A0A096NVU3_PAPAN Loading...

Pleckstrin homology and coiled-coil domain containing D1

AlphaFold DB (A0A2K5U7Z7), UniProt , Accession A0A096NVU3, Species PAPAN (Papio anubis, Olive baboon), Gene PLEKHD1, Length 506 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.5	Very low	32.7	Very low	233 Å²	233	149.5 Å²	149.5	100%	1.148	85%	0.853	S	S	*	*				0	92.2	0	-69.7	-176.6	-177.8	0	0	107.3
2	F	30.4	Very low	32.6	Very low	210 Å²	210	145.8 Å²	145.8	92%	0.921	84%	0.843	S	S	*	*			trans	-105	115	-178.4	-74.5	-78.5	0	0	0	108.6	S4	F2-S4 PolarHBondContact O-N 2.71Å
3	T	30	Very low	32.8	Very low	131 Å²	131	144.5 Å²	144.5	80%	0.804	84%	0.842	S	S	*	*			trans	-81.1	110.7	177.9	51.5	0	0	0	0	109.4	K5	T3-K5 PolarHBondContact O-N 3.19Å
4	S	30.1	Very low	32.6	Very low	123 Å²	123	142.2 Å²	142.2	86%	0.86	84%	0.838	S	S	*	*			trans	-69.6	113.7	171.1	-46.7	0	0	0	0	109.6	F2	F2-S4 PolarHBondContact O-N 2.71Å
5	K	32.3	Very low	33	Very low	198 Å²	198	144.5 Å²	144.5	86%	0.861	84%	0.844	S	S	*	*			trans	-83.8	119.6	167.9	-81.7	179.9	174.8	178	0	108.8	T3	T3-K5 PolarHBondContact O-N 3.19Å
6	S	31.7	Very low	33.3	Very low	115 Å²	115	146.3 Å²	146.3	80%	0.804	84%	0.842	S	S	*	*			trans	-71.1	124.6	170.6	34.9	0	0	0	0	110.4	S8	S6-S8 PolarHBondContact O-N 3.38Å
7	N	30.2	Very low	33.5	Very low	162 Å²	162	149.4 Å²	149.4	87%	0.866	85%	0.847	S	S	*	*			trans	-74.7	113.6	167.1	-93.8	-5.4	0	0	0	109	V9	N7-V9 PolarHBondContact O-N 3.07Å
8	S	32.6	Very low	33.7	Very low	110 Å²	110	146.2 Å²	146.2	77%	0.769	84%	0.842	S	S	*	*			trans	-76.4	108.7	168	54.2	0	0	0	0	109.4	S6 S10	S6-S8 PolarHBondContact O-N 3.38Å; S8-S10 PolarHBondContact O-N 2.89Å
9	V	34.7	Very low	33.8	Very low	138 Å²	138	145.9 Å²	145.9	84%	0.836	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-68.6	123.5	167.5	175	0	0	0	0	108.3	N7	N7-V9 PolarHBondContact O-N 3.07Å
10	S	35.4	Very low	33.9	Very low	99 Å²	99	144.7 Å²	144.7	69%	0.692	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-71.4	144.9	175.2	-47.2	0	0	0	0	110.9	S8	S8-S10 PolarHBondContact O-N 2.89Å
11	P	36.8	Very low	34	Very low	126 Å²	126	145.7 Å²	145.7	82%	0.818	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-76	134.5	177.7	30.5	-30.2	0	0	0	110.4
12	S	31.9	Very low	34.2	Very low	105 Å²	105	138.4 Å²	138.4	73%	0.734	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-57.4	143.7	172.8	-49	0	0	0	0	111.3	S14	S12-S14 PolarHBondContact O-N 2.73Å
13	P	35	Very low	34.5	Very low	129 Å²	129	135.1 Å²	135.1	84%	0.838	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-70.6	124.3	175.7	29.1	-30.4	0	0	0	109.6	L15	P13-L15 PolarHBondContact O-N 3.23Å
14	S	30.4	Very low	34.9	Very low	112 Å²	112	135.1 Å²	135.1	78%	0.783	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-59.2	119.6	179.6	-41.1	0	0	0	0	111.2	S12 E16	S12-S14 PolarHBondContact O-N 2.73Å; S14-E16 VanDerWaalsContact C-N 3.26Å; S14-E16 PolarHBondContact O-N 3.11Å
15	L	37.8	Very low	35.6	Very low	177 Å²	177	135.2 Å²	135.2	93%	0.927	79%	0.793	S	S	*	*			trans	-87.7	63.1	168.7	-169.6	78.8	0	0	0	108.9	P13	P13-L15 PolarHBondContact O-N 3.23Å
16	E	37.4	Very low	36.2	Very low	172 Å²	172	129.5 Å²	129.5	80%	0.804	78%	0.778	S	S	*	*			trans	-144.3	73.9	177.4	-73.9	-165.1	170.2	0	0	110.1	S14	S14-E16 VanDerWaalsContact C-N 3.26Å; S14-E16 PolarHBondContact O-N 3.11Å
17	Q	37.3	Very low	37.3	Very low	200 Å²	200	126.6 Å²	126.6	94%	0.935	76%	0.756	S	S	*	*	S	Bend	trans	-171.3	61	162.3	-110.8	154.5	18.8	0	0	111.4
18	A	36.8	Very low	39.1	Very low	91 Å²	91	127.4 Å²	127.4	75%	0.752	75%	0.751	S	S	*	*	S	Bend	trans	-158.2	41.5	170.3	0	0	0	0	0	113.1
19	D	36.3	Very low	41.3	Very low	142 Å²	142	123.7 Å²	123.7	76%	0.759	72%	0.724	S	S	*	*			trans	-150	34.3	-179.2	-100.3	-26.8	0	0	0	114.9
20	S	35	Very low	43.7	Very low	121 Å²	121	120 Å²	120	85%	0.846	70%	0.698	S	S	*	*	S	Bend	trans	-112.6	-5.8	168.9	-71.5	0	0	0	0	115
21	D	37.5	Very low	46.3	Very low	165 Å²	165	116.1 Å²	116.1	88%	0.882	67%	0.669	S	S	*	*	S	Bend	trans	-104.7	3.1	178.2	-79.6	-13.5	0	0	0	114.1
22	A	38.4	Very low	48.8	Very low	81 Å²	81	115.4 Å²	115.4	67%	0.669	65%	0.651	S	S	*	*	S	Bend	trans	-92.1	-0.1	-175.6	0	0	0	0	0	115.2
23	L	37.6	Very low	51.6	Low	140 Å²	140	111 Å²	111	73%	0.733	62%	0.622	S	S	*	*			trans	-114.2	27.6	-175.7	-88.3	156.3	0	0	0	113.6	I25	L23-I25 HydrophobicContact CD2-CD1 4.02Å; L23-I25 HydrophobicContact CD2-CG1 4.29Å; L23-I25 PolarHBondContact O-N 3.28Å
24	D	38.1	Very low	54.2	Low	132 Å²	132	105.7 Å²	105.7	71%	0.706	59%	0.587	S	S	*	*			trans	-75.1	78.3	164.7	-164.2	12.2	0	0	0	109.6	S26	D24-S26 PolarHBondContact O-N 3.48Å
25	I	44.4	Very low	57.1	Low	125 Å²	125	100.4 Å²	100.4	64%	0.641	55%	0.55	S	S	*	.			trans	-73.1	46.6	170.5	-46.1	170.3	0	0	0	108.9	L23 T27	L23-I25 HydrophobicContact CD2-CD1 4.02Å; L23-I25 HydrophobicContact CD2-CG1 4.29Å; L23-I25 PolarHBondContact O-N 3.28Å; I25-T27 PolarHBondContact O-N 2.9Å; I25-T27 VanDerWaalsContact O-N 3.12Å
26	S	44.2	Very low	59.6	Low	78 Å²	78	95 Å²	95	55%	0.545	52%	0.517	S	S	.	.			trans	-62.9	115.7	160.7	69.1	0	0	0	0	106.3	D24 K28	D24-S26 PolarHBondContact O-N 3.48Å; S26-K28 VanDerWaalsContact C-N 3.29Å; S26-K28 PolarHBondContact O-N 2.86Å
27	T	55.7	Low	62	Low	54 Å²	54	87.7 Å²	87.7	33%	0.331	48%	0.483	S	S	.	.			trans	-63.8	87.2	-174	23.8	0	0	0	0	109.9	I25 V29 K74 F76	I25-T27 PolarHBondContact O-N 2.9Å; I25-T27 VanDerWaalsContact O-N 3.12Å; T27-V29 PolarHBondContact O-N 3.5Å; T27-K74 PolarHBondContact OG1-O 3.22Å; T27-F76 HydrophobicContact CG2-CD1 3.93Å; T27-F76 HydrophobicContact CG2-CE1 3.44Å; T27-F76 VanDerWaalsContact CG2-CE1 3.44Å; T27-F76 HydrophobicContact CG2-CZ 4.42Å
28	K	67.6	Low	64.3	Low	179 Å²	179	81.4 Å²	81.4	78%	0.778	45%	0.45	S	S	*	.			trans	-71.6	68.2	175.7	-158.6	175.6	-174.8	177.8	0	110	S26 Q30	S26-K28 VanDerWaalsContact C-N 3.29Å; S26-K28 PolarHBondContact O-N 2.86Å; K28-Q30 PolarHBondContact O-N 3.35Å
29	V	79.8	Confident	66.1	Low	31 Å²	31	79.6 Å²	79.6	19%	0.188	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	126.4	170	168.3	0	0	0	0	107.3	T27 L31 Y32 I53 F70 F76	T27-V29 PolarHBondContact O-N 3.5Å; V29-L31 WeakPolarHBondContact CG1-O 3.35Å; V29-Y32 HydrophobicContact CG1-CD1 4.04Å; V29-I53 HydrophobicContact CB-CG2 4.3Å; V29-I53 HydrophobicContact CG1-CG2 3.57Å; V29-I53 HydrophobicContact CG2-CG2 3.74Å; V29-F70 HydrophobicContact CB-CZ 4.49Å; V29-F70 HydrophobicContact CG1-CZ 4.44Å; V29-F70 HydrophobicContact CG2-CE2 4.42Å; V29-F70 HydrophobicContact CG2-CZ 4.05Å; V29-F76 HydrophobicContact CG2-CD1 4.38Å
30	Q	85.4	Confident	67.6	Low	61 Å²	61	76.7 Å²	76.7	29%	0.285	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-40.3	-176.9	-76.1	159.9	-39.8	0	0	111.3	K28 I54 E56 M130 S134	K28-Q30 PolarHBondContact O-N 3.35Å; Q30-I54 HydrophobicContact CB-CB 4.32Å; Q30-I54 HydrophobicContact CB-CG2 4.19Å; Q30-I54 PolarHBondContact N-O 3.36Å; Q30-I54 VanDerWaalsContact OE1-CG2 3.31Å; Q30-E56 PolarHBondContact NE2-O 2.86Å; Q30-E56 VanDerWaalsContact NE2-O 3.16Å; Q30-E56 PolarHBondContact OE1-O 3.24Å; Q30-M130 HydrophobicContact CB-CE 3.61Å; Q30-M130 HydrophobicContact CG-CE 4.25Å; Q30-S134 VanDerWaalsContact CD-OG 3.23Å; Q30-S134 PolarHBondContact NE2-OG 3.4Å; Q30-S134 PolarHBondContact OE1-OG 3.3Å
31	L	88.5	Confident	68.8	Low	18 Å²	18	74.1 Å²	74.1	9%	0.094	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	146.9	177.5	-171.7	62.2	0	0	0	110.2	V29 I54 Q126 W127 M130	V29-L31 WeakPolarHBondContact CG1-O 3.35Å; L31-I54 HydrophobicContact CB-CB 4.31Å; L31-I54 HydrophobicContact CB-CD1 3.99Å; L31-I54 HydrophobicContact CB-CG1 4.18Å; L31-I54 HydrophobicContact CD2-CD1 4.21Å; L31-I54 PolarHBondContact O-N 2.97Å; L31-Q126 HydrophobicContact CD1-CG 4.23Å; L31-Q126 HydrophobicContact CD2-CG 4.3Å; L31-W127 HydrophobicContact CD2-CB 4.35Å; L31-W127 HydrophobicContact CD2-CD2 3.45Å; L31-W127 VanDerWaalsContact CD2-CD2 3.45Å; L31-W127 HydrophobicContact CD2-CE3 3.75Å; L31-W127 HydrophobicContact CD2-CG 3.76Å; L31-W127 HydrophobicContact CD2-CH2 4.42Å; L31-W127 HydrophobicContact CD2-CZ2 4.19Å; L31-W127 HydrophobicContact CD2-CZ3 4.23Å; L31-W127 HydrophobicContact CG-CD2 4.24Å; L31-W127 HydrophobicContact CG-CE3 4.45Å; L31-W127 HydrophobicContact CG-CH2 4.27Å; L31-W127 HydrophobicContact CG-CZ2 4.06Å; L31-W127 HydrophobicContact CG-CZ3 4.48Å; L31-M130 HydrophobicContact CB-CB 4.33Å; L31-M130 HydrophobicContact CB-CG 4.33Å; L31-M130 HydrophobicContact CD2-CB 3.87Å; L31-M130 HydrophobicContact CD2-CG 3.96Å
32	Y	90.4	Very high	70	Confident	111 Å²	111	76 Å²	76	44%	0.435	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	154.7	172.7	65.9	-89.8	0	0	0	111.1	V29 F51 F52 F70 E71	V29-Y32 HydrophobicContact CG1-CD1 4.04Å; Y32-F51 AromaticContact CD2-CE2 3.97Å; Y32-F51 HydrophobicContact CD2-CE2 3.97Å; Y32-F51 HydrophobicContact CD2-CZ 4.17Å; Y32-F51 HydrophobicContact CG-CE2 4.49Å; Y32-F51 HydrophobicContact CG-CZ 4.49Å; Y32-F52 CarbonylContact C-O 3.49Å; Y32-F52 VanDerWaalsContact CA-O 3.23Å; Y32-F52 WeakPolarHBondContact CA-O 3.4Å; Y32-F70 AromaticContact CD1-CE1 3.71Å; Y32-F70 HydrophobicContact CD1-CE1 3.71Å; Y32-F70 HydrophobicContact CD1-CZ 4.4Å; Y32-F70 HydrophobicContact CD2-CD1 4.12Å; Y32-F70 AromaticContact CD2-CE1 3.89Å; Y32-F70 HydrophobicContact CD2-CE1 3.89Å; Y32-F70 HydrophobicContact CE1-CE1 4.03Å; Y32-F70 HydrophobicContact CE2-CD1 4.4Å; Y32-F70 HydrophobicContact CE2-CE1 4.21Å; Y32-F70 HydrophobicContact CG-CD1 4.27Å; Y32-F70 AromaticContact CG-CE1 3.63Å; Y32-F70 HydrophobicContact CG-CE1 3.63Å; Y32-E71 HydrophobicContact CE2-CG 4.34Å
33	G	89.9	Confident	70.9	Confident	12 Å²	12	78.7 Å²	78.7	12%	0.124	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167	174.3	-176.5	0	0	0	0	0	113.1	F51 F52	G33-F51 WeakPolarHBondContact O-CD2 3.46Å; G33-F52 PolarHBondContact N-O 2.86Å; G33-F52 PolarHBondContact O-N 3.26Å
34	V	90.6	Very high	72.1	Confident	17 Å²	17	74.3 Å²	74.3	10%	0.103	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.9	178.7	172.9	0	0	0	0	108.5	R49 R50 F51 E64 K67	V34-R49 HydrophobicContact CG1-CB 4.04Å; V34-R49 HydrophobicContact CG1-CG 4.5Å; V34-R50 WeakPolarHBondContact CA-O 3.28Å; V34-F51 HydrophobicContact CG2-CB 4.34Å; V34-F51 HydrophobicContact CG2-CD2 4.19Å; V34-E64 HydrophobicContact CG1-CG 4.44Å; V34-E64 HydrophobicContact CG2-CG 4.34Å; V34-K67 HydrophobicContact CG2-CD 3.78Å
35	L	91.4	Very high	73.4	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.005	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	155.3	175.3	-60.4	172.9	0	0	0	110	R50 F52 L116 A118 W127	L35-R50 PolarHBondContact N-O 2.95Å; L35-R50 PolarHBondContact O-N 2.87Å; L35-F52 HydrophobicContact CB-CD2 3.64Å; L35-F52 HydrophobicContact CB-CE2 3.69Å; L35-F52 HydrophobicContact CD1-CD2 4.1Å; L35-F52 HydrophobicContact CD1-CG 4.33Å; L35-F52 HydrophobicContact CG-CD2 4.08Å; L35-L116 HydrophobicContact CD1-CB 4.36Å; L35-L116 HydrophobicContact CD1-CD1 4.02Å; L35-A118 HydrophobicContact CD2-CB 3.96Å; L35-W127 HydrophobicContact CD1-CD2 3.7Å; L35-W127 HydrophobicContact CD1-CE3 3.85Å; L35-W127 HydrophobicContact CD1-CG 4.16Å; L35-W127 HydrophobicContact CD1-CH2 4.37Å; L35-W127 HydrophobicContact CD1-CZ2 4.21Å; L35-W127 HydrophobicContact CD1-CZ3 4.17Å; L35-W127 HydrophobicContact CD2-CD2 4.44Å; L35-W127 HydrophobicContact CD2-CG 4.3Å; L35-W127 HydrophobicContact CG-CD2 4.39Å; L35-W127 HydrophobicContact CG-CZ2 4.36Å
36	W	89.3	Confident	75.1	Confident	63 Å²	63	73.5 Å²	73.5	24%	0.239	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120.9	169	-66.3	92.2	0	0	0	109.2	W47 R49 M99 L116 A117	W36-W47 HydrophobicContact CB-CE3 3.86Å; W36-W47 HydrophobicContact CB-CZ3 4.46Å; W36-W47 HydrophobicContact CE3-CB 3.88Å; W36-R49 HydrophobicContact CD2-CG 3.73Å; W36-R49 HydrophobicContact CE3-CG 3.63Å; W36-R49 HydrophobicContact CH2-CG 3.56Å; W36-R49 HydrophobicContact CZ2-CG 3.64Å; W36-R49 HydrophobicContact CZ3-CG 3.55Å; W36-M99 HydrophobicContact CB-CE 4.47Å; W36-M99 HydrophobicContact CD2-CE 3.82Å; W36-M99 HydrophobicContact CE3-CE 4.09Å; W36-M99 HydrophobicContact CG-CE 4Å; W36-M99 HydrophobicContact CG-SD 4.45Å; W36-L116 CarbonylContact O-C 3.53Å; W36-L116 WeakPolarHBondContact O-CA 3.36Å; W36-A117 HydrophobicContact CB-CB 4.13Å; W36-A117 PolarHBondContact N-O 3.49Å; W36-A117 PolarHBondContact O-N 3.4Å
37	K	87.9	Confident	77.1	Confident	19 Å²	19	71.4 Å²	71.4	8%	0.083	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.9	177.9	-173.7	-175.7	-178.2	-63.9	0	110.3	S48 R50 F52 Y61 L116	K37-S48 PolarHBondContact N-O 3.39Å; K37-S48 PolarHBondContact O-N 2.94Å; K37-S48 PolarHBondContact O-OG 2.85Å; K37-S48 VanDerWaalsContact O-OG 3.13Å; K37-R50 HydrophobicContact CB-CG 4.12Å; K37-R50 HydrophobicContact CD-CG 4.34Å; K37-F52 HydrophobicContact CB-CE2 4.24Å; K37-F52 HydrophobicContact CB-CZ 3.9Å; K37-F52 HydrophobicContact CD-CZ 3.94Å; K37-F52 HydrophobicContact CG-CZ 4.11Å; K37-Y61 HydrophobicContact CD-CD2 4.46Å; K37-Y61 HydrophobicContact CD-CE1 4.48Å; K37-Y61 HydrophobicContact CD-CE2 4.46Å; K37-L116 HydrophobicContact CB-CD2 4.02Å; K37-L116 HydrophobicContact CG-CD2 3.87Å
38	R	84.9	Confident	78.6	Confident	68 Å²	68	70.5 Å²	70.5	26%	0.257	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-82.8	140.3	166	-164.5	172.3	171.8	179.5	-4.4	110.7	F40 S44 W47 L115	R38-F40 PolarHBondContact O-N 3.31Å; R38-S44 PolarHBondContact NE-O 3.12Å; R38-W47 HydrophobicContact CB-CD2 4.38Å; R38-W47 HydrophobicContact CB-CE3 4.06Å; R38-W47 HydrophobicContact CB-CH2 4.3Å; R38-W47 HydrophobicContact CB-CZ3 4.02Å; R38-L115 HydrophobicContact CB-CB 4.12Å; R38-L115 PolarHBondContact N-O 2.97Å
39	P	74.8	Confident	79.6	Confident	53 Å²	53	65.7 Å²	65.7	34%	0.344	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-55.1	134.3	173.4	-26	33.5	0	0	0	111	K46	P39-K46 WeakPolarHBondContact CD-O 3.36Å
40	F	68.4	Low	80.2	Confident	82 Å²	82	67.9 Å²	67.9	36%	0.36	35%	0.348	S	S	.	.	S	Bend	trans	-93.4	140.7	177.9	180	-100.7	0	0	0	109.1	R38 R42 F110 H111 G112 I114	R38-F40 PolarHBondContact O-N 3.31Å; F40-R42 PolarHBondContact O-N 2.91Å; F40-F110 HydrophobicContact CZ-CB 4.29Å; F40-H111 HydrophobicContact CZ-CB 4.36Å; F40-G112 WeakPolarHBondContact CE2-O 3.38Å; F40-I114 HydrophobicContact CD2-CG1 3.75Å; F40-I114 HydrophobicContact CE2-CG1 3.97Å
41	G	60.8	Low	80.5	Confident	67 Å²	67	65 Å²	65	69%	0.691	34%	0.335	S	S	*	.	S	Bend	trans	80.5	-1.6	175.2	0	0	0	0	0	117.2
42	R	62.2	Low	80.6	Confident	203 Å²	203	64.2 Å²	64.2	77%	0.766	33%	0.331	S	S	*	.	S	Bend	trans	-133	140.5	171.7	-67.1	-173.5	-176.4	-108.7	1.1	110.5	F40 S44	F40-R42 PolarHBondContact O-N 2.91Å; R42-S44 PolarHBondContact O-N 3.4Å
43	P	56.5	Low	80.7	Confident	138 Å²	138	58.9 Å²	58.9	90%	0.896	31%	0.31	S	S	*	.			trans	-75.5	54.1	-179.9	32.5	-35.7	0	0	0	111.9
44	S	63.3	Low	80.6	Confident	49 Å²	49	58.3 Å²	58.3	34%	0.343	30%	0.304	S	S	.	.			trans	-94.2	135.4	172	-172.3	0	0	0	0	109.8	R38 R42 K46	R38-S44 PolarHBondContact NE-O 3.12Å; R42-S44 PolarHBondContact O-N 3.4Å; S44-K46 VanDerWaalsContact C-N 3.3Å; S44-K46 PolarHBondContact OG-N 3.04Å
45	A	65.7	Low	80.5	Confident	75 Å²	75	59.8 Å²	59.8	62%	0.62	31%	0.309	S	S	*	.			trans	-87.9	3.7	174.3	0	0	0	0	0	113	W47	A45-W47 PolarHBondContact O-N 3.23Å
46	K	80.8	Confident	80	Confident	164 Å²	164	64.6 Å²	64.6	71%	0.713	33%	0.332	S	S	*	.			trans	-83.5	115.9	-173.5	-166.4	174.6	-175.7	175.1	0	111.3	P39 S44	P39-K46 WeakPolarHBondContact CD-O 3.36Å; S44-K46 VanDerWaalsContact C-N 3.3Å; S44-K46 PolarHBondContact OG-N 3.04Å
47	W	84.3	Confident	79.7	Confident	34 Å²	34	62.2 Å²	62.2	13%	0.129	33%	0.325	C	S	.	.			trans	-79	147.1	174.2	-66	90.2	0	0	0	111.6	W36 R38 A45 S98 M99 A102 L115 A117	W36-W47 HydrophobicContact CB-CE3 3.86Å; W36-W47 HydrophobicContact CB-CZ3 4.46Å; W36-W47 HydrophobicContact CE3-CB 3.88Å; R38-W47 HydrophobicContact CB-CD2 4.38Å; R38-W47 HydrophobicContact CB-CE3 4.06Å; R38-W47 HydrophobicContact CB-CH2 4.3Å; R38-W47 HydrophobicContact CB-CZ3 4.02Å; A45-W47 PolarHBondContact O-N 3.23Å; W47-S98 PolarHBondContact NE1-OG 3.49Å; W47-M99 HydrophobicContact CB-CE 4.25Å; W47-M99 HydrophobicContact CD2-CG 4.11Å; W47-M99 HydrophobicContact CG-CE 4.2Å; W47-M99 HydrophobicContact CG-CG 4.41Å; W47-M99 HydrophobicContact CZ2-CB 4.3Å; W47-M99 HydrophobicContact CZ2-CG 4.13Å; W47-A102 HydrophobicContact CH2-CB 4.44Å; W47-L115 HydrophobicContact CH2-CB 3.95Å; W47-L115 HydrophobicContact CZ3-CB 4.39Å; W47-A117 HydrophobicContact CH2-CB 4.26Å; W47-A117 HydrophobicContact CZ3-CB 4.02Å
48	S	87.6	Confident	79.7	Confident	36 Å²	36	65.4 Å²	65.4	25%	0.252	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	134.9	178.2	62.7	0	0	0	0	111.5	K37	K37-S48 PolarHBondContact N-O 3.39Å; K37-S48 PolarHBondContact O-N 2.94Å; K37-S48 PolarHBondContact O-OG 2.85Å; K37-S48 VanDerWaalsContact O-OG 3.13Å
49	R	90.1	Very high	80	Confident	77 Å²	77	62.1 Å²	62.1	29%	0.291	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	130.4	175.2	-64.6	173.9	76.5	101.7	3.4	110	V34 W36 E64 E119	V34-R49 HydrophobicContact CG1-CB 4.04Å; V34-R49 HydrophobicContact CG1-CG 4.5Å; W36-R49 HydrophobicContact CD2-CG 3.73Å; W36-R49 HydrophobicContact CE3-CG 3.63Å; W36-R49 HydrophobicContact CH2-CG 3.56Å; W36-R49 HydrophobicContact CZ2-CG 3.64Å; W36-R49 HydrophobicContact CZ3-CG 3.55Å; R49-E64 VanDerWaalsContact CB-OE2 3.25Å; R49-E64 WeakPolarHBondContact CB-OE2 3.49Å; R49-E64 IonicContact CZ-OE1 2.67Å; R49-E64 IonicContact NE-OE1 2.85Å; R49-E64 PolarHBondContact NE-OE1 3.02Å; R49-E64 IonicContact NE-OE2 2.95Å; R49-E64 IonicContact NH2-OE1 3.77Å; R49-E119 IonicContact CZ-OE1 3.85Å; R49-E119 IonicContact NH1-OE1 2.76Å; R49-E119 PolarHBondContact NH1-OE1 3Å; R49-E119 IonicContact NH2-OE1 3.73Å; R49-E119 PolarHBondContact NH2-OE1 3.02Å
50	R	91	Very high	80.7	Confident	77 Å²	77	60.5 Å²	60.5	29%	0.291	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	144.9	177	-64.9	-66	-178.9	-139.2	4.5	108.9	V34 L35 K37 F52 Y61 Y62	V34-R50 WeakPolarHBondContact CA-O 3.28Å; L35-R50 PolarHBondContact N-O 2.95Å; L35-R50 PolarHBondContact O-N 2.87Å; K37-R50 HydrophobicContact CB-CG 4.12Å; K37-R50 HydrophobicContact CD-CG 4.34Å; R50-F52 HydrophobicContact CB-CD2 4.19Å; R50-F52 HydrophobicContact CB-CE2 3.58Å; R50-F52 HydrophobicContact CB-CZ 4.11Å; R50-F52 VanDerWaalsContact O-CD2 3.25Å; R50-F52 WeakPolarHBondContact O-CD2 3.34Å; R50-Y61 HydrophobicContact CG-CD2 4.43Å; R50-Y62 VanDerWaalsContact CD-O 3.28Å; R50-Y62 WeakPolarHBondContact CD-O 3.24Å
51	F	91.5	Very high	81.8	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.009	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	126.6	173.6	175.3	-125.9	0	0	0	108.7	Y32 G33 V34 I53 Y61 Y62 S63 E66 K67 F70	Y32-F51 AromaticContact CD2-CE2 3.97Å; Y32-F51 HydrophobicContact CD2-CE2 3.97Å; Y32-F51 HydrophobicContact CD2-CZ 4.17Å; Y32-F51 HydrophobicContact CG-CE2 4.49Å; Y32-F51 HydrophobicContact CG-CZ 4.49Å; G33-F51 WeakPolarHBondContact O-CD2 3.46Å; V34-F51 HydrophobicContact CG2-CB 4.34Å; V34-F51 HydrophobicContact CG2-CD2 4.19Å; F51-I53 HydrophobicContact CD1-CG1 4.41Å; F51-I53 HydrophobicContact CE1-CD1 3.63Å; F51-I53 HydrophobicContact CE1-CG1 3.71Å; F51-I53 HydrophobicContact CE2-CG1 4.48Å; F51-I53 HydrophobicContact CZ-CD1 3.96Å; F51-I53 HydrophobicContact CZ-CG1 3.72Å; F51-Y61 CarbonylContact O-C 3.16Å; F51-Y61 VanDerWaalsContact O-CA 3.24Å; F51-Y61 WeakPolarHBondContact O-CA 3.43Å; F51-Y62 HydrophobicContact CD1-CD2 4.14Å; F51-Y62 HydrophobicContact CD1-CG 4.47Å; F51-Y62 PolarHBondContact N-O 3.32Å; F51-Y62 PolarHBondContact O-N 3.44Å; F51-S63 WeakPolarHBondContact CB-O 3.37Å; F51-E66 HydrophobicContact CD1-CB 4.42Å; F51-K67 HydrophobicContact CB-CB 4.41Å; F51-K67 HydrophobicContact CD1-CB 4.42Å; F51-K67 HydrophobicContact CD2-CB 3.84Å; F51-K67 HydrophobicContact CD2-CG 4.02Å; F51-K67 HydrophobicContact CE2-CB 4.21Å; F51-K67 HydrophobicContact CE2-CG 4.04Å; F51-K67 HydrophobicContact CG-CB 3.97Å; F51-F70 HydrophobicContact CE1-CB 3.77Å; F51-F70 HydrophobicContact CE1-CD1 4.18Å; F51-F70 AromaticContact CE1-CG 3.97Å; F51-F70 HydrophobicContact CE1-CG 3.97Å; F51-F70 HydrophobicContact CZ-CB 3.99Å; F51-F70 AromaticContact CZ-CD1 3.6Å; F51-F70 HydrophobicContact CZ-CD1 3.6Å; F51-F70 HydrophobicContact CZ-CE1 4.3Å; F51-F70 AromaticContact CZ-CG 3.87Å; F51-F70 HydrophobicContact CZ-CG 3.87Å
52	F	91.7	Very high	83.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	145.6	-176.8	-73.5	-92.3	0	0	0	111.1	Y32 G33 L35 K37 R50 L59 L60 Y61 L116 W127	Y32-F52 CarbonylContact C-O 3.49Å; Y32-F52 VanDerWaalsContact CA-O 3.23Å; Y32-F52 WeakPolarHBondContact CA-O 3.4Å; G33-F52 PolarHBondContact N-O 2.86Å; G33-F52 PolarHBondContact O-N 3.26Å; L35-F52 HydrophobicContact CB-CD2 3.64Å; L35-F52 HydrophobicContact CB-CE2 3.69Å; L35-F52 HydrophobicContact CD1-CD2 4.1Å; L35-F52 HydrophobicContact CD1-CG 4.33Å; L35-F52 HydrophobicContact CG-CD2 4.08Å; K37-F52 HydrophobicContact CB-CE2 4.24Å; K37-F52 HydrophobicContact CB-CZ 3.9Å; K37-F52 HydrophobicContact CD-CZ 3.94Å; K37-F52 HydrophobicContact CG-CZ 4.11Å; R50-F52 HydrophobicContact CB-CD2 4.19Å; R50-F52 HydrophobicContact CB-CE2 3.58Å; R50-F52 HydrophobicContact CB-CZ 4.11Å; R50-F52 VanDerWaalsContact O-CD2 3.25Å; R50-F52 WeakPolarHBondContact O-CD2 3.34Å; F52-L59 HydrophobicContact CB-CD1 3.99Å; F52-L59 HydrophobicContact CD1-CD1 3.65Å; F52-L59 HydrophobicContact CD1-CD2 3.95Å; F52-L59 HydrophobicContact CD1-CG 3.76Å; F52-L59 HydrophobicContact CE1-CD2 4.12Å; F52-L59 HydrophobicContact CE1-CG 4.32Å; F52-L59 HydrophobicContact CG-CD1 4.25Å; F52-L60 CarbonylContact C-O 3.56Å; F52-L60 VanDerWaalsContact CA-O 3.25Å; F52-L60 WeakPolarHBondContact CA-O 3.47Å; F52-Y61 VanDerWaalsContact CD1-CB 3.46Å; F52-Y61 HydrophobicContact CE1-CD1 4.11Å; F52-Y61 HydrophobicContact CE1-CG 4Å; F52-Y61 HydrophobicContact CZ-CG 4.41Å; F52-L116 HydrophobicContact CE1-CD1 4.28Å; F52-L116 HydrophobicContact CE1-CD2 3.9Å; F52-L116 HydrophobicContact CE2-CD2 4.11Å; F52-L116 HydrophobicContact CZ-CD1 4.42Å; F52-L116 HydrophobicContact CZ-CD2 3.4Å; F52-W127 HydrophobicContact CB-CH2 3.56Å; F52-W127 HydrophobicContact CB-CZ2 4.31Å; F52-W127 HydrophobicContact CB-CZ3 4.04Å
53	I	91.2	Very high	84.4	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	127.5	175.5	-57.8	-176.7	0	0	0	108	V29 F51 L60 Y62 F70 F76	V29-I53 HydrophobicContact CB-CG2 4.3Å; V29-I53 HydrophobicContact CG1-CG2 3.57Å; V29-I53 HydrophobicContact CG2-CG2 3.74Å; F51-I53 HydrophobicContact CD1-CG1 4.41Å; F51-I53 HydrophobicContact CE1-CD1 3.63Å; F51-I53 HydrophobicContact CE1-CG1 3.71Å; F51-I53 HydrophobicContact CE2-CG1 4.48Å; F51-I53 HydrophobicContact CZ-CD1 3.96Å; F51-I53 HydrophobicContact CZ-CG1 3.72Å; I53-L60 HydrophobicContact CB-CB 4.38Å; I53-L60 PolarHBondContact N-O 3.32Å; I53-L60 PolarHBondContact O-N 2.95Å; I53-Y62 HydrophobicContact CB-CE2 4.5Å; I53-Y62 HydrophobicContact CD1-CD2 4.22Å; I53-Y62 HydrophobicContact CD1-CE2 3.77Å; I53-Y62 HydrophobicContact CG1-CD2 4.35Å; I53-Y62 HydrophobicContact CG1-CE2 4.13Å; I53-F70 HydrophobicContact CD1-CD2 3.96Å; I53-F70 HydrophobicContact CD1-CE2 3.94Å; I53-F70 HydrophobicContact CD1-CG 4.34Å; I53-F70 HydrophobicContact CD1-CZ 4.29Å; I53-F76 HydrophobicContact CD1-CB 3.58Å; I53-F76 HydrophobicContact CD1-CG 4.23Å
54	I	89.3	Confident	85.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	117.3	166.6	-51.2	-174.5	0	0	0	107.9	Q30 L31 F58 L59 L86 W127 M130 L131 S134	Q30-I54 HydrophobicContact CB-CB 4.32Å; Q30-I54 HydrophobicContact CB-CG2 4.19Å; Q30-I54 PolarHBondContact N-O 3.36Å; Q30-I54 VanDerWaalsContact OE1-CG2 3.31Å; L31-I54 HydrophobicContact CB-CB 4.31Å; L31-I54 HydrophobicContact CB-CD1 3.99Å; L31-I54 HydrophobicContact CB-CG1 4.18Å; L31-I54 HydrophobicContact CD2-CD1 4.21Å; L31-I54 PolarHBondContact O-N 2.97Å; I54-F58 WeakPolarHBondContact CA-O 3.44Å; I54-L59 HydrophobicContact CG1-CD1 3.88Å; I54-L86 HydrophobicContact CG2-CD1 4Å; I54-W127 HydrophobicContact CD1-CE3 3.74Å; I54-W127 HydrophobicContact CD1-CZ3 3.62Å; I54-W127 HydrophobicContact CG1-CE3 4.14Å; I54-W127 HydrophobicContact CG1-CH2 4.25Å; I54-W127 HydrophobicContact CG1-CZ3 3.47Å; I54-W127 VanDerWaalsContact CG1-CZ3 3.47Å; I54-M130 HydrophobicContact CD1-CB 3.96Å; I54-L131 HydrophobicContact CD1-CD2 3.63Å; I54-L131 HydrophobicContact CD1-CG 3.83Å; I54-L131 HydrophobicContact CG1-CD2 4.23Å; I54-S134 VanDerWaalsContact CG2-OG 3.22Å; I54-S134 WeakPolarHBondContact CG2-OG 3.33Å
55	K	86.9	Confident	86.9	Confident	48 Å²	48	46 Å²	46	21%	0.209	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	121	170.8	-171.5	-169.8	176.1	-155.6	0	108.8	S57 F58 L60 F76	K55-S57 PolarHBondContact O-N 3.02Å; K55-F58 PolarHBondContact N-O 2.88Å; K55-F58 PolarHBondContact O-N 3.29Å; K55-L60 HydrophobicContact CB-CD1 4.49Å; K55-F76 HydrophobicContact CD-CE1 3.78Å; K55-F76 HydrophobicContact CD-CZ 3.68Å
56	E	81	Confident	87.7	Confident	102 Å²	102	44.1 Å²	44.1	48%	0.477	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	-91.6	-177.3	-62.9	156.1	-147.9	0	0	112.6	Q30 S134	Q30-E56 PolarHBondContact NE2-O 2.86Å; Q30-E56 VanDerWaalsContact NE2-O 3.16Å; Q30-E56 PolarHBondContact OE1-O 3.24Å; E56-S134 WeakPolarHBondContact O-CA 3.27Å; E56-S134 WeakPolarHBondContact O-CB 3.38Å; E56-S134 PolarHBondContact O-OG 3.47Å
57	S	84.7	Confident	87.9	Confident	13 Å²	13	39.8 Å²	39.8	9%	0.091	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.8	18.4	-179.3	61.7	0	0	0	0	113	K55 L86 S134 T138	K55-S57 PolarHBondContact O-N 3.02Å; S57-L86 VanDerWaalsContact O-CB 3.29Å; S57-L86 WeakPolarHBondContact O-CB 3.3Å; S57-L86 PolarHBondContact O-N 2.93Å; S57-S134 WeakPolarHBondContact CB-O 3.45Å; S57-T138 WeakPolarHBondContact CB-OG1 3.37Å; S57-T138 PolarHBondContact OG-OG1 3.27Å
58	F	87.6	Confident	87.7	Confident	85 Å²	85	45.8 Å²	45.8	37%	0.373	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.9	179	-62.1	-81.7	0	0	0	109.9	I54 K55 L60 V83 P85	I54-F58 WeakPolarHBondContact CA-O 3.44Å; K55-F58 PolarHBondContact N-O 2.88Å; K55-F58 PolarHBondContact O-N 3.29Å; F58-L60 HydrophobicContact CB-CD2 4.47Å; F58-V83 HydrophobicContact CB-CG1 4.19Å; F58-V83 HydrophobicContact CD1-CG1 3.69Å; F58-V83 HydrophobicContact CG-CG1 4.28Å; F58-P85 HydrophobicContact CD1-CB 4.29Å; F58-P85 HydrophobicContact CE1-CB 4.14Å
59	L	90.1	Very high	87.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	109.6	166.6	176.1	69.6	0	0	0	108.5	F52 I54 I84 L86 I105 L116 W127 L131	F52-L59 HydrophobicContact CB-CD1 3.99Å; F52-L59 HydrophobicContact CD1-CD1 3.65Å; F52-L59 HydrophobicContact CD1-CD2 3.95Å; F52-L59 HydrophobicContact CD1-CG 3.76Å; F52-L59 HydrophobicContact CE1-CD2 4.12Å; F52-L59 HydrophobicContact CE1-CG 4.32Å; F52-L59 HydrophobicContact CG-CD1 4.25Å; I54-L59 HydrophobicContact CG1-CD1 3.88Å; L59-I84 HydrophobicContact CB-CB 4.17Å; L59-I84 HydrophobicContact CD2-CD1 3.96Å; L59-I84 HydrophobicContact CG-CD1 4.45Å; L59-I84 PolarHBondContact N-O 3.45Å; L59-I84 PolarHBondContact O-N 3.35Å; L59-L86 HydrophobicContact CB-CD1 4.1Å; L59-L86 HydrophobicContact CB-CD2 3.81Å; L59-L86 HydrophobicContact CB-CG 4.06Å; L59-I105 HydrophobicContact CD2-CD1 3.91Å; L59-L116 HydrophobicContact CD2-CD1 3.89Å; L59-W127 HydrophobicContact CD1-CZ3 3.78Å; L59-L131 HydrophobicContact CB-CD2 4.35Å; L59-L131 HydrophobicContact CD1-CD2 4.16Å; L59-L131 HydrophobicContact CD2-CD2 3.98Å; L59-L131 HydrophobicContact CG-CD2 4.41Å
60	L	90.8	Very high	87	Confident	18 Å²	18	44.3 Å²	44.3	9%	0.094	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	138.1	179.6	-54.6	166.6	0	0	0	108.5	F52 I53 K55 F58 Y62 F76 P80 V83	F52-L60 CarbonylContact C-O 3.56Å; F52-L60 VanDerWaalsContact CA-O 3.25Å; F52-L60 WeakPolarHBondContact CA-O 3.47Å; I53-L60 HydrophobicContact CB-CB 4.38Å; I53-L60 PolarHBondContact N-O 3.32Å; I53-L60 PolarHBondContact O-N 2.95Å; K55-L60 HydrophobicContact CB-CD1 4.49Å; F58-L60 HydrophobicContact CB-CD2 4.47Å; L60-Y62 HydrophobicContact CB-CE2 3.7Å; L60-F76 HydrophobicContact CD1-CD2 4.44Å; L60-F76 HydrophobicContact CD1-CE2 4.09Å; L60-F76 HydrophobicContact CD1-CZ 4.5Å; L60-P80 HydrophobicContact CB-CB 4.34Å; L60-P80 HydrophobicContact CD2-CB 4.36Å; L60-P80 HydrophobicContact CD2-CG 4.03Å; L60-V83 HydrophobicContact CD2-CB 4.23Å; L60-V83 HydrophobicContact CD2-CG1 3.86Å; L60-V83 HydrophobicContact CD2-CG2 3.71Å
