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Arginine vasopressin isoform A

Carrier protein that binds to and transports Arg-vasopressin from the hypothalamus to the posterior pituitary gland, protecting it from degradation and facilitating its release. Has a direct antidiuretic action on the kidney, it also causes vasoconstriction of the peripheral vessels. Acts by binding to vasopressin receptors (V1bR/AVPR1B, V1aR/AVPR1A, and V2R/AVPR2). Precursor of Arg-vasopressin, an antidiuretic hormone, and neurophysin 2, its carrier protein.

AlphaFold DB , UniProt , Accession X5D8U4, Species HUMAN (Homo sapiens, Human), Gene AVP, Length 222 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	50.4	Low	63.5	Low	213 Å²	213	112.4 Å²	112.4	100%	1.049	62%	0.622	S	S	*	*				0	83.3	0	-67.7	-175.7	166.7	0	0	108.9
2	P	57.1	Low	63.8	Low	91 Å²	91	106.2 Å²	106.2	59%	0.591	60%	0.602	S	S	*	*			trans	-88.5	-10.5	177.3	35	-33.3	0	0	0	113.7	T4 M5	P2-T4 VanDerWaalsContact C-N 3.25Å; P2-T4 PolarHBondContact O-N 3.13Å; P2-M5 PolarHBondContact O-N 2.7Å; P2-M5 VanDerWaalsContact O-N 3.16Å
3	D	57.8	Low	64	Low	133 Å²	133	107.2 Å²	107.2	71%	0.711	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-20	-170.3	-53.3	-76.8	0	0	0	114.2	P7	D3-P7 WeakPolarHBondContact O-CD 3.31Å
4	T	60.5	Low	64.1	Low	105 Å²	105	107.6 Å²	107.6	64%	0.644	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-11.8	176.3	22.9	0	0	0	0	114.3	P2	P2-T4 VanDerWaalsContact C-N 3.25Å; P2-T4 PolarHBondContact O-N 3.13Å
5	M	62.3	Low	64.2	Low	128 Å²	128	104.2 Å²	104.2	63%	0.631	59%	0.594	S	S	*	*	H	α-helix	trans	-79.8	-36.3	179.3	-83.5	-131.4	80.8	0	0	113.1	P2 A8 C9	P2-M5 PolarHBondContact O-N 2.7Å; P2-M5 VanDerWaalsContact O-N 3.16Å; M5-A8 PolarHBondContact O-N 3.42Å; M5-C9 PolarHBondContact O-N 3.16Å; M5-C9 PolarHBondContact O-SG 3.48Å
6	L	66.4	Low	63.9	Low	119 Å²	119	107.6 Å²	107.6	62%	0.623	60%	0.601	S	S	*	*	H	α-helix	trans	-59.6	-52.2	177.3	-84.5	164.5	0	0	0	113.3	A8 C9 F10	L6-A8 VanDerWaalsContact C-N 3.29Å; L6-A8 PolarHBondContact O-N 2.75Å; L6-C9 PolarHBondContact O-N 3.34Å; L6-F10 HydrophobicContact CD2-CE2 4.4Å; L6-F10 VanDerWaalsContact O-CD2 3.24Å; L6-F10 WeakPolarHBondContact O-CD2 3.49Å; L6-F10 PolarHBondContact O-N 3.27Å; L6-F10 VanDerWaalsContact O-N 3.08Å
7	P	68.9	Low	63.7	Low	63 Å²	63	105.2 Å²	105.2	41%	0.409	59%	0.593	S	S	.	*	H	α-helix	trans	-65.2	-34.3	179.1	24.2	-32.8	0	0	0	112.1	D3 F10 L11	D3-P7 WeakPolarHBondContact O-CD 3.31Å; P7-F10 PolarHBondContact O-N 3.25Å; P7-L11 WeakPolarHBondContact O-CB 3.34Å; P7-L11 WeakPolarHBondContact O-CD1 3.09Å; P7-L11 PolarHBondContact O-N 3.12Å
8	A	67.9	Low	63.4	Low	58 Å²	58	103.4 Å²	103.4	48%	0.479	59%	0.588	S	S	.	*	H	α-helix	trans	-64.2	-39.5	175.3	0	0	0	0	0	112.4	M5 L6 G12	M5-A8 PolarHBondContact O-N 3.42Å; L6-A8 VanDerWaalsContact C-N 3.29Å; L6-A8 PolarHBondContact O-N 2.75Å; A8-G12 PolarHBondContact O-N 2.9Å
9	C	67.8	Low	63	Low	70 Å²	70	101.5 Å²	101.5	47%	0.473	59%	0.587	S	S	.	*	H	α-helix	trans	-66	-42	174.2	-79.3	0	0	0	0	112.7	M5 L6 G12 L13	M5-C9 PolarHBondContact O-N 3.16Å; M5-C9 PolarHBondContact O-SG 3.48Å; L6-C9 PolarHBondContact O-N 3.34Å; C9-G12 PolarHBondContact O-N 2.59Å; C9-L13 WeakPolarHBondContact O-CG 3.39Å; C9-L13 PolarHBondContact O-N 2.74Å
10	F	70.1	Confident	62.6	Low	134 Å²	134	101.9 Å²	101.9	59%	0.588	59%	0.594	S	S	*	*	H	α-helix	trans	-63.9	-42.5	176	-83.3	-74.5	0	0	0	112.1	L6 P7 G12 L13 L14	L6-F10 HydrophobicContact CD2-CE2 4.4Å; L6-F10 VanDerWaalsContact O-CD2 3.24Å; L6-F10 WeakPolarHBondContact O-CD2 3.49Å; L6-F10 PolarHBondContact O-N 3.27Å; L6-F10 VanDerWaalsContact O-N 3.08Å; P7-F10 PolarHBondContact O-N 3.25Å; F10-G12 VanDerWaalsContact C-N 3.32Å; F10-G12 PolarHBondContact O-N 3.34Å; F10-L13 PolarHBondContact O-N 3.02Å; F10-L14 WeakPolarHBondContact O-CB 3.39Å; F10-L14 WeakPolarHBondContact O-CD1 3.01Å; F10-L14 PolarHBondContact O-N 2.53Å
11	L	69.2	Low	62.3	Low	122 Å²	122	104.4 Å²	104.4	64%	0.639	59%	0.594	S	S	*	*	H	α-helix	trans	-61.1	-39.5	172.8	-87.9	150.3	0	0	0	112.1	P7 L14 A15	P7-L11 WeakPolarHBondContact O-CB 3.34Å; P7-L11 WeakPolarHBondContact O-CD1 3.09Å; P7-L11 PolarHBondContact O-N 3.12Å; L11-L14 PolarHBondContact O-N 2.95Å; L11-A15 WeakPolarHBondContact O-CB 3.49Å; L11-A15 PolarHBondContact O-N 2.77Å
12	G	67.1	Low	62.3	Low	38 Å²	38	101.7 Å²	101.7	39%	0.392	58%	0.577	S	S	.	*	H	α-helix	trans	-63.4	-44.4	175.1	0	0	0	0	0	113.2	A8 C9 F10 A15 F16	A8-G12 PolarHBondContact O-N 2.9Å; C9-G12 PolarHBondContact O-N 2.59Å; F10-G12 VanDerWaalsContact C-N 3.32Å; F10-G12 PolarHBondContact O-N 3.34Å; G12-A15 PolarHBondContact O-N 2.85Å; G12-F16 PolarHBondContact O-N 3.21Å
13	L	67.1	Low	62.1	Low	119 Å²	119	103.4 Å²	103.4	62%	0.623	58%	0.577	S	S	*	*	H	α-helix	trans	-69.1	-35.9	177.3	-69.1	170.6	0	0	0	112.3	C9 F10 F16 S17	C9-L13 WeakPolarHBondContact O-CG 3.39Å; C9-L13 PolarHBondContact O-N 2.74Å; F10-L13 PolarHBondContact O-N 3.02Å; L13-F16 PolarHBondContact O-N 3.42Å; L13-S17 WeakPolarHBondContact O-CB 3.39Å; L13-S17 PolarHBondContact O-N 2.91Å; L13-S17 PolarHBondContact O-OG 2.81Å
14	L	65.5	Low	62	Low	113 Å²	113	103.8 Å²	103.8	59%	0.592	58%	0.579	S	S	*	*	H	α-helix	trans	-65.9	-38.7	172.5	-84.3	156.6	0	0	0	112.2	F10 L11 S17 S18	F10-L14 WeakPolarHBondContact O-CB 3.39Å; F10-L14 WeakPolarHBondContact O-CD1 3.01Å; F10-L14 PolarHBondContact O-N 2.53Å; L11-L14 PolarHBondContact O-N 2.95Å; L14-S17 VanDerWaalsContact CA-OG 3.26Å; L14-S17 WeakPolarHBondContact CA-OG 3.22Å; L14-S17 PolarHBondContact O-OG 3.03Å; L14-S17 VanDerWaalsContact O-OG 3.12Å; L14-S18 WeakPolarHBondContact O-CB 2.96Å; L14-S18 PolarHBondContact O-N 3.25Å; L14-S18 PolarHBondContact O-OG 3.44Å
15	A	65.4	Low	61.6	Low	57 Å²	57	103.3 Å²	103.3	47%	0.471	58%	0.579	S	S	.	*	H	α-helix	trans	-67.4	-40.1	173	0	0	0	0	0	112	L11 G12 S18 A19	L11-A15 WeakPolarHBondContact O-CB 3.49Å; L11-A15 PolarHBondContact O-N 2.77Å; G12-A15 PolarHBondContact O-N 2.85Å; A15-S18 WeakPolarHBondContact CA-OG 3.37Å; A15-S18 PolarHBondContact O-N 2.99Å; A15-S18 PolarHBondContact O-OG 3.35Å; A15-A19 WeakPolarHBondContact O-CB 3.23Å; A15-A19 PolarHBondContact O-N 2.92Å
16	F	58.6	Low	61.1	Low	159 Å²	159	102.5 Å²	102.5	70%	0.697	58%	0.584	S	S	*	*	H	α-helix	trans	-69.4	-39.5	177.2	-123.7	-88.6	0	0	0	112.9	G12 L13 A19 C20	G12-F16 PolarHBondContact O-N 3.21Å; L13-F16 PolarHBondContact O-N 3.42Å; F16-A19 PolarHBondContact O-N 2.02Å; F16-C20 PolarHBondContact O-N 3.17Å; F16-C20 VanDerWaalsContact O-N 3.12Å; F16-C20 PolarHBondContact O-SG 2.99Å
17	S	60.1	Low	60.5	Low	67 Å²	67	108.7 Å²	108.7	47%	0.469	60%	0.599	S	S	.	*	H	α-helix	trans	-69.6	-34.1	176	47.6	0	0	0	0	112.4	L13 L14 C20 Y21	L13-S17 WeakPolarHBondContact O-CB 3.39Å; L13-S17 PolarHBondContact O-N 2.91Å; L13-S17 PolarHBondContact O-OG 2.81Å; L14-S17 VanDerWaalsContact CA-OG 3.26Å; L14-S17 WeakPolarHBondContact CA-OG 3.22Å; L14-S17 PolarHBondContact O-OG 3.03Å; L14-S17 VanDerWaalsContact O-OG 3.12Å; S17-C20 CarbonylContact O-C 3.59Å; S17-C20 PolarHBondContact O-N 3.29Å; S17-Y21 WeakPolarHBondContact O-CB 3.46Å; S17-Y21 PolarHBondContact O-N 2.87Å
18	S	58.5	Low	59.9	Low	73 Å²	73	108.9 Å²	108.9	51%	0.51	61%	0.612	S	S	.	*	H	α-helix	trans	-72.6	-31.2	172.8	62.6	0	0	0	0	113.4	L14 A15 C20 Y21	L14-S18 WeakPolarHBondContact O-CB 2.96Å; L14-S18 PolarHBondContact O-N 3.25Å; L14-S18 PolarHBondContact O-OG 3.44Å; A15-S18 WeakPolarHBondContact CA-OG 3.37Å; A15-S18 PolarHBondContact O-N 2.99Å; A15-S18 PolarHBondContact O-OG 3.35Å; S18-C20 VanDerWaalsContact C-N 3.31Å; S18-C20 PolarHBondContact O-N 2.76Å; S18-Y21 CarbonylContact O-C 3.44Å; S18-Y21 WeakPolarHBondContact O-CA 3.36Å; S18-Y21 WeakPolarHBondContact O-CB 3Å; S18-Y21 PolarHBondContact O-N 2.99Å
19	A	55.6	Low	58.6	Low	67 Å²	67	108.9 Å²	108.9	55%	0.554	62%	0.617	S	S	*	*	H	α-helix	trans	-69.1	-27.9	170.5	0	0	0	0	0	113	A15 F16 Y21	A15-A19 WeakPolarHBondContact O-CB 3.23Å; A15-A19 PolarHBondContact O-N 2.92Å; F16-A19 PolarHBondContact O-N 2.02Å; A19-Y21 VanDerWaalsContact C-N 3.29Å
20	C	55.3	Low	57.8	Low	108 Å²	108	115.9 Å²	115.9	73%	0.73	64%	0.64	S	S	*	*	S	Bend	trans	-79.2	-12.6	167.6	-68.3	0	0	0	0	112.9	F16 S17 S18 F22	F16-C20 PolarHBondContact O-N 3.17Å; F16-C20 VanDerWaalsContact O-N 3.12Å; F16-C20 PolarHBondContact O-SG 2.99Å; S17-C20 CarbonylContact O-C 3.59Å; S17-C20 PolarHBondContact O-N 3.29Å; S18-C20 VanDerWaalsContact C-N 3.31Å; S18-C20 PolarHBondContact O-N 2.76Å; C20-F22 VanDerWaalsContact C-N 3.32Å; C20-F22 PolarHBondContact O-N 2.96Å
21	Y	57.3	Low	57.1	Low	155 Å²	155	121.2 Å²	121.2	61%	0.608	66%	0.656	S	S	*	*			trans	-96.1	48.6	178.1	-158	-107.9	0	0	0	111.1	S17 S18 A19 Q23	S17-Y21 WeakPolarHBondContact O-CB 3.46Å; S17-Y21 PolarHBondContact O-N 2.87Å; S18-Y21 CarbonylContact O-C 3.44Å; S18-Y21 WeakPolarHBondContact O-CA 3.36Å; S18-Y21 WeakPolarHBondContact O-CB 3Å; S18-Y21 PolarHBondContact O-N 2.99Å; A19-Y21 VanDerWaalsContact C-N 3.29Å; Y21-Q23 HydrophobicContact CD1-CB 4.46Å; Y21-Q23 HydrophobicContact CD1-CG 3.41Å; Y21-Q23 VanDerWaalsContact CD1-CG 3.41Å; Y21-Q23 HydrophobicContact CD2-CG 4.28Å; Y21-Q23 HydrophobicContact CE1-CB 4.42Å; Y21-Q23 HydrophobicContact CE1-CG 3.12Å; Y21-Q23 HydrophobicContact CE2-CG 4.03Å; Y21-Q23 HydrophobicContact CG-CG 4.01Å; Y21-Q23 VanDerWaalsContact CZ-CG 3.47Å; Y21-Q23 PolarHBondContact O-N 2.84Å; Y21-Q23 PolarHBondContact OH-NE2 2.99Å
22	F	49.4	Very low	56	Low	156 Å²	156	119.3 Å²	119.3	68%	0.684	66%	0.658	S	S	*	*			trans	-67.4	86.2	158.2	-104	-90.5	0	0	0	108.3	C20 N24 C25	C20-F22 VanDerWaalsContact C-N 3.32Å; C20-F22 PolarHBondContact O-N 2.96Å; F22-N24 PolarHBondContact O-N 3.44Å; F22-C25 PolarHBondContact O-N 3.01Å
23	Q	54.3	Low	54.6	Low	128 Å²	128	123.7 Å²	123.7	60%	0.598	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	15.6	171	-83.5	-86.2	45.1	0	0	114	Y21	Y21-Q23 HydrophobicContact CD1-CB 4.46Å; Y21-Q23 HydrophobicContact CD1-CG 3.41Å; Y21-Q23 VanDerWaalsContact CD1-CG 3.41Å; Y21-Q23 HydrophobicContact CD2-CG 4.28Å; Y21-Q23 HydrophobicContact CE1-CB 4.42Å; Y21-Q23 HydrophobicContact CE1-CG 3.12Å; Y21-Q23 HydrophobicContact CE2-CG 4.03Å; Y21-Q23 HydrophobicContact CG-CG 4.01Å; Y21-Q23 VanDerWaalsContact CZ-CG 3.47Å; Y21-Q23 PolarHBondContact O-N 2.84Å; Y21-Q23 PolarHBondContact OH-NE2 2.99Å
24	N	54.2	Low	53.6	Low	140 Å²	140	123 Å²	123	75%	0.749	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155.8	54.1	175	-105.3	-63.4	0	0	0	109.5	F22 P26	F22-N24 PolarHBondContact O-N 3.44Å; N24-P26 WeakPolarHBondContact O-CD 3.31Å; N24-P26 VanDerWaalsContact O-N 3.14Å
