 PolarHBondContact O-N 3.12Å; L246-W515 VanDerWaalsContact C-CH2 3.5Å; L246-W515 WeakPolarHBondContact O-CH2 3.4Å; L246-W515 WeakPolarHBondContact O-CZ2 3.4Å; L246-T519 HydrophobicContact CB-CG2 4Å; L246-M523 HydrophobicContact CD1-CE 3.61Å; L246-M523 HydrophobicContact CD2-CE 3.47Å; L246-M523 VanDerWaalsContact CD2-CE 3.47Å; L246-M523 HydrophobicContact CG-CE 4.15Å
247	K	95.1	Very high	95.8	Very high	15 Å²	15	20.7 Å²	20.7	7%	0.065	10%	0.098	C	C	.	.	S	Bend	trans	-159.9	138.2	178.3	-79	-83.9	166.1	158.3	0	109.5	E155 F159 A243 E244 I256 I257 L258 W515	E155-K247 VanDerWaalsContact OE1-CE 3.23Å; E155-K247 WeakPolarHBondContact OE1-CE 3.42Å; E155-K247 IonicContact OE1-NZ 3.53Å; E155-K247 PolarHBondContact OE1-NZ 3.42Å; F159-K247 HydrophobicContact CD2-CG 4.25Å; F159-K247 HydrophobicContact CE2-CB 4.32Å; F159-K247 HydrophobicContact CE2-CG 3.76Å; F159-K247 HydrophobicContact CZ-CB 4.02Å; F159-K247 HydrophobicContact CZ-CG 3.92Å; A243-K247 PolarHBondContact O-N 3.5Å; A243-K247 VanDerWaalsContact O-O 3.09Å; E244-K247 WeakPolarHBondContact CA-O 3.48Å; K247-I256 HydrophobicContact CB-CD1 4.38Å; K247-I256 HydrophobicContact CB-CG2 3.27Å; K247-I256 HydrophobicContact CG-CG2 3.92Å; K247-I256 WeakPolarHBondContact O-CD1 3.46Å; K247-I257 WeakPolarHBondContact CD-O 3.41Å; K247-L258 HydrophobicContact CD-CD2 4.35Å; K247-L258 HydrophobicContact CG-CD2 4.45Å; K247-L258 PolarHBondContact NZ-O 3.14Å; K247-W515 HydrophobicContact CB-CH2 4.04Å; K247-W515 HydrophobicContact CD-CH2 3.67Å; K247-W515 HydrophobicContact CD-CZ3 3.91Å; K247-W515 HydrophobicContact CG-CH2 3.86Å; K247-W515 VanDerWaalsContact N-CZ2 3.34Å
248	P	96.1	Very high	95.6	Very high	17 Å²	17	20.1 Å²	20.1	11%	0.11	10%	0.096	C	C	.	.			trans	-65.8	142.3	-178.8	25.4	-31	0	0	0	110.9	I257 Y269	P248-I257 HydrophobicContact CG-CB 4.3Å; P248-I257 WeakPolarHBondContact O-CB 3.07Å; P248-I257 PolarHBondContact O-N 3.32Å; P248-Y269 HydrophobicContact CB-CD1 4.08Å; P248-Y269 HydrophobicContact CB-CD2 3.8Å; P248-Y269 HydrophobicContact CB-CE2 4.34Å; P248-Y269 HydrophobicContact CB-CG 3.67Å
249	R	96.4	Very high	95.3	Very high	20 Å²	20	22 Å²	22	8%	0.075	11%	0.112	C	C	.	.	B	Isolated β-bridge	trans	-99.6	135.1	178.5	-169.1	-178.3	-62.3	-76	-5.7	111.1	D139 E244 Q251 D254 E255 I256	D139-R249 IonicContact OD1-CZ 2.68Å; D139-R249 IonicContact OD1-NH1 3.65Å; D139-R249 PolarHBondContact OD1-NH1 2.91Å; D139-R249 IonicContact OD1-NH2 3.71Å; D139-R249 PolarHBondContact OD1-NH2 2.78Å; D139-R249 IonicContact OD2-CZ 3.76Å; D139-R249 IonicContact OD2-NH1 3.77Å; D139-R249 IonicContact OD2-NH2 3.49Å; D139-R249 PolarHBondContact OD2-NH2 3.25Å; E244-R249 HydrophobicContact CG-CB 3.99Å; E244-R249 WeakPolarHBondContact OE1-CD 3.21Å; E244-R249 IonicContact OE1-CZ 2.65Å; E244-R249 IonicContact OE1-NE 3.83Å; E244-R249 PolarHBondContact OE1-NE 2.78Å; E244-R249 IonicContact OE1-NH2 3.18Å; R249-Q251 PolarHBondContact O-N 2.7Å; R249-D254 VanDerWaalsContact CD-O 3.25Å; R249-D254 WeakPolarHBondContact CD-O 3.36Å; R249-D254 WeakPolarHBondContact CD-OD1 3.46Å; R249-D254 WeakPolarHBondContact CG-O 3.32Å; R249-D254 PolarHBondContact NH1-O 2.86Å; R249-E255 WeakPolarHBondContact CG-O 3.25Å; R249-I256 HydrophobicContact CB-CD1 4.25Å
250	C	95.8	Very high	94.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-74	113.3	177.6	174.8	0	0	0	0	111.4	A252 C253 D254 E255 I257 Y269 H271	C250-A252 PolarHBondContact O-N 2.91Å; C250-C253 VanDerWaalsContact CB-SG 3.54Å; C250-C253 PolarHBondContact O-N 3.04Å; C250-C253 PolarHBondContact SG-SG 2.71Å; C250-D254 WeakPolarHBondContact O-CA 3.32Å; C250-D254 PolarHBondContact O-N 2.78Å; C250-E255 WeakPolarHBondContact CB-O 3.43Å; C250-E255 PolarHBondContact N-O 3.48Å; C250-I257 HydrophobicContact CB-CD1 4Å; C250-I257 HydrophobicContact CB-CG1 3.78Å; C250-Y269 CarbonylContact C-O 3.59Å; C250-Y269 VanDerWaalsContact CA-O 3.31Å; C250-Y269 WeakPolarHBondContact CA-O 3.45Å; C250-H271 WeakPolarHBondContact CB-ND1 3.43Å; C250-H271 PolarHBondContact SG-N 2.88Å; C250-H271 VanDerWaalsContact SG-N 3.36Å; C250-H271 PolarHBondContact SG-ND1 2.69Å
251	Q	94.9	Very high	94.6	Very high	73 Å²	73	28.7 Å²	28.7	34%	0.341	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-26.9	-175.3	-176.5	60.1	78.7	0	0	114.7	R249 Y269 W270	R249-Q251 PolarHBondContact O-N 2.7Å; Q251-Y269 PolarHBondContact N-O 2.98Å; Q251-W270 HydrophobicContact CB-CD2 4.34Å; Q251-W270 HydrophobicContact CB-CZ2 4.02Å; Q251-W270 HydrophobicContact CG-CZ2 4.14Å
252	A	93.4	Very high	94.4	Very high	25 Å²	25	27.2 Å²	27.2	21%	0.207	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-31.2	-177.7	0	0	0	0	0	115.2	W41 R42 C250 H274	W41-A252 HydrophobicContact CH2-CB 4.23Å; W41-A252 HydrophobicContact CZ3-CB 3.84Å; R42-A252 WeakPolarHBondContact CB-O 3.41Å; R42-A252 WeakPolarHBondContact CG-O 3.16Å; C250-A252 PolarHBondContact O-N 2.91Å; A252-H274 HydrophobicContact CB-CB 4.21Å
253	C	93.7	Very high	94.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	1.9	-177.9	76.8	0	0	0	0	113.7	W41 K43 C250 E255 H271 H274	W41-C253 HydrophobicContact CE3-CB 3.98Å; W41-C253 HydrophobicContact CZ3-CB 4.35Å; W41-C253 WeakPolarHBondContact O-CB 3.22Å; K43-C253 WeakPolarHBondContact CG-O 3.32Å; C250-C253 VanDerWaalsContact CB-SG 3.54Å; C250-C253 PolarHBondContact O-N 3.04Å; C250-C253 PolarHBondContact SG-SG 2.71Å; C253-E255 PolarHBondContact O-N 3.09Å; C253-H271 PolarHBondContact SG-ND1 3.46Å; C253-H271 VanDerWaalsContact SG-ND1 3.42Å; C253-H274 WeakPolarHBondContact CB-ND1 3.47Å; C253-H274 VanDerWaalsContact SG-CE1 3.52Å; C253-H274 PolarHBondContact SG-ND1 2.77Å
254	D	94.5	Very high	94.1	Very high	32 Å²	32	30.3 Å²	30.3	17%	0.171	16%	0.155	C	C	.	.			trans	56.2	9	180	-151.4	56.5	0	0	0	116.2	K43 H138 R240 R249 C250	K43-D254 HydrophobicContact CB-CB 4.17Å; K43-D254 HydrophobicContact CG-CB 3.97Å; H138-D254 IonicContact CE1-OD2 2.88Å; H138-D254 PolarHBondContact NE2-O 3.31Å; H138-D254 IonicContact NE2-OD2 3.31Å; R240-D254 IonicContact CZ-OD1 2.7Å; R240-D254 IonicContact CZ-OD2 2.73Å; R240-D254 IonicContact NH1-OD1 2.7Å; R240-D254 PolarHBondContact NH1-OD1 3.1Å; R240-D254 IonicContact NH1-OD2 3.65Å; R240-D254 PolarHBondContact NH1-OD2 3.11Å; R240-D254 IonicContact NH2-OD1 3.72Å; R240-D254 PolarHBondContact NH2-OD1 3.27Å; R240-D254 IonicContact NH2-OD2 3.34Å; R249-D254 VanDerWaalsContact CD-O 3.25Å; R249-D254 WeakPolarHBondContact CD-O 3.36Å; R249-D254 WeakPolarHBondContact CD-OD1 3.46Å; R249-D254 WeakPolarHBondContact CG-O 3.32Å; R249-D254 PolarHBondContact NH1-O 2.86Å; C250-D254 WeakPolarHBondContact O-CA 3.32Å; C250-D254 PolarHBondContact O-N 2.78Å
255	E	95.3	Very high	93.9	Very high	4 Å²	4	28 Å²	28	2%	0.019	15%	0.145	C	C	.	.			trans	-93.8	150.7	179.6	-71.8	167.6	-147.9	0	0	111.7	K43 H138 C145 N146 R249 C250 C253	K43-E255 WeakPolarHBondContact CE-OE1 3.49Å; K43-E255 IonicContact NZ-OE1 2.69Å; K43-E255 PolarHBondContact NZ-OE1 2.92Å; H138-E255 HydrophobicContact CB-CG 4.17Å; C145-E255 WeakPolarHBondContact CA-OE2 3.41Å; C145-E255 WeakPolarHBondContact CB-OE2 3.37Å; N146-E255 VanDerWaalsContact N-CD 3.34Å; N146-E255 PolarHBondContact N-OE1 3.01Å; N146-E255 PolarHBondContact N-OE2 3.28Å; N146-E255 PolarHBondContact ND2-OE1 2.93Å; R249-E255 WeakPolarHBondContact CG-O 3.25Å; C250-E255 WeakPolarHBondContact CB-O 3.43Å; C250-E255 PolarHBondContact N-O 3.48Å; C253-E255 PolarHBondContact O-N 3.09Å
256	I	95.6	Very high	93.6	Very high	7 Å²	7	28.3 Å²	28.3	4%	0.036	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-66.3	128.2	172.9	-70.5	-65.7	0	0	0	109.8	F159 A243 K247 R249 L258	F159-I256 HydrophobicContact CE1-CG2 4.47Å; A243-I256 HydrophobicContact CB-CD1 3.77Å; A243-I256 HydrophobicContact CB-CG1 4.29Å; K247-I256 HydrophobicContact CB-CD1 4.38Å; K247-I256 HydrophobicContact CB-CG2 3.27Å; K247-I256 HydrophobicContact CG-CG2 3.92Å; K247-I256 WeakPolarHBondContact O-CD1 3.46Å; R249-I256 HydrophobicContact CB-CD1 4.25Å; I256-L258 HydrophobicContact CG2-CD2 4.04Å; I256-L258 HydrophobicContact CG2-CG 4.41Å; I256-L258 PolarHBondContact O-N 3.39Å
257	I	95.8	Very high	93.4	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	18%	0.177	C	C	.	.			trans	-81.4	110.7	176.1	-54.5	165.6	0	0	0	107.9	K247 P248 C250 A259 C262	K247-I257 WeakPolarHBondContact CD-O 3.41Å; P248-I257 HydrophobicContact CG-CB 4.3Å; P248-I257 WeakPolarHBondContact O-CB 3.07Å; P248-I257 PolarHBondContact O-N 3.32Å; C250-I257 HydrophobicContact CB-CD1 4Å; C250-I257 HydrophobicContact CB-CG1 3.78Å; I257-A259 HydrophobicContact CG2-CB 4.49Å; I257-C262 HydrophobicContact CD1-CB 4.34Å; I257-C262 HydrophobicContact CG2-CB 4.23Å
258	L	94.4	Very high	93.4	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.016	19%	0.192	C	C	.	.			trans	-88.5	-36.5	178.2	-63.6	166.9	0	0	0	111.6	L148 E152 E155 L156 K247 I256	L148-L258 HydrophobicContact CD1-CD1 4.4Å; L148-L258 HydrophobicContact CD2-CD1 4.41Å; E152-L258 HydrophobicContact CB-CD1 4.16Å; E152-L258 HydrophobicContact CG-CB 4.3Å; E152-L258 WeakPolarHBondContact O-CD1 3.32Å; E155-L258 HydrophobicContact CG-CD2 4.36Å; L156-L258 HydrophobicContact CB-CD1 3.77Å; L156-L258 HydrophobicContact CD1-CD1 4.45Å; K247-L258 HydrophobicContact CD-CD2 4.35Å; K247-L258 HydrophobicContact CG-CD2 4.45Å; K247-L258 PolarHBondContact NZ-O 3.14Å; I256-L258 HydrophobicContact CG2-CD2 4.04Å; I256-L258 HydrophobicContact CG2-CG 4.41Å; I256-L258 PolarHBondContact O-N 3.39Å
259	A	91.3	Very high	93.3	Very high	40 Å²	40	37.7 Å²	37.7	33%	0.331	20%	0.202	S	C	.	.	S	Bend	trans	-54	145.7	179.4	0	0	0	0	0	113.9	I257 E261	I257-A259 HydrophobicContact CG2-CB 4.49Å; A259-E261 PolarHBondContact O-N 3.38Å
260	D	88.1	Confident	93.3	Very high	91 Å²	91	36.8 Å²	36.8	49%	0.487	20%	0.198	S	C	.	.	S	Bend	trans	-64.8	-18.9	178.7	-71.3	-24.3	0	0	0	114.1	C512	D260-C512 WeakPolarHBondContact O-CB 3.29Å
261	E	90.3	Very high	93.2	Very high	81 Å²	81	38.2 Å²	38.2	38%	0.379	21%	0.205	S	C	.	.			trans	-119	128.3	-178.2	-63.2	-162	150.3	0	0	111.8	A259 M272 N509	A259-E261 PolarHBondContact O-N 3.38Å; E261-M272 HydrophobicContact CB-SD 4.12Å; E261-N509 PolarHBondContact OE1-ND2 3.22Å
262	C	93.8	Very high	93.1	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.02	21%	0.212	C	C	.	.			trans	-137.4	146.4	-171.6	69	0	0	0	0	109.7	I257 C512	I257-C262 HydrophobicContact CD1-CB 4.34Å; I257-C262 HydrophobicContact CG2-CB 4.23Å; C262-C512 HydrophobicContact CB-CB 4.41Å; C262-C512 WeakPolarHBondContact CB-SG 3.29Å; C262-C512 PolarHBondContact N-SG 3.14Å; C262-C512 WeakPolarHBondContact SG-CB 3.45Å; C262-C512 CovalentContact SG-SG 2.07Å; C262-C512 PolarHBondContact SG-SG 3Å
263	T	94.5	Very high	93	Very high	10 Å²	10	47.3 Å²	47.3	6%	0.061	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.3	171.6	-57.2	0	0	0	0	108.6	Y269 W270 F275	T263-Y269 CarbonylContact O-C 3.57Å; T263-Y269 WeakPolarHBondContact O-CA 3.25Å; T263-W270 PolarHBondContact N-O 2.81Å; T263-W270 PolarHBondContact O-N 3.09Å; T263-F275 HydrophobicContact CG2-CB 3.98Å; T263-F275 HydrophobicContact CG2-CD1 3.81Å; T263-F275 HydrophobicContact CG2-CD2 4.07Å; T263-F275 HydrophobicContact CG2-CE1 4.35Å; T263-F275 HydrophobicContact CG2-CG 3.66Å
264	E	93.7	Very high	93	Very high	55 Å²	55	48.6 Å²	48.6	26%	0.257	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.1	174	-166.8	-175.2	161.1	0	0	110.6	R268 Y269	E264-R268 WeakPolarHBondContact CA-O 3.49Å; E264-Y269 HydrophobicContact CB-CD1 4.22Å; E264-Y269 HydrophobicContact CB-CE1 4.16Å; E264-Y269 HydrophobicContact CG-CD1 4.14Å; E264-Y269 HydrophobicContact CG-CE1 3.78Å
265	A	90.9	Very high	93.1	Very high	7 Å²	7	47.2 Å²	47.2	6%	0.058	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	136.1	175.4	0	0	0	0	0	110.6	G267 R268 W270 F275 Y289	A265-G267 PolarHBondContact O-N 2.85Å; A265-G267 VanDerWaalsContact O-N 3.11Å; A265-R268 PolarHBondContact N-O 3.22Å; A265-R268 PolarHBondContact O-N 2.9Å; A265-W270 HydrophobicContact CB-CE3 4.42Å; A265-W270 HydrophobicContact CB-CH2 4.04Å; A265-W270 HydrophobicContact CB-CZ3 3.6Å; A265-W270 WeakPolarHBondContact O-CH2 3.48Å; A265-W270 VanDerWaalsContact O-CZ3 3.24Å; A265-W270 WeakPolarHBondContact O-CZ3 3.15Å; A265-F275 HydrophobicContact CB-CE2 4Å; A265-F275 HydrophobicContact CB-CZ 4.25Å; A265-Y289 HydrophobicContact CB-CE2 4.43Å; A265-Y289 WeakPolarHBondContact CB-OH 3.22Å
266	E	88.9	Confident	93.1	Very high	98 Å²	98	47.3 Å²	47.3	46%	0.458	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	38.8	-179.4	-51.7	-54.6	144.8	0	0	113.9	R268 M291 S503	E266-R268 VanDerWaalsContact C-N 3.28Å; E266-R268 PolarHBondContact O-N 3.46Å; E266-M291 HydrophobicContact CB-CE 4.28Å; E266-M291 HydrophobicContact CG-CB 4.32Å; E266-M291 HydrophobicContact CG-CE 4.19Å; E266-M291 HydrophobicContact CG-CG 3.79Å; E266-S503 PolarHBondContact OE1-OG 2.78Å
267	G	89.9	Confident	93.1	Very high	60 Å²	60	47 Å²	47	62%	0.619	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.5	17.3	-179.2	0	0	0	0	0	115.3	A265	A265-G267 PolarHBondContact O-N 2.85Å; A265-G267 VanDerWaalsContact O-N 3.11Å
268	R	93.6	Very high	93.1	Very high	100 Å²	100	48.1 Å²	48.1	38%	0.377	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	164.6	178.1	-63.2	173	-168.6	-90.9	-5.8	110.3	E264 A265 E266 W270	E264-R268 WeakPolarHBondContact CA-O 3.49Å; A265-R268 PolarHBondContact N-O 3.22Å; A265-R268 PolarHBondContact O-N 2.9Å; E266-R268 VanDerWaalsContact C-N 3.28Å; E266-R268 PolarHBondContact O-N 3.46Å; R268-W270 VanDerWaalsContact C-CZ3 3.41Å; R268-W270 HydrophobicContact CB-CE3 4.44Å; R268-W270 HydrophobicContact CB-CH2 3.51Å; R268-W270 HydrophobicContact CB-CZ2 4.28Å; R268-W270 HydrophobicContact CB-CZ3 3.59Å; R268-W270 WeakPolarHBondContact O-CZ3 3.47Å
