A0A087YLR5_POEFO Loading...

T-complex-associated-testis-expressed 1

AlphaFold DB , UniProt , Accession A0A087YLR5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 442 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	N	29.8	Very low	44.8	Very low	216 Å²	216	162 Å²	162	100%	1.155	81%	0.813	S	S	*	*				0	135.6	0	-85.1	-8.7	0	0	0	108.8
2	P	46.2	Very low	45.5	Very low	113 Å²	113	162.2 Å²	162.2	73%	0.734	82%	0.816	S	S	*	*				-93.2	147.4	-99.1	4.5	15.2	0	0	0	112.3
3	V	45.2	Very low	46.2	Very low	125 Å²	125	160.3 Å²	160.3	76%	0.758	81%	0.807	S	S	*	*				55.1	106.4	92.8	-173.1	0	0	0	0	113.9
4	E	41	Very low	46.7	Very low	198 Å²	198	151.7 Å²	151.7	93%	0.925	77%	0.773	S	S	*	*			trans	-129.9	146.2	146.7	-106	-178	173.9	0	0	110.6
5	N	44.3	Very low	47.3	Very low	124 Å²	124	154.8 Å²	154.8	66%	0.663	78%	0.783	S	S	*	*			trans	-83.5	148.5	-146.8	-103.4	-49.8	0	0	0	115.6
6	K	51.5	Low	48.1	Very low	179 Å²	179	150.6 Å²	150.6	78%	0.778	76%	0.764	S	S	*	*			trans	22.1	127.9	133	-63	173.2	-179.6	173.8	0	116.1
7	I	44.7	Very low	48.6	Very low	153 Å²	153	149.2 Å²	149.2	79%	0.785	77%	0.767	S	S	*	*				-152.2	129.3	80.2	-81.4	147.2	0	0	0	110.1	M9	I7-M9 PolarHBondContact O-N 3.42Å; I7-M9 VanDerWaalsContact O-N 3.11Å
8	K	52.8	Low	49	Very low	185 Å²	185	149.1 Å²	149.1	80%	0.804	77%	0.768	S	S	*	*			trans	-61.3	104.7	159.5	-82.1	177.8	172.8	176	0	108.3	R10	K8-R10 PolarHBondContact O-N 3.3Å
9	M	41.3	Very low	49.3	Very low	177 Å²	177	150.2 Å²	150.2	87%	0.872	76%	0.762	S	S	*	*			trans	-78.7	101	153.5	-88	-162.5	-90.1	0	0	107.3	I7 S11	I7-M9 PolarHBondContact O-N 3.42Å; I7-M9 VanDerWaalsContact O-N 3.11Å; M9-S11 VanDerWaalsContact C-N 3.34Å; M9-S11 PolarHBondContact O-N 3.37Å; M9-S11 VanDerWaalsContact O-N 3.08Å
10	R	47.5	Very low	49.9	Very low	220 Å²	220	145.7 Å²	145.7	83%	0.83	75%	0.745	S	S	*	*			trans	-66.7	99.4	160.5	-76.2	-179.2	171.1	171.4	-3.4	106.2	K8 I12	K8-R10 PolarHBondContact O-N 3.3Å; R10-I12 PolarHBondContact O-N 3.11Å
11	S	48.1	Very low	50.4	Low	92 Å²	92	146.4 Å²	146.4	64%	0.643	75%	0.75	S	S	*	*			trans	-72.4	111.8	165.3	51.9	0	0	0	0	107.3	M9 I13	M9-S11 VanDerWaalsContact C-N 3.34Å; M9-S11 PolarHBondContact O-N 3.37Å; M9-S11 VanDerWaalsContact O-N 3.08Å; S11-I13 VanDerWaalsContact C-N 3.34Å; S11-I13 PolarHBondContact O-N 2.87Å; S11-I13 VanDerWaalsContact O-N 3.09Å
12	I	53.7	Low	51.9	Low	164 Å²	164	142.3 Å²	142.3	84%	0.841	73%	0.728	S	S	*	*			trans	-70.6	100.6	162.9	-59.7	174.2	0	0	0	104.8	R10	R10-I12 PolarHBondContact O-N 3.11Å
13	I	54.1	Low	52.7	Low	138 Å²	138	144.9 Å²	144.9	71%	0.708	73%	0.734	S	S	*	*			trans	-84.1	115.3	168.3	-57.3	174.5	0	0	0	104.6	S11 E15	S11-I13 VanDerWaalsContact C-N 3.34Å; S11-I13 PolarHBondContact O-N 2.87Å; S11-I13 VanDerWaalsContact O-N 3.09Å; I13-E15 PolarHBondContact O-N 3.02Å
14	A	54.4	Low	53.8	Low	40 Å²	40	145 Å²	145	33%	0.331	74%	0.735	S	S	.	*			trans	-62.1	127.2	172.4	0	0	0	0	0	108.6	D16 W19	A14-D16 PolarHBondContact O-N 3.21Å; A14-D16 VanDerWaalsContact O-N 3.11Å; A14-W19 HydrophobicContact CB-CD2 3.88Å; A14-W19 HydrophobicContact CB-CE3 3.64Å; A14-W19 HydrophobicContact CB-CG 4.42Å; A14-W19 HydrophobicContact CB-CH2 4.49Å; A14-W19 HydrophobicContact CB-CZ3 3.97Å
15	E	55.4	Low	55.3	Low	198 Å²	198	137.6 Å²	137.6	93%	0.925	70%	0.704	S	S	*	*	S	Bend	trans	-75.1	12.1	-176.5	-67.9	-175.6	162.4	0	0	113.9	I13 P17	I13-E15 PolarHBondContact O-N 3.02Å; E15-P17 VanDerWaalsContact O-CD 3.25Å; E15-P17 WeakPolarHBondContact O-CD 3.44Å
16	D	60.3	Low	56.9	Low	88 Å²	88	135.3 Å²	135.3	47%	0.471	70%	0.698	S	S	.	*			trans	-102.6	105.1	-179.9	-171.3	-5.4	0	0	0	110.4	A14 N18 W19	A14-D16 PolarHBondContact O-N 3.21Å; A14-D16 VanDerWaalsContact O-N 3.11Å; D16-N18 PolarHBondContact O-N 3.23Å; D16-N18 VanDerWaalsContact O-N 3.15Å; D16-N18 WeakPolarHBondContact OD1-CB 3.45Å; D16-N18 PolarHBondContact OD1-N 3.26Å; D16-W19 HydrophobicContact CB-CB 4.12Å; D16-W19 WeakPolarHBondContact O-CB 3.38Å; D16-W19 PolarHBondContact O-N 2.86Å
17	P	56.6	Low	58.1	Low	127 Å²	127	133.2 Å²	133.2	83%	0.825	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-8.3	176.5	26.3	-32.4	0	0	0	113.6	E15	E15-P17 VanDerWaalsContact O-CD 3.25Å; E15-P17 WeakPolarHBondContact O-CD 3.44Å
18	N	56	Low	59.5	Low	146 Å²	146	129 Å²	129	78%	0.781	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	5.5	170.1	-60.9	-39.7	0	0	0	112.9	D16 S20	D16-N18 PolarHBondContact O-N 3.23Å; D16-N18 VanDerWaalsContact O-N 3.15Å; D16-N18 WeakPolarHBondContact OD1-CB 3.45Å; D16-N18 PolarHBondContact OD1-N 3.26Å; N18-S20 PolarHBondContact O-N 3.12Å; N18-S20 VanDerWaalsContact O-N 3.1Å
19	W	53.6	Low	60.5	Low	170 Å²	170	121.1 Å²	121.1	64%	0.644	65%	0.647	S	S	*	*			trans	-68	108.3	179.4	-176.6	49.4	0	0	0	110.8	A14 D16	A14-W19 HydrophobicContact CB-CD2 3.88Å; A14-W19 HydrophobicContact CB-CE3 3.64Å; A14-W19 HydrophobicContact CB-CG 4.42Å; A14-W19 HydrophobicContact CB-CH2 4.49Å; A14-W19 HydrophobicContact CB-CZ3 3.97Å; D16-W19 HydrophobicContact CB-CB 4.12Å; D16-W19 WeakPolarHBondContact O-CB 3.38Å; D16-W19 PolarHBondContact O-N 2.86Å
20	S	61.5	Low	62.1	Low	61 Å²	61	116 Å²	116	43%	0.427	62%	0.623	S	S	.	*			trans	-88.5	142	174.4	-177.1	0	0	0	0	111.3	N18 D22	N18-S20 PolarHBondContact O-N 3.12Å; N18-S20 VanDerWaalsContact O-N 3.1Å; S20-D22 PolarHBondContact O-N 2.93Å; S20-D22 VanDerWaalsContact OG-CB 3.23Å; S20-D22 WeakPolarHBondContact OG-CB 3.48Å; S20-D22 PolarHBondContact OG-N 3.03Å; S20-D22 PolarHBondContact OG-OD2 3.2Å
21	L	60.6	Low	63.3	Low	161 Å²	161	108.5 Å²	108.5	84%	0.843	60%	0.603	S	S	*	*			trans	-74.5	-2.5	166.5	-78.1	164.8	0	0	0	112.6	L23	L21-L23 PolarHBondContact O-N 3.3Å
22	D	61.4	Low	64.3	Low	130 Å²	130	105.2 Å²	105.2	70%	0.695	58%	0.577	S	S	*	*	S	Bend	trans	-60.5	124.9	175.4	-66.5	-39.4	0	0	0	109.7	S20 V24	S20-D22 PolarHBondContact O-N 2.93Å; S20-D22 VanDerWaalsContact OG-CB 3.23Å; S20-D22 WeakPolarHBondContact OG-CB 3.48Å; S20-D22 PolarHBondContact OG-N 3.03Å; S20-D22 PolarHBondContact OG-OD2 3.2Å; D22-V24 PolarHBondContact O-N 3.1Å
23	L	62.7	Low	65.2	Low	167 Å²	167	102.8 Å²	102.8	87%	0.874	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-54.7	116.8	172	-84.1	150.3	0	0	0	108.9	L21 P25	L21-L23 PolarHBondContact O-N 3.3Å; L23-P25 WeakPolarHBondContact O-CD 3.47Å; L23-P25 VanDerWaalsContact O-N 3.13Å
24	V	67.8	Low	65.9	Low	126 Å²	126	100 Å²	100	76%	0.764	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-53.2	122.5	172.5	-178.3	0	0	0	0	107.3	D22 S26	D22-V24 PolarHBondContact O-N 3.1Å; V24-S26 PolarHBondContact O-N 3.43Å
25	P	72.4	Confident	66.7	Low	44 Å²	44	100.3 Å²	100.3	29%	0.286	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-55.7	141.7	179.8	-20.7	29.5	0	0	0	109.5	L23 L30	L23-P25 WeakPolarHBondContact O-CD 3.47Å; L23-P25 VanDerWaalsContact O-N 3.13Å; P25-L30 HydrophobicContact CB-CD2 4.09Å; P25-L30 HydrophobicContact CB-CG 4.12Å; P25-L30 HydrophobicContact CG-CD2 4.2Å
26	S	78.5	Confident	67.3	Low	75 Å²	75	91.4 Å²	91.4	52%	0.524	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-55	150.1	176.7	67.3	0	0	0	0	110.6	V24 S28 S29 L30	V24-S26 PolarHBondContact O-N 3.43Å; S26-S28 PolarHBondContact O-N 3.35Å; S26-S28 VanDerWaalsContact O-N 3.1Å; S26-S29 WeakPolarHBondContact O-CA 3.46Å; S26-S29 WeakPolarHBondContact O-CB 3.44Å; S26-S29 PolarHBondContact O-N 3.46Å; S26-S29 PolarHBondContact OG-N 2.96Å; S26-L30 PolarHBondContact O-N 3.1Å
27	L	77.7	Confident	67.6	Low	136 Å²	136	93.8 Å²	93.8	71%	0.712	52%	0.518	S	S	*	.	H	α-helix	trans	-51.5	-37.7	175.7	-178.7	62.8	0	0	0	111.2	S29 L30 C31	L27-S29 PolarHBondContact O-N 3.17Å; L27-L30 PolarHBondContact O-N 3.49Å; L27-C31 WeakPolarHBondContact O-CB 3.09Å; L27-C31 PolarHBondContact O-N 3.24Å; L27-C31 PolarHBondContact O-SG 3.49Å
28	S	73.2	Confident	68	Low	65 Å²	65	92.4 Å²	92.4	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-58.5	-45.7	173.5	-176.3	0	0	0	0	112.8	S26 C31 Q32	S26-S28 PolarHBondContact O-N 3.35Å; S26-S28 VanDerWaalsContact O-N 3.1Å; S28-C31 PolarHBondContact O-N 3.22Å; S28-Q32 WeakPolarHBondContact O-CB 3.27Å; S28-Q32 WeakPolarHBondContact O-CG 3.36Å; S28-Q32 PolarHBondContact O-N 3.1Å; S28-Q32 PolarHBondContact OG-NE2 3.25Å
29	S	73.5	Confident	68.3	Low	19 Å²	19	86.6 Å²	86.6	13%	0.133	48%	0.477	C	S	.	.	H	α-helix	trans	-64.2	-39.7	176.7	-175.9	0	0	0	0	112.4	S26 L27 Q32 R33	S26-S29 WeakPolarHBondContact O-CA 3.46Å; S26-S29 WeakPolarHBondContact O-CB 3.44Å; S26-S29 PolarHBondContact O-N 3.46Å; S26-S29 PolarHBondContact OG-N 2.96Å; L27-S29 PolarHBondContact O-N 3.17Å; S29-Q32 PolarHBondContact O-N 3.26Å; S29-R33 WeakPolarHBondContact O-CG 3.47Å; S29-R33 PolarHBondContact O-N 2.84Å; S29-R33 VanDerWaalsContact O-N 3.09Å
30	L	75.2	Confident	68.5	Low	70 Å²	70	86.6 Å²	86.6	37%	0.366	49%	0.485	S	S	.	.	H	α-helix	trans	-67.6	-44.8	176.2	-66.7	172.7	0	0	0	111.8	P25 S26 L27 Q32 R33 C34	P25-L30 HydrophobicContact CB-CD2 4.09Å; P25-L30 HydrophobicContact CB-CG 4.12Å; P25-L30 HydrophobicContact CG-CD2 4.2Å; S26-L30 PolarHBondContact O-N 3.1Å; L27-L30 PolarHBondContact O-N 3.49Å; L30-Q32 VanDerWaalsContact C-N 3.32Å; L30-Q32 PolarHBondContact O-N 3.01Å; L30-R33 WeakPolarHBondContact O-CB 3.46Å; L30-R33 PolarHBondContact O-N 2.75Å; L30-R33 VanDerWaalsContact O-N 3.17Å; L30-C34 PolarHBondContact O-N 2.94Å
31	C	72.4	Confident	68.4	Low	61 Å²	61	89.8 Å²	89.8	41%	0.412	49%	0.493	S	S	.	.	H	α-helix	trans	-60.8	-41.1	174.8	-69.1	0	0	0	0	111.6	L27 S28 R33 C34 I35	L27-C31 WeakPolarHBondContact O-CB 3.09Å; L27-C31 PolarHBondContact O-N 3.24Å; L27-C31 PolarHBondContact O-SG 3.49Å; S28-C31 PolarHBondContact O-N 3.22Å; C31-R33 VanDerWaalsContact C-N 3.32Å; C31-R33 PolarHBondContact O-N 3.29Å; C31-C34 PolarHBondContact O-N 3.29Å; C31-I35 WeakPolarHBondContact O-CB 3.38Å; C31-I35 WeakPolarHBondContact O-CD1 3.16Å; C31-I35 WeakPolarHBondContact O-CG1 3.47Å; C31-I35 PolarHBondContact O-N 3.06Å
32	Q	70.3	Confident	68.2	Low	23 Å²	23	86.7 Å²	86.7	11%	0.107	47%	0.472	C	S	.	.	H	α-helix	trans	-61.7	-38.3	175.1	-73.4	167	19.6	0	0	112.6	S28 S29 L30 A36 L52 S55 I56	S28-Q32 WeakPolarHBondContact O-CB 3.27Å; S28-Q32 WeakPolarHBondContact O-CG 3.36Å; S28-Q32 PolarHBondContact O-N 3.1Å; S28-Q32 PolarHBondContact OG-NE2 3.25Å; S29-Q32 PolarHBondContact O-N 3.26Å; L30-Q32 VanDerWaalsContact C-N 3.32Å; L30-Q32 PolarHBondContact O-N 3.01Å; Q32-A36 WeakPolarHBondContact O-CB 3.31Å; Q32-A36 PolarHBondContact O-N 2.91Å; Q32-L52 HydrophobicContact CG-CD2 4.34Å; Q32-S55 PolarHBondContact OE1-OG 2.68Å; Q32-I56 HydrophobicContact CB-CG1 4.38Å; Q32-I56 HydrophobicContact CG-CG1 4.36Å
33	R	71	Confident	67.8	Low	113 Å²	113	89.4 Å²	89.4	43%	0.426	47%	0.474	S	S	.	.	H	α-helix	trans	-64.7	-52.4	174.6	-73.3	177	-173.5	-179.5	-0.4	111	S29 L30 C31 I35 A36 D37	S29-R33 WeakPolarHBondContact O-CG 3.47Å; S29-R33 PolarHBondContact O-N 2.84Å; S29-R33 VanDerWaalsContact O-N 3.09Å; L30-R33 WeakPolarHBondContact O-CB 3.46Å; L30-R33 PolarHBondContact O-N 2.75Å; L30-R33 VanDerWaalsContact O-N 3.17Å; C31-R33 VanDerWaalsContact C-N 3.32Å; C31-R33 PolarHBondContact O-N 3.29Å; R33-I35 VanDerWaalsContact C-N 3.27Å; R33-I35 PolarHBondContact O-N 2.83Å; R33-A36 WeakPolarHBondContact O-CB 3.47Å; R33-A36 PolarHBondContact O-N 2.88Å; R33-A36 VanDerWaalsContact O-N 3.07Å; R33-D37 VanDerWaalsContact O-CG 3.23Å; R33-D37 PolarHBondContact O-N 3Å
34	C	70.4	Confident	67.7	Low	79 Å²	79	85.3 Å²	85.3	53%	0.534	45%	0.453	S	S	.	.	H	α-helix	trans	-56.8	-42.1	176.8	-73.7	0	0	0	0	112	L30 C31 D37 T38	L30-C34 PolarHBondContact O-N 2.94Å; C31-C34 PolarHBondContact O-N 3.29Å; C34-D37 PolarHBondContact O-N 3.28Å; C34-T38 WeakPolarHBondContact O-CB 2.99Å; C34-T38 PolarHBondContact O-N 2.99Å; C34-T38 PolarHBondContact O-OG1 2.64Å
35	I	71.3	Confident	67.6	Low	48 Å²	48	79.7 Å²	79.7	25%	0.246	42%	0.418	C	S	.	.	H	α-helix	trans	-62.2	-46.5	176.9	-68.5	163.5	0	0	0	110.4	C31 R33 D37 T38 V39 I56	C31-I35 WeakPolarHBondContact O-CB 3.38Å; C31-I35 WeakPolarHBondContact O-CD1 3.16Å; C31-I35 WeakPolarHBondContact O-CG1 3.47Å; C31-I35 PolarHBondContact O-N 3.06Å; R33-I35 VanDerWaalsContact C-N 3.27Å; R33-I35 PolarHBondContact O-N 2.83Å; I35-D37 PolarHBondContact O-N 2.99Å; I35-T38 CarbonylContact O-C 3.52Å; I35-T38 PolarHBondContact O-N 3.23Å; I35-T38 VanDerWaalsContact O-N 3.13Å; I35-V39 WeakPolarHBondContact O-CG2 3.32Å; I35-V39 PolarHBondContact O-N 3.01Å; I35-I56 HydrophobicContact CG2-CD1 3.96Å
36	A	66.1	Low	67.3	Low	11 Å²	11	84.4 Å²	84.4	9%	0.091	44%	0.436	C	S	.	.	H	α-helix	trans	-60.1	-32.3	177.1	0	0	0	0	0	112.9	Q32 R33 I56 R59 L60	Q32-A36 WeakPolarHBondContact O-CB 3.31Å; Q32-A36 PolarHBondContact O-N 2.91Å; R33-A36 WeakPolarHBondContact O-CB 3.47Å; R33-A36 PolarHBondContact O-N 2.88Å; R33-A36 VanDerWaalsContact O-N 3.07Å; A36-I56 HydrophobicContact CB-CG2 4.19Å; A36-R59 HydrophobicContact CB-CB 4.23Å; A36-L60 HydrophobicContact CB-CD2 4.25Å
37	D	67.3	Low	67.1	Low	138 Å²	138	89.9 Å²	89.9	74%	0.738	45%	0.451	S	S	*	.	H	α-helix	trans	-82.8	-16.4	179.3	-62.2	-26	0	0	0	113	R33 C34 I35	R33-D37 VanDerWaalsContact O-CG 3.23Å; R33-D37 PolarHBondContact O-N 3Å; C34-D37 PolarHBondContact O-N 3.28Å; I35-D37 PolarHBondContact O-N 2.99Å
38	T	66	Low	66.9	Low	98 Å²	98	85 Å²	85	60%	0.601	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	21.4	-174.7	-33.9	0	0	0	0	112.7	C34 I35 E40	C34-T38 WeakPolarHBondContact O-CB 2.99Å; C34-T38 PolarHBondContact O-N 2.99Å; C34-T38 PolarHBondContact O-OG1 2.64Å; I35-T38 CarbonylContact O-C 3.52Å; I35-T38 PolarHBondContact O-N 3.23Å; I35-T38 VanDerWaalsContact O-N 3.13Å; T38-E40 VanDerWaalsContact C-N 3.26Å; T38-E40 PolarHBondContact O-N 3.36Å
39	V	61.1	Low	67.3	Low	24 Å²	24	85.1 Å²	85.1	15%	0.145	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	79.5	-175.3	-176.4	0	0	0	0	111.6	I35 F45 L60 L72	I35-V39 WeakPolarHBondContact O-CG2 3.32Å; I35-V39 PolarHBondContact O-N 3.01Å; V39-F45 HydrophobicContact CG1-CE2 3.9Å; V39-F45 HydrophobicContact CG2-CE2 4.09Å; V39-L60 HydrophobicContact CB-CD2 4.47Å; V39-L60 HydrophobicContact CG2-CD2 3.77Å; V39-L72 HydrophobicContact CG1-CD1 4.16Å
40	E	58.4	Low	67.6	Low	170 Å²	170	88.1 Å²	88.1	79%	0.794	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.2	-14	169	-66.3	-173.1	169	0	0	111.7	T38	T38-E40 VanDerWaalsContact C-N 3.26Å; T38-E40 PolarHBondContact O-N 3.36Å
41	E	59.1	Low	67.9	Low	128 Å²	128	91 Å²	91	60%	0.598	45%	0.454	S	S	*	.			trans	-111.8	115.8	-174.2	-65.6	-170.9	178.5	0	0	114.5	Y43 L44	E41-Y43 VanDerWaalsContact C-N 3.31Å; E41-Y43 PolarHBondContact O-N 3.32Å; E41-L44 HydrophobicContact CB-CD1 4.32Å
42	K	55.8	Low	68.2	Low	96 Å²	96	90.6 Å²	90.6	42%	0.417	45%	0.447	S	S	.	.	H	α-helix	trans	-58.5	-35.3	-179.8	-163.5	168.4	179.9	169.4	0	114.2	L44 F45 D71 L72	K42-L44 VanDerWaalsContact C-N 3.27Å; K42-L44 PolarHBondContact O-N 3.43Å; K42-F45 PolarHBondContact O-N 2.99Å; K42-D71 VanDerWaalsContact CE-O 3.31Å; K42-D71 WeakPolarHBondContact CE-O 3.35Å; K42-L72 HydrophobicContact CB-CD2 3.42Å; K42-L72 VanDerWaalsContact CB-CD2 3.42Å; K42-L72 HydrophobicContact CD-CD2 4.44Å; K42-L72 HydrophobicContact CG-CD2 3.88Å
43	Y	53.3	Low	68.7	Low	187 Å²	187	91.9 Å²	91.9	73%	0.733	45%	0.453	S	S	*	.	H	α-helix	trans	-72.7	-16.6	-170.1	-65.1	-77.1	0	0	0	114.4	E41	E41-Y43 VanDerWaalsContact C-N 3.31Å; E41-Y43 PolarHBondContact O-N 3.32Å
44	L	61.8	Low	69.3	Low	81 Å²	81	90 Å²	90	42%	0.424	45%	0.451	S	S	.	.	H	α-helix	trans	-74.1	-38.7	178.4	-99.6	145.6	0	0	0	111.8	E41 K42 E46 L48	E41-L44 HydrophobicContact CB-CD1 4.32Å; K42-L44 VanDerWaalsContact C-N 3.27Å; K42-L44 PolarHBondContact O-N 3.43Å; L44-E46 PolarHBondContact O-N 3.06Å; L44-L48 WeakPolarHBondContact O-CG 3.41Å
45	F	65	Low	69.9	Low	8 Å²	8	87.6 Å²	87.6	4%	0.035	44%	0.435	C	S	.	.	H	α-helix	trans	-67.8	-39.8	-173.8	-99.6	-86.6	0	0	0	113.2	V39 K42 K47 L48 K53 I56 Q57 L60	V39-F45 HydrophobicContact CG1-CE2 3.9Å; V39-F45 HydrophobicContact CG2-CE2 4.09Å; K42-F45 PolarHBondContact O-N 2.99Å; F45-K47 VanDerWaalsContact C-N 3.29Å; F45-K47 PolarHBondContact O-N 2.89Å; F45-L48 PolarHBondContact O-N 3.24Å; F45-K53 HydrophobicContact CD1-CG 4.35Å; F45-K53 WeakPolarHBondContact O-CE 3.3Å; F45-K53 PolarHBondContact O-NZ 3.34Å; F45-I56 HydrophobicContact CE1-CB 4.44Å; F45-I56 HydrophobicContact CE1-CG2 4.15Å; F45-I56 HydrophobicContact CE2-CG2 4.34Å; F45-I56 HydrophobicContact CZ-CB 4.27Å; F45-I56 HydrophobicContact CZ-CG2 3.5Å; F45-Q57 HydrophobicContact CE1-CG 4.39Å; F45-L60 HydrophobicContact CZ-CD1 4.39Å
46	E	66.4	Low	70.4	Confident	143 Å²	143	85.3 Å²	85.3	67%	0.668	42%	0.423	S	S	*	.	H	α-helix	trans	-63.1	-35.1	-175	-69.6	-174.6	169	0	0	113.1	L44 L48 K53	L44-E46 PolarHBondContact O-N 3.06Å; E46-L48 VanDerWaalsContact C-N 3.33Å; E46-L48 PolarHBondContact O-N 3.12Å; E46-K53 PolarHBondContact O-NZ 3.11Å; E46-K53 VanDerWaalsContact O-NZ 3.11Å
47	K	72.9	Confident	71.4	Confident	190 Å²	190	85 Å²	85	83%	0.826	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-8.6	-176.8	-65.2	-177.3	179.5	177.6	0	114.6	F45	F45-K47 VanDerWaalsContact C-N 3.29Å; F45-K47 PolarHBondContact O-N 2.89Å
48	L	75.1	Confident	72.3	Confident	33 Å²	33	81 Å²	81	17%	0.173	40%	0.403	C	S	.	.	S	Bend	trans	-81.9	149.3	-177.8	-66.1	170.7	0	0	0	112.3	L44 F45 E46 L52 K53 I56	L44-L48 WeakPolarHBondContact O-CG 3.41Å; F45-L48 PolarHBondContact O-N 3.24Å; E46-L48 VanDerWaalsContact C-N 3.33Å; E46-L48 PolarHBondContact O-N 3.12Å; L48-L52 HydrophobicContact CB-CB 4.37Å; L48-L52 HydrophobicContact CD2-CD1 4.29Å; L48-K53 HydrophobicContact CB-CG 3.84Å; L48-K53 WeakPolarHBondContact O-CE 3.42Å; L48-K53 PolarHBondContact O-NZ 3.39Å; L48-I56 HydrophobicContact CD1-CD1 3.52Å
49	T	81.2	Confident	73.2	Confident	67 Å²	67	81.5 Å²	81.5	41%	0.411	39%	0.394	S	S	.	.			trans	-66.5	155.1	171.9	75.4	0	0	0	0	110.7	E51 L52 K53	T49-E51 VanDerWaalsContact C-N 3.26Å; T49-E51 VanDerWaalsContact CB-OE2 3.28Å; T49-E51 WeakPolarHBondContact CB-OE2 3.42Å; T49-E51 PolarHBondContact O-N 2.96Å; T49-E51 PolarHBondContact OG1-OE2 3.23Å; T49-L52 HydrophobicContact CG2-CD1 4.47Å; T49-L52 PolarHBondContact O-N 3.5Å; T49-L52 WeakPolarHBondContact OG1-CG 3.46Å; T49-K53 WeakPolarHBondContact O-CG 3.27Å; T49-K53 PolarHBondContact O-N 2.66Å
50	P	80.3	Confident	74.4	Confident	83 Å²	83	80.4 Å²	80.4	54%	0.539	39%	0.387	S	S	.	.	H	α-helix	trans	-53.1	-40.7	178.5	-27	36.2	0	0	0	113.6	L52 K53 D54	P50-L52 PolarHBondContact O-N 3.25Å; P50-K53 WeakPolarHBondContact O-CB 3.48Å; P50-K53 PolarHBondContact O-N 2.97Å; P50-D54 PolarHBondContact O-N 3.41Å
51	E	80.7	Confident	75.7	Confident	131 Å²	131	75.1 Å²	75.1	61%	0.612	37%	0.369	S	S	*	.	H	α-helix	trans	-67.3	-37.8	-178.3	-53.5	74.9	-160.3	0	0	111.9	T49 S55	T49-E51 VanDerWaalsContact C-N 3.26Å; T49-E51 VanDerWaalsContact CB-OE2 3.28Å; T49-E51 WeakPolarHBondContact CB-OE2 3.42Å; T49-E51 PolarHBondContact O-N 2.96Å; T49-E51 PolarHBondContact OG1-OE2 3.23Å; E51-S55 WeakPolarHBondContact O-CB 3.4Å; E51-S55 PolarHBondContact O-N 3.38Å
52	L	78.8	Confident	77.1	Confident	52 Å²	52	71.4 Å²	71.4	27%	0.272	35%	0.353	S	S	.	.	H	α-helix	trans	-70.7	-40	176	-69.5	173.6	0	0	0	111.2	Q32 L48 T49 P50 D54 S55 I56	Q32-L52 HydrophobicContact CG-CD2 4.34Å; L48-L52 HydrophobicContact CB-CB 4.37Å; L48-L52 HydrophobicContact CD2-CD1 4.29Å; T49-L52 HydrophobicContact CG2-CD1 4.47Å; T49-L52 PolarHBondContact O-N 3.5Å; T49-L52 WeakPolarHBondContact OG1-CG 3.46Å; P50-L52 PolarHBondContact O-N 3.25Å; L52-D54 VanDerWaalsContact C-N 3.33Å; L52-D54 PolarHBondContact O-N 3.38Å; L52-S55 PolarHBondContact O-N 3.4Å; L52-I56 WeakPolarHBondContact O-CD1 3.35Å; L52-I56 VanDerWaalsContact O-CG1 3.27Å; L52-I56 WeakPolarHBondContact O-CG1 3.24Å; L52-I56 PolarHBondContact O-N 2.93Å
53	K	81.1	Confident	78.5	Confident	50 Å²	50	71.7 Å²	71.7	22%	0.217	37%	0.367	C	S	.	.	H	α-helix	trans	-58	-47	174.1	-74.1	169.2	170.1	154.7	0	110.7	F45 E46 L48 T49 P50 I56 Q57	F45-K53 HydrophobicContact CD1-CG 4.35Å; F45-K53 WeakPolarHBondContact O-CE 3.3Å; F45-K53 PolarHBondContact O-NZ 3.34Å; E46-K53 PolarHBondContact O-NZ 3.11Å; E46-K53 VanDerWaalsContact O-NZ 3.11Å; L48-K53 HydrophobicContact CB-CG 3.84Å; L48-K53 WeakPolarHBondContact O-CE 3.42Å; L48-K53 PolarHBondContact O-NZ 3.39Å; T49-K53 WeakPolarHBondContact O-CG 3.27Å; T49-K53 PolarHBondContact O-N 2.66Å; P50-K53 WeakPolarHBondContact O-CB 3.48Å; P50-K53 PolarHBondContact O-N 2.97Å; K53-I56 PolarHBondContact O-N 2.86Å; K53-Q57 WeakPolarHBondContact O-CB 3.43Å; K53-Q57 VanDerWaalsContact O-CG 3.26Å; K53-Q57 WeakPolarHBondContact O-CG 3.32Å; K53-Q57 PolarHBondContact O-N 3.35Å
54	D	83.4	Confident	80.1	Confident	73 Å²	73	65.7 Å²	65.7	39%	0.39	35%	0.347	S	S	.	.	H	α-helix	trans	-65.5	-43.4	178.9	-79.9	-10.4	0	0	0	112.1	P50 L52 I56 Q57 S58 L77	P50-D54 PolarHBondContact O-N 3.41Å; L52-D54 VanDerWaalsContact C-N 3.33Å; L52-D54 PolarHBondContact O-N 3.38Å; D54-I56 PolarHBondContact O-N 3.22Å; D54-Q57 PolarHBondContact O-N 3.43Å; D54-S58 WeakPolarHBondContact O-CB 3.31Å; D54-S58 PolarHBondContact O-N 3.09Å; D54-L77 HydrophobicContact CB-CD1 3.63Å
55	S	82.4	Confident	81.3	Confident	28 Å²	28	64.8 Å²	64.8	20%	0.196	35%	0.346	C	S	.	.	H	α-helix	trans	-59.8	-44.5	175.9	-173.8	0	0	0	0	111.7	Q32 E51 L52 S58 R59	Q32-S55 PolarHBondContact OE1-OG 2.68Å; E51-S55 WeakPolarHBondContact O-CB 3.4Å; E51-S55 PolarHBondContact O-N 3.38Å; L52-S55 PolarHBondContact O-N 3.4Å; S55-S58 PolarHBondContact O-N 3.38Å; S55-S58 PolarHBondContact O-OG 3.21Å; S55-R59 WeakPolarHBondContact O-CG 3.38Å
56	I	82.9	Confident	82.5	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-67.2	-47.6	178.2	-64.7	162.5	0	0	0	110.4	Q32 I35 A36 F45 L48 L52 K53 D54 S58 R59 L60	Q32-I56 HydrophobicContact CB-CG1 4.38Å; Q32-I56 HydrophobicContact CG-CG1 4.36Å; I35-I56 HydrophobicContact CG2-CD1 3.96Å; A36-I56 HydrophobicContact CB-CG2 4.19Å; F45-I56 HydrophobicContact CE1-CB 4.44Å; F45-I56 HydrophobicContact CE1-CG2 4.15Å; F45-I56 HydrophobicContact CE2-CG2 4.34Å; F45-I56 HydrophobicContact CZ-CB 4.27Å; F45-I56 HydrophobicContact CZ-CG2 3.5Å; L48-I56 HydrophobicContact CD1-CD1 3.52Å; L52-I56 WeakPolarHBondContact O-CD1 3.35Å; L52-I56 VanDerWaalsContact O-CG1 3.27Å; L52-I56 WeakPolarHBondContact O-CG1 3.24Å; L52-I56 PolarHBondContact O-N 2.93Å; K53-I56 PolarHBondContact O-N 2.86Å; D54-I56 PolarHBondContact O-N 3.22Å; I56-S58 PolarHBondContact O-N 3.01Å; I56-R59 WeakPolarHBondContact O-CA 3.45Å; I56-R59 PolarHBondContact O-N 3.48Å; I56-L60 HydrophobicContact CG2-CG 4.44Å; I56-L60 PolarHBondContact O-N 3.5Å
57	Q	86.6	Confident	83.4	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.019	35%	0.35	C	S	.	.	H	α-helix	trans	-59.1	-31.7	177.9	-77.2	-173.5	60.8	0	0	113.2	F45 K53 D54 R59 V73 G76 L77 F78 R81	F45-Q57 HydrophobicContact CE1-CG 4.39Å; K53-Q57 WeakPolarHBondContact O-CB 3.43Å; K53-Q57 VanDerWaalsContact O-CG 3.26Å; K53-Q57 WeakPolarHBondContact O-CG 3.32Å; K53-Q57 PolarHBondContact O-N 3.35Å; D54-Q57 PolarHBondContact O-N 3.43Å; Q57-R59 PolarHBondContact O-N 3.32Å; Q57-V73 HydrophobicContact CG-CG1 4.26Å; Q57-G76 VanDerWaalsContact OE1-C 3.31Å; Q57-L77 HydrophobicContact CB-CB 4.1Å; Q57-F78 HydrophobicContact CB-CB 4.04Å; Q57-F78 HydrophobicContact CG-CB 4.08Å; Q57-F78 VanDerWaalsContact OE1-N 3.09Å; Q57-R81 PolarHBondContact O-NH1 3.08Å
58	S	86.3	Confident	83.9	Confident	55 Å²	55	58.4 Å²	58.4	39%	0.385	32%	0.323	S	S	.	.	H	α-helix	trans	-68.6	-20.3	174.8	79.4	0	0	0	0	113.6	D54 S55 I56 R81	D54-S58 WeakPolarHBondContact O-CB 3.31Å; D54-S58 PolarHBondContact O-N 3.09Å; S55-S58 PolarHBondContact O-N 3.38Å; S55-S58 PolarHBondContact O-OG 3.21Å; I56-S58 PolarHBondContact O-N 3.01Å; S58-R81 VanDerWaalsContact C-NH1 3.3Å; S58-R81 PolarHBondContact O-NH1 3.22Å
59	R	84.3	Confident	84.6	Confident	107 Å²	107	57 Å²	57	40%	0.404	32%	0.316	S	S	.	.	H	α-helix	trans	-101.9	-24.3	-177	-65.3	174.5	-171.5	-76	-2.6	113.7	A36 S55 I56 Q57 S61	A36-R59 HydrophobicContact CB-CB 4.23Å; S55-R59 WeakPolarHBondContact O-CG 3.38Å; I56-R59 WeakPolarHBondContact O-CA 3.45Å; I56-R59 PolarHBondContact O-N 3.48Å; Q57-R59 PolarHBondContact O-N 3.32Å; R59-S61 PolarHBondContact O-N 3.08Å
60	L	85.8	Confident	85	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	30%	0.296	C	S	.	.	S	Bend	trans	-52.7	137.5	177.2	-71	177.2	0	0	0	111.5	A36 V39 F45 I56 L64 V73 F78 R81	A36-L60 HydrophobicContact CB-CD2 4.25Å; V39-L60 HydrophobicContact CB-CD2 4.47Å; V39-L60 HydrophobicContact CG2-CD2 3.77Å; F45-L60 HydrophobicContact CZ-CD1 4.39Å; I56-L60 HydrophobicContact CG2-CG 4.44Å; I56-L60 PolarHBondContact O-N 3.5Å; L60-L64 HydrophobicContact CB-CD1 4.33Å; L60-L64 HydrophobicContact CD2-CD1 4.11Å; L60-V73 HydrophobicContact CD1-CG1 4.31Å; L60-V73 HydrophobicContact CD1-CG2 3.89Å; L60-F78 HydrophobicContact CB-CD2 3.65Å; L60-F78 HydrophobicContact CB-CE2 3.93Å; L60-F78 HydrophobicContact CD1-CD2 4.05Å; L60-F78 HydrophobicContact CD1-CG 4.35Å; L60-R81 PolarHBondContact O-NH1 2.65Å; L60-R81 PolarHBondContact O-NH2 3.11Å
61	S	85.9	Confident	85.2	Confident	58 Å²	58	54.3 Å²	54.3	41%	0.406	29%	0.294	S	S	.	.			trans	-70.9	135.9	176.3	-177.4	0	0	0	0	110.8	R59 S63 L64 F78	R59-S61 PolarHBondContact O-N 3.08Å; S61-S63 PolarHBondContact O-N 2.85Å; S61-S63 PolarHBondContact OG-N 2.86Å; S61-S63 PolarHBondContact OG-OG 3.19Å; S61-L64 WeakPolarHBondContact O-CD1 3.38Å; S61-L64 WeakPolarHBondContact O-CG 3.4Å; S61-L64 PolarHBondContact O-N 2.85Å; S61-F78 WeakPolarHBondContact O-CE2 3.35Å
62	L	88.5	Confident	85.4	Confident	51 Å²	51	49.2 Å²	49.2	27%	0.267	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-9	175.7	-52.3	179.1	0	0	0	112.6	L64 F78 R81 Q85	L62-L64 VanDerWaalsContact C-N 3.31Å; L62-F78 HydrophobicContact CD2-CD2 4.26Å; L62-F78 HydrophobicContact CD2-CE2 4.09Å; L62-R81 HydrophobicContact CD1-CB 4.19Å; L62-R81 HydrophobicContact CD2-CB 3.66Å; L62-Q85 VanDerWaalsContact CB-OE1 3.26Å; L62-Q85 HydrophobicContact CD1-CB 4.28Å
63	S	86.2	Confident	85.8	Confident	102 Å²	102	46.9 Å²	46.9	71%	0.713	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-1.3	175.5	68.9	0	0	0	0	113.6	S61	S61-S63 PolarHBondContact O-N 2.85Å; S61-S63 PolarHBondContact OG-N 2.86Å; S61-S63 PolarHBondContact OG-OG 3.19Å
64	L	85.7	Confident	86.2	Confident	61 Å²	61	47 Å²	47	32%	0.319	26%	0.264	S	S	.	.	S	Bend	trans	-63	139.2	178.8	-72.6	171.2	0	0	0	110.7	L60 S61 L62 T69	L60-L64 HydrophobicContact CB-CD1 4.33Å; L60-L64 HydrophobicContact CD2-CD1 4.11Å; S61-L64 WeakPolarHBondContact O-CD1 3.38Å; S61-L64 WeakPolarHBondContact O-CG 3.4Å; S61-L64 PolarHBondContact O-N 2.85Å; L62-L64 VanDerWaalsContact C-N 3.31Å; L64-T69 HydrophobicContact CB-CG2 3.56Å; L64-T69 HydrophobicContact CD1-CG2 4.12Å; L64-T69 HydrophobicContact CG-CG2 4.49Å
65	P	87.4	Confident	86.6	Confident	61 Å²	61	46.6 Å²	46.6	40%	0.396	26%	0.262	S	S	.	.			trans	-60.6	145.6	179.2	-23.1	33.2	0	0	0	113.2	H67 V68 T69	P65-H67 VanDerWaalsContact C-N 3.35Å; P65-H67 WeakPolarHBondContact CB-CE1 3.5Å; P65-H67 WeakPolarHBondContact CB-ND1 3.49Å; P65-H67 PolarHBondContact O-N 3.42Å; P65-V68 HydrophobicContact CB-CG2 4.26Å; P65-V68 HydrophobicContact CG-CG2 4.47Å; P65-V68 PolarHBondContact O-N 3.37Å; P65-T69 PolarHBondContact O-N 3.25Å; P65-T69 VanDerWaalsContact O-N 3.07Å; P65-T69 PolarHBondContact O-OG1 3.24Å; P65-T69 VanDerWaalsContact O-OG1 3.06Å
66	L	89.9	Confident	87	Confident	37 Å²	37	46 Å²	46	19%	0.194	26%	0.261	C	S	.	.	H	α-helix	trans	-65.5	-35.2	179.3	-72.5	178.5	0	0	0	112.9	V68 T69 A70 W79 F103 L131	L66-V68 PolarHBondContact O-N 3.02Å; L66-T69 WeakPolarHBondContact CA-OG1 3.39Å; L66-T69 PolarHBondContact O-N 3.25Å; L66-A70 WeakPolarHBondContact O-CB 3.24Å; L66-A70 PolarHBondContact O-N 3.34Å; L66-W79 HydrophobicContact CD2-CH2 4.05Å; L66-W79 HydrophobicContact CD2-CZ3 4.01Å; L66-F103 HydrophobicContact CD1-CE1 4.02Å; L66-F103 HydrophobicContact CD1-CZ 4.33Å; L66-F103 HydrophobicContact CD2-CE1 3.57Å; L66-F103 HydrophobicContact CD2-CZ 3.81Å; L66-F103 HydrophobicContact CG-CE1 4.47Å; L66-L131 HydrophobicContact CB-CD1 3.95Å
67	H	86.8	Confident	87.5	Confident	128 Å²	128	48.8 Å²	48.8	59%	0.593	28%	0.276	S	S	*	.	H	α-helix	trans	-63.8	-22.1	177.3	66.5	-95.1	0	0	0	113.2	P65 L131	P65-H67 VanDerWaalsContact C-N 3.35Å; P65-H67 WeakPolarHBondContact CB-CE1 3.5Å; P65-H67 WeakPolarHBondContact CB-ND1 3.49Å; P65-H67 PolarHBondContact O-N 3.42Å; H67-L131 HydrophobicContact CB-CD1 4.49Å; H67-L131 HydrophobicContact CB-CD2 4.23Å
68	V	83.6	Confident	87.8	Confident	43 Å²	43	48.7 Å²	48.7	26%	0.261	28%	0.275	S	S	.	.	H	α-helix	trans	-85.6	-50.8	173.1	179.3	0	0	0	0	109.9	P65 L66 L72	P65-V68 HydrophobicContact CB-CG2 4.26Å; P65-V68 HydrophobicContact CG-CG2 4.47Å; P65-V68 PolarHBondContact O-N 3.37Å; L66-V68 PolarHBondContact O-N 3.02Å; V68-L72 HydrophobicContact CG1-CD1 3.63Å; V68-L72 WeakPolarHBondContact O-CB 3.24Å; V68-L72 WeakPolarHBondContact O-CD1 3.26Å; V68-L72 WeakPolarHBondContact O-CG 3.45Å
69	T	88.9	Confident	88.3	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.018	26%	0.257	C	S	.	.	H	α-helix	trans	-76.9	-28.4	-170.3	52.4	0	0	0	0	113.9	L64 P65 L66 D71 V73 F78	L64-T69 HydrophobicContact CB-CG2 3.56Å; L64-T69 HydrophobicContact CD1-CG2 4.12Å; L64-T69 HydrophobicContact CG-CG2 4.49Å; P65-T69 PolarHBondContact O-N 3.25Å; P65-T69 VanDerWaalsContact O-N 3.07Å; P65-T69 PolarHBondContact O-OG1 3.24Å; P65-T69 VanDerWaalsContact O-OG1 3.06Å; L66-T69 WeakPolarHBondContact CA-OG1 3.39Å; L66-T69 PolarHBondContact O-N 3.25Å; T69-D71 VanDerWaalsContact C-N 3.34Å; T69-D71 PolarHBondContact O-N 3.15Å; T69-V73 HydrophobicContact CG2-CG2 4.2Å; T69-V73 WeakPolarHBondContact O-CB 3.42Å; T69-V73 PolarHBondContact O-N 3.12Å; T69-F78 HydrophobicContact CG2-CE1 3.98Å; T69-F78 HydrophobicContact CG2-CZ 3.75Å
70	A	88.8	Confident	88.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.1	-42.3	-177.5	0	0	0	0	0	112.7	L66 K100 F104 L131	L66-A70 WeakPolarHBondContact O-CB 3.24Å; L66-A70 PolarHBondContact O-N 3.34Å; A70-K100 WeakPolarHBondContact O-CE 3.17Å; A70-K100 PolarHBondContact O-NZ 3.01Å; A70-F104 HydrophobicContact CB-CE1 4.36Å; A70-F104 HydrophobicContact CB-CZ 3.63Å; A70-L131 HydrophobicContact CB-CB 4.04Å; A70-L131 HydrophobicContact CB-CD2 4.17Å
71	D	85.9	Confident	89.3	Confident	94 Å²	94	47.9 Å²	47.9	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-93.9	-28.1	-178.5	-77.8	-30.6	0	0	0	113.9	K42 T69	K42-D71 VanDerWaalsContact CE-O 3.31Å; K42-D71 WeakPolarHBondContact CE-O 3.35Å; T69-D71 VanDerWaalsContact C-N 3.34Å; T69-D71 PolarHBondContact O-N 3.15Å
72	L	84.6	Confident	89.8	Confident	24 Å²	24	45.5 Å²	45.5	13%	0.126	25%	0.249	C	C	.	.	H	α-helix	trans	-86.8	-39.9	-173.9	-62.7	178.5	0	0	0	112.8	V39 K42 V68 P74	V39-L72 HydrophobicContact CG1-CD1 4.16Å; K42-L72 HydrophobicContact CB-CD2 3.42Å; K42-L72 VanDerWaalsContact CB-CD2 3.42Å; K42-L72 HydrophobicContact CD-CD2 4.44Å; K42-L72 HydrophobicContact CG-CD2 3.88Å; V68-L72 HydrophobicContact CG1-CD1 3.63Å; V68-L72 WeakPolarHBondContact O-CB 3.24Å; V68-L72 WeakPolarHBondContact O-CD1 3.26Å; V68-L72 WeakPolarHBondContact O-CG 3.45Å; L72-P74 WeakPolarHBondContact O-CD 3.47Å
73	V	87.2	Confident	90.1	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.012	24%	0.236	C	C	.	.	S	Bend	trans	-95.1	117	-170.5	-172.8	0	0	0	0	109.9	Q57 L60 T69 F78 W79 K100	Q57-V73 HydrophobicContact CG-CG1 4.26Å; L60-V73 HydrophobicContact CD1-CG1 4.31Å; L60-V73 HydrophobicContact CD1-CG2 3.89Å; T69-V73 HydrophobicContact CG2-CG2 4.2Å; T69-V73 WeakPolarHBondContact O-CB 3.42Å; T69-V73 PolarHBondContact O-N 3.12Å; V73-F78 HydrophobicContact CB-CD1 4.2Å; V73-F78 HydrophobicContact CG1-CB 3.72Å; V73-F78 HydrophobicContact CG1-CD1 3.67Å; V73-F78 HydrophobicContact CG1-CG 3.86Å; V73-F78 HydrophobicContact CG2-CD1 4.45Å; V73-W79 PolarHBondContact O-NE1 3.19Å; V73-K100 PolarHBondContact O-NZ 3.32Å
74	P	89.1	Confident	90.6	Very high	52 Å²	52	43.4 Å²	43.4	34%	0.338	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-67	172.2	176.9	30	-35.5	0	0	0	111.4	L72 W79	L72-P74 WeakPolarHBondContact O-CD 3.47Å; P74-W79 PolarHBondContact O-NE1 3.2Å
75	D	91.2	Very high	91.1	Very high	65 Å²	65	46.6 Å²	46.6	35%	0.348	24%	0.239	S	C	.	.	S	Bend	trans	-56.4	143.3	169	-167.2	80.3	0	0	0	110.9	S98 W99 K100	D75-S98 WeakPolarHBondContact OD1-CA 3.29Å; D75-S98 WeakPolarHBondContact OD1-CB 3.28Å; D75-S98 PolarHBondContact OD1-OG 2.98Å; D75-W99 PolarHBondContact OD1-N 3.06Å; D75-K100 HydrophobicContact CB-CB 4.19Å; D75-K100 WeakPolarHBondContact OD1-CB 3.39Å; D75-K100 PolarHBondContact OD1-N 2.79Å
76	G	91.5	Very high	91.4	Very high	16 Å²	16	49.7 Å²	49.7	17%	0.165	24%	0.243	C	C	.	.	S	Bend	trans	149.6	-150.8	179.3	0	0	0	0	0	115.2	Q57 F78 W79 K80	Q57-G76 VanDerWaalsContact OE1-C 3.31Å; G76-F78 VanDerWaalsContact C-N 3.3Å; G76-F78 PolarHBondContact O-N 3.39Å; G76-W79 PolarHBondContact O-N 2.96Å; G76-K80 PolarHBondContact O-N 3.44Å
77	L	92.8	Very high	91.7	Very high	60 Å²	60	49.9 Å²	49.9	31%	0.314	24%	0.242	S	C	.	.	H	α-helix	trans	-60.4	-32.9	-171.7	-71.2	178	0	0	0	114.2	D54 Q57 K80 R81	D54-L77 HydrophobicContact CB-CD1 3.63Å; Q57-L77 HydrophobicContact CB-CB 4.1Å; L77-K80 HydrophobicContact CD2-CD 4.33Å; L77-K80 PolarHBondContact O-N 3.22Å; L77-R81 VanDerWaalsContact O-CG 3.28Å; L77-R81 WeakPolarHBondContact O-CG 3.31Å; L77-R81 PolarHBondContact O-N 3.26Å
78	F	94.1	Very high	92.1	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.009	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-53.7	178.1	173.5	-102.1	0	0	0	110.6	Q57 L60 S61 L62 T69 V73 G76 K80 R81 C82	Q57-F78 HydrophobicContact CB-CB 4.04Å; Q57-F78 HydrophobicContact CG-CB 4.08Å; Q57-F78 VanDerWaalsContact OE1-N 3.09Å; L60-F78 HydrophobicContact CB-CD2 3.65Å; L60-F78 HydrophobicContact CB-CE2 3.93Å; L60-F78 HydrophobicContact CD1-CD2 4.05Å; L60-F78 HydrophobicContact CD1-CG 4.35Å; S61-F78 WeakPolarHBondContact O-CE2 3.35Å; L62-F78 HydrophobicContact CD2-CD2 4.26Å; L62-F78 HydrophobicContact CD2-CE2 4.09Å; T69-F78 HydrophobicContact CG2-CE1 3.98Å; T69-F78 HydrophobicContact CG2-CZ 3.75Å; V73-F78 HydrophobicContact CB-CD1 4.2Å; V73-F78 HydrophobicContact CG1-CB 3.72Å; V73-F78 HydrophobicContact CG1-CD1 3.67Å; V73-F78 HydrophobicContact CG1-CG 3.86Å; V73-F78 HydrophobicContact CG2-CD1 4.45Å; G76-F78 VanDerWaalsContact C-N 3.3Å; G76-F78 PolarHBondContact O-N 3.39Å; F78-K80 VanDerWaalsContact C-N 3.3Å; F78-K80 PolarHBondContact O-N 3.05Å; F78-R81 WeakPolarHBondContact O-CB 3.23Å; F78-R81 PolarHBondContact O-N 3.42Å; F78-R81 VanDerWaalsContact O-N 3.1Å; F78-C82 VanDerWaalsContact CZ-SG 3.58Å; F78-C82 PolarHBondContact O-N 3.15Å; F78-C82 PolarHBondContact O-SG 3.36Å; F78-C82 VanDerWaalsContact O-SG 3.34Å
