A0A077ZBA8_TRITR Loading...

Protein numb

AlphaFold DB , UniProt , Accession A0A077ZBA8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 559 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	48.4	Very low	44.4	Very low	235 Å²	235	160.9 Å²	160.9	100%	1.158	83%	0.83	S	S	*	*				0	-1.9	0	-82.2	-60.5	-147.8	0	0	114.7
2	N	45.9	Very low	44.9	Very low	161 Å²	161	154.5 Å²	154.5	86%	0.861	81%	0.81	S	S	*	*			trans	-117.2	24.6	-176.4	-70.5	-18.9	0	0	0	115
3	Y	45.6	Very low	44.5	Very low	225 Å²	225	147 Å²	147	88%	0.882	78%	0.778	S	S	*	*	S	Bend	trans	-127.2	10.6	-172.6	-125.2	-91.9	0	0	0	115.5
4	L	47.6	Very low	44.8	Very low	182 Å²	182	147 Å²	147	95%	0.953	77%	0.774	S	S	*	*			trans	-124.3	50.8	-177.8	-81.4	161.4	0	0	0	111
5	R	41.9	Very low	45.5	Very low	245 Å²	245	148.9 Å²	148.9	93%	0.925	77%	0.766	S	S	*	*			trans	-129.4	33.2	-177.1	-150.7	-177.6	-150.5	-156.2	3.5	114.3
6	S	41.1	Very low	46.1	Very low	103 Å²	103	145.4 Å²	145.4	72%	0.72	75%	0.754	S	S	*	*			trans	-156.6	59.4	-177.1	61.7	0	0	0	0	113.1
7	T	48.5	Very low	46.2	Very low	122 Å²	122	146.6 Å²	146.6	75%	0.748	75%	0.748	S	S	*	*	S	Bend	trans	-162.2	111.4	156	43.1	0	0	0	0	108.5
8	L	38.6	Very low	46.8	Very low	171 Å²	171	141.7 Å²	141.7	90%	0.895	73%	0.732	S	S	*	*			trans	49.9	92.9	136.9	-62.3	143.9	0	0	0	114.1
9	G	37.5	Very low	47.4	Very low	70 Å²	70	140.3 Å²	140.3	72%	0.722	72%	0.722	S	S	*	*				94.8	73.1	81.1	0	0	0	0	0	109
10	D	45.1	Very low	47.8	Very low	111 Å²	111	140.5 Å²	140.5	59%	0.594	72%	0.718	S	S	*	*			trans	-175.2	77.8	163.1	-103	-20.8	0	0	0	110.6	S12 C13 M14	D10-S12 PolarHBondContact O-N 3.4Å; D10-S12 VanDerWaalsContact O-N 3.12Å; D10-C13 HydrophobicContact CB-CB 3.62Å; D10-C13 PolarHBondContact O-N 3.41Å; D10-C13 VanDerWaalsContact O-N 3.07Å; D10-M14 PolarHBondContact O-N 3.42Å
11	E	48.7	Very low	48.1	Very low	145 Å²	145	140.4 Å²	140.4	68%	0.678	71%	0.712	S	S	*	*	H	α-helix	trans	-51	-30.4	167	-85.6	-90.2	129.2	0	0	111.5	R15	E11-R15 WeakPolarHBondContact O-CG 3.32Å; E11-R15 PolarHBondContact O-N 3.43Å; E11-R15 IonicContact OE2-NH2 3.74Å; E11-R15 PolarHBondContact OE2-NH2 3.29Å
12	S	50.1	Low	48.7	Very low	84 Å²	84	135.4 Å²	135.4	59%	0.587	69%	0.686	S	S	*	*	H	α-helix	trans	-69	-39.9	177.4	-52.1	0	0	0	0	112.9	D10 R15 V16	D10-S12 PolarHBondContact O-N 3.4Å; D10-S12 VanDerWaalsContact O-N 3.12Å; S12-R15 PolarHBondContact O-N 3.44Å; S12-V16 WeakPolarHBondContact O-CG2 3.2Å; S12-V16 PolarHBondContact O-N 3.23Å; S12-V16 VanDerWaalsContact O-N 3.12Å
13	C	40.1	Very low	49.4	Very low	57 Å²	57	132 Å²	132	39%	0.385	67%	0.665	S	S	.	*	H	α-helix	trans	-70.7	-41.5	-178.2	-170.7	0	0	0	0	111.1	D10 R15 V16 Y17	D10-C13 HydrophobicContact CB-CB 3.62Å; D10-C13 PolarHBondContact O-N 3.41Å; D10-C13 VanDerWaalsContact O-N 3.07Å; C13-R15 VanDerWaalsContact C-N 3.33Å; C13-R15 PolarHBondContact O-N 3.2Å; C13-V16 PolarHBondContact O-N 3.32Å; C13-Y17 WeakPolarHBondContact O-CD2 3.14Å; C13-Y17 PolarHBondContact O-N 3.05Å
14	M	47.6	Very low	49.8	Very low	147 Å²	147	129.9 Å²	129.9	72%	0.724	66%	0.655	S	S	*	*	H	α-helix	trans	-63.9	-35.6	175.5	-78.6	-72.7	-86.1	0	0	112.5	D10 A18	D10-M14 PolarHBondContact O-N 3.42Å; M14-A18 WeakPolarHBondContact O-CB 3.16Å; M14-A18 PolarHBondContact O-N 3.43Å
15	R	55.4	Low	50.4	Low	175 Å²	175	124.9 Å²	124.9	66%	0.66	63%	0.628	S	S	*	*	H	α-helix	trans	-69.2	-39.6	175.1	-76.2	-178.1	-168.2	171.8	9.4	113	E11 S12 C13 A18 H19	E11-R15 WeakPolarHBondContact O-CG 3.32Å; E11-R15 PolarHBondContact O-N 3.43Å; E11-R15 IonicContact OE2-NH2 3.74Å; E11-R15 PolarHBondContact OE2-NH2 3.29Å; S12-R15 PolarHBondContact O-N 3.44Å; C13-R15 VanDerWaalsContact C-N 3.33Å; C13-R15 PolarHBondContact O-N 3.2Å; R15-A18 PolarHBondContact O-N 2.89Å; R15-H19 VanDerWaalsContact O-CB 3.31Å; R15-H19 WeakPolarHBondContact O-CB 3.48Å; R15-H19 PolarHBondContact O-N 2.96Å
16	V	56	Low	51.4	Low	94 Å²	94	116.9 Å²	116.9	57%	0.57	60%	0.601	S	S	*	*	H	α-helix	trans	-66.8	-45	176.4	175.6	0	0	0	0	110.4	S12 C13 H19 F20	S12-V16 WeakPolarHBondContact O-CG2 3.2Å; S12-V16 PolarHBondContact O-N 3.23Å; S12-V16 VanDerWaalsContact O-N 3.12Å; C13-V16 PolarHBondContact O-N 3.32Å; V16-H19 PolarHBondContact O-N 3.05Å; V16-F20 WeakPolarHBondContact O-CB 3.46Å; V16-F20 PolarHBondContact O-N 3.41Å
17	Y	46.9	Very low	52.4	Low	166 Å²	166	120.4 Å²	120.4	65%	0.651	60%	0.599	S	S	*	*	H	α-helix	trans	-63.6	-42.3	174.9	-92.2	-87.4	0	0	0	112.1	C13 F20 F21	C13-Y17 WeakPolarHBondContact O-CD2 3.14Å; C13-Y17 PolarHBondContact O-N 3.05Å; Y17-F20 PolarHBondContact O-N 3.24Å; Y17-F21 WeakPolarHBondContact O-CB 3.33Å; Y17-F21 PolarHBondContact O-N 3.42Å
18	A	57.4	Low	53	Low	57 Å²	57	119 Å²	119	47%	0.471	59%	0.586	S	S	.	*	H	α-helix	trans	-63	-43.9	176.3	0	0	0	0	0	111.6	M14 R15 F21 H22	M14-A18 WeakPolarHBondContact O-CB 3.16Å; M14-A18 PolarHBondContact O-N 3.43Å; R15-A18 PolarHBondContact O-N 2.89Å; A18-F21 PolarHBondContact O-N 2.91Å; A18-H22 VanDerWaalsContact O-CB 3.27Å; A18-H22 WeakPolarHBondContact O-CB 3.43Å; A18-H22 PolarHBondContact O-N 3.45Å
19	H	59.3	Low	54.4	Low	116 Å²	116	118.5 Å²	118.5	54%	0.537	57%	0.572	S	S	.	*	H	α-helix	trans	-65.6	-41.3	177.7	-171.4	-99.5	0	0	0	112.1	R15 V16 H22 Q23	R15-H19 VanDerWaalsContact O-CB 3.31Å; R15-H19 WeakPolarHBondContact O-CB 3.48Å; R15-H19 PolarHBondContact O-N 2.96Å; V16-H19 PolarHBondContact O-N 3.05Å; H19-H22 PolarHBondContact O-N 3.33Å; H19-Q23 PolarHBondContact CE1-NE2 3.03Å; H19-Q23 WeakPolarHBondContact O-CB 3.32Å; H19-Q23 PolarHBondContact O-N 3.05Å
20	F	53.5	Low	55.7	Low	144 Å²	144	123.5 Å²	123.5	63%	0.632	57%	0.569	S	S	*	*	H	α-helix	trans	-67.8	-40.1	176.5	-134.8	-89.9	0	0	0	112	V16 Y17 R24	V16-F20 WeakPolarHBondContact O-CB 3.46Å; V16-F20 PolarHBondContact O-N 3.41Å; Y17-F20 PolarHBondContact O-N 3.24Å; F20-R24 VanDerWaalsContact O-CB 3.29Å; F20-R24 WeakPolarHBondContact O-CB 3.4Å; F20-R24 PolarHBondContact O-N 3.17Å
21	F	55.4	Low	56.5	Low	139 Å²	139	121.6 Å²	121.6	61%	0.61	56%	0.564	S	S	*	*	H	α-helix	trans	-68.9	-38.4	176.7	-156.5	-90.8	0	0	0	110.9	Y17 A18 R24 M25	Y17-F21 WeakPolarHBondContact O-CB 3.33Å; Y17-F21 PolarHBondContact O-N 3.42Å; A18-F21 PolarHBondContact O-N 2.91Å; F21-R24 PolarHBondContact O-N 3.4Å; F21-M25 HydrophobicContact CD1-CG 3.68Å; F21-M25 HydrophobicContact CE1-CE 4.24Å; F21-M25 HydrophobicContact CE1-CG 3.62Å; F21-M25 HydrophobicContact CE1-SD 4.13Å; F21-M25 HydrophobicContact CZ-CG 4.44Å; F21-M25 VanDerWaalsContact O-CB 3.26Å; F21-M25 WeakPolarHBondContact O-CB 3.41Å; F21-M25 WeakPolarHBondContact O-CG 3.31Å; F21-M25 PolarHBondContact O-N 2.87Å
22	H	60.2	Low	57	Low	129 Å²	129	118.4 Å²	118.4	60%	0.597	55%	0.552	S	S	*	*	H	α-helix	trans	-69.1	-42.3	176.5	-138.8	-34.3	0	0	0	111.7	A18 H19 R24 M25 E26	A18-H22 VanDerWaalsContact O-CB 3.27Å; A18-H22 WeakPolarHBondContact O-CB 3.43Å; A18-H22 PolarHBondContact O-N 3.45Å; H19-H22 PolarHBondContact O-N 3.33Å; H22-R24 VanDerWaalsContact C-N 3.34Å; H22-R24 PolarHBondContact O-N 2.91Å; H22-M25 PolarHBondContact O-N 3.3Å; H22-E26 VanDerWaalsContact O-CB 3.27Å; H22-E26 WeakPolarHBondContact O-CB 3.35Å; H22-E26 PolarHBondContact O-N 2.86Å
23	Q	60.2	Low	57.7	Low	89 Å²	89	123 Å²	123	42%	0.416	56%	0.556	S	S	.	*	H	α-helix	trans	-62.9	-39	173.1	-92	-176.3	-0.5	0	0	112.4	H19 R27	H19-Q23 PolarHBondContact CE1-NE2 3.03Å; H19-Q23 WeakPolarHBondContact O-CB 3.32Å; H19-Q23 PolarHBondContact O-N 3.05Å; Q23-R27 WeakPolarHBondContact O-CB 3.46Å; Q23-R27 WeakPolarHBondContact O-CG 3.29Å; Q23-R27 PolarHBondContact O-N 3.33Å
24	R	54.4	Low	58.4	Low	182 Å²	182	126.3 Å²	126.3	69%	0.687	57%	0.566	S	S	*	*	H	α-helix	trans	-69.1	-41.7	176.6	-171.8	171.6	175.9	120.1	-2.4	111.7	F20 F21 H22 L28	F20-R24 VanDerWaalsContact O-CB 3.29Å; F20-R24 WeakPolarHBondContact O-CB 3.4Å; F20-R24 PolarHBondContact O-N 3.17Å; F21-R24 PolarHBondContact O-N 3.4Å; H22-R24 VanDerWaalsContact C-N 3.34Å; H22-R24 PolarHBondContact O-N 2.91Å; R24-L28 WeakPolarHBondContact O-CB 3.46Å; R24-L28 PolarHBondContact O-N 3.22Å
25	M	61	Low	58.8	Low	76 Å²	76	121.9 Å²	121.9	37%	0.374	55%	0.549	S	S	.	.	H	α-helix	trans	-70.7	-32.3	177.3	-72	-68.1	-92.4	0	0	112.3	F21 H22 L28 R29	F21-M25 HydrophobicContact CD1-CG 3.68Å; F21-M25 HydrophobicContact CE1-CE 4.24Å; F21-M25 HydrophobicContact CE1-CG 3.62Å; F21-M25 HydrophobicContact CE1-SD 4.13Å; F21-M25 HydrophobicContact CZ-CG 4.44Å; F21-M25 VanDerWaalsContact O-CB 3.26Å; F21-M25 WeakPolarHBondContact O-CB 3.41Å; F21-M25 WeakPolarHBondContact O-CG 3.31Å; F21-M25 PolarHBondContact O-N 2.87Å; H22-M25 PolarHBondContact O-N 3.3Å; M25-L28 PolarHBondContact O-N 3.06Å; M25-R29 WeakPolarHBondContact O-CB 3.42Å; M25-R29 VanDerWaalsContact O-CG 3.32Å; M25-R29 WeakPolarHBondContact O-CG 3.4Å; M25-R29 PolarHBondContact O-N 3.26Å
26	E	63.1	Low	58.6	Low	77 Å²	77	120.5 Å²	120.5	36%	0.36	55%	0.549	S	S	.	.	H	α-helix	trans	-74.5	-35.9	176.4	-151.5	57.6	-142.9	0	0	111.7	H22 R29 R30	H22-E26 VanDerWaalsContact O-CB 3.27Å; H22-E26 WeakPolarHBondContact O-CB 3.35Å; H22-E26 PolarHBondContact O-N 2.86Å; E26-R29 PolarHBondContact O-N 3.45Å; E26-R30 WeakPolarHBondContact O-CB 3.32Å; E26-R30 VanDerWaalsContact O-CG 3.25Å; E26-R30 WeakPolarHBondContact O-CG 3.41Å; E26-R30 PolarHBondContact O-N 3.38Å
27	R	61.7	Low	58.5	Low	178 Å²	178	124.9 Å²	124.9	67%	0.672	56%	0.555	S	S	*	*	H	α-helix	trans	-64.2	-39.6	168.1	-74.5	178	-175.9	167.9	3.5	111.7	Q23 S31	Q23-R27 WeakPolarHBondContact O-CB 3.46Å; Q23-R27 WeakPolarHBondContact O-CG 3.29Å; Q23-R27 PolarHBondContact O-N 3.33Å; R27-S31 VanDerWaalsContact O-CB 3.23Å; R27-S31 WeakPolarHBondContact O-CB 3.5Å; R27-S31 PolarHBondContact O-N 3.45Å
28	L	62.1	Low	58.6	Low	93 Å²	93	125.1 Å²	125.1	49%	0.487	55%	0.554	S	S	.	*	H	α-helix	trans	-66.6	-41.8	175	-139.5	89.1	0	0	0	111.6	R24 M25 S31 L32	R24-L28 WeakPolarHBondContact O-CB 3.46Å; R24-L28 PolarHBondContact O-N 3.22Å; M25-L28 PolarHBondContact O-N 3.06Å; L28-S31 PolarHBondContact O-N 3.03Å; L28-L32 HydrophobicContact CD2-CD1 4.42Å; L28-L32 VanDerWaalsContact O-CB 3.31Å; L28-L32 WeakPolarHBondContact O-CB 3.37Å; L28-L32 VanDerWaalsContact O-CG 3.29Å; L28-L32 WeakPolarHBondContact O-CG 3.33Å; L28-L32 PolarHBondContact O-N 2.94Å
29	R	67	Low	58.1	Low	160 Å²	160	125 Å²	125	60%	0.604	55%	0.554	S	S	*	*	H	α-helix	trans	-65.8	-42.2	176.3	-81	-178.2	127.8	87	1.5	112.2	M25 E26 L32 R33	M25-R29 WeakPolarHBondContact O-CB 3.42Å; M25-R29 VanDerWaalsContact O-CG 3.32Å; M25-R29 WeakPolarHBondContact O-CG 3.4Å; M25-R29 PolarHBondContact O-N 3.26Å; E26-R29 PolarHBondContact O-N 3.45Å; R29-L32 PolarHBondContact O-N 3.31Å; R29-R33 WeakPolarHBondContact O-CB 3.47Å; R29-R33 PolarHBondContact O-N 3.41Å
30	R	65.4	Low	57.3	Low	174 Å²	174	124.4 Å²	124.4	66%	0.657	56%	0.562	S	S	*	*	H	α-helix	trans	-64.2	-46.2	173.6	-73.4	178	-173.2	-164	1.9	110.7	E26 L32 R33 Q34	E26-R30 WeakPolarHBondContact O-CB 3.32Å; E26-R30 VanDerWaalsContact O-CG 3.25Å; E26-R30 WeakPolarHBondContact O-CG 3.41Å; E26-R30 PolarHBondContact O-N 3.38Å; R30-L32 VanDerWaalsContact C-N 3.33Å; R30-L32 PolarHBondContact O-N 3.03Å; R30-R33 PolarHBondContact O-N 3.43Å; R30-Q34 WeakPolarHBondContact O-CB 3.34Å; R30-Q34 PolarHBondContact O-N 2.89Å
31	S	60.6	Low	57	Low	71 Å²	71	121.8 Å²	121.8	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-59.2	-42.7	174.8	-176.8	0	0	0	0	111.8	R27 L28 Q34 S35	R27-S31 VanDerWaalsContact O-CB 3.23Å; R27-S31 WeakPolarHBondContact O-CB 3.5Å; R27-S31 PolarHBondContact O-N 3.45Å; L28-S31 PolarHBondContact O-N 3.03Å; S31-Q34 PolarHBondContact O-N 3.4Å; S31-S35 WeakPolarHBondContact O-CB 3.23Å; S31-S35 PolarHBondContact O-N 2.94Å; S31-S35 PolarHBondContact O-OG 3.43Å
32	L	60.4	Low	56.7	Low	78 Å²	78	121 Å²	121	41%	0.408	56%	0.56	S	S	.	*	H	α-helix	trans	-67.3	-46.7	177.9	-78	164.6	0	0	0	111.5	L28 R29 R30 Q34 S35 F36	L28-L32 HydrophobicContact CD2-CD1 4.42Å; L28-L32 VanDerWaalsContact O-CB 3.31Å; L28-L32 WeakPolarHBondContact O-CB 3.37Å; L28-L32 VanDerWaalsContact O-CG 3.29Å; L28-L32 WeakPolarHBondContact O-CG 3.33Å; L28-L32 PolarHBondContact O-N 2.94Å; R29-L32 PolarHBondContact O-N 3.31Å; R30-L32 VanDerWaalsContact C-N 3.33Å; R30-L32 PolarHBondContact O-N 3.03Å; L32-Q34 VanDerWaalsContact C-N 3.29Å; L32-Q34 PolarHBondContact O-N 3.11Å; L32-S35 VanDerWaalsContact CA-OG 3.23Å; L32-S35 WeakPolarHBondContact CA-OG 3.37Å; L32-S35 CarbonylContact O-C 3.6Å; L32-S35 PolarHBondContact O-N 3.06Å; L32-S35 PolarHBondContact O-OG 2.97Å; L32-F36 HydrophobicContact CB-CD2 4.31Å; L32-F36 HydrophobicContact CB-CE2 4.19Å; L32-F36 HydrophobicContact CD2-CE2 3.98Å; L32-F36 WeakPolarHBondContact O-CB 3.1Å; L32-F36 WeakPolarHBondContact O-CD2 3.18Å; L32-F36 PolarHBondContact O-N 3.32Å
33	R	63.5	Low	55.6	Low	181 Å²	181	121.6 Å²	121.6	68%	0.683	57%	0.568	S	S	*	*	H	α-helix	trans	-60.1	-38.3	175.2	-104	-174.4	178.5	-141.7	-0.5	112.4	R29 R30 R37	R29-R33 WeakPolarHBondContact O-CB 3.47Å; R29-R33 PolarHBondContact O-N 3.41Å; R30-R33 PolarHBondContact O-N 3.43Å; R33-R37 WeakPolarHBondContact O-CG 3.46Å; R33-R37 PolarHBondContact O-N 3.25Å
34	Q	56.6	Low	54.7	Low	127 Å²	127	128.8 Å²	128.8	59%	0.593	59%	0.591	S	S	*	*	H	α-helix	trans	-74.4	-35.7	178.7	-136.4	161.3	22.6	0	0	111.4	R30 S31 L32 R38	R30-Q34 WeakPolarHBondContact O-CB 3.34Å; R30-Q34 PolarHBondContact O-N 2.89Å; S31-Q34 PolarHBondContact O-N 3.4Å; L32-Q34 VanDerWaalsContact C-N 3.29Å; L32-Q34 PolarHBondContact O-N 3.11Å; Q34-R38 WeakPolarHBondContact O-CB 3.5Å; Q34-R38 PolarHBondContact O-N 3.05Å
35	S	54.4	Low	54.2	Low	53 Å²	53	122.8 Å²	122.8	37%	0.371	59%	0.586	S	S	.	*	H	α-helix	trans	-71.6	-31.6	172	52.2	0	0	0	0	113.3	S31 L32 A39	S31-S35 WeakPolarHBondContact O-CB 3.23Å; S31-S35 PolarHBondContact O-N 2.94Å; S31-S35 PolarHBondContact O-OG 3.43Å; L32-S35 VanDerWaalsContact CA-OG 3.23Å; L32-S35 WeakPolarHBondContact CA-OG 3.37Å; L32-S35 CarbonylContact O-C 3.6Å; L32-S35 PolarHBondContact O-N 3.06Å; L32-S35 PolarHBondContact O-OG 2.97Å; S35-A39 WeakPolarHBondContact O-CB 3.19Å; S35-A39 PolarHBondContact O-N 3.42Å
36	F	52.6	Low	53.5	Low	147 Å²	147	126.3 Å²	126.3	65%	0.645	60%	0.602	S	S	*	*	H	α-helix	trans	-74.6	-33.2	173.8	-76.2	-65.3	0	0	0	112.4	L32 S40	L32-F36 HydrophobicContact CB-CD2 4.31Å; L32-F36 HydrophobicContact CB-CE2 4.19Å; L32-F36 HydrophobicContact CD2-CE2 3.98Å; L32-F36 WeakPolarHBondContact O-CB 3.1Å; L32-F36 WeakPolarHBondContact O-CD2 3.18Å; L32-F36 PolarHBondContact O-N 3.32Å; F36-S40 PolarHBondContact O-N 2.93Å; F36-S40 VanDerWaalsContact O-N 3.17Å
37	R	53.7	Low	52.8	Low	186 Å²	186	129.8 Å²	129.8	70%	0.702	62%	0.622	S	S	*	*	H	α-helix	trans	-71.3	-38	171.9	-75.6	-176	-176	-174.7	-0.2	112.8	R33	R33-R37 WeakPolarHBondContact O-CG 3.46Å; R33-R37 PolarHBondContact O-N 3.25Å
38	R	49	Very low	52.5	Low	170 Å²	170	123.4 Å²	123.4	64%	0.642	61%	0.606	S	S	*	*	H	α-helix	trans	-71.8	-39.8	172.4	-76.5	-177.4	174.8	172.2	-1.8	112.6	Q34 S40 S41 E42	Q34-R38 WeakPolarHBondContact O-CB 3.5Å; Q34-R38 PolarHBondContact O-N 3.05Å; R38-S40 PolarHBondContact O-N 3.39Å; R38-S41 PolarHBondContact O-N 3.3Å; R38-S41 PolarHBondContact O-OG 3.32Å; R38-E42 WeakPolarHBondContact O-CB 3Å; R38-E42 PolarHBondContact O-N 3.06Å
39	A	46.9	Very low	52.2	Low	55 Å²	55	126.4 Å²	126.4	46%	0.455	62%	0.616	S	S	.	*	H	α-helix	trans	-61.9	-25.2	174.5	0	0	0	0	0	112.8	S35	S35-A39 WeakPolarHBondContact O-CB 3.19Å; S35-A39 PolarHBondContact O-N 3.42Å
40	S	42.9	Very low	52	Low	103 Å²	103	123.1 Å²	123.1	72%	0.72	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-19	173.8	-169.4	0	0	0	0	113.9	F36 R38	F36-S40 PolarHBondContact O-N 2.93Å; F36-S40 VanDerWaalsContact O-N 3.17Å; R38-S40 PolarHBondContact O-N 3.39Å
41	S	46.7	Very low	52.5	Low	90 Å²	90	120.3 Å²	120.3	63%	0.629	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-19.2	175.2	59.5	0	0	0	0	113.7	R38	R38-S41 PolarHBondContact O-N 3.3Å; R38-S41 PolarHBondContact O-OG 3.32Å
42	E	47.6	Very low	53.5	Low	121 Å²	121	117.9 Å²	117.9	57%	0.565	60%	0.598	S	S	*	*	S	Bend	trans	-94	2.7	-174.7	-141.1	156.1	159.4	0	0	113.2	R38	R38-E42 WeakPolarHBondContact O-CB 3Å; R38-E42 PolarHBondContact O-N 3.06Å
43	N	39	Very low	54.9	Low	142 Å²	142	118.9 Å²	118.9	76%	0.759	60%	0.596	S	S	*	*			trans	-103.9	17.2	-179.2	-150.8	16	0	0	0	113.7	G45	N43-G45 PolarHBondContact O-N 2.86Å
44	R	41	Very low	56.1	Low	240 Å²	240	115.2 Å²	115.2	91%	0.906	59%	0.59	S	S	*	*	S	Bend	trans	-78.3	106.5	161.5	-112.1	-178.2	-155.2	-167.5	5.6	106.9
45	G	43.2	Very low	57.7	Low	57 Å²	57	115.1 Å²	115.1	59%	0.588	59%	0.589	S	S	*	*			trans	-38.9	133.3	-176.5	0	0	0	0	0	114.3	N43 I47	N43-G45 PolarHBondContact O-N 2.86Å; G45-I47 PolarHBondContact O-N 3.45Å
46	Q	45.6	Very low	59.5	Low	149 Å²	149	112.9 Å²	112.9	70%	0.696	57%	0.574	S	S	*	*	S	Bend		60.8	50.7	88.4	-67.1	-178.1	18	0	0	112.7
47	I	48.4	Very low	61.4	Low	151 Å²	151	108.2 Å²	108.2	77%	0.774	56%	0.555	S	S	*	*			trans	-158.4	114.3	137.8	-82.8	132.6	0	0	0	101.6	G45 K49	G45-I47 PolarHBondContact O-N 3.45Å; I47-K49 PolarHBondContact O-N 2.99Å
48	A	55.2	Low	63.3	Low	43 Å²	43	104 Å²	104	36%	0.355	55%	0.55	S	S	.	*			trans	-56.5	120	170.4	0	0	0	0	0	106.7	A52	A48-A52 HydrophobicContact CB-CB 4.31Å
49	K	56	Low	65.4	Low	156 Å²	156	97.1 Å²	97.1	68%	0.678	53%	0.528	S	S	*	.			trans	-52.9	141.5	169.9	-69.8	179.7	178.4	-178.7	0	107.1	I47 D51 A52	I47-K49 PolarHBondContact O-N 2.99Å; K49-D51 PolarHBondContact O-N 3.12Å; K49-A52 WeakPolarHBondContact O-CB 3.19Å; K49-A52 PolarHBondContact O-N 3.01Å
50	P	64.3	Low	67.7	Low	92 Å²	92	94.5 Å²	94.5	60%	0.597	51%	0.506	S	S	*	.	H	α-helix	trans	-50.7	-28.3	-178.5	19	-32.1	0	0	0	112.7	A52 W53 N54	P50-A52 VanDerWaalsContact C-N 3.29Å; P50-A52 PolarHBondContact O-N 2.98Å; P50-W53 PolarHBondContact O-N 3.21Å; P50-N54 PolarHBondContact O-N 3.04Å; P50-N54 PolarHBondContact O-ND2 2.9Å
51	D	75.4	Confident	70.1	Confident	114 Å²	114	95.3 Å²	95.3	61%	0.61	49%	0.494	S	S	*	.	H	α-helix	trans	-55.4	-37.9	173.8	-56.7	-27	0	0	0	114	K49 W53 N54 E55	K49-D51 PolarHBondContact O-N 3.12Å; D51-W53 VanDerWaalsContact C-N 3.34Å; D51-W53 PolarHBondContact O-N 2.84Å; D51-N54 PolarHBondContact O-N 3.19Å; D51-E55 PolarHBondContact O-N 3.43Å
52	A	81.7	Confident	72.2	Confident	21 Å²	21	94.3 Å²	94.3	17%	0.174	49%	0.491	C	S	.	.	H	α-helix	trans	-69.2	-32.3	-177.8	0	0	0	0	0	112.3	A48 K49 P50 D56	A48-A52 HydrophobicContact CB-CB 4.31Å; K49-A52 WeakPolarHBondContact O-CB 3.19Å; K49-A52 PolarHBondContact O-N 3.01Å; P50-A52 VanDerWaalsContact C-N 3.29Å; P50-A52 PolarHBondContact O-N 2.98Å; A52-D56 PolarHBondContact O-N 3.49Å; A52-D56 VanDerWaalsContact O-N 3.16Å
53	W	88.8	Confident	74.2	Confident	98 Å²	98	90.4 Å²	90.4	37%	0.371	48%	0.482	S	S	.	.	H	α-helix	trans	-75.4	-35.7	178.2	-66.8	3.4	0	0	0	111.6	P50 D51 D56 D57 H208	P50-W53 PolarHBondContact O-N 3.21Å; D51-W53 VanDerWaalsContact C-N 3.34Å; D51-W53 PolarHBondContact O-N 2.84Å; W53-D56 PolarHBondContact O-N 2.94Å; W53-D57 PolarHBondContact O-N 3.03Å; W53-D57 VanDerWaalsContact O-N 3.09Å; W53-H208 PolarHBondContact O-CE1 3.12Å
54	N	90	Very high	76.6	Confident	104 Å²	104	88.2 Å²	88.2	56%	0.556	47%	0.474	S	S	*	.	H	α-helix	trans	-65.7	-41.1	173.6	-69	-28.4	0	0	0	111.4	P50 D51 D56 D57 V58	P50-N54 PolarHBondContact O-N 3.04Å; P50-N54 PolarHBondContact O-ND2 2.9Å; D51-N54 PolarHBondContact O-N 3.19Å; N54-D56 VanDerWaalsContact C-N 3.28Å; N54-D56 PolarHBondContact O-N 3.36Å; N54-D57 PolarHBondContact O-N 3.4Å; N54-V58 PolarHBondContact O-N 3.02Å
55	E	90.3	Very high	79.1	Confident	125 Å²	125	77 Å²	77	58%	0.584	43%	0.433	S	S	*	.	H	α-helix	trans	-60.6	-39.4	173.6	-173.5	179.4	-175.6	0	0	111.7	D51 V58 S59	D51-E55 PolarHBondContact O-N 3.43Å; E55-V58 PolarHBondContact O-N 3.11Å; E55-S59 VanDerWaalsContact O-CB 3.24Å; E55-S59 WeakPolarHBondContact O-CB 3.5Å; E55-S59 PolarHBondContact O-N 2.87Å; E55-S59 PolarHBondContact O-OG 3.46Å
56	D	91.6	Very high	81.5	Confident	7 Å²	7	77 Å²	77	4%	0.037	42%	0.424	C	S	.	.	H	α-helix	trans	-63.9	-41	176.2	-66.5	-22.6	0	0	0	111.6	A52 W53 N54 S59 V60 R205	A52-D56 PolarHBondContact O-N 3.49Å; A52-D56 VanDerWaalsContact O-N 3.16Å; W53-D56 PolarHBondContact O-N 2.94Å; N54-D56 VanDerWaalsContact C-N 3.28Å; N54-D56 PolarHBondContact O-N 3.36Å; D56-S59 PolarHBondContact O-N 3.47Å; D56-V60 WeakPolarHBondContact O-CB 3.22Å; D56-V60 VanDerWaalsContact O-CG2 3.22Å; D56-V60 WeakPolarHBondContact O-CG2 3.29Å; D56-V60 PolarHBondContact O-N 2.86Å; D56-R205 IonicContact OD1-CZ 2.82Å; D56-R205 IonicContact OD1-NE 2.99Å; D56-R205 IonicContact OD1-NH2 3.64Å; D56-R205 PolarHBondContact OD1-NH2 2.95Å; D56-R205 WeakPolarHBondContact OD2-CG 3.48Å; D56-R205 IonicContact OD2-CZ 3.38Å; D56-R205 IonicContact OD2-NE 3.04Å; D56-R205 PolarHBondContact OD2-NE 3.4Å; D56-R205 IonicContact OD2-NH2 3.65Å; D56-R205 PolarHBondContact OD2-NH2 3.39Å
57	D	92.9	Very high	83.8	Confident	48 Å²	48	70.2 Å²	70.2	26%	0.257	39%	0.392	S	S	.	.	H	α-helix	trans	-61.3	-48.4	176.9	-175.4	34.6	0	0	0	111.8	W53 N54 S59 V60 R61	W53-D57 PolarHBondContact O-N 3.03Å; W53-D57 VanDerWaalsContact O-N 3.09Å; N54-D57 PolarHBondContact O-N 3.4Å; D57-S59 VanDerWaalsContact C-N 3.29Å; D57-S59 PolarHBondContact O-N 3.08Å; D57-V60 PolarHBondContact O-N 3.37Å; D57-R61 WeakPolarHBondContact O-CG 3.35Å; D57-R61 PolarHBondContact O-N 3.21Å; D57-R61 IonicContact OD1-NE 3.9Å; D57-R61 IonicContact OD2-NE 3.07Å
58	V	93.2	Very high	86	Confident	99 Å²	99	64.2 Å²	64.2	60%	0.6	37%	0.365	S	S	*	.	H	α-helix	trans	-60.6	-42.1	175.9	179.3	0	0	0	0	110.6	N54 E55 R61 A62	N54-V58 PolarHBondContact O-N 3.02Å; E55-V58 PolarHBondContact O-N 3.11Å; V58-R61 PolarHBondContact O-N 3.3Å; V58-A62 WeakPolarHBondContact O-CB 3.21Å; V58-A62 PolarHBondContact O-N 3.11Å
59	S	93	Very high	87.9	Confident	24 Å²	24	62.1 Å²	62.1	17%	0.168	35%	0.348	C	S	.	.	H	α-helix	trans	-68.3	-35.8	179.9	-61.7	0	0	0	0	113	E55 D56 D57 A62 G63 T64 C65	E55-S59 VanDerWaalsContact O-CB 3.24Å; E55-S59 WeakPolarHBondContact O-CB 3.5Å; E55-S59 PolarHBondContact O-N 2.87Å; E55-S59 PolarHBondContact O-OG 3.46Å; D56-S59 PolarHBondContact O-N 3.47Å; D57-S59 VanDerWaalsContact C-N 3.29Å; D57-S59 PolarHBondContact O-N 3.08Å; S59-A62 CarbonylContact O-C 3.53Å; S59-A62 PolarHBondContact O-N 3.26Å; S59-G63 PolarHBondContact O-N 2.99Å; S59-T64 PolarHBondContact O-N 3.11Å; S59-T64 PolarHBondContact O-OG1 3.21Å; S59-C65 PolarHBondContact O-N 3.22Å
60	V	94.6	Very high	89.7	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-68.8	-40.8	175.9	169.1	0	0	0	0	110.4	D56 D57 A62 G63 C65 I107 A209 C212 A213	D56-V60 WeakPolarHBondContact O-CB 3.22Å; D56-V60 VanDerWaalsContact O-CG2 3.22Å; D56-V60 WeakPolarHBondContact O-CG2 3.29Å; D56-V60 PolarHBondContact O-N 2.86Å; D57-V60 PolarHBondContact O-N 3.37Å; V60-A62 VanDerWaalsContact C-N 3.32Å; V60-G63 PolarHBondContact O-N 3.49Å; V60-C65 HydrophobicContact CB-CB 4.39Å; V60-C65 HydrophobicContact CG2-CB 3.56Å; V60-I107 HydrophobicContact CG2-CG2 4.06Å; V60-A209 HydrophobicContact CG2-CB 4.09Å; V60-C212 HydrophobicContact CB-CB 4.33Å; V60-C212 HydrophobicContact CG1-CB 4.2Å; V60-C212 HydrophobicContact CG2-CB 4.49Å; V60-A213 HydrophobicContact CG1-CB 3.73Å
61	R	93.2	Very high	91.2	Very high	120 Å²	120	55.2 Å²	55.2	45%	0.453	31%	0.308	S	S	.	.	H	α-helix	trans	-63.7	-37.6	173.2	-73.5	177.7	179.7	-88.7	-0.7	112	D57 V58 G63 V216 E219	D57-R61 WeakPolarHBondContact O-CG 3.35Å; D57-R61 PolarHBondContact O-N 3.21Å; D57-R61 IonicContact OD1-NE 3.9Å; D57-R61 IonicContact OD2-NE 3.07Å; V58-R61 PolarHBondContact O-N 3.3Å; R61-G63 VanDerWaalsContact C-N 3.35Å; R61-V216 HydrophobicContact CG-CG2 3.61Å; R61-E219 IonicContact NH1-OE2 2.76Å; R61-E219 PolarHBondContact NH1-OE2 3.23Å; R61-E219 IonicContact NH2-OE2 3.78Å