269	Y	95.6	Very high	93.1	Very high	80 Å²	80	53 Å²	53	31%	0.314	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149	-175.1	-57.6	-87.3	0	0	0	112	P248 C250 Q251 T263 E264	P248-Y269 HydrophobicContact CB-CD1 4.08Å; P248-Y269 HydrophobicContact CB-CD2 3.8Å; P248-Y269 HydrophobicContact CB-CE2 4.34Å; P248-Y269 HydrophobicContact CB-CG 3.67Å; C250-Y269 CarbonylContact C-O 3.59Å; C250-Y269 VanDerWaalsContact CA-O 3.31Å; C250-Y269 WeakPolarHBondContact CA-O 3.45Å; Q251-Y269 PolarHBondContact N-O 2.98Å; T263-Y269 CarbonylContact O-C 3.57Å; T263-Y269 WeakPolarHBondContact O-CA 3.25Å; E264-Y269 HydrophobicContact CB-CD1 4.22Å; E264-Y269 HydrophobicContact CB-CE1 4.16Å; E264-Y269 HydrophobicContact CG-CD1 4.14Å; E264-Y269 HydrophobicContact CG-CE1 3.78Å
270	W	95.7	Very high	93.2	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.008	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	147.2	173.4	-65.2	-107.6	0	0	0	110.2	Q251 T263 A265 R268 F275 M291	Q251-W270 HydrophobicContact CB-CD2 4.34Å; Q251-W270 HydrophobicContact CB-CZ2 4.02Å; Q251-W270 HydrophobicContact CG-CZ2 4.14Å; T263-W270 PolarHBondContact N-O 2.81Å; T263-W270 PolarHBondContact O-N 3.09Å; A265-W270 HydrophobicContact CB-CE3 4.42Å; A265-W270 HydrophobicContact CB-CH2 4.04Å; A265-W270 HydrophobicContact CB-CZ3 3.6Å; A265-W270 WeakPolarHBondContact O-CH2 3.48Å; A265-W270 VanDerWaalsContact O-CZ3 3.24Å; A265-W270 WeakPolarHBondContact O-CZ3 3.15Å; R268-W270 VanDerWaalsContact C-CZ3 3.41Å; R268-W270 HydrophobicContact CB-CE3 4.44Å; R268-W270 HydrophobicContact CB-CH2 3.51Å; R268-W270 HydrophobicContact CB-CZ2 4.28Å; R268-W270 HydrophobicContact CB-CZ3 3.59Å; R268-W270 WeakPolarHBondContact O-CZ3 3.47Å; W270-F275 HydrophobicContact CB-CB 3.98Å; W270-F275 HydrophobicContact CB-CD2 4.4Å; W270-F275 AromaticContact CD2-CD2 3.72Å; W270-F275 HydrophobicContact CD2-CD2 3.72Å; W270-F275 HydrophobicContact CD2-CE2 4.35Å; W270-F275 AromaticContact CE3-CD2 3.96Å; W270-F275 HydrophobicContact CE3-CD2 3.96Å; W270-F275 HydrophobicContact CE3-CE2 4.31Å; W270-F275 HydrophobicContact CG-CB 4.26Å; W270-F275 AromaticContact CG-CD2 3.92Å; W270-F275 HydrophobicContact CG-CD2 3.92Å; W270-F275 HydrophobicContact CH2-CE2 4.48Å; W270-F275 HydrophobicContact CZ2-CE2 4.5Å; W270-F275 HydrophobicContact CZ3-CD2 4.48Å; W270-F275 HydrophobicContact CZ3-CE2 4.4Å; W270-M291 HydrophobicContact CH2-CE 3.81Å; W270-M291 HydrophobicContact CZ2-CE 3.99Å
271	H	94.2	Very high	93.5	Very high	29 Å²	29	54.1 Å²	54.1	13%	0.134	27%	0.269	C	S	.	.			trans	-58.1	143.6	156.8	-67.1	104.6	0	0	0	108.8	C250 C253 K273 H274 F275	C250-H271 WeakPolarHBondContact CB-ND1 3.43Å; C250-H271 PolarHBondContact SG-N 2.88Å; C250-H271 VanDerWaalsContact SG-N 3.36Å; C250-H271 PolarHBondContact SG-ND1 2.69Å; C253-H271 PolarHBondContact SG-ND1 3.46Å; C253-H271 VanDerWaalsContact SG-ND1 3.42Å; H271-K273 PolarHBondContact O-N 3.21Å; H271-K273 VanDerWaalsContact O-N 3.08Å; H271-H274 HydrophobicContact CB-CB 4.14Å; H271-H274 AromaticContact CG-ND1 3.85Å; H271-H274 AromaticContact ND1-CE1 3.89Å; H271-H274 AromaticContact ND1-ND1 3.45Å; H271-H274 PolarHBondContact ND1-ND1 3.32Å; H271-H274 WeakPolarHBondContact O-CA 3.42Å; H271-H274 PolarHBondContact O-N 3.18Å; H271-F275 PolarHBondContact O-N 2.88Å
272	M	91.4	Very high	93.7	Very high	100 Å²	100	52.5 Å²	52.5	49%	0.493	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-53.9	-36.8	-175.6	-58.9	-175	81.4	0	0	113.5	E261 H274	E261-M272 HydrophobicContact CB-SD 4.12Å; M272-H274 VanDerWaalsContact C-N 3.33Å
273	K	91.3	Very high	93.8	Very high	189 Å²	189	55.9 Å²	55.9	82%	0.822	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-75.6	-17.8	177.5	-63.7	178.8	-177.6	172.2	0	114.1	H271	H271-K273 PolarHBondContact O-N 3.21Å; H271-K273 VanDerWaalsContact O-N 3.08Å
274	H	94.6	Very high	93.8	Very high	28 Å²	28	55.5 Å²	55.5	13%	0.13	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-100.7	-5.3	-175.8	-61.7	167.9	0	0	0	113	W41 A252 C253 H271 M272 C276	W41-H274 HydrophobicContact CE3-CB 4.48Å; W41-H274 AromaticContact CE3-CD2 3.49Å; W41-H274 VanDerWaalsContact CE3-CD2 3.49Å; W41-H274 AromaticContact CE3-CE1 3.97Å; W41-H274 AromaticContact CE3-CG 3.78Å; W41-H274 AromaticContact CE3-NE2 3.65Å; W41-H274 HydrophobicContact CH2-CB 4.15Å; W41-H274 HydrophobicContact CZ3-CB 3.67Å; W41-H274 AromaticContact CZ3-CD2 3.48Å; W41-H274 VanDerWaalsContact CZ3-CD2 3.48Å; W41-H274 WeakPolarHBondContact CZ3-CD2 3.48Å; W41-H274 AromaticContact CZ3-CG 3.44Å; W41-H274 VanDerWaalsContact CZ3-CG 3.44Å; A252-H274 HydrophobicContact CB-CB 4.21Å; C253-H274 WeakPolarHBondContact CB-ND1 3.47Å; C253-H274 VanDerWaalsContact SG-CE1 3.52Å; C253-H274 PolarHBondContact SG-ND1 2.77Å; H271-H274 HydrophobicContact CB-CB 4.14Å; H271-H274 AromaticContact CG-ND1 3.85Å; H271-H274 AromaticContact ND1-CE1 3.89Å; H271-H274 AromaticContact ND1-ND1 3.45Å; H271-H274 PolarHBondContact ND1-ND1 3.32Å; H271-H274 WeakPolarHBondContact O-CA 3.42Å; H271-H274 PolarHBondContact O-N 3.18Å; M272-H274 VanDerWaalsContact C-N 3.33Å; H274-C276 PolarHBondContact O-N 3.19Å
275	F	95.9	Very high	93.6	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.009	31%	0.309	C	S	.	.			trans	-79.9	75.5	167.1	-168	-110.1	0	0	0	109.9	T263 A265 W270 H271 L284 Y289 P296	T263-F275 HydrophobicContact CG2-CB 3.98Å; T263-F275 HydrophobicContact CG2-CD1 3.81Å; T263-F275 HydrophobicContact CG2-CD2 4.07Å; T263-F275 HydrophobicContact CG2-CE1 4.35Å; T263-F275 HydrophobicContact CG2-CG 3.66Å; A265-F275 HydrophobicContact CB-CE2 4Å; A265-F275 HydrophobicContact CB-CZ 4.25Å; W270-F275 HydrophobicContact CB-CB 3.98Å; W270-F275 HydrophobicContact CB-CD2 4.4Å; W270-F275 AromaticContact CD2-CD2 3.72Å; W270-F275 HydrophobicContact CD2-CD2 3.72Å; W270-F275 HydrophobicContact CD2-CE2 4.35Å; W270-F275 AromaticContact CE3-CD2 3.96Å; W270-F275 HydrophobicContact CE3-CD2 3.96Å; W270-F275 HydrophobicContact CE3-CE2 4.31Å; W270-F275 HydrophobicContact CG-CB 4.26Å; W270-F275 AromaticContact CG-CD2 3.92Å; W270-F275 HydrophobicContact CG-CD2 3.92Å; W270-F275 HydrophobicContact CH2-CE2 4.48Å; W270-F275 HydrophobicContact CZ2-CE2 4.5Å; W270-F275 HydrophobicContact CZ3-CD2 4.48Å; W270-F275 HydrophobicContact CZ3-CE2 4.4Å; H271-F275 PolarHBondContact O-N 2.88Å; F275-L284 HydrophobicContact CD1-CB 3.66Å; F275-L284 HydrophobicContact CE1-CB 3.46Å; F275-L284 VanDerWaalsContact CE1-CB 3.46Å; F275-L284 HydrophobicContact CZ-CB 4.21Å; F275-L284 PolarHBondContact O-N 3.06Å; F275-Y289 HydrophobicContact CE1-CD1 4.24Å; F275-Y289 HydrophobicContact CE1-CE1 4.24Å; F275-Y289 HydrophobicContact CE2-CE2 4.3Å; F275-Y289 AromaticContact CZ-CD1 3.93Å; F275-Y289 HydrophobicContact CZ-CD1 3.93Å; F275-Y289 AromaticContact CZ-CD2 3.95Å; F275-Y289 HydrophobicContact CZ-CD2 3.95Å; F275-Y289 AromaticContact CZ-CE1 3.76Å; F275-Y289 HydrophobicContact CZ-CE1 3.76Å; F275-Y289 AromaticContact CZ-CE2 3.74Å; F275-Y289 HydrophobicContact CZ-CE2 3.74Å; F275-Y289 HydrophobicContact CZ-CG 4.05Å; F275-Y289 AromaticContact CZ-CZ 3.68Å; F275-P296 HydrophobicContact CE2-CB 4.23Å; F275-P296 HydrophobicContact CE2-CG 4.44Å
276	C	95.7	Very high	93.4	Very high	6 Å²	6	57.9 Å²	57.9	4%	0.041	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-133.9	159.2	-176	65.2	0	0	0	0	111.5	H274 F278 E281 A282	H274-C276 PolarHBondContact O-N 3.19Å; C276-F278 PolarHBondContact O-N 3.24Å; C276-E281 VanDerWaalsContact CB-O 3.31Å; C276-E281 WeakPolarHBondContact CB-O 3.38Å; C276-A282 CarbonylContact C-O 3.55Å; C276-A282 VanDerWaalsContact CA-O 3.22Å; C276-A282 WeakPolarHBondContact CA-O 3.5Å; C276-A282 WeakPolarHBondContact CB-O 3.49Å
277	C	96.1	Very high	93.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.339	C	S	.	.			trans	-54.7	130.5	176.6	-176.4	0	0	0	0	110.2	R42 E279 C280 E281 A282 L284 P296 C298	R42-C277 PolarHBondContact NH2-O 3.27Å; C277-E279 PolarHBondContact O-N 2.83Å; C277-C280 VanDerWaalsContact CB-SG 3.52Å; C277-E281 VanDerWaalsContact O-CA 3.23Å; C277-E281 WeakPolarHBondContact O-CA 3.18Å; C277-E281 PolarHBondContact O-N 2.84Å; C277-A282 PolarHBondContact N-O 2.61Å; C277-L284 HydrophobicContact CB-CD2 4.43Å; C277-P296 WeakPolarHBondContact CA-O 3.15Å; C277-C298 HydrophobicContact CB-CB 4.3Å; C277-C298 PolarHBondContact SG-N 2.66Å; C277-C298 VanDerWaalsContact SG-N 3.36Å
278	F	94.8	Very high	93.5	Very high	26 Å²	26	59.9 Å²	59.9	11%	0.114	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-29.3	-179.2	-169.6	-99.9	0	0	0	112.6	I44 K49 C276 R295 P296 Y297	I44-F278 HydrophobicContact CD1-CE2 4.15Å; I44-F278 HydrophobicContact CD1-CZ 4.13Å; K49-F278 HydrophobicContact CB-CE1 4.4Å; K49-F278 HydrophobicContact CB-CZ 4.03Å; K49-F278 HydrophobicContact CD-CZ 4.48Å; K49-F278 HydrophobicContact CG-CE1 4.13Å; K49-F278 HydrophobicContact CG-CZ 4.16Å; C276-F278 PolarHBondContact O-N 3.24Å; F278-R295 HydrophobicContact CB-CB 4.15Å; F278-R295 HydrophobicContact CD2-CB 4.21Å; F278-R295 HydrophobicContact CD2-CG 3.91Å; F278-R295 HydrophobicContact CE2-CG 4.11Å; F278-R295 HydrophobicContact CG-CB 4.07Å; F278-R295 HydrophobicContact CG-CG 4.12Å; F278-R295 HydrophobicContact CZ-CG 4.48Å; F278-P296 PolarHBondContact N-O 3.4Å; F278-Y297 HydrophobicContact CB-CD1 4.49Å; F278-Y297 HydrophobicContact CB-CE1 4.1Å; F278-Y297 HydrophobicContact CD1-CE1 4.44Å
279	E	94.4	Very high	93.5	Very high	107 Å²	107	55.3 Å²	55.3	50%	0.5	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-61.5	-178.7	-165.1	59.1	-144.2	0	0	112.6	C277 Y297 C301 L305	C277-E279 PolarHBondContact O-N 2.83Å; E279-Y297 HydrophobicContact CB-CD1 4.49Å; E279-Y297 HydrophobicContact CB-CE1 4.5Å; E279-C301 HydrophobicContact CB-CB 4.16Å; E279-L305 HydrophobicContact CB-CD1 4.47Å; E279-L305 HydrophobicContact CG-CD1 4.22Å
280	C	94.8	Very high	93.5	Very high	66 Å²	66	52.3 Å²	52.3	45%	0.446	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	2.5	-172.2	68.7	0	0	0	0	115.3	C277 A282	C277-C280 VanDerWaalsContact CB-SG 3.52Å; C280-A282 PolarHBondContact O-N 3.19Å
281	E	93.5	Very high	93.4	Very high	87 Å²	87	54.4 Å²	54.4	41%	0.407	31%	0.307	S	S	.	.			trans	57.5	8.6	-178.1	-46.9	-156.5	142.1	0	0	116.3	H39 R42 C276 C277 A283	H39-E281 IonicContact CE1-OE1 3.5Å; H39-E281 PolarHBondContact CE1-OE1 3.08Å; H39-E281 IonicContact NE2-OE1 3.15Å; H39-E281 PolarHBondContact NE2-OE1 3.32Å; R42-E281 IonicContact CZ-OE1 2.87Å; R42-E281 IonicContact NH1-OE1 3.24Å; R42-E281 PolarHBondContact NH1-OE1 3.38Å; R42-E281 IonicContact NH2-OE1 3.78Å; C276-E281 VanDerWaalsContact CB-O 3.31Å; C276-E281 WeakPolarHBondContact CB-O 3.38Å; C277-E281 VanDerWaalsContact O-CA 3.23Å; C277-E281 WeakPolarHBondContact O-CA 3.18Å; C277-E281 PolarHBondContact O-N 2.84Å; E281-A283 PolarHBondContact O-N 3.3Å
282	A	95.2	Very high	93.2	Very high	47 Å²	47	57.2 Å²	57.2	39%	0.388	32%	0.316	S	S	.	.			trans	-60.5	131.1	174.1	0	0	0	0	0	111.1	C276 C277 C280 L284	C276-A282 CarbonylContact C-O 3.55Å; C276-A282 VanDerWaalsContact CA-O 3.22Å; C276-A282 WeakPolarHBondContact CA-O 3.5Å; C276-A282 WeakPolarHBondContact CB-O 3.49Å; C277-A282 PolarHBondContact N-O 2.61Å; C280-A282 PolarHBondContact O-N 3.19Å; A282-L284 PolarHBondContact O-N 3.4Å
283	A	94.8	Very high	93.2	Very high	75 Å²	75	58.6 Å²	58.6	62%	0.62	32%	0.322	S	S	*	.	B	Isolated β-bridge	trans	-62.4	134	179.1	0	0	0	0	0	111.4	E281	E281-A283 PolarHBondContact O-N 3.3Å
284	L	95.3	Very high	93.1	Very high	2 Å²	2	52 Å²	52	1%	0.01	30%	0.299	C	S	.	.			trans	-104.3	-0.1	-175.2	-63.3	173.9	0	0	0	113.4	F275 C277 A282 G286 Q287 Y289 P296 C298	F275-L284 HydrophobicContact CD1-CB 3.66Å; F275-L284 HydrophobicContact CE1-CB 3.46Å; F275-L284 VanDerWaalsContact CE1-CB 3.46Å; F275-L284 HydrophobicContact CZ-CB 4.21Å; F275-L284 PolarHBondContact O-N 3.06Å; C277-L284 HydrophobicContact CB-CD2 4.43Å; A282-L284 PolarHBondContact O-N 3.4Å; L284-G286 PolarHBondContact O-N 2.82Å; L284-Q287 PolarHBondContact O-N 3.34Å; L284-Y289 HydrophobicContact CD1-CG 4.46Å; L284-P296 HydrophobicContact CD1-CB 3.64Å; L284-P296 HydrophobicContact CD1-CG 4.2Å; L284-C298 HydrophobicContact CD2-CB 3.75Å
285	G	89.6	Confident	93	Very high	52 Å²	52	54.3 Å²	54.3	54%	0.536	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	119.9	176.5	0	0	0	0	0	111.6	Q287	G285-Q287 PolarHBondContact O-N 3.42Å
286	G	85.7	Confident	92.9	Very high	59 Å²	59	54.6 Å²	54.6	61%	0.608	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	-3.8	-175.9	0	0	0	0	0	115.8	L284	L284-G286 PolarHBondContact O-N 2.82Å
287	Q	89.5	Confident	92.9	Very high	118 Å²	118	54.6 Å²	54.6	55%	0.551	31%	0.308	S	S	*	.	S	Bend	trans	-92	166.2	178	-58.3	-56.4	-39.6	0	0	111.6	L284 G285	L284-Q287 PolarHBondContact O-N 3.34Å; G285-Q287 PolarHBondContact O-N 3.42Å
288	R	92	Very high	92.9	Very high	83 Å²	83	55.8 Å²	55.8	31%	0.313	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	139.7	165.7	-71.1	-179.3	57.2	-164.5	-6.3	110.1	D320 N502	R288-D320 IonicContact CZ-OD1 2.68Å; R288-D320 IonicContact CZ-OD2 3.48Å; R288-D320 IonicContact NH1-OD1 3.03Å; R288-D320 PolarHBondContact NH1-OD1 3.27Å; R288-D320 IonicContact NH1-OD2 3.12Å; R288-D320 PolarHBondContact NH1-OD2 3.4Å; R288-D320 IonicContact NH2-OD1 2.76Å; R288-D320 PolarHBondContact NH2-OD1 3.36Å; R288-D320 IonicContact NH2-OD2 2.67Å; R288-D320 PolarHBondContact NH2-OD2 2.75Å; R288-N502 PolarHBondContact NE-OD1 3.26Å; R288-N502 VanDerWaalsContact NH2-CG 3.34Å; R288-N502 PolarHBondContact NH2-ND2 2.85Å; R288-N502 PolarHBondContact NH2-OD1 3Å