79	W	96.1	Very high	92.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65	-34.3	179.1	-64	104.8	0	0	0	112.2	L66 V73 P74 G76 R81 C82 C83 W99 K100 F103 F104	L66-W79 HydrophobicContact CD2-CH2 4.05Å; L66-W79 HydrophobicContact CD2-CZ3 4.01Å; V73-W79 PolarHBondContact O-NE1 3.19Å; P74-W79 PolarHBondContact O-NE1 3.2Å; G76-W79 PolarHBondContact O-N 2.96Å; W79-R81 VanDerWaalsContact C-N 3.35Å; W79-R81 PolarHBondContact O-N 3.17Å; W79-C82 WeakPolarHBondContact O-CB 3.18Å; W79-C82 PolarHBondContact O-N 3Å; W79-C83 WeakPolarHBondContact O-CB 3.29Å; W79-C83 PolarHBondContact O-N 3.29Å; W79-C83 PolarHBondContact O-SG 2.74Å; W79-C83 VanDerWaalsContact O-SG 3.33Å; W79-W99 HydrophobicContact CB-CB 3.71Å; W79-K100 HydrophobicContact CB-CB 4.34Å; W79-K100 HydrophobicContact CD2-CB 4.11Å; W79-K100 HydrophobicContact CD2-CG 3.94Å; W79-K100 HydrophobicContact CG-CB 3.78Å; W79-K100 HydrophobicContact CG-CG 4.11Å; W79-K100 HydrophobicContact CZ2-CD 4.27Å; W79-K100 HydrophobicContact CZ2-CG 4.15Å; W79-F103 HydrophobicContact CE3-CB 3.88Å; W79-F103 AromaticContact CE3-CD1 3.77Å; W79-F103 HydrophobicContact CE3-CD1 3.77Å; W79-F103 HydrophobicContact CE3-CD2 4.13Å; W79-F103 HydrophobicContact CE3-CE1 4.36Å; W79-F103 AromaticContact CE3-CG 3.64Å; W79-F103 HydrophobicContact CE3-CG 3.64Å; W79-F103 HydrophobicContact CH2-CD1 4.48Å; W79-F103 HydrophobicContact CZ3-CB 4.39Å; W79-F103 AromaticContact CZ3-CD1 3.41Å; W79-F103 HydrophobicContact CZ3-CD1 3.41Å; W79-F103 VanDerWaalsContact CZ3-CD1 3.41Å; W79-F103 HydrophobicContact CZ3-CD2 4.35Å; W79-F103 AromaticContact CZ3-CE1 3.66Å; W79-F103 HydrophobicContact CZ3-CE1 3.66Å; W79-F103 AromaticContact CZ3-CG 3.79Å; W79-F103 HydrophobicContact CZ3-CG 3.79Å; W79-F103 HydrophobicContact CZ3-CZ 4.21Å; W79-F104 HydrophobicContact CH2-CE1 4.39Å; W79-F104 AromaticContact CH2-CE2 3.92Å; W79-F104 HydrophobicContact CH2-CE2 3.92Å; W79-F104 AromaticContact CH2-CZ 3.58Å; W79-F104 HydrophobicContact CH2-CZ 3.58Å; W79-F104 HydrophobicContact CZ2-CE2 4.14Å; W79-F104 HydrophobicContact CZ2-CZ 4.15Å; W79-F104 HydrophobicContact CZ3-CE2 4.38Å; W79-F104 HydrophobicContact CZ3-CZ 4.16Å
80	K	96	Very high	92.8	Very high	74 Å²	74	60.2 Å²	60.2	32%	0.322	29%	0.29	S	S	.	.	H	α-helix	trans	-56	-48.9	170.6	179.2	175.6	179.1	-178.3	0	111.8	G76 L77 F78 C83 Q84 W99	G76-K80 PolarHBondContact O-N 3.44Å; L77-K80 HydrophobicContact CD2-CD 4.33Å; L77-K80 PolarHBondContact O-N 3.22Å; F78-K80 VanDerWaalsContact C-N 3.3Å; F78-K80 PolarHBondContact O-N 3.05Å; K80-C83 PolarHBondContact O-N 2.96Å; K80-Q84 WeakPolarHBondContact O-CB 3.33Å; K80-Q84 VanDerWaalsContact O-CG 3.27Å; K80-Q84 WeakPolarHBondContact O-CG 3.31Å; K80-Q84 PolarHBondContact O-N 3.46Å; K80-W99 HydrophobicContact CB-CD2 3.61Å; K80-W99 HydrophobicContact CB-CE3 4.04Å; K80-W99 HydrophobicContact CB-CG 3.82Å; K80-W99 HydrophobicContact CB-CZ2 4.33Å; K80-W99 HydrophobicContact CD-CZ2 3.9Å; K80-W99 HydrophobicContact CG-CD2 3.91Å; K80-W99 HydrophobicContact CG-CE3 4.17Å; K80-W99 HydrophobicContact CG-CH2 3.96Å; K80-W99 HydrophobicContact CG-CZ2 3.7Å; K80-W99 HydrophobicContact CG-CZ3 4.16Å
81	R	95.4	Very high	93	Very high	73 Å²	73	64 Å²	64	28%	0.275	31%	0.31	S	S	.	.	H	α-helix	trans	-63.9	-42.7	177.6	-68.6	164.9	64.2	-140.1	-2.7	111.3	Q57 S58 L60 L62 L77 F78 W79 C83 Q84 Q85	Q57-R81 PolarHBondContact O-NH1 3.08Å; S58-R81 VanDerWaalsContact C-NH1 3.3Å; S58-R81 PolarHBondContact O-NH1 3.22Å; L60-R81 PolarHBondContact O-NH1 2.65Å; L60-R81 PolarHBondContact O-NH2 3.11Å; L62-R81 HydrophobicContact CD1-CB 4.19Å; L62-R81 HydrophobicContact CD2-CB 3.66Å; L77-R81 VanDerWaalsContact O-CG 3.28Å; L77-R81 WeakPolarHBondContact O-CG 3.31Å; L77-R81 PolarHBondContact O-N 3.26Å; F78-R81 WeakPolarHBondContact O-CB 3.23Å; F78-R81 PolarHBondContact O-N 3.42Å; F78-R81 VanDerWaalsContact O-N 3.1Å; W79-R81 VanDerWaalsContact C-N 3.35Å; W79-R81 PolarHBondContact O-N 3.17Å; R81-C83 PolarHBondContact O-N 3.3Å; R81-Q84 PolarHBondContact O-N 3.45Å; R81-Q85 WeakPolarHBondContact O-CB 3.35Å; R81-Q85 PolarHBondContact O-N 2.85Å
82	C	95.4	Very high	93.5	Very high	8 Å²	8	61.1 Å²	61.1	5%	0.054	29%	0.294	C	S	.	.	H	α-helix	trans	-58.3	-45.6	174.8	-66.1	0	0	0	0	112.1	F78 W79 Q85 R86 F103	F78-C82 VanDerWaalsContact CZ-SG 3.58Å; F78-C82 PolarHBondContact O-N 3.15Å; F78-C82 PolarHBondContact O-SG 3.36Å; F78-C82 VanDerWaalsContact O-SG 3.34Å; W79-C82 WeakPolarHBondContact O-CB 3.18Å; W79-C82 PolarHBondContact O-N 3Å; C82-Q85 PolarHBondContact O-N 3.4Å; C82-R86 WeakPolarHBondContact O-CG 3.46Å; C82-R86 PolarHBondContact O-N 2.79Å; C82-F103 HydrophobicContact CB-CD2 3.82Å; C82-F103 HydrophobicContact CB-CE2 3.76Å
83	C	96.3	Very high	93.9	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.8	-48	178	-72.8	0	0	0	0	111.8	W79 K80 R81 Q85 R86 W87 W99	W79-C83 WeakPolarHBondContact O-CB 3.29Å; W79-C83 PolarHBondContact O-N 3.29Å; W79-C83 PolarHBondContact O-SG 2.74Å; W79-C83 VanDerWaalsContact O-SG 3.33Å; K80-C83 PolarHBondContact O-N 2.96Å; R81-C83 PolarHBondContact O-N 3.3Å; C83-Q85 VanDerWaalsContact C-N 3.26Å; C83-Q85 PolarHBondContact O-N 3.29Å; C83-R86 PolarHBondContact O-N 2.86Å; C83-R86 VanDerWaalsContact O-N 3.14Å; C83-W87 HydrophobicContact CB-CE3 3.99Å; C83-W87 HydrophobicContact CB-CZ3 4.14Å; C83-W87 PolarHBondContact O-N 3.3Å; C83-W99 HydrophobicContact CB-CE3 3.8Å; C83-W99 HydrophobicContact CB-CZ3 3.86Å
84	Q	95.9	Very high	94.1	Very high	108 Å²	108	67.1 Å²	67.1	51%	0.505	33%	0.328	S	S	.	.	H	α-helix	trans	-65.7	-28.7	-179	-71.3	177.1	-34.7	0	0	113	K80 R81	K80-Q84 WeakPolarHBondContact O-CB 3.33Å; K80-Q84 VanDerWaalsContact O-CG 3.27Å; K80-Q84 WeakPolarHBondContact O-CG 3.31Å; K80-Q84 PolarHBondContact O-N 3.46Å; R81-Q84 PolarHBondContact O-N 3.45Å
85	Q	95.8	Very high	94.4	Very high	128 Å²	128	65.7 Å²	65.7	60%	0.598	32%	0.316	S	S	*	.	H	α-helix	trans	-70.3	-38.9	173.3	-173.2	-177.3	13.8	0	0	112	L62 R81 C82 C83	L62-Q85 VanDerWaalsContact CB-OE1 3.26Å; L62-Q85 HydrophobicContact CD1-CB 4.28Å; R81-Q85 WeakPolarHBondContact O-CB 3.35Å; R81-Q85 PolarHBondContact O-N 2.85Å; C82-Q85 PolarHBondContact O-N 3.4Å; C83-Q85 VanDerWaalsContact C-N 3.26Å; C83-Q85 PolarHBondContact O-N 3.29Å
86	R	95.2	Very high	94.5	Very high	126 Å²	126	67.2 Å²	67.2	48%	0.475	32%	0.324	S	S	.	.	H	α-helix	trans	-87.1	-34	-175	-69.4	-173.7	179.7	-156.5	-1.7	113.6	C82 C83	C82-R86 WeakPolarHBondContact O-CG 3.46Å; C82-R86 PolarHBondContact O-N 2.79Å; C83-R86 PolarHBondContact O-N 2.86Å; C83-R86 VanDerWaalsContact O-N 3.14Å
87	W	95.9	Very high	94.7	Very high	42 Å²	42	74.6 Å²	74.6	16%	0.159	35%	0.348	C	S	.	.			trans	-130.6	129	-171.2	-57.6	-68.4	0	0	0	112.3	C83 I89 C90 F103 R106	C83-W87 HydrophobicContact CB-CE3 3.99Å; C83-W87 HydrophobicContact CB-CZ3 4.14Å; C83-W87 PolarHBondContact O-N 3.3Å; W87-I89 VanDerWaalsContact C-N 3.3Å; W87-I89 PolarHBondContact O-N 3.36Å; W87-C90 PolarHBondContact O-SG 3.03Å; W87-F103 AromaticContact CH2-CD2 3.99Å; W87-F103 HydrophobicContact CH2-CD2 3.99Å; W87-F103 HydrophobicContact CH2-CE2 4.36Å; W87-F103 HydrophobicContact CH2-CG 4.45Å; W87-F103 AromaticContact CZ3-CD2 3.81Å; W87-F103 HydrophobicContact CZ3-CD2 3.81Å; W87-F103 HydrophobicContact CZ3-CE2 4.41Å; W87-F103 HydrophobicContact CZ3-CG 4.46Å; W87-R106 VanDerWaalsContact CD1-CZ 3.47Å; W87-R106 VanDerWaalsContact CG-NH2 3.33Å; W87-R106 HydrophobicContact CH2-CB 3.77Å; W87-R106 HydrophobicContact CZ2-CB 3.53Å; W87-R106 HydrophobicContact CZ3-CB 4.47Å
88	K	93.9	Very high	94.9	Very high	218 Å²	218	72.9 Å²	72.9	95%	0.948	34%	0.341	S	S	*	.	S	Bend	trans	-61.3	-38.2	178.5	-66.2	-176	179	-179.8	0	113
89	I	93.7	Very high	95	Very high	138 Å²	138	74.6 Å²	74.6	71%	0.708	35%	0.348	S	S	*	.			trans	-114.4	122.8	-179.2	-57.8	175	0	0	0	107.9	W87 R106	W87-I89 VanDerWaalsContact C-N 3.3Å; W87-I89 PolarHBondContact O-N 3.36Å; I89-R106 PolarHBondContact O-NH1 2.94Å
90	C	94.3	Very high	95.1	Very high	35 Å²	35	75 Å²	75	24%	0.236	35%	0.349	C	S	.	.			trans	-128.4	112.8	176.7	-63.4	0	0	0	0	109.7	W87 W99 M102	W87-C90 PolarHBondContact O-SG 3.03Å; C90-W99 HydrophobicContact CB-CH2 3.84Å; C90-W99 HydrophobicContact CB-CZ3 3.59Å; C90-M102 HydrophobicContact CB-CE 3.68Å; C90-M102 HydrophobicContact CB-SD 4.19Å
91	D	93.1	Very high	95.1	Very high	79 Å²	79	72.2 Å²	72.2	42%	0.422	34%	0.337	S	S	.	.			trans	-123.7	115	173.9	177	13.1	0	0	0	108.6	S93 Y95	D91-S93 WeakPolarHBondContact OD1-CB 3.16Å; D91-S93 PolarHBondContact OD1-N 2.9Å; D91-S93 PolarHBondContact OD1-OG 3.31Å; D91-S93 PolarHBondContact OD2-OG 3.39Å; D91-Y95 VanDerWaalsContact O-CD2 3.22Å; D91-Y95 WeakPolarHBondContact O-CD2 3.31Å; D91-Y95 VanDerWaalsContact O-CE2 3.23Å; D91-Y95 WeakPolarHBondContact O-CE2 3.28Å
92	I	95.3	Very high	95.2	Very high	33 Å²	33	68.8 Å²	68.8	17%	0.169	32%	0.324	C	S	.	.			trans	-88.8	-4.3	-178.2	59.8	173.8	0	0	0	113	Q94 Y95 Y97 W99 M102	I92-Q94 PolarHBondContact O-N 3.02Å; I92-Q94 VanDerWaalsContact O-N 3.13Å; I92-Y95 PolarHBondContact O-N 2.76Å; I92-Y97 HydrophobicContact CD1-CD1 4.17Å; I92-Y97 HydrophobicContact CG1-CD1 4.09Å; I92-Y97 WeakPolarHBondContact O-CA 3.4Å; I92-Y97 PolarHBondContact O-N 3.36Å; I92-Y97 VanDerWaalsContact O-N 3.08Å; I92-W99 HydrophobicContact CD1-CZ2 4.25Å; I92-W99 HydrophobicContact CG2-CD2 3.61Å; I92-W99 HydrophobicContact CG2-CE3 3.72Å; I92-W99 HydrophobicContact CG2-CG 4.19Å; I92-W99 HydrophobicContact CG2-CH2 3.99Å; I92-W99 HydrophobicContact CG2-CZ2 3.86Å; I92-W99 HydrophobicContact CG2-CZ3 3.94Å; I92-M102 HydrophobicContact CG2-SD 3.88Å
93	S	94.6	Very high	95.3	Very high	56 Å²	56	68.4 Å²	68.4	39%	0.392	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-28.5	-177.2	68.3	0	0	0	0	113	D91	D91-S93 WeakPolarHBondContact OD1-CB 3.16Å; D91-S93 PolarHBondContact OD1-N 2.9Å; D91-S93 PolarHBondContact OD1-OG 3.31Å; D91-S93 PolarHBondContact OD2-OG 3.39Å
94	Q	91.3	Very high	95.4	Very high	96 Å²	96	68.5 Å²	68.5	45%	0.449	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-3.1	179.5	-54.9	-174.5	12.8	0	0	113.9	I92	I92-Q94 PolarHBondContact O-N 3.02Å; I92-Q94 VanDerWaalsContact O-N 3.13Å
95	Y	95	Very high	95.4	Very high	23 Å²	23	63.4 Å²	63.4	9%	0.09	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	31.7	-171.1	-57.5	-87.4	0	0	0	111.7	D91 I92 Y97 S98 R101 M102 E105	D91-Y95 VanDerWaalsContact O-CD2 3.22Å; D91-Y95 WeakPolarHBondContact O-CD2 3.31Å; D91-Y95 VanDerWaalsContact O-CE2 3.23Å; D91-Y95 WeakPolarHBondContact O-CE2 3.28Å; I92-Y95 PolarHBondContact O-N 2.76Å; Y95-Y97 PolarHBondContact O-N 2.79Å; Y95-Y97 VanDerWaalsContact O-N 3.16Å; Y95-S98 WeakPolarHBondContact O-CB 3.09Å; Y95-S98 PolarHBondContact O-N 2.8Å; Y95-R101 HydrophobicContact CD1-CG 4.28Å; Y95-M102 VanDerWaalsContact CD1-CA 3.43Å; Y95-M102 HydrophobicContact CD1-CB 3.86Å; Y95-M102 HydrophobicContact CD1-CG 4.26Å; Y95-M102 HydrophobicContact CD2-CB 3.85Å; Y95-M102 HydrophobicContact CD2-CG 3.8Å; Y95-M102 HydrophobicContact CE1-CB 4.22Å; Y95-M102 HydrophobicContact CE1-CG 4.17Å; Y95-M102 HydrophobicContact CE2-CB 4.23Å; Y95-M102 HydrophobicContact CE2-CG 3.71Å; Y95-M102 HydrophobicContact CG-CB 3.63Å; Y95-M102 HydrophobicContact CG-CG 4.07Å; Y95-E105 WeakPolarHBondContact CD1-OE2 3.5Å; Y95-E105 HydrophobicContact CE1-CB 4.12Å; Y95-E105 WeakPolarHBondContact CE1-OE2 3.43Å
96	D	93.4	Very high	95.5	Very high	97 Å²	97	60.1 Å²	60.1	52%	0.519	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	32.4	-173.5	-54	-31.3	0	0	0	112.8	S98 R101 K137	D96-S98 PolarHBondContact O-N 2.82Å; D96-R101 IonicContact OD1-NH1 2.86Å; D96-R101 PolarHBondContact OD1-NH1 3.14Å; D96-R101 IonicContact OD2-CZ 2.79Å; D96-R101 IonicContact OD2-NH1 3.79Å; D96-R101 PolarHBondContact OD2-NH1 3.09Å; D96-K137 IonicContact OD2-NZ 3.67Å; D96-K137 PolarHBondContact OD2-NZ 3.05Å
97	Y	95.6	Very high	95.6	Very high	170 Å²	170	55.7 Å²	55.7	67%	0.667	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	24	-173.7	-58.3	-88.8	0	0	0	114.6	I92 Y95	I92-Y97 HydrophobicContact CD1-CD1 4.17Å; I92-Y97 HydrophobicContact CG1-CD1 4.09Å; I92-Y97 WeakPolarHBondContact O-CA 3.4Å; I92-Y97 PolarHBondContact O-N 3.36Å; I92-Y97 VanDerWaalsContact O-N 3.08Å; Y95-Y97 PolarHBondContact O-N 2.79Å; Y95-Y97 VanDerWaalsContact O-N 3.16Å
98	S	96.9	Very high	95.7	Very high	24 Å²	24	53.8 Å²	53.8	17%	0.168	26%	0.258	C	S	.	.			trans	-101.7	122.8	177	167.7	0	0	0	0	112.3	D75 Y95 D96 R101 M102	D75-S98 WeakPolarHBondContact OD1-CA 3.29Å; D75-S98 WeakPolarHBondContact OD1-CB 3.28Å; D75-S98 PolarHBondContact OD1-OG 2.98Å; Y95-S98 WeakPolarHBondContact O-CB 3.09Å; Y95-S98 PolarHBondContact O-N 2.8Å; D96-S98 PolarHBondContact O-N 2.82Å; S98-R101 WeakPolarHBondContact OG-CB 3.45Å; S98-R101 PolarHBondContact OG-N 3.12Å; S98-M102 WeakPolarHBondContact O-CB 3.48Å; S98-M102 PolarHBondContact O-N 2.81Å; S98-M102 VanDerWaalsContact O-N 3.16Å
99	W	97	Very high	95.9	Very high	38 Å²	38	44.1 Å²	44.1	14%	0.144	22%	0.216	C	C	.	.	H	α-helix	trans	-69.6	-37.3	174.7	-73.5	100	0	0	0	113	D75 W79 K80 C83 C90 I92 M102 F103	D75-W99 PolarHBondContact OD1-N 3.06Å; W79-W99 HydrophobicContact CB-CB 3.71Å; K80-W99 HydrophobicContact CB-CD2 3.61Å; K80-W99 HydrophobicContact CB-CE3 4.04Å; K80-W99 HydrophobicContact CB-CG 3.82Å; K80-W99 HydrophobicContact CB-CZ2 4.33Å; K80-W99 HydrophobicContact CD-CZ2 3.9Å; K80-W99 HydrophobicContact CG-CD2 3.91Å; K80-W99 HydrophobicContact CG-CE3 4.17Å; K80-W99 HydrophobicContact CG-CH2 3.96Å; K80-W99 HydrophobicContact CG-CZ2 3.7Å; K80-W99 HydrophobicContact CG-CZ3 4.16Å; C83-W99 HydrophobicContact CB-CE3 3.8Å; C83-W99 HydrophobicContact CB-CZ3 3.86Å; C90-W99 HydrophobicContact CB-CH2 3.84Å; C90-W99 HydrophobicContact CB-CZ3 3.59Å; I92-W99 HydrophobicContact CD1-CZ2 4.25Å; I92-W99 HydrophobicContact CG2-CD2 3.61Å; I92-W99 HydrophobicContact CG2-CE3 3.72Å; I92-W99 HydrophobicContact CG2-CG 4.19Å; I92-W99 HydrophobicContact CG2-CH2 3.99Å; I92-W99 HydrophobicContact CG2-CZ2 3.86Å; I92-W99 HydrophobicContact CG2-CZ3 3.94Å; W99-M102 HydrophobicContact CE3-SD 4.16Å; W99-M102 HydrophobicContact CZ3-SD 4.12Å; W99-M102 PolarHBondContact O-N 3.35Å; W99-F103 WeakPolarHBondContact O-CB 3.4Å; W99-F103 PolarHBondContact O-N 3.27Å
100	K	96.1	Very high	96.1	Very high	9 Å²	9	41 Å²	41	4%	0.039	20%	0.201	C	C	.	.	H	α-helix	trans	-66.3	-45.4	178.7	-172.5	172.1	-172.7	176.3	0	110.9	A70 V73 D75 W79 F103 F104 Y135	A70-K100 WeakPolarHBondContact O-CE 3.17Å; A70-K100 PolarHBondContact O-NZ 3.01Å; V73-K100 PolarHBondContact O-NZ 3.32Å; D75-K100 HydrophobicContact CB-CB 4.19Å; D75-K100 WeakPolarHBondContact OD1-CB 3.39Å; D75-K100 PolarHBondContact OD1-N 2.79Å; W79-K100 HydrophobicContact CB-CB 4.34Å; W79-K100 HydrophobicContact CD2-CB 4.11Å; W79-K100 HydrophobicContact CD2-CG 3.94Å; W79-K100 HydrophobicContact CG-CB 3.78Å; W79-K100 HydrophobicContact CG-CG 4.11Å; W79-K100 HydrophobicContact CZ2-CD 4.27Å; W79-K100 HydrophobicContact CZ2-CG 4.15Å; K100-F103 PolarHBondContact O-N 3.21Å; K100-F104 HydrophobicContact CD-CE2 4.28Å; K100-F104 HydrophobicContact CG-CD2 3.78Å; K100-F104 HydrophobicContact CG-CE2 3.61Å; K100-F104 VanDerWaalsContact O-CD2 3.23Å; K100-F104 WeakPolarHBondContact O-CD2 3.46Å; K100-F104 PolarHBondContact O-N 2.96Å; K100-Y135 HydrophobicContact CD-CE1 4.14Å; K100-Y135 WeakPolarHBondContact CE-OH 3.28Å; K100-Y135 PolarHBondContact NZ-OH 3.46Å; K100-Y135 VanDerWaalsContact NZ-OH 3.13Å
101	R	96.9	Very high	96.2	Very high	15 Å²	15	41 Å²	41	6%	0.057	20%	0.198	C	C	.	.	H	α-helix	trans	-59	-50.7	173.3	175.2	166.3	176.3	-130.2	-26.5	111.1	Y95 D96 S98 F103 F104 E105 Y135	Y95-R101 HydrophobicContact CD1-CG 4.28Å; D96-R101 IonicContact OD1-NH1 2.86Å; D96-R101 PolarHBondContact OD1-NH1 3.14Å; D96-R101 IonicContact OD2-CZ 2.79Å; D96-R101 IonicContact OD2-NH1 3.79Å; D96-R101 PolarHBondContact OD2-NH1 3.09Å; S98-R101 WeakPolarHBondContact OG-CB 3.45Å; S98-R101 PolarHBondContact OG-N 3.12Å; R101-F103 VanDerWaalsContact C-N 3.31Å; R101-F103 PolarHBondContact O-N 3.33Å; R101-F104 PolarHBondContact O-N 3.09Å; R101-E105 HydrophobicContact CG-CG 4.28Å; R101-E105 IonicContact CZ-OE1 3.72Å; R101-E105 IonicContact CZ-OE2 2.98Å; R101-E105 IonicContact NE-OE1 3.56Å; R101-E105 PolarHBondContact NE-OE1 3.04Å; R101-E105 IonicContact NE-OE2 3.23Å; R101-E105 IonicContact NH2-OE1 3.36Å; R101-E105 PolarHBondContact NH2-OE1 3.38Å; R101-E105 IonicContact NH2-OE2 3.3Å; R101-E105 PolarHBondContact NH2-OE2 3.25Å; R101-E105 PolarHBondContact O-N 3.12Å; R101-Y135 WeakPolarHBondContact CG-O 3.19Å
102	M	97.4	Very high	96.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-55.2	-45.6	176.6	-178.6	-166.5	163.3	0	0	112.4	C90 I92 Y95 S98 W99 R106	C90-M102 HydrophobicContact CB-CE 3.68Å; C90-M102 HydrophobicContact CB-SD 4.19Å; I92-M102 HydrophobicContact CG2-SD 3.88Å; Y95-M102 VanDerWaalsContact CD1-CA 3.43Å; Y95-M102 HydrophobicContact CD1-CB 3.86Å; Y95-M102 HydrophobicContact CD1-CG 4.26Å; Y95-M102 HydrophobicContact CD2-CB 3.85Å; Y95-M102 HydrophobicContact CD2-CG 3.8Å; Y95-M102 HydrophobicContact CE1-CB 4.22Å; Y95-M102 HydrophobicContact CE1-CG 4.17Å; Y95-M102 HydrophobicContact CE2-CB 4.23Å; Y95-M102 HydrophobicContact CE2-CG 3.71Å; Y95-M102 HydrophobicContact CG-CB 3.63Å; Y95-M102 HydrophobicContact CG-CG 4.07Å; S98-M102 WeakPolarHBondContact O-CB 3.48Å; S98-M102 PolarHBondContact O-N 2.81Å; S98-M102 VanDerWaalsContact O-N 3.16Å; W99-M102 HydrophobicContact CE3-SD 4.16Å; W99-M102 HydrophobicContact CZ3-SD 4.12Å; W99-M102 PolarHBondContact O-N 3.35Å; M102-R106 WeakPolarHBondContact O-CB 3.43Å; M102-R106 VanDerWaalsContact O-CG 3.28Å; M102-R106 WeakPolarHBondContact O-CG 3.5Å; M102-R106 PolarHBondContact O-N 3.45Å
103	F	97.6	Very high	96.5	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	18%	0.175	C	C	.	.	H	α-helix	trans	-59.2	-49.5	178.3	-178.7	-86.6	0	0	0	111.3	L66 W79 C82 W87 W99 K100 R101 H107	L66-F103 HydrophobicContact CD1-CE1 4.02Å; L66-F103 HydrophobicContact CD1-CZ 4.33Å; L66-F103 HydrophobicContact CD2-CE1 3.57Å; L66-F103 HydrophobicContact CD2-CZ 3.81Å; L66-F103 HydrophobicContact CG-CE1 4.47Å; W79-F103 HydrophobicContact CE3-CB 3.88Å; W79-F103 AromaticContact CE3-CD1 3.77Å; W79-F103 HydrophobicContact CE3-CD1 3.77Å; W79-F103 HydrophobicContact CE3-CD2 4.13Å; W79-F103 HydrophobicContact CE3-CE1 4.36Å; W79-F103 AromaticContact CE3-CG 3.64Å; W79-F103 HydrophobicContact CE3-CG 3.64Å; W79-F103 HydrophobicContact CH2-CD1 4.48Å; W79-F103 HydrophobicContact CZ3-CB 4.39Å; W79-F103 AromaticContact CZ3-CD1 3.41Å; W79-F103 HydrophobicContact CZ3-CD1 3.41Å; W79-F103 VanDerWaalsContact CZ3-CD1 3.41Å; W79-F103 HydrophobicContact CZ3-CD2 4.35Å; W79-F103 AromaticContact CZ3-CE1 3.66Å; W79-F103 HydrophobicContact CZ3-CE1 3.66Å; W79-F103 AromaticContact CZ3-CG 3.79Å; W79-F103 HydrophobicContact CZ3-CG 3.79Å; W79-F103 HydrophobicContact CZ3-CZ 4.21Å; C82-F103 HydrophobicContact CB-CD2 3.82Å; C82-F103 HydrophobicContact CB-CE2 3.76Å; W87-F103 AromaticContact CH2-CD2 3.99Å; W87-F103 HydrophobicContact CH2-CD2 3.99Å; W87-F103 HydrophobicContact CH2-CE2 4.36Å; W87-F103 HydrophobicContact CH2-CG 4.45Å; W87-F103 AromaticContact CZ3-CD2 3.81Å; W87-F103 HydrophobicContact CZ3-CD2 3.81Å; W87-F103 HydrophobicContact CZ3-CE2 4.41Å; W87-F103 HydrophobicContact CZ3-CG 4.46Å; W99-F103 WeakPolarHBondContact O-CB 3.4Å; W99-F103 PolarHBondContact O-N 3.27Å; K100-F103 PolarHBondContact O-N 3.21Å; R101-F103 VanDerWaalsContact C-N 3.31Å; R101-F103 PolarHBondContact O-N 3.33Å; F103-H107 HydrophobicContact CD1-CB 4.46Å; F103-H107 HydrophobicContact CE1-CB 4.26Å; F103-H107 WeakPolarHBondContact O-CB 3.47Å; F103-H107 PolarHBondContact O-N 3.39Å
104	F	97.5	Very high	96.5	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.009	18%	0.181	C	C	.	.	H	α-helix	trans	-71.5	-42.4	-173.6	-84.5	-50.6	0	0	0	113.9	A70 W79 K100 R101 H107 L108 L131 C132 Y135	A70-F104 HydrophobicContact CB-CE1 4.36Å; A70-F104 HydrophobicContact CB-CZ 3.63Å; W79-F104 HydrophobicContact CH2-CE1 4.39Å; W79-F104 AromaticContact CH2-CE2 3.92Å; W79-F104 HydrophobicContact CH2-CE2 3.92Å; W79-F104 AromaticContact CH2-CZ 3.58Å; W79-F104 HydrophobicContact CH2-CZ 3.58Å; W79-F104 HydrophobicContact CZ2-CE2 4.14Å; W79-F104 HydrophobicContact CZ2-CZ 4.15Å; W79-F104 HydrophobicContact CZ3-CE2 4.38Å; W79-F104 HydrophobicContact CZ3-CZ 4.16Å; K100-F104 HydrophobicContact CD-CE2 4.28Å; K100-F104 HydrophobicContact CG-CD2 3.78Å; K100-F104 HydrophobicContact CG-CE2 3.61Å; K100-F104 VanDerWaalsContact O-CD2 3.23Å; K100-F104 WeakPolarHBondContact O-CD2 3.46Å; K100-F104 PolarHBondContact O-N 2.96Å; R101-F104 PolarHBondContact O-N 3.09Å; F104-H107 PolarHBondContact O-N 3.15Å; F104-L108 WeakPolarHBondContact O-CB 3.39Å; F104-L108 PolarHBondContact O-N 3.49Å; F104-L131 HydrophobicContact CE1-CB 4.43Å; F104-C132 HydrophobicContact CB-CB 3.77Å; F104-C132 HydrophobicContact CD1-CB 3.42Å; F104-C132 VanDerWaalsContact CD1-CB 3.42Å; F104-C132 HydrophobicContact CE1-CB 4.18Å; F104-C132 HydrophobicContact CG-CB 3.67Å; F104-Y135 AromaticContact CD2-CD2 3.68Å; F104-Y135 HydrophobicContact CD2-CD2 3.68Å; F104-Y135 HydrophobicContact CD2-CE2 4.29Å; F104-Y135 HydrophobicContact CD2-CG 4.07Å; F104-Y135 AromaticContact CE2-CD2 3.95Å; F104-Y135 HydrophobicContact CE2-CD2 3.95Å; F104-Y135 HydrophobicContact CE2-CE2 4.1Å; F104-Y135 HydrophobicContact CG-CD2 4.49Å
105	E	98	Very high	96.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.2	-53.6	174.4	-72	-174.9	172.4	0	0	109.8	Y95 R101 H107 L108 E109 V136 K137 R138	Y95-E105 WeakPolarHBondContact CD1-OE2 3.5Å; Y95-E105 HydrophobicContact CE1-CB 4.12Å; Y95-E105 WeakPolarHBondContact CE1-OE2 3.43Å; R101-E105 HydrophobicContact CG-CG 4.28Å; R101-E105 IonicContact CZ-OE1 3.72Å; R101-E105 IonicContact CZ-OE2 2.98Å; R101-E105 IonicContact NE-OE1 3.56Å; R101-E105 PolarHBondContact NE-OE1 3.04Å; R101-E105 IonicContact NE-OE2 3.23Å; R101-E105 IonicContact NH2-OE1 3.36Å; R101-E105 PolarHBondContact NH2-OE1 3.38Å; R101-E105 IonicContact NH2-OE2 3.3Å; R101-E105 PolarHBondContact NH2-OE2 3.25Å; R101-E105 PolarHBondContact O-N 3.12Å; E105-H107 VanDerWaalsContact C-N 3.3Å; E105-H107 PolarHBondContact O-N 3.16Å; E105-L108 PolarHBondContact O-N 2.94Å; E105-E109 WeakPolarHBondContact O-CB 3.44Å; E105-E109 WeakPolarHBondContact O-CG 3.46Å; E105-E109 PolarHBondContact O-N 2.99Å; E105-V136 HydrophobicContact CG-CB 4.31Å; E105-V136 HydrophobicContact CG-CG1 4.27Å; E105-V136 HydrophobicContact CG-CG2 4.19Å; E105-K137 PolarHBondContact OE1-N 3.08Å; E105-R138 WeakPolarHBondContact CG-O 3.36Å; E105-R138 PolarHBondContact OE1-N 3.06Å
106	R	97.8	Very high	96.5	Very high	59 Å²	59	36.6 Å²	36.6	22%	0.223	17%	0.173	C	C	.	.	H	α-helix	trans	-65.4	-32.1	180	-65.6	-176.8	71.9	170.6	8.5	113.7	W87 I89 M102 E109 N110	W87-R106 VanDerWaalsContact CD1-CZ 3.47Å; W87-R106 VanDerWaalsContact CG-NH2 3.33Å; W87-R106 HydrophobicContact CH2-CB 3.77Å; W87-R106 HydrophobicContact CZ2-CB 3.53Å; W87-R106 HydrophobicContact CZ3-CB 4.47Å; I89-R106 PolarHBondContact O-NH1 2.94Å; M102-R106 WeakPolarHBondContact O-CB 3.43Å; M102-R106 VanDerWaalsContact O-CG 3.28Å; M102-R106 WeakPolarHBondContact O-CG 3.5Å; M102-R106 PolarHBondContact O-N 3.45Å; R106-E109 WeakPolarHBondContact CA-OE2 3.43Å; R106-N110 VanDerWaalsContact O-CB 3.31Å; R106-N110 WeakPolarHBondContact O-CB 3.46Å; R106-N110 PolarHBondContact O-N 3.33Å
107	H	97.1	Very high	96.3	Very high	34 Å²	34	32.3 Å²	32.3	16%	0.157	15%	0.15	C	C	.	.	H	α-helix	trans	-67.3	-46.4	176.4	-178.2	42.4	0	0	0	111	F103 F104 E105 N110 L111	F103-H107 HydrophobicContact CD1-CB 4.46Å; F103-H107 HydrophobicContact CE1-CB 4.26Å; F103-H107 WeakPolarHBondContact O-CB 3.47Å; F103-H107 PolarHBondContact O-N 3.39Å; F104-H107 PolarHBondContact O-N 3.15Å; E105-H107 VanDerWaalsContact C-N 3.3Å; E105-H107 PolarHBondContact O-N 3.16Å; H107-N110 PolarHBondContact O-N 2.8Å; H107-L111 WeakPolarHBondContact O-CG 3.05Å; H107-L111 PolarHBondContact O-N 3.22Å; H107-L111 VanDerWaalsContact O-N 3.08Å
108	L	98.1	Very high	95.9	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-65.7	-44	177.1	-179.5	59.1	0	0	0	111.4	F104 E105 N110 L111 I112 I125 A128 L129 V136 L139 L187	F104-L108 WeakPolarHBondContact O-CB 3.39Å; F104-L108 PolarHBondContact O-N 3.49Å; E105-L108 PolarHBondContact O-N 2.94Å; L108-N110 VanDerWaalsContact C-N 3.32Å; L108-N110 PolarHBondContact O-N 3.45Å; L108-L111 PolarHBondContact O-N 3.06Å; L108-L111 VanDerWaalsContact O-N 3.14Å; L108-I112 HydrophobicContact CD1-CD1 4.11Å; L108-I112 HydrophobicContact CD1-CG1 4.32Å; L108-I112 HydrophobicContact CG-CD1 3.96Å; L108-I112 WeakPolarHBondContact O-CG1 3.33Å; L108-I112 PolarHBondContact O-N 2.83Å; L108-I125 HydrophobicContact CD1-CG2 4.19Å; L108-A128 HydrophobicContact CD1-CB 4.47Å; L108-L129 HydrophobicContact CD1-CD2 4.44Å; L108-L129 HydrophobicContact CD2-CD2 3.75Å; L108-V136 HydrophobicContact CD2-CG1 4.47Å; L108-V136 HydrophobicContact CD2-CG2 4.07Å; L108-L139 HydrophobicContact CD2-CD2 3.94Å; L108-L139 HydrophobicContact CG-CD2 4.19Å; L108-L187 HydrophobicContact CD2-CD1 4.43Å
109	E	98.1	Very high	95.5	Very high	16 Å²	16	36 Å²	36	8%	0.075	17%	0.171	C	C	.	.	H	α-helix	trans	-53.4	-48.7	173.2	-72.1	166.6	174.4	0	0	111.3	E105 R106 L111 I112 E113 L139 N140 I141	E105-E109 WeakPolarHBondContact O-CB 3.44Å; E105-E109 WeakPolarHBondContact O-CG 3.46Å; E105-E109 PolarHBondContact O-N 2.99Å; R106-E109 WeakPolarHBondContact CA-OE2 3.43Å; E109-L111 VanDerWaalsContact C-N 3.32Å; E109-L111 PolarHBondContact O-N 3.28Å; E109-I112 PolarHBondContact O-N 3.07Å; E109-E113 WeakPolarHBondContact O-CB 3.33Å; E109-E113 WeakPolarHBondContact O-CG 3.39Å; E109-E113 PolarHBondContact O-N 3.35Å; E109-L139 HydrophobicContact CG-CD2 4.09Å; E109-N140 WeakPolarHBondContact OE1-CB 3.46Å; E109-N140 PolarHBondContact OE1-N 3.38Å; E109-I141 HydrophobicContact CB-CD1 4.15Å; E109-I141 HydrophobicContact CG-CD1 4.09Å
110	N	97.1	Very high	95.3	Very high	72 Å²	72	36.5 Å²	36.5	39%	0.385	18%	0.178	S	C	.	.	H	α-helix	trans	-63.8	-36	179.1	-177.4	88.9	0	0	0	112.9	R106 H107 L108 L114	R106-N110 VanDerWaalsContact O-CB 3.31Å; R106-N110 WeakPolarHBondContact O-CB 3.46Å; R106-N110 PolarHBondContact O-N 3.33Å; H107-N110 PolarHBondContact O-N 2.8Å; L108-N110 VanDerWaalsContact C-N 3.32Å; L108-N110 PolarHBondContact O-N 3.45Å; N110-L114 WeakPolarHBondContact O-CB 3.42Å; N110-L114 VanDerWaalsContact O-CG 3.3Å; N110-L114 WeakPolarHBondContact O-CG 3.27Å; N110-L114 PolarHBondContact O-N 3.31Å
111	L	97.3	Very high	95.2	Very high	36 Å²	36	42.9 Å²	42.9	19%	0.188	21%	0.208	C	C	.	.	H	α-helix	trans	-66.9	-41.7	175.2	-69.2	173.9	0	0	0	111.3	H107 L108 E109 F115 V124 I125 A128	H107-L111 WeakPolarHBondContact O-CG 3.05Å; H107-L111 PolarHBondContact O-N 3.22Å; H107-L111 VanDerWaalsContact O-N 3.08Å; L108-L111 PolarHBondContact O-N 3.06Å; L108-L111 VanDerWaalsContact O-N 3.14Å; E109-L111 VanDerWaalsContact C-N 3.32Å; E109-L111 PolarHBondContact O-N 3.28Å; L111-F115 PolarHBondContact O-N 3.33Å; L111-F115 VanDerWaalsContact O-N 3.14Å; L111-V124 HydrophobicContact CD2-CG1 4.11Å; L111-I125 HydrophobicContact CB-CD1 3.66Å; L111-A128 HydrophobicContact CD1-CB 3.57Å
112	I	97.4	Very high	95	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67	-45.1	177.5	-66.7	169.2	0	0	0	110.8	L108 E109 L114 F115 I125 L139 I141 L144 F178 F180	L108-I112 HydrophobicContact CD1-CD1 4.11Å; L108-I112 HydrophobicContact CD1-CG1 4.32Å; L108-I112 HydrophobicContact CG-CD1 3.96Å; L108-I112 WeakPolarHBondContact O-CG1 3.33Å; L108-I112 PolarHBondContact O-N 2.83Å; E109-I112 PolarHBondContact O-N 3.07Å; I112-L114 PolarHBondContact O-N 2.76Å; I112-F115 VanDerWaalsContact O-CB 3.28Å; I112-F115 WeakPolarHBondContact O-CB 3.43Å; I112-F115 PolarHBondContact O-N 3.3Å; I112-F115 VanDerWaalsContact O-N 3.09Å; I112-I125 HydrophobicContact CG1-CD1 4.14Å; I112-L139 HydrophobicContact CD1-CD1 4.42Å; I112-I141 HydrophobicContact CB-CD1 3.9Å; I112-I141 HydrophobicContact CD1-CD1 4.2Å; I112-I141 HydrophobicContact CG2-CD1 3.74Å; I112-I141 HydrophobicContact CG2-CG1 4.18Å; I112-I141 HydrophobicContact CG2-CG2 4.34Å; I112-L144 HydrophobicContact CG2-CD2 4.09Å; I112-F178 HydrophobicContact CD1-CE1 4.28Å; I112-F178 HydrophobicContact CG1-CE1 4.12Å; I112-F178 HydrophobicContact CG1-CE2 4.41Å; I112-F178 HydrophobicContact CG1-CZ 4.03Å; I112-F178 HydrophobicContact CG2-CB 4.42Å; I112-F178 HydrophobicContact CG2-CD1 3.78Å; I112-F178 HydrophobicContact CG2-CD2 4.34Å; I112-F178 HydrophobicContact CG2-CE1 4.13Å; I112-F178 HydrophobicContact CG2-CG 3.9Å; I112-F180 HydrophobicContact CG2-CE1 4.25Å; I112-F180 HydrophobicContact CG2-CZ 4.16Å
113	E	96.8	Very high	94.9	Very high	20 Å²	20	50.7 Å²	50.7	9%	0.093	24%	0.243	C	C	.	.	H	α-helix	trans	-64.1	-26.5	-179.9	-76.1	-163.3	-179.7	0	0	113.6	E109 I141 T142 Q143 K200	E109-E113 WeakPolarHBondContact O-CB 3.33Å; E109-E113 WeakPolarHBondContact O-CG 3.39Å; E109-E113 PolarHBondContact O-N 3.35Å; E113-I141 HydrophobicContact CG-CG2 4.11Å; E113-T142 WeakPolarHBondContact OE1-CB 3.07Å; E113-T142 PolarHBondContact OE1-N 3.22Å; E113-T142 PolarHBondContact OE1-OG1 3.16Å; E113-Q143 HydrophobicContact CB-CG 3.81Å; E113-Q143 HydrophobicContact CG-CG 3.88Å; E113-Q143 PolarHBondContact OE2-NE2 2.92Å; E113-K200 IonicContact OE1-NZ 2.98Å; E113-K200 IonicContact OE2-NZ 3.77Å; E113-K200 PolarHBondContact OE2-NZ 3.31Å
114	L	94.9	Very high	94.7	Very high	100 Å²	100	53.9 Å²	53.9	52%	0.524	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-1.3	177.2	-64.2	176.7	0	0	0	112.8	N110 I112 I116	N110-L114 WeakPolarHBondContact O-CB 3.42Å; N110-L114 VanDerWaalsContact O-CG 3.3Å; N110-L114 WeakPolarHBondContact O-CG 3.27Å; N110-L114 PolarHBondContact O-N 3.31Å; I112-L114 PolarHBondContact O-N 2.76Å; L114-I116 PolarHBondContact O-N 2.73Å
115	F	95	Very high	94.7	Very high	14 Å²	14	53.8 Å²	53.8	6%	0.061	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-72.3	120.2	-178.6	-171.2	-85.6	0	0	0	110	L111 I112 P117 T120 F122 I125 F178	L111-F115 PolarHBondContact O-N 3.33Å; L111-F115 VanDerWaalsContact O-N 3.14Å; I112-F115 VanDerWaalsContact O-CB 3.28Å; I112-F115 WeakPolarHBondContact O-CB 3.43Å; I112-F115 PolarHBondContact O-N 3.3Å; I112-F115 VanDerWaalsContact O-N 3.09Å; F115-P117 HydrophobicContact CD1-CG 4.48Å; F115-T120 HydrophobicContact CD2-CG2 3.5Å; F115-T120 VanDerWaalsContact CD2-CG2 3.5Å; F115-T120 HydrophobicContact CE2-CG2 3.66Å; F115-T120 VanDerWaalsContact CE2-O 3.31Å; F115-T120 WeakPolarHBondContact CE2-O 3.23Å; F115-T120 HydrophobicContact CG-CG2 4.32Å; F115-T120 WeakPolarHBondContact CZ-O 3.21Å; F115-F122 HydrophobicContact CE2-CB 4.47Å; F115-F122 HydrophobicContact CE2-CD2 4.14Å; F115-F122 HydrophobicContact CZ-CB 4.38Å; F115-F122 AromaticContact CZ-CD2 3.87Å; F115-F122 HydrophobicContact CZ-CD2 3.87Å; F115-I125 HydrophobicContact CD2-CD1 4.4Å; F115-I125 HydrophobicContact CD2-CG1 4.05Å; F115-I125 HydrophobicContact CE2-CG1 4.33Å; F115-F178 HydrophobicContact CB-CD2 3.88Å; F115-F178 HydrophobicContact CB-CE2 4.37Å; F115-F178 AromaticContact CD1-CD2 3.51Å; F115-F178 HydrophobicContact CD1-CD2 3.51Å; F115-F178 HydrophobicContact CD1-CE2 4.14Å; F115-F178 HydrophobicContact CD2-CD2 4.26Å; F115-F178 HydrophobicContact CD2-CE2 4.14Å; F115-F178 HydrophobicContact CE1-CD2 4.05Å; F115-F178 HydrophobicContact CE1-CE2 4.45Å; F115-F178 HydrophobicContact CE2-CE2 4.5Å; F115-F178 AromaticContact CG-CD2 3.61Å; F115-F178 HydrophobicContact CG-CD2 3.61Å; F115-F178 AromaticContact CG-CE2 3.95Å; F115-F178 HydrophobicContact CG-CE2 3.95Å
116	I	91.4	Very high	94.6	Very high	59 Å²	59	57.7 Å²	57.7	30%	0.303	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-101.9	116.3	173.3	-58.4	173	0	0	0	107.6	L114 E119 T120 L145	L114-I116 PolarHBondContact O-N 2.73Å; I116-E119 HydrophobicContact CB-CB 4.07Å; I116-E119 HydrophobicContact CG2-CB 3.87Å; I116-E119 HydrophobicContact CG2-CG 3.88Å; I116-E119 PolarHBondContact O-N 3.39Å; I116-T120 PolarHBondContact N-OG1 3.37Å; I116-T120 VanDerWaalsContact N-OG1 3.12Å; I116-T120 WeakPolarHBondContact O-CB 3.46Å; I116-T120 PolarHBondContact O-N 3.43Å; I116-T120 PolarHBondContact O-OG1 3.26Å; I116-L145 HydrophobicContact CD1-CD1 4.24Å; I116-L145 HydrophobicContact CG1-CB 4.2Å; I116-L145 HydrophobicContact CG1-CD1 3.58Å
117	P	88.9	Confident	94.5	Very high	7 Å²	7	59.1 Å²	59.1	5%	0.045	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	140.6	173.8	-27.6	37	0	0	0	111.8	F115 E119 C176	F115-P117 HydrophobicContact CD1-CG 4.48Å; P117-E119 PolarHBondContact O-N 2.68Å; P117-C176 WeakPolarHBondContact CG-O 3.44Å
118	E	86.3	Confident	94.4	Very high	159 Å²	159	58 Å²	58	74%	0.743	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	-23	-176.7	-52.2	-176.7	178	0	0	116.7	T147	E118-T147 HydrophobicContact CB-CG2 4.19Å; E118-T147 VanDerWaalsContact CD-CG2 3.4Å; E118-T147 HydrophobicContact CG-CG2 3.83Å; E118-T147 WeakPolarHBondContact OE2-CG2 3.32Å
119	E	89.7	Confident	94.3	Very high	114 Å²	114	58.2 Å²	58.2	53%	0.533	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-33.8	179.3	-63.1	-66.5	158.8	0	0	112.6	I116 P117	I116-E119 HydrophobicContact CB-CB 4.07Å; I116-E119 HydrophobicContact CG2-CB 3.87Å; I116-E119 HydrophobicContact CG2-CG 3.88Å; I116-E119 PolarHBondContact O-N 3.39Å; P117-E119 PolarHBondContact O-N 2.68Å
120	T	92.1	Very high	94.2	Very high	47 Å²	47	61 Å²	61	29%	0.288	32%	0.318	S	S	.	.	S	Bend	trans	-97.6	126.7	179.9	-50.6	0	0	0	0	110.5	F115 I116 F122	F115-T120 HydrophobicContact CD2-CG2 3.5Å; F115-T120 VanDerWaalsContact CD2-CG2 3.5Å; F115-T120 HydrophobicContact CE2-CG2 3.66Å; F115-T120 VanDerWaalsContact CE2-O 3.31Å; F115-T120 WeakPolarHBondContact CE2-O 3.23Å; F115-T120 HydrophobicContact CG-CG2 4.32Å; F115-T120 WeakPolarHBondContact CZ-O 3.21Å; I116-T120 PolarHBondContact N-OG1 3.37Å; I116-T120 VanDerWaalsContact N-OG1 3.12Å; I116-T120 WeakPolarHBondContact O-CB 3.46Å; I116-T120 PolarHBondContact O-N 3.43Å; I116-T120 PolarHBondContact O-OG1 3.26Å; T120-F122 PolarHBondContact O-N 2.76Å
121	E	93.4	Very high	94	Very high	143 Å²	143	59.4 Å²	59.4	67%	0.668	31%	0.309	S	S	*	.			trans	-66.1	123.3	175.1	-68.1	-174.9	-170.5	0	0	111.1	K123 V124	E121-K123 PolarHBondContact O-N 3.37Å; E121-V124 WeakPolarHBondContact O-CG2 3.49Å; E121-V124 PolarHBondContact O-N 3.3Å; E121-V124 VanDerWaalsContact O-N 3.09Å