62	A	91.9	Very high	92.1	Very high	69 Å²	69	50.9 Å²	50.9	57%	0.57	28%	0.284	S	S	*	.	H	α-helix	trans	-77.4	-15.4	175.7	0	0	0	0	0	114.1	V58 S59 V60 T64	V58-A62 WeakPolarHBondContact O-CB 3.21Å; V58-A62 PolarHBondContact O-N 3.11Å; S59-A62 CarbonylContact O-C 3.53Å; S59-A62 PolarHBondContact O-N 3.26Å; V60-A62 VanDerWaalsContact C-N 3.32Å; A62-T64 HydrophobicContact CB-CG2 4.49Å
63	G	89.4	Confident	92.6	Very high	38 Å²	38	50.6 Å²	50.6	39%	0.392	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	18.5	-177.3	0	0	0	0	0	114.6	S59 V60 R61	S59-G63 PolarHBondContact O-N 2.99Å; V60-G63 PolarHBondContact O-N 3.49Å; R61-G63 VanDerWaalsContact C-N 3.35Å
64	T	89.9	Confident	92.8	Very high	96 Å²	96	49 Å²	49	59%	0.589	29%	0.287	S	S	*	.			trans	-106.8	-2.7	-177.6	54.6	0	0	0	0	113.5	S59 A62 S66	S59-T64 PolarHBondContact O-N 3.11Å; S59-T64 PolarHBondContact O-OG1 3.21Å; A62-T64 HydrophobicContact CB-CG2 4.49Å; T64-S66 PolarHBondContact O-N 3.16Å
65	C	93.5	Very high	93	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.034	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	126.2	-178.5	-171.6	0	0	0	0	111.9	S59 V60 F67 I107	S59-C65 PolarHBondContact O-N 3.22Å; V60-C65 HydrophobicContact CB-CB 4.39Å; V60-C65 HydrophobicContact CG2-CB 3.56Å; C65-F67 WeakPolarHBondContact SG-CE2 3.37Å; C65-I107 HydrophobicContact CB-CB 4.45Å; C65-I107 WeakPolarHBondContact CB-O 3.36Å; C65-I107 PolarHBondContact O-N 2.86Å
66	S	92.8	Very high	93.2	Very high	58 Å²	58	43.7 Å²	43.7	41%	0.406	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	139.2	-178.5	72.7	0	0	0	0	113	T64 L105	T64-S66 PolarHBondContact O-N 3.16Å; S66-L105 CarbonylContact C-O 3.57Å; S66-L105 VanDerWaalsContact CA-O 3.3Å; S66-L105 WeakPolarHBondContact CA-O 3.29Å
67	F	94.1	Very high	93.4	Very high	6 Å²	6	44 Å²	44	3%	0.026	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.5	-177.4	-64.5	-76.2	0	0	0	111.7	C65 V69 I104 L105 I107 D201 R205 L206 A209	C65-F67 WeakPolarHBondContact SG-CE2 3.37Å; F67-V69 HydrophobicContact CB-CG1 4.2Å; F67-V69 PolarHBondContact O-N 3.44Å; F67-I104 CarbonylContact O-C 3.53Å; F67-I104 VanDerWaalsContact O-CA 3.3Å; F67-I104 WeakPolarHBondContact O-CA 3.4Å; F67-L105 PolarHBondContact N-O 3.44Å; F67-L105 PolarHBondContact O-N 2.89Å; F67-I107 HydrophobicContact CD2-CD1 3.59Å; F67-I107 HydrophobicContact CD2-CG1 4.29Å; F67-I107 HydrophobicContact CE2-CD1 3.71Å; F67-D201 HydrophobicContact CD1-CB 4.4Å; F67-R205 HydrophobicContact CE1-CG 4.11Å; F67-R205 HydrophobicContact CZ-CG 4.32Å; F67-L206 HydrophobicContact CB-CD1 4.24Å; F67-L206 HydrophobicContact CB-CG 4.3Å; F67-L206 HydrophobicContact CD1-CD1 4.03Å; F67-L206 HydrophobicContact CD2-CG 4.26Å; F67-L206 HydrophobicContact CG-CD1 4.01Å; F67-L206 HydrophobicContact CG-CG 4.13Å; F67-A209 HydrophobicContact CE2-CB 3.59Å; F67-A209 HydrophobicContact CZ-CB 3.99Å
68	A	94.1	Very high	93.4	Very high	24 Å²	24	52 Å²	52	20%	0.198	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	116.1	173.9	0	0	0	0	0	110	I199	A68-I199 HydrophobicContact CB-CB 4.25Å; A68-I199 HydrophobicContact CB-CD1 4.29Å; A68-I199 WeakPolarHBondContact O-CB 3.3Å; A68-I199 PolarHBondContact O-N 3Å
69	V	95.2	Very high	93.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	159.1	-173.7	-56.9	0	0	0	0	112.4	F67 G103 L105 F196 H197 L206	F67-V69 HydrophobicContact CB-CG1 4.2Å; F67-V69 PolarHBondContact O-N 3.44Å; V69-G103 PolarHBondContact N-O 3.48Å; V69-G103 PolarHBondContact O-N 2.87Å; V69-L105 HydrophobicContact CB-CB 4.49Å; V69-L105 HydrophobicContact CG1-CB 3.96Å; V69-L105 HydrophobicContact CG1-CD2 4.38Å; V69-L105 HydrophobicContact CG2-CB 3.67Å; V69-F196 HydrophobicContact CG2-CD1 4.03Å; V69-H197 CarbonylContact C-O 3.54Å; V69-H197 WeakPolarHBondContact CA-O 3.16Å; V69-L206 HydrophobicContact CG1-CD2 3.65Å
70	K	94.6	Very high	93.6	Very high	77 Å²	77	53.1 Å²	53.1	34%	0.335	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.2	164.8	-149.6	-168.2	-163.4	-165.2	0	107.9	L72 S100 T101 R102 F196 H197	K70-L72 PolarHBondContact O-N 3.04Å; K70-S100 VanDerWaalsContact CD-OG 3.28Å; K70-S100 WeakPolarHBondContact CD-OG 3.47Å; K70-S100 WeakPolarHBondContact CE-OG 3.02Å; K70-S100 PolarHBondContact NZ-OG 3.38Å; K70-T101 CarbonylContact C-O 3.46Å; K70-T101 WeakPolarHBondContact CA-O 3.37Å; K70-R102 HydrophobicContact CG-CG 4.14Å; K70-F196 CarbonylContact O-C 3.31Å; K70-F196 WeakPolarHBondContact O-CA 3.17Å; K70-H197 HydrophobicContact CB-CB 4.09Å; K70-H197 PolarHBondContact N-O 2.94Å; K70-H197 PolarHBondContact O-N 2.99Å
71	Y	94.9	Very high	93.6	Very high	26 Å²	26	61.5 Å²	61.5	10%	0.102	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118.4	173.5	-177.7	-126.5	0	0	0	109.4	G73 S100 T101 I158 V159 H194 F196	Y71-G73 WeakPolarHBondContact CE2-O 3.16Å; Y71-S100 CarbonylContact O-C 3.54Å; Y71-S100 WeakPolarHBondContact O-CA 3.44Å; Y71-S100 WeakPolarHBondContact O-CB 3.43Å; Y71-T101 PolarHBondContact N-O 3.49Å; Y71-T101 PolarHBondContact O-N 2.98Å; Y71-I158 HydrophobicContact CD1-CG2 3.6Å; Y71-I158 HydrophobicContact CE1-CG2 3.82Å; Y71-I158 HydrophobicContact CG-CG2 4.48Å; Y71-V159 HydrophobicContact CD1-CG2 4.46Å; Y71-V159 HydrophobicContact CD2-CG2 4.39Å; Y71-V159 HydrophobicContact CE1-CG2 4.01Å; Y71-V159 HydrophobicContact CE2-CG2 3.93Å; Y71-H194 HydrophobicContact CE2-CB 4.37Å; Y71-H194 AromaticContact CE2-ND1 3.85Å; Y71-H194 AromaticContact CZ-ND1 3.85Å; Y71-H194 PolarHBondContact OH-ND1 3.23Å; Y71-F196 AromaticContact CD2-CD1 3.82Å; Y71-F196 HydrophobicContact CD2-CD1 3.82Å; Y71-F196 AromaticContact CD2-CE1 3.29Å; Y71-F196 HydrophobicContact CD2-CE1 3.29Å; Y71-F196 AromaticContact CD2-CZ 3.69Å; Y71-F196 HydrophobicContact CD2-CZ 3.69Å; Y71-F196 AromaticContact CE2-CE1 3.91Å; Y71-F196 HydrophobicContact CE2-CE1 3.91Å; Y71-F196 AromaticContact CE2-CZ 3.81Å; Y71-F196 HydrophobicContact CE2-CZ 3.81Å; Y71-F196 HydrophobicContact CG-CE1 4.19Å
72	L	94.2	Very high	93.7	Very high	22 Å²	22	56.9 Å²	56.9	12%	0.115	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	-33.4	179.9	-58.2	-179.7	0	0	0	111.5	K70 M90 L93 R94 G195 H197	K70-L72 PolarHBondContact O-N 3.04Å; L72-M90 HydrophobicContact CD1-CE 3.68Å; L72-M90 HydrophobicContact CD1-SD 4.02Å; L72-L93 HydrophobicContact CB-CB 4.08Å; L72-L93 HydrophobicContact CB-CD1 4.4Å; L72-L93 HydrophobicContact CD1-CB 4.41Å; L72-R94 HydrophobicContact CD1-CG 4.34Å; L72-G195 WeakPolarHBondContact CB-O 3.26Å; L72-G195 PolarHBondContact N-O 3.08Å; L72-H197 HydrophobicContact CD2-CB 4.46Å
73	G	92.8	Very high	93.8	Very high	15 Å²	15	56.9 Å²	56.9	16%	0.155	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137.5	-164.2	-177.8	0	0	0	0	0	111.7	Y71 G195	Y71-G73 WeakPolarHBondContact CE2-O 3.16Å; G73-G195 PolarHBondContact O-N 2.85Å
74	C	92.1	Very high	94.1	Very high	65 Å²	65	62 Å²	62	44%	0.439	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	150.7	171.6	56	0	0	0	0	110.5	C193	C74-C193 CarbonylContact C-O 3.47Å; C74-C193 WeakPolarHBondContact CA-O 3.3Å
75	V	94.1	Very high	94.4	Very high	34 Å²	34	59.2 Å²	59.2	21%	0.206	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	144.6	176.6	64	0	0	0	0	109	V77 A89 L92 L93 L192 C193	V75-V77 HydrophobicContact CG1-CG1 4.44Å; V75-A89 HydrophobicContact CG1-CB 3.44Å; V75-A89 VanDerWaalsContact CG1-CB 3.44Å; V75-L92 HydrophobicContact CG2-CD1 4.25Å; V75-L93 HydrophobicContact CB-CD2 4.33Å; V75-L93 HydrophobicContact CB-CG 4.44Å; V75-L93 HydrophobicContact CG1-CD1 4.38Å; V75-L93 HydrophobicContact CG1-CG 4.3Å; V75-L192 CarbonylContact O-C 3.58Å; V75-L192 WeakPolarHBondContact O-CA 3.36Å; V75-C193 HydrophobicContact CG1-CB 4.06Å; V75-C193 PolarHBondContact N-O 3.02Å; V75-C193 PolarHBondContact O-N 2.96Å
76	E	94.7	Very high	94.6	Very high	84 Å²	84	59.1 Å²	59.1	39%	0.393	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	135.1	174.9	-176.6	175.8	169.4	0	0	110.5	R190 W191 L192	E76-R190 VanDerWaalsContact CD-CD 3.48Å; E76-R190 VanDerWaalsContact CD-NH1 3.29Å; E76-R190 HydrophobicContact CG-CB 4.3Å; E76-R190 WeakPolarHBondContact OE1-CD 3.34Å; E76-R190 WeakPolarHBondContact OE1-CG 3.43Å; E76-R190 IonicContact OE1-CZ 3.51Å; E76-R190 IonicContact OE1-NE 3.52Å; E76-R190 IonicContact OE1-NH1 2.71Å; E76-R190 PolarHBondContact OE1-NH1 3.37Å; E76-R190 IonicContact OE2-CZ 3.73Å; E76-R190 IonicContact OE2-NH1 2.76Å; E76-R190 PolarHBondContact OE2-NH1 3.12Å; E76-W191 WeakPolarHBondContact CA-O 3.28Å; E76-L192 HydrophobicContact CB-CD2 4.22Å
77	V	95.8	Very high	94.7	Very high	14 Å²	14	57.8 Å²	57.8	9%	0.085	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.4	176.3	-64.3	0	0	0	0	110	V75 E79 I85 A89 I182 W191 C193	V75-V77 HydrophobicContact CG1-CG1 4.44Å; V77-E79 WeakPolarHBondContact CG2-O 3.42Å; V77-I85 HydrophobicContact CB-CG2 3.78Å; V77-I85 HydrophobicContact CG1-CG2 3.81Å; V77-I85 HydrophobicContact CG2-CG2 4.31Å; V77-A89 HydrophobicContact CG1-CB 4.21Å; V77-I182 HydrophobicContact CG2-CD1 4.49Å; V77-I182 HydrophobicContact CG2-CG1 4.42Å; V77-I182 HydrophobicContact CG2-CG2 3.93Å; V77-W191 HydrophobicContact CG2-CB 3.72Å; V77-W191 PolarHBondContact N-O 2.91Å; V77-W191 WeakPolarHBondContact O-CB 2.83Å; V77-C193 HydrophobicContact CG1-CB 3.54Å; V77-C193 HydrophobicContact CG2-CB 4.17Å
78	Y	93.7	Very high	94.8	Very high	215 Å²	215	62.1 Å²	62.1	84%	0.843	31%	0.306	S	S	*	.	S	Bend	trans	-82.2	-33.6	-179.7	-68.3	-77.4	0	0	0	112.3
79	E	95.8	Very high	94.9	Very high	110 Å²	110	61.1 Å²	61.1	51%	0.514	30%	0.298	S	S	.	.			trans	-101.7	145.6	-176.3	-63	-169.1	-170	0	0	112.2	V77 R81 I85	V77-E79 WeakPolarHBondContact CG2-O 3.42Å; E79-R81 VanDerWaalsContact C-N 3.29Å; E79-R81 PolarHBondContact O-N 2.9Å; E79-I85 HydrophobicContact CB-CD1 4.26Å; E79-I85 HydrophobicContact CB-CG1 4.08Å; E79-I85 HydrophobicContact CG-CD1 4.25Å
80	S	93.9	Very high	94.8	Very high	36 Å²	36	61.1 Å²	61.1	25%	0.252	30%	0.298	S	S	.	.	S	Bend	trans	-79.6	-11.8	179.3	66.7	0	0	0	0	113.8	S167 W191	S80-S167 WeakPolarHBondContact O-CB 3.33Å; S80-S167 PolarHBondContact O-OG 2.87Å; S80-W191 VanDerWaalsContact CB-CE2 3.43Å; S80-W191 VanDerWaalsContact CB-CZ2 3.41Å
81	R	95.1	Very high	94.8	Very high	178 Å²	178	64.5 Å²	64.5	67%	0.672	31%	0.313	S	S	*	.			trans	-157.1	150.3	-171.7	57.9	-174.5	171.4	90.8	-0.4	109.8	E79 F168	E79-R81 VanDerWaalsContact C-N 3.29Å; E79-R81 PolarHBondContact O-N 2.9Å; R81-F168 HydrophobicContact CB-CB 4.08Å; R81-F168 HydrophobicContact CB-CD2 4.24Å; R81-F168 HydrophobicContact CB-CG 4.11Å
82	G	95.3	Very high	94.8	Very high	22 Å²	22	68 Å²	68	23%	0.227	33%	0.332	C	S	.	.			trans	143.1	130.4	176.7	0	0	0	0	0	111.3	I85 C86	G82-I85 PolarHBondContact O-N 2.88Å; G82-C86 PolarHBondContact O-N 3.21Å
83	M	93.9	Very high	94.8	Very high	70 Å²	70	67.7 Å²	67.7	35%	0.345	33%	0.331	S	S	.	.	H	α-helix	trans	-63.5	-48	177	-173.3	66	69.8	0	0	110.8	I85 C86 E87 A170	M83-I85 VanDerWaalsContact C-N 3.25Å; M83-I85 PolarHBondContact O-N 3.42Å; M83-C86 WeakPolarHBondContact O-CB 3.42Å; M83-C86 PolarHBondContact O-N 2.99Å; M83-E87 WeakPolarHBondContact O-CG 3.49Å; M83-E87 PolarHBondContact O-N 3.36Å; M83-A170 HydrophobicContact CE-CB 3.82Å; M83-A170 HydrophobicContact SD-CB 3.42Å; M83-A170 WeakPolarHBondContact SD-CB 3.4Å
84	Q	96	Very high	94.7	Very high	146 Å²	146	70.5 Å²	70.5	68%	0.682	34%	0.337	S	S	*	.	H	α-helix	trans	-59.4	-37.2	178.9	-65.8	173.5	-6.5	0	0	111.8	C86 E87 D88	Q84-C86 PolarHBondContact O-N 3.39Å; Q84-E87 PolarHBondContact O-N 3.43Å; Q84-D88 WeakPolarHBondContact O-CB 2.97Å; Q84-D88 PolarHBondContact O-N 3.28Å
85	I	96.6	Very high	94.7	Very high	36 Å²	36	71.7 Å²	71.7	19%	0.185	35%	0.346	C	S	.	.	H	α-helix	trans	-63.5	-42.2	176.8	-52.5	-62.8	0	0	0	111.1	V77 E79 G82 M83 A89 I182	V77-I85 HydrophobicContact CB-CG2 3.78Å; V77-I85 HydrophobicContact CG1-CG2 3.81Å; V77-I85 HydrophobicContact CG2-CG2 4.31Å; E79-I85 HydrophobicContact CB-CD1 4.26Å; E79-I85 HydrophobicContact CB-CG1 4.08Å; E79-I85 HydrophobicContact CG-CD1 4.25Å; G82-I85 PolarHBondContact O-N 2.88Å; M83-I85 VanDerWaalsContact C-N 3.25Å; M83-I85 PolarHBondContact O-N 3.42Å; I85-A89 VanDerWaalsContact O-CB 3.22Å; I85-A89 WeakPolarHBondContact O-CB 3.15Å; I85-A89 PolarHBondContact O-N 3.34Å; I85-I182 HydrophobicContact CB-CD1 4.44Å; I85-I182 HydrophobicContact CG2-CD1 4.07Å
86	C	96.2	Very high	94.4	Very high	3 Å²	3	72.2 Å²	72.2	2%	0.02	35%	0.351	C	S	.	.	H	α-helix	trans	-66.5	-41.1	174.7	-72.9	0	0	0	0	112.2	G82 M83 Q84 A89 M90 A170 A180	G82-C86 PolarHBondContact O-N 3.21Å; M83-C86 WeakPolarHBondContact O-CB 3.42Å; M83-C86 PolarHBondContact O-N 2.99Å; Q84-C86 PolarHBondContact O-N 3.39Å; C86-A89 PolarHBondContact O-N 3.34Å; C86-M90 WeakPolarHBondContact O-CB 3.18Å; C86-M90 VanDerWaalsContact O-CG 3.22Å; C86-M90 WeakPolarHBondContact O-CG 3.08Å; C86-M90 PolarHBondContact O-N 3.21Å; C86-A170 HydrophobicContact CB-CB 4.1Å; C86-A180 HydrophobicContact CB-CB 4.1Å
87	E	95.5	Very high	93.7	Very high	30 Å²	30	80.2 Å²	80.2	14%	0.14	38%	0.378	C	S	.	.	H	α-helix	trans	-64.5	-45.7	177.7	-70.4	172.8	168.8	0	0	111.7	M83 Q84 M90 K91 R173	M83-E87 WeakPolarHBondContact O-CG 3.49Å; M83-E87 PolarHBondContact O-N 3.36Å; Q84-E87 PolarHBondContact O-N 3.43Å; E87-M90 PolarHBondContact O-N 3.32Å; E87-K91 WeakPolarHBondContact O-CB 3.25Å; E87-K91 PolarHBondContact O-N 3.2Å; E87-R173 WeakPolarHBondContact OE1-CB 3.37Å; E87-R173 WeakPolarHBondContact OE1-CD 3.18Å; E87-R173 WeakPolarHBondContact OE1-CG 3.4Å
88	D	96	Very high	92.9	Very high	97 Å²	97	86.5 Å²	86.5	52%	0.519	41%	0.406	S	S	.	.	H	α-helix	trans	-63.1	-43.8	176.2	-77.4	-19.6	0	0	0	111.7	Q84 M90 K91 L92	Q84-D88 WeakPolarHBondContact O-CB 2.97Å; Q84-D88 PolarHBondContact O-N 3.28Å; D88-M90 VanDerWaalsContact C-N 3.35Å; D88-M90 PolarHBondContact O-N 3.11Å; D88-K91 WeakPolarHBondContact O-CB 3.42Å; D88-K91 PolarHBondContact O-N 2.98Å; D88-L92 WeakPolarHBondContact O-CG 3.46Å; D88-L92 PolarHBondContact O-N 3.14Å
89	A	95.8	Very high	92.4	Very high	3 Å²	3	87.2 Å²	87.2	3%	0.025	41%	0.407	C	S	.	.	H	α-helix	trans	-59.6	-44.5	174	0	0	0	0	0	111.9	V75 V77 I85 C86 K91 L92 L93 C193	V75-A89 HydrophobicContact CG1-CB 3.44Å; V75-A89 VanDerWaalsContact CG1-CB 3.44Å; V77-A89 HydrophobicContact CG1-CB 4.21Å; I85-A89 VanDerWaalsContact O-CB 3.22Å; I85-A89 WeakPolarHBondContact O-CB 3.15Å; I85-A89 PolarHBondContact O-N 3.34Å; C86-A89 PolarHBondContact O-N 3.34Å; A89-K91 VanDerWaalsContact C-N 3.33Å; A89-K91 PolarHBondContact O-N 3.1Å; A89-L92 PolarHBondContact O-N 3.47Å; A89-L93 WeakPolarHBondContact O-CB 3.39Å; A89-L93 VanDerWaalsContact O-CG 3.3Å; A89-L93 WeakPolarHBondContact O-CG 3.46Å; A89-L93 PolarHBondContact O-N 2.81Å; A89-C193 HydrophobicContact CB-CB 3.73Å; A89-C193 WeakPolarHBondContact CB-SG 3.37Å
90	M	94.4	Very high	92.1	Very high	1 Å²	1	83.1 Å²	83.1	1%	0.005	39%	0.391	C	S	.	.	H	α-helix	trans	-63.9	-38.1	176.3	-76.5	-67.6	-70.3	0	0	112	L72 C86 E87 D88 L93 R94 A180 G195 F196	L72-M90 HydrophobicContact CD1-CE 3.68Å; L72-M90 HydrophobicContact CD1-SD 4.02Å; C86-M90 WeakPolarHBondContact O-CB 3.18Å; C86-M90 VanDerWaalsContact O-CG 3.22Å; C86-M90 WeakPolarHBondContact O-CG 3.08Å; C86-M90 PolarHBondContact O-N 3.21Å; E87-M90 PolarHBondContact O-N 3.32Å; D88-M90 VanDerWaalsContact C-N 3.35Å; D88-M90 PolarHBondContact O-N 3.11Å; M90-L93 PolarHBondContact O-N 3.43Å; M90-R94 VanDerWaalsContact CE-NH2 3.32Å; M90-R94 WeakPolarHBondContact O-CB 3.48Å; M90-R94 VanDerWaalsContact O-CG 3.29Å; M90-R94 WeakPolarHBondContact O-CG 3.13Å; M90-R94 PolarHBondContact O-N 3.47Å; M90-A180 HydrophobicContact CG-CB 3.8Å; M90-A180 HydrophobicContact SD-CB 4Å; M90-G195 WeakPolarHBondContact SD-CA 3.16Å; M90-F196 WeakPolarHBondContact CE-O 3.48Å
91	K	94.5	Very high	91.9	Very high	148 Å²	148	83.9 Å²	83.9	64%	0.643	39%	0.394	S	S	*	.	H	α-helix	trans	-62.5	-45.5	173.9	-173.4	178.1	179.4	-179.8	0	111.5	E87 D88 A89 R94 S95	E87-K91 WeakPolarHBondContact O-CB 3.25Å; E87-K91 PolarHBondContact O-N 3.2Å; D88-K91 WeakPolarHBondContact O-CB 3.42Å; D88-K91 PolarHBondContact O-N 2.98Å; A89-K91 VanDerWaalsContact C-N 3.33Å; A89-K91 PolarHBondContact O-N 3.1Å; K91-R94 PolarHBondContact O-N 3.11Å; K91-S95 WeakPolarHBondContact O-CB 3.36Å; K91-S95 PolarHBondContact O-N 2.88Å; K91-S95 PolarHBondContact O-OG 2.67Å
92	L	94.2	Very high	91.7	Very high	99 Å²	99	83.1 Å²	83.1	52%	0.518	39%	0.391	S	S	.	.	H	α-helix	trans	-61.5	-46.3	175.6	-70.4	173.3	0	0	0	111.7	V75 D88 A89 R94 S95 S96	V75-L92 HydrophobicContact CG2-CD1 4.25Å; D88-L92 WeakPolarHBondContact O-CG 3.46Å; D88-L92 PolarHBondContact O-N 3.14Å; A89-L92 PolarHBondContact O-N 3.47Å; L92-R94 VanDerWaalsContact C-N 3.32Å; L92-R94 PolarHBondContact O-N 3.36Å; L92-S95 WeakPolarHBondContact CA-OG 3.12Å; L92-S95 PolarHBondContact O-N 2.81Å; L92-S95 PolarHBondContact O-OG 3.48Å; L92-S96 WeakPolarHBondContact O-CB 3.18Å; L92-S96 PolarHBondContact O-N 3.42Å
93	L	93.6	Very high	91.5	Very high	16 Å²	16	82.2 Å²	82.2	8%	0.084	38%	0.382	C	S	.	.	H	α-helix	trans	-63.8	-34.8	179.1	-72.4	171.1	0	0	0	112.9	L72 V75 A89 M90	L72-L93 HydrophobicContact CB-CB 4.08Å; L72-L93 HydrophobicContact CB-CD1 4.4Å; L72-L93 HydrophobicContact CD1-CB 4.41Å; V75-L93 HydrophobicContact CB-CD2 4.33Å; V75-L93 HydrophobicContact CB-CG 4.44Å; V75-L93 HydrophobicContact CG1-CD1 4.38Å; V75-L93 HydrophobicContact CG1-CG 4.3Å; A89-L93 WeakPolarHBondContact O-CB 3.39Å; A89-L93 VanDerWaalsContact O-CG 3.3Å; A89-L93 WeakPolarHBondContact O-CG 3.46Å; A89-L93 PolarHBondContact O-N 2.81Å; M90-L93 PolarHBondContact O-N 3.43Å
94	R	91.9	Very high	91.5	Very high	74 Å²	74	80.4 Å²	80.4	28%	0.279	37%	0.373	S	S	.	.	H	α-helix	trans	-72.1	-36.8	173.2	-72.3	179.2	-168.9	115.4	-0.2	113	L72 M90 K91 L92 S96 D172 H175	L72-R94 HydrophobicContact CD1-CG 4.34Å; M90-R94 VanDerWaalsContact CE-NH2 3.32Å; M90-R94 WeakPolarHBondContact O-CB 3.48Å; M90-R94 VanDerWaalsContact O-CG 3.29Å; M90-R94 WeakPolarHBondContact O-CG 3.13Å; M90-R94 PolarHBondContact O-N 3.47Å; K91-R94 PolarHBondContact O-N 3.11Å; L92-R94 VanDerWaalsContact C-N 3.32Å; L92-R94 PolarHBondContact O-N 3.36Å; R94-S96 VanDerWaalsContact C-N 3.27Å; R94-D172 IonicContact CZ-OD2 2.78Å; R94-D172 IonicContact NH1-OD2 3.33Å; R94-D172 PolarHBondContact NH1-OD2 2.8Å; R94-D172 IonicContact NH2-OD2 3.78Å; R94-D172 PolarHBondContact NH2-OD2 3.09Å; R94-H175 PolarHBondContact NH1-CE1 3.15Å; R94-H175 PolarHBondContact NH1-ND1 3.47Å; R94-H175 PolarHBondContact NH2-ND1 2.92Å; R94-H175 VanDerWaalsContact NH2-ND1 3.19Å
95	S	92	Very high	91.4	Very high	89 Å²	89	73.5 Å²	73.5	62%	0.622	34%	0.341	S	S	*	.	H	α-helix	trans	-72.7	-23.7	176.2	74	0	0	0	0	112.6	K91 L92	K91-S95 WeakPolarHBondContact O-CB 3.36Å; K91-S95 PolarHBondContact O-N 2.88Å; K91-S95 PolarHBondContact O-OG 2.67Å; L92-S95 WeakPolarHBondContact CA-OG 3.12Å; L92-S95 PolarHBondContact O-N 2.81Å; L92-S95 PolarHBondContact O-OG 3.48Å
96	S	88.1	Confident	91.3	Very high	46 Å²	46	75 Å²	75	32%	0.322	35%	0.345	S	S	.	.	S	Bend	trans	-66.3	144.4	179.3	-174	0	0	0	0	111.6	L92 R94 H98	L92-S96 WeakPolarHBondContact O-CB 3.18Å; L92-S96 PolarHBondContact O-N 3.42Å; R94-S96 VanDerWaalsContact C-N 3.27Å; S96-H98 PolarHBondContact O-N 3.5Å; S96-H98 PolarHBondContact OG-CD2 3.16Å; S96-H98 PolarHBondContact OG-N 3.47Å
97	R	79.6	Confident	91.2	Very high	252 Å²	252	74.9 Å²	74.9	95%	0.951	34%	0.344	S	S	*	.			trans	-76.6	3.6	177.7	-63.1	-179.7	68.3	163.5	1.3	113
98	H	79.7	Confident	91.1	Very high	146 Å²	146	74.6 Å²	74.6	68%	0.676	35%	0.345	S	S	*	.			trans	-67.8	133.8	-179.5	-71.3	-55.9	0	0	0	112.2	S96 S100	S96-H98 PolarHBondContact O-N 3.5Å; S96-H98 PolarHBondContact OG-CD2 3.16Å; S96-H98 PolarHBondContact OG-N 3.47Å; H98-S100 PolarHBondContact O-N 2.99Å; H98-S100 VanDerWaalsContact O-N 3.08Å
99	R	82.4	Confident	90.9	Very high	229 Å²	229	70.2 Å²	70.2	86%	0.864	32%	0.322	S	S	*	.			trans	-73.7	104.7	177	-171.8	-178.7	-172.8	-170.8	0.2	109.5	T101	R99-T101 PolarHBondContact O-N 2.83Å
100	S	89.3	Confident	90.6	Very high	25 Å²	25	75.5 Å²	75.5	18%	0.175	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-55.7	132.6	169.5	48.6	0	0	0	0	113.5	K70 Y71 H98	K70-S100 VanDerWaalsContact CD-OG 3.28Å; K70-S100 WeakPolarHBondContact CD-OG 3.47Å; K70-S100 WeakPolarHBondContact CE-OG 3.02Å; K70-S100 PolarHBondContact NZ-OG 3.38Å; Y71-S100 CarbonylContact O-C 3.54Å; Y71-S100 WeakPolarHBondContact O-CA 3.44Å; Y71-S100 WeakPolarHBondContact O-CB 3.43Å; H98-S100 PolarHBondContact O-N 2.99Å; H98-S100 VanDerWaalsContact O-N 3.08Å
101	T	90.2	Very high	90.5	Very high	52 Å²	52	75.7 Å²	75.7	32%	0.319	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	133.2	-173.2	-55.1	0	0	0	0	110.9	K70 Y71 R99 D116 I158	K70-T101 CarbonylContact C-O 3.46Å; K70-T101 WeakPolarHBondContact CA-O 3.37Å; Y71-T101 PolarHBondContact N-O 3.49Å; Y71-T101 PolarHBondContact O-N 2.98Å; R99-T101 PolarHBondContact O-N 2.83Å; T101-D116 WeakPolarHBondContact CG2-OD1 3.43Å; T101-I158 HydrophobicContact CG2-CD1 3.51Å
102	R	91.6	Very high	90.5	Very high	161 Å²	161	68.7 Å²	68.7	61%	0.608	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.5	177.8	-68.9	177	67.9	-165.1	1.4	110	K70 D116 A117	K70-R102 HydrophobicContact CG-CG 4.14Å; R102-D116 VanDerWaalsContact O-OD1 3.04Å; R102-A117 VanDerWaalsContact O-CB 3.3Å; R102-A117 WeakPolarHBondContact O-CB 3.47Å; R102-A117 PolarHBondContact O-N 3.29Å
103	G	90.8	Very high	90.4	Very high	3 Å²	3	68.4 Å²	68.4	3%	0.031	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	-178	-178.5	0	0	0	0	0	113.3	V69 V115	V69-G103 PolarHBondContact N-O 3.48Å; V69-G103 PolarHBondContact O-N 2.87Å; G103-V115 CarbonylContact C-O 3.59Å; G103-V115 WeakPolarHBondContact CA-O 3.07Å
104	I	92.8	Very high	90.4	Very high	33 Å²	33	67.6 Å²	67.6	17%	0.169	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129.8	159.6	-78.9	168.9	0	0	0	108	F67 Y106 V114 V115 K120	F67-I104 CarbonylContact O-C 3.53Å; F67-I104 VanDerWaalsContact O-CA 3.3Å; F67-I104 WeakPolarHBondContact O-CA 3.4Å; I104-Y106 HydrophobicContact CB-CE2 4.13Å; I104-Y106 HydrophobicContact CG2-CD1 4.39Å; I104-Y106 HydrophobicContact CG2-CD2 3.93Å; I104-Y106 HydrophobicContact CG2-CE1 4.08Å; I104-Y106 HydrophobicContact CG2-CE2 3.57Å; I104-Y106 HydrophobicContact CG2-CG 4.33Å; I104-V114 WeakPolarHBondContact O-CA 3.46Å; I104-V115 PolarHBondContact N-O 3.11Å; I104-V115 PolarHBondContact O-N 3.13Å; I104-K120 HydrophobicContact CD1-CD 3.76Å; I104-K120 HydrophobicContact CG1-CD 4.48Å
105	L	94.4	Very high	90.3	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	116.4	169.3	173.4	66	0	0	0	108.3	S66 F67 V69 I107 L112 R113 V114 L206	S66-L105 CarbonylContact C-O 3.57Å; S66-L105 VanDerWaalsContact CA-O 3.3Å; S66-L105 WeakPolarHBondContact CA-O 3.29Å; F67-L105 PolarHBondContact N-O 3.44Å; F67-L105 PolarHBondContact O-N 2.89Å; V69-L105 HydrophobicContact CB-CB 4.49Å; V69-L105 HydrophobicContact CG1-CB 3.96Å; V69-L105 HydrophobicContact CG1-CD2 4.38Å; V69-L105 HydrophobicContact CG2-CB 3.67Å; L105-I107 HydrophobicContact CD2-CD1 4Å; L105-I107 HydrophobicContact CD2-CG1 4.14Å; L105-I107 HydrophobicContact CG-CD1 4.3Å; L105-I107 HydrophobicContact CG-CG1 3.9Å; L105-L112 HydrophobicContact CD1-CB 4.24Å; L105-R113 CarbonylContact C-O 3.58Å; L105-R113 WeakPolarHBondContact CA-O 3.46Å; L105-V114 HydrophobicContact CD1-CG2 3.64Å; L105-L206 HydrophobicContact CD2-CD2 4.21Å