61	Y	90.9	Very high	86.5	Confident	46 Å²	46	45.1 Å²	45.1	18%	0.18	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.7	172.7	74.2	-97.9	0	0	0	113.9	K37 R50 F51 F52 K81 G82 I84	K37-Y61 HydrophobicContact CD-CD2 4.46Å; K37-Y61 HydrophobicContact CD-CE1 4.48Å; K37-Y61 HydrophobicContact CD-CE2 4.46Å; R50-Y61 HydrophobicContact CG-CD2 4.43Å; F51-Y61 CarbonylContact O-C 3.16Å; F51-Y61 VanDerWaalsContact O-CA 3.24Å; F51-Y61 WeakPolarHBondContact O-CA 3.43Å; F52-Y61 VanDerWaalsContact CD1-CB 3.46Å; F52-Y61 HydrophobicContact CE1-CD1 4.11Å; F52-Y61 HydrophobicContact CE1-CG 4Å; F52-Y61 HydrophobicContact CZ-CG 4.41Å; Y61-K81 HydrophobicContact CD2-CB 3.8Å; Y61-K81 HydrophobicContact CE2-CB 3.47Å; Y61-K81 VanDerWaalsContact CE2-CB 3.47Å; Y61-K81 WeakPolarHBondContact O-CB 3.33Å; Y61-K81 PolarHBondContact O-N 3.47Å; Y61-K81 PolarHBondContact OH-O 2.87Å; Y61-K81 VanDerWaalsContact OH-O 3.07Å; Y61-G82 WeakPolarHBondContact CD1-O 3.21Å; Y61-G82 VanDerWaalsContact CE1-CA 3.43Å; Y61-G82 VanDerWaalsContact CZ-CA 3.49Å; Y61-G82 PolarHBondContact N-O 2.98Å; Y61-G82 PolarHBondContact O-N 3.4Å; Y61-I84 HydrophobicContact CD1-CD1 4.26Å; Y61-I84 HydrophobicContact CE1-CD1 4.44Å
62	Y	90.6	Very high	85.9	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	176	-168.2	-64.1	-82.3	0	0	0	111.2	R50 F51 I53 L60 E66 F76 N77 P80	R50-Y62 VanDerWaalsContact CD-O 3.28Å; R50-Y62 WeakPolarHBondContact CD-O 3.24Å; F51-Y62 HydrophobicContact CD1-CD2 4.14Å; F51-Y62 HydrophobicContact CD1-CG 4.47Å; F51-Y62 PolarHBondContact N-O 3.32Å; F51-Y62 PolarHBondContact O-N 3.44Å; I53-Y62 HydrophobicContact CB-CE2 4.5Å; I53-Y62 HydrophobicContact CD1-CD2 4.22Å; I53-Y62 HydrophobicContact CD1-CE2 3.77Å; I53-Y62 HydrophobicContact CG1-CD2 4.35Å; I53-Y62 HydrophobicContact CG1-CE2 4.13Å; L60-Y62 HydrophobicContact CB-CE2 3.7Å; Y62-E66 WeakPolarHBondContact CD1-OE2 3.49Å; Y62-F76 VanDerWaalsContact OH-CD2 3.31Å; Y62-F76 WeakPolarHBondContact OH-CD2 3.36Å; Y62-N77 HydrophobicContact CD1-CB 4.3Å; Y62-N77 HydrophobicContact CE1-CB 3.84Å; Y62-N77 WeakPolarHBondContact CE1-O 3.49Å; Y62-N77 VanDerWaalsContact CZ-O 3.29Å; Y62-N77 PolarHBondContact OH-O 2.91Å; Y62-P80 HydrophobicContact CD1-CB 4.21Å; Y62-P80 HydrophobicContact CE1-CB 3.65Å; Y62-P80 HydrophobicContact CE2-CB 4.3Å
63	S	88.1	Confident	85.2	Confident	22 Å²	22	53.6 Å²	53.6	15%	0.154	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	148.2	164.9	-28.7	0	0	0	0	110.1	F51 S65 E66 K81	F51-S63 WeakPolarHBondContact CB-O 3.37Å; S63-S65 WeakPolarHBondContact CB-OG 3.39Å; S63-S65 PolarHBondContact O-N 2.95Å; S63-E66 WeakPolarHBondContact CB-OE1 3.5Å; S63-E66 PolarHBondContact N-OE1 3.31Å; S63-E66 WeakPolarHBondContact O-CB 3.48Å; S63-E66 PolarHBondContact O-N 3.22Å; S63-E66 PolarHBondContact OG-OE1 3.47Å; S63-K81 WeakPolarHBondContact OG-CE 3.41Å; S63-K81 PolarHBondContact OG-NZ 3.33Å
64	E	86.7	Confident	84.3	Confident	80 Å²	80	61.3 Å²	61.3	37%	0.374	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-32.3	173.4	-178.6	171.7	-158.8	0	0	112.9	V34 R49 E66 K67	V34-E64 HydrophobicContact CG1-CG 4.44Å; V34-E64 HydrophobicContact CG2-CG 4.34Å; R49-E64 VanDerWaalsContact CB-OE2 3.25Å; R49-E64 WeakPolarHBondContact CB-OE2 3.49Å; R49-E64 IonicContact CZ-OE1 2.67Å; R49-E64 IonicContact NE-OE1 2.85Å; R49-E64 PolarHBondContact NE-OE1 3.02Å; R49-E64 IonicContact NE-OE2 2.95Å; R49-E64 IonicContact NH2-OE1 3.77Å; E64-E66 PolarHBondContact O-N 3.43Å; E64-K67 WeakPolarHBondContact O-CB 3.34Å; E64-K67 PolarHBondContact O-N 2.66Å
65	S	84.3	Confident	83.4	Confident	85 Å²	85	68.3 Å²	68.3	59%	0.594	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.5	176.2	53.3	0	0	0	0	114	S63 K67	S63-S65 WeakPolarHBondContact CB-OG 3.39Å; S63-S65 PolarHBondContact O-N 2.95Å; S65-K67 VanDerWaalsContact C-N 3.26Å; S65-K67 PolarHBondContact O-N 3.43Å
66	E	82.9	Confident	82.8	Confident	35 Å²	35	67.9 Å²	67.9	16%	0.164	33%	0.333	C	S	.	.	H	α-helix	trans	-76.1	-14.4	-178	-66.4	174.6	-117.5	0	0	112.8	F51 Y62 S63 E64 K68 S69 F70 N77	F51-E66 HydrophobicContact CD1-CB 4.42Å; Y62-E66 WeakPolarHBondContact CD1-OE2 3.49Å; S63-E66 WeakPolarHBondContact CB-OE1 3.5Å; S63-E66 PolarHBondContact N-OE1 3.31Å; S63-E66 WeakPolarHBondContact O-CB 3.48Å; S63-E66 PolarHBondContact O-N 3.22Å; S63-E66 PolarHBondContact OG-OE1 3.47Å; E64-E66 PolarHBondContact O-N 3.43Å; E66-K68 PolarHBondContact O-N 2.89Å; E66-S69 PolarHBondContact O-N 3.35Å; E66-F70 PolarHBondContact O-N 2.95Å; E66-N77 PolarHBondContact OE2-ND2 2.9Å; E66-N77 VanDerWaalsContact OE2-ND2 3.13Å
67	K	84.2	Confident	82.5	Confident	73 Å²	73	66.3 Å²	66.3	32%	0.317	33%	0.328	S	S	.	.	H	α-helix	trans	-55.6	-48.9	173.5	-178.5	-174	177.5	173.5	0	111.6	V34 F51 E64 S65 S69 F70 E71	V34-K67 HydrophobicContact CG2-CD 3.78Å; F51-K67 HydrophobicContact CB-CB 4.41Å; F51-K67 HydrophobicContact CD1-CB 4.42Å; F51-K67 HydrophobicContact CD2-CB 3.84Å; F51-K67 HydrophobicContact CD2-CG 4.02Å; F51-K67 HydrophobicContact CE2-CB 4.21Å; F51-K67 HydrophobicContact CE2-CG 4.04Å; F51-K67 HydrophobicContact CG-CB 3.97Å; E64-K67 WeakPolarHBondContact O-CB 3.34Å; E64-K67 PolarHBondContact O-N 2.66Å; S65-K67 VanDerWaalsContact C-N 3.26Å; S65-K67 PolarHBondContact O-N 3.43Å; K67-S69 VanDerWaalsContact C-N 3.3Å; K67-S69 PolarHBondContact O-N 3.04Å; K67-F70 PolarHBondContact O-N 3.19Å; K67-E71 WeakPolarHBondContact CE-OE1 3.48Å; K67-E71 HydrophobicContact CG-CG 4.48Å; K67-E71 IonicContact NZ-OE1 3.9Å; K67-E71 WeakPolarHBondContact O-CG 3.32Å; K67-E71 PolarHBondContact O-N 2.99Å
68	K	81.7	Confident	82.3	Confident	160 Å²	160	72 Å²	72	70%	0.696	36%	0.356	S	S	*	.	H	α-helix	trans	-62	-39.9	-177.5	-67.2	-174.1	179.2	-176.4	0	111.7	E66 T72	E66-K68 PolarHBondContact O-N 2.89Å; K68-T72 WeakPolarHBondContact O-CB 3.48Å; K68-T72 PolarHBondContact O-N 2.84Å; K68-T72 VanDerWaalsContact O-N 3.1Å; K68-T72 PolarHBondContact O-OG1 3.4Å
69	S	79.1	Confident	82	Confident	65 Å²	65	74.6 Å²	74.6	46%	0.455	37%	0.369	S	S	.	.	H	α-helix	trans	-68.3	-38.3	178.3	-54.9	0	0	0	0	112.2	E66 K67 N73	E66-S69 PolarHBondContact O-N 3.35Å; K67-S69 VanDerWaalsContact C-N 3.3Å; K67-S69 PolarHBondContact O-N 3.04Å; S69-N73 PolarHBondContact O-N 3.39Å; S69-N73 VanDerWaalsContact O-N 3.13Å; S69-N73 PolarHBondContact O-ND2 2.79Å
70	F	82.8	Confident	81.9	Confident	18 Å²	18	76.3 Å²	76.3	8%	0.079	38%	0.38	C	S	.	.	H	α-helix	trans	-67.5	-45.1	176.1	179.6	-101.4	0	0	0	112.1	V29 Y32 F51 I53 E66 K67 T72 K74 F76	V29-F70 HydrophobicContact CB-CZ 4.49Å; V29-F70 HydrophobicContact CG1-CZ 4.44Å; V29-F70 HydrophobicContact CG2-CE2 4.42Å; V29-F70 HydrophobicContact CG2-CZ 4.05Å; Y32-F70 AromaticContact CD1-CE1 3.71Å; Y32-F70 HydrophobicContact CD1-CE1 3.71Å; Y32-F70 HydrophobicContact CD1-CZ 4.4Å; Y32-F70 HydrophobicContact CD2-CD1 4.12Å; Y32-F70 AromaticContact CD2-CE1 3.89Å; Y32-F70 HydrophobicContact CD2-CE1 3.89Å; Y32-F70 HydrophobicContact CE1-CE1 4.03Å; Y32-F70 HydrophobicContact CE2-CD1 4.4Å; Y32-F70 HydrophobicContact CE2-CE1 4.21Å; Y32-F70 HydrophobicContact CG-CD1 4.27Å; Y32-F70 AromaticContact CG-CE1 3.63Å; Y32-F70 HydrophobicContact CG-CE1 3.63Å; F51-F70 HydrophobicContact CE1-CB 3.77Å; F51-F70 HydrophobicContact CE1-CD1 4.18Å; F51-F70 AromaticContact CE1-CG 3.97Å; F51-F70 HydrophobicContact CE1-CG 3.97Å; F51-F70 HydrophobicContact CZ-CB 3.99Å; F51-F70 AromaticContact CZ-CD1 3.6Å; F51-F70 HydrophobicContact CZ-CD1 3.6Å; F51-F70 HydrophobicContact CZ-CE1 4.3Å; F51-F70 AromaticContact CZ-CG 3.87Å; F51-F70 HydrophobicContact CZ-CG 3.87Å; I53-F70 HydrophobicContact CD1-CD2 3.96Å; I53-F70 HydrophobicContact CD1-CE2 3.94Å; I53-F70 HydrophobicContact CD1-CG 4.34Å; I53-F70 HydrophobicContact CD1-CZ 4.29Å; E66-F70 PolarHBondContact O-N 2.95Å; K67-F70 PolarHBondContact O-N 3.19Å; F70-T72 VanDerWaalsContact C-N 3.32Å; F70-T72 PolarHBondContact O-N 3.42Å; F70-K74 VanDerWaalsContact O-CA 3.3Å; F70-K74 WeakPolarHBondContact O-CA 3.45Å; F70-K74 PolarHBondContact O-N 3.37Å; F70-F76 HydrophobicContact CD2-CB 3.65Å; F70-F76 HydrophobicContact CE2-CB 3.79Å; F70-F76 HydrophobicContact CE2-CD1 4.29Å
71	E	80.6	Confident	81.7	Confident	93 Å²	93	80.3 Å²	80.3	44%	0.435	40%	0.397	S	S	.	.	H	α-helix	trans	-64.7	-35.5	178.4	-72.5	173.8	165.4	0	0	112.5	Y32 K67	Y32-E71 HydrophobicContact CE2-CG 4.34Å; K67-E71 WeakPolarHBondContact CE-OE1 3.48Å; K67-E71 HydrophobicContact CG-CG 4.48Å; K67-E71 IonicContact NZ-OE1 3.9Å; K67-E71 WeakPolarHBondContact O-CG 3.32Å; K67-E71 PolarHBondContact O-N 2.99Å
72	T	78.8	Confident	81.4	Confident	111 Å²	111	78.9 Å²	78.9	68%	0.681	40%	0.396	S	S	*	.	H	α-helix	trans	-74.4	-43.4	-179.1	-54.9	0	0	0	0	112.1	K68 F70	K68-T72 WeakPolarHBondContact O-CB 3.48Å; K68-T72 PolarHBondContact O-N 2.84Å; K68-T72 VanDerWaalsContact O-N 3.1Å; K68-T72 PolarHBondContact O-OG1 3.4Å; F70-T72 VanDerWaalsContact C-N 3.32Å; F70-T72 PolarHBondContact O-N 3.42Å
73	N	76.8	Confident	81.3	Confident	69 Å²	69	82.5 Å²	82.5	37%	0.369	42%	0.418	S	S	.	.	H	α-helix	trans	-110.1	-8.4	-168.4	-52.2	-64.8	0	0	0	115.3	S69 Y75	S69-N73 PolarHBondContact O-N 3.39Å; S69-N73 VanDerWaalsContact O-N 3.13Å; S69-N73 PolarHBondContact O-ND2 2.79Å; N73-Y75 HydrophobicContact CB-CD1 3.39Å; N73-Y75 HydrophobicContact CB-CD2 4.32Å; N73-Y75 HydrophobicContact CB-CE1 3.05Å; N73-Y75 HydrophobicContact CB-CE2 3.99Å; N73-Y75 HydrophobicContact CB-CG 4.04Å; N73-Y75 VanDerWaalsContact CG-CZ 3.49Å; N73-Y75 VanDerWaalsContact CG-OH 3.28Å; N73-Y75 PolarHBondContact ND2-OH 3.17Å; N73-Y75 VanDerWaalsContact ND2-OH 3.11Å; N73-Y75 WeakPolarHBondContact O-CD1 3.49Å; N73-Y75 PolarHBondContact O-N 2.94Å
74	K	72.2	Confident	81.2	Confident	163 Å²	163	82 Å²	82	71%	0.709	41%	0.414	S	S	*	.	S	Bend	trans	57.5	5.6	-177.5	-60.2	-167.8	176	-174.7	0	116.4	T27 F70	T27-K74 PolarHBondContact OG1-O 3.22Å; F70-K74 VanDerWaalsContact O-CA 3.3Å; F70-K74 WeakPolarHBondContact O-CA 3.45Å; F70-K74 PolarHBondContact O-N 3.37Å
75	Y	71.4	Confident	81.2	Confident	146 Å²	146	81.1 Å²	81.1	57%	0.573	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-99	139.5	165.2	58.4	-108.2	0	0	0	110.2	N73	N73-Y75 HydrophobicContact CB-CD1 3.39Å; N73-Y75 HydrophobicContact CB-CD2 4.32Å; N73-Y75 HydrophobicContact CB-CE1 3.05Å; N73-Y75 HydrophobicContact CB-CE2 3.99Å; N73-Y75 HydrophobicContact CB-CG 4.04Å; N73-Y75 VanDerWaalsContact CG-CZ 3.49Å; N73-Y75 VanDerWaalsContact CG-OH 3.28Å; N73-Y75 PolarHBondContact ND2-OH 3.17Å; N73-Y75 VanDerWaalsContact ND2-OH 3.11Å; N73-Y75 WeakPolarHBondContact O-CD1 3.49Å; N73-Y75 PolarHBondContact O-N 2.94Å
76	F	73.1	Confident	81.3	Confident	39 Å²	39	77.1 Å²	77.1	17%	0.171	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-97.2	152.7	170.6	63.2	-95.1	0	0	0	110.8	T27 V29 I53 K55 L60 Y62 F70 I78	T27-F76 HydrophobicContact CG2-CD1 3.93Å; T27-F76 HydrophobicContact CG2-CE1 3.44Å; T27-F76 VanDerWaalsContact CG2-CE1 3.44Å; T27-F76 HydrophobicContact CG2-CZ 4.42Å; V29-F76 HydrophobicContact CG2-CD1 4.38Å; I53-F76 HydrophobicContact CD1-CB 3.58Å; I53-F76 HydrophobicContact CD1-CG 4.23Å; K55-F76 HydrophobicContact CD-CE1 3.78Å; K55-F76 HydrophobicContact CD-CZ 3.68Å; L60-F76 HydrophobicContact CD1-CD2 4.44Å; L60-F76 HydrophobicContact CD1-CE2 4.09Å; L60-F76 HydrophobicContact CD1-CZ 4.5Å; Y62-F76 VanDerWaalsContact OH-CD2 3.31Å; Y62-F76 WeakPolarHBondContact OH-CD2 3.36Å; F70-F76 HydrophobicContact CD2-CB 3.65Å; F70-F76 HydrophobicContact CE2-CB 3.79Å; F70-F76 HydrophobicContact CE2-CD1 4.29Å; F76-I78 PolarHBondContact O-N 3.19Å
77	N	76.3	Confident	81.2	Confident	70 Å²	70	76.7 Å²	76.7	37%	0.374	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-66	127.9	176.9	178.8	-1.1	0	0	0	110.4	Y62 E66 H79	Y62-N77 HydrophobicContact CD1-CB 4.3Å; Y62-N77 HydrophobicContact CE1-CB 3.84Å; Y62-N77 WeakPolarHBondContact CE1-O 3.49Å; Y62-N77 VanDerWaalsContact CZ-O 3.29Å; Y62-N77 PolarHBondContact OH-O 2.91Å; E66-N77 PolarHBondContact OE2-ND2 2.9Å; E66-N77 VanDerWaalsContact OE2-ND2 3.13Å; N77-H79 PolarHBondContact O-N 2.95Å; N77-H79 VanDerWaalsContact O-N 3.13Å; N77-H79 PolarHBondContact OD1-N 3.45Å
78	I	79.2	Confident	80.8	Confident	132 Å²	132	76 Å²	76	68%	0.677	41%	0.406	S	S	*	.	S	Bend	trans	-67.8	-9.5	-179.9	60.2	170.8	0	0	0	113.7	F76 P80	F76-I78 PolarHBondContact O-N 3.19Å; I78-P80 WeakPolarHBondContact O-CD 3.35Å
79	H	80.8	Confident	81	Confident	139 Å²	139	69.3 Å²	69.3	64%	0.644	38%	0.379	S	S	*	.	S	Bend	trans	-114.1	80.4	179.7	-60.2	-54.8	0	0	0	112.1	N77	N77-H79 PolarHBondContact O-N 2.95Å; N77-H79 VanDerWaalsContact O-N 3.13Å; N77-H79 PolarHBondContact OD1-N 3.45Å
80	P	88.3	Confident	81.2	Confident	36 Å²	36	71.8 Å²	71.8	23%	0.234	39%	0.386	C	S	.	.			trans	-66.7	155.1	173.9	30.5	-36.9	0	0	0	112	L60 Y62 I78 G82 V83	L60-P80 HydrophobicContact CB-CB 4.34Å; L60-P80 HydrophobicContact CD2-CB 4.36Å; L60-P80 HydrophobicContact CD2-CG 4.03Å; Y62-P80 HydrophobicContact CD1-CB 4.21Å; Y62-P80 HydrophobicContact CE1-CB 3.65Å; Y62-P80 HydrophobicContact CE2-CB 4.3Å; I78-P80 WeakPolarHBondContact O-CD 3.35Å; P80-G82 PolarHBondContact O-N 2.98Å; P80-V83 HydrophobicContact CB-CG2 4.36Å; P80-V83 HydrophobicContact CG-CG2 3.43Å; P80-V83 VanDerWaalsContact CG-CG2 3.43Å
81	K	86.8	Confident	81.5	Confident	103 Å²	103	71.3 Å²	71.3	45%	0.448	39%	0.385	S	S	.	.	S	Bend	trans	-71	-15.9	171.2	-65.5	-166.9	179	-177.9	0	112.7	Y61 S63	Y61-K81 HydrophobicContact CD2-CB 3.8Å; Y61-K81 HydrophobicContact CE2-CB 3.47Å; Y61-K81 VanDerWaalsContact CE2-CB 3.47Å; Y61-K81 WeakPolarHBondContact O-CB 3.33Å; Y61-K81 PolarHBondContact O-N 3.47Å; Y61-K81 PolarHBondContact OH-O 2.87Å; Y61-K81 VanDerWaalsContact OH-O 3.07Å; S63-K81 WeakPolarHBondContact OG-CE 3.41Å; S63-K81 PolarHBondContact OG-NZ 3.33Å
82	G	85.6	Confident	81.8	Confident	16 Å²	16	71.3 Å²	71.3	17%	0.165	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176	156.7	167.3	0	0	0	0	0	111.2	Y61 P80	Y61-G82 WeakPolarHBondContact CD1-O 3.21Å; Y61-G82 VanDerWaalsContact CE1-CA 3.43Å; Y61-G82 VanDerWaalsContact CZ-CA 3.49Å; Y61-G82 PolarHBondContact N-O 2.98Å; Y61-G82 PolarHBondContact O-N 3.4Å; P80-G82 PolarHBondContact O-N 2.98Å
83	V	87.6	Confident	82.2	Confident	78 Å²	78	70.4 Å²	70.4	47%	0.473	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.6	-179.6	-175.7	0	0	0	0	107.2	F58 L60 P80	F58-V83 HydrophobicContact CB-CG1 4.19Å; F58-V83 HydrophobicContact CD1-CG1 3.69Å; F58-V83 HydrophobicContact CG-CG1 4.28Å; L60-V83 HydrophobicContact CD2-CB 4.23Å; L60-V83 HydrophobicContact CD2-CG1 3.86Å; L60-V83 HydrophobicContact CD2-CG2 3.71Å; P80-V83 HydrophobicContact CB-CG2 4.36Å; P80-V83 HydrophobicContact CG-CG2 3.43Å; P80-V83 VanDerWaalsContact CG-CG2 3.43Å
84	I	86.6	Confident	82.6	Confident	11 Å²	11	71.1 Å²	71.1	6%	0.056	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	113	177	-59.6	161.2	0	0	0	106.9	L59 Y61 L86 F110 I114	L59-I84 HydrophobicContact CB-CB 4.17Å; L59-I84 HydrophobicContact CD2-CD1 3.96Å; L59-I84 HydrophobicContact CG-CD1 4.45Å; L59-I84 PolarHBondContact N-O 3.45Å; L59-I84 PolarHBondContact O-N 3.35Å; Y61-I84 HydrophobicContact CD1-CD1 4.26Å; Y61-I84 HydrophobicContact CE1-CD1 4.44Å; I84-L86 HydrophobicContact CG2-CD2 4.47Å; I84-L86 PolarHBondContact O-N 2.97Å; I84-F110 HydrophobicContact CG2-CE2 4.13Å; I84-F110 HydrophobicContact CG2-CZ 3.87Å; I84-I114 HydrophobicContact CD1-CD1 3.7Å; I84-I114 HydrophobicContact CD1-CG2 4.27Å; I84-I114 HydrophobicContact CG1-CD1 3.86Å; I84-I114 HydrophobicContact CG2-CD1 3.84Å
85	P	86.8	Confident	82.9	Confident	61 Å²	61	71.4 Å²	71.4	40%	0.396	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	128.4	171.8	29	-31.8	0	0	0	108.9	F58 C89 F110	F58-P85 HydrophobicContact CD1-CB 4.29Å; F58-P85 HydrophobicContact CE1-CB 4.14Å; P85-C89 PolarHBondContact O-SG 3.14Å; P85-F110 HydrophobicContact CG-CE1 4.36Å; P85-F110 HydrophobicContact CG-CZ 4.5Å
86	L	85.4	Confident	83.3	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	37%	0.366	C	S	.	.			trans	-92.5	-11.7	-179.4	-59.8	175.5	0	0	0	112.6	I54 S57 L59 I84 G88 C89 L131 G135	I54-L86 HydrophobicContact CG2-CD1 4Å; S57-L86 VanDerWaalsContact O-CB 3.29Å; S57-L86 WeakPolarHBondContact O-CB 3.3Å; S57-L86 PolarHBondContact O-N 2.93Å; L59-L86 HydrophobicContact CB-CD1 4.1Å; L59-L86 HydrophobicContact CB-CD2 3.81Å; L59-L86 HydrophobicContact CB-CG 4.06Å; I84-L86 HydrophobicContact CG2-CD2 4.47Å; I84-L86 PolarHBondContact O-N 2.97Å; L86-G88 PolarHBondContact O-N 3.38Å; L86-C89 WeakPolarHBondContact O-CB 3.32Å; L86-C89 PolarHBondContact O-N 3.14Å; L86-C89 VanDerWaalsContact O-N 3.14Å; L86-L131 HydrophobicContact CD1-CD2 3.73Å; L86-L131 HydrophobicContact CD2-CD2 3.66Å; L86-L131 HydrophobicContact CG-CD2 4.35Å; L86-G135 WeakPolarHBondContact O-CA 3.28Å
87	G	81.1	Confident	83.4	Confident	26 Å²	26	71 Å²	71	27%	0.268	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	126.3	173.4	0	0	0	0	0	110.6	C89	G87-C89 PolarHBondContact O-N 3.45Å; G87-C89 VanDerWaalsContact O-N 3.16Å
88	G	76.1	Confident	83.3	Confident	60 Å²	60	71.4 Å²	71.4	62%	0.619	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	1.7	179.6	0	0	0	0	0	116	L86 H107	L86-G88 PolarHBondContact O-N 3.38Å; G88-H107 VanDerWaalsContact C-CD2 3.49Å; G88-H107 PolarHBondContact O-CD2 2.67Å
89	C	85.2	Confident	83.5	Confident	19 Å²	19	66.8 Å²	66.8	13%	0.128	39%	0.385	C	S	.	.			trans	-75	137.5	-179.9	-75.2	0	0	0	0	112.2	P85 L86 G87 I105 S106	P85-C89 PolarHBondContact O-SG 3.14Å; L86-C89 WeakPolarHBondContact O-CB 3.32Å; L86-C89 PolarHBondContact O-N 3.14Å; L86-C89 VanDerWaalsContact O-N 3.14Å; G87-C89 PolarHBondContact O-N 3.45Å; G87-C89 VanDerWaalsContact O-N 3.16Å; C89-I105 HydrophobicContact CB-CG2 3.9Å; C89-S106 WeakPolarHBondContact CA-O 3.41Å
90	L	84.1	Confident	83.5	Confident	117 Å²	117	63.7 Å²	63.7	61%	0.613	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	117.6	169.1	-68.5	170.4	0	0	0	109.1	I105 S106	L90-I105 WeakPolarHBondContact O-CA 3.43Å; L90-S106 PolarHBondContact N-O 3.26Å; L90-S106 PolarHBondContact O-N 3.02Å; L90-S106 PolarHBondContact O-OG 3.46Å
91	V	88	Confident	83.5	Confident	8 Å²	8	66 Å²	66	5%	0.048	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	114.7	-178.9	-173	0	0	0	0	109.1	K104 I105 L128 L131 Q132	V91-K104 WeakPolarHBondContact CA-O 3.45Å; V91-I105 HydrophobicContact CG1-CG1 4.26Å; V91-I105 HydrophobicContact CG2-CG1 4.18Å; V91-I105 HydrophobicContact CG2-CG2 4.31Å; V91-L128 HydrophobicContact CG1-CD1 4.31Å; V91-L128 HydrophobicContact CG1-CG 4.16Å; V91-L131 HydrophobicContact CG1-CB 4.23Å; V91-L131 HydrophobicContact CG1-CD1 4.06Å; V91-L131 HydrophobicContact CG2-CB 4.02Å; V91-Q132 HydrophobicContact CB-CG 4.1Å; V91-Q132 PolarHBondContact O-NE2 2.9Å
92	E	87.9	Confident	83.5	Confident	93 Å²	93	61.1 Å²	61.1	44%	0.435	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.6	-175	-59.6	178.1	124.3	0	0	110.7	M103 K104	E92-M103 CarbonylContact O-C 3.6Å; E92-M103 WeakPolarHBondContact O-CA 3.39Å; E92-K104 PolarHBondContact N-O 3.13Å; E92-K104 PolarHBondContact O-N 2.97Å; E92-K104 IonicContact OE2-NZ 3.56Å; E92-K104 PolarHBondContact OE2-NZ 3.02Å; E92-K104 VanDerWaalsContact OE2-NZ 3.11Å
93	P	87.1	Confident	83.8	Confident	92 Å²	92	60.3 Å²	60.3	60%	0.597	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	144.4	168.9	31.3	-32.1	0	0	0	109.6	L128	P93-L128 HydrophobicContact CB-CD1 4.14Å; P93-L128 HydrophobicContact CG-CD1 4.34Å
94	K	84.7	Confident	83.9	Confident	84 Å²	84	58.8 Å²	58.8	37%	0.365	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	130.8	177.6	-168.2	-176.6	-173	-161.4	0	110	E96 A102 K104 L115	K94-E96 WeakPolarHBondContact CE-OE1 3.12Å; K94-E96 IonicContact NZ-OE1 3.66Å; K94-E96 PolarHBondContact NZ-OE1 2.86Å; K94-A102 CarbonylContact C-O 3.5Å; K94-A102 PolarHBondContact N-O 3.4Å; K94-A102 CarbonylContact O-C 3.25Å; K94-A102 WeakPolarHBondContact O-CA 3.46Å; K94-A102 WeakPolarHBondContact O-CB 3.41Å; K94-A102 PolarHBondContact O-N 3.36Å; K94-K104 HydrophobicContact CB-CB 4.36Å; K94-L115 HydrophobicContact CD-CD2 4.02Å
95	E	79.8	Confident	84	Confident	168 Å²	168	58.2 Å²	58.2	79%	0.785	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	128.2	172.2	-62.7	-179.2	-179.6	0	0	109.9
96	E	79.1	Confident	83.9	Confident	39 Å²	39	56.1 Å²	56.1	18%	0.182	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.4	173.6	-73.8	-77.9	167.2	0	0	109.6	K94 S98 M99 A102	K94-E96 WeakPolarHBondContact CE-OE1 3.12Å; K94-E96 IonicContact NZ-OE1 3.66Å; K94-E96 PolarHBondContact NZ-OE1 2.86Å; E96-S98 PolarHBondContact O-N 3.33Å; E96-M99 PolarHBondContact N-O 3.21Å; E96-M99 CarbonylContact O-C 3.57Å; E96-M99 VanDerWaalsContact O-C 3.25Å; E96-M99 PolarHBondContact O-N 2.86Å; E96-M99 VanDerWaalsContact O-O 3.12Å; E96-A102 HydrophobicContact CG-CB 4.31Å
97	P	75	Confident	83.9	Confident	138 Å²	138	58.6 Å²	58.6	90%	0.896	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-21.9	-172.9	-27.3	34.2	0	0	0	115.8
98	S	75.2	Confident	83.8	Confident	79 Å²	79	66.4 Å²	66.4	55%	0.552	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-8.7	178.2	68	0	0	0	0	114.4	W47 E96	W47-S98 PolarHBondContact NE1-OG 3.49Å; E96-S98 PolarHBondContact O-N 3.33Å
99	M	83.3	Confident	83.8	Confident	34 Å²	34	69.4 Å²	69.4	17%	0.167	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	93.4	-173.5	-70.1	-64.1	177.4	0	0	108.6	W36 W47 E96 Y101 A102 A117	W36-M99 HydrophobicContact CB-CE 4.47Å; W36-M99 HydrophobicContact CD2-CE 3.82Å; W36-M99 HydrophobicContact CE3-CE 4.09Å; W36-M99 HydrophobicContact CG-CE 4Å; W36-M99 HydrophobicContact CG-SD 4.45Å; W47-M99 HydrophobicContact CB-CE 4.25Å; W47-M99 HydrophobicContact CD2-CG 4.11Å; W47-M99 HydrophobicContact CG-CE 4.2Å; W47-M99 HydrophobicContact CG-CG 4.41Å; W47-M99 HydrophobicContact CZ2-CB 4.3Å; W47-M99 HydrophobicContact CZ2-CG 4.13Å; E96-M99 PolarHBondContact N-O 3.21Å; E96-M99 CarbonylContact O-C 3.57Å; E96-M99 VanDerWaalsContact O-C 3.25Å; E96-M99 PolarHBondContact O-N 2.86Å; E96-M99 VanDerWaalsContact O-O 3.12Å; M99-Y101 VanDerWaalsContact C-N 3.34Å; M99-Y101 PolarHBondContact O-N 3.24Å; M99-A102 HydrophobicContact CB-CB 4.5Å; M99-A117 HydrophobicContact CB-CB 3.84Å; M99-A117 HydrophobicContact CG-CB 4.1Å; M99-A117 HydrophobicContact SD-CB 4.36Å
100	P	79.8	Confident	83.6	Confident	75 Å²	75	70.5 Å²	70.5	49%	0.487	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	-33.5	-174.4	24.8	-32.8	0	0	0	112.7	A102	P100-A102 VanDerWaalsContact C-N 3.31Å; P100-A102 PolarHBondContact O-N 2.97Å
101	Y	88.4	Confident	82.8	Confident	84 Å²	84	73.4 Å²	73.4	33%	0.329	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	45.2	-177.8	-45.5	-59.2	0	0	0	112.7	M99 A117 A118 E121	M99-Y101 VanDerWaalsContact C-N 3.34Å; M99-Y101 PolarHBondContact O-N 3.24Å; Y101-A117 WeakPolarHBondContact O-CA 3.45Å; Y101-A118 PolarHBondContact O-N 3Å; Y101-E121 HydrophobicContact CD1-CB 3.93Å; Y101-E121 HydrophobicContact CE1-CB 3.72Å
102	A	87.6	Confident	82.1	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	154.6	178.4	0	0	0	0	0	112.4	W47 K94 E96 M99 P100 L116 A117 Q124	W47-A102 HydrophobicContact CH2-CB 4.44Å; K94-A102 CarbonylContact C-O 3.5Å; K94-A102 PolarHBondContact N-O 3.4Å; K94-A102 CarbonylContact O-C 3.25Å; K94-A102 WeakPolarHBondContact O-CA 3.46Å; K94-A102 WeakPolarHBondContact O-CB 3.41Å; K94-A102 PolarHBondContact O-N 3.36Å; E96-A102 HydrophobicContact CG-CB 4.31Å; M99-A102 HydrophobicContact CB-CB 4.5Å; P100-A102 VanDerWaalsContact C-N 3.31Å; P100-A102 PolarHBondContact O-N 2.97Å; A102-L116 CarbonylContact C-O 3.35Å; A102-L116 VanDerWaalsContact CA-O 3.25Å; A102-L116 WeakPolarHBondContact CA-O 3.29Å; A102-A117 HydrophobicContact CB-CB 3.98Å; A102-Q124 PolarHBondContact O-NE2 3.29Å
103	M	90.8	Very high	81.9	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	141.8	178.5	63.9	-173.1	67.6	0	0	108.9	E92 L115 L116 A118 Q124 W127 L131	E92-M103 CarbonylContact O-C 3.6Å; E92-M103 WeakPolarHBondContact O-CA 3.39Å; M103-L115 WeakPolarHBondContact O-CA 3.44Å; M103-L116 HydrophobicContact CG-CB 3.66Å; M103-L116 PolarHBondContact N-O 3.31Å; M103-L116 PolarHBondContact O-N 2.93Å; M103-L116 HydrophobicContact SD-CB 4.12Å; M103-L116 HydrophobicContact SD-CD1 4.46Å; M103-A118 HydrophobicContact CE-CB 4.38Å; M103-Q124 HydrophobicContact CE-CB 4.26Å; M103-Q124 HydrophobicContact CE-CG 3.89Å; M103-W127 HydrophobicContact CE-CB 3.72Å; M103-W127 HydrophobicContact SD-CB 4.04Å; M103-L131 HydrophobicContact SD-CD1 3.94Å
104	K	88.9	Confident	81.8	Confident	45 Å²	45	70.6 Å²	70.6	20%	0.196	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.8	-174.6	179.2	-167.7	160.1	-141.3	0	108.6	V91 E92 K94 N113 I114 L115	V91-K104 WeakPolarHBondContact CA-O 3.45Å; E92-K104 PolarHBondContact N-O 3.13Å; E92-K104 PolarHBondContact O-N 2.97Å; E92-K104 IonicContact OE2-NZ 3.56Å; E92-K104 PolarHBondContact OE2-NZ 3.02Å; E92-K104 VanDerWaalsContact OE2-NZ 3.11Å; K94-K104 HydrophobicContact CB-CB 4.36Å; K104-N113 HydrophobicContact CD-CB 4.45Å; K104-N113 VanDerWaalsContact CE-ND2 3.3Å; K104-N113 WeakPolarHBondContact CE-ND2 3.27Å; K104-N113 WeakPolarHBondContact CE-OD1 3.34Å; K104-N113 HydrophobicContact CG-CB 3.96Å; K104-I114 WeakPolarHBondContact CA-O 3.42Å; K104-L115 HydrophobicContact CB-CD2 3.78Å; K104-L115 HydrophobicContact CG-CD2 3.95Å
105	I	89.1	Confident	82	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.3	172.2	-52	175.4	0	0	0	107.5	L59 C89 L90 V91 F110 I114 L116 L131	L59-I105 HydrophobicContact CD2-CD1 3.91Å; C89-I105 HydrophobicContact CB-CG2 3.9Å; L90-I105 WeakPolarHBondContact O-CA 3.43Å; V91-I105 HydrophobicContact CG1-CG1 4.26Å; V91-I105 HydrophobicContact CG2-CG1 4.18Å; V91-I105 HydrophobicContact CG2-CG2 4.31Å; I105-F110 HydrophobicContact CG2-CE2 4.29Å; I105-I114 HydrophobicContact CB-CB 4.24Å; I105-I114 PolarHBondContact N-O 2.88Å; I105-I114 PolarHBondContact O-N 3.05Å; I105-L116 HydrophobicContact CD1-CD1 3.75Å; I105-L116 HydrophobicContact CD1-CG 4.49Å; I105-L131 HydrophobicContact CD1-CD1 4.04Å; I105-L131 HydrophobicContact CD1-CD2 4.42Å
106	S	85.3	Confident	82.4	Confident	17 Å²	17	59.3 Å²	59.3	12%	0.119	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.5	-177.6	58.6	0	0	0	0	111.3	C89 L90 N113	C89-S106 WeakPolarHBondContact CA-O 3.41Å; L90-S106 PolarHBondContact N-O 3.26Å; L90-S106 PolarHBondContact O-N 3.02Å; L90-S106 PolarHBondContact O-OG 3.46Å; S106-N113 WeakPolarHBondContact CB-OD1 3.44Å
107	H	84.8	Confident	83	Confident	52 Å²	52	57.5 Å²	57.5	24%	0.241	31%	0.31	C	S	.	.			trans	-143.3	150.5	175.8	-168.3	-97.4	0	0	0	108.5	G88 D109 F110	G88-H107 VanDerWaalsContact C-CD2 3.49Å; G88-H107 PolarHBondContact O-CD2 2.67Å; H107-D109 IonicContact CE1-OD2 3.84Å; H107-D109 PolarHBondContact CE1-OD2 2.91Å; H107-D109 WeakPolarHBondContact ND1-CB 3.34Å; H107-D109 PolarHBondContact ND1-N 3.39Å; H107-D109 VanDerWaalsContact ND1-N 3.12Å; H107-D109 IonicContact ND1-OD2 3.6Å; H107-D109 PolarHBondContact O-N 3.45Å; H107-F110 HydrophobicContact CB-CB 4.29Å; H107-F110 HydrophobicContact CB-CD1 3.8Å; H107-F110 HydrophobicContact CB-CD2 3.54Å; H107-F110 HydrophobicContact CB-CE1 3.89Å; H107-F110 HydrophobicContact CB-CE2 3.65Å; H107-F110 HydrophobicContact CB-CG 3.61Å; H107-F110 HydrophobicContact CB-CZ 3.81Å; H107-F110 PolarHBondContact O-N 3Å; H107-F110 VanDerWaalsContact O-N 3.09Å
108	Q	79.1	Confident	83.7	Confident	191 Å²	191	51.1 Å²	51.1	89%	0.893	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-33.1	-179.1	-63	-177.7	18	0	0	112	F110	Q108-F110 VanDerWaalsContact C-N 3.35Å
109	D	77.2	Confident	84.3	Confident	122 Å²	122	52.1 Å²	52.1	65%	0.652	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.7	178.7	-55.5	-31.1	0	0	0	114	H107	H107-D109 IonicContact CE1-OD2 3.84Å; H107-D109 PolarHBondContact CE1-OD2 2.91Å; H107-D109 WeakPolarHBondContact ND1-CB 3.34Å; H107-D109 PolarHBondContact ND1-N 3.39Å; H107-D109 VanDerWaalsContact ND1-N 3.12Å; H107-D109 IonicContact ND1-OD2 3.6Å; H107-D109 PolarHBondContact O-N 3.45Å
110	F	79.9	Confident	84.5	Confident	42 Å²	42	52.4 Å²	52.4	18%	0.184	27%	0.27	C	S	.	.	S	Bend	trans	-83.7	129.8	176.1	-66.7	-7.4	0	0	0	110.2	F40 I84 P85 I105 H107 Q108 G112 I114	F40-F110 HydrophobicContact CZ-CB 4.29Å; I84-F110 HydrophobicContact CG2-CE2 4.13Å; I84-F110 HydrophobicContact CG2-CZ 3.87Å; P85-F110 HydrophobicContact CG-CE1 4.36Å; P85-F110 HydrophobicContact CG-CZ 4.5Å; I105-F110 HydrophobicContact CG2-CE2 4.29Å; H107-F110 HydrophobicContact CB-CB 4.29Å; H107-F110 HydrophobicContact CB-CD1 3.8Å; H107-F110 HydrophobicContact CB-CD2 3.54Å; H107-F110 HydrophobicContact CB-CE1 3.89Å; H107-F110 HydrophobicContact CB-CE2 3.65Å; H107-F110 HydrophobicContact CB-CG 3.61Å; H107-F110 HydrophobicContact CB-CZ 3.81Å; H107-F110 PolarHBondContact O-N 3Å; H107-F110 VanDerWaalsContact O-N 3.09Å; Q108-F110 VanDerWaalsContact C-N 3.35Å; F110-G112 VanDerWaalsContact CB-O 3.26Å; F110-G112 WeakPolarHBondContact CB-O 3.44Å; F110-G112 PolarHBondContact O-N 3.33Å; F110-I114 HydrophobicContact CD2-CD1 4.06Å; F110-I114 HydrophobicContact CD2-CG1 4.39Å; F110-I114 HydrophobicContact CE2-CD1 3.86Å