25	C	52.7	Low	52.8	Low	95 Å²	95	122.3 Å²	122.3	64%	0.642	67%	0.672	S	S	*	*			trans	-59.6	114.8	157	-79.3	0	0	0	0	107	F22 R27	F22-C25 PolarHBondContact O-N 3.01Å; C25-R27 PolarHBondContact O-N 2.74Å
26	P	51.8	Low	52.1	Low	112 Å²	112	126.2 Å²	126.2	73%	0.727	68%	0.684	S	S	*	*			trans	-53.9	136.8	168.8	24.8	-32.6	0	0	0	106.7	N24 G28	N24-P26 WeakPolarHBondContact O-CD 3.31Å; N24-P26 VanDerWaalsContact O-N 3.14Å; P26-G28 WeakPolarHBondContact O-CA 3.48Å; P26-G28 PolarHBondContact O-N 2.91Å
27	R	54.6	Low	52	Low	249 Å²	249	127.4 Å²	127.4	94%	0.94	69%	0.692	S	S	*	*	S	Bend	trans	-58.9	85.5	-177	-162.9	165.6	-174.8	167.7	-1.3	109.5	C25	C25-R27 PolarHBondContact O-N 2.74Å
28	G	55	Low	52.5	Low	67 Å²	67	127.1 Å²	127.1	69%	0.691	68%	0.684	S	S	*	*			trans	-167.6	39	-155.6	0	0	0	0	0	112.8	P26	P26-G28 WeakPolarHBondContact O-CA 3.48Å; P26-G28 PolarHBondContact O-N 2.91Å
29	G	41.8	Very low	53.6	Low	57 Å²	57	126.7 Å²	126.7	59%	0.588	67%	0.672	S	S	*	*			trans	-87.9	133.1	160.8	0	0	0	0	0	109.5	R31 A32	G29-R31 PolarHBondContact O-N 3.33Å; G29-A32 PolarHBondContact O-N 2.04Å
30	K	49.9	Very low	55	Low	218 Å²	218	129.5 Å²	129.5	95%	0.948	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	14.8	-176.2	-69.5	-174.3	176.7	-177.8	0	116.3
31	R	55.9	Low	56.6	Low	245 Å²	245	124.8 Å²	124.8	93%	0.925	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.5	16.4	-174.3	-58.7	-171.7	-172.6	-156.7	2.2	115.9	G29	G29-R31 PolarHBondContact O-N 3.33Å
32	A	45.3	Very low	58.2	Low	82 Å²	82	119 Å²	119	68%	0.678	62%	0.621	S	S	*	*	S	Bend	trans	-145.9	42.1	179.3	0	0	0	0	0	114.2	G29	G29-A32 PolarHBondContact O-N 2.04Å
33	M	38.1	Very low	60.2	Low	130 Å²	130	114.3 Å²	114.3	64%	0.64	61%	0.606	S	S	*	*			trans	-131.4	47.4	160.9	-161.4	177.3	-139.9	0	0	109.4	D35 L36	M33-D35 PolarHBondContact O-N 2.04Å; M33-L36 HydrophobicContact CE-CB 4.16Å; M33-L36 HydrophobicContact CE-CD1 3.47Å; M33-L36 VanDerWaalsContact CE-CD1 3.47Å; M33-L36 HydrophobicContact CE-CG 4.42Å
34	S	46.8	Very low	61.9	Low	104 Å²	104	108.3 Å²	108.3	73%	0.727	58%	0.579	S	S	*	*	S	Bend	trans	-67.6	117.3	148.3	46.9	0	0	0	0	104.6
35	D	48.5	Very low	63.6	Low	99 Å²	99	102.7 Å²	102.7	53%	0.529	55%	0.553	S	S	.	*			trans	90.4	71.7	172.5	-151.1	24.3	0	0	0	115.6	M33 E37 L38	M33-D35 PolarHBondContact O-N 2.04Å; D35-E37 PolarHBondContact O-N 3.12Å; D35-E37 WeakPolarHBondContact OD1-CA 3.31Å; D35-E37 PolarHBondContact OD1-N 2.95Å; D35-L38 PolarHBondContact OD1-N 3.18Å
36	L	50	Low	65.1	Low	139 Å²	139	101.7 Å²	101.7	73%	0.728	55%	0.546	S	S	*	.	S	Bend	trans	-68.8	77.5	142.2	-171.5	88.4	0	0	0	106.4	M33 L38	M33-L36 HydrophobicContact CE-CB 4.16Å; M33-L36 HydrophobicContact CE-CD1 3.47Å; M33-L36 VanDerWaalsContact CE-CD1 3.47Å; M33-L36 HydrophobicContact CE-CG 4.42Å; L36-L38 PolarHBondContact O-N 3Å
37	E	56.8	Low	66.8	Low	184 Å²	184	100 Å²	100	86%	0.86	55%	0.549	S	S	*	.			trans	33.4	56.7	165.9	-153.3	162.7	121.3	0	0	115.9	D35 R39	D35-E37 PolarHBondContact O-N 3.12Å; D35-E37 WeakPolarHBondContact OD1-CA 3.31Å; D35-E37 PolarHBondContact OD1-N 2.95Å; E37-R39 PolarHBondContact O-N 3Å
38	L	70.4	Confident	68.3	Low	61 Å²	61	90 Å²	90	32%	0.319	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-79	121.1	171.9	-141.8	78.8	0	0	0	107.6	D35 L36 Q40 P84 Q86	D35-L38 PolarHBondContact OD1-N 3.18Å; L36-L38 PolarHBondContact O-N 3Å; L38-Q40 PolarHBondContact O-N 2.8Å; L38-P84 HydrophobicContact CD1-CB 4.24Å; L38-P84 HydrophobicContact CD1-CG 4.29Å; L38-P84 HydrophobicContact CD2-CB 4.13Å; L38-P84 HydrophobicContact CG-CB 4.42Å; L38-Q86 HydrophobicContact CB-CB 4.29Å; L38-Q86 HydrophobicContact CD2-CB 3.64Å
39	R	82.6	Confident	69.8	Low	65 Å²	65	94.6 Å²	94.6	25%	0.245	52%	0.524	C	S	.	.	B	Isolated β-bridge	trans	-50.3	141.4	-178.6	53.1	170.6	-173.5	114.5	-6.1	110.9	E37 C41 E78 L81 S83 P84 C85 Q86	E37-R39 PolarHBondContact O-N 3Å; R39-C41 PolarHBondContact O-N 3.28Å; R39-E78 IonicContact CZ-OE2 3.32Å; R39-E78 VanDerWaalsContact CZ-OE2 3.32Å; R39-E78 VanDerWaalsContact NH1-CD 3.31Å; R39-E78 IonicContact NH1-OE1 3.1Å; R39-E78 PolarHBondContact NH1-OE1 3.16Å; R39-E78 VanDerWaalsContact NH1-OE1 3.1Å; R39-E78 IonicContact NH1-OE2 2.7Å; R39-E78 PolarHBondContact NH1-OE2 3.27Å; R39-E78 IonicContact NH2-OE2 2.99Å; R39-E78 PolarHBondContact NH2-OE2 3.29Å; R39-L81 VanDerWaalsContact NH2-CB 3.28Å; R39-S83 VanDerWaalsContact CZ-OG 3.26Å; R39-S83 VanDerWaalsContact NE-CB 3.34Å; R39-S83 PolarHBondContact NE-O 3.1Å; R39-S83 PolarHBondContact NE-OG 2.7Å; R39-S83 PolarHBondContact NH2-O 2.99Å; R39-S83 PolarHBondContact NH2-OG 2.71Å; R39-P84 WeakPolarHBondContact CD-O 3.09Å; R39-P84 WeakPolarHBondContact CG-O 3.22Å; R39-P84 PolarHBondContact NE-O 3.2Å; R39-C85 HydrophobicContact CG-CB 3.97Å; R39-C85 CarbonylContact O-C 3.6Å; R39-C85 WeakPolarHBondContact O-CA 3.24Å; R39-C85 WeakPolarHBondContact O-CB 3.49Å; R39-Q86 PolarHBondContact O-N 2.95Å
40	Q	84.8	Confident	72.1	Confident	126 Å²	126	92 Å²	92	59%	0.589	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-64.7	137.9	169	-63.1	177.3	24.3	0	0	108.5	L38	L38-Q40 PolarHBondContact O-N 2.8Å
41	C	89.1	Confident	74	Confident	9 Å²	9	85.7 Å²	85.7	6%	0.061	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-63.8	162.2	176.3	-55.3	0	0	0	0	111.2	R39 R51 C52 E78 C85 S87	R39-C41 PolarHBondContact O-N 3.28Å; C41-R51 VanDerWaalsContact O-CD 3.3Å; C41-R51 WeakPolarHBondContact O-CD 3.45Å; C41-R51 PolarHBondContact O-NH1 3.43Å; C41-C52 HydrophobicContact CB-CB 4.04Å; C41-C52 VanDerWaalsContact CB-O 3.29Å; C41-C52 WeakPolarHBondContact CB-O 3.14Å; C41-E78 VanDerWaalsContact CA-OE1 3.29Å; C41-E78 WeakPolarHBondContact CA-OE1 3.06Å; C41-C85 VanDerWaalsContact CA-SG 3.59Å; C41-C85 HydrophobicContact CB-CB 3.94Å; C41-C85 WeakPolarHBondContact CB-SG 3.03Å; C41-C85 WeakPolarHBondContact SG-CB 3.16Å; C41-C85 CovalentContact SG-SG 2.05Å; C41-C85 PolarHBondContact SG-SG 3.36Å; C41-S87 VanDerWaalsContact CB-OG 3.31Å; C41-S87 WeakPolarHBondContact CB-OG 2.82Å; C41-S87 PolarHBondContact N-OG 3.11Å
42	L	89.3	Confident	75.7	Confident	32 Å²	32	74.1 Å²	74.1	17%	0.168	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-50.4	142.6	-177.4	-100.7	73.5	0	0	0	111.6	C52 E77 E78	L42-C52 PolarHBondContact O-N 2.94Å; L42-C52 VanDerWaalsContact O-N 3.15Å; L42-C52 PolarHBondContact O-SG 3Å; L42-C52 VanDerWaalsContact O-SG 3.35Å; L42-E77 HydrophobicContact CD2-CB 4.06Å; L42-E77 HydrophobicContact CD2-CG 4.2Å; L42-E78 HydrophobicContact CB-CG 4.12Å; L42-E78 HydrophobicContact CD1-CG 4.12Å; L42-E78 WeakPolarHBondContact CD1-OE1 3.47Å; L42-E78 PolarHBondContact N-OE1 3.32Å
43	P	91.5	Very high	77.8	Confident	58 Å²	58	71.6 Å²	71.6	38%	0.377	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	143.5	171.3	30.2	-32.2	0	0	0	110.5	G50	P43-G50 CarbonylContact C-O 3.57Å; P43-G50 VanDerWaalsContact CA-O 3.26Å; P43-G50 WeakPolarHBondContact CA-O 3.13Å
44	C	91.4	Very high	80.1	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.02	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	171.4	-177.6	65.1	0	0	0	0	111.5	G50 R51 C58	C44-G50 PolarHBondContact N-O 3.35Å; C44-G50 CarbonylContact O-C 3.56Å; C44-G50 VanDerWaalsContact O-CA 3.23Å; C44-G50 WeakPolarHBondContact O-CA 3.22Å; C44-G50 PolarHBondContact O-N 3.18Å; C44-R51 PolarHBondContact SG-N 3.15Å; C44-R51 VanDerWaalsContact SG-N 3.43Å; C44-R51 PolarHBondContact SG-O 3.36Å; C44-R51 VanDerWaalsContact SG-O 3.36Å; C44-C58 HydrophobicContact CB-CB 3.84Å; C44-C58 WeakPolarHBondContact CB-SG 3.14Å; C44-C58 WeakPolarHBondContact SG-CA 3.26Å; C44-C58 WeakPolarHBondContact SG-CB 3.17Å; C44-C58 CovalentContact SG-SG 2.02Å; C44-C58 PolarHBondContact SG-SG 2.72Å
45	G	88.6	Confident	82	Confident	21 Å²	21	63.6 Å²	63.6	22%	0.216	36%	0.355	C	S	.	.	S	Bend	trans	77.2	178.2	179.9	0	0	0	0	0	115.2	G47 G48 C58	G45-G47 PolarHBondContact O-N 3.28Å; G45-G48 PolarHBondContact O-N 3.33Å; G45-C58 PolarHBondContact N-SG 3Å; G45-C58 VanDerWaalsContact N-SG 3.42Å
46	P	85.7	Confident	83.8	Confident	75 Å²	75	60.9 Å²	60.9	49%	0.487	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-65.7	121.6	-173.6	26.5	-33.9	0	0	0	110.7	G48 L63	P46-G48 VanDerWaalsContact C-N 3.28Å; P46-G48 PolarHBondContact O-N 3.22Å; P46-L63 HydrophobicContact CG-CD1 3.64Å
47	G	85.8	Confident	85.7	Confident	77 Å²	77	54.3 Å²	54.3	79%	0.794	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	73.2	13.7	-175.9	0	0	0	0	0	114.8	G45 K49	G45-G47 PolarHBondContact O-N 3.28Å; G47-K49 PolarHBondContact O-N 2.03Å; G47-K49 VanDerWaalsContact O-N 3.17Å
48	G	86.2	Confident	87.3	Confident	38 Å²	38	45.6 Å²	45.6	39%	0.392	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	64.9	20	175.9	0	0	0	0	0	114.4	G45 P46 G50	G45-G48 PolarHBondContact O-N 3.33Å; P46-G48 VanDerWaalsContact C-N 3.28Å; P46-G48 PolarHBondContact O-N 3.22Å; G48-G50 VanDerWaalsContact C-N 3.31Å
49	K	87.3	Confident	88.3	Confident	164 Å²	164	42.8 Å²	42.8	71%	0.713	25%	0.254	S	S	*	.			trans	-77.9	-16.9	-177.5	-62.6	-176.5	179.2	-178.6	0	113.1	G47	G47-K49 PolarHBondContact O-N 2.03Å; G47-K49 VanDerWaalsContact O-N 3.17Å
50	G	89.4	Confident	88.6	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	171.9	177.7	0	0	0	0	0	113.1	P43 C44 G48 C59	P43-G50 CarbonylContact C-O 3.57Å; P43-G50 VanDerWaalsContact CA-O 3.26Å; P43-G50 WeakPolarHBondContact CA-O 3.13Å; C44-G50 PolarHBondContact N-O 3.35Å; C44-G50 CarbonylContact O-C 3.56Å; C44-G50 VanDerWaalsContact O-CA 3.23Å; C44-G50 WeakPolarHBondContact O-CA 3.22Å; C44-G50 PolarHBondContact O-N 3.18Å; G48-G50 VanDerWaalsContact C-N 3.31Å; G50-C59 CarbonylContact C-O 3.45Å; G50-C59 WeakPolarHBondContact CA-O 2.97Å
51	R	90.9	Very high	88.5	Confident	86 Å²	86	37.1 Å²	37.1	33%	0.325	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	149.1	175	-65.3	-67.5	176	173.8	-2.2	110.7	C41 C44 F53 C59	C41-R51 VanDerWaalsContact O-CD 3.3Å; C41-R51 WeakPolarHBondContact O-CD 3.45Å; C41-R51 PolarHBondContact O-NH1 3.43Å; C44-R51 PolarHBondContact SG-N 3.15Å; C44-R51 VanDerWaalsContact SG-N 3.43Å; C44-R51 PolarHBondContact SG-O 3.36Å; C44-R51 VanDerWaalsContact SG-O 3.36Å; R51-F53 HydrophobicContact CB-CE2 4.21Å; R51-F53 VanDerWaalsContact O-CD2 3.24Å; R51-F53 WeakPolarHBondContact O-CD2 3.42Å; R51-F53 PolarHBondContact O-N 3.28Å; R51-C59 PolarHBondContact N-O 2.96Å; R51-C59 PolarHBondContact O-N 3.21Å