106	Y	94.1	Very high	90	Very high	68 Å²	68	62.2 Å²	62.2	27%	0.267	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	130.8	169.6	-65.3	-86.7	0	0	0	109	I104 L112 R113 V115	I104-Y106 HydrophobicContact CB-CE2 4.13Å; I104-Y106 HydrophobicContact CG2-CD1 4.39Å; I104-Y106 HydrophobicContact CG2-CD2 3.93Å; I104-Y106 HydrophobicContact CG2-CE1 4.08Å; I104-Y106 HydrophobicContact CG2-CE2 3.57Å; I104-Y106 HydrophobicContact CG2-CG 4.33Å; Y106-L112 WeakPolarHBondContact O-CA 3.37Å; Y106-R113 PolarHBondContact N-O 3.49Å; Y106-R113 PolarHBondContact O-N 2.6Å; Y106-V115 HydrophobicContact CD2-CG2 3.92Å; Y106-V115 HydrophobicContact CE2-CB 4.01Å; Y106-V115 HydrophobicContact CE2-CG2 3.68Å
107	I	95	Very high	89.4	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.1	-178.4	-54.7	-177.8	0	0	0	107.8	V60 C65 F67 L105 L112 A209 V210 A213	V60-I107 HydrophobicContact CG2-CG2 4.06Å; C65-I107 HydrophobicContact CB-CB 4.45Å; C65-I107 WeakPolarHBondContact CB-O 3.36Å; C65-I107 PolarHBondContact O-N 2.86Å; F67-I107 HydrophobicContact CD2-CD1 3.59Å; F67-I107 HydrophobicContact CD2-CG1 4.29Å; F67-I107 HydrophobicContact CE2-CD1 3.71Å; L105-I107 HydrophobicContact CD2-CD1 4Å; L105-I107 HydrophobicContact CD2-CG1 4.14Å; L105-I107 HydrophobicContact CG-CD1 4.3Å; L105-I107 HydrophobicContact CG-CG1 3.9Å; I107-L112 HydrophobicContact CB-CD2 4.18Å; I107-L112 HydrophobicContact CG1-CD2 3.93Å; I107-L112 HydrophobicContact CG2-CD2 3.81Å; I107-A209 HydrophobicContact CD1-CB 3.88Å; I107-A209 HydrophobicContact CG2-CB 4.47Å; I107-V210 HydrophobicContact CD1-CG2 3.73Å; I107-V210 HydrophobicContact CG1-CG2 4.47Å; I107-V210 HydrophobicContact CG2-CG2 4.29Å; I107-A213 HydrophobicContact CG2-CB 4Å
108	S	93.2	Very high	88.7	Confident	24 Å²	24	57.1 Å²	57.1	17%	0.168	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	160.8	178.4	-54.3	0	0	0	0	109.5	D110 G111	S108-D110 PolarHBondContact O-N 3.45Å; S108-G111 PolarHBondContact N-O 3.17Å; S108-G111 VanDerWaalsContact N-O 3.16Å; S108-G111 PolarHBondContact O-N 3.22Å; S108-G111 VanDerWaalsContact O-N 3.08Å
109	G	91.3	Very high	87.7	Confident	4 Å²	4	51.3 Å²	51.3	4%	0.041	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-4.9	175.2	0	0	0	0	0	115.4	I163	G109-I163 WeakPolarHBondContact O-CG2 3.22Å
110	D	89.8	Confident	86.3	Confident	115 Å²	115	41.3 Å²	41.3	62%	0.615	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101	-28.7	177.1	-53.9	-31	0	0	0	112.7	S108 I163 R220	S108-D110 PolarHBondContact O-N 3.45Å; D110-I163 PolarHBondContact O-N 3.25Å; D110-R220 IonicContact OD1-NH1 2.74Å; D110-R220 PolarHBondContact OD1-NH1 2.9Å
111	G	92.2	Very high	84.3	Confident	5 Å²	5	44.2 Å²	44.2	5%	0.052	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.3	175.4	-175.3	0	0	0	0	0	115.7	S108 Q161	S108-G111 PolarHBondContact N-O 3.17Å; S108-G111 VanDerWaalsContact N-O 3.16Å; S108-G111 PolarHBondContact O-N 3.22Å; S108-G111 VanDerWaalsContact O-N 3.08Å; G111-Q161 CarbonylContact C-O 3.57Å; G111-Q161 WeakPolarHBondContact CA-O 3.44Å
112	L	94	Very high	82.3	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.2	177.5	-55.7	177.7	0	0	0	109.1	L105 Y106 I107 Q161 V166 Y181 V210	L105-L112 HydrophobicContact CD1-CB 4.24Å; Y106-L112 WeakPolarHBondContact O-CA 3.37Å; I107-L112 HydrophobicContact CB-CD2 4.18Å; I107-L112 HydrophobicContact CG1-CD2 3.93Å; I107-L112 HydrophobicContact CG2-CD2 3.81Å; L112-Q161 HydrophobicContact CB-CB 4.41Å; L112-Q161 PolarHBondContact N-O 3.37Å; L112-Q161 PolarHBondContact O-N 2.8Å; L112-V166 HydrophobicContact CD1-CG2 4.26Å; L112-Y181 HydrophobicContact CD1-CD1 3.76Å; L112-Y181 HydrophobicContact CD1-CE1 3.63Å; L112-Y181 HydrophobicContact CD1-CG 4.37Å; L112-V210 HydrophobicContact CD1-CG1 4.34Å; L112-V210 HydrophobicContact CD1-CG2 4.37Å; L112-V210 HydrophobicContact CD2-CG1 4.49Å; L112-V210 HydrophobicContact CD2-CG2 3.83Å
113	R	93.2	Very high	80.5	Confident	93 Å²	93	41.6 Å²	41.6	35%	0.351	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	128.4	-177.5	-67.9	177.5	-173	-80.7	-13.8	110.7	L105 Y106 L157 V159 D160	L105-R113 CarbonylContact C-O 3.58Å; L105-R113 WeakPolarHBondContact CA-O 3.46Å; Y106-R113 PolarHBondContact N-O 3.49Å; Y106-R113 PolarHBondContact O-N 2.6Å; R113-L157 HydrophobicContact CB-CD1 3.91Å; R113-L157 HydrophobicContact CG-CD1 4.37Å; R113-V159 CarbonylContact C-O 3.57Å; R113-V159 VanDerWaalsContact CA-O 3.29Å; R113-V159 WeakPolarHBondContact CA-O 3.41Å; R113-D160 IonicContact CZ-OD1 3.83Å; R113-D160 IonicContact CZ-OD2 3.28Å; R113-D160 IonicContact NE-OD1 2.66Å; R113-D160 IonicContact NH1-OD1 3.83Å; R113-D160 PolarHBondContact NH1-OD1 2.86Å; R113-D160 IonicContact NH1-OD2 3.55Å; R113-D160 PolarHBondContact NH1-OD2 3.26Å; R113-D160 IonicContact NH2-OD1 3.17Å; R113-D160 PolarHBondContact NH2-OD1 3.44Å; R113-D160 IonicContact NH2-OD2 3.15Å
114	V	92.6	Very high	78.6	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.2	180	-175.7	0	0	0	0	109.1	I104 L105 I158 V159 F196	I104-V114 WeakPolarHBondContact O-CA 3.46Å; L105-V114 HydrophobicContact CD1-CG2 3.64Å; V114-I158 HydrophobicContact CB-CB 4.29Å; V114-I158 HydrophobicContact CG1-CB 4.23Å; V114-I158 HydrophobicContact CG1-CD1 4.04Å; V114-I158 PolarHBondContact O-N 2.97Å; V114-V159 HydrophobicContact CB-CB 3.86Å; V114-V159 HydrophobicContact CB-CG2 4.03Å; V114-V159 HydrophobicContact CG2-CB 3.7Å; V114-V159 HydrophobicContact CG2-CG1 4.49Å; V114-V159 HydrophobicContact CG2-CG2 3.91Å; V114-V159 PolarHBondContact N-O 3.23Å; V114-V159 PolarHBondContact O-N 3.4Å; V114-F196 HydrophobicContact CG2-CE1 3.61Å; V114-F196 HydrophobicContact CG2-CZ 4.13Å
115	V	89.1	Confident	76.5	Confident	23 Å²	23	53 Å²	53	14%	0.139	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.9	178.2	-176.8	0	0	0	0	109.4	G103 I104 Y106 K120 G156 L157	G103-V115 CarbonylContact C-O 3.59Å; G103-V115 WeakPolarHBondContact CA-O 3.07Å; I104-V115 PolarHBondContact N-O 3.11Å; I104-V115 PolarHBondContact O-N 3.13Å; Y106-V115 HydrophobicContact CD2-CG2 3.92Å; Y106-V115 HydrophobicContact CE2-CB 4.01Å; Y106-V115 HydrophobicContact CE2-CG2 3.68Å; V115-K120 HydrophobicContact CG1-CG 4.26Å; V115-G156 WeakPolarHBondContact CA-O 3.33Å; V115-L157 HydrophobicContact CG2-CD1 4.1Å
116	D	86.6	Confident	74.4	Confident	26 Å²	26	54.9 Å²	54.9	14%	0.139	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	137.3	177.1	-177.7	35.4	0	0	0	111.6	T101 R102 E118 S119 K120 G156 I158	T101-D116 WeakPolarHBondContact CG2-OD1 3.43Å; R102-D116 VanDerWaalsContact O-OD1 3.04Å; D116-E118 VanDerWaalsContact C-N 3.29Å; D116-E118 PolarHBondContact O-N 3.48Å; D116-E118 WeakPolarHBondContact OD2-CB 2.86Å; D116-S119 PolarHBondContact O-N 3.39Å; D116-S119 PolarHBondContact OD2-N 2.92Å; D116-S119 PolarHBondContact OD2-OG 2.81Å; D116-K120 PolarHBondContact O-N 3.47Å; D116-K120 VanDerWaalsContact O-N 3.16Å; D116-G156 PolarHBondContact N-O 3.45Å; D116-I158 HydrophobicContact CB-CD1 3.68Å; D116-I158 HydrophobicContact CB-CG1 4.01Å
117	A	74.6	Confident	72.6	Confident	39 Å²	39	54 Å²	54	32%	0.322	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.7	-176.8	0	0	0	0	0	112.6	R102 K120	R102-A117 VanDerWaalsContact O-CB 3.3Å; R102-A117 WeakPolarHBondContact O-CB 3.47Å; R102-A117 PolarHBondContact O-N 3.29Å; A117-K120 WeakPolarHBondContact O-CB 3.11Å
118	E	66.4	Low	70.9	Confident	152 Å²	152	57.3 Å²	57.3	71%	0.71	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-38.9	177.2	-56.9	-176.9	175.1	0	0	110.4	D116 K120 V121	D116-E118 VanDerWaalsContact C-N 3.29Å; D116-E118 PolarHBondContact O-N 3.48Å; D116-E118 WeakPolarHBondContact OD2-CB 2.86Å; E118-K120 PolarHBondContact O-N 3.11Å; E118-V121 PolarHBondContact O-N 3.44Å
119	S	57.4	Low	69	Low	25 Å²	25	60.4 Å²	60.4	18%	0.175	32%	0.321	C	S	.	.	H	α-helix	trans	-66.8	-22.6	174	-59.9	0	0	0	0	113.2	D116 V121 I122 V123 G156	D116-S119 PolarHBondContact O-N 3.39Å; D116-S119 PolarHBondContact OD2-N 2.92Å; D116-S119 PolarHBondContact OD2-OG 2.81Å; S119-V121 PolarHBondContact O-N 3.49Å; S119-I122 PolarHBondContact O-N 3.44Å; S119-V123 WeakPolarHBondContact O-CG2 3.47Å; S119-V123 PolarHBondContact O-N 2.99Å; S119-G156 WeakPolarHBondContact OG-CA 3.09Å
120	K	54.3	Low	67.2	Low	19 Å²	19	66 Å²	66	8%	0.083	34%	0.341	C	S	.	.	H	α-helix	trans	-60	-29.3	177.1	-108	177	-95.6	142.5	0	113.4	I104 V115 D116 A117 E118 I122 V123 F124	I104-K120 HydrophobicContact CD1-CD 3.76Å; I104-K120 HydrophobicContact CG1-CD 4.48Å; V115-K120 HydrophobicContact CG1-CG 4.26Å; D116-K120 PolarHBondContact O-N 3.47Å; D116-K120 VanDerWaalsContact O-N 3.16Å; A117-K120 WeakPolarHBondContact O-CB 3.11Å; E118-K120 PolarHBondContact O-N 3.11Å; K120-I122 VanDerWaalsContact C-N 3.27Å; K120-I122 PolarHBondContact O-N 2.73Å; K120-V123 PolarHBondContact O-N 3.35Å; K120-F124 HydrophobicContact CB-CD2 3.74Å; K120-F124 HydrophobicContact CB-CE2 3.72Å; K120-F124 HydrophobicContact CD-CD2 4.21Å; K120-F124 HydrophobicContact CD-CE2 3.32Å; K120-F124 HydrophobicContact CD-CZ 3.91Å; K120-F124 HydrophobicContact CG-CD2 3.74Å; K120-F124 HydrophobicContact CG-CE2 3.34Å; K120-F124 HydrophobicContact CG-CZ 4.12Å; K120-F124 VanDerWaalsContact O-CB 3.22Å; K120-F124 WeakPolarHBondContact O-CB 3.27Å; K120-F124 WeakPolarHBondContact O-CD2 3.49Å; K120-F124 WeakPolarHBondContact O-CG 3.47Å; K120-F124 PolarHBondContact O-N 3.44Å
121	V	46.1	Very low	65.5	Low	86 Å²	86	66.5 Å²	66.5	52%	0.521	34%	0.34	S	S	.	.	H	α-helix	trans	-56.1	-49.3	172	179.9	0	0	0	0	109.1	E118 S119 Y125	E118-V121 PolarHBondContact O-N 3.44Å; S119-V121 PolarHBondContact O-N 3.49Å; V121-Y125 HydrophobicContact CG1-CD2 3.74Å; V121-Y125 HydrophobicContact CG1-CE2 3.39Å; V121-Y125 WeakPolarHBondContact O-CB 3.45Å; V121-Y125 WeakPolarHBondContact O-CD2 3.42Å; V121-Y125 PolarHBondContact O-N 2.76Å
122	I	49.3	Very low	63.6	Low	124 Å²	124	72.7 Å²	72.7	64%	0.636	37%	0.367	S	S	*	.	H	α-helix	trans	-71	-42.1	-178.9	-59.2	171.1	0	0	0	111.6	S119 K120 Y125 A126	S119-I122 PolarHBondContact O-N 3.44Å; K120-I122 VanDerWaalsContact C-N 3.27Å; K120-I122 PolarHBondContact O-N 2.73Å; I122-Y125 PolarHBondContact O-N 2.74Å; I122-A126 WeakPolarHBondContact O-CB 3.43Å; I122-A126 PolarHBondContact O-N 2.85Å
123	V	52.4	Low	61.7	Low	34 Å²	34	77 Å²	77	21%	0.206	39%	0.389	C	S	.	.	H	α-helix	trans	-71	-37.6	-178.1	-179.5	0	0	0	0	111.7	S119 K120 A126 S127	S119-V123 WeakPolarHBondContact O-CG2 3.47Å; S119-V123 PolarHBondContact O-N 2.99Å; K120-V123 PolarHBondContact O-N 3.35Å; V123-A126 PolarHBondContact O-N 3.43Å; V123-S127 WeakPolarHBondContact O-CB 3.28Å; V123-S127 PolarHBondContact O-N 2.92Å; V123-S127 PolarHBondContact O-OG 2.77Å; V123-S127 VanDerWaalsContact O-OG 3.14Å
124	F	51.8	Low	59.8	Low	117 Å²	117	76.7 Å²	76.7	51%	0.513	39%	0.391	S	S	.	.	H	α-helix	trans	-71.1	-37.1	173.6	-74.7	-62.6	0	0	0	112.1	K120 A126 S127 S128	K120-F124 HydrophobicContact CB-CD2 3.74Å; K120-F124 HydrophobicContact CB-CE2 3.72Å; K120-F124 HydrophobicContact CD-CD2 4.21Å; K120-F124 HydrophobicContact CD-CE2 3.32Å; K120-F124 HydrophobicContact CD-CZ 3.91Å; K120-F124 HydrophobicContact CG-CD2 3.74Å; K120-F124 HydrophobicContact CG-CE2 3.34Å; K120-F124 HydrophobicContact CG-CZ 4.12Å; K120-F124 VanDerWaalsContact O-CB 3.22Å; K120-F124 WeakPolarHBondContact O-CB 3.27Å; K120-F124 WeakPolarHBondContact O-CD2 3.49Å; K120-F124 WeakPolarHBondContact O-CG 3.47Å; K120-F124 PolarHBondContact O-N 3.44Å; F124-A126 VanDerWaalsContact C-N 3.31Å; F124-A126 PolarHBondContact O-N 3.46Å; F124-S127 PolarHBondContact O-N 3.25Å; F124-S128 VanDerWaalsContact O-CB 3.27Å; F124-S128 WeakPolarHBondContact O-CB 3.47Å; F124-S128 PolarHBondContact O-N 3.28Å
125	Y	48.8	Very low	58.2	Low	157 Å²	157	87 Å²	87	62%	0.616	43%	0.43	S	S	*	.	H	α-helix	trans	-61.7	-42.1	169.9	-78.7	-59.7	0	0	0	110.9	V121 I122 S127 S128 I129	V121-Y125 HydrophobicContact CG1-CD2 3.74Å; V121-Y125 HydrophobicContact CG1-CE2 3.39Å; V121-Y125 WeakPolarHBondContact O-CB 3.45Å; V121-Y125 WeakPolarHBondContact O-CD2 3.42Å; V121-Y125 PolarHBondContact O-N 2.76Å; I122-Y125 PolarHBondContact O-N 2.74Å; Y125-S127 VanDerWaalsContact C-N 3.33Å; Y125-S127 PolarHBondContact O-N 3.26Å; Y125-S128 PolarHBondContact O-N 2.77Å; Y125-I129 VanDerWaalsContact O-CB 3.25Å; Y125-I129 WeakPolarHBondContact O-CB 3.4Å; Y125-I129 WeakPolarHBondContact O-CD1 3.35Å; Y125-I129 WeakPolarHBondContact O-CG1 3.43Å; Y125-I129 PolarHBondContact O-N 3.09Å
126	A	50.6	Low	56.6	Low	42 Å²	42	90.6 Å²	90.6	35%	0.347	46%	0.457	S	S	.	.	H	α-helix	trans	-63.3	-38	175	0	0	0	0	0	112.4	I122 V123 F124 R130	I122-A126 WeakPolarHBondContact O-CB 3.43Å; I122-A126 PolarHBondContact O-N 2.85Å; V123-A126 PolarHBondContact O-N 3.43Å; F124-A126 VanDerWaalsContact C-N 3.31Å; F124-A126 PolarHBondContact O-N 3.46Å; A126-R130 WeakPolarHBondContact O-CB 3.44Å; A126-R130 PolarHBondContact O-N 3.34Å
127	S	56	Low	54.8	Low	49 Å²	49	93 Å²	93	34%	0.343	47%	0.468	S	S	.	.	H	α-helix	trans	-74.9	-35.8	176.8	-67.2	0	0	0	0	113.7	V123 F124 Y125 R130 E131	V123-S127 WeakPolarHBondContact O-CB 3.28Å; V123-S127 PolarHBondContact O-N 2.92Å; V123-S127 PolarHBondContact O-OG 2.77Å; V123-S127 VanDerWaalsContact O-OG 3.14Å; F124-S127 PolarHBondContact O-N 3.25Å; Y125-S127 VanDerWaalsContact C-N 3.33Å; Y125-S127 PolarHBondContact O-N 3.26Å; S127-R130 WeakPolarHBondContact O-CB 3.25Å; S127-R130 PolarHBondContact O-N 3.39Å; S127-E131 PolarHBondContact O-N 3.27Å
128	S	58.9	Low	53.8	Low	69 Å²	69	100.4 Å²	100.4	48%	0.483	49%	0.493	S	S	.	.	H	α-helix	trans	-70.6	-42.7	175.5	-169	0	0	0	0	110.6	F124 Y125 R130 E131 E132	F124-S128 VanDerWaalsContact O-CB 3.27Å; F124-S128 WeakPolarHBondContact O-CB 3.47Å; F124-S128 PolarHBondContact O-N 3.28Å; Y125-S128 PolarHBondContact O-N 2.77Å; S128-R130 PolarHBondContact O-N 2.84Å; S128-E131 PolarHBondContact O-N 2.97Å; S128-E132 WeakPolarHBondContact O-CB 3.32Å; S128-E132 PolarHBondContact O-N 3.36Å; S128-E132 VanDerWaalsContact O-N 3.12Å
129	I	54.2	Low	53.1	Low	89 Å²	89	104.4 Å²	104.4	46%	0.456	50%	0.502	S	S	.	.	H	α-helix	trans	-66.1	-31.2	170.8	-63.4	165.5	0	0	0	109.8	Y125 E132 M133	Y125-I129 VanDerWaalsContact O-CB 3.25Å; Y125-I129 WeakPolarHBondContact O-CB 3.4Å; Y125-I129 WeakPolarHBondContact O-CD1 3.35Å; Y125-I129 WeakPolarHBondContact O-CG1 3.43Å; Y125-I129 PolarHBondContact O-N 3.09Å; I129-E132 PolarHBondContact O-N 3.29Å; I129-M133 HydrophobicContact CG2-CG 4.15Å; I129-M133 HydrophobicContact CG2-SD 4.19Å; I129-M133 WeakPolarHBondContact O-CA 3.43Å; I129-M133 WeakPolarHBondContact O-CB 3.28Å; I129-M133 WeakPolarHBondContact O-CG 3.45Å; I129-M133 PolarHBondContact O-N 2.87Å
130	R	52.1	Low	53.1	Low	121 Å²	121	108.2 Å²	108.2	46%	0.457	52%	0.52	S	S	.	.	H	α-helix	trans	-65.7	-44.7	174.4	175.4	-176.9	176.7	-151	-11.7	112	A126 S127 S128 E132 M133 E134	A126-R130 WeakPolarHBondContact O-CB 3.44Å; A126-R130 PolarHBondContact O-N 3.34Å; S127-R130 WeakPolarHBondContact O-CB 3.25Å; S127-R130 PolarHBondContact O-N 3.39Å; S128-R130 PolarHBondContact O-N 2.84Å; R130-E132 VanDerWaalsContact C-N 3.31Å; R130-E132 PolarHBondContact O-N 3.2Å; R130-M133 PolarHBondContact O-N 2.83Å; R130-E134 HydrophobicContact CG-CG 4.13Å; R130-E134 WeakPolarHBondContact CG-OE1 3.35Å; R130-E134 IonicContact CZ-OE1 3.34Å; R130-E134 IonicContact NE-OE1 3.46Å; R130-E134 PolarHBondContact NE-OE1 3.05Å; R130-E134 IonicContact NH2-OE1 3.61Å; R130-E134 PolarHBondContact NH2-OE1 3.37Å; R130-E134 WeakPolarHBondContact O-CB 3.45Å; R130-E134 WeakPolarHBondContact O-CG 3.46Å; R130-E134 PolarHBondContact O-N 2.71Å
131	E	54.9	Low	53.1	Low	127 Å²	127	109 Å²	109	59%	0.593	53%	0.53	S	S	*	.	H	α-helix	trans	-64	-38.2	174.4	-80.2	-174.8	168.7	0	0	111.8	S127 S128 R135	S127-E131 PolarHBondContact O-N 3.27Å; S128-E131 PolarHBondContact O-N 2.97Å; E131-R135 WeakPolarHBondContact O-CG 3.35Å; E131-R135 PolarHBondContact O-N 3.17Å
132	E	53.2	Low	53.4	Low	134 Å²	134	112 Å²	112	63%	0.626	54%	0.538	S	S	*	.	H	α-helix	trans	-72.8	-35.4	178.5	-157.3	165.8	-161.9	0	0	112.4	S128 I129 R130 S136	S128-E132 WeakPolarHBondContact O-CB 3.32Å; S128-E132 PolarHBondContact O-N 3.36Å; S128-E132 VanDerWaalsContact O-N 3.12Å; I129-E132 PolarHBondContact O-N 3.29Å; R130-E132 VanDerWaalsContact C-N 3.31Å; R130-E132 PolarHBondContact O-N 3.2Å; E132-S136 WeakPolarHBondContact O-CB 3.49Å; E132-S136 PolarHBondContact O-N 3Å; E132-S136 PolarHBondContact O-OG 3.48Å
133	M	53.3	Low	53.8	Low	90 Å²	90	111.2 Å²	111.2	44%	0.443	53%	0.534	S	S	.	.	H	α-helix	trans	-75	-37.3	172.2	-90.9	-171.9	141.3	0	0	112.8	I129 R130 R135 S136 M137	I129-M133 HydrophobicContact CG2-CG 4.15Å; I129-M133 HydrophobicContact CG2-SD 4.19Å; I129-M133 WeakPolarHBondContact O-CA 3.43Å; I129-M133 WeakPolarHBondContact O-CB 3.28Å; I129-M133 WeakPolarHBondContact O-CG 3.45Å; I129-M133 PolarHBondContact O-N 2.87Å; R130-M133 PolarHBondContact O-N 2.83Å; M133-R135 PolarHBondContact O-N 3.28Å; M133-S136 CarbonylContact O-C 3.58Å; M133-S136 PolarHBondContact O-N 2.92Å; M133-M137 HydrophobicContact CB-CE 4.03Å; M133-M137 HydrophobicContact CE-CE 3.56Å; M133-M137 HydrophobicContact CE-SD 3.65Å; M133-M137 HydrophobicContact CG-CE 3.99Å; M133-M137 WeakPolarHBondContact O-CB 3.32Å; M133-M137 PolarHBondContact O-N 3.42Å; M133-M137 HydrophobicContact SD-CE 3.54Å; M133-M137 VanDerWaalsContact SD-CE 3.54Å; M133-M137 HydrophobicContact SD-SD 4.42Å
134	E	52.7	Low	53.8	Low	87 Å²	87	115.3 Å²	115.3	41%	0.407	56%	0.555	S	S	.	*	H	α-helix	trans	-62.9	-31.2	177.5	-82.2	177.6	180	0	0	110.5	R130	R130-E134 HydrophobicContact CG-CG 4.13Å; R130-E134 WeakPolarHBondContact CG-OE1 3.35Å; R130-E134 IonicContact CZ-OE1 3.34Å; R130-E134 IonicContact NE-OE1 3.46Å; R130-E134 PolarHBondContact NE-OE1 3.05Å; R130-E134 IonicContact NH2-OE1 3.61Å; R130-E134 PolarHBondContact NH2-OE1 3.37Å; R130-E134 WeakPolarHBondContact O-CB 3.45Å; R130-E134 WeakPolarHBondContact O-CG 3.46Å; R130-E134 PolarHBondContact O-N 2.71Å
135	R	59.6	Low	53.5	Low	217 Å²	217	113.5 Å²	113.5	82%	0.819	55%	0.547	S	S	*	.	H	α-helix	trans	-74.1	-26.1	170.5	-72.2	178.5	-178.7	167.4	3.4	114.2	E131 M133	E131-R135 WeakPolarHBondContact O-CG 3.35Å; E131-R135 PolarHBondContact O-N 3.17Å; M133-R135 PolarHBondContact O-N 3.28Å
136	S	54.7	Low	53.5	Low	99 Å²	99	111.9 Å²	111.9	69%	0.692	55%	0.548	S	S	*	.	H	α-helix	trans	-113.2	-7.9	-165.6	-49.2	0	0	0	0	114.8	E132 M133	E132-S136 WeakPolarHBondContact O-CB 3.49Å; E132-S136 PolarHBondContact O-N 3Å; E132-S136 PolarHBondContact O-OG 3.48Å; M133-S136 CarbonylContact O-C 3.58Å; M133-S136 PolarHBondContact O-N 2.92Å
137	M	49.6	Very low	53.2	Low	77 Å²	77	114.9 Å²	114.9	38%	0.379	56%	0.558	S	S	.	*			trans	-137.3	50.8	-163.9	-160.6	176.7	49.7	0	0	113.7	M133 R139	M133-M137 HydrophobicContact CB-CE 4.03Å; M133-M137 HydrophobicContact CE-CE 3.56Å; M133-M137 HydrophobicContact CE-SD 3.65Å; M133-M137 HydrophobicContact CG-CE 3.99Å; M133-M137 WeakPolarHBondContact O-CB 3.32Å; M133-M137 PolarHBondContact O-N 3.42Å; M133-M137 HydrophobicContact SD-CE 3.54Å; M133-M137 VanDerWaalsContact SD-CE 3.54Å; M133-M137 HydrophobicContact SD-SD 4.42Å; M137-R139 VanDerWaalsContact C-N 3.26Å; M137-R139 PolarHBondContact O-N 3.33Å; M137-R139 VanDerWaalsContact O-N 3.09Å
138	F	53.1	Low	52.4	Low	193 Å²	193	116.2 Å²	116.2	85%	0.846	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	18.3	-175	-128.3	-86.8	0	0	0	116.4
139	R	52.8	Low	51.5	Low	236 Å²	236	118.7 Å²	118.7	89%	0.891	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.8	-3.9	-176	-71.5	-165.2	-166.5	163.1	5.8	119	M137	M137-R139 VanDerWaalsContact C-N 3.26Å; M137-R139 PolarHBondContact O-N 3.33Å; M137-R139 VanDerWaalsContact O-N 3.09Å
140	L	56.5	Low	50.8	Low	106 Å²	106	123.2 Å²	123.2	56%	0.555	58%	0.58	S	S	*	*	S	Bend	trans	-135.4	8.7	-176	-69.7	171.6	0	0	0	114.8
141	A	54	Low	50.1	Low	36 Å²	36	123.2 Å²	123.2	30%	0.298	58%	0.584	S	S	.	*			trans	-86.2	-18.2	-162.6	0	0	0	0	0	115.5	I143 N144 F145	A141-I143 PolarHBondContact O-N 3.34Å; A141-N144 PolarHBondContact O-N 3.48Å; A141-F145 WeakPolarHBondContact O-CA 3.34Å; A141-F145 WeakPolarHBondContact O-CB 3.39Å; A141-F145 PolarHBondContact O-N 2.91Å
142	E	53.1	Low	49.6	Very low	148 Å²	148	119.1 Å²	119.1	69%	0.692	57%	0.569	S	S	*	*	H	α-helix	trans	-64	-36.9	-160.8	-145.6	167.1	-162.6	0	0	114.4	L146	E142-L146 WeakPolarHBondContact O-CD1 3.17Å
143	I	57.1	Low	49.4	Very low	107 Å²	107	117 Å²	117	55%	0.549	56%	0.559	S	S	.	*	H	α-helix	trans	-86.8	-33.2	-178.7	-61.2	173.6	0	0	0	112.3	A141	A141-I143 PolarHBondContact O-N 3.34Å
144	N	52.2	Low	49.4	Very low	120 Å²	120	119.1 Å²	119.1	64%	0.642	57%	0.568	S	S	*	*	H	α-helix	trans	-78	-26.9	176.3	-74.8	-37	0	0	0	112.2	A141 N147 C148	A141-N144 PolarHBondContact O-N 3.48Å; N144-N147 PolarHBondContact O-N 3.11Å; N144-C148 WeakPolarHBondContact O-CB 3.22Å; N144-C148 PolarHBondContact O-N 3.12Å
145	F	46.9	Very low	49.3	Very low	80 Å²	80	123 Å²	123	35%	0.351	58%	0.579	S	S	.	*	H	α-helix	trans	-68.4	-39.2	179.4	-172.6	-101	0	0	0	112.2	A141 C148 K149	A141-F145 WeakPolarHBondContact O-CA 3.34Å; A141-F145 WeakPolarHBondContact O-CB 3.39Å; A141-F145 PolarHBondContact O-N 2.91Å; F145-C148 PolarHBondContact O-N 2.92Å; F145-K149 HydrophobicContact CE1-CD 4.32Å; F145-K149 WeakPolarHBondContact O-CB 3.44Å; F145-K149 PolarHBondContact O-N 3.48Å
146	L	48.5	Very low	49.9	Very low	123 Å²	123	113.5 Å²	113.5	64%	0.644	55%	0.548	S	S	*	.	H	α-helix	trans	-65.6	-40.3	174.4	-92.1	125.5	0	0	0	112.5	E142 R150	E142-L146 WeakPolarHBondContact O-CD1 3.17Å; L146-R150 WeakPolarHBondContact O-CB 3.5Å; L146-R150 PolarHBondContact O-N 3.24Å; L146-R150 VanDerWaalsContact O-N 3.11Å
147	N	43.4	Very low	51.2	Low	105 Å²	105	110.7 Å²	110.7	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-72.2	-37.3	175.3	-79.3	-46.1	0	0	0	112.2	N144 R150 F151	N144-N147 PolarHBondContact O-N 3.11Å; N147-R150 PolarHBondContact O-N 2.9Å; N147-F151 WeakPolarHBondContact O-CB 3.43Å; N147-F151 PolarHBondContact O-N 2.76Å
148	C	39.1	Very low	53	Low	77 Å²	77	109.9 Å²	109.9	52%	0.52	52%	0.522	S	S	.	.	H	α-helix	trans	-67.6	-40.8	175.3	-169.8	0	0	0	0	111.9	N144 F145 R150 F151 S152	N144-C148 WeakPolarHBondContact O-CB 3.22Å; N144-C148 PolarHBondContact O-N 3.12Å; F145-C148 PolarHBondContact O-N 2.92Å; C148-R150 PolarHBondContact O-N 2.93Å; C148-F151 PolarHBondContact O-N 2.93Å; C148-S152 WeakPolarHBondContact O-CB 3.42Å; C148-S152 PolarHBondContact O-N 2.89Å
149	K	41	Very low	54.7	Low	121 Å²	121	101.2 Å²	101.2	53%	0.526	48%	0.484	S	S	.	.	H	α-helix	trans	-64.5	-39.3	176.2	-165.4	173.4	-175.2	177.8	0	111.6	F145 Q153	F145-K149 HydrophobicContact CE1-CD 4.32Å; F145-K149 WeakPolarHBondContact O-CB 3.44Å; F145-K149 PolarHBondContact O-N 3.48Å; K149-Q153 WeakPolarHBondContact O-CG 3.49Å; K149-Q153 PolarHBondContact O-N 2.78Å
150	R	39.4	Very low	56.5	Low	184 Å²	184	93.8 Å²	93.8	69%	0.694	46%	0.462	S	S	*	.	H	α-helix	trans	-74.3	-34.6	176.7	-152.5	169.8	-160	156.6	4.8	112.6	L146 N147 C148 H154	L146-R150 WeakPolarHBondContact O-CB 3.5Å; L146-R150 PolarHBondContact O-N 3.24Å; L146-R150 VanDerWaalsContact O-N 3.11Å; N147-R150 PolarHBondContact O-N 2.9Å; C148-R150 PolarHBondContact O-N 2.93Å; R150-H154 PolarHBondContact O-CD2 3.4Å