111	H	67	Low	84.9	Confident	179 Å²	179	55 Å²	55	83%	0.829	28%	0.276	S	S	*	.	S	Bend	trans	-75.3	45.8	173.7	-61.7	71.7	0	0	0	111.8	F40	F40-H111 HydrophobicContact CZ-CB 4.36Å
112	G	75	Confident	84.9	Confident	34 Å²	34	58.4 Å²	58.4	35%	0.351	29%	0.293	S	S	.	.	S	Bend	trans	139.7	174.5	-175.7	0	0	0	0	0	113.4	F40 F110	F40-G112 WeakPolarHBondContact CE2-O 3.38Å; F110-G112 VanDerWaalsContact CB-O 3.26Å; F110-G112 WeakPolarHBondContact CB-O 3.44Å; F110-G112 PolarHBondContact O-N 3.33Å
113	N	82.4	Confident	85	Confident	88 Å²	88	61.4 Å²	61.4	47%	0.471	31%	0.307	S	S	.	.			trans	-93.5	138.5	173.8	-61.4	-49.5	0	0	0	110.6	K104 S106	K104-N113 HydrophobicContact CD-CB 4.45Å; K104-N113 VanDerWaalsContact CE-ND2 3.3Å; K104-N113 WeakPolarHBondContact CE-ND2 3.27Å; K104-N113 WeakPolarHBondContact CE-OD1 3.34Å; K104-N113 HydrophobicContact CG-CB 3.96Å; S106-N113 WeakPolarHBondContact CB-OD1 3.44Å
114	I	86.2	Confident	85	Confident	11 Å²	11	62.5 Å²	62.5	6%	0.056	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.9	172.7	-57.3	174.1	0	0	0	107.7	F40 I84 K104 I105 F110 L116	F40-I114 HydrophobicContact CD2-CG1 3.75Å; F40-I114 HydrophobicContact CE2-CG1 3.97Å; I84-I114 HydrophobicContact CD1-CD1 3.7Å; I84-I114 HydrophobicContact CD1-CG2 4.27Å; I84-I114 HydrophobicContact CG1-CD1 3.86Å; I84-I114 HydrophobicContact CG2-CD1 3.84Å; K104-I114 WeakPolarHBondContact CA-O 3.42Å; I105-I114 HydrophobicContact CB-CB 4.24Å; I105-I114 PolarHBondContact N-O 2.88Å; I105-I114 PolarHBondContact O-N 3.05Å; F110-I114 HydrophobicContact CD2-CD1 4.06Å; F110-I114 HydrophobicContact CD2-CG1 4.39Å; F110-I114 HydrophobicContact CE2-CD1 3.86Å; I114-L116 HydrophobicContact CG2-CD2 4.2Å; I114-L116 HydrophobicContact CG2-CG 4.36Å
115	L	87.4	Confident	85	Confident	16 Å²	16	64.1 Å²	64.1	8%	0.084	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.8	177.9	-65.7	172.3	0	0	0	109.8	R38 W47 K94 M103 K104	R38-L115 HydrophobicContact CB-CB 4.12Å; R38-L115 PolarHBondContact N-O 2.97Å; W47-L115 HydrophobicContact CH2-CB 3.95Å; W47-L115 HydrophobicContact CZ3-CB 4.39Å; K94-L115 HydrophobicContact CD-CD2 4.02Å; M103-L115 WeakPolarHBondContact O-CA 3.44Å; K104-L115 HydrophobicContact CB-CD2 3.78Å; K104-L115 HydrophobicContact CG-CD2 3.95Å
116	L	89.8	Confident	85.1	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	155.4	172.9	-53.5	178.3	0	0	0	109	L35 W36 K37 F52 L59 A102 M103 I105 I114	L35-L116 HydrophobicContact CD1-CB 4.36Å; L35-L116 HydrophobicContact CD1-CD1 4.02Å; W36-L116 CarbonylContact O-C 3.53Å; W36-L116 WeakPolarHBondContact O-CA 3.36Å; K37-L116 HydrophobicContact CB-CD2 4.02Å; K37-L116 HydrophobicContact CG-CD2 3.87Å; F52-L116 HydrophobicContact CE1-CD1 4.28Å; F52-L116 HydrophobicContact CE1-CD2 3.9Å; F52-L116 HydrophobicContact CE2-CD2 4.11Å; F52-L116 HydrophobicContact CZ-CD1 4.42Å; F52-L116 HydrophobicContact CZ-CD2 3.4Å; L59-L116 HydrophobicContact CD2-CD1 3.89Å; A102-L116 CarbonylContact C-O 3.35Å; A102-L116 VanDerWaalsContact CA-O 3.25Å; A102-L116 WeakPolarHBondContact CA-O 3.29Å; M103-L116 HydrophobicContact CG-CB 3.66Å; M103-L116 PolarHBondContact N-O 3.31Å; M103-L116 PolarHBondContact O-N 2.93Å; M103-L116 HydrophobicContact SD-CB 4.12Å; M103-L116 HydrophobicContact SD-CD1 4.46Å; I105-L116 HydrophobicContact CD1-CD1 3.75Å; I105-L116 HydrophobicContact CD1-CG 4.49Å; I114-L116 HydrophobicContact CG2-CD2 4.2Å; I114-L116 HydrophobicContact CG2-CG 4.36Å
117	A	89.9	Confident	85.4	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	137.8	169.9	0	0	0	0	0	111.1	W36 W47 M99 Y101 A102	W36-A117 HydrophobicContact CB-CB 4.13Å; W36-A117 PolarHBondContact N-O 3.49Å; W36-A117 PolarHBondContact O-N 3.4Å; W47-A117 HydrophobicContact CH2-CB 4.26Å; W47-A117 HydrophobicContact CZ3-CB 4.02Å; M99-A117 HydrophobicContact CB-CB 3.84Å; M99-A117 HydrophobicContact CG-CB 4.1Å; M99-A117 HydrophobicContact SD-CB 4.36Å; Y101-A117 WeakPolarHBondContact O-CA 3.45Å; A102-A117 HydrophobicContact CB-CB 3.98Å
118	A	90.9	Very high	85.7	Confident	5 Å²	5	66.5 Å²	66.5	4%	0.041	34%	0.335	C	S	.	.			trans	-90.7	168	175.1	0	0	0	0	0	110.9	L35 Y101 M103 E123 Q124	L35-A118 HydrophobicContact CD2-CB 3.96Å; Y101-A118 PolarHBondContact O-N 3Å; M103-A118 HydrophobicContact CE-CB 4.38Å; A118-E123 HydrophobicContact CB-CB 3.81Å; A118-Q124 HydrophobicContact CB-CB 4.01Å
119	E	86.9	Confident	86.2	Confident	100 Å²	100	63.7 Å²	63.7	47%	0.467	32%	0.322	S	S	.	.	S	Bend	trans	-84.6	-20.1	178.1	-63	-172.9	166.2	0	0	112.2	R49 E123	R49-E119 IonicContact CZ-OE1 3.85Å; R49-E119 IonicContact NH1-OE1 2.76Å; R49-E119 PolarHBondContact NH1-OE1 3Å; R49-E119 IonicContact NH2-OE1 3.73Å; R49-E119 PolarHBondContact NH2-OE1 3.02Å; E119-E123 PolarHBondContact N-OE2 2.94Å
120	S	88.1	Confident	86.7	Confident	39 Å²	39	60.3 Å²	60.3	27%	0.273	30%	0.303	S	S	.	.	S	Bend	trans	-140.8	159.6	179.1	66.9	0	0	0	0	112.7	F122 E123 Q124	S120-F122 VanDerWaalsContact C-N 3.26Å; S120-F122 PolarHBondContact O-N 3.44Å; S120-E123 PolarHBondContact O-N 2.89Å; S120-E123 WeakPolarHBondContact OG-CG 3.3Å; S120-E123 PolarHBondContact OG-N 2.94Å; S120-Q124 WeakPolarHBondContact O-CB 3.43Å; S120-Q124 PolarHBondContact O-N 2.91Å
121	E	88.5	Confident	87.1	Confident	130 Å²	130	58.4 Å²	58.4	61%	0.607	30%	0.295	S	S	*	.	H	α-helix	trans	-58.9	-37.6	172.5	-174.4	179.6	-170.5	0	0	112.2	Y101 Q124 T125	Y101-E121 HydrophobicContact CD1-CB 3.93Å; Y101-E121 HydrophobicContact CE1-CB 3.72Å; E121-Q124 PolarHBondContact O-N 3.06Å; E121-T125 PolarHBondContact O-N 2.9Å; E121-T125 PolarHBondContact O-OG1 2.88Å
122	F	88.5	Confident	88	Confident	155 Å²	155	53.7 Å²	53.7	68%	0.68	27%	0.273	S	S	*	.	H	α-helix	trans	-63.1	-49.2	177.7	180	-96.8	0	0	0	111.5	S120 Q124 T125 Q126	S120-F122 VanDerWaalsContact C-N 3.26Å; S120-F122 PolarHBondContact O-N 3.44Å; F122-Q124 VanDerWaalsContact C-N 3.35Å; F122-Q124 PolarHBondContact O-N 3.4Å; F122-T125 PolarHBondContact O-N 3.41Å; F122-Q126 PolarHBondContact O-N 3.46Å
123	E	89.6	Confident	88.5	Confident	64 Å²	64	55.7 Å²	55.7	30%	0.299	27%	0.273	S	S	.	.	H	α-helix	trans	-63	-41.8	176	-75	-177.9	165.6	0	0	111.5	A118 E119 S120 T125 Q126 W127	A118-E123 HydrophobicContact CB-CB 3.81Å; E119-E123 PolarHBondContact N-OE2 2.94Å; S120-E123 PolarHBondContact O-N 2.89Å; S120-E123 WeakPolarHBondContact OG-CG 3.3Å; S120-E123 PolarHBondContact OG-N 2.94Å; E123-T125 VanDerWaalsContact C-N 3.3Å; E123-T125 PolarHBondContact O-N 2.98Å; E123-Q126 PolarHBondContact O-N 3.27Å; E123-W127 WeakPolarHBondContact O-CB 2.92Å; E123-W127 PolarHBondContact O-N 3.39Å
124	Q	90.4	Very high	88.6	Confident	23 Å²	23	51.5 Å²	51.5	11%	0.107	25%	0.251	C	S	.	.	H	α-helix	trans	-56.7	-46.4	177.2	-175.2	-168.3	19.2	0	0	111.4	A102 M103 A118 S120 E121 F122 W127 L128	A102-Q124 PolarHBondContact O-NE2 3.29Å; M103-Q124 HydrophobicContact CE-CB 4.26Å; M103-Q124 HydrophobicContact CE-CG 3.89Å; A118-Q124 HydrophobicContact CB-CB 4.01Å; S120-Q124 WeakPolarHBondContact O-CB 3.43Å; S120-Q124 PolarHBondContact O-N 2.91Å; E121-Q124 PolarHBondContact O-N 3.06Å; F122-Q124 VanDerWaalsContact C-N 3.35Å; F122-Q124 PolarHBondContact O-N 3.4Å; Q124-W127 PolarHBondContact O-N 3.48Å; Q124-L128 VanDerWaalsContact O-CB 3.24Å; Q124-L128 WeakPolarHBondContact O-CB 3.46Å; Q124-L128 PolarHBondContact O-N 3.41Å
125	T	89.9	Confident	88.4	Confident	79 Å²	79	51.6 Å²	51.6	49%	0.485	26%	0.255	S	S	.	.	H	α-helix	trans	-63.6	-46.8	179.4	-55.5	0	0	0	0	111	E121 F122 E123 W127 L128 E129	E121-T125 PolarHBondContact O-N 2.9Å; E121-T125 PolarHBondContact O-OG1 2.88Å; F122-T125 PolarHBondContact O-N 3.41Å; E123-T125 VanDerWaalsContact C-N 3.3Å; E123-T125 PolarHBondContact O-N 2.98Å; T125-W127 PolarHBondContact O-N 3.4Å; T125-L128 PolarHBondContact O-N 3.42Å; T125-E129 WeakPolarHBondContact O-CB 3.22Å; T125-E129 PolarHBondContact O-N 2.97Å
126	Q	90.9	Very high	88.1	Confident	81 Å²	81	56 Å²	56	38%	0.379	27%	0.273	S	S	.	.	H	α-helix	trans	-60.9	-44.2	178.4	-172.5	-177.7	20.7	0	0	112.4	L31 F122 E123 M130	L31-Q126 HydrophobicContact CD1-CG 4.23Å; L31-Q126 HydrophobicContact CD2-CG 4.3Å; F122-Q126 PolarHBondContact O-N 3.46Å; E123-Q126 PolarHBondContact O-N 3.27Å; Q126-M130 WeakPolarHBondContact O-CB 3.35Å; Q126-M130 WeakPolarHBondContact O-CG 3.42Å; Q126-M130 PolarHBondContact O-N 2.86Å; Q126-M130 VanDerWaalsContact O-N 3.13Å
127	W	91.8	Very high	87.4	Confident	7 Å²	7	57.9 Å²	57.9	3%	0.027	29%	0.285	C	S	.	.	H	α-helix	trans	-66.3	-41.8	176.7	-85.7	97.2	0	0	0	111.9	L31 L35 F52 I54 L59 M103 E123 Q124 T125 L131	L31-W127 HydrophobicContact CD2-CB 4.35Å; L31-W127 HydrophobicContact CD2-CD2 3.45Å; L31-W127 VanDerWaalsContact CD2-CD2 3.45Å; L31-W127 HydrophobicContact CD2-CE3 3.75Å; L31-W127 HydrophobicContact CD2-CG 3.76Å; L31-W127 HydrophobicContact CD2-CH2 4.42Å; L31-W127 HydrophobicContact CD2-CZ2 4.19Å; L31-W127 HydrophobicContact CD2-CZ3 4.23Å; L31-W127 HydrophobicContact CG-CD2 4.24Å; L31-W127 HydrophobicContact CG-CE3 4.45Å; L31-W127 HydrophobicContact CG-CH2 4.27Å; L31-W127 HydrophobicContact CG-CZ2 4.06Å; L31-W127 HydrophobicContact CG-CZ3 4.48Å; L35-W127 HydrophobicContact CD1-CD2 3.7Å; L35-W127 HydrophobicContact CD1-CE3 3.85Å; L35-W127 HydrophobicContact CD1-CG 4.16Å; L35-W127 HydrophobicContact CD1-CH2 4.37Å; L35-W127 HydrophobicContact CD1-CZ2 4.21Å; L35-W127 HydrophobicContact CD1-CZ3 4.17Å; L35-W127 HydrophobicContact CD2-CD2 4.44Å; L35-W127 HydrophobicContact CD2-CG 4.3Å; L35-W127 HydrophobicContact CG-CD2 4.39Å; L35-W127 HydrophobicContact CG-CZ2 4.36Å; F52-W127 HydrophobicContact CB-CH2 3.56Å; F52-W127 HydrophobicContact CB-CZ2 4.31Å; F52-W127 HydrophobicContact CB-CZ3 4.04Å; I54-W127 HydrophobicContact CD1-CE3 3.74Å; I54-W127 HydrophobicContact CD1-CZ3 3.62Å; I54-W127 HydrophobicContact CG1-CE3 4.14Å; I54-W127 HydrophobicContact CG1-CH2 4.25Å; I54-W127 HydrophobicContact CG1-CZ3 3.47Å; I54-W127 VanDerWaalsContact CG1-CZ3 3.47Å; L59-W127 HydrophobicContact CD1-CZ3 3.78Å; M103-W127 HydrophobicContact CE-CB 3.72Å; M103-W127 HydrophobicContact SD-CB 4.04Å; E123-W127 WeakPolarHBondContact O-CB 2.92Å; E123-W127 PolarHBondContact O-N 3.39Å; Q124-W127 PolarHBondContact O-N 3.48Å; T125-W127 PolarHBondContact O-N 3.4Å; W127-L131 HydrophobicContact CE3-CD1 4.47Å; W127-L131 HydrophobicContact CE3-CG 4.43Å; W127-L131 VanDerWaalsContact O-CB 3.26Å; W127-L131 WeakPolarHBondContact O-CB 3.41Å; W127-L131 WeakPolarHBondContact O-CD1 3.49Å; W127-L131 WeakPolarHBondContact O-CG 3.49Å; W127-L131 PolarHBondContact O-N 3.44Å
128	L	89.5	Confident	86.6	Confident	30 Å²	30	60.4 Å²	60.4	16%	0.157	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-46.4	179.7	-170.9	133.9	0	0	0	111.7	V91 P93 Q124 T125 L131 Q132	V91-L128 HydrophobicContact CG1-CD1 4.31Å; V91-L128 HydrophobicContact CG1-CG 4.16Å; P93-L128 HydrophobicContact CB-CD1 4.14Å; P93-L128 HydrophobicContact CG-CD1 4.34Å; Q124-L128 VanDerWaalsContact O-CB 3.24Å; Q124-L128 WeakPolarHBondContact O-CB 3.46Å; Q124-L128 PolarHBondContact O-N 3.41Å; T125-L128 PolarHBondContact O-N 3.42Å; L128-L131 PolarHBondContact O-N 2.89Å; L128-Q132 WeakPolarHBondContact O-CB 3.4Å; L128-Q132 VanDerWaalsContact O-CG 3.29Å; L128-Q132 WeakPolarHBondContact O-CG 3.45Å; L128-Q132 PolarHBondContact O-N 3.31Å; L128-Q132 VanDerWaalsContact O-N 3.07Å
129	E	89.3	Confident	85.8	Confident	132 Å²	132	69.5 Å²	69.5	62%	0.617	33%	0.334	S	S	*	.	H	α-helix	trans	-63.6	-46.1	179.5	-159.9	174.7	-148	0	0	111.5	T125 Q132 E133	T125-E129 WeakPolarHBondContact O-CB 3.22Å; T125-E129 PolarHBondContact O-N 2.97Å; E129-Q132 PolarHBondContact O-N 3.25Å; E129-E133 WeakPolarHBondContact O-CB 3.45Å; E129-E133 PolarHBondContact O-N 3.43Å
130	M	88.8	Confident	85.5	Confident	51 Å²	51	69.8 Å²	69.8	25%	0.251	33%	0.334	S	S	.	.	H	α-helix	trans	-68.4	-38.6	178.8	-70.1	-55	-60.6	0	0	113.1	Q30 L31 I54 Q126 Q132 E133 S134	Q30-M130 HydrophobicContact CB-CE 3.61Å; Q30-M130 HydrophobicContact CG-CE 4.25Å; L31-M130 HydrophobicContact CB-CB 4.33Å; L31-M130 HydrophobicContact CB-CG 4.33Å; L31-M130 HydrophobicContact CD2-CB 3.87Å; L31-M130 HydrophobicContact CD2-CG 3.96Å; I54-M130 HydrophobicContact CD1-CB 3.96Å; Q126-M130 WeakPolarHBondContact O-CB 3.35Å; Q126-M130 WeakPolarHBondContact O-CG 3.42Å; Q126-M130 PolarHBondContact O-N 2.86Å; Q126-M130 VanDerWaalsContact O-N 3.13Å; M130-Q132 VanDerWaalsContact C-N 3.32Å; M130-Q132 PolarHBondContact O-N 3.46Å; M130-E133 PolarHBondContact O-N 3.34Å; M130-S134 VanDerWaalsContact O-CB 3.3Å; M130-S134 WeakPolarHBondContact O-CB 3.28Å; M130-S134 PolarHBondContact O-N 3.17Å; M130-S134 PolarHBondContact O-OG 3.03Å; M130-S134 VanDerWaalsContact O-OG 3.12Å
131	L	88.1	Confident	85.2	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.01	35%	0.346	C	S	.	.	H	α-helix	trans	-63.6	-39.4	175.8	-72	166.3	0	0	0	111.5	I54 L59 L86 V91 M103 I105 W127 L128 G135	I54-L131 HydrophobicContact CD1-CD2 3.63Å; I54-L131 HydrophobicContact CD1-CG 3.83Å; I54-L131 HydrophobicContact CG1-CD2 4.23Å; L59-L131 HydrophobicContact CB-CD2 4.35Å; L59-L131 HydrophobicContact CD1-CD2 4.16Å; L59-L131 HydrophobicContact CD2-CD2 3.98Å; L59-L131 HydrophobicContact CG-CD2 4.41Å; L86-L131 HydrophobicContact CD1-CD2 3.73Å; L86-L131 HydrophobicContact CD2-CD2 3.66Å; L86-L131 HydrophobicContact CG-CD2 4.35Å; V91-L131 HydrophobicContact CG1-CB 4.23Å; V91-L131 HydrophobicContact CG1-CD1 4.06Å; V91-L131 HydrophobicContact CG2-CB 4.02Å; M103-L131 HydrophobicContact SD-CD1 3.94Å; I105-L131 HydrophobicContact CD1-CD1 4.04Å; I105-L131 HydrophobicContact CD1-CD2 4.42Å; W127-L131 HydrophobicContact CE3-CD1 4.47Å; W127-L131 HydrophobicContact CE3-CG 4.43Å; W127-L131 VanDerWaalsContact O-CB 3.26Å; W127-L131 WeakPolarHBondContact O-CB 3.41Å; W127-L131 WeakPolarHBondContact O-CD1 3.49Å; W127-L131 WeakPolarHBondContact O-CG 3.49Å; W127-L131 PolarHBondContact O-N 3.44Å; L128-L131 PolarHBondContact O-N 2.89Å; L131-G135 PolarHBondContact O-N 3.32Å
132	Q	86.9	Confident	84.8	Confident	81 Å²	81	69.4 Å²	69.4	38%	0.379	34%	0.342	S	S	.	.	H	α-helix	trans	-68.7	-42.5	175.9	-72.7	179.2	-3.2	0	0	112.2	V91 L128 E129 M130 G135 K136	V91-Q132 HydrophobicContact CB-CG 4.1Å; V91-Q132 PolarHBondContact O-NE2 2.9Å; L128-Q132 WeakPolarHBondContact O-CB 3.4Å; L128-Q132 VanDerWaalsContact O-CG 3.29Å; L128-Q132 WeakPolarHBondContact O-CG 3.45Å; L128-Q132 PolarHBondContact O-N 3.31Å; L128-Q132 VanDerWaalsContact O-N 3.07Å; E129-Q132 PolarHBondContact O-N 3.25Å; M130-Q132 VanDerWaalsContact C-N 3.32Å; M130-Q132 PolarHBondContact O-N 3.46Å; Q132-G135 PolarHBondContact O-N 3.25Å; Q132-K136 PolarHBondContact O-N 3.46Å
133	E	84.9	Confident	84.5	Confident	75 Å²	75	67.7 Å²	67.7	35%	0.35	34%	0.335	S	S	.	.	H	α-helix	trans	-68.2	-42.3	-179.6	-168.2	57.8	-152.6	0	0	111.7	E129 M130 G135 K136 V137 K140	E129-E133 WeakPolarHBondContact O-CB 3.45Å; E129-E133 PolarHBondContact O-N 3.43Å; M130-E133 PolarHBondContact O-N 3.34Å; E133-G135 PolarHBondContact O-N 3.27Å; E133-K136 WeakPolarHBondContact O-CB 3.36Å; E133-K136 PolarHBondContact O-N 2.97Å; E133-K136 IonicContact OE2-NZ 3.62Å; E133-K136 PolarHBondContact OE2-NZ 2.89Å; E133-K136 VanDerWaalsContact OE2-NZ 3.15Å; E133-V137 PolarHBondContact O-N 2.97Å; E133-K140 IonicContact OE1-NZ 2.99Å
134	S	84.8	Confident	84.4	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-59.5	-32.9	175.1	-72.8	0	0	0	0	113.2	Q30 I54 E56 S57 M130 K136 V137	Q30-S134 VanDerWaalsContact CD-OG 3.23Å; Q30-S134 PolarHBondContact NE2-OG 3.4Å; Q30-S134 PolarHBondContact OE1-OG 3.3Å; I54-S134 VanDerWaalsContact CG2-OG 3.22Å; I54-S134 WeakPolarHBondContact CG2-OG 3.33Å; E56-S134 WeakPolarHBondContact O-CA 3.27Å; E56-S134 WeakPolarHBondContact O-CB 3.38Å; E56-S134 PolarHBondContact O-OG 3.47Å; S57-S134 WeakPolarHBondContact CB-O 3.45Å; M130-S134 VanDerWaalsContact O-CB 3.3Å; M130-S134 WeakPolarHBondContact O-CB 3.28Å; M130-S134 PolarHBondContact O-N 3.17Å; M130-S134 PolarHBondContact O-OG 3.03Å; M130-S134 VanDerWaalsContact O-OG 3.12Å; S134-K136 VanDerWaalsContact C-N 3.34Å; S134-V137 PolarHBondContact O-N 3.09Å
135	G	80.8	Confident	84.2	Confident	14 Å²	14	70.7 Å²	70.7	14%	0.144	36%	0.361	C	S	.	.	H	α-helix	trans	-66.6	-30.7	173.1	0	0	0	0	0	113.9	L86 L131 Q132 E133	L86-G135 WeakPolarHBondContact O-CA 3.28Å; L131-G135 PolarHBondContact O-N 3.32Å; Q132-G135 PolarHBondContact O-N 3.25Å; E133-G135 PolarHBondContact O-N 3.27Å
136	K	80.8	Confident	84.2	Confident	107 Å²	107	71.8 Å²	71.8	47%	0.465	36%	0.361	S	S	.	.	H	α-helix	trans	-78.1	-29.3	177.8	-62.7	173.6	-163.3	157.5	0	113	Q132 E133 S134 T138 W139 K140	Q132-K136 PolarHBondContact O-N 3.46Å; E133-K136 WeakPolarHBondContact O-CB 3.36Å; E133-K136 PolarHBondContact O-N 2.97Å; E133-K136 IonicContact OE2-NZ 3.62Å; E133-K136 PolarHBondContact OE2-NZ 2.89Å; E133-K136 VanDerWaalsContact OE2-NZ 3.15Å; S134-K136 VanDerWaalsContact C-N 3.34Å; K136-T138 VanDerWaalsContact C-N 3.35Å; K136-T138 PolarHBondContact O-N 2.98Å; K136-W139 PolarHBondContact O-N 3.19Å; K136-K140 PolarHBondContact O-N 3.4Å; K136-K140 VanDerWaalsContact O-N 3.14Å
137	V	76.6	Confident	84.2	Confident	40 Å²	40	70.7 Å²	70.7	24%	0.242	37%	0.365	C	S	.	.	H	α-helix	trans	-61.2	-41.3	-178.3	172.4	0	0	0	0	111.6	E133 S134 W139 K140 N141	E133-V137 PolarHBondContact O-N 2.97Å; S134-V137 PolarHBondContact O-N 3.09Å; V137-W139 VanDerWaalsContact C-N 3.32Å; V137-W139 PolarHBondContact O-N 2.94Å; V137-K140 PolarHBondContact O-N 2.92Å; V137-N141 PolarHBondContact O-N 2.84Å
138	T	73.6	Confident	84.2	Confident	54 Å²	54	76.4 Å²	76.4	33%	0.331	39%	0.394	S	S	.	.	H	α-helix	trans	-59.5	-43.1	176.5	-44.6	0	0	0	0	112.2	S57 K136 N141 A142	S57-T138 WeakPolarHBondContact CB-OG1 3.37Å; S57-T138 PolarHBondContact OG-OG1 3.27Å; K136-T138 VanDerWaalsContact C-N 3.35Å; K136-T138 PolarHBondContact O-N 2.98Å; T138-N141 PolarHBondContact O-N 3.2Å; T138-A142 WeakPolarHBondContact O-CB 3.42Å; T138-A142 PolarHBondContact O-N 2.86Å
139	W	73.9	Confident	84.4	Confident	195 Å²	195	79.6 Å²	79.6	74%	0.739	41%	0.41	S	S	*	.	H	α-helix	trans	-64.1	-46.4	-179.5	-174.4	-86.6	0	0	0	111.4	K136 V137 N141 A142 Q143	K136-W139 PolarHBondContact O-N 3.19Å; V137-W139 VanDerWaalsContact C-N 3.32Å; V137-W139 PolarHBondContact O-N 2.94Å; W139-N141 VanDerWaalsContact C-N 3.34Å; W139-N141 PolarHBondContact O-N 2.86Å; W139-A142 PolarHBondContact O-N 3.31Å; W139-Q143 WeakPolarHBondContact O-CB 3.46Å; W139-Q143 PolarHBondContact O-N 3.44Å
140	K	79.3	Confident	84.6	Confident	106 Å²	106	78.8 Å²	78.8	46%	0.461	41%	0.405	S	S	.	.	H	α-helix	trans	-61	-42.7	177.1	-69.8	175.7	-179	170.8	0	111.5	E133 K136 V137 Q143 L144	E133-K140 IonicContact OE1-NZ 2.99Å; K136-K140 PolarHBondContact O-N 3.4Å; K136-K140 VanDerWaalsContact O-N 3.14Å; V137-K140 PolarHBondContact O-N 2.92Å; K140-Q143 PolarHBondContact O-N 3.33Å; K140-L144 WeakPolarHBondContact O-CG 3.42Å; K140-L144 PolarHBondContact O-N 3.41Å
141	N	81.4	Confident	84.8	Confident	99 Å²	99	79.3 Å²	79.3	53%	0.529	41%	0.413	S	S	.	.	H	α-helix	trans	-66.8	-40.9	178.3	-72.4	-7.1	0	0	0	112.4	V137 T138 W139 Q143 L144 G145	V137-N141 PolarHBondContact O-N 2.84Å; T138-N141 PolarHBondContact O-N 3.2Å; W139-N141 VanDerWaalsContact C-N 3.34Å; W139-N141 PolarHBondContact O-N 2.86Å; N141-Q143 VanDerWaalsContact C-N 3.34Å; N141-L144 PolarHBondContact O-N 3.09Å; N141-G145 PolarHBondContact O-N 2.9Å
142	A	81.1	Confident	85.2	Confident	63 Å²	63	83.9 Å²	83.9	52%	0.521	44%	0.437	S	S	.	.	H	α-helix	trans	-62.1	-43	174.4	0	0	0	0	0	111.5	T138 W139 G145 E146	T138-A142 WeakPolarHBondContact O-CB 3.42Å; T138-A142 PolarHBondContact O-N 2.86Å; W139-A142 PolarHBondContact O-N 3.31Å; A142-G145 PolarHBondContact O-N 3.29Å; A142-E146 WeakPolarHBondContact O-CB 3.5Å; A142-E146 PolarHBondContact O-N 3.44Å
143	Q	82.9	Confident	85.5	Confident	118 Å²	118	86 Å²	86	55%	0.551	45%	0.447	S	S	*	.	H	α-helix	trans	-63.1	-41.7	176.6	-172.5	178.6	19.4	0	0	112.4	W139 K140 N141 A147	W139-Q143 WeakPolarHBondContact O-CB 3.46Å; W139-Q143 PolarHBondContact O-N 3.44Å; K140-Q143 PolarHBondContact O-N 3.33Å; N141-Q143 VanDerWaalsContact C-N 3.34Å; Q143-A147 WeakPolarHBondContact O-CB 3.41Å; Q143-A147 PolarHBondContact O-N 2.88Å
144	L	86.1	Confident	86	Confident	120 Å²	120	85.2 Å²	85.2	63%	0.628	45%	0.453	S	S	*	.	H	α-helix	trans	-65.3	-42.6	175.3	-72.7	172.3	0	0	0	111.8	K140 N141 A147 M148	K140-L144 WeakPolarHBondContact O-CG 3.42Å; K140-L144 PolarHBondContact O-N 3.41Å; N141-L144 PolarHBondContact O-N 3.09Å; L144-A147 PolarHBondContact O-N 3.09Å; L144-M148 WeakPolarHBondContact O-CB 3.36Å; L144-M148 PolarHBondContact O-N 2.94Å
145	G	86.9	Confident	86.6	Confident	30 Å²	30	90.5 Å²	90.5	31%	0.309	48%	0.478	S	S	.	.	H	α-helix	trans	-61.3	-45.3	175.6	0	0	0	0	0	112.2	N141 A142 A147 M148 I149	N141-G145 PolarHBondContact O-N 2.9Å; A142-G145 PolarHBondContact O-N 3.29Å; G145-A147 PolarHBondContact O-N 3.25Å; G145-M148 PolarHBondContact O-N 3.22Å; G145-I149 VanDerWaalsContact O-CG1 3.26Å; G145-I149 WeakPolarHBondContact O-CG1 3.48Å; G145-I149 PolarHBondContact O-N 3.31Å
146	E	89.2	Confident	87.2	Confident	103 Å²	103	91.8 Å²	91.8	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-62.8	-42.4	176.1	-170.7	-176.3	168.7	0	0	111.9	A142 M148 I149 K150	A142-E146 WeakPolarHBondContact O-CB 3.5Å; A142-E146 PolarHBondContact O-N 3.44Å; E146-M148 VanDerWaalsContact C-N 3.35Å; E146-I149 PolarHBondContact O-N 3.05Å; E146-K150 HydrophobicContact CG-CD 4.39Å; E146-K150 WeakPolarHBondContact O-CB 3.42Å; E146-K150 WeakPolarHBondContact O-CG 3.3Å; E146-K150 PolarHBondContact O-N 3.02Å; E146-K150 VanDerWaalsContact OE1-CE 3.24Å; E146-K150 WeakPolarHBondContact OE1-CE 3.3Å; E146-K150 IonicContact OE1-NZ 3.74Å; E146-K150 PolarHBondContact OE1-NZ 3.34Å
147	A	91.8	Very high	88	Confident	58 Å²	58	91.6 Å²	91.6	48%	0.479	50%	0.495	S	S	.	.	H	α-helix	trans	-63.5	-40.3	176.1	0	0	0	0	0	112.2	Q143 L144 G145 S151	Q143-A147 WeakPolarHBondContact O-CB 3.41Å; Q143-A147 PolarHBondContact O-N 2.88Å; L144-A147 PolarHBondContact O-N 3.09Å; G145-A147 PolarHBondContact O-N 3.25Å; A147-S151 WeakPolarHBondContact O-CB 3.39Å; A147-S151 PolarHBondContact O-N 3.4Å
148	M	91.8	Very high	88.9	Confident	127 Å²	127	94 Å²	94	63%	0.626	50%	0.503	S	S	*	.	H	α-helix	trans	-65.9	-45.3	176.8	-175	175	-179.3	0	0	111.7	L144 G145 E146 K150 S151 L152	L144-M148 WeakPolarHBondContact O-CB 3.36Å; L144-M148 PolarHBondContact O-N 2.94Å; G145-M148 PolarHBondContact O-N 3.22Å; E146-M148 VanDerWaalsContact C-N 3.35Å; M148-K150 PolarHBondContact O-N 2.99Å; M148-S151 WeakPolarHBondContact O-CB 3.41Å; M148-S151 PolarHBondContact O-N 2.98Å; M148-L152 HydrophobicContact CE-CD1 4.41Å; M148-L152 HydrophobicContact CG-CD1 4.3Å; M148-L152 WeakPolarHBondContact O-CG 3.45Å; M148-L152 PolarHBondContact O-N 3.32Å
149	I	92.5	Very high	89.9	Confident	97 Å²	97	96.8 Å²	96.8	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-58.6	-49.7	176	-69.2	165.1	0	0	0	110	G145 E146 S151 L152 E153	G145-I149 VanDerWaalsContact O-CG1 3.26Å; G145-I149 WeakPolarHBondContact O-CG1 3.48Å; G145-I149 PolarHBondContact O-N 3.31Å; E146-I149 PolarHBondContact O-N 3.05Å; I149-S151 VanDerWaalsContact C-N 3.27Å; I149-S151 PolarHBondContact O-N 3.17Å; I149-L152 PolarHBondContact O-N 2.92Å; I149-L152 VanDerWaalsContact O-N 3.1Å; I149-E153 HydrophobicContact CG2-CG 4.26Å; I149-E153 WeakPolarHBondContact O-CG 3.46Å; I149-E153 PolarHBondContact O-N 3.33Å
150	K	94	Very high	90.9	Very high	115 Å²	115	90.2 Å²	90.2	50%	0.5	50%	0.503	S	S	.	.	H	α-helix	trans	-58	-39.5	177.1	-74.8	175.6	-176.3	169.3	0	112.5	E146 M148 A154	E146-K150 HydrophobicContact CG-CD 4.39Å; E146-K150 WeakPolarHBondContact O-CB 3.42Å; E146-K150 WeakPolarHBondContact O-CG 3.3Å; E146-K150 PolarHBondContact O-N 3.02Å; E146-K150 VanDerWaalsContact OE1-CE 3.24Å; E146-K150 WeakPolarHBondContact OE1-CE 3.3Å; E146-K150 IonicContact OE1-NZ 3.74Å; E146-K150 PolarHBondContact OE1-NZ 3.34Å; M148-K150 PolarHBondContact O-N 2.99Å; K150-A154 WeakPolarHBondContact O-CB 3.48Å; K150-A154 PolarHBondContact O-N 3.47Å
151	S	94.1	Very high	91.7	Very high	61 Å²	61	90.2 Å²	90.2	43%	0.427	50%	0.503	S	S	.	.	H	α-helix	trans	-64.8	-43.1	176.3	-174.8	0	0	0	0	111.9	A147 M148 I149 A154 Q155	A147-S151 WeakPolarHBondContact O-CB 3.39Å; A147-S151 PolarHBondContact O-N 3.4Å; M148-S151 WeakPolarHBondContact O-CB 3.41Å; M148-S151 PolarHBondContact O-N 2.98Å; I149-S151 VanDerWaalsContact C-N 3.27Å; I149-S151 PolarHBondContact O-N 3.17Å; S151-A154 PolarHBondContact O-N 3.01Å; S151-Q155 WeakPolarHBondContact O-CG 3.37Å; S151-Q155 PolarHBondContact O-N 3.12Å
152	L	95.6	Very high	92.3	Very high	98 Å²	98	89.9 Å²	89.9	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-67.5	-40.5	178.2	-72.1	171.5	0	0	0	111.8	M148 I149 Q155 G156	M148-L152 HydrophobicContact CE-CD1 4.41Å; M148-L152 HydrophobicContact CG-CD1 4.3Å; M148-L152 WeakPolarHBondContact O-CG 3.45Å; M148-L152 PolarHBondContact O-N 3.32Å; I149-L152 PolarHBondContact O-N 2.92Å; I149-L152 VanDerWaalsContact O-N 3.1Å; L152-Q155 PolarHBondContact O-N 2.86Å; L152-G156 PolarHBondContact O-N 2.89Å
153	E	94	Very high	93	Very high	127 Å²	127	93.9 Å²	93.9	59%	0.593	50%	0.504	S	S	*	.	H	α-helix	trans	-61.6	-44.2	174.2	-72.5	175.7	161.9	0	0	111.5	I149 G156 L157	I149-E153 HydrophobicContact CG2-CG 4.26Å; I149-E153 WeakPolarHBondContact O-CG 3.46Å; I149-E153 PolarHBondContact O-N 3.33Å; E153-G156 PolarHBondContact O-N 2.93Å; E153-L157 WeakPolarHBondContact O-CB 3.38Å; E153-L157 PolarHBondContact O-N 3.31Å
154	A	95.4	Very high	93.6	Very high	58 Å²	58	93 Å²	93	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-42.8	176.7	0	0	0	0	0	112	K150 S151 L157 Q158	K150-A154 WeakPolarHBondContact O-CB 3.48Å; K150-A154 PolarHBondContact O-N 3.47Å; S151-A154 PolarHBondContact O-N 3.01Å; A154-L157 PolarHBondContact O-N 3.34Å; A154-Q158 WeakPolarHBondContact O-CB 3.32Å; A154-Q158 PolarHBondContact O-N 3.02Å
155	Q	95.8	Very high	94	Very high	111 Å²	111	92.4 Å²	92.4	52%	0.519	49%	0.494	S	S	.	.	H	α-helix	trans	-63.7	-44.4	174.7	-74.6	175.7	-4.9	0	0	111.9	S151 L152 L157 Q158 L159	S151-Q155 WeakPolarHBondContact O-CG 3.37Å; S151-Q155 PolarHBondContact O-N 3.12Å; L152-Q155 PolarHBondContact O-N 2.86Å; Q155-L157 VanDerWaalsContact C-N 3.34Å; Q155-L157 PolarHBondContact O-N 3.03Å; Q155-Q158 PolarHBondContact O-N 3.47Å; Q155-L159 WeakPolarHBondContact O-CG 3.46Å; Q155-L159 PolarHBondContact O-N 3.35Å
156	G	95.1	Very high	94.3	Very high	41 Å²	41	98.1 Å²	98.1	42%	0.423	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-41.8	176.7	0	0	0	0	0	112.4	L152 E153 A160	L152-G156 PolarHBondContact O-N 2.89Å; E153-G156 PolarHBondContact O-N 2.93Å; G156-A160 WeakPolarHBondContact O-CB 3.48Å; G156-A160 PolarHBondContact O-N 3.37Å
157	L	96.2	Very high	94.4	Very high	103 Å²	103	97.1 Å²	97.1	54%	0.539	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-41.3	174.9	-176.7	64.6	0	0	0	111.8	E153 A154 Q155 A160 K161	E153-L157 WeakPolarHBondContact O-CB 3.38Å; E153-L157 PolarHBondContact O-N 3.31Å; A154-L157 PolarHBondContact O-N 3.34Å; Q155-L157 VanDerWaalsContact C-N 3.34Å; Q155-L157 PolarHBondContact O-N 3.03Å; L157-A160 PolarHBondContact O-N 3.4Å; L157-K161 WeakPolarHBondContact O-CG 3.38Å; L157-K161 PolarHBondContact O-N 3.03Å
158	Q	95.3	Very high	94.5	Very high	89 Å²	89	97.8 Å²	97.8	42%	0.416	50%	0.5	S	S	.	.	H	α-helix	trans	-63.9	-46.5	177.7	-177.3	60.1	22.2	0	0	111.5	A154 Q155 A160 K161 E162	A154-Q158 WeakPolarHBondContact O-CB 3.32Å; A154-Q158 PolarHBondContact O-N 3.02Å; Q155-Q158 PolarHBondContact O-N 3.47Å; Q158-A160 VanDerWaalsContact C-N 3.29Å; Q158-A160 PolarHBondContact O-N 3.15Å; Q158-K161 WeakPolarHBondContact O-CB 3.47Å; Q158-K161 PolarHBondContact O-N 3.46Å; Q158-K161 VanDerWaalsContact O-N 3.15Å; Q158-E162 WeakPolarHBondContact CG-OE1 3.47Å; Q158-E162 PolarHBondContact NE2-OE1 2.91Å; Q158-E162 WeakPolarHBondContact O-CG 3.5Å; Q158-E162 PolarHBondContact O-N 3.46Å
159	L	95.3	Very high	94.5	Very high	113 Å²	113	97.4 Å²	97.4	59%	0.592	50%	0.495	S	S	*	.	H	α-helix	trans	-61.1	-38.2	175.8	-73.6	169.8	0	0	0	112.2	Q155 K163	Q155-L159 WeakPolarHBondContact O-CG 3.46Å; Q155-L159 PolarHBondContact O-N 3.35Å; L159-K163 VanDerWaalsContact O-CB 3.32Å; L159-K163 WeakPolarHBondContact O-CB 3.4Å; L159-K163 PolarHBondContact O-N 3.23Å
160	A	94.4	Very high	94.4	Very high	58 Å²	58	95.7 Å²	95.7	48%	0.479	49%	0.487	S	S	.	.	H	α-helix	trans	-64.6	-40.3	175.6	0	0	0	0	0	111.9	G156 L157 Q158 Q164	G156-A160 WeakPolarHBondContact O-CB 3.48Å; G156-A160 PolarHBondContact O-N 3.37Å; L157-A160 PolarHBondContact O-N 3.4Å; Q158-A160 VanDerWaalsContact C-N 3.29Å; Q158-A160 PolarHBondContact O-N 3.15Å; A160-Q164 PolarHBondContact O-N 3.45Å