289	Y	94.5	Very high	92.9	Very high	4 Å²	4	55.7 Å²	55.7	2%	0.016	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	162.4	177.1	68.7	-76.8	0	0	0	110.2	A265 F275 L284 M291 P296 Y297 S503	A265-Y289 HydrophobicContact CB-CE2 4.43Å; A265-Y289 WeakPolarHBondContact CB-OH 3.22Å; F275-Y289 HydrophobicContact CE1-CD1 4.24Å; F275-Y289 HydrophobicContact CE1-CE1 4.24Å; F275-Y289 HydrophobicContact CE2-CE2 4.3Å; F275-Y289 AromaticContact CZ-CD1 3.93Å; F275-Y289 HydrophobicContact CZ-CD1 3.93Å; F275-Y289 AromaticContact CZ-CD2 3.95Å; F275-Y289 HydrophobicContact CZ-CD2 3.95Å; F275-Y289 AromaticContact CZ-CE1 3.76Å; F275-Y289 HydrophobicContact CZ-CE1 3.76Å; F275-Y289 AromaticContact CZ-CE2 3.74Å; F275-Y289 HydrophobicContact CZ-CE2 3.74Å; F275-Y289 HydrophobicContact CZ-CG 4.05Å; F275-Y289 AromaticContact CZ-CZ 3.68Å; L284-Y289 HydrophobicContact CD1-CG 4.46Å; Y289-M291 HydrophobicContact CD2-CG 3.92Å; Y289-M291 HydrophobicContact CD2-SD 4.22Å; Y289-M291 HydrophobicContact CE2-CG 3.51Å; Y289-M291 HydrophobicContact CE2-SD 3.96Å; Y289-P296 HydrophobicContact CD2-CB 4.07Å; Y289-Y297 CarbonylContact C-O 3.49Å; Y289-Y297 WeakPolarHBondContact CA-O 3.47Å; Y289-Y297 VanDerWaalsContact CB-O 3.32Å; Y289-Y297 WeakPolarHBondContact CB-O 3.32Å; Y289-S503 VanDerWaalsContact CD1-O 3.32Å; Y289-S503 WeakPolarHBondContact CD1-O 3.42Å; Y289-S503 WeakPolarHBondContact CE1-O 3.42Å; Y289-S503 VanDerWaalsContact OH-CB 3.25Å; Y289-S503 WeakPolarHBondContact OH-CB 3.08Å
290	I	93.7	Very high	92.9	Very high	16 Å²	16	54.7 Å²	54.7	8%	0.082	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.9	171.3	-62.5	172.7	0	0	0	108.8	Y297 Y302 I319	I290-Y297 PolarHBondContact N-O 2.81Å; I290-Y297 PolarHBondContact O-N 2.9Å; I290-Y302 HydrophobicContact CB-CD2 3.71Å; I290-Y302 HydrophobicContact CB-CE2 4.05Å; I290-Y302 HydrophobicContact CB-CG 4.16Å; I290-Y302 HydrophobicContact CD1-CD1 3.59Å; I290-Y302 HydrophobicContact CD1-CD2 3.98Å; I290-Y302 HydrophobicContact CD1-CE1 3.94Å; I290-Y302 HydrophobicContact CD1-CE2 4.28Å; I290-Y302 HydrophobicContact CD1-CG 3.63Å; I290-Y302 HydrophobicContact CG1-CD2 4.45Å; I290-Y302 HydrophobicContact CG1-CG 4.45Å; I290-Y302 HydrophobicContact CG2-CD2 3.6Å; I290-Y302 HydrophobicContact CG2-CE2 3.38Å; I290-Y302 HydrophobicContact CG2-CG 4.36Å; I290-I319 HydrophobicContact CD1-CB 4.43Å; I290-I319 HydrophobicContact CD1-CD1 3.38Å; I290-I319 HydrophobicContact CD1-CG1 3.64Å; I290-I319 HydrophobicContact CD1-CG2 3.88Å
291	M	93.8	Very high	92.9	Very high	47 Å²	47	52.4 Å²	52.4	23%	0.232	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.4	173.6	-71.1	-73.1	-79.6	0	0	110.1	E266 W270 Y289 R295 P296	E266-M291 HydrophobicContact CB-CE 4.28Å; E266-M291 HydrophobicContact CG-CB 4.32Å; E266-M291 HydrophobicContact CG-CE 4.19Å; E266-M291 HydrophobicContact CG-CG 3.79Å; W270-M291 HydrophobicContact CH2-CE 3.81Å; W270-M291 HydrophobicContact CZ2-CE 3.99Å; Y289-M291 HydrophobicContact CD2-CG 3.92Å; Y289-M291 HydrophobicContact CD2-SD 4.22Å; Y289-M291 HydrophobicContact CE2-CG 3.51Å; Y289-M291 HydrophobicContact CE2-SD 3.96Å; M291-R295 WeakPolarHBondContact CA-O 3.32Å; M291-P296 VanDerWaalsContact SD-CA 3.59Å; M291-P296 HydrophobicContact SD-CB 3.6Å; M291-P296 VanDerWaalsContact SD-CB 3.6Å; M291-P296 HydrophobicContact SD-CG 4.37Å
292	R	91.7	Very high	93	Very high	87 Å²	87	51 Å²	51	33%	0.328	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	126.5	174.5	-164.9	179.4	-175.6	-78.5	-0.5	107.9	S294 R295 Y297 Y302 Y306	R292-S294 PolarHBondContact O-N 3.15Å; R292-R295 PolarHBondContact N-O 2.73Å; R292-R295 WeakPolarHBondContact O-CB 3.2Å; R292-R295 PolarHBondContact O-N 2.78Å; R292-Y297 HydrophobicContact CB-CD2 4.2Å; R292-Y297 HydrophobicContact CB-CE2 4.01Å; R292-Y302 HydrophobicContact CB-CE2 4.22Å; R292-Y302 HydrophobicContact CG-CE2 4.48Å; R292-Y306 VanDerWaalsContact CD-CE2 3.48Å
293	E	89.6	Confident	92.9	Very high	130 Å²	130	51.5 Å²	51.5	61%	0.607	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	40	-178.8	-60.9	167.1	-150.2	0	0	113.5	R295	E293-R295 PolarHBondContact O-N 3Å
294	S	89.8	Confident	92.7	Very high	49 Å²	49	52.5 Å²	52.5	34%	0.343	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	10	-173.4	71.7	0	0	0	0	116.8	R292	R292-S294 PolarHBondContact O-N 3.15Å
295	R	92.1	Very high	92.5	Very high	78 Å²	78	56.3 Å²	56.3	29%	0.294	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.3	175.3	-66	167.4	174.6	170.3	-4.7	110.3	F278 M291 R292 E293 Y297	F278-R295 HydrophobicContact CB-CB 4.15Å; F278-R295 HydrophobicContact CD2-CB 4.21Å; F278-R295 HydrophobicContact CD2-CG 3.91Å; F278-R295 HydrophobicContact CE2-CG 4.11Å; F278-R295 HydrophobicContact CG-CB 4.07Å; F278-R295 HydrophobicContact CG-CG 4.12Å; F278-R295 HydrophobicContact CZ-CG 4.48Å; M291-R295 WeakPolarHBondContact CA-O 3.32Å; R292-R295 PolarHBondContact N-O 2.73Å; R292-R295 WeakPolarHBondContact O-CB 3.2Å; R292-R295 PolarHBondContact O-N 2.78Å; E293-R295 PolarHBondContact O-N 3Å; R295-Y297 HydrophobicContact CB-CD2 4.49Å; R295-Y297 HydrophobicContact CB-CE2 3.68Å; R295-Y297 WeakPolarHBondContact O-CD2 3.48Å; R295-Y297 WeakPolarHBondContact O-CE2 3.32Å
296	P	95.3	Very high	92.6	Very high	7 Å²	7	56.8 Å²	56.8	5%	0.045	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	135.6	176.6	32.9	-33.7	0	0	0	111.4	F275 C277 F278 L284 Y289 M291	F275-P296 HydrophobicContact CE2-CB 4.23Å; F275-P296 HydrophobicContact CE2-CG 4.44Å; C277-P296 WeakPolarHBondContact CA-O 3.15Å; F278-P296 PolarHBondContact N-O 3.4Å; L284-P296 HydrophobicContact CD1-CB 3.64Å; L284-P296 HydrophobicContact CD1-CG 4.2Å; Y289-P296 HydrophobicContact CD2-CB 4.07Å; M291-P296 VanDerWaalsContact SD-CA 3.59Å; M291-P296 HydrophobicContact SD-CB 3.6Å; M291-P296 VanDerWaalsContact SD-CB 3.6Å; M291-P296 HydrophobicContact SD-CG 4.37Å
297	Y	95.7	Very high	92.8	Very high	7 Å²	7	54.7 Å²	54.7	3%	0.027	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	142	176.3	-64.9	-95.3	0	0	0	109.9	F278 E279 Y289 I290 R292 R295 L305 Y306	F278-Y297 HydrophobicContact CB-CD1 4.49Å; F278-Y297 HydrophobicContact CB-CE1 4.1Å; F278-Y297 HydrophobicContact CD1-CE1 4.44Å; E279-Y297 HydrophobicContact CB-CD1 4.49Å; E279-Y297 HydrophobicContact CB-CE1 4.5Å; Y289-Y297 CarbonylContact C-O 3.49Å; Y289-Y297 WeakPolarHBondContact CA-O 3.47Å; Y289-Y297 VanDerWaalsContact CB-O 3.32Å; Y289-Y297 WeakPolarHBondContact CB-O 3.32Å; I290-Y297 PolarHBondContact N-O 2.81Å; I290-Y297 PolarHBondContact O-N 2.9Å; R292-Y297 HydrophobicContact CB-CD2 4.2Å; R292-Y297 HydrophobicContact CB-CE2 4.01Å; R295-Y297 HydrophobicContact CB-CD2 4.49Å; R295-Y297 HydrophobicContact CB-CE2 3.68Å; R295-Y297 WeakPolarHBondContact O-CD2 3.48Å; R295-Y297 WeakPolarHBondContact O-CE2 3.32Å; Y297-L305 HydrophobicContact CD1-CD1 4.32Å; Y297-L305 HydrophobicContact CE1-CD1 4.06Å; Y297-Y306 HydrophobicContact CD1-CE2 4.46Å; Y297-Y306 HydrophobicContact CE1-CE2 4.28Å; Y297-Y306 HydrophobicContact CE2-CE2 4.49Å; Y297-Y306 PolarHBondContact OH-OH 2.95Å
298	C	96.1	Very high	92.9	Very high	24 Å²	24	53.5 Å²	53.5	16%	0.162	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	155.3	164.5	68.2	0	0	0	0	109.8	C277 L284 S300 C301 Y302	C277-C298 HydrophobicContact CB-CB 4.3Å; C277-C298 PolarHBondContact SG-N 2.66Å; C277-C298 VanDerWaalsContact SG-N 3.36Å; L284-C298 HydrophobicContact CD2-CB 3.75Å; C298-S300 VanDerWaalsContact C-N 3.31Å; C298-S300 PolarHBondContact O-N 3.24Å; C298-C301 PolarHBondContact O-N 3.15Å; C298-C301 PolarHBondContact SG-N 3.13Å; C298-Y302 PolarHBondContact O-N 2.9Å
299	C	93.7	Very high	93	Very high	25 Å²	25	56.5 Å²	56.5	17%	0.169	29%	0.286	C	S	.	.	H	α-helix	trans	-52.5	-46.6	-178	-62.6	0	0	0	0	112.7	C301 Y302 E303 I319	C299-C301 PolarHBondContact O-N 2.9Å; C299-Y302 PolarHBondContact O-N 2.88Å; C299-E303 WeakPolarHBondContact O-CG 3.45Å; C299-E303 PolarHBondContact O-N 3.14Å; C299-I319 HydrophobicContact CB-CD1 3.61Å; C299-I319 WeakPolarHBondContact O-CD1 3.38Å
300	S	94.3	Very high	93.1	Very high	85 Å²	85	56.4 Å²	56.4	59%	0.594	29%	0.285	S	S	*	.	H	α-helix	trans	-62.2	-42.7	179.9	171.2	0	0	0	0	113.9	C298 S304	C298-S300 VanDerWaalsContact C-N 3.31Å; C298-S300 PolarHBondContact O-N 3.24Å; S300-S304 VanDerWaalsContact O-CB 3.32Å; S300-S304 WeakPolarHBondContact O-CB 3.39Å; S300-S304 PolarHBondContact O-N 3.06Å
301	C	96.2	Very high	93.1	Very high	19 Å²	19	60.1 Å²	60.1	13%	0.128	31%	0.305	C	S	.	.	H	α-helix	trans	-70.7	-34	175.1	-71.3	0	0	0	0	111.9	E279 C298 C299 L305	E279-C301 HydrophobicContact CB-CB 4.16Å; C298-C301 PolarHBondContact O-N 3.15Å; C298-C301 PolarHBondContact SG-N 3.13Å; C299-C301 PolarHBondContact O-N 2.9Å; C301-L305 WeakPolarHBondContact O-CB 3.22Å; C301-L305 WeakPolarHBondContact O-CD1 3.23Å; C301-L305 WeakPolarHBondContact O-CG 3.31Å; C301-L305 PolarHBondContact O-N 3.17Å; C301-L305 VanDerWaalsContact O-N 3.15Å
302	Y	94.6	Very high	93	Very high	56 Å²	56	60.9 Å²	60.9	22%	0.22	31%	0.313	C	S	.	.	H	α-helix	trans	-65.6	-46.9	176.1	-173	-79.9	0	0	0	111.1	I290 R292 C298 C299 L305 Y306 I319	I290-Y302 HydrophobicContact CB-CD2 3.71Å; I290-Y302 HydrophobicContact CB-CE2 4.05Å; I290-Y302 HydrophobicContact CB-CG 4.16Å; I290-Y302 HydrophobicContact CD1-CD1 3.59Å; I290-Y302 HydrophobicContact CD1-CD2 3.98Å; I290-Y302 HydrophobicContact CD1-CE1 3.94Å; I290-Y302 HydrophobicContact CD1-CE2 4.28Å; I290-Y302 HydrophobicContact CD1-CG 3.63Å; I290-Y302 HydrophobicContact CG1-CD2 4.45Å; I290-Y302 HydrophobicContact CG1-CG 4.45Å; I290-Y302 HydrophobicContact CG2-CD2 3.6Å; I290-Y302 HydrophobicContact CG2-CE2 3.38Å; I290-Y302 HydrophobicContact CG2-CG 4.36Å; R292-Y302 HydrophobicContact CB-CE2 4.22Å; R292-Y302 HydrophobicContact CG-CE2 4.48Å; C298-Y302 PolarHBondContact O-N 2.9Å; C299-Y302 PolarHBondContact O-N 2.88Å; Y302-L305 PolarHBondContact O-N 3.08Å; Y302-Y306 HydrophobicContact CD1-CD2 4.3Å; Y302-Y306 AromaticContact CD2-CD2 3.57Å; Y302-Y306 HydrophobicContact CD2-CD2 3.57Å; Y302-Y306 HydrophobicContact CD2-CE2 4.11Å; Y302-Y306 HydrophobicContact CE1-CD2 4.38Å; Y302-Y306 AromaticContact CE2-CD2 3.68Å; Y302-Y306 HydrophobicContact CE2-CD2 3.68Å; Y302-Y306 HydrophobicContact CE2-CE2 4.32Å; Y302-Y306 HydrophobicContact CE2-CG 4.44Å; Y302-Y306 AromaticContact CG-CD2 3.89Å; Y302-Y306 HydrophobicContact CG-CD2 3.89Å; Y302-Y306 WeakPolarHBondContact O-CA 3.41Å; Y302-Y306 WeakPolarHBondContact O-CB 3.37Å; Y302-Y306 WeakPolarHBondContact O-CD2 3.24Å; Y302-Y306 PolarHBondContact O-N 3.22Å; Y302-I319 HydrophobicContact CD1-CD1 4.06Å; Y302-I319 HydrophobicContact CD1-CG1 4.14Å; Y302-I319 HydrophobicContact CG-CD1 4.49Å
303	E	92.3	Very high	93.2	Very high	59 Å²	59	59.5 Å²	59.5	28%	0.276	32%	0.316	S	S	.	.	H	α-helix	trans	-61.2	-46.3	175.7	-74.4	165.9	164.7	0	0	111.4	C299 L305 Y306 A307 G318 I319	C299-E303 WeakPolarHBondContact O-CG 3.45Å; C299-E303 PolarHBondContact O-N 3.14Å; E303-L305 PolarHBondContact O-N 3.01Å; E303-Y306 PolarHBondContact O-N 3.48Å; E303-A307 HydrophobicContact CB-CB 4.33Å; E303-A307 WeakPolarHBondContact O-CB 3.39Å; E303-A307 PolarHBondContact O-N 3.35Å; E303-G318 WeakPolarHBondContact OE1-CA 3.23Å; E303-I319 HydrophobicContact CG-CD1 3.57Å; E303-I319 HydrophobicContact CG-CG1 3.71Å; E303-I319 WeakPolarHBondContact OE1-CG1 3.43Å; E303-I319 PolarHBondContact OE1-N 3.21Å
304	S	91.6	Very high	93.3	Very high	96 Å²	96	55.8 Å²	55.8	67%	0.671	31%	0.312	S	S	*	.	H	α-helix	trans	-63.2	-23.4	179.2	-174.8	0	0	0	0	114.3	S300	S300-S304 VanDerWaalsContact O-CB 3.32Å; S300-S304 WeakPolarHBondContact O-CB 3.39Å; S300-S304 PolarHBondContact O-N 3.06Å
305	L	91.2	Very high	93.5	Very high	81 Å²	81	59.7 Å²	59.7	42%	0.424	33%	0.325	S	S	.	.	H	α-helix	trans	-103.7	-25.6	-177.6	-68.5	173	0	0	0	113.5	E279 Y297 C301 Y302 E303	E279-L305 HydrophobicContact CB-CD1 4.47Å; E279-L305 HydrophobicContact CG-CD1 4.22Å; Y297-L305 HydrophobicContact CD1-CD1 4.32Å; Y297-L305 HydrophobicContact CE1-CD1 4.06Å; C301-L305 WeakPolarHBondContact O-CB 3.22Å; C301-L305 WeakPolarHBondContact O-CD1 3.23Å; C301-L305 WeakPolarHBondContact O-CG 3.31Å; C301-L305 PolarHBondContact O-N 3.17Å; C301-L305 VanDerWaalsContact O-N 3.15Å; Y302-L305 PolarHBondContact O-N 3.08Å; E303-L305 PolarHBondContact O-N 3.01Å
306	Y	90.4	Very high	93.5	Very high	63 Å²	63	58.4 Å²	58.4	25%	0.247	33%	0.328	C	S	.	.	H	α-helix	trans	-143.1	6.7	-164.6	-47.4	-59.5	0	0	0	114.7	R292 Y297 Y302 E303	R292-Y306 VanDerWaalsContact CD-CE2 3.48Å; Y297-Y306 HydrophobicContact CD1-CE2 4.46Å; Y297-Y306 HydrophobicContact CE1-CE2 4.28Å; Y297-Y306 HydrophobicContact CE2-CE2 4.49Å; Y297-Y306 PolarHBondContact OH-OH 2.95Å; Y302-Y306 HydrophobicContact CD1-CD2 4.3Å; Y302-Y306 AromaticContact CD2-CD2 3.57Å; Y302-Y306 HydrophobicContact CD2-CD2 3.57Å; Y302-Y306 HydrophobicContact CD2-CE2 4.11Å; Y302-Y306 HydrophobicContact CE1-CD2 4.38Å; Y302-Y306 AromaticContact CE2-CD2 3.68Å; Y302-Y306 HydrophobicContact CE2-CD2 3.68Å; Y302-Y306 HydrophobicContact CE2-CE2 4.32Å; Y302-Y306 HydrophobicContact CE2-CG 4.44Å; Y302-Y306 AromaticContact CG-CD2 3.89Å; Y302-Y306 HydrophobicContact CG-CD2 3.89Å; Y302-Y306 WeakPolarHBondContact O-CA 3.41Å; Y302-Y306 WeakPolarHBondContact O-CB 3.37Å; Y302-Y306 WeakPolarHBondContact O-CD2 3.24Å; Y302-Y306 PolarHBondContact O-N 3.22Å; E303-Y306 PolarHBondContact O-N 3.48Å
307	A	90.2	Very high	93.4	Very high	15 Å²	15	58.6 Å²	58.6	12%	0.124	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-70.7	133.2	172.3	0	0	0	0	0	110.5	E303	E303-A307 HydrophobicContact CB-CB 4.33Å; E303-A307 WeakPolarHBondContact O-CB 3.39Å; E303-A307 PolarHBondContact O-N 3.35Å
308	E	92.9	Very high	93.1	Very high	93 Å²	93	58.8 Å²	58.8	44%	0.435	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-76.7	153.6	166.7	-57.1	-61.1	169.9	0	0	109.8	I317 H330	E308-I317 PolarHBondContact O-N 2.94Å; E308-H330 HydrophobicContact CB-CB 4.06Å
309	Y	93.9	Very high	92.7	Very high	146 Å²	146	59.8 Å²	59.8	57%	0.573	34%	0.336	S	S	*	.	B	Isolated β-bridge	trans	-100.7	143.4	179.2	-64.7	-90.3	0	0	0	110.6	D311 G314	Y309-D311 PolarHBondContact O-N 2.9Å; Y309-G314 WeakPolarHBondContact CD1-O 3.2Å
310	C	95.3	Very high	92.4	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.007	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-79.9	117	-179.4	173.8	0	0	0	0	111.5	T312 C313 G314 E315 I317 H330 H332	C310-T312 PolarHBondContact O-N 2.67Å; C310-C313 PolarHBondContact O-N 2.76Å; C310-C313 VanDerWaalsContact O-N 3.14Å; C310-C313 VanDerWaalsContact SG-SG 3.68Å; C310-G314 WeakPolarHBondContact O-CA 3.42Å; C310-G314 PolarHBondContact O-N 3.48Å; C310-E315 PolarHBondContact N-O 3.31Å; C310-I317 HydrophobicContact CB-CD1 4.17Å; C310-I317 HydrophobicContact CB-CG1 4.04Å; C310-H330 CarbonylContact C-O 3.56Å; C310-H330 VanDerWaalsContact CA-O 3.29Å; C310-H330 WeakPolarHBondContact CA-O 3.44Å; C310-H332 VanDerWaalsContact CB-CE1 3.42Å; C310-H332 WeakPolarHBondContact CB-CE1 3.5Å; C310-H332 VanDerWaalsContact CB-ND1 3.27Å; C310-H332 WeakPolarHBondContact CB-ND1 3.27Å; C310-H332 PolarHBondContact SG-ND1 2.8Å; C310-H332 VanDerWaalsContact SG-ND1 3.43Å