151	F	36.4	Very low	58.1	Low	120 Å²	120	89.7 Å²	89.7	53%	0.526	44%	0.44	S	S	.	.	H	α-helix	trans	-83.4	-35.6	-177.6	-161.3	-106.5	0	0	0	113.5	N147 C148 Q153 H154 R155	N147-F151 WeakPolarHBondContact O-CB 3.43Å; N147-F151 PolarHBondContact O-N 2.76Å; C148-F151 PolarHBondContact O-N 2.93Å; F151-Q153 VanDerWaalsContact C-N 3.3Å; F151-Q153 PolarHBondContact O-N 3.4Å; F151-H154 PolarHBondContact O-N 3.32Å; F151-R155 VanDerWaalsContact CZ-NE 3.28Å; F151-R155 PolarHBondContact O-N 2.89Å
152	S	44.1	Very low	60	Low	41 Å²	41	90.7 Å²	90.7	29%	0.287	44%	0.443	S	S	.	.	H	α-helix	trans	-67.2	-32.4	175.5	-170.1	0	0	0	0	111.6	C148 H154	C148-S152 WeakPolarHBondContact O-CB 3.42Å; C148-S152 PolarHBondContact O-N 2.89Å; S152-H154 PolarHBondContact O-N 3.04Å
153	Q	50.6	Low	61.9	Low	91 Å²	91	83.7 Å²	83.7	43%	0.425	41%	0.41	S	S	.	.	H	α-helix	trans	-70.4	-27.3	176.8	-76.2	177.8	-1.4	0	0	114.1	K149 F151 L157	K149-Q153 WeakPolarHBondContact O-CG 3.49Å; K149-Q153 PolarHBondContact O-N 2.78Å; F151-Q153 VanDerWaalsContact C-N 3.3Å; F151-Q153 PolarHBondContact O-N 3.4Å; Q153-L157 WeakPolarHBondContact O-CB 3.47Å; Q153-L157 WeakPolarHBondContact O-CD2 3.47Å
154	H	52.4	Low	63.5	Low	134 Å²	134	84.7 Å²	84.7	62%	0.62	41%	0.412	S	S	*	.	H	α-helix	trans	-92.7	-21.9	-177.4	-72.3	-60.4	0	0	0	113.9	R150 F151 S152 G156	R150-H154 PolarHBondContact O-CD2 3.4Å; F151-H154 PolarHBondContact O-N 3.32Å; S152-H154 PolarHBondContact O-N 3.04Å; H154-G156 PolarHBondContact O-N 2.93Å; H154-G156 VanDerWaalsContact O-N 3.11Å
155	R	51.8	Low	65.4	Low	169 Å²	169	84.1 Å²	84.1	64%	0.638	40%	0.404	S	S	*	.	S	Bend	trans	-87	78.8	178.2	-70.4	-170	171.4	-166.4	-3.5	110.7	F151	F151-R155 VanDerWaalsContact CZ-NE 3.28Å; F151-R155 PolarHBondContact O-N 2.89Å
156	G	70.9	Confident	67.7	Low	16 Å²	16	80.7 Å²	80.7	17%	0.165	39%	0.39	C	S	.	.	S	Bend	trans	126.7	-3.1	174.3	0	0	0	0	0	115.3	V115 D116 S119 H154	V115-G156 WeakPolarHBondContact CA-O 3.33Å; D116-G156 PolarHBondContact N-O 3.45Å; S119-G156 WeakPolarHBondContact OG-CA 3.09Å; H154-G156 PolarHBondContact O-N 2.93Å; H154-G156 VanDerWaalsContact O-N 3.11Å
157	L	82.5	Confident	69.8	Low	40 Å²	40	77.3 Å²	77.3	21%	0.209	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	115.3	172.9	-172.3	69.1	0	0	0	109.6	R113 V115 Q153 V159 D160	R113-L157 HydrophobicContact CB-CD1 3.91Å; R113-L157 HydrophobicContact CG-CD1 4.37Å; V115-L157 HydrophobicContact CG2-CD1 4.1Å; Q153-L157 WeakPolarHBondContact O-CB 3.47Å; Q153-L157 WeakPolarHBondContact O-CD2 3.47Å; L157-V159 WeakPolarHBondContact CD1-O 3.03Å; L157-D160 HydrophobicContact CD2-CB 3.7Å; L157-D160 HydrophobicContact CG-CB 4.36Å
158	I	86.6	Confident	72.3	Confident	61 Å²	61	75.2 Å²	75.2	31%	0.313	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-41.6	-179.5	-56.4	166.5	0	0	0	110.1	Y71 T101 V114 D116	Y71-I158 HydrophobicContact CD1-CG2 3.6Å; Y71-I158 HydrophobicContact CE1-CG2 3.82Å; Y71-I158 HydrophobicContact CG-CG2 4.48Å; T101-I158 HydrophobicContact CG2-CD1 3.51Å; V114-I158 HydrophobicContact CB-CB 4.29Å; V114-I158 HydrophobicContact CG1-CB 4.23Å; V114-I158 HydrophobicContact CG1-CD1 4.04Å; V114-I158 PolarHBondContact O-N 2.97Å; D116-I158 HydrophobicContact CB-CD1 3.68Å; D116-I158 HydrophobicContact CB-CG1 4.01Å
159	V	89.3	Confident	75	Confident	11 Å²	11	72.8 Å²	72.8	7%	0.067	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	130.9	-176.6	-176.6	0	0	0	0	109	Y71 R113 V114 L157 Q161 Y181	Y71-V159 HydrophobicContact CD1-CG2 4.46Å; Y71-V159 HydrophobicContact CD2-CG2 4.39Å; Y71-V159 HydrophobicContact CE1-CG2 4.01Å; Y71-V159 HydrophobicContact CE2-CG2 3.93Å; R113-V159 CarbonylContact C-O 3.57Å; R113-V159 VanDerWaalsContact CA-O 3.29Å; R113-V159 WeakPolarHBondContact CA-O 3.41Å; V114-V159 HydrophobicContact CB-CB 3.86Å; V114-V159 HydrophobicContact CB-CG2 4.03Å; V114-V159 HydrophobicContact CG2-CB 3.7Å; V114-V159 HydrophobicContact CG2-CG1 4.49Å; V114-V159 HydrophobicContact CG2-CG2 3.91Å; V114-V159 PolarHBondContact N-O 3.23Å; V114-V159 PolarHBondContact O-N 3.4Å; L157-V159 WeakPolarHBondContact CD1-O 3.03Å; V159-Q161 HydrophobicContact CG1-CB 4.17Å; V159-Y181 WeakPolarHBondContact CG1-OH 3.3Å
160	D	90.3	Very high	77.6	Confident	79 Å²	79	67 Å²	67	42%	0.422	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	90.8	170.9	-167.9	2.1	0	0	0	109.6	R113 L157	R113-D160 IonicContact CZ-OD1 3.83Å; R113-D160 IonicContact CZ-OD2 3.28Å; R113-D160 IonicContact NE-OD1 2.66Å; R113-D160 IonicContact NH1-OD1 3.83Å; R113-D160 PolarHBondContact NH1-OD1 2.86Å; R113-D160 IonicContact NH1-OD2 3.55Å; R113-D160 PolarHBondContact NH1-OD2 3.26Å; R113-D160 IonicContact NH2-OD1 3.17Å; R113-D160 PolarHBondContact NH2-OD1 3.44Å; R113-D160 IonicContact NH2-OD2 3.15Å; L157-D160 HydrophobicContact CD2-CB 3.7Å; L157-D160 HydrophobicContact CG-CB 4.36Å
161	Q	91.5	Very high	80.3	Confident	21 Å²	21	59.9 Å²	59.9	10%	0.098	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118	-175.2	-171.4	58	70.7	0	0	109.6	G111 L112 V159 V166 Y181 C183	G111-Q161 CarbonylContact C-O 3.57Å; G111-Q161 WeakPolarHBondContact CA-O 3.44Å; L112-Q161 HydrophobicContact CB-CB 4.41Å; L112-Q161 PolarHBondContact N-O 3.37Å; L112-Q161 PolarHBondContact O-N 2.8Å; V159-Q161 HydrophobicContact CG1-CB 4.17Å; Q161-V166 HydrophobicContact CG-CG2 3.61Å; Q161-Y181 HydrophobicContact CG-CE2 3.99Å; Q161-C183 HydrophobicContact CG-CB 4.23Å; Q161-C183 PolarHBondContact OE1-SG 2.91Å
162	T	92.5	Very high	83.1	Confident	56 Å²	56	54.5 Å²	54.5	34%	0.344	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	140.3	170.8	57.2	0	0	0	0	109.7	E164 K165	T162-E164 PolarHBondContact O-N 3.14Å; T162-K165 PolarHBondContact O-N 2.93Å; T162-K165 VanDerWaalsContact O-N 3.12Å; T162-K165 WeakPolarHBondContact OG1-CD 3.36Å; T162-K165 WeakPolarHBondContact OG1-CG 3.43Å
163	I	93.2	Very high	85.4	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-63.9	-32.3	-175.7	-168.5	65.8	0	0	0	111.7	G109 D110 K165 V166 V210 A213 F214 C217	G109-I163 WeakPolarHBondContact O-CG2 3.22Å; D110-I163 PolarHBondContact O-N 3.25Å; I163-K165 PolarHBondContact O-N 2.86Å; I163-K165 VanDerWaalsContact O-N 3.11Å; I163-V166 PolarHBondContact O-N 3.04Å; I163-V210 HydrophobicContact CD1-CG1 4.38Å; I163-A213 HydrophobicContact CD1-CB 4.2Å; I163-A213 HydrophobicContact CG1-CB 4.45Å; I163-F214 HydrophobicContact CD1-CD1 3.75Å; I163-F214 HydrophobicContact CD1-CD2 4.45Å; I163-F214 HydrophobicContact CD1-CE1 3.62Å; I163-F214 HydrophobicContact CD1-CE2 4.35Å; I163-F214 HydrophobicContact CD1-CG 4.18Å; I163-F214 HydrophobicContact CD1-CZ 3.96Å; I163-F214 HydrophobicContact CG1-CD1 3.72Å; I163-F214 HydrophobicContact CG1-CE1 3.88Å; I163-F214 HydrophobicContact CG1-CG 4.39Å; I163-C217 HydrophobicContact CG1-CB 4.38Å; I163-C217 HydrophobicContact CG2-CB 3.62Å; I163-C217 WeakPolarHBondContact CG2-SG 3.37Å
164	E	91.1	Very high	87.3	Confident	128 Å²	128	63.8 Å²	63.8	60%	0.598	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-61.9	-20.9	177.5	-63.2	-173.9	156.2	0	0	114	T162 R224	T162-E164 PolarHBondContact O-N 3.14Å; E164-R224 IonicContact OE1-NH2 3.05Å; E164-R224 PolarHBondContact OE1-NH2 2.91Å
165	K	92.1	Very high	89.2	Confident	107 Å²	107	61 Å²	61	47%	0.465	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-92.5	-14.2	178	-77.1	-178.5	-177.6	178.5	0	112.7	T162 I163 C183 R184	T162-K165 PolarHBondContact O-N 2.93Å; T162-K165 VanDerWaalsContact O-N 3.12Å; T162-K165 WeakPolarHBondContact OG1-CD 3.36Å; T162-K165 WeakPolarHBondContact OG1-CG 3.43Å; I163-K165 PolarHBondContact O-N 2.86Å; I163-K165 VanDerWaalsContact O-N 3.11Å; K165-C183 CarbonylContact O-C 3.43Å; K165-C183 VanDerWaalsContact O-CA 3.25Å; K165-C183 WeakPolarHBondContact O-CA 3.21Å; K165-C183 WeakPolarHBondContact O-CB 3.46Å; K165-R184 PolarHBondContact O-N 2.79Å
166	V	94.2	Very high	91.2	Very high	9 Å²	9	57.6 Å²	57.6	6%	0.055	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	122.9	176.6	-168.2	0	0	0	0	107.3	L112 Q161 I163 Y181 I182 C183 F214	L112-V166 HydrophobicContact CD1-CG2 4.26Å; Q161-V166 HydrophobicContact CG-CG2 3.61Å; I163-V166 PolarHBondContact O-N 3.04Å; V166-Y181 HydrophobicContact CG1-CD2 3.72Å; V166-Y181 HydrophobicContact CG1-CG 3.96Å; V166-Y181 HydrophobicContact CG2-CD2 4.26Å; V166-Y181 HydrophobicContact CG2-CE2 4.37Å; V166-I182 CarbonylContact C-O 3.59Å; V166-I182 WeakPolarHBondContact CA-O 3.47Å; V166-I182 WeakPolarHBondContact CG1-O 3.41Å; V166-C183 HydrophobicContact CG2-CB 4.37Å; V166-F214 HydrophobicContact CB-CE1 3.89Å; V166-F214 HydrophobicContact CB-CZ 3.64Å; V166-F214 HydrophobicContact CG1-CE1 4.3Å; V166-F214 HydrophobicContact CG1-CE2 4.43Å; V166-F214 HydrophobicContact CG1-CZ 3.53Å; V166-F214 VanDerWaalsContact O-CE1 3.32Å; V166-F214 WeakPolarHBondContact O-CE1 3.31Å
167	S	93.3	Very high	92.4	Very high	51 Å²	51	60.7 Å²	60.7	36%	0.357	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-33.7	-177.2	50.1	0	0	0	0	112.5	S80 I182	S80-S167 WeakPolarHBondContact O-CB 3.33Å; S80-S167 PolarHBondContact O-OG 2.87Å; S167-I182 PolarHBondContact N-O 3.5Å; S167-I182 PolarHBondContact OG-O 3.44Å
168	F	95.2	Very high	93	Very high	62 Å²	62	58.8 Å²	58.8	27%	0.272	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	142.9	-174.8	-172.7	-106.7	0	0	0	110.5	R81 A170 Y181 I182	R81-F168 HydrophobicContact CB-CB 4.08Å; R81-F168 HydrophobicContact CB-CD2 4.24Å; R81-F168 HydrophobicContact CB-CG 4.11Å; F168-A170 HydrophobicContact CD1-CB 4.3Å; F168-A170 HydrophobicContact CE1-CB 3.55Å; F168-A170 HydrophobicContact CZ-CB 4.18Å; F168-Y181 CarbonylContact O-C 3.54Å; F168-Y181 VanDerWaalsContact O-CA 3.29Å; F168-Y181 WeakPolarHBondContact O-CA 3.46Å; F168-Y181 WeakPolarHBondContact O-CB 3.43Å; F168-I182 HydrophobicContact CD1-CD1 4.43Å; F168-I182 PolarHBondContact N-O 2.76Å; F168-I182 PolarHBondContact O-N 3.27Å
169	C	96.4	Very high	93.5	Very high	25 Å²	25	55.9 Å²	55.9	17%	0.169	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.4	171	65.9	0	0	0	0	109.7	F179 V210 F214	C169-F179 HydrophobicContact CB-CE2 4Å; C169-F179 HydrophobicContact CB-CZ 4.05Å; C169-V210 HydrophobicContact CB-CG1 4Å; C169-F214 HydrophobicContact CB-CE2 4.14Å
170	A	96.2	Very high	93.9	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	139.6	-178.1	0	0	0	0	0	111.8	M83 C86 F168 A180	M83-A170 HydrophobicContact CE-CB 3.82Å; M83-A170 HydrophobicContact SD-CB 3.42Å; M83-A170 WeakPolarHBondContact SD-CB 3.4Å; C86-A170 HydrophobicContact CB-CB 4.1Å; F168-A170 HydrophobicContact CD1-CB 4.3Å; F168-A170 HydrophobicContact CE1-CB 3.55Å; F168-A170 HydrophobicContact CZ-CB 4.18Å; A170-A180 PolarHBondContact N-O 3.18Å; A170-A180 PolarHBondContact O-N 3.44Å; A170-A180 VanDerWaalsContact O-O 3.09Å
171	P	96	Very high	94.2	Very high	34 Å²	34	51.7 Å²	51.7	22%	0.221	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	155.7	164.1	32	-31.8	0	0	0	110.2	E204 S207	P171-E204 HydrophobicContact CB-CG 4.15Å; P171-E204 HydrophobicContact CG-CG 4.41Å; P171-S207 WeakPolarHBondContact CB-OG 3.39Å; P171-S207 VanDerWaalsContact CD-OG 3.29Å; P171-S207 WeakPolarHBondContact CD-OG 3.49Å
172	D	95.2	Very high	94.5	Very high	8 Å²	8	50.7 Å²	50.7	4%	0.043	24%	0.244	C	C	.	.			trans	-89.7	121	174.8	-179.8	-14.5	0	0	0	110.2	R94 N174 H175 G178	R94-D172 IonicContact CZ-OD2 2.78Å; R94-D172 IonicContact NH1-OD2 3.33Å; R94-D172 PolarHBondContact NH1-OD2 2.8Å; R94-D172 IonicContact NH2-OD2 3.78Å; R94-D172 PolarHBondContact NH2-OD2 3.09Å; D172-N174 VanDerWaalsContact C-N 3.3Å; D172-N174 PolarHBondContact O-N 3.12Å; D172-N174 WeakPolarHBondContact OD1-CA 3.22Å; D172-N174 WeakPolarHBondContact OD1-CB 3.44Å; D172-N174 PolarHBondContact OD1-N 3.39Å; D172-H175 CarbonylContact O-C 3.58Å; D172-H175 VanDerWaalsContact O-C 3.31Å; D172-H175 PolarHBondContact O-N 3.49Å; D172-H175 PolarHBondContact OD1-N 2.99Å; D172-H175 IonicContact OD1-ND1 2.9Å; D172-H175 IonicContact OD2-CG 3.52Å; D172-H175 IonicContact OD2-ND1 3.24Å; D172-H175 PolarHBondContact OD2-ND1 2.69Å; D172-G178 PolarHBondContact N-O 2.97Å
173	R	92	Very high	94.6	Very high	205 Å²	205	48 Å²	48	77%	0.774	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.3	-179.5	-63.7	173.8	64.1	-140.3	2.5	113.3	E87	E87-R173 WeakPolarHBondContact OE1-CB 3.37Å; E87-R173 WeakPolarHBondContact OE1-CD 3.18Å; E87-R173 WeakPolarHBondContact OE1-CG 3.4Å
174	N	91.1	Very high	94.6	Very high	121 Å²	121	54.4 Å²	54.4	65%	0.647	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-20.8	177.8	-59.8	111.8	0	0	0	112.2	D172	D172-N174 VanDerWaalsContact C-N 3.3Å; D172-N174 PolarHBondContact O-N 3.12Å; D172-N174 WeakPolarHBondContact OD1-CA 3.22Å; D172-N174 WeakPolarHBondContact OD1-CB 3.44Å; D172-N174 PolarHBondContact OD1-N 3.39Å
175	H	92.6	Very high	94.6	Very high	76 Å²	76	51.4 Å²	51.4	35%	0.352	24%	0.238	S	C	.	.			trans	-138.6	107.2	-178.4	-57.3	76.8	0	0	0	109.6	R94 D172 K177 G178	R94-H175 PolarHBondContact NH1-CE1 3.15Å; R94-H175 PolarHBondContact NH1-ND1 3.47Å; R94-H175 PolarHBondContact NH2-ND1 2.92Å; R94-H175 VanDerWaalsContact NH2-ND1 3.19Å; D172-H175 CarbonylContact O-C 3.58Å; D172-H175 VanDerWaalsContact O-C 3.31Å; D172-H175 PolarHBondContact O-N 3.49Å; D172-H175 PolarHBondContact OD1-N 2.99Å; D172-H175 IonicContact OD1-ND1 2.9Å; D172-H175 IonicContact OD2-CG 3.52Å; D172-H175 IonicContact OD2-ND1 3.24Å; D172-H175 PolarHBondContact OD2-ND1 2.69Å; H175-K177 PolarHBondContact O-N 2.92Å; H175-G178 WeakPolarHBondContact O-CA 3.29Å; H175-G178 PolarHBondContact O-N 3.32Å
176	E	93.5	Very high	94.2	Very high	97 Å²	97	49.3 Å²	49.3	45%	0.453	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-33.4	-178.5	-169.1	-169.8	167	0	0	113.2	S202 G203	E176-S202 PolarHBondContact O-OG 2.85Å; E176-S202 VanDerWaalsContact O-OG 3.13Å; E176-G203 PolarHBondContact O-N 3.21Å
177	K	95.7	Very high	93.8	Very high	81 Å²	81	54.6 Å²	54.6	35%	0.352	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-4	178.5	-60.3	-170	175	-163.1	0	114.5	H175 H197 A198 I199	H175-K177 PolarHBondContact O-N 2.92Å; K177-H197 CarbonylContact O-C 3.43Å; K177-H197 WeakPolarHBondContact O-CA 3.47Å; K177-A198 HydrophobicContact CB-CB 4.37Å; K177-A198 WeakPolarHBondContact CD-O 3.23Å; K177-A198 PolarHBondContact O-N 2.9Å; K177-I199 PolarHBondContact NZ-O 3.37Å; K177-I199 VanDerWaalsContact NZ-O 3.09Å
178	G	95.6	Very high	93.4	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	132.7	-179.3	0	0	0	0	0	111.4	D172 H175	D172-G178 PolarHBondContact N-O 2.97Å; H175-G178 WeakPolarHBondContact O-CA 3.29Å; H175-G178 PolarHBondContact O-N 3.32Å
179	F	96.8	Very high	93	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	135.8	176.2	171.1	-111.2	0	0	0	109.6	C169 Y181 F196 L206 S207 V210	C169-F179 HydrophobicContact CB-CE2 4Å; C169-F179 HydrophobicContact CB-CZ 4.05Å; F179-Y181 HydrophobicContact CE1-CD1 4.21Å; F179-F196 HydrophobicContact CB-CB 4.46Å; F179-F196 HydrophobicContact CD1-CB 4.21Å; F179-F196 AromaticContact CD1-CD2 3.91Å; F179-F196 HydrophobicContact CD1-CD2 3.91Å; F179-F196 HydrophobicContact CD1-CG 4.33Å; F179-F196 HydrophobicContact CE1-CD2 4.28Å; F179-F196 PolarHBondContact N-O 3.46Å; F179-F196 WeakPolarHBondContact O-CA 3.42Å; F179-F196 PolarHBondContact O-N 2.85Å; F179-F196 VanDerWaalsContact O-O 3.11Å; F179-L206 HydrophobicContact CB-CB 4.31Å; F179-L206 HydrophobicContact CB-CD2 4.2Å; F179-L206 HydrophobicContact CD1-CB 4.13Å; F179-L206 HydrophobicContact CD1-CD2 4.05Å; F179-L206 HydrophobicContact CD2-CB 4.26Å; F179-L206 HydrophobicContact CG-CB 3.95Å; F179-L206 HydrophobicContact CG-CD2 4.28Å; F179-S207 WeakPolarHBondContact CD2-OG 3.39Å; F179-S207 WeakPolarHBondContact CE2-OG 3.33Å; F179-V210 HydrophobicContact CE1-CG2 4.11Å; F179-V210 HydrophobicContact CZ-CB 4.18Å; F179-V210 HydrophobicContact CZ-CG1 4.49Å; F179-V210 HydrophobicContact CZ-CG2 3.66Å
180	A	96.6	Very high	92.9	Very high	1 Å²	1	67 Å²	67	1%	0.008	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	154.4	176.3	0	0	0	0	0	112.3	C86 M90 A170 H194	C86-A180 HydrophobicContact CB-CB 4.1Å; M90-A180 HydrophobicContact CG-CB 3.8Å; M90-A180 HydrophobicContact SD-CB 4Å; A170-A180 PolarHBondContact N-O 3.18Å; A170-A180 PolarHBondContact O-N 3.44Å; A170-A180 VanDerWaalsContact O-O 3.09Å; A180-H194 WeakPolarHBondContact CA-O 3.3Å; A180-H194 WeakPolarHBondContact CB-O 3.3Å
181	Y	97.5	Very high	92.8	Very high	1 Å²	1	69.9 Å²	69.9	0%	0.004	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.4	169.9	70.5	-106.6	0	0	0	111.1	L112 V159 Q161 V166 F168 F179 C183 C193 H194 F196	L112-Y181 HydrophobicContact CD1-CD1 3.76Å; L112-Y181 HydrophobicContact CD1-CE1 3.63Å; L112-Y181 HydrophobicContact CD1-CG 4.37Å; V159-Y181 WeakPolarHBondContact CG1-OH 3.3Å; Q161-Y181 HydrophobicContact CG-CE2 3.99Å; V166-Y181 HydrophobicContact CG1-CD2 3.72Å; V166-Y181 HydrophobicContact CG1-CG 3.96Å; V166-Y181 HydrophobicContact CG2-CD2 4.26Å; V166-Y181 HydrophobicContact CG2-CE2 4.37Å; F168-Y181 CarbonylContact O-C 3.54Å; F168-Y181 VanDerWaalsContact O-CA 3.29Å; F168-Y181 WeakPolarHBondContact O-CA 3.46Å; F168-Y181 WeakPolarHBondContact O-CB 3.43Å; F179-Y181 HydrophobicContact CE1-CD1 4.21Å; Y181-C183 HydrophobicContact CD2-CB 4.15Å; Y181-C183 HydrophobicContact CE2-CB 3.94Å; Y181-C193 CarbonylContact O-C 3.52Å; Y181-C193 VanDerWaalsContact O-CA 3.28Å; Y181-C193 WeakPolarHBondContact O-CA 3.34Å; Y181-H194 HydrophobicContact CD1-CB 4.28Å; Y181-H194 HydrophobicContact CD2-CB 4.23Å; Y181-H194 HydrophobicContact CE1-CB 3.86Å; Y181-H194 HydrophobicContact CE2-CB 3.76Å; Y181-H194 AromaticContact CE2-CD2 3.39Å; Y181-H194 WeakPolarHBondContact CE2-CD2 3.29Å; Y181-H194 AromaticContact CE2-CG 3.7Å; Y181-H194 HydrophobicContact CG-CB 4.47Å; Y181-H194 AromaticContact CZ-CD2 3.79Å; Y181-H194 AromaticContact CZ-CG 3.64Å; Y181-H194 PolarHBondContact N-O 2.77Å; Y181-H194 VanDerWaalsContact N-O 3.08Å; Y181-H194 PolarHBondContact O-N 3.46Å; Y181-F196 HydrophobicContact CD1-CD2 4.41Å; Y181-F196 AromaticContact CD1-CE2 3.66Å; Y181-F196 HydrophobicContact CD1-CE2 3.66Å; Y181-F196 HydrophobicContact CE1-CD2 4.37Å; Y181-F196 AromaticContact CE1-CE2 3.28Å; Y181-F196 HydrophobicContact CE1-CE2 3.28Å; Y181-F196 AromaticContact CE1-CZ 3.7Å; Y181-F196 HydrophobicContact CE1-CZ 3.7Å
182	I	96.9	Very high	92.8	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	130.1	175.1	-57.1	170.3	0	0	0	108	V77 I85 V166 S167 F168 W191 L192 C193	V77-I182 HydrophobicContact CG2-CD1 4.49Å; V77-I182 HydrophobicContact CG2-CG1 4.42Å; V77-I182 HydrophobicContact CG2-CG2 3.93Å; I85-I182 HydrophobicContact CB-CD1 4.44Å; I85-I182 HydrophobicContact CG2-CD1 4.07Å; V166-I182 CarbonylContact C-O 3.59Å; V166-I182 WeakPolarHBondContact CA-O 3.47Å; V166-I182 WeakPolarHBondContact CG1-O 3.41Å; S167-I182 PolarHBondContact N-O 3.5Å; S167-I182 PolarHBondContact OG-O 3.44Å; F168-I182 HydrophobicContact CD1-CD1 4.43Å; F168-I182 PolarHBondContact N-O 2.76Å; F168-I182 PolarHBondContact O-N 3.27Å; I182-W191 HydrophobicContact CG2-CB 4.17Å; I182-W191 HydrophobicContact CG2-CE3 4.12Å; I182-L192 CarbonylContact C-O 3.51Å; I182-L192 WeakPolarHBondContact CA-O 3.14Å; I182-C193 HydrophobicContact CG1-CB 4.2Å
183	C	95.4	Very high	92.8	Very high	1 Å²	1	68.9 Å²	68.9	1%	0.007	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	157.1	175.2	71	0	0	0	0	111.7	Q161 K165 V166 Y181 L192 H194	Q161-C183 HydrophobicContact CG-CB 4.23Å; Q161-C183 PolarHBondContact OE1-SG 2.91Å; K165-C183 CarbonylContact O-C 3.43Å; K165-C183 VanDerWaalsContact O-CA 3.25Å; K165-C183 WeakPolarHBondContact O-CA 3.21Å; K165-C183 WeakPolarHBondContact O-CB 3.46Å; V166-C183 HydrophobicContact CG2-CB 4.37Å; Y181-C183 HydrophobicContact CD2-CB 4.15Å; Y181-C183 HydrophobicContact CE2-CB 3.94Å; C183-L192 PolarHBondContact N-O 3.02Å; C183-L192 PolarHBondContact O-N 2.89Å; C183-H194 VanDerWaalsContact SG-CD2 3.53Å; C183-H194 PolarHBondContact SG-NE2 3.07Å; C183-H194 VanDerWaalsContact SG-NE2 3.43Å
184	R	93.7	Very high	93	Very high	136 Å²	136	59.9 Å²	59.9	51%	0.513	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	120.4	174.2	-162.5	167.2	-177.9	164	1.8	110.4	K165 W191	K165-R184 PolarHBondContact O-N 2.79Å; R184-W191 HydrophobicContact CB-CE3 3.9Å; R184-W191 HydrophobicContact CB-CH2 4.04Å; R184-W191 HydrophobicContact CB-CZ3 3.51Å; R184-W191 HydrophobicContact CG-CE3 4.26Å; R184-W191 HydrophobicContact CG-CH2 4.15Å; R184-W191 HydrophobicContact CG-CZ3 4.01Å
185	E	91.4	Very high	93.2	Very high	65 Å²	65	54.1 Å²	54.1	30%	0.304	26%	0.259	S	S	.	.			trans	-85.7	123.3	172.5	-168.7	179.1	-149.6	0	0	110.4	T187 T188 R189 R190 L192	E185-T187 WeakPolarHBondContact CG-OG1 3.41Å; E185-T187 PolarHBondContact OE1-OG1 2.98Å; E185-T188 WeakPolarHBondContact OE2-CB 3.48Å; E185-T188 WeakPolarHBondContact OE2-CG2 3.47Å; E185-T188 PolarHBondContact OE2-OG1 3.43Å; E185-R189 PolarHBondContact O-N 3.18Å; E185-R190 PolarHBondContact N-O 3.29Å; E185-R190 VanDerWaalsContact N-O 3.17Å; E185-L192 HydrophobicContact CB-CD1 3.89Å; E185-L192 HydrophobicContact CB-CG 4.08Å; E185-L192 HydrophobicContact CG-CD1 4.11Å; E185-L192 WeakPolarHBondContact OE2-CD1 3.37Å
186	G	82.6	Confident	93.4	Very high	62 Å²	62	50.5 Å²	50.5	64%	0.639	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-26.7	-173.6	0	0	0	0	0	114.4
187	T	85.2	Confident	93.5	Very high	121 Å²	121	48.8 Å²	48.8	74%	0.742	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-45.2	-176	46.1	0	0	0	0	111.8	E185	E185-T187 WeakPolarHBondContact CG-OG1 3.41Å; E185-T187 PolarHBondContact OE1-OG1 2.98Å
188	T	85.3	Confident	93.5	Very high	61 Å²	61	44.9 Å²	44.9	37%	0.374	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-13.7	-173.9	60.1	0	0	0	0	113.2	E185 R190	E185-T188 WeakPolarHBondContact OE2-CB 3.48Å; E185-T188 WeakPolarHBondContact OE2-CG2 3.47Å; E185-T188 PolarHBondContact OE2-OG1 3.43Å; T188-R190 PolarHBondContact O-N 2.85Å; T188-R190 VanDerWaalsContact O-N 3.17Å; T188-R190 PolarHBondContact OG1-N 3.02Å
189	R	88	Confident	93.5	Very high	209 Å²	209	47.7 Å²	47.7	79%	0.789	23%	0.231	S	C	*	.			trans	56.8	19.7	-170.6	-55.1	-178	173.6	-139.1	-1.3	113.2	E185	E185-R189 PolarHBondContact O-N 3.18Å
190	R	92.9	Very high	93.2	Very high	127 Å²	127	56.2 Å²	56.2	48%	0.479	26%	0.264	S	S	.	.			trans	-100.7	161.6	177.9	-66.4	163.6	178.6	-138.4	2.1	110.1	E76 E185 T188	E76-R190 VanDerWaalsContact CD-CD 3.48Å; E76-R190 VanDerWaalsContact CD-NH1 3.29Å; E76-R190 HydrophobicContact CG-CB 4.3Å; E76-R190 WeakPolarHBondContact OE1-CD 3.34Å; E76-R190 WeakPolarHBondContact OE1-CG 3.43Å; E76-R190 IonicContact OE1-CZ 3.51Å; E76-R190 IonicContact OE1-NE 3.52Å; E76-R190 IonicContact OE1-NH1 2.71Å; E76-R190 PolarHBondContact OE1-NH1 3.37Å; E76-R190 IonicContact OE2-CZ 3.73Å; E76-R190 IonicContact OE2-NH1 2.76Å; E76-R190 PolarHBondContact OE2-NH1 3.12Å; E185-R190 PolarHBondContact N-O 3.29Å; E185-R190 VanDerWaalsContact N-O 3.17Å; T188-R190 PolarHBondContact O-N 2.85Å; T188-R190 VanDerWaalsContact O-N 3.17Å; T188-R190 PolarHBondContact OG1-N 3.02Å
191	W	95.3	Very high	93	Very high	61 Å²	61	57.7 Å²	57.7	23%	0.231	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.8	171.7	-61	104.2	0	0	0	109.2	E76 V77 S80 I182 R184	E76-W191 WeakPolarHBondContact CA-O 3.28Å; V77-W191 HydrophobicContact CG2-CB 3.72Å; V77-W191 PolarHBondContact N-O 2.91Å; V77-W191 WeakPolarHBondContact O-CB 2.83Å; S80-W191 VanDerWaalsContact CB-CE2 3.43Å; S80-W191 VanDerWaalsContact CB-CZ2 3.41Å; I182-W191 HydrophobicContact CG2-CB 4.17Å; I182-W191 HydrophobicContact CG2-CE3 4.12Å; R184-W191 HydrophobicContact CB-CE3 3.9Å; R184-W191 HydrophobicContact CB-CH2 4.04Å; R184-W191 HydrophobicContact CB-CZ3 3.51Å; R184-W191 HydrophobicContact CG-CE3 4.26Å; R184-W191 HydrophobicContact CG-CH2 4.15Å; R184-W191 HydrophobicContact CG-CZ3 4.01Å