161	K	96.1	Very high	94.2	Very high	105 Å²	105	95.2 Å²	95.2	46%	0.457	49%	0.487	S	S	.	.	H	α-helix	trans	-63.8	-49.7	174.5	-73.5	176	178.8	-179.2	0	111.7	L157 Q158 K163 Q164 E165	L157-K161 WeakPolarHBondContact O-CG 3.38Å; L157-K161 PolarHBondContact O-N 3.03Å; Q158-K161 WeakPolarHBondContact O-CB 3.47Å; Q158-K161 PolarHBondContact O-N 3.46Å; Q158-K161 VanDerWaalsContact O-N 3.15Å; K161-K163 VanDerWaalsContact C-N 3.28Å; K161-K163 PolarHBondContact O-N 3.02Å; K161-Q164 PolarHBondContact O-N 3.27Å; K161-E165 WeakPolarHBondContact O-CG 3.34Å; K161-E165 PolarHBondContact O-N 3.46Å
162	E	94.6	Very high	94.1	Very high	93 Å²	93	97.9 Å²	97.9	44%	0.435	49%	0.493	S	S	.	.	H	α-helix	trans	-59.9	-40	178.9	-71.9	171.3	-171	0	0	111.8	Q158 Y166	Q158-E162 WeakPolarHBondContact CG-OE1 3.47Å; Q158-E162 PolarHBondContact NE2-OE1 2.91Å; Q158-E162 WeakPolarHBondContact O-CG 3.5Å; Q158-E162 PolarHBondContact O-N 3.46Å; E162-Y166 WeakPolarHBondContact O-CB 3.47Å; E162-Y166 PolarHBondContact O-N 3.47Å
163	K	95.2	Very high	93.8	Very high	146 Å²	146	98.5 Å²	98.5	64%	0.635	49%	0.493	S	S	*	.	H	α-helix	trans	-62	-43.8	173.6	-178.4	-176.3	173.8	-174.8	0	111.8	L159 K161 Y166 L167	L159-K163 VanDerWaalsContact O-CB 3.32Å; L159-K163 WeakPolarHBondContact O-CB 3.4Å; L159-K163 PolarHBondContact O-N 3.23Å; K161-K163 VanDerWaalsContact C-N 3.28Å; K161-K163 PolarHBondContact O-N 3.02Å; K163-Y166 PolarHBondContact O-N 3.17Å; K163-L167 HydrophobicContact CG-CD1 4.41Å; K163-L167 WeakPolarHBondContact O-CG 3.36Å; K163-L167 PolarHBondContact O-N 3.34Å; K163-L167 VanDerWaalsContact O-N 3.07Å
164	Q	95.4	Very high	93.5	Very high	100 Å²	100	96.3 Å²	96.3	47%	0.467	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-47.6	178.6	-174.1	61.4	40.7	0	0	111.2	A160 K161 Y166 L167 D168	A160-Q164 PolarHBondContact O-N 3.45Å; K161-Q164 PolarHBondContact O-N 3.27Å; Q164-Y166 PolarHBondContact O-N 2.92Å; Q164-L167 WeakPolarHBondContact O-CB 3.46Å; Q164-L167 PolarHBondContact O-N 3.06Å; Q164-D168 PolarHBondContact NE2-OD1 2.94Å; Q164-D168 VanDerWaalsContact O-CG 3.26Å; Q164-D168 PolarHBondContact O-N 3.4Å
165	E	94.8	Very high	93.2	Very high	107 Å²	107	98.9 Å²	98.9	50%	0.5	49%	0.491	S	S	.	.	H	α-helix	trans	-58.8	-37.1	177.4	-71.1	173.8	-168.2	0	0	112.3	K161 K169	K161-E165 WeakPolarHBondContact O-CG 3.34Å; K161-E165 PolarHBondContact O-N 3.46Å; E165-K169 VanDerWaalsContact O-CG 3.31Å; E165-K169 WeakPolarHBondContact O-CG 3.4Å; E165-K169 PolarHBondContact O-N 3Å; E165-K169 VanDerWaalsContact O-N 3.1Å
166	Y	94.1	Very high	92.9	Very high	150 Å²	150	98.5 Å²	98.5	59%	0.588	49%	0.489	S	S	*	.	H	α-helix	trans	-67.5	-40.8	175.2	-176.1	-101.5	0	0	0	112.3	E162 K163 Q164 L170	E162-Y166 WeakPolarHBondContact O-CB 3.47Å; E162-Y166 PolarHBondContact O-N 3.47Å; K163-Y166 PolarHBondContact O-N 3.17Å; Q164-Y166 PolarHBondContact O-N 2.92Å; Y166-L170 HydrophobicContact CD1-CD1 3.81Å; Y166-L170 HydrophobicContact CD1-CG 4.43Å; Y166-L170 HydrophobicContact CE1-CD1 3.3Å; Y166-L170 HydrophobicContact CE1-CG 4.05Å; Y166-L170 WeakPolarHBondContact O-CG 3.33Å; Y166-L170 PolarHBondContact O-N 3.41Å; Y166-L170 VanDerWaalsContact O-N 3.09Å
167	L	91.8	Very high	92.3	Very high	83 Å²	83	101.7 Å²	101.7	44%	0.435	50%	0.496	S	S	.	.	H	α-helix	trans	-65	-41.9	175.3	-72.2	172.4	0	0	0	111.9	K163 Q164 L170 M171	K163-L167 HydrophobicContact CG-CD1 4.41Å; K163-L167 WeakPolarHBondContact O-CG 3.36Å; K163-L167 PolarHBondContact O-N 3.34Å; K163-L167 VanDerWaalsContact O-N 3.07Å; Q164-L167 WeakPolarHBondContact O-CB 3.46Å; Q164-L167 PolarHBondContact O-N 3.06Å; L167-L170 PolarHBondContact O-N 2.92Å; L167-M171 WeakPolarHBondContact O-CB 3.42Å; L167-M171 PolarHBondContact O-N 3.42Å
168	D	92.3	Very high	91.9	Very high	71 Å²	71	99.9 Å²	99.9	38%	0.38	49%	0.491	S	S	.	.	H	α-helix	trans	-62.4	-44.2	178.8	-65.3	-19.7	0	0	0	110.8	Q164 L170 M171 E172	Q164-D168 PolarHBondContact NE2-OD1 2.94Å; Q164-D168 VanDerWaalsContact O-CG 3.26Å; Q164-D168 PolarHBondContact O-N 3.4Å; D168-L170 PolarHBondContact O-N 3.49Å; D168-M171 WeakPolarHBondContact O-CB 3.29Å; D168-M171 PolarHBondContact O-N 3.43Å; D168-E172 PolarHBondContact O-N 3.21Å
169	K	93.1	Very high	91.6	Very high	120 Å²	120	100.4 Å²	100.4	52%	0.522	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-44.3	174.5	-74.2	172	-175.7	173.5	0	112.8	E165 M171 E172 E173	E165-K169 VanDerWaalsContact O-CG 3.31Å; E165-K169 WeakPolarHBondContact O-CG 3.4Å; E165-K169 PolarHBondContact O-N 3Å; E165-K169 VanDerWaalsContact O-N 3.1Å; K169-M171 VanDerWaalsContact C-N 3.28Å; K169-M171 PolarHBondContact O-N 2.83Å; K169-E172 PolarHBondContact O-N 2.94Å; K169-E173 WeakPolarHBondContact O-CG 3.35Å; K169-E173 PolarHBondContact O-N 3.08Å
170	L	90.5	Very high	91.1	Very high	61 Å²	61	100.5 Å²	100.5	32%	0.319	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-36.6	177.3	-76.6	176.5	0	0	0	112.1	Y166 L167 D168 T174	Y166-L170 HydrophobicContact CD1-CD1 3.81Å; Y166-L170 HydrophobicContact CD1-CG 4.43Å; Y166-L170 HydrophobicContact CE1-CD1 3.3Å; Y166-L170 HydrophobicContact CE1-CG 4.05Å; Y166-L170 WeakPolarHBondContact O-CG 3.33Å; Y166-L170 PolarHBondContact O-N 3.41Å; Y166-L170 VanDerWaalsContact O-N 3.09Å; L167-L170 PolarHBondContact O-N 2.92Å; D168-L170 PolarHBondContact O-N 3.49Å; L170-T174 WeakPolarHBondContact O-CB 3.36Å; L170-T174 PolarHBondContact O-N 3.04Å; L170-T174 PolarHBondContact O-OG1 2.9Å
171	M	90.1	Very high	90.7	Very high	105 Å²	105	105.8 Å²	105.8	52%	0.517	50%	0.501	S	S	.	.	H	α-helix	trans	-66.4	-45.8	176.2	-171.1	173.4	64.4	0	0	110.8	L167 D168 K169 T174 E175	L167-M171 WeakPolarHBondContact O-CB 3.42Å; L167-M171 PolarHBondContact O-N 3.42Å; D168-M171 WeakPolarHBondContact O-CB 3.29Å; D168-M171 PolarHBondContact O-N 3.43Å; K169-M171 VanDerWaalsContact C-N 3.28Å; K169-M171 PolarHBondContact O-N 2.83Å; M171-T174 WeakPolarHBondContact O-CB 3.45Å; M171-T174 PolarHBondContact O-N 2.98Å; M171-E175 WeakPolarHBondContact O-CG 3.45Å; M171-E175 PolarHBondContact O-N 2.88Å
172	E	90.8	Very high	90.4	Very high	117 Å²	117	106 Å²	106	55%	0.547	50%	0.504	S	S	.	.	H	α-helix	trans	-58.1	-49.9	174.9	-174.1	173.4	-157.7	0	0	111.7	D168 K169 T174 E175 E176	D168-E172 PolarHBondContact O-N 3.21Å; K169-E172 PolarHBondContact O-N 2.94Å; E172-T174 VanDerWaalsContact C-N 3.27Å; E172-T174 PolarHBondContact O-N 3.23Å; E172-E175 PolarHBondContact O-N 3.43Å; E172-E176 WeakPolarHBondContact O-CG 3.45Å; E172-E176 PolarHBondContact O-N 2.87Å
173	E	89.6	Confident	90	Very high	110 Å²	110	107.2 Å²	107.2	51%	0.514	51%	0.509	S	S	.	.	H	α-helix	trans	-58.9	-38	175.5	-73.1	178.2	-174.9	0	0	112.2	K169 L177	K169-E173 WeakPolarHBondContact O-CG 3.35Å; K169-E173 PolarHBondContact O-N 3.08Å; E173-L177 WeakPolarHBondContact O-CB 3.22Å; E173-L177 VanDerWaalsContact O-CG 3.25Å; E173-L177 WeakPolarHBondContact O-CG 3.3Å; E173-L177 PolarHBondContact O-N 2.92Å
174	T	87.9	Confident	89.6	Confident	82 Å²	82	109.1 Å²	109.1	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-68.6	-41.5	178.1	-58.1	0	0	0	0	111.4	L170 M171 E172 L177 C178	L170-T174 WeakPolarHBondContact O-CB 3.36Å; L170-T174 PolarHBondContact O-N 3.04Å; L170-T174 PolarHBondContact O-OG1 2.9Å; M171-T174 WeakPolarHBondContact O-CB 3.45Å; M171-T174 PolarHBondContact O-N 2.98Å; E172-T174 VanDerWaalsContact C-N 3.27Å; E172-T174 PolarHBondContact O-N 3.23Å; T174-L177 PolarHBondContact O-N 3.37Å; T174-C178 WeakPolarHBondContact O-CB 3.39Å; T174-C178 PolarHBondContact O-N 3.4Å; T174-C178 PolarHBondContact O-SG 3.15Å
175	E	88.6	Confident	89.4	Confident	112 Å²	112	107.4 Å²	107.4	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-63.5	-44.9	175.6	-73.1	177.4	-175.8	0	0	111.3	M171 E172 L177 C178 L179	M171-E175 WeakPolarHBondContact O-CG 3.45Å; M171-E175 PolarHBondContact O-N 2.88Å; E172-E175 PolarHBondContact O-N 3.43Å; E175-L177 PolarHBondContact O-N 3.5Å; E175-C178 WeakPolarHBondContact O-CB 3.43Å; E175-C178 PolarHBondContact O-N 3.29Å; E175-L179 WeakPolarHBondContact O-CG 3.45Å; E175-L179 PolarHBondContact O-N 3.32Å
176	E	88.9	Confident	89.1	Confident	103 Å²	103	108 Å²	108	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-59.9	-44.3	175.4	-72.4	-174.2	169.5	0	0	112.2	E172 C178 L179 Q180	E172-E176 WeakPolarHBondContact O-CG 3.45Å; E172-E176 PolarHBondContact O-N 2.87Å; E176-C178 VanDerWaalsContact C-N 3.35Å; E176-C178 PolarHBondContact O-N 3.09Å; E176-L179 PolarHBondContact O-N 3.49Å; E176-Q180 WeakPolarHBondContact O-CB 3.27Å; E176-Q180 VanDerWaalsContact O-CG 3.32Å; E176-Q180 WeakPolarHBondContact O-CG 3.49Å; E176-Q180 PolarHBondContact O-N 2.67Å
177	L	84.5	Confident	88.7	Confident	108 Å²	108	106.5 Å²	106.5	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-64.6	-38	176.8	-75.1	172.4	0	0	0	112.4	E173 T174 E175 R181	E173-L177 WeakPolarHBondContact O-CB 3.22Å; E173-L177 VanDerWaalsContact O-CG 3.25Å; E173-L177 WeakPolarHBondContact O-CG 3.3Å; E173-L177 PolarHBondContact O-N 2.92Å; T174-L177 PolarHBondContact O-N 3.37Å; E175-L177 PolarHBondContact O-N 3.5Å; L177-R181 WeakPolarHBondContact O-CB 3.15Å; L177-R181 PolarHBondContact O-N 2.66Å
178	C	87.8	Confident	88.6	Confident	65 Å²	65	107.8 Å²	107.8	44%	0.439	51%	0.513	S	S	.	.	H	α-helix	trans	-62.5	-48	173.9	-76.1	0	0	0	0	111.2	T174 E175 E176 Q180 R181 E182	T174-C178 WeakPolarHBondContact O-CB 3.39Å; T174-C178 PolarHBondContact O-N 3.4Å; T174-C178 PolarHBondContact O-SG 3.15Å; E175-C178 WeakPolarHBondContact O-CB 3.43Å; E175-C178 PolarHBondContact O-N 3.29Å; E176-C178 VanDerWaalsContact C-N 3.35Å; E176-C178 PolarHBondContact O-N 3.09Å; C178-Q180 PolarHBondContact O-N 3.02Å; C178-R181 WeakPolarHBondContact O-CB 3.46Å; C178-R181 PolarHBondContact O-N 2.91Å; C178-R181 VanDerWaalsContact O-N 3.17Å; C178-E182 WeakPolarHBondContact O-CG 3.47Å; C178-E182 PolarHBondContact O-N 3.02Å
179	L	87.3	Confident	88.6	Confident	99 Å²	99	111.5 Å²	111.5	52%	0.518	52%	0.521	S	S	.	.	H	α-helix	trans	-60.5	-44.1	176.9	-70.4	171.7	0	0	0	112	E175 E176 R181 E182 Q183	E175-L179 WeakPolarHBondContact O-CG 3.45Å; E175-L179 PolarHBondContact O-N 3.32Å; E176-L179 PolarHBondContact O-N 3.49Å; L179-R181 VanDerWaalsContact C-N 3.3Å; L179-R181 PolarHBondContact O-N 2.93Å; L179-E182 PolarHBondContact O-N 3Å; L179-Q183 WeakPolarHBondContact O-CB 3.37Å; L179-Q183 VanDerWaalsContact O-CG 3.31Å; L179-Q183 WeakPolarHBondContact O-CG 3.43Å; L179-Q183 PolarHBondContact O-N 3.44Å
180	Q	84.8	Confident	88.5	Confident	116 Å²	116	110.5 Å²	110.5	54%	0.542	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-39.1	175.9	-74.7	179.6	12.1	0	0	112.1	E176 C178 R184	E176-Q180 WeakPolarHBondContact O-CB 3.27Å; E176-Q180 VanDerWaalsContact O-CG 3.32Å; E176-Q180 WeakPolarHBondContact O-CG 3.49Å; E176-Q180 PolarHBondContact O-N 2.67Å; C178-Q180 PolarHBondContact O-N 3.02Å; Q180-R184 WeakPolarHBondContact O-CB 3.27Å; Q180-R184 PolarHBondContact O-N 3.46Å
181	R	87.7	Confident	88.3	Confident	168 Å²	168	112.3 Å²	112.3	63%	0.634	53%	0.531	S	S	*	.	H	α-helix	trans	-66	-46.5	176.3	-180	-178.5	171.3	179.6	-1.5	111.3	L177 C178 L179 R184 E185	L177-R181 WeakPolarHBondContact O-CB 3.15Å; L177-R181 PolarHBondContact O-N 2.66Å; C178-R181 WeakPolarHBondContact O-CB 3.46Å; C178-R181 PolarHBondContact O-N 2.91Å; C178-R181 VanDerWaalsContact O-N 3.17Å; L179-R181 VanDerWaalsContact C-N 3.3Å; L179-R181 PolarHBondContact O-N 2.93Å; R181-R184 WeakPolarHBondContact O-CB 3.25Å; R181-R184 PolarHBondContact O-N 3.15Å; R181-E185 HydrophobicContact CG-CG 4.5Å; R181-E185 IonicContact CZ-OE1 2.75Å; R181-E185 IonicContact NE-OE1 3.99Å; R181-E185 PolarHBondContact NE-OE1 3.35Å; R181-E185 IonicContact NH2-OE1 2.7Å; R181-E185 PolarHBondContact NH2-OE1 3.41Å; R181-E185 WeakPolarHBondContact O-CG 3.44Å; R181-E185 PolarHBondContact O-N 3.46Å
182	E	87.8	Confident	88.4	Confident	110 Å²	110	112.9 Å²	112.9	51%	0.514	53%	0.533	S	S	.	.	H	α-helix	trans	-58.7	-48.2	177.1	-73.3	175.5	176.8	0	0	111.1	C178 L179 R184 E185 E186	C178-E182 WeakPolarHBondContact O-CG 3.47Å; C178-E182 PolarHBondContact O-N 3.02Å; L179-E182 PolarHBondContact O-N 3Å; E182-R184 VanDerWaalsContact C-N 3.29Å; E182-R184 PolarHBondContact O-N 3.06Å; E182-E185 PolarHBondContact O-N 3.06Å; E182-E186 WeakPolarHBondContact O-CG 3.29Å; E182-E186 PolarHBondContact O-N 3.21Å
183	Q	87	Confident	88.5	Confident	118 Å²	118	111 Å²	111	55%	0.551	53%	0.529	S	S	*	.	H	α-helix	trans	-58.5	-40.7	175.1	-73.2	177.1	-1.5	0	0	112.3	L179 E186 L187	L179-Q183 WeakPolarHBondContact O-CB 3.37Å; L179-Q183 VanDerWaalsContact O-CG 3.31Å; L179-Q183 WeakPolarHBondContact O-CG 3.43Å; L179-Q183 PolarHBondContact O-N 3.44Å; Q183-E186 PolarHBondContact O-N 3.24Å; Q183-L187 WeakPolarHBondContact O-CB 3.25Å; Q183-L187 VanDerWaalsContact O-CG 3.29Å; Q183-L187 WeakPolarHBondContact O-CG 3.34Å; Q183-L187 PolarHBondContact O-N 2.96Å
184	R	87.4	Confident	88.3	Confident	186 Å²	186	110 Å²	110	70%	0.702	53%	0.527	S	S	*	.	H	α-helix	trans	-66.1	-42.3	177.2	-176.6	178.5	176.3	177.7	-0.8	111.9	Q180 R181 E182 L187 E188	Q180-R184 WeakPolarHBondContact O-CB 3.27Å; Q180-R184 PolarHBondContact O-N 3.46Å; R181-R184 WeakPolarHBondContact O-CB 3.25Å; R181-R184 PolarHBondContact O-N 3.15Å; E182-R184 VanDerWaalsContact C-N 3.29Å; E182-R184 PolarHBondContact O-N 3.06Å; R184-L187 PolarHBondContact O-N 2.92Å; R184-E188 WeakPolarHBondContact O-CB 3.3Å; R184-E188 PolarHBondContact O-N 2.95Å
185	E	89.9	Confident	88.3	Confident	64 Å²	64	111.2 Å²	111.2	30%	0.299	53%	0.527	S	S	.	.	H	α-helix	trans	-65.2	-39.5	176.5	-72.1	-179.3	-167.6	0	0	111.2	R181 E182 E188 R189	R181-E185 HydrophobicContact CG-CG 4.5Å; R181-E185 IonicContact CZ-OE1 2.75Å; R181-E185 IonicContact NE-OE1 3.99Å; R181-E185 PolarHBondContact NE-OE1 3.35Å; R181-E185 IonicContact NH2-OE1 2.7Å; R181-E185 PolarHBondContact NH2-OE1 3.41Å; R181-E185 WeakPolarHBondContact O-CG 3.44Å; R181-E185 PolarHBondContact O-N 3.46Å; E182-E185 PolarHBondContact O-N 3.06Å; E185-E188 PolarHBondContact O-N 3.49Å; E185-R189 WeakPolarHBondContact O-CG 3.45Å; E185-R189 PolarHBondContact O-N 2.86Å; E185-R189 IonicContact OE2-NH2 3.53Å
186	E	89	Confident	88.5	Confident	121 Å²	121	108 Å²	108	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-63.4	-44.5	173.5	-73.7	-179.4	173.4	0	0	112.4	E182 Q183 E188 R189 L190	E182-E186 WeakPolarHBondContact O-CG 3.29Å; E182-E186 PolarHBondContact O-N 3.21Å; Q183-E186 PolarHBondContact O-N 3.24Å; E186-E188 VanDerWaalsContact C-N 3.31Å; E186-E188 PolarHBondContact O-N 3.09Å; E186-R189 PolarHBondContact O-N 3.43Å; E186-L190 WeakPolarHBondContact O-CB 3.42Å; E186-L190 PolarHBondContact O-N 2.92Å
187	L	86.7	Confident	88.4	Confident	117 Å²	117	108.2 Å²	108.2	61%	0.613	52%	0.52	S	S	*	.	H	α-helix	trans	-61.6	-40	175	-76.6	171.4	0	0	0	111.8	Q183 R184 L190 N191	Q183-L187 WeakPolarHBondContact O-CB 3.25Å; Q183-L187 VanDerWaalsContact O-CG 3.29Å; Q183-L187 WeakPolarHBondContact O-CG 3.34Å; Q183-L187 PolarHBondContact O-N 2.96Å; R184-L187 PolarHBondContact O-N 2.92Å; L187-L190 PolarHBondContact O-N 2.93Å; L187-N191 VanDerWaalsContact O-CB 3.3Å; L187-N191 WeakPolarHBondContact O-CB 3.19Å; L187-N191 PolarHBondContact O-N 3.43Å
188	E	88.7	Confident	88.4	Confident	111 Å²	111	108.6 Å²	108.6	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-66	-43	177	-173	170	-172.7	0	0	111.6	R184 E185 E186 N191 Q192	R184-E188 WeakPolarHBondContact O-CB 3.3Å; R184-E188 PolarHBondContact O-N 2.95Å; E185-E188 PolarHBondContact O-N 3.49Å; E186-E188 VanDerWaalsContact C-N 3.31Å; E186-E188 PolarHBondContact O-N 3.09Å; E188-N191 PolarHBondContact O-N 2.74Å; E188-Q192 WeakPolarHBondContact O-CG 3.47Å; E188-Q192 PolarHBondContact O-N 2.73Å
189	R	93.6	Very high	88.6	Confident	149 Å²	149	110.6 Å²	110.6	56%	0.562	52%	0.52	S	S	*	.	H	α-helix	trans	-60.7	-45.7	173.3	-71.7	176.3	-165.4	154.4	9.8	111.8	E185 E186 N191 Q192 V193	E185-R189 WeakPolarHBondContact O-CG 3.45Å; E185-R189 PolarHBondContact O-N 2.86Å; E185-R189 IonicContact OE2-NH2 3.53Å; E186-R189 PolarHBondContact O-N 3.43Å; R189-N191 VanDerWaalsContact C-N 3.31Å; R189-N191 PolarHBondContact O-N 3.47Å; R189-Q192 PolarHBondContact O-N 2.91Å; R189-V193 WeakPolarHBondContact O-CG2 3.34Å; R189-V193 PolarHBondContact O-N 3.48Å; R189-V193 VanDerWaalsContact O-N 3.08Å
190	L	89.4	Confident	88.7	Confident	99 Å²	99	111.8 Å²	111.8	52%	0.518	52%	0.523	S	S	.	.	H	α-helix	trans	-62.2	-41	177.9	-177.1	63.2	0	0	0	111.2	E186 L187 Q192 V193 L194	E186-L190 WeakPolarHBondContact O-CB 3.42Å; E186-L190 PolarHBondContact O-N 2.92Å; L187-L190 PolarHBondContact O-N 2.93Å; L190-Q192 PolarHBondContact O-N 2.8Å; L190-V193 PolarHBondContact O-N 3.27Å; L190-L194 HydrophobicContact CG-CD1 4.08Å; L190-L194 HydrophobicContact CG-CG 4.48Å; L190-L194 WeakPolarHBondContact O-CB 3.46Å; L190-L194 WeakPolarHBondContact O-CG 3.18Å; L190-L194 PolarHBondContact O-N 2.81Å
191	N	87.2	Confident	88.6	Confident	99 Å²	99	109.9 Å²	109.9	53%	0.529	51%	0.513	S	S	.	.	H	α-helix	trans	-63.4	-41	177.5	-164.9	16.5	0	0	0	111.9	L187 E188 R189 V193 L194 E195	L187-N191 VanDerWaalsContact O-CB 3.3Å; L187-N191 WeakPolarHBondContact O-CB 3.19Å; L187-N191 PolarHBondContact O-N 3.43Å; E188-N191 PolarHBondContact O-N 2.74Å; R189-N191 VanDerWaalsContact C-N 3.31Å; R189-N191 PolarHBondContact O-N 3.47Å; N191-V193 PolarHBondContact O-N 3.17Å; N191-L194 PolarHBondContact O-N 3.5Å; N191-E195 WeakPolarHBondContact O-CB 3.42Å; N191-E195 PolarHBondContact O-N 3.4Å
192	Q	91.5	Very high	88.5	Confident	117 Å²	117	105.3 Å²	105.3	55%	0.547	50%	0.499	S	S	.	.	H	α-helix	trans	-61.3	-42.9	174.6	-71.4	170.5	10.1	0	0	112.2	E188 R189 L190 E195 A196	E188-Q192 WeakPolarHBondContact O-CG 3.47Å; E188-Q192 PolarHBondContact O-N 2.73Å; R189-Q192 PolarHBondContact O-N 2.91Å; L190-Q192 PolarHBondContact O-N 2.8Å; Q192-E195 PolarHBondContact O-N 3.26Å; Q192-A196 WeakPolarHBondContact O-CB 3.32Å; Q192-A196 PolarHBondContact O-N 3.32Å
193	V	93.3	Very high	88.6	Confident	77 Å²	77	105.5 Å²	105.5	47%	0.467	50%	0.5	S	S	.	.	H	α-helix	trans	-63.7	-46.8	176.3	173.6	0	0	0	0	110.7	R189 L190 N191 E195 A196 E197	R189-V193 WeakPolarHBondContact O-CG2 3.34Å; R189-V193 PolarHBondContact O-N 3.48Å; R189-V193 VanDerWaalsContact O-N 3.08Å; L190-V193 PolarHBondContact O-N 3.27Å; N191-V193 PolarHBondContact O-N 3.17Å; V193-E195 VanDerWaalsContact C-N 3.31Å; V193-E195 PolarHBondContact O-N 3.33Å; V193-A196 PolarHBondContact O-N 2.73Å; V193-E197 HydrophobicContact CG1-CG 4.45Å; V193-E197 WeakPolarHBondContact O-CG 3.46Å; V193-E197 PolarHBondContact O-N 2.75Å
194	L	84.9	Confident	88.6	Confident	90 Å²	90	103.2 Å²	103.2	47%	0.471	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-38.2	178	-74.1	170.9	0	0	0	112.3	L190 N191 K198	L190-L194 HydrophobicContact CG-CD1 4.08Å; L190-L194 HydrophobicContact CG-CG 4.48Å; L190-L194 WeakPolarHBondContact O-CB 3.46Å; L190-L194 WeakPolarHBondContact O-CG 3.18Å; L190-L194 PolarHBondContact O-N 2.81Å; N191-L194 PolarHBondContact O-N 3.5Å; L194-K198 VanDerWaalsContact O-CB 3.27Å; L194-K198 WeakPolarHBondContact O-CB 3.41Å; L194-K198 PolarHBondContact O-N 3.28Å
195	E	88.8	Confident	88.4	Confident	106 Å²	106	95.2 Å²	95.2	50%	0.495	47%	0.465	S	S	.	.	H	α-helix	trans	-69.8	-37.5	177.2	-169.8	152.5	-141.4	0	0	111.9	N191 Q192 V193 K198 Q199	N191-E195 WeakPolarHBondContact O-CB 3.42Å; N191-E195 PolarHBondContact O-N 3.4Å; Q192-E195 PolarHBondContact O-N 3.26Å; V193-E195 VanDerWaalsContact C-N 3.31Å; V193-E195 PolarHBondContact O-N 3.33Å; E195-K198 PolarHBondContact O-N 3.43Å; E195-Q199 VanDerWaalsContact O-CG 3.32Å; E195-Q199 WeakPolarHBondContact O-CG 3.39Å; E195-Q199 PolarHBondContact O-N 3.04Å
196	A	91.8	Very high	88.3	Confident	44 Å²	44	98 Å²	98	36%	0.364	48%	0.478	S	S	.	.	H	α-helix	trans	-65.5	-45.7	172.6	0	0	0	0	0	112.2	Q192 V193 K198 Q199 Q200	Q192-A196 WeakPolarHBondContact O-CB 3.32Å; Q192-A196 PolarHBondContact O-N 3.32Å; V193-A196 PolarHBondContact O-N 2.73Å; A196-K198 VanDerWaalsContact C-N 3.3Å; A196-K198 PolarHBondContact O-N 3.48Å; A196-Q199 PolarHBondContact O-N 3.38Å; A196-Q200 WeakPolarHBondContact O-CG 3.45Å; A196-Q200 PolarHBondContact O-N 3.11Å
197	E	87.2	Confident	88.3	Confident	109 Å²	109	98 Å²	98	51%	0.509	48%	0.479	S	S	.	.	H	α-helix	trans	-61.5	-39.6	175.2	-74.9	-177.8	174.2	0	0	111.6	V193 Q200 F201	V193-E197 HydrophobicContact CG1-CG 4.45Å; V193-E197 WeakPolarHBondContact O-CG 3.46Å; V193-E197 PolarHBondContact O-N 2.75Å; E197-Q200 PolarHBondContact O-N 3.1Å; E197-F201 WeakPolarHBondContact O-CB 3.06Å; E197-F201 PolarHBondContact O-N 3.41Å
198	K	85.6	Confident	88.1	Confident	116 Å²	116	93.9 Å²	93.9	50%	0.504	46%	0.457	S	S	.	.	H	α-helix	trans	-61.3	-44.5	174.1	179.8	-170.9	167.3	-164.8	0	111.6	L194 E195 A196 F201 E202	L194-K198 VanDerWaalsContact O-CB 3.27Å; L194-K198 WeakPolarHBondContact O-CB 3.41Å; L194-K198 PolarHBondContact O-N 3.28Å; E195-K198 PolarHBondContact O-N 3.43Å; A196-K198 VanDerWaalsContact C-N 3.3Å; A196-K198 PolarHBondContact O-N 3.48Å; K198-F201 PolarHBondContact O-N 3.1Å; K198-E202 WeakPolarHBondContact CE-OE1 3.43Å; K198-E202 IonicContact NZ-OE1 3.81Å; K198-E202 WeakPolarHBondContact O-CG 3.47Å; K198-E202 PolarHBondContact O-N 3.5Å
199	Q	90.8	Very high	88	Confident	106 Å²	106	95.2 Å²	95.2	50%	0.495	46%	0.457	S	S	.	.	H	α-helix	trans	-62	-46.8	177.4	-74.2	171.4	9.7	0	0	111.1	E195 A196 F201 E202 E203	E195-Q199 VanDerWaalsContact O-CG 3.32Å; E195-Q199 WeakPolarHBondContact O-CG 3.39Å; E195-Q199 PolarHBondContact O-N 3.04Å; A196-Q199 PolarHBondContact O-N 3.38Å; Q199-F201 VanDerWaalsContact C-N 3.3Å; Q199-F201 PolarHBondContact O-N 3.11Å; Q199-E202 PolarHBondContact O-N 3.35Å; Q199-E202 VanDerWaalsContact O-N 3.13Å; Q199-E203 WeakPolarHBondContact O-CG 3.39Å; Q199-E203 PolarHBondContact O-N 3.49Å
200	Q	88.9	Confident	87.8	Confident	124 Å²	124	94.3 Å²	94.3	58%	0.579	46%	0.461	S	S	*	.	H	α-helix	trans	-58.4	-41.9	175.5	-71.5	179.9	-9.7	0	0	112.1	A196 E197 E203 V204	A196-Q200 WeakPolarHBondContact O-CG 3.45Å; A196-Q200 PolarHBondContact O-N 3.11Å; E197-Q200 PolarHBondContact O-N 3.1Å; Q200-E203 PolarHBondContact O-N 2.9Å; Q200-V204 WeakPolarHBondContact O-CG2 3.48Å; Q200-V204 PolarHBondContact O-N 3.37Å
201	F	82.9	Confident	87.7	Confident	76 Å²	76	94.3 Å²	94.3	33%	0.333	46%	0.458	S	S	.	.	H	α-helix	trans	-63.4	-42.7	175.8	-174	-89.8	0	0	0	112.2	E197 K198 Q199 E203 V204 V205 L340 K344	E197-F201 WeakPolarHBondContact O-CB 3.06Å; E197-F201 PolarHBondContact O-N 3.41Å; K198-F201 PolarHBondContact O-N 3.1Å; Q199-F201 VanDerWaalsContact C-N 3.3Å; Q199-F201 PolarHBondContact O-N 3.11Å; F201-E203 VanDerWaalsContact C-N 3.34Å; F201-V204 PolarHBondContact O-N 3.39Å; F201-V205 HydrophobicContact CD1-CG2 3.98Å; F201-V205 HydrophobicContact CE1-CG2 3.65Å; F201-V205 HydrophobicContact CZ-CG2 4.11Å; F201-V205 WeakPolarHBondContact O-CB 3.41Å; F201-V205 VanDerWaalsContact O-CG2 3.3Å; F201-V205 WeakPolarHBondContact O-CG2 3.15Å; F201-V205 PolarHBondContact O-N 3.03Å; F201-L340 HydrophobicContact CE2-CD2 3.86Å; F201-L340 HydrophobicContact CZ-CB 4.08Å; F201-L340 HydrophobicContact CZ-CD2 4.11Å; F201-K344 HydrophobicContact CE1-CB 4.48Å; F201-K344 HydrophobicContact CE1-CD 4.45Å
202	E	86.2	Confident	87.5	Confident	72 Å²	72	91.8 Å²	91.8	34%	0.336	44%	0.443	S	S	.	.	H	α-helix	trans	-64.4	-37.6	177.1	-74.7	178.1	177.7	0	0	112.1	K198 Q199 Q206	K198-E202 WeakPolarHBondContact CE-OE1 3.43Å; K198-E202 IonicContact NZ-OE1 3.81Å; K198-E202 WeakPolarHBondContact O-CG 3.47Å; K198-E202 PolarHBondContact O-N 3.5Å; Q199-E202 PolarHBondContact O-N 3.35Å; Q199-E202 VanDerWaalsContact O-N 3.13Å; E202-Q206 VanDerWaalsContact O-CG 3.29Å; E202-Q206 WeakPolarHBondContact O-CG 3.36Å; E202-Q206 PolarHBondContact O-N 3.02Å
203	E	88.8	Confident	87.5	Confident	114 Å²	114	90.4 Å²	90.4	53%	0.533	44%	0.437	S	S	.	.	H	α-helix	trans	-61.9	-52.4	173.3	-72.9	173.3	178	0	0	111.4	Q199 Q200 F201 V205 Q206 E207	Q199-E203 WeakPolarHBondContact O-CG 3.39Å; Q199-E203 PolarHBondContact O-N 3.49Å; Q200-E203 PolarHBondContact O-N 2.9Å; F201-E203 VanDerWaalsContact C-N 3.34Å; E203-V205 VanDerWaalsContact C-N 3.29Å; E203-V205 PolarHBondContact O-N 3.42Å; E203-Q206 WeakPolarHBondContact O-CA 3.31Å; E203-Q206 WeakPolarHBondContact O-CB 3.47Å; E203-Q206 PolarHBondContact O-N 3.47Å; E203-E207 WeakPolarHBondContact O-CG 3.47Å; E203-E207 PolarHBondContact O-N 3Å
204	V	87.3	Confident	87.4	Confident	70 Å²	70	91.3 Å²	91.3	42%	0.424	44%	0.436	S	S	.	.	H	α-helix	trans	-58.8	-41.5	178.4	172.1	0	0	0	0	111.3	Q200 F201 Q206 E207 L208	Q200-V204 WeakPolarHBondContact O-CG2 3.48Å; Q200-V204 PolarHBondContact O-N 3.37Å; F201-V204 PolarHBondContact O-N 3.39Å; V204-Q206 VanDerWaalsContact C-N 3.3Å; V204-Q206 PolarHBondContact O-N 2.88Å; V204-E207 PolarHBondContact O-N 3.29Å; V204-L208 HydrophobicContact CG1-CD1 4Å; V204-L208 HydrophobicContact CG1-CG 4.36Å; V204-L208 WeakPolarHBondContact O-CB 3.37Å; V204-L208 VanDerWaalsContact O-CG 3.29Å; V204-L208 WeakPolarHBondContact O-CG 3.41Å; V204-L208 PolarHBondContact O-N 2.76Å
205	V	84.7	Confident	87.7	Confident	18 Å²	18	87.6 Å²	87.6	11%	0.109	42%	0.416	C	S	.	.	H	α-helix	trans	-64.3	-35.8	176.2	169.3	0	0	0	0	111.7	F201 E203 R209 L337	F201-V205 HydrophobicContact CD1-CG2 3.98Å; F201-V205 HydrophobicContact CE1-CG2 3.65Å; F201-V205 HydrophobicContact CZ-CG2 4.11Å; F201-V205 WeakPolarHBondContact O-CB 3.41Å; F201-V205 VanDerWaalsContact O-CG2 3.3Å; F201-V205 WeakPolarHBondContact O-CG2 3.15Å; F201-V205 PolarHBondContact O-N 3.03Å; E203-V205 VanDerWaalsContact C-N 3.29Å; E203-V205 PolarHBondContact O-N 3.42Å; V205-R209 VanDerWaalsContact O-CG 3.24Å; V205-R209 WeakPolarHBondContact O-CG 3.35Å; V205-R209 PolarHBondContact O-N 3.4Å; V205-L337 HydrophobicContact CG1-CD2 4.44Å
206	Q	87.5	Confident	87.8	Confident	122 Å²	122	87 Å²	87	57%	0.57	41%	0.412	S	S	*	.	H	α-helix	trans	-68.7	-43.7	175.2	-73.8	175.8	30.6	0	0	111.7	E202 E203 V204 R209 M210	E202-Q206 VanDerWaalsContact O-CG 3.29Å; E202-Q206 WeakPolarHBondContact O-CG 3.36Å; E202-Q206 PolarHBondContact O-N 3.02Å; E203-Q206 WeakPolarHBondContact O-CA 3.31Å; E203-Q206 WeakPolarHBondContact O-CB 3.47Å; E203-Q206 PolarHBondContact O-N 3.47Å; V204-Q206 VanDerWaalsContact C-N 3.3Å; V204-Q206 PolarHBondContact O-N 2.88Å; Q206-R209 WeakPolarHBondContact O-CB 3.29Å; Q206-R209 PolarHBondContact O-N 2.98Å; Q206-M210 WeakPolarHBondContact O-CG 3.24Å; Q206-M210 PolarHBondContact O-N 2.92Å
207	E	87.7	Confident	87.9	Confident	123 Å²	123	91.2 Å²	91.2	58%	0.575	42%	0.419	S	S	*	.	H	α-helix	trans	-58.9	-50.4	176.5	-70.4	-179.3	166	0	0	111.4	E203 V204 R209 M210 E211	E203-E207 WeakPolarHBondContact O-CG 3.47Å; E203-E207 PolarHBondContact O-N 3Å; V204-E207 PolarHBondContact O-N 3.29Å; E207-R209 PolarHBondContact O-N 3.22Å; E207-M210 WeakPolarHBondContact O-CB 3.32Å; E207-M210 PolarHBondContact O-N 2.97Å; E207-E211 PolarHBondContact O-N 2.94Å
208	L	83.8	Confident	88.1	Confident	30 Å²	30	88.6 Å²	88.6	16%	0.157	41%	0.406	C	S	.	.	H	α-helix	trans	-59.8	-33.6	177.8	-69.6	173.9	0	0	0	112.7	V204 Q212 L333 L337 L340	V204-L208 HydrophobicContact CG1-CD1 4Å; V204-L208 HydrophobicContact CG1-CG 4.36Å; V204-L208 WeakPolarHBondContact O-CB 3.37Å; V204-L208 VanDerWaalsContact O-CG 3.29Å; V204-L208 WeakPolarHBondContact O-CG 3.41Å; V204-L208 PolarHBondContact O-N 2.76Å; L208-Q212 WeakPolarHBondContact O-CB 3.47Å; L208-Q212 PolarHBondContact O-N 3.48Å; L208-L333 HydrophobicContact CD2-CD2 3.7Å; L208-L337 HydrophobicContact CB-CD2 3.87Å; L208-L337 HydrophobicContact CB-CG 4.35Å; L208-L337 HydrophobicContact CD1-CD2 4.25Å; L208-L340 HydrophobicContact CD1-CD1 4.11Å
209	R	85.3	Confident	88.4	Confident	139 Å²	139	85.3 Å²	85.3	53%	0.525	39%	0.394	S	S	.	.	H	α-helix	trans	-69.8	-39.9	174.2	-75.9	173.4	-178.3	-169.6	1.9	112.2	V205 Q206 E207 Q212 E213 L337	V205-R209 VanDerWaalsContact O-CG 3.24Å; V205-R209 WeakPolarHBondContact O-CG 3.35Å; V205-R209 PolarHBondContact O-N 3.4Å; Q206-R209 WeakPolarHBondContact O-CB 3.29Å; Q206-R209 PolarHBondContact O-N 2.98Å; E207-R209 PolarHBondContact O-N 3.22Å; R209-Q212 PolarHBondContact O-N 3.34Å; R209-E213 PolarHBondContact O-N 3.3Å; R209-L337 HydrophobicContact CG-CD1 4.26Å; R209-L337 HydrophobicContact CG-CD2 4.45Å
210	M	89.4	Confident	88.6	Confident	129 Å²	129	84.1 Å²	84.1	64%	0.635	39%	0.389	S	S	*	.	H	α-helix	trans	-64.3	-42.6	176.3	-69.6	-66	-69.7	0	0	111.1	Q206 E207 E213 Q214	Q206-M210 WeakPolarHBondContact O-CG 3.24Å; Q206-M210 PolarHBondContact O-N 2.92Å; E207-M210 WeakPolarHBondContact O-CB 3.32Å; E207-M210 PolarHBondContact O-N 2.97Å; M210-E213 PolarHBondContact O-N 2.88Å; M210-Q214 PolarHBondContact O-N 3.32Å