311	D	93.9	Very high	92.2	Very high	95 Å²	95	64.6 Å²	64.6	51%	0.508	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-21.2	-178.8	-75.4	-86.7	0	0	0	114.3	Y309 Q329 H330 W331	Y309-D311 PolarHBondContact O-N 2.9Å; D311-Q329 VanDerWaalsContact OD2-CA 3.29Å; D311-Q329 WeakPolarHBondContact OD2-CA 3.42Å; D311-Q329 VanDerWaalsContact OD2-CB 3.3Å; D311-Q329 WeakPolarHBondContact OD2-CB 3.39Å; D311-H330 PolarHBondContact N-O 3.25Å; D311-H330 PolarHBondContact OD2-N 2.85Å; D311-H330 VanDerWaalsContact OD2-O 3.1Å; D311-W331 HydrophobicContact CB-CZ2 4.37Å
312	T	93.1	Very high	91.8	Very high	63 Å²	63	65.9 Å²	65.9	39%	0.387	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-33.6	177.5	-62.3	0	0	0	0	114.5	C310 W331 C337	C310-T312 PolarHBondContact O-N 2.67Å; T312-W331 PolarHBondContact OG1-NE1 2.68Å; T312-C337 WeakPolarHBondContact CB-O 3.46Å; T312-C337 PolarHBondContact OG1-O 2.94Å
313	C	94.3	Very high	91.8	Very high	58 Å²	58	67.3 Å²	67.3	39%	0.392	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123	-7.9	-172.8	73	0	0	0	0	114.7	C310 E315 H332	C310-C313 PolarHBondContact O-N 2.76Å; C310-C313 VanDerWaalsContact O-N 3.14Å; C310-C313 VanDerWaalsContact SG-SG 3.68Å; C313-E315 PolarHBondContact O-N 2.83Å; C313-E315 VanDerWaalsContact O-N 3.15Å; C313-H332 VanDerWaalsContact SG-CE1 3.52Å
314	G	92.5	Very high	91.8	Very high	51 Å²	51	67.3 Å²	67.3	53%	0.526	38%	0.376	S	S	.	.			trans	74.9	-11.5	179.8	0	0	0	0	0	115.6	Y309 C310	Y309-G314 WeakPolarHBondContact CD1-O 3.2Å; C310-G314 WeakPolarHBondContact O-CA 3.42Å; C310-G314 PolarHBondContact O-N 3.48Å
315	E	93.6	Very high	91.9	Very high	131 Å²	131	66.9 Å²	66.9	61%	0.612	37%	0.369	S	S	*	.			trans	-78.2	153.5	179.3	-61.8	-59.3	151.6	0	0	112.1	C310 C313	C310-E315 PolarHBondContact N-O 3.31Å; C313-E315 PolarHBondContact O-N 2.83Å; C313-E315 VanDerWaalsContact O-N 3.15Å
316	S	93	Very high	92	Very high	51 Å²	51	66.7 Å²	66.7	36%	0.357	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-68.9	147.7	176.9	57	0	0	0	0	112.4	H332	S316-H332 PolarHBondContact O-NE2 3.04Å
317	I	93.3	Very high	92.1	Very high	12 Å²	12	70.9 Å²	70.9	6%	0.062	39%	0.385	C	S	.	.			trans	-93.8	104.9	176.6	-52.4	175.5	0	0	0	107.6	E308 C310 Q321 Q323 H330 W331	E308-I317 PolarHBondContact O-N 2.94Å; C310-I317 HydrophobicContact CB-CD1 4.17Å; C310-I317 HydrophobicContact CB-CG1 4.04Å; I317-Q321 HydrophobicContact CG2-CB 4.31Å; I317-Q323 HydrophobicContact CD1-CG 3.92Å; I317-Q323 HydrophobicContact CG2-CB 4.05Å; I317-Q323 HydrophobicContact CG2-CG 4.18Å; I317-H330 HydrophobicContact CD1-CB 3.91Å; I317-W331 VanDerWaalsContact CD1-C 3.47Å
318	G	89.1	Confident	92.1	Very high	11 Å²	11	73.2 Å²	73.2	11%	0.113	41%	0.411	C	S	.	.			trans	-68.7	158.7	-177.2	0	0	0	0	0	113.2	E303 D320 Q321	E303-G318 WeakPolarHBondContact OE1-CA 3.23Å; G318-D320 PolarHBondContact O-N 2.95Å; G318-D320 VanDerWaalsContact O-N 3.14Å; G318-Q321 WeakPolarHBondContact O-CB 3.18Å; G318-Q321 PolarHBondContact O-N 3.38Å
319	I	88	Confident	92.1	Very high	44 Å²	44	70.1 Å²	70.1	23%	0.226	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-32.3	-176.7	-67	154.9	0	0	0	112.6	I290 C299 Y302 E303	I290-I319 HydrophobicContact CD1-CB 4.43Å; I290-I319 HydrophobicContact CD1-CD1 3.38Å; I290-I319 HydrophobicContact CD1-CG1 3.64Å; I290-I319 HydrophobicContact CD1-CG2 3.88Å; C299-I319 HydrophobicContact CB-CD1 3.61Å; C299-I319 WeakPolarHBondContact O-CD1 3.38Å; Y302-I319 HydrophobicContact CD1-CD1 4.06Å; Y302-I319 HydrophobicContact CD1-CG1 4.14Å; Y302-I319 HydrophobicContact CG-CD1 4.49Å; E303-I319 HydrophobicContact CG-CD1 3.57Å; E303-I319 HydrophobicContact CG-CG1 3.71Å; E303-I319 WeakPolarHBondContact OE1-CG1 3.43Å; E303-I319 PolarHBondContact OE1-N 3.21Å
320	D	87.3	Confident	92.2	Very high	111 Å²	111	64.9 Å²	64.9	59%	0.594	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-1.1	-179.4	-67.5	-46.5	0	0	0	113.6	R288 G318	R288-D320 IonicContact CZ-OD1 2.68Å; R288-D320 IonicContact CZ-OD2 3.48Å; R288-D320 IonicContact NH1-OD1 3.03Å; R288-D320 PolarHBondContact NH1-OD1 3.27Å; R288-D320 IonicContact NH1-OD2 3.12Å; R288-D320 PolarHBondContact NH1-OD2 3.4Å; R288-D320 IonicContact NH2-OD1 2.76Å; R288-D320 PolarHBondContact NH2-OD1 3.36Å; R288-D320 IonicContact NH2-OD2 2.67Å; R288-D320 PolarHBondContact NH2-OD2 2.75Å; G318-D320 PolarHBondContact O-N 2.95Å; G318-D320 VanDerWaalsContact O-N 3.14Å
321	Q	88.5	Confident	92.2	Very high	101 Å²	101	65.1 Å²	65.1	47%	0.472	38%	0.378	S	S	.	.	S	Bend	trans	-97.1	139.7	-179.2	-61.4	172.1	-4.3	0	0	109.7	I317 G318 H332	I317-Q321 HydrophobicContact CG2-CB 4.31Å; G318-Q321 WeakPolarHBondContact O-CB 3.18Å; G318-Q321 PolarHBondContact O-N 3.38Å; Q321-H332 PolarHBondContact OE1-CD2 2.83Å; Q321-H332 PolarHBondContact OE1-NE2 3.22Å; Q321-H332 VanDerWaalsContact OE1-NE2 3.09Å
322	G	89.4	Confident	92.3	Very high	46 Å²	46	61.6 Å²	61.6	47%	0.474	36%	0.358	S	S	.	.			trans	-65.3	145.5	171.5	0	0	0	0	0	110.8	A333	G322-A333 VanDerWaalsContact C-CB 3.41Å; G322-A333 WeakPolarHBondContact O-CB 3.24Å; G322-A333 PolarHBondContact O-N 3.14Å
323	Q	93.4	Very high	92.4	Very high	86 Å²	86	60.1 Å²	60.1	40%	0.402	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	136.7	-179.2	-172.1	178.4	22.4	0	0	110.6	I317 T325 H330 W331	I317-Q323 HydrophobicContact CD1-CG 3.92Å; I317-Q323 HydrophobicContact CG2-CB 4.05Å; I317-Q323 HydrophobicContact CG2-CG 4.18Å; Q323-T325 HydrophobicContact CG-CG2 3.82Å; Q323-H330 PolarHBondContact NE2-ND1 3.06Å; Q323-W331 CarbonylContact C-O 3.54Å; Q323-W331 WeakPolarHBondContact CA-O 3.33Å
324	M	93.5	Very high	92.5	Very high	58 Å²	58	60.7 Å²	60.7	29%	0.286	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	140.4	164.8	-61.7	-60.9	-65.2	0	0	108.6	H330 W331 A333 F338 L348	M324-H330 WeakPolarHBondContact O-CA 3.39Å; M324-W331 HydrophobicContact CB-CB 4.36Å; M324-W331 HydrophobicContact CB-CE3 4.49Å; M324-W331 PolarHBondContact N-O 3.05Å; M324-W331 PolarHBondContact O-N 3.47Å; M324-A333 HydrophobicContact CG-CB 3.86Å; M324-A333 HydrophobicContact SD-CB 4.17Å; M324-F338 HydrophobicContact CB-CD2 3.53Å; M324-F338 HydrophobicContact CB-CE2 3.75Å; M324-F338 HydrophobicContact CB-CG 3.97Å; M324-F338 HydrophobicContact CB-CZ 4.37Å; M324-F338 HydrophobicContact CE-CD1 4.13Å; M324-F338 HydrophobicContact CE-CE1 3.74Å; M324-F338 HydrophobicContact CE-CE2 4.41Å; M324-F338 HydrophobicContact CE-CZ 3.89Å; M324-F338 HydrophobicContact CG-CB 4.1Å; M324-F338 HydrophobicContact CG-CD1 4.06Å; M324-F338 HydrophobicContact CG-CD2 3.84Å; M324-F338 HydrophobicContact CG-CE1 4.48Å; M324-F338 HydrophobicContact CG-CE2 4.28Å; M324-F338 HydrophobicContact CG-CG 3.72Å; M324-L348 HydrophobicContact CE-CD2 4.44Å; M324-L348 HydrophobicContact CG-CD2 3.7Å; M324-L348 HydrophobicContact SD-CD2 3.81Å
325	T	93.9	Very high	92.5	Very high	88 Å²	88	64.6 Å²	64.6	54%	0.54	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	136.5	-179	62	0	0	0	0	111.2	Q323 Q329 H330	Q323-T325 HydrophobicContact CG-CG2 3.82Å; T325-Q329 VanDerWaalsContact CA-O 3.3Å; T325-Q329 WeakPolarHBondContact CA-O 3.32Å; T325-H330 WeakPolarHBondContact CG2-ND1 3.34Å
326	Y	92.6	Very high	92.5	Very high	77 Å²	77	62.5 Å²	62.5	30%	0.302	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	126.5	175.4	-175	-92.8	0	0	0	111.1	G328 Q329 F352 P354	Y326-G328 PolarHBondContact O-N 3.33Å; Y326-Q329 PolarHBondContact N-O 2.97Å; Y326-Q329 WeakPolarHBondContact O-CB 3.27Å; Y326-Q329 PolarHBondContact O-N 3.33Å; Y326-F352 HydrophobicContact CD1-CE2 4.25Å; Y326-F352 HydrophobicContact CD2-CE2 4.06Å; Y326-F352 AromaticContact CD2-CZ 3.71Å; Y326-F352 HydrophobicContact CD2-CZ 3.71Å; Y326-F352 HydrophobicContact CE2-CE2 4.49Å; Y326-F352 HydrophobicContact CE2-CZ 4.33Å; Y326-F352 AromaticContact CG-CE2 3.94Å; Y326-F352 HydrophobicContact CG-CE2 3.94Å; Y326-F352 AromaticContact CG-CZ 3.9Å; Y326-F352 HydrophobicContact CG-CZ 3.9Å; Y326-P354 HydrophobicContact CD1-CB 3.88Å; Y326-P354 HydrophobicContact CD1-CG 4.19Å; Y326-P354 HydrophobicContact CE1-CB 3.36Å; Y326-P354 HydrophobicContact CE1-CG 3.3Å; Y326-P354 HydrophobicContact CE2-CG 4.5Å; Y326-P354 WeakPolarHBondContact OH-CG 3.46Å
327	E	91.4	Very high	92.7	Very high	151 Å²	151	60.5 Å²	60.5	71%	0.706	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	34.8	179.3	-71.8	-179.6	172.4	0	0	114.9	Q329	E327-Q329 VanDerWaalsContact C-N 3.33Å
328	G	90.8	Very high	92.8	Very high	64 Å²	64	60 Å²	60	66%	0.66	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	5.9	-179.5	0	0	0	0	0	115.5	Y326 H330	Y326-G328 PolarHBondContact O-N 3.33Å; G328-H330 PolarHBondContact O-CD2 2.97Å; G328-H330 PolarHBondContact O-NE2 2.86Å
329	Q	93.9	Very high	93.2	Very high	28 Å²	28	59.7 Å²	59.7	13%	0.131	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	153.8	163.2	-70.1	149.8	92.2	0	0	110.1	D311 T325 Y326 E327 W331 G357	D311-Q329 VanDerWaalsContact OD2-CA 3.29Å; D311-Q329 WeakPolarHBondContact OD2-CA 3.42Å; D311-Q329 VanDerWaalsContact OD2-CB 3.3Å; D311-Q329 WeakPolarHBondContact OD2-CB 3.39Å; T325-Q329 VanDerWaalsContact CA-O 3.3Å; T325-Q329 WeakPolarHBondContact CA-O 3.32Å; Y326-Q329 PolarHBondContact N-O 2.97Å; Y326-Q329 WeakPolarHBondContact O-CB 3.27Å; Y326-Q329 PolarHBondContact O-N 3.33Å; E327-Q329 VanDerWaalsContact C-N 3.33Å; Q329-W331 HydrophobicContact CB-CE3 4.45Å; Q329-W331 HydrophobicContact CB-CH2 3.26Å; Q329-W331 HydrophobicContact CB-CZ2 3.73Å; Q329-W331 HydrophobicContact CB-CZ3 3.66Å; Q329-W331 HydrophobicContact CG-CH2 4.15Å; Q329-W331 HydrophobicContact CG-CZ2 4.38Å; Q329-G357 PolarHBondContact OE1-O 2.89Å
330	H	95.5	Very high	93.5	Very high	36 Å²	36	57.6 Å²	57.6	17%	0.167	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	138.4	-171	-58.7	-86.6	0	0	0	110.5	E308 C310 D311 I317 Q323 M324 T325 G328	E308-H330 HydrophobicContact CB-CB 4.06Å; C310-H330 CarbonylContact C-O 3.56Å; C310-H330 VanDerWaalsContact CA-O 3.29Å; C310-H330 WeakPolarHBondContact CA-O 3.44Å; D311-H330 PolarHBondContact N-O 3.25Å; D311-H330 PolarHBondContact OD2-N 2.85Å; D311-H330 VanDerWaalsContact OD2-O 3.1Å; I317-H330 HydrophobicContact CD1-CB 3.91Å; Q323-H330 PolarHBondContact NE2-ND1 3.06Å; M324-H330 WeakPolarHBondContact O-CA 3.39Å; T325-H330 WeakPolarHBondContact CG2-ND1 3.34Å; G328-H330 PolarHBondContact O-CD2 2.97Å; G328-H330 PolarHBondContact O-NE2 2.86Å
331	W	95.8	Very high	93.8	Very high	6 Å²	6	54.3 Å²	54.3	2%	0.023	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150	176	-58.9	-92	0	0	0	111	D311 T312 I317 Q323 M324 Q329 A333 F338 I359	D311-W331 HydrophobicContact CB-CZ2 4.37Å; T312-W331 PolarHBondContact OG1-NE1 2.68Å; I317-W331 VanDerWaalsContact CD1-C 3.47Å; Q323-W331 CarbonylContact C-O 3.54Å; Q323-W331 WeakPolarHBondContact CA-O 3.33Å; M324-W331 HydrophobicContact CB-CB 4.36Å; M324-W331 HydrophobicContact CB-CE3 4.49Å; M324-W331 PolarHBondContact N-O 3.05Å; M324-W331 PolarHBondContact O-N 3.47Å; Q329-W331 HydrophobicContact CB-CE3 4.45Å; Q329-W331 HydrophobicContact CB-CH2 3.26Å; Q329-W331 HydrophobicContact CB-CZ2 3.73Å; Q329-W331 HydrophobicContact CB-CZ3 3.66Å; Q329-W331 HydrophobicContact CG-CH2 4.15Å; Q329-W331 HydrophobicContact CG-CZ2 4.38Å; W331-A333 PolarHBondContact O-N 3.14Å; W331-F338 HydrophobicContact CB-CB 4.36Å; W331-F338 HydrophobicContact CB-CD2 3.94Å; W331-F338 AromaticContact CD2-CD2 3.84Å; W331-F338 HydrophobicContact CD2-CD2 3.84Å; W331-F338 HydrophobicContact CD2-CE2 4.13Å; W331-F338 AromaticContact CE3-CD2 3.84Å; W331-F338 HydrophobicContact CE3-CD2 3.84Å; W331-F338 AromaticContact CE3-CE2 3.74Å; W331-F338 HydrophobicContact CE3-CE2 3.74Å; W331-F338 AromaticContact CG-CD2 3.9Å; W331-F338 HydrophobicContact CG-CD2 3.9Å; W331-F338 HydrophobicContact CZ3-CE2 4.1Å; W331-I359 HydrophobicContact CD2-CD1 4.44Å; W331-I359 HydrophobicContact CH2-CG2 3.84Å; W331-I359 HydrophobicContact CZ2-CD1 4.12Å; W331-I359 HydrophobicContact CZ2-CG1 4.42Å; W331-I359 HydrophobicContact CZ2-CG2 3.92Å
332	H	96.3	Very high	94	Very high	20 Å²	20	54.3 Å²	54.3	9%	0.093	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	137	162.2	-57.7	101.4	0	0	0	109.5	C310 C313 S316 Q321 V334 C337	C310-H332 VanDerWaalsContact CB-CE1 3.42Å; C310-H332 WeakPolarHBondContact CB-CE1 3.5Å; C310-H332 VanDerWaalsContact CB-ND1 3.27Å; C310-H332 WeakPolarHBondContact CB-ND1 3.27Å; C310-H332 PolarHBondContact SG-ND1 2.8Å; C310-H332 VanDerWaalsContact SG-ND1 3.43Å; C313-H332 VanDerWaalsContact SG-CE1 3.52Å; S316-H332 PolarHBondContact O-NE2 3.04Å; Q321-H332 PolarHBondContact OE1-CD2 2.83Å; Q321-H332 PolarHBondContact OE1-NE2 3.22Å; Q321-H332 VanDerWaalsContact OE1-NE2 3.09Å; H332-V334 HydrophobicContact CB-CG2 3.79Å; H332-V334 PolarHBondContact O-N 3.39Å; H332-C337 HydrophobicContact CB-CB 3.89Å
333	A	95.1	Very high	94.2	Very high	33 Å²	33	55.2 Å²	55.2	27%	0.273	31%	0.309	S	S	.	.	S	Bend	trans	-77.7	51.9	176.1	0	0	0	0	0	111.9	G322 M324 W331 L348	G322-A333 VanDerWaalsContact C-CB 3.41Å; G322-A333 WeakPolarHBondContact O-CB 3.24Å; G322-A333 PolarHBondContact O-N 3.14Å; M324-A333 HydrophobicContact CG-CB 3.86Å; M324-A333 HydrophobicContact SD-CB 4.17Å; W331-A333 PolarHBondContact O-N 3.14Å; A333-L348 HydrophobicContact CB-CD2 4.25Å
334	V	95	Very high	94.3	Very high	70 Å²	70	56.4 Å²	56.4	42%	0.424	31%	0.314	S	S	.	.	S	Bend	trans	-127	153.2	176.4	-59.6	0	0	0	0	110	H332 S336 C337 F338	H332-V334 HydrophobicContact CB-CG2 3.79Å; H332-V334 PolarHBondContact O-N 3.39Å; V334-S336 WeakPolarHBondContact CG2-OG 3.41Å; V334-S336 PolarHBondContact O-N 3.03Å; V334-S336 VanDerWaalsContact O-N 3.16Å; V334-C337 HydrophobicContact CG2-CB 3.93Å; V334-C337 PolarHBondContact O-N 2.97Å; V334-F338 PolarHBondContact O-N 2.84Å