192	L	94.9	Very high	92.9	Very high	22 Å²	22	58.7 Å²	58.7	12%	0.115	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.3	176.8	-64.4	-175.7	0	0	0	109.3	V75 E76 I182 C183 E185	V75-L192 CarbonylContact O-C 3.58Å; V75-L192 WeakPolarHBondContact O-CA 3.36Å; E76-L192 HydrophobicContact CB-CD2 4.22Å; I182-L192 CarbonylContact C-O 3.51Å; I182-L192 WeakPolarHBondContact CA-O 3.14Å; C183-L192 PolarHBondContact N-O 3.02Å; C183-L192 PolarHBondContact O-N 2.89Å; E185-L192 HydrophobicContact CB-CD1 3.89Å; E185-L192 HydrophobicContact CB-CG 4.08Å; E185-L192 HydrophobicContact CG-CD1 4.11Å; E185-L192 WeakPolarHBondContact OE2-CD1 3.37Å
193	C	96.4	Very high	92.8	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	122.9	169	-173	0	0	0	0	109.4	C74 V75 V77 A89 Y181 I182	C74-C193 CarbonylContact C-O 3.47Å; C74-C193 WeakPolarHBondContact CA-O 3.3Å; V75-C193 HydrophobicContact CG1-CB 4.06Å; V75-C193 PolarHBondContact N-O 3.02Å; V75-C193 PolarHBondContact O-N 2.96Å; V77-C193 HydrophobicContact CG1-CB 3.54Å; V77-C193 HydrophobicContact CG2-CB 4.17Å; A89-C193 HydrophobicContact CB-CB 3.73Å; A89-C193 WeakPolarHBondContact CB-SG 3.37Å; Y181-C193 CarbonylContact O-C 3.52Å; Y181-C193 VanDerWaalsContact O-CA 3.28Å; Y181-C193 WeakPolarHBondContact O-CA 3.34Å; I182-C193 HydrophobicContact CG1-CB 4.2Å
194	H	95.6	Very high	92.8	Very high	15 Å²	15	64.2 Å²	64.2	7%	0.069	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	130.1	175.3	-69.7	-100.2	0	0	0	109.9	Y71 A180 Y181 C183 F196	Y71-H194 HydrophobicContact CE2-CB 4.37Å; Y71-H194 AromaticContact CE2-ND1 3.85Å; Y71-H194 AromaticContact CZ-ND1 3.85Å; Y71-H194 PolarHBondContact OH-ND1 3.23Å; A180-H194 WeakPolarHBondContact CA-O 3.3Å; A180-H194 WeakPolarHBondContact CB-O 3.3Å; Y181-H194 HydrophobicContact CD1-CB 4.28Å; Y181-H194 HydrophobicContact CD2-CB 4.23Å; Y181-H194 HydrophobicContact CE1-CB 3.86Å; Y181-H194 HydrophobicContact CE2-CB 3.76Å; Y181-H194 AromaticContact CE2-CD2 3.39Å; Y181-H194 WeakPolarHBondContact CE2-CD2 3.29Å; Y181-H194 AromaticContact CE2-CG 3.7Å; Y181-H194 HydrophobicContact CG-CB 4.47Å; Y181-H194 AromaticContact CZ-CD2 3.79Å; Y181-H194 AromaticContact CZ-CG 3.64Å; Y181-H194 PolarHBondContact N-O 2.77Å; Y181-H194 VanDerWaalsContact N-O 3.08Å; Y181-H194 PolarHBondContact O-N 3.46Å; C183-H194 VanDerWaalsContact SG-CD2 3.53Å; C183-H194 PolarHBondContact SG-NE2 3.07Å; C183-H194 VanDerWaalsContact SG-NE2 3.43Å; H194-F196 HydrophobicContact CB-CE2 3.72Å; H194-F196 HydrophobicContact CB-CZ 4.16Å
195	G	95.7	Very high	92.8	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.9	-178.1	0	0	0	0	0	113.7	L72 G73 M90	L72-G195 WeakPolarHBondContact CB-O 3.26Å; L72-G195 PolarHBondContact N-O 3.08Å; G73-G195 PolarHBondContact O-N 2.85Å; M90-G195 WeakPolarHBondContact SD-CA 3.16Å
196	F	96.4	Very high	93	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	148	-179.7	-57.6	-89.1	0	0	0	111.1	V69 K70 Y71 M90 V114 F179 Y181 H194	V69-F196 HydrophobicContact CG2-CD1 4.03Å; K70-F196 CarbonylContact O-C 3.31Å; K70-F196 WeakPolarHBondContact O-CA 3.17Å; Y71-F196 AromaticContact CD2-CD1 3.82Å; Y71-F196 HydrophobicContact CD2-CD1 3.82Å; Y71-F196 AromaticContact CD2-CE1 3.29Å; Y71-F196 HydrophobicContact CD2-CE1 3.29Å; Y71-F196 AromaticContact CD2-CZ 3.69Å; Y71-F196 HydrophobicContact CD2-CZ 3.69Å; Y71-F196 AromaticContact CE2-CE1 3.91Å; Y71-F196 HydrophobicContact CE2-CE1 3.91Å; Y71-F196 AromaticContact CE2-CZ 3.81Å; Y71-F196 HydrophobicContact CE2-CZ 3.81Å; Y71-F196 HydrophobicContact CG-CE1 4.19Å; M90-F196 WeakPolarHBondContact CE-O 3.48Å; V114-F196 HydrophobicContact CG2-CE1 3.61Å; V114-F196 HydrophobicContact CG2-CZ 4.13Å; F179-F196 HydrophobicContact CB-CB 4.46Å; F179-F196 HydrophobicContact CD1-CB 4.21Å; F179-F196 AromaticContact CD1-CD2 3.91Å; F179-F196 HydrophobicContact CD1-CD2 3.91Å; F179-F196 HydrophobicContact CD1-CG 4.33Å; F179-F196 HydrophobicContact CE1-CD2 4.28Å; F179-F196 PolarHBondContact N-O 3.46Å; F179-F196 WeakPolarHBondContact O-CA 3.42Å; F179-F196 PolarHBondContact O-N 2.85Å; F179-F196 VanDerWaalsContact O-O 3.11Å; Y181-F196 HydrophobicContact CD1-CD2 4.41Å; Y181-F196 AromaticContact CD1-CE2 3.66Å; Y181-F196 HydrophobicContact CD1-CE2 3.66Å; Y181-F196 HydrophobicContact CE1-CD2 4.37Å; Y181-F196 AromaticContact CE1-CE2 3.28Å; Y181-F196 HydrophobicContact CE1-CE2 3.28Å; Y181-F196 AromaticContact CE1-CZ 3.7Å; Y181-F196 HydrophobicContact CE1-CZ 3.7Å; H194-F196 HydrophobicContact CB-CE2 3.72Å; H194-F196 HydrophobicContact CB-CZ 4.16Å
197	H	95.6	Very high	93.6	Very high	61 Å²	61	55 Å²	55	28%	0.282	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	114.6	169.7	-165.3	88.7	0	0	0	108.9	V69 K70 L72 K177	V69-H197 CarbonylContact C-O 3.54Å; V69-H197 WeakPolarHBondContact CA-O 3.16Å; K70-H197 HydrophobicContact CB-CB 4.09Å; K70-H197 PolarHBondContact N-O 2.94Å; K70-H197 PolarHBondContact O-N 2.99Å; L72-H197 HydrophobicContact CD2-CB 4.46Å; K177-H197 CarbonylContact O-C 3.43Å; K177-H197 WeakPolarHBondContact O-CA 3.47Å
198	A	96.1	Very high	94.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	140	176.7	0	0	0	0	0	110.4	K177 D201 L206	K177-A198 HydrophobicContact CB-CB 4.37Å; K177-A198 WeakPolarHBondContact CD-O 3.23Å; K177-A198 PolarHBondContact O-N 2.9Å; A198-D201 WeakPolarHBondContact CB-O 3.31Å; A198-L206 HydrophobicContact CB-CD1 3.89Å; A198-L206 HydrophobicContact CB-CD2 4.21Å
199	I	94.3	Very high	94.6	Very high	59 Å²	59	49.3 Å²	49.3	30%	0.303	21%	0.21	S	C	.	.	S	Bend	trans	-90.1	-55.9	-177.3	-63.4	174.5	0	0	0	110.1	A68 K177	A68-I199 HydrophobicContact CB-CB 4.25Å; A68-I199 HydrophobicContact CB-CD1 4.29Å; A68-I199 WeakPolarHBondContact O-CB 3.3Å; A68-I199 PolarHBondContact O-N 3Å; K177-I199 PolarHBondContact NZ-O 3.37Å; K177-I199 VanDerWaalsContact NZ-O 3.09Å
200	R	91.7	Very high	95	Very high	179 Å²	179	39.3 Å²	39.3	68%	0.675	17%	0.173	S	C	*	.	S	Bend	trans	-95.8	-36.8	-177.3	-60.4	-174	-170.6	168.1	2.4	112
201	D	93.1	Very high	95.1	Very high	31 Å²	31	34.8 Å²	34.8	17%	0.166	17%	0.165	C	C	.	.	S	Bend	trans	-97.2	171.7	-172.4	-55.7	-75.9	0	0	0	113.2	F67 A198 R205 L206	F67-D201 HydrophobicContact CD1-CB 4.4Å; A198-D201 WeakPolarHBondContact CB-O 3.31Å; D201-R205 IonicContact OD1-CZ 2.72Å; D201-R205 IonicContact OD1-NE 3.91Å; D201-R205 IonicContact OD1-NH1 3.98Å; D201-R205 PolarHBondContact OD1-NH1 3.49Å; D201-L206 HydrophobicContact CB-CD1 3.9Å
202	S	94.6	Very high	95	Very high	23 Å²	23	32.5 Å²	32.5	16%	0.161	16%	0.159	C	C	.	.			trans	-84.3	149.2	167.1	167.4	0	0	0	0	110.6	E176 E204 R205 L206	E176-S202 PolarHBondContact O-OG 2.85Å; E176-S202 VanDerWaalsContact O-OG 3.13Å; S202-E204 PolarHBondContact O-N 3.16Å; S202-E204 PolarHBondContact OG-N 3.49Å; S202-E204 VanDerWaalsContact OG-N 3.17Å; S202-R205 WeakPolarHBondContact O-CB 3.27Å; S202-R205 PolarHBondContact O-N 2.95Å; S202-R205 VanDerWaalsContact O-N 3.14Å; S202-L206 VanDerWaalsContact O-CD1 3.31Å; S202-L206 WeakPolarHBondContact O-CD1 3.38Å; S202-L206 PolarHBondContact O-N 3.44Å
203	G	94.4	Very high	95.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.6	-24.6	172.7	0	0	0	0	0	112.9	E176 L206 S207	E176-G203 PolarHBondContact O-N 3.21Å; G203-L206 PolarHBondContact O-N 2.96Å; G203-S207 WeakPolarHBondContact O-CB 3.49Å; G203-S207 PolarHBondContact O-N 3.36Å; G203-S207 PolarHBondContact O-OG 3.31Å
204	E	94.7	Very high	95	Very high	116 Å²	116	33.5 Å²	33.5	54%	0.542	16%	0.162	S	C	.	.	H	α-helix	trans	-64.9	-42.9	172.1	-64.8	-176.4	162.6	0	0	111.6	P171 S202 L206 S207 H208	P171-E204 HydrophobicContact CB-CG 4.15Å; P171-E204 HydrophobicContact CG-CG 4.41Å; S202-E204 PolarHBondContact O-N 3.16Å; S202-E204 PolarHBondContact OG-N 3.49Å; S202-E204 VanDerWaalsContact OG-N 3.17Å; E204-L206 VanDerWaalsContact C-N 3.34Å; E204-L206 PolarHBondContact O-N 2.88Å; E204-S207 WeakPolarHBondContact O-CB 3.41Å; E204-S207 PolarHBondContact O-N 3.3Å; E204-S207 VanDerWaalsContact O-N 3.17Å; E204-H208 PolarHBondContact O-N 2.76Å
205	R	95	Very high	95	Very high	53 Å²	53	35.1 Å²	35.1	20%	0.2	18%	0.178	C	C	.	.	H	α-helix	trans	-62.3	-42.5	176.9	-173.1	-179.7	179.7	-173.2	2.1	111.4	D56 F67 D201 S202 S207 H208 A209	D56-R205 IonicContact OD1-CZ 2.82Å; D56-R205 IonicContact OD1-NE 2.99Å; D56-R205 IonicContact OD1-NH2 3.64Å; D56-R205 PolarHBondContact OD1-NH2 2.95Å; D56-R205 WeakPolarHBondContact OD2-CG 3.48Å; D56-R205 IonicContact OD2-CZ 3.38Å; D56-R205 IonicContact OD2-NE 3.04Å; D56-R205 PolarHBondContact OD2-NE 3.4Å; D56-R205 IonicContact OD2-NH2 3.65Å; D56-R205 PolarHBondContact OD2-NH2 3.39Å; F67-R205 HydrophobicContact CE1-CG 4.11Å; F67-R205 HydrophobicContact CZ-CG 4.32Å; D201-R205 IonicContact OD1-CZ 2.72Å; D201-R205 IonicContact OD1-NE 3.91Å; D201-R205 IonicContact OD1-NH1 3.98Å; D201-R205 PolarHBondContact OD1-NH1 3.49Å; S202-R205 WeakPolarHBondContact O-CB 3.27Å; S202-R205 PolarHBondContact O-N 2.95Å; S202-R205 VanDerWaalsContact O-N 3.14Å; R205-S207 VanDerWaalsContact C-N 3.35Å; R205-H208 PolarHBondContact O-N 2.92Å; R205-A209 PolarHBondContact O-N 3.36Å
206	L	95.5	Very high	94.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-43.7	174.4	-83.9	69.8	0	0	0	111	F67 V69 L105 F179 A198 D201 S202 G203 E204 H208 A209 V210	F67-L206 HydrophobicContact CB-CD1 4.24Å; F67-L206 HydrophobicContact CB-CG 4.3Å; F67-L206 HydrophobicContact CD1-CD1 4.03Å; F67-L206 HydrophobicContact CD2-CG 4.26Å; F67-L206 HydrophobicContact CG-CD1 4.01Å; F67-L206 HydrophobicContact CG-CG 4.13Å; V69-L206 HydrophobicContact CG1-CD2 3.65Å; L105-L206 HydrophobicContact CD2-CD2 4.21Å; F179-L206 HydrophobicContact CB-CB 4.31Å; F179-L206 HydrophobicContact CB-CD2 4.2Å; F179-L206 HydrophobicContact CD1-CB 4.13Å; F179-L206 HydrophobicContact CD1-CD2 4.05Å; F179-L206 HydrophobicContact CD2-CB 4.26Å; F179-L206 HydrophobicContact CG-CB 3.95Å; F179-L206 HydrophobicContact CG-CD2 4.28Å; A198-L206 HydrophobicContact CB-CD1 3.89Å; A198-L206 HydrophobicContact CB-CD2 4.21Å; D201-L206 HydrophobicContact CB-CD1 3.9Å; S202-L206 VanDerWaalsContact O-CD1 3.31Å; S202-L206 WeakPolarHBondContact O-CD1 3.38Å; S202-L206 PolarHBondContact O-N 3.44Å; G203-L206 PolarHBondContact O-N 2.96Å; E204-L206 VanDerWaalsContact C-N 3.34Å; E204-L206 PolarHBondContact O-N 2.88Å; L206-H208 VanDerWaalsContact C-N 3.31Å; L206-H208 PolarHBondContact O-N 3.44Å; L206-A209 PolarHBondContact O-N 3.16Å; L206-V210 WeakPolarHBondContact O-CG2 3.46Å; L206-V210 PolarHBondContact O-N 2.82Å
207	S	95.3	Very high	94.6	Very high	16 Å²	16	36 Å²	36	11%	0.112	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-40.6	177.3	-56.9	0	0	0	0	111.9	P171 F179 G203 E204 R205 V210 G211	P171-S207 WeakPolarHBondContact CB-OG 3.39Å; P171-S207 VanDerWaalsContact CD-OG 3.29Å; P171-S207 WeakPolarHBondContact CD-OG 3.49Å; F179-S207 WeakPolarHBondContact CD2-OG 3.39Å; F179-S207 WeakPolarHBondContact CE2-OG 3.33Å; G203-S207 WeakPolarHBondContact O-CB 3.49Å; G203-S207 PolarHBondContact O-N 3.36Å; G203-S207 PolarHBondContact O-OG 3.31Å; E204-S207 WeakPolarHBondContact O-CB 3.41Å; E204-S207 PolarHBondContact O-N 3.3Å; E204-S207 VanDerWaalsContact O-N 3.17Å; R205-S207 VanDerWaalsContact C-N 3.35Å; S207-V210 PolarHBondContact O-N 2.95Å; S207-G211 PolarHBondContact O-N 3.41Å
208	H	94.9	Very high	94.4	Very high	63 Å²	63	37.7 Å²	37.7	29%	0.292	19%	0.194	S	C	.	.	H	α-helix	trans	-61.7	-51	174.9	179.6	-95.8	0	0	0	111.7	W53 E204 R205 L206 V210 G211 C212	W53-H208 PolarHBondContact O-CE1 3.12Å; E204-H208 PolarHBondContact O-N 2.76Å; R205-H208 PolarHBondContact O-N 2.92Å; L206-H208 VanDerWaalsContact C-N 3.31Å; L206-H208 PolarHBondContact O-N 3.44Å; H208-V210 VanDerWaalsContact C-N 3.31Å; H208-V210 PolarHBondContact O-N 3.07Å; H208-G211 CarbonylContact O-C 3.59Å; H208-G211 WeakPolarHBondContact O-CA 3.22Å; H208-G211 PolarHBondContact O-N 3.31Å; H208-C212 PolarHBondContact CE1-SG 3.35Å; H208-C212 PolarHBondContact O-N 3.48Å; H208-C212 PolarHBondContact O-SG 3.38Å
209	A	96.1	Very high	94.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-38.8	178.6	0	0	0	0	0	112.7	V60 F67 I107 R205 L206 C212 A213	V60-A209 HydrophobicContact CG2-CB 4.09Å; F67-A209 HydrophobicContact CE2-CB 3.59Å; F67-A209 HydrophobicContact CZ-CB 3.99Å; I107-A209 HydrophobicContact CD1-CB 3.88Å; I107-A209 HydrophobicContact CG2-CB 4.47Å; R205-A209 PolarHBondContact O-N 3.36Å; L206-A209 PolarHBondContact O-N 3.16Å; A209-C212 PolarHBondContact O-N 3.49Å; A209-A213 PolarHBondContact O-N 2.85Å; A209-A213 VanDerWaalsContact O-N 3.08Å
210	V	96	Very high	94	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-67.3	-38.1	172.7	178.5	0	0	0	0	111.3	I107 L112 I163 C169 F179 L206 S207 H208 A213 F214	I107-V210 HydrophobicContact CD1-CG2 3.73Å; I107-V210 HydrophobicContact CG1-CG2 4.47Å; I107-V210 HydrophobicContact CG2-CG2 4.29Å; L112-V210 HydrophobicContact CD1-CG1 4.34Å; L112-V210 HydrophobicContact CD1-CG2 4.37Å; L112-V210 HydrophobicContact CD2-CG1 4.49Å; L112-V210 HydrophobicContact CD2-CG2 3.83Å; I163-V210 HydrophobicContact CD1-CG1 4.38Å; C169-V210 HydrophobicContact CB-CG1 4Å; F179-V210 HydrophobicContact CE1-CG2 4.11Å; F179-V210 HydrophobicContact CZ-CB 4.18Å; F179-V210 HydrophobicContact CZ-CG1 4.49Å; F179-V210 HydrophobicContact CZ-CG2 3.66Å; L206-V210 WeakPolarHBondContact O-CG2 3.46Å; L206-V210 PolarHBondContact O-N 2.82Å; S207-V210 PolarHBondContact O-N 2.95Å; H208-V210 VanDerWaalsContact C-N 3.31Å; H208-V210 PolarHBondContact O-N 3.07Å; V210-A213 WeakPolarHBondContact O-CB 3.42Å; V210-A213 PolarHBondContact O-N 3.43Å; V210-A213 VanDerWaalsContact O-N 3.15Å; V210-F214 HydrophobicContact CG1-CD2 3.97Å; V210-F214 HydrophobicContact CG1-CE2 3.59Å; V210-F214 HydrophobicContact CG1-CZ 4.36Å; V210-F214 VanDerWaalsContact O-CD2 3.23Å; V210-F214 WeakPolarHBondContact O-CD2 3.34Å; V210-F214 PolarHBondContact O-N 2.89Å
211	G	95	Very high	94	Very high	31 Å²	31	41 Å²	41	32%	0.32	21%	0.211	S	C	.	.	H	α-helix	trans	-57.4	-45.3	171.3	0	0	0	0	0	113	S207 H208 A213 F214 A215	S207-G211 PolarHBondContact O-N 3.41Å; H208-G211 CarbonylContact O-C 3.59Å; H208-G211 WeakPolarHBondContact O-CA 3.22Å; H208-G211 PolarHBondContact O-N 3.31Å; G211-A213 VanDerWaalsContact C-N 3.32Å; G211-A213 PolarHBondContact O-N 3.12Å; G211-F214 WeakPolarHBondContact O-CB 3.42Å; G211-F214 PolarHBondContact O-N 3.5Å; G211-A215 PolarHBondContact O-N 3.01Å
212	C	94.9	Very high	93.9	Very high	14 Å²	14	44.1 Å²	44.1	10%	0.095	22%	0.224	C	C	.	.	H	α-helix	trans	-59.8	-42	172.8	-66.5	0	0	0	0	111.4	V60 H208 A209 F214 A215 V216	V60-C212 HydrophobicContact CB-CB 4.33Å; V60-C212 HydrophobicContact CG1-CB 4.2Å; V60-C212 HydrophobicContact CG2-CB 4.49Å; H208-C212 PolarHBondContact CE1-SG 3.35Å; H208-C212 PolarHBondContact O-N 3.48Å; H208-C212 PolarHBondContact O-SG 3.38Å; A209-C212 PolarHBondContact O-N 3.49Å; C212-F214 VanDerWaalsContact C-N 3.33Å; C212-F214 PolarHBondContact O-N 3.5Å; C212-A215 PolarHBondContact O-N 2.8Å; C212-V216 WeakPolarHBondContact O-CG2 3.38Å; C212-V216 PolarHBondContact O-N 2.82Å
213	A	95.7	Very high	93.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-38.3	177.2	0	0	0	0	0	112.2	V60 I107 I163 A209 V210 G211 C217	V60-A213 HydrophobicContact CG1-CB 3.73Å; I107-A213 HydrophobicContact CG2-CB 4Å; I163-A213 HydrophobicContact CD1-CB 4.2Å; I163-A213 HydrophobicContact CG1-CB 4.45Å; A209-A213 PolarHBondContact O-N 2.85Å; A209-A213 VanDerWaalsContact O-N 3.08Å; V210-A213 WeakPolarHBondContact O-CB 3.42Å; V210-A213 PolarHBondContact O-N 3.43Å; V210-A213 VanDerWaalsContact O-N 3.15Å; G211-A213 VanDerWaalsContact C-N 3.32Å; G211-A213 PolarHBondContact O-N 3.12Å; A213-C217 WeakPolarHBondContact O-CB 3.47Å; A213-C217 PolarHBondContact O-N 3.22Å
214	F	95.4	Very high	93.6	Very high	42 Å²	42	54 Å²	54	18%	0.184	26%	0.261	C	S	.	.	H	α-helix	trans	-62	-45.9	172.6	-78.1	-58.7	0	0	0	112.4	I163 V166 C169 V210 G211 C212 V216 C217 L218	I163-F214 HydrophobicContact CD1-CD1 3.75Å; I163-F214 HydrophobicContact CD1-CD2 4.45Å; I163-F214 HydrophobicContact CD1-CE1 3.62Å; I163-F214 HydrophobicContact CD1-CE2 4.35Å; I163-F214 HydrophobicContact CD1-CG 4.18Å; I163-F214 HydrophobicContact CD1-CZ 3.96Å; I163-F214 HydrophobicContact CG1-CD1 3.72Å; I163-F214 HydrophobicContact CG1-CE1 3.88Å; I163-F214 HydrophobicContact CG1-CG 4.39Å; V166-F214 HydrophobicContact CB-CE1 3.89Å; V166-F214 HydrophobicContact CB-CZ 3.64Å; V166-F214 HydrophobicContact CG1-CE1 4.3Å; V166-F214 HydrophobicContact CG1-CE2 4.43Å; V166-F214 HydrophobicContact CG1-CZ 3.53Å; V166-F214 VanDerWaalsContact O-CE1 3.32Å; V166-F214 WeakPolarHBondContact O-CE1 3.31Å; C169-F214 HydrophobicContact CB-CE2 4.14Å; V210-F214 HydrophobicContact CG1-CD2 3.97Å; V210-F214 HydrophobicContact CG1-CE2 3.59Å; V210-F214 HydrophobicContact CG1-CZ 4.36Å; V210-F214 VanDerWaalsContact O-CD2 3.23Å; V210-F214 WeakPolarHBondContact O-CD2 3.34Å; V210-F214 PolarHBondContact O-N 2.89Å; G211-F214 WeakPolarHBondContact O-CB 3.42Å; G211-F214 PolarHBondContact O-N 3.5Å; C212-F214 VanDerWaalsContact C-N 3.33Å; C212-F214 PolarHBondContact O-N 3.5Å; F214-V216 PolarHBondContact O-N 2.95Å; F214-C217 PolarHBondContact O-N 3.42Å; F214-L218 WeakPolarHBondContact O-CB 3.29Å; F214-L218 WeakPolarHBondContact O-CG 3.5Å; F214-L218 PolarHBondContact O-N 3.23Å
215	A	94.3	Very high	93.5	Very high	49 Å²	49	51.9 Å²	51.9	41%	0.405	25%	0.253	S	S	.	.	H	α-helix	trans	-59.6	-46.5	178.9	0	0	0	0	0	111.4	G211 C212 C217 L218 E219	G211-A215 PolarHBondContact O-N 3.01Å; C212-A215 PolarHBondContact O-N 2.8Å; A215-C217 VanDerWaalsContact C-N 3.34Å; A215-C217 PolarHBondContact O-N 3.15Å; A215-L218 PolarHBondContact O-N 2.98Å; A215-E219 WeakPolarHBondContact O-CB 3.35Å; A215-E219 PolarHBondContact O-N 3.04Å
216	V	92.3	Very high	93.4	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.024	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-41.4	176.5	174.7	0	0	0	0	111.6	R61 C212 F214 R220	R61-V216 HydrophobicContact CG-CG2 3.61Å; C212-V216 WeakPolarHBondContact O-CG2 3.38Å; C212-V216 PolarHBondContact O-N 2.82Å; F214-V216 PolarHBondContact O-N 2.95Å; V216-R220 VanDerWaalsContact O-CG 3.32Å; V216-R220 WeakPolarHBondContact O-CG 3.12Å; V216-R220 PolarHBondContact O-N 3.03Å; V216-R220 VanDerWaalsContact O-N 3.12Å
217	C	91.9	Very high	93.2	Very high	15 Å²	15	60 Å²	60	10%	0.101	29%	0.288	C	S	.	.	H	α-helix	trans	-65.1	-46.3	177.2	-178.3	0	0	0	0	112.1	I163 A213 F214 A215 R220 K221	I163-C217 HydrophobicContact CG1-CB 4.38Å; I163-C217 HydrophobicContact CG2-CB 3.62Å; I163-C217 WeakPolarHBondContact CG2-SG 3.37Å; A213-C217 WeakPolarHBondContact O-CB 3.47Å; A213-C217 PolarHBondContact O-N 3.22Å; F214-C217 PolarHBondContact O-N 3.42Å; A215-C217 VanDerWaalsContact C-N 3.34Å; A215-C217 PolarHBondContact O-N 3.15Å; C217-R220 PolarHBondContact O-N 3.45Å; C217-K221 WeakPolarHBondContact O-CB 3.45Å; C217-K221 PolarHBondContact O-N 2.77Å
218	L	91.2	Very high	92.9	Very high	96 Å²	96	63.7 Å²	63.7	50%	0.503	31%	0.31	S	S	.	.	H	α-helix	trans	-62.8	-42.5	178.1	-74.8	168.6	0	0	0	111.4	F214 A215 R220 K221 Q222	F214-L218 WeakPolarHBondContact O-CB 3.29Å; F214-L218 WeakPolarHBondContact O-CG 3.5Å; F214-L218 PolarHBondContact O-N 3.23Å; A215-L218 PolarHBondContact O-N 2.98Å; L218-R220 PolarHBondContact O-N 3.47Å; L218-K221 PolarHBondContact O-N 3.43Å; L218-Q222 WeakPolarHBondContact O-CB 3.33Å; L218-Q222 VanDerWaalsContact O-CG 3.31Å; L218-Q222 WeakPolarHBondContact O-CG 3.44Å; L218-Q222 PolarHBondContact O-N 3.39Å
219	E	92.1	Very high	92.5	Very high	107 Å²	107	67 Å²	67	50%	0.5	33%	0.326	S	S	.	.	H	α-helix	trans	-58.1	-49.2	176.1	-173.7	-177.4	179.8	0	0	111.2	R61 A215 K221 Q222 K223	R61-E219 IonicContact NH1-OE2 2.76Å; R61-E219 PolarHBondContact NH1-OE2 3.23Å; R61-E219 IonicContact NH2-OE2 3.78Å; A215-E219 WeakPolarHBondContact O-CB 3.35Å; A215-E219 PolarHBondContact O-N 3.04Å; E219-K221 PolarHBondContact O-N 3.18Å; E219-Q222 PolarHBondContact O-N 2.92Å; E219-K223 WeakPolarHBondContact O-CB 3.38Å; E219-K223 PolarHBondContact O-N 3.47Å
220	R	90.6	Very high	92.1	Very high	103 Å²	103	71.9 Å²	71.9	39%	0.389	35%	0.351	S	S	.	.	H	α-helix	trans	-63.5	-39.5	176.9	-70.8	173.4	-173.5	161.6	-1.5	112.4	D110 V216 C217 L218 R224	D110-R220 IonicContact OD1-NH1 2.74Å; D110-R220 PolarHBondContact OD1-NH1 2.9Å; V216-R220 VanDerWaalsContact O-CG 3.32Å; V216-R220 WeakPolarHBondContact O-CG 3.12Å; V216-R220 PolarHBondContact O-N 3.03Å; V216-R220 VanDerWaalsContact O-N 3.12Å; C217-R220 PolarHBondContact O-N 3.45Å; L218-R220 PolarHBondContact O-N 3.47Å; R220-R224 WeakPolarHBondContact O-CG 3.46Å; R220-R224 PolarHBondContact O-N 3.38Å; R220-R224 VanDerWaalsContact O-N 3.07Å; R220-R224 PolarHBondContact O-NE 3.08Å
221	K	89.9	Confident	91.6	Very high	99 Å²	99	77.4 Å²	77.4	43%	0.43	38%	0.379	S	S	.	.	H	α-helix	trans	-66.3	-48.6	178	-176.6	176.9	176	179.9	0	111.3	C217 L218 E219 K223 R224 D225	C217-K221 WeakPolarHBondContact O-CB 3.45Å; C217-K221 PolarHBondContact O-N 2.77Å; L218-K221 PolarHBondContact O-N 3.43Å; E219-K221 PolarHBondContact O-N 3.18Å; K221-K223 VanDerWaalsContact C-N 3.29Å; K221-K223 PolarHBondContact O-N 3.3Å; K221-R224 PolarHBondContact O-N 2.86Å; K221-D225 VanDerWaalsContact O-CG 3.26Å; K221-D225 PolarHBondContact O-N 3.48Å
222	Q	92.3	Very high	91.1	Very high	95 Å²	95	78.8 Å²	78.8	44%	0.444	39%	0.388	S	S	.	.	H	α-helix	trans	-61.5	-38.3	177	-71	178.1	8.7	0	0	112	L218 E219 D225 R226	L218-Q222 WeakPolarHBondContact O-CB 3.33Å; L218-Q222 VanDerWaalsContact O-CG 3.31Å; L218-Q222 WeakPolarHBondContact O-CG 3.44Å; L218-Q222 PolarHBondContact O-N 3.39Å; E219-Q222 PolarHBondContact O-N 2.92Å; Q222-D225 PolarHBondContact O-N 2.97Å; Q222-R226 WeakPolarHBondContact O-CB 3.31Å; Q222-R226 VanDerWaalsContact O-CG 3.28Å; Q222-R226 WeakPolarHBondContact O-CG 3.22Å; Q222-R226 PolarHBondContact O-N 3.25Å; Q222-R226 PolarHBondContact O-NH1 3.45Å
223	K	92.8	Very high	90.4	Very high	124 Å²	124	81 Å²	81	54%	0.539	40%	0.403	S	S	.	.	H	α-helix	trans	-60.7	-47.5	174.5	-175.9	174.4	175.6	178.7	0	111.4	E219 K221 R226 E227	E219-K223 WeakPolarHBondContact O-CB 3.38Å; E219-K223 PolarHBondContact O-N 3.47Å; K221-K223 VanDerWaalsContact C-N 3.29Å; K221-K223 PolarHBondContact O-N 3.3Å; K223-R226 PolarHBondContact O-N 3.27Å; K223-E227 WeakPolarHBondContact CE-OE1 3.4Å; K223-E227 WeakPolarHBondContact CG-OE1 3.43Å; K223-E227 WeakPolarHBondContact O-CG 3.43Å; K223-E227 PolarHBondContact O-N 3.42Å
224	R	90.4	Very high	89.4	Confident	107 Å²	107	87.1 Å²	87.1	40%	0.404	43%	0.432	S	S	.	.	H	α-helix	trans	-61.2	-43.5	174.3	-73.9	-176.9	-74.8	111	-15.7	112.4	E164 R220 K221 R226 E227 V228	E164-R224 IonicContact OE1-NH2 3.05Å; E164-R224 PolarHBondContact OE1-NH2 2.91Å; R220-R224 WeakPolarHBondContact O-CG 3.46Å; R220-R224 PolarHBondContact O-N 3.38Å; R220-R224 VanDerWaalsContact O-N 3.07Å; R220-R224 PolarHBondContact O-NE 3.08Å; K221-R224 PolarHBondContact O-N 2.86Å; R224-R226 VanDerWaalsContact C-N 3.31Å; R224-R226 PolarHBondContact O-N 3.08Å; R224-E227 PolarHBondContact O-N 2.91Å; R224-V228 WeakPolarHBondContact O-CB 3.23Å; R224-V228 WeakPolarHBondContact O-CG2 3.46Å; R224-V228 PolarHBondContact O-N 2.91Å