211	E	88	Confident	88.9	Confident	99 Å²	99	83.2 Å²	83.2	46%	0.463	39%	0.387	S	S	.	.	H	α-helix	trans	-61.2	-44.6	173.4	-70.8	-175.5	169.7	0	0	111.8	E207 E213 Q214 I215	E207-E211 PolarHBondContact O-N 2.94Å; E211-E213 VanDerWaalsContact C-N 3.35Å; E211-E213 PolarHBondContact O-N 3.34Å; E211-Q214 WeakPolarHBondContact O-CB 3.29Å; E211-Q214 PolarHBondContact O-N 3.47Å; E211-Q214 VanDerWaalsContact O-N 3.13Å; E211-I215 WeakPolarHBondContact O-CG1 3.45Å; E211-I215 PolarHBondContact O-N 3.05Å
212	Q	83.2	Confident	89.4	Confident	47 Å²	47	80.1 Å²	80.1	22%	0.22	37%	0.374	C	S	.	.	H	α-helix	trans	-57.8	-46	176.3	-179.2	-179.1	56.1	0	0	112	L208 R209 Q214 I215 K216	L208-Q212 WeakPolarHBondContact O-CB 3.47Å; L208-Q212 PolarHBondContact O-N 3.48Å; R209-Q212 PolarHBondContact O-N 3.34Å; Q212-Q214 VanDerWaalsContact C-N 3.3Å; Q212-Q214 PolarHBondContact O-N 3.46Å; Q212-I215 PolarHBondContact O-N 2.97Å; Q212-K216 WeakPolarHBondContact O-CB 3.31Å; Q212-K216 PolarHBondContact O-N 3Å
213	E	91.4	Very high	89.7	Confident	88 Å²	88	78.6 Å²	78.6	41%	0.411	38%	0.375	S	S	.	.	H	α-helix	trans	-68.7	-28.8	177.6	-76.5	-61.8	154.7	0	0	112.6	R209 M210 E211 R217	R209-E213 PolarHBondContact O-N 3.3Å; M210-E213 PolarHBondContact O-N 2.88Å; E211-E213 VanDerWaalsContact C-N 3.35Å; E211-E213 PolarHBondContact O-N 3.34Å; E213-R217 WeakPolarHBondContact O-CG 3.49Å; E213-R217 PolarHBondContact O-N 3.42Å; E213-R217 PolarHBondContact O-NE 3.23Å
214	Q	91.4	Very high	90.1	Very high	96 Å²	96	81.2 Å²	81.2	45%	0.449	38%	0.38	S	S	.	.	H	α-helix	trans	-69.1	-50.8	172.5	178.5	172.2	-14	0	0	111.5	M210 E211 Q212 K216 R217 E218	M210-Q214 PolarHBondContact O-N 3.32Å; E211-Q214 WeakPolarHBondContact O-CB 3.29Å; E211-Q214 PolarHBondContact O-N 3.47Å; E211-Q214 VanDerWaalsContact O-N 3.13Å; Q212-Q214 VanDerWaalsContact C-N 3.3Å; Q212-Q214 PolarHBondContact O-N 3.46Å; Q214-K216 PolarHBondContact O-N 2.9Å; Q214-R217 WeakPolarHBondContact O-CB 3.29Å; Q214-R217 PolarHBondContact O-N 2.88Å; Q214-E218 WeakPolarHBondContact CG-OE1 3.49Å; Q214-E218 PolarHBondContact NE2-OE1 3.33Å; Q214-E218 PolarHBondContact O-N 3.22Å
215	I	90.1	Very high	90.4	Very high	11 Å²	11	80.7 Å²	80.7	6%	0.056	38%	0.378	C	S	.	.	H	α-helix	trans	-59.3	-39.3	178.9	-69.7	161.2	0	0	0	110.7	E211 Q212 R217 E218 L219 Y326 Q329 L333	E211-I215 WeakPolarHBondContact O-CG1 3.45Å; E211-I215 PolarHBondContact O-N 3.05Å; Q212-I215 PolarHBondContact O-N 2.97Å; I215-R217 PolarHBondContact O-N 3.41Å; I215-E218 PolarHBondContact O-N 2.98Å; I215-L219 VanDerWaalsContact O-CB 3.31Å; I215-L219 WeakPolarHBondContact O-CB 2.96Å; I215-L219 PolarHBondContact O-N 2.99Å; I215-Y326 HydrophobicContact CG2-CD1 4.13Å; I215-Y326 WeakPolarHBondContact CG2-O 3.23Å; I215-Q329 HydrophobicContact CD1-CG 3.82Å; I215-L333 HydrophobicContact CD1-CD1 3.24Å
216	K	91	Very high	90.9	Very high	94 Å²	94	81.1 Å²	81.1	41%	0.409	38%	0.38	S	S	.	.	H	α-helix	trans	-60.5	-44.5	174.9	-175.7	-178.5	172.2	-167.7	0	112.1	Q212 Q214 L219 E220	Q212-K216 WeakPolarHBondContact O-CB 3.31Å; Q212-K216 PolarHBondContact O-N 3Å; Q214-K216 PolarHBondContact O-N 2.9Å; K216-L219 PolarHBondContact O-N 3.32Å; K216-E220 WeakPolarHBondContact O-CG 3.36Å; K216-E220 PolarHBondContact O-N 2.98Å
217	R	94.1	Very high	91.3	Very high	132 Å²	132	82.8 Å²	82.8	50%	0.498	39%	0.385	S	S	.	.	H	α-helix	trans	-62.4	-43.4	175	-77.7	176.8	-83.8	139.8	-9.3	111.8	E213 Q214 I215 E220 L221	E213-R217 WeakPolarHBondContact O-CG 3.49Å; E213-R217 PolarHBondContact O-N 3.42Å; E213-R217 PolarHBondContact O-NE 3.23Å; Q214-R217 WeakPolarHBondContact O-CB 3.29Å; Q214-R217 PolarHBondContact O-N 2.88Å; I215-R217 PolarHBondContact O-N 3.41Å; R217-E220 PolarHBondContact O-N 3.35Å; R217-L221 WeakPolarHBondContact O-CG 3.45Å; R217-L221 PolarHBondContact O-N 2.98Å
218	E	92.6	Very high	91.7	Very high	54 Å²	54	78.5 Å²	78.5	25%	0.252	37%	0.374	S	S	.	.	H	α-helix	trans	-62.7	-45.5	177.2	-70.5	177.3	-161.4	0	0	111.2	Q214 I215 E220 L221 T222 Y326	Q214-E218 WeakPolarHBondContact CG-OE1 3.49Å; Q214-E218 PolarHBondContact NE2-OE1 3.33Å; Q214-E218 PolarHBondContact O-N 3.22Å; I215-E218 PolarHBondContact O-N 2.98Å; E218-E220 VanDerWaalsContact C-N 3.35Å; E218-E220 PolarHBondContact O-N 3.19Å; E218-L221 WeakPolarHBondContact O-CB 3.45Å; E218-L221 PolarHBondContact O-N 3.08Å; E218-L221 VanDerWaalsContact O-N 3.1Å; E218-T222 PolarHBondContact O-N 3.15Å; E218-T222 PolarHBondContact O-OG1 3.04Å; E218-Y326 HydrophobicContact CB-CE1 4.19Å; E218-Y326 HydrophobicContact CB-CE2 4.29Å; E218-Y326 WeakPolarHBondContact OE2-CE1 3.48Å; E218-Y326 PolarHBondContact OE2-OH 2.91Å
219	L	91.6	Very high	92.2	Very high	47 Å²	47	77.1 Å²	77.1	25%	0.246	37%	0.367	C	S	.	.	H	α-helix	trans	-60.9	-40.9	176	-168.7	150.4	0	0	0	112.4	I215 K216 L221 T222 A223	I215-L219 VanDerWaalsContact O-CB 3.31Å; I215-L219 WeakPolarHBondContact O-CB 2.96Å; I215-L219 PolarHBondContact O-N 2.99Å; K216-L219 PolarHBondContact O-N 3.32Å; L219-L221 VanDerWaalsContact C-N 3.34Å; L219-T222 PolarHBondContact O-N 3.44Å; L219-A223 WeakPolarHBondContact O-CB 3.49Å; L219-A223 PolarHBondContact O-N 3.18Å
220	E	94.5	Very high	92.7	Very high	82 Å²	82	74.9 Å²	74.9	38%	0.383	36%	0.362	S	S	.	.	H	α-helix	trans	-62.9	-38.8	174.1	-76.2	177.8	-161	0	0	112.4	K216 R217 E218 R224	K216-E220 WeakPolarHBondContact O-CG 3.36Å; K216-E220 PolarHBondContact O-N 2.98Å; R217-E220 PolarHBondContact O-N 3.35Å; E218-E220 VanDerWaalsContact C-N 3.35Å; E218-E220 PolarHBondContact O-N 3.19Å; E220-R224 VanDerWaalsContact O-CG 3.29Å; E220-R224 WeakPolarHBondContact O-CG 3.4Å; E220-R224 PolarHBondContact O-N 2.94Å; E220-R224 VanDerWaalsContact O-N 3.08Å
221	L	95.3	Very high	93	Very high	104 Å²	104	73.1 Å²	73.1	55%	0.545	35%	0.353	S	S	.	.	H	α-helix	trans	-66.8	-47.6	175.6	-69.3	172.2	0	0	0	111.2	R217 E218 L219 A223 R224 C225	R217-L221 WeakPolarHBondContact O-CG 3.45Å; R217-L221 PolarHBondContact O-N 2.98Å; E218-L221 WeakPolarHBondContact O-CB 3.45Å; E218-L221 PolarHBondContact O-N 3.08Å; E218-L221 VanDerWaalsContact O-N 3.1Å; L219-L221 VanDerWaalsContact C-N 3.34Å; L221-A223 VanDerWaalsContact C-N 3.31Å; L221-A223 PolarHBondContact O-N 3.47Å; L221-R224 PolarHBondContact O-N 2.95Å; L221-R224 VanDerWaalsContact O-N 3.15Å; L221-C225 PolarHBondContact O-N 2.98Å; L221-C225 PolarHBondContact O-SG 3Å; L221-C225 VanDerWaalsContact O-SG 3.38Å
222	T	93.3	Very high	93.3	Very high	11 Å²	11	72.2 Å²	72.2	7%	0.067	35%	0.348	C	S	.	.	H	α-helix	trans	-58.5	-43.4	176.5	-56.4	0	0	0	0	111.1	E218 L219 R224 C225 L226 L319 E322 R323	E218-T222 PolarHBondContact O-N 3.15Å; E218-T222 PolarHBondContact O-OG1 3.04Å; L219-T222 PolarHBondContact O-N 3.44Å; T222-R224 PolarHBondContact O-N 3.49Å; T222-C225 PolarHBondContact O-N 3.33Å; T222-L226 WeakPolarHBondContact O-CB 3.3Å; T222-L226 PolarHBondContact O-N 3.47Å; T222-L319 HydrophobicContact CG2-CB 4.29Å; T222-L319 HydrophobicContact CG2-CD2 4.05Å; T222-L319 WeakPolarHBondContact CG2-O 3.33Å; T222-E322 HydrophobicContact CG2-CB 4.04Å; T222-R323 HydrophobicContact CG2-CB 4.12Å
223	A	93.5	Very high	93.8	Very high	41 Å²	41	71.5 Å²	71.5	34%	0.339	35%	0.345	S	S	.	.	H	α-helix	trans	-62.7	-39.2	176.6	0	0	0	0	0	112.9	L219 L221 K227	L219-A223 WeakPolarHBondContact O-CB 3.49Å; L219-A223 PolarHBondContact O-N 3.18Å; L221-A223 VanDerWaalsContact C-N 3.31Å; L221-A223 PolarHBondContact O-N 3.47Å; A223-K227 PolarHBondContact O-N 3.45Å; A223-K227 VanDerWaalsContact O-N 3.11Å
224	R	96.1	Very high	93.9	Very high	169 Å²	169	71.5 Å²	71.5	64%	0.638	34%	0.343	S	S	*	.	H	α-helix	trans	-66	-44.2	174.6	-72.7	174.5	-166	-175.1	8.3	111.7	E220 L221 T222 K227 G228	E220-R224 VanDerWaalsContact O-CG 3.29Å; E220-R224 WeakPolarHBondContact O-CG 3.4Å; E220-R224 PolarHBondContact O-N 2.94Å; E220-R224 VanDerWaalsContact O-N 3.08Å; L221-R224 PolarHBondContact O-N 2.95Å; L221-R224 VanDerWaalsContact O-N 3.15Å; T222-R224 PolarHBondContact O-N 3.49Å; R224-K227 PolarHBondContact O-N 3.46Å; R224-G228 PolarHBondContact O-N 3.36Å; R224-G228 VanDerWaalsContact O-N 3.1Å
225	C	94.5	Very high	94.1	Very high	59 Å²	59	72.2 Å²	72.2	40%	0.399	35%	0.346	S	S	.	.	H	α-helix	trans	-60.3	-46.3	176.2	-71.3	0	0	0	0	111.7	L221 T222 K227 G228 V229 L319	L221-C225 PolarHBondContact O-N 2.98Å; L221-C225 PolarHBondContact O-SG 3Å; L221-C225 VanDerWaalsContact O-SG 3.38Å; T222-C225 PolarHBondContact O-N 3.33Å; C225-K227 VanDerWaalsContact C-N 3.32Å; C225-K227 PolarHBondContact O-N 3.41Å; C225-G228 PolarHBondContact O-N 2.93Å; C225-G228 VanDerWaalsContact O-N 3.11Å; C225-V229 PolarHBondContact O-N 3.39Å; C225-L319 HydrophobicContact CB-CD1 3.93Å; C225-L319 HydrophobicContact CB-CD2 4.05Å
226	L	94.5	Very high	94.4	Very high	27 Å²	27	72.6 Å²	72.6	14%	0.141	35%	0.349	C	S	.	.	H	α-helix	trans	-59.1	-44.1	178.5	-169.6	116	0	0	0	111.4	T222 G228 V229 E230 L319 E320	T222-L226 WeakPolarHBondContact O-CB 3.3Å; T222-L226 PolarHBondContact O-N 3.47Å; L226-G228 VanDerWaalsContact C-N 3.31Å; L226-G228 PolarHBondContact O-N 3.38Å; L226-V229 PolarHBondContact O-N 2.88Å; L226-E230 WeakPolarHBondContact O-CB 3.34Å; L226-E230 PolarHBondContact O-N 3.16Å; L226-L319 HydrophobicContact CB-CB 4.49Å; L226-L319 HydrophobicContact CD1-CB 3.81Å; L226-E320 HydrophobicContact CD1-CB 4.29Å; L226-E320 WeakPolarHBondContact CD1-OE2 3.43Å
227	K	95.6	Very high	94.5	Very high	156 Å²	156	73.4 Å²	73.4	68%	0.678	35%	0.349	S	S	*	.	H	α-helix	trans	-61.1	-37.9	175.5	-171.6	178.9	-179.5	-178.7	0	112.6	A223 R224 C225 E230 Q231	A223-K227 PolarHBondContact O-N 3.45Å; A223-K227 VanDerWaalsContact O-N 3.11Å; R224-K227 PolarHBondContact O-N 3.46Å; C225-K227 VanDerWaalsContact C-N 3.32Å; C225-K227 PolarHBondContact O-N 3.41Å; K227-E230 PolarHBondContact O-N 3.44Å; K227-Q231 PolarHBondContact O-N 3.1Å; K227-Q231 VanDerWaalsContact O-N 3.09Å
228	G	96	Very high	94.6	Very high	33 Å²	33	73.1 Å²	73.1	34%	0.34	35%	0.353	S	S	.	.	H	α-helix	trans	-62.5	-49.8	174.5	0	0	0	0	0	112.2	R224 C225 L226 E230 Q231 E232	R224-G228 PolarHBondContact O-N 3.36Å; R224-G228 VanDerWaalsContact O-N 3.1Å; C225-G228 PolarHBondContact O-N 2.93Å; C225-G228 VanDerWaalsContact O-N 3.11Å; L226-G228 VanDerWaalsContact C-N 3.31Å; L226-G228 PolarHBondContact O-N 3.38Å; G228-E230 VanDerWaalsContact C-N 3.29Å; G228-E230 PolarHBondContact O-N 2.9Å; G228-Q231 WeakPolarHBondContact O-CB 3.49Å; G228-Q231 PolarHBondContact O-N 3.04Å; G228-Q231 VanDerWaalsContact O-N 3.15Å; G228-E232 PolarHBondContact O-N 3.37Å
229	V	95.6	Very high	94.7	Very high	2 Å²	2	74.7 Å²	74.7	1%	0.012	36%	0.363	C	S	.	.	H	α-helix	trans	-62	-37.7	177.5	176.1	0	0	0	0	111.6	C225 L226 Q231 E232 K233 N312 R315 L319	C225-V229 PolarHBondContact O-N 3.39Å; L226-V229 PolarHBondContact O-N 2.88Å; V229-Q231 VanDerWaalsContact C-N 3.33Å; V229-Q231 PolarHBondContact O-N 3.39Å; V229-E232 PolarHBondContact O-N 2.97Å; V229-K233 WeakPolarHBondContact O-CB 3.46Å; V229-K233 WeakPolarHBondContact O-CG 3.42Å; V229-K233 PolarHBondContact O-N 3.44Å; V229-N312 HydrophobicContact CG1-CB 3.97Å; V229-N312 VanDerWaalsContact CG1-O 3.3Å; V229-N312 WeakPolarHBondContact CG1-O 3.49Å; V229-R315 HydrophobicContact CG2-CG 4.16Å; V229-L319 HydrophobicContact CG2-CD1 4.06Å
230	E	94.1	Very high	94.8	Very high	92 Å²	92	73.8 Å²	73.8	43%	0.43	36%	0.359	S	S	.	.	H	α-helix	trans	-66.3	-35.5	177	-168	173.6	-160.1	0	0	112.5	L226 K227 G228 K234	L226-E230 WeakPolarHBondContact O-CB 3.34Å; L226-E230 PolarHBondContact O-N 3.16Å; K227-E230 PolarHBondContact O-N 3.44Å; G228-E230 VanDerWaalsContact C-N 3.29Å; G228-E230 PolarHBondContact O-N 2.9Å; E230-K234 WeakPolarHBondContact O-CG 3.48Å; E230-K234 PolarHBondContact O-N 2.93Å; E230-K234 VanDerWaalsContact O-N 3.17Å
231	Q	95.8	Very high	94.8	Very high	92 Å²	92	75.5 Å²	75.5	43%	0.43	37%	0.367	S	S	.	.	H	α-helix	trans	-67.7	-47.9	174	-176.6	58.1	33.9	0	0	111.3	K227 G228 V229 K233 K234 E235	K227-Q231 PolarHBondContact O-N 3.1Å; K227-Q231 VanDerWaalsContact O-N 3.09Å; G228-Q231 WeakPolarHBondContact O-CB 3.49Å; G228-Q231 PolarHBondContact O-N 3.04Å; G228-Q231 VanDerWaalsContact O-N 3.15Å; V229-Q231 VanDerWaalsContact C-N 3.33Å; V229-Q231 PolarHBondContact O-N 3.39Å; Q231-K233 VanDerWaalsContact C-N 3.27Å; Q231-K233 PolarHBondContact O-N 2.85Å; Q231-K234 WeakPolarHBondContact O-CB 3.46Å; Q231-K234 PolarHBondContact O-N 2.92Å; Q231-E235 PolarHBondContact NE2-OE1 3.44Å; Q231-E235 PolarHBondContact O-N 2.87Å
232	E	94.6	Very high	94.8	Very high	80 Å²	80	73.6 Å²	73.6	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-57.6	-40.2	174.8	-69.6	175.2	-166	0	0	111.8	G228 V229 K234 E235 L236 N312	G228-E232 PolarHBondContact O-N 3.37Å; V229-E232 PolarHBondContact O-N 2.97Å; E232-K234 VanDerWaalsContact C-N 3.3Å; E232-K234 PolarHBondContact O-N 3.29Å; E232-E235 PolarHBondContact O-N 2.73Å; E232-L236 WeakPolarHBondContact O-CB 3.25Å; E232-L236 WeakPolarHBondContact O-CG 3.34Å; E232-L236 PolarHBondContact O-N 3.49Å; E232-N312 WeakPolarHBondContact CB-ND2 3.4Å; E232-N312 PolarHBondContact OE2-ND2 2.92Å
233	K	93.8	Very high	94.9	Very high	32 Å²	32	73.7 Å²	73.7	14%	0.139	36%	0.362	C	S	.	.	H	α-helix	trans	-62.1	-33.4	173.7	-85.6	177.7	150.8	-176	0	113.6	V229 Q231 R237 M309 N312 E313	V229-K233 WeakPolarHBondContact O-CB 3.46Å; V229-K233 WeakPolarHBondContact O-CG 3.42Å; V229-K233 PolarHBondContact O-N 3.44Å; Q231-K233 VanDerWaalsContact C-N 3.27Å; Q231-K233 PolarHBondContact O-N 2.85Å; K233-R237 WeakPolarHBondContact O-CB 3.35Å; K233-R237 VanDerWaalsContact O-CG 3.27Å; K233-R237 WeakPolarHBondContact O-CG 3.41Å; K233-R237 PolarHBondContact O-N 3.38Å; K233-R237 VanDerWaalsContact O-N 3.12Å; K233-R237 PolarHBondContact O-NE 2.9Å; K233-M309 HydrophobicContact CB-SD 4.28Å; K233-M309 HydrophobicContact CG-CE 4.38Å; K233-M309 HydrophobicContact CG-SD 4.14Å; K233-N312 HydrophobicContact CG-CB 3.94Å; K233-E313 VanDerWaalsContact NZ-CG 3.31Å
234	K	94.7	Very high	94.9	Very high	87 Å²	87	75 Å²	75	38%	0.378	36%	0.361	S	S	.	.	H	α-helix	trans	-71.2	-43.2	176.4	-72.4	169.9	-174.9	171.7	0	110.2	E230 Q231 E232 R237 H238	E230-K234 WeakPolarHBondContact O-CG 3.48Å; E230-K234 PolarHBondContact O-N 2.93Å; E230-K234 VanDerWaalsContact O-N 3.17Å; Q231-K234 WeakPolarHBondContact O-CB 3.46Å; Q231-K234 PolarHBondContact O-N 2.92Å; E232-K234 VanDerWaalsContact C-N 3.3Å; E232-K234 PolarHBondContact O-N 3.29Å; K234-R237 PolarHBondContact O-N 2.97Å; K234-H238 PolarHBondContact O-CD2 3.01Å; K234-H238 PolarHBondContact O-N 3.32Å
235	E	95.9	Very high	94.9	Very high	111 Å²	111	72.3 Å²	72.3	52%	0.519	36%	0.356	S	S	.	.	H	α-helix	trans	-63.4	-46	177.5	-70.1	168.2	-164.4	0	0	111.8	Q231 E232 R237 H238 L239	Q231-E235 PolarHBondContact NE2-OE1 3.44Å; Q231-E235 PolarHBondContact O-N 2.87Å; E232-E235 PolarHBondContact O-N 2.73Å; E235-R237 PolarHBondContact O-N 3.34Å; E235-H238 PolarHBondContact O-N 3.35Å; E235-L239 WeakPolarHBondContact O-CB 3.49Å; E235-L239 PolarHBondContact O-N 3.42Å
236	L	94.6	Very high	94.9	Very high	20 Å²	20	71.7 Å²	71.7	11%	0.105	35%	0.351	C	S	.	.	H	α-helix	trans	-63.3	-38.9	175.5	-74.5	170.9	0	0	0	112.3	E232 L239 T240 A305 R308 M309	E232-L236 WeakPolarHBondContact O-CB 3.25Å; E232-L236 WeakPolarHBondContact O-CG 3.34Å; E232-L236 PolarHBondContact O-N 3.49Å; L236-L239 PolarHBondContact O-N 2.92Å; L236-T240 WeakPolarHBondContact O-CB 3.49Å; L236-T240 PolarHBondContact O-N 2.9Å; L236-T240 PolarHBondContact O-OG1 2.95Å; L236-A305 HydrophobicContact CD2-CB 4.49Å; L236-R308 HydrophobicContact CD1-CB 3.9Å; L236-R308 HydrophobicContact CD2-CB 4.26Å; L236-M309 HydrophobicContact CB-CG 3.65Å; L236-M309 HydrophobicContact CB-SD 3.37Å; L236-M309 WeakPolarHBondContact CB-SD 3.26Å; L236-M309 HydrophobicContact CD1-CG 4.04Å; L236-M309 HydrophobicContact CD1-SD 3.94Å; L236-M309 HydrophobicContact CG-CG 4.43Å; L236-M309 HydrophobicContact CG-SD 4.31Å
237	R	94.2	Very high	94.8	Very high	111 Å²	111	71.1 Å²	71.1	42%	0.419	35%	0.348	S	S	.	.	H	α-helix	trans	-60.1	-49.2	173.7	-84.2	179.7	-84.1	175.5	-8.9	112	K233 K234 E235 L239 T240 E241 M309	K233-R237 WeakPolarHBondContact O-CB 3.35Å; K233-R237 VanDerWaalsContact O-CG 3.27Å; K233-R237 WeakPolarHBondContact O-CG 3.41Å; K233-R237 PolarHBondContact O-N 3.38Å; K233-R237 VanDerWaalsContact O-N 3.12Å; K233-R237 PolarHBondContact O-NE 2.9Å; K234-R237 PolarHBondContact O-N 2.97Å; E235-R237 PolarHBondContact O-N 3.34Å; R237-L239 VanDerWaalsContact C-N 3.3Å; R237-L239 PolarHBondContact O-N 3.1Å; R237-T240 PolarHBondContact O-N 3.43Å; R237-E241 WeakPolarHBondContact O-CB 3.34Å; R237-E241 VanDerWaalsContact O-CG 3.28Å; R237-E241 WeakPolarHBondContact O-CG 3.32Å; R237-E241 PolarHBondContact O-N 3.44Å; R237-M309 HydrophobicContact CG-CE 3.64Å; R237-M309 HydrophobicContact CG-SD 4.26Å
238	H	95.6	Very high	94.7	Very high	126 Å²	126	68.6 Å²	68.6	58%	0.583	34%	0.338	S	S	*	.	H	α-helix	trans	-60.8	-39.6	176.4	-74.7	-48.8	0	0	0	112.5	K234 E235 E241 S242	K234-H238 PolarHBondContact O-CD2 3.01Å; K234-H238 PolarHBondContact O-N 3.32Å; E235-H238 PolarHBondContact O-N 3.35Å; H238-E241 IonicContact ND1-OE2 3.51Å; H238-E241 PolarHBondContact ND1-OE2 3.29Å; H238-S242 WeakPolarHBondContact O-CB 3.41Å; H238-S242 PolarHBondContact O-N 3.37Å
239	L	95.3	Very high	94.6	Very high	87 Å²	87	72 Å²	72	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-63.4	-48.1	175	179.7	63.7	0	0	0	111.5	E235 L236 R237 E241 S242 L243 A305	E235-L239 WeakPolarHBondContact O-CB 3.49Å; E235-L239 PolarHBondContact O-N 3.42Å; L236-L239 PolarHBondContact O-N 2.92Å; R237-L239 VanDerWaalsContact C-N 3.3Å; R237-L239 PolarHBondContact O-N 3.1Å; L239-E241 VanDerWaalsContact C-N 3.34Å; L239-E241 PolarHBondContact O-N 2.9Å; L239-S242 PolarHBondContact O-N 2.97Å; L239-L243 HydrophobicContact CD1-CD1 4.35Å; L239-L243 HydrophobicContact CD1-CG 4.34Å; L239-L243 HydrophobicContact CG-CD1 4.11Å; L239-L243 HydrophobicContact CG-CG 4.5Å; L239-L243 WeakPolarHBondContact O-CG 3.46Å; L239-L243 PolarHBondContact O-N 3.44Å; L239-A305 HydrophobicContact CD2-CB 4.43Å
240	T	94.2	Very high	94.4	Very high	27 Å²	27	73.3 Å²	73.3	17%	0.166	35%	0.352	C	S	.	.	H	α-helix	trans	-62	-40.5	178	-59.7	0	0	0	0	111.8	L236 R237 L243 Q244 K302 E306	L236-T240 WeakPolarHBondContact O-CB 3.49Å; L236-T240 PolarHBondContact O-N 2.9Å; L236-T240 PolarHBondContact O-OG1 2.95Å; R237-T240 PolarHBondContact O-N 3.43Å; T240-L243 PolarHBondContact O-N 3.44Å; T240-Q244 WeakPolarHBondContact O-CB 3.4Å; T240-Q244 PolarHBondContact O-N 3Å; T240-K302 HydrophobicContact CG2-CG 4.41Å; T240-E306 HydrophobicContact CG2-CG 4.43Å
241	E	94.6	Very high	94.3	Very high	118 Å²	118	71.7 Å²	71.7	55%	0.551	35%	0.351	S	S	*	.	H	α-helix	trans	-60.8	-46	173.7	-74.2	165.9	-176.3	0	0	111.4	R237 H238 L239 Q244 Q245	R237-E241 WeakPolarHBondContact O-CB 3.34Å; R237-E241 VanDerWaalsContact O-CG 3.28Å; R237-E241 WeakPolarHBondContact O-CG 3.32Å; R237-E241 PolarHBondContact O-N 3.44Å; H238-E241 IonicContact ND1-OE2 3.51Å; H238-E241 PolarHBondContact ND1-OE2 3.29Å; L239-E241 VanDerWaalsContact C-N 3.34Å; L239-E241 PolarHBondContact O-N 2.9Å; E241-Q244 PolarHBondContact O-N 3.24Å; E241-Q245 PolarHBondContact O-N 2.9Å
242	S	95.5	Very high	94.2	Very high	64 Å²	64	71.7 Å²	71.7	45%	0.448	35%	0.353	S	S	.	.	H	α-helix	trans	-63.9	-42.4	177.4	-174.7	0	0	0	0	112.4	H238 L239 Q244 Q245 T246	H238-S242 WeakPolarHBondContact O-CB 3.41Å; H238-S242 PolarHBondContact O-N 3.37Å; L239-S242 PolarHBondContact O-N 2.97Å; S242-Q244 VanDerWaalsContact C-N 3.32Å; S242-Q245 PolarHBondContact O-N 3.09Å; S242-T246 WeakPolarHBondContact O-CG2 3.39Å; S242-T246 PolarHBondContact O-N 2.95Å; S242-T246 PolarHBondContact O-OG1 3.03Å
243	L	93.9	Very high	94	Very high	13 Å²	13	72.7 Å²	72.7	7%	0.068	36%	0.358	C	S	.	.	H	α-helix	trans	-65.2	-36.8	176.6	-71.5	173.2	0	0	0	111.7	L239 T240 T246 L247 L298 E301 K302	L239-L243 HydrophobicContact CD1-CD1 4.35Å; L239-L243 HydrophobicContact CD1-CG 4.34Å; L239-L243 HydrophobicContact CG-CD1 4.11Å; L239-L243 HydrophobicContact CG-CG 4.5Å; L239-L243 WeakPolarHBondContact O-CG 3.46Å; L239-L243 PolarHBondContact O-N 3.44Å; T240-L243 PolarHBondContact O-N 3.44Å; L243-T246 PolarHBondContact O-OG1 3.35Å; L243-L247 WeakPolarHBondContact O-CB 3.22Å; L243-L247 VanDerWaalsContact O-CG 3.27Å; L243-L247 WeakPolarHBondContact O-CG 3.48Å; L243-L247 PolarHBondContact O-N 3.28Å; L243-L298 HydrophobicContact CD2-CD2 3.57Å; L243-E301 HydrophobicContact CD1-CB 4.23Å; L243-K302 HydrophobicContact CD1-CB 4.26Å
244	Q	94.1	Very high	93.9	Very high	68 Å²	68	73.4 Å²	73.4	32%	0.318	36%	0.361	S	S	.	.	H	α-helix	trans	-64.9	-43.4	175.4	-178.4	62	33.7	0	0	111.2	T240 E241 S242 L247 E248	T240-Q244 WeakPolarHBondContact O-CB 3.4Å; T240-Q244 PolarHBondContact O-N 3Å; E241-Q244 PolarHBondContact O-N 3.24Å; S242-Q244 VanDerWaalsContact C-N 3.32Å; Q244-L247 PolarHBondContact O-N 2.76Å; Q244-E248 PolarHBondContact NE2-OE1 3.46Å; Q244-E248 PolarHBondContact O-N 2.91Å
245	Q	95.6	Very high	93.6	Very high	114 Å²	114	75.5 Å²	75.5	53%	0.533	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-44.3	178.1	-172.5	178.3	-11.1	0	0	112	E241 S242 L247 E248 E249	E241-Q245 PolarHBondContact O-N 2.9Å; S242-Q245 PolarHBondContact O-N 3.09Å; Q245-L247 PolarHBondContact O-N 2.93Å; Q245-E248 PolarHBondContact O-N 3.3Å; Q245-E249 PolarHBondContact NE2-OE1 2.98Å; Q245-E249 WeakPolarHBondContact O-CG 3.3Å; Q245-E249 PolarHBondContact O-N 3.38Å
246	T	94.4	Very high	93.4	Very high	45 Å²	45	76 Å²	76	28%	0.276	37%	0.37	S	S	.	.	H	α-helix	trans	-66.8	-36.1	177.5	55.9	0	0	0	0	112.4	S242 L243 E249 L250	S242-T246 WeakPolarHBondContact O-CG2 3.39Å; S242-T246 PolarHBondContact O-N 2.95Å; S242-T246 PolarHBondContact O-OG1 3.03Å; L243-T246 PolarHBondContact O-OG1 3.35Å; T246-E249 PolarHBondContact O-N 3.37Å; T246-L250 WeakPolarHBondContact O-CB 3.48Å; T246-L250 WeakPolarHBondContact O-CG 3.39Å; T246-L250 PolarHBondContact O-N 3.21Å
247	L	93.1	Very high	93	Very high	16 Å²	16	75.5 Å²	75.5	8%	0.084	37%	0.368	C	S	.	.	H	α-helix	trans	-62.3	-41.4	171.9	-80	170	0	0	0	112	L243 Q244 Q245 S251 M295 L298 L299 K302	L243-L247 WeakPolarHBondContact O-CB 3.22Å; L243-L247 VanDerWaalsContact O-CG 3.27Å; L243-L247 WeakPolarHBondContact O-CG 3.48Å; L243-L247 PolarHBondContact O-N 3.28Å; Q244-L247 PolarHBondContact O-N 2.76Å; Q245-L247 PolarHBondContact O-N 2.93Å; L247-S251 WeakPolarHBondContact O-CB 3.45Å; L247-S251 PolarHBondContact O-N 3.36Å; L247-M295 HydrophobicContact CD2-CB 4.38Å; L247-M295 HydrophobicContact CD2-CG 3.61Å; L247-L298 HydrophobicContact CD2-CB 3.72Å; L247-L298 HydrophobicContact CD2-CD1 4.4Å; L247-L298 HydrophobicContact CG-CB 3.99Å; L247-L299 HydrophobicContact CD1-CD2 4.29Å; L247-L299 HydrophobicContact CD1-CG 4.19Å; L247-L299 HydrophobicContact CD2-CG 4.11Å; L247-K302 HydrophobicContact CD1-CD 4.12Å
248	E	93.5	Very high	92.6	Very high	102 Å²	102	73.9 Å²	73.9	48%	0.477	37%	0.368	S	S	.	.	H	α-helix	trans	-64.1	-45.2	175.5	-82.8	168.1	-157.4	0	0	111.8	Q244 Q245 S251 I252	Q244-E248 PolarHBondContact NE2-OE1 3.46Å; Q244-E248 PolarHBondContact O-N 2.91Å; Q245-E248 PolarHBondContact O-N 3.3Å; E248-S251 WeakPolarHBondContact O-CB 3.37Å; E248-S251 PolarHBondContact O-N 3.47Å; E248-S251 PolarHBondContact O-OG 3.3Å; E248-I252 WeakPolarHBondContact O-CG1 3.44Å; E248-I252 PolarHBondContact O-N 2.99Å
249	E	94	Very high	92.2	Very high	106 Å²	106	72 Å²	72	50%	0.495	36%	0.359	S	S	.	.	H	α-helix	trans	-59.5	-47.2	175.7	-71.9	171.7	-170.5	0	0	111.9	Q245 T246 S251 I252 E253	Q245-E249 PolarHBondContact NE2-OE1 2.98Å; Q245-E249 WeakPolarHBondContact O-CG 3.3Å; Q245-E249 PolarHBondContact O-N 3.38Å; T246-E249 PolarHBondContact O-N 3.37Å; E249-S251 VanDerWaalsContact C-N 3.31Å; E249-S251 PolarHBondContact O-N 2.99Å; E249-I252 WeakPolarHBondContact O-CB 3.5Å; E249-I252 PolarHBondContact O-N 3.49Å; E249-E253 PolarHBondContact O-N 3.04Å
250	L	92.3	Very high	91.6	Very high	28 Å²	28	71.8 Å²	71.8	15%	0.147	36%	0.357	C	S	.	.	H	α-helix	trans	-64.7	-33.8	175.7	-74.3	172.9	0	0	0	112.4	T246 I252 E253 K254 I291 K294 L298	T246-L250 WeakPolarHBondContact O-CB 3.48Å; T246-L250 WeakPolarHBondContact O-CG 3.39Å; T246-L250 PolarHBondContact O-N 3.21Å; L250-I252 VanDerWaalsContact C-N 3.33Å; L250-E253 PolarHBondContact O-N 2.93Å; L250-K254 VanDerWaalsContact O-CB 3.3Å; L250-K254 WeakPolarHBondContact O-CB 3.3Å; L250-K254 PolarHBondContact O-N 3.29Å; L250-I291 HydrophobicContact CB-CG2 4.48Å; L250-I291 HydrophobicContact CD2-CG2 4.36Å; L250-K294 HydrophobicContact CD1-CB 4.44Å; L250-L298 HydrophobicContact CD1-CD1 3.45Å; L250-L298 VanDerWaalsContact CD1-CD1 3.45Å
251	S	91.6	Very high	91	Very high	58 Å²	58	71.4 Å²	71.4	41%	0.406	35%	0.354	S	S	.	.	H	α-helix	trans	-65.5	-37.8	175.4	81.9	0	0	0	0	111.9	L247 E248 E249 K255	L247-S251 WeakPolarHBondContact O-CB 3.45Å; L247-S251 PolarHBondContact O-N 3.36Å; E248-S251 WeakPolarHBondContact O-CB 3.37Å; E248-S251 PolarHBondContact O-N 3.47Å; E248-S251 PolarHBondContact O-OG 3.3Å; E249-S251 VanDerWaalsContact C-N 3.31Å; E249-S251 PolarHBondContact O-N 2.99Å; S251-K255 PolarHBondContact O-N 3.01Å
252	I	93	Very high	90.4	Very high	92 Å²	92	71.6 Å²	71.6	47%	0.472	35%	0.354	S	S	.	.	H	α-helix	trans	-68.3	-42.9	174.8	-65.9	164	0	0	0	109.9	E248 E249 L250 K255 K256	E248-I252 WeakPolarHBondContact O-CG1 3.44Å; E248-I252 PolarHBondContact O-N 2.99Å; E249-I252 WeakPolarHBondContact O-CB 3.5Å; E249-I252 PolarHBondContact O-N 3.49Å; L250-I252 VanDerWaalsContact C-N 3.33Å; I252-K255 WeakPolarHBondContact O-CB 3.48Å; I252-K255 PolarHBondContact O-N 3.22Å; I252-K256 HydrophobicContact CG2-CD 4.33Å; I252-K256 WeakPolarHBondContact O-CG 3.27Å; I252-K256 PolarHBondContact O-N 2.88Å
253	E	90.4	Very high	89.8	Confident	102 Å²	102	74 Å²	74	48%	0.477	36%	0.359	S	S	.	.	H	α-helix	trans	-65.8	-39.5	177.2	-169.8	166.3	-146.3	0	0	112.2	E249 L250 K255 K256 T257 I291	E249-E253 PolarHBondContact O-N 3.04Å; L250-E253 PolarHBondContact O-N 2.93Å; E253-K255 VanDerWaalsContact C-N 3.32Å; E253-K255 PolarHBondContact O-N 3.09Å; E253-K256 PolarHBondContact O-N 2.86Å; E253-T257 WeakPolarHBondContact O-CB 3.47Å; E253-T257 WeakPolarHBondContact O-CG2 3.38Å; E253-T257 PolarHBondContact O-N 3Å; E253-T257 PolarHBondContact O-OG1 3.32Å; E253-I291 HydrophobicContact CG-CD1 4.01Å
254	K	90.9	Very high	88.9	Confident	47 Å²	47	77.3 Å²	77.3	20%	0.204	38%	0.376	C	S	.	.	H	α-helix	trans	-56.8	-46.1	170.2	-173.9	-179.1	-179.9	169.3	0	111.1	L250 T257 L258 L288 I291 E292 M295	L250-K254 VanDerWaalsContact O-CB 3.3Å; L250-K254 WeakPolarHBondContact O-CB 3.3Å; L250-K254 PolarHBondContact O-N 3.29Å; K254-T257 WeakPolarHBondContact CA-OG1 3.3Å; K254-T257 PolarHBondContact O-N 3.45Å; K254-T257 PolarHBondContact O-OG1 2.9Å; K254-L258 HydrophobicContact CG-CD1 4.22Å; K254-L258 WeakPolarHBondContact O-CB 3.26Å; K254-L258 WeakPolarHBondContact O-CG 3.47Å; K254-L258 PolarHBondContact O-N 2.98Å; K254-L288 HydrophobicContact CG-CD1 3.78Å; K254-I291 HydrophobicContact CB-CG2 3.93Å; K254-E292 HydrophobicContact CD-CG 4.35Å; K254-E292 WeakPolarHBondContact CE-OE1 3.42Å; K254-E292 IonicContact NZ-OE1 2.67Å; K254-E292 PolarHBondContact NZ-OE1 3.17Å; K254-M295 HydrophobicContact CD-CE 4.45Å
255	K	90.1	Very high	87.9	Confident	130 Å²	130	79.8 Å²	79.8	57%	0.565	39%	0.388	S	S	*	.	H	α-helix	trans	-62.2	-46.4	177.9	-169.1	-177	178.7	-170.6	0	111.8	S251 I252 E253 T257 L258 E259	S251-K255 PolarHBondContact O-N 3.01Å; I252-K255 WeakPolarHBondContact O-CB 3.48Å; I252-K255 PolarHBondContact O-N 3.22Å; E253-K255 VanDerWaalsContact C-N 3.32Å; E253-K255 PolarHBondContact O-N 3.09Å; K255-T257 PolarHBondContact O-N 2.96Å; K255-L258 PolarHBondContact O-N 3.13Å; K255-E259 VanDerWaalsContact CE-OE1 3.24Å; K255-E259 WeakPolarHBondContact CE-OE1 3.48Å; K255-E259 WeakPolarHBondContact O-CG 3.24Å; K255-E259 PolarHBondContact O-N 3.42Å
256	K	90.4	Very high	86.8	Confident	121 Å²	121	78 Å²	78	53%	0.526	38%	0.382	S	S	.	.	H	α-helix	trans	-61.9	-41	176.8	-71.9	174.2	-179.3	174.7	0	112.7	I252 E253 E259 M260	I252-K256 HydrophobicContact CG2-CD 4.33Å; I252-K256 WeakPolarHBondContact O-CG 3.27Å; I252-K256 PolarHBondContact O-N 2.88Å; E253-K256 PolarHBondContact O-N 2.86Å; K256-E259 PolarHBondContact O-N 3.16Å; K256-M260 WeakPolarHBondContact O-CG 3.49Å; K256-M260 PolarHBondContact O-N 3.43Å
257	T	86.1	Confident	85.4	Confident	10 Å²	10	81.3 Å²	81.3	6%	0.061	39%	0.394	C	S	.	.	H	α-helix	trans	-69	-35.3	178.4	45.9	0	0	0	0	112.4	E253 K254 K255 M260 L261 I291	E253-T257 WeakPolarHBondContact O-CB 3.47Å; E253-T257 WeakPolarHBondContact O-CG2 3.38Å; E253-T257 PolarHBondContact O-N 3Å; E253-T257 PolarHBondContact O-OG1 3.32Å; K254-T257 WeakPolarHBondContact CA-OG1 3.3Å; K254-T257 PolarHBondContact O-N 3.45Å; K254-T257 PolarHBondContact O-OG1 2.9Å; K255-T257 PolarHBondContact O-N 2.96Å; T257-M260 HydrophobicContact CG2-CE 3.85Å; T257-L261 WeakPolarHBondContact O-CB 3.43Å; T257-L261 WeakPolarHBondContact O-CG 3.45Å; T257-L261 PolarHBondContact O-N 3.4Å; T257-I291 HydrophobicContact CG2-CD1 4.06Å