335	E	93.8	Very high	94.3	Very high	133 Å²	133	57 Å²	57	62%	0.621	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-28.5	-172.6	-66.3	-166.3	164.8	0	0	114.3	C339 P346 L348	E335-C339 WeakPolarHBondContact O-CB 3.5Å; E335-P346 HydrophobicContact CB-CB 3.82Å; E335-P346 HydrophobicContact CB-CG 3.7Å; E335-P346 HydrophobicContact CG-CB 3.88Å; E335-P346 HydrophobicContact CG-CG 4.09Å; E335-L348 HydrophobicContact CG-CD1 4.25Å
336	S	94.1	Very high	94.4	Very high	86 Å²	86	54.2 Å²	54.2	60%	0.601	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-20.5	178.2	55.7	0	0	0	0	114.5	V334	V334-S336 WeakPolarHBondContact CG2-OG 3.41Å; V334-S336 PolarHBondContact O-N 3.03Å; V334-S336 VanDerWaalsContact O-N 3.16Å
337	C	95.9	Very high	94.6	Very high	9 Å²	9	50.7 Å²	50.7	6%	0.061	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-44.9	-174.6	-66.3	0	0	0	0	111.7	T312 H332 V334 C339	T312-C337 WeakPolarHBondContact CB-O 3.46Å; T312-C337 PolarHBondContact OG1-O 2.94Å; H332-C337 HydrophobicContact CB-CB 3.89Å; V334-C337 HydrophobicContact CG2-CB 3.93Å; V334-C337 PolarHBondContact O-N 2.97Å; C337-C339 PolarHBondContact O-N 2.83Å
338	F	96.6	Very high	94.7	Very high	3 Å²	3	46.1 Å²	46.1	1%	0.013	27%	0.268	C	S	.	.	S	Bend	trans	-92.7	70.1	176.6	-162.2	-105.5	0	0	0	110.7	M324 W331 V334 L347 L348 F352 I359	M324-F338 HydrophobicContact CB-CD2 3.53Å; M324-F338 HydrophobicContact CB-CE2 3.75Å; M324-F338 HydrophobicContact CB-CG 3.97Å; M324-F338 HydrophobicContact CB-CZ 4.37Å; M324-F338 HydrophobicContact CE-CD1 4.13Å; M324-F338 HydrophobicContact CE-CE1 3.74Å; M324-F338 HydrophobicContact CE-CE2 4.41Å; M324-F338 HydrophobicContact CE-CZ 3.89Å; M324-F338 HydrophobicContact CG-CB 4.1Å; M324-F338 HydrophobicContact CG-CD1 4.06Å; M324-F338 HydrophobicContact CG-CD2 3.84Å; M324-F338 HydrophobicContact CG-CE1 4.48Å; M324-F338 HydrophobicContact CG-CE2 4.28Å; M324-F338 HydrophobicContact CG-CG 3.72Å; W331-F338 HydrophobicContact CB-CB 4.36Å; W331-F338 HydrophobicContact CB-CD2 3.94Å; W331-F338 AromaticContact CD2-CD2 3.84Å; W331-F338 HydrophobicContact CD2-CD2 3.84Å; W331-F338 HydrophobicContact CD2-CE2 4.13Å; W331-F338 AromaticContact CE3-CD2 3.84Å; W331-F338 HydrophobicContact CE3-CD2 3.84Å; W331-F338 AromaticContact CE3-CE2 3.74Å; W331-F338 HydrophobicContact CE3-CE2 3.74Å; W331-F338 AromaticContact CG-CD2 3.9Å; W331-F338 HydrophobicContact CG-CD2 3.9Å; W331-F338 HydrophobicContact CZ3-CE2 4.1Å; V334-F338 PolarHBondContact O-N 2.84Å; F338-L347 HydrophobicContact CD1-CB 3.71Å; F338-L347 HydrophobicContact CE1-CB 3.66Å; F338-L347 PolarHBondContact O-N 3.14Å; F338-L348 HydrophobicContact CB-CD2 3.89Å; F338-L348 HydrophobicContact CB-CG 4.32Å; F338-L348 HydrophobicContact CD1-CD2 3.78Å; F338-L348 HydrophobicContact CD1-CG 4.24Å; F338-L348 HydrophobicContact CG-CD2 4.13Å; F338-F352 HydrophobicContact CE1-CD1 4.33Å; F338-F352 HydrophobicContact CE1-CE1 4.43Å; F338-F352 HydrophobicContact CZ-CD1 4Å; F338-F352 AromaticContact CZ-CE1 3.8Å; F338-F352 HydrophobicContact CZ-CE1 3.8Å; F338-F352 HydrophobicContact CZ-CG 4.5Å; F338-F352 HydrophobicContact CZ-CZ 4.11Å; F338-I359 HydrophobicContact CD2-CD1 3.6Å; F338-I359 HydrophobicContact CE2-CD1 3.52Å; F338-I359 HydrophobicContact CG-CD1 4.25Å; F338-I359 HydrophobicContact CZ-CD1 4.1Å
339	C	96	Very high	94.7	Very high	4 Å²	4	47.3 Å²	47.3	3%	0.027	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-129.2	163.5	-174.6	66.5	0	0	0	0	112.3	E335 C337 A341 Q344 L345 I359	E335-C339 WeakPolarHBondContact O-CB 3.5Å; C337-C339 PolarHBondContact O-N 2.83Å; C339-A341 PolarHBondContact O-N 2.84Å; C339-Q344 PolarHBondContact SG-OE1 3.28Å; C339-L345 CarbonylContact C-O 3.59Å; C339-L345 WeakPolarHBondContact CA-O 3.36Å; C339-I359 WeakPolarHBondContact O-CG1 3.21Å
340	C	95.7	Very high	94.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.298	C	S	.	.			trans	-68.4	123.3	175.9	173.5	0	0	0	0	111.3	R342 C343 Q344 L345 L347 I359 F360 C361	C340-R342 PolarHBondContact O-N 2.99Å; C340-C343 VanDerWaalsContact CB-SG 3.58Å; C340-C343 PolarHBondContact O-N 2.86Å; C340-Q344 VanDerWaalsContact O-CA 3.23Å; C340-Q344 WeakPolarHBondContact O-CA 3.47Å; C340-Q344 PolarHBondContact O-N 3.48Å; C340-L345 HydrophobicContact CB-CB 4.39Å; C340-L345 PolarHBondContact N-O 2.87Å; C340-L347 HydrophobicContact CB-CD1 4.35Å; C340-L347 HydrophobicContact CB-CD2 4.48Å; C340-I359 WeakPolarHBondContact CA-O 3.4Å; C340-F360 VanDerWaalsContact SG-CA 3.59Å; C340-C361 HydrophobicContact CB-CB 4.09Å; C340-C361 PolarHBondContact SG-N 3.17Å; C340-C361 VanDerWaalsContact SG-N 3.45Å
341	A	92.8	Very high	94.5	Very high	41 Å²	41	56.1 Å²	56.1	34%	0.339	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-25.2	-177.5	0	0	0	0	0	115	C339 Q344 L358 I359 F360	C339-A341 PolarHBondContact O-N 2.84Å; A341-Q344 PolarHBondContact O-NE2 3.46Å; A341-L358 HydrophobicContact CB-CB 4.08Å; A341-L358 HydrophobicContact CB-CD1 4.27Å; A341-L358 HydrophobicContact CB-CD2 4.04Å; A341-L358 HydrophobicContact CB-CG 4.37Å; A341-I359 PolarHBondContact N-O 3.45Å; A341-F360 HydrophobicContact CB-CD1 4.46Å; A341-F360 HydrophobicContact CB-CE1 3.97Å; A341-F360 HydrophobicContact CB-CZ 4.37Å
342	R	92.3	Very high	94.4	Very high	102 Å²	102	58.7 Å²	58.7	39%	0.385	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-60	175.8	-172.3	176.2	-58.1	162.2	12.1	113.8	C340 S364 C365 G368 D369	C340-R342 PolarHBondContact O-N 2.99Å; R342-S364 PolarHBondContact NH1-O 3.24Å; R342-C365 HydrophobicContact CB-CB 4.44Å; R342-C365 PolarHBondContact NE-O 2.97Å; R342-C365 PolarHBondContact NH2-O 2.87Å; R342-G368 PolarHBondContact NH1-O 3Å; R342-D369 PolarHBondContact NH1-O 3.16Å
343	C	94.4	Very high	94.3	Very high	64 Å²	64	61.5 Å²	61.5	43%	0.432	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	1.2	-170.1	64.2	0	0	0	0	113.9	C340 L345	C340-C343 VanDerWaalsContact CB-SG 3.58Å; C340-C343 PolarHBondContact O-N 2.86Å; C343-L345 PolarHBondContact O-N 3.15Å; C343-L345 VanDerWaalsContact SG-CB 3.58Å
344	Q	94.4	Very high	94.2	Very high	111 Å²	111	62 Å²	62	52%	0.519	35%	0.354	S	S	.	.			trans	57.1	16.6	-179.1	-56.3	-63.9	-47.6	0	0	114.1	C339 C340 A341 P346	C339-Q344 PolarHBondContact SG-OE1 3.28Å; C340-Q344 VanDerWaalsContact O-CA 3.23Å; C340-Q344 WeakPolarHBondContact O-CA 3.47Å; C340-Q344 PolarHBondContact O-N 3.48Å; A341-Q344 PolarHBondContact O-NE2 3.46Å; Q344-P346 WeakPolarHBondContact O-CD 3.46Å
345	L	94.8	Very high	93.9	Very high	71 Å²	71	65.1 Å²	65.1	37%	0.372	36%	0.359	S	S	.	.			trans	-64.6	125.1	175.7	-174.9	71.6	0	0	0	109.8	C339 C340 C343 L347 C361	C339-L345 CarbonylContact C-O 3.59Å; C339-L345 WeakPolarHBondContact CA-O 3.36Å; C340-L345 HydrophobicContact CB-CB 4.39Å; C340-L345 PolarHBondContact N-O 2.87Å; C343-L345 PolarHBondContact O-N 3.15Å; C343-L345 VanDerWaalsContact SG-CB 3.58Å; L345-L347 PolarHBondContact O-N 3.46Å; L345-C361 HydrophobicContact CD2-CB 3.8Å
346	P	95.9	Very high	93.5	Very high	30 Å²	30	62.8 Å²	62.8	20%	0.195	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-59.9	137.5	176.1	-26.4	36.6	0	0	0	111.8	E335 Q344 R350	E335-P346 HydrophobicContact CB-CB 3.82Å; E335-P346 HydrophobicContact CB-CG 3.7Å; E335-P346 HydrophobicContact CG-CB 3.88Å; E335-P346 HydrophobicContact CG-CG 4.09Å; Q344-P346 WeakPolarHBondContact O-CD 3.46Å; P346-R350 WeakPolarHBondContact O-CD 3.45Å; P346-R350 PolarHBondContact O-NH1 3.12Å
347	L	95.6	Very high	93.1	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.01	36%	0.364	C	S	.	.			trans	-110.4	-0.4	-174.2	-62.8	175.4	0	0	0	113.4	F338 C340 L345 G349 R350 F352 I359 C361	F338-L347 HydrophobicContact CD1-CB 3.71Å; F338-L347 HydrophobicContact CE1-CB 3.66Å; F338-L347 PolarHBondContact O-N 3.14Å; C340-L347 HydrophobicContact CB-CD1 4.35Å; C340-L347 HydrophobicContact CB-CD2 4.48Å; L345-L347 PolarHBondContact O-N 3.46Å; L347-G349 PolarHBondContact O-N 3.39Å; L347-R350 PolarHBondContact O-N 3.27Å; L347-F352 HydrophobicContact CD1-CB 3.85Å; L347-F352 HydrophobicContact CD2-CB 4.26Å; L347-F352 HydrophobicContact CG-CB 4.45Å; L347-I359 HydrophobicContact CD1-CB 4.1Å; L347-I359 HydrophobicContact CD1-CD1 3.83Å; L347-I359 HydrophobicContact CD1-CG1 3.85Å; L347-C361 HydrophobicContact CD2-CB 3.7Å
348	L	94.6	Very high	92.9	Very high	55 Å²	55	64.8 Å²	64.8	29%	0.288	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	124.8	177.2	-65.1	174	0	0	0	110.6	M324 A333 E335 F338 R350	M324-L348 HydrophobicContact CE-CD2 4.44Å; M324-L348 HydrophobicContact CG-CD2 3.7Å; M324-L348 HydrophobicContact SD-CD2 3.81Å; A333-L348 HydrophobicContact CB-CD2 4.25Å; E335-L348 HydrophobicContact CG-CD1 4.25Å; F338-L348 HydrophobicContact CB-CD2 3.89Å; F338-L348 HydrophobicContact CB-CG 4.32Å; F338-L348 HydrophobicContact CD1-CD2 3.78Å; F338-L348 HydrophobicContact CD1-CG 4.24Å; F338-L348 HydrophobicContact CG-CD2 4.13Å; L348-R350 PolarHBondContact O-N 3.24Å
349	G	90.1	Very high	92.8	Very high	90 Å²	90	64.8 Å²	64.8	93%	0.928	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	11.6	-176.7	0	0	0	0	0	115.3	L347	L347-G349 PolarHBondContact O-N 3.39Å
350	R	92.9	Very high	92.8	Very high	130 Å²	130	65.5 Å²	65.5	49%	0.491	39%	0.386	S	S	.	.	S	Bend	trans	-115.8	151.1	-179.8	-64.6	-179.3	-179.6	166.5	-4.5	111.2	P346 L347 L348	P346-R350 WeakPolarHBondContact O-CD 3.45Å; P346-R350 PolarHBondContact O-NH1 3.12Å; L347-R350 PolarHBondContact O-N 3.27Å; L348-R350 PolarHBondContact O-N 3.24Å
351	P	91.8	Very high	92.8	Very high	119 Å²	119	67.2 Å²	67.2	77%	0.773	40%	0.398	S	S	*	.			trans	-62.6	142.2	168.7	28.4	-34.7	0	0	0	110
352	F	94.8	Very high	92.8	Very high	59 Å²	59	67.2 Å²	67.2	26%	0.259	40%	0.396	S	S	.	.			trans	-136.8	160.2	176.6	66.9	-85.7	0	0	0	110.8	Y326 F338 L347 P354 I359 F360	Y326-F352 HydrophobicContact CD1-CE2 4.25Å; Y326-F352 HydrophobicContact CD2-CE2 4.06Å; Y326-F352 AromaticContact CD2-CZ 3.71Å; Y326-F352 HydrophobicContact CD2-CZ 3.71Å; Y326-F352 HydrophobicContact CE2-CE2 4.49Å; Y326-F352 HydrophobicContact CE2-CZ 4.33Å; Y326-F352 AromaticContact CG-CE2 3.94Å; Y326-F352 HydrophobicContact CG-CE2 3.94Å; Y326-F352 AromaticContact CG-CZ 3.9Å; Y326-F352 HydrophobicContact CG-CZ 3.9Å; F338-F352 HydrophobicContact CE1-CD1 4.33Å; F338-F352 HydrophobicContact CE1-CE1 4.43Å; F338-F352 HydrophobicContact CZ-CD1 4Å; F338-F352 AromaticContact CZ-CE1 3.8Å; F338-F352 HydrophobicContact CZ-CE1 3.8Å; F338-F352 HydrophobicContact CZ-CG 4.5Å; F338-F352 HydrophobicContact CZ-CZ 4.11Å; L347-F352 HydrophobicContact CD1-CB 3.85Å; L347-F352 HydrophobicContact CD2-CB 4.26Å; L347-F352 HydrophobicContact CG-CB 4.45Å; F352-P354 HydrophobicContact CE2-CB 4.4Å; F352-P354 HydrophobicContact CE2-CG 4.44Å; F352-I359 HydrophobicContact CD2-CB 4.04Å; F352-I359 HydrophobicContact CD2-CG2 3.8Å; F352-I359 HydrophobicContact CE2-CG2 3.9Å; F352-F360 CarbonylContact C-O 3.3Å; F352-F360 VanDerWaalsContact CA-O 3.31Å; F352-F360 WeakPolarHBondContact CA-O 3.34Å
353	L	93.8	Very high	92.8	Very high	79 Å²	79	71.1 Å²	71.1	41%	0.414	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	109.4	177.5	-79.8	162.4	0	0	0	108.8	F360 R363	L353-F360 HydrophobicContact CB-CB 4.44Å; L353-F360 PolarHBondContact N-O 2.96Å; L353-F360 WeakPolarHBondContact O-CD2 3.28Å; L353-F360 PolarHBondContact O-N 2.81Å; L353-R363 HydrophobicContact CD1-CB 4.31Å
354	P	92.5	Very high	92.7	Very high	45 Å²	45	71.3 Å²	71.3	29%	0.292	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	135.7	171.5	31	-30.2	0	0	0	109.9	Y326 F352 L358	Y326-P354 HydrophobicContact CD1-CB 3.88Å; Y326-P354 HydrophobicContact CD1-CG 4.19Å; Y326-P354 HydrophobicContact CE1-CB 3.36Å; Y326-P354 HydrophobicContact CE1-CG 3.3Å; Y326-P354 HydrophobicContact CE2-CG 4.5Å; Y326-P354 WeakPolarHBondContact OH-CG 3.46Å; F352-P354 HydrophobicContact CE2-CB 4.4Å; F352-P354 HydrophobicContact CE2-CG 4.44Å; P354-L358 CarbonylContact C-O 3.57Å; P354-L358 WeakPolarHBondContact CA-O 3.32Å
355	R	90	Very high	92.6	Very high	135 Å²	135	67 Å²	67	51%	0.509	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	118.2	175.7	-172.3	-179	-173.2	174.1	4.8	110.8	G357 L358 F360 S366 L367	R355-G357 PolarHBondContact O-N 2.82Å; R355-L358 PolarHBondContact N-O 3.09Å; R355-L358 PolarHBondContact O-N 2.8Å; R355-F360 HydrophobicContact CB-CD2 4.23Å; R355-F360 HydrophobicContact CB-CE2 4.01Å; R355-S366 PolarHBondContact NH1-O 3.24Å; R355-L367 VanDerWaalsContact NH1-CD2 3.3Å
356	G	84.7	Confident	92.4	Very high	83 Å²	83	64.4 Å²	64.4	86%	0.856	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	38.8	172.2	0	0	0	0	0	114.6	L358	G356-L358 VanDerWaalsContact C-N 3.34Å
357	G	86.2	Confident	91.9	Very high	47 Å²	47	66.9 Å²	66.9	49%	0.485	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	18.5	-177.7	0	0	0	0	0	114.6	Q329 R355	Q329-G357 PolarHBondContact OE1-O 2.89Å; R355-G357 PolarHBondContact O-N 2.82Å
358	L	91.6	Very high	91	Very high	90 Å²	90	68.9 Å²	68.9	47%	0.471	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	151.9	176.6	-65.2	175.1	0	0	0	110.7	A341 P354 R355 G356 F360	A341-L358 HydrophobicContact CB-CB 4.08Å; A341-L358 HydrophobicContact CB-CD1 4.27Å; A341-L358 HydrophobicContact CB-CD2 4.04Å; A341-L358 HydrophobicContact CB-CG 4.37Å; P354-L358 CarbonylContact C-O 3.57Å; P354-L358 WeakPolarHBondContact CA-O 3.32Å; R355-L358 PolarHBondContact N-O 3.09Å; R355-L358 PolarHBondContact O-N 2.8Å; G356-L358 VanDerWaalsContact C-N 3.34Å; L358-F360 HydrophobicContact CB-CE2 3.63Å; L358-F360 HydrophobicContact CB-CZ 3.64Å; L358-F360 HydrophobicContact CD1-CZ 4.03Å