122	F	93.5	Very high	93.9	Very high	54 Å²	54	57.9 Å²	57.9	24%	0.237	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-20	178.7	-159.7	-92.5	0	0	0	113.3	F115 T120 V124 I125 L126 F178 P182 V183	F115-F122 HydrophobicContact CE2-CB 4.47Å; F115-F122 HydrophobicContact CE2-CD2 4.14Å; F115-F122 HydrophobicContact CZ-CB 4.38Å; F115-F122 AromaticContact CZ-CD2 3.87Å; F115-F122 HydrophobicContact CZ-CD2 3.87Å; T120-F122 PolarHBondContact O-N 2.76Å; F122-V124 PolarHBondContact O-N 3.24Å; F122-I125 WeakPolarHBondContact O-CB 3.43Å; F122-I125 PolarHBondContact O-N 2.75Å; F122-L126 HydrophobicContact CD1-CD1 4.19Å; F122-L126 HydrophobicContact CD1-CD2 4.17Å; F122-L126 HydrophobicContact CD1-CG 3.87Å; F122-L126 HydrophobicContact CE1-CD2 3.87Å; F122-L126 HydrophobicContact CE1-CG 4.08Å; F122-L126 PolarHBondContact O-N 3.33Å; F122-F178 HydrophobicContact CD2-CE2 4.13Å; F122-F178 HydrophobicContact CE2-CD2 4.44Å; F122-F178 AromaticContact CE2-CE2 3.52Å; F122-F178 HydrophobicContact CE2-CE2 3.52Å; F122-F178 AromaticContact CE2-CZ 3.58Å; F122-F178 HydrophobicContact CE2-CZ 3.58Å; F122-F178 HydrophobicContact CZ-CE2 4.34Å; F122-F178 AromaticContact CZ-CZ 3.97Å; F122-F178 HydrophobicContact CZ-CZ 3.97Å; F122-P182 HydrophobicContact CE1-CB 3.75Å; F122-P182 HydrophobicContact CE1-CG 4.1Å; F122-P182 HydrophobicContact CZ-CB 3.82Å; F122-P182 HydrophobicContact CZ-CG 3.91Å; F122-V183 HydrophobicContact CZ-CG2 4.03Å
123	K	94.4	Very high	93.8	Very high	127 Å²	127	61 Å²	61	55%	0.552	31%	0.314	S	S	*	.	H	α-helix	trans	-54.5	-34.7	174.1	-174	178.1	176.2	-175.1	0	112.7	E121 I125 L126 D127	E121-K123 PolarHBondContact O-N 3.37Å; K123-I125 PolarHBondContact O-N 2.85Å; K123-L126 PolarHBondContact O-N 2.67Å; K123-L126 VanDerWaalsContact O-N 3.12Å; K123-D127 WeakPolarHBondContact O-CB 3.48Å; K123-D127 PolarHBondContact O-N 2.99Å
124	V	94.8	Very high	93.6	Very high	67 Å²	67	64.8 Å²	64.8	41%	0.406	34%	0.335	S	S	.	.	H	α-helix	trans	-58.2	-37.5	177.4	179.4	0	0	0	0	111.4	L111 E121 F122 A128	L111-V124 HydrophobicContact CD2-CG1 4.11Å; E121-V124 WeakPolarHBondContact O-CG2 3.49Å; E121-V124 PolarHBondContact O-N 3.3Å; E121-V124 VanDerWaalsContact O-N 3.09Å; F122-V124 PolarHBondContact O-N 3.24Å; V124-A128 PolarHBondContact O-N 3.28Å
125	I	96.8	Very high	93.6	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-73.7	-42.5	176.9	-56.6	-62	0	0	0	111	L108 L111 I112 F115 F122 K123 D127 A128 L129 F178 V183	L108-I125 HydrophobicContact CD1-CG2 4.19Å; L111-I125 HydrophobicContact CB-CD1 3.66Å; I112-I125 HydrophobicContact CG1-CD1 4.14Å; F115-I125 HydrophobicContact CD2-CD1 4.4Å; F115-I125 HydrophobicContact CD2-CG1 4.05Å; F115-I125 HydrophobicContact CE2-CG1 4.33Å; F122-I125 WeakPolarHBondContact O-CB 3.43Å; F122-I125 PolarHBondContact O-N 2.75Å; K123-I125 PolarHBondContact O-N 2.85Å; I125-D127 PolarHBondContact O-N 2.63Å; I125-A128 PolarHBondContact O-N 3.13Å; I125-L129 HydrophobicContact CG2-CD1 3.96Å; I125-L129 HydrophobicContact CG2-CG 4.27Å; I125-L129 WeakPolarHBondContact O-CB 2.98Å; I125-L129 WeakPolarHBondContact O-CG 3.45Å; I125-L129 PolarHBondContact O-N 3Å; I125-F178 HydrophobicContact CD1-CE2 4.4Å; I125-F178 HydrophobicContact CG1-CE2 3.95Å; I125-F178 HydrophobicContact CG1-CZ 4.27Å; I125-F178 HydrophobicContact CG2-CZ 4.18Å; I125-V183 HydrophobicContact CG2-CG2 3.85Å
126	L	95.6	Very high	93.7	Very high	82 Å²	82	62.8 Å²	62.8	43%	0.429	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-42.9	178.5	-64.4	178.6	0	0	0	112.1	F122 K123 A128 L129 A130	F122-L126 HydrophobicContact CD1-CD1 4.19Å; F122-L126 HydrophobicContact CD1-CD2 4.17Å; F122-L126 HydrophobicContact CD1-CG 3.87Å; F122-L126 HydrophobicContact CE1-CD2 3.87Å; F122-L126 HydrophobicContact CE1-CG 4.08Å; F122-L126 PolarHBondContact O-N 3.33Å; K123-L126 PolarHBondContact O-N 2.67Å; K123-L126 VanDerWaalsContact O-N 3.12Å; L126-A128 VanDerWaalsContact C-N 3.31Å; L126-A128 PolarHBondContact O-N 2.86Å; L126-L129 HydrophobicContact CD2-CD1 4.45Å; L126-L129 PolarHBondContact O-N 3.13Å; L126-A130 PolarHBondContact O-N 2.82Å
127	D	94.9	Very high	94	Very high	89 Å²	89	63.2 Å²	63.2	48%	0.476	32%	0.321	S	S	.	.	H	α-helix	trans	-63.7	-38.9	176.9	-70.1	-14.6	0	0	0	110.7	K123 I125 L131	K123-D127 WeakPolarHBondContact O-CB 3.48Å; K123-D127 PolarHBondContact O-N 2.99Å; I125-D127 PolarHBondContact O-N 2.63Å; D127-L131 WeakPolarHBondContact O-CG 3.37Å
128	A	95.9	Very high	94.4	Very high	11 Å²	11	64.8 Å²	64.8	9%	0.091	33%	0.326	C	S	.	.	H	α-helix	trans	-66.4	-44.5	173.5	0	0	0	0	0	112.2	L108 L111 V124 I125 L126 A130 L131 C132	L108-A128 HydrophobicContact CD1-CB 4.47Å; L111-A128 HydrophobicContact CD1-CB 3.57Å; V124-A128 PolarHBondContact O-N 3.28Å; I125-A128 PolarHBondContact O-N 3.13Å; L126-A128 VanDerWaalsContact C-N 3.31Å; L126-A128 PolarHBondContact O-N 2.86Å; A128-A130 VanDerWaalsContact C-N 3.31Å; A128-A130 PolarHBondContact O-N 3.45Å; A128-L131 WeakPolarHBondContact O-CB 2.71Å; A128-L131 PolarHBondContact O-N 3.29Å; A128-C132 PolarHBondContact O-N 3.11Å; A128-C132 PolarHBondContact O-SG 2.88Å
129	L	96.1	Very high	94.9	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-60.4	-38.8	178.7	-78	171.4	0	0	0	112.6	L108 I125 L126 L131 C132 K133 V183 L187	L108-L129 HydrophobicContact CD1-CD2 4.44Å; L108-L129 HydrophobicContact CD2-CD2 3.75Å; I125-L129 HydrophobicContact CG2-CD1 3.96Å; I125-L129 HydrophobicContact CG2-CG 4.27Å; I125-L129 WeakPolarHBondContact O-CB 2.98Å; I125-L129 WeakPolarHBondContact O-CG 3.45Å; I125-L129 PolarHBondContact O-N 3Å; L126-L129 HydrophobicContact CD2-CD1 4.45Å; L126-L129 PolarHBondContact O-N 3.13Å; L129-L131 PolarHBondContact O-N 3.29Å; L129-L131 VanDerWaalsContact O-N 3.15Å; L129-C132 PolarHBondContact O-N 3.43Å; L129-K133 VanDerWaalsContact O-CB 3.24Å; L129-K133 WeakPolarHBondContact O-CB 3.36Å; L129-K133 WeakPolarHBondContact O-CG 3.45Å; L129-K133 PolarHBondContact O-N 3.49Å; L129-V183 HydrophobicContact CD1-CB 4.39Å; L129-V183 HydrophobicContact CD1-CG1 4.3Å; L129-V183 HydrophobicContact CD1-CG2 4.13Å; L129-V183 HydrophobicContact CD2-CG1 4.19Å; L129-L187 HydrophobicContact CD2-CD1 4.48Å; L129-L187 HydrophobicContact CD2-CD2 3.59Å; L129-L187 HydrophobicContact CD2-CG 4.03Å
130	A	95.3	Very high	95.3	Very high	75 Å²	75	54.6 Å²	54.6	62%	0.62	28%	0.28	S	S	*	.	H	α-helix	trans	-55.8	-31.6	175.8	0	0	0	0	0	112.4	L126 A128	L126-A130 PolarHBondContact O-N 2.82Å; A128-A130 VanDerWaalsContact C-N 3.31Å; A128-A130 PolarHBondContact O-N 3.45Å
131	L	94.4	Very high	95.6	Very high	39 Å²	39	52.4 Å²	52.4	20%	0.204	27%	0.266	C	S	.	.	H	α-helix	trans	-90.2	-34	-179.7	-55.5	177.5	0	0	0	112.9	L66 H67 A70 F104 D127 A128 L129	L66-L131 HydrophobicContact CB-CD1 3.95Å; H67-L131 HydrophobicContact CB-CD1 4.49Å; H67-L131 HydrophobicContact CB-CD2 4.23Å; A70-L131 HydrophobicContact CB-CB 4.04Å; A70-L131 HydrophobicContact CB-CD2 4.17Å; F104-L131 HydrophobicContact CE1-CB 4.43Å; D127-L131 WeakPolarHBondContact O-CG 3.37Å; A128-L131 WeakPolarHBondContact O-CB 2.71Å; A128-L131 PolarHBondContact O-N 3.29Å; L129-L131 PolarHBondContact O-N 3.29Å; L129-L131 VanDerWaalsContact O-N 3.15Å
132	C	94.9	Very high	95.8	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.02	25%	0.248	C	C	.	.	H	α-helix	trans	-111	-14.4	-164.8	75.7	0	0	0	0	116	F104 A128 L129 N134 Y135 V136	F104-C132 HydrophobicContact CB-CB 3.77Å; F104-C132 HydrophobicContact CD1-CB 3.42Å; F104-C132 VanDerWaalsContact CD1-CB 3.42Å; F104-C132 HydrophobicContact CE1-CB 4.18Å; F104-C132 HydrophobicContact CG-CB 3.67Å; A128-C132 PolarHBondContact O-N 3.11Å; A128-C132 PolarHBondContact O-SG 2.88Å; L129-C132 PolarHBondContact O-N 3.43Å; C132-N134 PolarHBondContact O-N 3Å; C132-Y135 PolarHBondContact O-N 3.05Å; C132-V136 HydrophobicContact CB-CG2 4.28Å; C132-V136 PolarHBondContact O-N 3.3Å
133	K	94.1	Very high	95.9	Very high	65 Å²	65	46.4 Å²	46.4	28%	0.283	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-31.6	-168.2	65.8	-173.2	-170.1	179.4	0	115.5	L129 Y135 E186 L187	L129-K133 VanDerWaalsContact O-CB 3.24Å; L129-K133 WeakPolarHBondContact O-CB 3.36Å; L129-K133 WeakPolarHBondContact O-CG 3.45Å; L129-K133 PolarHBondContact O-N 3.49Å; K133-Y135 VanDerWaalsContact C-N 3.26Å; K133-Y135 PolarHBondContact O-N 2.82Å; K133-E186 IonicContact NZ-OE2 2.85Å; K133-E186 PolarHBondContact NZ-OE2 3.46Å; K133-L187 HydrophobicContact CB-CD2 3.98Å
134	N	93.4	Very high	95.9	Very high	100 Å²	100	40.3 Å²	40.3	54%	0.535	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-13.9	179.5	-64.1	-32.4	0	0	0	113.8	C132	C132-N134 PolarHBondContact O-N 3Å
135	Y	94.4	Very high	95.7	Very high	73 Å²	73	38.8 Å²	38.8	29%	0.286	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-18.7	-177.1	-58.9	-70.7	0	0	0	112.8	K100 R101 F104 C132 K133 K137	K100-Y135 HydrophobicContact CD-CE1 4.14Å; K100-Y135 WeakPolarHBondContact CE-OH 3.28Å; K100-Y135 PolarHBondContact NZ-OH 3.46Å; K100-Y135 VanDerWaalsContact NZ-OH 3.13Å; R101-Y135 WeakPolarHBondContact CG-O 3.19Å; F104-Y135 AromaticContact CD2-CD2 3.68Å; F104-Y135 HydrophobicContact CD2-CD2 3.68Å; F104-Y135 HydrophobicContact CD2-CE2 4.29Å; F104-Y135 HydrophobicContact CD2-CG 4.07Å; F104-Y135 AromaticContact CE2-CD2 3.95Å; F104-Y135 HydrophobicContact CE2-CD2 3.95Å; F104-Y135 HydrophobicContact CE2-CE2 4.1Å; F104-Y135 HydrophobicContact CG-CD2 4.49Å; C132-Y135 PolarHBondContact O-N 3.05Å; K133-Y135 VanDerWaalsContact C-N 3.26Å; K133-Y135 PolarHBondContact O-N 2.82Å; Y135-K137 PolarHBondContact O-N 3.37Å
136	V	96.6	Very high	95.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.			trans	-84.1	106.5	-175	178.6	0	0	0	0	110.2	E105 L108 C132 L139 L187 L190	E105-V136 HydrophobicContact CG-CB 4.31Å; E105-V136 HydrophobicContact CG-CG1 4.27Å; E105-V136 HydrophobicContact CG-CG2 4.19Å; L108-V136 HydrophobicContact CD2-CG1 4.47Å; L108-V136 HydrophobicContact CD2-CG2 4.07Å; C132-V136 HydrophobicContact CB-CG2 4.28Å; C132-V136 PolarHBondContact O-N 3.3Å; V136-L139 HydrophobicContact CG1-CD2 3.79Å; V136-L139 HydrophobicContact CG1-CG 3.9Å; V136-L187 HydrophobicContact CB-CD2 3.89Å; V136-L187 HydrophobicContact CG1-CD1 3.88Å; V136-L187 HydrophobicContact CG1-CD2 4.11Å; V136-L187 HydrophobicContact CG2-CD2 4.4Å; V136-L190 HydrophobicContact CG1-CD1 4.05Å
137	K	97.5	Very high	94.5	Very high	68 Å²	68	37.2 Å²	37.2	30%	0.296	20%	0.198	S	C	.	.	S	Bend	trans	-106.7	-20.1	168.6	-56.1	-175.2	-177.6	171.3	0	112.5	D96 E105 Y135 H189 E191 E192	D96-K137 IonicContact OD2-NZ 3.67Å; D96-K137 PolarHBondContact OD2-NZ 3.05Å; E105-K137 PolarHBondContact OE1-N 3.08Å; Y135-K137 PolarHBondContact O-N 3.37Å; K137-H189 WeakPolarHBondContact CA-O 3.47Å; K137-E191 HydrophobicContact CB-CG 4.34Å; K137-E191 PolarHBondContact O-N 2.89Å; K137-E192 PolarHBondContact O-N 2.94Å
138	R	97.9	Very high	92.9	Very high	40 Å²	40	36.7 Å²	36.7	15%	0.151	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	137.6	176.9	179.4	-179.2	-64.2	-167.3	3.2	110.6	E105 E192	E105-R138 WeakPolarHBondContact CG-O 3.36Å; E105-R138 PolarHBondContact OE1-N 3.06Å; R138-E192 WeakPolarHBondContact CA-O 3.31Å; R138-E192 HydrophobicContact CB-CB 4.13Å; R138-E192 HydrophobicContact CG-CB 3.94Å; R138-E192 IonicContact CZ-OE1 3.74Å; R138-E192 IonicContact CZ-OE2 2.66Å; R138-E192 VanDerWaalsContact NE-CD 3.33Å; R138-E192 IonicContact NE-OE1 3.31Å; R138-E192 IonicContact NE-OE2 3.62Å; R138-E192 PolarHBondContact NE-OE2 2.79Å; R138-E192 IonicContact NH1-OE2 2.77Å; R138-E192 IonicContact NH2-OE1 3.48Å; R138-E192 PolarHBondContact NH2-OE1 2.92Å; R138-E192 IonicContact NH2-OE2 3.5Å; R138-E192 PolarHBondContact NH2-OE2 3.18Å
139	L	98.1	Very high	91.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	118.3	164	-74.5	-177.7	0	0	0	109.5	L108 E109 I112 V136 V183 L187 L190 E192 L193 H194	L108-L139 HydrophobicContact CD2-CD2 3.94Å; L108-L139 HydrophobicContact CG-CD2 4.19Å; E109-L139 HydrophobicContact CG-CD2 4.09Å; I112-L139 HydrophobicContact CD1-CD1 4.42Å; V136-L139 HydrophobicContact CG1-CD2 3.79Å; V136-L139 HydrophobicContact CG1-CG 3.9Å; L139-V183 HydrophobicContact CD1-CG1 4.31Å; L139-L187 HydrophobicContact CD1-CD1 3.55Å; L139-L187 HydrophobicContact CG-CD1 4.21Å; L139-L190 HydrophobicContact CB-CD1 4.22Å; L139-L190 HydrophobicContact CD1-CD1 4.3Å; L139-L190 HydrophobicContact CG-CD1 3.87Å; L139-E192 PolarHBondContact N-O 2.84Å; L139-L193 HydrophobicContact CB-CD1 3.85Å; L139-L193 HydrophobicContact CD1-CD1 4.39Å; L139-H194 PolarHBondContact O-N 2.93Å
140	N	97.8	Very high	88.7	Confident	59 Å²	59	50.7 Å²	50.7	32%	0.316	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	93.2	176.9	-177.5	54.4	0	0	0	110.9	E109 H194	E109-N140 WeakPolarHBondContact OE1-CB 3.46Å; E109-N140 PolarHBondContact OE1-N 3.38Å; N140-H194 WeakPolarHBondContact OD1-CB 3.38Å; N140-H194 PolarHBondContact OD1-ND1 3.14Å
141	I	98.1	Very high	86	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	112.8	-178.8	-52.6	-55.2	0	0	0	108.9	E109 I112 E113 Q143 L144 F180 H194 L195 V196	E109-I141 HydrophobicContact CB-CD1 4.15Å; E109-I141 HydrophobicContact CG-CD1 4.09Å; I112-I141 HydrophobicContact CB-CD1 3.9Å; I112-I141 HydrophobicContact CD1-CD1 4.2Å; I112-I141 HydrophobicContact CG2-CD1 3.74Å; I112-I141 HydrophobicContact CG2-CG1 4.18Å; I112-I141 HydrophobicContact CG2-CG2 4.34Å; E113-I141 HydrophobicContact CG-CG2 4.11Å; I141-Q143 WeakPolarHBondContact CG2-O 3.31Å; I141-L144 HydrophobicContact CG2-CD1 4.48Å; I141-L144 HydrophobicContact CG2-CD2 3.69Å; I141-L144 HydrophobicContact CG2-CG 3.8Å; I141-F180 HydrophobicContact CG1-CE1 4.09Å; I141-F180 HydrophobicContact CG1-CZ 4.06Å; I141-H194 PolarHBondContact N-O 3.03Å; I141-L195 HydrophobicContact CB-CD2 4.01Å; I141-L195 HydrophobicContact CG1-CD2 4.07Å; I141-L195 CarbonylContact O-C 3.55Å; I141-V196 PolarHBondContact O-N 3.34Å
142	T	96.6	Very high	83.2	Confident	45 Å²	45	60 Å²	60	28%	0.276	29%	0.293	S	S	.	.			trans	-103.9	0.3	-174.3	59.4	0	0	0	0	113.3	E113 K200	E113-T142 WeakPolarHBondContact OE1-CB 3.07Å; E113-T142 PolarHBondContact OE1-N 3.22Å; E113-T142 PolarHBondContact OE1-OG1 3.16Å; T142-K200 WeakPolarHBondContact OG1-CE 3.35Å; T142-K200 PolarHBondContact OG1-NZ 2.73Å
143	Q	95.8	Very high	80.3	Confident	26 Å²	26	69.2 Å²	69.2	12%	0.121	33%	0.332	C	S	.	.			trans	-157.7	156.5	167.3	67.7	-171.8	-39.8	0	0	110.3	E113 I141 T198 K200	E113-Q143 HydrophobicContact CB-CG 3.81Å; E113-Q143 HydrophobicContact CG-CG 3.88Å; E113-Q143 PolarHBondContact OE2-NE2 2.92Å; I141-Q143 WeakPolarHBondContact CG2-O 3.31Å; Q143-T198 CarbonylContact C-O 3.2Å; Q143-T198 WeakPolarHBondContact CA-O 3.42Å; Q143-T198 WeakPolarHBondContact CB-O 3.35Å; Q143-K200 HydrophobicContact CB-CD 4.38Å; Q143-K200 HydrophobicContact CB-CG 4.12Å; Q143-K200 HydrophobicContact CG-CD 4.41Å
144	L	94.3	Very high	77.4	Confident	0 Å²	0	69 Å²	69	0%	0	35%	0.349	C	S	.	.			trans	-136.6	127.5	169.7	-75.1	169.5	0	0	0	108.7	I112 I141 H177 F178 F180 Y197 T198 I199	I112-L144 HydrophobicContact CG2-CD2 4.09Å; I141-L144 HydrophobicContact CG2-CD1 4.48Å; I141-L144 HydrophobicContact CG2-CD2 3.69Å; I141-L144 HydrophobicContact CG2-CG 3.8Å; L144-H177 HydrophobicContact CB-CB 4.29Å; L144-H177 HydrophobicContact CD1-CB 4.44Å; L144-F178 HydrophobicContact CD2-CB 3.72Å; L144-F180 HydrophobicContact CD1-CE2 3.86Å; L144-F180 HydrophobicContact CD1-CZ 4.25Å; L144-F180 HydrophobicContact CD2-CE2 4.21Å; L144-F180 HydrophobicContact CD2-CZ 4.1Å; L144-Y197 HydrophobicContact CD1-CD1 3.64Å; L144-Y197 HydrophobicContact CD1-CD2 4.25Å; L144-Y197 HydrophobicContact CD1-CE1 3.45Å; L144-Y197 VanDerWaalsContact CD1-CE1 3.45Å; L144-Y197 HydrophobicContact CD1-CE2 4.07Å; L144-Y197 HydrophobicContact CD1-CG 4.04Å; L144-T198 PolarHBondContact N-O 3.23Å; L144-T198 VanDerWaalsContact N-O 3.08Å; L144-I199 WeakPolarHBondContact O-CG1 3.32Å
145	L	91.1	Very high	74.9	Confident	34 Å²	34	75 Å²	75	18%	0.178	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-82.1	149.5	176.1	-55.2	177.5	0	0	0	109.7	I116 I199	I116-L145 HydrophobicContact CD1-CD1 4.24Å; I116-L145 HydrophobicContact CG1-CB 4.2Å; I116-L145 HydrophobicContact CG1-CD1 3.58Å; L145-I199 HydrophobicContact CD2-CD1 4.22Å; L145-I199 HydrophobicContact CD2-CG1 4.32Å; L145-I199 HydrophobicContact CD2-CG2 4.21Å
146	L	86.3	Confident	72.2	Confident	23 Å²	23	78.4 Å²	78.4	12%	0.12	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-101.1	164	177	-50.6	113.5	0	0	0	110.8	S148 I175 H177 I199 M210	L146-S148 PolarHBondContact O-N 3.32Å; L146-I175 HydrophobicContact CB-CG2 4.37Å; L146-I175 HydrophobicContact CD2-CG2 3.27Å; L146-I175 HydrophobicContact CG-CG2 4.43Å; L146-H177 WeakPolarHBondContact CD2-CE1 3.5Å; L146-H177 WeakPolarHBondContact CD2-NE2 3.19Å; L146-H177 VanDerWaalsContact CG-NE2 3.33Å; L146-H177 WeakPolarHBondContact CG-NE2 3.45Å; L146-I199 HydrophobicContact CD1-CD1 3.5Å; L146-I199 VanDerWaalsContact CD1-CD1 3.5Å; L146-I199 HydrophobicContact CD1-CG1 4.35Å; L146-M210 HydrophobicContact CD1-CB 3.78Å; L146-M210 HydrophobicContact CD1-CG 3.72Å
147	T	80.6	Confident	69.7	Low	27 Å²	27	85.3 Å²	85.3	17%	0.166	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-51.4	131.7	168.4	-41	0	0	0	0	111.1	E118 R149 C176	E118-T147 HydrophobicContact CB-CG2 4.19Å; E118-T147 VanDerWaalsContact CD-CG2 3.4Å; E118-T147 HydrophobicContact CG-CG2 3.83Å; E118-T147 WeakPolarHBondContact OE2-CG2 3.32Å; T147-R149 PolarHBondContact O-N 3.08Å; T147-C176 PolarHBondContact N-O 3.33Å; T147-C176 PolarHBondContact OG1-O 2.85Å; T147-C176 PolarHBondContact OG1-SG 2.86Å; T147-C176 VanDerWaalsContact OG1-SG 3.36Å
148	S	62.7	Low	67	Low	79 Å²	79	88.8 Å²	88.8	55%	0.552	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-72.9	117.8	178.7	-151.7	0	0	0	0	110.2	L146 K150	L146-S148 PolarHBondContact O-N 3.32Å; S148-K150 PolarHBondContact O-N 2.89Å
149	R	59	Low	64.3	Low	135 Å²	135	94.6 Å²	94.6	51%	0.509	48%	0.475	S	S	.	.			trans	-58.6	109.4	167.9	-91.7	-178.9	170.2	171.7	-4.2	109	T147 F151 D172 E207	T147-R149 PolarHBondContact O-N 3.08Å; R149-F151 VanDerWaalsContact C-N 3.35Å; R149-F151 PolarHBondContact O-N 3.18Å; R149-D172 IonicContact NH2-OD2 2.84Å; R149-E207 IonicContact NH1-OE1 3.77Å; R149-E207 PolarHBondContact NH1-OE1 3.07Å; R149-E207 IonicContact NH1-OE2 3.65Å; R149-E207 PolarHBondContact NH1-OE2 3.27Å
150	K	44.7	Very low	61.6	Low	173 Å²	173	102.2 Å²	102.2	75%	0.752	52%	0.515	S	S	*	.			trans	-68.7	99.7	156	-74.2	-179.7	-178.1	166.7	0	106.6	S148 V152	S148-K150 PolarHBondContact O-N 2.89Å; K150-V152 PolarHBondContact O-N 3.37Å
151	F	38.7	Very low	58.7	Low	174 Å²	174	108.3 Å²	108.3	76%	0.763	54%	0.542	S	S	*	.			trans	-53.3	105.1	166.7	-88.2	-90.5	0	0	0	108.2	R149 K153	R149-F151 VanDerWaalsContact C-N 3.35Å; R149-F151 PolarHBondContact O-N 3.18Å; F151-K153 PolarHBondContact O-N 2.78Å
152	V	34.5	Very low	55.8	Low	135 Å²	135	115.8 Å²	115.8	82%	0.818	58%	0.58	S	S	*	*			trans	-69.7	91.9	160.3	-177.9	0	0	0	0	105.1	K150 G154	K150-V152 PolarHBondContact O-N 3.37Å; V152-G154 PolarHBondContact O-N 2.91Å
153	K	34.7	Very low	53	Low	197 Å²	197	117.7 Å²	117.7	86%	0.857	60%	0.601	S	S	*	*			trans	-66.4	80.8	158.3	-100.9	-175.8	175.7	176.5	0	106.7	F151 R155	F151-K153 PolarHBondContact O-N 2.78Å; K153-R155 VanDerWaalsContact C-N 3.3Å; K153-R155 PolarHBondContact O-N 2.77Å
154	G	33	Very low	49.9	Very low	61 Å²	61	122.1 Å²	122.1	63%	0.629	63%	0.63	S	S	*	*			trans	-65.7	98.4	156.1	0	0	0	0	0	106.6	V152 D156	V152-G154 PolarHBondContact O-N 2.91Å; G154-D156 PolarHBondContact O-N 3.17Å
155	R	40.5	Very low	47.2	Very low	227 Å²	227	129.9 Å²	129.9	86%	0.857	67%	0.67	S	S	*	*			trans	-60.6	114.1	145.4	-70.8	176.4	-175.7	164.4	1	104.4	K153	K153-R155 VanDerWaalsContact C-N 3.3Å; K153-R155 PolarHBondContact O-N 2.77Å
156	D	38.3	Very low	44.3	Very low	143 Å²	143	132.9 Å²	132.9	77%	0.765	69%	0.694	S	S	*	*				178	112.8	123.2	-78.1	-15.5	0	0	0	108.1	G154	G154-D156 PolarHBondContact O-N 3.17Å
157	D	43.4	Very low	42	Very low	146 Å²	146	138.8 Å²	138.8	78%	0.781	73%	0.726	S	S	*	*			trans	40.4	130.9	145.3	-58.6	-20.5	0	0	0	122
158	D	41.1	Very low	40	Very low	140 Å²	140	145.8 Å²	145.8	75%	0.749	76%	0.757	S	S	*	*			trans	84.8	114.2	144.9	-79.2	-9	0	0	0	121
159	Q	40.8	Very low	39.2	Very low	163 Å²	163	149.4 Å²	149.4	76%	0.762	77%	0.765	S	S	*	*			trans	95.8	109.5	142.6	-64.4	171.7	38.4	0	0	118.9
160	N	42.6	Very low	38.9	Very low	159 Å²	159	151.5 Å²	151.5	85%	0.85	78%	0.781	S	S	*	*			trans	35.6	87.8	135.2	-77.4	-12.4	0	0	0	117.2
161	E	36.8	Very low	39.4	Very low	187 Å²	187	144.7 Å²	144.7	87%	0.874	75%	0.752	S	S	*	*			trans	-125	99.8	145.1	-78.8	-172.3	160.1	0	0	108.9	A163	E161-A163 PolarHBondContact O-N 3.01Å
162	I	37.3	Very low	40.6	Very low	157 Å²	157	139.2 Å²	139.2	81%	0.805	73%	0.731	S	S	*	*			trans	-60.4	101.8	151.4	-65.9	171.7	0	0	0	104.1	T164	I162-T164 VanDerWaalsContact C-N 3.32Å; I162-T164 PolarHBondContact O-N 3.1Å
163	A	36.8	Very low	41.8	Very low	86 Å²	86	138.1 Å²	138.1	71%	0.711	73%	0.727	S	S	*	*			trans	-57.6	100	174.7	0	0	0	0	0	108.1	E161 L165	E161-A163 PolarHBondContact O-N 3.01Å; A163-L165 PolarHBondContact O-N 2.94Å
164	T	31.2	Very low	43.4	Very low	119 Å²	119	132 Å²	132	73%	0.73	71%	0.709	S	S	*	*			trans	-55.9	110.4	163.5	30.5	0	0	0	0	107.1	I162 S166	I162-T164 VanDerWaalsContact C-N 3.32Å; I162-T164 PolarHBondContact O-N 3.1Å; T164-S166 PolarHBondContact O-N 2.71Å
165	L	36.3	Very low	45.3	Very low	162 Å²	162	130.3 Å²	130.3	85%	0.848	69%	0.685	S	S	*	*			trans	-63.2	75.1	165.6	-70.3	160.2	0	0	0	108.5	A163 N167	A163-L165 PolarHBondContact O-N 2.94Å; L165-N167 PolarHBondContact O-N 3.23Å
166	S	31.7	Very low	47.1	Very low	98 Å²	98	120.1 Å²	120.1	69%	0.685	65%	0.648	S	S	*	*			trans	-82.5	105.5	163.7	50.2	0	0	0	0	107.5	T164 E168	T164-S166 PolarHBondContact O-N 2.71Å; S166-E168 PolarHBondContact O-N 3.05Å
167	N	37.6	Very low	49.6	Very low	146 Å²	146	113.6 Å²	113.6	78%	0.781	61%	0.614	S	S	*	*			trans	-67.7	64.8	178.1	-69.1	-32.6	0	0	0	112.7	L165	L165-N167 PolarHBondContact O-N 3.23Å
168	E	37.9	Very low	52	Low	175 Å²	175	106.8 Å²	106.8	82%	0.818	58%	0.577	S	S	*	*			trans	-132.4	79.1	160.7	-67.6	-168.8	173.8	0	0	107	S166 E170	S166-E168 PolarHBondContact O-N 3.05Å; E168-E170 PolarHBondContact O-N 2.83Å
169	E	47.1	Very low	54.5	Low	154 Å²	154	103.9 Å²	103.9	72%	0.72	56%	0.561	S	S	*	*			trans	-69.7	81.3	174.6	-67.7	179.5	168.9	0	0	109.1
170	E	51.3	Low	57	Low	180 Å²	180	96.2 Å²	96.2	84%	0.841	53%	0.526	S	S	*	.			trans	-68.8	128	157.6	-73.1	-169.3	157.4	0	0	108.2	E168 D172	E168-E170 PolarHBondContact O-N 2.83Å; E170-D172 PolarHBondContact O-N 3.14Å
171	D	56.3	Low	59.4	Low	30 Å²	30	89.6 Å²	89.6	16%	0.16	50%	0.495	C	S	.	.			trans	-54.6	127.8	177.6	-77.1	-32.4	0	0	0	109.8	P173 Q212 T214 D215	D171-P173 VanDerWaalsContact O-CD 3.27Å; D171-P173 WeakPolarHBondContact O-CD 3.18Å; D171-P173 VanDerWaalsContact O-N 3.09Å; D171-Q212 PolarHBondContact OD1-NE2 2.8Å; D171-T214 VanDerWaalsContact OD2-CA 3.23Å; D171-T214 WeakPolarHBondContact OD2-CA 3.09Å; D171-D215 PolarHBondContact OD2-N 3.39Å
172	D	62.6	Low	62.1	Low	58 Å²	58	83.2 Å²	83.2	31%	0.31	47%	0.469	S	S	.	.			trans	-57.4	115.2	170.7	178.6	-14.4	0	0	0	108.5	R149 E170 S174 I175	R149-D172 IonicContact NH2-OD2 2.84Å; E170-D172 PolarHBondContact O-N 3.14Å; D172-S174 PolarHBondContact O-N 2.91Å; D172-S174 WeakPolarHBondContact OD1-CB 3.3Å; D172-S174 PolarHBondContact OD1-N 3.47Å; D172-S174 PolarHBondContact OD1-OG 2.95Å; D172-S174 PolarHBondContact OD2-OG 3.35Å; D172-I175 HydrophobicContact CB-CD1 3.86Å; D172-I175 HydrophobicContact CB-CG1 3.98Å; D172-I175 PolarHBondContact O-N 3.08Å
173	P	61.1	Low	64.8	Low	113 Å²	113	75.7 Å²	75.7	73%	0.734	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-12	-173.1	24	-32	0	0	0	113.6	D171	D171-P173 VanDerWaalsContact O-CD 3.27Å; D171-P173 WeakPolarHBondContact O-CD 3.18Å; D171-P173 VanDerWaalsContact O-N 3.09Å
174	S	67.4	Low	67.5	Low	69 Å²	69	71.8 Å²	71.8	48%	0.483	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-19	175.6	71.3	0	0	0	0	113.9	D172	D172-S174 PolarHBondContact O-N 2.91Å; D172-S174 WeakPolarHBondContact OD1-CB 3.3Å; D172-S174 PolarHBondContact OD1-N 3.47Å; D172-S174 PolarHBondContact OD1-OG 2.95Å; D172-S174 PolarHBondContact OD2-OG 3.35Å
175	I	74.1	Confident	70.4	Confident	24 Å²	24	69.4 Å²	69.4	12%	0.123	39%	0.39	C	S	.	.			trans	-82.7	127.9	-179.5	-61.6	-179.9	0	0	0	109.5	L146 D172 T214	L146-I175 HydrophobicContact CB-CG2 4.37Å; L146-I175 HydrophobicContact CD2-CG2 3.27Å; L146-I175 HydrophobicContact CG-CG2 4.43Å; D172-I175 HydrophobicContact CB-CD1 3.86Å; D172-I175 HydrophobicContact CB-CG1 3.98Å; D172-I175 PolarHBondContact O-N 3.08Å; I175-T214 HydrophobicContact CG2-CG2 4.39Å
176	C	77.3	Confident	73.2	Confident	13 Å²	13	65.7 Å²	65.7	9%	0.088	37%	0.368	C	S	.	.			trans	-145.3	155.2	172.9	64.1	0	0	0	0	111.7	P117 T147	P117-C176 WeakPolarHBondContact CG-O 3.44Å; T147-C176 PolarHBondContact N-O 3.33Å; T147-C176 PolarHBondContact OG1-O 2.85Å; T147-C176 PolarHBondContact OG1-SG 2.86Å; T147-C176 VanDerWaalsContact OG1-SG 3.36Å
177	H	91.8	Very high	76.2	Confident	7 Å²	7	61 Å²	61	3%	0.032	34%	0.336	C	S	.	.			trans	-100.2	-170.3	170.2	-63.7	95.8	0	0	0	110.5	L144 L146 D179 Y197 Q212 D217	L144-H177 HydrophobicContact CB-CB 4.29Å; L144-H177 HydrophobicContact CD1-CB 4.44Å; L146-H177 WeakPolarHBondContact CD2-CE1 3.5Å; L146-H177 WeakPolarHBondContact CD2-NE2 3.19Å; L146-H177 VanDerWaalsContact CG-NE2 3.33Å; L146-H177 WeakPolarHBondContact CG-NE2 3.45Å; H177-D179 PolarHBondContact O-N 2.79Å; H177-Y197 HydrophobicContact CB-CD1 4.26Å; H177-Y197 HydrophobicContact CB-CE1 3.97Å; H177-Y197 AromaticContact CE1-CD1 3.72Å; H177-Y197 AromaticContact CG-CD1 3.74Å; H177-Y197 AromaticContact CG-CE1 3.93Å; H177-Y197 AromaticContact ND1-CD1 3.51Å; H177-Y197 AromaticContact ND1-CE1 3.85Å; H177-Q212 PolarHBondContact CE1-O 3.09Å; H177-Q212 VanDerWaalsContact CE1-O 3.32Å; H177-D217 IonicContact CE1-OD2 3.53Å; H177-D217 IonicContact CG-OD2 3.33Å; H177-D217 PolarHBondContact N-OD1 2.78Å; H177-D217 IonicContact ND1-OD1 2.68Å; H177-D217 IonicContact ND1-OD2 2.64Å; H177-D217 PolarHBondContact ND1-OD2 3.35Å
178	F	93.4	Very high	78.7	Confident	3 Å²	3	58.9 Å²	58.9	1%	0.013	32%	0.323	C	S	.	.			trans	-55.3	126.4	171.1	-173.8	-98.3	0	0	0	112.7	I112 F115 F122 I125 L144 F180 V183	I112-F178 HydrophobicContact CD1-CE1 4.28Å; I112-F178 HydrophobicContact CG1-CE1 4.12Å; I112-F178 HydrophobicContact CG1-CE2 4.41Å; I112-F178 HydrophobicContact CG1-CZ 4.03Å; I112-F178 HydrophobicContact CG2-CB 4.42Å; I112-F178 HydrophobicContact CG2-CD1 3.78Å; I112-F178 HydrophobicContact CG2-CD2 4.34Å; I112-F178 HydrophobicContact CG2-CE1 4.13Å; I112-F178 HydrophobicContact CG2-CG 3.9Å; F115-F178 HydrophobicContact CB-CD2 3.88Å; F115-F178 HydrophobicContact CB-CE2 4.37Å; F115-F178 AromaticContact CD1-CD2 3.51Å; F115-F178 HydrophobicContact CD1-CD2 3.51Å; F115-F178 HydrophobicContact CD1-CE2 4.14Å; F115-F178 HydrophobicContact CD2-CD2 4.26Å; F115-F178 HydrophobicContact CD2-CE2 4.14Å; F115-F178 HydrophobicContact CE1-CD2 4.05Å; F115-F178 HydrophobicContact CE1-CE2 4.45Å; F115-F178 HydrophobicContact CE2-CE2 4.5Å; F115-F178 AromaticContact CG-CD2 3.61Å; F115-F178 HydrophobicContact CG-CD2 3.61Å; F115-F178 AromaticContact CG-CE2 3.95Å; F115-F178 HydrophobicContact CG-CE2 3.95Å; F122-F178 HydrophobicContact CD2-CE2 4.13Å; F122-F178 HydrophobicContact CE2-CD2 4.44Å; F122-F178 AromaticContact CE2-CE2 3.52Å; F122-F178 HydrophobicContact CE2-CE2 3.52Å; F122-F178 AromaticContact CE2-CZ 3.58Å; F122-F178 HydrophobicContact CE2-CZ 3.58Å; F122-F178 HydrophobicContact CZ-CE2 4.34Å; F122-F178 AromaticContact CZ-CZ 3.97Å; F122-F178 HydrophobicContact CZ-CZ 3.97Å; I125-F178 HydrophobicContact CD1-CE2 4.4Å; I125-F178 HydrophobicContact CG1-CE2 3.95Å; I125-F178 HydrophobicContact CG1-CZ 4.27Å; I125-F178 HydrophobicContact CG2-CZ 4.18Å; L144-F178 HydrophobicContact CD2-CB 3.72Å; F178-F180 HydrophobicContact CB-CE2 4.45Å; F178-F180 AromaticContact CD1-CD1 3.99Å; F178-F180 HydrophobicContact CD1-CD1 3.99Å; F178-F180 AromaticContact CD1-CD2 3.97Å; F178-F180 HydrophobicContact CD1-CD2 3.97Å; F178-F180 AromaticContact CD1-CE1 3.95Å; F178-F180 HydrophobicContact CD1-CE1 3.95Å; F178-F180 AromaticContact CD1-CE2 3.93Å; F178-F180 HydrophobicContact CD1-CE2 3.93Å; F178-F180 AromaticContact CD1-CG 4Å; F178-F180 HydrophobicContact CD1-CG 4Å; F178-F180 AromaticContact CD1-CZ 3.91Å; F178-F180 HydrophobicContact CD1-CZ 3.91Å; F178-F180 HydrophobicContact CE1-CD1 4.1Å; F178-F180 HydrophobicContact CE1-CE1 4.28Å; F178-F180 HydrophobicContact CE1-CG 4.33Å; F178-F180 WeakPolarHBondContact O-CD2 3.5Å; F178-F180 PolarHBondContact O-N 3.38Å; F178-V183 HydrophobicContact CE1-CB 4.48Å; F178-V183 HydrophobicContact CE1-CG2 3.6Å; F178-V183 HydrophobicContact CZ-CG2 3.51Å
179	D	92.8	Very high	81.4	Confident	78 Å²	78	54.6 Å²	54.6	42%	0.417	30%	0.303	S	S	.	.			trans	-81	108.2	173.6	-175.9	5.8	0	0	0	111.1	H177 G181	H177-D179 PolarHBondContact O-N 2.79Å; D179-G181 VanDerWaalsContact C-N 3.28Å; D179-G181 PolarHBondContact O-N 2.84Å; D179-G181 PolarHBondContact OD1-N 3.02Å
180	F	94.5	Very high	83.8	Confident	3 Å²	3	47.3 Å²	47.3	1%	0.013	27%	0.269	C	S	.	.			trans	-74.3	-13.1	177.7	-74	-85.8	0	0	0	114.1	I112 I141 L144 F178 V183 L184 L195 L221	I112-F180 HydrophobicContact CG2-CE1 4.25Å; I112-F180 HydrophobicContact CG2-CZ 4.16Å; I141-F180 HydrophobicContact CG1-CE1 4.09Å; I141-F180 HydrophobicContact CG1-CZ 4.06Å; L144-F180 HydrophobicContact CD1-CE2 3.86Å; L144-F180 HydrophobicContact CD1-CZ 4.25Å; L144-F180 HydrophobicContact CD2-CE2 4.21Å; L144-F180 HydrophobicContact CD2-CZ 4.1Å; F178-F180 HydrophobicContact CB-CE2 4.45Å; F178-F180 AromaticContact CD1-CD1 3.99Å; F178-F180 HydrophobicContact CD1-CD1 3.99Å; F178-F180 AromaticContact CD1-CD2 3.97Å; F178-F180 HydrophobicContact CD1-CD2 3.97Å; F178-F180 AromaticContact CD1-CE1 3.95Å; F178-F180 HydrophobicContact CD1-CE1 3.95Å; F178-F180 AromaticContact CD1-CE2 3.93Å; F178-F180 HydrophobicContact CD1-CE2 3.93Å; F178-F180 AromaticContact CD1-CG 4Å; F178-F180 HydrophobicContact CD1-CG 4Å; F178-F180 AromaticContact CD1-CZ 3.91Å; F178-F180 HydrophobicContact CD1-CZ 3.91Å; F178-F180 HydrophobicContact CE1-CD1 4.1Å; F178-F180 HydrophobicContact CE1-CE1 4.28Å; F178-F180 HydrophobicContact CE1-CG 4.33Å; F178-F180 WeakPolarHBondContact O-CD2 3.5Å; F178-F180 PolarHBondContact O-N 3.38Å; F180-V183 PolarHBondContact O-N 2.88Å; F180-L184 HydrophobicContact CB-CD1 3.89Å; F180-L184 HydrophobicContact CB-CG 4.08Å; F180-L184 WeakPolarHBondContact O-CB 3.13Å; F180-L184 WeakPolarHBondContact O-CG 3.32Å; F180-L184 PolarHBondContact O-N 3.24Å; F180-L195 HydrophobicContact CE1-CD2 3.78Å; F180-L195 HydrophobicContact CE2-CD2 3.87Å; F180-L195 HydrophobicContact CZ-CD2 3.37Å; F180-L221 HydrophobicContact CB-CD2 4.15Å; F180-L221 HydrophobicContact CD2-CD2 4.13Å; F180-L221 HydrophobicContact CG-CD2 4.32Å
181	G	93.1	Very high	86	Confident	20 Å²	20	41.4 Å²	41.4	21%	0.206	24%	0.242	C	C	.	.	H	α-helix	trans	-51.7	-58	-175.8	0	0	0	0	0	113.7	D179 V183 A185	D179-G181 VanDerWaalsContact C-N 3.28Å; D179-G181 PolarHBondContact O-N 2.84Å; D179-G181 PolarHBondContact OD1-N 3.02Å; G181-V183 VanDerWaalsContact C-N 3.29Å; G181-V183 PolarHBondContact O-N 3Å; G181-A185 WeakPolarHBondContact O-CB 3.3Å; G181-A185 PolarHBondContact O-N 3.41Å; G181-A185 VanDerWaalsContact O-N 3.17Å
182	P	92.6	Very high	88	Confident	52 Å²	52	41.7 Å²	41.7	34%	0.338	24%	0.242	S	C	.	.	H	α-helix	trans	-62.6	-34.2	179.5	-22.8	33.5	0	0	0	113.4	F122	F122-P182 HydrophobicContact CE1-CB 3.75Å; F122-P182 HydrophobicContact CE1-CG 4.1Å; F122-P182 HydrophobicContact CZ-CB 3.82Å; F122-P182 HydrophobicContact CZ-CG 3.91Å
183	V	94.4	Very high	89.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70.9	-51.1	-179.1	179.2	0	0	0	0	110.9	F122 I125 L129 L139 F178 F180 G181 A185 E186 L187	F122-V183 HydrophobicContact CZ-CG2 4.03Å; I125-V183 HydrophobicContact CG2-CG2 3.85Å; L129-V183 HydrophobicContact CD1-CB 4.39Å; L129-V183 HydrophobicContact CD1-CG1 4.3Å; L129-V183 HydrophobicContact CD1-CG2 4.13Å; L129-V183 HydrophobicContact CD2-CG1 4.19Å; L139-V183 HydrophobicContact CD1-CG1 4.31Å; F178-V183 HydrophobicContact CE1-CB 4.48Å; F178-V183 HydrophobicContact CE1-CG2 3.6Å; F178-V183 HydrophobicContact CZ-CG2 3.51Å; F180-V183 PolarHBondContact O-N 2.88Å; G181-V183 VanDerWaalsContact C-N 3.29Å; G181-V183 PolarHBondContact O-N 3Å; V183-A185 PolarHBondContact O-N 2.85Å; V183-E186 PolarHBondContact O-N 3.31Å; V183-E186 VanDerWaalsContact O-N 3.1Å; V183-L187 HydrophobicContact CG1-CD1 3.64Å; V183-L187 HydrophobicContact CG1-CG 4.16Å; V183-L187 WeakPolarHBondContact O-CG 3.47Å; V183-L187 PolarHBondContact O-N 3.18Å; V183-L187 VanDerWaalsContact O-N 3.12Å
184	L	94	Very high	91.5	Very high	4 Å²	4	34.1 Å²	34.1	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-67.8	-21.3	-178	-65.2	-177.6	0	0	0	112.7	F180 L190 L193 A224 F225	F180-L184 HydrophobicContact CB-CD1 3.89Å; F180-L184 HydrophobicContact CB-CG 4.08Å; F180-L184 WeakPolarHBondContact O-CB 3.13Å; F180-L184 WeakPolarHBondContact O-CG 3.32Å; F180-L184 PolarHBondContact O-N 3.24Å; L184-L190 HydrophobicContact CD2-CD2 3.23Å; L184-L193 HydrophobicContact CD1-CD2 3.97Å; L184-L193 HydrophobicContact CD2-CD2 4.32Å; L184-A224 HydrophobicContact CB-CB 4.16Å; L184-A224 HydrophobicContact CD1-CB 3.64Å; L184-A224 HydrophobicContact CG-CB 4.43Å; L184-F225 HydrophobicContact CD1-CD1 4.43Å; L184-F225 HydrophobicContact CD1-CE1 4.25Å
185	A	92.1	Very high	92.9	Very high	68 Å²	68	30.9 Å²	30.9	56%	0.562	17%	0.172	S	C	*	.	H	α-helix	trans	-69.9	-33.6	172	0	0	0	0	0	113.2	G181 V183	G181-A185 WeakPolarHBondContact O-CB 3.3Å; G181-A185 PolarHBondContact O-N 3.41Å; G181-A185 VanDerWaalsContact O-N 3.17Å; V183-A185 PolarHBondContact O-N 2.85Å
186	E	93.4	Very high	94	Very high	84 Å²	84	30.8 Å²	30.8	39%	0.393	17%	0.172	S	C	.	.	H	α-helix	trans	-89	-25.9	-179.6	-75	-68.4	141.5	0	0	113.4	K133 V183 I188	K133-E186 IonicContact NZ-OE2 2.85Å; K133-E186 PolarHBondContact NZ-OE2 3.46Å; V183-E186 PolarHBondContact O-N 3.31Å; V183-E186 VanDerWaalsContact O-N 3.1Å; E186-I188 VanDerWaalsContact C-N 3.29Å; E186-I188 PolarHBondContact O-N 2.79Å