258	L	85.3	Confident	83.8	Confident	78 Å²	78	87.9 Å²	87.9	41%	0.408	42%	0.418	S	S	.	.	H	α-helix	trans	-64.5	-45.8	169.8	-74.5	169.2	0	0	0	112.1	K254 K255 M260 L261 E262 L288	K254-L258 HydrophobicContact CG-CD1 4.22Å; K254-L258 WeakPolarHBondContact O-CB 3.26Å; K254-L258 WeakPolarHBondContact O-CG 3.47Å; K254-L258 PolarHBondContact O-N 2.98Å; K255-L258 PolarHBondContact O-N 3.13Å; L258-M260 PolarHBondContact O-N 3.35Å; L258-L261 WeakPolarHBondContact O-CB 3.49Å; L258-L261 PolarHBondContact O-N 3.35Å; L258-L261 VanDerWaalsContact O-N 3.12Å; L258-E262 PolarHBondContact O-N 2.69Å; L258-L288 HydrophobicContact CD2-CD1 4.17Å; L258-L288 HydrophobicContact CD2-CD2 3.71Å; L258-L288 HydrophobicContact CG-CD1 3.99Å; L258-L288 HydrophobicContact CG-CD2 4.45Å
259	E	87	Confident	82.1	Confident	85 Å²	85	90.2 Å²	90.2	40%	0.397	43%	0.429	S	S	.	.	H	α-helix	trans	-58.6	-44.6	175.8	-73.3	167.5	-176.6	0	0	111.3	K255 K256 L261 E262 E263	K255-E259 VanDerWaalsContact CE-OE1 3.24Å; K255-E259 WeakPolarHBondContact CE-OE1 3.48Å; K255-E259 WeakPolarHBondContact O-CG 3.24Å; K255-E259 PolarHBondContact O-N 3.42Å; K256-E259 PolarHBondContact O-N 3.16Å; E259-L261 VanDerWaalsContact C-N 3.32Å; E259-L261 PolarHBondContact O-N 2.99Å; E259-E262 PolarHBondContact O-N 3.47Å; E259-E263 WeakPolarHBondContact O-CB 3.49Å; E259-E263 WeakPolarHBondContact O-CG 3.44Å; E259-E263 PolarHBondContact O-N 2.9Å
260	M	83.7	Confident	80.3	Confident	84 Å²	84	90.5 Å²	90.5	41%	0.414	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-30.7	175	-72.5	-171.7	-61.4	0	0	113.8	K256 T257 L258 N264 L284	K256-M260 WeakPolarHBondContact O-CG 3.49Å; K256-M260 PolarHBondContact O-N 3.43Å; T257-M260 HydrophobicContact CG2-CE 3.85Å; L258-M260 PolarHBondContact O-N 3.35Å; M260-N264 WeakPolarHBondContact O-CB 3.38Å; M260-N264 PolarHBondContact O-N 3.15Å; M260-N264 PolarHBondContact O-ND2 2.91Å; M260-L284 HydrophobicContact CE-CD2 4.31Å
261	L	81.8	Confident	78.4	Confident	19 Å²	19	95 Å²	95	10%	0.099	46%	0.461	C	S	.	.	H	α-helix	trans	-71.2	-43.1	174.6	-81	167	0	0	0	110.9	T257 L258 E259 N264 E265 L284 H285 L288	T257-L261 WeakPolarHBondContact O-CB 3.43Å; T257-L261 WeakPolarHBondContact O-CG 3.45Å; T257-L261 PolarHBondContact O-N 3.4Å; L258-L261 WeakPolarHBondContact O-CB 3.49Å; L258-L261 PolarHBondContact O-N 3.35Å; L258-L261 VanDerWaalsContact O-N 3.12Å; E259-L261 VanDerWaalsContact C-N 3.32Å; E259-L261 PolarHBondContact O-N 2.99Å; L261-N264 PolarHBondContact O-N 2.95Å; L261-E265 PolarHBondContact O-N 3.2Å; L261-L284 HydrophobicContact CD2-CB 3.57Å; L261-L284 HydrophobicContact CD2-CD1 4.17Å; L261-L284 HydrophobicContact CG-CB 4.06Å; L261-H285 WeakPolarHBondContact CD1-ND1 3.22Å; L261-L288 HydrophobicContact CD1-CD2 4.01Å
262	E	82.3	Confident	76.3	Confident	121 Å²	121	96.2 Å²	96.2	57%	0.565	48%	0.475	S	S	*	.	H	α-helix	trans	-65.1	-43.3	175.6	-171.6	175.5	-171.3	0	0	111.3	L258 E259 N264 E265 N266	L258-E262 PolarHBondContact O-N 2.69Å; E259-E262 PolarHBondContact O-N 3.47Å; E262-N264 PolarHBondContact O-N 3.04Å; E262-E265 PolarHBondContact O-N 2.89Å; E262-N266 WeakPolarHBondContact O-CB 3.29Å; E262-N266 VanDerWaalsContact O-CG 3.22Å; E262-N266 PolarHBondContact O-N 3.29Å; E262-N266 PolarHBondContact O-ND2 3.05Å; E262-N266 VanDerWaalsContact O-ND2 3.11Å
263	E	81.8	Confident	74.3	Confident	116 Å²	116	98.8 Å²	98.8	54%	0.542	49%	0.49	S	S	.	.	H	α-helix	trans	-59.4	-44.2	171.5	-75.5	177.7	179.1	0	0	111.6	E259 N266 H267	E259-E263 WeakPolarHBondContact O-CB 3.49Å; E259-E263 WeakPolarHBondContact O-CG 3.44Å; E259-E263 PolarHBondContact O-N 2.9Å; E263-N266 PolarHBondContact O-N 3.23Å; E263-H267 WeakPolarHBondContact O-CB 3.43Å; E263-H267 PolarHBondContact O-N 3.41Å; E263-H267 PolarHBondContact O-ND1 3.03Å
264	N	75.8	Confident	72.1	Confident	82 Å²	82	102.3 Å²	102.3	44%	0.439	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-38.9	175.6	-97	-50.5	0	0	0	112.8	M260 L261 E262 H267 R268 L284	M260-N264 WeakPolarHBondContact O-CB 3.38Å; M260-N264 PolarHBondContact O-N 3.15Å; M260-N264 PolarHBondContact O-ND2 2.91Å; L261-N264 PolarHBondContact O-N 2.95Å; E262-N264 PolarHBondContact O-N 3.04Å; N264-H267 PolarHBondContact O-N 2.97Å; N264-R268 WeakPolarHBondContact O-CB 3.45Å; N264-R268 WeakPolarHBondContact O-CG 3.46Å; N264-R268 PolarHBondContact O-N 2.99Å; N264-L284 WeakPolarHBondContact ND2-CD1 3.31Å
265	E	74	Confident	69.8	Low	119 Å²	119	105.9 Å²	105.9	56%	0.556	54%	0.537	S	S	*	.	H	α-helix	trans	-64.5	-42.5	174	-82.3	-167	146	0	0	112	L261 E262 R268 Q269	L261-E265 PolarHBondContact O-N 3.2Å; E262-E265 PolarHBondContact O-N 2.89Å; E265-R268 WeakPolarHBondContact O-CB 3.42Å; E265-R268 PolarHBondContact O-N 3Å; E265-Q269 PolarHBondContact O-N 3.23Å
266	N	72.1	Confident	67.7	Low	78 Å²	78	108.9 Å²	108.9	42%	0.417	55%	0.553	S	S	.	*	H	α-helix	trans	-64.5	-42.2	175.6	-71.2	-32.6	0	0	0	111.8	E262 E263 Q269 T270	E262-N266 WeakPolarHBondContact O-CB 3.29Å; E262-N266 VanDerWaalsContact O-CG 3.22Å; E262-N266 PolarHBondContact O-N 3.29Å; E262-N266 PolarHBondContact O-ND2 3.05Å; E262-N266 VanDerWaalsContact O-ND2 3.11Å; E263-N266 PolarHBondContact O-N 3.23Å; N266-Q269 PolarHBondContact O-N 3.37Å; N266-T270 PolarHBondContact O-N 3.13Å; N266-T270 PolarHBondContact O-OG1 3.06Å
267	H	65.4	Low	65.5	Low	113 Å²	113	111.5 Å²	111.5	52%	0.523	57%	0.567	S	S	.	*	H	α-helix	trans	-65.2	-37.8	173.2	-76.9	76.4	0	0	0	111.8	E263 N264 T270 L271	E263-H267 WeakPolarHBondContact O-CB 3.43Å; E263-H267 PolarHBondContact O-N 3.41Å; E263-H267 PolarHBondContact O-ND1 3.03Å; N264-H267 PolarHBondContact O-N 2.97Å; H267-T270 PolarHBondContact O-N 3.23Å; H267-L271 WeakPolarHBondContact O-CB 3.47Å; H267-L271 PolarHBondContact O-N 2.89Å
268	R	58.2	Low	64.1	Low	155 Å²	155	117.2 Å²	117.2	59%	0.585	61%	0.605	S	S	*	*	H	α-helix	trans	-64.3	-41.1	173.4	-77.9	178.4	75.5	-171.4	3.8	112.2	N264 E265 T270 L271 A272	N264-R268 WeakPolarHBondContact O-CB 3.45Å; N264-R268 WeakPolarHBondContact O-CG 3.46Å; N264-R268 PolarHBondContact O-N 2.99Å; E265-R268 WeakPolarHBondContact O-CB 3.42Å; E265-R268 PolarHBondContact O-N 3Å; R268-T270 PolarHBondContact O-N 3.18Å; R268-L271 PolarHBondContact O-N 3.04Å; R268-A272 VanDerWaalsContact O-CB 3.28Å; R268-A272 WeakPolarHBondContact O-CB 3.45Å; R268-A272 PolarHBondContact O-N 2.98Å
269	Q	58	Low	62.6	Low	151 Å²	151	118.6 Å²	118.6	71%	0.706	62%	0.618	S	S	*	*	H	α-helix	trans	-63.4	-30.2	172.9	-79.7	179.2	-1.3	0	0	112.4	E265 N266	E265-Q269 PolarHBondContact O-N 3.23Å; N266-Q269 PolarHBondContact O-N 3.37Å
270	T	57.2	Low	61	Low	112 Å²	112	119.8 Å²	119.8	69%	0.687	63%	0.633	S	S	*	*	H	α-helix	trans	-81.2	-32.7	178.1	-42.4	0	0	0	0	112.8	N266 H267 R268	N266-T270 PolarHBondContact O-N 3.13Å; N266-T270 PolarHBondContact O-OG1 3.06Å; H267-T270 PolarHBondContact O-N 3.23Å; R268-T270 PolarHBondContact O-N 3.18Å
271	L	51.5	Low	59.6	Low	122 Å²	122	118.7 Å²	118.7	64%	0.639	63%	0.634	S	S	*	*	H	α-helix	trans	-92	-12	-179.3	-80.4	157.7	0	0	0	114.7	H267 R268 N273 Q274	H267-L271 WeakPolarHBondContact O-CB 3.47Å; H267-L271 PolarHBondContact O-N 2.89Å; R268-L271 PolarHBondContact O-N 3.04Å; L271-N273 PolarHBondContact O-N 3.41Å; L271-Q274 PolarHBondContact O-N 2.97Å
272	A	46.8	Very low	58.6	Low	84 Å²	84	120.2 Å²	120.2	69%	0.694	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	0.1	178.6	0	0	0	0	0	115.3	R268	R268-A272 VanDerWaalsContact O-CB 3.28Å; R268-A272 WeakPolarHBondContact O-CB 3.45Å; R268-A272 PolarHBondContact O-N 2.98Å
273	N	51.3	Low	58.3	Low	146 Å²	146	116.2 Å²	116.2	78%	0.781	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-13.5	174.4	-79.6	-31.7	0	0	0	114.9	L271	L271-N273 PolarHBondContact O-N 3.41Å
274	Q	45.4	Very low	58	Low	176 Å²	176	112.5 Å²	112.5	82%	0.822	63%	0.629	S	S	*	*	S	Bend	trans	-150.1	111.5	176.8	-62.1	-175.3	25.4	0	0	112.8	L271	L271-Q274 PolarHBondContact O-N 2.97Å
275	S	41.4	Very low	58.3	Low	122 Å²	122	113.8 Å²	113.8	85%	0.853	63%	0.632	S	S	*	*			trans	95.6	128.6	162.8	-154.1	0	0	0	0	119.6
276	E	47	Very low	58.8	Low	192 Å²	192	110.9 Å²	110.9	90%	0.897	63%	0.625	S	S	*	*			trans	-82.5	103.1	171.9	-68.3	-175.6	149.7	0	0	111.2
277	Q	43.9	Very low	59.4	Low	177 Å²	177	110.8 Å²	110.8	83%	0.827	63%	0.625	S	S	*	*			trans	-150.5	136.3	150.9	-81.1	-155.5	-36.9	0	0	110.6
278	P	56.8	Low	60.4	Low	130 Å²	130	106.3 Å²	106.3	84%	0.844	61%	0.605	S	S	*	*			trans	-92.4	124.3	173.4	32.6	-26.8	0	0	0	111.6
279	P	52.8	Low	61.9	Low	107 Å²	107	105.3 Å²	105.3	70%	0.695	61%	0.607	S	S	*	*			trans	-143.9	-169.3	140.6	38.3	-21	0	0	0	112.7	S281	P279-S281 PolarHBondContact O-N 3.42Å
280	P	53.7	Low	63.4	Low	109 Å²	109	102.8 Å²	102.8	71%	0.708	60%	0.595	S	S	*	*				-95.6	60.7	-89.8	39.2	-24.3	0	0	0	112.3	G282 G283	P280-G282 PolarHBondContact O-N 3.34Å; P280-G283 PolarHBondContact O-N 2.93Å
281	S	53.5	Low	65	Low	61 Å²	61	98.2 Å²	98.2	43%	0.427	57%	0.566	S	S	.	*	H	α-helix	trans	-61.8	-23.1	177.1	66.2	0	0	0	0	113.6	P279 G283 H285	P279-S281 PolarHBondContact O-N 3.42Å; S281-G283 VanDerWaalsContact C-N 3.29Å; S281-G283 PolarHBondContact O-N 3.17Å; S281-H285 PolarHBondContact O-N 3.09Å
282	G	61.6	Low	66.8	Low	51 Å²	51	95.9 Å²	95.9	53%	0.526	55%	0.552	S	S	.	*	H	α-helix	trans	-65.2	-26.4	177.1	0	0	0	0	0	114.4	P280 S286	P280-G282 PolarHBondContact O-N 3.34Å; G282-S286 VanDerWaalsContact O-CB 3.29Å; G282-S286 WeakPolarHBondContact O-CB 3.42Å; G282-S286 PolarHBondContact O-N 2.93Å
283	G	75.3	Confident	69	Low	38 Å²	38	97.9 Å²	97.9	39%	0.392	55%	0.546	S	S	.	.	H	α-helix	trans	-69.5	-43.8	178.9	0	0	0	0	0	112.6	P280 S281 S286 N287	P280-G283 PolarHBondContact O-N 2.93Å; S281-G283 VanDerWaalsContact C-N 3.29Å; S281-G283 PolarHBondContact O-N 3.17Å; G283-S286 PolarHBondContact O-N 2.7Å; G283-N287 WeakPolarHBondContact O-CB 3.48Å; G283-N287 PolarHBondContact O-N 2.98Å; G283-N287 PolarHBondContact O-ND2 3.16Å; G283-N287 PolarHBondContact O-OD1 3.09Å
284	L	77.1	Confident	71	Confident	38 Å²	38	96.5 Å²	96.5	20%	0.199	53%	0.534	C	S	.	.	H	α-helix	trans	-69.6	-38.5	178.5	-72.1	172.8	0	0	0	112.3	M260 L261 N264 N287 L288	M260-L284 HydrophobicContact CE-CD2 4.31Å; L261-L284 HydrophobicContact CD2-CB 3.57Å; L261-L284 HydrophobicContact CD2-CD1 4.17Å; L261-L284 HydrophobicContact CG-CB 4.06Å; N264-L284 WeakPolarHBondContact ND2-CD1 3.31Å; L284-N287 PolarHBondContact O-N 3.29Å; L284-L288 WeakPolarHBondContact O-CB 3.26Å; L284-L288 PolarHBondContact O-N 3.19Å
285	H	80.6	Confident	73.2	Confident	109 Å²	109	89.9 Å²	89.9	51%	0.505	50%	0.503	S	S	.	.	H	α-helix	trans	-65.5	-41	171.9	-87	-8.4	0	0	0	112.7	L261 S281 N287 L288 Q289	L261-H285 WeakPolarHBondContact CD1-ND1 3.22Å; S281-H285 PolarHBondContact O-N 3.09Å; H285-N287 VanDerWaalsContact C-N 3.31Å; H285-N287 PolarHBondContact O-N 3.46Å; H285-L288 PolarHBondContact O-N 3.3Å; H285-Q289 WeakPolarHBondContact O-CB 3.28Å; H285-Q289 PolarHBondContact O-N 3.08Å
286	S	84.3	Confident	75.7	Confident	57 Å²	57	90.4 Å²	90.4	40%	0.399	49%	0.492	S	S	.	.	H	α-helix	trans	-63.1	-37.9	174.1	-173.8	0	0	0	0	112.2	G282 G283 Q290	G282-S286 VanDerWaalsContact O-CB 3.29Å; G282-S286 WeakPolarHBondContact O-CB 3.42Å; G282-S286 PolarHBondContact O-N 2.93Å; G283-S286 PolarHBondContact O-N 2.7Å; S286-Q290 WeakPolarHBondContact O-CG 3.4Å; S286-Q290 PolarHBondContact O-N 3.36Å
287	N	85.6	Confident	77.9	Confident	77 Å²	77	86.5 Å²	86.5	41%	0.412	47%	0.474	S	S	.	.	H	α-helix	trans	-67.3	-43.3	176.2	-71.3	-12.5	0	0	0	111.5	G283 L284 H285 Q289 Q290 I291	G283-N287 WeakPolarHBondContact O-CB 3.48Å; G283-N287 PolarHBondContact O-N 2.98Å; G283-N287 PolarHBondContact O-ND2 3.16Å; G283-N287 PolarHBondContact O-OD1 3.09Å; L284-N287 PolarHBondContact O-N 3.29Å; H285-N287 VanDerWaalsContact C-N 3.31Å; H285-N287 PolarHBondContact O-N 3.46Å; N287-Q289 VanDerWaalsContact C-N 3.32Å; N287-Q289 PolarHBondContact O-N 3.21Å; N287-Q290 PolarHBondContact O-N 3.34Å; N287-I291 VanDerWaalsContact O-CG1 3.3Å; N287-I291 WeakPolarHBondContact O-CG1 3.46Å; N287-I291 PolarHBondContact O-N 2.98Å
288	L	87.3	Confident	80.3	Confident	19 Å²	19	79.6 Å²	79.6	10%	0.099	44%	0.443	C	S	.	.	H	α-helix	trans	-59.5	-45.2	175.7	-174.4	70.9	0	0	0	111	K254 L258 L261 L284 H285 Q290 I291 E292	K254-L288 HydrophobicContact CG-CD1 3.78Å; L258-L288 HydrophobicContact CD2-CD1 4.17Å; L258-L288 HydrophobicContact CD2-CD2 3.71Å; L258-L288 HydrophobicContact CG-CD1 3.99Å; L258-L288 HydrophobicContact CG-CD2 4.45Å; L261-L288 HydrophobicContact CD1-CD2 4.01Å; L284-L288 WeakPolarHBondContact O-CB 3.26Å; L284-L288 PolarHBondContact O-N 3.19Å; H285-L288 PolarHBondContact O-N 3.3Å; L288-Q290 VanDerWaalsContact C-N 3.34Å; L288-Q290 PolarHBondContact O-N 2.91Å; L288-I291 PolarHBondContact O-N 3.44Å; L288-E292 WeakPolarHBondContact O-CG 2.86Å; L288-E292 PolarHBondContact O-N 3.11Å
289	Q	88.1	Confident	82.1	Confident	134 Å²	134	77.5 Å²	77.5	63%	0.626	42%	0.424	S	S	*	.	H	α-helix	trans	-62.5	-40.4	177.6	-163.6	174.2	7.5	0	0	111.8	H285 N287 E292 E293	H285-Q289 WeakPolarHBondContact O-CB 3.28Å; H285-Q289 PolarHBondContact O-N 3.08Å; N287-Q289 VanDerWaalsContact C-N 3.32Å; N287-Q289 PolarHBondContact O-N 3.21Å; Q289-E292 PolarHBondContact O-N 3.26Å; Q289-E293 WeakPolarHBondContact O-CB 3.38Å; Q289-E293 PolarHBondContact O-N 2.89Å
290	Q	90.4	Very high	84.1	Confident	98 Å²	98	78.5 Å²	78.5	46%	0.458	42%	0.419	S	S	.	.	H	α-helix	trans	-65.3	-37.9	173.3	-81.1	-178.1	-3.4	0	0	113.3	S286 N287 L288 K294	S286-Q290 WeakPolarHBondContact O-CG 3.4Å; S286-Q290 PolarHBondContact O-N 3.36Å; N287-Q290 PolarHBondContact O-N 3.34Å; L288-Q290 VanDerWaalsContact C-N 3.34Å; L288-Q290 PolarHBondContact O-N 2.91Å; Q290-K294 WeakPolarHBondContact O-CB 3.47Å; Q290-K294 WeakPolarHBondContact O-CG 3.4Å; Q290-K294 PolarHBondContact O-N 2.96Å
291	I	89.6	Confident	86	Confident	15 Å²	15	78.5 Å²	78.5	8%	0.077	41%	0.41	C	S	.	.	H	α-helix	trans	-64.2	-44.4	175.6	-69.6	163.5	0	0	0	109.9	L250 E253 K254 T257 N287 L288 K294 M295	L250-I291 HydrophobicContact CB-CG2 4.48Å; L250-I291 HydrophobicContact CD2-CG2 4.36Å; E253-I291 HydrophobicContact CG-CD1 4.01Å; K254-I291 HydrophobicContact CB-CG2 3.93Å; T257-I291 HydrophobicContact CG2-CD1 4.06Å; N287-I291 VanDerWaalsContact O-CG1 3.3Å; N287-I291 WeakPolarHBondContact O-CG1 3.46Å; N287-I291 PolarHBondContact O-N 2.98Å; L288-I291 PolarHBondContact O-N 3.44Å; I291-K294 PolarHBondContact O-N 2.88Å; I291-M295 VanDerWaalsContact O-CB 3.22Å; I291-M295 WeakPolarHBondContact O-CB 3.36Å; I291-M295 PolarHBondContact O-N 2.87Å
292	E	89.4	Confident	87.9	Confident	74 Å²	74	77.5 Å²	77.5	35%	0.346	40%	0.397	S	S	.	.	H	α-helix	trans	-62.7	-43.6	177.3	-71.9	-177.6	155.1	0	0	112.3	K254 L288 Q289 M295 Q296	K254-E292 HydrophobicContact CD-CG 4.35Å; K254-E292 WeakPolarHBondContact CE-OE1 3.42Å; K254-E292 IonicContact NZ-OE1 2.67Å; K254-E292 PolarHBondContact NZ-OE1 3.17Å; L288-E292 WeakPolarHBondContact O-CG 2.86Å; L288-E292 PolarHBondContact O-N 3.11Å; Q289-E292 PolarHBondContact O-N 3.26Å; E292-M295 PolarHBondContact O-N 3.43Å; E292-Q296 WeakPolarHBondContact O-CB 3.47Å; E292-Q296 PolarHBondContact O-N 2.86Å
293	E	93.1	Very high	89.5	Confident	125 Å²	125	80.5 Å²	80.5	58%	0.584	40%	0.401	S	S	*	.	H	α-helix	trans	-66.3	-42.2	179.4	-161.4	168.5	-148	0	0	111.9	Q289 Q296 Q297	Q289-E293 WeakPolarHBondContact O-CB 3.38Å; Q289-E293 PolarHBondContact O-N 2.89Å; E293-Q296 WeakPolarHBondContact O-CB 3.36Å; E293-Q296 PolarHBondContact O-N 3.36Å; E293-Q297 WeakPolarHBondContact O-CG 3.29Å; E293-Q297 PolarHBondContact O-N 3.29Å
294	K	93.4	Very high	90.5	Very high	117 Å²	117	83.3 Å²	83.3	51%	0.509	41%	0.407	S	S	.	.	H	α-helix	trans	-64.3	-41	172.8	-76.1	179.7	179.9	176	0	112.6	L250 Q290 I291 Q296 Q297 L298	L250-K294 HydrophobicContact CD1-CB 4.44Å; Q290-K294 WeakPolarHBondContact O-CB 3.47Å; Q290-K294 WeakPolarHBondContact O-CG 3.4Å; Q290-K294 PolarHBondContact O-N 2.96Å; I291-K294 PolarHBondContact O-N 2.88Å; K294-Q296 VanDerWaalsContact C-N 3.29Å; K294-Q296 PolarHBondContact O-N 3.5Å; K294-Q297 PolarHBondContact O-N 2.88Å; K294-L298 WeakPolarHBondContact O-CG 3.36Å; K294-L298 PolarHBondContact O-N 2.92Å
295	M	92.3	Very high	91.2	Very high	38 Å²	38	81.8 Å²	81.8	19%	0.187	40%	0.399	C	S	.	.	H	α-helix	trans	-62.9	-39.1	176.5	-172.5	-179.4	64.6	0	0	111	L247 K254 I291 E292 L299	L247-M295 HydrophobicContact CD2-CB 4.38Å; L247-M295 HydrophobicContact CD2-CG 3.61Å; K254-M295 HydrophobicContact CD-CE 4.45Å; I291-M295 VanDerWaalsContact O-CB 3.22Å; I291-M295 WeakPolarHBondContact O-CB 3.36Å; I291-M295 PolarHBondContact O-N 2.87Å; E292-M295 PolarHBondContact O-N 3.43Å; M295-L299 HydrophobicContact CG-CD1 4.42Å; M295-L299 WeakPolarHBondContact O-CB 3.41Å; M295-L299 PolarHBondContact O-N 3.16Å
296	Q	93.9	Very high	91.8	Very high	133 Å²	133	80.7 Å²	80.7	62%	0.621	39%	0.394	S	S	*	.	H	α-helix	trans	-62.3	-46.1	174.5	-160.4	90.3	9.6	0	0	111.5	E292 E293 K294 L299 E300	E292-Q296 WeakPolarHBondContact O-CB 3.47Å; E292-Q296 PolarHBondContact O-N 2.86Å; E293-Q296 WeakPolarHBondContact O-CB 3.36Å; E293-Q296 PolarHBondContact O-N 3.36Å; K294-Q296 VanDerWaalsContact C-N 3.29Å; K294-Q296 PolarHBondContact O-N 3.5Å; Q296-L299 WeakPolarHBondContact O-CB 3.43Å; Q296-L299 PolarHBondContact O-N 3.33Å; Q296-E300 PolarHBondContact O-N 3.41Å; Q296-E300 VanDerWaalsContact O-N 3.09Å
297	Q	94.4	Very high	92.4	Very high	110 Å²	110	84.2 Å²	84.2	51%	0.514	40%	0.403	S	S	.	.	H	α-helix	trans	-61.1	-46.5	177.5	-71.5	170.5	1.4	0	0	111.8	E293 K294 L299 E300 E301	E293-Q297 WeakPolarHBondContact O-CG 3.29Å; E293-Q297 PolarHBondContact O-N 3.29Å; K294-Q297 PolarHBondContact O-N 2.88Å; Q297-L299 VanDerWaalsContact C-N 3.33Å; Q297-L299 PolarHBondContact O-N 3.36Å; Q297-E300 PolarHBondContact O-N 2.95Å; Q297-E301 PolarHBondContact O-N 3.13Å
298	L	94	Very high	92.8	Very high	32 Å²	32	88.2 Å²	88.2	17%	0.168	41%	0.412	C	S	.	.	H	α-helix	trans	-65.4	-34.6	178.4	-70.7	170.1	0	0	0	112.7	L243 L247 L250 K294 E300 K302	L243-L298 HydrophobicContact CD2-CD2 3.57Å; L247-L298 HydrophobicContact CD2-CB 3.72Å; L247-L298 HydrophobicContact CD2-CD1 4.4Å; L247-L298 HydrophobicContact CG-CB 3.99Å; L250-L298 HydrophobicContact CD1-CD1 3.45Å; L250-L298 VanDerWaalsContact CD1-CD1 3.45Å; K294-L298 WeakPolarHBondContact O-CG 3.36Å; K294-L298 PolarHBondContact O-N 2.92Å; L298-E300 VanDerWaalsContact C-N 3.34Å; L298-K302 VanDerWaalsContact O-CB 3.28Å; L298-K302 WeakPolarHBondContact O-CB 3.38Å; L298-K302 PolarHBondContact O-N 3.45Å
299	L	93.4	Very high	93.1	Very high	85 Å²	85	88.5 Å²	88.5	45%	0.445	41%	0.413	S	S	.	.	H	α-helix	trans	-63.3	-40.7	172.7	-90	161.5	0	0	0	111.8	L247 M295 Q296 Q297 K302 L303	L247-L299 HydrophobicContact CD1-CD2 4.29Å; L247-L299 HydrophobicContact CD1-CG 4.19Å; L247-L299 HydrophobicContact CD2-CG 4.11Å; M295-L299 HydrophobicContact CG-CD1 4.42Å; M295-L299 WeakPolarHBondContact O-CB 3.41Å; M295-L299 PolarHBondContact O-N 3.16Å; Q296-L299 WeakPolarHBondContact O-CB 3.43Å; Q296-L299 PolarHBondContact O-N 3.33Å; Q297-L299 VanDerWaalsContact C-N 3.33Å; Q297-L299 PolarHBondContact O-N 3.36Å; L299-K302 PolarHBondContact O-N 3.02Å; L299-L303 WeakPolarHBondContact O-CB 3.39Å; L299-L303 PolarHBondContact O-N 2.99Å
300	E	94.8	Very high	93.5	Very high	129 Å²	129	88.2 Å²	88.2	60%	0.603	41%	0.41	S	S	*	.	H	α-helix	trans	-67.8	-43.5	177.3	-168.6	168.7	-167.1	0	0	111.6	Q296 Q297 L298 K302 L303 L304	Q296-E300 PolarHBondContact O-N 3.41Å; Q296-E300 VanDerWaalsContact O-N 3.09Å; Q297-E300 PolarHBondContact O-N 2.95Å; L298-E300 VanDerWaalsContact C-N 3.34Å; E300-K302 VanDerWaalsContact C-N 3.34Å; E300-K302 PolarHBondContact O-N 3.37Å; E300-L303 PolarHBondContact O-N 3.11Å; E300-L304 WeakPolarHBondContact O-CG 2.82Å; E300-L304 PolarHBondContact O-N 3.43Å
301	E	94.6	Very high	93.7	Very high	108 Å²	108	88.2 Å²	88.2	51%	0.505	41%	0.41	S	S	.	.	H	α-helix	trans	-60.7	-42.2	173.4	-72.7	-175.7	176.3	0	0	112.2	L243 Q297 L304 A305	L243-E301 HydrophobicContact CD1-CB 4.23Å; Q297-E301 PolarHBondContact O-N 3.13Å; E301-L304 PolarHBondContact O-N 2.99Å; E301-A305 PolarHBondContact O-N 3.3Å
302	K	93.8	Very high	94	Very high	40 Å²	40	88.2 Å²	88.2	17%	0.174	41%	0.41	C	S	.	.	H	α-helix	trans	-60.4	-46.9	175.2	-179.5	-172.6	166	-179.8	0	111	T240 L243 L247 L298 L299 E300 L304 A305 E306	T240-K302 HydrophobicContact CG2-CG 4.41Å; L243-K302 HydrophobicContact CD1-CB 4.26Å; L247-K302 HydrophobicContact CD1-CD 4.12Å; L298-K302 VanDerWaalsContact O-CB 3.28Å; L298-K302 WeakPolarHBondContact O-CB 3.38Å; L298-K302 PolarHBondContact O-N 3.45Å; L299-K302 PolarHBondContact O-N 3.02Å; E300-K302 VanDerWaalsContact C-N 3.34Å; E300-K302 PolarHBondContact O-N 3.37Å; K302-L304 VanDerWaalsContact C-N 3.3Å; K302-L304 PolarHBondContact O-N 2.92Å; K302-A305 PolarHBondContact O-N 3.03Å; K302-E306 WeakPolarHBondContact CE-OE1 3.49Å; K302-E306 IonicContact NZ-OE1 3.78Å; K302-E306 WeakPolarHBondContact O-CG 3.29Å; K302-E306 PolarHBondContact O-N 2.9Å
303	L	94.8	Very high	94.2	Very high	115 Å²	115	88.7 Å²	88.7	60%	0.602	41%	0.412	S	S	*	.	H	α-helix	trans	-61.3	-39.5	178.7	-169.1	107.8	0	0	0	111.7	L299 E300 E306 K307	L299-L303 WeakPolarHBondContact O-CB 3.39Å; L299-L303 PolarHBondContact O-N 2.99Å; E300-L303 PolarHBondContact O-N 3.11Å; L303-E306 PolarHBondContact O-N 2.97Å; L303-K307 WeakPolarHBondContact O-CB 3.46Å; L303-K307 PolarHBondContact O-N 3.21Å
304	L	95	Very high	94.3	Very high	97 Å²	97	87.5 Å²	87.5	51%	0.508	41%	0.406	S	S	.	.	H	α-helix	trans	-65.9	-41.1	175	-71.5	170.3	0	0	0	112.2	E300 E301 K302 K307 R308	E300-L304 WeakPolarHBondContact O-CG 2.82Å; E300-L304 PolarHBondContact O-N 3.43Å; E301-L304 PolarHBondContact O-N 2.99Å; K302-L304 VanDerWaalsContact C-N 3.3Å; K302-L304 PolarHBondContact O-N 2.92Å; L304-K307 PolarHBondContact O-N 3.46Å; L304-R308 PolarHBondContact O-N 3Å
305	A	93.5	Very high	94.4	Very high	5 Å²	5	88.3 Å²	88.3	4%	0.041	41%	0.406	C	S	.	.	H	α-helix	trans	-64	-42.1	174.9	0	0	0	0	0	111.8	L236 L239 E301 K302 R308 M309	L236-A305 HydrophobicContact CD2-CB 4.49Å; L239-A305 HydrophobicContact CD2-CB 4.43Å; E301-A305 PolarHBondContact O-N 3.3Å; K302-A305 PolarHBondContact O-N 3.03Å; A305-R308 PolarHBondContact O-N 2.76Å; A305-M309 WeakPolarHBondContact O-CG 3.45Å; A305-M309 PolarHBondContact O-N 2.75Å
306	E	92.9	Very high	94.5	Very high	87 Å²	87	87.6 Å²	87.6	41%	0.407	41%	0.405	S	S	.	.	H	α-helix	trans	-63.9	-39.7	175.1	-74.7	178.6	173.2	0	0	112.3	T240 K302 L303 M309 K310	T240-E306 HydrophobicContact CG2-CG 4.43Å; K302-E306 WeakPolarHBondContact CE-OE1 3.49Å; K302-E306 IonicContact NZ-OE1 3.78Å; K302-E306 WeakPolarHBondContact O-CG 3.29Å; K302-E306 PolarHBondContact O-N 2.9Å; L303-E306 PolarHBondContact O-N 2.97Å; E306-M309 WeakPolarHBondContact O-CB 3.39Å; E306-M309 PolarHBondContact O-N 3.26Å; E306-K310 PolarHBondContact O-N 3.45Å
307	K	95.4	Very high	94.7	Very high	131 Å²	131	87.9 Å²	87.9	57%	0.57	40%	0.401	S	S	*	.	H	α-helix	trans	-62.1	-46.4	174.7	-172	-178.4	175.2	-172.8	0	111.5	L303 L304 M309 K310 E311	L303-K307 WeakPolarHBondContact O-CB 3.46Å; L303-K307 PolarHBondContact O-N 3.21Å; L304-K307 PolarHBondContact O-N 3.46Å; K307-M309 VanDerWaalsContact C-N 3.32Å; K307-M309 PolarHBondContact O-N 3.14Å; K307-K310 PolarHBondContact O-N 3.37Å; K307-E311 WeakPolarHBondContact CE-OE1 3.36Å; K307-E311 WeakPolarHBondContact O-CG 3.38Å; K307-E311 PolarHBondContact O-N 3.22Å
308	R	95.3	Very high	94.7	Very high	160 Å²	160	84.9 Å²	84.9	60%	0.604	39%	0.394	S	S	*	.	H	α-helix	trans	-61.7	-38.4	174.1	-81.6	-174	177.2	145.4	-0.2	112.5	L236 L304 A305 K310 E311 N312	L236-R308 HydrophobicContact CD1-CB 3.9Å; L236-R308 HydrophobicContact CD2-CB 4.26Å; L304-R308 PolarHBondContact O-N 3Å; A305-R308 PolarHBondContact O-N 2.76Å; R308-K310 VanDerWaalsContact C-N 3.32Å; R308-K310 PolarHBondContact O-N 3.03Å; R308-E311 PolarHBondContact O-N 2.98Å; R308-N312 WeakPolarHBondContact O-CB 3.46Å; R308-N312 PolarHBondContact O-N 3.34Å
309	M	94.1	Very high	94.7	Very high	25 Å²	25	84.2 Å²	84.2	12%	0.123	39%	0.391	C	S	.	.	H	α-helix	trans	-58.2	-45.4	174.6	-86.4	-66	-66.7	0	0	111.6	K233 L236 R237 A305 E306 K307 N312 E313	K233-M309 HydrophobicContact CB-SD 4.28Å; K233-M309 HydrophobicContact CG-CE 4.38Å; K233-M309 HydrophobicContact CG-SD 4.14Å; L236-M309 HydrophobicContact CB-CG 3.65Å; L236-M309 HydrophobicContact CB-SD 3.37Å; L236-M309 WeakPolarHBondContact CB-SD 3.26Å; L236-M309 HydrophobicContact CD1-CG 4.04Å; L236-M309 HydrophobicContact CD1-SD 3.94Å; L236-M309 HydrophobicContact CG-CG 4.43Å; L236-M309 HydrophobicContact CG-SD 4.31Å; R237-M309 HydrophobicContact CG-CE 3.64Å; R237-M309 HydrophobicContact CG-SD 4.26Å; A305-M309 WeakPolarHBondContact O-CG 3.45Å; A305-M309 PolarHBondContact O-N 2.75Å; E306-M309 WeakPolarHBondContact O-CB 3.39Å; E306-M309 PolarHBondContact O-N 3.26Å; K307-M309 VanDerWaalsContact C-N 3.32Å; K307-M309 PolarHBondContact O-N 3.14Å; M309-N312 PolarHBondContact O-N 3.42Å; M309-E313 WeakPolarHBondContact O-CG 3.46Å; M309-E313 PolarHBondContact O-N 2.9Å
310	K	94.9	Very high	94.7	Very high	128 Å²	128	83.2 Å²	83.2	56%	0.557	38%	0.384	S	S	*	.	H	α-helix	trans	-65.7	-42.3	178.2	-169.2	178.2	177.5	-177	0	112.5	E306 K307 R308 N312 E313 E314	E306-K310 PolarHBondContact O-N 3.45Å; K307-K310 PolarHBondContact O-N 3.37Å; R308-K310 VanDerWaalsContact C-N 3.32Å; R308-K310 PolarHBondContact O-N 3.03Å; K310-N312 VanDerWaalsContact C-N 3.32Å; K310-N312 PolarHBondContact O-N 3.41Å; K310-E313 WeakPolarHBondContact O-CB 3.38Å; K310-E313 PolarHBondContact O-N 3.23Å; K310-E313 VanDerWaalsContact O-N 3.15Å; K310-E314 PolarHBondContact O-N 3.33Å
311	E	95.6	Very high	94.7	Very high	98 Å²	98	83.5 Å²	83.5	46%	0.458	39%	0.386	S	S	.	.	H	α-helix	trans	-60.2	-42.4	174.2	-71.2	170.2	-173.6	0	0	111.2	K307 R308 E313 E314 R315	K307-E311 WeakPolarHBondContact CE-OE1 3.36Å; K307-E311 WeakPolarHBondContact O-CG 3.38Å; K307-E311 PolarHBondContact O-N 3.22Å; R308-E311 PolarHBondContact O-N 2.98Å; E311-E313 VanDerWaalsContact C-N 3.34Å; E311-E313 PolarHBondContact O-N 3.38Å; E311-E314 PolarHBondContact O-N 3.23Å; E311-R315 WeakPolarHBondContact O-CB 3.08Å; E311-R315 PolarHBondContact O-N 2.94Å
312	N	95	Very high	94.6	Very high	16 Å²	16	82.7 Å²	82.7	9%	0.086	38%	0.382	C	S	.	.	H	α-helix	trans	-69.3	-27.8	175.1	-85	-2.2	0	0	0	113.2	V229 E232 K233 R308 M309 K310 S316	V229-N312 HydrophobicContact CG1-CB 3.97Å; V229-N312 VanDerWaalsContact CG1-O 3.3Å; V229-N312 WeakPolarHBondContact CG1-O 3.49Å; E232-N312 WeakPolarHBondContact CB-ND2 3.4Å; E232-N312 PolarHBondContact OE2-ND2 2.92Å; K233-N312 HydrophobicContact CG-CB 3.94Å; R308-N312 WeakPolarHBondContact O-CB 3.46Å; R308-N312 PolarHBondContact O-N 3.34Å; M309-N312 PolarHBondContact O-N 3.42Å; K310-N312 VanDerWaalsContact C-N 3.32Å; K310-N312 PolarHBondContact O-N 3.41Å; N312-S316 WeakPolarHBondContact O-CB 3.35Å; N312-S316 PolarHBondContact O-N 3.46Å
313	E	94.5	Very high	94.6	Very high	84 Å²	84	84.5 Å²	84.5	39%	0.393	39%	0.387	S	S	.	.	H	α-helix	trans	-66.5	-45	169.9	-78.6	177.1	178.2	0	0	112.7	K233 M309 K310 E311 S316 R317	K233-E313 VanDerWaalsContact NZ-CG 3.31Å; M309-E313 WeakPolarHBondContact O-CG 3.46Å; M309-E313 PolarHBondContact O-N 2.9Å; K310-E313 WeakPolarHBondContact O-CB 3.38Å; K310-E313 PolarHBondContact O-N 3.23Å; K310-E313 VanDerWaalsContact O-N 3.15Å; E311-E313 VanDerWaalsContact C-N 3.34Å; E311-E313 PolarHBondContact O-N 3.38Å; E313-S316 PolarHBondContact O-N 2.96Å; E313-R317 PolarHBondContact O-N 2.91Å
314	E	95.5	Very high	94.6	Very high	99 Å²	99	84.7 Å²	84.7	46%	0.463	39%	0.385	S	S	.	.	H	α-helix	trans	-63.3	-45.8	175.6	-70.4	171.1	-171.2	0	0	111	K310 E311 S316 R317 A318	K310-E314 PolarHBondContact O-N 3.33Å; E311-E314 PolarHBondContact O-N 3.23Å; E314-S316 VanDerWaalsContact C-N 3.35Å; E314-S316 PolarHBondContact O-N 2.88Å; E314-R317 PolarHBondContact O-N 3.4Å; E314-A318 PolarHBondContact O-N 3.32Å
315	R	95.6	Very high	94.5	Very high	134 Å²	134	85.5 Å²	85.5	51%	0.506	39%	0.385	S	S	.	.	H	α-helix	trans	-61.2	-41.3	175.5	-170.7	178.1	-178.4	-176.1	1.3	112.7	V229 E311 R317 A318 L319	V229-R315 HydrophobicContact CG2-CG 4.16Å; E311-R315 WeakPolarHBondContact O-CB 3.08Å; E311-R315 PolarHBondContact O-N 2.94Å; R315-R317 VanDerWaalsContact C-N 3.35Å; R315-A318 PolarHBondContact O-N 2.91Å; R315-L319 HydrophobicContact CG-CD1 4.28Å; R315-L319 WeakPolarHBondContact O-CG 3.41Å; R315-L319 PolarHBondContact O-N 2.9Å; R315-L319 VanDerWaalsContact O-N 3.09Å
316	S	94.6	Very high	94.3	Very high	24 Å²	24	87.6 Å²	87.6	17%	0.168	39%	0.392	C	S	.	.	H	α-helix	trans	-63.7	-38.9	176.4	-179.5	0	0	0	0	112	N312 E313 E314 E320	N312-S316 WeakPolarHBondContact O-CB 3.35Å; N312-S316 PolarHBondContact O-N 3.46Å; E313-S316 PolarHBondContact O-N 2.96Å; E314-S316 VanDerWaalsContact C-N 3.35Å; E314-S316 PolarHBondContact O-N 2.88Å; S316-E320 WeakPolarHBondContact O-CB 3.27Å; S316-E320 PolarHBondContact O-N 3.43Å