359	I	94.5	Very high	89.6	Confident	4 Å²	4	70.5 Å²	70.5	2%	0.021	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	139.5	178.9	59.7	177.9	0	0	0	111.8	W331 F338 C339 C340 A341 L347 F352	W331-I359 HydrophobicContact CD2-CD1 4.44Å; W331-I359 HydrophobicContact CH2-CG2 3.84Å; W331-I359 HydrophobicContact CZ2-CD1 4.12Å; W331-I359 HydrophobicContact CZ2-CG1 4.42Å; W331-I359 HydrophobicContact CZ2-CG2 3.92Å; F338-I359 HydrophobicContact CD2-CD1 3.6Å; F338-I359 HydrophobicContact CE2-CD1 3.52Å; F338-I359 HydrophobicContact CG-CD1 4.25Å; F338-I359 HydrophobicContact CZ-CD1 4.1Å; C339-I359 WeakPolarHBondContact O-CG1 3.21Å; C340-I359 WeakPolarHBondContact CA-O 3.4Å; A341-I359 PolarHBondContact N-O 3.45Å; L347-I359 HydrophobicContact CD1-CB 4.1Å; L347-I359 HydrophobicContact CD1-CD1 3.83Å; L347-I359 HydrophobicContact CD1-CG1 3.85Å; F352-I359 HydrophobicContact CD2-CB 4.04Å; F352-I359 HydrophobicContact CD2-CG2 3.8Å; F352-I359 HydrophobicContact CE2-CG2 3.9Å
360	F	95.2	Very high	88.1	Confident	18 Å²	18	71.9 Å²	71.9	8%	0.079	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	147	-173.5	-58	-82.1	0	0	0	112.8	C340 A341 F352 L353 R355 L358 C365 S366	C340-F360 VanDerWaalsContact SG-CA 3.59Å; A341-F360 HydrophobicContact CB-CD1 4.46Å; A341-F360 HydrophobicContact CB-CE1 3.97Å; A341-F360 HydrophobicContact CB-CZ 4.37Å; F352-F360 CarbonylContact C-O 3.3Å; F352-F360 VanDerWaalsContact CA-O 3.31Å; F352-F360 WeakPolarHBondContact CA-O 3.34Å; L353-F360 HydrophobicContact CB-CB 4.44Å; L353-F360 PolarHBondContact N-O 2.96Å; L353-F360 WeakPolarHBondContact O-CD2 3.28Å; L353-F360 PolarHBondContact O-N 2.81Å; R355-F360 HydrophobicContact CB-CD2 4.23Å; R355-F360 HydrophobicContact CB-CE2 4.01Å; L358-F360 HydrophobicContact CB-CE2 3.63Å; L358-F360 HydrophobicContact CB-CZ 3.64Å; L358-F360 HydrophobicContact CD1-CZ 4.03Å; F360-C365 HydrophobicContact CB-CB 4.35Å; F360-C365 HydrophobicContact CD1-CB 4.28Å; F360-C365 WeakPolarHBondContact CD1-O 3.39Å; F360-C365 WeakPolarHBondContact CE1-O 3.35Å; F360-S366 VanDerWaalsContact CD2-CB 3.47Å
361	C	95.6	Very high	86.4	Confident	37 Å²	37	71 Å²	71	25%	0.25	42%	0.421	C	S	.	.	S	Bend	trans	-76.9	-21.4	177.2	64.1	0	0	0	0	114.1	C340 L345 L347 C365	C340-C361 HydrophobicContact CB-CB 4.09Å; C340-C361 PolarHBondContact SG-N 3.17Å; C340-C361 VanDerWaalsContact SG-N 3.45Å; L345-C361 HydrophobicContact CD2-CB 3.8Å; L347-C361 HydrophobicContact CD2-CB 3.7Å; C361-C365 VanDerWaalsContact SG-SG 3.61Å
362	S	94	Very high	84.7	Confident	40 Å²	40	72.7 Å²	72.7	28%	0.28	42%	0.423	S	S	.	.	S	Bend	trans	-158.6	165.2	-173.1	73.4	0	0	0	0	111.8	S364 C365 S366	S362-S364 VanDerWaalsContact C-N 3.34Å; S362-S364 PolarHBondContact O-N 3.04Å; S362-C365 PolarHBondContact O-N 2.96Å; S362-C365 PolarHBondContact OG-N 3.18Å; S362-S366 PolarHBondContact O-N 3.49Å; S362-S366 VanDerWaalsContact O-N 3.13Å
363	R	92.4	Very high	82.5	Confident	185 Å²	185	75.6 Å²	75.6	70%	0.698	44%	0.441	S	S	*	.	H	α-helix	trans	-62.9	-37.1	178	-176.9	170.4	178.3	147.6	0.7	112.8	L353 S366 L367	L353-R363 HydrophobicContact CD1-CB 4.31Å; R363-S366 PolarHBondContact O-N 2.96Å; R363-S366 VanDerWaalsContact O-N 3.17Å; R363-S366 PolarHBondContact O-OG 3.5Å; R363-L367 HydrophobicContact CG-CD1 3.66Å; R363-L367 HydrophobicContact CG-CG 4.31Å; R363-L367 WeakPolarHBondContact O-CB 3.5Å; R363-L367 WeakPolarHBondContact O-CG 3.4Å; R363-L367 PolarHBondContact O-N 3.37Å
364	S	91.2	Very high	80.4	Confident	68 Å²	68	76.8 Å²	76.8	48%	0.476	46%	0.456	S	S	.	.	H	α-helix	trans	-61.2	-46.9	174.9	-44.9	0	0	0	0	110.9	R342 S362 S366 L367	R342-S364 PolarHBondContact NH1-O 3.24Å; S362-S364 VanDerWaalsContact C-N 3.34Å; S362-S364 PolarHBondContact O-N 3.04Å; S364-S366 PolarHBondContact O-N 3.05Å; S364-L367 PolarHBondContact O-N 2.9Å
365	C	92	Very high	78	Confident	20 Å²	20	81.4 Å²	81.4	14%	0.135	48%	0.479	C	S	.	.	H	α-helix	trans	-65.3	-20.9	176.2	-72.7	0	0	0	0	113.9	R342 F360 C361 S362	R342-C365 HydrophobicContact CB-CB 4.44Å; R342-C365 PolarHBondContact NE-O 2.97Å; R342-C365 PolarHBondContact NH2-O 2.87Å; F360-C365 HydrophobicContact CB-CB 4.35Å; F360-C365 HydrophobicContact CD1-CB 4.28Å; F360-C365 WeakPolarHBondContact CD1-O 3.39Å; F360-C365 WeakPolarHBondContact CE1-O 3.35Å; C361-C365 VanDerWaalsContact SG-SG 3.61Å; S362-C365 PolarHBondContact O-N 2.96Å; S362-C365 PolarHBondContact OG-N 3.18Å
366	S	90.3	Very high	75.9	Confident	16 Å²	16	79.8 Å²	79.8	11%	0.112	49%	0.488	C	S	.	.	H	α-helix	trans	-98	-6.8	177	77.5	0	0	0	0	115	R355 F360 S362 R363 S364	R355-S366 PolarHBondContact NH1-O 3.24Å; F360-S366 VanDerWaalsContact CD2-CB 3.47Å; S362-S366 PolarHBondContact O-N 3.49Å; S362-S366 VanDerWaalsContact O-N 3.13Å; R363-S366 PolarHBondContact O-N 2.96Å; R363-S366 VanDerWaalsContact O-N 3.17Å; R363-S366 PolarHBondContact O-OG 3.5Å; S364-S366 PolarHBondContact O-N 3.05Å
367	L	87.3	Confident	74.1	Confident	82 Å²	82	81.5 Å²	81.5	43%	0.429	49%	0.486	S	S	.	.	H	α-helix	trans	-97.7	-46.3	-177.5	-85.7	168.8	0	0	0	114.4	R355 R363 S364	R355-L367 VanDerWaalsContact NH1-CD2 3.3Å; R363-L367 HydrophobicContact CG-CD1 3.66Å; R363-L367 HydrophobicContact CG-CG 4.31Å; R363-L367 WeakPolarHBondContact O-CB 3.5Å; R363-L367 WeakPolarHBondContact O-CG 3.4Å; R363-L367 PolarHBondContact O-N 3.37Å; S364-L367 PolarHBondContact O-N 2.9Å
368	G	74.8	Confident	72.2	Confident	45 Å²	45	86.5 Å²	86.5	46%	0.464	50%	0.501	S	S	.	.			trans	141.9	-24.6	-175.8	0	0	0	0	0	112.2	R342 D370	R342-G368 PolarHBondContact NH1-O 3Å; G368-D370 PolarHBondContact O-N 3.07Å
369	D	65.7	Low	70	Confident	88 Å²	88	88 Å²	88	47%	0.471	52%	0.519	S	S	.	.			trans	-50.6	115.6	-170.9	-40.9	-31.6	0	0	0	112.4	R342	R342-D369 PolarHBondContact NH1-O 3.16Å
370	D	58.8	Low	67.2	Low	119 Å²	119	92 Å²	92	64%	0.636	55%	0.553	S	S	*	*			trans	-62.8	133.6	169.4	-97.4	-58.2	0	0	0	109.2	G368 N372 N373	G368-D370 PolarHBondContact O-N 3.07Å; D370-N372 PolarHBondContact O-N 3.03Å; D370-N373 PolarHBondContact O-N 2.84Å
371	P	57.2	Low	64.7	Low	113 Å²	113	98.8 Å²	98.8	73%	0.734	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-14.9	174	26.8	-33.8	0	0	0	112.5	S374	P371-S374 PolarHBondContact O-OG 2.85Å; P371-S374 VanDerWaalsContact O-OG 3.09Å
372	N	55.2	Low	61.9	Low	153 Å²	153	105.7 Å²	105.7	82%	0.818	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-4.1	176.1	-159.9	65.2	0	0	0	114.3	D370 S374	D370-N372 PolarHBondContact O-N 3.03Å; N372-S374 VanDerWaalsContact C-N 3.3Å; N372-S374 PolarHBondContact O-N 2.88Å
373	N	49.1	Very low	58.9	Low	120 Å²	120	109.6 Å²	109.6	64%	0.642	65%	0.645	S	S	*	*			trans	-98.1	50.6	169.7	-159.5	45.9	0	0	0	111.2	D370 D375	D370-N373 PolarHBondContact O-N 2.84Å; N373-D375 PolarHBondContact O-N 2.77Å
374	S	49.2	Very low	55.9	Low	104 Å²	104	112.8 Å²	112.8	73%	0.727	66%	0.657	S	S	*	*			trans	-82.2	83.4	173.7	-65.6	0	0	0	0	109.6	P371 N372 S376	P371-S374 PolarHBondContact O-OG 2.85Å; P371-S374 VanDerWaalsContact O-OG 3.09Å; N372-S374 VanDerWaalsContact C-N 3.3Å; N372-S374 PolarHBondContact O-N 2.88Å; S374-S376 PolarHBondContact O-N 3.35Å
375	D	42.8	Very low	53.1	Low	142 Å²	142	114.6 Å²	114.6	76%	0.759	67%	0.67	S	S	*	*			trans	-63.5	119.7	172.7	-96.2	-36	0	0	0	110.9	N373	N373-D375 PolarHBondContact O-N 2.77Å
376	S	45.3	Very low	51	Low	101 Å²	101	118.2 Å²	118.2	71%	0.706	69%	0.693	S	S	*	*			trans	31.2	119.1	160.3	-159.6	0	0	0	0	119.6	S374	S374-S376 PolarHBondContact O-N 3.35Å
377	C	48.2	Very low	48.3	Very low	120 Å²	120	125.1 Å²	125.1	81%	0.811	72%	0.723	S	S	*	*			trans	-36.9	137.7	156.3	47.1	0	0	0	0	115.9
378	D	45.6	Very low	45.7	Very low	151 Å²	151	128.9 Å²	128.9	81%	0.807	74%	0.738	S	S	*	*			trans	-147	127.2	134	-166.9	11.5	0	0	0	111.7
379	S	46.1	Very low	43.7	Very low	122 Å²	122	131.5 Å²	131.5	85%	0.853	75%	0.745	S	S	*	*			trans	158.5	70.7	159.8	-77.6	0	0	0	0	110
380	A	34.6	Very low	42	Very low	87 Å²	87	138.6 Å²	138.6	72%	0.719	77%	0.765	S	S	*	*			trans	-105.8	82.5	172.7	0	0	0	0	0	111.6
381	L	42.6	Very low	40.5	Very low	161 Å²	161	144.9 Å²	144.9	84%	0.843	78%	0.78	S	S	*	*			trans	-120.4	80.4	166.5	-72.9	-179.5	0	0	0	112.1
382	Q	37.4	Very low	39.1	Very low	182 Å²	182	150.4 Å²	150.4	85%	0.85	79%	0.787	S	S	*	*			trans	44	100	137.4	-58.5	175.5	19.1	0	0	118.2
383	S	31	Very low	37.8	Very low	123 Å²	123	146.8 Å²	146.8	86%	0.86	79%	0.785	S	S	*	*			trans	-123.6	139.1	144.9	52.2	0	0	0	0	110.2
384	R	30.5	Very low	36.9	Very low	251 Å²	251	146.8 Å²	146.8	95%	0.947	79%	0.79	S	S	*	*			trans	-73	131.7	-174.7	-80.1	170.8	155.2	-171.9	-6.8	111.7
385	S	31.5	Very low	36.5	Very low	107 Å²	107	147.2 Å²	147.2	75%	0.748	79%	0.79	S	S	*	*			trans	-79.9	171.5	149.2	-127.5	0	0	0	0	109.4
386	P	47.8	Very low	35.7	Very low	96 Å²	96	149.7 Å²	149.7	62%	0.623	80%	0.797	S	S	*	*			cis	-134.6	164.9	33.8	32.5	-9	0	0	0	114.3
387	H	33.7	Very low	35	Very low	160 Å²	160	156.1 Å²	156.1	74%	0.741	81%	0.806	S	S	*	*			cis	-151.7	-165.5	38.7	-70.3	-90.9	0	0	0	110.1
388	H	33	Very low	34.1	Very low	161 Å²	161	157 Å²	157	75%	0.745	81%	0.807	S	S	*	*			cis	-154.7	152.8	5.7	-152.3	-141	0	0	0	114.2
389	V	32.1	Very low	33.5	Very low	100 Å²	100	155.5 Å²	155.5	61%	0.606	81%	0.806	S	S	*	*			trans	35.2	104.8	154	174.9	0	0	0	0	123
390	R	31.4	Very low	32.5	Very low	237 Å²	237	155.4 Å²	155.4	89%	0.894	80%	0.804	S	S	*	*				31.6	133.7	125.2	-44.7	-177.6	-174.5	-156.6	2.1	121.2
391	R	27.1	Very low	32	Very low	251 Å²	251	154.8 Å²	154.8	95%	0.947	81%	0.806	S	S	*	*				-153.3	149.9	99	-147.5	171	-159.5	-120.4	2.8	112.5
392	W	27.4	Very low	31.5	Very low	229 Å²	229	152.1 Å²	152.1	87%	0.867	80%	0.801	S	S	*	*			trans	-100.5	149.5	-177.6	-133.2	-53.6	0	0	0	110.8
393	G	26.9	Very low	31.6	Very low	77 Å²	77	148.7 Å²	148.7	79%	0.794	80%	0.795	S	S	*	*			trans	-158.7	109.2	163	0	0	0	0	0	109.5
394	T	31.5	Very low	31.4	Very low	120 Å²	120	150.9 Å²	150.9	74%	0.736	80%	0.796	S	S	*	*			trans	-98.3	164.1	-175.8	18.7	0	0	0	0	112.2
395	P	39.4	Very low	31.3	Very low	113 Å²	113	147.7 Å²	147.7	73%	0.734	79%	0.791	S	S	*	*			trans	-102.5	172.5	-156.7	40.4	-37.9	0	0	0	114.4
396	E	26.1	Very low	31.5	Very low	195 Å²	195	147.8 Å²	147.8	91%	0.911	79%	0.789	S	S	*	*			trans	-110.7	140.2	156	-78.4	-169.1	106.3	0	0	111.8
397	R	30.3	Very low	30.6	Very low	236 Å²	236	151 Å²	151	89%	0.891	80%	0.801	S	S	*	*			trans	-109	143.7	170.6	-72.6	175	165.7	-176.5	-4.8	108.3
398	V	29.9	Very low	30.2	Very low	138 Å²	138	152.1 Å²	152.1	84%	0.836	81%	0.806	S	S	*	*			trans	-134	139.7	151.7	-177.1	0	0	0	0	108.4
399	P	32.8	Very low	29.8	Very low	119 Å²	119	147.7 Å²	147.7	77%	0.773	81%	0.805	S	S	*	*			trans	-95.6	169.1	-162.3	-2.3	24.3	0	0	0	115.5
400	C	25.5	Very low	29.6	Very low	120 Å²	120	149 Å²	149	81%	0.811	81%	0.813	S	S	*	*			trans	-67.6	153.7	174.7	-179.1	0	0	0	0	113.9
401	G	25.2	Very low	29.3	Very low	75 Å²	75	146.3 Å²	146.3	77%	0.773	81%	0.807	S	S	*	*			trans	-148.6	107.8	164.5	0	0	0	0	0	112.4
402	S	30.5	Very low	29.3	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	80%	0.804	S	S	*	*			trans	-86.1	176.8	161.6	-52.3	0	0	0	0	109.2
403	P	39.8	Very low	29.3	Very low	111 Å²	111	137.8 Å²	137.8	72%	0.721	80%	0.8	S	S	*	*			cis	-143.6	-169.6	12.6	33.4	-8	0	0	0	116.8
404	L	28.1	Very low	29.8	Very low	169 Å²	169	139.8 Å²	139.8	89%	0.885	80%	0.799	S	S	*	*			trans	104.9	129.3	156.8	-55.2	177.8	0	0	0	119.1
405	Q	27.7	Very low	29.5	Very low	183 Å²	183	138.3 Å²	138.3	86%	0.855	80%	0.798	S	S	*	*			trans	-83.2	-169.9	167.5	-63.8	-179	-35.2	0	0	110.8
406	P	36	Very low	29	Very low	109 Å²	109	142 Å²	142	71%	0.708	81%	0.806	S	S	*	*			cis	-124.8	169.6	-38.3	25	-6.8	0	0	0	111.7
407	L	28.1	Very low	29	Very low	165 Å²	165	139.6 Å²	139.6	86%	0.864	80%	0.799	S	S	*	*			trans	-162.9	159.8	141.4	-113.5	147.9	0	0	0	113.1
408	E	25.7	Very low	28.8	Very low	182 Å²	182	134.9 Å²	134.9	85%	0.85	80%	0.801	S	S	*	*			trans	-88.3	162.1	-165.5	-53.8	167.2	108.8	0	0	113.1
409	G	25.1	Very low	28.7	Very low	69 Å²	69	135.6 Å²	135.6	71%	0.711	80%	0.799	S	S	*	*			trans	122.3	116.8	135.9	0	0	0	0	0	119.4
410	V	27.9	Very low	28.4	Very low	128 Å²	128	138.2 Å²	138.2	78%	0.776	80%	0.8	S	S	*	*			trans	81.5	99.2	139.9	-169.2	0	0	0	0	119.3
411	K	24.1	Very low	28.5	Very low	180 Å²	180	137.9 Å²	137.9	78%	0.783	80%	0.795	S	S	*	*			trans	43	127.8	132.4	-54.5	176.4	-176.7	178.3	0	119.5
412	H	27.3	Very low	28.5	Very low	189 Å²	189	139.1 Å²	139.1	88%	0.875	80%	0.798	S	S	*	*				-170.1	138.7	113	-96.9	-72.4	0	0	0	111.3
413	S	27	Very low	28.4	Very low	111 Å²	111	140.7 Å²	140.7	78%	0.776	80%	0.802	S	S	*	*			trans	-107	175.7	163.5	-46.1	0	0	0	0	108.4
414	P	37.9	Very low	27.7	Very low	120 Å²	120	144.5 Å²	144.5	78%	0.779	81%	0.811	S	S	*	*			cis	-140.3	-177.4	5.6	42.5	-24.2	0	0	0	116.9
415	A	25.5	Very low	27.8	Very low	88 Å²	88	142 Å²	142	73%	0.727	81%	0.807	S	S	*	*			trans	73.1	122.5	149.5	0	0	0	0	0	120.8
416	Q	28.3	Very low	27.8	Very low	192 Å²	192	145.3 Å²	145.3	90%	0.897	81%	0.812	S	S	*	*				-163.8	156.3	106.7	-108.4	178.5	-43.6	0	0	113.1
417	D	25.8	Very low	27.2	Very low	144 Å²	144	143.6 Å²	143.6	77%	0.77	81%	0.814	S	S	*	*			trans	-67.7	150.8	-176.5	-50.8	-89.5	0	0	0	114.2
418	C	27.1	Very low	27.3	Very low	137 Å²	137	144.3 Å²	144.3	93%	0.926	82%	0.818	S	S	*	*			trans	-145.6	120.7	152.7	-95	0	0	0	0	111.3
419	I	27.7	Very low	27.2	Very low	153 Å²	153	144.3 Å²	144.3	79%	0.785	82%	0.817	S	S	*	*			trans	-83.3	134.5	173.7	-60.8	166	0	0	0	108.1
420	H	27.4	Very low	27.3	Very low	174 Å²	174	147.5 Å²	147.5	81%	0.806	83%	0.827	S	S	*	*			trans	-155.7	113.8	151.5	-109.7	-68.7	0	0	0	115.1
421	T	25.7	Very low	27.1	Very low	113 Å²	113	146.7 Å²	146.7	69%	0.693	83%	0.828	S	S	*	*			trans	20.1	122.1	142.4	52.6	0	0	0	0	120.7
422	A	25.1	Very low	27.2	Very low	101 Å²	101	142.6 Å²	142.6	84%	0.835	83%	0.827	S	S	*	*			trans	-78.1	154.7	167.2	0	0	0	0	0	113.7
423	V	28.6	Very low	27.3	Very low	136 Å²	136	139 Å²	139	82%	0.824	82%	0.82	S	S	*	*			trans	-135.8	125.1	165.2	178.4	0	0	0	0	108.8
424	E	26.6	Very low	27.2	Very low	192 Å²	192	139.1 Å²	139.1	90%	0.897	82%	0.816	S	S	*	*			trans	-76.4	145.1	177	-64.4	173.4	106.7	0	0	111.9
425	S	29.2	Very low	26.6	Very low	117 Å²	117	141.1 Å²	141.1	82%	0.818	82%	0.815	S	S	*	*			trans	-140.5	130.9	164.1	-54	0	0	0	0	110.5
426	R	28.5	Very low	26.6	Very low	251 Å²	251	145 Å²	145	95%	0.947	82%	0.823	S	S	*	*			trans	-78.7	143.5	-175.2	-68.1	169.4	168.3	-179.9	-6.2	111.5