187	L	94.7	Very high	94.9	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	17%	0.169	C	C	.	.			trans	-81.7	71.4	-177.2	-65.1	-177.3	0	0	0	112.4	L108 L129 K133 V136 L139 V183 H189 L190	L108-L187 HydrophobicContact CD2-CD1 4.43Å; L129-L187 HydrophobicContact CD2-CD1 4.48Å; L129-L187 HydrophobicContact CD2-CD2 3.59Å; L129-L187 HydrophobicContact CD2-CG 4.03Å; K133-L187 HydrophobicContact CB-CD2 3.98Å; V136-L187 HydrophobicContact CB-CD2 3.89Å; V136-L187 HydrophobicContact CG1-CD1 3.88Å; V136-L187 HydrophobicContact CG1-CD2 4.11Å; V136-L187 HydrophobicContact CG2-CD2 4.4Å; L139-L187 HydrophobicContact CD1-CD1 3.55Å; L139-L187 HydrophobicContact CG-CD1 4.21Å; V183-L187 HydrophobicContact CG1-CD1 3.64Å; V183-L187 HydrophobicContact CG1-CG 4.16Å; V183-L187 WeakPolarHBondContact O-CG 3.47Å; V183-L187 PolarHBondContact O-N 3.18Å; V183-L187 VanDerWaalsContact O-N 3.12Å; L187-H189 PolarHBondContact O-N 2.86Å; L187-H189 VanDerWaalsContact O-N 3.11Å; L187-L190 HydrophobicContact CB-CB 3.98Å; L187-L190 HydrophobicContact CD1-CD1 4.3Å; L187-L190 WeakPolarHBondContact O-CB 3.38Å; L187-L190 PolarHBondContact O-N 3.28Å; L187-L190 VanDerWaalsContact O-N 3.15Å
188	I	90.1	Very high	94.8	Very high	100 Å²	100	31.2 Å²	31.2	51%	0.513	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-10	-177.8	62.1	169	0	0	0	115	E186 T230	E186-I188 VanDerWaalsContact C-N 3.29Å; E186-I188 PolarHBondContact O-N 2.79Å; I188-T230 VanDerWaalsContact O-CG2 3.29Å; I188-T230 WeakPolarHBondContact O-CG2 3.47Å
189	H	95.1	Very high	94.7	Very high	86 Å²	86	32 Å²	32	40%	0.398	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	7.3	178.4	-62.7	-41.8	0	0	0	112.9	K137 L187 E191	K137-H189 WeakPolarHBondContact CA-O 3.47Å; L187-H189 PolarHBondContact O-N 2.86Å; L187-H189 VanDerWaalsContact O-N 3.11Å; H189-E191 WeakPolarHBondContact O-CG 3.11Å; H189-E191 PolarHBondContact O-N 2.86Å
190	L	97.4	Very high	94.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.182	C	C	.	.			trans	-66.9	120.3	-179.6	-168.4	74.8	0	0	0	110.7	V136 L139 L184 L187 L193 T230 L231	V136-L190 HydrophobicContact CG1-CD1 4.05Å; L139-L190 HydrophobicContact CB-CD1 4.22Å; L139-L190 HydrophobicContact CD1-CD1 4.3Å; L139-L190 HydrophobicContact CG-CD1 3.87Å; L184-L190 HydrophobicContact CD2-CD2 3.23Å; L187-L190 HydrophobicContact CB-CB 3.98Å; L187-L190 HydrophobicContact CD1-CD1 4.3Å; L187-L190 WeakPolarHBondContact O-CB 3.38Å; L187-L190 PolarHBondContact O-N 3.28Å; L187-L190 VanDerWaalsContact O-N 3.15Å; L190-L193 HydrophobicContact CD2-CB 4.39Å; L190-T230 CarbonylContact O-C 3.47Å; L190-T230 VanDerWaalsContact O-CB 3.27Å; L190-T230 WeakPolarHBondContact O-CB 3.38Å; L190-T230 PolarHBondContact O-OG1 2.74Å; L190-L231 HydrophobicContact CD2-CD1 4.48Å; L190-L231 PolarHBondContact O-N 3.32Å
191	E	97.5	Very high	94	Very high	57 Å²	57	41.9 Å²	41.9	27%	0.266	22%	0.221	S	C	.	.			trans	-108	-26.5	177.9	-55	-165.3	165	0	0	111.9	K137 H189 K232 V233	K137-E191 HydrophobicContact CB-CG 4.34Å; K137-E191 PolarHBondContact O-N 2.89Å; H189-E191 WeakPolarHBondContact O-CG 3.11Å; H189-E191 PolarHBondContact O-N 2.86Å; E191-K232 HydrophobicContact CB-CD 4.25Å; E191-K232 HydrophobicContact CB-CG 4.42Å; E191-K232 HydrophobicContact CG-CD 4.48Å; E191-K232 WeakPolarHBondContact O-CA 3.09Å; E191-K232 WeakPolarHBondContact O-CB 3.45Å; E191-K232 PolarHBondContact O-N 3.07Å; E191-K232 IonicContact OE1-NZ 2.62Å; E191-K232 PolarHBondContact OE1-NZ 2.96Å; E191-K232 IonicContact OE2-NZ 2.79Å; E191-K232 PolarHBondContact OE2-NZ 3.39Å; E191-V233 PolarHBondContact O-N 3.17Å
192	E	98.4	Very high	93.1	Very high	35 Å²	35	42.6 Å²	42.6	16%	0.164	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	128.5	-175	-55.4	-172.3	-141.6	0	0	111.7	K137 R138 L139 H194 V233	K137-E192 PolarHBondContact O-N 2.94Å; R138-E192 WeakPolarHBondContact CA-O 3.31Å; R138-E192 HydrophobicContact CB-CB 4.13Å; R138-E192 HydrophobicContact CG-CB 3.94Å; R138-E192 IonicContact CZ-OE1 3.74Å; R138-E192 IonicContact CZ-OE2 2.66Å; R138-E192 VanDerWaalsContact NE-CD 3.33Å; R138-E192 IonicContact NE-OE1 3.31Å; R138-E192 IonicContact NE-OE2 3.62Å; R138-E192 PolarHBondContact NE-OE2 2.79Å; R138-E192 IonicContact NH1-OE2 2.77Å; R138-E192 IonicContact NH2-OE1 3.48Å; R138-E192 PolarHBondContact NH2-OE1 2.92Å; R138-E192 IonicContact NH2-OE2 3.5Å; R138-E192 PolarHBondContact NH2-OE2 3.18Å; L139-E192 PolarHBondContact N-O 2.84Å; E192-H194 IonicContact OE2-CE1 3.85Å; E192-H194 IonicContact OE2-NE2 2.78Å; E192-V233 WeakPolarHBondContact CA-O 3.18Å; E192-V233 HydrophobicContact CB-CB 4.15Å; E192-V233 HydrophobicContact CG-CB 3.84Å; E192-V233 HydrophobicContact CG-CG2 3.83Å
193	L	98.4	Very high	92.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	116	175.3	-177.4	65.1	0	0	0	109.7	L139 L184 L190 L195 F225 L231 V233 L234 R235	L139-L193 HydrophobicContact CB-CD1 3.85Å; L139-L193 HydrophobicContact CD1-CD1 4.39Å; L184-L193 HydrophobicContact CD1-CD2 3.97Å; L184-L193 HydrophobicContact CD2-CD2 4.32Å; L190-L193 HydrophobicContact CD2-CB 4.39Å; L193-L195 HydrophobicContact CD1-CD2 3.82Å; L193-L195 HydrophobicContact CD1-CG 4.26Å; L193-L195 HydrophobicContact CD2-CD1 4.05Å; L193-L195 HydrophobicContact CD2-CG 4.32Å; L193-L195 HydrophobicContact CG-CD1 4.28Å; L193-L195 HydrophobicContact CG-CD2 4.12Å; L193-L195 HydrophobicContact CG-CG 3.98Å; L193-F225 HydrophobicContact CD2-CE1 3.71Å; L193-F225 HydrophobicContact CD2-CZ 4.26Å; L193-L231 HydrophobicContact CB-CD1 3.72Å; L193-V233 PolarHBondContact N-O 3.09Å; L193-L234 HydrophobicContact CB-CD1 4.37Å; L193-L234 HydrophobicContact CD2-CD1 4.22Å; L193-L234 HydrophobicContact CG-CD1 4.48Å; L193-R235 PolarHBondContact O-N 3.43Å
194	H	98.4	Very high	91.9	Very high	13 Å²	13	52 Å²	52	6%	0.06	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126.9	174.5	-47.6	159	0	0	0	109.6	L139 N140 I141 E192 R235	L139-H194 PolarHBondContact O-N 2.93Å; N140-H194 WeakPolarHBondContact OD1-CB 3.38Å; N140-H194 PolarHBondContact OD1-ND1 3.14Å; I141-H194 PolarHBondContact N-O 3.03Å; E192-H194 IonicContact OE2-CE1 3.85Å; E192-H194 IonicContact OE2-NE2 2.78Å; H194-R235 CarbonylContact C-O 3.58Å; H194-R235 WeakPolarHBondContact CA-O 3.38Å; H194-R235 HydrophobicContact CB-CB 4.16Å; H194-R235 VanDerWaalsContact CD2-CG 3.43Å; H194-R235 WeakPolarHBondContact CD2-CG 3.38Å; H194-R235 PolarHBondContact CE1-NH1 3.28Å; H194-R235 PolarHBondContact NE2-NH1 2.93Å
195	L	98.1	Very high	91.1	Very high	1 Å²	1	58 Å²	58	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138	-176.4	-58	178.8	0	0	0	110.3	I141 F180 L193 Y197 L221 R235 I236 R237	I141-L195 HydrophobicContact CB-CD2 4.01Å; I141-L195 HydrophobicContact CG1-CD2 4.07Å; I141-L195 CarbonylContact O-C 3.55Å; F180-L195 HydrophobicContact CE1-CD2 3.78Å; F180-L195 HydrophobicContact CE2-CD2 3.87Å; F180-L195 HydrophobicContact CZ-CD2 3.37Å; L193-L195 HydrophobicContact CD1-CD2 3.82Å; L193-L195 HydrophobicContact CD1-CG 4.26Å; L193-L195 HydrophobicContact CD2-CD1 4.05Å; L193-L195 HydrophobicContact CD2-CG 4.32Å; L193-L195 HydrophobicContact CG-CD1 4.28Å; L193-L195 HydrophobicContact CG-CD2 4.12Å; L193-L195 HydrophobicContact CG-CG 3.98Å; L195-Y197 HydrophobicContact CB-CD2 4.45Å; L195-Y197 HydrophobicContact CB-CE2 4.03Å; L195-Y197 HydrophobicContact CD1-CE2 4.08Å; L195-L221 HydrophobicContact CD1-CD1 3.94Å; L195-L221 HydrophobicContact CD1-CD2 3.81Å; L195-R235 PolarHBondContact N-O 2.94Å; L195-I236 HydrophobicContact CB-CG1 4.46Å; L195-I236 HydrophobicContact CD1-CG1 4.5Å; L195-I236 WeakPolarHBondContact O-CA 3.19Å; L195-R237 PolarHBondContact O-N 3.2Å; L195-R237 VanDerWaalsContact O-N 3.09Å
196	V	97.3	Very high	90.5	Very high	21 Å²	21	59.4 Å²	59.4	13%	0.127	31%	0.307	C	S	.	.			trans	-133.7	113	168.4	-177.5	0	0	0	0	108	I141 T198 Q238	I141-V196 PolarHBondContact O-N 3.34Å; V196-T198 HydrophobicContact CG1-CG2 3.75Å; V196-T198 VanDerWaalsContact CG1-OG1 3.25Å; V196-T198 WeakPolarHBondContact CG1-OG1 3.43Å; V196-T198 PolarHBondContact O-N 3.37Å; V196-Q238 HydrophobicContact CG1-CB 4.15Å
197	Y	94.6	Very high	89.9	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.008	30%	0.302	C	S	.	.			trans	-85.2	61.1	177	-73.5	-98.6	0	0	0	110.4	L144 H177 L195 F211 Q212 I213 D217 L221 S239	L144-Y197 HydrophobicContact CD1-CD1 3.64Å; L144-Y197 HydrophobicContact CD1-CD2 4.25Å; L144-Y197 HydrophobicContact CD1-CE1 3.45Å; L144-Y197 VanDerWaalsContact CD1-CE1 3.45Å; L144-Y197 HydrophobicContact CD1-CE2 4.07Å; L144-Y197 HydrophobicContact CD1-CG 4.04Å; H177-Y197 HydrophobicContact CB-CD1 4.26Å; H177-Y197 HydrophobicContact CB-CE1 3.97Å; H177-Y197 AromaticContact CE1-CD1 3.72Å; H177-Y197 AromaticContact CG-CD1 3.74Å; H177-Y197 AromaticContact CG-CE1 3.93Å; H177-Y197 AromaticContact ND1-CD1 3.51Å; H177-Y197 AromaticContact ND1-CE1 3.85Å; L195-Y197 HydrophobicContact CB-CD2 4.45Å; L195-Y197 HydrophobicContact CB-CE2 4.03Å; L195-Y197 HydrophobicContact CD1-CE2 4.08Å; Y197-F211 CarbonylContact O-C 3.6Å; Y197-F211 VanDerWaalsContact O-CA 3.31Å; Y197-F211 WeakPolarHBondContact O-CA 3.1Å; Y197-Q212 PolarHBondContact O-N 3.15Å; Y197-I213 HydrophobicContact CD1-CB 4.1Å; Y197-I213 HydrophobicContact CD1-CG1 3.97Å; Y197-I213 HydrophobicContact CD2-CB 3.93Å; Y197-I213 HydrophobicContact CD2-CD1 3.94Å; Y197-I213 HydrophobicContact CD2-CG1 3.95Å; Y197-I213 HydrophobicContact CE1-CD1 4.35Å; Y197-I213 HydrophobicContact CE1-CG1 3.89Å; Y197-I213 HydrophobicContact CE2-CB 4.39Å; Y197-I213 HydrophobicContact CE2-CD1 3.55Å; Y197-I213 HydrophobicContact CE2-CG1 3.88Å; Y197-I213 HydrophobicContact CG-CB 3.79Å; Y197-I213 HydrophobicContact CG-CD1 4.49Å; Y197-I213 HydrophobicContact CG-CG1 4Å; Y197-D217 HydrophobicContact CE1-CB 3.79Å; Y197-L221 HydrophobicContact CE2-CD1 4.36Å; Y197-L221 WeakPolarHBondContact OH-CD1 3.47Å; Y197-S239 PolarHBondContact N-OG 3.48Å
198	T	91.6	Very high	89.2	Confident	27 Å²	27	67 Å²	67	17%	0.166	34%	0.335	C	S	.	.			trans	-134.4	165.1	174.9	68.3	0	0	0	0	110.7	Q143 L144 V196 F211 Q238	Q143-T198 CarbonylContact C-O 3.2Å; Q143-T198 WeakPolarHBondContact CA-O 3.42Å; Q143-T198 WeakPolarHBondContact CB-O 3.35Å; L144-T198 PolarHBondContact N-O 3.23Å; L144-T198 VanDerWaalsContact N-O 3.08Å; V196-T198 HydrophobicContact CG1-CG2 3.75Å; V196-T198 VanDerWaalsContact CG1-OG1 3.25Å; V196-T198 WeakPolarHBondContact CG1-OG1 3.43Å; V196-T198 PolarHBondContact O-N 3.37Å; T198-F211 HydrophobicContact CG2-CB 4.21Å; T198-F211 HydrophobicContact CG2-CD1 3.81Å; T198-F211 HydrophobicContact CG2-CG 4.48Å; T198-Q238 WeakPolarHBondContact CG2-O 3.43Å
199	I	90.6	Very high	88.8	Confident	20 Å²	20	64.4 Å²	64.4	10%	0.103	32%	0.324	C	S	.	.			trans	-110.8	129.9	173.7	-62	-173.7	0	0	0	109.6	L144 L145 L146 C202 M210 F211	L144-I199 WeakPolarHBondContact O-CG1 3.32Å; L145-I199 HydrophobicContact CD2-CD1 4.22Å; L145-I199 HydrophobicContact CD2-CG1 4.32Å; L145-I199 HydrophobicContact CD2-CG2 4.21Å; L146-I199 HydrophobicContact CD1-CD1 3.5Å; L146-I199 VanDerWaalsContact CD1-CD1 3.5Å; L146-I199 HydrophobicContact CD1-CG1 4.35Å; I199-C202 HydrophobicContact CG2-CB 4.42Å; I199-M210 HydrophobicContact CD1-CB 4.05Å; I199-M210 HydrophobicContact CD1-CG 4.3Å; I199-M210 HydrophobicContact CD1-SD 4.24Å; I199-M210 HydrophobicContact CG1-CB 4.38Å; I199-F211 WeakPolarHBondContact O-CE1 3.41Å
200	K	89.4	Confident	88.3	Confident	110 Å²	110	62 Å²	62	48%	0.478	31%	0.313	S	S	.	.	S	Bend	trans	-72.1	-33.4	179.9	-69.1	172.1	-169.1	160.9	0	113.3	E113 T142 Q143	E113-K200 IonicContact OE1-NZ 2.98Å; E113-K200 IonicContact OE2-NZ 3.77Å; E113-K200 PolarHBondContact OE2-NZ 3.31Å; T142-K200 WeakPolarHBondContact OG1-CE 3.35Å; T142-K200 PolarHBondContact OG1-NZ 2.73Å; Q143-K200 HydrophobicContact CB-CD 4.38Å; Q143-K200 HydrophobicContact CB-CG 4.12Å; Q143-K200 HydrophobicContact CG-CD 4.41Å
201	Q	83.4	Confident	87.9	Confident	178 Å²	178	64 Å²	64	83%	0.832	32%	0.322	S	S	*	.			trans	-138.6	87.4	-174.3	-64.6	-174	-5.2	0	0	110.6
202	C	74.8	Confident	87.6	Confident	36 Å²	36	62.5 Å²	62.5	24%	0.243	32%	0.315	C	S	.	.			trans	-87.7	-9.2	176	51	0	0	0	0	113.7	I199 M204 N205 M210	I199-C202 HydrophobicContact CG2-CB 4.42Å; C202-M204 PolarHBondContact O-N 3.3Å; C202-N205 PolarHBondContact O-N 3.39Å; C202-M210 HydrophobicContact CB-SD 4.1Å
203	G	80.6	Confident	87.4	Confident	64 Å²	64	60.9 Å²	60.9	66%	0.66	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	-137.3	-177.6	0	0	0	0	0	111.6	N205	G203-N205 VanDerWaalsContact C-N 3.34Å
204	M	79.6	Confident	87	Confident	185 Å²	185	61.1 Å²	61.1	91%	0.911	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-7.2	178.1	-63.8	-64.8	-68.3	0	0	113.5	C202 F206	C202-M204 PolarHBondContact O-N 3.3Å; M204-F206 VanDerWaalsContact C-N 3.3Å; M204-F206 PolarHBondContact O-N 2.83Å
205	N	76.7	Confident	86.6	Confident	130 Å²	130	63.5 Å²	63.5	70%	0.695	32%	0.322	S	S	*	.			trans	-95.7	52.3	-176.5	-63.6	-23.9	0	0	0	110.5	C202 G203 M210	C202-N205 PolarHBondContact O-N 3.39Å; G203-N205 VanDerWaalsContact C-N 3.34Å; N205-M210 WeakPolarHBondContact O-CE 3.45Å
206	F	80.2	Confident	86.2	Confident	97 Å²	97	69.5 Å²	69.5	43%	0.425	35%	0.345	S	S	.	.			trans	-76.8	127.5	-177.9	171.5	-91.7	0	0	0	111.4	M204 W208 F211	M204-F206 VanDerWaalsContact C-N 3.3Å; M204-F206 PolarHBondContact O-N 2.83Å; F206-W208 HydrophobicContact CE1-CD2 4.07Å; F206-W208 AromaticContact CE1-CE2 3.86Å; F206-W208 HydrophobicContact CE1-CG 4.22Å; F206-W208 HydrophobicContact CE1-CZ2 4.34Å; F206-W208 AromaticContact CE1-NE1 3.87Å; F206-W208 AromaticContact CZ-CD2 3.73Å; F206-W208 HydrophobicContact CZ-CD2 3.73Å; F206-W208 AromaticContact CZ-CE2 3.77Å; F206-W208 AromaticContact CZ-CE3 3.94Å; F206-W208 HydrophobicContact CZ-CE3 3.94Å; F206-W208 HydrophobicContact CZ-CG 4.22Å; F206-W208 HydrophobicContact CZ-CH2 4.25Å; F206-W208 HydrophobicContact CZ-CZ2 4.05Å; F206-W208 HydrophobicContact CZ-CZ3 4.2Å; F206-F211 AromaticContact CD2-CE2 3.74Å; F206-F211 HydrophobicContact CD2-CE2 3.74Å; F206-F211 HydrophobicContact CD2-CZ 4.26Å; F206-F211 HydrophobicContact CE2-CD2 4.08Å; F206-F211 AromaticContact CE2-CE2 3.44Å; F206-F211 HydrophobicContact CE2-CE2 3.44Å; F206-F211 VanDerWaalsContact CE2-CE2 3.44Å; F206-F211 HydrophobicContact CE2-CZ 4.06Å; F206-F211 HydrophobicContact CZ-CE2 4.45Å
207	E	81.8	Confident	86	Confident	59 Å²	59	68.9 Å²	68.9	28%	0.276	34%	0.341	S	S	.	.			trans	-133.7	140.8	166.5	-61.5	-175.4	-179.1	0	0	109.4	R149 T209 M210	R149-E207 IonicContact NH1-OE1 3.77Å; R149-E207 PolarHBondContact NH1-OE1 3.07Å; R149-E207 IonicContact NH1-OE2 3.65Å; R149-E207 PolarHBondContact NH1-OE2 3.27Å; E207-T209 PolarHBondContact O-N 3.28Å; E207-M210 HydrophobicContact CB-CE 4.09Å; E207-M210 HydrophobicContact CB-CG 4.17Å; E207-M210 HydrophobicContact CG-CE 4.17Å; E207-M210 VanDerWaalsContact O-CB 3.28Å; E207-M210 WeakPolarHBondContact O-CB 3.44Å; E207-M210 WeakPolarHBondContact O-CG 3.21Å; E207-M210 PolarHBondContact O-N 3.03Å; E207-M210 VanDerWaalsContact O-N 3.08Å
208	W	80.3	Confident	85.9	Confident	186 Å²	186	68.9 Å²	68.9	71%	0.705	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-61.9	-32	-179.5	-75.8	109.1	0	0	0	113.1	F206 M210 F211	F206-W208 HydrophobicContact CE1-CD2 4.07Å; F206-W208 AromaticContact CE1-CE2 3.86Å; F206-W208 HydrophobicContact CE1-CG 4.22Å; F206-W208 HydrophobicContact CE1-CZ2 4.34Å; F206-W208 AromaticContact CE1-NE1 3.87Å; F206-W208 AromaticContact CZ-CD2 3.73Å; F206-W208 HydrophobicContact CZ-CD2 3.73Å; F206-W208 AromaticContact CZ-CE2 3.77Å; F206-W208 AromaticContact CZ-CE3 3.94Å; F206-W208 HydrophobicContact CZ-CE3 3.94Å; F206-W208 HydrophobicContact CZ-CG 4.22Å; F206-W208 HydrophobicContact CZ-CH2 4.25Å; F206-W208 HydrophobicContact CZ-CZ2 4.05Å; F206-W208 HydrophobicContact CZ-CZ3 4.2Å; W208-M210 PolarHBondContact O-N 3.49Å; W208-F211 PolarHBondContact O-N 3.29Å
209	T	80.9	Confident	85.9	Confident	46 Å²	46	74.8 Å²	74.8	28%	0.282	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-58.2	-17.9	174.7	52.6	0	0	0	0	113.3	E207 F211	E207-T209 PolarHBondContact O-N 3.28Å; T209-F211 PolarHBondContact O-N 3.49Å
210	M	85	Confident	86	Confident	34 Å²	34	75.1 Å²	75.1	17%	0.167	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-75.9	-7.6	176.3	-58.8	-176.5	176.8	0	0	114.4	L146 I199 C202 N205 E207 W208	L146-M210 HydrophobicContact CD1-CB 3.78Å; L146-M210 HydrophobicContact CD1-CG 3.72Å; I199-M210 HydrophobicContact CD1-CB 4.05Å; I199-M210 HydrophobicContact CD1-CG 4.3Å; I199-M210 HydrophobicContact CD1-SD 4.24Å; I199-M210 HydrophobicContact CG1-CB 4.38Å; C202-M210 HydrophobicContact CB-SD 4.1Å; N205-M210 WeakPolarHBondContact O-CE 3.45Å; E207-M210 HydrophobicContact CB-CE 4.09Å; E207-M210 HydrophobicContact CB-CG 4.17Å; E207-M210 HydrophobicContact CG-CE 4.17Å; E207-M210 VanDerWaalsContact O-CB 3.28Å; E207-M210 WeakPolarHBondContact O-CB 3.44Å; E207-M210 WeakPolarHBondContact O-CG 3.21Å; E207-M210 PolarHBondContact O-N 3.03Å; E207-M210 VanDerWaalsContact O-N 3.08Å; W208-M210 PolarHBondContact O-N 3.49Å
211	F	89.2	Confident	86.2	Confident	44 Å²	44	69.9 Å²	69.9	19%	0.193	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-119.4	19.2	-173.4	-60.6	-93.2	0	0	0	112.2	Y197 T198 I199 F206 W208 T209 Q240	Y197-F211 CarbonylContact O-C 3.6Å; Y197-F211 VanDerWaalsContact O-CA 3.31Å; Y197-F211 WeakPolarHBondContact O-CA 3.1Å; T198-F211 HydrophobicContact CG2-CB 4.21Å; T198-F211 HydrophobicContact CG2-CD1 3.81Å; T198-F211 HydrophobicContact CG2-CG 4.48Å; I199-F211 WeakPolarHBondContact O-CE1 3.41Å; F206-F211 AromaticContact CD2-CE2 3.74Å; F206-F211 HydrophobicContact CD2-CE2 3.74Å; F206-F211 HydrophobicContact CD2-CZ 4.26Å; F206-F211 HydrophobicContact CE2-CD2 4.08Å; F206-F211 AromaticContact CE2-CE2 3.44Å; F206-F211 HydrophobicContact CE2-CE2 3.44Å; F206-F211 VanDerWaalsContact CE2-CE2 3.44Å; F206-F211 HydrophobicContact CE2-CZ 4.06Å; F206-F211 HydrophobicContact CZ-CE2 4.45Å; W208-F211 PolarHBondContact O-N 3.29Å; T209-F211 PolarHBondContact O-N 3.49Å; F211-Q240 WeakPolarHBondContact O-CG 3.41Å
212	Q	91.3	Very high	86.7	Confident	25 Å²	25	62.4 Å²	62.4	12%	0.117	31%	0.309	C	S	.	.	S	Bend	trans	-131.2	145.4	-179.1	75	-169.4	34.1	0	0	112.4	D171 H177 Y197 Q240	D171-Q212 PolarHBondContact OD1-NE2 2.8Å; H177-Q212 PolarHBondContact CE1-O 3.09Å; H177-Q212 VanDerWaalsContact CE1-O 3.32Å; Y197-Q212 PolarHBondContact O-N 3.15Å; Q212-Q240 HydrophobicContact CB-CB 3.7Å; Q212-Q240 HydrophobicContact CB-CG 4.07Å
213	I	93.1	Very high	87.5	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.328	C	S	.	.			trans	-73.1	138	164.8	-168.9	172.8	0	0	0	109.9	Y197 D217 L221 S239 V241 K245	Y197-I213 HydrophobicContact CD1-CB 4.1Å; Y197-I213 HydrophobicContact CD1-CG1 3.97Å; Y197-I213 HydrophobicContact CD2-CB 3.93Å; Y197-I213 HydrophobicContact CD2-CD1 3.94Å; Y197-I213 HydrophobicContact CD2-CG1 3.95Å; Y197-I213 HydrophobicContact CE1-CD1 4.35Å; Y197-I213 HydrophobicContact CE1-CG1 3.89Å; Y197-I213 HydrophobicContact CE2-CB 4.39Å; Y197-I213 HydrophobicContact CE2-CD1 3.55Å; Y197-I213 HydrophobicContact CE2-CG1 3.88Å; Y197-I213 HydrophobicContact CG-CB 3.79Å; Y197-I213 HydrophobicContact CG-CD1 4.49Å; Y197-I213 HydrophobicContact CG-CG1 4Å; I213-D217 HydrophobicContact CD1-CB 4.23Å; I213-D217 HydrophobicContact CG1-CB 3.62Å; I213-L221 HydrophobicContact CD1-CD1 3.94Å; I213-S239 VanDerWaalsContact CG2-O 3.28Å; I213-S239 WeakPolarHBondContact CG2-O 3.45Å; I213-S239 PolarHBondContact N-O 2.85Å; I213-V241 HydrophobicContact CG2-CG2 3.84Å; I213-K245 HydrophobicContact CG2-CD 3.8Å; I213-K245 VanDerWaalsContact O-CD 3.31Å; I213-K245 WeakPolarHBondContact O-CD 3.41Å; I213-K245 WeakPolarHBondContact O-CE 3.41Å
214	T	91.4	Very high	88.1	Confident	6 Å²	6	63.8 Å²	63.8	4%	0.037	30%	0.3	C	S	.	.			trans	-90.6	160.5	176.9	71.1	0	0	0	0	112	D171 I175 R216 D217 C218	D171-T214 VanDerWaalsContact OD2-CA 3.23Å; D171-T214 WeakPolarHBondContact OD2-CA 3.09Å; I175-T214 HydrophobicContact CG2-CG2 4.39Å; T214-R216 PolarHBondContact O-N 3.29Å; T214-R216 PolarHBondContact OG1-N 2.87Å; T214-D217 WeakPolarHBondContact CB-OD2 3.45Å; T214-D217 PolarHBondContact N-OD2 3.33Å; T214-D217 WeakPolarHBondContact O-CB 3.43Å; T214-D217 PolarHBondContact O-N 3.4Å; T214-D217 VanDerWaalsContact O-N 3.11Å; T214-D217 PolarHBondContact OG1-N 2.98Å; T214-D217 VanDerWaalsContact OG1-N 3.12Å; T214-D217 PolarHBondContact OG1-OD2 2.98Å; T214-C218 PolarHBondContact O-N 2.97Å; T214-C218 PolarHBondContact O-SG 3Å; T214-C218 VanDerWaalsContact O-SG 3.39Å
215	D	89.9	Confident	88.6	Confident	62 Å²	62	55 Å²	55	33%	0.332	26%	0.257	S	S	.	.	H	α-helix	trans	-56.8	-32	170.7	-84.3	-55.4	0	0	0	112.6	D171 R219	D171-D215 PolarHBondContact OD2-N 3.39Å; D215-R219 WeakPolarHBondContact O-CG 3.42Å; D215-R219 PolarHBondContact O-N 2.82Å; D215-R219 PolarHBondContact O-NH1 3.21Å
216	R	89.3	Confident	89.1	Confident	127 Å²	127	54.5 Å²	54.5	48%	0.479	25%	0.248	S	C	.	.	H	α-helix	trans	-67.8	-44.4	175.6	-176.3	176.9	176.5	180	-5	111	T214 C218 R219 A220	T214-R216 PolarHBondContact O-N 3.29Å; T214-R216 PolarHBondContact OG1-N 2.87Å; R216-C218 VanDerWaalsContact C-N 3.33Å; R216-C218 PolarHBondContact O-N 2.96Å; R216-R219 PolarHBondContact O-N 2.97Å; R216-A220 PolarHBondContact O-N 2.92Å
217	D	92.3	Very high	89.3	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.043	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-42.4	176.1	-56.1	-42.9	0	0	0	110.6	H177 Y197 I213 T214 R219 A220 L221	H177-D217 IonicContact CE1-OD2 3.53Å; H177-D217 IonicContact CG-OD2 3.33Å; H177-D217 PolarHBondContact N-OD1 2.78Å; H177-D217 IonicContact ND1-OD1 2.68Å; H177-D217 IonicContact ND1-OD2 2.64Å; H177-D217 PolarHBondContact ND1-OD2 3.35Å; Y197-D217 HydrophobicContact CE1-CB 3.79Å; I213-D217 HydrophobicContact CD1-CB 4.23Å; I213-D217 HydrophobicContact CG1-CB 3.62Å; T214-D217 WeakPolarHBondContact CB-OD2 3.45Å; T214-D217 PolarHBondContact N-OD2 3.33Å; T214-D217 WeakPolarHBondContact O-CB 3.43Å; T214-D217 PolarHBondContact O-N 3.4Å; T214-D217 VanDerWaalsContact O-N 3.11Å; T214-D217 PolarHBondContact OG1-N 2.98Å; T214-D217 VanDerWaalsContact OG1-N 3.12Å; T214-D217 PolarHBondContact OG1-OD2 2.98Å; D217-R219 VanDerWaalsContact C-N 3.34Å; D217-R219 PolarHBondContact O-N 3.16Å; D217-A220 PolarHBondContact O-N 3.22Å; D217-L221 WeakPolarHBondContact O-CB 3.37Å; D217-L221 WeakPolarHBondContact O-CG 3.47Å; D217-L221 PolarHBondContact O-N 3.3Å
218	C	93.4	Very high	89.8	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.014	24%	0.243	C	C	.	.	H	α-helix	trans	-59.6	-42.5	175.4	-66	0	0	0	0	112.4	T214 R216 T222 L249	T214-C218 PolarHBondContact O-N 2.97Å; T214-C218 PolarHBondContact O-SG 3Å; T214-C218 VanDerWaalsContact O-SG 3.39Å; R216-C218 VanDerWaalsContact C-N 3.33Å; R216-C218 PolarHBondContact O-N 2.96Å; C218-T222 VanDerWaalsContact O-CB 3.3Å; C218-T222 WeakPolarHBondContact O-CB 3.43Å; C218-T222 PolarHBondContact O-N 2.9Å; C218-T222 PolarHBondContact O-OG1 3.48Å; C218-L249 HydrophobicContact CB-CD2 4.39Å; C218-L249 HydrophobicContact CB-CG 4.38Å
219	R	91.3	Very high	90.4	Very high	152 Å²	152	46.5 Å²	46.5	57%	0.574	23%	0.234	S	C	*	.	H	α-helix	trans	-63.9	-44.1	175.2	-73.9	-173.6	-64.9	-90.8	5.3	111.8	D215 R216 D217 T222 L223	D215-R219 WeakPolarHBondContact O-CG 3.42Å; D215-R219 PolarHBondContact O-N 2.82Å; D215-R219 PolarHBondContact O-NH1 3.21Å; R216-R219 PolarHBondContact O-N 2.97Å; D217-R219 VanDerWaalsContact C-N 3.34Å; D217-R219 PolarHBondContact O-N 3.16Å; R219-T222 PolarHBondContact O-N 3.06Å; R219-L223 WeakPolarHBondContact O-CG 3.48Å; R219-L223 PolarHBondContact O-N 2.73Å; R219-L223 VanDerWaalsContact O-N 3.11Å
220	A	92.3	Very high	91.1	Very high	26 Å²	26	46.7 Å²	46.7	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-61.8	-48.9	178.2	0	0	0	0	0	111.5	R216 D217 T222 L223 A224	R216-A220 PolarHBondContact O-N 2.92Å; D217-A220 PolarHBondContact O-N 3.22Å; A220-T222 PolarHBondContact O-N 3.44Å; A220-L223 PolarHBondContact O-N 3.23Å; A220-A224 WeakPolarHBondContact O-CB 3.48Å; A220-A224 PolarHBondContact O-N 2.96Å
221	L	94.5	Very high	91.6	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-59.9	-43.4	175.4	-73.4	179.7	0	0	0	112.3	F180 L195 Y197 I213 D217 L223 A224 F225 I236 L249	F180-L221 HydrophobicContact CB-CD2 4.15Å; F180-L221 HydrophobicContact CD2-CD2 4.13Å; F180-L221 HydrophobicContact CG-CD2 4.32Å; L195-L221 HydrophobicContact CD1-CD1 3.94Å; L195-L221 HydrophobicContact CD1-CD2 3.81Å; Y197-L221 HydrophobicContact CE2-CD1 4.36Å; Y197-L221 WeakPolarHBondContact OH-CD1 3.47Å; I213-L221 HydrophobicContact CD1-CD1 3.94Å; D217-L221 WeakPolarHBondContact O-CB 3.37Å; D217-L221 WeakPolarHBondContact O-CG 3.47Å; D217-L221 PolarHBondContact O-N 3.3Å; L221-L223 VanDerWaalsContact C-N 3.25Å; L221-L223 PolarHBondContact O-N 3.15Å; L221-A224 PolarHBondContact O-N 2.72Å; L221-A224 VanDerWaalsContact O-N 3.1Å; L221-F225 HydrophobicContact CB-CE2 4.01Å; L221-F225 HydrophobicContact CB-CZ 4.11Å; L221-F225 HydrophobicContact CD1-CZ 4.48Å; L221-F225 HydrophobicContact CD2-CE1 4.33Å; L221-F225 HydrophobicContact CD2-CZ 4.07Å; L221-F225 HydrophobicContact CG-CZ 4.47Å; L221-F225 WeakPolarHBondContact O-CD2 3.43Å; L221-F225 VanDerWaalsContact O-CG 3.24Å; L221-F225 WeakPolarHBondContact O-CG 3.32Å; L221-F225 PolarHBondContact O-N 2.94Å; L221-I236 HydrophobicContact CD1-CD1 4.24Å; L221-L249 HydrophobicContact CB-CD2 3.78Å; L221-L249 HydrophobicContact CD1-CD2 4.21Å
222	T	92.9	Very high	92.1	Very high	20 Å²	20	46.5 Å²	46.5	12%	0.123	23%	0.233	C	C	.	.	H	α-helix	trans	-58.2	-39.4	178	-61.5	0	0	0	0	111.6	C218 R219 A220 C252	C218-T222 VanDerWaalsContact O-CB 3.3Å; C218-T222 WeakPolarHBondContact O-CB 3.43Å; C218-T222 PolarHBondContact O-N 2.9Å; C218-T222 PolarHBondContact O-OG1 3.48Å; R219-T222 PolarHBondContact O-N 3.06Å; A220-T222 PolarHBondContact O-N 3.44Å; T222-C252 HydrophobicContact CG2-CB 3.92Å
223	L	91.6	Very high	92.4	Very high	120 Å²	120	45.9 Å²	45.9	63%	0.628	23%	0.231	S	C	*	.	H	α-helix	trans	-70.6	-42.7	175.1	-69.2	171	0	0	0	111.3	R219 A220 L221 F225 K226	R219-L223 WeakPolarHBondContact O-CG 3.48Å; R219-L223 PolarHBondContact O-N 2.73Å; R219-L223 VanDerWaalsContact O-N 3.11Å; A220-L223 PolarHBondContact O-N 3.23Å; L221-L223 VanDerWaalsContact C-N 3.25Å; L221-L223 PolarHBondContact O-N 3.15Å; L223-F225 PolarHBondContact O-N 3.16Å; L223-K226 WeakPolarHBondContact O-CB 3.39Å; L223-K226 PolarHBondContact O-N 3.19Å
224	A	92.3	Very high	92.7	Very high	9 Å²	9	46 Å²	46	7%	0.074	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-42.1	-179.2	0	0	0	0	0	112.7	L184 A220 L221 K226 G227 C228	L184-A224 HydrophobicContact CB-CB 4.16Å; L184-A224 HydrophobicContact CD1-CB 3.64Å; L184-A224 HydrophobicContact CG-CB 4.43Å; A220-A224 WeakPolarHBondContact O-CB 3.48Å; A220-A224 PolarHBondContact O-N 2.96Å; L221-A224 PolarHBondContact O-N 2.72Å; L221-A224 VanDerWaalsContact O-N 3.1Å; A224-K226 PolarHBondContact O-N 2.97Å; A224-G227 PolarHBondContact O-N 2.8Å; A224-C228 PolarHBondContact O-N 3.21Å; A224-C228 VanDerWaalsContact O-N 3.1Å
225	F	91.9	Very high	93	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.009	24%	0.241	C	C	.	.	H	α-helix	trans	-65.1	-22	177.3	-63.2	-25.2	0	0	0	113.7	L184 L193 L221 L223 G227 L231 L234 L249 L253	L184-F225 HydrophobicContact CD1-CD1 4.43Å; L184-F225 HydrophobicContact CD1-CE1 4.25Å; L193-F225 HydrophobicContact CD2-CE1 3.71Å; L193-F225 HydrophobicContact CD2-CZ 4.26Å; L221-F225 HydrophobicContact CB-CE2 4.01Å; L221-F225 HydrophobicContact CB-CZ 4.11Å; L221-F225 HydrophobicContact CD1-CZ 4.48Å; L221-F225 HydrophobicContact CD2-CE1 4.33Å; L221-F225 HydrophobicContact CD2-CZ 4.07Å; L221-F225 HydrophobicContact CG-CZ 4.47Å; L221-F225 WeakPolarHBondContact O-CD2 3.43Å; L221-F225 VanDerWaalsContact O-CG 3.24Å; L221-F225 WeakPolarHBondContact O-CG 3.32Å; L221-F225 PolarHBondContact O-N 2.94Å; L223-F225 PolarHBondContact O-N 3.16Å; F225-G227 VanDerWaalsContact C-N 3.29Å; F225-L231 HydrophobicContact CD1-CD2 4.23Å; F225-L231 HydrophobicContact CE1-CD2 4.22Å; F225-L234 HydrophobicContact CE1-CD1 4.11Å; F225-L234 HydrophobicContact CE2-CD1 4.37Å; F225-L234 HydrophobicContact CE2-CD2 3.75Å; F225-L234 HydrophobicContact CZ-CD1 3.6Å; F225-L234 HydrophobicContact CZ-CD2 3.83Å; F225-L234 HydrophobicContact CZ-CG 4.4Å; F225-L249 HydrophobicContact CE2-CD2 4.2Å; F225-L253 HydrophobicContact CB-CD2 4.08Å; F225-L253 HydrophobicContact CD2-CD2 4.06Å; F225-L253 HydrophobicContact CD2-CG 4.49Å; F225-L253 HydrophobicContact CG-CD2 4.18Å
226	K	86.8	Confident	93.4	Very high	118 Å²	118	45.8 Å²	45.8	51%	0.513	23%	0.225	S	C	.	.	H	α-helix	trans	-68	-33.1	172.1	-70.6	176.6	-178.2	180	0	111.7	L223 A224 K229	L223-K226 WeakPolarHBondContact O-CB 3.39Å; L223-K226 PolarHBondContact O-N 3.19Å; A224-K226 PolarHBondContact O-N 2.97Å; K226-K229 WeakPolarHBondContact O-CE 3.21Å; K226-K229 PolarHBondContact O-NZ 2.78Å
227	G	84.9	Confident	93.8	Very high	55 Å²	55	43.9 Å²	43.9	57%	0.567	22%	0.218	S	C	*	.	H	α-helix	trans	-84.2	-37.5	-179.7	0	0	0	0	0	113.8	A224 F225 K229	A224-G227 PolarHBondContact O-N 2.8Å; F225-G227 VanDerWaalsContact C-N 3.29Å; G227-K229 PolarHBondContact O-N 3.39Å
228	C	91.4	Very high	93.9	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.034	24%	0.24	C	C	.	.			trans	-77.3	110.3	179.3	-170.1	0	0	0	0	110.2	A224 H256	A224-C228 PolarHBondContact O-N 3.21Å; A224-C228 VanDerWaalsContact O-N 3.1Å; C228-H256 PolarHBondContact O-NE2 2.85Å
229	K	92.1	Very high	94	Very high	115 Å²	115	48.5 Å²	48.5	50%	0.5	24%	0.239	S	C	.	.			trans	-103.8	-4.2	-178.8	-61.1	-52	-169.9	-168.4	0	114.3	K226 G227 P257 S258	K226-K229 WeakPolarHBondContact O-CE 3.21Å; K226-K229 PolarHBondContact O-NZ 2.78Å; G227-K229 PolarHBondContact O-N 3.39Å; K229-P257 HydrophobicContact CB-CG 4.04Å; K229-P257 HydrophobicContact CD-CG 4.05Å; K229-P257 WeakPolarHBondContact O-CG 3.45Å; K229-S258 PolarHBondContact O-OG 2.76Å
230	T	95.9	Very high	94.2	Very high	49 Å²	49	44.8 Å²	44.8	30%	0.301	23%	0.228	S	C	.	.			trans	-98.4	-9.1	-176.9	49.7	0	0	0	0	113.2	I188 L190 K232 S258	I188-T230 VanDerWaalsContact O-CG2 3.29Å; I188-T230 WeakPolarHBondContact O-CG2 3.47Å; L190-T230 CarbonylContact O-C 3.47Å; L190-T230 VanDerWaalsContact O-CB 3.27Å; L190-T230 WeakPolarHBondContact O-CB 3.38Å; L190-T230 PolarHBondContact O-OG1 2.74Å; T230-K232 PolarHBondContact O-N 2.98Å; T230-S258 VanDerWaalsContact C-OG 3.28Å
231	L	97	Very high	94.4	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	22%	0.218	C	C	.	.			trans	-62.7	120.9	-175.8	-168.6	68.2	0	0	0	111.4	L190 L193 F225 V233 L234 H256 S258 L259	L190-L231 HydrophobicContact CD2-CD1 4.48Å; L190-L231 PolarHBondContact O-N 3.32Å; L193-L231 HydrophobicContact CB-CD1 3.72Å; F225-L231 HydrophobicContact CD1-CD2 4.23Å; F225-L231 HydrophobicContact CE1-CD2 4.22Å; L231-V233 WeakPolarHBondContact CD1-O 3.41Å; L231-L234 HydrophobicContact CD2-CB 4.19Å; L231-L234 HydrophobicContact CD2-CD1 4.38Å; L231-H256 PolarHBondContact O-CE1 3.07Å; L231-H256 PolarHBondContact O-ND1 3.34Å; L231-S258 PolarHBondContact N-OG 2.6Å; L231-S258 CarbonylContact O-C 3.32Å; L231-S258 PolarHBondContact O-OG 2.87Å; L231-L259 PolarHBondContact O-N 2.98Å
232	K	97.9	Very high	94.5	Very high	73 Å²	73	45.1 Å²	45.1	32%	0.317	23%	0.226	S	C	.	.			trans	-103.9	-38.8	179	-65.4	179.3	-165.6	162.4	0	111.5	E191 T230 S258 I260 E261	E191-K232 HydrophobicContact CB-CD 4.25Å; E191-K232 HydrophobicContact CB-CG 4.42Å; E191-K232 HydrophobicContact CG-CD 4.48Å; E191-K232 WeakPolarHBondContact O-CA 3.09Å; E191-K232 WeakPolarHBondContact O-CB 3.45Å; E191-K232 PolarHBondContact O-N 3.07Å; E191-K232 IonicContact OE1-NZ 2.62Å; E191-K232 PolarHBondContact OE1-NZ 2.96Å; E191-K232 IonicContact OE2-NZ 2.79Å; E191-K232 PolarHBondContact OE2-NZ 3.39Å; T230-K232 PolarHBondContact O-N 2.98Å; K232-S258 WeakPolarHBondContact CA-O 3.04Å; K232-I260 HydrophobicContact CB-CD1 4.19Å; K232-I260 HydrophobicContact CB-CG1 3.95Å; K232-I260 WeakPolarHBondContact O-CG1 3.39Å; K232-I260 PolarHBondContact O-N 2.81Å; K232-E261 PolarHBondContact O-N 3.1Å
233	V	98.6	Very high	94.7	Very high	12 Å²	12	46 Å²	46	7%	0.073	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	120.1	-176.2	-175.2	0	0	0	0	109.3	E191 E192 L193 L231 R235 E261	E191-V233 PolarHBondContact O-N 3.17Å; E192-V233 WeakPolarHBondContact CA-O 3.18Å; E192-V233 HydrophobicContact CB-CB 4.15Å; E192-V233 HydrophobicContact CG-CB 3.84Å; E192-V233 HydrophobicContact CG-CG2 3.83Å; L193-V233 PolarHBondContact N-O 3.09Å; L231-V233 WeakPolarHBondContact CD1-O 3.41Å; V233-R235 HydrophobicContact CG1-CG 3.9Å; V233-E261 HydrophobicContact CB-CB 4.34Å; V233-E261 HydrophobicContact CG1-CB 4.06Å; V233-E261 HydrophobicContact CG1-CG 4.01Å; V233-E261 HydrophobicContact CG2-CB 4.07Å
234	L	98.4	Very high	94.9	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.7	169.7	178.1	61.7	0	0	0	109.5	L193 F225 L231 I236 L253 L259 E261 L262 D263	L193-L234 HydrophobicContact CB-CD1 4.37Å; L193-L234 HydrophobicContact CD2-CD1 4.22Å; L193-L234 HydrophobicContact CG-CD1 4.48Å; F225-L234 HydrophobicContact CE1-CD1 4.11Å; F225-L234 HydrophobicContact CE2-CD1 4.37Å; F225-L234 HydrophobicContact CE2-CD2 3.75Å; F225-L234 HydrophobicContact CZ-CD1 3.6Å; F225-L234 HydrophobicContact CZ-CD2 3.83Å; F225-L234 HydrophobicContact CZ-CG 4.4Å; L231-L234 HydrophobicContact CD2-CB 4.19Å; L231-L234 HydrophobicContact CD2-CD1 4.38Å; L234-I236 HydrophobicContact CD1-CD1 4.23Å; L234-I236 HydrophobicContact CD1-CG1 4.01Å; L234-I236 HydrophobicContact CD2-CD1 4.38Å; L234-I236 HydrophobicContact CG-CD1 4.45Å; L234-I236 HydrophobicContact CG-CG1 4.29Å; L234-L253 HydrophobicContact CD2-CD1 3.51Å; L234-L259 HydrophobicContact CB-CD1 3.97Å; L234-E261 PolarHBondContact N-O 3.44Å; L234-L262 HydrophobicContact CB-CD1 4.32Å; L234-L262 HydrophobicContact CD2-CD1 4.13Å; L234-L262 HydrophobicContact CG-CD1 4.28Å; L234-L262 WeakPolarHBondContact O-CA 3.36Å; L234-D263 PolarHBondContact O-N 2.95Å