225	D	91.9	Very high	88.1	Confident	71 Å²	71	88.5 Å²	88.5	38%	0.38	45%	0.451	S	S	.	.	H	α-helix	trans	-64.7	-36.3	179.6	-67.1	-17.7	0	0	0	111.4	K221 Q222 Q229	K221-D225 VanDerWaalsContact O-CG 3.26Å; K221-D225 PolarHBondContact O-N 3.48Å; Q222-D225 PolarHBondContact O-N 2.97Å; D225-Q229 WeakPolarHBondContact O-CB 3.32Å; D225-Q229 WeakPolarHBondContact O-CG 3.33Å; D225-Q229 PolarHBondContact O-N 3.38Å; D225-Q229 PolarHBondContact O-NE2 2.75Å
226	R	92.5	Very high	86.5	Confident	132 Å²	132	90.6 Å²	90.6	50%	0.498	46%	0.463	S	S	.	.	H	α-helix	trans	-68	-46	171.9	-70.8	-179.3	-154	102.2	0	112.2	Q222 K223 R224 V228 Q229 L230	Q222-R226 WeakPolarHBondContact O-CB 3.31Å; Q222-R226 VanDerWaalsContact O-CG 3.28Å; Q222-R226 WeakPolarHBondContact O-CG 3.22Å; Q222-R226 PolarHBondContact O-N 3.25Å; Q222-R226 PolarHBondContact O-NH1 3.45Å; K223-R226 PolarHBondContact O-N 3.27Å; R224-R226 VanDerWaalsContact C-N 3.31Å; R224-R226 PolarHBondContact O-N 3.08Å; R226-V228 VanDerWaalsContact C-N 3.34Å; R226-V228 PolarHBondContact O-N 3.4Å; R226-Q229 PolarHBondContact O-N 3.02Å; R226-L230 WeakPolarHBondContact O-CG 3.27Å; R226-L230 PolarHBondContact O-N 2.74Å
227	E	90.9	Very high	84.8	Confident	91 Å²	91	95.1 Å²	95.1	43%	0.425	49%	0.491	S	S	.	.	H	α-helix	trans	-61.8	-41.9	177.7	-74.3	169.8	-175.2	0	0	111.5	K223 R224 L230 I231	K223-E227 WeakPolarHBondContact CE-OE1 3.4Å; K223-E227 WeakPolarHBondContact CG-OE1 3.43Å; K223-E227 WeakPolarHBondContact O-CG 3.43Å; K223-E227 PolarHBondContact O-N 3.42Å; R224-E227 PolarHBondContact O-N 2.91Å; E227-L230 PolarHBondContact O-N 2.86Å; E227-I231 VanDerWaalsContact O-CG1 3.3Å; E227-I231 WeakPolarHBondContact O-CG1 3.46Å; E227-I231 PolarHBondContact O-N 2.84Å
228	V	89.3	Confident	82.9	Confident	94 Å²	94	99.7 Å²	99.7	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-63.9	-40.6	174.1	171	0	0	0	0	111.2	R224 R226 I231 A232	R224-V228 WeakPolarHBondContact O-CB 3.23Å; R224-V228 WeakPolarHBondContact O-CG2 3.46Å; R224-V228 PolarHBondContact O-N 2.91Å; R226-V228 VanDerWaalsContact C-N 3.34Å; R226-V228 PolarHBondContact O-N 3.4Å; V228-I231 PolarHBondContact O-N 2.91Å; V228-A232 WeakPolarHBondContact O-CB 3.25Å; V228-A232 PolarHBondContact O-N 2.83Å
229	Q	87.2	Confident	80.9	Confident	134 Å²	134	100.6 Å²	100.6	63%	0.626	53%	0.529	S	S	*	.	H	α-helix	trans	-64.8	-38.7	174.4	-76.9	171.1	44.2	0	0	112.6	D225 R226 A232 S233	D225-Q229 WeakPolarHBondContact O-CB 3.32Å; D225-Q229 WeakPolarHBondContact O-CG 3.33Å; D225-Q229 PolarHBondContact O-N 3.38Å; D225-Q229 PolarHBondContact O-NE2 2.75Å; R226-Q229 PolarHBondContact O-N 3.02Å; Q229-A232 PolarHBondContact O-N 2.83Å; Q229-S233 WeakPolarHBondContact O-CB 3.34Å; Q229-S233 PolarHBondContact O-N 3.43Å; Q229-S233 PolarHBondContact O-OG 3.08Å
230	L	88.4	Confident	78.7	Confident	102 Å²	102	100.9 Å²	100.9	53%	0.534	54%	0.538	S	S	.	.	H	α-helix	trans	-69.4	-37.1	176.4	-72.4	173.4	0	0	0	112.6	R226 E227 S233 Q234	R226-L230 WeakPolarHBondContact O-CG 3.27Å; R226-L230 PolarHBondContact O-N 2.74Å; E227-L230 PolarHBondContact O-N 2.86Å; L230-S233 WeakPolarHBondContact CA-OG 3.34Å; L230-S233 PolarHBondContact O-OG 2.92Å; L230-Q234 WeakPolarHBondContact O-CB 3.27Å; L230-Q234 VanDerWaalsContact O-CG 3.29Å; L230-Q234 WeakPolarHBondContact O-CG 3.41Å; L230-Q234 PolarHBondContact O-N 3.45Å; L230-Q234 PolarHBondContact O-NE2 2.75Å
231	I	85.6	Confident	76.6	Confident	115 Å²	115	103.7 Å²	103.7	59%	0.59	56%	0.56	S	S	*	*	H	α-helix	trans	-70.2	-40.8	173.8	-67.5	165.8	0	0	0	110	E227 V228 S233 Q234 A235	E227-I231 VanDerWaalsContact O-CG1 3.3Å; E227-I231 WeakPolarHBondContact O-CG1 3.46Å; E227-I231 PolarHBondContact O-N 2.84Å; V228-I231 PolarHBondContact O-N 2.91Å; I231-S233 VanDerWaalsContact C-N 3.34Å; I231-S233 PolarHBondContact O-N 3.4Å; I231-Q234 PolarHBondContact O-N 2.81Å; I231-A235 VanDerWaalsContact O-CB 3.23Å; I231-A235 WeakPolarHBondContact O-CB 3.37Å; I231-A235 PolarHBondContact O-N 3.41Å
232	A	84	Confident	74.4	Confident	61 Å²	61	105.6 Å²	105.6	50%	0.504	58%	0.575	S	S	.	*	H	α-helix	trans	-64.4	-37.8	176.5	0	0	0	0	0	112.2	V228 Q229 S236	V228-A232 WeakPolarHBondContact O-CB 3.25Å; V228-A232 PolarHBondContact O-N 2.83Å; Q229-A232 PolarHBondContact O-N 2.83Å; A232-S236 PolarHBondContact O-N 2.81Å
233	S	80.3	Confident	72	Confident	59 Å²	59	104.2 Å²	104.2	41%	0.413	59%	0.586	S	S	.	*	H	α-helix	trans	-70.6	-42.6	174.4	65.7	0	0	0	0	111.9	Q229 L230 I231 A235 S236 T237	Q229-S233 WeakPolarHBondContact O-CB 3.34Å; Q229-S233 PolarHBondContact O-N 3.43Å; Q229-S233 PolarHBondContact O-OG 3.08Å; L230-S233 WeakPolarHBondContact CA-OG 3.34Å; L230-S233 PolarHBondContact O-OG 2.92Å; I231-S233 VanDerWaalsContact C-N 3.34Å; I231-S233 PolarHBondContact O-N 3.4Å; S233-A235 PolarHBondContact O-N 3.4Å; S233-S236 WeakPolarHBondContact O-CB 3.37Å; S233-S236 PolarHBondContact O-N 2.85Å; S233-S236 VanDerWaalsContact O-N 3.14Å; S233-S236 PolarHBondContact O-OG 3.42Å; S233-T237 PolarHBondContact O-N 2.96Å; S233-T237 PolarHBondContact O-OG1 3.47Å
234	Q	75.1	Confident	69.9	Low	130 Å²	130	105 Å²	105	61%	0.607	60%	0.602	S	S	*	*	H	α-helix	trans	-66	-35.6	176.2	-76.3	178.1	69.6	0	0	113.1	L230 I231 S236 T237	L230-Q234 WeakPolarHBondContact O-CB 3.27Å; L230-Q234 VanDerWaalsContact O-CG 3.29Å; L230-Q234 WeakPolarHBondContact O-CG 3.41Å; L230-Q234 PolarHBondContact O-N 3.45Å; L230-Q234 PolarHBondContact O-NE2 2.75Å; I231-Q234 PolarHBondContact O-N 2.81Å; Q234-S236 PolarHBondContact O-N 3.47Å; Q234-T237 PolarHBondContact O-N 2.89Å; Q234-T237 VanDerWaalsContact O-N 3.16Å; Q234-T237 PolarHBondContact O-OG1 3.39Å
235	A	66.6	Low	67.6	Low	71 Å²	71	104.8 Å²	104.8	59%	0.587	62%	0.616	S	S	*	*	H	α-helix	trans	-67.3	-21.7	174.3	0	0	0	0	0	112.8	I231 S233	I231-A235 VanDerWaalsContact O-CB 3.23Å; I231-A235 WeakPolarHBondContact O-CB 3.37Å; I231-A235 PolarHBondContact O-N 3.41Å; S233-A235 PolarHBondContact O-N 3.4Å
236	S	60.7	Low	65.4	Low	93 Å²	93	109.2 Å²	109.2	65%	0.65	64%	0.639	S	S	*	*	H	α-helix	trans	-81.2	-16.6	173.6	79.1	0	0	0	0	113.7	A232 S233 Q234	A232-S236 PolarHBondContact O-N 2.81Å; S233-S236 WeakPolarHBondContact O-CB 3.37Å; S233-S236 PolarHBondContact O-N 2.85Å; S233-S236 VanDerWaalsContact O-N 3.14Å; S233-S236 PolarHBondContact O-OG 3.42Å; Q234-S236 PolarHBondContact O-N 3.47Å
237	T	56.5	Low	63	Low	99 Å²	99	108.5 Å²	108.5	61%	0.607	65%	0.649	S	S	*	*			trans	-102.4	63.7	175.4	43.9	0	0	0	0	111.3	S233 Q234 P239	S233-T237 PolarHBondContact O-N 2.96Å; S233-T237 PolarHBondContact O-OG1 3.47Å; Q234-T237 PolarHBondContact O-N 2.89Å; Q234-T237 VanDerWaalsContact O-N 3.16Å; Q234-T237 PolarHBondContact O-OG1 3.39Å; T237-P239 WeakPolarHBondContact O-CD 3.29Å
238	V	53.3	Low	60.6	Low	110 Å²	110	110 Å²	110	67%	0.667	67%	0.67	S	S	*	*			trans	-86.3	113.5	153.8	-79.6	0	0	0	0	107.6	V240	V238-V240 PolarHBondContact O-N 3.46Å
239	P	47.6	Very low	58.8	Low	115 Å²	115	112.2 Å²	112.2	75%	0.747	68%	0.677	S	S	*	*			trans	-68	109.5	170.8	27.9	-29.4	0	0	0	107.1	T237 L241	T237-P239 WeakPolarHBondContact O-CD 3.29Å; P239-L241 PolarHBondContact O-N 2.85Å
240	V	46.5	Very low	56.4	Low	113 Å²	113	115.5 Å²	115.5	69%	0.685	69%	0.689	S	S	*	*			trans	-67.5	89	162	177.7	0	0	0	0	106	V238 N242	V238-V240 PolarHBondContact O-N 3.46Å; V240-N242 WeakPolarHBondContact CG1-OD1 3.35Å; V240-N242 PolarHBondContact O-N 3.28Å
241	L	46.6	Very low	54	Low	162 Å²	162	113.9 Å²	113.9	85%	0.848	70%	0.697	S	S	*	*			trans	-74.6	80.6	171.1	-157.9	85.1	0	0	0	107.5	P239 G243	P239-L241 PolarHBondContact O-N 2.85Å; L241-G243 PolarHBondContact O-N 3.26Å
242	N	44.3	Very low	52.1	Low	140 Å²	140	114.8 Å²	114.8	75%	0.749	71%	0.708	S	S	*	*			trans	-69.8	110.1	165	-85.5	-4.2	0	0	0	107.7	V240 T244	V240-N242 WeakPolarHBondContact CG1-OD1 3.35Å; V240-N242 PolarHBondContact O-N 3.28Å; N242-T244 PolarHBondContact O-N 3.47Å
243	G	42.5	Very low	50.1	Low	66 Å²	66	118.2 Å²	118.2	68%	0.68	72%	0.723	S	S	*	*			trans	-58.7	133.6	174.2	0	0	0	0	0	111.3	L241	L241-G243 PolarHBondContact O-N 3.26Å
244	T	48.6	Very low	48.3	Very low	141 Å²	141	120.9 Å²	120.9	87%	0.865	74%	0.739	S	S	*	*			trans	-161.2	138.2	132.4	21.1	0	0	0	0	108.5	N242	N242-T244 PolarHBondContact O-N 3.47Å
245	S	41.8	Very low	46.7	Very low	102 Å²	102	121.9 Å²	121.9	71%	0.713	75%	0.754	S	S	*	*			trans	-42.3	139.9	178.3	58	0	0	0	0	115.3
246	L	45.7	Very low	45.4	Very low	164 Å²	164	122.5 Å²	122.5	86%	0.859	77%	0.767	S	S	*	*				-165.2	140	104.3	-132	97.6	0	0	0	111.9
247	V	41.1	Very low	44.4	Very low	116 Å²	116	121.6 Å²	121.6	70%	0.703	77%	0.773	S	S	*	*			trans	-66.7	132.3	175.7	-177	0	0	0	0	109.7	I249	V247-I249 HydrophobicContact CG1-CD1 4.33Å; V247-I249 HydrophobicContact CG1-CG1 4.09Å
248	S	41.5	Very low	43.5	Very low	123 Å²	123	125 Å²	125	86%	0.86	78%	0.784	S	S	*	*			trans	-153.1	121.2	144.7	-161	0	0	0	0	111.4
249	I	50.5	Low	43	Very low	141 Å²	141	125.9 Å²	125.9	72%	0.723	79%	0.789	S	S	*	*			trans	-91.1	130.3	-174.1	-59.6	169	0	0	0	107.8	V247	V247-I249 HydrophobicContact CG1-CD1 4.33Å; V247-I249 HydrophobicContact CG1-CG1 4.09Å
250	K	38.4	Very low	42.4	Very low	203 Å²	203	124.8 Å²	124.8	88%	0.883	78%	0.784	S	S	*	*			trans	164.1	118.8	130.2	-97.6	174.8	172	174	0	110.1
251	G	37.8	Very low	42.2	Very low	68 Å²	68	125.9 Å²	125.9	70%	0.701	79%	0.786	S	S	*	*			trans	-82.4	169.6	168.5	0	0	0	0	0	112.7
252	T	44.8	Very low	41.8	Very low	134 Å²	134	125 Å²	125	82%	0.822	78%	0.782	S	S	*	*			trans	-177	112.8	139	30.9	0	0	0	0	109.5
253	T	42.8	Very low	41.4	Very low	132 Å²	132	125.6 Å²	125.6	81%	0.81	79%	0.785	S	S	*	*			trans	47.7	139.9	138.6	49	0	0	0	0	123.9
254	P	41.3	Very low	41.2	Very low	115 Å²	115	128 Å²	128	75%	0.747	79%	0.791	S	S	*	*			trans	-104.6	149.6	-175.3	39.7	-30.4	0	0	0	114.5
255	T	42.7	Very low	40.8	Very low	151 Å²	151	125.8 Å²	125.8	93%	0.926	79%	0.787	S	S	*	*			trans	-167.1	127.4	160.9	28.6	0	0	0	0	113.4
256	G	39.4	Very low	40.6	Very low	84 Å²	84	127 Å²	127	87%	0.866	80%	0.796	S	S	*	*			trans	101.1	124	135.7	0	0	0	0	0	121.4
257	G	38	Very low	40.4	Very low	74 Å²	74	122 Å²	122	76%	0.763	79%	0.785	S	S	*	*			trans	104.6	93.9	148.7	0	0	0	0	0	116.3
258	M	38.3	Very low	40.5	Very low	172 Å²	172	122.4 Å²	122.4	85%	0.847	79%	0.787	S	S	*	*				71.1	117.1	83.6	-76.1	173.5	70.3	0	0	116.6
259	T	42.1	Very low	40.8	Very low	127 Å²	127	122.6 Å²	122.6	78%	0.779	78%	0.778	S	S	*	*			trans	64.9	146.5	147.5	61.8	0	0	0	0	117.8
260	S	35	Very low	40.8	Very low	92 Å²	92	124.9 Å²	124.9	64%	0.643	78%	0.782	S	S	*	*			cis	179.2	159.4	-8.3	53.9	0	0	0	0	105.8
261	L	42.5	Very low	41	Very low	137 Å²	137	127 Å²	127	72%	0.717	78%	0.784	S	S	*	*			trans	85.9	112.1	154.7	-60.3	149.9	0	0	0	119.5
262	D	37.8	Very low	41.3	Very low	142 Å²	142	127.4 Å²	127.4	76%	0.759	79%	0.789	S	S	*	*				82.9	114.7	124.4	-61.9	-12	0	0	0	123.6
263	N	37	Very low	41.3	Very low	154 Å²	154	126.8 Å²	126.8	82%	0.824	79%	0.79	S	S	*	*			trans	-13.6	119.5	144.7	-74.9	-22.2	0	0	0	116.2
264	S	37.6	Very low	41.2	Very low	115 Å²	115	130.1 Å²	130.1	80%	0.804	79%	0.794	S	S	*	*				175.4	141.5	110.8	-78.8	0	0	0	0	111.8
265	A	39.9	Very low	41.8	Very low	95 Å²	95	135.6 Å²	135.6	79%	0.785	80%	0.8	S	S	*	*			trans	70.1	112.3	156.3	0	0	0	0	0	119.5
266	S	39.3	Very low	42.5	Very low	127 Å²	127	136.8 Å²	136.8	89%	0.888	79%	0.794	S	S	*	*				64.5	109.3	124.9	-168.5	0	0	0	0	118.7
267	G	40.2	Very low	43.5	Very low	61 Å²	61	138 Å²	138	63%	0.629	78%	0.78	S	S	*	*			trans	149.8	109.6	145	0	0	0	0	0	116.3
268	T	43.1	Very low	44.9	Very low	123 Å²	123	137.5 Å²	137.5	76%	0.755	77%	0.765	S	S	*	*				95.9	92.8	120.5	-54.1	0	0	0	0	118.6
269	I	47.8	Very low	46	Very low	128 Å²	128	136.1 Å²	136.1	66%	0.656	76%	0.76	S	S	*	*			trans	76.4	114.6	132	-44.2	173.7	0	0	0	117.7
270	K	50.5	Low	47.1	Very low	189 Å²	189	140.5 Å²	140.5	82%	0.822	76%	0.763	S	S	*	*				170.6	97.8	104.8	-84.3	176.2	-170.3	169.9	0	113
271	R	43.4	Very low	48.4	Very low	246 Å²	246	140.2 Å²	140.2	93%	0.928	75%	0.754	S	S	*	*			trans	43.2	122.9	137.6	-61.8	-177.6	-163.1	-157.5	3.1	120.2
272	G	43.6	Very low	49.2	Very low	77 Å²	77	141.8 Å²	141.8	79%	0.794	75%	0.75	S	S	*	*			trans	169.3	69.7	152.3	0	0	0	0	0	117.4
273	S	44.3	Very low	50.4	Low	122 Å²	122	142.4 Å²	142.4	85%	0.853	75%	0.753	S	S	*	*			trans	62	87.4	141	-167.9	0	0	0	0	121.3
274	F	41.9	Very low	51.5	Low	202 Å²	202	145.2 Å²	145.2	89%	0.886	75%	0.753	S	S	*	*				176.1	115.7	119.9	-166.5	-106.3	0	0	0	107.3	H276	F274-H276 PolarHBondContact O-N 3.29Å
275	R	54.1	Low	52.4	Low	229 Å²	229	144.4 Å²	144.4	86%	0.864	74%	0.74	S	S	*	*			trans	-79.9	108.4	-165.2	-66.7	178.7	-119.4	-106	0.7	111	L277	R275-L277 PolarHBondContact O-N 3.44Å
276	H	57.6	Low	53.4	Low	177 Å²	177	145 Å²	145	82%	0.819	74%	0.736	S	S	*	*			trans	-61.6	113.4	155.3	-113.5	-102.6	0	0	0	108.3	F274	F274-H276 PolarHBondContact O-N 3.29Å
277	L	60.6	Low	54.3	Low	108 Å²	108	146.8 Å²	146.8	57%	0.565	73%	0.73	S	S	*	*			trans	-68.1	140.4	174.4	-74.8	166.8	0	0	0	110.2	R275 D281	R275-L277 PolarHBondContact O-N 3.44Å; L277-D281 HydrophobicContact CB-CB 3.89Å; L277-D281 HydrophobicContact CD2-CB 3.8Å; L277-D281 HydrophobicContact CG-CB 4.29Å
278	S	65.9	Low	55.2	Low	64 Å²	64	152.1 Å²	152.1	45%	0.448	74%	0.738	S	S	.	*			trans	-72.8	161.3	-179.3	74.7	0	0	0	0	110.9	R280 D281	S278-R280 PolarHBondContact O-N 2.96Å; S278-D281 PolarHBondContact N-OD2 3.26Å; S278-D281 VanDerWaalsContact N-OD2 3.09Å; S278-D281 PolarHBondContact O-N 3.07Å; S278-D281 PolarHBondContact OG-OD2 3.23Å
279	L	62.6	Low	55.9	Low	143 Å²	143	151.9 Å²	151.9	75%	0.749	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-21.7	179.7	-86.5	162.9	0	0	0	114.1
280	R	65.5	Low	56.5	Low	220 Å²	220	152.3 Å²	152.3	83%	0.83	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-29.4	174.7	-80.9	-174.8	168.6	130.6	-1.7	113.8	S278 R282 L283	S278-R280 PolarHBondContact O-N 2.96Å; R280-R282 PolarHBondContact O-N 3.46Å; R280-L283 PolarHBondContact O-N 2.93Å
281	D	61.1	Low	56.7	Low	85 Å²	85	149 Å²	149	46%	0.455	74%	0.737	S	S	.	*	G	3₁₀ helix	trans	-78.1	-9.5	-177.8	-59.8	-49.7	0	0	0	112.7	L277 S278 L283	L277-D281 HydrophobicContact CB-CB 3.89Å; L277-D281 HydrophobicContact CD2-CB 3.8Å; L277-D281 HydrophobicContact CG-CB 4.29Å; S278-D281 PolarHBondContact N-OD2 3.26Å; S278-D281 VanDerWaalsContact N-OD2 3.09Å; S278-D281 PolarHBondContact O-N 3.07Å; S278-D281 PolarHBondContact OG-OD2 3.23Å; D281-L283 VanDerWaalsContact C-N 3.31Å
282	R	59.6	Low	57.4	Low	170 Å²	170	142.1 Å²	142.1	64%	0.642	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-81.6	-3.2	175.5	-71.2	-176.7	167.8	146.1	-2.2	114.2	R280	R280-R282 PolarHBondContact O-N 3.46Å
283	L	63.8	Low	58.3	Low	155 Å²	155	146.4 Å²	146.4	81%	0.812	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-91.8	-4.4	-178.4	-111.4	85	0	0	0	114.7	R280 D281	R280-L283 PolarHBondContact O-N 2.93Å; D281-L283 VanDerWaalsContact C-N 3.31Å
284	Y	59.9	Low	59.6	Low	213 Å²	213	145.8 Å²	145.8	84%	0.835	73%	0.725	S	S	*	*	S	Bend	trans	-99.3	141.7	174	-94.5	-93.6	0	0	0	111.2
285	D	55.3	Low	60.6	Low	98 Å²	98	141.4 Å²	141.4	52%	0.524	72%	0.717	S	S	.	*			trans	-47.6	124	-174	-173.8	-17.1	0	0	0	112.9	Q287	D285-Q287 PolarHBondContact O-N 2.87Å; D285-Q287 PolarHBondContact OD1-N 3.26Å; D285-Q287 VanDerWaalsContact OD1-N 3.11Å
286	P	60.4	Low	61.5	Low	109 Å²	109	136 Å²	136	71%	0.708	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-1.4	-178.2	25.4	-34.8	0	0	0	115.8
287	Q	60.1	Low	61.8	Low	163 Å²	163	133.9 Å²	133.9	76%	0.762	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-3.1	-176.9	-64.7	-170	12.3	0	0	116.3	D285	D285-Q287 PolarHBondContact O-N 2.87Å; D285-Q287 PolarHBondContact OD1-N 3.26Å; D285-Q287 VanDerWaalsContact OD1-N 3.11Å
288	H	58.4	Low	62	Low	173 Å²	173	137.2 Å²	137.2	80%	0.801	72%	0.721	S	S	*	*	S	Bend	trans	-104.9	1.1	-179.3	-84.6	-77.2	0	0	0	115.9
289	V	58.2	Low	61.9	Low	119 Å²	119	140.7 Å²	140.7	72%	0.721	74%	0.739	S	S	*	*			trans	-121.5	48.3	-175.6	-171.9	0	0	0	0	111.1
290	I	60.4	Low	61.9	Low	137 Å²	137	137.4 Å²	137.4	70%	0.703	73%	0.725	S	S	*	*			trans	-128.8	98.5	166.4	-54.4	176.1	0	0	0	107.6	A292	I290-A292 PolarHBondContact O-N 2.93Å
291	P	54.5	Low	62.1	Low	119 Å²	119	135.4 Å²	135.4	77%	0.773	73%	0.725	S	S	*	*			trans	-61.5	117.2	163.5	-16.6	30.2	0	0	0	108.5	E293	P291-E293 PolarHBondContact O-N 2.9Å; P291-E293 VanDerWaalsContact O-N 3.11Å
292	A	56.8	Low	62.7	Low	102 Å²	102	139 Å²	139	84%	0.843	73%	0.733	S	S	*	*			trans	-78	87.2	172.1	0	0	0	0	0	109.2	I290	I290-A292 PolarHBondContact O-N 2.93Å
293	E	63.4	Low	63.4	Low	167 Å²	167	136.2 Å²	136.2	78%	0.78	74%	0.737	S	S	*	*			trans	-115.1	115.4	162.7	-165.8	179.2	172.7	0	0	109.1	P291	P291-E293 PolarHBondContact O-N 2.9Å; P291-E293 VanDerWaalsContact O-N 3.11Å
294	P	72.2	Confident	64	Low	109 Å²	109	136.9 Å²	136.9	71%	0.708	74%	0.736	S	S	*	*			trans	-68.3	130.8	175.3	27.8	-31.4	0	0	0	109.4
295	P	62.8	Low	64.9	Low	109 Å²	109	130 Å²	130	71%	0.708	72%	0.723	S	S	*	*			trans	-62.3	140.5	178.8	24.5	-32.4	0	0	0	110.6	V297	P295-V297 PolarHBondContact O-N 3Å; P295-V297 VanDerWaalsContact O-N 3.12Å
296	P	71.4	Confident	65.6	Low	117 Å²	117	131.1 Å²	131.1	76%	0.76	73%	0.727	S	S	*	*			trans	-63.3	115.8	-178.7	24.3	-32.6	0	0	0	110.4	K298	P296-K298 PolarHBondContact O-N 3.44Å
297	V	65.4	Low	66.4	Low	131 Å²	131	129.6 Å²	129.6	79%	0.794	72%	0.724	S	S	*	*			trans	-72.4	93.5	174.6	-175.7	0	0	0	0	108.1	P295 V299	P295-V297 PolarHBondContact O-N 3Å; P295-V297 VanDerWaalsContact O-N 3.12Å; V297-V299 PolarHBondContact O-N 3.37Å
298	K	63.8	Low	67.3	Low	179 Å²	179	132.2 Å²	132.2	78%	0.778	73%	0.727	S	S	*	*			trans	-68.7	115.6	160.6	-72.6	-174.5	-178.7	-179.4	0	107	P296 T300	P296-K298 PolarHBondContact O-N 3.44Å; K298-T300 PolarHBondContact O-N 2.96Å
299	V	64.5	Low	68.3	Low	137 Å²	137	129.9 Å²	129.9	83%	0.83	73%	0.727	S	S	*	*			trans	-70.1	83.3	172.3	-169.5	0	0	0	0	107.1	V297 E301	V297-V299 PolarHBondContact O-N 3.37Å; V299-E301 PolarHBondContact O-N 2.99Å
300	T	61.9	Low	69.1	Low	74 Å²	74	132.3 Å²	132.3	45%	0.454	73%	0.73	S	S	.	*			trans	-84.6	106.5	169.1	-58.3	0	0	0	0	106.9	K298 Y302	K298-T300 PolarHBondContact O-N 2.96Å; T300-Y302 HydrophobicContact CG2-CD1 4.09Å; T300-Y302 HydrophobicContact CG2-CD2 4.46Å; T300-Y302 HydrophobicContact CG2-CE1 3.58Å; T300-Y302 HydrophobicContact CG2-CE2 4Å; T300-Y302 HydrophobicContact CG2-CG 4.49Å; T300-Y302 WeakPolarHBondContact O-CD2 3.44Å; T300-Y302 WeakPolarHBondContact O-CE2 3.46Å; T300-Y302 PolarHBondContact O-N 2.78Å
301	E	69.8	Low	70	Confident	177 Å²	177	128.4 Å²	128.4	83%	0.827	72%	0.724	S	S	*	*			trans	-69.6	115.8	172.1	-166.8	164.3	-160.4	0	0	108.4	V299 P303	V299-E301 PolarHBondContact O-N 2.99Å; E301-P303 WeakPolarHBondContact O-CD 3.47Å
302	Y	73.4	Confident	71.1	Confident	161 Å²	161	127.5 Å²	127.5	63%	0.631	71%	0.712	S	S	*	*			trans	-101.1	94.7	178.7	-64.5	-76.8	0	0	0	108.7	T300 H304 A305	T300-Y302 HydrophobicContact CG2-CD1 4.09Å; T300-Y302 HydrophobicContact CG2-CD2 4.46Å; T300-Y302 HydrophobicContact CG2-CE1 3.58Å; T300-Y302 HydrophobicContact CG2-CE2 4Å; T300-Y302 HydrophobicContact CG2-CG 4.49Å; T300-Y302 WeakPolarHBondContact O-CD2 3.44Å; T300-Y302 WeakPolarHBondContact O-CE2 3.46Å; T300-Y302 PolarHBondContact O-N 2.78Å; Y302-H304 PolarHBondContact O-N 2.94Å; Y302-A305 VanDerWaalsContact CB-CB 3.44Å; Y302-A305 HydrophobicContact CG-CB 4.31Å; Y302-A305 PolarHBondContact O-N 2.85Å
303	P	75.1	Confident	72	Confident	111 Å²	111	133 Å²	133	72%	0.721	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-10.4	-175.1	24.3	-34.5	0	0	0	114.1	E301	E301-P303 WeakPolarHBondContact O-CD 3.47Å
304	H	77	Confident	72.5	Confident	170 Å²	170	128.1 Å²	128.1	79%	0.787	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	5	178.1	-54.9	-54.3	0	0	0	114.1	Y302 I306	Y302-H304 PolarHBondContact O-N 2.94Å; H304-I306 PolarHBondContact O-N 3.46Å
305	A	77.9	Confident	72.4	Confident	68 Å²	68	130 Å²	130	56%	0.562	70%	0.702	S	S	*	*			trans	-84.3	103.6	179.2	0	0	0	0	0	111.2	Y302 A307	Y302-A305 VanDerWaalsContact CB-CB 3.44Å; Y302-A305 HydrophobicContact CG-CB 4.31Å; Y302-A305 PolarHBondContact O-N 2.85Å; A305-A307 PolarHBondContact O-N 3.17Å
306	I	71.1	Confident	72.7	Confident	122 Å²	122	131.4 Å²	131.4	63%	0.626	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-73.6	120.9	170.6	-57.8	172.4	0	0	0	108.1	H304 R308 V548	H304-I306 PolarHBondContact O-N 3.46Å; I306-R308 PolarHBondContact O-N 2.94Å; I306-V548 HydrophobicContact CD1-CG2 3.99Å
307	A	76.9	Confident	72.5	Confident	77 Å²	77	134.1 Å²	134.1	64%	0.636	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-57.2	135.7	175	0	0	0	0	0	110.7	A305	A305-A307 PolarHBondContact O-N 3.17Å
308	R	79.4	Confident	72.6	Confident	218 Å²	218	139.5 Å²	139.5	82%	0.823	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-55.1	130.8	176.1	-168.2	179.9	-132.3	-143.9	2.9	109	I306 H310	I306-R308 PolarHBondContact O-N 2.94Å; R308-H310 PolarHBondContact O-N 3.43Å
309	P	77.7	Confident	72.3	Confident	123 Å²	123	140 Å²	140	80%	0.799	71%	0.714	S	S	*	*			trans	-55.5	109.1	176.8	-23.7	32	0	0	0	110	G311	P309-G311 PolarHBondContact O-N 2.97Å
310	H	76.3	Confident	71.7	Confident	170 Å²	170	137.3 Å²	137.3	79%	0.787	71%	0.714	S	S	*	*			trans	-71	127.2	173.8	-71.8	-76.5	0	0	0	108	R308 N312	R308-H310 PolarHBondContact O-N 3.43Å; H310-N312 PolarHBondContact O-N 3.31Å
311	G	78.7	Confident	71	Confident	55 Å²	55	138.2 Å²	138.2	57%	0.567	72%	0.724	S	S	*	*			trans	-52.7	137.8	173.6	0	0	0	0	0	110.4	P309 R313	P309-G311 PolarHBondContact O-N 2.97Å; G311-R313 PolarHBondContact O-N 3.42Å
312	N	77.6	Confident	69.7	Low	101 Å²	101	137.2 Å²	137.2	54%	0.54	72%	0.723	S	S	.	*			trans	-54	108.3	-177.5	-177.6	-1.8	0	0	0	110	H310 A314 L315	H310-N312 PolarHBondContact O-N 3.31Å; N312-A314 PolarHBondContact O-N 3.34Å; N312-A314 WeakPolarHBondContact OD1-CB 3.45Å; N312-A314 PolarHBondContact OD1-N 3.05Å; N312-L315 HydrophobicContact CB-CD1 4.2Å; N312-L315 HydrophobicContact CB-CG 4.22Å; N312-L315 WeakPolarHBondContact O-CB 3.41Å; N312-L315 PolarHBondContact O-N 2.85Å
313	R	76.1	Confident	68.5	Low	218 Å²	218	140.9 Å²	140.9	82%	0.823	74%	0.736	S	S	*	*	H	α-helix	trans	-58	-22.9	-179.3	-73.6	-179.2	135.1	150.6	-2.8	112.6	G311 L315 L316 K317	G311-R313 PolarHBondContact O-N 3.42Å; R313-L315 VanDerWaalsContact C-N 3.27Å; R313-L315 PolarHBondContact O-N 2.8Å; R313-L316 PolarHBondContact O-N 2.85Å; R313-L316 VanDerWaalsContact O-N 3.17Å; R313-K317 PolarHBondContact O-N 3Å
314	A	74.3	Confident	66.9	Low	63 Å²	63	143.4 Å²	143.4	52%	0.521	74%	0.743	S	S	.	*	H	α-helix	trans	-64.1	-30.6	174.3	0	0	0	0	0	112.7	N312 L316 K317	N312-A314 PolarHBondContact O-N 3.34Å; N312-A314 WeakPolarHBondContact OD1-CB 3.45Å; N312-A314 PolarHBondContact OD1-N 3.05Å; A314-L316 VanDerWaalsContact C-N 3.28Å; A314-L316 PolarHBondContact O-N 3.44Å; A314-K317 PolarHBondContact O-N 3.5Å
315	L	69.8	Low	64.9	Low	148 Å²	148	140.9 Å²	140.9	78%	0.775	74%	0.744	S	S	*	*	H	α-helix	trans	-72.1	-21.7	175.4	-64.5	175.9	0	0	0	112.7	N312 R313	N312-L315 HydrophobicContact CB-CD1 4.2Å; N312-L315 HydrophobicContact CB-CG 4.22Å; N312-L315 WeakPolarHBondContact O-CB 3.41Å; N312-L315 PolarHBondContact O-N 2.85Å; R313-L315 VanDerWaalsContact C-N 3.27Å; R313-L315 PolarHBondContact O-N 2.8Å
316	L	69.2	Low	63	Low	139 Å²	139	141.7 Å²	141.7	73%	0.728	75%	0.751	S	S	*	*	H	α-helix	trans	-86.7	-12.3	175.1	-71.8	101	0	0	0	113.3	R313 A314 R318	R313-L316 PolarHBondContact O-N 2.85Å; R313-L316 VanDerWaalsContact O-N 3.17Å; A314-L316 VanDerWaalsContact C-N 3.28Å; A314-L316 PolarHBondContact O-N 3.44Å; L316-R318 PolarHBondContact O-N 2.81Å