427	G	23.8	Very low	26.4	Very low	73 Å²	73	139.3 Å²	139.3	75%	0.753	82%	0.817	S	S	*	*			trans	-79.5	162.4	178.8	0	0	0	0	0	114.8
428	L	28.4	Very low	26.6	Very low	180 Å²	180	139 Å²	139	94%	0.942	82%	0.82	S	S	*	*			trans	-137.5	127.9	170.7	-79.3	167.1	0	0	0	109.2
429	H	24.8	Very low	27.2	Very low	182 Å²	182	137 Å²	137	84%	0.843	81%	0.805	S	S	*	*			trans	-95.2	143.2	172.4	-77.4	-98.3	0	0	0	110.7
430	C	26.1	Very low	27.5	Very low	136 Å²	136	135.9 Å²	135.9	92%	0.919	81%	0.808	S	S	*	*			trans	-149	150.6	158.1	-92.4	0	0	0	0	109.7
431	S	24.3	Very low	27.5	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	81%	0.806	S	S	*	*			trans	-133.2	169	-164.1	-51.1	0	0	0	0	113
432	A	26.1	Very low	27.6	Very low	93 Å²	93	136.7 Å²	136.7	77%	0.769	81%	0.813	S	S	*	*			trans	86.6	160.9	159.8	0	0	0	0	0	118
433	P	28.7	Very low	27.6	Very low	114 Å²	114	135.7 Å²	135.7	74%	0.74	81%	0.805	S	S	*	*			cis	-142.9	-175.9	-49	39	-22.5	0	0	0	115.7
434	V	25.7	Very low	27.7	Very low	114 Å²	114	137.7 Å²	137.7	69%	0.691	81%	0.805	S	S	*	*			trans	103.7	118.8	135.8	136.6	0	0	0	0	123.1
435	Q	26.2	Very low	28.2	Very low	162 Å²	162	134 Å²	134	76%	0.757	80%	0.798	S	S	*	*			trans	76.2	101.6	141.9	-65	169	53	0	0	125.7
436	N	24.3	Very low	28.8	Very low	168 Å²	168	133.6 Å²	133.6	90%	0.898	79%	0.793	S	S	*	*				39.9	127.7	119.2	-62.2	-2.6	0	0	0	124.3
437	G	25.3	Very low	29	Very low	74 Å²	74	127.8 Å²	127.8	76%	0.763	79%	0.787	S	S	*	*			trans	-175.9	133.7	155.2	0	0	0	0	0	113.3
438	V	28.2	Very low	29.3	Very low	138 Å²	138	135.9 Å²	135.9	84%	0.836	80%	0.795	S	S	*	*			trans	-158.2	157.7	-166.8	-177.8	0	0	0	0	109.6
439	P	41.5	Very low	29.3	Very low	93 Å²	93	130.4 Å²	130.4	60%	0.604	78%	0.782	S	S	*	*			cis	-121.2	-159.5	-34.5	36.9	-17.4	0	0	0	111.9
440	P	32.2	Very low	29.4	Very low	130 Å²	130	127.7 Å²	127.7	84%	0.844	78%	0.783	S	S	*	*				-143.9	-177.6	89.7	34.1	-13.8	0	0	0	116.9
441	H	27.6	Very low	29.5	Very low	166 Å²	166	131.9 Å²	131.9	77%	0.769	78%	0.782	S	S	*	*			trans	-107.3	155	-158.9	-67.5	-108.5	0	0	0	118
442	T	28.2	Very low	29.7	Very low	138 Å²	138	132.2 Å²	132.2	85%	0.847	78%	0.784	S	S	*	*				167.5	109.7	129.8	29.5	0	0	0	0	110.7
443	A	25.9	Very low	29.9	Very low	80 Å²	80	133.6 Å²	133.6	66%	0.661	79%	0.785	S	S	*	*				69.7	127.2	83.2	0	0	0	0	0	114.2
444	H	29.7	Very low	29.9	Very low	178 Å²	178	136 Å²	136	82%	0.824	79%	0.791	S	S	*	*			cis	-151.2	-165.5	25.4	-72.6	-90.8	0	0	0	111.8
445	P	36.7	Very low	30.1	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	79%	0.792	S	S	*	*				-129	-148.8	-80.7	48.5	-29.2	0	0	0	113
446	P	42.1	Very low	30.2	Very low	108 Å²	108	136.7 Å²	136.7	70%	0.701	80%	0.796	S	S	*	*				-124.7	-165.6	-125.1	38.3	-14.4	0	0	0	115.9
447	P	33.6	Very low	30.3	Very low	128 Å²	128	136.8 Å²	136.8	83%	0.831	79%	0.794	S	S	*	*				-137.2	166.8	97.6	37.9	-26	0	0	0	116.2
448	R	30.6	Very low	30.3	Very low	244 Å²	244	141.7 Å²	141.7	92%	0.921	80%	0.797	S	S	*	*			trans	-74.5	157.5	-179.7	-58.6	171.3	177.7	-139.4	-0.6	111.4
449	G	28.1	Very low	30.1	Very low	64 Å²	64	143.6 Å²	143.6	66%	0.66	80%	0.802	S	S	*	*			cis	125.9	88.5	6.7	0	0	0	0	0	111.4
450	S	27.1	Very low	29.2	Very low	126 Å²	126	142 Å²	142	88%	0.881	80%	0.801	S	S	*	*			trans	-89.4	126.3	176.4	40.2	0	0	0	0	111.2
451	Y	28.4	Very low	28.8	Very low	224 Å²	224	144.2 Å²	144.2	88%	0.878	81%	0.806	S	S	*	*			trans	-105.5	135.9	177.4	-86	-91.7	0	0	0	111.6
452	S	27	Very low	28.6	Very low	118 Å²	118	139.4 Å²	139.4	83%	0.825	80%	0.801	S	S	*	*			trans	-119	131.2	161.3	-70.8	0	0	0	0	108.9
453	P	30.7	Very low	28.5	Very low	123 Å²	123	144.8 Å²	144.8	80%	0.799	81%	0.806	S	S	*	*			trans	-95.9	136	-179.2	34.7	-31.6	0	0	0	112.7
454	L	28.9	Very low	28.9	Very low	165 Å²	165	146.1 Å²	146.1	86%	0.864	81%	0.808	S	S	*	*			trans	-140.1	161.8	163.9	-85.8	-178.4	0	0	0	109.5
455	P	30.8	Very low	28.7	Very low	110 Å²	110	142.6 Å²	142.6	71%	0.714	80%	0.803	S	S	*	*			trans	-95.4	155.7	-134.7	35.4	-38.4	0	0	0	115.8
456	H	27.4	Very low	28.2	Very low	180 Å²	180	143.8 Å²	143.8	83%	0.833	80%	0.804	S	S	*	*			trans	-91	139.8	169	-72.1	-73.4	0	0	0	112.3
457	I	27.2	Very low	27.4	Very low	169 Å²	169	145.6 Å²	145.6	87%	0.867	81%	0.812	S	S	*	*			trans	-109.8	130.9	174.3	-47.3	170.8	0	0	0	106.7
458	H	24.1	Very low	27.2	Very low	178 Å²	178	145.4 Å²	145.4	82%	0.824	81%	0.811	S	S	*	*			trans	-110	117.6	-175.6	-98.1	-72.8	0	0	0	113.2
459	L	24.6	Very low	26.9	Very low	178 Å²	178	141.8 Å²	141.8	93%	0.932	80%	0.804	S	S	*	*			trans	-153	140.3	154.6	-71.7	174.1	0	0	0	105.3
460	G	21.9	Very low	26.7	Very low	58 Å²	58	149.5 Å²	149.5	60%	0.598	82%	0.815	S	S	*	*			cis	159.6	146.3	-2	0	0	0	0	0	109.2
461	N	24.6	Very low	26.7	Very low	178 Å²	178	147.4 Å²	147.4	95%	0.952	80%	0.8	S	S	*	*			trans	82.1	130.3	174	-41.5	-16.2	0	0	0	116.7
462	G	23.9	Very low	26.6	Very low	64 Å²	64	145.1 Å²	145.1	66%	0.66	80%	0.802	S	S	*	*			cis	170.3	133.8	-14.8	0	0	0	0	0	116.2
463	W	24.7	Very low	26.6	Very low	252 Å²	252	147.2 Å²	147.2	96%	0.955	80%	0.803	S	S	*	*			trans	78.7	161.8	139	-70.1	27.3	0	0	0	121.1
464	P	34.1	Very low	26.9	Very low	108 Å²	108	147.2 Å²	147.2	70%	0.701	80%	0.803	S	S	*	*			cis	-138.8	165.4	-36.8	38.1	-22.3	0	0	0	115.3
465	S	26.6	Very low	26.7	Very low	103 Å²	103	143 Å²	143	72%	0.72	80%	0.8	S	S	*	*			trans	176.8	159	151.1	-93.4	0	0	0	0	109.6
466	D	25.8	Very low	26.4	Very low	142 Å²	142	144.8 Å²	144.8	76%	0.759	80%	0.803	S	S	*	*			cis	-157.8	129	-19.4	-95.1	-5	0	0	0	108.4
467	V	24.7	Very low	26.4	Very low	146 Å²	146	144.2 Å²	144.2	89%	0.885	81%	0.807	S	S	*	*			trans	-150.5	139.1	170.4	-175.2	0	0	0	0	109
468	P	30	Very low	26.2	Very low	124 Å²	124	141.3 Å²	141.3	81%	0.805	80%	0.801	S	S	*	*			trans	-87	164.5	-163.2	33.1	-37.6	0	0	0	117.6
469	H	24.4	Very low	26.5	Very low	168 Å²	168	139.8 Å²	139.8	78%	0.778	80%	0.804	S	S	*	*			trans	-57.2	146.9	178.7	-92	-99.8	0	0	0	116.5	S471	H469-S471 PolarHBondContact ND1-OG 3.32Å; H469-S471 VanDerWaalsContact ND1-OG 3.14Å
470	Y	24.9	Very low	26.7	Very low	226 Å²	226	140.6 Å²	140.6	89%	0.886	80%	0.8	S	S	*	*				-140	143.5	118	59.6	-87.8	0	0	0	110
471	S	26.1	Very low	27	Very low	82 Å²	82	143.4 Å²	143.4	57%	0.573	81%	0.808	S	S	*	*			trans	-115.2	153.3	-177.6	-52.6	0	0	0	0	110	H469	H469-S471 PolarHBondContact ND1-OG 3.32Å; H469-S471 VanDerWaalsContact ND1-OG 3.14Å
472	L	26.9	Very low	27.3	Very low	175 Å²	175	141.1 Å²	141.1	92%	0.916	80%	0.802	S	S	*	*				-179.1	130.5	118.4	-92.6	169.2	0	0	0	111.8
473	L	25.8	Very low	27.4	Very low	162 Å²	162	142.8 Å²	142.8	85%	0.848	81%	0.81	S	S	*	*			trans	-94.5	-174.2	169.4	-81	174.9	0	0	0	108.6
474	P	37.8	Very low	27.5	Very low	123 Å²	123	137.9 Å²	137.9	80%	0.799	81%	0.808	S	S	*	*			cis	-143	-178.8	14.2	42.8	-22.7	0	0	0	117.9
475	G	25.1	Very low	26.9	Very low	76 Å²	76	136.2 Å²	136.2	78%	0.784	81%	0.81	S	S	*	*			trans	176.6	92.6	165.9	0	0	0	0	0	113.3
476	D	24.6	Very low	26.9	Very low	148 Å²	148	138.2 Å²	138.2	79%	0.791	82%	0.818	S	S	*	*			trans	-66.1	149.4	179.5	-80.3	-64.1	0	0	0	114.6
477	N	26.2	Very low	26.8	Very low	169 Å²	169	140.2 Å²	140.2	90%	0.904	82%	0.823	S	S	*	*				-164.2	141.5	122.9	-105.2	-44.5	0	0	0	113.7
478	S	24.1	Very low	26.6	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	82%	0.822	S	S	*	*			trans	-95.2	138	-174.6	-72.2	0	0	0	0	113.6
479	V	29.4	Very low	26.3	Very low	145 Å²	145	144.4 Å²	144.4	88%	0.879	83%	0.827	S	S	*	*			trans	-140.1	129.1	155	-176.6	0	0	0	0	109.8
480	K	28.6	Very low	26.2	Very low	195 Å²	195	144.6 Å²	144.6	85%	0.848	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-93.8	144.5	173.9	-66.3	176.4	177.1	176.9	0	110.9
481	P	29.4	Very low	26.1	Very low	118 Å²	118	141.6 Å²	141.6	77%	0.766	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-88	155.8	157.2	35.1	-31	0	0	0	111.4
482	P	30.2	Very low	26	Very low	129 Å²	129	144.4 Å²	144.4	84%	0.838	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-80.5	153.4	175.7	33.4	-34.4	0	0	0	112.2
483	A	25.3	Very low	25.8	Very low	100 Å²	100	143.5 Å²	143.5	83%	0.826	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-93.2	140	175.1	0	0	0	0	0	111.9
484	T	27.1	Very low	25.8	Very low	149 Å²	149	139.3 Å²	139.3	91%	0.914	82%	0.822	S	S	*	*			trans	-133.1	111.7	153.4	44.5	0	0	0	0	107.5
485	G	22.6	Very low	25.1	Very low	72 Å²	72	141.5 Å²	141.5	74%	0.742	83%	0.827	S	S	*	*			trans	-113.2	140.1	174.1	0	0	0	0	0	110.9
486	V	25.3	Very low	25.2	Very low	145 Å²	145	144.2 Å²	144.2	88%	0.879	83%	0.828	S	S	*	*			trans	-136.4	143.6	153.9	-178.7	0	0	0	0	107.4
487	Q	24	Very low	25.2	Very low	185 Å²	185	140.2 Å²	140.2	86%	0.864	82%	0.822	S	S	*	*			trans	-57.8	145.1	-160.8	-78.5	133.8	-42.9	0	0	118.1
488	L	21	Very low	25.3	Very low	165 Å²	165	141 Å²	141	86%	0.864	83%	0.825	S	S	*	*			trans	-66.4	151.5	149.9	-83.5	140.4	0	0	0	111
489	Q	22.8	Very low	25.5	Very low	193 Å²	193	141.9 Å²	141.9	90%	0.902	83%	0.826	S	S	*	*			trans	-130.7	131	149.9	-173	161.3	-10	0	0	109
490	E	22.5	Very low	25.7	Very low	171 Å²	171	138.1 Å²	138.1	80%	0.799	82%	0.816	S	S	*	*			trans	-82.4	173.3	-173	-80.5	171.6	110.8	0	0	115
491	E	23.1	Very low	26.1	Very low	163 Å²	163	138.7 Å²	138.7	76%	0.762	81%	0.813	S	S	*	*			trans	77.7	147.5	172.6	-65.9	-78.2	54.3	0	0	117.1
492	L	24.4	Very low	27	Very low	141 Å²	141	136.7 Å²	136.7	74%	0.738	80%	0.796	S	S	*	*			cis	-143.8	152.6	5.2	-136.7	177.4	0	0	0	111.1
493	N	23.3	Very low	27.9	Very low	157 Å²	157	131.5 Å²	131.5	84%	0.84	76%	0.763	S	S	*	*			trans	-64.5	137.5	168.7	-87.2	-43.7	0	0	0	112.8
494	G	24.1	Very low	29.2	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	76%	0.759	S	S	*	*			trans	-123	96.8	171.8	0	0	0	0	0	112.1	T496	G494-T496 PolarHBondContact O-N 2.99Å
495	N	24	Very low	30	Very low	169 Å²	169	129.9 Å²	129.9	90%	0.904	72%	0.723	S	S	*	*			trans	-84.2	105.8	-175.8	-157.2	20.4	0	0	0	110.6	G497	N495-G497 PolarHBondContact O-N 3.09Å
496	T	26.3	Very low	31.3	Very low	132 Å²	132	130.7 Å²	130.7	81%	0.81	71%	0.714	S	S	*	*			trans	-71.7	117.4	-178.9	34.1	0	0	0	0	112.4	G494	G494-T496 PolarHBondContact O-N 2.99Å
497	G	25.1	Very low	32.2	Very low	64 Å²	64	127 Å²	127	66%	0.66	70%	0.695	S	S	*	*			trans	-65.7	141.4	169.5	0	0	0	0	0	112.4	N495 T499	N495-G497 PolarHBondContact O-N 3.09Å; G497-T499 VanDerWaalsContact C-N 3.35Å; G497-T499 PolarHBondContact O-N 3.43Å
498	L	28.4	Very low	33.5	Very low	185 Å²	185	119.3 Å²	119.3	97%	0.969	66%	0.66	S	S	*	*			trans	-72.3	84.9	176.9	-70.9	168.9	0	0	0	110.8
499	T	27.6	Very low	34.6	Very low	128 Å²	128	113.6 Å²	113.6	79%	0.785	63%	0.63	S	S	*	*			trans	-84	127.3	158.9	44.5	0	0	0	0	109	G497 R501	G497-T499 VanDerWaalsContact C-N 3.35Å; G497-T499 PolarHBondContact O-N 3.43Å; T499-R501 PolarHBondContact O-N 2.88Å
500	G	34.1	Very low	35.3	Very low	65 Å²	65	112.1 Å²	112.1	67%	0.67	62%	0.621	S	S	*	*			trans	-61.5	99.4	175.3	0	0	0	0	0	110.1	N502	G500-N502 PolarHBondContact O-N 3.46Å; G500-N502 VanDerWaalsContact O-N 3.09Å
501	R	38.3	Very low	36.5	Very low	208 Å²	208	107.7 Å²	107.7	79%	0.785	60%	0.603	S	S	*	*			trans	-72.3	108.3	-173.6	-159.6	170.4	170.7	-179.9	-6.4	108.9	T499 S503	T499-R501 PolarHBondContact O-N 2.88Å; R501-S503 PolarHBondContact O-N 2.95Å
502	N	46.8	Very low	37.4	Very low	75 Å²	75	100.5 Å²	100.5	40%	0.401	57%	0.57	S	S	.	*			trans	-66.2	80.4	175.3	-83.9	-54	0	0	0	110.4	R288 G500	R288-N502 PolarHBondContact NE-OD1 3.26Å; R288-N502 VanDerWaalsContact NH2-CG 3.34Å; R288-N502 PolarHBondContact NH2-ND2 2.85Å; R288-N502 PolarHBondContact NH2-OD1 3Å; G500-N502 PolarHBondContact O-N 3.46Å; G500-N502 VanDerWaalsContact O-N 3.09Å
503	S	49.9	Very low	38.4	Very low	20 Å²	20	99.7 Å²	99.7	14%	0.14	56%	0.557	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.5	140.2	178.5	-68.5	0	0	0	0	110.7	E266 Y289 R501	E266-S503 PolarHBondContact OE1-OG 2.78Å; Y289-S503 VanDerWaalsContact CD1-O 3.32Å; Y289-S503 WeakPolarHBondContact CD1-O 3.42Å; Y289-S503 WeakPolarHBondContact CE1-O 3.42Å; Y289-S503 VanDerWaalsContact OH-CB 3.25Å; Y289-S503 WeakPolarHBondContact OH-CB 3.08Å; R501-S503 PolarHBondContact O-N 2.95Å
504	R	51.8	Low	39.4	Very low	200 Å²	200	96 Å²	96	76%	0.755	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.2	166.5	-88.6	-174.8	-94.8	-167.5	-7.4	107.7	T506	R504-T506 PolarHBondContact O-N 3.5Å
505	G	44.2	Very low	40.6	Very low	15 Å²	15	95.7 Å²	95.7	16%	0.155	51%	0.514	C	S	.	.			trans	-70.6	115.4	-177.5	0	0	0	0	0	110.4
506	T	50.2	Low	41.7	Very low	90 Å²	90	88.9 Å²	88.9	55%	0.552	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	125.1	175.7	47	0	0	0	0	110	R504 T508	R504-T506 PolarHBondContact O-N 3.5Å; T506-T508 PolarHBondContact O-N 2.85Å
507	S	44.8	Very low	42.4	Very low	67 Å²	67	87.7 Å²	87.7	47%	0.469	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	117	168	-173.3	0	0	0	0	109.2
508	T	50.4	Low	43.2	Very low	24 Å²	24	91.7 Å²	91.7	15%	0.147	46%	0.462	C	S	.	.			trans	-109.8	69.3	-169	44.8	0	0	0	0	112.3	T506 K510 D511 C512	T506-T508 PolarHBondContact O-N 2.85Å; T508-K510 PolarHBondContact O-N 3.16Å; T508-D511 WeakPolarHBondContact CB-OD2 3.43Å; T508-D511 PolarHBondContact O-N 3.18Å; T508-C512 PolarHBondContact O-N 3.27Å; T508-C512 PolarHBondContact O-SG 2.8Å; T508-C512 VanDerWaalsContact O-SG 3.38Å
509	N	44.4	Very low	43.9	Very low	44 Å²	44	84 Å²	84	24%	0.235	42%	0.423	C	S	.	.	H	α-helix	trans	-49.1	-35.1	174.8	178.4	-71.5	0	0	0	113.1	E261 R513	E261-N509 PolarHBondContact OE1-ND2 3.22Å; N509-R513 WeakPolarHBondContact O-CB 3.44Å; N509-R513 WeakPolarHBondContact O-CG 3.42Å; N509-R513 PolarHBondContact O-N 3.15Å; N509-R513 WeakPolarHBondContact OD1-CD 3.27Å; N509-R513 PolarHBondContact OD1-NH1 3.35Å
510	K	37.4	Very low	44.4	Very low	163 Å²	163	81.6 Å²	81.6	71%	0.709	41%	0.406	S	S	*	.	H	α-helix	trans	-67.8	-35.8	178.6	-77.3	-175	175.2	179.6	0	113.8	T508 N514	T508-K510 PolarHBondContact O-N 3.16Å; K510-N514 VanDerWaalsContact O-CB 3.25Å; K510-N514 WeakPolarHBondContact O-CB 3.4Å; K510-N514 VanDerWaalsContact O-CG 3.28Å; K510-N514 PolarHBondContact O-N 3.13Å; K510-N514 PolarHBondContact O-ND2 3.45Å; K510-N514 VanDerWaalsContact O-ND2 3.1Å