52	C	90.7	Very high	88.2	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.02	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	124.4	178.4	-64	0	0	0	0	111.1	C41 L42 C75 E78 S87	C41-C52 HydrophobicContact CB-CB 4.04Å; C41-C52 VanDerWaalsContact CB-O 3.29Å; C41-C52 WeakPolarHBondContact CB-O 3.14Å; L42-C52 PolarHBondContact O-N 2.94Å; L42-C52 VanDerWaalsContact O-N 3.15Å; L42-C52 PolarHBondContact O-SG 3Å; L42-C52 VanDerWaalsContact O-SG 3.35Å; C52-C75 WeakPolarHBondContact CA-SG 3.4Å; C52-C75 HydrophobicContact CB-CB 3.52Å; C52-C75 WeakPolarHBondContact CB-SG 3.36Å; C52-C75 WeakPolarHBondContact SG-CA 3.14Å; C52-C75 WeakPolarHBondContact SG-CB 3.22Å; C52-C75 CovalentContact SG-SG 2.03Å; C52-C75 PolarHBondContact SG-SG 3.07Å; C52-E78 HydrophobicContact CB-CG 4.45Å; C52-S87 PolarHBondContact O-OG 3.19Å
53	F	89.1	Confident	87.7	Confident	28 Å²	28	47.8 Å²	47.8	12%	0.123	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-10.1	172.8	-76.2	-98.1	0	0	0	112.1	R51 I57 C59 S87 R97 A99 C105 D107	R51-F53 HydrophobicContact CB-CE2 4.21Å; R51-F53 VanDerWaalsContact O-CD2 3.24Å; R51-F53 WeakPolarHBondContact O-CD2 3.42Å; R51-F53 PolarHBondContact O-N 3.28Å; F53-I57 HydrophobicContact CB-CB 4.37Å; F53-I57 HydrophobicContact CB-CG2 4.04Å; F53-I57 PolarHBondContact N-O 2.84Å; F53-C59 HydrophobicContact CD2-CB 3.68Å; F53-C59 HydrophobicContact CE2-CB 3.75Å; F53-S87 VanDerWaalsContact CE1-C 3.45Å; F53-S87 WeakPolarHBondContact CE1-O 3.39Å; F53-R97 HydrophobicContact CD1-CB 4.47Å; F53-R97 HydrophobicContact CE1-CB 4.2Å; F53-A99 HydrophobicContact CD1-CB 3.73Å; F53-A99 HydrophobicContact CD2-CB 3.84Å; F53-A99 HydrophobicContact CE1-CB 3.62Å; F53-A99 HydrophobicContact CE2-CB 3.75Å; F53-A99 HydrophobicContact CG-CB 3.85Å; F53-A99 VanDerWaalsContact CZ-CA 3.46Å; F53-A99 HydrophobicContact CZ-CB 3.64Å; F53-C105 HydrophobicContact CB-CB 4.42Å; F53-D107 WeakPolarHBondContact O-CB 3.47Å
54	G	87.7	Confident	87.5	Confident	11 Å²	11	46.1 Å²	46.1	11%	0.113	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	173.4	175.9	0	0	0	0	0	110.9	S56 I57 C75 E166	G54-S56 PolarHBondContact O-N 3.02Å; G54-S56 VanDerWaalsContact O-N 3.12Å; G54-I57 PolarHBondContact O-N 3.15Å; G54-C75 WeakPolarHBondContact O-CB 3.38Å; G54-E166 VanDerWaalsContact CA-OE1 3.22Å; G54-E166 WeakPolarHBondContact CA-OE1 3.28Å
55	P	85.5	Confident	87.4	Confident	55 Å²	55	47.8 Å²	47.8	36%	0.357	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-24.8	-174.6	21.5	-35.5	0	0	0	115.1	C75 Q76 E166	P55-C75 CarbonylContact O-C 3.55Å; P55-Q76 PolarHBondContact O-N 3.31Å; P55-E166 WeakPolarHBondContact CD-OE1 3.3Å
56	S	87.9	Confident	87.3	Confident	43 Å²	43	49.6 Å²	49.6	30%	0.301	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.1	19.6	174.7	73.3	0	0	0	0	113.6	G54 V67 G68 A72 E166	G54-S56 PolarHBondContact O-N 3.02Å; G54-S56 VanDerWaalsContact O-N 3.12Å; S56-V67 CarbonylContact O-C 3.56Å; S56-V67 WeakPolarHBondContact O-CA 2.96Å; S56-G68 PolarHBondContact O-N 3.31Å; S56-A72 WeakPolarHBondContact O-CB 3.25Å; S56-E166 WeakPolarHBondContact CA-OE2 2.98Å; S56-E166 WeakPolarHBondContact CB-OE2 3.42Å; S56-E166 PolarHBondContact N-OE2 3.05Å; S56-E166 PolarHBondContact OG-OE2 3.21Å
57	I	89.1	Confident	87.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	118.5	179.1	-49.6	177	0	0	0	110.5	F53 G54 V67 E166	F53-I57 HydrophobicContact CB-CB 4.37Å; F53-I57 HydrophobicContact CB-CG2 4.04Å; F53-I57 PolarHBondContact N-O 2.84Å; G54-I57 PolarHBondContact O-N 3.15Å; I57-V67 HydrophobicContact CG1-CG1 4.41Å; I57-V67 HydrophobicContact CG1-CG2 4.5Å; I57-V67 HydrophobicContact CG2-CG2 4.39Å; I57-E166 HydrophobicContact CD1-CB 3.83Å; I57-E166 HydrophobicContact CD1-CG 4.32Å; I57-E166 HydrophobicContact CG1-CB 4.16Å
58	C	91.3	Very high	87.5	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.007	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.3	169.3	178.2	0	0	0	0	110.1	C44 G45 C65 F66 A72	C44-C58 HydrophobicContact CB-CB 3.84Å; C44-C58 WeakPolarHBondContact CB-SG 3.14Å; C44-C58 WeakPolarHBondContact SG-CA 3.26Å; C44-C58 WeakPolarHBondContact SG-CB 3.17Å; C44-C58 CovalentContact SG-SG 2.02Å; C44-C58 PolarHBondContact SG-SG 2.72Å; G45-C58 PolarHBondContact N-SG 3Å; G45-C58 VanDerWaalsContact N-SG 3.42Å; C58-C65 WeakPolarHBondContact O-CA 3.02Å; C58-F66 PolarHBondContact N-O 3.33Å; C58-F66 PolarHBondContact O-N 3.14Å; C58-A72 HydrophobicContact CB-CB 3.86Å
59	C	90.9	Very high	87.5	Confident	2 Å²	2	49 Å²	49	1%	0.014	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	136.4	176.5	-61.5	0	0	0	0	111.6	G50 R51 F53 G64 C65 A99 C105	G50-C59 CarbonylContact C-O 3.45Å; G50-C59 WeakPolarHBondContact CA-O 2.97Å; R51-C59 PolarHBondContact N-O 2.96Å; R51-C59 PolarHBondContact O-N 3.21Å; F53-C59 HydrophobicContact CD2-CB 3.68Å; F53-C59 HydrophobicContact CE2-CB 3.75Å; C59-G64 WeakPolarHBondContact CA-O 3.5Å; C59-C65 HydrophobicContact CB-CB 4.12Å; C59-C65 WeakPolarHBondContact CB-SG 3.46Å; C59-C65 WeakPolarHBondContact SG-CB 3.43Å; C59-C65 CovalentContact SG-SG 2.04Å; C59-C65 PolarHBondContact SG-SG 2.04Å; C59-A99 HydrophobicContact CB-CB 3.65Å; C59-A99 WeakPolarHBondContact CB-O 3.06Å; C59-A99 WeakPolarHBondContact SG-CB 3.31Å; C59-C105 VanDerWaalsContact SG-SG 3.69Å
60	A	88.3	Confident	87.5	Confident	5 Å²	5	44.5 Å²	44.5	4%	0.041	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	142.8	171.2	0	0	0	0	0	109.3	E62 L63 G64	A60-E62 PolarHBondContact O-N 3.14Å; A60-L63 HydrophobicContact CB-CB 4.03Å; A60-L63 HydrophobicContact CB-CD1 4.15Å; A60-L63 HydrophobicContact CB-CG 4.32Å; A60-L63 PolarHBondContact O-N 2.02Å; A60-G64 PolarHBondContact N-O 3.39Å; A60-G64 PolarHBondContact O-N 3.45Å; A60-G64 VanDerWaalsContact O-O 3.13Å
61	D	83.2	Confident	87.5	Confident	68 Å²	68	48 Å²	48	36%	0.364	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-35.3	-173.2	-78.8	-39	0	0	0	112.4	F178 R181	D61-F178 HydrophobicContact CB-CE1 3.51Å; D61-F178 HydrophobicContact CB-CZ 3.45Å; D61-F178 VanDerWaalsContact CB-CZ 3.45Å; D61-F178 WeakPolarHBondContact OD1-CE2 3.4Å; D61-F178 WeakPolarHBondContact OD1-CZ 3.49Å; D61-R181 VanDerWaalsContact CG-NH1 3.34Å; D61-R181 IonicContact OD1-CZ 3.75Å; D61-R181 IonicContact OD1-NH1 2.82Å; D61-R181 PolarHBondContact OD1-NH1 2.84Å; D61-R181 VanDerWaalsContact OD1-NH1 3.09Å; D61-R181 IonicContact OD1-NH2 3.15Å; D61-R181 PolarHBondContact OD1-NH2 2.7Å; D61-R181 IonicContact OD2-CZ 3.91Å; D61-R181 IonicContact OD2-NH1 3.42Å; D61-R181 PolarHBondContact OD2-NH1 3.46Å; D61-R181 IonicContact OD2-NH2 2.84Å
62	E	81.5	Confident	87.3	Confident	181 Å²	181	44 Å²	44	85%	0.846	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-28.5	-178.8	-66	-76.5	148.7	0	0	114.1	A60	A60-E62 PolarHBondContact O-N 3.14Å
63	L	79.1	Confident	87.1	Confident	83 Å²	83	49.5 Å²	49.5	44%	0.435	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-7.4	-170.9	-55.1	164.8	0	0	0	113	P46 A60 F66	P46-L63 HydrophobicContact CG-CD1 3.64Å; A60-L63 HydrophobicContact CB-CB 4.03Å; A60-L63 HydrophobicContact CB-CD1 4.15Å; A60-L63 HydrophobicContact CB-CG 4.32Å; A60-L63 PolarHBondContact O-N 2.02Å; L63-F66 HydrophobicContact CB-CE2 3.93Å; L63-F66 HydrophobicContact CB-CZ 4.08Å
64	G	86.9	Confident	87.1	Confident	24 Å²	24	55.1 Å²	55.1	25%	0.247	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	84.3	-157.8	-175.8	0	0	0	0	0	113.1	C59 A60	C59-G64 WeakPolarHBondContact CA-O 3.5Å; A60-G64 PolarHBondContact N-O 3.39Å; A60-G64 PolarHBondContact O-N 3.45Å; A60-G64 VanDerWaalsContact O-O 3.13Å
65	C	89.9	Confident	87.1	Confident	37 Å²	37	54.6 Å²	54.6	25%	0.25	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	130.7	-178.1	-74	0	0	0	0	111.1	C58 C59 V103	C58-C65 WeakPolarHBondContact O-CA 3.02Å; C59-C65 HydrophobicContact CB-CB 4.12Å; C59-C65 WeakPolarHBondContact CB-SG 3.46Å; C59-C65 WeakPolarHBondContact SG-CB 3.43Å; C59-C65 CovalentContact SG-SG 2.04Å; C59-C65 PolarHBondContact SG-SG 2.04Å; C65-V103 HydrophobicContact CB-CG1 4.48Å
66	F	87.9	Confident	87.3	Confident	59 Å²	59	57.1 Å²	57.1	26%	0.259	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	118.4	175.4	-55.1	-82.7	0	0	0	109.1	C58 L63 T69	C58-F66 PolarHBondContact N-O 3.33Å; C58-F66 PolarHBondContact O-N 3.14Å; L63-F66 HydrophobicContact CB-CE2 3.93Å; L63-F66 HydrophobicContact CB-CZ 4.08Å; F66-T69 HydrophobicContact CB-CG2 4.1Å; F66-T69 VanDerWaalsContact CB-OG1 3.31Å; F66-T69 WeakPolarHBondContact CB-OG1 3.36Å
67	V	89.4	Confident	87.3	Confident	71 Å²	71	59.3 Å²	59.3	43%	0.43	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.3	-178.6	-174.9	0	0	0	0	108.6	S56 I57 T69	S56-V67 CarbonylContact O-C 3.56Å; S56-V67 WeakPolarHBondContact O-CA 2.96Å; I57-V67 HydrophobicContact CG1-CG1 4.41Å; I57-V67 HydrophobicContact CG1-CG2 4.5Å; I57-V67 HydrophobicContact CG2-CG2 4.39Å; V67-T69 VanDerWaalsContact C-N 3.27Å; V67-T69 PolarHBondContact O-N 3.16Å
68	G	84.5	Confident	87.1	Confident	61 Å²	61	59.8 Å²	59.8	63%	0.629	33%	0.327	S	S	*	.	S	Bend	trans	69.5	17.3	178.3	0	0	0	0	0	115.2	S56	S56-G68 PolarHBondContact O-N 3.31Å
69	T	86.9	Confident	86.7	Confident	47 Å²	47	62.7 Å²	62.7	29%	0.288	34%	0.343	S	S	.	.	S	Bend	trans	-96.6	172.6	179.4	74.6	0	0	0	0	112.2	F66 V67 E71 A72	F66-T69 HydrophobicContact CB-CG2 4.1Å; F66-T69 VanDerWaalsContact CB-OG1 3.31Å; F66-T69 WeakPolarHBondContact CB-OG1 3.36Å; V67-T69 VanDerWaalsContact C-N 3.27Å; V67-T69 PolarHBondContact O-N 3.16Å; T69-E71 WeakPolarHBondContact CB-OE2 3.03Å; T69-E71 PolarHBondContact O-N 2.82Å; T69-E71 PolarHBondContact OG1-N 3.46Å; T69-E71 PolarHBondContact OG1-OE2 2.91Å; T69-A72 PolarHBondContact O-N 3.31Å; T69-A72 VanDerWaalsContact O-N 3.12Å
70	A	87.9	Confident	86.5	Confident	69 Å²	69	71 Å²	71	57%	0.57	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-59.7	-32.6	178.2	0	0	0	0	0	112.6	A72 L73	A70-A72 PolarHBondContact O-N 2.98Å; A70-L73 HydrophobicContact CB-CD1 4.36Å; A70-L73 WeakPolarHBondContact O-CB 3.4Å; A70-L73 PolarHBondContact O-N 3.04Å
71	E	87.9	Confident	86.1	Confident	75 Å²	75	73.7 Å²	73.7	35%	0.35	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-64.7	-28.8	178.5	-65.6	71.7	-148.1	0	0	112.7	T69	T69-E71 WeakPolarHBondContact CB-OE2 3.03Å; T69-E71 PolarHBondContact O-N 2.82Å; T69-E71 PolarHBondContact OG1-N 3.46Å; T69-E71 PolarHBondContact OG1-OE2 2.91Å
72	A	88	Confident	85.8	Confident	1 Å²	1	76.7 Å²	76.7	1%	0.008	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-90.4	-8	179.9	0	0	0	0	0	113.6	S56 C58 T69 A70 R74 C75	S56-A72 WeakPolarHBondContact O-CB 3.25Å; C58-A72 HydrophobicContact CB-CB 3.86Å; T69-A72 PolarHBondContact O-N 3.31Å; T69-A72 VanDerWaalsContact O-N 3.12Å; A70-A72 PolarHBondContact O-N 2.98Å; A72-R74 PolarHBondContact O-N 2.97Å; A72-C75 WeakPolarHBondContact O-CB 3.27Å; A72-C75 PolarHBondContact O-N 2.94Å