235	R	98.6	Very high	95.1	Very high	64 Å²	64	48.9 Å²	48.9	24%	0.242	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	122.5	172.7	-51.3	-163.9	176.3	137.7	-6.3	110.1	L193 H194 L195 V233 E261 D263	L193-R235 PolarHBondContact O-N 3.43Å; H194-R235 CarbonylContact C-O 3.58Å; H194-R235 WeakPolarHBondContact CA-O 3.38Å; H194-R235 HydrophobicContact CB-CB 4.16Å; H194-R235 VanDerWaalsContact CD2-CG 3.43Å; H194-R235 WeakPolarHBondContact CD2-CG 3.38Å; H194-R235 PolarHBondContact CE1-NH1 3.28Å; H194-R235 PolarHBondContact NE2-NH1 2.93Å; L195-R235 PolarHBondContact N-O 2.94Å; V233-R235 HydrophobicContact CG1-CG 3.9Å; R235-E261 IonicContact CZ-OE1 3.33Å; R235-E261 VanDerWaalsContact CZ-OE1 3.23Å; R235-E261 IonicContact NE-OE1 2.76Å; R235-E261 PolarHBondContact NE-OE1 2.98Å; R235-E261 IonicContact NH2-OE1 3.51Å; R235-E261 PolarHBondContact NH2-OE1 3.49Å; R235-D263 CarbonylContact C-O 3.05Å; R235-D263 WeakPolarHBondContact CA-O 3.4Å; R235-D263 HydrophobicContact CB-CB 3.87Å; R235-D263 HydrophobicContact CG-CB 3.56Å
236	I	98	Very high	95.3	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	93	171.7	-53.1	177.5	0	0	0	106.1	L195 L221 L234 V241 L249 D263 L264 N267	L195-I236 HydrophobicContact CB-CG1 4.46Å; L195-I236 HydrophobicContact CD1-CG1 4.5Å; L195-I236 WeakPolarHBondContact O-CA 3.19Å; L221-I236 HydrophobicContact CD1-CD1 4.24Å; L234-I236 HydrophobicContact CD1-CD1 4.23Å; L234-I236 HydrophobicContact CD1-CG1 4.01Å; L234-I236 HydrophobicContact CD2-CD1 4.38Å; L234-I236 HydrophobicContact CG-CD1 4.45Å; L234-I236 HydrophobicContact CG-CG1 4.29Å; I236-V241 HydrophobicContact CG2-CG2 3.77Å; I236-L249 HydrophobicContact CD1-CD1 4.24Å; I236-D263 PolarHBondContact N-O 2.95Å; I236-L264 HydrophobicContact CB-CD2 4.03Å; I236-N267 PolarHBondContact O-ND2 3.14Å
237	R	97.1	Very high	95.7	Very high	86 Å²	86	49.6 Å²	49.6	33%	0.325	24%	0.236	S	C	.	.			trans	-108.4	153.8	-173.6	-68.7	-174.7	178.6	-162.2	0.9	110.7	L195 S239 D263 A265	L195-R237 PolarHBondContact O-N 3.2Å; L195-R237 VanDerWaalsContact O-N 3.09Å; R237-S239 PolarHBondContact O-N 3.43Å; R237-S239 PolarHBondContact O-OG 2.9Å; R237-D263 WeakPolarHBondContact CD-OD2 3.29Å; R237-D263 WeakPolarHBondContact CG-OD2 3.09Å; R237-D263 IonicContact CZ-OD1 3.67Å; R237-D263 VanDerWaalsContact CZ-OD1 3.31Å; R237-D263 IonicContact CZ-OD2 2.85Å; R237-D263 IonicContact NE-OD1 2.78Å; R237-D263 PolarHBondContact NE-OD1 3.22Å; R237-D263 IonicContact NE-OD2 3.94Å; R237-D263 PolarHBondContact NE-OD2 3.33Å; R237-D263 VanDerWaalsContact NH2-CG 3.32Å; R237-D263 IonicContact NH2-OD1 2.89Å; R237-D263 PolarHBondContact NH2-OD1 3.26Å; R237-D263 IonicContact NH2-OD2 2.99Å; R237-A265 VanDerWaalsContact CA-O 3.29Å; R237-A265 WeakPolarHBondContact CA-O 3.35Å; R237-A265 HydrophobicContact CG-CB 4.41Å
238	Q	95.4	Very high	96.2	Very high	108 Å²	108	49.4 Å²	49.4	51%	0.505	23%	0.225	S	C	.	.	S	Bend	trans	50.7	40.3	169.4	-62.6	-179.2	-54.4	0	0	112.5	V196 T198 A265 H266	V196-Q238 HydrophobicContact CG1-CB 4.15Å; T198-Q238 WeakPolarHBondContact CG2-O 3.43Å; Q238-A265 PolarHBondContact N-O 3.15Å; Q238-H266 WeakPolarHBondContact CA-O 3.42Å; Q238-H266 HydrophobicContact CB-CB 4.48Å; Q238-H266 HydrophobicContact CG-CB 3.49Å; Q238-H266 VanDerWaalsContact CG-CB 3.49Å; Q238-H266 PolarHBondContact N-O 3.33Å; Q238-H266 VanDerWaalsContact N-O 3.08Å
239	S	96.1	Very high	96.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	-125	13.4	-169.5	-64.5	0	0	0	0	112.4	Y197 I213 R237 V241 N267	Y197-S239 PolarHBondContact N-OG 3.48Å; I213-S239 VanDerWaalsContact CG2-O 3.28Å; I213-S239 WeakPolarHBondContact CG2-O 3.45Å; I213-S239 PolarHBondContact N-O 2.85Å; R237-S239 PolarHBondContact O-N 3.43Å; R237-S239 PolarHBondContact O-OG 2.9Å; S239-V241 PolarHBondContact O-N 3.29Å; S239-V241 VanDerWaalsContact O-N 3.16Å; S239-N267 PolarHBondContact N-OD1 3.1Å
240	Q	95.2	Very high	96.5	Very high	73 Å²	73	44.1 Å²	44.1	34%	0.341	20%	0.201	S	C	.	.			trans	50.4	38.7	-177.8	-56.7	-69.6	4.9	0	0	113.2	F211 Q212 D242 N267 I268	F211-Q240 WeakPolarHBondContact O-CG 3.41Å; Q212-Q240 HydrophobicContact CB-CB 3.7Å; Q212-Q240 HydrophobicContact CB-CG 4.07Å; Q240-D242 PolarHBondContact O-N 3.24Å; Q240-D242 VanDerWaalsContact O-N 3.14Å; Q240-N267 PolarHBondContact N-OD1 3.19Å; Q240-I268 HydrophobicContact CB-CD1 4.32Å; Q240-I268 VanDerWaalsContact OE1-CG2 3.27Å
241	V	96.6	Very high	96.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	22%	0.217	C	C	.	.			trans	-68.8	110.9	174	-178.4	0	0	0	0	108.9	I213 I236 S239 K245 C246 N267 I268 L269	I213-V241 HydrophobicContact CG2-CG2 3.84Å; I236-V241 HydrophobicContact CG2-CG2 3.77Å; S239-V241 PolarHBondContact O-N 3.29Å; S239-V241 VanDerWaalsContact O-N 3.16Å; V241-K245 HydrophobicContact CG1-CB 4.27Å; V241-C246 HydrophobicContact CG1-CB 3.81Å; V241-N267 HydrophobicContact CB-CB 3.97Å; V241-N267 WeakPolarHBondContact CG2-OD1 3.49Å; V241-N267 PolarHBondContact N-OD1 3.41Å; V241-N267 VanDerWaalsContact N-OD1 3.1Å; V241-N267 WeakPolarHBondContact O-CB 3.4Å; V241-I268 CarbonylContact O-C 3.6Å; V241-I268 WeakPolarHBondContact O-CG1 3.16Å; V241-I268 PolarHBondContact O-N 3.27Å; V241-I268 VanDerWaalsContact O-N 3.17Å; V241-L269 HydrophobicContact CG1-CD2 4.2Å
242	D	96.6	Very high	96.2	Very high	34 Å²	34	51.1 Å²	51.1	18%	0.182	23%	0.226	C	C	.	.			trans	-90.5	179.6	173.3	66.6	41.6	0	0	0	112.8	Q240 K244 K245 C246 I268	Q240-D242 PolarHBondContact O-N 3.24Å; Q240-D242 VanDerWaalsContact O-N 3.14Å; D242-K244 VanDerWaalsContact C-N 3.31Å; D242-K244 PolarHBondContact O-N 2.79Å; D242-K244 WeakPolarHBondContact OD1-CA 3.26Å; D242-K244 VanDerWaalsContact OD1-CB 3.31Å; D242-K244 WeakPolarHBondContact OD1-CB 3.39Å; D242-K244 PolarHBondContact OD1-N 3.02Å; D242-K245 PolarHBondContact O-N 3.2Å; D242-K245 WeakPolarHBondContact OD1-CG 3.42Å; D242-K245 PolarHBondContact OD1-N 3.27Å; D242-K245 IonicContact OD2-NZ 3.4Å; D242-K245 PolarHBondContact OD2-NZ 3.49Å; D242-C246 WeakPolarHBondContact O-CB 3.44Å; D242-C246 PolarHBondContact O-N 3.12Å; D242-I268 HydrophobicContact CB-CD1 3.74Å; D242-I268 HydrophobicContact CB-CG1 3.87Å
243	D	97.4	Very high	96.1	Very high	40 Å²	40	47.8 Å²	47.8	21%	0.214	21%	0.211	C	C	.	.	H	α-helix	trans	-57.8	-38.5	178.3	-70.8	-1.4	0	0	0	113.9	R247 R270 G272 G273	D243-R247 WeakPolarHBondContact O-CB 3.27Å; D243-R247 PolarHBondContact O-N 2.97Å; D243-R270 PolarHBondContact OD1-N 3.27Å; D243-G272 WeakPolarHBondContact OD2-CA 3.42Å; D243-G272 PolarHBondContact OD2-N 2.62Å; D243-G273 VanDerWaalsContact OD1-CA 3.32Å; D243-G273 WeakPolarHBondContact OD1-CA 3.46Å; D243-G273 PolarHBondContact OD1-N 3.13Å; D243-G273 PolarHBondContact OD2-N 3.33Å
244	K	95.8	Very high	95.8	Very high	171 Å²	171	48.3 Å²	48.3	74%	0.743	21%	0.213	S	C	*	.	H	α-helix	trans	-69.6	-43.8	-178.8	-64.2	179.7	179.6	175.9	0	110.1	D242 P248	D242-K244 VanDerWaalsContact C-N 3.31Å; D242-K244 PolarHBondContact O-N 2.79Å; D242-K244 WeakPolarHBondContact OD1-CA 3.26Å; D242-K244 VanDerWaalsContact OD1-CB 3.31Å; D242-K244 WeakPolarHBondContact OD1-CB 3.39Å; D242-K244 PolarHBondContact OD1-N 3.02Å; K244-P248 WeakPolarHBondContact O-CD 3.09Å
245	K	95.1	Very high	95.3	Very high	17 Å²	17	55 Å²	55	7%	0.074	25%	0.249	C	C	.	.	H	α-helix	trans	-72.7	-38.2	179.6	-65.3	-170.4	-170.8	90.8	0	112.4	I213 V241 D242 P248 L249	I213-K245 HydrophobicContact CG2-CD 3.8Å; I213-K245 VanDerWaalsContact O-CD 3.31Å; I213-K245 WeakPolarHBondContact O-CD 3.41Å; I213-K245 WeakPolarHBondContact O-CE 3.41Å; V241-K245 HydrophobicContact CG1-CB 4.27Å; D242-K245 PolarHBondContact O-N 3.2Å; D242-K245 WeakPolarHBondContact OD1-CG 3.42Å; D242-K245 PolarHBondContact OD1-N 3.27Å; D242-K245 IonicContact OD2-NZ 3.4Å; D242-K245 PolarHBondContact OD2-NZ 3.49Å; K245-P248 WeakPolarHBondContact O-CD 3.28Å; K245-P248 WeakPolarHBondContact O-CG 3.42Å; K245-L249 WeakPolarHBondContact O-CD1 3.47Å; K245-L249 WeakPolarHBondContact O-CG 3.47Å
246	C	96	Very high	95.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-43.1	178.8	-176.1	0	0	0	0	112.5	V241 D242 L249 L250 L269	V241-C246 HydrophobicContact CG1-CB 3.81Å; D242-C246 WeakPolarHBondContact O-CB 3.44Å; D242-C246 PolarHBondContact O-N 3.12Å; C246-L249 WeakPolarHBondContact O-CB 3.47Å; C246-L249 PolarHBondContact O-N 3.21Å; C246-L250 WeakPolarHBondContact O-CG 3.25Å; C246-L250 PolarHBondContact O-N 3.07Å; C246-L250 WeakPolarHBondContact SG-CD1 3.44Å; C246-L269 HydrophobicContact CB-CD2 3.48Å; C246-L269 VanDerWaalsContact CB-CD2 3.48Å; C246-L269 VanDerWaalsContact SG-CD2 3.58Å
247	R	95.9	Very high	94.9	Very high	136 Å²	136	56 Å²	56	51%	0.513	26%	0.263	S	S	.	.	H	α-helix	trans	-54.4	-53.5	-174.1	-174.3	176.9	-170.6	155.6	6.4	114.7	D243 L249 L250 R251	D243-R247 WeakPolarHBondContact O-CB 3.27Å; D243-R247 PolarHBondContact O-N 2.97Å; R247-L249 VanDerWaalsContact C-N 3.34Å; R247-L250 PolarHBondContact O-N 3.41Å; R247-R251 VanDerWaalsContact O-CB 3.27Å; R247-R251 WeakPolarHBondContact O-CB 3.25Å; R247-R251 PolarHBondContact O-N 3.36Å
248	P	95.1	Very high	94.8	Very high	51 Å²	51	53.4 Å²	53.4	33%	0.331	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-38.4	178.7	24.9	-33.6	0	0	0	112.4	K244 K245 L250 R251 C252	K244-P248 WeakPolarHBondContact O-CD 3.09Å; K245-P248 WeakPolarHBondContact O-CD 3.28Å; K245-P248 WeakPolarHBondContact O-CG 3.42Å; P248-L250 PolarHBondContact O-N 2.83Å; P248-R251 PolarHBondContact O-N 3.44Å; P248-C252 PolarHBondContact O-N 3.21Å
249	L	94.9	Very high	94.9	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-60	-45.7	177.9	-68.1	173.2	0	0	0	111.5	C218 L221 F225 I236 K245 C246 R247 C252 L253	C218-L249 HydrophobicContact CB-CD2 4.39Å; C218-L249 HydrophobicContact CB-CG 4.38Å; L221-L249 HydrophobicContact CB-CD2 3.78Å; L221-L249 HydrophobicContact CD1-CD2 4.21Å; F225-L249 HydrophobicContact CE2-CD2 4.2Å; I236-L249 HydrophobicContact CD1-CD1 4.24Å; K245-L249 WeakPolarHBondContact O-CD1 3.47Å; K245-L249 WeakPolarHBondContact O-CG 3.47Å; C246-L249 WeakPolarHBondContact O-CB 3.47Å; C246-L249 PolarHBondContact O-N 3.21Å; R247-L249 VanDerWaalsContact C-N 3.34Å; L249-C252 PolarHBondContact O-SG 2.86Å; L249-L253 WeakPolarHBondContact O-CD1 3.02Å; L249-L253 VanDerWaalsContact O-CG 3.31Å; L249-L253 WeakPolarHBondContact O-CG 3.38Å
250	L	96.1	Very high	95	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-77.4	-31.7	-179.5	-61.3	-166.9	0	0	0	112.8	C246 R247 P248 C252 L253 M254 L262 L264 V277 L280	C246-L250 WeakPolarHBondContact O-CG 3.25Å; C246-L250 PolarHBondContact O-N 3.07Å; C246-L250 WeakPolarHBondContact SG-CD1 3.44Å; R247-L250 PolarHBondContact O-N 3.41Å; P248-L250 PolarHBondContact O-N 2.83Å; L250-C252 VanDerWaalsContact C-N 3.3Å; L250-C252 PolarHBondContact O-N 2.82Å; L250-L253 HydrophobicContact CD2-CD1 4.18Å; L250-L253 PolarHBondContact O-N 3.45Å; L250-M254 PolarHBondContact O-N 3.09Å; L250-L262 HydrophobicContact CD1-CD2 4.46Å; L250-L262 HydrophobicContact CD2-CD1 4.27Å; L250-L262 HydrophobicContact CD2-CD2 3.63Å; L250-L264 HydrophobicContact CD1-CD1 4.27Å; L250-L264 HydrophobicContact CD2-CD1 4.24Å; L250-V277 HydrophobicContact CD1-CB 4.25Å; L250-V277 HydrophobicContact CD1-CG2 3.47Å; L250-V277 VanDerWaalsContact CD1-CG2 3.47Å; L250-L280 HydrophobicContact CD2-CD2 4.12Å
251	R	93.8	Very high	95.2	Very high	170 Å²	170	49.2 Å²	49.2	64%	0.642	24%	0.24	S	C	*	.	H	α-helix	trans	-61.4	-37.5	179.2	-169	-180	180	169.7	0.9	112.1	R247 P248 L253 M254	R247-R251 VanDerWaalsContact O-CB 3.27Å; R247-R251 WeakPolarHBondContact O-CB 3.25Å; R247-R251 PolarHBondContact O-N 3.36Å; P248-R251 PolarHBondContact O-N 3.44Å; R251-L253 PolarHBondContact O-N 2.94Å; R251-M254 HydrophobicContact CB-CE 4.45Å; R251-M254 HydrophobicContact CG-CE 3.65Å; R251-M254 WeakPolarHBondContact O-CE 3.32Å
252	C	92.3	Very high	95.3	Very high	28 Å²	28	49.2 Å²	49.2	19%	0.189	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-14.2	176.8	66.8	0	0	0	0	113.8	T222 P248 L249 L250	T222-C252 HydrophobicContact CG2-CB 3.92Å; P248-C252 PolarHBondContact O-N 3.21Å; L249-C252 PolarHBondContact O-SG 2.86Å; L250-C252 VanDerWaalsContact C-N 3.3Å; L250-C252 PolarHBondContact O-N 2.82Å
253	L	94.6	Very high	95.4	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.01	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-9.8	-178	-62.8	173	0	0	0	113.6	F225 L234 L249 L250 R251 D255 H256 L259 L280	F225-L253 HydrophobicContact CB-CD2 4.08Å; F225-L253 HydrophobicContact CD2-CD2 4.06Å; F225-L253 HydrophobicContact CD2-CG 4.49Å; F225-L253 HydrophobicContact CG-CD2 4.18Å; L234-L253 HydrophobicContact CD2-CD1 3.51Å; L249-L253 WeakPolarHBondContact O-CD1 3.02Å; L249-L253 VanDerWaalsContact O-CG 3.31Å; L249-L253 WeakPolarHBondContact O-CG 3.38Å; L250-L253 HydrophobicContact CD2-CD1 4.18Å; L250-L253 PolarHBondContact O-N 3.45Å; R251-L253 PolarHBondContact O-N 2.94Å; L253-D255 PolarHBondContact O-N 3.08Å; L253-H256 HydrophobicContact CD2-CB 4.4Å; L253-H256 VanDerWaalsContact O-CB 3.26Å; L253-H256 WeakPolarHBondContact O-CB 3.49Å; L253-H256 PolarHBondContact O-N 3.48Å; L253-L259 HydrophobicContact CB-CD2 4.04Å; L253-L259 HydrophobicContact CD1-CD2 4.07Å; L253-L259 HydrophobicContact CD2-CD2 4.31Å; L253-L259 HydrophobicContact CG-CD2 4.36Å; L253-L280 HydrophobicContact CB-CD1 4.29Å
254	M	92.1	Very high	95.4	Very high	23 Å²	23	46 Å²	46	11%	0.113	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-37.4	-178	-67.4	-171.6	-62.4	0	0	113.4	L250 R251 L280 K283	L250-M254 PolarHBondContact O-N 3.09Å; R251-M254 HydrophobicContact CB-CE 4.45Å; R251-M254 HydrophobicContact CG-CE 3.65Å; R251-M254 WeakPolarHBondContact O-CE 3.32Å; M254-L280 HydrophobicContact CG-CD1 4.28Å; M254-K283 HydrophobicContact CB-CB 4.46Å; M254-K283 HydrophobicContact SD-CD 3.84Å
255	D	88.9	Confident	95.6	Very high	142 Å²	142	37.9 Å²	37.9	76%	0.759	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.1	18.4	179.9	-56.2	-50.5	0	0	0	112.2	L253	L253-D255 PolarHBondContact O-N 3.08Å
256	H	93.9	Very high	95.7	Very high	14 Å²	14	40.5 Å²	40.5	7%	0.065	20%	0.2	C	C	.	.			trans	-67.1	126.7	-178.9	-165	-81.2	0	0	0	110.4	C228 L231 L253 S258 L259	C228-H256 PolarHBondContact O-NE2 2.85Å; L231-H256 PolarHBondContact O-CE1 3.07Å; L231-H256 PolarHBondContact O-ND1 3.34Å; L253-H256 HydrophobicContact CD2-CB 4.4Å; L253-H256 VanDerWaalsContact O-CB 3.26Å; L253-H256 WeakPolarHBondContact O-CB 3.49Å; L253-H256 PolarHBondContact O-N 3.48Å; H256-S258 VanDerWaalsContact C-N 3.32Å; H256-S258 PolarHBondContact CE1-OG 2.7Å; H256-S258 PolarHBondContact ND1-N 2.84Å; H256-S258 PolarHBondContact O-N 2.58Å; H256-L259 HydrophobicContact CB-CB 3.98Å; H256-L259 PolarHBondContact ND1-N 3.31Å
257	P	93.9	Very high	95.8	Very high	74 Å²	74	40.9 Å²	40.9	48%	0.481	20%	0.202	S	C	.	.	S	Bend	trans	-70.7	-25.4	-167.1	27	-36.2	0	0	0	114.3	K229	K229-P257 HydrophobicContact CB-CG 4.04Å; K229-P257 HydrophobicContact CD-CG 4.05Å; K229-P257 WeakPolarHBondContact O-CG 3.45Å
258	S	95.6	Very high	95.9	Very high	30 Å²	30	36.6 Å²	36.6	21%	0.21	19%	0.189	C	C	.	.	S	Bend	trans	-125.9	0.7	-170.6	60	0	0	0	0	115.2	K229 T230 L231 K232 H256 I260	K229-S258 PolarHBondContact O-OG 2.76Å; T230-S258 VanDerWaalsContact C-OG 3.28Å; L231-S258 PolarHBondContact N-OG 2.6Å; L231-S258 CarbonylContact O-C 3.32Å; L231-S258 PolarHBondContact O-OG 2.87Å; K232-S258 WeakPolarHBondContact CA-O 3.04Å; H256-S258 VanDerWaalsContact C-N 3.32Å; H256-S258 PolarHBondContact CE1-OG 2.7Å; H256-S258 PolarHBondContact ND1-N 2.84Å; H256-S258 PolarHBondContact O-N 2.58Å; S258-I260 PolarHBondContact O-N 2.68Å
259	L	97.5	Very high	96	Very high	7 Å²	7	34.2 Å²	34.2	4%	0.037	17%	0.173	C	C	.	.			trans	-73.4	121	-173.2	-172.2	75.1	0	0	0	109.9	L231 L234 L253 H256 L286	L231-L259 PolarHBondContact O-N 2.98Å; L234-L259 HydrophobicContact CB-CD1 3.97Å; L253-L259 HydrophobicContact CB-CD2 4.04Å; L253-L259 HydrophobicContact CD1-CD2 4.07Å; L253-L259 HydrophobicContact CD2-CD2 4.31Å; L253-L259 HydrophobicContact CG-CD2 4.36Å; H256-L259 HydrophobicContact CB-CB 3.98Å; H256-L259 PolarHBondContact ND1-N 3.31Å; L259-L286 HydrophobicContact CD2-CD1 4.36Å; L259-L286 HydrophobicContact CG-CD1 4.28Å
260	I	98	Very high	96.2	Very high	63 Å²	63	40.9 Å²	40.9	32%	0.323	20%	0.198	S	C	.	.			trans	-119	-25.7	-177.7	58.4	169.7	0	0	0	112.7	K232 S258 L286 E287 K288	K232-I260 HydrophobicContact CB-CD1 4.19Å; K232-I260 HydrophobicContact CB-CG1 3.95Å; K232-I260 WeakPolarHBondContact O-CG1 3.39Å; K232-I260 PolarHBondContact O-N 2.81Å; S258-I260 PolarHBondContact O-N 2.68Å; I260-L286 WeakPolarHBondContact O-CD1 3.28Å; I260-E287 PolarHBondContact O-N 3.33Å; I260-K288 PolarHBondContact O-N 2.98Å
261	E	98.7	Very high	96.3	Very high	23 Å²	23	42.6 Å²	42.6	11%	0.107	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	130.5	-178.4	-178.5	174	142.6	0	0	111.1	K232 V233 L234 R235 K288	K232-E261 PolarHBondContact O-N 3.1Å; V233-E261 HydrophobicContact CB-CB 4.34Å; V233-E261 HydrophobicContact CG1-CB 4.06Å; V233-E261 HydrophobicContact CG1-CG 4.01Å; V233-E261 HydrophobicContact CG2-CB 4.07Å; L234-E261 PolarHBondContact N-O 3.44Å; R235-E261 IonicContact CZ-OE1 3.33Å; R235-E261 VanDerWaalsContact CZ-OE1 3.23Å; R235-E261 IonicContact NE-OE1 2.76Å; R235-E261 PolarHBondContact NE-OE1 2.98Å; R235-E261 IonicContact NH2-OE1 3.51Å; R235-E261 PolarHBondContact NH2-OE1 3.49Å; E261-K288 WeakPolarHBondContact CA-O 3.34Å; E261-K288 HydrophobicContact CB-CB 4.08Å; E261-K288 HydrophobicContact CG-CB 3.85Å; E261-K288 HydrophobicContact CG-CD 4.36Å; E261-K288 VanDerWaalsContact OE2-CD 3.25Å; E261-K288 WeakPolarHBondContact OE2-CD 3.44Å; E261-K288 IonicContact OE2-NZ 2.75Å
262	L	98.8	Very high	96.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	127.7	175.1	176.7	65.7	0	0	0	108.7	L234 L250 L264 L280 L286 K288 L289 N290	L234-L262 HydrophobicContact CB-CD1 4.32Å; L234-L262 HydrophobicContact CD2-CD1 4.13Å; L234-L262 HydrophobicContact CG-CD1 4.28Å; L234-L262 WeakPolarHBondContact O-CA 3.36Å; L250-L262 HydrophobicContact CD1-CD2 4.46Å; L250-L262 HydrophobicContact CD2-CD1 4.27Å; L250-L262 HydrophobicContact CD2-CD2 3.63Å; L262-L264 HydrophobicContact CD1-CD1 4.44Å; L262-L264 HydrophobicContact CD1-CD2 4.23Å; L262-L264 HydrophobicContact CD1-CG 4.06Å; L262-L264 HydrophobicContact CD2-CD1 4.14Å; L262-L264 HydrophobicContact CD2-CG 4.45Å; L262-L264 HydrophobicContact CG-CD1 4.39Å; L262-L264 HydrophobicContact CG-CG 4.16Å; L262-L280 HydrophobicContact CD2-CD2 3.62Å; L262-L286 HydrophobicContact CB-CD1 3.78Å; L262-L286 HydrophobicContact CB-CD2 3.85Å; L262-L286 HydrophobicContact CB-CG 4.46Å; L262-K288 PolarHBondContact N-O 3.47Å; L262-L289 HydrophobicContact CB-CD1 4.31Å; L262-L289 HydrophobicContact CD2-CD1 4.11Å; L262-L289 HydrophobicContact CG-CD1 4.31Å; L262-L289 WeakPolarHBondContact O-CA 3.25Å; L262-N290 PolarHBondContact O-N 2.96Å
263	D	98.8	Very high	96.8	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	115.2	177.2	-165.1	114.6	0	0	0	111	L234 R235 I236 R237 A265 N290	L234-D263 PolarHBondContact O-N 2.95Å; R235-D263 CarbonylContact C-O 3.05Å; R235-D263 WeakPolarHBondContact CA-O 3.4Å; R235-D263 HydrophobicContact CB-CB 3.87Å; R235-D263 HydrophobicContact CG-CB 3.56Å; I236-D263 PolarHBondContact N-O 2.95Å; R237-D263 WeakPolarHBondContact CD-OD2 3.29Å; R237-D263 WeakPolarHBondContact CG-OD2 3.09Å; R237-D263 IonicContact CZ-OD1 3.67Å; R237-D263 VanDerWaalsContact CZ-OD1 3.31Å; R237-D263 IonicContact CZ-OD2 2.85Å; R237-D263 IonicContact NE-OD1 2.78Å; R237-D263 PolarHBondContact NE-OD1 3.22Å; R237-D263 IonicContact NE-OD2 3.94Å; R237-D263 PolarHBondContact NE-OD2 3.33Å; R237-D263 VanDerWaalsContact NH2-CG 3.32Å; R237-D263 IonicContact NH2-OD1 2.89Å; R237-D263 PolarHBondContact NH2-OD1 3.26Å; R237-D263 IonicContact NH2-OD2 2.99Å; D263-A265 WeakPolarHBondContact OD2-CB 3.08Å; D263-A265 PolarHBondContact OD2-N 2.99Å; D263-A265 VanDerWaalsContact OD2-N 3.15Å; D263-N290 WeakPolarHBondContact CA-O 3.25Å; D263-N290 HydrophobicContact CB-CB 4.43Å; D263-N290 WeakPolarHBondContact OD1-CB 3.48Å; D263-N290 VanDerWaalsContact OD1-CG 3.29Å; D263-N290 PolarHBondContact OD1-ND2 3.24Å
264	L	98.6	Very high	97	Very high	4 Å²	4	34.1 Å²	34.1	2%	0.021	18%	0.178	C	C	.	.			trans	-121.6	31.6	176.2	-60.8	174.7	0	0	0	110.3	I236 L250 L262 N267 L269 V277 N290 I291 N294	I236-L264 HydrophobicContact CB-CD2 4.03Å; L250-L264 HydrophobicContact CD1-CD1 4.27Å; L250-L264 HydrophobicContact CD2-CD1 4.24Å; L262-L264 HydrophobicContact CD1-CD1 4.44Å; L262-L264 HydrophobicContact CD1-CD2 4.23Å; L262-L264 HydrophobicContact CD1-CG 4.06Å; L262-L264 HydrophobicContact CD2-CD1 4.14Å; L262-L264 HydrophobicContact CD2-CG 4.45Å; L262-L264 HydrophobicContact CG-CD1 4.39Å; L262-L264 HydrophobicContact CG-CG 4.16Å; L264-N267 VanDerWaalsContact C-ND2 3.27Å; L264-N267 PolarHBondContact O-ND2 3.24Å; L264-L269 HydrophobicContact CB-CD1 3.88Å; L264-L269 HydrophobicContact CD1-CD1 3.83Å; L264-V277 HydrophobicContact CD1-CG2 4.45Å; L264-N290 PolarHBondContact N-O 2.96Å; L264-I291 HydrophobicContact CB-CG2 4.41Å; L264-N294 PolarHBondContact O-ND2 3Å
265	A	98.6	Very high	97.3	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.008	19%	0.192	C	C	.	.			trans	-66.7	147.8	-177.6	0	0	0	0	0	111.9	R237 Q238 D263 N267 C292	R237-A265 VanDerWaalsContact CA-O 3.29Å; R237-A265 WeakPolarHBondContact CA-O 3.35Å; R237-A265 HydrophobicContact CG-CB 4.41Å; Q238-A265 PolarHBondContact N-O 3.15Å; D263-A265 WeakPolarHBondContact OD2-CB 3.08Å; D263-A265 PolarHBondContact OD2-N 2.99Å; D263-A265 VanDerWaalsContact OD2-N 3.15Å; A265-N267 PolarHBondContact O-ND2 3.43Å; A265-C292 CarbonylContact C-O 3.58Å; A265-C292 WeakPolarHBondContact CA-O 3.49Å; A265-C292 HydrophobicContact CB-CB 4.1Å; A265-C292 WeakPolarHBondContact CB-O 3.47Å
266	H	98.1	Very high	97.7	Very high	71 Å²	71	31.8 Å²	31.8	33%	0.329	16%	0.159	S	C	.	.	S	Bend	trans	59.4	49.8	-179.7	-53	-84.5	0	0	0	113	Q238 C292 N293	Q238-H266 WeakPolarHBondContact CA-O 3.42Å; Q238-H266 HydrophobicContact CB-CB 4.48Å; Q238-H266 HydrophobicContact CG-CB 3.49Å; Q238-H266 VanDerWaalsContact CG-CB 3.49Å; Q238-H266 PolarHBondContact N-O 3.33Å; Q238-H266 VanDerWaalsContact N-O 3.08Å; H266-C292 PolarHBondContact N-O 2.86Å; H266-N293 WeakPolarHBondContact CA-O 3.28Å; H266-N293 PolarHBondContact N-O 2.64Å; H266-N293 WeakPolarHBondContact ND1-CB 3.45Å; H266-N293 PolarHBondContact ND1-ND2 3.37Å
267	N	98.3	Very high	98	Very high	8 Å²	8	31.2 Å²	31.2	4%	0.043	16%	0.156	C	C	.	.	S	Bend	trans	-122.6	-163.2	169.2	-69	-70.7	0	0	0	109.2	I236 S239 Q240 V241 L264 A265 N293 N294	I236-N267 PolarHBondContact O-ND2 3.14Å; S239-N267 PolarHBondContact N-OD1 3.1Å; Q240-N267 PolarHBondContact N-OD1 3.19Å; V241-N267 HydrophobicContact CB-CB 3.97Å; V241-N267 WeakPolarHBondContact CG2-OD1 3.49Å; V241-N267 PolarHBondContact N-OD1 3.41Å; V241-N267 VanDerWaalsContact N-OD1 3.1Å; V241-N267 WeakPolarHBondContact O-CB 3.4Å; L264-N267 VanDerWaalsContact C-ND2 3.27Å; L264-N267 PolarHBondContact O-ND2 3.24Å; A265-N267 PolarHBondContact O-ND2 3.43Å; N267-N293 PolarHBondContact N-O 3.25Å; N267-N294 WeakPolarHBondContact CA-OD1 3.31Å; N267-N294 WeakPolarHBondContact CB-OD1 3.39Å; N267-N294 PolarHBondContact N-OD1 3.33Å; N267-N294 PolarHBondContact O-OD1 2.79Å; N267-N294 VanDerWaalsContact O-OD1 3.09Å
268	I	97.4	Very high	98.2	Very high	47 Å²	47	27.9 Å²	27.9	24%	0.241	14%	0.135	C	C	.	.			trans	-119.2	42	-177.3	50.2	170.3	0	0	0	110.6	Q240 V241 D242 R270 N294	Q240-I268 HydrophobicContact CB-CD1 4.32Å; Q240-I268 VanDerWaalsContact OE1-CG2 3.27Å; V241-I268 CarbonylContact O-C 3.6Å; V241-I268 WeakPolarHBondContact O-CG1 3.16Å; V241-I268 PolarHBondContact O-N 3.27Å; V241-I268 VanDerWaalsContact O-N 3.17Å; D242-I268 HydrophobicContact CB-CD1 3.74Å; D242-I268 HydrophobicContact CB-CG1 3.87Å; I268-R270 PolarHBondContact O-N 2.85Å; I268-N294 PolarHBondContact N-OD1 2.74Å
269	L	98	Very high	98.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.141	C	C	.	.			trans	-69.1	124.8	173.4	-58	-179.9	0	0	0	109.7	V241 C246 L264 I291 N294 E295 I296	V241-L269 HydrophobicContact CG1-CD2 4.2Å; C246-L269 HydrophobicContact CB-CD2 3.48Å; C246-L269 VanDerWaalsContact CB-CD2 3.48Å; C246-L269 VanDerWaalsContact SG-CD2 3.58Å; L264-L269 HydrophobicContact CB-CD1 3.88Å; L264-L269 HydrophobicContact CD1-CD1 3.83Å; L269-I291 HydrophobicContact CD1-CG2 4.32Å; L269-N294 HydrophobicContact CB-CB 4.04Å; L269-N294 WeakPolarHBondContact CB-OD1 3.4Å; L269-N294 VanDerWaalsContact CG-OD1 3.3Å; L269-N294 WeakPolarHBondContact CG-OD1 3.11Å; L269-N294 PolarHBondContact N-OD1 3Å; L269-E295 CarbonylContact O-C 3.3Å; L269-E295 WeakPolarHBondContact O-CA 3.33Å; L269-E295 PolarHBondContact O-N 3.16Å; L269-I296 HydrophobicContact CB-CG1 4.44Å; L269-I296 WeakPolarHBondContact O-CG1 3.4Å; L269-I296 PolarHBondContact O-N 2.93Å
270	R	98.3	Very high	98.2	Very high	144 Å²	144	29.7 Å²	29.7	54%	0.543	14%	0.14	S	C	.	.			trans	-105.8	-158.1	170	-61.4	177.2	179.5	168.6	4.2	108.9	D243 I268 G272 G273 A274 E295	D243-R270 PolarHBondContact OD1-N 3.27Å; I268-R270 PolarHBondContact O-N 2.85Å; R270-G272 VanDerWaalsContact C-N 3.26Å; R270-G272 PolarHBondContact O-N 2.98Å; R270-G273 PolarHBondContact O-N 3.35Å; R270-A274 PolarHBondContact O-N 2.91Å; R270-E295 WeakPolarHBondContact CA-O 3.41Å; R270-E295 HydrophobicContact CG-CB 3.78Å; R270-E295 IonicContact CZ-OE2 3.73Å; R270-E295 IonicContact NE-OE2 2.67Å; R270-E295 PolarHBondContact NE-OE2 3.08Å; R270-E295 IonicContact NH2-OE2 3.4Å; R270-E295 PolarHBondContact NH2-OE2 2.96Å
271	D	98.4	Very high	98.2	Very high	41 Å²	41	26.9 Å²	26.9	22%	0.219	13%	0.126	C	C	.	.	H	α-helix	trans	-63.3	-28.2	-177	-61.9	-24.4	0	0	0	113.8	R275 D297 H299 G300	D271-R275 WeakPolarHBondContact O-CB 3.5Å; D271-R275 PolarHBondContact O-N 3Å; D271-D297 PolarHBondContact OD1-N 3.23Å; D271-D297 VanDerWaalsContact OD1-N 3.12Å; D271-H299 WeakPolarHBondContact OD2-CB 3.36Å; D271-G300 VanDerWaalsContact OD1-CA 3.25Å; D271-G300 WeakPolarHBondContact OD1-CA 3.49Å; D271-G300 PolarHBondContact OD1-N 2.72Å
272	G	98.3	Very high	98	Very high	22 Å²	22	29.7 Å²	29.7	23%	0.227	15%	0.148	C	C	.	.	H	α-helix	trans	-71.6	-37.3	175.2	0	0	0	0	0	112.7	D243 R270 R275 S276	D243-G272 WeakPolarHBondContact OD2-CA 3.42Å; D243-G272 PolarHBondContact OD2-N 2.62Å; R270-G272 VanDerWaalsContact C-N 3.26Å; R270-G272 PolarHBondContact O-N 2.98Å; G272-R275 WeakPolarHBondContact O-CB 3.35Å; G272-R275 PolarHBondContact O-N 3.28Å; G272-S276 PolarHBondContact O-N 3.28Å; G272-S276 VanDerWaalsContact O-N 3.12Å; G272-S276 PolarHBondContact O-OG 3.38Å; G272-S276 VanDerWaalsContact O-OG 3.09Å
273	G	98.1	Very high	97.7	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.3	-46	171.4	0	0	0	0	0	110.7	D243 R270 R275 S276 V277	D243-G273 VanDerWaalsContact OD1-CA 3.32Å; D243-G273 WeakPolarHBondContact OD1-CA 3.46Å; D243-G273 PolarHBondContact OD1-N 3.13Å; D243-G273 PolarHBondContact OD2-N 3.33Å; R270-G273 PolarHBondContact O-N 3.35Å; G273-R275 VanDerWaalsContact C-N 3.28Å; G273-R275 PolarHBondContact O-N 3.46Å; G273-S276 WeakPolarHBondContact O-CB 3.45Å; G273-S276 PolarHBondContact O-N 2.97Å; G273-V277 WeakPolarHBondContact O-CG2 3.31Å; G273-V277 PolarHBondContact O-N 3.45Å
274	A	98.6	Very high	97.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-57.3	-39.8	174.1	0	0	0	0	0	112.3	R270 V277 A278 I296 L304	R270-A274 PolarHBondContact O-N 2.91Å; A274-V277 PolarHBondContact O-N 2.89Å; A274-A278 WeakPolarHBondContact O-CB 3.4Å; A274-A278 PolarHBondContact O-N 2.85Å; A274-I296 HydrophobicContact CB-CD1 4.21Å; A274-I296 HydrophobicContact CB-CG1 4.27Å; A274-I296 HydrophobicContact CB-CG2 3.93Å; A274-L304 HydrophobicContact CB-CD1 3.96Å; A274-L304 HydrophobicContact CB-CG 4.15Å
275	R	98.6	Very high	97	Very high	107 Å²	107	45 Å²	45	40%	0.404	21%	0.213	S	C	.	.	H	α-helix	trans	-61.4	-44.3	172.7	-175.5	-179.9	-62.6	140.9	3.2	112.3	D271 G272 G273 V277 A278 E279 H299 I303	D271-R275 WeakPolarHBondContact O-CB 3.5Å; D271-R275 PolarHBondContact O-N 3Å; G272-R275 WeakPolarHBondContact O-CB 3.35Å; G272-R275 PolarHBondContact O-N 3.28Å; G273-R275 VanDerWaalsContact C-N 3.28Å; G273-R275 PolarHBondContact O-N 3.46Å; R275-V277 VanDerWaalsContact C-N 3.31Å; R275-V277 PolarHBondContact O-N 2.89Å; R275-A278 PolarHBondContact O-N 3.47Å; R275-E279 WeakPolarHBondContact O-CG 3.46Å; R275-E279 PolarHBondContact O-N 3.05Å; R275-H299 PolarHBondContact NH2-NE2 2.94Å; R275-I303 HydrophobicContact CB-CD1 4.31Å; R275-I303 HydrophobicContact CB-CG2 4.39Å; R275-I303 HydrophobicContact CG-CG2 4.49Å
276	S	98.3	Very high	97	Very high	9 Å²	9	45.1 Å²	45.1	6%	0.063	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-38.5	178.1	-57.2	0	0	0	0	111.7	G272 G273 E279 L280	G272-S276 PolarHBondContact O-N 3.28Å; G272-S276 VanDerWaalsContact O-N 3.12Å; G272-S276 PolarHBondContact O-OG 3.38Å; G272-S276 VanDerWaalsContact O-OG 3.09Å; G273-S276 WeakPolarHBondContact O-CB 3.45Å; G273-S276 PolarHBondContact O-N 2.97Å; S276-E279 PolarHBondContact O-N 3.38Å; S276-L280 PolarHBondContact O-N 3.46Å; S276-L280 VanDerWaalsContact O-N 3.15Å
277	V	98.4	Very high	97	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-64.7	-43.6	172.7	173.5	0	0	0	0	111.1	L250 L264 G273 A274 R275 E279 L280 L281 L289 L304	L250-V277 HydrophobicContact CD1-CB 4.25Å; L250-V277 HydrophobicContact CD1-CG2 3.47Å; L250-V277 VanDerWaalsContact CD1-CG2 3.47Å; L264-V277 HydrophobicContact CD1-CG2 4.45Å; G273-V277 WeakPolarHBondContact O-CG2 3.31Å; G273-V277 PolarHBondContact O-N 3.45Å; A274-V277 PolarHBondContact O-N 2.89Å; R275-V277 VanDerWaalsContact C-N 3.31Å; R275-V277 PolarHBondContact O-N 2.89Å; V277-E279 VanDerWaalsContact C-N 3.35Å; V277-E279 PolarHBondContact O-N 3.46Å; V277-L280 WeakPolarHBondContact O-CB 3.28Å; V277-L280 PolarHBondContact O-N 3.31Å; V277-L280 VanDerWaalsContact O-N 3.16Å; V277-L281 HydrophobicContact CG1-CD1 4.39Å; V277-L281 HydrophobicContact CG1-CG 4.42Å; V277-L281 WeakPolarHBondContact O-CG 3.48Å; V277-L281 PolarHBondContact O-N 2.67Å; V277-L289 HydrophobicContact CG1-CD1 3.98Å; V277-L289 HydrophobicContact CG1-CD2 3.4Å; V277-L289 HydrophobicContact CG1-CG 4.33Å; V277-L304 HydrophobicContact CB-CD2 4.08Å; V277-L304 HydrophobicContact CG1-CD2 3.73Å
278	A	98.3	Very high	97	Very high	5 Å²	5	50.1 Å²	50.1	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-37.9	177.7	0	0	0	0	0	112.9	A274 R275 L280 L281 S282 I303 L304 A307	A274-A278 WeakPolarHBondContact O-CB 3.4Å; A274-A278 PolarHBondContact O-N 2.85Å; R275-A278 PolarHBondContact O-N 3.47Å; A278-L280 VanDerWaalsContact C-N 3.34Å; A278-L281 PolarHBondContact O-N 2.85Å; A278-S282 WeakPolarHBondContact O-CB 3.14Å; A278-S282 PolarHBondContact O-N 2.89Å; A278-S282 PolarHBondContact O-OG 2.75Å; A278-I303 HydrophobicContact CB-CG2 3.53Å; A278-L304 HydrophobicContact CB-CD2 4.15Å; A278-A307 HydrophobicContact CB-CB 3.79Å
279	E	97.5	Very high	97.1	Very high	71 Å²	71	47.9 Å²	47.9	33%	0.332	22%	0.224	S	C	.	.	H	α-helix	trans	-60.9	-43.5	172	-73.9	178.8	-163.7	0	0	111.3	R275 S276 V277 S282 K283	R275-E279 WeakPolarHBondContact O-CG 3.46Å; R275-E279 PolarHBondContact O-N 3.05Å; S276-E279 PolarHBondContact O-N 3.38Å; V277-E279 VanDerWaalsContact C-N 3.35Å; V277-E279 PolarHBondContact O-N 3.46Å; E279-S282 PolarHBondContact O-N 3.02Å; E279-K283 PolarHBondContact O-N 2.81Å
280	L	97.1	Very high	97.1	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-43	174.6	177.7	62.3	0	0	0	111.9	L250 L253 M254 L262 S276 V277 A278 S282 K283 G284	L250-L280 HydrophobicContact CD2-CD2 4.12Å; L253-L280 HydrophobicContact CB-CD1 4.29Å; M254-L280 HydrophobicContact CG-CD1 4.28Å; L262-L280 HydrophobicContact CD2-CD2 3.62Å; S276-L280 PolarHBondContact O-N 3.46Å; S276-L280 VanDerWaalsContact O-N 3.15Å; V277-L280 WeakPolarHBondContact O-CB 3.28Å; V277-L280 PolarHBondContact O-N 3.31Å; V277-L280 VanDerWaalsContact O-N 3.16Å; A278-L280 VanDerWaalsContact C-N 3.34Å; L280-S282 PolarHBondContact O-N 3.19Å; L280-K283 PolarHBondContact O-N 3.06Å; L280-G284 WeakPolarHBondContact O-CA 3.35Å; L280-G284 PolarHBondContact O-N 2.84Å
281	L	96.7	Very high	97.1	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-62.6	-31.2	176.1	-71.2	179.8	0	0	0	112.7	V277 A278 L286 L289 L304 A307 N311 L314	V277-L281 HydrophobicContact CG1-CD1 4.39Å; V277-L281 HydrophobicContact CG1-CG 4.42Å; V277-L281 WeakPolarHBondContact O-CG 3.48Å; V277-L281 PolarHBondContact O-N 2.67Å; A278-L281 PolarHBondContact O-N 2.85Å; L281-L286 HydrophobicContact CD2-CB 4.33Å; L281-L286 HydrophobicContact CD2-CD2 4Å; L281-L289 HydrophobicContact CD1-CD2 3.88Å; L281-L289 HydrophobicContact CD2-CD2 4.09Å; L281-L289 HydrophobicContact CG-CD2 4.25Å; L281-L304 HydrophobicContact CD1-CD2 4.21Å; L281-A307 HydrophobicContact CB-CB 4.18Å; L281-N311 PolarHBondContact O-ND2 3.1Å; L281-L314 HydrophobicContact CD1-CD2 4.42Å; L281-L314 HydrophobicContact CD2-CD1 3.87Å; L281-L314 HydrophobicContact CD2-CD2 4.02Å; L281-L314 HydrophobicContact CD2-CG 4.42Å
282	S	95.3	Very high	97.2	Very high	82 Å²	82	40.3 Å²	40.3	57%	0.573	20%	0.195	S	C	*	.	H	α-helix	trans	-77.9	-24.4	-178	-58.5	0	0	0	0	113.3	A278 E279 L280	A278-S282 WeakPolarHBondContact O-CB 3.14Å; A278-S282 PolarHBondContact O-N 2.89Å; A278-S282 PolarHBondContact O-OG 2.75Å; E279-S282 PolarHBondContact O-N 3.02Å; L280-S282 PolarHBondContact O-N 3.19Å
283	K	91.9	Very high	97.2	Very high	134 Å²	134	42.4 Å²	42.4	58%	0.583	20%	0.201	S	C	*	.	H	α-helix	trans	-116.4	-32.9	-174.5	-66.3	-178.5	-179.7	175.7	0	114.2	M254 E279 L280	M254-K283 HydrophobicContact CB-CB 4.46Å; M254-K283 HydrophobicContact SD-CD 3.84Å; E279-K283 PolarHBondContact O-N 2.81Å; L280-K283 PolarHBondContact O-N 3.06Å
284	G	89.9	Confident	97.2	Very high	14 Å²	14	42.9 Å²	42.9	14%	0.144	20%	0.203	C	C	.	.	S	Bend	trans	-79.9	-176.3	-176.9	0	0	0	0	0	112.9	L280	L280-G284 WeakPolarHBondContact O-CA 3.35Å; L280-G284 PolarHBondContact O-N 2.84Å
285	R	93.1	Very high	97.2	Very high	181 Å²	181	46.1 Å²	46.1	68%	0.683	22%	0.219	S	C	*	.			trans	-116.9	29.3	-180	-61.3	-180	-179.2	174.8	-0.7	112.4	E287	R285-E287 PolarHBondContact O-N 3.38Å
286	L	97.7	Very high	97.2	Very high	3 Å²	3	41 Å²	41	2%	0.016	20%	0.199	C	C	.	.			trans	-63.4	131.9	-174.6	-159.3	74.2	0	0	0	110.4	L259 I260 L262 L281 K288 L289 T313 L314	L259-L286 HydrophobicContact CD2-CD1 4.36Å; L259-L286 HydrophobicContact CG-CD1 4.28Å; I260-L286 WeakPolarHBondContact O-CD1 3.28Å; L262-L286 HydrophobicContact CB-CD1 3.78Å; L262-L286 HydrophobicContact CB-CD2 3.85Å; L262-L286 HydrophobicContact CB-CG 4.46Å; L281-L286 HydrophobicContact CD2-CB 4.33Å; L281-L286 HydrophobicContact CD2-CD2 4Å; L286-K288 WeakPolarHBondContact CG-O 3.5Å; L286-L289 HydrophobicContact CD2-CB 3.84Å; L286-L289 HydrophobicContact CD2-CD1 4Å; L286-L289 HydrophobicContact CD2-CG 4.4Å; L286-T313 CarbonylContact O-C 3.55Å; L286-T313 VanDerWaalsContact O-C 3.28Å; L286-T313 WeakPolarHBondContact O-CB 3.18Å; L286-T313 PolarHBondContact O-OG1 3.06Å; L286-L314 HydrophobicContact CB-CD1 4.46Å; L286-L314 HydrophobicContact CD2-CD1 4.28Å; L286-L314 HydrophobicContact CG-CD1 4.37Å; L286-L314 WeakPolarHBondContact O-CA 3.45Å; L286-L314 PolarHBondContact O-N 3.05Å