511	D	47.1	Very low	44.8	Very low	78 Å²	78	84.7 Å²	84.7	42%	0.417	40%	0.403	S	S	.	.	H	α-helix	trans	-86.1	-41.6	-171.6	-60.7	-56.8	0	0	0	111.1	T508 R513 N514 W515	T508-D511 WeakPolarHBondContact CB-OD2 3.43Å; T508-D511 PolarHBondContact O-N 3.18Å; D511-R513 VanDerWaalsContact C-N 3.28Å; D511-R513 PolarHBondContact O-N 2.75Å; D511-N514 PolarHBondContact O-N 3.29Å; D511-W515 WeakPolarHBondContact O-CB 3.3Å; D511-W515 PolarHBondContact O-N 2.88Å; D511-W515 VanDerWaalsContact O-N 3.08Å
512	C	42.7	Very low	44.9	Very low	11 Å²	11	77.9 Å²	77.9	7%	0.074	39%	0.391	C	S	.	.	H	α-helix	trans	-56.9	-42.5	168.9	-36.4	0	0	0	0	110.1	D260 C262 T508 V516	D260-C512 WeakPolarHBondContact O-CB 3.29Å; C262-C512 HydrophobicContact CB-CB 4.41Å; C262-C512 WeakPolarHBondContact CB-SG 3.29Å; C262-C512 PolarHBondContact N-SG 3.14Å; C262-C512 WeakPolarHBondContact SG-CB 3.45Å; C262-C512 CovalentContact SG-SG 2.07Å; C262-C512 PolarHBondContact SG-SG 3Å; T508-C512 PolarHBondContact O-N 3.27Å; T508-C512 PolarHBondContact O-SG 2.8Å; T508-C512 VanDerWaalsContact O-SG 3.38Å; C512-V516 WeakPolarHBondContact O-CG2 3.49Å; C512-V516 PolarHBondContact O-N 3.43Å
513	R	45	Very low	44.5	Very low	124 Å²	124	77 Å²	77	47%	0.468	39%	0.385	S	S	.	.	H	α-helix	trans	-67.9	-51.9	175.5	-80.9	-176	174.5	156	-5.9	115.2	N509 D511 W515 V516 E517	N509-R513 WeakPolarHBondContact O-CB 3.44Å; N509-R513 WeakPolarHBondContact O-CG 3.42Å; N509-R513 PolarHBondContact O-N 3.15Å; N509-R513 WeakPolarHBondContact OD1-CD 3.27Å; N509-R513 PolarHBondContact OD1-NH1 3.35Å; D511-R513 VanDerWaalsContact C-N 3.28Å; D511-R513 PolarHBondContact O-N 2.75Å; R513-W515 PolarHBondContact O-N 2.83Å; R513-W515 VanDerWaalsContact O-N 3.13Å; R513-V516 PolarHBondContact O-N 3.37Å; R513-E517 PolarHBondContact O-N 3.47Å
514	N	44.2	Very low	44.1	Very low	79 Å²	79	82.9 Å²	82.9	42%	0.422	41%	0.41	S	S	.	.	H	α-helix	trans	-53.8	-36.2	178.4	-88.5	-40.1	0	0	0	111.5	K510 D511 K518	K510-N514 VanDerWaalsContact O-CB 3.25Å; K510-N514 WeakPolarHBondContact O-CB 3.4Å; K510-N514 VanDerWaalsContact O-CG 3.28Å; K510-N514 PolarHBondContact O-N 3.13Å; K510-N514 PolarHBondContact O-ND2 3.45Å; K510-N514 VanDerWaalsContact O-ND2 3.1Å; D511-N514 PolarHBondContact O-N 3.29Å; N514-K518 WeakPolarHBondContact O-CB 3.33Å; N514-K518 VanDerWaalsContact O-CG 3.26Å; N514-K518 WeakPolarHBondContact O-CG 3.3Å; N514-K518 PolarHBondContact O-N 3.47Å
515	W	49.7	Very low	43.3	Very low	69 Å²	69	76.3 Å²	76.3	26%	0.261	40%	0.404	S	S	.	.	H	α-helix	trans	-77	-35.8	179.2	172	101.7	0	0	0	111.8	L246 K247 D511 R513 K518 T519	L246-W515 VanDerWaalsContact C-CH2 3.5Å; L246-W515 WeakPolarHBondContact O-CH2 3.4Å; L246-W515 WeakPolarHBondContact O-CZ2 3.4Å; K247-W515 HydrophobicContact CB-CH2 4.04Å; K247-W515 HydrophobicContact CD-CH2 3.67Å; K247-W515 HydrophobicContact CD-CZ3 3.91Å; K247-W515 HydrophobicContact CG-CH2 3.86Å; K247-W515 VanDerWaalsContact N-CZ2 3.34Å; D511-W515 WeakPolarHBondContact O-CB 3.3Å; D511-W515 PolarHBondContact O-N 2.88Å; D511-W515 VanDerWaalsContact O-N 3.08Å; R513-W515 PolarHBondContact O-N 2.83Å; R513-W515 VanDerWaalsContact O-N 3.13Å; W515-K518 PolarHBondContact O-N 3.06Å; W515-T519 HydrophobicContact CD2-CG2 4.44Å; W515-T519 HydrophobicContact CH2-CG2 4.07Å; W515-T519 HydrophobicContact CZ2-CG2 3.69Å; W515-T519 WeakPolarHBondContact O-CB 3.31Å; W515-T519 WeakPolarHBondContact O-CG2 3.39Å; W515-T519 PolarHBondContact O-N 3.01Å; W515-T519 PolarHBondContact O-OG1 2.81Å
516	V	48.3	Very low	42.7	Very low	26 Å²	26	82.4 Å²	82.4	16%	0.158	43%	0.434	C	S	.	.	H	α-helix	trans	-64	-40.3	170	166	0	0	0	0	110.9	C512 R513 T519 N520	C512-V516 WeakPolarHBondContact O-CG2 3.49Å; C512-V516 PolarHBondContact O-N 3.43Å; R513-V516 PolarHBondContact O-N 3.37Å; V516-T519 WeakPolarHBondContact CA-OG1 3.34Å; V516-T519 PolarHBondContact O-OG1 2.95Å; V516-T519 VanDerWaalsContact O-OG1 3.14Å; V516-N520 WeakPolarHBondContact CG1-ND2 3.23Å; V516-N520 VanDerWaalsContact O-CB 3.26Å; V516-N520 WeakPolarHBondContact O-CB 3.42Å; V516-N520 PolarHBondContact O-N 3.17Å; V516-N520 PolarHBondContact O-ND2 3.15Å
517	E	39.4	Very low	41.8	Very low	106 Å²	106	89 Å²	89	50%	0.495	45%	0.449	S	S	.	.	H	α-helix	trans	-68	-44.1	177	-71.3	177.9	-178.3	0	0	111.7	R513 N520 Q521	R513-E517 PolarHBondContact O-N 3.47Å; E517-N520 PolarHBondContact O-N 2.93Å; E517-Q521 WeakPolarHBondContact O-CB 3.4Å; E517-Q521 VanDerWaalsContact O-CG 3.23Å; E517-Q521 WeakPolarHBondContact O-CG 3.42Å; E517-Q521 PolarHBondContact O-N 3.29Å
518	K	42.8	Very low	41	Very low	148 Å²	148	93 Å²	93	64%	0.643	46%	0.464	S	S	*	.	H	α-helix	trans	-62.9	-41.8	174.7	-78.5	173.4	-179.9	177.2	0	112.9	N514 W515 Q521 A522	N514-K518 WeakPolarHBondContact O-CB 3.33Å; N514-K518 VanDerWaalsContact O-CG 3.26Å; N514-K518 WeakPolarHBondContact O-CG 3.3Å; N514-K518 PolarHBondContact O-N 3.47Å; W515-K518 PolarHBondContact O-N 3.06Å; K518-Q521 PolarHBondContact O-N 2.82Å; K518-A522 WeakPolarHBondContact O-CB 3.47Å; K518-A522 PolarHBondContact O-N 3.3Å
519	T	43.8	Very low	40.1	Very low	23 Å²	23	97.6 Å²	97.6	14%	0.141	50%	0.495	C	S	.	.	H	α-helix	trans	-70.5	-38.6	177.5	47.2	0	0	0	0	112	L246 W515 V516 A522 M523	L246-T519 HydrophobicContact CB-CG2 4Å; W515-T519 HydrophobicContact CD2-CG2 4.44Å; W515-T519 HydrophobicContact CH2-CG2 4.07Å; W515-T519 HydrophobicContact CZ2-CG2 3.69Å; W515-T519 WeakPolarHBondContact O-CB 3.31Å; W515-T519 WeakPolarHBondContact O-CG2 3.39Å; W515-T519 PolarHBondContact O-N 3.01Å; W515-T519 PolarHBondContact O-OG1 2.81Å; V516-T519 WeakPolarHBondContact CA-OG1 3.34Å; V516-T519 PolarHBondContact O-OG1 2.95Å; V516-T519 VanDerWaalsContact O-OG1 3.14Å; T519-A522 PolarHBondContact O-N 2.83Å; T519-M523 WeakPolarHBondContact O-CB 3.46Å; T519-M523 VanDerWaalsContact O-CG 3.24Å; T519-M523 WeakPolarHBondContact O-CG 2.97Å; T519-M523 PolarHBondContact O-N 3.31Å
520	N	38.1	Very low	39.3	Very low	79 Å²	79	101.2 Å²	101.2	42%	0.422	52%	0.523	S	S	.	.	H	α-helix	trans	-63	-40.7	171.4	-81.3	-46.1	0	0	0	112.3	V516 E517 M523 Q524	V516-N520 WeakPolarHBondContact CG1-ND2 3.23Å; V516-N520 VanDerWaalsContact O-CB 3.26Å; V516-N520 WeakPolarHBondContact O-CB 3.42Å; V516-N520 PolarHBondContact O-N 3.17Å; V516-N520 PolarHBondContact O-ND2 3.15Å; E517-N520 PolarHBondContact O-N 2.93Å; N520-M523 PolarHBondContact O-N 3.09Å; N520-Q524 WeakPolarHBondContact O-CB 3.46Å; N520-Q524 WeakPolarHBondContact O-CG 3.2Å; N520-Q524 PolarHBondContact O-N 2.97Å
521	Q	41	Very low	38.9	Very low	129 Å²	129	96.9 Å²	96.9	60%	0.603	53%	0.525	S	S	*	.	H	α-helix	trans	-66.1	-41.7	174.9	-72.9	170.3	27.7	0	0	112	E517 K518 M523 Q524 G525	E517-Q521 WeakPolarHBondContact O-CB 3.4Å; E517-Q521 VanDerWaalsContact O-CG 3.23Å; E517-Q521 WeakPolarHBondContact O-CG 3.42Å; E517-Q521 PolarHBondContact O-N 3.29Å; K518-Q521 PolarHBondContact O-N 2.82Å; Q521-M523 VanDerWaalsContact C-N 3.34Å; Q521-M523 PolarHBondContact O-N 3.28Å; Q521-Q524 PolarHBondContact O-N 3.25Å; Q521-G525 PolarHBondContact O-N 2.89Å
522	A	40.8	Very low	37.9	Very low	65 Å²	65	98.1 Å²	98.1	54%	0.537	54%	0.54	S	S	.	.	H	α-helix	trans	-63.5	-37.6	174.4	0	0	0	0	0	112.6	K518 T519	K518-A522 WeakPolarHBondContact O-CB 3.47Å; K518-A522 PolarHBondContact O-N 3.3Å; T519-A522 PolarHBondContact O-N 2.83Å
523	M	39.1	Very low	37.2	Very low	57 Å²	57	105.9 Å²	105.9	28%	0.281	58%	0.58	S	S	.	*	H	α-helix	trans	-73.4	-28.1	176.3	-73.9	-72.6	165.8	0	0	113.4	Q162 L246 T519 N520 Q521	Q162-M523 HydrophobicContact CG-SD 3.98Å; L246-M523 HydrophobicContact CD1-CE 3.61Å; L246-M523 HydrophobicContact CD2-CE 3.47Å; L246-M523 VanDerWaalsContact CD2-CE 3.47Å; L246-M523 HydrophobicContact CG-CE 4.15Å; T519-M523 WeakPolarHBondContact O-CB 3.46Å; T519-M523 VanDerWaalsContact O-CG 3.24Å; T519-M523 WeakPolarHBondContact O-CG 2.97Å; T519-M523 PolarHBondContact O-N 3.31Å; N520-M523 PolarHBondContact O-N 3.09Å; Q521-M523 VanDerWaalsContact C-N 3.34Å; Q521-M523 PolarHBondContact O-N 3.28Å
524	Q	40.3	Very low	36.5	Very low	144 Å²	144	110 Å²	110	67%	0.673	60%	0.596	S	S	*	*	H	α-helix	trans	-88.8	-25	178	-69.5	171.9	31.9	0	0	113	N520 Q521 N526	N520-Q524 WeakPolarHBondContact O-CB 3.46Å; N520-Q524 WeakPolarHBondContact O-CG 3.2Å; N520-Q524 PolarHBondContact O-N 2.97Å; Q521-Q524 PolarHBondContact O-N 3.25Å; Q524-N526 VanDerWaalsContact C-N 3.28Å; Q524-N526 PolarHBondContact O-N 3.01Å
525	G	34.8	Very low	35.9	Very low	61 Å²	61	118 Å²	118	63%	0.629	62%	0.62	S	S	*	*	S	Bend	trans	-69.8	-13.8	-175.4	0	0	0	0	0	115.8	Q521 R527	Q521-G525 PolarHBondContact O-N 2.89Å; G525-R527 VanDerWaalsContact C-N 3.31Å; G525-R527 PolarHBondContact O-N 3.17Å
526	N	33.5	Very low	34.8	Very low	144 Å²	144	121.8 Å²	121.8	77%	0.77	65%	0.645	S	S	*	*			trans	-93.1	40.6	-173.6	-147.6	7.7	0	0	0	114.3	Q524	Q524-N526 VanDerWaalsContact C-N 3.28Å; Q524-N526 PolarHBondContact O-N 3.01Å
527	R	31.2	Very low	33.8	Very low	229 Å²	229	128.5 Å²	128.5	86%	0.864	68%	0.679	S	S	*	*			trans	-109.4	79.9	166.2	-75.7	-171.1	176.2	-166	0.3	110.1	G525	G525-R527 VanDerWaalsContact C-N 3.31Å; G525-R527 PolarHBondContact O-N 3.17Å
528	N	27.8	Very low	33.2	Very low	150 Å²	150	128.2 Å²	128.2	80%	0.802	70%	0.695	S	S	*	*			trans	-71.6	131.5	167.2	-99.3	-20.1	0	0	0	110.2	S530	N528-S530 PolarHBondContact O-N 3.38Å
529	P	31.2	Very low	32.5	Very low	120 Å²	120	126.8 Å²	126.8	78%	0.779	70%	0.704	S	S	*	*			trans	-75.7	119.5	176	30.3	-32.3	0	0	0	109.8	G531	P529-G531 PolarHBondContact O-N 3.4Å
530	S	28.1	Very low	31.7	Very low	120 Å²	120	130.8 Å²	130.8	84%	0.839	73%	0.733	S	S	*	*			trans	-70.5	98.6	172.2	38.3	0	0	0	0	110.5	N528 S532	N528-S530 PolarHBondContact O-N 3.38Å; S530-S532 PolarHBondContact O-N 3.24Å; S530-S532 VanDerWaalsContact O-N 3.11Å
531	G	27.4	Very low	31.3	Very low	73 Å²	73	136.3 Å²	136.3	75%	0.753	76%	0.756	S	S	*	*			trans	-61.6	109.2	172.6	0	0	0	0	0	111.5	P529 L533	P529-G531 PolarHBondContact O-N 3.4Å; G531-L533 PolarHBondContact O-N 3.45Å
532	S	26.8	Very low	30.7	Very low	104 Å²	104	136.8 Å²	136.8	73%	0.727	76%	0.763	S	S	*	*			trans	-73.3	88.8	175.2	168.4	0	0	0	0	111.2	S530 R534	S530-S532 PolarHBondContact O-N 3.24Å; S530-S532 VanDerWaalsContact O-N 3.11Å; S532-R534 PolarHBondContact O-N 3.18Å
533	L	29	Very low	30.2	Very low	174 Å²	174	143.1 Å²	143.1	91%	0.911	78%	0.781	S	S	*	*			trans	-74.1	100.6	159.5	-84.3	165.3	0	0	0	109.5	G531	G531-L533 PolarHBondContact O-N 3.45Å
534	R	28.7	Very low	29.7	Very low	211 Å²	211	145 Å²	145	80%	0.796	80%	0.8	S	S	*	*			trans	-105.1	134.6	157.9	-82.6	-167.2	171	-144	-0.8	109.8	S532	S532-R534 PolarHBondContact O-N 3.18Å
535	R	31.3	Very low	29.2	Very low	245 Å²	245	146.4 Å²	146.4	93%	0.925	81%	0.811	S	S	*	*			trans	-90.9	127.5	167.6	-57.3	173.4	-173.2	168.2	1.2	106.5
536	D	26.5	Very low	28.9	Very low	150 Å²	150	146.3 Å²	146.3	80%	0.802	81%	0.81	S	S	*	*			trans	-116.6	134	165.4	-69.7	-51	0	0	0	108.9
537	L	28.2	Very low	28.7	Very low	166 Å²	166	146 Å²	146	87%	0.869	82%	0.819	S	S	*	*			trans	-130.2	118.7	-174.6	-119.3	171.2	0	0	0	108.1
538	A	27.5	Very low	28.5	Very low	101 Å²	101	138.4 Å²	138.4	84%	0.835	81%	0.812	S	S	*	*			trans	59.4	136.8	172.6	0	0	0	0	0	116.5
539	S	27.3	Very low	28.5	Very low	118 Å²	118	136.9 Å²	136.9	83%	0.825	81%	0.813	S	S	*	*			cis	-147.3	164.5	41	61.6	0	0	0	0	114.1
540	S	26.8	Very low	28.3	Very low	107 Å²	107	138.7 Å²	138.7	75%	0.748	82%	0.815	S	S	*	*			trans	-93.1	136	173.1	50.1	0	0	0	0	111.7
541	Q	29.7	Very low	28.3	Very low	194 Å²	194	136.7 Å²	136.7	91%	0.907	81%	0.806	S	S	*	*			trans	-162.7	152	143.2	-115.4	165.2	12.7	0	0	113.2
542	D	29	Very low	28.2	Very low	140 Å²	140	142 Å²	142	75%	0.749	81%	0.811	S	S	*	*			trans	-56.9	144.9	-174.2	-61.8	-86.9	0	0	0	115.8
543	Q	30.9	Very low	28.3	Very low	198 Å²	198	142.5 Å²	142.5	93%	0.925	81%	0.814	S	S	*	*				-158.5	150.7	109.7	-109.6	154.1	89	0	0	113.9
544	S	27.9	Very low	28.1	Very low	95 Å²	95	143 Å²	143	66%	0.664	81%	0.809	S	S	*	*			trans	-106.7	172.8	-168.3	53.7	0	0	0	0	112.5
545	L	30.5	Very low	28.2	Very low	175 Å²	175	142.6 Å²	142.6	92%	0.916	81%	0.807	S	S	*	*			trans	75.1	137.8	171.9	-44.8	170.6	0	0	0	114.8
546	G	27	Very low	28.1	Very low	58 Å²	58	137.9 Å²	137.9	60%	0.598	79%	0.794	S	S	*	*			cis	157.5	143.8	-5.1	0	0	0	0	0	111.2
547	S	29.6	Very low	28.4	Very low	138 Å²	138	139.2 Å²	139.2	97%	0.965	79%	0.792	S	S	*	*			trans	62.2	154	179.1	74.5	0	0	0	0	116.5
548	G	28.2	Very low	29.4	Very low	70 Å²	70	141.1 Å²	141.1	72%	0.722	81%	0.811	S	S	*	*			cis	170	125.9	-10.4	0	0	0	0	0	113.2
549	S	26.1	Very low	29.5	Very low	117 Å²	117	143.1 Å²	143.1	82%	0.818	81%	0.81	S	S	*	*			trans	57.2	152.3	149.2	-140.8	0	0	0	0	123.9
550	L	28.2	Very low	29.6	Very low	158 Å²	158	144.4 Å²	144.4	83%	0.827	81%	0.809	S	S	*	*			trans	95.2	116.3	152.2	-75.8	160.9	0	0	0	123.2
551	A	27.6	Very low	29.8	Very low	78 Å²	78	146.5 Å²	146.5	65%	0.645	81%	0.812	S	S	*	*			trans	58.4	112	133.5	0	0	0	0	0	120.1
552	Q	26.4	Very low	29.8	Very low	185 Å²	185	143.7 Å²	143.7	86%	0.864	81%	0.806	S	S	*	*				58.4	106.9	82.3	-71.2	-172.8	-8.2	0	0	115.8
553	C	27.3	Very low	29.8	Very low	115 Å²	115	143.9 Å²	143.9	78%	0.777	81%	0.81	S	S	*	*				179.9	117.1	109.2	-106.5	0	0	0	0	115.3
554	F	25.9	Very low	29.8	Very low	184 Å²	184	140.3 Å²	140.3	81%	0.807	80%	0.802	S	S	*	*				36.8	142.3	123.4	-96.2	-67.1	0	0	0	124.2
555	R	30.4	Very low	29.9	Very low	203 Å²	203	143.6 Å²	143.6	77%	0.766	81%	0.812	S	S	*	*			trans	78.3	147.6	150.7	-68.9	177.3	179.3	-164.7	3.7	116.6
556	K	30.1	Very low	29.9	Very low	146 Å²	146	141.2 Å²	141.2	64%	0.635	80%	0.804	S	S	*	*			cis	-169.1	154.4	-11.7	-123	174.5	-179.9	177.6	0	109.3
557	K	32.8	Very low	30.1	Very low	178 Å²	178	148.1 Å²	148.1	77%	0.774	82%	0.821	S	S	*	*			trans	65.3	156	151.6	-71.3	-177.8	172.1	-163.6	0	116.1
558	T	48.6	Very low	30.2	Very low	205 Å²	205	149 Å²	149	100%	1.258	81%	0.808	S	S	*	*			cis	-106.8	0	7.1	47.1	0	0	0	0	113.4

Retrieved 558 of 558 residues in 648.7 ms (Link to these results)

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