73	L	86.4	Confident	85.6	Confident	119 Å²	119	70.6 Å²	70.6	62%	0.623	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-59.1	-33	178.8	-70.9	173.2	0	0	0	112.6	A70 C75 Q76	A70-L73 HydrophobicContact CB-CD1 4.36Å; A70-L73 WeakPolarHBondContact O-CB 3.4Å; A70-L73 PolarHBondContact O-N 3.04Å; L73-C75 PolarHBondContact O-N 3.16Å; L73-Q76 WeakPolarHBondContact O-CB 3.2Å; L73-Q76 PolarHBondContact O-N 2.81Å
74	R	88.6	Confident	85.6	Confident	146 Å²	146	70.9 Å²	70.9	55%	0.551	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-61.3	-26.1	175.1	-66.7	-140.3	68.5	164	0.8	112.9	A72 Q76 E77	A72-R74 PolarHBondContact O-N 2.97Å; R74-Q76 PolarHBondContact O-N 3.49Å; R74-E77 IonicContact NH2-OE2 3.09Å; R74-E77 PolarHBondContact NH2-OE2 2.84Å; R74-E77 VanDerWaalsContact NH2-OE2 3.15Å; R74-E77 WeakPolarHBondContact O-CB 3.3Å; R74-E77 PolarHBondContact O-N 2.82Å
75	C	89.1	Confident	85.5	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-73.8	-15.7	-179.5	-58	0	0	0	0	113.5	C52 G54 P55 A72 L73 E77 E78	C52-C75 WeakPolarHBondContact CA-SG 3.4Å; C52-C75 HydrophobicContact CB-CB 3.52Å; C52-C75 WeakPolarHBondContact CB-SG 3.36Å; C52-C75 WeakPolarHBondContact SG-CA 3.14Å; C52-C75 WeakPolarHBondContact SG-CB 3.22Å; C52-C75 CovalentContact SG-SG 2.03Å; C52-C75 PolarHBondContact SG-SG 3.07Å; G54-C75 WeakPolarHBondContact O-CB 3.38Å; P55-C75 CarbonylContact O-C 3.55Å; A72-C75 WeakPolarHBondContact O-CB 3.27Å; A72-C75 PolarHBondContact O-N 2.94Å; L73-C75 PolarHBondContact O-N 3.16Å; C75-E77 PolarHBondContact O-N 2.91Å; C75-E78 WeakPolarHBondContact O-CB 3.45Å; C75-E78 PolarHBondContact O-N 3Å
76	Q	88.2	Confident	85.2	Confident	108 Å²	108	73 Å²	73	51%	0.505	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-65.2	-26.6	170.9	-167.9	174.6	53.4	0	0	111.9	P55 L73 R74 E78 N79	P55-Q76 PolarHBondContact O-N 3.31Å; L73-Q76 WeakPolarHBondContact O-CB 3.2Å; L73-Q76 PolarHBondContact O-N 2.81Å; R74-Q76 PolarHBondContact O-N 3.49Å; Q76-E78 PolarHBondContact O-N 2.84Å; Q76-N79 VanDerWaalsContact O-CB 3.27Å; Q76-N79 WeakPolarHBondContact O-CB 3.35Å; Q76-N79 PolarHBondContact O-N 3.09Å
77	E	87.8	Confident	84.9	Confident	88 Å²	88	70.6 Å²	70.6	41%	0.411	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-60.2	-33	177.9	-162.5	173	172.4	0	0	111.3	L42 R74 C75 N79 Y80 L81	L42-E77 HydrophobicContact CD2-CB 4.06Å; L42-E77 HydrophobicContact CD2-CG 4.2Å; R74-E77 IonicContact NH2-OE2 3.09Å; R74-E77 PolarHBondContact NH2-OE2 2.84Å; R74-E77 VanDerWaalsContact NH2-OE2 3.15Å; R74-E77 WeakPolarHBondContact O-CB 3.3Å; R74-E77 PolarHBondContact O-N 2.82Å; C75-E77 PolarHBondContact O-N 2.91Å; E77-N79 PolarHBondContact O-N 3.47Å; E77-N79 VanDerWaalsContact O-N 3.1Å; E77-Y80 PolarHBondContact O-N 3.32Å; E77-L81 VanDerWaalsContact O-CD1 3.25Å; E77-L81 WeakPolarHBondContact O-CD1 3.15Å
78	E	85.6	Confident	84.5	Confident	10 Å²	10	68.1 Å²	68.1	5%	0.047	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-62.8	-14.7	174.2	-74.6	-72.3	-177.7	0	0	114.3	R39 C41 L42 C52 C75 Q76 Y80 R110	R39-E78 IonicContact CZ-OE2 3.32Å; R39-E78 VanDerWaalsContact CZ-OE2 3.32Å; R39-E78 VanDerWaalsContact NH1-CD 3.31Å; R39-E78 IonicContact NH1-OE1 3.1Å; R39-E78 PolarHBondContact NH1-OE1 3.16Å; R39-E78 VanDerWaalsContact NH1-OE1 3.1Å; R39-E78 IonicContact NH1-OE2 2.7Å; R39-E78 PolarHBondContact NH1-OE2 3.27Å; R39-E78 IonicContact NH2-OE2 2.99Å; R39-E78 PolarHBondContact NH2-OE2 3.29Å; C41-E78 VanDerWaalsContact CA-OE1 3.29Å; C41-E78 WeakPolarHBondContact CA-OE1 3.06Å; L42-E78 HydrophobicContact CB-CG 4.12Å; L42-E78 HydrophobicContact CD1-CG 4.12Å; L42-E78 WeakPolarHBondContact CD1-OE1 3.47Å; L42-E78 PolarHBondContact N-OE1 3.32Å; C52-E78 HydrophobicContact CB-CG 4.45Å; C75-E78 WeakPolarHBondContact O-CB 3.45Å; C75-E78 PolarHBondContact O-N 3Å; Q76-E78 PolarHBondContact O-N 2.84Å; E78-Y80 VanDerWaalsContact C-N 3.29Å; E78-R110 PolarHBondContact O-NH2 3.02Å
79	N	83.7	Confident	83.9	Confident	63 Å²	63	72 Å²	72	34%	0.337	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-74.3	-23.2	173.4	-170.1	36.6	0	0	0	112.6	Q76 E77 R110	Q76-N79 VanDerWaalsContact O-CB 3.27Å; Q76-N79 WeakPolarHBondContact O-CB 3.35Å; Q76-N79 PolarHBondContact O-N 3.09Å; E77-N79 PolarHBondContact O-N 3.47Å; E77-N79 VanDerWaalsContact O-N 3.1Å; N79-R110 PolarHBondContact OD1-NH1 2.05Å
80	Y	85.2	Confident	83.7	Confident	177 Å²	177	73.7 Å²	73.7	69%	0.694	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-18.5	-179.3	-59.5	-77.1	0	0	0	112.9	E77 E78	E77-Y80 PolarHBondContact O-N 3.32Å; E78-Y80 VanDerWaalsContact C-N 3.29Å
81	L	81.2	Confident	83.6	Confident	60 Å²	60	74 Å²	74	31%	0.314	39%	0.387	S	S	.	.			trans	-80.8	127.1	176.5	-75.8	88.4	0	0	0	110.9	R39 E77 S83	R39-L81 VanDerWaalsContact NH2-CB 3.28Å; E77-L81 VanDerWaalsContact O-CD1 3.25Å; E77-L81 WeakPolarHBondContact O-CD1 3.15Å; L81-S83 VanDerWaalsContact C-N 3.32Å; L81-S83 PolarHBondContact O-N 3Å
82	P	76.2	Confident	83.5	Confident	131 Å²	131	70.7 Å²	70.7	85%	0.851	37%	0.372	S	S	*	.			trans	-78.3	-13.7	-178.5	30	-34.7	0	0	0	113.8
83	S	76.7	Confident	83.2	Confident	54 Å²	54	73.7 Å²	73.7	38%	0.378	40%	0.402	S	S	.	.	S	Bend	trans	-81.6	147.5	-174.9	37.5	0	0	0	0	112.9	R39 L81 C85	R39-S83 VanDerWaalsContact CZ-OG 3.26Å; R39-S83 VanDerWaalsContact NE-CB 3.34Å; R39-S83 PolarHBondContact NE-O 3.1Å; R39-S83 PolarHBondContact NE-OG 2.7Å; R39-S83 PolarHBondContact NH2-O 2.99Å; R39-S83 PolarHBondContact NH2-OG 2.71Å; L81-S83 VanDerWaalsContact C-N 3.32Å; L81-S83 PolarHBondContact O-N 3Å; S83-C85 PolarHBondContact O-N 3.1Å
84	P	79.1	Confident	82.7	Confident	88 Å²	88	73.7 Å²	73.7	57%	0.571	41%	0.412	S	S	*	.			trans	-39.6	130.2	164.6	46.2	-31.5	0	0	0	115.5	L38 R39	L38-P84 HydrophobicContact CD1-CB 4.24Å; L38-P84 HydrophobicContact CD1-CG 4.29Å; L38-P84 HydrophobicContact CD2-CB 4.13Å; L38-P84 HydrophobicContact CG-CB 4.42Å; R39-P84 WeakPolarHBondContact CD-O 3.09Å; R39-P84 WeakPolarHBondContact CG-O 3.22Å; R39-P84 PolarHBondContact NE-O 3.2Å
85	C	85.3	Confident	82.2	Confident	32 Å²	32	69.2 Å²	69.2	22%	0.216	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-132.5	147.3	157.2	83.6	0	0	0	0	111.5	R39 C41 S83	R39-C85 HydrophobicContact CG-CB 3.97Å; R39-C85 CarbonylContact O-C 3.6Å; R39-C85 WeakPolarHBondContact O-CA 3.24Å; R39-C85 WeakPolarHBondContact O-CB 3.49Å; C41-C85 VanDerWaalsContact CA-SG 3.59Å; C41-C85 HydrophobicContact CB-CB 3.94Å; C41-C85 WeakPolarHBondContact CB-SG 3.03Å; C41-C85 WeakPolarHBondContact SG-CB 3.16Å; C41-C85 CovalentContact SG-SG 2.05Å; C41-C85 PolarHBondContact SG-SG 3.36Å; S83-C85 PolarHBondContact O-N 3.1Å
86	Q	83.5	Confident	81.9	Confident	75 Å²	75	69.4 Å²	69.4	35%	0.35	41%	0.413	S	S	.	.			trans	-140.7	124.7	178.6	173.7	164.1	-10.9	0	0	110.5	L38 R39	L38-Q86 HydrophobicContact CB-CB 4.29Å; L38-Q86 HydrophobicContact CD2-CB 3.64Å; R39-Q86 PolarHBondContact O-N 2.95Å
87	S	82.8	Confident	81.9	Confident	7 Å²	7	67.6 Å²	67.6	5%	0.049	40%	0.402	C	S	.	.			trans	-114	144.6	172.1	-68.4	0	0	0	0	109.8	C41 C52 F53 R97	C41-S87 VanDerWaalsContact CB-OG 3.31Å; C41-S87 WeakPolarHBondContact CB-OG 2.82Å; C41-S87 PolarHBondContact N-OG 3.11Å; C52-S87 PolarHBondContact O-OG 3.19Å; F53-S87 VanDerWaalsContact CE1-C 3.45Å; F53-S87 WeakPolarHBondContact CE1-O 3.39Å; S87-R97 VanDerWaalsContact O-CD 3.28Å; S87-R97 WeakPolarHBondContact O-CD 3.08Å
88	G	79.6	Confident	81.9	Confident	20 Å²	20	63.8 Å²	63.8	21%	0.206	39%	0.385	C	S	.	.			trans	86	127.8	-174.8	0	0	0	0	0	113.2
89	Q	72.4	Confident	82	Confident	143 Å²	143	63.4 Å²	63.4	67%	0.668	38%	0.383	S	S	*	.	S	Bend	trans	-85.8	-30.9	-176.7	-67.3	-67.7	-27.7	0	0	112.6
90	K	82.9	Confident	82.1	Confident	81 Å²	81	60.5 Å²	60.5	35%	0.352	37%	0.368	S	S	.	.	S	Bend	trans	-102.5	120.4	-176.2	-170.7	175	179.5	-176	0	110.3	R97 C98 E173	K90-R97 WeakPolarHBondContact O-CA 3.06Å; K90-C98 HydrophobicContact CB-CB 4.28Å; K90-C98 PolarHBondContact O-N 3.21Å; K90-E173 PolarHBondContact NZ-O 3.42Å
91	A	85.1	Confident	82.1	Confident	77 Å²	77	56.2 Å²	56.2	64%	0.636	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	146.6	169.1	0	0	0	0	0	110.5	G96	A91-G96 WeakPolarHBondContact CA-O 3.29Å
92	C	87	Confident	82.4	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.034	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	150.7	178.2	54.5	0	0	0	0	110.6	G96 R97 C98 C104	C92-G96 PolarHBondContact N-O 2.98Å; C92-G96 CarbonylContact O-C 3.45Å; C92-G96 WeakPolarHBondContact O-CA 3.27Å; C92-G96 PolarHBondContact O-N 3.44Å; C92-G96 VanDerWaalsContact O-O 3.09Å; C92-G96 VanDerWaalsContact SG-C 3.56Å; C92-R97 VanDerWaalsContact SG-CA 3.53Å; C92-R97 PolarHBondContact SG-N 3.13Å; C92-R97 VanDerWaalsContact SG-N 3.45Å; C92-C98 PolarHBondContact SG-N 2.93Å; C92-C98 VanDerWaalsContact SG-N 3.39Å; C92-C104 HydrophobicContact CB-CB 3.87Å; C92-C104 WeakPolarHBondContact CB-SG 2.93Å; C92-C104 WeakPolarHBondContact SG-CA 3.34Å; C92-C104 WeakPolarHBondContact SG-CB 3.25Å; C92-C104 CovalentContact SG-SG 2.02Å; C92-C104 PolarHBondContact SG-SG 2.8Å
93	G	80.8	Confident	82.9	Confident	63 Å²	63	48.8 Å²	48.8	65%	0.649	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	-144.1	177.2	0	0	0	0	0	114.5	G95	G93-G95 VanDerWaalsContact C-N 3.31Å; G93-G95 PolarHBondContact O-N 2.75Å; G93-G95 VanDerWaalsContact O-N 3.13Å
94	S	75.9	Confident	83.5	Confident	119 Å²	119	46.6 Å²	46.6	83%	0.832	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	55.6	-177.3	64.7	0	0	0	0	113
95	G	77.3	Confident	84	Confident	53 Å²	53	42.5 Å²	42.5	55%	0.546	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.8	14.7	178.6	0	0	0	0	0	115.3	G93	G93-G95 VanDerWaalsContact C-N 3.31Å; G93-G95 PolarHBondContact O-N 2.75Å; G93-G95 VanDerWaalsContact O-N 3.13Å
96	G	84.4	Confident	83.9	Confident	3 Å²	3	42.7 Å²	42.7	3%	0.031	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	174	168.8	0	0	0	0	0	112.3	A91 C92 C105	A91-G96 WeakPolarHBondContact CA-O 3.29Å; C92-G96 PolarHBondContact N-O 2.98Å; C92-G96 CarbonylContact O-C 3.45Å; C92-G96 WeakPolarHBondContact O-CA 3.27Å; C92-G96 PolarHBondContact O-N 3.44Å; C92-G96 VanDerWaalsContact O-O 3.09Å; C92-G96 VanDerWaalsContact SG-C 3.56Å; G96-C105 CarbonylContact C-O 3.26Å; G96-C105 VanDerWaalsContact CA-O 3.22Å; G96-C105 WeakPolarHBondContact CA-O 3.36Å