287	E	98.6	Very high	97.2	Very high	88 Å²	88	42.5 Å²	42.5	41%	0.411	21%	0.207	S	C	.	.	S	Bend	trans	-103.8	-28.6	176.9	-63.4	-173.2	-173	0	0	111.7	I260 R285 R315 Y316	I260-E287 PolarHBondContact O-N 3.33Å; R285-E287 PolarHBondContact O-N 3.38Å; E287-R315 PolarHBondContact O-N 2.79Å; E287-Y316 PolarHBondContact O-N 2.9Å
288	K	98.9	Very high	97.2	Very high	96 Å²	96	43.6 Å²	43.6	42%	0.417	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	124.5	-178.8	-58.9	-179.3	179.5	174.7	0	111.7	I260 E261 L262 L286 Y316	I260-K288 PolarHBondContact O-N 2.98Å; E261-K288 WeakPolarHBondContact CA-O 3.34Å; E261-K288 HydrophobicContact CB-CB 4.08Å; E261-K288 HydrophobicContact CG-CB 3.85Å; E261-K288 HydrophobicContact CG-CD 4.36Å; E261-K288 VanDerWaalsContact OE2-CD 3.25Å; E261-K288 WeakPolarHBondContact OE2-CD 3.44Å; E261-K288 IonicContact OE2-NZ 2.75Å; L262-K288 PolarHBondContact N-O 3.47Å; L286-K288 WeakPolarHBondContact CG-O 3.5Å; K288-Y316 HydrophobicContact CB-CD1 4.37Å; K288-Y316 HydrophobicContact CG-CG 4.49Å
289	L	98.9	Very high	97.2	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	125.7	176.3	179.4	60.7	0	0	0	110.1	L262 V277 L281 L286 I291 L314 Y316 L317 N318	L262-L289 HydrophobicContact CB-CD1 4.31Å; L262-L289 HydrophobicContact CD2-CD1 4.11Å; L262-L289 HydrophobicContact CG-CD1 4.31Å; L262-L289 WeakPolarHBondContact O-CA 3.25Å; V277-L289 HydrophobicContact CG1-CD1 3.98Å; V277-L289 HydrophobicContact CG1-CD2 3.4Å; V277-L289 HydrophobicContact CG1-CG 4.33Å; L281-L289 HydrophobicContact CD1-CD2 3.88Å; L281-L289 HydrophobicContact CD2-CD2 4.09Å; L281-L289 HydrophobicContact CG-CD2 4.25Å; L286-L289 HydrophobicContact CD2-CB 3.84Å; L286-L289 HydrophobicContact CD2-CD1 4Å; L286-L289 HydrophobicContact CD2-CG 4.4Å; L289-I291 HydrophobicContact CD1-CG2 3.86Å; L289-I291 HydrophobicContact CD2-CD1 4.33Å; L289-I291 HydrophobicContact CG-CG2 4.26Å; L289-L314 HydrophobicContact CB-CD1 3.81Å; L289-L314 HydrophobicContact CB-CD2 4.45Å; L289-Y316 PolarHBondContact N-O 3.38Å; L289-L317 HydrophobicContact CB-CD1 4.18Å; L289-L317 HydrophobicContact CD2-CD1 3.79Å; L289-L317 HydrophobicContact CG-CD1 4.06Å; L289-L317 WeakPolarHBondContact O-CA 3.29Å; L289-N318 PolarHBondContact O-N 2.82Å
290	N	98.9	Very high	97.3	Very high	16 Å²	16	44.6 Å²	44.6	9%	0.086	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	115.9	170.4	-177.7	14.1	0	0	0	110.5	L262 D263 L264 C292 Y316 N318	L262-N290 PolarHBondContact O-N 2.96Å; D263-N290 WeakPolarHBondContact CA-O 3.25Å; D263-N290 HydrophobicContact CB-CB 4.43Å; D263-N290 WeakPolarHBondContact OD1-CB 3.48Å; D263-N290 VanDerWaalsContact OD1-CG 3.29Å; D263-N290 PolarHBondContact OD1-ND2 3.24Å; L264-N290 PolarHBondContact N-O 2.96Å; N290-C292 WeakPolarHBondContact OD1-CB 3.22Å; N290-C292 PolarHBondContact OD1-N 3.3Å; N290-Y316 HydrophobicContact CB-CE1 4.43Å; N290-N318 HydrophobicContact CB-CB 4.32Å; N290-N318 WeakPolarHBondContact OD1-CB 3.08Å; N290-N318 PolarHBondContact OD1-ND2 3.05Å
291	I	98.8	Very high	97.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.			trans	-126.4	28.6	178.2	49.5	176.8	0	0	0	109.8	L264 L269 L289 N294 I296 L304 N318 M319 N322	L264-I291 HydrophobicContact CB-CG2 4.41Å; L269-I291 HydrophobicContact CD1-CG2 4.32Å; L289-I291 HydrophobicContact CD1-CG2 3.86Å; L289-I291 HydrophobicContact CD2-CD1 4.33Å; L289-I291 HydrophobicContact CG-CG2 4.26Å; I291-N294 PolarHBondContact O-ND2 3.37Å; I291-I296 HydrophobicContact CB-CD1 4.3Å; I291-I296 HydrophobicContact CD1-CD1 3.72Å; I291-I296 HydrophobicContact CG1-CD1 4.35Å; I291-L304 HydrophobicContact CD1-CD1 3.72Å; I291-N318 CarbonylContact C-O 3.48Å; I291-N318 WeakPolarHBondContact CG1-O 3.23Å; I291-N318 PolarHBondContact N-O 3.27Å; I291-M319 HydrophobicContact CD1-CE 4.4Å; I291-M319 HydrophobicContact CD1-CG 3.79Å; I291-M319 HydrophobicContact CD1-SD 4.4Å; I291-M319 HydrophobicContact CG1-CG 3.88Å; I291-N322 PolarHBondContact O-ND2 2.96Å
292	C	98.6	Very high	97.5	Very high	11 Å²	11	48.1 Å²	48.1	7%	0.074	23%	0.232	C	C	.	.			trans	-55.9	142.5	176	172.5	0	0	0	0	111.8	A265 H266 N290 N294 N318 R320	A265-C292 CarbonylContact C-O 3.58Å; A265-C292 WeakPolarHBondContact CA-O 3.49Å; A265-C292 HydrophobicContact CB-CB 4.1Å; A265-C292 WeakPolarHBondContact CB-O 3.47Å; H266-C292 PolarHBondContact N-O 2.86Å; N290-C292 WeakPolarHBondContact OD1-CB 3.22Å; N290-C292 PolarHBondContact OD1-N 3.3Å; C292-N294 PolarHBondContact O-ND2 2.97Å; C292-N318 PolarHBondContact N-O 2.79Å; C292-R320 CarbonylContact C-O 3.59Å; C292-R320 WeakPolarHBondContact CA-O 3.22Å; C292-R320 HydrophobicContact CB-CB 4.31Å
293	N	98.6	Very high	97.6	Very high	65 Å²	65	45.6 Å²	45.6	35%	0.348	21%	0.212	S	C	.	.	S	Bend	trans	56.9	59.8	174	-163.5	73.8	0	0	0	112.4	H266 N267 R320 L321	H266-N293 WeakPolarHBondContact CA-O 3.28Å; H266-N293 PolarHBondContact N-O 2.64Å; H266-N293 WeakPolarHBondContact ND1-CB 3.45Å; H266-N293 PolarHBondContact ND1-ND2 3.37Å; N267-N293 PolarHBondContact N-O 3.25Å; N293-R320 PolarHBondContact N-O 3.43Å; N293-L321 WeakPolarHBondContact CA-O 3.38Å; N293-L321 HydrophobicContact CB-CB 4.04Å; N293-L321 HydrophobicContact CB-CD1 4.39Å; N293-L321 PolarHBondContact N-O 2.91Å
294	N	98.8	Very high	98	Very high	10 Å²	10	39.4 Å²	39.4	5%	0.053	19%	0.185	C	C	.	.	S	Bend	trans	-124.3	-173.1	171.3	-79.8	-82.7	0	0	0	108.7	L264 N267 I268 L269 I291 C292 I296 L321 N322	L264-N294 PolarHBondContact O-ND2 3Å; N267-N294 WeakPolarHBondContact CA-OD1 3.31Å; N267-N294 WeakPolarHBondContact CB-OD1 3.39Å; N267-N294 PolarHBondContact N-OD1 3.33Å; N267-N294 PolarHBondContact O-OD1 2.79Å; N267-N294 VanDerWaalsContact O-OD1 3.09Å; I268-N294 PolarHBondContact N-OD1 2.74Å; L269-N294 HydrophobicContact CB-CB 4.04Å; L269-N294 WeakPolarHBondContact CB-OD1 3.4Å; L269-N294 VanDerWaalsContact CG-OD1 3.3Å; L269-N294 WeakPolarHBondContact CG-OD1 3.11Å; L269-N294 PolarHBondContact N-OD1 3Å; I291-N294 PolarHBondContact O-ND2 3.37Å; C292-N294 PolarHBondContact O-ND2 2.97Å; N294-I296 HydrophobicContact CB-CD1 4.46Å; N294-I296 HydrophobicContact CB-CG1 4.24Å; N294-L321 PolarHBondContact N-O 3.36Å; N294-N322 WeakPolarHBondContact CA-OD1 3.49Å; N294-N322 VanDerWaalsContact CB-OD1 3.25Å; N294-N322 WeakPolarHBondContact CB-OD1 3.4Å; N294-N322 PolarHBondContact N-OD1 3.42Å; N294-N322 PolarHBondContact O-OD1 3.43Å; N294-N322 VanDerWaalsContact O-OD1 3.11Å
295	E	98.3	Very high	98.4	Very high	68 Å²	68	39 Å²	39	32%	0.318	18%	0.18	S	C	.	.			trans	-107.6	34.8	-179.1	-64.2	-179.6	-172.4	0	0	111.6	L269 R270 D297	L269-E295 CarbonylContact O-C 3.3Å; L269-E295 WeakPolarHBondContact O-CA 3.33Å; L269-E295 PolarHBondContact O-N 3.16Å; R270-E295 WeakPolarHBondContact CA-O 3.41Å; R270-E295 HydrophobicContact CG-CB 3.78Å; R270-E295 IonicContact CZ-OE2 3.73Å; R270-E295 IonicContact NE-OE2 2.67Å; R270-E295 PolarHBondContact NE-OE2 3.08Å; R270-E295 IonicContact NH2-OE2 3.4Å; R270-E295 PolarHBondContact NH2-OE2 2.96Å; E295-D297 PolarHBondContact O-N 3.29Å
296	I	98.8	Very high	98.6	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.178	C	C	.	.			trans	-74.7	122.9	-179.1	-58.9	173.4	0	0	0	109.1	L269 A274 I291 N294 L304 N322 Q323	L269-I296 HydrophobicContact CB-CG1 4.44Å; L269-I296 WeakPolarHBondContact O-CG1 3.4Å; L269-I296 PolarHBondContact O-N 2.93Å; A274-I296 HydrophobicContact CB-CD1 4.21Å; A274-I296 HydrophobicContact CB-CG1 4.27Å; A274-I296 HydrophobicContact CB-CG2 3.93Å; I291-I296 HydrophobicContact CB-CD1 4.3Å; I291-I296 HydrophobicContact CD1-CD1 3.72Å; I291-I296 HydrophobicContact CG1-CD1 4.35Å; N294-I296 HydrophobicContact CB-CD1 4.46Å; N294-I296 HydrophobicContact CB-CG1 4.24Å; I296-L304 HydrophobicContact CD1-CD1 4.31Å; I296-L304 HydrophobicContact CG2-CD1 4.41Å; I296-N322 HydrophobicContact CB-CB 4.32Å; I296-N322 WeakPolarHBondContact CB-OD1 3.24Å; I296-N322 PolarHBondContact N-OD1 2.96Å; I296-Q323 CarbonylContact O-C 3.59Å; I296-Q323 WeakPolarHBondContact O-CA 3.31Å; I296-Q323 PolarHBondContact O-N 2.85Å
297	D	98.4	Very high	98.7	Very high	41 Å²	41	37.1 Å²	37.1	22%	0.219	18%	0.18	C	C	.	.			trans	-101.5	-174.4	-179.8	-153.1	-31.7	0	0	0	110.4	D271 E295 H299 G300 A301 Q323 R325	D271-D297 PolarHBondContact OD1-N 3.23Å; D271-D297 VanDerWaalsContact OD1-N 3.12Å; E295-D297 PolarHBondContact O-N 3.29Å; D297-H299 VanDerWaalsContact C-N 3.27Å; D297-H299 PolarHBondContact O-N 3.21Å; D297-G300 PolarHBondContact O-N 3.37Å; D297-A301 WeakPolarHBondContact O-CB 3.4Å; D297-A301 PolarHBondContact O-N 3.41Å; D297-Q323 WeakPolarHBondContact CA-O 3.5Å; D297-R325 IonicContact OD1-CZ 3.33Å; D297-R325 IonicContact OD1-NH1 2.74Å; D297-R325 PolarHBondContact OD1-NH1 3.3Å; D297-R325 IonicContact OD2-CZ 2.97Å; D297-R325 IonicContact OD2-NH1 3.32Å; D297-R325 PolarHBondContact OD2-NH1 2.94Å; D297-R325 IonicContact OD2-NH2 2.79Å
298	V	98.7	Very high	98.7	Very high	23 Å²	23	33 Å²	33	14%	0.139	16%	0.161	C	C	.	.	H	α-helix	trans	-48.1	-44.4	-179.5	172.3	0	0	0	0	112.4	A301 K302 V324 R325 E327	V298-A301 PolarHBondContact O-N 2.68Å; V298-K302 HydrophobicContact CG1-CD 4.16Å; V298-K302 WeakPolarHBondContact O-CG 3.45Å; V298-K302 PolarHBondContact O-N 2.95Å; V298-V324 WeakPolarHBondContact CG2-O 3.42Å; V298-R325 HydrophobicContact CG2-CB 3.87Å; V298-R325 HydrophobicContact CG2-CG 4.45Å; V298-E327 HydrophobicContact CG1-CB 3.52Å; V298-E327 HydrophobicContact CG2-CB 4.34Å
299	H	98.7	Very high	98.6	Very high	97 Å²	97	29.6 Å²	29.6	45%	0.449	15%	0.149	S	C	.	.	H	α-helix	trans	-71.2	-43.3	-175.4	-177.8	70.2	0	0	0	111.7	D271 R275 D297 A301 K302 I303	D271-H299 WeakPolarHBondContact OD2-CB 3.36Å; R275-H299 PolarHBondContact NH2-NE2 2.94Å; D297-H299 VanDerWaalsContact C-N 3.27Å; D297-H299 PolarHBondContact O-N 3.21Å; H299-A301 VanDerWaalsContact C-N 3.33Å; H299-A301 PolarHBondContact O-N 3.42Å; H299-K302 PolarHBondContact O-N 3.48Å; H299-I303 WeakPolarHBondContact NE2-CD1 2.95Å; H299-I303 WeakPolarHBondContact O-CG1 3.33Å; H299-I303 PolarHBondContact O-N 2.9Å; H299-I303 VanDerWaalsContact O-N 3.1Å
300	G	98.7	Very high	98.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-41.2	173.4	0	0	0	0	0	112.2	D271 D297 I303 L304	D271-G300 VanDerWaalsContact OD1-CA 3.25Å; D271-G300 WeakPolarHBondContact OD1-CA 3.49Å; D271-G300 PolarHBondContact OD1-N 2.72Å; D297-G300 PolarHBondContact O-N 3.37Å; G300-I303 PolarHBondContact O-N 2.89Å; G300-L304 WeakPolarHBondContact O-CG 3.47Å; G300-L304 PolarHBondContact O-N 3.44Å
301	A	98.8	Very high	98.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.8	-43.3	175.3	0	0	0	0	0	112.7	D297 V298 H299 I303 L304 A305 M319 V324 I332	D297-A301 WeakPolarHBondContact O-CB 3.4Å; D297-A301 PolarHBondContact O-N 3.41Å; V298-A301 PolarHBondContact O-N 2.68Å; H299-A301 VanDerWaalsContact C-N 3.33Å; H299-A301 PolarHBondContact O-N 3.42Å; A301-I303 VanDerWaalsContact C-N 3.32Å; A301-I303 PolarHBondContact O-N 3.36Å; A301-L304 PolarHBondContact O-N 3.31Å; A301-A305 WeakPolarHBondContact O-CB 3.43Å; A301-A305 PolarHBondContact O-N 3.03Å; A301-M319 HydrophobicContact CB-CE 4.45Å; A301-V324 HydrophobicContact CB-CB 4.34Å; A301-V324 HydrophobicContact CB-CG1 3.81Å; A301-V324 HydrophobicContact CB-CG2 4.09Å; A301-I332 WeakPolarHBondContact O-CD1 3.18Å
302	K	98.9	Very high	98.3	Very high	81 Å²	81	39.7 Å²	39.7	35%	0.352	21%	0.21	S	C	.	.	H	α-helix	trans	-61.3	-39.4	174.9	-75.2	175.1	-178	174.2	0	112.2	V298 H299 A305 Q306 E327 A331	V298-K302 HydrophobicContact CG1-CD 4.16Å; V298-K302 WeakPolarHBondContact O-CG 3.45Å; V298-K302 PolarHBondContact O-N 2.95Å; H299-K302 PolarHBondContact O-N 3.48Å; K302-A305 WeakPolarHBondContact O-CB 3.47Å; K302-A305 PolarHBondContact O-N 3.33Å; K302-Q306 PolarHBondContact O-N 3.45Å; K302-Q306 VanDerWaalsContact O-N 3.1Å; K302-E327 IonicContact NZ-OE2 4Å; K302-E327 PolarHBondContact NZ-OE2 2.95Å; K302-A331 HydrophobicContact CB-CB 4.45Å; K302-A331 HydrophobicContact CG-CB 3.81Å
303	I	98.7	Very high	98.3	Very high	29 Å²	29	40.7 Å²	40.7	15%	0.149	22%	0.216	C	C	.	.	H	α-helix	trans	-65.5	-45	176	-67.4	165	0	0	0	110.8	R275 A278 H299 G300 A301 A305 Q306 A307	R275-I303 HydrophobicContact CB-CD1 4.31Å; R275-I303 HydrophobicContact CB-CG2 4.39Å; R275-I303 HydrophobicContact CG-CG2 4.49Å; A278-I303 HydrophobicContact CB-CG2 3.53Å; H299-I303 WeakPolarHBondContact NE2-CD1 2.95Å; H299-I303 WeakPolarHBondContact O-CG1 3.33Å; H299-I303 PolarHBondContact O-N 2.9Å; H299-I303 VanDerWaalsContact O-N 3.1Å; G300-I303 PolarHBondContact O-N 2.89Å; A301-I303 VanDerWaalsContact C-N 3.32Å; A301-I303 PolarHBondContact O-N 3.36Å; I303-A305 VanDerWaalsContact C-N 3.32Å; I303-A305 PolarHBondContact O-N 2.99Å; I303-Q306 PolarHBondContact O-N 3.48Å; I303-A307 PolarHBondContact O-N 2.68Å
304	L	98.8	Very high	98.3	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-61.6	-40.5	175.8	-73.4	168.1	0	0	0	111.7	A274 V277 A278 L281 I291 I296 G300 A301 Q306 A307 L308 M319 I332	A274-L304 HydrophobicContact CB-CD1 3.96Å; A274-L304 HydrophobicContact CB-CG 4.15Å; V277-L304 HydrophobicContact CB-CD2 4.08Å; V277-L304 HydrophobicContact CG1-CD2 3.73Å; A278-L304 HydrophobicContact CB-CD2 4.15Å; L281-L304 HydrophobicContact CD1-CD2 4.21Å; I291-L304 HydrophobicContact CD1-CD1 3.72Å; I296-L304 HydrophobicContact CD1-CD1 4.31Å; I296-L304 HydrophobicContact CG2-CD1 4.41Å; G300-L304 WeakPolarHBondContact O-CG 3.47Å; G300-L304 PolarHBondContact O-N 3.44Å; A301-L304 PolarHBondContact O-N 3.31Å; L304-Q306 VanDerWaalsContact C-N 3.34Å; L304-Q306 PolarHBondContact O-N 3.24Å; L304-A307 PolarHBondContact O-N 2.92Å; L304-L308 VanDerWaalsContact O-CB 3.29Å; L304-L308 WeakPolarHBondContact O-CB 3.4Å; L304-L308 PolarHBondContact O-N 3.11Å; L304-M319 HydrophobicContact CD1-CE 3.62Å; L304-M319 HydrophobicContact CD1-SD 4.25Å; L304-I332 HydrophobicContact CB-CD1 4.17Å
305	A	98.8	Very high	98.3	Very high	5 Å²	5	41.7 Å²	41.7	4%	0.041	21%	0.213	C	C	.	.	H	α-helix	trans	-59.2	-43.5	175.6	0	0	0	0	0	112.3	A301 K302 I303 A307 L308 S309 A331 I332 A335	A301-A305 WeakPolarHBondContact O-CB 3.43Å; A301-A305 PolarHBondContact O-N 3.03Å; K302-A305 WeakPolarHBondContact O-CB 3.47Å; K302-A305 PolarHBondContact O-N 3.33Å; I303-A305 VanDerWaalsContact C-N 3.32Å; I303-A305 PolarHBondContact O-N 2.99Å; A305-A307 PolarHBondContact O-N 2.66Å; A305-L308 PolarHBondContact O-N 3.4Å; A305-S309 WeakPolarHBondContact O-CB 3.43Å; A305-S309 PolarHBondContact O-N 3.39Å; A305-A331 HydrophobicContact CB-CB 3.74Å; A305-A331 VanDerWaalsContact CB-O 3.31Å; A305-A331 WeakPolarHBondContact CB-O 3.35Å; A305-I332 HydrophobicContact CB-CD1 3.87Å; A305-I332 HydrophobicContact CB-CG1 4.28Å; A305-A335 HydrophobicContact CB-CB 4.26Å; A305-A335 VanDerWaalsContact O-CB 3.28Å; A305-A335 WeakPolarHBondContact O-CB 3.4Å
306	Q	98.4	Very high	98.3	Very high	139 Å²	139	41.4 Å²	41.4	65%	0.65	21%	0.21	S	C	*	.	H	α-helix	trans	-61.9	-44.7	177.1	-172.8	179.7	5.7	0	0	111.7	K302 I303 L304 S309 N310	K302-Q306 PolarHBondContact O-N 3.45Å; K302-Q306 VanDerWaalsContact O-N 3.1Å; I303-Q306 PolarHBondContact O-N 3.48Å; L304-Q306 VanDerWaalsContact C-N 3.34Å; L304-Q306 PolarHBondContact O-N 3.24Å; Q306-S309 PolarHBondContact O-N 2.85Å; Q306-S309 PolarHBondContact O-OG 3.26Å; Q306-N310 PolarHBondContact O-ND2 3.1Å; Q306-N310 VanDerWaalsContact O-ND2 3.15Å
307	A	98.2	Very high	98.3	Very high	7 Å²	7	41.6 Å²	41.6	6%	0.058	21%	0.211	C	C	.	.	H	α-helix	trans	-64.6	-43.6	175.5	0	0	0	0	0	111.7	A278 L281 I303 L304 A305 S309 N310 N311	A278-A307 HydrophobicContact CB-CB 3.79Å; L281-A307 HydrophobicContact CB-CB 4.18Å; I303-A307 PolarHBondContact O-N 2.68Å; L304-A307 PolarHBondContact O-N 2.92Å; A305-A307 PolarHBondContact O-N 2.66Å; A307-S309 VanDerWaalsContact C-N 3.32Å; A307-S309 PolarHBondContact O-N 2.77Å; A307-N310 PolarHBondContact O-N 3.32Å; A307-N311 WeakPolarHBondContact O-CB 3.41Å; A307-N311 PolarHBondContact O-N 2.88Å
308	L	98.4	Very high	98.3	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-59.3	-41.6	178.2	-178.4	64.4	0	0	0	112	L304 A305 N310 N311 L314 L317 A335 L336 N339 L342	L304-L308 VanDerWaalsContact O-CB 3.29Å; L304-L308 WeakPolarHBondContact O-CB 3.4Å; L304-L308 PolarHBondContact O-N 3.11Å; A305-L308 PolarHBondContact O-N 3.4Å; L308-N310 PolarHBondContact O-N 3.47Å; L308-N310 VanDerWaalsContact O-N 3.16Å; L308-N311 PolarHBondContact O-N 3.43Å; L308-N311 VanDerWaalsContact O-N 3.15Å; L308-L314 HydrophobicContact CD1-CD2 4Å; L308-L317 HydrophobicContact CD2-CD2 4.07Å; L308-A335 HydrophobicContact CB-CB 4.35Å; L308-A335 HydrophobicContact CD2-CB 4.23Å; L308-A335 HydrophobicContact CG-CB 4.37Å; L308-L336 HydrophobicContact CD2-CD2 4.31Å; L308-N339 PolarHBondContact O-ND2 2.83Å; L308-L342 HydrophobicContact CD1-CD1 4.31Å; L308-L342 HydrophobicContact CD1-CD2 4.35Å; L308-L342 HydrophobicContact CD2-CD2 4.31Å
309	S	97.6	Very high	98.3	Very high	24 Å²	24	39.3 Å²	39.3	17%	0.168	20%	0.198	C	C	.	.	H	α-helix	trans	-59.6	-28.5	-178.2	72.4	0	0	0	0	113.8	A305 Q306 A307	A305-S309 WeakPolarHBondContact O-CB 3.43Å; A305-S309 PolarHBondContact O-N 3.39Å; Q306-S309 PolarHBondContact O-N 2.85Å; Q306-S309 PolarHBondContact O-OG 3.26Å; A307-S309 VanDerWaalsContact C-N 3.32Å; A307-S309 PolarHBondContact O-N 2.77Å
310	N	96.1	Very high	98.3	Very high	132 Å²	132	39.4 Å²	39.4	71%	0.706	19%	0.194	S	C	*	.	H	α-helix	trans	-105.5	-8.3	-179.6	-61.3	-60.2	0	0	0	113	Q306 A307 L308	Q306-N310 PolarHBondContact O-ND2 3.1Å; Q306-N310 VanDerWaalsContact O-ND2 3.15Å; A307-N310 PolarHBondContact O-N 3.32Å; L308-N310 PolarHBondContact O-N 3.47Å; L308-N310 VanDerWaalsContact O-N 3.16Å
311	N	97.7	Very high	98.3	Very high	14 Å²	14	42.8 Å²	42.8	8%	0.075	21%	0.212	C	C	.	.			trans	-76.4	140.4	-178.2	178.9	-82.6	0	0	0	110.8	L281 A307 L308 T313 L314 N339	L281-N311 PolarHBondContact O-ND2 3.1Å; A307-N311 WeakPolarHBondContact O-CB 3.41Å; A307-N311 PolarHBondContact O-N 2.88Å; L308-N311 PolarHBondContact O-N 3.43Å; L308-N311 VanDerWaalsContact O-N 3.15Å; N311-T313 PolarHBondContact ND2-OG1 3.41Å; N311-T313 PolarHBondContact OD1-N 3.02Å; N311-L314 WeakPolarHBondContact OD1-CB 3.37Å; N311-L314 PolarHBondContact OD1-N 3.26Å; N311-N339 PolarHBondContact O-ND2 3.04Å
312	S	96.9	Very high	98.3	Very high	82 Å²	82	43.1 Å²	43.1	57%	0.573	21%	0.214	S	C	*	.	S	Bend	trans	-121.9	9.5	-178	58.6	0	0	0	0	113.6	R315 T341	S312-R315 PolarHBondContact O-NH1 3.36Å; S312-T341 WeakPolarHBondContact O-CG2 3.16Å
313	T	97.8	Very high	98.3	Very high	32 Å²	32	42.8 Å²	42.8	20%	0.196	21%	0.213	C	C	.	.	S	Bend	trans	-118.5	-34.4	-175.2	62.5	0	0	0	0	112.7	L286 N311 R315	L286-T313 CarbonylContact O-C 3.55Å; L286-T313 VanDerWaalsContact O-C 3.28Å; L286-T313 WeakPolarHBondContact O-CB 3.18Å; L286-T313 PolarHBondContact O-OG1 3.06Å; N311-T313 PolarHBondContact ND2-OG1 3.41Å; N311-T313 PolarHBondContact OD1-N 3.02Å; T313-R315 PolarHBondContact O-N 3Å; T313-R315 PolarHBondContact O-NH1 3.22Å
314	L	98.7	Very high	98.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.206	C	C	.	.			trans	-67.8	126.2	-176.4	-159.2	73.1	0	0	0	110.4	L281 L286 L289 L308 N311 L317 T341 L342	L281-L314 HydrophobicContact CD1-CD2 4.42Å; L281-L314 HydrophobicContact CD2-CD1 3.87Å; L281-L314 HydrophobicContact CD2-CD2 4.02Å; L281-L314 HydrophobicContact CD2-CG 4.42Å; L286-L314 HydrophobicContact CB-CD1 4.46Å; L286-L314 HydrophobicContact CD2-CD1 4.28Å; L286-L314 HydrophobicContact CG-CD1 4.37Å; L286-L314 WeakPolarHBondContact O-CA 3.45Å; L286-L314 PolarHBondContact O-N 3.05Å; L289-L314 HydrophobicContact CB-CD1 3.81Å; L289-L314 HydrophobicContact CB-CD2 4.45Å; L308-L314 HydrophobicContact CD1-CD2 4Å; N311-L314 WeakPolarHBondContact OD1-CB 3.37Å; N311-L314 PolarHBondContact OD1-N 3.26Å; L314-L317 HydrophobicContact CD2-CB 4.11Å; L314-L317 HydrophobicContact CD2-CD1 4.45Å; L314-T341 CarbonylContact O-C 3.48Å; L314-T341 PolarHBondContact O-OG1 3.44Å; L314-L342 HydrophobicContact CB-CD1 4.49Å; L314-L342 HydrophobicContact CD2-CD1 4.08Å; L314-L342 HydrophobicContact CG-CD1 4.09Å; L314-L342 PolarHBondContact O-N 2.9Å
315	R	98.8	Very high	98.3	Very high	95 Å²	95	45.7 Å²	45.7	36%	0.358	22%	0.222	S	C	.	.			trans	-112	-32.2	178.1	-56.4	-54.5	-170.6	-104.2	14.4	111.1	E287 S312 T313 T341 T343 Y344	E287-R315 PolarHBondContact O-N 2.79Å; S312-R315 PolarHBondContact O-NH1 3.36Å; T313-R315 PolarHBondContact O-N 3Å; T313-R315 PolarHBondContact O-NH1 3.22Å; R315-T341 WeakPolarHBondContact CD-O 3.39Å; R315-T343 PolarHBondContact O-N 2.95Å; R315-T343 PolarHBondContact O-OG1 3.38Å; R315-Y344 PolarHBondContact O-N 2.97Å
316	Y	98.9	Very high	98.3	Very high	63 Å²	63	46.6 Å²	46.6	25%	0.247	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.2	-176.8	179.4	-79.7	0	0	0	111.2	E287 K288 L289 N290 N318 Y344	E287-Y316 PolarHBondContact O-N 2.9Å; K288-Y316 HydrophobicContact CB-CD1 4.37Å; K288-Y316 HydrophobicContact CG-CG 4.49Å; L289-Y316 PolarHBondContact N-O 3.38Å; N290-Y316 HydrophobicContact CB-CE1 4.43Å; Y316-N318 HydrophobicContact CE1-CB 3.64Å; Y316-Y344 HydrophobicContact CD1-CD1 4.44Å; Y316-Y344 AromaticContact CD2-CD1 3.25Å; Y316-Y344 HydrophobicContact CD2-CD1 3.25Å; Y316-Y344 HydrophobicContact CD2-CD2 4.04Å; Y316-Y344 AromaticContact CD2-CE1 3.8Å; Y316-Y344 HydrophobicContact CD2-CE1 3.8Å; Y316-Y344 AromaticContact CD2-CG 3.41Å; Y316-Y344 HydrophobicContact CD2-CG 3.41Å; Y316-Y344 VanDerWaalsContact CD2-CG 3.41Å; Y316-Y344 HydrophobicContact CE1-CD1 4.38Å; Y316-Y344 HydrophobicContact CE1-CE1 4.3Å; Y316-Y344 AromaticContact CE2-CD1 3.18Å; Y316-Y344 HydrophobicContact CE2-CD1 3.18Å; Y316-Y344 AromaticContact CE2-CD2 3.92Å; Y316-Y344 HydrophobicContact CE2-CD2 3.92Å; Y316-Y344 AromaticContact CE2-CE1 3.17Å; Y316-Y344 HydrophobicContact CE2-CE1 3.17Å; Y316-Y344 AromaticContact CE2-CE2 3.92Å; Y316-Y344 HydrophobicContact CE2-CE2 3.92Å; Y316-Y344 AromaticContact CE2-CG 3.59Å; Y316-Y344 HydrophobicContact CE2-CG 3.59Å; Y316-Y344 AromaticContact CE2-CZ 3.57Å; Y316-Y344 AromaticContact CG-CD1 3.9Å; Y316-Y344 HydrophobicContact CG-CD1 3.9Å; Y316-Y344 HydrophobicContact CG-CG 4.29Å; Y316-Y344 AromaticContact CZ-CD1 3.78Å; Y316-Y344 AromaticContact CZ-CE1 3.45Å; Y316-Y344 VanDerWaalsContact CZ-CE1 3.45Å
317	L	98.9	Very high	98.3	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	119.3	173.1	178.9	57.1	0	0	0	110.5	L289 L308 L314 M319 L342 Y344 L345 H346	L289-L317 HydrophobicContact CB-CD1 4.18Å; L289-L317 HydrophobicContact CD2-CD1 3.79Å; L289-L317 HydrophobicContact CG-CD1 4.06Å; L289-L317 WeakPolarHBondContact O-CA 3.29Å; L308-L317 HydrophobicContact CD2-CD2 4.07Å; L314-L317 HydrophobicContact CD2-CB 4.11Å; L314-L317 HydrophobicContact CD2-CD1 4.45Å; L317-M319 HydrophobicContact CD1-CG 3.81Å; L317-M319 HydrophobicContact CD1-SD 4.25Å; L317-M319 HydrophobicContact CD2-CG 4.37Å; L317-M319 HydrophobicContact CD2-SD 3.96Å; L317-M319 HydrophobicContact CG-CG 3.97Å; L317-M319 HydrophobicContact CG-SD 4.23Å; L317-L342 HydrophobicContact CB-CD1 3.81Å; L317-L342 HydrophobicContact CB-CD2 4.29Å; L317-Y344 PolarHBondContact N-O 3.23Å; L317-L345 HydrophobicContact CB-CD1 4.25Å; L317-L345 HydrophobicContact CD2-CD1 3.99Å; L317-L345 HydrophobicContact CG-CD1 4.13Å; L317-L345 WeakPolarHBondContact O-CA 3.34Å; L317-H346 PolarHBondContact O-N 3.41Å
318	N	98.9	Very high	98.3	Very high	15 Å²	15	45.2 Å²	45.2	8%	0.08	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	113.9	171.4	-175.7	-2.5	0	0	0	110.9	L289 N290 I291 C292 Y316 R320 H346	L289-N318 PolarHBondContact O-N 2.82Å; N290-N318 HydrophobicContact CB-CB 4.32Å; N290-N318 WeakPolarHBondContact OD1-CB 3.08Å; N290-N318 PolarHBondContact OD1-ND2 3.05Å; I291-N318 CarbonylContact C-O 3.48Å; I291-N318 WeakPolarHBondContact CG1-O 3.23Å; I291-N318 PolarHBondContact N-O 3.27Å; C292-N318 PolarHBondContact N-O 2.79Å; Y316-N318 HydrophobicContact CE1-CB 3.64Å; N318-R320 WeakPolarHBondContact OD1-CB 3.39Å; N318-R320 PolarHBondContact OD1-N 3.41Å; N318-H346 HydrophobicContact CB-CB 4.32Å
319	M	98.8	Very high	98.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.218	C	C	.	.			trans	-119.9	20.8	177.1	-66.2	-176.7	66.8	0	0	111.7	I291 A301 L304 L317 N322 V324 I332 H346 L347 N350	I291-M319 HydrophobicContact CD1-CE 4.4Å; I291-M319 HydrophobicContact CD1-CG 3.79Å; I291-M319 HydrophobicContact CD1-SD 4.4Å; I291-M319 HydrophobicContact CG1-CG 3.88Å; A301-M319 HydrophobicContact CB-CE 4.45Å; L304-M319 HydrophobicContact CD1-CE 3.62Å; L304-M319 HydrophobicContact CD1-SD 4.25Å; L317-M319 HydrophobicContact CD1-CG 3.81Å; L317-M319 HydrophobicContact CD1-SD 4.25Å; L317-M319 HydrophobicContact CD2-CG 4.37Å; L317-M319 HydrophobicContact CD2-SD 3.96Å; L317-M319 HydrophobicContact CG-CG 3.97Å; L317-M319 HydrophobicContact CG-SD 4.23Å; M319-N322 PolarHBondContact O-ND2 3.42Å; M319-V324 HydrophobicContact CE-CG2 3.82Å; M319-I332 HydrophobicContact CE-CD1 4.39Å; M319-I332 HydrophobicContact SD-CD1 3.9Å; M319-I332 HydrophobicContact SD-CG1 4.43Å; M319-H346 CarbonylContact C-O 3.42Å; M319-H346 PolarHBondContact N-O 2.83Å; M319-L347 HydrophobicContact CB-CD2 4.11Å; M319-N350 PolarHBondContact O-ND2 3Å; M319-N350 PolarHBondContact O-OD1 3.25Å
320	R	98.8	Very high	98.4	Very high	99 Å²	99	46.3 Å²	46.3	37%	0.374	22%	0.221	S	C	.	.			trans	-52.3	147.5	178.7	-177.6	-175.8	179.2	-171.7	-3.9	111.7	C292 N293 N318 N322 H346 G348	C292-R320 CarbonylContact C-O 3.59Å; C292-R320 WeakPolarHBondContact CA-O 3.22Å; C292-R320 HydrophobicContact CB-CB 4.31Å; N293-R320 PolarHBondContact N-O 3.43Å; N318-R320 WeakPolarHBondContact OD1-CB 3.39Å; N318-R320 PolarHBondContact OD1-N 3.41Å; R320-N322 PolarHBondContact O-ND2 3.03Å; R320-H346 WeakPolarHBondContact CB-ND1 3.24Å; R320-H346 VanDerWaalsContact CD-CE1 3.42Å; R320-H346 WeakPolarHBondContact CD-CE1 3.08Å; R320-H346 VanDerWaalsContact CG-CE1 3.43Å; R320-H346 WeakPolarHBondContact CG-CE1 3.49Å; R320-H346 PolarHBondContact N-O 3.28Å; R320-G348 CarbonylContact C-O 3.52Å; R320-G348 VanDerWaalsContact CA-O 3.24Å; R320-G348 WeakPolarHBondContact CA-O 3.39Å; R320-G348 VanDerWaalsContact CG-O 3.31Å; R320-G348 WeakPolarHBondContact CG-O 3.49Å
321	L	98.6	Very high	98.5	Very high	72 Å²	72	40.9 Å²	40.9	38%	0.377	20%	0.195	S	C	.	.	S	Bend	trans	56.8	51.4	173.6	-68	166.2	0	0	0	112.2	N293 N294 G348 G349	N293-L321 WeakPolarHBondContact CA-O 3.38Å; N293-L321 HydrophobicContact CB-CB 4.04Å; N293-L321 HydrophobicContact CB-CD1 4.39Å; N293-L321 PolarHBondContact N-O 2.91Å; N294-L321 PolarHBondContact N-O 3.36Å; L321-G348 PolarHBondContact N-O 2.96Å; L321-G349 WeakPolarHBondContact CA-O 3.41Å; L321-G349 PolarHBondContact N-O 2.69Å
322	N	98.8	Very high	98.5	Very high	7 Å²	7	40.2 Å²	40.2	4%	0.037	19%	0.191	C	C	.	.	S	Bend	trans	-122.1	-171.9	169	-77.9	-87.1	0	0	0	108.6	I291 N294 I296 M319 R320 V324 G349 N350	I291-N322 PolarHBondContact O-ND2 2.96Å; N294-N322 WeakPolarHBondContact CA-OD1 3.49Å; N294-N322 VanDerWaalsContact CB-OD1 3.25Å; N294-N322 WeakPolarHBondContact CB-OD1 3.4Å; N294-N322 PolarHBondContact N-OD1 3.42Å; N294-N322 PolarHBondContact O-OD1 3.43Å; N294-N322 VanDerWaalsContact O-OD1 3.11Å; I296-N322 HydrophobicContact CB-CB 4.32Å; I296-N322 WeakPolarHBondContact CB-OD1 3.24Å; I296-N322 PolarHBondContact N-OD1 2.96Å; M319-N322 PolarHBondContact O-ND2 3.42Å; R320-N322 PolarHBondContact O-ND2 3.03Å; N322-V324 HydrophobicContact CB-CG2 4.09Å; N322-G349 PolarHBondContact N-O 2.98Å; N322-N350 WeakPolarHBondContact CA-OD1 3.48Å; N322-N350 VanDerWaalsContact CB-OD1 3.24Å; N322-N350 WeakPolarHBondContact CB-OD1 3.27Å; N322-N350 PolarHBondContact N-OD1 3.42Å; N322-N350 WeakPolarHBondContact O-CA 3.45Å; N322-N350 PolarHBondContact O-OD1 3.34Å
323	Q	97.8	Very high	98.6	Very high	73 Å²	73	36.3 Å²	36.3	34%	0.341	16%	0.164	S	C	.	.			trans	-112.4	42.4	-179.4	-63.8	170.8	45	0	0	110.6	I296 D297 R325	I296-Q323 CarbonylContact O-C 3.59Å; I296-Q323 WeakPolarHBondContact O-CA 3.31Å; I296-Q323 PolarHBondContact O-N 2.85Å; D297-Q323 WeakPolarHBondContact CA-O 3.5Å; Q323-R325 VanDerWaalsContact C-N 3.31Å; Q323-R325 PolarHBondContact O-N 3.13Å
324	V	98.3	Very high	98.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.175	C	C	.	.			trans	-61.8	-37.5	-171.9	169.4	0	0	0	0	112.3	V298 A301 M319 N322 G328 N350 L352	V298-V324 WeakPolarHBondContact CG2-O 3.42Å; A301-V324 HydrophobicContact CB-CB 4.34Å; A301-V324 HydrophobicContact CB-CG1 3.81Å; A301-V324 HydrophobicContact CB-CG2 4.09Å; M319-V324 HydrophobicContact CE-CG2 3.82Å; N322-V324 HydrophobicContact CB-CG2 4.09Å; V324-G328 WeakPolarHBondContact O-CA 3.25Å; V324-G328 PolarHBondContact O-N 3.15Å; V324-N350 HydrophobicContact CB-CB 4.06Å; V324-N350 WeakPolarHBondContact CB-OD1 3.37Å; V324-N350 WeakPolarHBondContact CG2-OD1 3.28Å; V324-L352 HydrophobicContact CG1-CD2 4.4Å
325	R	98.6	Very high	98.6	Very high	95 Å²	95	39.4 Å²	39.4	36%	0.358	18%	0.177	S	C	.	.	H	α-helix	trans	54.3	179.9	-179.8	-59.6	169.8	-173.3	137.4	5.2	112.7	D297 V298 Q323 E327 G328 G329 N350 D351 L352	D297-R325 IonicContact OD1-CZ 3.33Å; D297-R325 IonicContact OD1-NH1 2.74Å; D297-R325 PolarHBondContact OD1-NH1 3.3Å; D297-R325 IonicContact OD2-CZ 2.97Å; D297-R325 IonicContact OD2-NH1 3.32Å; D297-R325 PolarHBondContact OD2-NH1 2.94Å; D297-R325 IonicContact OD2-NH2 2.79Å; V298-R325 HydrophobicContact CG2-CB 3.87Å; V298-R325 HydrophobicContact CG2-CG 4.45Å; Q323-R325 VanDerWaalsContact C-N 3.31Å; Q323-R325 PolarHBondContact O-N 3.13Å; R325-E327 PolarHBondContact O-N 2.95Å; R325-G328 PolarHBondContact O-N 3.44Å; R325-G329 PolarHBondContact O-N 3.5Å; R325-N350 WeakPolarHBondContact CA-O 3.23Å; R325-N350 PolarHBondContact N-O 3.37Å; R325-D351 HydrophobicContact CG-CB 4.2Å; R325-L352 VanDerWaalsContact O-CD2 3.27Å; R325-L352 WeakPolarHBondContact O-CD2 3.26Å
326	D	98.7	Very high	98.6	Very high	24 Å²	24	35 Å²	35	13%	0.128	16%	0.16	C	C	.	.	H	α-helix	trans	-63.8	-36.6	-172.7	-81.9	-45.8	0	0	0	114.4	G329 Q330 T353 I355 T356	D326-G329 PolarHBondContact O-N 2.96Å; D326-Q330 VanDerWaalsContact O-CB 3.27Å; D326-Q330 WeakPolarHBondContact O-CB 3.2Å; D326-Q330 WeakPolarHBondContact O-CG 3.38Å; D326-Q330 PolarHBondContact O-N 3.13Å; D326-Q330 PolarHBondContact O-NE2 2.88Å; D326-T353 VanDerWaalsContact CG-OG1 3.31Å; D326-T353 PolarHBondContact OD1-N 3.46Å; D326-T353 PolarHBondContact OD1-OG1 2.83Å; D326-T353 WeakPolarHBondContact OD2-CB 3.49Å; D326-T353 VanDerWaalsContact OD2-CG2 3.27Å; D326-T353 WeakPolarHBondContact OD2-CG2 3.29Å; D326-T353 PolarHBondContact OD2-OG1 2.87Å; D326-I355 HydrophobicContact CB-CB 4.37Å; D326-T356 VanDerWaalsContact CA-OG1 3.3Å; D326-T356 WeakPolarHBondContact CA-OG1 3.43Å; D326-T356 PolarHBondContact O-OG1 2.86Å; D326-T356 WeakPolarHBondContact OD1-CB 3.07Å; D326-T356 PolarHBondContact OD1-N 2.93Å; D326-T356 PolarHBondContact OD1-OG1 3.1Å
327	E	98.6	Very high	98.4	Very high	116 Å²	116	36.3 Å²	36.3	54%	0.542	17%	0.169	S	C	.	.	H	α-helix	trans	-69	-40.7	-179.4	-73.6	-172.5	-143	0	0	112.7	V298 K302 R325 A331	V298-E327 HydrophobicContact CG1-CB 3.52Å; V298-E327 HydrophobicContact CG2-CB 4.34Å; K302-E327 IonicContact NZ-OE2 4Å; K302-E327 PolarHBondContact NZ-OE2 2.95Å; R325-E327 PolarHBondContact O-N 2.95Å; E327-A331 PolarHBondContact O-N 2.9Å
328	G	98.8	Very high	98.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-72	-38.3	174.4	0	0	0	0	0	111.3	V324 R325 A331 I332	V324-G328 WeakPolarHBondContact O-CA 3.25Å; V324-G328 PolarHBondContact O-N 3.15Å; R325-G328 PolarHBondContact O-N 3.44Å; G328-A331 PolarHBondContact O-N 2.83Å; G328-I332 WeakPolarHBondContact O-CG1 3.38Å; G328-I332 PolarHBondContact O-N 3.14Å
329	G	98.6	Very high	98.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-48.4	178.9	0	0	0	0	0	111.6	R325 D326 A331 I332 V333	R325-G329 PolarHBondContact O-N 3.5Å; D326-G329 PolarHBondContact O-N 2.96Å; G329-A331 VanDerWaalsContact C-N 3.34Å; G329-A331 PolarHBondContact O-N 3.39Å; G329-I332 PolarHBondContact O-N 2.89Å; G329-V333 WeakPolarHBondContact O-CG1 3.33Å; G329-V333 WeakPolarHBondContact O-CG2 3.45Å; G329-V333 PolarHBondContact O-N 2.99Å
330	Q	98.8	Very high	98.1	Very high	49 Å²	49	45.9 Å²	45.9	23%	0.229	22%	0.224	C	C	.	.	H	α-helix	trans	-54.7	-48.1	173.2	-77.3	172.3	74.2	0	0	111.8	D326 I332 V333 E334 I355 V359	D326-Q330 VanDerWaalsContact O-CB 3.27Å; D326-Q330 WeakPolarHBondContact O-CB 3.2Å; D326-Q330 WeakPolarHBondContact O-CG 3.38Å; D326-Q330 PolarHBondContact O-N 3.13Å; D326-Q330 PolarHBondContact O-NE2 2.88Å; Q330-I332 PolarHBondContact O-N 3.27Å; Q330-V333 VanDerWaalsContact O-CG2 3.26Å; Q330-V333 WeakPolarHBondContact O-CG2 3.15Å; Q330-V333 PolarHBondContact O-N 3.16Å; Q330-E334 VanDerWaalsContact O-CB 3.31Å; Q330-E334 WeakPolarHBondContact O-CB 3.3Å; Q330-E334 VanDerWaalsContact O-CG 3.24Å; Q330-E334 WeakPolarHBondContact O-CG 3.27Å; Q330-E334 PolarHBondContact O-N 3.37Å; Q330-I355 VanDerWaalsContact NE2-CG2 3.29Å; Q330-V359 HydrophobicContact CG-CB 4.21Å; Q330-V359 HydrophobicContact CG-CG2 3.89Å
331	A	98.8	Very high	98.1	Very high	18 Å²	18	41.9 Å²	41.9	15%	0.149	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-45.6	178.8	0	0	0	0	0	112	K302 A305 E327 G328 G329 V333 E334 A335	K302-A331 HydrophobicContact CB-CB 4.45Å; K302-A331 HydrophobicContact CG-CB 3.81Å; A305-A331 HydrophobicContact CB-CB 3.74Å; A305-A331 VanDerWaalsContact CB-O 3.31Å; A305-A331 WeakPolarHBondContact CB-O 3.35Å; E327-A331 PolarHBondContact O-N 2.9Å; G328-A331 PolarHBondContact O-N 2.83Å; G329-A331 VanDerWaalsContact C-N 3.34Å; G329-A331 PolarHBondContact O-N 3.39Å; A331-V333 PolarHBondContact O-N 2.95Å; A331-E334 PolarHBondContact O-N 3.12Å; A331-A335 PolarHBondContact O-N 3.42Å
332	I	98.8	Very high	98.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-44.5	178.8	-67.4	-73.1	0	0	0	111.2	A301 L304 A305 M319 G328 G329 Q330 A335 L345 L347	A301-I332 WeakPolarHBondContact O-CD1 3.18Å; L304-I332 HydrophobicContact CB-CD1 4.17Å; A305-I332 HydrophobicContact CB-CD1 3.87Å; A305-I332 HydrophobicContact CB-CG1 4.28Å; M319-I332 HydrophobicContact CE-CD1 4.39Å; M319-I332 HydrophobicContact SD-CD1 3.9Å; M319-I332 HydrophobicContact SD-CG1 4.43Å; G328-I332 WeakPolarHBondContact O-CG1 3.38Å; G328-I332 PolarHBondContact O-N 3.14Å; G329-I332 PolarHBondContact O-N 2.89Å; Q330-I332 PolarHBondContact O-N 3.27Å; I332-A335 WeakPolarHBondContact O-CB 3.36Å; I332-A335 PolarHBondContact O-N 3.25Å; I332-L345 HydrophobicContact CG2-CD1 4.23Å; I332-L345 HydrophobicContact CG2-CD2 4.25Å; I332-L347 HydrophobicContact CG2-CD1 4.17Å; I332-L347 HydrophobicContact CG2-CD2 4.3Å