317	K	67.3	Low	61.4	Low	174 Å²	174	142.9 Å²	142.9	76%	0.757	76%	0.758	S	S	*	*	S	Bend	trans	-73.7	97.1	170.8	-79.9	-175.5	176.4	-179.9	0	108.2	R313 A314 Q319	R313-K317 PolarHBondContact O-N 3Å; A314-K317 PolarHBondContact O-N 3.5Å; K317-Q319 PolarHBondContact O-N 3.3Å
318	R	67.2	Low	59.5	Low	245 Å²	245	146.5 Å²	146.5	93%	0.925	77%	0.767	S	S	*	*			trans	-50	111.1	165.5	-98.2	-179.7	159.9	173.2	-5.8	108.5	L316 G320	L316-R318 PolarHBondContact O-N 2.81Å; R318-G320 VanDerWaalsContact C-N 3.28Å; R318-G320 PolarHBondContact O-N 3.26Å
319	Q	57.5	Low	57.5	Low	188 Å²	188	140.8 Å²	140.8	88%	0.879	76%	0.76	S	S	*	*			trans	-66.6	90.8	170.3	-165.4	176.8	5.8	0	0	107.6	K317 S321	K317-Q319 PolarHBondContact O-N 3.3Å; Q319-S321 PolarHBondContact O-N 3.38Å
320	G	51.7	Low	55.6	Low	81 Å²	81	141.6 Å²	141.6	84%	0.835	76%	0.758	S	S	*	*			trans	-88.7	87.3	168.1	0	0	0	0	0	108.5	R318	R318-G320 VanDerWaalsContact C-N 3.28Å; R318-G320 PolarHBondContact O-N 3.26Å
321	S	47.4	Very low	54.1	Low	94 Å²	94	140.2 Å²	140.2	66%	0.657	76%	0.756	S	S	*	*			trans	-152.7	96.9	174.9	-176.2	0	0	0	0	110.7	Q319	Q319-S321 PolarHBondContact O-N 3.38Å
322	L	42.2	Very low	52.1	Low	155 Å²	155	144 Å²	144	81%	0.812	77%	0.768	S	S	*	*			trans	-161.5	89.8	135.4	-101.8	160.7	0	0	0	105.6
323	R	48.7	Very low	50.2	Low	238 Å²	238	144.4 Å²	144.4	90%	0.898	78%	0.779	S	S	*	*			trans	-88	105.5	162.9	-73.5	-180	172.5	171	-4.1	105.5	S325	R323-S325 PolarHBondContact O-N 2.9Å
324	L	41	Very low	48.3	Very low	164 Å²	164	139.8 Å²	139.8	86%	0.859	78%	0.775	S	S	*	*			trans	-79.4	108	164.3	-85.7	146.6	0	0	0	106.8
325	S	35.2	Very low	46.6	Very low	117 Å²	117	146.8 Å²	146.8	82%	0.818	79%	0.794	S	S	*	*			trans	-80.7	120.2	167.7	-58	0	0	0	0	108.5	R323	R323-S325 PolarHBondContact O-N 2.9Å
326	A	37.5	Very low	45.2	Very low	85 Å²	85	149.9 Å²	149.9	70%	0.702	80%	0.796	S	S	*	*			trans	-163.2	112.4	149.4	0	0	0	0	0	107.7
327	N	37.3	Very low	44.2	Very low	147 Å²	147	154.2 Å²	154.2	79%	0.786	80%	0.802	S	S	*	*			trans	49	105.3	144.7	-51.2	-4	0	0	0	117.4
328	D	36.7	Very low	43.1	Very low	154 Å²	154	154.3 Å²	154.3	82%	0.824	80%	0.803	S	S	*	*				-175.3	142.8	90.2	-94.9	-28.9	0	0	0	109.8	D330	D328-D330 PolarHBondContact O-N 3.17Å
329	S	37.4	Very low	41.6	Very low	97 Å²	97	150.1 Å²	150.1	68%	0.678	80%	0.799	S	S	*	*			trans	-53.7	123.1	166.9	43.3	0	0	0	0	110.4
330	D	39.7	Very low	41	Very low	140 Å²	140	145.9 Å²	145.9	75%	0.749	79%	0.79	S	S	*	*				-179.1	125.6	126.1	-88.7	-26.4	0	0	0	112	D328	D328-D330 PolarHBondContact O-N 3.17Å
331	L	43	Very low	40.2	Very low	142 Å²	142	149 Å²	149	74%	0.743	79%	0.786	S	S	*	*			trans	51.6	100	139.4	-53.9	175.4	0	0	0	119.1
332	T	37	Very low	40.1	Very low	134 Å²	134	155.4 Å²	155.4	82%	0.822	80%	0.796	S	S	*	*			trans	67.2	132.6	135.9	76.4	0	0	0	0	119
333	S	37.8	Very low	39.9	Very low	110 Å²	110	155 Å²	155	77%	0.769	79%	0.793	S	S	*	*			trans	109.7	80.4	169.6	-162.8	0	0	0	0	112.8
334	T	37.4	Very low	39.4	Very low	121 Å²	121	148.9 Å²	148.9	74%	0.742	79%	0.787	S	S	*	*				54.6	89.4	82	-45.6	0	0	0	0	114.1
335	F	36.8	Very low	38.9	Very low	210 Å²	210	148 Å²	148	92%	0.921	78%	0.783	S	S	*	*			trans	-144.4	96.3	140.3	-138.7	-96.5	0	0	0	110.6
336	R	41.6	Very low	38.9	Very low	213 Å²	213	147.7 Å²	147.7	80%	0.804	78%	0.781	S	S	*	*			trans	-77.8	136.5	171.2	-76.6	-175.7	176	179.2	-0.1	109.5	F338	R336-F338 HydrophobicContact CB-CD2 4.46Å; R336-F338 HydrophobicContact CB-CE2 4.39Å; R336-F338 PolarHBondContact O-N 3.48Å
337	R	48.1	Very low	38.7	Very low	230 Å²	230	149.1 Å²	149.1	87%	0.868	79%	0.786	S	S	*	*			trans	-65.7	110.6	170.1	-65.1	170.5	176.3	174.1	-2.3	111.1
338	F	43.7	Very low	38.7	Very low	176 Å²	176	146.2 Å²	146.2	77%	0.772	79%	0.791	S	S	*	*			trans	-155.1	96.2	153.2	-67.8	-72.7	0	0	0	109.5	R336	R336-F338 HydrophobicContact CB-CD2 4.46Å; R336-F338 HydrophobicContact CB-CE2 4.39Å; R336-F338 PolarHBondContact O-N 3.48Å
339	N	35.2	Very low	38.7	Very low	157 Å²	157	142.1 Å²	142.1	84%	0.84	79%	0.785	S	S	*	*			trans	-111.2	78	160.6	-133.9	-17.5	0	0	0	107
340	S	45.2	Very low	38.9	Very low	98 Å²	98	145.5 Å²	145.5	69%	0.685	79%	0.794	S	S	*	*			trans	-120.9	94.2	166.1	-57.9	0	0	0	0	105.2	R342	S340-R342 PolarHBondContact O-N 2.94Å
341	L	36.2	Very low	38.7	Very low	146 Å²	146	143.7 Å²	143.7	76%	0.764	79%	0.792	S	S	*	*			trans	-68.2	97	173.1	-82.9	157.9	0	0	0	108.4	I343	L341-I343 HydrophobicContact CD2-CD1 4.43Å; L341-I343 HydrophobicContact CD2-CG1 4.47Å
342	R	44.6	Very low	38.4	Very low	230 Å²	230	148.6 Å²	148.6	87%	0.868	80%	0.801	S	S	*	*			trans	-120.3	108.7	152.3	-74.5	-172	-179.2	123.8	-1.6	106.1	S340	S340-R342 PolarHBondContact O-N 2.94Å
343	I	38.8	Very low	38.7	Very low	146 Å²	146	147.3 Å²	147.3	75%	0.749	80%	0.795	S	S	*	*			trans	-92.2	111	170.6	-62.9	173	0	0	0	106.1	L341	L341-I343 HydrophobicContact CD2-CD1 4.43Å; L341-I343 HydrophobicContact CD2-CG1 4.47Å
344	S	38.1	Very low	38.7	Very low	110 Å²	110	151.9 Å²	151.9	77%	0.769	80%	0.801	S	S	*	*			trans	-120.8	118.4	160.6	53.1	0	0	0	0	107.3
345	N	30	Very low	38.8	Very low	145 Å²	145	153.2 Å²	153.2	78%	0.775	80%	0.799	S	S	*	*			trans	-49.5	139	-179.8	-64.4	2	0	0	0	113.2
346	S	34.4	Very low	38.6	Very low	110 Å²	110	149.8 Å²	149.8	77%	0.769	79%	0.79	S	S	*	*				170.3	139.9	118	42.8	0	0	0	0	112.9
347	S	34.6	Very low	38.2	Very low	116 Å²	116	144.5 Å²	144.5	81%	0.811	79%	0.785	S	S	*	*			trans	67.9	113.1	149.2	62.5	0	0	0	0	121.7
348	G	37.1	Very low	37.5	Very low	86 Å²	86	139.5 Å²	139.5	89%	0.887	78%	0.78	S	S	*	*			trans	74.6	128.1	138	0	0	0	0	0	116.2
349	G	35.6	Very low	37	Very low	68 Å²	68	137 Å²	137	70%	0.701	78%	0.779	S	S	*	*			cis	144	153.4	24.1	0	0	0	0	0	106
350	I	42.8	Very low	36.7	Very low	168 Å²	168	135.5 Å²	135.5	86%	0.862	78%	0.775	S	S	*	*			trans	98.1	79.8	172.1	-47.3	161.7	0	0	0	115.9
351	S	34.8	Very low	36.4	Very low	102 Å²	102	139.7 Å²	139.7	71%	0.713	78%	0.784	S	S	*	*			trans	-5	139.8	135.3	24	0	0	0	0	121.5
352	R	37.3	Very low	36.1	Very low	244 Å²	244	138.7 Å²	138.7	92%	0.921	78%	0.784	S	S	*	*				-178.4	156.2	106.4	-93.4	177.6	-175.9	173.7	2.5	113.5
353	P	42	Very low	35.9	Very low	107 Å²	107	134.5 Å²	134.5	70%	0.695	79%	0.785	S	S	*	*			trans	-130.1	174.1	-145	41.4	-24.5	0	0	0	117
354	F	38.6	Very low	35.8	Very low	206 Å²	206	134 Å²	134	90%	0.904	78%	0.783	S	S	*	*			trans	-161.7	99.2	153	-132.6	-94.7	0	0	0	106.9
355	Q	39.4	Very low	35.8	Very low	149 Å²	149	139.4 Å²	139.4	70%	0.696	79%	0.788	S	S	*	*				51.1	136.4	72.9	-79.3	-125.3	-17.3	0	0	113.8
356	L	32.5	Very low	36.4	Very low	139 Å²	139	140.5 Å²	140.5	73%	0.728	79%	0.793	S	S	*	*			cis	-169.9	155.2	-0.4	-157.4	60.1	0	0	0	103
357	S	33.2	Very low	36.4	Very low	101 Å²	101	138.7 Å²	138.7	71%	0.706	79%	0.792	S	S	*	*				-179.4	131.5	65.7	52.9	0	0	0	0	113.2
358	V	33.7	Very low	36.6	Very low	126 Å²	126	139.3 Å²	139.3	76%	0.764	79%	0.793	S	S	*	*			trans	-89.8	139.6	157.4	159.3	0	0	0	0	107.8
359	V	33	Very low	36.8	Very low	124 Å²	124	144.4 Å²	144.4	75%	0.752	79%	0.794	S	S	*	*			trans	-108.3	114.3	165.2	173.8	0	0	0	0	107.9
360	T	28.9	Very low	36.6	Very low	125 Å²	125	146.9 Å²	146.9	77%	0.767	80%	0.796	S	S	*	*			trans	-101.3	130.2	164.1	14.5	0	0	0	0	108.1
361	Q	39.4	Very low	36.2	Very low	186 Å²	186	146 Å²	146	87%	0.869	79%	0.791	S	S	*	*			trans	-116.7	128.3	159.4	-82.3	-176	25.2	0	0	109.3
362	T	30.5	Very low	36.4	Very low	124 Å²	124	147.4 Å²	147.4	76%	0.761	80%	0.796	S	S	*	*			trans	-83.6	136.4	-179.7	45	0	0	0	0	111.4
363	T	39.9	Very low	36.1	Very low	143 Å²	143	144.4 Å²	144.4	88%	0.877	79%	0.792	S	S	*	*			trans	-143.4	121.5	147.3	52.1	0	0	0	0	109.7
364	N	35.4	Very low	36	Very low	135 Å²	135	148.6 Å²	148.6	72%	0.722	80%	0.802	S	S	*	*			trans	-62.5	154.4	173.1	-61.7	-39.1	0	0	0	111.4
365	Y	40	Very low	35.9	Very low	223 Å²	223	148 Å²	148	88%	0.875	80%	0.802	S	S	*	*				178.2	136.4	119.1	-88.7	-69.8	0	0	0	110.4
366	L	41	Very low	35.7	Very low	168 Å²	168	144.1 Å²	144.1	88%	0.88	80%	0.802	S	S	*	*			trans	-32.1	154.9	171.8	-72.2	57.2	0	0	0	114.8
367	G	34.6	Very low	35.9	Very low	73 Å²	73	144.6 Å²	144.6	75%	0.753	80%	0.804	S	S	*	*			cis	163.9	158.6	13.1	0	0	0	0	0	106.6
368	P	40.2	Very low	36.3	Very low	128 Å²	128	146.3 Å²	146.3	83%	0.831	80%	0.801	S	S	*	*			trans	-104.4	146.8	-170.9	36.6	-28	0	0	0	113.8
369	E	39.6	Very low	36.3	Very low	194 Å²	194	147.1 Å²	147.1	91%	0.907	80%	0.801	S	S	*	*			trans	-143.3	141.8	157	-80.2	-151.4	147.9	0	0	112.5
370	T	31.3	Very low	36.7	Very low	120 Å²	120	145.5 Å²	145.5	74%	0.736	80%	0.801	S	S	*	*			trans	-73.6	162	175.3	44.4	0	0	0	0	113.3
371	I	35.3	Very low	36.9	Very low	148 Å²	148	148.7 Å²	148.7	76%	0.759	81%	0.807	S	S	*	*			trans	153.8	108	140.1	-80.3	157.2	0	0	0	109.8
372	V	39.3	Very low	36.8	Very low	133 Å²	133	144.1 Å²	144.1	81%	0.806	80%	0.801	S	S	*	*				100.5	137.2	100.4	178	0	0	0	0	113.4
373	E	31	Very low	37	Very low	181 Å²	181	146 Å²	146	85%	0.846	80%	0.802	S	S	*	*			trans	-67.3	148.5	179	-55.6	171.7	137.5	0	0	113.2
374	E	40.1	Very low	36.9	Very low	195 Å²	195	142.2 Å²	142.2	91%	0.911	78%	0.784	S	S	*	*				-169.7	156.8	128.8	-109.8	-152.2	166.7	0	0	113
375	E	35.4	Very low	37.3	Very low	193 Å²	193	143.8 Å²	143.8	90%	0.902	79%	0.785	S	S	*	*			trans	-86.8	174.8	-168.1	-51.3	-159.3	136.6	0	0	114.7
376	G	35.2	Very low	37.2	Very low	67 Å²	67	140.7 Å²	140.7	69%	0.691	78%	0.783	S	S	*	*			trans	124.5	96.2	161.4	0	0	0	0	0	113.4
377	L	37	Very low	37.1	Very low	149 Å²	149	137 Å²	137	78%	0.78	78%	0.777	S	S	*	*				75	119.8	87.8	-81.9	-28.1	0	0	0	115.6
378	H	41.2	Very low	37.5	Very low	138 Å²	138	139.8 Å²	139.8	64%	0.639	78%	0.78	S	S	*	*			trans	97.6	106.5	134.5	-62.9	-165.6	0	0	0	119.8
379	D	35.1	Very low	37.9	Very low	142 Å²	142	138.4 Å²	138.4	76%	0.759	77%	0.77	S	S	*	*				77.9	141.6	118.9	-55.1	-27.4	0	0	0	122.9
380	A	40	Very low	37.8	Very low	90 Å²	90	136.3 Å²	136.3	74%	0.744	77%	0.765	S	S	*	*			trans	96.9	91.5	148.3	0	0	0	0	0	119.8
381	E	32.8	Very low	38.5	Very low	192 Å²	192	136.4 Å²	136.4	90%	0.897	77%	0.765	S	S	*	*				56.3	143.7	109.2	-127	171.7	130	0	0	123.3
382	A	38.5	Very low	38.9	Very low	91 Å²	91	134.4 Å²	134.4	75%	0.752	76%	0.762	S	S	*	*			trans	79.1	144.2	155.9	0	0	0	0	0	117.7
383	E	34.5	Very low	38.7	Very low	164 Å²	164	132.1 Å²	132.1	77%	0.766	76%	0.756	S	S	*	*			cis	-176.7	152.1	-20	-163	-164.3	125	0	0	103.5	K385	E383-K385 IonicContact OE1-NZ 3.38Å
384	A	37.3	Very low	39.2	Very low	62 Å²	62	130.7 Å²	130.7	51%	0.512	76%	0.76	S	S	.	*			trans	76.7	116	140.5	0	0	0	0	0	122.7
385	K	45.2	Very low	39	Very low	169 Å²	169	127.3 Å²	127.3	74%	0.735	75%	0.753	S	S	*	*				98.3	120	121.1	-67	162.8	-160.7	157.3	0	119.7	E383	E383-K385 IonicContact OE1-NZ 3.38Å
386	N	37.3	Very low	39.1	Very low	157 Å²	157	121.8 Å²	121.8	84%	0.84	74%	0.74	S	S	*	*				107.1	130.7	126.5	-88	1.6	0	0	0	121
387	A	38.9	Very low	39.1	Very low	91 Å²	91	126.4 Å²	126.4	75%	0.752	75%	0.748	S	S	*	*			trans	94.7	88.8	140.9	0	0	0	0	0	120.1
388	T	43.3	Very low	39.2	Very low	132 Å²	132	124.8 Å²	124.8	81%	0.81	74%	0.744	S	S	*	*			trans	-46.6	-179.8	133.2	16.4	0	0	0	0	114.2
389	P	47.7	Very low	39.1	Very low	98 Å²	98	123.1 Å²	123.1	64%	0.636	75%	0.748	S	S	*	*			cis	-133.4	-168.7	-33.2	32.1	-11.9	0	0	0	110.6
390	L	37.3	Very low	38.8	Very low	150 Å²	150	123.5 Å²	123.5	79%	0.785	75%	0.75	S	S	*	*				157.8	117.3	129.7	-85.6	171.6	0	0	0	116.4
391	V	46.9	Very low	38.6	Very low	123 Å²	123	124.1 Å²	124.1	75%	0.745	75%	0.749	S	S	*	*			trans	71.5	164.3	135.4	-106.9	0	0	0	0	123.6
392	P	44.2	Very low	38.7	Very low	106 Å²	106	121.6 Å²	121.6	69%	0.688	74%	0.742	S	S	*	*				-140.6	-173.7	-88.6	45.4	-24.1	0	0	0	115.9
393	A	33.5	Very low	38.7	Very low	84 Å²	84	124.8 Å²	124.8	69%	0.694	74%	0.741	S	S	*	*			trans	42.6	122.3	140.2	0	0	0	0	0	121.9
394	V	41.8	Very low	38.5	Very low	152 Å²	152	123.6 Å²	123.6	92%	0.921	74%	0.74	S	S	*	*			trans	-129.5	130.2	149.5	-170.5	0	0	0	0	108.7
395	T	36	Very low	38.7	Very low	123 Å²	123	127.6 Å²	127.6	76%	0.755	76%	0.758	S	S	*	*			trans	-106.6	154.8	-174.9	-41.9	0	0	0	0	109.3
396	A	37.4	Very low	37.9	Very low	78 Å²	78	130.6 Å²	130.6	65%	0.645	77%	0.765	S	S	*	*			trans	108.4	145.4	134.3	0	0	0	0	0	120.1
397	L	36.3	Very low	37.9	Very low	163 Å²	163	132.4 Å²	132.4	85%	0.853	77%	0.766	S	S	*	*			trans	86.9	138.4	153.4	-50.4	175.7	0	0	0	115.9
398	V	38.2	Very low	37.7	Very low	116 Å²	116	133.9 Å²	133.9	70%	0.703	76%	0.761	S	S	*	*			cis	-176.7	150.1	8.5	122.3	0	0	0	0	109.2
399	S	38.6	Very low	37.2	Very low	103 Å²	103	135.2 Å²	135.2	72%	0.72	76%	0.758	S	S	*	*			trans	51.9	124.6	151.4	-56.4	0	0	0	0	121.5
400	D	28.9	Very low	36.6	Very low	150 Å²	150	138.7 Å²	138.7	80%	0.802	77%	0.77	S	S	*	*				69.2	125.9	58.9	-155.4	19.3	0	0	0	114.9
401	S	36.1	Very low	36	Very low	102 Å²	102	135.4 Å²	135.4	71%	0.713	76%	0.76	S	S	*	*			trans	138.7	103.9	156.9	-61.5	0	0	0	0	116.1
402	N	35.6	Very low	35.2	Very low	140 Å²	140	139.6 Å²	139.6	75%	0.749	77%	0.768	S	S	*	*				56.6	136.2	118.2	-78.1	-23.7	0	0	0	125.1
403	Q	37.8	Very low	34.6	Very low	157 Å²	157	142.2 Å²	142.2	73%	0.734	77%	0.771	S	S	*	*			trans	93.8	114.5	139.9	-76.6	174.3	29.3	0	0	121.3
404	D	30.8	Very low	34.3	Very low	139 Å²	139	143.2 Å²	143.2	74%	0.743	77%	0.773	S	S	*	*				47.4	119.4	127.8	-61.3	-39.7	0	0	0	119.7
405	T	40.7	Very low	33.7	Very low	146 Å²	146	142.9 Å²	142.9	90%	0.896	77%	0.771	S	S	*	*				-166	121	127.6	17.6	0	0	0	0	111.2
406	R	28.6	Very low	33.3	Very low	233 Å²	233	142.9 Å²	142.9	88%	0.879	78%	0.776	S	S	*	*			trans	-62.5	149	165.4	-66.1	171.1	166.9	170.2	-4.6	110.2
407	F	37.2	Very low	33	Very low	194 Å²	194	144.1 Å²	144.1	85%	0.851	78%	0.78	S	S	*	*			trans	-167.3	124.1	131.1	-103.8	-71	0	0	0	112.5
408	N	34.8	Very low	32.9	Very low	123 Å²	123	142.1 Å²	142.1	66%	0.658	78%	0.779	S	S	*	*			trans	33.6	116.4	151.3	-70.4	8.7	0	0	0	120.9
409	E	32	Very low	32.8	Very low	160 Å²	160	143 Å²	143	75%	0.748	79%	0.785	S	S	*	*				76.4	104.1	65.3	-166.7	-176.4	-164.5	0	0	112
410	L	35	Very low	32.6	Very low	171 Å²	171	143 Å²	143	90%	0.895	79%	0.785	S	S	*	*			trans	-156.2	102.7	143.4	-89.7	-179	0	0	0	108.5
411	S	25	Very low	32.9	Very low	80 Å²	80	144.6 Å²	144.6	56%	0.559	79%	0.788	S	S	*	*			trans	-72.4	140.6	169.7	-69.6	0	0	0	0	111.2
412	F	31.3	Very low	32.7	Very low	212 Å²	212	144.9 Å²	144.9	93%	0.93	79%	0.787	S	S	*	*			trans	-140.2	129.5	144.2	-93.4	-77.4	0	0	0	110.8
413	H	30.4	Very low	32.5	Very low	161 Å²	161	145.3 Å²	145.3	75%	0.745	79%	0.789	S	S	*	*			trans	-88.4	154.4	-171	-90.1	-80.2	0	0	0	112.6
414	S	26.9	Very low	32.1	Very low	104 Å²	104	146.4 Å²	146.4	73%	0.727	79%	0.792	S	S	*	*			trans	68	116.2	143.9	-54.1	0	0	0	0	119.1
415	V	30.4	Very low	32.1	Very low	145 Å²	145	144.6 Å²	144.6	88%	0.879	79%	0.79	S	S	*	*				-162.9	121.8	112.6	-96.6	0	0	0	0	110.6
416	S	28.1	Very low	31.6	Very low	123 Å²	123	142.6 Å²	142.6	86%	0.86	78%	0.782	S	S	*	*			trans	-71.3	137	165.1	-53	0	0	0	0	110.2
417	S	31.1	Very low	31.7	Very low	104 Å²	104	141.6 Å²	141.6	73%	0.727	78%	0.78	S	S	*	*			trans	-156.1	95.6	152.5	55.1	0	0	0	0	110	V419	S417-V419 PolarHBondContact O-N 3.04Å
418	S	32.9	Very low	31.4	Very low	121 Å²	121	141.7 Å²	141.7	85%	0.846	78%	0.783	S	S	*	*			trans	-62.8	117.4	157.8	48.8	0	0	0	0	108.9
419	V	36	Very low	31.3	Very low	135 Å²	135	141.3 Å²	141.3	82%	0.818	79%	0.79	S	S	*	*			trans	-104.6	106.6	169.2	179.3	0	0	0	0	108.1	S417	S417-V419 PolarHBondContact O-N 3.04Å
420	S	35.9	Very low	31.4	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	80%	0.795	S	S	*	*			trans	-57.3	141	170.6	40	0	0	0	0	112.5
421	Q	33.5	Very low	31.4	Very low	183 Å²	183	139 Å²	139	86%	0.855	79%	0.787	S	S	*	*			trans	-55.6	138	170.2	-66.4	-170.1	-25.3	0	0	111.2	N423	Q421-N423 PolarHBondContact O-N 2.79Å
422	P	32.9	Very low	32.3	Very low	108 Å²	108	145 Å²	145	70%	0.701	80%	0.803	S	S	*	*			trans	-76.2	115.9	169	29.3	-28.9	0	0	0	109.2	F424	P422-F424 PolarHBondContact O-N 3.36Å
423	N	30.6	Very low	32.8	Very low	148 Å²	148	138.4 Å²	138.4	79%	0.791	79%	0.794	S	S	*	*			trans	-72.2	104.9	169.2	-161.4	-0.8	0	0	0	108.4	Q421 S425	Q421-N423 PolarHBondContact O-N 2.79Å; N423-S425 VanDerWaalsContact C-N 3.29Å; N423-S425 PolarHBondContact O-N 3.38Å
424	F	30.1	Very low	34	Very low	181 Å²	181	134.4 Å²	134.4	79%	0.794	78%	0.782	S	S	*	*			trans	-81	77.1	174.9	-103	-90.3	0	0	0	109.5	P422	P422-F424 PolarHBondContact O-N 3.36Å
425	S	29.7	Very low	36	Very low	100 Å²	100	131.5 Å²	131.5	70%	0.699	77%	0.768	S	S	*	*			trans	-145.1	63.8	171.6	-145.5	0	0	0	0	110.9	N423	N423-S425 VanDerWaalsContact C-N 3.29Å; N423-S425 PolarHBondContact O-N 3.38Å
426	S	31.9	Very low	37.9	Very low	104 Å²	104	133.6 Å²	133.6	73%	0.727	77%	0.765	S	S	*	*			trans	173.5	77.2	158.6	56.2	0	0	0	0	110.3
427	Y	30.7	Very low	39.9	Very low	212 Å²	212	130 Å²	130	83%	0.831	75%	0.748	S	S	*	*			trans	-130.3	109.2	153.1	-80.7	-76.8	0	0	0	107.8	S429	Y427-S429 PolarHBondContact O-N 2.95Å
428	Q	30.9	Very low	42.1	Very low	197 Å²	197	130 Å²	130	92%	0.921	74%	0.736	S	S	*	*			trans	-51.4	119.6	169.4	-96.6	170.9	-4.4	0	0	108.9	L430	Q428-L430 PolarHBondContact O-N 2.82Å
429	S	32.2	Very low	44.1	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	72%	0.719	S	S	*	*			trans	-67.6	105.4	170	61.2	0	0	0	0	108.5	Y427 T431	Y427-S429 PolarHBondContact O-N 2.95Å; S429-T431 PolarHBondContact O-N 3.05Å
430	L	33.1	Very low	46	Very low	163 Å²	163	130.3 Å²	130.3	85%	0.853	71%	0.709	S	S	*	*			trans	-58.6	116.9	167.9	-164.1	73.5	0	0	0	108.6	Q428 K432	Q428-L430 PolarHBondContact O-N 2.82Å; L430-K432 PolarHBondContact O-N 2.84Å
431	T	34.9	Very low	47.9	Very low	119 Å²	119	130.3 Å²	130.3	73%	0.73	70%	0.7	S	S	*	*			trans	-57.7	119.7	173.1	53.2	0	0	0	0	110.1	S429	S429-T431 PolarHBondContact O-N 3.05Å
432	K	43.9	Very low	50	Low	207 Å²	207	126.4 Å²	126.4	90%	0.9	68%	0.682	S	S	*	*			trans	178	118.2	151.1	-101.2	155.6	-173.4	-176.7	0	113.3	L430	L430-K432 PolarHBondContact O-N 2.84Å
433	G	43.3	Very low	52.1	Low	73 Å²	73	124.1 Å²	124.1	75%	0.753	67%	0.669	S	S	*	*			trans	90.1	91.8	148.8	0	0	0	0	0	116.7	G435	G433-G435 PolarHBondContact O-N 3.42Å
434	T	54.2	Low	54.2	Low	78 Å²	78	120.3 Å²	120.3	48%	0.479	65%	0.648	S	S	.	*			trans	-65	106.4	164.9	51.2	0	0	0	0	108.9	Q439	T434-Q439 PolarHBondContact OG1-NE2 2.83Å
435	G	69.8	Low	56.4	Low	42 Å²	42	115 Å²	115	43%	0.433	63%	0.63	S	S	.	*			trans	-63.5	152.7	172.5	0	0	0	0	0	110.3	G433 G437 E438 Q439	G433-G435 PolarHBondContact O-N 3.42Å; G435-G437 PolarHBondContact O-N 2.99Å; G435-E438 PolarHBondContact O-N 3.08Å; G435-Q439 PolarHBondContact O-N 3.19Å
436	K	70.8	Confident	58.6	Low	189 Å²	189	115 Å²	115	82%	0.822	62%	0.621	S	S	*	*	H	α-helix	trans	-49.2	-31.6	178	-69.4	-178	176.1	-178.6	0	113.5	W440	K436-W440 WeakPolarHBondContact O-CB 3.33Å; K436-W440 PolarHBondContact O-N 2.75Å
437	G	70.5	Confident	60.7	Low	48 Å²	48	119.4 Å²	119.4	50%	0.495	62%	0.622	S	S	.	*	H	α-helix	trans	-67.7	-34	176.7	0	0	0	0	0	114.2	G435 W440 L441	G435-G437 PolarHBondContact O-N 2.99Å; G437-W440 PolarHBondContact O-N 3.17Å; G437-L441 WeakPolarHBondContact O-CG 3.08Å; G437-L441 PolarHBondContact O-N 2.66Å
438	E	76.7	Confident	62.6	Low	103 Å²	103	111.3 Å²	111.3	48%	0.481	60%	0.599	S	S	.	*	H	α-helix	trans	-76.6	-37.9	179.2	-152.9	173.3	-164.1	0	0	111	G435 W440 L441 Q442	G435-E438 PolarHBondContact O-N 3.08Å; E438-W440 VanDerWaalsContact C-N 3.28Å; E438-W440 PolarHBondContact O-N 2.97Å; E438-L441 PolarHBondContact O-N 3.34Å; E438-Q442 WeakPolarHBondContact O-CG 3.47Å; E438-Q442 PolarHBondContact O-N 2.74Å
439	Q	74.2	Confident	64.5	Low	107 Å²	107	110.2 Å²	110.2	50%	0.5	59%	0.586	S	S	.	*	H	α-helix	trans	-60.7	-37.8	169	-67.5	-177.2	1.5	0	0	111.8	T434 G435 Q442 S443	T434-Q439 PolarHBondContact OG1-NE2 2.83Å; G435-Q439 PolarHBondContact O-N 3.19Å; Q439-Q442 PolarHBondContact O-N 2.81Å; Q439-S443 VanDerWaalsContact O-CB 3.31Å; Q439-S443 WeakPolarHBondContact O-CB 3.44Å; Q439-S443 PolarHBondContact O-N 3Å
440	W	75.4	Confident	66.3	Low	156 Å²	156	108.5 Å²	108.5	59%	0.591	57%	0.571	S	S	*	*	H	α-helix	trans	-67.2	-41.5	176.1	-174.8	79	0	0	0	112.5	K436 G437 E438 S443 L444	K436-W440 WeakPolarHBondContact O-CB 3.33Å; K436-W440 PolarHBondContact O-N 2.75Å; G437-W440 PolarHBondContact O-N 3.17Å; E438-W440 VanDerWaalsContact C-N 3.28Å; E438-W440 PolarHBondContact O-N 2.97Å; W440-S443 WeakPolarHBondContact O-CB 3.24Å; W440-S443 PolarHBondContact O-N 2.76Å; W440-L444 HydrophobicContact CD2-CD1 3.69Å; W440-L444 HydrophobicContact CE3-CD1 3.61Å; W440-L444 HydrophobicContact CH2-CD1 3.41Å; W440-L444 VanDerWaalsContact CH2-CD1 3.41Å; W440-L444 HydrophobicContact CZ2-CD1 3.48Å; W440-L444 VanDerWaalsContact CZ2-CD1 3.48Å; W440-L444 HydrophobicContact CZ3-CD1 3.47Å; W440-L444 VanDerWaalsContact CZ3-CD1 3.47Å; W440-L444 PolarHBondContact O-N 3.37Å
441	L	77.2	Confident	67.8	Low	104 Å²	104	102.9 Å²	102.9	55%	0.545	55%	0.548	S	S	.	.	H	α-helix	trans	-64.6	-39.7	173.6	-72.7	170.4	0	0	0	112.5	G437 E438 L444 T445	G437-L441 WeakPolarHBondContact O-CG 3.08Å; G437-L441 PolarHBondContact O-N 2.66Å; E438-L441 PolarHBondContact O-N 3.34Å; L441-L444 PolarHBondContact O-N 3.3Å; L441-T445 PolarHBondContact O-N 3.35Å; L441-T445 PolarHBondContact O-OG1 3.37Å
442	Q	76	Confident	69	Low	101 Å²	101	106.8 Å²	106.8	47%	0.472	55%	0.549	S	S	.	.	H	α-helix	trans	-65.1	-41.6	173.9	-71	178.2	22.7	0	0	111.5	E438 Q439 L444 T445 I446	E438-Q442 WeakPolarHBondContact O-CG 3.47Å; E438-Q442 PolarHBondContact O-N 2.74Å; Q439-Q442 PolarHBondContact O-N 2.81Å; Q442-L444 PolarHBondContact O-N 3.17Å; Q442-T445 PolarHBondContact O-N 3.44Å; Q442-I446 WeakPolarHBondContact O-CG1 3.31Å; Q442-I446 PolarHBondContact O-N 3.43Å
443	S	77.3	Confident	69.3	Low	61 Å²	61	99 Å²	99	43%	0.427	53%	0.528	S	S	.	.	H	α-helix	trans	-57.5	-47.9	174.1	169.2	0	0	0	0	112	Q439 W440 T445 I446 R447	Q439-S443 VanDerWaalsContact O-CB 3.31Å; Q439-S443 WeakPolarHBondContact O-CB 3.44Å; Q439-S443 PolarHBondContact O-N 3Å; W440-S443 WeakPolarHBondContact O-CB 3.24Å; W440-S443 PolarHBondContact O-N 2.76Å; S443-T445 VanDerWaalsContact C-N 3.32Å; S443-T445 PolarHBondContact O-N 2.74Å; S443-I446 PolarHBondContact O-N 3.45Å; S443-R447 WeakPolarHBondContact O-CB 3.23Å; S443-R447 PolarHBondContact O-N 2.87Å
444	L	75.4	Confident	69.6	Low	67 Å²	67	100.8 Å²	100.8	35%	0.351	52%	0.519	S	S	.	.	H	α-helix	trans	-59.2	-41.9	174.8	-91.8	149.4	0	0	0	112.3	W440 L441 Q442 R447 A448	W440-L444 HydrophobicContact CD2-CD1 3.69Å; W440-L444 HydrophobicContact CE3-CD1 3.61Å; W440-L444 HydrophobicContact CH2-CD1 3.41Å; W440-L444 VanDerWaalsContact CH2-CD1 3.41Å; W440-L444 HydrophobicContact CZ2-CD1 3.48Å; W440-L444 VanDerWaalsContact CZ2-CD1 3.48Å; W440-L444 HydrophobicContact CZ3-CD1 3.47Å; W440-L444 VanDerWaalsContact CZ3-CD1 3.47Å; W440-L444 PolarHBondContact O-N 3.37Å; L441-L444 PolarHBondContact O-N 3.3Å; Q442-L444 PolarHBondContact O-N 3.17Å; L444-R447 PolarHBondContact O-N 3.47Å; L444-A448 WeakPolarHBondContact O-CB 3.38Å; L444-A448 PolarHBondContact O-N 3.09Å
445	T	76.7	Confident	69.1	Low	70 Å²	70	104.4 Å²	104.4	43%	0.429	54%	0.535	S	S	.	.	H	α-helix	trans	-66	-43.5	179.4	-56	0	0	0	0	111.7	L441 Q442 S443 A448 R449	L441-T445 PolarHBondContact O-N 3.35Å; L441-T445 PolarHBondContact O-OG1 3.37Å; Q442-T445 PolarHBondContact O-N 3.44Å; S443-T445 VanDerWaalsContact C-N 3.32Å; S443-T445 PolarHBondContact O-N 2.74Å; T445-A448 PolarHBondContact O-N 3.25Å; T445-R449 WeakPolarHBondContact O-CB 3.29Å; T445-R449 PolarHBondContact O-N 3.13Å