317	R	96.3	Very high	94.2	Very high	139 Å²	139	86.2 Å²	86.2	53%	0.525	39%	0.392	S	S	.	.	H	α-helix	trans	-65	-46.8	176	-78.8	-174.4	-72.2	-142	-3.1	111.9	E313 E314 R315 L319 E320 E321	E313-R317 PolarHBondContact O-N 2.91Å; E314-R317 PolarHBondContact O-N 3.4Å; R315-R317 VanDerWaalsContact C-N 3.35Å; R317-L319 VanDerWaalsContact C-N 3.34Å; R317-L319 PolarHBondContact O-N 2.87Å; R317-E320 WeakPolarHBondContact O-CB 3.32Å; R317-E320 PolarHBondContact O-N 3.44Å; R317-E320 VanDerWaalsContact O-N 3.15Å; R317-E321 WeakPolarHBondContact O-CG 3.48Å; R317-E321 PolarHBondContact O-N 2.97Å
318	A	95.1	Very high	94	Very high	46 Å²	46	83.1 Å²	83.1	38%	0.38	39%	0.386	S	S	.	.	H	α-helix	trans	-59.1	-43.9	178	0	0	0	0	0	112.3	E314 R315 E320 E321 E322	E314-A318 PolarHBondContact O-N 3.32Å; R315-A318 PolarHBondContact O-N 2.91Å; A318-E320 VanDerWaalsContact C-N 3.34Å; A318-E320 PolarHBondContact O-N 3.43Å; A318-E321 PolarHBondContact O-N 2.98Å; A318-E322 WeakPolarHBondContact O-CG 3.47Å; A318-E322 PolarHBondContact O-N 3.49Å
319	L	93.9	Very high	93.7	Very high	19 Å²	19	78.9 Å²	78.9	10%	0.099	37%	0.374	C	S	.	.	H	α-helix	trans	-66.6	-33	176.7	-71.7	171.2	0	0	0	113	T222 C225 L226 V229 R315 R317 R323	T222-L319 HydrophobicContact CG2-CB 4.29Å; T222-L319 HydrophobicContact CG2-CD2 4.05Å; T222-L319 WeakPolarHBondContact CG2-O 3.33Å; C225-L319 HydrophobicContact CB-CD1 3.93Å; C225-L319 HydrophobicContact CB-CD2 4.05Å; L226-L319 HydrophobicContact CB-CB 4.49Å; L226-L319 HydrophobicContact CD1-CB 3.81Å; V229-L319 HydrophobicContact CG2-CD1 4.06Å; R315-L319 HydrophobicContact CG-CD1 4.28Å; R315-L319 WeakPolarHBondContact O-CG 3.41Å; R315-L319 PolarHBondContact O-N 2.9Å; R315-L319 VanDerWaalsContact O-N 3.09Å; R317-L319 VanDerWaalsContact C-N 3.34Å; R317-L319 PolarHBondContact O-N 2.87Å; L319-R323 WeakPolarHBondContact O-CB 3.42Å; L319-R323 PolarHBondContact O-N 3.29Å
320	E	93.4	Very high	93.4	Very high	63 Å²	63	78.9 Å²	78.9	29%	0.294	38%	0.376	S	S	.	.	H	α-helix	trans	-67.2	-43	175.5	-165.1	78.2	-172.9	0	0	110.8	L226 S316 R317 A318 R323 E324	L226-E320 HydrophobicContact CD1-CB 4.29Å; L226-E320 WeakPolarHBondContact CD1-OE2 3.43Å; S316-E320 WeakPolarHBondContact O-CB 3.27Å; S316-E320 PolarHBondContact O-N 3.43Å; R317-E320 WeakPolarHBondContact O-CB 3.32Å; R317-E320 PolarHBondContact O-N 3.44Å; R317-E320 VanDerWaalsContact O-N 3.15Å; A318-E320 VanDerWaalsContact C-N 3.34Å; A318-E320 PolarHBondContact O-N 3.43Å; E320-R323 VanDerWaalsContact CD-CZ 3.5Å; E320-R323 WeakPolarHBondContact O-CB 3.41Å; E320-R323 PolarHBondContact O-N 3.4Å; E320-R323 IonicContact OE1-CZ 3.66Å; E320-R323 IonicContact OE1-NH1 3.75Å; E320-R323 PolarHBondContact OE1-NH1 2.91Å; E320-R323 IonicContact OE1-NH2 3.7Å; E320-R323 PolarHBondContact OE1-NH2 3.23Å; E320-R323 IonicContact OE2-CZ 2.94Å; E320-R323 IonicContact OE2-NH1 2.67Å; E320-R323 PolarHBondContact OE2-NH1 2.87Å; E320-E324 WeakPolarHBondContact O-CG 3.43Å; E320-E324 PolarHBondContact O-N 2.88Å
321	E	95	Very high	93.1	Very high	136 Å²	136	78.3 Å²	78.3	64%	0.636	38%	0.376	S	S	*	.	H	α-helix	trans	-61.9	-44.8	174.7	-70.3	172.6	-170.7	0	0	111.7	R317 A318 R323 E324 F325	R317-E321 WeakPolarHBondContact O-CG 3.48Å; R317-E321 PolarHBondContact O-N 2.97Å; A318-E321 PolarHBondContact O-N 2.98Å; E321-R323 VanDerWaalsContact C-N 3.34Å; E321-R323 PolarHBondContact O-N 3.2Å; E321-E324 PolarHBondContact O-N 2.98Å; E321-F325 WeakPolarHBondContact O-CB 3.38Å; E321-F325 PolarHBondContact O-N 3.01Å
322	E	92.9	Very high	92.8	Very high	90 Å²	90	76.4 Å²	76.4	42%	0.421	38%	0.377	S	S	.	.	H	α-helix	trans	-59.6	-43.1	173.3	-74.7	178.4	-178.2	0	0	111.6	T222 A318 E324 F325 Y326	T222-E322 HydrophobicContact CG2-CB 4.04Å; A318-E322 WeakPolarHBondContact O-CG 3.47Å; A318-E322 PolarHBondContact O-N 3.49Å; E322-E324 PolarHBondContact O-N 3.21Å; E322-F325 WeakPolarHBondContact O-CB 3.4Å; E322-F325 PolarHBondContact O-N 3.36Å; E322-Y326 HydrophobicContact CB-CD2 4.48Å; E322-Y326 HydrophobicContact CB-CE2 4.37Å; E322-Y326 WeakPolarHBondContact O-CD2 3.46Å; E322-Y326 PolarHBondContact O-N 3.21Å
323	R	93.2	Very high	92.5	Very high	79 Å²	79	76.9 Å²	76.9	30%	0.298	38%	0.379	S	S	.	.	H	α-helix	trans	-61.6	-45.3	177.9	-169.5	-160.3	75.3	-151	-4.6	111.5	T222 L319 E320 E321 S327	T222-R323 HydrophobicContact CG2-CB 4.12Å; L319-R323 WeakPolarHBondContact O-CB 3.42Å; L319-R323 PolarHBondContact O-N 3.29Å; E320-R323 VanDerWaalsContact CD-CZ 3.5Å; E320-R323 WeakPolarHBondContact O-CB 3.41Å; E320-R323 PolarHBondContact O-N 3.4Å; E320-R323 IonicContact OE1-CZ 3.66Å; E320-R323 IonicContact OE1-NH1 3.75Å; E320-R323 PolarHBondContact OE1-NH1 2.91Å; E320-R323 IonicContact OE1-NH2 3.7Å; E320-R323 PolarHBondContact OE1-NH2 3.23Å; E320-R323 IonicContact OE2-CZ 2.94Å; E320-R323 IonicContact OE2-NH1 2.67Å; E320-R323 PolarHBondContact OE2-NH1 2.87Å; E321-R323 VanDerWaalsContact C-N 3.34Å; E321-R323 PolarHBondContact O-N 3.2Å; R323-S327 WeakPolarHBondContact O-CB 3.49Å; R323-S327 PolarHBondContact O-N 3.09Å
324	E	94.1	Very high	92.2	Very high	118 Å²	118	77 Å²	77	55%	0.551	38%	0.379	S	S	*	.	H	α-helix	trans	-63.4	-42	177.4	-73.2	-173.5	173.7	0	0	111.7	E320 E321 E322 S327 S328	E320-E324 WeakPolarHBondContact O-CG 3.43Å; E320-E324 PolarHBondContact O-N 2.88Å; E321-E324 PolarHBondContact O-N 2.98Å; E322-E324 PolarHBondContact O-N 3.21Å; E324-S327 PolarHBondContact O-N 3.09Å; E324-S328 WeakPolarHBondContact O-CB 3.44Å; E324-S328 PolarHBondContact O-N 2.88Å; E324-S328 PolarHBondContact O-OG 3.17Å
325	F	93.6	Very high	91.8	Very high	115 Å²	115	75.7 Å²	75.7	50%	0.504	38%	0.375	S	S	.	.	H	α-helix	trans	-56.7	-56.6	174.6	175	-98.4	0	0	0	111.4	E321 E322 S327 S328 Q329	E321-F325 WeakPolarHBondContact O-CB 3.38Å; E321-F325 PolarHBondContact O-N 3.01Å; E322-F325 WeakPolarHBondContact O-CB 3.4Å; E322-F325 PolarHBondContact O-N 3.36Å; F325-S327 VanDerWaalsContact C-N 3.31Å; F325-S327 PolarHBondContact O-N 2.9Å; F325-S328 PolarHBondContact O-N 2.91Å; F325-S328 PolarHBondContact O-OG 2.94Å; F325-Q329 PolarHBondContact O-N 3.34Å
326	Y	88.8	Confident	91.4	Very high	49 Å²	49	71.5 Å²	71.5	19%	0.192	37%	0.367	C	S	.	.	H	α-helix	trans	-63.9	-35.9	-179.9	-70.9	-57	0	0	0	112.9	I215 E218 E322 Q329 S330	I215-Y326 HydrophobicContact CG2-CD1 4.13Å; I215-Y326 WeakPolarHBondContact CG2-O 3.23Å; E218-Y326 HydrophobicContact CB-CE1 4.19Å; E218-Y326 HydrophobicContact CB-CE2 4.29Å; E218-Y326 WeakPolarHBondContact OE2-CE1 3.48Å; E218-Y326 PolarHBondContact OE2-OH 2.91Å; E322-Y326 HydrophobicContact CB-CD2 4.48Å; E322-Y326 HydrophobicContact CB-CE2 4.37Å; E322-Y326 WeakPolarHBondContact O-CD2 3.46Å; E322-Y326 PolarHBondContact O-N 3.21Å; Y326-Q329 PolarHBondContact O-N 3.2Å; Y326-S330 VanDerWaalsContact O-CB 3.23Å; Y326-S330 WeakPolarHBondContact O-CB 3.29Å; Y326-S330 PolarHBondContact O-N 2.96Å
327	S	90.8	Very high	91	Very high	57 Å²	57	71 Å²	71	40%	0.399	36%	0.362	S	S	.	.	H	α-helix	trans	-63.4	-45	175.9	-174.8	0	0	0	0	111.3	R323 E324 F325 S330 Q331	R323-S327 WeakPolarHBondContact O-CB 3.49Å; R323-S327 PolarHBondContact O-N 3.09Å; E324-S327 PolarHBondContact O-N 3.09Å; F325-S327 VanDerWaalsContact C-N 3.31Å; F325-S327 PolarHBondContact O-N 2.9Å; S327-S330 PolarHBondContact O-N 3.19Å; S327-Q331 WeakPolarHBondContact O-CB 3.43Å; S327-Q331 PolarHBondContact O-N 3.35Å
328	S	91.8	Very high	90.7	Very high	66 Å²	66	69.7 Å²	69.7	46%	0.462	36%	0.362	S	S	.	.	H	α-helix	trans	-65.4	-41.5	178.7	74.3	0	0	0	0	111.9	E324 F325 Q331 A332	E324-S328 WeakPolarHBondContact O-CB 3.44Å; E324-S328 PolarHBondContact O-N 2.88Å; E324-S328 PolarHBondContact O-OG 3.17Å; F325-S328 PolarHBondContact O-N 2.91Å; F325-S328 PolarHBondContact O-OG 2.94Å; S328-Q331 PolarHBondContact O-N 3.41Å; S328-A332 WeakPolarHBondContact O-CB 3.28Å; S328-A332 PolarHBondContact O-N 2.91Å
329	Q	88.9	Confident	90.4	Very high	72 Å²	72	73.6 Å²	73.6	34%	0.336	37%	0.372	S	S	.	.	H	α-helix	trans	-65.7	-44.3	177.6	-167.3	-177.8	44.6	0	0	111.5	I215 F325 Y326 Q331 A332 L333	I215-Q329 HydrophobicContact CD1-CG 3.82Å; F325-Q329 PolarHBondContact O-N 3.34Å; Y326-Q329 PolarHBondContact O-N 3.2Å; Q329-Q331 VanDerWaalsContact C-N 3.34Å; Q329-Q331 PolarHBondContact O-N 3.03Å; Q329-A332 PolarHBondContact O-N 3.35Å; Q329-L333 HydrophobicContact CG-CD1 4.36Å; Q329-L333 WeakPolarHBondContact O-CG 3.1Å; Q329-L333 PolarHBondContact O-N 3.22Å
330	S	87.1	Confident	90	Very high	25 Å²	25	74.5 Å²	74.5	18%	0.175	38%	0.377	C	S	.	.	H	α-helix	trans	-59.9	-44.1	176	-171.6	0	0	0	0	111.7	Y326 S327 L333 Q334	Y326-S330 VanDerWaalsContact O-CB 3.23Å; Y326-S330 WeakPolarHBondContact O-CB 3.29Å; Y326-S330 PolarHBondContact O-N 2.96Å; S327-S330 PolarHBondContact O-N 3.19Å; S330-L333 PolarHBondContact O-N 3.2Å; S330-Q334 VanDerWaalsContact O-CB 3.29Å; S330-Q334 WeakPolarHBondContact O-CB 3.36Å; S330-Q334 PolarHBondContact O-N 3.16Å
331	Q	89.7	Confident	89.6	Confident	116 Å²	116	74.1 Å²	74.1	54%	0.542	38%	0.379	S	S	.	.	H	α-helix	trans	-65.8	-41.5	178.3	-171	173.2	14.6	0	0	112	S327 S328 Q329 Q334 N335	S327-Q331 WeakPolarHBondContact O-CB 3.43Å; S327-Q331 PolarHBondContact O-N 3.35Å; S328-Q331 PolarHBondContact O-N 3.41Å; Q329-Q331 VanDerWaalsContact C-N 3.34Å; Q329-Q331 PolarHBondContact O-N 3.03Å; Q331-Q334 PolarHBondContact O-N 2.9Å; Q331-N335 PolarHBondContact O-N 3.35Å; Q331-N335 PolarHBondContact O-ND2 3.45Å; Q331-N335 PolarHBondContact O-OD1 2.89Å
332	A	89.6	Confident	89.4	Confident	58 Å²	58	70.1 Å²	70.1	48%	0.479	37%	0.369	S	S	.	.	H	α-helix	trans	-62.5	-46.1	176.3	0	0	0	0	0	111.9	S328 Q329 N335 S336	S328-A332 WeakPolarHBondContact O-CB 3.28Å; S328-A332 PolarHBondContact O-N 2.91Å; Q329-A332 PolarHBondContact O-N 3.35Å; A332-N335 PolarHBondContact O-N 3.45Å; A332-S336 PolarHBondContact O-N 3.32Å
333	L	87.4	Confident	89.1	Confident	25 Å²	25	71.8 Å²	71.8	13%	0.131	38%	0.377	C	S	.	.	H	α-helix	trans	-62.9	-41.3	175.7	-77.4	168.4	0	0	0	112.1	L208 I215 Q329 S330 N335 S336 L337	L208-L333 HydrophobicContact CD2-CD2 3.7Å; I215-L333 HydrophobicContact CD1-CD1 3.24Å; Q329-L333 HydrophobicContact CG-CD1 4.36Å; Q329-L333 WeakPolarHBondContact O-CG 3.1Å; Q329-L333 PolarHBondContact O-N 3.22Å; S330-L333 PolarHBondContact O-N 3.2Å; L333-N335 PolarHBondContact O-N 2.93Å; L333-S336 PolarHBondContact O-N 3.29Å; L333-L337 WeakPolarHBondContact O-CB 3.31Å; L333-L337 WeakPolarHBondContact O-CG 3.48Å; L333-L337 PolarHBondContact O-N 2.98Å
334	Q	87.8	Confident	88.8	Confident	87 Å²	87	71.9 Å²	71.9	41%	0.407	38%	0.38	S	S	.	.	H	α-helix	trans	-62	-43.3	177.2	-176.5	174.9	3.1	0	0	111.9	S330 Q331 L337 Q338	S330-Q334 VanDerWaalsContact O-CB 3.29Å; S330-Q334 WeakPolarHBondContact O-CB 3.36Å; S330-Q334 PolarHBondContact O-N 3.16Å; Q331-Q334 PolarHBondContact O-N 2.9Å; Q334-L337 PolarHBondContact O-N 2.99Å; Q334-Q338 WeakPolarHBondContact O-CB 3.46Å; Q334-Q338 VanDerWaalsContact O-CG 3.29Å; Q334-Q338 WeakPolarHBondContact O-CG 3.44Å; Q334-Q338 PolarHBondContact O-N 3.48Å
335	N	88.9	Confident	88.5	Confident	71 Å²	71	71 Å²	71	38%	0.38	38%	0.376	S	S	.	.	H	α-helix	trans	-63.1	-45.5	176.4	-67.1	-18.3	0	0	0	111.1	Q331 A332 L333 L337 Q338 E339	Q331-N335 PolarHBondContact O-N 3.35Å; Q331-N335 PolarHBondContact O-ND2 3.45Å; Q331-N335 PolarHBondContact O-OD1 2.89Å; A332-N335 PolarHBondContact O-N 3.45Å; L333-N335 PolarHBondContact O-N 2.93Å; N335-L337 PolarHBondContact O-N 2.9Å; N335-Q338 WeakPolarHBondContact O-CB 3.35Å; N335-Q338 PolarHBondContact O-N 3.43Å; N335-E339 WeakPolarHBondContact O-CG 3.41Å; N335-E339 PolarHBondContact O-N 3.4Å
336	S	87.1	Confident	88.4	Confident	46 Å²	46	69.4 Å²	69.4	32%	0.322	37%	0.37	S	S	.	.	H	α-helix	trans	-58.9	-47	176.8	-177.3	0	0	0	0	112.1	A332 L333 Q338 E339 L340	A332-S336 PolarHBondContact O-N 3.32Å; L333-S336 PolarHBondContact O-N 3.29Å; S336-Q338 VanDerWaalsContact C-N 3.31Å; S336-Q338 PolarHBondContact O-N 3.45Å; S336-E339 PolarHBondContact O-N 3.31Å; S336-L340 WeakPolarHBondContact O-CB 3.45Å; S336-L340 WeakPolarHBondContact O-CG 3.3Å; S336-L340 PolarHBondContact O-N 3.08Å
337	L	86	Confident	88.2	Confident	15 Å²	15	69.7 Å²	69.7	8%	0.079	38%	0.382	C	S	.	.	H	α-helix	trans	-62.1	-36.6	176.2	-78.1	173.5	0	0	0	112.7	V205 L208 R209 L333 Q334 N335 T341	V205-L337 HydrophobicContact CG1-CD2 4.44Å; L208-L337 HydrophobicContact CB-CD2 3.87Å; L208-L337 HydrophobicContact CB-CG 4.35Å; L208-L337 HydrophobicContact CD1-CD2 4.25Å; R209-L337 HydrophobicContact CG-CD1 4.26Å; R209-L337 HydrophobicContact CG-CD2 4.45Å; L333-L337 WeakPolarHBondContact O-CB 3.31Å; L333-L337 WeakPolarHBondContact O-CG 3.48Å; L333-L337 PolarHBondContact O-N 2.98Å; Q334-L337 PolarHBondContact O-N 2.99Å; N335-L337 PolarHBondContact O-N 2.9Å; L337-T341 VanDerWaalsContact O-CB 3.25Å; L337-T341 WeakPolarHBondContact O-CB 3.38Å; L337-T341 PolarHBondContact O-N 2.96Å; L337-T341 PolarHBondContact O-OG1 2.95Å
338	Q	89	Confident	87.9	Confident	110 Å²	110	71.9 Å²	71.9	51%	0.514	39%	0.386	S	S	.	.	H	α-helix	trans	-66.8	-44.9	176	-76.6	176.6	0.4	0	0	111.9	Q334 N335 S336 T341 A342	Q334-Q338 WeakPolarHBondContact O-CB 3.46Å; Q334-Q338 VanDerWaalsContact O-CG 3.29Å; Q334-Q338 WeakPolarHBondContact O-CG 3.44Å; Q334-Q338 PolarHBondContact O-N 3.48Å; N335-Q338 WeakPolarHBondContact O-CB 3.35Å; N335-Q338 PolarHBondContact O-N 3.43Å; S336-Q338 VanDerWaalsContact C-N 3.31Å; S336-Q338 PolarHBondContact O-N 3.45Å; Q338-T341 PolarHBondContact O-N 3.27Å; Q338-A342 WeakPolarHBondContact O-CB 3.24Å; Q338-A342 PolarHBondContact O-N 3.01Å
339	E	89.4	Confident	87.9	Confident	128 Å²	128	75.1 Å²	75.1	60%	0.598	39%	0.388	S	S	*	.	H	α-helix	trans	-60.3	-52	176.2	-72.4	176.1	-177.5	0	0	110.9	N335 S336 T341 A342 E343	N335-E339 WeakPolarHBondContact O-CG 3.41Å; N335-E339 PolarHBondContact O-N 3.4Å; S336-E339 PolarHBondContact O-N 3.31Å; E339-T341 VanDerWaalsContact C-N 3.29Å; E339-T341 PolarHBondContact O-N 3.49Å; E339-A342 WeakPolarHBondContact O-CB 3.39Å; E339-A342 PolarHBondContact O-N 3.12Å; E339-A342 VanDerWaalsContact O-N 3.09Å; E339-E343 WeakPolarHBondContact O-CG 3.33Å; E339-E343 PolarHBondContact O-N 3.33Å
340	L	84.8	Confident	87.8	Confident	38 Å²	38	77.2 Å²	77.2	20%	0.199	40%	0.398	C	S	.	.	H	α-helix	trans	-58.8	-39.5	177.5	-70.6	175.9	0	0	0	112.6	F201 L208 S336 K344	F201-L340 HydrophobicContact CE2-CD2 3.86Å; F201-L340 HydrophobicContact CZ-CB 4.08Å; F201-L340 HydrophobicContact CZ-CD2 4.11Å; L208-L340 HydrophobicContact CD1-CD1 4.11Å; S336-L340 WeakPolarHBondContact O-CB 3.45Å; S336-L340 WeakPolarHBondContact O-CG 3.3Å; S336-L340 PolarHBondContact O-N 3.08Å; L340-K344 WeakPolarHBondContact O-CB 3.27Å; L340-K344 PolarHBondContact O-N 2.98Å
341	T	85.7	Confident	87.7	Confident	56 Å²	56	81.7 Å²	81.7	34%	0.344	42%	0.419	S	S	.	.	H	α-helix	trans	-67.6	-39.8	177.1	-59.6	0	0	0	0	111.4	L337 Q338 E339 Q345	L337-T341 VanDerWaalsContact O-CB 3.25Å; L337-T341 WeakPolarHBondContact O-CB 3.38Å; L337-T341 PolarHBondContact O-N 2.96Å; L337-T341 PolarHBondContact O-OG1 2.95Å; Q338-T341 PolarHBondContact O-N 3.27Å; E339-T341 VanDerWaalsContact C-N 3.29Å; E339-T341 PolarHBondContact O-N 3.49Å; T341-Q345 WeakPolarHBondContact O-CB 3.5Å; T341-Q345 VanDerWaalsContact O-CG 3.27Å; T341-Q345 WeakPolarHBondContact O-CG 3.23Å; T341-Q345 PolarHBondContact O-N 3.29Å
342	A	90.9	Very high	87.6	Confident	51 Å²	51	83.9 Å²	83.9	42%	0.421	43%	0.427	S	S	.	.	H	α-helix	trans	-66.6	-42.7	177.4	0	0	0	0	0	111.7	Q338 E339 Q345 Q346	Q338-A342 WeakPolarHBondContact O-CB 3.24Å; Q338-A342 PolarHBondContact O-N 3.01Å; E339-A342 WeakPolarHBondContact O-CB 3.39Å; E339-A342 PolarHBondContact O-N 3.12Å; E339-A342 VanDerWaalsContact O-N 3.09Å; A342-Q345 PolarHBondContact O-N 2.99Å; A342-Q346 WeakPolarHBondContact O-CB 3.48Å; A342-Q346 PolarHBondContact O-N 3.45Å
343	E	86.3	Confident	87.7	Confident	126 Å²	126	83.8 Å²	83.8	59%	0.589	43%	0.426	S	S	*	.	H	α-helix	trans	-61.4	-47.4	174.8	-72.7	-177.6	174.2	0	0	111.4	E339 Q345 Q346 A347	E339-E343 WeakPolarHBondContact O-CG 3.33Å; E339-E343 PolarHBondContact O-N 3.33Å; E343-Q345 PolarHBondContact O-N 3.47Å; E343-Q346 WeakPolarHBondContact O-CB 3.29Å; E343-Q346 PolarHBondContact O-N 2.84Å; E343-Q346 VanDerWaalsContact O-N 3.15Å; E343-A347 PolarHBondContact O-N 3.5Å
344	K	86.8	Confident	87.5	Confident	81 Å²	81	88.5 Å²	88.5	35%	0.352	45%	0.448	S	S	.	.	H	α-helix	trans	-55	-50.2	173.7	175.5	179.7	172.1	170.2	0	111.6	F201 L340 Q346 A347 E348	F201-K344 HydrophobicContact CE1-CB 4.48Å; F201-K344 HydrophobicContact CE1-CD 4.45Å; L340-K344 WeakPolarHBondContact O-CB 3.27Å; L340-K344 PolarHBondContact O-N 2.98Å; K344-Q346 VanDerWaalsContact C-N 3.27Å; K344-Q346 PolarHBondContact O-N 3.33Å; K344-A347 PolarHBondContact O-N 2.89Å; K344-E348 WeakPolarHBondContact CE-OE1 3.43Å; K344-E348 HydrophobicContact CG-CG 4.44Å; K344-E348 IonicContact NZ-OE1 3.55Å; K344-E348 WeakPolarHBondContact O-CB 3.46Å; K344-E348 WeakPolarHBondContact O-CG 3.49Å; K344-E348 PolarHBondContact O-N 2.9Å
345	Q	88.6	Confident	87.5	Confident	100 Å²	100	87.8 Å²	87.8	47%	0.467	45%	0.449	S	S	.	.	H	α-helix	trans	-64.3	-32.4	-179.8	-74.4	176.6	5.4	0	0	112.6	T341 A342 E343 R349	T341-Q345 WeakPolarHBondContact O-CB 3.5Å; T341-Q345 VanDerWaalsContact O-CG 3.27Å; T341-Q345 WeakPolarHBondContact O-CG 3.23Å; T341-Q345 PolarHBondContact O-N 3.29Å; A342-Q345 PolarHBondContact O-N 2.99Å; E343-Q345 PolarHBondContact O-N 3.47Å; Q345-R349 WeakPolarHBondContact O-CB 3.32Å; Q345-R349 VanDerWaalsContact O-CG 3.26Å; Q345-R349 WeakPolarHBondContact O-CG 3.49Å; Q345-R349 PolarHBondContact O-N 3.43Å; Q345-R349 VanDerWaalsContact O-N 3.16Å; Q345-R349 PolarHBondContact O-NE 2.93Å
346	Q	91.5	Very high	87.5	Confident	80 Å²	80	91 Å²	91	37%	0.374	46%	0.459	S	S	.	.	H	α-helix	trans	-68	-49.5	174.9	-179.2	63.8	27.3	0	0	110.6	A342 E343 K344 E348 R349 E350	A342-Q346 WeakPolarHBondContact O-CB 3.48Å; A342-Q346 PolarHBondContact O-N 3.45Å; E343-Q346 WeakPolarHBondContact O-CB 3.29Å; E343-Q346 PolarHBondContact O-N 2.84Å; E343-Q346 VanDerWaalsContact O-N 3.15Å; K344-Q346 VanDerWaalsContact C-N 3.27Å; K344-Q346 PolarHBondContact O-N 3.33Å; Q346-E348 VanDerWaalsContact C-N 3.35Å; Q346-E348 PolarHBondContact O-N 2.69Å; Q346-R349 WeakPolarHBondContact O-CB 3.44Å; Q346-R349 PolarHBondContact O-N 3.26Å; Q346-R349 VanDerWaalsContact O-N 3.13Å; Q346-R349 VanDerWaalsContact OE1-CZ 3.23Å; Q346-E350 PolarHBondContact NE2-OE1 3.48Å; Q346-E350 WeakPolarHBondContact O-CG 3.38Å; Q346-E350 PolarHBondContact O-N 3.32Å
347	A	83.6	Confident	87.6	Confident	55 Å²	55	92.4 Å²	92.4	46%	0.455	47%	0.466	S	S	.	.	H	α-helix	trans	-60.4	-41.9	177.6	0	0	0	0	0	112.1	E343 K344 R349 E350 L351	E343-A347 PolarHBondContact O-N 3.5Å; K344-A347 PolarHBondContact O-N 2.89Å; A347-R349 VanDerWaalsContact C-N 3.32Å; A347-R349 PolarHBondContact O-N 2.91Å; A347-E350 PolarHBondContact O-N 3Å; A347-L351 WeakPolarHBondContact O-CB 3.5Å; A347-L351 PolarHBondContact O-N 2.89Å
348	E	85.4	Confident	87.6	Confident	103 Å²	103	99.4 Å²	99.4	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-62.6	-37.8	174.9	-75.9	178.3	171.5	0	0	112.5	K344 Q346 K352	K344-E348 WeakPolarHBondContact CE-OE1 3.43Å; K344-E348 HydrophobicContact CG-CG 4.44Å; K344-E348 IonicContact NZ-OE1 3.55Å; K344-E348 WeakPolarHBondContact O-CB 3.46Å; K344-E348 WeakPolarHBondContact O-CG 3.49Å; K344-E348 PolarHBondContact O-N 2.9Å; Q346-E348 VanDerWaalsContact C-N 3.35Å; Q346-E348 PolarHBondContact O-N 2.69Å; E348-K352 VanDerWaalsContact O-CB 3.26Å; E348-K352 WeakPolarHBondContact O-CB 3.44Å; E348-K352 PolarHBondContact O-N 3.45Å
349	R	90.3	Very high	87.6	Confident	135 Å²	135	99.3 Å²	99.3	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-67.7	-42.4	176.4	-80.5	180	-81.4	124.9	-3.4	111.7	Q345 Q346 A347 K352 A353	Q345-R349 WeakPolarHBondContact O-CB 3.32Å; Q345-R349 VanDerWaalsContact O-CG 3.26Å; Q345-R349 WeakPolarHBondContact O-CG 3.49Å; Q345-R349 PolarHBondContact O-N 3.43Å; Q345-R349 VanDerWaalsContact O-N 3.16Å; Q345-R349 PolarHBondContact O-NE 2.93Å; Q346-R349 WeakPolarHBondContact O-CB 3.44Å; Q346-R349 PolarHBondContact O-N 3.26Å; Q346-R349 VanDerWaalsContact O-N 3.13Å; Q346-R349 VanDerWaalsContact OE1-CZ 3.23Å; A347-R349 VanDerWaalsContact C-N 3.32Å; A347-R349 PolarHBondContact O-N 2.91Å; R349-K352 PolarHBondContact O-N 3.39Å; R349-A353 WeakPolarHBondContact O-CB 3.33Å; R349-A353 PolarHBondContact O-N 3.26Å
350	E	88	Confident	87.6	Confident	116 Å²	116	95.5 Å²	95.5	54%	0.542	48%	0.476	S	S	.	.	H	α-helix	trans	-64	-47.8	175.8	-72.1	174	-170.1	0	0	111.3	Q346 A347 K352 A353 E354	Q346-E350 PolarHBondContact NE2-OE1 3.48Å; Q346-E350 WeakPolarHBondContact O-CG 3.38Å; Q346-E350 PolarHBondContact O-N 3.32Å; A347-E350 PolarHBondContact O-N 3Å; E350-K352 VanDerWaalsContact C-N 3.32Å; E350-K352 PolarHBondContact O-N 2.91Å; E350-A353 WeakPolarHBondContact O-CB 3.39Å; E350-A353 PolarHBondContact O-N 2.94Å; E350-A353 VanDerWaalsContact O-N 3.11Å; E350-E354 PolarHBondContact O-N 3.18Å
351	L	84.2	Confident	87.8	Confident	118 Å²	118	97.9 Å²	97.9	62%	0.618	49%	0.489	S	S	*	.	H	α-helix	trans	-58.2	-43.9	175.8	-179.2	62.9	0	0	0	111.6	A347 A353 E354 V355	A347-L351 WeakPolarHBondContact O-CB 3.5Å; A347-L351 PolarHBondContact O-N 2.89Å; L351-A353 VanDerWaalsContact C-N 3.32Å; L351-A353 PolarHBondContact O-N 3.33Å; L351-E354 PolarHBondContact O-N 3.19Å; L351-V355 HydrophobicContact CD1-CG2 4.4Å; L351-V355 WeakPolarHBondContact O-CB 3.35Å; L351-V355 VanDerWaalsContact O-CG2 3.28Å; L351-V355 WeakPolarHBondContact O-CG2 3.41Å; L351-V355 PolarHBondContact O-N 3.39Å
352	K	89	Confident	87.9	Confident	163 Å²	163	98.7 Å²	98.7	71%	0.709	49%	0.488	S	S	*	.	H	α-helix	trans	-64.3	-36.6	177.4	-173.4	175.4	-177.2	175.7	0	112.4	E348 R349 E350 K356	E348-K352 VanDerWaalsContact O-CB 3.26Å; E348-K352 WeakPolarHBondContact O-CB 3.44Å; E348-K352 PolarHBondContact O-N 3.45Å; R349-K352 PolarHBondContact O-N 3.39Å; E350-K352 VanDerWaalsContact C-N 3.32Å; E350-K352 PolarHBondContact O-N 2.91Å; K352-K356 WeakPolarHBondContact O-CB 3.4Å; K352-K356 PolarHBondContact O-N 3.41Å; K352-K356 VanDerWaalsContact O-N 3.08Å
353	A	90.1	Very high	87.9	Confident	56 Å²	56	102.2 Å²	102.2	46%	0.463	49%	0.491	S	S	.	.	H	α-helix	trans	-66.1	-45.3	175	0	0	0	0	0	110.9	R349 E350 L351 K356 V357	R349-A353 WeakPolarHBondContact O-CB 3.33Å; R349-A353 PolarHBondContact O-N 3.26Å; E350-A353 WeakPolarHBondContact O-CB 3.39Å; E350-A353 PolarHBondContact O-N 2.94Å; E350-A353 VanDerWaalsContact O-N 3.11Å; L351-A353 VanDerWaalsContact C-N 3.32Å; L351-A353 PolarHBondContact O-N 3.33Å; A353-K356 WeakPolarHBondContact O-CB 3.33Å; A353-K356 PolarHBondContact O-N 2.89Å; A353-V357 WeakPolarHBondContact O-CG2 2.98Å; A353-V357 PolarHBondContact O-N 2.89Å
354	E	85	Confident	88.1	Confident	124 Å²	124	101.1 Å²	101.1	58%	0.579	48%	0.481	S	S	*	.	H	α-helix	trans	-61.5	-46.3	177.4	-169.5	58.9	-145	0	0	111.6	E350 L351 K356 V357 R358	E350-E354 PolarHBondContact O-N 3.18Å; L351-E354 PolarHBondContact O-N 3.19Å; E354-K356 VanDerWaalsContact C-N 3.28Å; E354-K356 PolarHBondContact O-N 3Å; E354-V357 PolarHBondContact O-N 3.37Å; E354-V357 VanDerWaalsContact O-N 3.16Å; E354-R358 PolarHBondContact O-N 2.88Å
355	V	86.5	Confident	88.4	Confident	71 Å²	71	101.1 Å²	101.1	43%	0.43	49%	0.485	S	S	.	.	H	α-helix	trans	-57.7	-41.7	175	169	0	0	0	0	111.1	L351 R358 M359	L351-V355 HydrophobicContact CD1-CG2 4.4Å; L351-V355 WeakPolarHBondContact O-CB 3.35Å; L351-V355 VanDerWaalsContact O-CG2 3.28Å; L351-V355 WeakPolarHBondContact O-CG2 3.41Å; L351-V355 PolarHBondContact O-N 3.39Å; V355-R358 PolarHBondContact O-N 2.94Å; V355-M359 HydrophobicContact CG1-CG 4.38Å; V355-M359 HydrophobicContact CG1-SD 4.18Å; V355-M359 WeakPolarHBondContact O-CB 3.45Å; V355-M359 VanDerWaalsContact O-CG 3.28Å; V355-M359 WeakPolarHBondContact O-CG 3.39Å; V355-M359 PolarHBondContact O-N 2.78Å
356	K	89.1	Confident	88.6	Confident	138 Å²	138	103.8 Å²	103.8	60%	0.6	49%	0.49	S	S	*	.	H	α-helix	trans	-64.3	-44.3	177.4	-173.5	-177	177	-173.4	0	111.7	K352 A353 E354 M359 D360	K352-K356 WeakPolarHBondContact O-CB 3.4Å; K352-K356 PolarHBondContact O-N 3.41Å; K352-K356 VanDerWaalsContact O-N 3.08Å; A353-K356 WeakPolarHBondContact O-CB 3.33Å; A353-K356 PolarHBondContact O-N 2.89Å; E354-K356 VanDerWaalsContact C-N 3.28Å; E354-K356 PolarHBondContact O-N 3Å; K356-M359 PolarHBondContact O-N 3.34Å; K356-D360 PolarHBondContact O-N 2.67Å
357	V	88.9	Confident	88.6	Confident	76 Å²	76	105.7 Å²	105.7	46%	0.461	50%	0.499	S	S	.	.	H	α-helix	trans	-59.9	-47.3	176	172.1	0	0	0	0	110.3	A353 E354 M359 D360 L361	A353-V357 WeakPolarHBondContact O-CG2 2.98Å; A353-V357 PolarHBondContact O-N 2.89Å; E354-V357 PolarHBondContact O-N 3.37Å; E354-V357 VanDerWaalsContact O-N 3.16Å; V357-M359 PolarHBondContact O-N 2.94Å; V357-D360 PolarHBondContact O-N 3.19Å; V357-L361 HydrophobicContact CG1-CD1 4.13Å; V357-L361 HydrophobicContact CG1-CG 4.49Å; V357-L361 WeakPolarHBondContact O-CG 3.3Å; V357-L361 PolarHBondContact O-N 3.23Å
358	R	86.6	Confident	89.1	Confident	162 Å²	162	103.6 Å²	103.6	61%	0.611	48%	0.482	S	S	*	.	H	α-helix	trans	-58.6	-46.5	176.1	-178.3	-179	169	166.7	4.7	112.3	E354 V355 D360 L361 E362	E354-R358 PolarHBondContact O-N 2.88Å; V355-R358 PolarHBondContact O-N 2.94Å; R358-D360 VanDerWaalsContact C-N 3.31Å; R358-D360 PolarHBondContact O-N 3.38Å; R358-L361 PolarHBondContact O-N 2.89Å; R358-E362 IonicContact CZ-OE1 3.11Å; R358-E362 IonicContact NE-OE1 3.12Å; R358-E362 PolarHBondContact NE-OE1 2.93Å; R358-E362 IonicContact NH2-OE1 2.67Å; R358-E362 WeakPolarHBondContact O-CG 3.01Å; R358-E362 PolarHBondContact O-N 3.24Å
359	M	88.9	Confident	89.4	Confident	108 Å²	108	102.3 Å²	102.3	53%	0.532	48%	0.476	S	S	.	.	H	α-helix	trans	-61.2	-39.2	177.5	-75.7	-177.6	74.6	0	0	112.5	V355 K356 V357 R363	V355-M359 HydrophobicContact CG1-CG 4.38Å; V355-M359 HydrophobicContact CG1-SD 4.18Å; V355-M359 WeakPolarHBondContact O-CB 3.45Å; V355-M359 VanDerWaalsContact O-CG 3.28Å; V355-M359 WeakPolarHBondContact O-CG 3.39Å; V355-M359 PolarHBondContact O-N 2.78Å; K356-M359 PolarHBondContact O-N 3.34Å; V357-M359 PolarHBondContact O-N 2.94Å; M359-R363 WeakPolarHBondContact O-CB 3.28Å; M359-R363 PolarHBondContact O-N 3.19Å
360	D	89.7	Confident	89.5	Confident	49 Å²	49	97.5 Å²	97.5	26%	0.262	47%	0.468	S	S	.	.	H	α-helix	trans	-68.9	-38	176.9	-74.3	-24.7	0	0	0	111.3	K356 V357 R358 R363 R364	K356-D360 PolarHBondContact O-N 2.67Å; V357-D360 PolarHBondContact O-N 3.19Å; R358-D360 VanDerWaalsContact C-N 3.31Å; R358-D360 PolarHBondContact O-N 3.38Å; D360-R363 PolarHBondContact O-N 2.91Å; D360-R363 IonicContact OD1-CZ 3.79Å; D360-R363 IonicContact OD1-NH1 2.98Å; D360-R363 IonicContact OD1-NH2 2.7Å; D360-R363 PolarHBondContact OD1-NH2 2.95Å; D360-R364 WeakPolarHBondContact O-CG 3.43Å; D360-R364 PolarHBondContact O-N 3.48Å
361	L	87.9	Confident	89.8	Confident	88 Å²	88	92.4 Å²	92.4	46%	0.461	45%	0.446	S	S	.	.	H	α-helix	trans	-64	-46	173.3	-70.3	173.3	0	0	0	112	V357 R358 R363 R364 L365	V357-L361 HydrophobicContact CG1-CD1 4.13Å; V357-L361 HydrophobicContact CG1-CG 4.49Å; V357-L361 WeakPolarHBondContact O-CG 3.3Å; V357-L361 PolarHBondContact O-N 3.23Å; R358-L361 PolarHBondContact O-N 2.89Å; L361-R363 VanDerWaalsContact C-N 3.26Å; L361-R363 PolarHBondContact O-N 3.4Å; L361-R364 PolarHBondContact O-N 2.93Å; L361-L365 PolarHBondContact O-N 2.92Å
362	E	87.4	Confident	90.3	Very high	73 Å²	73	90.6 Å²	90.6	34%	0.341	44%	0.436	S	S	.	.	H	α-helix	trans	-62.4	-33.1	176	-75.3	177.1	-169	0	0	112.5	R358 R366	R358-E362 IonicContact CZ-OE1 3.11Å; R358-E362 IonicContact NE-OE1 3.12Å; R358-E362 PolarHBondContact NE-OE1 2.93Å; R358-E362 IonicContact NH2-OE1 2.67Å; R358-E362 WeakPolarHBondContact O-CG 3.01Å; R358-E362 PolarHBondContact O-N 3.24Å; E362-R366 WeakPolarHBondContact O-CG 3.47Å; E362-R366 PolarHBondContact O-N 3.36Å; E362-R366 VanDerWaalsContact O-N 3.16Å; E362-R366 PolarHBondContact O-NE 3.49Å
363	R	92.4	Very high	90.5	Very high	125 Å²	125	89 Å²	89	47%	0.472	43%	0.426	S	S	.	.	H	α-helix	trans	-66.4	-48.9	173.3	-171.2	-170.1	-51.1	147.8	20.1	110.9	M359 D360 L361 L365 R366 E367	M359-R363 WeakPolarHBondContact O-CB 3.28Å; M359-R363 PolarHBondContact O-N 3.19Å; D360-R363 PolarHBondContact O-N 2.91Å; D360-R363 IonicContact OD1-CZ 3.79Å; D360-R363 IonicContact OD1-NH1 2.98Å; D360-R363 IonicContact OD1-NH2 2.7Å; D360-R363 PolarHBondContact OD1-NH2 2.95Å; L361-R363 VanDerWaalsContact C-N 3.26Å; L361-R363 PolarHBondContact O-N 3.4Å; R363-L365 VanDerWaalsContact C-N 3.31Å; R363-L365 PolarHBondContact O-N 2.94Å; R363-R366 PolarHBondContact O-N 3.07Å; R363-E367 WeakPolarHBondContact O-CG 3.25Å; R363-E367 PolarHBondContact O-N 3.4Å