333	V	98.3	Very high	98.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-72.4	-35.3	-179.5	-58.1	0	0	0	0	112	G329 Q330 A331 A335 L336 L347 T356 V359 L360 V363	G329-V333 WeakPolarHBondContact O-CG1 3.33Å; G329-V333 WeakPolarHBondContact O-CG2 3.45Å; G329-V333 PolarHBondContact O-N 2.99Å; Q330-V333 VanDerWaalsContact O-CG2 3.26Å; Q330-V333 WeakPolarHBondContact O-CG2 3.15Å; Q330-V333 PolarHBondContact O-N 3.16Å; A331-V333 PolarHBondContact O-N 2.95Å; V333-A335 VanDerWaalsContact C-N 3.29Å; V333-A335 PolarHBondContact O-N 3.28Å; V333-L336 VanDerWaalsContact O-CB 3.28Å; V333-L336 WeakPolarHBondContact O-CB 3.48Å; V333-L336 PolarHBondContact O-N 3.11Å; V333-L336 VanDerWaalsContact O-N 3.13Å; V333-L347 HydrophobicContact CG1-CD1 4.27Å; V333-T356 HydrophobicContact CG1-CG2 4.36Å; V333-T356 HydrophobicContact CG2-CG2 4.49Å; V333-V359 HydrophobicContact CG2-CB 4.28Å; V333-V359 HydrophobicContact CG2-CG1 3.82Å; V333-L360 HydrophobicContact CB-CB 4.25Å; V333-L360 HydrophobicContact CB-CD1 3.94Å; V333-L360 HydrophobicContact CG1-CB 4.12Å; V333-L360 HydrophobicContact CG1-CD1 3.8Å; V333-L360 HydrophobicContact CG1-CD2 4.3Å; V333-L360 HydrophobicContact CG1-CG 4.29Å; V333-L360 HydrophobicContact CG2-CB 4.3Å; V333-V363 WeakPolarHBondContact O-CG1 3.16Å; V333-V363 WeakPolarHBondContact O-CG2 3.27Å
334	E	98.6	Very high	98.1	Very high	92 Å²	92	39.8 Å²	39.8	43%	0.43	20%	0.201	S	C	.	.	H	α-helix	trans	-63.9	-34.9	174.3	-75.6	177.4	167	0	0	112.1	Q330 A331 L336 Q337 V359	Q330-E334 VanDerWaalsContact O-CB 3.31Å; Q330-E334 WeakPolarHBondContact O-CB 3.3Å; Q330-E334 VanDerWaalsContact O-CG 3.24Å; Q330-E334 WeakPolarHBondContact O-CG 3.27Å; Q330-E334 PolarHBondContact O-N 3.37Å; A331-E334 PolarHBondContact O-N 3.12Å; E334-L336 PolarHBondContact O-N 3.33Å; E334-L336 VanDerWaalsContact O-N 3.16Å; E334-Q337 WeakPolarHBondContact O-CB 3.31Å; E334-Q337 WeakPolarHBondContact O-CG 3.24Å; E334-Q337 PolarHBondContact O-N 2.88Å; E334-V359 HydrophobicContact CG-CG1 3.78Å
335	A	98.4	Very high	98.2	Very high	6 Å²	6	39.8 Å²	39.8	5%	0.05	20%	0.201	C	C	.	.	H	α-helix	trans	-58.5	-27.6	174.5	0	0	0	0	0	112.9	A305 L308 A331 I332 V333 Q337 N338 N339	A305-A335 HydrophobicContact CB-CB 4.26Å; A305-A335 VanDerWaalsContact O-CB 3.28Å; A305-A335 WeakPolarHBondContact O-CB 3.4Å; L308-A335 HydrophobicContact CB-CB 4.35Å; L308-A335 HydrophobicContact CD2-CB 4.23Å; L308-A335 HydrophobicContact CG-CB 4.37Å; A331-A335 PolarHBondContact O-N 3.42Å; I332-A335 WeakPolarHBondContact O-CB 3.36Å; I332-A335 PolarHBondContact O-N 3.25Å; V333-A335 VanDerWaalsContact C-N 3.29Å; V333-A335 PolarHBondContact O-N 3.28Å; A335-Q337 PolarHBondContact O-N 3.21Å; A335-N338 PolarHBondContact O-N 3.34Å; A335-N339 WeakPolarHBondContact O-CB 3.42Å; A335-N339 PolarHBondContact O-N 3.05Å
336	L	97.9	Very high	98.2	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-15	176.6	-52.8	174.9	0	0	0	113.5	L308 V333 E334 N338 L342 L345 V363 N367 L370	L308-L336 HydrophobicContact CD2-CD2 4.31Å; V333-L336 VanDerWaalsContact O-CB 3.28Å; V333-L336 WeakPolarHBondContact O-CB 3.48Å; V333-L336 PolarHBondContact O-N 3.11Å; V333-L336 VanDerWaalsContact O-N 3.13Å; E334-L336 PolarHBondContact O-N 3.33Å; E334-L336 VanDerWaalsContact O-N 3.16Å; L336-N338 PolarHBondContact O-N 3.47Å; L336-L342 HydrophobicContact CD2-CB 4.42Å; L336-L342 HydrophobicContact CD2-CD2 3.65Å; L336-L345 HydrophobicContact CD1-CD2 3.85Å; L336-L345 HydrophobicContact CD2-CD2 4.5Å; L336-V363 HydrophobicContact CB-CG1 3.84Å; L336-N367 PolarHBondContact O-ND2 3.35Å; L336-L370 HydrophobicContact CD1-CD2 4.28Å
337	Q	95.8	Very high	98.2	Very high	91 Å²	91	34.6 Å²	34.6	43%	0.425	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-33.7	173.6	-63.6	-176.2	5.4	0	0	111.5	E334 A335 V363	E334-Q337 WeakPolarHBondContact O-CB 3.31Å; E334-Q337 WeakPolarHBondContact O-CG 3.24Å; E334-Q337 PolarHBondContact O-N 2.88Å; A335-Q337 PolarHBondContact O-N 3.21Å; Q337-V363 HydrophobicContact CG-CB 4.39Å; Q337-V363 HydrophobicContact CG-CG1 4.1Å; Q337-V363 HydrophobicContact CG-CG2 3.82Å
338	N	95.4	Very high	98.2	Very high	113 Å²	113	29 Å²	29	60%	0.604	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103	-28.6	-178.9	-62.6	-32.6	0	0	0	112.2	A335 L336 T340	A335-N338 PolarHBondContact O-N 3.34Å; L336-N338 PolarHBondContact O-N 3.47Å; N338-T340 PolarHBondContact O-N 2.91Å
339	N	97.7	Very high	98.2	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.161	C	C	.	.			trans	-72.9	119.7	177.9	-172.7	-77	0	0	0	110.6	L308 N311 A335 T341 L342 N367	L308-N339 PolarHBondContact O-ND2 2.83Å; N311-N339 PolarHBondContact O-ND2 3.04Å; A335-N339 WeakPolarHBondContact O-CB 3.42Å; A335-N339 PolarHBondContact O-N 3.05Å; N339-T341 PolarHBondContact OD1-N 2.91Å; N339-T341 PolarHBondContact OD1-OG1 3.27Å; N339-L342 VanDerWaalsContact OD1-CB 3.31Å; N339-L342 WeakPolarHBondContact OD1-CB 3.43Å; N339-L342 PolarHBondContact OD1-N 3.18Å; N339-N367 PolarHBondContact O-ND2 3.21Å
340	T	96.3	Very high	98.2	Very high	106 Å²	106	29.7 Å²	29.7	65%	0.65	16%	0.161	S	C	*	.			trans	-108.7	17.8	-178.1	52.6	0	0	0	0	113	N338 T369	N338-T340 PolarHBondContact O-N 2.91Å; T340-T369 WeakPolarHBondContact O-CG2 3.45Å
341	T	98.2	Very high	98.2	Very high	16 Å²	16	32.3 Å²	32.3	10%	0.098	18%	0.176	C	C	.	.	S	Bend	trans	-128	-29.1	-171.3	64.3	0	0	0	0	114.5	S312 L314 R315 N339 T343	S312-T341 WeakPolarHBondContact O-CG2 3.16Å; L314-T341 CarbonylContact O-C 3.48Å; L314-T341 PolarHBondContact O-OG1 3.44Å; R315-T341 WeakPolarHBondContact CD-O 3.39Å; N339-T341 PolarHBondContact OD1-N 2.91Å; N339-T341 PolarHBondContact OD1-OG1 3.27Å; T341-T343 PolarHBondContact O-N 3.06Å
342	L	98.7	Very high	98.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.17	C	C	.	.			trans	-67	122.5	179.9	-162.2	76.8	0	0	0	109.6	L308 L314 L317 L336 N339 L345 T369 L370	L308-L342 HydrophobicContact CD1-CD1 4.31Å; L308-L342 HydrophobicContact CD1-CD2 4.35Å; L308-L342 HydrophobicContact CD2-CD2 4.31Å; L314-L342 HydrophobicContact CB-CD1 4.49Å; L314-L342 HydrophobicContact CD2-CD1 4.08Å; L314-L342 HydrophobicContact CG-CD1 4.09Å; L314-L342 PolarHBondContact O-N 2.9Å; L317-L342 HydrophobicContact CB-CD1 3.81Å; L317-L342 HydrophobicContact CB-CD2 4.29Å; L336-L342 HydrophobicContact CD2-CB 4.42Å; L336-L342 HydrophobicContact CD2-CD2 3.65Å; N339-L342 VanDerWaalsContact OD1-CB 3.31Å; N339-L342 WeakPolarHBondContact OD1-CB 3.43Å; N339-L342 PolarHBondContact OD1-N 3.18Å; L342-L345 HydrophobicContact CD2-CB 4.01Å; L342-L345 HydrophobicContact CD2-CD1 4.25Å; L342-T369 CarbonylContact O-C 3.57Å; L342-T369 PolarHBondContact O-OG1 2.95Å; L342-L370 HydrophobicContact CD2-CD1 4.47Å
343	T	98.8	Very high	98.1	Very high	55 Å²	55	33.5 Å²	33.5	34%	0.337	18%	0.182	S	C	.	.			trans	-109.3	-22.6	178.7	58.6	0	0	0	0	112	R315 T341 K371 T372	R315-T343 PolarHBondContact O-N 2.95Å; R315-T343 PolarHBondContact O-OG1 3.38Å; T341-T343 PolarHBondContact O-N 3.06Å; T343-K371 HydrophobicContact CG2-CG 4.37Å; T343-K371 WeakPolarHBondContact O-CA 3.14Å; T343-K371 WeakPolarHBondContact O-CB 3.43Å; T343-K371 PolarHBondContact O-N 3.44Å; T343-T372 PolarHBondContact O-N 3.09Å
344	Y	98.9	Very high	98.1	Very high	52 Å²	52	35.4 Å²	35.4	20%	0.204	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	124.8	178.8	-178.6	-76.7	0	0	0	111.1	R315 Y316 L317 H346 T372	R315-Y344 PolarHBondContact O-N 2.97Å; Y316-Y344 HydrophobicContact CD1-CD1 4.44Å; Y316-Y344 AromaticContact CD2-CD1 3.25Å; Y316-Y344 HydrophobicContact CD2-CD1 3.25Å; Y316-Y344 HydrophobicContact CD2-CD2 4.04Å; Y316-Y344 AromaticContact CD2-CE1 3.8Å; Y316-Y344 HydrophobicContact CD2-CE1 3.8Å; Y316-Y344 AromaticContact CD2-CG 3.41Å; Y316-Y344 HydrophobicContact CD2-CG 3.41Å; Y316-Y344 VanDerWaalsContact CD2-CG 3.41Å; Y316-Y344 HydrophobicContact CE1-CD1 4.38Å; Y316-Y344 HydrophobicContact CE1-CE1 4.3Å; Y316-Y344 AromaticContact CE2-CD1 3.18Å; Y316-Y344 HydrophobicContact CE2-CD1 3.18Å; Y316-Y344 AromaticContact CE2-CD2 3.92Å; Y316-Y344 HydrophobicContact CE2-CD2 3.92Å; Y316-Y344 AromaticContact CE2-CE1 3.17Å; Y316-Y344 HydrophobicContact CE2-CE1 3.17Å; Y316-Y344 AromaticContact CE2-CE2 3.92Å; Y316-Y344 HydrophobicContact CE2-CE2 3.92Å; Y316-Y344 AromaticContact CE2-CG 3.59Å; Y316-Y344 HydrophobicContact CE2-CG 3.59Å; Y316-Y344 AromaticContact CE2-CZ 3.57Å; Y316-Y344 AromaticContact CG-CD1 3.9Å; Y316-Y344 HydrophobicContact CG-CD1 3.9Å; Y316-Y344 HydrophobicContact CG-CG 4.29Å; Y316-Y344 AromaticContact CZ-CD1 3.78Å; Y316-Y344 AromaticContact CZ-CE1 3.45Å; Y316-Y344 VanDerWaalsContact CZ-CE1 3.45Å; L317-Y344 PolarHBondContact N-O 3.23Å; Y344-H346 HydrophobicContact CE1-CB 3.72Å; Y344-T372 WeakPolarHBondContact CA-O 3.16Å; Y344-T372 VanDerWaalsContact CD2-CB 3.49Å; Y344-T372 HydrophobicContact CD2-CG2 3.43Å; Y344-T372 VanDerWaalsContact CD2-CG2 3.43Å; Y344-T372 HydrophobicContact CE2-CG2 3.44Å; Y344-T372 VanDerWaalsContact CE2-CG2 3.44Å; Y344-T372 HydrophobicContact CG-CG2 4.41Å
345	L	98.9	Very high	98.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	125.1	174.4	178.8	60.2	0	0	0	111	L317 I332 L336 L342 L347 L370 T372 L373 N374	L317-L345 HydrophobicContact CB-CD1 4.25Å; L317-L345 HydrophobicContact CD2-CD1 3.99Å; L317-L345 HydrophobicContact CG-CD1 4.13Å; L317-L345 WeakPolarHBondContact O-CA 3.34Å; I332-L345 HydrophobicContact CG2-CD1 4.23Å; I332-L345 HydrophobicContact CG2-CD2 4.25Å; L336-L345 HydrophobicContact CD1-CD2 3.85Å; L336-L345 HydrophobicContact CD2-CD2 4.5Å; L342-L345 HydrophobicContact CD2-CB 4.01Å; L342-L345 HydrophobicContact CD2-CD1 4.25Å; L345-L347 HydrophobicContact CD1-CD1 4.41Å; L345-L347 HydrophobicContact CD1-CD2 4.34Å; L345-L347 HydrophobicContact CD1-CG 4.02Å; L345-L347 HydrophobicContact CD2-CD1 3.89Å; L345-L347 HydrophobicContact CD2-CG 4.31Å; L345-L347 HydrophobicContact CG-CD1 4.17Å; L345-L347 HydrophobicContact CG-CG 4.03Å; L345-L370 HydrophobicContact CB-CD1 3.88Å; L345-T372 PolarHBondContact N-O 3.11Å; L345-L373 HydrophobicContact CB-CD1 4.47Å; L345-L373 HydrophobicContact CD2-CD1 4.33Å; L345-L373 HydrophobicContact CG-CD1 4.47Å; L345-L373 CarbonylContact O-C 3.28Å; L345-L373 WeakPolarHBondContact O-CA 3.48Å; L345-N374 PolarHBondContact O-N 2.8Å
346	H	98.9	Very high	98.2	Very high	10 Å²	10	35.1 Å²	35.1	5%	0.046	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.7	173.9	-166.6	-36.4	0	0	0	111.4	L317 N318 M319 R320 Y344 G348 N374	L317-H346 PolarHBondContact O-N 3.41Å; N318-H346 HydrophobicContact CB-CB 4.32Å; M319-H346 CarbonylContact C-O 3.42Å; M319-H346 PolarHBondContact N-O 2.83Å; R320-H346 WeakPolarHBondContact CB-ND1 3.24Å; R320-H346 VanDerWaalsContact CD-CE1 3.42Å; R320-H346 WeakPolarHBondContact CD-CE1 3.08Å; R320-H346 VanDerWaalsContact CG-CE1 3.43Å; R320-H346 WeakPolarHBondContact CG-CE1 3.49Å; R320-H346 PolarHBondContact N-O 3.28Å; Y344-H346 HydrophobicContact CE1-CB 3.72Å; H346-G348 PolarHBondContact ND1-N 3.15Å; H346-G348 VanDerWaalsContact ND1-N 3.11Å; H346-N374 HydrophobicContact CB-CB 4.16Å; H346-N374 PolarHBondContact CE1-OD1 3.2Å; H346-N374 VanDerWaalsContact CE1-OD1 3.3Å; H346-N374 PolarHBondContact NE2-ND2 3.3Å; H346-N374 VanDerWaalsContact NE2-ND2 3.2Å
347	L	98.8	Very high	98.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.195	C	C	.	.			trans	-122.8	13.3	179.4	-68.9	174	0	0	0	113	M319 I332 V333 L345 N350 L352 N374 L375 N378	M319-L347 HydrophobicContact CB-CD2 4.11Å; I332-L347 HydrophobicContact CG2-CD1 4.17Å; I332-L347 HydrophobicContact CG2-CD2 4.3Å; V333-L347 HydrophobicContact CG1-CD1 4.27Å; L345-L347 HydrophobicContact CD1-CD1 4.41Å; L345-L347 HydrophobicContact CD1-CD2 4.34Å; L345-L347 HydrophobicContact CD1-CG 4.02Å; L345-L347 HydrophobicContact CD2-CD1 3.89Å; L345-L347 HydrophobicContact CD2-CG 4.31Å; L345-L347 HydrophobicContact CG-CD1 4.17Å; L345-L347 HydrophobicContact CG-CG 4.03Å; L347-N350 VanDerWaalsContact C-ND2 3.27Å; L347-N350 WeakPolarHBondContact O-CB 3.24Å; L347-N350 PolarHBondContact O-ND2 3.2Å; L347-L352 HydrophobicContact CB-CD1 3.9Å; L347-L352 HydrophobicContact CD1-CD1 4.29Å; L347-N374 CarbonylContact C-O 3.48Å; L347-N374 PolarHBondContact N-O 3.36Å; L347-L375 HydrophobicContact CB-CD2 4.24Å; L347-N378 PolarHBondContact O-ND2 3.19Å
348	G	98.8	Very high	98.3	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.188	C	C	.	.			trans	-59.7	144.9	177	0	0	0	0	0	115	R320 L321 H346 N350 N374 S376	R320-G348 CarbonylContact C-O 3.52Å; R320-G348 VanDerWaalsContact CA-O 3.24Å; R320-G348 WeakPolarHBondContact CA-O 3.39Å; R320-G348 VanDerWaalsContact CG-O 3.31Å; R320-G348 WeakPolarHBondContact CG-O 3.49Å; L321-G348 PolarHBondContact N-O 2.96Å; H346-G348 PolarHBondContact ND1-N 3.15Å; H346-G348 VanDerWaalsContact ND1-N 3.11Å; G348-N350 PolarHBondContact O-ND2 2.92Å; G348-N374 PolarHBondContact N-O 2.91Å; G348-S376 CarbonylContact C-O 3.53Å; G348-S376 VanDerWaalsContact C-O 3.3Å; G348-S376 WeakPolarHBondContact CA-O 3.35Å
349	G	98.5	Very high	98.5	Very high	14 Å²	14	28.8 Å²	28.8	14%	0.144	17%	0.166	C	C	.	.	S	Bend	trans	64	52.9	-179.5	0	0	0	0	0	113.4	L321 N322 S376 C377	L321-G349 WeakPolarHBondContact CA-O 3.41Å; L321-G349 PolarHBondContact N-O 2.69Å; N322-G349 PolarHBondContact N-O 2.98Å; G349-S376 PolarHBondContact N-O 3.39Å; G349-C377 WeakPolarHBondContact CA-O 3.17Å; G349-C377 PolarHBondContact N-O 3.39Å; G349-C377 VanDerWaalsContact N-O 3.16Å
350	N	98.7	Very high	98.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-131.6	16.1	-175.4	-88.1	-74.4	0	0	0	113.7	M319 N322 V324 R325 L347 G348 L352 N378	M319-N350 PolarHBondContact O-ND2 3Å; M319-N350 PolarHBondContact O-OD1 3.25Å; N322-N350 WeakPolarHBondContact CA-OD1 3.48Å; N322-N350 VanDerWaalsContact CB-OD1 3.24Å; N322-N350 WeakPolarHBondContact CB-OD1 3.27Å; N322-N350 PolarHBondContact N-OD1 3.42Å; N322-N350 WeakPolarHBondContact O-CA 3.45Å; N322-N350 PolarHBondContact O-OD1 3.34Å; V324-N350 HydrophobicContact CB-CB 4.06Å; V324-N350 WeakPolarHBondContact CB-OD1 3.37Å; V324-N350 WeakPolarHBondContact CG2-OD1 3.28Å; R325-N350 WeakPolarHBondContact CA-O 3.23Å; R325-N350 PolarHBondContact N-O 3.37Å; L347-N350 VanDerWaalsContact C-ND2 3.27Å; L347-N350 WeakPolarHBondContact O-CB 3.24Å; L347-N350 PolarHBondContact O-ND2 3.2Å; G348-N350 PolarHBondContact O-ND2 2.92Å; N350-L352 HydrophobicContact CB-CD1 4.46Å; N350-L352 HydrophobicContact CB-CD2 4.27Å; N350-L352 HydrophobicContact CB-CG 3.95Å; N350-L352 PolarHBondContact O-N 2.86Å; N350-N378 PolarHBondContact N-OD1 2.98Å
351	D	98.3	Very high	98.6	Very high	104 Å²	104	24.3 Å²	24.3	56%	0.556	14%	0.14	S	C	*	.			trans	54.1	38	-175.6	-54.2	-31.1	0	0	0	112.9	R325 N378	R325-D351 HydrophobicContact CG-CB 4.2Å; D351-N378 PolarHBondContact N-OD1 2.87Å
352	L	98.7	Very high	98.6	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	16%	0.162	C	C	.	.			trans	-80.2	141.7	175.3	-55	-177.2	0	0	0	110.4	V324 R325 L347 N350 T356 L375 N378 S379 L380	V324-L352 HydrophobicContact CG1-CD2 4.4Å; R325-L352 VanDerWaalsContact O-CD2 3.27Å; R325-L352 WeakPolarHBondContact O-CD2 3.26Å; L347-L352 HydrophobicContact CB-CD1 3.9Å; L347-L352 HydrophobicContact CD1-CD1 4.29Å; N350-L352 HydrophobicContact CB-CD1 4.46Å; N350-L352 HydrophobicContact CB-CD2 4.27Å; N350-L352 HydrophobicContact CB-CG 3.95Å; N350-L352 PolarHBondContact O-N 2.86Å; L352-T356 HydrophobicContact CD1-CG2 4.22Å; L352-T356 HydrophobicContact CD2-CG2 4.34Å; L352-L375 HydrophobicContact CD1-CD2 4.34Å; L352-N378 HydrophobicContact CB-CB 4.09Å; L352-N378 PolarHBondContact N-OD1 3.46Å; L352-S379 CarbonylContact O-C 3.47Å; L352-S379 PolarHBondContact O-N 3.04Å; L352-L380 HydrophobicContact CB-CD2 4.12Å
353	T	98.7	Very high	98.6	Very high	42 Å²	42	29.8 Å²	29.8	26%	0.258	16%	0.162	S	C	.	.	B	Isolated β-bridge	trans	-118.1	-173.1	177.8	84.1	0	0	0	0	112.8	D326 I355 T356 A357 S379	D326-T353 VanDerWaalsContact CG-OG1 3.31Å; D326-T353 PolarHBondContact OD1-N 3.46Å; D326-T353 PolarHBondContact OD1-OG1 2.83Å; D326-T353 WeakPolarHBondContact OD2-CB 3.49Å; D326-T353 VanDerWaalsContact OD2-CG2 3.27Å; D326-T353 WeakPolarHBondContact OD2-CG2 3.29Å; D326-T353 PolarHBondContact OD2-OG1 2.87Å; T353-I355 PolarHBondContact O-N 3.39Å; T353-I355 VanDerWaalsContact O-N 3.08Å; T353-I355 PolarHBondContact OG1-N 2.89Å; T353-T356 PolarHBondContact O-N 3.37Å; T353-A357 PolarHBondContact O-N 3.27Å; T353-S379 VanDerWaalsContact CA-O 3.25Å; T353-S379 WeakPolarHBondContact CA-O 3.39Å
354	S	98.4	Very high	98.5	Very high	39 Å²	39	27.2 Å²	27.2	27%	0.273	15%	0.146	S	C	.	.	H	α-helix	trans	-49.6	-29.6	172	65.9	0	0	0	0	113.6	A357 V358 L380	S354-A357 PolarHBondContact O-N 3.19Å; S354-V358 VanDerWaalsContact O-CG2 3.26Å; S354-V358 WeakPolarHBondContact O-CG2 3.45Å; S354-V358 PolarHBondContact O-N 3.05Å; S354-L380 WeakPolarHBondContact CA-O 3.19Å; S354-L380 WeakPolarHBondContact CB-O 3.34Å; S354-L380 PolarHBondContact N-O 3.27Å
355	I	98.4	Very high	98.4	Very high	91 Å²	91	29.4 Å²	29.4	47%	0.467	16%	0.161	S	C	.	.	H	α-helix	trans	-62.2	-52.4	-179.2	-57.3	175.2	0	0	0	110.1	D326 Q330 T353 A357 V358 V359	D326-I355 HydrophobicContact CB-CB 4.37Å; Q330-I355 VanDerWaalsContact NE2-CG2 3.29Å; T353-I355 PolarHBondContact O-N 3.39Å; T353-I355 VanDerWaalsContact O-N 3.08Å; T353-I355 PolarHBondContact OG1-N 2.89Å; I355-A357 VanDerWaalsContact C-N 3.34Å; I355-A357 PolarHBondContact O-N 3.26Å; I355-V358 PolarHBondContact O-N 3.37Å; I355-V359 PolarHBondContact O-N 3.37Å
356	T	98.6	Very high	98.2	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-63.2	-40.5	176.5	-61	0	0	0	0	111.8	D326 V333 L352 T353 V358 V359 L360	D326-T356 VanDerWaalsContact CA-OG1 3.3Å; D326-T356 WeakPolarHBondContact CA-OG1 3.43Å; D326-T356 PolarHBondContact O-OG1 2.86Å; D326-T356 WeakPolarHBondContact OD1-CB 3.07Å; D326-T356 PolarHBondContact OD1-N 2.93Å; D326-T356 PolarHBondContact OD1-OG1 3.1Å; V333-T356 HydrophobicContact CG1-CG2 4.36Å; V333-T356 HydrophobicContact CG2-CG2 4.49Å; L352-T356 HydrophobicContact CD1-CG2 4.22Å; L352-T356 HydrophobicContact CD2-CG2 4.34Å; T353-T356 PolarHBondContact O-N 3.37Å; T356-V358 VanDerWaalsContact C-N 3.33Å; T356-V358 PolarHBondContact O-N 2.88Å; T356-V359 PolarHBondContact O-N 3.13Å; T356-L360 WeakPolarHBondContact O-CB 3.39Å; T356-L360 PolarHBondContact O-N 3.27Å
357	A	98.5	Very high	98.1	Very high	2 Å²	2	36.6 Å²	36.6	2%	0.017	19%	0.192	C	C	.	.	H	α-helix	trans	-60.4	-40.1	179.2	0	0	0	0	0	112.8	T353 S354 I355 L360 S361 L380 L388	T353-A357 PolarHBondContact O-N 3.27Å; S354-A357 PolarHBondContact O-N 3.19Å; I355-A357 VanDerWaalsContact C-N 3.34Å; I355-A357 PolarHBondContact O-N 3.26Å; A357-L360 PolarHBondContact O-N 2.85Å; A357-S361 PolarHBondContact O-N 3.05Å; A357-L380 HydrophobicContact CB-CB 4.42Å; A357-L380 HydrophobicContact CB-CD2 4.29Å; A357-L388 HydrophobicContact CB-CD1 4.1Å; A357-L388 HydrophobicContact CB-CG 4.25Å
358	V	98.6	Very high	97.9	Very high	46 Å²	46	44 Å²	44	28%	0.279	23%	0.227	S	C	.	.	H	α-helix	trans	-68.1	-34.1	177.3	169.6	0	0	0	0	112.1	S354 I355 T356 S361 V383 A387	S354-V358 VanDerWaalsContact O-CG2 3.26Å; S354-V358 WeakPolarHBondContact O-CG2 3.45Å; S354-V358 PolarHBondContact O-N 3.05Å; I355-V358 PolarHBondContact O-N 3.37Å; T356-V358 VanDerWaalsContact C-N 3.33Å; T356-V358 PolarHBondContact O-N 2.88Å; V358-S361 PolarHBondContact O-OG 2.72Å; V358-V383 HydrophobicContact CG2-CG1 4.44Å; V358-A387 HydrophobicContact CG2-CB 3.9Å
359	V	98.6	Very high	97.9	Very high	23 Å²	23	45.5 Å²	45.5	14%	0.139	24%	0.236	C	C	.	.	H	α-helix	trans	-71.6	-45.4	174.1	177.3	0	0	0	0	110.2	Q330 V333 E334 I355 T356 S361 K362 V363	Q330-V359 HydrophobicContact CG-CB 4.21Å; Q330-V359 HydrophobicContact CG-CG2 3.89Å; V333-V359 HydrophobicContact CG2-CB 4.28Å; V333-V359 HydrophobicContact CG2-CG1 3.82Å; E334-V359 HydrophobicContact CG-CG1 3.78Å; I355-V359 PolarHBondContact O-N 3.37Å; T356-V359 PolarHBondContact O-N 3.13Å; V359-S361 VanDerWaalsContact C-N 3.31Å; V359-S361 PolarHBondContact O-N 3.17Å; V359-K362 WeakPolarHBondContact O-CB 3.47Å; V359-K362 PolarHBondContact O-N 3.35Å; V359-V363 WeakPolarHBondContact O-CG2 3.44Å; V359-V363 PolarHBondContact O-N 3.19Å; V359-V363 VanDerWaalsContact O-N 3.15Å
360	L	98.6	Very high	97.9	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-58.8	-40.9	177.3	178.7	56.2	0	0	0	112	V333 T356 A357 K362 V363 L364 L373 L375 L388	V333-L360 HydrophobicContact CB-CB 4.25Å; V333-L360 HydrophobicContact CB-CD1 3.94Å; V333-L360 HydrophobicContact CG1-CB 4.12Å; V333-L360 HydrophobicContact CG1-CD1 3.8Å; V333-L360 HydrophobicContact CG1-CD2 4.3Å; V333-L360 HydrophobicContact CG1-CG 4.29Å; V333-L360 HydrophobicContact CG2-CB 4.3Å; T356-L360 WeakPolarHBondContact O-CB 3.39Å; T356-L360 PolarHBondContact O-N 3.27Å; A357-L360 PolarHBondContact O-N 2.85Å; L360-K362 VanDerWaalsContact C-N 3.28Å; L360-K362 PolarHBondContact O-N 3.2Å; L360-V363 WeakPolarHBondContact O-CA 3.27Å; L360-V363 WeakPolarHBondContact O-CB 3.33Å; L360-V363 PolarHBondContact O-N 2.96Å; L360-L364 HydrophobicContact CD1-CD1 4.32Å; L360-L364 HydrophobicContact CD1-CD2 4.1Å; L360-L364 HydrophobicContact CD1-CG 3.9Å; L360-L364 HydrophobicContact CG-CD1 4.12Å; L360-L364 HydrophobicContact CG-CG 4.16Å; L360-L364 WeakPolarHBondContact O-CG 2.99Å; L360-L364 PolarHBondContact O-N 3.38Å; L360-L373 HydrophobicContact CD2-CD1 4.37Å; L360-L373 HydrophobicContact CD2-CD2 3.85Å; L360-L375 HydrophobicContact CD2-CD1 3.75Å; L360-L375 HydrophobicContact CD2-CD2 4.11Å; L360-L375 HydrophobicContact CD2-CG 4.45Å; L360-L388 HydrophobicContact CB-CD2 4.47Å; L360-L388 HydrophobicContact CD2-CD2 4.19Å; L360-L388 HydrophobicContact CG-CD2 4.17Å
361	S	98.3	Very high	97.9	Very high	13 Å²	13	48.2 Å²	48.2	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-58.2	-41.6	178.3	73.6	0	0	0	0	112.1	A357 V358 V359 V363 L364 L365 A387 A391	A357-S361 PolarHBondContact O-N 3.05Å; V358-S361 PolarHBondContact O-OG 2.72Å; V359-S361 VanDerWaalsContact C-N 3.31Å; V359-S361 PolarHBondContact O-N 3.17Å; S361-V363 VanDerWaalsContact C-N 3.33Å; S361-V363 PolarHBondContact O-N 3.37Å; S361-L364 PolarHBondContact O-N 2.55Å; S361-L365 PolarHBondContact O-N 3.48Å; S361-A387 WeakPolarHBondContact CB-O 3.32Å; S361-A391 WeakPolarHBondContact O-CB 3.35Å
362	K	98.2	Very high	97.9	Very high	130 Å²	130	44.3 Å²	44.3	57%	0.565	22%	0.224	S	C	*	.	H	α-helix	trans	-65.7	-36	175.2	-63.8	173.5	-175.3	174.5	0	112.5	V359 L360	V359-K362 WeakPolarHBondContact O-CB 3.47Å; V359-K362 PolarHBondContact O-N 3.35Å; L360-K362 VanDerWaalsContact C-N 3.28Å; L360-K362 PolarHBondContact O-N 3.2Å
363	V	98	Very high	97.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-67.8	-43.2	176.9	172.7	0	0	0	0	110.8	V333 L336 Q337 V359 L360 S361 L365 K366 N367	V333-V363 WeakPolarHBondContact O-CG1 3.16Å; V333-V363 WeakPolarHBondContact O-CG2 3.27Å; L336-V363 HydrophobicContact CB-CG1 3.84Å; Q337-V363 HydrophobicContact CG-CB 4.39Å; Q337-V363 HydrophobicContact CG-CG1 4.1Å; Q337-V363 HydrophobicContact CG-CG2 3.82Å; V359-V363 WeakPolarHBondContact O-CG2 3.44Å; V359-V363 PolarHBondContact O-N 3.19Å; V359-V363 VanDerWaalsContact O-N 3.15Å; L360-V363 WeakPolarHBondContact O-CA 3.27Å; L360-V363 WeakPolarHBondContact O-CB 3.33Å; L360-V363 PolarHBondContact O-N 2.96Å; S361-V363 VanDerWaalsContact C-N 3.33Å; S361-V363 PolarHBondContact O-N 3.37Å; V363-L365 PolarHBondContact O-N 3.37Å; V363-K366 PolarHBondContact O-N 3.47Å; V363-N367 HydrophobicContact CG1-CB 4.31Å; V363-N367 PolarHBondContact O-N 3.34Å
364	L	97.4	Very high	97.9	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-63.7	-22.3	-178.5	-70.3	-179.9	0	0	0	113.6	L360 S361 K366 L370 L373 L388 A391 M392 N395 L398	L360-L364 HydrophobicContact CD1-CD1 4.32Å; L360-L364 HydrophobicContact CD1-CD2 4.1Å; L360-L364 HydrophobicContact CD1-CG 3.9Å; L360-L364 HydrophobicContact CG-CD1 4.12Å; L360-L364 HydrophobicContact CG-CG 4.16Å; L360-L364 WeakPolarHBondContact O-CG 2.99Å; L360-L364 PolarHBondContact O-N 3.38Å; S361-L364 PolarHBondContact O-N 2.55Å; L364-K366 PolarHBondContact O-N 3.38Å; L364-L370 HydrophobicContact CD2-CD2 4.46Å; L364-L373 HydrophobicContact CD1-CD2 4.36Å; L364-L388 HydrophobicContact CD1-CD2 4.19Å; L364-A391 HydrophobicContact CB-CB 4.5Å; L364-M392 HydrophobicContact CD1-SD 4.38Å; L364-N395 PolarHBondContact O-ND2 3.44Å; L364-L398 HydrophobicContact CD1-CD1 3.96Å; L364-L398 HydrophobicContact CD2-CD1 3.63Å; L364-L398 HydrophobicContact CG-CD1 4.4Å
365	L	96.4	Very high	97.9	Very high	99 Å²	99	41.4 Å²	41.4	52%	0.518	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-21.1	171.3	-63.8	176.4	0	0	0	113.2	S361 V363 A391 H394	S361-L365 PolarHBondContact O-N 3.48Å; V363-L365 PolarHBondContact O-N 3.37Å; L365-A391 HydrophobicContact CD2-CB 4.12Å; L365-A391 HydrophobicContact CG-CB 4.36Å; L365-H394 HydrophobicContact CD2-CB 3.69Å
366	K	95.4	Very high	97.9	Very high	152 Å²	152	37.5 Å²	37.5	66%	0.661	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.4	-31.2	-175.4	-62	-176.4	-179.1	-179.6	0	113.4	V363 L364 E368	V363-K366 PolarHBondContact O-N 3.47Å; L364-K366 PolarHBondContact O-N 3.38Å; K366-E368 PolarHBondContact O-N 3.3Å
367	N	96.5	Very high	97.9	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.043	20%	0.199	C	C	.	.			trans	-75	120.4	-179.4	-176.9	-86	0	0	0	110	L336 N339 V363 T369 L370 N395	L336-N367 PolarHBondContact O-ND2 3.35Å; N339-N367 PolarHBondContact O-ND2 3.21Å; V363-N367 HydrophobicContact CG1-CB 4.31Å; V363-N367 PolarHBondContact O-N 3.34Å; N367-T369 PolarHBondContact ND2-OG1 2.61Å; N367-T369 VanDerWaalsContact ND2-OG1 3.12Å; N367-T369 PolarHBondContact OD1-N 2.88Å; N367-T369 VanDerWaalsContact OD1-N 3.13Å; N367-T369 PolarHBondContact OD1-OG1 2.86Å; N367-L370 VanDerWaalsContact OD1-CB 3.29Å; N367-L370 WeakPolarHBondContact OD1-CB 3.25Å; N367-L370 PolarHBondContact OD1-N 3.04Å; N367-N395 PolarHBondContact O-ND2 2.9Å
368	E	95.4	Very high	97.9	Very high	156 Å²	156	39.8 Å²	39.8	73%	0.729	20%	0.2	S	C	*	.			trans	-107.1	10.1	-178.2	-62.6	-177.7	172.5	0	0	112.9	K366 T397	K366-E368 PolarHBondContact O-N 3.3Å; E368-T397 HydrophobicContact CB-CG2 4.2Å; E368-T397 VanDerWaalsContact O-CG2 3.32Å; E368-T397 WeakPolarHBondContact O-CG2 3.42Å
369	T	97.4	Very high	97.9	Very high	31 Å²	31	40.2 Å²	40.2	19%	0.19	21%	0.205	C	C	.	.	S	Bend	trans	-114	-35.4	-167	66.2	0	0	0	0	112.5	T340 L342 N367 K371	T340-T369 WeakPolarHBondContact O-CG2 3.45Å; L342-T369 CarbonylContact O-C 3.57Å; L342-T369 PolarHBondContact O-OG1 2.95Å; N367-T369 PolarHBondContact ND2-OG1 2.61Å; N367-T369 VanDerWaalsContact ND2-OG1 3.12Å; N367-T369 PolarHBondContact OD1-N 2.88Å; N367-T369 VanDerWaalsContact OD1-N 3.13Å; N367-T369 PolarHBondContact OD1-OG1 2.86Å; T369-K371 PolarHBondContact O-N 3.11Å
370	L	98.4	Very high	97.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.198	C	C	.	.			trans	-65.6	132.3	-179.7	-162.8	69.9	0	0	0	110.6	L336 L342 L345 L364 N367 L373 T397 L398	L336-L370 HydrophobicContact CD1-CD2 4.28Å; L342-L370 HydrophobicContact CD2-CD1 4.47Å; L345-L370 HydrophobicContact CB-CD1 3.88Å; L364-L370 HydrophobicContact CD2-CD2 4.46Å; N367-L370 VanDerWaalsContact OD1-CB 3.29Å; N367-L370 WeakPolarHBondContact OD1-CB 3.25Å; N367-L370 PolarHBondContact OD1-N 3.04Å; L370-L373 HydrophobicContact CD2-CB 4.11Å; L370-L373 HydrophobicContact CD2-CD1 4.25Å; L370-T397 CarbonylContact O-C 3.12Å; L370-T397 PolarHBondContact O-OG1 3.11Å; L370-L398 HydrophobicContact CB-CD2 4.12Å; L370-L398 HydrophobicContact CD2-CD2 3.97Å; L370-L398 HydrophobicContact CG-CD2 3.81Å
371	K	98.3	Very high	97.8	Very high	72 Å²	72	39.9 Å²	39.9	31%	0.313	21%	0.205	S	C	.	.			trans	-113.3	-42.1	-178.7	-60.4	-53	-171.9	-178.1	0	112.1	T343 T369 T397 L398 T399 E400	T343-K371 HydrophobicContact CG2-CG 4.37Å; T343-K371 WeakPolarHBondContact O-CA 3.14Å; T343-K371 WeakPolarHBondContact O-CB 3.43Å; T343-K371 PolarHBondContact O-N 3.44Å; T369-K371 PolarHBondContact O-N 3.11Å; K371-T397 WeakPolarHBondContact CD-O 3.49Å; K371-T397 PolarHBondContact NZ-O 3.43Å; K371-L398 WeakPolarHBondContact O-CA 3.37Å; K371-L398 WeakPolarHBondContact O-CD2 3.4Å; K371-T399 PolarHBondContact O-N 3.16Å; K371-T399 PolarHBondContact O-OG1 2.95Å; K371-E400 PolarHBondContact O-N 3.01Å
372	T	98.8	Very high	97.8	Very high	22 Å²	22	45.7 Å²	45.7	14%	0.135	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.7	-179.9	-56.4	0	0	0	0	110.4	T343 Y344 L345 E400	T343-T372 PolarHBondContact O-N 3.09Å; Y344-T372 WeakPolarHBondContact CA-O 3.16Å; Y344-T372 VanDerWaalsContact CD2-CB 3.49Å; Y344-T372 HydrophobicContact CD2-CG2 3.43Å; Y344-T372 VanDerWaalsContact CD2-CG2 3.43Å; Y344-T372 HydrophobicContact CE2-CG2 3.44Å; Y344-T372 VanDerWaalsContact CE2-CG2 3.44Å; Y344-T372 HydrophobicContact CG-CG2 4.41Å; L345-T372 PolarHBondContact N-O 3.11Å; T372-E400 WeakPolarHBondContact CA-O 3.17Å; T372-E400 HydrophobicContact CG2-CB 3.8Å; T372-E400 VanDerWaalsContact CG2-OE2 3.24Å; T372-E400 WeakPolarHBondContact CG2-OE2 2.82Å; T372-E400 PolarHBondContact OG1-OE2 3.46Å
373	L	98.8	Very high	97.7	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	126.9	177.4	174.6	62.9	0	0	0	109.8	L345 L360 L364 L370 L375 L398 E400 C401 D402	L345-L373 HydrophobicContact CB-CD1 4.47Å; L345-L373 HydrophobicContact CD2-CD1 4.33Å; L345-L373 HydrophobicContact CG-CD1 4.47Å; L345-L373 CarbonylContact O-C 3.28Å; L345-L373 WeakPolarHBondContact O-CA 3.48Å; L360-L373 HydrophobicContact CD2-CD1 4.37Å; L360-L373 HydrophobicContact CD2-CD2 3.85Å; L364-L373 HydrophobicContact CD1-CD2 4.36Å; L370-L373 HydrophobicContact CD2-CB 4.11Å; L370-L373 HydrophobicContact CD2-CD1 4.25Å; L373-L375 HydrophobicContact CD1-CD2 4.12Å; L373-L375 HydrophobicContact CD1-CG 4.12Å; L373-L375 HydrophobicContact CD2-CD1 4.09Å; L373-L375 HydrophobicContact CD2-CG 4.36Å; L373-L375 HydrophobicContact CG-CD1 4.35Å; L373-L375 HydrophobicContact CG-CG 4.08Å; L373-L398 HydrophobicContact CB-CD2 3.95Å; L373-L398 HydrophobicContact CD2-CD1 4.33Å; L373-E400 PolarHBondContact N-O 3.32Å; L373-C401 CarbonylContact O-C 3.36Å; L373-C401 VanDerWaalsContact O-CA 3.23Å; L373-C401 WeakPolarHBondContact O-CA 3.27Å; L373-D402 PolarHBondContact O-N 3.28Å
374	N	98.8	Very high	97.7	Very high	18 Å²	18	44.1 Å²	44.1	10%	0.096	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	117	174.1	-169.5	-42.5	0	0	0	110.9	L345 H346 L347 G348 S376 D402	L345-N374 PolarHBondContact O-N 2.8Å; H346-N374 HydrophobicContact CB-CB 4.16Å; H346-N374 PolarHBondContact CE1-OD1 3.2Å; H346-N374 VanDerWaalsContact CE1-OD1 3.3Å; H346-N374 PolarHBondContact NE2-ND2 3.3Å; H346-N374 VanDerWaalsContact NE2-ND2 3.2Å; L347-N374 CarbonylContact C-O 3.48Å; L347-N374 PolarHBondContact N-O 3.36Å; G348-N374 PolarHBondContact N-O 2.91Å; N374-S376 WeakPolarHBondContact OD1-CB 3.24Å; N374-S376 PolarHBondContact OD1-N 3.2Å; N374-S376 PolarHBondContact OD1-OG 3.22Å; N374-D402 HydrophobicContact CB-CB 4.32Å; N374-D402 WeakPolarHBondContact ND2-CB 3.38Å; N374-D402 PolarHBondContact ND2-OD2 2.88Å
375	L	98.7	Very high	97.8	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	23%	0.232	C	C	.	.			trans	-117.2	10.6	177.9	-61.6	171.9	0	0	0	112.4	L347 L352 L360 L373 N378 L380 L388 D402 T406	L347-L375 HydrophobicContact CB-CD2 4.24Å; L352-L375 HydrophobicContact CD1-CD2 4.34Å; L360-L375 HydrophobicContact CD2-CD1 3.75Å; L360-L375 HydrophobicContact CD2-CD2 4.11Å; L360-L375 HydrophobicContact CD2-CG 4.45Å; L373-L375 HydrophobicContact CD1-CD2 4.12Å; L373-L375 HydrophobicContact CD1-CG 4.12Å; L373-L375 HydrophobicContact CD2-CD1 4.09Å; L373-L375 HydrophobicContact CD2-CG 4.36Å; L373-L375 HydrophobicContact CG-CD1 4.35Å; L373-L375 HydrophobicContact CG-CG 4.08Å; L375-N378 WeakPolarHBondContact O-CB 3.23Å; L375-N378 PolarHBondContact O-ND2 2.87Å; L375-L380 HydrophobicContact CB-CD1 4.01Å; L375-L380 HydrophobicContact CD1-CD1 3.93Å; L375-L388 HydrophobicContact CD1-CD1 3.97Å; L375-D402 PolarHBondContact N-O 3.46Å; L375-T406 VanDerWaalsContact O-CG2 3.24Å; L375-T406 WeakPolarHBondContact O-CG2 3.26Å
376	S	98.6	Very high	97.9	Very high	8 Å²	8	44.9 Å²	44.9	6%	0.056	23%	0.231	C	C	.	.			trans	-56	154.7	-174.7	61.1	0	0	0	0	113.5	G348 G349 N374 N378 D402 R404	G348-S376 CarbonylContact C-O 3.53Å; G348-S376 VanDerWaalsContact C-O 3.3Å; G348-S376 WeakPolarHBondContact CA-O 3.35Å; G349-S376 PolarHBondContact N-O 3.39Å; N374-S376 WeakPolarHBondContact OD1-CB 3.24Å; N374-S376 PolarHBondContact OD1-N 3.2Å; N374-S376 PolarHBondContact OD1-OG 3.22Å; S376-N378 PolarHBondContact O-N 2.95Å; S376-D402 PolarHBondContact N-O 2.78Å; S376-R404 CarbonylContact C-O 3.46Å; S376-R404 WeakPolarHBondContact CA-O 3.46Å; S376-R404 VanDerWaalsContact CB-O 3.27Å; S376-R404 WeakPolarHBondContact CB-O 3.17Å
377	C	98.4	Very high	98	Very high	47 Å²	47	38.3 Å²	38.3	32%	0.318	21%	0.205	S	C	.	.	S	Bend	trans	57.6	45.6	179.1	-48.5	0	0	0	0	113	G349 R404 Q405	G349-C377 WeakPolarHBondContact CA-O 3.17Å; G349-C377 PolarHBondContact N-O 3.39Å; G349-C377 VanDerWaalsContact N-O 3.16Å; C377-R404 PolarHBondContact N-O 3.28Å; C377-Q405 CarbonylContact C-O 3.58Å; C377-Q405 WeakPolarHBondContact CA-O 3.41Å; C377-Q405 PolarHBondContact N-O 3.44Å; C377-Q405 VanDerWaalsContact N-O 3.14Å; C377-Q405 PolarHBondContact SG-OE1 3.08Å
378	N	98.7	Very high	98.1	Very high	6 Å²	6	38 Å²	38	3%	0.032	20%	0.204	C	C	.	.	S	Bend	trans	-127.1	178.7	172.4	-77.8	-59.9	0	0	0	108.7	L347 N350 D351 L352 L375 S376 L380 Q405 T406	L347-N378 PolarHBondContact O-ND2 3.19Å; N350-N378 PolarHBondContact N-OD1 2.98Å; D351-N378 PolarHBondContact N-OD1 2.87Å; L352-N378 HydrophobicContact CB-CB 4.09Å; L352-N378 PolarHBondContact N-OD1 3.46Å; L375-N378 WeakPolarHBondContact O-CB 3.23Å; L375-N378 PolarHBondContact O-ND2 2.87Å; S376-N378 PolarHBondContact O-N 2.95Å; N378-L380 HydrophobicContact CB-CD2 3.96Å; N378-L380 HydrophobicContact CB-CG 4.26Å; N378-Q405 PolarHBondContact N-O 3.21Å; N378-Q405 VanDerWaalsContact N-O 3.11Å; N378-T406 WeakPolarHBondContact O-CA 3.36Å