446	I	75.1	Confident	67.6	Low	99 Å²	99	109.7 Å²	109.7	51%	0.508	55%	0.553	S	S	.	*	H	α-helix	trans	-62.5	-46.1	175.4	-67.3	167.3	0	0	0	109.8	Q442 S443 A448 R449 T450	Q442-I446 WeakPolarHBondContact O-CG1 3.31Å; Q442-I446 PolarHBondContact O-N 3.43Å; S443-I446 PolarHBondContact O-N 3.45Å; I446-A448 VanDerWaalsContact C-N 3.34Å; I446-A448 PolarHBondContact O-N 3.31Å; I446-R449 PolarHBondContact O-N 3.14Å; I446-R449 VanDerWaalsContact O-N 3.08Å; I446-T450 PolarHBondContact O-N 2.76Å; I446-T450 PolarHBondContact O-OG1 3.38Å; I446-T450 VanDerWaalsContact O-OG1 3.11Å
447	R	77.2	Confident	65.9	Low	198 Å²	198	108.6 Å²	108.6	75%	0.747	55%	0.551	S	S	*	*	H	α-helix	trans	-62.5	-39.2	-179.6	-143.8	172.8	-169.3	173.2	1.7	112.4	S443 L444 A451	S443-R447 WeakPolarHBondContact O-CB 3.23Å; S443-R447 PolarHBondContact O-N 2.87Å; L444-R447 PolarHBondContact O-N 3.47Å; R447-A451 VanDerWaalsContact O-CB 3.32Å; R447-A451 WeakPolarHBondContact O-CB 3.33Å; R447-A451 PolarHBondContact O-N 2.82Å
448	A	69.9	Low	64.1	Low	41 Å²	41	113.6 Å²	113.6	34%	0.339	57%	0.567	S	S	.	*	H	α-helix	trans	-67.4	-35.6	174	0	0	0	0	0	112.6	L444 T445 I446 R452	L444-A448 WeakPolarHBondContact O-CB 3.38Å; L444-A448 PolarHBondContact O-N 3.09Å; T445-A448 PolarHBondContact O-N 3.25Å; I446-A448 VanDerWaalsContact C-N 3.34Å; I446-A448 PolarHBondContact O-N 3.31Å; A448-R452 WeakPolarHBondContact O-CG 3.03Å; A448-R452 PolarHBondContact O-N 3.16Å
449	R	71.1	Confident	62.1	Low	175 Å²	175	117.6 Å²	117.6	66%	0.66	59%	0.585	S	S	*	*	H	α-helix	trans	-73.3	-41.9	179.1	-150.8	-179.8	-83.2	133.9	-9.6	111.4	T445 I446 R452 G453	T445-R449 WeakPolarHBondContact O-CB 3.29Å; T445-R449 PolarHBondContact O-N 3.13Å; I446-R449 PolarHBondContact O-N 3.14Å; I446-R449 VanDerWaalsContact O-N 3.08Å; R449-R452 PolarHBondContact O-N 3.43Å; R449-G453 PolarHBondContact O-N 2.75Å
450	T	70.5	Confident	60.1	Low	77 Å²	77	118.6 Å²	118.6	47%	0.472	60%	0.604	S	S	.	*	H	α-helix	trans	-63.8	-41.8	173	-54.7	0	0	0	0	111.7	I446 R452 G453 I454	I446-T450 PolarHBondContact O-N 2.76Å; I446-T450 PolarHBondContact O-OG1 3.38Å; I446-T450 VanDerWaalsContact O-OG1 3.11Å; T450-R452 VanDerWaalsContact C-N 3.25Å; T450-R452 PolarHBondContact O-N 2.72Å; T450-G453 PolarHBondContact O-N 3.02Å; T450-G453 VanDerWaalsContact O-N 3.16Å; T450-I454 HydrophobicContact CG2-CD1 3.69Å; T450-I454 HydrophobicContact CG2-CG1 4.38Å; T450-I454 VanDerWaalsContact O-CG1 3.29Å; T450-I454 WeakPolarHBondContact O-CG1 3.45Å; T450-I454 PolarHBondContact O-N 3.09Å; T450-I454 VanDerWaalsContact O-N 3.11Å
451	A	63.8	Low	58.1	Low	46 Å²	46	120 Å²	120	38%	0.38	62%	0.617	S	S	.	*	H	α-helix	trans	-63.9	-28.1	176	0	0	0	0	0	113.5	R447	R447-A451 VanDerWaalsContact O-CB 3.32Å; R447-A451 WeakPolarHBondContact O-CB 3.33Å; R447-A451 PolarHBondContact O-N 2.82Å
452	R	60.8	Low	56.1	Low	200 Å²	200	121 Å²	121	76%	0.755	63%	0.633	S	S	*	*	H	α-helix	trans	-82.2	-27.4	173.2	-74.6	-175.9	177.7	178.1	-0.4	113.5	A448 R449 T450	A448-R452 WeakPolarHBondContact O-CG 3.03Å; A448-R452 PolarHBondContact O-N 3.16Å; R449-R452 PolarHBondContact O-N 3.43Å; T450-R452 VanDerWaalsContact C-N 3.25Å; T450-R452 PolarHBondContact O-N 2.72Å
453	G	48.6	Very low	54.1	Low	44 Å²	44	126.8 Å²	126.8	45%	0.454	65%	0.651	S	S	.	*	H	α-helix	trans	-76.7	-25.6	175.9	0	0	0	0	0	114.2	R449 T450 L455	R449-G453 PolarHBondContact O-N 2.75Å; T450-G453 PolarHBondContact O-N 3.02Å; T450-G453 VanDerWaalsContact O-N 3.16Å; G453-L455 VanDerWaalsContact C-N 3.3Å; G453-L455 PolarHBondContact O-N 2.91Å
454	I	49.7	Very low	52.3	Low	111 Å²	111	131.7 Å²	131.7	57%	0.569	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-8.6	-178.3	-66.4	169.1	0	0	0	112.9	T450	T450-I454 HydrophobicContact CG2-CD1 3.69Å; T450-I454 HydrophobicContact CG2-CG1 4.38Å; T450-I454 VanDerWaalsContact O-CG1 3.29Å; T450-I454 WeakPolarHBondContact O-CG1 3.45Å; T450-I454 PolarHBondContact O-N 3.09Å; T450-I454 VanDerWaalsContact O-N 3.11Å
455	L	43.5	Very low	50.5	Low	153 Å²	153	133.4 Å²	133.4	80%	0.801	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	8.9	175.7	-80.4	168.7	0	0	0	114.2	G453	G453-L455 VanDerWaalsContact C-N 3.3Å; G453-L455 PolarHBondContact O-N 2.91Å
456	N	38.7	Very low	48.6	Very low	153 Å²	153	137.8 Å²	137.8	82%	0.818	71%	0.707	S	S	*	*	S	Bend	trans	-126.8	11.3	179.2	-124.2	33.3	0	0	0	114.7
457	E	36.3	Very low	46.6	Very low	166 Å²	166	144.2 Å²	144.2	78%	0.776	73%	0.725	S	S	*	*			trans	-133.8	86.2	171.9	-60.2	-146.7	143.5	0	0	108.7
458	N	32.3	Very low	44.5	Very low	154 Å²	154	139 Å²	139	82%	0.824	72%	0.724	S	S	*	*			trans	-161.8	57.9	165.3	-88.5	-25.8	0	0	0	108.1
459	E	33.5	Very low	42.7	Very low	187 Å²	187	142.6 Å²	142.6	87%	0.874	75%	0.745	S	S	*	*			trans	-110.4	132.7	151	-88.1	-159.6	106.3	0	0	107
460	S	33.4	Very low	41.2	Very low	128 Å²	128	139 Å²	139	90%	0.895	75%	0.747	S	S	*	*			trans	91.9	76.5	170.4	-36.1	0	0	0	0	116.9
461	E	34.1	Very low	39.9	Very low	184 Å²	184	140.8 Å²	140.8	86%	0.86	76%	0.763	S	S	*	*			trans	-110.6	113	157.5	-154.9	177.4	150.3	0	0	108.8
462	S	34.6	Very low	38.7	Very low	126 Å²	126	143.9 Å²	143.9	88%	0.881	78%	0.779	S	S	*	*			trans	-147.5	102.1	161.7	171.4	0	0	0	0	107.1
463	R	33.6	Very low	37.6	Very low	223 Å²	223	142.6 Å²	142.6	84%	0.842	78%	0.781	S	S	*	*			trans	-107.5	134.1	166.7	-84.3	-178.6	172.1	175	-0.4	107.3
464	D	40.3	Very low	37	Very low	163 Å²	163	145.2 Å²	145.2	87%	0.872	79%	0.793	S	S	*	*			trans	-140.9	148.6	138.8	-94.4	-37.3	0	0	0	109.8
465	P	36.1	Very low	36.3	Very low	103 Å²	103	145.3 Å²	145.3	67%	0.669	80%	0.798	S	S	*	*			trans	-100.8	157.9	-159.3	36.4	-28	0	0	0	112.8
466	L	37.5	Very low	35.9	Very low	162 Å²	162	143.6 Å²	143.6	85%	0.848	79%	0.794	S	S	*	*			trans	152.3	124.7	130.6	-78.3	166.3	0	0	0	113.1
467	R	33.6	Very low	35.6	Very low	235 Å²	235	141.1 Å²	141.1	89%	0.887	79%	0.789	S	S	*	*			trans	71.5	98.3	137.1	-155.5	173.8	-120.2	-178.3	-1.9	120.3
468	A	32.8	Very low	35.5	Very low	87 Å²	87	137.4 Å²	137.4	72%	0.719	78%	0.781	S	S	*	*				38.8	128.5	126.5	0	0	0	0	0	122.2
469	C	32.7	Very low	35.6	Very low	118 Å²	118	138.7 Å²	138.7	80%	0.797	78%	0.782	S	S	*	*			trans	108.2	106.6	143.1	-66.3	0	0	0	0	119.2
470	S	39.7	Very low	35.8	Very low	100 Å²	100	135 Å²	135	70%	0.699	77%	0.773	S	S	*	*			trans	70.3	100.2	133.9	59.6	0	0	0	0	121.9
471	S	41.8	Very low	36	Very low	114 Å²	114	136.7 Å²	136.7	80%	0.797	77%	0.772	S	S	*	*				67.7	159.1	116.6	-36.2	0	0	0	0	120.1
472	P	39.5	Very low	36.2	Very low	111 Å²	111	131.4 Å²	131.4	72%	0.721	77%	0.766	S	S	*	*				-135.1	-169	-101.9	29.8	-4	0	0	0	114.1
473	Q	37.8	Very low	36.4	Very low	173 Å²	173	134.2 Å²	134.2	81%	0.808	76%	0.763	S	S	*	*			trans	100.2	105.3	162.7	-57.7	-173.6	1.5	0	0	115.6
474	S	35.4	Very low	36.7	Very low	99 Å²	99	129.8 Å²	129.8	69%	0.692	76%	0.756	S	S	*	*				91.1	123.7	91.6	79	0	0	0	0	110.5
475	T	34.4	Very low	36.6	Very low	112 Å²	112	128.9 Å²	128.9	69%	0.687	75%	0.751	S	S	*	*				163.1	137.5	74.4	-67.9	0	0	0	0	108.5
476	V	36.1	Very low	36.6	Very low	117 Å²	117	131.7 Å²	131.7	71%	0.709	76%	0.76	S	S	*	*			trans	67.7	114.1	144.3	171.5	0	0	0	0	120
477	S	32.5	Very low	36.6	Very low	101 Å²	101	127.9 Å²	127.9	71%	0.706	75%	0.752	S	S	*	*				71.1	144.6	104.1	-38.9	0	0	0	0	114.1
478	S	34.5	Very low	36.5	Very low	89 Å²	89	126.2 Å²	126.2	62%	0.622	75%	0.754	S	S	*	*			cis	-175.4	154.1	24.7	-10.2	0	0	0	0	108.3
479	E	34.7	Very low	36.5	Very low	181 Å²	181	133.6 Å²	133.6	85%	0.846	76%	0.763	S	S	*	*			trans	62.3	147	145.5	-51.7	174.8	129.5	0	0	119.4
480	T	37.2	Very low	36.3	Very low	109 Å²	109	133.2 Å²	133.2	67%	0.669	76%	0.762	S	S	*	*			cis	-169.4	164.9	41.1	40.2	0	0	0	0	111.1
481	N	38.1	Very low	35.9	Very low	163 Å²	163	137.3 Å²	137.3	87%	0.872	77%	0.772	S	S	*	*			trans	72.2	130.4	151.6	-69.5	-26.7	0	0	0	118.2
482	G	37.7	Very low	35.2	Very low	73 Å²	73	140.5 Å²	140.5	75%	0.753	77%	0.774	S	S	*	*			cis	143.2	157.3	22.2	0	0	0	0	0	104.7
483	K	38.5	Very low	34.8	Very low	186 Å²	186	145.3 Å²	145.3	81%	0.809	79%	0.785	S	S	*	*			cis	-178	160.8	-1.2	-147.8	178.1	-176.3	166.3	0	104.5
484	N	39.7	Very low	34.3	Very low	130 Å²	130	147.6 Å²	147.6	70%	0.695	79%	0.786	S	S	*	*			trans	85.3	139	159	-39.2	-23.7	0	0	0	116.9
485	D	38.6	Very low	34	Very low	144 Å²	144	149.8 Å²	149.8	77%	0.77	80%	0.795	S	S	*	*			cis	-177.5	148	-18.9	-110.9	-40	0	0	0	107.6
486	L	35.6	Very low	33.8	Very low	161 Å²	161	147.7 Å²	147.7	84%	0.843	80%	0.795	S	S	*	*			trans	115.9	114.8	133.5	-139.9	61.2	0	0	0	122.3
487	A	37.8	Very low	33.6	Very low	83 Å²	83	148.3 Å²	148.3	69%	0.686	80%	0.795	S	S	*	*			trans	71.7	96.1	148.8	0	0	0	0	0	119.8
488	Q	31.6	Very low	33.7	Very low	199 Å²	199	148.6 Å²	148.6	93%	0.93	80%	0.803	S	S	*	*				49.1	114.1	70.7	-82.8	-177.6	-40.7	0	0	116.3
489	R	32.2	Very low	33.8	Very low	242 Å²	242	150.4 Å²	150.4	91%	0.913	81%	0.81	S	S	*	*				-171.7	124.3	103.8	-167.1	164.7	174.7	-174.2	-2.4	112.4
490	S	28.9	Very low	33.8	Very low	110 Å²	110	152 Å²	152	77%	0.769	81%	0.808	S	S	*	*			trans	-60.6	148.1	172.6	-57.6	0	0	0	0	114.3
491	M	31.4	Very low	33.6	Very low	186 Å²	186	151.4 Å²	151.4	92%	0.916	82%	0.815	S	S	*	*			trans	-148.8	121.3	139.9	-123.8	-175.5	-71.5	0	0	110.1
492	E	27.9	Very low	33.5	Very low	181 Å²	181	152 Å²	152	85%	0.846	82%	0.817	S	S	*	*			trans	-63.5	139	170.8	-62.1	168	125.2	0	0	110.3
493	F	30.1	Very low	33.2	Very low	213 Å²	213	158 Å²	158	93%	0.934	83%	0.826	S	S	*	*			trans	-152.6	129.9	149.8	-129.4	-90.9	0	0	0	112
494	R	26.7	Very low	32.9	Very low	221 Å²	221	153.7 Å²	153.7	83%	0.834	83%	0.825	S	S	*	*			trans	-82.6	154.7	178.9	-66.6	177.1	161.4	-160.9	-2.4	111.7
495	T	30.6	Very low	32.7	Very low	145 Å²	145	155.8 Å²	155.8	89%	0.89	83%	0.834	S	S	*	*			trans	68.2	122.3	148.1	7.8	0	0	0	0	119.4
496	G	29.3	Very low	32.2	Very low	67 Å²	67	155.2 Å²	155.2	69%	0.691	84%	0.835	S	S	*	*			trans	140.2	131.4	147.6	0	0	0	0	0	115.3
497	D	31.5	Very low	31.8	Very low	131 Å²	131	152.8 Å²	152.8	70%	0.701	83%	0.831	S	S	*	*			trans	82.3	77.5	154.4	-64.1	-6.7	0	0	0	120.6	R500	D497-R500 IonicContact OD2-NH2 3.63Å; D497-R500 PolarHBondContact OD2-NH2 2.84Å
498	A	35.6	Very low	31.5	Very low	106 Å²	106	153.7 Å²	153.7	88%	0.876	83%	0.828	S	S	*	*			trans	-98.7	43.8	159.1	0	0	0	0	0	112.9
499	V	36.1	Very low	31.7	Very low	128 Å²	128	152.8 Å²	152.8	78%	0.776	82%	0.823	S	S	*	*			trans	-132.1	40.7	-176.9	-163.6	0	0	0	0	112.9
500	R	34.7	Very low	31.6	Very low	213 Å²	213	149 Å²	149	80%	0.804	82%	0.821	S	S	*	*			trans	-145.1	14.2	-180	-116.7	-173.6	-71.1	159.7	-0.3	117.7	D497	D497-R500 IonicContact OD2-NH2 3.63Å; D497-R500 PolarHBondContact OD2-NH2 2.84Å
501	A	33.9	Very low	31.6	Very low	98 Å²	98	148.8 Å²	148.8	81%	0.81	82%	0.819	S	S	*	*	S	Bend	trans	-103.5	11.7	-168.6	0	0	0	0	0	116.9
502	L	35.9	Very low	31.7	Very low	175 Å²	175	146.9 Å²	146.9	92%	0.916	81%	0.812	S	S	*	*	S	Bend	trans	-135.8	46.5	-177.8	-128.1	86	0	0	0	114
503	E	30.8	Very low	31.9	Very low	200 Å²	200	146.7 Å²	146.7	94%	0.935	81%	0.812	S	S	*	*			trans	-129.3	69.1	163.3	-85	-169	154.2	0	0	108.6
504	A	32.4	Very low	31.9	Very low	95 Å²	95	141.7 Å²	141.7	79%	0.785	80%	0.803	S	S	*	*			trans	-164.6	46.6	174.7	0	0	0	0	0	114.4
505	I	35.1	Very low	32.3	Very low	174 Å²	174	137.2 Å²	137.2	89%	0.892	80%	0.802	S	S	*	*			trans	-141.9	87.4	161.6	-52.3	178.8	0	0	0	108.9
506	V	28.3	Very low	32.1	Very low	131 Å²	131	135.2 Å²	135.2	79%	0.794	80%	0.8	S	S	*	*			trans	-133.1	145.3	165	177	0	0	0	0	106.6
507	C	28.1	Very low	32.3	Very low	111 Å²	111	137 Å²	137	75%	0.75	81%	0.808	S	S	*	*			trans	81	124.1	-179.1	-52.6	0	0	0	0	112.2
508	T	30.1	Very low	32.1	Very low	101 Å²	101	134.2 Å²	134.2	62%	0.62	81%	0.811	S	S	*	*			cis	-159.3	165.8	31.6	29.7	0	0	0	0	106.4
509	H	35.8	Very low	32.2	Very low	180 Å²	180	137.6 Å²	137.6	83%	0.833	81%	0.814	S	S	*	*				174.4	140.6	94.3	-69.9	-70.7	0	0	0	109.7
510	N	31.6	Very low	31.8	Very low	163 Å²	163	139.6 Å²	139.6	87%	0.872	81%	0.814	S	S	*	*			trans	-78.1	149.4	-175.9	-83.7	-29.7	0	0	0	114.6
511	S	28.2	Very low	31.5	Very low	105 Å²	105	136.2 Å²	136.2	73%	0.734	81%	0.812	S	S	*	*			trans	18.7	117.5	133.5	-172.6	0	0	0	0	119
512	L	32.3	Very low	31.4	Very low	147 Å²	147	140 Å²	140	77%	0.77	82%	0.818	S	S	*	*			trans	178.9	118.7	132.9	-98.4	143	0	0	0	112.9
513	Q	33.6	Very low	31.2	Very low	177 Å²	177	137 Å²	137	83%	0.827	81%	0.811	S	S	*	*			trans	44.7	125.3	143.4	-86.8	159.6	-5.8	0	0	123.4
514	S	30.1	Very low	31.4	Very low	108 Å²	108	132.2 Å²	132.2	76%	0.755	81%	0.806	S	S	*	*			trans	-65.6	164.1	165.6	64.6	0	0	0	0	113.7
515	P	33.7	Very low	31.8	Very low	126 Å²	126	132 Å²	132	82%	0.818	80%	0.799	S	S	*	*				-147.1	157.1	75.6	33.4	-11.9	0	0	0	117.9
516	A	27.4	Very low	32.5	Very low	103 Å²	103	132 Å²	132	85%	0.851	80%	0.799	S	S	*	*			trans	3.5	124.8	156.7	0	0	0	0	0	121.7
517	A	33.9	Very low	33.8	Very low	104 Å²	104	128.8 Å²	128.8	86%	0.86	78%	0.78	S	S	*	*			trans	-162.6	142.7	133.1	0	0	0	0	0	109.3
518	G	27.3	Very low	35.3	Very low	73 Å²	73	127.6 Å²	127.6	75%	0.753	77%	0.766	S	S	*	*			trans	-69.3	153.8	-154.7	0	0	0	0	0	117.8
519	L	36.1	Very low	37	Very low	178 Å²	178	127.2 Å²	127.2	93%	0.932	77%	0.765	S	S	*	*			trans	-155.6	122.6	143.1	-123.9	120.4	0	0	0	109.2
520	E	28.8	Very low	37.9	Very low	169 Å²	169	125 Å²	125	79%	0.79	75%	0.754	S	S	*	*			trans	-78.9	155.9	-178.8	-53	-166	158.7	0	0	111.4
521	N	28.2	Very low	39.3	Very low	142 Å²	142	122.4 Å²	122.4	76%	0.759	74%	0.736	S	S	*	*			trans	68.8	126.8	165.1	-71.5	-29.3	0	0	0	118.8
522	L	32.5	Very low	41.1	Very low	178 Å²	178	119.8 Å²	119.8	93%	0.932	72%	0.721	S	S	*	*				-173.1	75	127.9	-93.5	161.9	0	0	0	109	A524	L522-A524 PolarHBondContact O-N 3.25Å
523	S	31.7	Very low	42.7	Very low	111 Å²	111	120.4 Å²	120.4	78%	0.776	71%	0.713	S	S	*	*			trans	-79.4	105.1	161.9	63	0	0	0	0	108.4	S525	S523-S525 VanDerWaalsContact C-N 3.34Å; S523-S525 PolarHBondContact O-N 2.87Å
524	A	34.5	Very low	44	Very low	100 Å²	100	120 Å²	120	83%	0.826	70%	0.704	S	S	*	*			trans	-71.8	86.9	175.3	0	0	0	0	0	110.6	L522 I526	L522-A524 PolarHBondContact O-N 3.25Å; A524-I526 PolarHBondContact O-N 3.42Å
525	S	40.3	Very low	45.8	Very low	92 Å²	92	120.4 Å²	120.4	64%	0.643	70%	0.698	S	S	*	*			trans	-73.6	101.8	166.5	173.6	0	0	0	0	109.3	S523 T527	S523-S525 VanDerWaalsContact C-N 3.34Å; S523-S525 PolarHBondContact O-N 2.87Å; S525-T527 VanDerWaalsContact C-N 3.31Å; S525-T527 PolarHBondContact O-N 3.35Å; S525-T527 PolarHBondContact O-OG1 2.86Å; S525-T527 VanDerWaalsContact O-OG1 3.11Å; S525-T527 PolarHBondContact OG-OG1 2.81Å; S525-T527 VanDerWaalsContact OG-OG1 3.13Å
526	I	49.5	Very low	47.4	Very low	174 Å²	174	118.1 Å²	118.1	89%	0.892	69%	0.69	S	S	*	*			trans	-62.7	98.1	164.2	-75.6	172.4	0	0	0	106.7	A524	A524-I526 PolarHBondContact O-N 3.42Å
527	T	55.5	Low	48.6	Very low	62 Å²	62	118.1 Å²	118.1	38%	0.38	68%	0.675	S	S	.	*			trans	-99.4	131.2	177.6	-43.6	0	0	0	0	107.1	S525 E531	S525-T527 VanDerWaalsContact C-N 3.31Å; S525-T527 PolarHBondContact O-N 3.35Å; S525-T527 PolarHBondContact O-OG1 2.86Å; S525-T527 VanDerWaalsContact O-OG1 3.11Å; S525-T527 PolarHBondContact OG-OG1 2.81Å; S525-T527 VanDerWaalsContact OG-OG1 3.13Å; T527-E531 HydrophobicContact CG2-CB 4.09Å
528	D	59.3	Low	49.5	Very low	87 Å²	87	117.9 Å²	117.9	47%	0.465	67%	0.667	S	S	.	*			trans	-54.9	129.7	177.7	-178.5	-20.2	0	0	0	109.3	F530 E531 A532	D528-F530 PolarHBondContact O-N 3.47Å; D528-F530 WeakPolarHBondContact OD1-CB 3.47Å; D528-F530 PolarHBondContact OD1-N 2.86Å; D528-E531 HydrophobicContact CB-CB 4.24Å; D528-E531 HydrophobicContact CB-CG 4.42Å; D528-E531 WeakPolarHBondContact O-CA 3.48Å; D528-E531 PolarHBondContact O-N 3.42Å; D528-A532 PolarHBondContact O-N 3.42Å
529	P	67.5	Low	50.6	Low	93 Å²	93	120.7 Å²	120.7	60%	0.604	67%	0.672	S	S	*	*	H	α-helix	trans	-55.4	-21.7	176.8	19.4	-30.8	0	0	0	113.5	R533	P529-R533 PolarHBondContact O-N 3.33Å
530	F	53	Low	50.9	Low	133 Å²	133	120.6 Å²	120.6	58%	0.583	67%	0.666	S	S	*	*	H	α-helix	trans	-71.4	-46.9	169.2	-173.1	-95.1	0	0	0	112.6	D528 R533 W534	D528-F530 PolarHBondContact O-N 3.47Å; D528-F530 WeakPolarHBondContact OD1-CB 3.47Å; D528-F530 PolarHBondContact OD1-N 2.86Å; F530-R533 PolarHBondContact O-N 3.45Å; F530-W534 WeakPolarHBondContact O-CB 3.46Å; F530-W534 PolarHBondContact O-N 2.84Å
531	E	62.9	Low	52	Low	108 Å²	108	121 Å²	121	51%	0.505	67%	0.665	S	S	.	*	H	α-helix	trans	-65.9	-39.2	176.6	-84.6	-166.1	148.3	0	0	112.4	T527 D528 R533 W534 N535	T527-E531 HydrophobicContact CG2-CB 4.09Å; D528-E531 HydrophobicContact CB-CB 4.24Å; D528-E531 HydrophobicContact CB-CG 4.42Å; D528-E531 WeakPolarHBondContact O-CA 3.48Å; D528-E531 PolarHBondContact O-N 3.42Å; E531-R533 VanDerWaalsContact C-N 3.28Å; E531-R533 PolarHBondContact O-N 3.25Å; E531-W534 PolarHBondContact O-N 2.92Å; E531-N535 WeakPolarHBondContact O-CB 3.46Å; E531-N535 VanDerWaalsContact O-CG 3.24Å; E531-N535 PolarHBondContact O-N 2.9Å; E531-N535 PolarHBondContact O-ND2 3.41Å
532	A	64.7	Low	52.9	Low	50 Å²	50	122.3 Å²	122.3	41%	0.413	67%	0.666	S	S	.	*	H	α-helix	trans	-60.8	-38.6	177.5	0	0	0	0	0	111.8	D528 A536	D528-A532 PolarHBondContact O-N 3.42Å; A532-A536 WeakPolarHBondContact O-CB 2.96Å; A532-A536 PolarHBondContact O-N 3.47Å
533	R	66.7	Low	53.7	Low	161 Å²	161	117.8 Å²	117.8	61%	0.608	66%	0.662	S	S	*	*	H	α-helix	trans	-76	-34.2	176.3	-170.5	176.5	176.3	-150.5	-2.9	112.4	P529 F530 E531 A536	P529-R533 PolarHBondContact O-N 3.33Å; F530-R533 PolarHBondContact O-N 3.45Å; E531-R533 VanDerWaalsContact C-N 3.28Å; E531-R533 PolarHBondContact O-N 3.25Å; R533-A536 PolarHBondContact O-N 3.3Å
534	W	61.5	Low	55.2	Low	168 Å²	168	117.8 Å²	117.8	64%	0.636	66%	0.658	S	S	*	*	H	α-helix	trans	-64	-45.3	175	-171.7	-97.6	0	0	0	111.5	F530 E531 A536 L537	F530-W534 WeakPolarHBondContact O-CB 3.46Å; F530-W534 PolarHBondContact O-N 2.84Å; E531-W534 PolarHBondContact O-N 2.92Å; W534-A536 VanDerWaalsContact C-N 3.3Å; W534-A536 PolarHBondContact O-N 2.94Å; W534-L537 PolarHBondContact O-N 3.07Å
535	N	66.4	Low	55.8	Low	117 Å²	117	117 Å²	117	63%	0.626	64%	0.64	S	S	*	*	H	α-helix	trans	-74	-19.2	-179.8	-65.8	-22.7	0	0	0	113.4	E531 L537	E531-N535 WeakPolarHBondContact O-CB 3.46Å; E531-N535 VanDerWaalsContact O-CG 3.24Å; E531-N535 PolarHBondContact O-N 2.9Å; E531-N535 PolarHBondContact O-ND2 3.41Å; N535-L537 VanDerWaalsContact C-N 3.29Å
536	A	67.1	Low	56.8	Low	78 Å²	78	117.2 Å²	117.2	65%	0.645	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-5.3	175.6	0	0	0	0	0	114	A532 R533 W534	A532-A536 WeakPolarHBondContact O-CB 2.96Å; A532-A536 PolarHBondContact O-N 3.47Å; R533-A536 PolarHBondContact O-N 3.3Å; W534-A536 VanDerWaalsContact C-N 3.3Å; W534-A536 PolarHBondContact O-N 2.94Å
537	L	53.7	Low	56.7	Low	103 Å²	103	115.4 Å²	115.4	54%	0.539	63%	0.625	S	S	.	*	S	Bend	trans	-88.5	120.1	178.1	-68.8	168	0	0	0	110.5	W534 N535	W534-L537 PolarHBondContact O-N 3.07Å; N535-L537 VanDerWaalsContact C-N 3.29Å
538	S	51.9	Low	56.6	Low	99 Å²	99	116 Å²	116	69%	0.692	63%	0.628	S	S	*	*			trans	-62.4	130.9	178.5	-54.8	0	0	0	0	111.2	H540	S538-H540 PolarHBondContact O-N 2.98Å
539	P	51.4	Low	56	Low	132 Å²	132	117.1 Å²	117.1	86%	0.857	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	8.9	-173	-18.5	30.6	0	0	0	116.4
540	H	42.9	Very low	55	Low	176 Å²	176	121 Å²	121	82%	0.815	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.9	6.1	-161.7	-107.7	-58.2	0	0	0	118	S538	S538-H540 PolarHBondContact O-N 2.98Å
541	K	50.5	Low	54.5	Low	176 Å²	176	118.6 Å²	118.6	77%	0.765	66%	0.658	S	S	*	*	S	Bend	trans	-143.2	129.7	174.5	-65.8	-176.3	-179.9	178.6	0	109.2
542	H	46.8	Very low	53.7	Low	171 Å²	171	119.4 Å²	119.4	79%	0.792	67%	0.673	S	S	*	*			trans	92.2	92.2	177.5	-48.9	-70	0	0	0	116.1	T544	H542-T544 PolarHBondContact O-N 3.2Å
543	G	50.5	Low	52.5	Low	82 Å²	82	123.5 Å²	123.5	85%	0.845	69%	0.692	S	S	*	*	S	Bend	trans	-75.9	33.6	171.2	0	0	0	0	0	114.9
544	T	62.1	Low	51.3	Low	112 Å²	112	120.5 Å²	120.5	69%	0.687	70%	0.702	S	S	*	*	S	Bend	trans	-142.6	143	176.5	54.2	0	0	0	0	111.1	H542	H542-T544 PolarHBondContact O-N 3.2Å
545	N	48.4	Very low	50.3	Low	83 Å²	83	119.1 Å²	119.1	44%	0.444	71%	0.712	S	S	.	*			trans	-64.1	121.6	-180	-174.2	-23.5	0	0	0	109.9	F547 V548	N545-F547 PolarHBondContact O-N 2.81Å; N545-F547 VanDerWaalsContact OD1-CD2 3.32Å; N545-F547 WeakPolarHBondContact OD1-CD2 3.43Å; N545-F547 PolarHBondContact OD1-N 3.03Å; N545-V548 HydrophobicContact CB-CG2 4.36Å; N545-V548 PolarHBondContact O-N 2.8Å; N545-V548 VanDerWaalsContact O-N 3.11Å
546	P	60.1	Low	49.3	Very low	96 Å²	96	122.9 Å²	122.9	62%	0.623	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	0.1	-174.9	27.7	-35.5	0	0	0	114.4
547	F	48.2	Very low	48	Very low	136 Å²	136	122.9 Å²	122.9	60%	0.596	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	0.6	175	-64.3	-74.4	0	0	0	114.2	N545	N545-F547 PolarHBondContact O-N 2.81Å; N545-F547 VanDerWaalsContact OD1-CD2 3.32Å; N545-F547 WeakPolarHBondContact OD1-CD2 3.43Å; N545-F547 PolarHBondContact OD1-N 3.03Å
548	V	53.7	Low	47.5	Very low	74 Å²	74	124.1 Å²	124.1	45%	0.448	74%	0.738	S	S	.	*			trans	-97.9	89.6	172.8	-175.2	0	0	0	0	108.6	I306 N545 H550	I306-V548 HydrophobicContact CD1-CG2 3.99Å; N545-V548 HydrophobicContact CB-CG2 4.36Å; N545-V548 PolarHBondContact O-N 2.8Å; N545-V548 VanDerWaalsContact O-N 3.11Å; V548-H550 PolarHBondContact O-N 2.99Å
549	S	46.5	Very low	46.9	Very low	112 Å²	112	132 Å²	132	78%	0.783	76%	0.764	S	S	*	*			trans	-73.3	104.1	166.5	56.5	0	0	0	0	108.7	A551	S549-A551 PolarHBondContact O-N 3.37Å
550	H	46.5	Very low	46.7	Very low	173 Å²	173	132 Å²	132	80%	0.801	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-64.9	118.9	162.2	-79.2	-80.3	0	0	0	108.2	V548	V548-H550 PolarHBondContact O-N 2.99Å
551	A	42.2	Very low	46.9	Very low	84 Å²	84	129.7 Å²	129.7	69%	0.694	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-62.2	140.6	168.6	0	0	0	0	0	109.2	S549 T553	S549-A551 PolarHBondContact O-N 3.37Å; A551-T553 PolarHBondContact O-N 3.36Å
552	P	45.9	Very low	46.7	Very low	125 Å²	125	127.1 Å²	127.1	81%	0.812	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-68.7	118.7	174.6	27.8	-30.4	0	0	0	108.8	A554	P552-A554 PolarHBondContact O-N 3.04Å
553	T	40.7	Very low	46.7	Very low	135 Å²	135	124.5 Å²	124.5	83%	0.828	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-57.4	127.5	167	35.3	0	0	0	0	109.5	A551 T555	A551-T553 PolarHBondContact O-N 3.36Å; T553-T555 PolarHBondContact O-N 3.35Å
554	A	40.2	Very low	46.5	Very low	98 Å²	98	127.2 Å²	127.2	81%	0.81	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-57.5	128	175.7	0	0	0	0	0	110.7	P552 E556	P552-A554 PolarHBondContact O-N 3.04Å; A554-E556 PolarHBondContact O-N 3.17Å
555	T	41.6	Very low	45.4	Very low	140 Å²	140	128.2 Å²	128.2	86%	0.859	75%	0.753	S	S	*	*			trans	-65.4	114.8	164.7	-0.5	0	0	0	0	108.7	T553	T553-T555 PolarHBondContact O-N 3.35Å
556	E	44.2	Very low	45.2	Very low	195 Å²	195	131.4 Å²	131.4	91%	0.911	78%	0.775	S	S	*	*			trans	-86.4	119.7	162.3	-158	165.8	-158.9	0	0	107.3	A554	A554-E556 PolarHBondContact O-N 3.17Å
557	A	41	Very low	44.1	Very low	79 Å²	79	134.2 Å²	134.2	65%	0.653	79%	0.786	S	S	*	*			trans	-101.7	143.9	177.8	0	0	0	0	0	109.2
558	T	43.3	Very low	43.7	Very low	129 Å²	129	134 Å²	134	79%	0.791	80%	0.802	S	S	*	*			trans	100.9	116.8	147.6	-49.6	0	0	0	0	117.7
559	Q	39	Very low	42.8	Very low	264 Å²	264	139.5 Å²	139.5	100%	1.234	83%	0.834	S	S	*	*			trans	83.3	0	168.9	-76.5	179	18.3	0	0	118.7

Retrieved 559 of 559 residues in 205.3 ms (Link to these results)

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