97	R	87	Confident	83.5	Confident	70 Å²	70	41.3 Å²	41.3	26%	0.264	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145.7	175.4	-73	-174.8	-93.6	-105.5	-4	110.7	F53 S87 K90 C92 A99 C105	F53-R97 HydrophobicContact CD1-CB 4.47Å; F53-R97 HydrophobicContact CE1-CB 4.2Å; S87-R97 VanDerWaalsContact O-CD 3.28Å; S87-R97 WeakPolarHBondContact O-CD 3.08Å; K90-R97 WeakPolarHBondContact O-CA 3.06Å; C92-R97 VanDerWaalsContact SG-CA 3.53Å; C92-R97 PolarHBondContact SG-N 3.13Å; C92-R97 VanDerWaalsContact SG-N 3.45Å; R97-A99 PolarHBondContact O-N 3.46Å; R97-A99 VanDerWaalsContact O-N 3.16Å; R97-C105 PolarHBondContact N-O 3.2Å; R97-C105 PolarHBondContact O-N 3.31Å
98	C	88.7	Confident	82.5	Confident	8 Å²	8	41.8 Å²	41.8	5%	0.054	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	114.9	177.4	-65.6	0	0	0	0	109	K90 C92 V103 C174	K90-C98 HydrophobicContact CB-CB 4.28Å; K90-C98 PolarHBondContact O-N 3.21Å; C92-C98 PolarHBondContact SG-N 2.93Å; C92-C98 VanDerWaalsContact SG-N 3.39Å; C98-V103 WeakPolarHBondContact CA-O 3.3Å; C98-C174 WeakPolarHBondContact CA-SG 3.44Å; C98-C174 HydrophobicContact CB-CB 3.6Å; C98-C174 WeakPolarHBondContact CB-SG 3.45Å; C98-C174 WeakPolarHBondContact SG-CA 3.35Å; C98-C174 WeakPolarHBondContact SG-CB 3.47Å; C98-C174 CovalentContact SG-SG 2.04Å; C98-C174 PolarHBondContact SG-SG 3.24Å
99	A	87.9	Confident	81.1	Confident	2 Å²	2	42.9 Å²	42.9	2%	0.017	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-31.7	-168.7	0	0	0	0	0	112.9	F53 C59 R97 V103 C105	F53-A99 HydrophobicContact CD1-CB 3.73Å; F53-A99 HydrophobicContact CD2-CB 3.84Å; F53-A99 HydrophobicContact CE1-CB 3.62Å; F53-A99 HydrophobicContact CE2-CB 3.75Å; F53-A99 HydrophobicContact CG-CB 3.85Å; F53-A99 VanDerWaalsContact CZ-CA 3.46Å; F53-A99 HydrophobicContact CZ-CB 3.64Å; C59-A99 HydrophobicContact CB-CB 3.65Å; C59-A99 WeakPolarHBondContact CB-O 3.06Å; C59-A99 WeakPolarHBondContact SG-CB 3.31Å; R97-A99 PolarHBondContact O-N 3.46Å; R97-A99 VanDerWaalsContact O-N 3.16Å; A99-V103 PolarHBondContact N-O 3.4Å; A99-C105 HydrophobicContact CB-CB 3.89Å
100	A	85.4	Confident	79.8	Confident	2 Å²	2	43 Å²	43	2%	0.017	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	179.8	171.8	0	0	0	0	0	109.8	G102 V103	A100-G102 PolarHBondContact O-N 2.69Å; A100-V103 HydrophobicContact CB-CB 4.24Å; A100-V103 HydrophobicContact CB-CG2 4.36Å; A100-V103 PolarHBondContact O-N 3.03Å
101	F	84.6	Confident	77.7	Confident	87 Å²	87	50.7 Å²	50.7	38%	0.382	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	109.2	-175.7	-174.9	-95.1	0	0	0	111.4	V103 R175 F178 H179	F101-V103 VanDerWaalsContact C-N 3.3Å; F101-V103 PolarHBondContact O-N 2.84Å; F101-R175 HydrophobicContact CD1-CG 4.47Å; F101-R175 HydrophobicContact CD2-CG 4.37Å; F101-R175 HydrophobicContact CE1-CG 3.77Å; F101-R175 HydrophobicContact CE2-CG 3.64Å; F101-R175 HydrophobicContact CZ-CB 4.48Å; F101-R175 HydrophobicContact CZ-CG 3.34Å; F101-F178 HydrophobicContact CB-CD1 4.4Å; F101-F178 HydrophobicContact CB-CD2 4.34Å; F101-F178 HydrophobicContact CB-CE1 4.24Å; F101-F178 HydrophobicContact CB-CE2 4.22Å; F101-F178 HydrophobicContact CB-CG 4.38Å; F101-F178 HydrophobicContact CB-CZ 4.11Å; F101-F178 HydrophobicContact CD2-CB 3.61Å; F101-F178 AromaticContact CD2-CD1 3.96Å; F101-F178 HydrophobicContact CD2-CD1 3.96Å; F101-F178 HydrophobicContact CD2-CD2 4.32Å; F101-F178 AromaticContact CD2-CG 3.74Å; F101-F178 HydrophobicContact CD2-CG 3.74Å; F101-F178 HydrophobicContact CE2-CB 4.09Å; F101-F178 VanDerWaalsContact N-CZ 3.34Å; F101-H179 AromaticContact CE2-NE2 3.85Å; F101-H179 AromaticContact CZ-NE2 3.96Å
102	G	86.9	Confident	75.4	Confident	7 Å²	7	50.1 Å²	50.1	7%	0.072	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	22.4	-177.6	0	0	0	0	0	114.4	A100 T170 E171	A100-G102 PolarHBondContact O-N 2.69Å; G102-T170 CarbonylContact O-C 3.5Å; G102-T170 VanDerWaalsContact O-CA 3.31Å; G102-T170 WeakPolarHBondContact O-CA 3.46Å; G102-T170 WeakPolarHBondContact O-CG2 3.46Å; G102-E171 CarbonylContact C-O 3.55Å; G102-E171 VanDerWaalsContact C-O 3.26Å; G102-E171 VanDerWaalsContact CA-O 3.22Å; G102-E171 WeakPolarHBondContact CA-O 3.29Å; G102-E171 PolarHBondContact O-N 3.38Å
103	V	88.1	Confident	73	Confident	29 Å²	29	58.4 Å²	58.4	18%	0.176	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.2	178.3	-176.2	0	0	0	0	110.3	C65 C98 A99 A100 F101 C168	C65-V103 HydrophobicContact CB-CG1 4.48Å; C98-V103 WeakPolarHBondContact CA-O 3.3Å; A99-V103 PolarHBondContact N-O 3.4Å; A100-V103 HydrophobicContact CB-CB 4.24Å; A100-V103 HydrophobicContact CB-CG2 4.36Å; A100-V103 PolarHBondContact O-N 3.03Å; F101-V103 VanDerWaalsContact C-N 3.3Å; F101-V103 PolarHBondContact O-N 2.84Å; V103-C168 HydrophobicContact CG1-CB 4.08Å
104	C	89.2	Confident	70.8	Confident	7 Å²	7	59.9 Å²	59.9	5%	0.047	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	120.2	173.4	-175	0	0	0	0	109.5	C92 C168 V169 E171	C92-C104 HydrophobicContact CB-CB 3.87Å; C92-C104 WeakPolarHBondContact CB-SG 2.93Å; C92-C104 WeakPolarHBondContact SG-CA 3.34Å; C92-C104 WeakPolarHBondContact SG-CB 3.25Å; C92-C104 CovalentContact SG-SG 2.02Å; C92-C104 PolarHBondContact SG-SG 2.8Å; C104-C168 CarbonylContact O-C 3.4Å; C104-C168 VanDerWaalsContact O-CA 3.31Å; C104-C168 WeakPolarHBondContact O-CA 3.33Å; C104-V169 HydrophobicContact CB-CG2 4.22Å; C104-V169 PolarHBondContact N-O 3.08Å; C104-V169 PolarHBondContact O-N 3.11Å; C104-E171 HydrophobicContact CB-CB 3.59Å; C104-E171 HydrophobicContact CB-CG 4.21Å
105	C	88.5	Confident	68.9	Low	3 Å²	3	64.3 Å²	64.3	2%	0.02	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.1	176.4	-66.3	0	0	0	0	111	F53 C59 G96 R97 A99 S167 C168	F53-C105 HydrophobicContact CB-CB 4.42Å; C59-C105 VanDerWaalsContact SG-SG 3.69Å; G96-C105 CarbonylContact C-O 3.26Å; G96-C105 VanDerWaalsContact CA-O 3.22Å; G96-C105 WeakPolarHBondContact CA-O 3.36Å; R97-C105 PolarHBondContact N-O 3.2Å; R97-C105 PolarHBondContact O-N 3.31Å; A99-C105 HydrophobicContact CB-CB 3.89Å; C105-S167 WeakPolarHBondContact CA-O 3.41Å; C105-C168 HydrophobicContact CB-CB 4.2Å; C105-C168 WeakPolarHBondContact CB-SG 3.27Å; C105-C168 WeakPolarHBondContact SG-CB 3.15Å; C105-C168 CovalentContact SG-SG 2.04Å; C105-C168 PolarHBondContact SG-SG 2.82Å
106	N	84.6	Confident	67	Low	35 Å²	35	65.5 Å²	65.5	19%	0.187	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.8	172.9	-170.4	5.9	0	0	0	108.9	G108 S167	N106-G108 PolarHBondContact O-N 3.41Å; N106-S167 PolarHBondContact N-O 3.39Å; N106-S167 PolarHBondContact O-N 3.33Å
107	D	73.9	Confident	64.8	Low	47 Å²	47	75.9 Å²	75.9	25%	0.251	38%	0.383	S	S	.	.			trans	-73.7	16.5	177.3	64	-61.5	0	0	0	113	F53 A109	F53-D107 WeakPolarHBondContact O-CB 3.47Å; D107-A109 PolarHBondContact O-N 3.01Å; D107-A109 WeakPolarHBondContact OD2-CA 3.48Å
108	G	61.5	Low	62.4	Low	17 Å²	17	76 Å²	76	18%	0.175	41%	0.406	C	S	.	.			trans	61.9	8.6	-168.1	0	0	0	0	0	113.3	N106 P164	N106-G108 PolarHBondContact O-N 3.41Å; G108-P164 WeakPolarHBondContact O-CB 3.48Å; G108-P164 VanDerWaalsContact O-CG 3.27Å; G108-P164 WeakPolarHBondContact O-CG 3.2Å
109	A	50.1	Low	60.5	Low	43 Å²	43	79.3 Å²	79.3	36%	0.355	44%	0.442	S	S	.	.			trans	42.7	117.1	-169.7	0	0	0	0	0	114.5	D107 R111	D107-A109 PolarHBondContact O-N 3.01Å; D107-A109 WeakPolarHBondContact OD2-CA 3.48Å; A109-R111 PolarHBondContact O-N 2.96Å
110	R	46.8	Very low	58.2	Low	146 Å²	146	90.7 Å²	90.7	55%	0.551	48%	0.484	S	S	*	.			trans	-58.1	79.1	154.5	-61.6	-171	-152.1	-175.8	10.8	110.8	E78 N79 G112	E78-R110 PolarHBondContact O-NH2 3.02Å; N79-R110 PolarHBondContact OD1-NH1 2.05Å; R110-G112 PolarHBondContact O-N 2.78Å
111	R	38.1	Very low	56.2	Low	242 Å²	242	101.5 Å²	101.5	91%	0.913	53%	0.525	S	S	*	.			trans	-81.5	101.4	154.1	-79.3	-172.1	-179.3	-127	1.7	107.3	A109	A109-R111 PolarHBondContact O-N 2.96Å
112	G	36.1	Very low	54.2	Low	65 Å²	65	103.3 Å²	103.3	67%	0.67	55%	0.545	S	S	*	.			trans	111.6	68.4	159	0	0	0	0	0	116.5	R110	R110-G112 PolarHBondContact O-N 2.78Å
113	R	38.3	Very low	52.2	Low	179 Å²	179	110.8 Å²	110.8	68%	0.675	58%	0.582	S	S	*	*				-123.7	64	128.6	-72	-158.4	-64.6	-98.4	1.9	108.8	W115	R113-W115 PolarHBondContact O-N 3.46Å
114	A	33.4	Very low	49.8	Very low	94 Å²	94	113 Å²	113	78%	0.777	61%	0.611	S	S	*	*			trans	-60	115.3	145.9	0	0	0	0	0	105	G116	A114-G116 PolarHBondContact O-N 3.49Å
115	W	37.2	Very low	47.5	Very low	211 Å²	211	125.1 Å²	125.1	80%	0.799	66%	0.656	S	S	*	*			trans	-61.2	94	167.6	-75.1	67.6	0	0	0	106.8	R113 W117	R113-W115 PolarHBondContact O-N 3.46Å; W115-W117 AromaticContact CE3-CD1 3.86Å; W115-W117 AromaticContact CE3-NE1 3.73Å; W115-W117 PolarHBondContact O-N 3.45Å
116	G	37.3	Very low	45.5	Very low	78 Å²	78	129 Å²	129	80%	0.804	70%	0.697	S	S	*	*			trans	-72.8	64.8	169.2	0	0	0	0	0	109.7	A114	A114-G116 PolarHBondContact O-N 3.49Å
117	W	37.6	Very low	43.2	Very low	222 Å²	222	130.7 Å²	130.7	84%	0.841	72%	0.723	S	S	*	*			trans	-92.4	107.2	159.4	-81.7	60.3	0	0	0	106.9	W115	W115-W117 AromaticContact CE3-CD1 3.86Å; W115-W117 AromaticContact CE3-NE1 3.73Å; W115-W117 PolarHBondContact O-N 3.45Å
118	G	36.4	Very low	41.8	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	76%	0.758	S	S	*	*			trans	152.3	69.3	174.5	0	0	0	0	0	112.6	R120	G118-R120 PolarHBondContact O-N 2.92Å
119	G	48	Very low	40.5	Very low	79 Å²	79	143.4 Å²	143.4	81%	0.814	78%	0.783	S	S	*	*			trans	-55.6	132.6	171.6	0	0	0	0	0	112.1
120	R	39.9	Very low	40.2	Very low	240 Å²	240	147.8 Å²	147.8	91%	0.906	81%	0.808	S	S	*	*			trans	-123.4	110.7	146.8	-74.1	-173.7	-167.9	-104.2	-0.3	107.3	G118	G118-R120 PolarHBondContact O-N 2.92Å
121	R	44.5	Very low	40.2	Very low	230 Å²	230	145.8 Å²	145.8	87%	0.868	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-47	132.1	165.4	-72.3	169.8	150.4	-132.7	-3.1	108.4	L123	R121-L123 PolarHBondContact O-N 3.46Å; R121-L123 VanDerWaalsContact O-N 3.09Å
122	P	41.8	Very low	40.3	Very low	124 Å²	124	138.2 Å²	138.2	81%	0.805	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-62.2	118	162.3	-11.4	26.4	0	0	0	106.5	G124	P122-G124 PolarHBondContact O-N 3.26Å
123	L	44	Very low	40.8	Very low	164 Å²	164	139.2 Å²	139.2	86%	0.859	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-50.5	136.1	164.5	-83.5	110.2	0	0	0	108.3	R121 W125	R121-L123 PolarHBondContact O-N 3.46Å; R121-L123 VanDerWaalsContact O-N 3.09Å; L123-W125 PolarHBondContact O-N 3.12Å
124	G	39	Very low	41	Very low	76 Å²	76	140.9 Å²	140.9	78%	0.784	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-50.2	121	-174.7	0	0	0	0	0	112.7	P122 G126	P122-G124 PolarHBondContact O-N 3.26Å; G124-G126 VanDerWaalsContact C-N 3.33Å; G124-G126 PolarHBondContact O-N 3.35Å