379	S	98	Very high	98.2	Very high	55 Å²	55	30.8 Å²	30.8	39%	0.385	17%	0.171	S	C	.	.	B	Isolated β-bridge	trans	-115.1	59.5	178.9	-68.2	0	0	0	0	111	L352 T353 G381 E407	L352-S379 CarbonylContact O-C 3.47Å; L352-S379 PolarHBondContact O-N 3.04Å; T353-S379 VanDerWaalsContact CA-O 3.25Å; T353-S379 WeakPolarHBondContact CA-O 3.39Å; S379-G381 VanDerWaalsContact C-N 3.3Å; S379-G381 PolarHBondContact O-N 2.97Å; S379-E407 WeakPolarHBondContact CB-OE1 3.34Å; S379-E407 PolarHBondContact OG-OE1 3.29Å
380	L	98.2	Very high	98.2	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.187	C	C	.	.			trans	-67.8	-31.4	-175.4	-52	-174.7	0	0	0	112.5	L352 S354 A357 L375 N378 G384 L388 T406 I408	L352-L380 HydrophobicContact CB-CD2 4.12Å; S354-L380 WeakPolarHBondContact CA-O 3.19Å; S354-L380 WeakPolarHBondContact CB-O 3.34Å; S354-L380 PolarHBondContact N-O 3.27Å; A357-L380 HydrophobicContact CB-CB 4.42Å; A357-L380 HydrophobicContact CB-CD2 4.29Å; L375-L380 HydrophobicContact CB-CD1 4.01Å; L375-L380 HydrophobicContact CD1-CD1 3.93Å; N378-L380 HydrophobicContact CB-CD2 3.96Å; N378-L380 HydrophobicContact CB-CG 4.26Å; L380-G384 WeakPolarHBondContact O-CA 3.46Å; L380-G384 PolarHBondContact O-N 2.89Å; L380-L388 HydrophobicContact CD1-CD1 4.04Å; L380-T406 HydrophobicContact CD1-CG2 3.85Å; L380-T406 HydrophobicContact CG-CG2 4.07Å; L380-T406 PolarHBondContact N-O 3.14Å; L380-I408 HydrophobicContact CB-CD1 4.34Å; L380-I408 HydrophobicContact CB-CG1 4.29Å; L380-I408 HydrophobicContact CD1-CD1 4.05Å
381	G	97.3	Very high	98.2	Very high	15 Å²	15	34.9 Å²	34.9	16%	0.155	19%	0.188	C	C	.	.	H	α-helix	trans	65.3	178.3	177.2	0	0	0	0	0	114.3	S379 V383 G384 G385 T406 E407	S379-G381 VanDerWaalsContact C-N 3.3Å; S379-G381 PolarHBondContact O-N 2.97Å; G381-V383 VanDerWaalsContact C-N 3.31Å; G381-V383 PolarHBondContact O-N 3.27Å; G381-G384 PolarHBondContact O-N 3.41Å; G381-G385 PolarHBondContact O-N 2.99Å; G381-T406 PolarHBondContact N-O 2.91Å; G381-E407 CarbonylContact C-O 3.35Å; G381-E407 WeakPolarHBondContact CA-O 3.48Å
382	E	97.6	Very high	98.1	Very high	136 Å²	136	31.6 Å²	31.6	64%	0.636	17%	0.174	S	C	*	.	H	α-helix	trans	-60.4	-38.4	-178.9	-62.5	-178	-176.4	0	0	112.7	G385 K386 D409	E382-G385 PolarHBondContact O-N 2.95Å; E382-K386 WeakPolarHBondContact O-CB 3.44Å; E382-K386 PolarHBondContact O-N 2.67Å; E382-D409 HydrophobicContact CG-CB 4.48Å
383	V	97.6	Very high	97.9	Very high	97 Å²	97	35.2 Å²	35.2	59%	0.588	20%	0.196	S	C	*	.	H	α-helix	trans	-64	-46.6	179.5	178.1	0	0	0	0	111	V358 G381 A387	V358-V383 HydrophobicContact CG2-CG1 4.44Å; G381-V383 VanDerWaalsContact C-N 3.31Å; G381-V383 PolarHBondContact O-N 3.27Å; V383-A387 PolarHBondContact O-N 2.91Å
384	G	98	Very high	97.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.2	-41.3	176.2	0	0	0	0	0	111.8	L380 G381 A387 L388	L380-G384 WeakPolarHBondContact O-CA 3.46Å; L380-G384 PolarHBondContact O-N 2.89Å; G381-G384 PolarHBondContact O-N 3.41Å; G384-A387 PolarHBondContact O-N 3.38Å; G384-L388 WeakPolarHBondContact O-CG 3.21Å; G384-L388 PolarHBondContact O-N 2.83Å
385	G	98	Very high	97.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.6	-47.2	176.9	0	0	0	0	0	113.4	G381 E382 L388 A389	G381-G385 PolarHBondContact O-N 2.99Å; E382-G385 PolarHBondContact O-N 2.95Å; G385-L388 PolarHBondContact O-N 2.89Å; G385-A389 WeakPolarHBondContact O-CB 3.37Å; G385-A389 PolarHBondContact O-N 3.31Å
386	K	98.4	Very high	97.4	Very high	116 Å²	116	45.2 Å²	45.2	50%	0.504	25%	0.251	S	S	.	.	H	α-helix	trans	-60	-47.4	175.5	-178.2	177.5	174.8	179.6	0	111.7	E382 L388 A389 E390	E382-K386 WeakPolarHBondContact O-CB 3.44Å; E382-K386 PolarHBondContact O-N 2.67Å; K386-L388 VanDerWaalsContact C-N 3.34Å; K386-L388 PolarHBondContact O-N 2.88Å; K386-A389 PolarHBondContact O-N 3.44Å; K386-E390 WeakPolarHBondContact CE-OE1 3.43Å; K386-E390 WeakPolarHBondContact O-CG 3.32Å; K386-E390 PolarHBondContact O-N 3.04Å
387	A	98.4	Very high	97.3	Very high	14 Å²	14	45.4 Å²	45.4	12%	0.116	25%	0.252	C	S	.	.	H	α-helix	trans	-61.3	-42.6	179.6	0	0	0	0	0	112	V358 S361 V383 G384 A391	V358-A387 HydrophobicContact CG2-CB 3.9Å; S361-A387 WeakPolarHBondContact CB-O 3.32Å; V383-A387 PolarHBondContact O-N 2.91Å; G384-A387 PolarHBondContact O-N 3.38Å; A387-A391 PolarHBondContact O-N 3.2Å
388	L	98.3	Very high	97.2	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-65.4	-44.4	175.3	-72	172.5	0	0	0	111.7	A357 L360 L364 L375 L380 G384 G385 K386 E390 A391 M392 I408 I416	A357-L388 HydrophobicContact CB-CD1 4.1Å; A357-L388 HydrophobicContact CB-CG 4.25Å; L360-L388 HydrophobicContact CB-CD2 4.47Å; L360-L388 HydrophobicContact CD2-CD2 4.19Å; L360-L388 HydrophobicContact CG-CD2 4.17Å; L364-L388 HydrophobicContact CD1-CD2 4.19Å; L375-L388 HydrophobicContact CD1-CD1 3.97Å; L380-L388 HydrophobicContact CD1-CD1 4.04Å; G384-L388 WeakPolarHBondContact O-CG 3.21Å; G384-L388 PolarHBondContact O-N 2.83Å; G385-L388 PolarHBondContact O-N 2.89Å; K386-L388 VanDerWaalsContact C-N 3.34Å; K386-L388 PolarHBondContact O-N 2.88Å; L388-E390 VanDerWaalsContact C-N 3.34Å; L388-E390 PolarHBondContact O-N 2.87Å; L388-A391 PolarHBondContact O-N 3.4Å; L388-M392 WeakPolarHBondContact O-CB 3.46Å; L388-M392 WeakPolarHBondContact O-CG 3.41Å; L388-M392 PolarHBondContact O-N 3.04Å; L388-I408 HydrophobicContact CD1-CD1 4.41Å; L388-I416 HydrophobicContact CB-CD1 3.96Å
389	A	98	Very high	97.1	Very high	4 Å²	4	44 Å²	44	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-58.7	-44.5	178.5	0	0	0	0	0	112	G385 K386 M392 N412 I416	G385-A389 WeakPolarHBondContact O-CB 3.37Å; G385-A389 PolarHBondContact O-N 3.31Å; K386-A389 PolarHBondContact O-N 3.44Å; A389-M392 PolarHBondContact O-N 3.09Å; A389-N412 HydrophobicContact CB-CB 4.29Å; A389-I416 HydrophobicContact CB-CD1 4.42Å; A389-I416 HydrophobicContact CB-CG1 3.98Å
390	E	97.6	Very high	97.2	Very high	113 Å²	113	46.1 Å²	46.1	53%	0.528	25%	0.246	S	C	.	.	H	α-helix	trans	-62	-42.3	176.3	-72.3	173.6	-176.8	0	0	112.1	K386 L388	K386-E390 WeakPolarHBondContact CE-OE1 3.43Å; K386-E390 WeakPolarHBondContact O-CG 3.32Å; K386-E390 PolarHBondContact O-N 3.04Å; L388-E390 VanDerWaalsContact C-N 3.34Å; L388-E390 PolarHBondContact O-N 2.87Å
391	A	97.5	Very high	97.2	Very high	4 Å²	4	47 Å²	47	3%	0.033	25%	0.252	C	S	.	.	H	α-helix	trans	-71.3	-37.1	179.2	0	0	0	0	0	113.5	S361 L364 L365 A387 L388 V393 H394 N395	S361-A391 WeakPolarHBondContact O-CB 3.35Å; L364-A391 HydrophobicContact CB-CB 4.5Å; L365-A391 HydrophobicContact CD2-CB 4.12Å; L365-A391 HydrophobicContact CG-CB 4.36Å; A387-A391 PolarHBondContact O-N 3.2Å; L388-A391 PolarHBondContact O-N 3.4Å; A391-V393 PolarHBondContact O-N 3.29Å; A391-H394 PolarHBondContact O-N 3.08Å; A391-N395 PolarHBondContact O-N 3.34Å; A391-N395 VanDerWaalsContact O-N 3.14Å
392	M	95.9	Very high	97.2	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-27.7	-178.9	-74.5	-69.7	-151.7	0	0	112.9	L364 L388 A389 H394 N395 L398 C401 I416 A419 I420	L364-M392 HydrophobicContact CD1-SD 4.38Å; L388-M392 WeakPolarHBondContact O-CB 3.46Å; L388-M392 WeakPolarHBondContact O-CG 3.41Å; L388-M392 PolarHBondContact O-N 3.04Å; A389-M392 PolarHBondContact O-N 3.09Å; M392-H394 PolarHBondContact O-N 2.94Å; M392-N395 PolarHBondContact O-N 2.95Å; M392-L398 HydrophobicContact CE-CD1 3.74Å; M392-L398 HydrophobicContact SD-CD1 3.69Å; M392-C401 HydrophobicContact CE-CB 3.8Å; M392-C401 VanDerWaalsContact CE-SG 3.53Å; M392-I416 HydrophobicContact CE-CG2 3.95Å; M392-I416 HydrophobicContact CG-CG1 4.32Å; M392-I416 HydrophobicContact CG-CG2 4.34Å; M392-A419 HydrophobicContact CB-CB 3.86Å; M392-I420 HydrophobicContact CE-CD1 4.11Å; M392-I420 HydrophobicContact SD-CD1 4.33Å
393	V	94.4	Very high	97.2	Very high	97 Å²	97	41.9 Å²	41.9	59%	0.588	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-29.3	174.3	174.9	0	0	0	0	112.1	A391	A391-V393 PolarHBondContact O-N 3.29Å
394	H	95	Very high	97.2	Very high	141 Å²	141	45.5 Å²	45.5	65%	0.653	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-17.2	-179.4	-62.7	-62.9	0	0	0	113.2	L365 A391 M392	L365-H394 HydrophobicContact CD2-CB 3.69Å; A391-H394 PolarHBondContact O-N 3.08Å; M392-H394 PolarHBondContact O-N 2.94Å
395	N	95.9	Very high	97.2	Very high	9 Å²	9	52.8 Å²	52.8	5%	0.048	26%	0.262	C	S	.	.			trans	-82.9	123.3	176.2	-173.3	-83.1	0	0	0	110.5	L364 N367 A391 M392 T397 L398 N423	L364-N395 PolarHBondContact O-ND2 3.44Å; N367-N395 PolarHBondContact O-ND2 2.9Å; A391-N395 PolarHBondContact O-N 3.34Å; A391-N395 VanDerWaalsContact O-N 3.14Å; M392-N395 PolarHBondContact O-N 2.95Å; N395-T397 PolarHBondContact ND2-OG1 3.35Å; N395-T397 PolarHBondContact OD1-N 3.01Å; N395-T397 PolarHBondContact OD1-OG1 2.88Å; N395-L398 WeakPolarHBondContact OD1-CB 3.34Å; N395-L398 PolarHBondContact OD1-N 3.13Å; N395-N423 PolarHBondContact O-ND2 2.93Å
396	S	95	Very high	97.2	Very high	81 Å²	81	52.9 Å²	52.9	57%	0.566	26%	0.263	S	S	*	.			trans	-108.6	10.3	-179.4	62.2	0	0	0	0	113.8	N423	S396-N423 WeakPolarHBondContact CA-OD1 3.48Å
397	T	96.2	Very high	97.2	Very high	13 Å²	13	53.6 Å²	53.6	8%	0.08	27%	0.268	C	S	.	.	S	Bend	trans	-113.7	-35	-167.5	63.3	0	0	0	0	112.7	E368 L370 K371 N395 T399	E368-T397 HydrophobicContact CB-CG2 4.2Å; E368-T397 VanDerWaalsContact O-CG2 3.32Å; E368-T397 WeakPolarHBondContact O-CG2 3.42Å; L370-T397 CarbonylContact O-C 3.12Å; L370-T397 PolarHBondContact O-OG1 3.11Å; K371-T397 WeakPolarHBondContact CD-O 3.49Å; K371-T397 PolarHBondContact NZ-O 3.43Å; N395-T397 PolarHBondContact ND2-OG1 3.35Å; N395-T397 PolarHBondContact OD1-N 3.01Å; N395-T397 PolarHBondContact OD1-OG1 2.88Å; T397-T399 PolarHBondContact O-N 3.09Å
398	L	97.4	Very high	97.1	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.268	C	S	.	.			trans	-68.4	122	175.1	-77.7	174.8	0	0	0	110.6	L364 L370 K371 L373 M392 N395 I420 N423	L364-L398 HydrophobicContact CD1-CD1 3.96Å; L364-L398 HydrophobicContact CD2-CD1 3.63Å; L364-L398 HydrophobicContact CG-CD1 4.4Å; L370-L398 HydrophobicContact CB-CD2 4.12Å; L370-L398 HydrophobicContact CD2-CD2 3.97Å; L370-L398 HydrophobicContact CG-CD2 3.81Å; K371-L398 WeakPolarHBondContact O-CA 3.37Å; K371-L398 WeakPolarHBondContact O-CD2 3.4Å; L373-L398 HydrophobicContact CB-CD2 3.95Å; L373-L398 HydrophobicContact CD2-CD1 4.33Å; M392-L398 HydrophobicContact CE-CD1 3.74Å; M392-L398 HydrophobicContact SD-CD1 3.69Å; N395-L398 WeakPolarHBondContact OD1-CB 3.34Å; N395-L398 PolarHBondContact OD1-N 3.13Å; L398-I420 HydrophobicContact CB-CD1 3.84Å; L398-I420 WeakPolarHBondContact O-CD1 3.4Å; L398-N423 WeakPolarHBondContact O-CB 3.35Å; L398-N423 PolarHBondContact O-ND2 3.36Å
399	T	97.4	Very high	97.1	Very high	23 Å²	23	56 Å²	56	14%	0.141	28%	0.279	C	S	.	.			trans	-112.3	-10.5	178.5	52.7	0	0	0	0	112	K371 T397 I420 Q424	K371-T399 PolarHBondContact O-N 3.16Å; K371-T399 PolarHBondContact O-OG1 2.95Å; T397-T399 PolarHBondContact O-N 3.09Å; T399-I420 WeakPolarHBondContact O-CG2 3.41Å; T399-Q424 VanDerWaalsContact O-CG 3.32Å; T399-Q424 WeakPolarHBondContact O-CG 3.19Å; T399-Q424 PolarHBondContact O-NE2 3.06Å
400	E	98.3	Very high	97	Very high	100 Å²	100	64 Å²	64	47%	0.467	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	127.5	176.6	-64.9	176.8	-177	0	0	109.8	K371 T372 L373	K371-E400 PolarHBondContact O-N 3.01Å; T372-E400 WeakPolarHBondContact CA-O 3.17Å; T372-E400 HydrophobicContact CG2-CB 3.8Å; T372-E400 VanDerWaalsContact CG2-OE2 3.24Å; T372-E400 WeakPolarHBondContact CG2-OE2 2.82Å; T372-E400 PolarHBondContact OG1-OE2 3.46Å; L373-E400 PolarHBondContact N-O 3.32Å
401	C	98.3	Very high	97	Very high	19 Å²	19	64 Å²	64	13%	0.128	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	123.3	173.7	-168.9	0	0	0	0	110	L373 M392 I416 I420	L373-C401 CarbonylContact O-C 3.36Å; L373-C401 VanDerWaalsContact O-CA 3.23Å; L373-C401 WeakPolarHBondContact O-CA 3.27Å; M392-C401 HydrophobicContact CE-CB 3.8Å; M392-C401 VanDerWaalsContact CE-SG 3.53Å; C401-I416 HydrophobicContact CB-CG2 4.42Å; C401-I420 HydrophobicContact CB-CD1 3.75Å; C401-I420 HydrophobicContact CB-CG1 3.83Å
402	D	98.4	Very high	97	Very high	27 Å²	27	65.4 Å²	65.4	14%	0.144	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	115.3	173.6	-170.5	-5.6	0	0	0	110.2	L373 N374 L375 S376 R404	L373-D402 PolarHBondContact O-N 3.28Å; N374-D402 HydrophobicContact CB-CB 4.32Å; N374-D402 WeakPolarHBondContact ND2-CB 3.38Å; N374-D402 PolarHBondContact ND2-OD2 2.88Å; L375-D402 PolarHBondContact N-O 3.46Å; S376-D402 PolarHBondContact N-O 2.78Å; D402-R404 WeakPolarHBondContact OD1-CB 3.11Å; D402-R404 WeakPolarHBondContact OD1-CG 3.19Å; D402-R404 IonicContact OD1-CZ 3.89Å; D402-R404 PolarHBondContact OD1-N 3.19Å; D402-R404 IonicContact OD1-NE 2.99Å; D402-R404 PolarHBondContact OD1-NE 3.31Å; D402-R404 IonicContact OD1-NH2 3.9Å; D402-R404 IonicContact OD2-CZ 3.43Å; D402-R404 IonicContact OD2-NE 3.3Å; D402-R404 PolarHBondContact OD2-NE 2.99Å; D402-R404 IonicContact OD2-NH2 2.72Å; D402-R404 PolarHBondContact OD2-NH2 2.98Å
403	I	98	Very high	97.1	Very high	16 Å²	16	66.1 Å²	66.1	8%	0.082	34%	0.337	C	S	.	.			trans	-121.3	19.5	-179.8	58.1	169.7	0	0	0	111.7	T406 I408 A413 I416	I403-T406 HydrophobicContact CB-CG2 4.27Å; I403-T406 WeakPolarHBondContact O-CB 3.33Å; I403-T406 WeakPolarHBondContact O-CG2 3.22Å; I403-T406 PolarHBondContact O-OG1 2.9Å; I403-I408 HydrophobicContact CB-CD1 4.25Å; I403-I408 HydrophobicContact CD1-CD1 4.3Å; I403-I408 HydrophobicContact CG2-CD1 4.37Å; I403-A413 HydrophobicContact CD1-CB 3.81Å; I403-I416 HydrophobicContact CD1-CB 4.25Å; I403-I416 HydrophobicContact CD1-CD1 3.84Å; I403-I416 HydrophobicContact CD1-CG2 4.2Å
404	R	97.8	Very high	97.2	Very high	174 Å²	174	64.2 Å²	64.2	66%	0.657	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	143.1	178.4	-68.6	175.7	-64.1	167.7	1.5	110.6	S376 C377 D402	S376-R404 CarbonylContact C-O 3.46Å; S376-R404 WeakPolarHBondContact CA-O 3.46Å; S376-R404 VanDerWaalsContact CB-O 3.27Å; S376-R404 WeakPolarHBondContact CB-O 3.17Å; C377-R404 PolarHBondContact N-O 3.28Å; D402-R404 WeakPolarHBondContact OD1-CB 3.11Å; D402-R404 WeakPolarHBondContact OD1-CG 3.19Å; D402-R404 IonicContact OD1-CZ 3.89Å; D402-R404 PolarHBondContact OD1-N 3.19Å; D402-R404 IonicContact OD1-NE 2.99Å; D402-R404 PolarHBondContact OD1-NE 3.31Å; D402-R404 IonicContact OD1-NH2 3.9Å; D402-R404 IonicContact OD2-CZ 3.43Å; D402-R404 IonicContact OD2-NE 3.3Å; D402-R404 PolarHBondContact OD2-NE 2.99Å; D402-R404 IonicContact OD2-NH2 2.72Å; D402-R404 PolarHBondContact OD2-NH2 2.98Å
405	Q	97.4	Very high	97.4	Very high	152 Å²	152	59.8 Å²	59.8	71%	0.71	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	50.2	-178.8	-54.4	177.7	0.2	0	0	111.6	C377 N378	C377-Q405 CarbonylContact C-O 3.58Å; C377-Q405 WeakPolarHBondContact CA-O 3.41Å; C377-Q405 PolarHBondContact N-O 3.44Å; C377-Q405 VanDerWaalsContact N-O 3.14Å; C377-Q405 PolarHBondContact SG-OE1 3.08Å; N378-Q405 PolarHBondContact N-O 3.21Å; N378-Q405 VanDerWaalsContact N-O 3.11Å
406	T	97.9	Very high	97.5	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.018	31%	0.313	C	S	.	.	S	Bend	trans	-117.3	2.3	178	58.3	0	0	0	0	114.8	L375 N378 L380 G381 I403 I408	L375-T406 VanDerWaalsContact O-CG2 3.24Å; L375-T406 WeakPolarHBondContact O-CG2 3.26Å; N378-T406 WeakPolarHBondContact O-CA 3.36Å; L380-T406 HydrophobicContact CD1-CG2 3.85Å; L380-T406 HydrophobicContact CG-CG2 4.07Å; L380-T406 PolarHBondContact N-O 3.14Å; G381-T406 PolarHBondContact N-O 2.91Å; I403-T406 HydrophobicContact CB-CG2 4.27Å; I403-T406 WeakPolarHBondContact O-CB 3.33Å; I403-T406 WeakPolarHBondContact O-CG2 3.22Å; I403-T406 PolarHBondContact O-OG1 2.9Å; T406-I408 PolarHBondContact O-N 3.36Å; T406-I408 WeakPolarHBondContact OG1-CD1 3.42Å; T406-I408 WeakPolarHBondContact OG1-CG1 3.37Å
407	E	97.7	Very high	97.6	Very high	131 Å²	131	59.6 Å²	59.6	61%	0.612	31%	0.308	S	S	*	.			trans	59.6	19.3	-173.1	-56.3	166.4	-148.7	0	0	113.9	S379 G381	S379-E407 WeakPolarHBondContact CB-OE1 3.34Å; S379-E407 PolarHBondContact OG-OE1 3.29Å; G381-E407 CarbonylContact C-O 3.35Å; G381-E407 WeakPolarHBondContact CA-O 3.48Å
408	I	97.6	Very high	97.6	Very high	24 Å²	24	65.6 Å²	65.6	12%	0.123	33%	0.334	C	S	.	.			trans	-77.5	134.3	169.8	-63.9	175.2	0	0	0	108.9	L380 L388 I403 T406 N412 A413	L380-I408 HydrophobicContact CB-CD1 4.34Å; L380-I408 HydrophobicContact CB-CG1 4.29Å; L380-I408 HydrophobicContact CD1-CD1 4.05Å; L388-I408 HydrophobicContact CD1-CD1 4.41Å; I403-I408 HydrophobicContact CB-CD1 4.25Å; I403-I408 HydrophobicContact CD1-CD1 4.3Å; I403-I408 HydrophobicContact CG2-CD1 4.37Å; T406-I408 PolarHBondContact O-N 3.36Å; T406-I408 WeakPolarHBondContact OG1-CD1 3.42Å; T406-I408 WeakPolarHBondContact OG1-CG1 3.37Å; I408-N412 HydrophobicContact CG2-CB 3.8Å; I408-A413 HydrophobicContact CG2-CB 4.18Å
409	D	96.6	Very high	97.7	Very high	42 Å²	42	66.1 Å²	66.1	23%	0.225	34%	0.338	C	S	.	.			trans	-66.5	157.2	176.5	67.1	93	0	0	0	112.5	E382 T411 N412 A413	E382-D409 HydrophobicContact CG-CB 4.48Å; D409-T411 PolarHBondContact O-N 3.31Å; D409-T411 WeakPolarHBondContact OD1-CA 3.18Å; D409-T411 VanDerWaalsContact OD1-CB 3.24Å; D409-T411 WeakPolarHBondContact OD1-CB 3.44Å; D409-T411 PolarHBondContact OD1-N 3.03Å; D409-N412 PolarHBondContact O-N 3.19Å; D409-N412 PolarHBondContact OD1-N 2.72Å; D409-N412 PolarHBondContact OD2-ND2 3.3Å; D409-A413 WeakPolarHBondContact O-CB 3.36Å; D409-A413 PolarHBondContact O-N 2.6Å
410	E	96.8	Very high	97.7	Very high	173 Å²	173	65.6 Å²	65.6	81%	0.808	33%	0.334	S	S	*	.	H	α-helix	trans	-60.2	-31.5	-175.6	-170.4	175.6	-173.2	0	0	113	A414	E410-A414 WeakPolarHBondContact O-CB 3.17Å; E410-A414 PolarHBondContact O-N 3.42Å
411	T	97.4	Very high	97.6	Very high	111 Å²	111	68.4 Å²	68.4	68%	0.681	34%	0.34	S	S	*	.	H	α-helix	trans	-69.2	-50.3	-178.5	-54	0	0	0	0	110.6	D409 A414 S415	D409-T411 PolarHBondContact O-N 3.31Å; D409-T411 WeakPolarHBondContact OD1-CA 3.18Å; D409-T411 VanDerWaalsContact OD1-CB 3.24Å; D409-T411 WeakPolarHBondContact OD1-CB 3.44Å; D409-T411 PolarHBondContact OD1-N 3.03Å; T411-A414 PolarHBondContact O-N 2.99Å; T411-S415 PolarHBondContact O-N 2.95Å
412	N	97.8	Very high	97.6	Very high	34 Å²	34	71.5 Å²	71.5	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-67.1	-38.6	177.4	-75.2	-43.8	0	0	0	111.8	A389 I408 D409 A414 S415 I416	A389-N412 HydrophobicContact CB-CB 4.29Å; I408-N412 HydrophobicContact CG2-CB 3.8Å; D409-N412 PolarHBondContact O-N 3.19Å; D409-N412 PolarHBondContact OD1-N 2.72Å; D409-N412 PolarHBondContact OD2-ND2 3.3Å; N412-A414 PolarHBondContact O-N 3.43Å; N412-S415 WeakPolarHBondContact O-CB 3.47Å; N412-S415 PolarHBondContact O-N 3.38Å; N412-I416 WeakPolarHBondContact O-CG1 3.34Å; N412-I416 PolarHBondContact O-N 3.34Å
413	A	97.6	Very high	97.5	Very high	19 Å²	19	71.1 Å²	71.1	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-61.6	-42.8	174.7	0	0	0	0	0	112.2	I403 I408 D409 S415 I416 N417	I403-A413 HydrophobicContact CD1-CB 3.81Å; I408-A413 HydrophobicContact CG2-CB 4.18Å; D409-A413 WeakPolarHBondContact O-CB 3.36Å; D409-A413 PolarHBondContact O-N 2.6Å; A413-S415 VanDerWaalsContact C-N 3.34Å; A413-S415 PolarHBondContact O-N 3.18Å; A413-I416 PolarHBondContact O-N 3.22Å; A413-N417 WeakPolarHBondContact O-CB 3.38Å; A413-N417 VanDerWaalsContact O-CG 3.3Å; A413-N417 PolarHBondContact O-N 2.9Å; A413-N417 PolarHBondContact O-ND2 3.46Å
414	A	97.6	Very high	97.4	Very high	56 Å²	56	73.8 Å²	73.8	46%	0.463	37%	0.366	S	S	.	.	H	α-helix	trans	-63.2	-39.9	175.3	0	0	0	0	0	112	E410 T411 N412 N417 K418	E410-A414 WeakPolarHBondContact O-CB 3.17Å; E410-A414 PolarHBondContact O-N 3.42Å; T411-A414 PolarHBondContact O-N 2.99Å; N412-A414 PolarHBondContact O-N 3.43Å; A414-N417 PolarHBondContact O-N 3.14Å; A414-K418 WeakPolarHBondContact O-CB 3.32Å; A414-K418 PolarHBondContact O-N 3.25Å
415	S	97.8	Very high	97.3	Very high	48 Å²	48	67.9 Å²	67.9	34%	0.336	35%	0.351	S	S	.	.	H	α-helix	trans	-62.3	-44.6	175.3	-169.6	0	0	0	0	112	T411 N412 A413 K418 A419	T411-S415 PolarHBondContact O-N 2.95Å; N412-S415 WeakPolarHBondContact O-CB 3.47Å; N412-S415 PolarHBondContact O-N 3.38Å; A413-S415 VanDerWaalsContact C-N 3.34Å; A413-S415 PolarHBondContact O-N 3.18Å; S415-K418 PolarHBondContact O-N 3.38Å; S415-A419 PolarHBondContact O-N 2.76Å
416	I	97.9	Very high	97	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.1	-49.8	175.9	-69.1	165.8	0	0	0	110.4	L388 A389 M392 C401 I403 N412 A413 K418 A419 I420	L388-I416 HydrophobicContact CB-CD1 3.96Å; A389-I416 HydrophobicContact CB-CD1 4.42Å; A389-I416 HydrophobicContact CB-CG1 3.98Å; M392-I416 HydrophobicContact CE-CG2 3.95Å; M392-I416 HydrophobicContact CG-CG1 4.32Å; M392-I416 HydrophobicContact CG-CG2 4.34Å; C401-I416 HydrophobicContact CB-CG2 4.42Å; I403-I416 HydrophobicContact CD1-CB 4.25Å; I403-I416 HydrophobicContact CD1-CD1 3.84Å; I403-I416 HydrophobicContact CD1-CG2 4.2Å; N412-I416 WeakPolarHBondContact O-CG1 3.34Å; N412-I416 PolarHBondContact O-N 3.34Å; A413-I416 PolarHBondContact O-N 3.22Å; I416-K418 VanDerWaalsContact C-N 3.27Å; I416-K418 PolarHBondContact O-N 3.39Å; I416-A419 PolarHBondContact O-N 2.9Å; I416-I420 WeakPolarHBondContact O-CG1 3.29Å; I416-I420 PolarHBondContact O-N 3.32Å
417	N	97.3	Very high	96.7	Very high	86 Å²	86	65.4 Å²	65.4	46%	0.46	35%	0.347	S	S	.	.	H	α-helix	trans	-61.5	-36.2	180	-73	-30	0	0	0	112.5	A413 A414 I420 W421	A413-N417 WeakPolarHBondContact O-CB 3.38Å; A413-N417 VanDerWaalsContact O-CG 3.3Å; A413-N417 PolarHBondContact O-N 2.9Å; A413-N417 PolarHBondContact O-ND2 3.46Å; A414-N417 PolarHBondContact O-N 3.14Å; N417-I420 PolarHBondContact O-N 3.28Å; N417-W421 WeakPolarHBondContact O-CB 3.44Å; N417-W421 PolarHBondContact O-N 3.02Å
418	K	97.4	Very high	96.3	Very high	140 Å²	140	63.4 Å²	63.4	61%	0.609	35%	0.347	S	S	*	.	H	α-helix	trans	-63.8	-47.2	174.4	-176.5	179.3	177.1	-176.6	0	111.7	A414 S415 I416 I420 W421 D422	A414-K418 WeakPolarHBondContact O-CB 3.32Å; A414-K418 PolarHBondContact O-N 3.25Å; S415-K418 PolarHBondContact O-N 3.38Å; I416-K418 VanDerWaalsContact C-N 3.27Å; I416-K418 PolarHBondContact O-N 3.39Å; K418-I420 VanDerWaalsContact C-N 3.29Å; K418-I420 PolarHBondContact O-N 3.27Å; K418-W421 WeakPolarHBondContact O-CB 3.48Å; K418-W421 PolarHBondContact O-N 3.06Å; K418-D422 PolarHBondContact O-N 2.94Å
419	A	97.6	Very high	95.9	Very high	11 Å²	11	67.3 Å²	67.3	9%	0.091	37%	0.365	C	S	.	.	H	α-helix	trans	-59.6	-41.1	177	0	0	0	0	0	111.9	M392 S415 I416 D422 N423	M392-A419 HydrophobicContact CB-CB 3.86Å; S415-A419 PolarHBondContact O-N 2.76Å; I416-A419 PolarHBondContact O-N 2.9Å; A419-D422 PolarHBondContact O-N 3.29Å; A419-N423 PolarHBondContact O-N 3.47Å
420	I	97.9	Very high	95.5	Very high	11 Å²	11	70.6 Å²	70.6	6%	0.056	38%	0.377	C	S	.	.	H	α-helix	trans	-62.1	-45.4	174.6	-66.4	-60.3	0	0	0	111.6	M392 L398 T399 C401 I416 N417 K418 D422 N423 Q424	M392-I420 HydrophobicContact CE-CD1 4.11Å; M392-I420 HydrophobicContact SD-CD1 4.33Å; L398-I420 HydrophobicContact CB-CD1 3.84Å; L398-I420 WeakPolarHBondContact O-CD1 3.4Å; T399-I420 WeakPolarHBondContact O-CG2 3.41Å; C401-I420 HydrophobicContact CB-CD1 3.75Å; C401-I420 HydrophobicContact CB-CG1 3.83Å; I416-I420 WeakPolarHBondContact O-CG1 3.29Å; I416-I420 PolarHBondContact O-N 3.32Å; N417-I420 PolarHBondContact O-N 3.28Å; K418-I420 VanDerWaalsContact C-N 3.29Å; K418-I420 PolarHBondContact O-N 3.27Å; I420-D422 PolarHBondContact O-N 2.96Å; I420-N423 PolarHBondContact O-N 3.4Å; I420-Q424 HydrophobicContact CG2-CG 4.47Å; I420-Q424 WeakPolarHBondContact O-CG 2.98Å; I420-Q424 PolarHBondContact O-N 3.48Å
421	W	97.2	Very high	95	Very high	160 Å²	160	66.5 Å²	66.5	61%	0.606	36%	0.358	S	S	*	.	H	α-helix	trans	-60	-43.8	176.8	177.8	-89.2	0	0	0	112.4	N417 K418 N423 Q424 C425	N417-W421 WeakPolarHBondContact O-CB 3.44Å; N417-W421 PolarHBondContact O-N 3.02Å; K418-W421 WeakPolarHBondContact O-CB 3.48Å; K418-W421 PolarHBondContact O-N 3.06Å; W421-N423 VanDerWaalsContact C-N 3.31Å; W421-N423 PolarHBondContact O-N 3.29Å; W421-Q424 PolarHBondContact O-N 3.39Å; W421-C425 PolarHBondContact NE1-SG 3.43Å; W421-C425 WeakPolarHBondContact O-CB 3.39Å; W421-C425 PolarHBondContact O-N 3.33Å; W421-C425 PolarHBondContact O-SG 2.98Å
422	D	96.9	Very high	94.5	Very high	83 Å²	83	63.1 Å²	63.1	44%	0.444	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-41.2	178	-69	-20	0	0	0	110.8	K418 A419 I420 C425 A426	K418-D422 PolarHBondContact O-N 2.94Å; A419-D422 PolarHBondContact O-N 3.29Å; I420-D422 PolarHBondContact O-N 2.96Å; D422-C425 PolarHBondContact O-N 2.99Å; D422-A426 WeakPolarHBondContact O-CB 3.41Å; D422-A426 PolarHBondContact O-N 3.29Å
423	N	96.4	Very high	94	Very high	20 Å²	20	68.5 Å²	68.5	11%	0.107	36%	0.359	C	S	.	.	H	α-helix	trans	-65.6	-42.9	175.5	-72.4	-14.6	0	0	0	112.8	N395 S396 L398 A419 I420 W421 A426 D427	N395-N423 PolarHBondContact O-ND2 2.93Å; S396-N423 WeakPolarHBondContact CA-OD1 3.48Å; L398-N423 WeakPolarHBondContact O-CB 3.35Å; L398-N423 PolarHBondContact O-ND2 3.36Å; A419-N423 PolarHBondContact O-N 3.47Å; I420-N423 PolarHBondContact O-N 3.4Å; W421-N423 VanDerWaalsContact C-N 3.31Å; W421-N423 PolarHBondContact O-N 3.29Å; N423-A426 PolarHBondContact O-N 3.11Å; N423-D427 PolarHBondContact O-N 2.88Å
424	Q	96.3	Very high	93.4	Very high	71 Å²	71	75 Å²	75	33%	0.332	38%	0.383	S	S	.	.	H	α-helix	trans	-60.3	-44.8	175	-72.2	173	-11.7	0	0	111.6	T399 I420 W421 D427 C428	T399-Q424 VanDerWaalsContact O-CG 3.32Å; T399-Q424 WeakPolarHBondContact O-CG 3.19Å; T399-Q424 PolarHBondContact O-NE2 3.06Å; I420-Q424 HydrophobicContact CG2-CG 4.47Å; I420-Q424 WeakPolarHBondContact O-CG 2.98Å; I420-Q424 PolarHBondContact O-N 3.48Å; W421-Q424 PolarHBondContact O-N 3.39Å; Q424-D427 PolarHBondContact O-N 2.95Å; Q424-C428 WeakPolarHBondContact O-CB 3.35Å; Q424-C428 PolarHBondContact O-N 2.99Å; Q424-C428 PolarHBondContact O-SG 3.49Å
425	C	95	Very high	92.7	Very high	51 Å²	51	80 Å²	80	35%	0.345	39%	0.391	S	S	.	.	H	α-helix	trans	-60	-47.1	176.5	-71.6	0	0	0	0	111.1	W421 D422 D427 C428 E429	W421-C425 PolarHBondContact NE1-SG 3.43Å; W421-C425 WeakPolarHBondContact O-CB 3.39Å; W421-C425 PolarHBondContact O-N 3.33Å; W421-C425 PolarHBondContact O-SG 2.98Å; D422-C425 PolarHBondContact O-N 2.99Å; C425-D427 VanDerWaalsContact C-N 3.31Å; C425-D427 PolarHBondContact O-N 3.34Å; C425-C428 PolarHBondContact O-N 3.26Å; C425-E429 PolarHBondContact O-N 3.05Å
426	A	93	Very high	92.1	Very high	39 Å²	39	86.4 Å²	86.4	32%	0.322	41%	0.407	S	S	.	.	H	α-helix	trans	-62.1	-37	177.8	0	0	0	0	0	112.8	D422 N423 K430	D422-A426 WeakPolarHBondContact O-CB 3.41Å; D422-A426 PolarHBondContact O-N 3.29Å; N423-A426 PolarHBondContact O-N 3.11Å; A426-K430 WeakPolarHBondContact O-CG 3.45Å; A426-K430 PolarHBondContact O-N 2.87Å; A426-K430 VanDerWaalsContact O-N 3.11Å
427	D	90.9	Very high	91.1	Very high	63 Å²	63	95.8 Å²	95.8	34%	0.337	44%	0.442	S	S	.	.	H	α-helix	trans	-71.2	-42.6	178.9	-153.7	40.7	0	0	0	111.9	N423 Q424 C425 E429 K430 E431	N423-D427 PolarHBondContact O-N 2.88Å; Q424-D427 PolarHBondContact O-N 2.95Å; C425-D427 VanDerWaalsContact C-N 3.31Å; C425-D427 PolarHBondContact O-N 3.34Å; D427-E429 VanDerWaalsContact C-N 3.3Å; D427-E429 PolarHBondContact O-N 2.87Å; D427-K430 WeakPolarHBondContact O-CB 3.47Å; D427-K430 PolarHBondContact O-N 3.5Å; D427-K430 VanDerWaalsContact O-N 3.09Å; D427-E431 PolarHBondContact O-N 3.22Å
428	C	89.5	Confident	89.9	Confident	89 Å²	89	95 Å²	95	60%	0.601	44%	0.444	S	S	*	.	H	α-helix	trans	-56.9	-41.9	172.3	-79.6	0	0	0	0	112.2	Q424 C425 E431 A432	Q424-C428 WeakPolarHBondContact O-CB 3.35Å; Q424-C428 PolarHBondContact O-N 2.99Å; Q424-C428 PolarHBondContact O-SG 3.49Å; C425-C428 PolarHBondContact O-N 3.26Å; C428-E431 PolarHBondContact O-N 3.32Å; C428-A432 WeakPolarHBondContact O-CB 3.5Å; C428-A432 PolarHBondContact O-N 3.02Å
429	E	89.6	Confident	88.3	Confident	107 Å²	107	93 Å²	93	50%	0.5	44%	0.443	S	S	.	.	H	α-helix	trans	-63.6	-42.3	174.1	-76.9	-167.3	-164.5	0	0	112.9	C425 D427 E431 A432 R433	C425-E429 PolarHBondContact O-N 3.05Å; D427-E429 VanDerWaalsContact C-N 3.3Å; D427-E429 PolarHBondContact O-N 2.87Å; E429-E431 VanDerWaalsContact C-N 3.34Å; E429-A432 PolarHBondContact O-N 3.07Å; E429-R433 VanDerWaalsContact O-CG 3.29Å; E429-R433 WeakPolarHBondContact O-CG 3.35Å; E429-R433 PolarHBondContact O-N 3.26Å; E429-R433 IonicContact OE2-CZ 3.84Å; E429-R433 IonicContact OE2-NH2 2.88Å; E429-R433 PolarHBondContact OE2-NH2 2.97Å
430	K	88.1	Confident	86.4	Confident	110 Å²	110	101.4 Å²	101.4	48%	0.478	48%	0.478	S	S	.	.	H	α-helix	trans	-61.4	-43.9	177.3	-73.8	169.5	-173.3	170.8	0	110.8	A426 D427 R433 K434	A426-K430 WeakPolarHBondContact O-CG 3.45Å; A426-K430 PolarHBondContact O-N 2.87Å; A426-K430 VanDerWaalsContact O-N 3.11Å; D427-K430 WeakPolarHBondContact O-CB 3.47Å; D427-K430 PolarHBondContact O-N 3.5Å; D427-K430 VanDerWaalsContact O-N 3.09Å; K430-R433 PolarHBondContact O-N 2.94Å; K430-K434 WeakPolarHBondContact O-CG 3.45Å; K430-K434 PolarHBondContact O-N 3.35Å
431	E	86.6	Confident	84.2	Confident	88 Å²	88	106.4 Å²	106.4	41%	0.411	51%	0.513	S	S	.	.	H	α-helix	trans	-62.7	-46.3	175.1	-71.8	-157.4	171	0	0	112.4	D427 C428 E429 R433 K434 R435	D427-E431 PolarHBondContact O-N 3.22Å; C428-E431 PolarHBondContact O-N 3.32Å; E429-E431 VanDerWaalsContact C-N 3.34Å; E431-R433 VanDerWaalsContact C-N 3.29Å; E431-R433 PolarHBondContact O-N 3.38Å; E431-K434 WeakPolarHBondContact O-CB 3.48Å; E431-K434 PolarHBondContact O-N 2.91Å; E431-K434 VanDerWaalsContact O-N 3.13Å; E431-R435 WeakPolarHBondContact O-CG 3.45Å; E431-R435 PolarHBondContact O-N 3.42Å; E431-R435 IonicContact OE2-CZ 3.88Å; E431-R435 IonicContact OE2-NH2 2.94Å; E431-R435 PolarHBondContact OE2-NH2 3.18Å
432	A	85.9	Confident	81.7	Confident	39 Å²	39	109 Å²	109	32%	0.322	54%	0.537	S	S	.	.	H	α-helix	trans	-59.7	-40.7	178.5	0	0	0	0	0	111.7	C428 E429 R435 R436	C428-A432 WeakPolarHBondContact O-CB 3.5Å; C428-A432 PolarHBondContact O-N 3.02Å; E429-A432 PolarHBondContact O-N 3.07Å; A432-R435 PolarHBondContact O-N 3.34Å; A432-R436 WeakPolarHBondContact O-CG 3.22Å; A432-R436 PolarHBondContact O-N 2.95Å
433	R	86.8	Confident	80.9	Confident	148 Å²	148	110.3 Å²	110.3	56%	0.558	54%	0.542	S	S	*	.	H	α-helix	trans	-64.8	-41.7	174.6	-70.3	174.8	-162.9	-174.8	9	112	E429 K430 E431 R437	E429-R433 VanDerWaalsContact O-CG 3.29Å; E429-R433 WeakPolarHBondContact O-CG 3.35Å; E429-R433 PolarHBondContact O-N 3.26Å; E429-R433 IonicContact OE2-CZ 3.84Å; E429-R433 IonicContact OE2-NH2 2.88Å; E429-R433 PolarHBondContact OE2-NH2 2.97Å; K430-R433 PolarHBondContact O-N 2.94Å; E431-R433 VanDerWaalsContact C-N 3.29Å; E431-R433 PolarHBondContact O-N 3.38Å; R433-R437 WeakPolarHBondContact O-CG 3.24Å; R433-R437 PolarHBondContact O-N 2.94Å
434	K	85.1	Confident	80.1	Confident	155 Å²	155	115.1 Å²	115.1	67%	0.674	57%	0.565	S	S	*	*	H	α-helix	trans	-61.1	-47.7	175	-77	178	-179.5	176	0	111.3	K430 E431 R436 R437 S438	K430-K434 WeakPolarHBondContact O-CG 3.45Å; K430-K434 PolarHBondContact O-N 3.35Å; E431-K434 WeakPolarHBondContact O-CB 3.48Å; E431-K434 PolarHBondContact O-N 2.91Å; E431-K434 VanDerWaalsContact O-N 3.13Å; K434-R436 PolarHBondContact O-N 3.44Å; K434-R437 PolarHBondContact O-N 2.93Å; K434-S438 PolarHBondContact O-N 3.17Å; K434-S438 PolarHBondContact O-OG 3.19Å
435	R	84.3	Confident	79.2	Confident	162 Å²	162	117.5 Å²	117.5	61%	0.611	58%	0.578	S	S	*	*	H	α-helix	trans	-58.9	-48.7	178.3	-69.3	179.9	-163.5	-175.8	9.1	111.4	E431 A432 R437 S438 T439	E431-R435 WeakPolarHBondContact O-CG 3.45Å; E431-R435 PolarHBondContact O-N 3.42Å; E431-R435 IonicContact OE2-CZ 3.88Å; E431-R435 IonicContact OE2-NH2 2.94Å; E431-R435 PolarHBondContact OE2-NH2 3.18Å; A432-R435 PolarHBondContact O-N 3.34Å; R435-R437 VanDerWaalsContact C-N 3.32Å; R435-R437 PolarHBondContact O-N 2.94Å; R435-S438 WeakPolarHBondContact CA-OG 3.37Å; R435-S438 PolarHBondContact O-N 3.43Å; R435-S438 PolarHBondContact O-OG 2.96Å; R435-T439 PolarHBondContact O-N 3.24Å; R435-T439 PolarHBondContact O-OG1 2.69Å
436	R	84.4	Confident	78.3	Confident	182 Å²	182	121.4 Å²	121.4	69%	0.687	59%	0.592	S	S	*	*	H	α-helix	trans	-56.7	-44.1	176	-72.5	176	-174.9	179.4	3.1	112	A432 K434 T439 F440	A432-R436 WeakPolarHBondContact O-CG 3.22Å; A432-R436 PolarHBondContact O-N 2.95Å; K434-R436 PolarHBondContact O-N 3.44Å; R436-T439 PolarHBondContact O-N 3.04Å; R436-F440 WeakPolarHBondContact O-CD2 3.37Å; R436-F440 PolarHBondContact O-N 3.38Å
437	R	77.1	Confident	77.3	Confident	196 Å²	196	126.6 Å²	126.6	74%	0.74	61%	0.609	S	S	*	*	H	α-helix	trans	-65.1	-39.6	177.6	-73.9	178.9	178.2	-177.3	-0.9	113	R433 K434 R435 T439 F440	R433-R437 WeakPolarHBondContact O-CG 3.24Å; R433-R437 PolarHBondContact O-N 2.94Å; K434-R437 PolarHBondContact O-N 2.93Å; R435-R437 VanDerWaalsContact C-N 3.32Å; R435-R437 PolarHBondContact O-N 2.94Å; R437-T439 VanDerWaalsContact C-N 3.32Å; R437-T439 PolarHBondContact O-N 3.05Å; R437-F440 PolarHBondContact O-N 2.89Å
438	S	72.4	Confident	76.4	Confident	69 Å²	69	130.8 Å²	130.8	48%	0.483	63%	0.627	S	S	.	*	H	α-helix	trans	-67.1	-30.9	176.1	47.5	0	0	0	0	113.3	K434 R435 F440 C441	K434-S438 PolarHBondContact O-N 3.17Å; K434-S438 PolarHBondContact O-OG 3.19Å; R435-S438 WeakPolarHBondContact CA-OG 3.37Å; R435-S438 PolarHBondContact O-N 3.43Å; R435-S438 PolarHBondContact O-OG 2.96Å; S438-F440 VanDerWaalsContact C-N 3.33Å; S438-C441 PolarHBondContact O-N 3.35Å
439	T	63.5	Low	75.5	Confident	98 Å²	98	133.8 Å²	133.8	60%	0.601	63%	0.629	S	S	*	*	H	α-helix	trans	-74.9	-20.2	177.8	-40.4	0	0	0	0	113.2	R435 R436 R437	R435-T439 PolarHBondContact O-N 3.24Å; R435-T439 PolarHBondContact O-OG1 2.69Å; R436-T439 PolarHBondContact O-N 3.04Å; R437-T439 VanDerWaalsContact C-N 3.32Å; R437-T439 PolarHBondContact O-N 3.05Å
440	F	57.8	Low	74.4	Confident	188 Å²	188	135.8 Å²	135.8	83%	0.825	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-4.9	173.9	-88.4	-81.9	0	0	0	113.6	R436 R437 S438	R436-F440 WeakPolarHBondContact O-CD2 3.37Å; R436-F440 PolarHBondContact O-N 3.38Å; R437-F440 PolarHBondContact O-N 2.89Å; S438-F440 VanDerWaalsContact C-N 3.33Å
441	C	51.9	Low	73.3	Confident	116 Å²	116	138 Å²	138	78%	0.784	65%	0.652	S	S	*	*			trans	-108	7.5	179	-72.6	0	0	0	0	113.9	S438	S438-C441 PolarHBondContact O-N 3.35Å
442	L	43.7	Very low	72.1	Confident	215 Å²	215	142.5 Å²	142.5	100%	1.126	67%	0.674	S	S	*	*			trans	-114.2	0	165.8	-76.9	164.4	0	0	0	107.8

Retrieved 442 of 442 residues in 414.5 ms (Link to these results)

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