125	W	40.4	Very low	41.6	Very low	261 Å²	261	140.4 Å²	140.4	99%	0.989	83%	0.834	S	S	*	*			trans	-75.2	94.4	151.1	-88.7	-0	0	0	0	108	L123 G127	L123-W125 PolarHBondContact O-N 3.12Å; W125-G127 PolarHBondContact O-N 2.79Å
126	G	46.8	Very low	41.8	Very low	86 Å²	86	137.2 Å²	137.2	89%	0.887	83%	0.831	S	S	*	*			trans	-67.4	109.6	157.1	0	0	0	0	0	108.6	G124	G124-G126 VanDerWaalsContact C-N 3.33Å; G124-G126 PolarHBondContact O-N 3.35Å
127	G	36.1	Very low	41.9	Very low	70 Å²	70	145.1 Å²	145.1	72%	0.722	84%	0.837	S	S	*	*			trans	-147.9	98.5	173.8	0	0	0	0	0	109.6	W125	W125-G127 PolarHBondContact O-N 2.79Å
128	R	43.8	Very low	42	Very low	261 Å²	261	146.1 Å²	146.1	99%	0.985	84%	0.841	S	S	*	*			trans	-63.5	134.5	166.3	-78.5	178.1	-102.3	-100.4	-0.1	109.3
129	G	34.7	Very low	42.1	Very low	69 Å²	69	146.5 Å²	146.5	71%	0.711	84%	0.836	S	S	*	*			trans	177.4	133.4	167.9	0	0	0	0	0	111.8
130	P	43.6	Very low	41.9	Very low	135 Å²	135	154.6 Å²	154.6	88%	0.877	84%	0.843	S	S	*	*			trans	-88.3	170.7	-162	36.3	-35.3	0	0	0	114.1
131	A	47.6	Very low	42.2	Very low	104 Å²	104	151.9 Å²	151.9	86%	0.86	84%	0.84	S	S	*	*			trans	-44.7	131.5	175.9	0	0	0	0	0	114.8
132	A	39.5	Very low	42.2	Very low	83 Å²	83	144.3 Å²	144.3	69%	0.686	83%	0.834	S	S	*	*			trans	-155.6	116.5	150.3	0	0	0	0	0	108.5
133	G	47	Very low	42	Very low	87 Å²	87	141.8 Å²	141.8	90%	0.897	83%	0.83	S	S	*	*			trans	-66.9	138.8	179.8	0	0	0	0	0	112.3
134	W	41.3	Very low	42	Very low	213 Å²	213	140.6 Å²	140.6	81%	0.807	83%	0.834	S	S	*	*			trans	-138.8	104.8	158.3	37.2	-77.7	0	0	0	106.4	L136	W134-L136 PolarHBondContact O-N 3.09Å; W134-L136 VanDerWaalsContact O-N 3.11Å
135	G	46.5	Very low	42.2	Very low	85 Å²	85	139.7 Å²	139.7	88%	0.876	83%	0.825	S	S	*	*			trans	-64.3	107.1	169.5	0	0	0	0	0	109.1
136	L	42.3	Very low	42.3	Very low	143 Å²	143	133.3 Å²	133.3	75%	0.749	82%	0.817	S	S	*	*			trans	-120	123.2	156.9	-117	78.9	0	0	0	107.8	W134 R138	W134-L136 PolarHBondContact O-N 3.09Å; W134-L136 VanDerWaalsContact O-N 3.11Å; L136-R138 PolarHBondContact O-N 2.78Å
137	R	38.8	Very low	42.1	Very low	244 Å²	244	135.1 Å²	135.1	92%	0.921	81%	0.813	S	S	*	*			trans	-30.4	116.6	177.1	-68.7	178	-94	-97.6	3.4	111.6	A139	R137-A139 VanDerWaalsContact C-N 3.31Å; R137-A139 PolarHBondContact O-N 3.38Å
138	R	39.4	Very low	42.6	Very low	244 Å²	244	136 Å²	136	92%	0.921	81%	0.813	S	S	*	*			trans	-59.1	99.5	163.9	-72.2	-173.5	-164	-159.1	4.2	107.1	L136 R140	L136-R138 PolarHBondContact O-N 2.78Å; R138-R140 PolarHBondContact O-N 2.63Å
139	A	39.3	Very low	42.8	Very low	78 Å²	78	129.8 Å²	129.8	65%	0.645	81%	0.807	S	S	*	*			trans	-51.3	114.5	150.4	0	0	0	0	0	105.3	R137 Q141	R137-A139 VanDerWaalsContact C-N 3.31Å; R137-A139 PolarHBondContact O-N 3.38Å; A139-Q141 PolarHBondContact O-N 3.47Å
140	R	44.5	Very low	43.4	Very low	250 Å²	250	138 Å²	138	94%	0.943	82%	0.816	S	S	*	*			trans	-59.5	85.4	167.5	-95.4	-177.2	165.5	-166.6	-2.4	106.5	R138 G142	R138-R140 PolarHBondContact O-N 2.63Å; R140-G142 PolarHBondContact O-N 3.36Å
141	Q	45.5	Very low	43.3	Very low	182 Å²	182	136 Å²	136	85%	0.85	81%	0.812	S	S	*	*			trans	-66.1	98.2	157.1	-71.1	-177.9	47.1	0	0	104.4	A139 G143	A139-Q141 PolarHBondContact O-N 3.47Å; Q141-G143 PolarHBondContact O-N 2.99Å
142	G	43.5	Very low	43	Very low	72 Å²	72	135.5 Å²	135.5	74%	0.742	81%	0.807	S	S	*	*			trans	-62.1	89.4	171.2	0	0	0	0	0	108.3	R140	R140-G142 PolarHBondContact O-N 3.36Å
143	G	39.2	Very low	43	Very low	70 Å²	70	137.6 Å²	137.6	72%	0.722	81%	0.814	S	S	*	*			trans	-69.8	127.3	167	0	0	0	0	0	108.8	Q141 G145	Q141-G143 PolarHBondContact O-N 2.99Å; G143-G145 VanDerWaalsContact C-N 3.26Å; G143-G145 PolarHBondContact O-N 3.07Å
144	C	43.2	Very low	42.7	Very low	140 Å²	140	137.2 Å²	137.2	95%	0.946	80%	0.802	S	S	*	*			trans	-69.3	84.5	169.7	-63.3	0	0	0	0	109.2
145	G	43.4	Very low	42.8	Very low	57 Å²	57	133.8 Å²	133.8	59%	0.588	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-80.5	152.6	162	0	0	0	0	0	110.4	G143	G143-G145 VanDerWaalsContact C-N 3.26Å; G143-G145 PolarHBondContact O-N 3.07Å
146	P	41.8	Very low	42.4	Very low	126 Å²	126	132.5 Å²	132.5	82%	0.818	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-60.5	145.3	173.4	26.3	-33	0	0	0	110.5
147	P	44.2	Very low	42.3	Very low	124 Å²	124	136.8 Å²	136.8	81%	0.805	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.3	138.3	-174	27.2	-33.2	0	0	0	111.6
148	A	46.4	Very low	42.1	Very low	88 Å²	88	130.7 Å²	130.7	73%	0.727	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-66.8	142.5	168.1	0	0	0	0	0	110.1	R150	A148-R150 VanDerWaalsContact C-N 3.3Å; A148-R150 PolarHBondContact O-N 3.44Å
149	P	47	Very low	41.7	Very low	131 Å²	131	124.4 Å²	124.4	85%	0.851	79%	0.785	S	S	*	*	S	Bend	trans	-81.9	21.6	-161.7	31.3	-36.4	0	0	0	116.3
150	R	47.8	Very low	41.6	Very low	241 Å²	241	125.9 Å²	125.9	91%	0.909	79%	0.79	S	S	*	*			trans	-148.7	48.8	-171.3	-70.8	-167	167.6	-161.8	-4	116.9	A148	A148-R150 VanDerWaalsContact C-N 3.3Å; A148-R150 PolarHBondContact O-N 3.44Å
151	A	41	Very low	41.2	Very low	95 Å²	95	121.3 Å²	121.3	79%	0.785	78%	0.779	S	S	*	*			trans	-134.3	126.6	163.9	0	0	0	0	0	110.7
152	A	41.9	Very low	41	Very low	93 Å²	93	119.1 Å²	119.1	77%	0.769	78%	0.778	S	S	*	*			trans	-56.6	141.4	172.2	0	0	0	0	0	110.2	A154	A152-A154 PolarHBondContact O-N 3.37Å; A152-A154 VanDerWaalsContact O-N 3.13Å
153	P	38.8	Very low	40.7	Very low	127 Å²	127	121.8 Å²	121.8	83%	0.825	78%	0.775	S	S	*	*			trans	-70.8	112.9	-178.9	27.9	-31.1	0	0	0	109.4
154	A	40.8	Very low	41	Very low	79 Å²	79	121.7 Å²	121.7	65%	0.653	76%	0.762	S	S	*	*			trans	-57.3	156.3	155.8	0	0	0	0	0	108.9	A152 G156	A152-A154 PolarHBondContact O-N 3.37Å; A152-A154 VanDerWaalsContact O-N 3.13Å; A154-G156 PolarHBondContact O-N 2.95Å
155	P	42.5	Very low	41.5	Very low	140 Å²	140	118.8 Å²	118.8	91%	0.909	75%	0.747	S	S	*	*			trans	-71.4	67.5	165.5	32.1	-32.5	0	0	0	108.2	R157	P155-R157 PolarHBondContact O-N 3.48Å
156	G	38.3	Very low	42.7	Very low	59 Å²	59	118.1 Å²	118.1	61%	0.608	73%	0.729	S	S	*	*			trans	-65.7	126.5	168.8	0	0	0	0	0	107.1	A154	A154-G156 PolarHBondContact O-N 2.95Å
157	R	41.4	Very low	44.3	Very low	232 Å²	232	114.9 Å²	114.9	88%	0.875	71%	0.709	S	S	*	*			trans	-33.9	129.3	166.7	-65	164.3	68.4	-166.8	3.2	108.6	P155 C159	P155-R157 PolarHBondContact O-N 3.48Å; R157-C159 PolarHBondContact O-N 3.42Å; R157-C159 VanDerWaalsContact O-N 3.16Å
158	P	34.1	Very low	46.2	Very low	116 Å²	116	110.8 Å²	110.8	75%	0.753	68%	0.683	S	S	*	*			trans	-52.7	131.5	-177.9	22	-31.1	0	0	0	107.4	S160	P158-S160 VanDerWaalsContact C-N 3.28Å; P158-S160 PolarHBondContact O-N 3.37Å
159	C	30.7	Very low	48.1	Very low	113 Å²	113	109.9 Å²	109.9	76%	0.764	67%	0.669	S	S	*	*			trans	-51.8	102.6	170.6	-69.6	0	0	0	0	106.6	R157 H161	R157-C159 PolarHBondContact O-N 3.42Å; R157-C159 VanDerWaalsContact O-N 3.16Å; C159-H161 PolarHBondContact O-N 3.23Å
160	S	37.6	Very low	49.8	Very low	108 Å²	108	109.6 Å²	109.6	76%	0.755	67%	0.665	S	S	*	*			trans	-61.2	89.1	158.5	-75.4	0	0	0	0	104.5	P158 V162	P158-S160 VanDerWaalsContact C-N 3.28Å; P158-S160 PolarHBondContact O-N 3.37Å; S160-V162 PolarHBondContact O-N 3.27Å
161	H	36.2	Very low	51.5	Low	154 Å²	154	100.9 Å²	100.9	71%	0.713	63%	0.634	S	S	*	*			trans	-48.1	108.2	148.1	-83.8	-95.4	0	0	0	104.3	C159 L163	C159-H161 PolarHBondContact O-N 3.23Å; H161-L163 HydrophobicContact CB-CG 4.16Å; H161-L163 PolarHBondContact O-N 2.81Å
162	V	40.3	Very low	53.3	Low	136 Å²	136	100.9 Å²	100.9	82%	0.824	63%	0.626	S	S	*	*			trans	-66.7	73.5	161	-178.7	0	0	0	0	104.6	S160	S160-V162 PolarHBondContact O-N 3.27Å
163	L	38.5	Very low	55.2	Low	129 Å²	129	101.6 Å²	101.6	68%	0.675	61%	0.614	S	S	*	*			trans	-60.7	128.8	156	-71.6	161.6	0	0	0	103.6	H161 A165	H161-L163 HydrophobicContact CB-CG 4.16Å; H161-L163 PolarHBondContact O-N 2.81Å; L163-A165 PolarHBondContact O-N 3.42Å
164	P	45.5	Very low	57.2	Low	68 Å²	68	95.6 Å²	95.6	44%	0.442	57%	0.574	S	S	.	*			trans	-52.3	120.5	170.5	24.6	-32	0	0	0	106.1	G108 E166	G108-P164 WeakPolarHBondContact O-CB 3.48Å; G108-P164 VanDerWaalsContact O-CG 3.27Å; G108-P164 WeakPolarHBondContact O-CG 3.2Å; P164-E166 PolarHBondContact O-N 3.21Å
165	A	53.4	Low	59.1	Low	78 Å²	78	98.4 Å²	98.4	65%	0.645	57%	0.568	S	S	*	*			trans	-58.1	111.5	-163.2	0	0	0	0	0	109.2	L163 S167	L163-A165 PolarHBondContact O-N 3.42Å; A165-S167 WeakPolarHBondContact O-CB 3.24Å; A165-S167 PolarHBondContact O-N 2.92Å
166	E	68.1	Low	60.2	Low	44 Å²	44	97 Å²	97	21%	0.206	55%	0.55	C	S	.	.			trans	-51.9	109.4	161.6	-71.9	-138.4	102.1	0	0	106.4	G54 P55 S56 I57 P164	G54-E166 VanDerWaalsContact CA-OE1 3.22Å; G54-E166 WeakPolarHBondContact CA-OE1 3.28Å; P55-E166 WeakPolarHBondContact CD-OE1 3.3Å; S56-E166 WeakPolarHBondContact CA-OE2 2.98Å; S56-E166 WeakPolarHBondContact CB-OE2 3.42Å; S56-E166 PolarHBondContact N-OE2 3.05Å; S56-E166 PolarHBondContact OG-OE2 3.21Å; I57-E166 HydrophobicContact CD1-CB 3.83Å; I57-E166 HydrophobicContact CD1-CG 4.32Å; I57-E166 HydrophobicContact CG1-CB 4.16Å; P164-E166 PolarHBondContact O-N 3.21Å
167	S	76.3	Confident	61.4	Low	57 Å²	57	94.9 Å²	94.9	40%	0.399	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	126.5	-169	-172.8	0	0	0	0	109.5	C105 N106 A165	C105-S167 WeakPolarHBondContact CA-O 3.41Å; N106-S167 PolarHBondContact N-O 3.39Å; N106-S167 PolarHBondContact O-N 3.33Å; A165-S167 WeakPolarHBondContact O-CB 3.24Å; A165-S167 PolarHBondContact O-N 2.92Å
168	C	83.9	Confident	62.4	Low	39 Å²	39	85.1 Å²	85.1	26%	0.264	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125.1	170.8	-67	0	0	0	0	107.6	V103 C104 C105	V103-C168 HydrophobicContact CG1-CB 4.08Å; C104-C168 CarbonylContact O-C 3.4Å; C104-C168 VanDerWaalsContact O-CA 3.31Å; C104-C168 WeakPolarHBondContact O-CA 3.33Å; C105-C168 HydrophobicContact CB-CB 4.2Å; C105-C168 WeakPolarHBondContact CB-SG 3.27Å; C105-C168 WeakPolarHBondContact SG-CB 3.15Å; C105-C168 CovalentContact SG-SG 2.04Å; C105-C168 PolarHBondContact SG-SG 2.82Å
169	V	86.3	Confident	63.6	Low	69 Å²	69	83.5 Å²	83.5	42%	0.418	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	146.1	177.4	-65.4	0	0	0	0	109.4	C104 E171	C104-V169 HydrophobicContact CB-CG2 4.22Å; C104-V169 PolarHBondContact N-O 3.08Å; C104-V169 PolarHBondContact O-N 3.11Å; V169-E171 PolarHBondContact O-N 3.19Å
170	T	83.4	Confident	65	Low	125 Å²	125	86.4 Å²	86.4	77%	0.767	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	118.9	172.3	-52.1	0	0	0	0	108.4	G102	G102-T170 CarbonylContact O-C 3.5Å; G102-T170 VanDerWaalsContact O-CA 3.31Å; G102-T170 WeakPolarHBondContact O-CA 3.46Å; G102-T170 WeakPolarHBondContact O-CG2 3.46Å
171	E	82.6	Confident	66.1	Low	57 Å²	57	85.7 Å²	85.7	27%	0.266	45%	0.449	S	S	.	.			trans	-130.1	114.1	-176.1	-164.7	68.1	51	0	0	109.6	G102 C104 V169 E173 C174	G102-E171 CarbonylContact C-O 3.55Å; G102-E171 VanDerWaalsContact C-O 3.26Å; G102-E171 VanDerWaalsContact CA-O 3.22Å; G102-E171 WeakPolarHBondContact CA-O 3.29Å; G102-E171 PolarHBondContact O-N 3.38Å; C104-E171 HydrophobicContact CB-CB 3.59Å; C104-E171 HydrophobicContact CB-CG 4.21Å; V169-E171 PolarHBondContact O-N 3.19Å; E171-E173 HydrophobicContact CG-CB 4.29Å; E171-E173 HydrophobicContact CG-CG 4.48Å; E171-E173 PolarHBondContact O-N 3.02Å; E171-C174 WeakPolarHBondContact O-CB 3.49Å; E171-C174 PolarHBondContact O-N 2.99Å; E171-C174 VanDerWaalsContact O-N 3.14Å
172	P	79.7	Confident	67.1	Low	96 Å²	96	80.7 Å²	80.7	62%	0.623	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.4	-175.2	25.8	-33.8	0	0	0	112.7	C174 R175	P172-C174 PolarHBondContact O-N 3.5Å; P172-C174 VanDerWaalsContact O-N 3.14Å; P172-R175 WeakPolarHBondContact O-CB 2.82Å; P172-R175 PolarHBondContact O-N 3.11Å
173	E	80.1	Confident	67.9	Low	108 Å²	108	82.8 Å²	82.8	51%	0.505	43%	0.428	S	S	.	.	H	α-helix	trans	-60.1	-26.7	176.9	-59.8	-170.3	139.6	0	0	112.9	K90 E171 R175	K90-E173 PolarHBondContact NZ-O 3.42Å; E171-E173 HydrophobicContact CG-CB 4.29Å; E171-E173 HydrophobicContact CG-CG 4.48Å; E171-E173 PolarHBondContact O-N 3.02Å; E173-R175 VanDerWaalsContact C-N 3.26Å; E173-R175 PolarHBondContact O-N 2.94Å
174	C	81.1	Confident	68.8	Low	0 Å²	0	79 Å²	79	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-74.6	-16.7	177.4	-68.6	0	0	0	0	113.1	C98 E171 P172	C98-C174 WeakPolarHBondContact CA-SG 3.44Å; C98-C174 HydrophobicContact CB-CB 3.6Å; C98-C174 WeakPolarHBondContact CB-SG 3.45Å; C98-C174 WeakPolarHBondContact SG-CA 3.35Å; C98-C174 WeakPolarHBondContact SG-CB 3.47Å; C98-C174 CovalentContact SG-SG 2.04Å; C98-C174 PolarHBondContact SG-SG 3.24Å; E171-C174 WeakPolarHBondContact O-CB 3.49Å; E171-C174 PolarHBondContact O-N 2.99Å; E171-C174 VanDerWaalsContact O-N 3.14Å; P172-C174 PolarHBondContact O-N 3.5Å; P172-C174 VanDerWaalsContact O-N 3.14Å
175	R	80.7	Confident	69.3	Low	139 Å²	139	79.4 Å²	79.4	53%	0.525	42%	0.42	S	S	.	.	H	α-helix	trans	-69.9	-42.8	176	-173.2	163.9	-179.6	168.9	7.1	112.4	F101 P172 E173 G177 F178 H179	F101-R175 HydrophobicContact CD1-CG 4.47Å; F101-R175 HydrophobicContact CD2-CG 4.37Å; F101-R175 HydrophobicContact CE1-CG 3.77Å; F101-R175 HydrophobicContact CE2-CG 3.64Å; F101-R175 HydrophobicContact CZ-CB 4.48Å; F101-R175 HydrophobicContact CZ-CG 3.34Å; P172-R175 WeakPolarHBondContact O-CB 2.82Å; P172-R175 PolarHBondContact O-N 3.11Å; E173-R175 VanDerWaalsContact C-N 3.26Å; E173-R175 PolarHBondContact O-N 2.94Å; R175-G177 VanDerWaalsContact C-N 3.28Å; R175-G177 PolarHBondContact O-N 3.29Å; R175-F178 WeakPolarHBondContact O-CB 3.49Å; R175-F178 PolarHBondContact O-N 3.35Å; R175-F178 VanDerWaalsContact O-N 3.16Å; R175-H179 PolarHBondContact O-CD2 2.94Å; R175-H179 VanDerWaalsContact O-CD2 3.31Å; R175-H179 PolarHBondContact O-N 2.88Å
176	E	66.3	Low	69.4	Low	110 Å²	110	81 Å²	81	51%	0.514	42%	0.418	S	S	.	.	H	α-helix	trans	-60.6	-38	179.4	-165.4	77.6	-144.4	0	0	111.9	F178 H179 R180	E176-F178 VanDerWaalsContact C-N 3.3Å; E176-F178 PolarHBondContact O-N 3.38Å; E176-H179 PolarHBondContact O-N 3.03Å; E176-R180 PolarHBondContact O-N 2.76Å
177	G	63.7	Low	68.7	Low	14 Å²	14	86.4 Å²	86.4	14%	0.144	44%	0.436	C	S	.	.	H	α-helix	trans	-66.7	-31.7	178.9	0	0	0	0	0	113.1	R175 R181	R175-G177 VanDerWaalsContact C-N 3.28Å; R175-G177 PolarHBondContact O-N 3.29Å; G177-R181 PolarHBondContact O-N 3.03Å
178	F	62.9	Low	67.6	Low	28 Å²	28	88.8 Å²	88.8	12%	0.123	45%	0.452	C	S	.	.	H	α-helix	trans	-70	-45	175.5	-104.6	-99.7	0	0	0	112.9	D61 F101 R175 E176 R180 R181 A182	D61-F178 HydrophobicContact CB-CE1 3.51Å; D61-F178 HydrophobicContact CB-CZ 3.45Å; D61-F178 VanDerWaalsContact CB-CZ 3.45Å; D61-F178 WeakPolarHBondContact OD1-CE2 3.4Å; D61-F178 WeakPolarHBondContact OD1-CZ 3.49Å; F101-F178 HydrophobicContact CB-CD1 4.4Å; F101-F178 HydrophobicContact CB-CD2 4.34Å; F101-F178 HydrophobicContact CB-CE1 4.24Å; F101-F178 HydrophobicContact CB-CE2 4.22Å; F101-F178 HydrophobicContact CB-CG 4.38Å; F101-F178 HydrophobicContact CB-CZ 4.11Å; F101-F178 HydrophobicContact CD2-CB 3.61Å; F101-F178 AromaticContact CD2-CD1 3.96Å; F101-F178 HydrophobicContact CD2-CD1 3.96Å; F101-F178 HydrophobicContact CD2-CD2 4.32Å; F101-F178 AromaticContact CD2-CG 3.74Å; F101-F178 HydrophobicContact CD2-CG 3.74Å; F101-F178 HydrophobicContact CE2-CB 4.09Å; F101-F178 VanDerWaalsContact N-CZ 3.34Å; R175-F178 WeakPolarHBondContact O-CB 3.49Å; R175-F178 PolarHBondContact O-N 3.35Å; R175-F178 VanDerWaalsContact O-N 3.16Å; E176-F178 VanDerWaalsContact C-N 3.3Å; E176-F178 PolarHBondContact O-N 3.38Å; F178-R180 PolarHBondContact O-N 3.41Å; F178-R181 PolarHBondContact O-N 3.42Å; F178-A182 WeakPolarHBondContact O-CB 3.34Å; F178-A182 PolarHBondContact O-N 3.16Å
179	H	58.8	Low	66.4	Low	81 Å²	81	93.9 Å²	93.9	38%	0.375	48%	0.477	S	S	.	.	H	α-helix	trans	-61.2	-34.9	175.7	-70	-63.1	0	0	0	111.7	F101 R175 E176 R183	F101-H179 AromaticContact CE2-NE2 3.85Å; F101-H179 AromaticContact CZ-NE2 3.96Å; R175-H179 PolarHBondContact O-CD2 2.94Å; R175-H179 VanDerWaalsContact O-CD2 3.31Å; R175-H179 PolarHBondContact O-N 2.88Å; E176-H179 PolarHBondContact O-N 3.03Å; H179-R183 VanDerWaalsContact O-CB 3.3Å; H179-R183 WeakPolarHBondContact O-CB 3.44Å; H179-R183 WeakPolarHBondContact O-CG 3.42Å; H179-R183 PolarHBondContact O-N 3.31Å
180	R	59.9	Low	64.8	Low	175 Å²	175	93.2 Å²	93.2	66%	0.66	48%	0.479	S	S	*	.	H	α-helix	trans	-67	-41.7	171.5	-69.6	-174	-171.7	-168.4	1.7	112.8	E176 F178 A184	E176-R180 PolarHBondContact O-N 2.76Å; F178-R180 PolarHBondContact O-N 3.41Å; R180-A184 WeakPolarHBondContact O-CB 3.35Å; R180-A184 PolarHBondContact O-N 3.43Å
181	R	59.9	Low	63.6	Low	93 Å²	93	93.5 Å²	93.5	35%	0.351	48%	0.481	S	S	.	.	H	α-helix	trans	-66.1	-43.6	176.4	-79.4	-167.9	-72.7	157.5	-2.7	112.5	D61 G177 F178 A184 S185	D61-R181 VanDerWaalsContact CG-NH1 3.34Å; D61-R181 IonicContact OD1-CZ 3.75Å; D61-R181 IonicContact OD1-NH1 2.82Å; D61-R181 PolarHBondContact OD1-NH1 2.84Å; D61-R181 VanDerWaalsContact OD1-NH1 3.09Å; D61-R181 IonicContact OD1-NH2 3.15Å; D61-R181 PolarHBondContact OD1-NH2 2.7Å; D61-R181 IonicContact OD2-CZ 3.91Å; D61-R181 IonicContact OD2-NH1 3.42Å; D61-R181 PolarHBondContact OD2-NH1 3.46Å; D61-R181 IonicContact OD2-NH2 2.84Å; G177-R181 PolarHBondContact O-N 3.03Å; F178-R181 PolarHBondContact O-N 3.42Å; R181-A184 PolarHBondContact O-N 3.21Å; R181-S185 VanDerWaalsContact O-CB 3.3Å; R181-S185 WeakPolarHBondContact O-CB 3.18Å; R181-S185 PolarHBondContact O-N 3.28Å
182	A	58.3	Low	62.2	Low	49 Å²	49	96.7 Å²	96.7	41%	0.405	50%	0.496	S	S	.	.	H	α-helix	trans	-59.8	-51.4	174.5	0	0	0	0	0	110.7	F178 A184 S185 D186	F178-A182 WeakPolarHBondContact O-CB 3.34Å; F178-A182 PolarHBondContact O-N 3.16Å; A182-A184 VanDerWaalsContact C-N 3.31Å; A182-A184 PolarHBondContact O-N 3.43Å; A182-S185 WeakPolarHBondContact O-CB 3.35Å; A182-S185 PolarHBondContact O-N 3.2Å; A182-S185 VanDerWaalsContact O-N 3.16Å; A182-D186 VanDerWaalsContact O-CG 3.31Å; A182-D186 PolarHBondContact O-N 2.94Å
183	R	56.3	Low	61.1	Low	179 Å²	179	96.3 Å²	96.3	68%	0.675	49%	0.488	S	S	*	.	H	α-helix	trans	-60.9	-36.4	175.8	-73	178	-171.9	167.2	4.6	113.4	H179 R187	H179-R183 VanDerWaalsContact O-CB 3.3Å; H179-R183 WeakPolarHBondContact O-CB 3.44Å; H179-R183 WeakPolarHBondContact O-CG 3.42Å; H179-R183 PolarHBondContact O-N 3.31Å; R183-R187 VanDerWaalsContact O-CB 3.24Å; R183-R187 WeakPolarHBondContact O-CB 3.4Å; R183-R187 PolarHBondContact O-N 3.39Å
184	A	57	Low	60.2	Low	51 Å²	51	96.8 Å²	96.8	42%	0.421	49%	0.494	S	S	.	.	H	α-helix	trans	-69.5	-42.7	176	0	0	0	0	0	111.2	R180 R181 A182 R187 S188	R180-A184 WeakPolarHBondContact O-CB 3.35Å; R180-A184 PolarHBondContact O-N 3.43Å; R181-A184 PolarHBondContact O-N 3.21Å; A182-A184 VanDerWaalsContact C-N 3.31Å; A182-A184 PolarHBondContact O-N 3.43Å; A184-R187 CarbonylContact O-C 3.58Å; A184-R187 PolarHBondContact O-N 2.77Å; A184-S188 WeakPolarHBondContact O-CB 3.4Å; A184-S188 PolarHBondContact O-N 3.09Å; A184-S188 PolarHBondContact O-OG 2.64Å
185	S	56.2	Low	59.5	Low	76 Å²	76	99.6 Å²	99.6	53%	0.531	52%	0.523	S	S	.	.	H	α-helix	trans	-62.2	-44.7	175.3	-168.7	0	0	0	0	111.5	R181 A182 R187 S188 N189	R181-S185 VanDerWaalsContact O-CB 3.3Å; R181-S185 WeakPolarHBondContact O-CB 3.18Å; R181-S185 PolarHBondContact O-N 3.28Å; A182-S185 WeakPolarHBondContact O-CB 3.35Å; A182-S185 PolarHBondContact O-N 3.2Å; A182-S185 VanDerWaalsContact O-N 3.16Å; S185-R187 VanDerWaalsContact C-N 3.28Å; S185-R187 PolarHBondContact O-N 3.43Å; S185-S188 PolarHBondContact O-N 3.35Å; S185-N189 WeakPolarHBondContact O-CB 3.4Å; S185-N189 PolarHBondContact O-N 3.12Å
186	D	55.4	Low	58.8	Low	112 Å²	112	98.1 Å²	98.1	60%	0.599	53%	0.531	S	S	*	.	H	α-helix	trans	-60.1	-40.5	173.8	-69.9	-32.3	0	0	0	111.2	A182 N189 A190	A182-D186 VanDerWaalsContact O-CG 3.31Å; A182-D186 PolarHBondContact O-N 2.94Å; D186-N189 PolarHBondContact O-N 2.87Å; D186-A190 PolarHBondContact O-N 3.46Å; D186-A190 VanDerWaalsContact O-N 3.12Å
187	R	53.8	Low	58.8	Low	157 Å²	157	94.7 Å²	94.7	59%	0.592	52%	0.522	S	S	*	.	H	α-helix	trans	-71.3	-33.5	177.6	-170.3	173.9	-177.1	165.7	6.5	113.2	R183 A184 S185 A190 Q192	R183-R187 VanDerWaalsContact O-CB 3.24Å; R183-R187 WeakPolarHBondContact O-CB 3.4Å; R183-R187 PolarHBondContact O-N 3.39Å; A184-R187 CarbonylContact O-C 3.58Å; A184-R187 PolarHBondContact O-N 2.77Å; S185-R187 VanDerWaalsContact C-N 3.28Å; S185-R187 PolarHBondContact O-N 3.43Å; R187-A190 PolarHBondContact O-N 3.5Å; R187-A190 VanDerWaalsContact O-O 3.12Å; R187-Q192 VanDerWaalsContact NH2-NE2 3.13Å
188	S	54.4	Low	59.1	Low	106 Å²	106	95 Å²	95	74%	0.741	53%	0.525	S	S	*	.	H	α-helix	trans	-76	-25.4	175.6	-64	0	0	0	0	112.6	A184 S185 A190	A184-S188 WeakPolarHBondContact O-CB 3.4Å; A184-S188 PolarHBondContact O-N 3.09Å; A184-S188 PolarHBondContact O-OG 2.64Å; S185-S188 PolarHBondContact O-N 3.35Å; S188-A190 VanDerWaalsContact C-N 3.34Å
189	N	56.8	Low	59.7	Low	146 Å²	146	96.3 Å²	96.3	78%	0.781	54%	0.541	S	S	*	.	H	α-helix	trans	-84.3	-12.1	173.4	-156.8	12.7	0	0	0	112.5	S185 D186	S185-N189 WeakPolarHBondContact O-CB 3.4Å; S185-N189 PolarHBondContact O-N 3.12Å; D186-N189 PolarHBondContact O-N 2.87Å
190	A	54.5	Low	60.6	Low	55 Å²	55	97.8 Å²	97.8	46%	0.455	55%	0.551	S	S	.	*	S	Bend	trans	-84.6	125.3	165.3	0	0	0	0	0	109	D186 R187 S188 Q192	D186-A190 PolarHBondContact O-N 3.46Å; D186-A190 VanDerWaalsContact O-N 3.12Å; R187-A190 PolarHBondContact O-N 3.5Å; R187-A190 VanDerWaalsContact O-O 3.12Å; S188-A190 VanDerWaalsContact C-N 3.34Å; A190-Q192 PolarHBondContact O-N 3.42Å
191	T	56.8	Low	61.3	Low	132 Å²	132	93.2 Å²	93.2	81%	0.81	54%	0.539	S	S	*	.			trans	-62.8	91.1	161.7	40.4	0	0	0	0	107.7	L193	T191-L193 PolarHBondContact O-N 2.86Å
192	Q	54.4	Low	62.1	Low	124 Å²	124	94.2 Å²	94.2	58%	0.579	55%	0.551	S	S	*	*			trans	-70.3	87.9	177.4	-169.1	179.5	-6.3	0	0	108	R187 A190 D194	R187-Q192 VanDerWaalsContact NH2-NE2 3.13Å; A190-Q192 PolarHBondContact O-N 3.42Å; Q192-D194 PolarHBondContact O-N 3.02Å
193	L	56.8	Low	63.1	Low	88 Å²	88	99.9 Å²	99.9	46%	0.461	56%	0.562	S	S	.	*			trans	-62.1	125.7	160.5	-75.5	144.6	0	0	0	106.6	T191 G195 A197 L201	T191-L193 PolarHBondContact O-N 2.86Å; L193-G195 PolarHBondContact O-N 2.94Å; L193-A197 HydrophobicContact CB-CB 4.2Å; L193-A197 HydrophobicContact CD2-CB 3.89Å; L193-L201 HydrophobicContact CD1-CD1 3.4Å; L193-L201 HydrophobicContact CD2-CD1 3.94Å; L193-L201 HydrophobicContact CG-CD1 4.26Å
194	D	59.7	Low	64.2	Low	118 Å²	118	95.9 Å²	95.9	63%	0.631	55%	0.553	S	S	*	*			trans	-46.3	138.8	170.9	-75.9	-60.6	0	0	0	109.2	Q192 P196 A197 G198	Q192-D194 PolarHBondContact O-N 3.02Å; D194-P196 HydrophobicContact CB-CG 4.2Å; D194-P196 CarbonylContact O-C 3.58Å; D194-P196 WeakPolarHBondContact O-CD 3.26Å; D194-A197 WeakPolarHBondContact O-CA 3.43Å; D194-A197 WeakPolarHBondContact O-CB 3.47Å; D194-A197 PolarHBondContact O-N 3.06Å; D194-G198 PolarHBondContact O-N 3.12Å
195	G	68	Low	65.4	Low	59 Å²	59	98.3 Å²	98.3	61%	0.608	56%	0.563	S	S	*	*	H	α-helix	trans	-37.7	-45.8	-178.3	0	0	0	0	0	115.4	L193 G198 A199	L193-G195 PolarHBondContact O-N 2.94Å; G195-G198 PolarHBondContact O-N 3.5Å; G195-A199 PolarHBondContact O-N 3.38Å
196	P	65.1	Low	66.6	Low	107 Å²	107	100.1 Å²	100.1	70%	0.695	56%	0.563	S	S	*	*	H	α-helix	trans	-62.7	-38.7	175.2	22.6	-34.6	0	0	0	114.6	D194 L200	D194-P196 HydrophobicContact CB-CG 4.2Å; D194-P196 CarbonylContact O-C 3.58Å; D194-P196 WeakPolarHBondContact O-CD 3.26Å; P196-L200 PolarHBondContact O-N 3.4Å; P196-L200 VanDerWaalsContact O-N 3.16Å
197	A	65.9	Low	67.5	Low	39 Å²	39	100.9 Å²	100.9	32%	0.322	57%	0.566	S	S	.	*	H	α-helix	trans	-71.7	-36.7	177.3	0	0	0	0	0	111.9	L193 D194 L200 L201	L193-A197 HydrophobicContact CB-CB 4.2Å; L193-A197 HydrophobicContact CD2-CB 3.89Å; D194-A197 WeakPolarHBondContact O-CA 3.43Å; D194-A197 WeakPolarHBondContact O-CB 3.47Å; D194-A197 PolarHBondContact O-N 3.06Å; A197-L200 PolarHBondContact O-N 2.99Å; A197-L201 PolarHBondContact O-N 2.93Å; A197-L201 VanDerWaalsContact O-N 3.11Å
198	G	70.5	Confident	68.2	Low	21 Å²	21	97.7 Å²	97.7	22%	0.216	57%	0.573	C	S	.	*	H	α-helix	trans	-63	-40.6	173.2	0	0	0	0	0	112.7	D194 G195 L202	D194-G198 PolarHBondContact O-N 3.12Å; G195-G198 PolarHBondContact O-N 3.5Å; G198-L202 WeakPolarHBondContact O-CG 3.48Å; G198-L202 PolarHBondContact O-N 3.02Å; G198-L202 VanDerWaalsContact O-N 3.11Å
199	A	75.4	Confident	68.6	Low	54 Å²	54	95.5 Å²	95.5	45%	0.446	57%	0.568	S	S	.	*	H	α-helix	trans	-66.9	-38.6	177	0	0	0	0	0	112.9	G195 L202 R203	G195-A199 PolarHBondContact O-N 3.38Å; A199-L202 PolarHBondContact O-N 2.94Å; A199-R203 PolarHBondContact O-N 3.47Å; A199-R203 VanDerWaalsContact O-N 3.08Å
200	L	76.9	Confident	68.5	Low	113 Å²	113	91.4 Å²	91.4	59%	0.592	55%	0.554	S	S	*	*	H	α-helix	trans	-65.2	-44.2	176.7	-170.2	115.2	0	0	0	111.6	P196 A197 R203 L204	P196-L200 PolarHBondContact O-N 3.4Å; P196-L200 VanDerWaalsContact O-N 3.16Å; A197-L200 PolarHBondContact O-N 2.99Å; L200-R203 PolarHBondContact O-N 2.68Å; L200-L204 HydrophobicContact CD2-CD1 3.86Å; L200-L204 HydrophobicContact CG-CD1 4.42Å; L200-L204 WeakPolarHBondContact O-CG 3.4Å; L200-L204 PolarHBondContact O-N 3.47Å
201	L	74.9	Confident	68.5	Low	79 Å²	79	94.6 Å²	94.6	41%	0.414	57%	0.57	S	S	.	*	H	α-helix	trans	-62.9	-42.4	176.8	-81.1	164.8	0	0	0	112.3	L193 A197 R203 L204 V205	L193-L201 HydrophobicContact CD1-CD1 3.4Å; L193-L201 HydrophobicContact CD2-CD1 3.94Å; L193-L201 HydrophobicContact CG-CD1 4.26Å; A197-L201 PolarHBondContact O-N 2.93Å; A197-L201 VanDerWaalsContact O-N 3.11Å; L201-R203 VanDerWaalsContact C-N 3.28Å; L201-R203 PolarHBondContact O-N 3.35Å; L201-L204 PolarHBondContact O-N 3.26Å; L201-V205 WeakPolarHBondContact O-CG2 3.37Å; L201-V205 PolarHBondContact O-N 3Å
202	L	76.6	Confident	68.3	Low	114 Å²	114	96.7 Å²	96.7	60%	0.597	57%	0.571	S	S	*	*	H	α-helix	trans	-59.1	-40.1	174	-80.4	162.6	0	0	0	111.9	G198 A199 Q206	G198-L202 WeakPolarHBondContact O-CG 3.48Å; G198-L202 PolarHBondContact O-N 3.02Å; G198-L202 VanDerWaalsContact O-N 3.11Å; A199-L202 PolarHBondContact O-N 2.94Å; L202-Q206 VanDerWaalsContact O-CG 3.27Å; L202-Q206 WeakPolarHBondContact O-CG 3.38Å; L202-Q206 PolarHBondContact O-N 3.46Å; L202-Q206 VanDerWaalsContact O-N 3.09Å
203	R	79.2	Confident	67.9	Low	168 Å²	168	96.5 Å²	96.5	63%	0.634	58%	0.581	S	S	*	*	H	α-helix	trans	-67.7	-40.1	176	-83.3	-65.1	-168.7	173.6	2.2	113.1	A199 L200 L201 Q206 L207	A199-R203 PolarHBondContact O-N 3.47Å; A199-R203 VanDerWaalsContact O-N 3.08Å; L200-R203 PolarHBondContact O-N 2.68Å; L201-R203 VanDerWaalsContact C-N 3.28Å; L201-R203 PolarHBondContact O-N 3.35Å; R203-Q206 PolarHBondContact O-N 2.97Å; R203-L207 WeakPolarHBondContact O-CG 3.49Å; R203-L207 PolarHBondContact O-N 2.96Å
204	L	79.4	Confident	67.4	Low	94 Å²	94	101.5 Å²	101.5	49%	0.492	60%	0.599	S	S	.	*	H	α-helix	trans	-65	-40.3	176.8	-70.9	171.2	0	0	0	112	L200 L201 L207 A208	L200-L204 HydrophobicContact CD2-CD1 3.86Å; L200-L204 HydrophobicContact CG-CD1 4.42Å; L200-L204 WeakPolarHBondContact O-CG 3.4Å; L200-L204 PolarHBondContact O-N 3.47Å; L201-L204 PolarHBondContact O-N 3.26Å; L204-L207 PolarHBondContact O-N 3.23Å; L204-A208 WeakPolarHBondContact O-CB 3.46Å; L204-A208 PolarHBondContact O-N 3.42Å
205	V	82.6	Confident	67.2	Low	102 Å²	102	104.5 Å²	104.5	62%	0.618	61%	0.609	S	S	*	*	H	α-helix	trans	-64.7	-40.1	175.6	173.1	0	0	0	0	111.4	L201 L207 A208 G209	L201-V205 WeakPolarHBondContact O-CG2 3.37Å; L201-V205 PolarHBondContact O-N 3Å; V205-L207 VanDerWaalsContact C-N 3.33Å; V205-L207 PolarHBondContact O-N 2.98Å; V205-A208 PolarHBondContact O-N 2.96Å; V205-G209 PolarHBondContact O-N 2.98Å; V205-G209 VanDerWaalsContact O-N 3.07Å
206	Q	80.9	Confident	66.1	Low	115 Å²	115	106.9 Å²	106.9	54%	0.537	61%	0.614	S	S	.	*	H	α-helix	trans	-65	-35.4	175.6	-74.2	173.6	-4.1	0	0	112.8	L202 R203	L202-Q206 VanDerWaalsContact O-CG 3.27Å; L202-Q206 WeakPolarHBondContact O-CG 3.38Å; L202-Q206 PolarHBondContact O-N 3.46Å; L202-Q206 VanDerWaalsContact O-N 3.09Å; R203-Q206 PolarHBondContact O-N 2.97Å
207	L	74.2	Confident	65.6	Low	127 Å²	127	106.6 Å²	106.6	67%	0.665	62%	0.62	S	S	*	*	H	α-helix	trans	-72.9	-36.7	176.1	-71.6	169	0	0	0	112.1	R203 L204 V205 G209 A210	R203-L207 WeakPolarHBondContact O-CG 3.49Å; R203-L207 PolarHBondContact O-N 2.96Å; L204-L207 PolarHBondContact O-N 3.23Å; V205-L207 VanDerWaalsContact C-N 3.33Å; V205-L207 PolarHBondContact O-N 2.98Å; L207-G209 VanDerWaalsContact C-N 3.27Å; L207-G209 PolarHBondContact O-N 3.37Å; L207-A210 WeakPolarHBondContact O-CB 3.49Å; L207-A210 PolarHBondContact O-N 3.08Å
208	A	69.1	Low	65	Low	90 Å²	90	113.6 Å²	113.6	74%	0.744	65%	0.646	S	S	*	*	H	α-helix	trans	-72.2	-20.2	176.1	0	0	0	0	0	113.4	L204 V205	L204-A208 WeakPolarHBondContact O-CB 3.46Å; L204-A208 PolarHBondContact O-N 3.42Å; V205-A208 PolarHBondContact O-N 2.96Å
209	G	63.3	Low	64.3	Low	61 Å²	61	118.5 Å²	118.5	63%	0.629	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	3.1	175.1	0	0	0	0	0	114.5	V205 L207 P211	V205-G209 PolarHBondContact O-N 2.98Å; V205-G209 VanDerWaalsContact O-N 3.07Å; L207-G209 VanDerWaalsContact C-N 3.27Å; L207-G209 PolarHBondContact O-N 3.37Å; G209-P211 WeakPolarHBondContact O-CD 3.24Å
210	A	55.1	Low	62.9	Low	60 Å²	60	124.1 Å²	124.1	50%	0.496	70%	0.697	S	S	.	*	S	Bend	trans	-71.9	124.1	175.1	0	0	0	0	0	109.5	L207 E212	L207-A210 WeakPolarHBondContact O-CB 3.49Å; L207-A210 PolarHBondContact O-N 3.08Å; A210-E212 PolarHBondContact O-N 3.38Å
211	P	54.3	Low	61.3	Low	122 Å²	122	123.6 Å²	123.6	79%	0.792	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-66.3	129.5	170.8	25.9	-30.3	0	0	0	109.5	G209	G209-P211 WeakPolarHBondContact O-CD 3.24Å
212	E	51.7	Low	59.8	Low	176 Å²	176	133.9 Å²	133.9	82%	0.822	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-50.3	133.3	173.9	-69.5	-78.1	111.6	0	0	110.5	A210 F214	A210-E212 PolarHBondContact O-N 3.38Å; E212-F214 PolarHBondContact O-N 3.22Å
213	P	46.2	Very low	59	Low	120 Å²	120	134.9 Å²	134.9	78%	0.779	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-64.3	120.6	175.7	-16.6	29.3	0	0	0	110.5	E215	P213-E215 PolarHBondContact O-N 3.16Å
214	F	46.4	Very low	57.9	Low	192 Å²	192	133.1 Å²	133.1	84%	0.842	76%	0.758	S	S	*	*			trans	-65.1	115.1	171.4	-171.7	-95.9	0	0	0	109.6	E212 P216	E212-F214 PolarHBondContact O-N 3.22Å; F214-P216 WeakPolarHBondContact O-CD 3.35Å
215	E	55.8	Low	56.7	Low	182 Å²	182	135.3 Å²	135.3	85%	0.85	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-75.7	119.4	177.3	-163.3	155.4	90.2	0	0	109.8	P213	P213-E215 PolarHBondContact O-N 3.16Å
216	P	45.5	Very low	55.2	Low	109 Å²	109	137.2 Å²	137.2	71%	0.708	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-82.4	123.1	-179	29.8	-30.6	0	0	0	111.4	F214	F214-P216 WeakPolarHBondContact O-CD 3.35Å
217	A	53	Low	53.6	Low	100 Å²	100	138.6 Å²	138.6	83%	0.826	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-64.5	135.6	169.3	0	0	0	0	0	111.4
218	Q	55.1	Low	52.2	Low	187 Å²	187	139.4 Å²	139.4	87%	0.874	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-69.4	142.1	172.6	-68.7	173.4	36.2	0	0	110.7
219	P	54.8	Low	51	Low	124 Å²	124	142.9 Å²	142.9	81%	0.805	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-92	123.8	168.4	31.7	-25.9	0	0	0	111.3
220	D	45.6	Very low	50.1	Low	171 Å²	171	149.2 Å²	149.2	91%	0.914	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-59.8	129.3	163.8	-68.5	-62.1	0	0	0	110.5
221	A	44.7	Very low	49.6	Very low	102 Å²	102	156.7 Å²	156.7	84%	0.843	85%	0.851	S	S	*	*			trans	-106.1	118.9	169.8	0	0	0	0	0	109.2
222	Y	42.6	Very low	49.2	Very low	295 Å²	295	159.8 Å²	159.8	100%	1.157	86%	0.857	S	S	*	*			trans	-97.5	0	159.6	96	-98	0	0	0	109.2

Retrieved 222 of 222 residues in 322.3 ms (Link to these results)

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