364	R	90.7	Very high	90.6	Very high	103 Å²	103	88.7 Å²	88.7	39%	0.389	42%	0.42	S	S	.	.	H	α-helix	trans	-60.8	-40.3	178.7	-71.4	-179.9	-166.1	-174.8	9.1	112	D360 L361 E367 A368 E405	D360-R364 WeakPolarHBondContact O-CG 3.43Å; D360-R364 PolarHBondContact O-N 3.48Å; L361-R364 PolarHBondContact O-N 2.93Å; R364-E367 PolarHBondContact O-N 3.29Å; R364-A368 WeakPolarHBondContact O-CB 3.42Å; R364-A368 PolarHBondContact O-N 3.46Å; R364-E405 IonicContact CZ-OE2 3.9Å; R364-E405 IonicContact NH1-OE1 3.02Å; R364-E405 PolarHBondContact NH1-OE1 3.18Å; R364-E405 IonicContact NH1-OE2 3.15Å; R364-E405 PolarHBondContact NH1-OE2 3.38Å
365	L	91.8	Very high	90.9	Very high	81 Å²	81	83.9 Å²	83.9	42%	0.424	40%	0.398	S	S	.	.	H	α-helix	trans	-59.9	-48.3	175.1	-179	64.6	0	0	0	111	L361 R363 E367 A368 E369 F402	L361-L365 PolarHBondContact O-N 2.92Å; R363-L365 VanDerWaalsContact C-N 3.31Å; R363-L365 PolarHBondContact O-N 2.94Å; L365-E367 VanDerWaalsContact C-N 3.33Å; L365-E367 PolarHBondContact O-N 3.01Å; L365-A368 PolarHBondContact O-N 3.44Å; L365-E369 WeakPolarHBondContact O-CG 3.4Å; L365-E369 PolarHBondContact O-N 3.34Å; L365-F402 HydrophobicContact CD1-CE2 4.46Å; L365-F402 HydrophobicContact CD1-CZ 3.77Å
366	R	93	Very high	91.1	Very high	155 Å²	155	85.3 Å²	85.3	59%	0.585	40%	0.4	S	S	*	.	H	α-helix	trans	-60.3	-40.1	176.7	-80.6	-178.1	-89.9	176.2	-15.9	113.1	E362 R363 G370	E362-R366 WeakPolarHBondContact O-CG 3.47Å; E362-R366 PolarHBondContact O-N 3.36Å; E362-R366 VanDerWaalsContact O-N 3.16Å; E362-R366 PolarHBondContact O-NE 3.49Å; R363-R366 PolarHBondContact O-N 3.07Å; R366-G370 PolarHBondContact O-N 3.17Å
367	E	92.6	Very high	91.1	Very high	121 Å²	121	85.4 Å²	85.4	57%	0.565	40%	0.403	S	S	*	.	H	α-helix	trans	-63.3	-43.7	175	-72.3	170	-171.9	0	0	111.4	R363 R364 L365 G370 A371	R363-E367 WeakPolarHBondContact O-CG 3.25Å; R363-E367 PolarHBondContact O-N 3.4Å; R364-E367 PolarHBondContact O-N 3.29Å; L365-E367 VanDerWaalsContact C-N 3.33Å; L365-E367 PolarHBondContact O-N 3.01Å; E367-G370 PolarHBondContact O-N 3.24Å; E367-A371 PolarHBondContact O-N 2.94Å
368	A	93.6	Very high	91.1	Very high	10 Å²	10	82.4 Å²	82.4	8%	0.083	39%	0.387	C	S	.	.	H	α-helix	trans	-64	-45.2	176.5	0	0	0	0	0	112.2	R364 L365 G370 A371 L372 L399 F402	R364-A368 WeakPolarHBondContact O-CB 3.42Å; R364-A368 PolarHBondContact O-N 3.46Å; L365-A368 PolarHBondContact O-N 3.44Å; A368-G370 VanDerWaalsContact C-N 3.28Å; A368-G370 PolarHBondContact O-N 2.97Å; A368-A371 PolarHBondContact O-N 2.89Å; A368-L372 WeakPolarHBondContact O-CB 3.34Å; A368-L372 PolarHBondContact O-N 3.28Å; A368-L399 HydrophobicContact CB-CD2 4.28Å; A368-L399 WeakPolarHBondContact O-CD2 3.24Å; A368-F402 HydrophobicContact CB-CB 4.19Å; A368-F402 HydrophobicContact CB-CD1 3.9Å; A368-F402 HydrophobicContact CB-CD2 3.76Å; A368-F402 HydrophobicContact CB-CE1 4.2Å; A368-F402 HydrophobicContact CB-CE2 4.08Å; A368-F402 HydrophobicContact CB-CG 3.66Å; A368-F402 HydrophobicContact CB-CZ 4.29Å
369	E	91.2	Very high	91.1	Very high	77 Å²	77	79.1 Å²	79.1	36%	0.36	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-36.8	173.5	-69.5	176.6	-172.3	0	0	112.4	L365 L372 R373	L365-E369 WeakPolarHBondContact O-CG 3.4Å; L365-E369 PolarHBondContact O-N 3.34Å; E369-L372 PolarHBondContact O-N 3.43Å; E369-R373 WeakPolarHBondContact O-CB 3.45Å; E369-R373 WeakPolarHBondContact O-CG 3.48Å; E369-R373 PolarHBondContact O-N 3.49Å; E369-R373 PolarHBondContact O-NE 2.96Å; E369-R373 IonicContact OE2-CZ 2.75Å; E369-R373 IonicContact OE2-NH2 3.59Å; E369-R373 PolarHBondContact OE2-NH2 2.92Å
370	G	93.7	Very high	91.1	Very high	34 Å²	34	80.6 Å²	80.6	35%	0.351	39%	0.391	S	S	.	.	H	α-helix	trans	-63.3	-47.2	174.6	0	0	0	0	0	111.9	R366 E367 A368 L372 R373 S374	R366-G370 PolarHBondContact O-N 3.17Å; E367-G370 PolarHBondContact O-N 3.24Å; A368-G370 VanDerWaalsContact C-N 3.28Å; A368-G370 PolarHBondContact O-N 2.97Å; G370-L372 VanDerWaalsContact C-N 3.33Å; G370-L372 PolarHBondContact O-N 2.95Å; G370-R373 PolarHBondContact O-N 3.29Å; G370-S374 WeakPolarHBondContact O-CB 3.37Å; G370-S374 PolarHBondContact O-N 3.29Å
371	A	94	Very high	90.9	Very high	8 Å²	8	79.8 Å²	79.8	7%	0.066	39%	0.39	C	S	.	.	H	α-helix	trans	-61.9	-40.3	175.7	0	0	0	0	0	111.8	E367 A368 S374 L375 D395 H398 L399	E367-A371 PolarHBondContact O-N 2.94Å; A368-A371 PolarHBondContact O-N 2.89Å; A371-S374 PolarHBondContact O-N 3.29Å; A371-L375 VanDerWaalsContact O-CB 3.29Å; A371-L375 WeakPolarHBondContact O-CB 3.31Å; A371-L375 PolarHBondContact O-N 2.85Å; A371-D395 HydrophobicContact CB-CB 4.09Å; A371-H398 HydrophobicContact CB-CB 4.44Å; A371-L399 HydrophobicContact CB-CD2 4.5Å; A371-L399 HydrophobicContact CB-CG 4.24Å
372	L	94	Very high	90.3	Very high	80 Å²	80	85.8 Å²	85.8	42%	0.419	41%	0.412	S	S	.	.	H	α-helix	trans	-62.7	-49.7	176.3	-171.9	64.1	0	0	0	111.7	A368 E369 G370 S374 L375 E376 L399	A368-L372 WeakPolarHBondContact O-CB 3.34Å; A368-L372 PolarHBondContact O-N 3.28Å; E369-L372 PolarHBondContact O-N 3.43Å; G370-L372 VanDerWaalsContact C-N 3.33Å; G370-L372 PolarHBondContact O-N 2.95Å; L372-S374 VanDerWaalsContact C-N 3.32Å; L372-S374 PolarHBondContact O-N 3.18Å; L372-L375 WeakPolarHBondContact O-CB 3.41Å; L372-L375 PolarHBondContact O-N 3.5Å; L372-E376 WeakPolarHBondContact O-CG 3.48Å; L372-E376 PolarHBondContact O-N 2.96Å; L372-L399 HydrophobicContact CB-CD1 4.35Å; L372-L399 HydrophobicContact CB-CD2 4.14Å; L372-L399 HydrophobicContact CD1-CD1 3.95Å
373	R	92.4	Very high	89.9	Confident	131 Å²	131	87.2 Å²	87.2	49%	0.494	43%	0.425	S	S	.	.	H	α-helix	trans	-60	-41.6	176.7	-76.7	-177.5	-84.5	-134.8	-5.1	112.2	E369 G370 Q377	E369-R373 WeakPolarHBondContact O-CB 3.45Å; E369-R373 WeakPolarHBondContact O-CG 3.48Å; E369-R373 PolarHBondContact O-N 3.49Å; E369-R373 PolarHBondContact O-NE 2.96Å; E369-R373 IonicContact OE2-CZ 2.75Å; E369-R373 IonicContact OE2-NH2 3.59Å; E369-R373 PolarHBondContact OE2-NH2 2.92Å; G370-R373 PolarHBondContact O-N 3.29Å; R373-Q377 VanDerWaalsContact O-CG 3.28Å; R373-Q377 WeakPolarHBondContact O-CG 3.48Å; R373-Q377 PolarHBondContact O-N 3.32Å
374	S	92.2	Very high	89.2	Confident	49 Å²	49	89.5 Å²	89.5	34%	0.343	43%	0.434	S	S	.	.	H	α-helix	trans	-62.6	-43.9	175.6	174.7	0	0	0	0	111.7	G370 A371 L372 Q377 G378 D395	G370-S374 WeakPolarHBondContact O-CB 3.37Å; G370-S374 PolarHBondContact O-N 3.29Å; A371-S374 PolarHBondContact O-N 3.29Å; L372-S374 VanDerWaalsContact C-N 3.32Å; L372-S374 PolarHBondContact O-N 3.18Å; S374-Q377 PolarHBondContact O-N 3.41Å; S374-G378 PolarHBondContact O-N 3.09Å; S374-D395 VanDerWaalsContact CB-OD2 3.23Å; S374-D395 WeakPolarHBondContact CB-OD2 3.34Å; S374-D395 PolarHBondContact OG-OD2 2.87Å
375	L	92.4	Very high	88.9	Confident	22 Å²	22	87.7 Å²	87.7	12%	0.115	43%	0.432	C	S	.	.	H	α-helix	trans	-63.1	-45.1	177.7	-176.5	62.7	0	0	0	111.9	A371 L372 Q377 G378 L379 M392 D395 V396 L399	A371-L375 VanDerWaalsContact O-CB 3.29Å; A371-L375 WeakPolarHBondContact O-CB 3.31Å; A371-L375 PolarHBondContact O-N 2.85Å; L372-L375 WeakPolarHBondContact O-CB 3.41Å; L372-L375 PolarHBondContact O-N 3.5Å; L375-Q377 PolarHBondContact O-N 3.28Å; L375-G378 PolarHBondContact O-N 3.48Å; L375-L379 HydrophobicContact CD1-CD1 4.38Å; L375-L379 HydrophobicContact CD1-CG 4.47Å; L375-L379 HydrophobicContact CG-CD1 4.08Å; L375-L379 WeakPolarHBondContact O-CB 3.44Å; L375-L379 VanDerWaalsContact O-CG 3.3Å; L375-L379 WeakPolarHBondContact O-CG 3.47Å; L375-L379 PolarHBondContact O-N 3.42Å; L375-M392 HydrophobicContact CD1-CB 3.76Å; L375-M392 HydrophobicContact CD1-CE 4.04Å; L375-M392 HydrophobicContact CD1-CG 3.89Å; L375-D395 HydrophobicContact CB-CB 4.28Å; L375-V396 HydrophobicContact CD1-CG2 3.82Å; L375-V396 HydrophobicContact CD2-CG2 3.64Å; L375-V396 HydrophobicContact CG-CG2 4.41Å; L375-L399 HydrophobicContact CD2-CD1 3.93Å
376	E	90.5	Very high	88.6	Confident	101 Å²	101	92 Å²	92	47%	0.472	45%	0.447	S	S	.	.	H	α-helix	trans	-58.9	-45.8	175.3	-74.2	175.6	175.6	0	0	111.9	L372 G378 L379 N380	L372-E376 WeakPolarHBondContact O-CG 3.48Å; L372-E376 PolarHBondContact O-N 2.96Å; E376-G378 VanDerWaalsContact C-N 3.34Å; E376-G378 PolarHBondContact O-N 3.3Å; E376-L379 PolarHBondContact O-N 3.33Å; E376-N380 WeakPolarHBondContact O-CB 3.47Å; E376-N380 VanDerWaalsContact O-CG 3.31Å; E376-N380 PolarHBondContact O-N 3Å; E376-N380 PolarHBondContact O-ND2 3.17Å
377	Q	89.4	Confident	88.3	Confident	141 Å²	141	89.4 Å²	89.4	66%	0.659	44%	0.442	S	S	*	.	H	α-helix	trans	-63.7	-39.6	176.3	-70.9	174.3	17.3	0	0	112.1	R373 S374 L375 N380 S381	R373-Q377 VanDerWaalsContact O-CG 3.28Å; R373-Q377 WeakPolarHBondContact O-CG 3.48Å; R373-Q377 PolarHBondContact O-N 3.32Å; S374-Q377 PolarHBondContact O-N 3.41Å; L375-Q377 PolarHBondContact O-N 3.28Å; Q377-N380 PolarHBondContact O-N 3.1Å; Q377-S381 PolarHBondContact O-N 2.89Å
378	G	88.5	Confident	87.9	Confident	12 Å²	12	87.1 Å²	87.1	12%	0.124	43%	0.43	C	S	.	.	H	α-helix	trans	-61.5	-46.4	175.8	0	0	0	0	0	112.3	S374 L375 E376 S381	S374-G378 PolarHBondContact O-N 3.09Å; L375-G378 PolarHBondContact O-N 3.48Å; E376-G378 VanDerWaalsContact C-N 3.34Å; E376-G378 PolarHBondContact O-N 3.3Å; G378-S381 PolarHBondContact O-N 3.06Å; G378-S381 PolarHBondContact O-OG 3.22Å
379	L	87.1	Confident	87.5	Confident	94 Å²	94	91 Å²	91	49%	0.492	45%	0.447	S	S	.	.	H	α-helix	trans	-65.7	-38.9	178.6	-72.7	169.3	0	0	0	112.7	L375 E376 S381 M392	L375-L379 HydrophobicContact CD1-CD1 4.38Å; L375-L379 HydrophobicContact CD1-CG 4.47Å; L375-L379 HydrophobicContact CG-CD1 4.08Å; L375-L379 WeakPolarHBondContact O-CB 3.44Å; L375-L379 VanDerWaalsContact O-CG 3.3Å; L375-L379 WeakPolarHBondContact O-CG 3.47Å; L375-L379 PolarHBondContact O-N 3.42Å; E376-L379 PolarHBondContact O-N 3.33Å; L379-S381 VanDerWaalsContact C-N 3.25Å; L379-S381 PolarHBondContact O-N 2.87Å; L379-M392 HydrophobicContact CD2-CE 3.47Å; L379-M392 VanDerWaalsContact CD2-CE 3.47Å; L379-M392 HydrophobicContact CG-CE 3.85Å
380	N	87.5	Confident	87.4	Confident	138 Å²	138	93.6 Å²	93.6	74%	0.738	46%	0.459	S	S	*	.	H	α-helix	trans	-76.8	-9.2	178.2	-72.1	-25.8	0	0	0	113.6	E376 Q377	E376-N380 WeakPolarHBondContact O-CB 3.47Å; E376-N380 VanDerWaalsContact O-CG 3.31Å; E376-N380 PolarHBondContact O-N 3Å; E376-N380 PolarHBondContact O-ND2 3.17Å; Q377-N380 PolarHBondContact O-N 3.1Å
381	S	85.6	Confident	87.2	Confident	33 Å²	33	99 Å²	99	23%	0.231	47%	0.469	C	S	.	.			trans	-78.7	128.6	-178.9	83.8	0	0	0	0	112.2	Q377 G378 L379 V383 K388	Q377-S381 PolarHBondContact O-N 2.89Å; G378-S381 PolarHBondContact O-N 3.06Å; G378-S381 PolarHBondContact O-OG 3.22Å; L379-S381 VanDerWaalsContact C-N 3.25Å; L379-S381 PolarHBondContact O-N 2.87Å; S381-V383 PolarHBondContact O-N 2.96Å; S381-V383 PolarHBondContact OG-O 2.7Å; S381-K388 PolarHBondContact OG-NZ 3.15Å
382	K	77.1	Confident	87	Confident	214 Å²	214	100.2 Å²	100.2	93%	0.93	47%	0.473	S	S	*	.	S	Bend	trans	-71.1	-13.8	179.8	-64.3	-177.6	-179.8	-180	0	113.9
383	V	77.8	Confident	86.8	Confident	103 Å²	103	105.1 Å²	105.1	62%	0.624	49%	0.486	S	S	*	.			trans	-115.6	107.4	-177.6	-178.5	0	0	0	0	109.6	S381 K388	S381-V383 PolarHBondContact O-N 2.96Å; S381-V383 PolarHBondContact OG-O 2.7Å; V383-K388 PolarHBondContact O-NZ 2.81Å
384	R	77.2	Confident	86.8	Confident	172 Å²	172	101 Å²	101	65%	0.649	48%	0.48	S	S	*	.			trans	-89.5	127	172.6	-70.5	-170.5	176.5	170.4	0.1	110.5
385	N	84.5	Confident	86.8	Confident	66 Å²	66	99.8 Å²	99.8	35%	0.353	47%	0.47	S	S	.	.			trans	-124	159.1	167.7	68.9	-3.4	0	0	0	108.7	E387 K388 E389	N385-E387 PolarHBondContact O-N 2.92Å; N385-K388 PolarHBondContact O-N 2.88Å; N385-K388 WeakPolarHBondContact OD1-CA 3.48Å; N385-K388 WeakPolarHBondContact OD1-CB 3.35Å; N385-K388 WeakPolarHBondContact OD1-CD 3.45Å; N385-K388 WeakPolarHBondContact OD1-CG 3.44Å; N385-K388 PolarHBondContact OD1-N 3.01Å; N385-E389 PolarHBondContact O-N 3.02Å; N385-E389 VanDerWaalsContact O-N 3.12Å
386	K	86.6	Confident	86.9	Confident	170 Å²	170	102.2 Å²	102.2	74%	0.739	49%	0.485	S	S	*	.	H	α-helix	trans	-56	-38.3	179.8	-79.4	-174.9	172.9	-177.9	0	112.5	K388 E389 E390	K386-K388 PolarHBondContact O-N 3.45Å; K386-E389 PolarHBondContact O-N 3.28Å; K386-E390 WeakPolarHBondContact O-CG 3.4Å; K386-E390 PolarHBondContact O-N 3.24Å
387	E	85.6	Confident	87	Confident	101 Å²	101	99.8 Å²	99.8	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-64.5	-39.9	-179.9	-166.3	-176.9	174.4	0	0	113	N385 E390 R391	N385-E387 PolarHBondContact O-N 2.92Å; E387-E390 PolarHBondContact O-N 3.37Å; E387-R391 WeakPolarHBondContact O-CG 3.41Å; E387-R391 PolarHBondContact O-N 3.34Å; E387-R391 IonicContact OE1-CZ 3.09Å; E387-R391 IonicContact OE1-NE 3.39Å; E387-R391 IonicContact OE1-NH2 3.81Å; E387-R391 PolarHBondContact OE1-NH2 3.44Å
388	K	84.4	Confident	87.2	Confident	73 Å²	73	97.9 Å²	97.9	32%	0.317	47%	0.47	S	S	.	.	H	α-helix	trans	-69.3	-38.2	174.2	-76.1	171.1	-179.1	-171.7	0	111.6	S381 V383 N385 K386 E390 R391 M392	S381-K388 PolarHBondContact OG-NZ 3.15Å; V383-K388 PolarHBondContact O-NZ 2.81Å; N385-K388 PolarHBondContact O-N 2.88Å; N385-K388 WeakPolarHBondContact OD1-CA 3.48Å; N385-K388 WeakPolarHBondContact OD1-CB 3.35Å; N385-K388 WeakPolarHBondContact OD1-CD 3.45Å; N385-K388 WeakPolarHBondContact OD1-CG 3.44Å; N385-K388 PolarHBondContact OD1-N 3.01Å; K386-K388 PolarHBondContact O-N 3.45Å; K388-E390 VanDerWaalsContact C-N 3.3Å; K388-E390 PolarHBondContact O-N 3.06Å; K388-R391 PolarHBondContact O-N 2.95Å; K388-M392 WeakPolarHBondContact O-CB 3.35Å; K388-M392 VanDerWaalsContact O-CG 3.24Å; K388-M392 WeakPolarHBondContact O-CG 3.4Å; K388-M392 PolarHBondContact O-N 2.92Å
389	E	86.8	Confident	87.5	Confident	93 Å²	93	98 Å²	98	44%	0.435	47%	0.468	S	S	.	.	H	α-helix	trans	-63.5	-37.7	175.5	-72	-176.3	170.4	0	0	111.7	N385 K386 R393	N385-E389 PolarHBondContact O-N 3.02Å; N385-E389 VanDerWaalsContact O-N 3.12Å; K386-E389 PolarHBondContact O-N 3.28Å; E389-R393 WeakPolarHBondContact O-CB 3.45Å; E389-R393 PolarHBondContact O-N 3.38Å
390	E	89.3	Confident	87.8	Confident	131 Å²	131	99.7 Å²	99.7	61%	0.612	47%	0.472	S	S	*	.	H	α-helix	trans	-67.1	-43.5	173.4	-75	175.6	-179.8	0	0	112.2	K386 E387 K388 R393 A394	K386-E390 WeakPolarHBondContact O-CG 3.4Å; K386-E390 PolarHBondContact O-N 3.24Å; E387-E390 PolarHBondContact O-N 3.37Å; K388-E390 VanDerWaalsContact C-N 3.3Å; K388-E390 PolarHBondContact O-N 3.06Å; E390-R393 PolarHBondContact O-N 3.04Å; E390-A394 PolarHBondContact O-N 3.07Å
391	R	88.1	Confident	88.1	Confident	147 Å²	147	100.5 Å²	100.5	56%	0.555	46%	0.464	S	S	*	.	H	α-helix	trans	-61.4	-47.2	174.3	-72.2	176.9	-165.5	-167.6	4	112.1	E387 K388 R393 A394 D395	E387-R391 WeakPolarHBondContact O-CG 3.41Å; E387-R391 PolarHBondContact O-N 3.34Å; E387-R391 IonicContact OE1-CZ 3.09Å; E387-R391 IonicContact OE1-NE 3.39Å; E387-R391 IonicContact OE1-NH2 3.81Å; E387-R391 PolarHBondContact OE1-NH2 3.44Å; K388-R391 PolarHBondContact O-N 2.95Å; R391-R393 VanDerWaalsContact C-N 3.28Å; R391-R393 PolarHBondContact O-N 2.97Å; R391-A394 WeakPolarHBondContact O-CB 3.32Å; R391-A394 PolarHBondContact O-N 2.98Å; R391-A394 VanDerWaalsContact O-N 3.09Å; R391-D395 PolarHBondContact O-N 3.47Å
392	M	89.6	Confident	88.5	Confident	33 Å²	33	101 Å²	101	16%	0.163	46%	0.462	C	S	.	.	H	α-helix	trans	-59.8	-38.6	175.8	-73.1	172.9	49.9	0	0	112.1	L375 L379 K388 A394 D395 V396	L375-M392 HydrophobicContact CD1-CB 3.76Å; L375-M392 HydrophobicContact CD1-CE 4.04Å; L375-M392 HydrophobicContact CD1-CG 3.89Å; L379-M392 HydrophobicContact CD2-CE 3.47Å; L379-M392 VanDerWaalsContact CD2-CE 3.47Å; L379-M392 HydrophobicContact CG-CE 3.85Å; K388-M392 WeakPolarHBondContact O-CB 3.35Å; K388-M392 VanDerWaalsContact O-CG 3.24Å; K388-M392 WeakPolarHBondContact O-CG 3.4Å; K388-M392 PolarHBondContact O-N 2.92Å; M392-A394 VanDerWaalsContact C-N 3.35Å; M392-D395 PolarHBondContact O-N 3.45Å; M392-V396 WeakPolarHBondContact O-CB 3.37Å; M392-V396 VanDerWaalsContact O-CG2 3.27Å; M392-V396 WeakPolarHBondContact O-CG2 3.35Å; M392-V396 PolarHBondContact O-N 2.84Å
393	R	90.9	Very high	89.3	Confident	184 Å²	184	96.5 Å²	96.5	69%	0.694	44%	0.443	S	S	*	.	H	α-helix	trans	-65.2	-39.4	175.4	-172.6	-174.6	-59.6	-138.9	0.2	111.9	E389 E390 R391 S397	E389-R393 WeakPolarHBondContact O-CB 3.45Å; E389-R393 PolarHBondContact O-N 3.38Å; E390-R393 PolarHBondContact O-N 3.04Å; R391-R393 VanDerWaalsContact C-N 3.28Å; R391-R393 PolarHBondContact O-N 2.97Å; R393-S397 WeakPolarHBondContact O-CB 3.4Å; R393-S397 PolarHBondContact O-N 2.92Å; R393-S397 PolarHBondContact O-OG 2.65Å
394	A	91.8	Very high	90.1	Very high	44 Å²	44	96.4 Å²	96.4	36%	0.364	44%	0.435	S	S	.	.	H	α-helix	trans	-65	-42.7	174.2	0	0	0	0	0	111.4	E390 R391 M392 S397 H398	E390-A394 PolarHBondContact O-N 3.07Å; R391-A394 WeakPolarHBondContact O-CB 3.32Å; R391-A394 PolarHBondContact O-N 2.98Å; R391-A394 VanDerWaalsContact O-N 3.09Å; M392-A394 VanDerWaalsContact C-N 3.35Å; A394-S397 WeakPolarHBondContact O-CB 3.32Å; A394-S397 PolarHBondContact O-N 3.37Å; A394-H398 PolarHBondContact O-N 3.35Å; A394-H398 PolarHBondContact O-ND1 3.29Å; A394-H398 VanDerWaalsContact O-ND1 3.09Å
395	D	93.3	Very high	90.7	Very high	24 Å²	24	90.5 Å²	90.5	13%	0.128	42%	0.415	C	S	.	.	H	α-helix	trans	-62.7	-46.3	177.1	-68.2	-22.5	0	0	0	111.7	A371 S374 L375 R391 M392 S397 H398 L399	A371-D395 HydrophobicContact CB-CB 4.09Å; S374-D395 VanDerWaalsContact CB-OD2 3.23Å; S374-D395 WeakPolarHBondContact CB-OD2 3.34Å; S374-D395 PolarHBondContact OG-OD2 2.87Å; L375-D395 HydrophobicContact CB-CB 4.28Å; R391-D395 PolarHBondContact O-N 3.47Å; M392-D395 PolarHBondContact O-N 3.45Å; D395-S397 VanDerWaalsContact C-N 3.28Å; D395-S397 PolarHBondContact O-N 3.01Å; D395-H398 PolarHBondContact O-N 3.49Å; D395-L399 WeakPolarHBondContact O-CG 3.43Å; D395-L399 PolarHBondContact O-N 3.2Å
396	V	94.3	Very high	90.9	Very high	73 Å²	73	89.8 Å²	89.8	44%	0.442	42%	0.415	S	S	.	.	H	α-helix	trans	-59.6	-39.3	173.7	170.9	0	0	0	0	111.5	L375 M392 K400	L375-V396 HydrophobicContact CD1-CG2 3.82Å; L375-V396 HydrophobicContact CD2-CG2 3.64Å; L375-V396 HydrophobicContact CG-CG2 4.41Å; M392-V396 WeakPolarHBondContact O-CB 3.37Å; M392-V396 VanDerWaalsContact O-CG2 3.27Å; M392-V396 WeakPolarHBondContact O-CG2 3.35Å; M392-V396 PolarHBondContact O-N 2.84Å; V396-K400 VanDerWaalsContact O-CB 3.29Å; V396-K400 WeakPolarHBondContact O-CB 3.33Å; V396-K400 PolarHBondContact O-N 3.34Å
397	S	92.5	Very high	91.1	Very high	49 Å²	49	86.5 Å²	86.5	34%	0.343	41%	0.405	S	S	.	.	H	α-helix	trans	-67.8	-38.9	177.5	-59.2	0	0	0	0	112.1	R393 A394 D395 R401	R393-S397 WeakPolarHBondContact O-CB 3.4Å; R393-S397 PolarHBondContact O-N 2.92Å; R393-S397 PolarHBondContact O-OG 2.65Å; A394-S397 WeakPolarHBondContact O-CB 3.32Å; A394-S397 PolarHBondContact O-N 3.37Å; D395-S397 VanDerWaalsContact C-N 3.28Å; D395-S397 PolarHBondContact O-N 3.01Å; S397-R401 WeakPolarHBondContact O-CG 3.39Å; S397-R401 PolarHBondContact O-N 3.29Å; S397-R401 VanDerWaalsContact O-N 3.14Å
398	H	92.4	Very high	91.2	Very high	101 Å²	101	87.2 Å²	87.2	47%	0.468	40%	0.403	S	S	.	.	H	α-helix	trans	-64.6	-47.9	173.9	-79.7	115.7	0	0	0	111.8	A371 A394 D395 K400 R401 F402	A371-H398 HydrophobicContact CB-CB 4.44Å; A394-H398 PolarHBondContact O-N 3.35Å; A394-H398 PolarHBondContact O-ND1 3.29Å; A394-H398 VanDerWaalsContact O-ND1 3.09Å; D395-H398 PolarHBondContact O-N 3.49Å; H398-K400 VanDerWaalsContact C-N 3.35Å; H398-K400 PolarHBondContact O-N 2.99Å; H398-R401 PolarHBondContact O-N 2.91Å; H398-F402 PolarHBondContact O-N 3.5Å
399	L	94.9	Very high	91.3	Very high	16 Å²	16	86.9 Å²	86.9	8%	0.084	40%	0.404	C	S	.	.	H	α-helix	trans	-59.5	-45	176.8	-72.6	169.8	0	0	0	111.7	A368 A371 L372 L375 D395 R401 F402 F403	A368-L399 HydrophobicContact CB-CD2 4.28Å; A368-L399 WeakPolarHBondContact O-CD2 3.24Å; A371-L399 HydrophobicContact CB-CD2 4.5Å; A371-L399 HydrophobicContact CB-CG 4.24Å; L372-L399 HydrophobicContact CB-CD1 4.35Å; L372-L399 HydrophobicContact CB-CD2 4.14Å; L372-L399 HydrophobicContact CD1-CD1 3.95Å; L375-L399 HydrophobicContact CD2-CD1 3.93Å; D395-L399 WeakPolarHBondContact O-CG 3.43Å; D395-L399 PolarHBondContact O-N 3.2Å; L399-R401 PolarHBondContact O-N 2.94Å; L399-F402 WeakPolarHBondContact O-CB 3.48Å; L399-F402 PolarHBondContact O-N 2.98Å; L399-F403 HydrophobicContact CB-CE2 4.39Å; L399-F403 HydrophobicContact CD2-CE2 4.38Å; L399-F403 WeakPolarHBondContact O-CD2 3.44Å; L399-F403 PolarHBondContact O-N 2.98Å
400	K	94.2	Very high	91.3	Very high	129 Å²	129	85 Å²	85	56%	0.561	41%	0.405	S	S	*	.	H	α-helix	trans	-56.8	-48.2	176.3	179.2	176.4	170.2	178.3	0	111.7	V396 H398 F402 F403 E404	V396-K400 VanDerWaalsContact O-CB 3.29Å; V396-K400 WeakPolarHBondContact O-CB 3.33Å; V396-K400 PolarHBondContact O-N 3.34Å; H398-K400 VanDerWaalsContact C-N 3.35Å; H398-K400 PolarHBondContact O-N 2.99Å; K400-F402 VanDerWaalsContact C-N 3.33Å; K400-F402 PolarHBondContact O-N 3.49Å; K400-F403 PolarHBondContact O-N 3.45Å; K400-E404 WeakPolarHBondContact CE-OE1 3.47Å; K400-E404 HydrophobicContact CG-CG 4.41Å; K400-E404 IonicContact NZ-OE1 2.98Å; K400-E404 WeakPolarHBondContact O-CB 3.41Å; K400-E404 VanDerWaalsContact O-CG 3.31Å; K400-E404 WeakPolarHBondContact O-CG 3.32Å; K400-E404 PolarHBondContact O-N 3.39Å
401	R	93.1	Very high	91.2	Very high	155 Å²	155	83.7 Å²	83.7	59%	0.585	40%	0.399	S	S	*	.	H	α-helix	trans	-62.1	-40.9	177.8	-71.7	178.5	-161.8	154.8	4.7	112.2	S397 H398 L399 E405	S397-R401 WeakPolarHBondContact O-CG 3.39Å; S397-R401 PolarHBondContact O-N 3.29Å; S397-R401 VanDerWaalsContact O-N 3.14Å; H398-R401 PolarHBondContact O-N 2.91Å; L399-R401 PolarHBondContact O-N 2.94Å; R401-E405 WeakPolarHBondContact O-CB 3.37Å; R401-E405 PolarHBondContact O-N 3.1Å
402	F	94.3	Very high	91	Very high	44 Å²	44	81 Å²	81	19%	0.193	40%	0.395	C	S	.	.	H	α-helix	trans	-59.8	-50.3	177.1	176.6	-96.2	0	0	0	111.1	L365 A368 H398 L399 K400 E405 C406	L365-F402 HydrophobicContact CD1-CE2 4.46Å; L365-F402 HydrophobicContact CD1-CZ 3.77Å; A368-F402 HydrophobicContact CB-CB 4.19Å; A368-F402 HydrophobicContact CB-CD1 3.9Å; A368-F402 HydrophobicContact CB-CD2 3.76Å; A368-F402 HydrophobicContact CB-CE1 4.2Å; A368-F402 HydrophobicContact CB-CE2 4.08Å; A368-F402 HydrophobicContact CB-CG 3.66Å; A368-F402 HydrophobicContact CB-CZ 4.29Å; H398-F402 PolarHBondContact O-N 3.5Å; L399-F402 WeakPolarHBondContact O-CB 3.48Å; L399-F402 PolarHBondContact O-N 2.98Å; K400-F402 VanDerWaalsContact C-N 3.33Å; K400-F402 PolarHBondContact O-N 3.49Å; F402-E405 WeakPolarHBondContact O-CB 3.4Å; F402-E405 PolarHBondContact O-N 3.4Å; F402-C406 PolarHBondContact O-N 3.45Å; F402-C406 PolarHBondContact O-SG 2.92Å; F402-C406 VanDerWaalsContact O-SG 3.33Å
403	F	94.2	Very high	90.6	Very high	119 Å²	119	86.3 Å²	86.3	52%	0.522	42%	0.419	S	S	.	.	H	α-helix	trans	-67.4	-39.2	178.8	-71.4	-63.5	0	0	0	113.3	L399 K400 E405 C406 I407	L399-F403 HydrophobicContact CB-CE2 4.39Å; L399-F403 HydrophobicContact CD2-CE2 4.38Å; L399-F403 WeakPolarHBondContact O-CD2 3.44Å; L399-F403 PolarHBondContact O-N 2.98Å; K400-F403 PolarHBondContact O-N 3.45Å; F403-E405 PolarHBondContact O-N 3.15Å; F403-C406 PolarHBondContact O-N 2.91Å; F403-I407 VanDerWaalsContact O-CG1 3.26Å; F403-I407 WeakPolarHBondContact O-CG1 3.46Å; F403-I407 PolarHBondContact O-N 2.86Å
404	E	93.4	Very high	90.3	Very high	100 Å²	100	81.2 Å²	81.2	47%	0.467	42%	0.417	S	S	.	.	H	α-helix	trans	-58.6	-37.4	172.9	-76.7	174.5	169.4	0	0	111.7	K400 R408	K400-E404 WeakPolarHBondContact CE-OE1 3.47Å; K400-E404 HydrophobicContact CG-CG 4.41Å; K400-E404 IonicContact NZ-OE1 2.98Å; K400-E404 WeakPolarHBondContact O-CB 3.41Å; K400-E404 VanDerWaalsContact O-CG 3.31Å; K400-E404 WeakPolarHBondContact O-CG 3.32Å; K400-E404 PolarHBondContact O-N 3.39Å; E404-R408 WeakPolarHBondContact O-CB 3.48Å; E404-R408 PolarHBondContact O-N 3.48Å; E404-R408 VanDerWaalsContact O-N 3.09Å
405	E	90.2	Very high	90	Very high	49 Å²	49	84.3 Å²	84.3	23%	0.229	42%	0.422	C	S	.	.	H	α-helix	trans	-70.6	-42.9	174.4	178.4	150.7	-122	0	0	113.1	R364 R401 F402 F403 I407 R408 N409	R364-E405 IonicContact CZ-OE2 3.9Å; R364-E405 IonicContact NH1-OE1 3.02Å; R364-E405 PolarHBondContact NH1-OE1 3.18Å; R364-E405 IonicContact NH1-OE2 3.15Å; R364-E405 PolarHBondContact NH1-OE2 3.38Å; R401-E405 WeakPolarHBondContact O-CB 3.37Å; R401-E405 PolarHBondContact O-N 3.1Å; F402-E405 WeakPolarHBondContact O-CB 3.4Å; F402-E405 PolarHBondContact O-N 3.4Å; F403-E405 PolarHBondContact O-N 3.15Å; E405-I407 VanDerWaalsContact C-N 3.34Å; E405-I407 PolarHBondContact O-N 3.36Å; E405-R408 VanDerWaalsContact CB-NH2 3.35Å; E405-R408 PolarHBondContact O-N 2.94Å; E405-R408 IonicContact OE1-CZ 2.66Å; E405-R408 IonicContact OE1-NH1 3.77Å; E405-R408 PolarHBondContact OE1-NH1 2.93Å; E405-R408 VanDerWaalsContact OE1-NH1 3.09Å; E405-R408 IonicContact OE1-NH2 3.76Å; E405-N409 WeakPolarHBondContact O-CB 3.42Å; E405-N409 VanDerWaalsContact O-CG 3.25Å; E405-N409 PolarHBondContact O-N 3.35Å
406	C	89.5	Confident	89.5	Confident	51 Å²	51	87.5 Å²	87.5	35%	0.345	44%	0.437	S	S	.	.	H	α-helix	trans	-58.1	-45.4	173.3	-68.9	0	0	0	0	111.8	F402 F403 R408 N409 A410	F402-C406 PolarHBondContact O-N 3.45Å; F402-C406 PolarHBondContact O-SG 2.92Å; F402-C406 VanDerWaalsContact O-SG 3.33Å; F403-C406 PolarHBondContact O-N 2.91Å; C406-R408 PolarHBondContact O-N 3.26Å; C406-N409 PolarHBondContact O-N 3.45Å; C406-A410 WeakPolarHBondContact O-CB 3.26Å; C406-A410 PolarHBondContact O-N 3.32Å
407	I	89.9	Confident	88.9	Confident	101 Å²	101	88.1 Å²	88.1	52%	0.518	44%	0.443	S	S	.	.	H	α-helix	trans	-60.2	-48.3	177.3	-68.6	164.1	0	0	0	110.2	F403 E405 N409 A410 E411	F403-I407 VanDerWaalsContact O-CG1 3.26Å; F403-I407 WeakPolarHBondContact O-CG1 3.46Å; F403-I407 PolarHBondContact O-N 2.86Å; E405-I407 VanDerWaalsContact C-N 3.34Å; E405-I407 PolarHBondContact O-N 3.36Å; I407-N409 VanDerWaalsContact C-N 3.3Å; I407-N409 PolarHBondContact O-N 3.39Å; I407-A410 PolarHBondContact O-N 2.92Å; I407-E411 WeakPolarHBondContact O-CG 3.48Å; I407-E411 PolarHBondContact O-N 3.14Å
408	R	89.3	Confident	88.4	Confident	116 Å²	116	89.9 Å²	89.9	44%	0.438	45%	0.451	S	S	.	.	H	α-helix	trans	-59.3	-41.5	178.5	-163.9	-155.7	-35.4	121	-0.7	112.3	E404 E405 C406 E411 L412	E404-R408 WeakPolarHBondContact O-CB 3.48Å; E404-R408 PolarHBondContact O-N 3.48Å; E404-R408 VanDerWaalsContact O-N 3.09Å; E405-R408 VanDerWaalsContact CB-NH2 3.35Å; E405-R408 PolarHBondContact O-N 2.94Å; E405-R408 IonicContact OE1-CZ 2.66Å; E405-R408 IonicContact OE1-NH1 3.77Å; E405-R408 PolarHBondContact OE1-NH1 2.93Å; E405-R408 VanDerWaalsContact OE1-NH1 3.09Å; E405-R408 IonicContact OE1-NH2 3.76Å; C406-R408 PolarHBondContact O-N 3.26Å; R408-E411 PolarHBondContact O-N 2.94Å; R408-L412 WeakPolarHBondContact O-CG 3.44Å; R408-L412 PolarHBondContact O-N 3.34Å
409	N	86.2	Confident	87.8	Confident	65 Å²	65	89.1 Å²	89.1	35%	0.348	45%	0.45	S	S	.	.	H	α-helix	trans	-68.7	-42.8	178.8	-69.7	-8.1	0	0	0	111.2	E405 C406 I407 E411 L412 E413	E405-N409 WeakPolarHBondContact O-CB 3.42Å; E405-N409 VanDerWaalsContact O-CG 3.25Å; E405-N409 PolarHBondContact O-N 3.35Å; C406-N409 PolarHBondContact O-N 3.45Å; I407-N409 VanDerWaalsContact C-N 3.3Å; I407-N409 PolarHBondContact O-N 3.39Å; N409-E411 VanDerWaalsContact C-N 3.32Å; N409-E411 PolarHBondContact O-N 2.99Å; N409-L412 WeakPolarHBondContact O-CB 3.46Å; N409-L412 PolarHBondContact O-N 3.36Å; N409-L412 VanDerWaalsContact O-N 3.16Å; N409-E413 WeakPolarHBondContact O-CB 3.29Å; N409-E413 PolarHBondContact O-N 3.4Å
410	A	86.8	Confident	87	Confident	55 Å²	55	93.7 Å²	93.7	46%	0.455	47%	0.472	S	S	.	.	H	α-helix	trans	-62.2	-38.3	174.6	0	0	0	0	0	112.1	C406 I407 E413 A414	C406-A410 WeakPolarHBondContact O-CB 3.26Å; C406-A410 PolarHBondContact O-N 3.32Å; I407-A410 PolarHBondContact O-N 2.92Å; A410-E413 PolarHBondContact O-N 3.35Å; A410-A414 WeakPolarHBondContact O-CB 3.49Å; A410-A414 PolarHBondContact O-N 3.15Å
411	E	87.4	Confident	86.4	Confident	102 Å²	102	95.2 Å²	95.2	48%	0.477	48%	0.479	S	S	.	.	H	α-helix	trans	-64.9	-38.7	173.3	-75.8	-176	-171.1	0	0	112.9	I407 R408 N409 K415	I407-E411 WeakPolarHBondContact O-CG 3.48Å; I407-E411 PolarHBondContact O-N 3.14Å; R408-E411 PolarHBondContact O-N 2.94Å; N409-E411 VanDerWaalsContact C-N 3.32Å; N409-E411 PolarHBondContact O-N 2.99Å; E411-K415 WeakPolarHBondContact O-CD 2.77Å; E411-K415 VanDerWaalsContact O-CG 3.22Å; E411-K415 WeakPolarHBondContact O-CG 3.44Å; E411-K415 PolarHBondContact O-N 3.12Å; E411-K415 IonicContact OE2-NZ 3.15Å
412	L	82.3	Confident	85.8	Confident	90 Å²	90	92 Å²	92	47%	0.471	47%	0.473	S	S	.	.	H	α-helix	trans	-65.7	-45.1	175	-79.3	165.8	0	0	0	110.7	R408 N409 K415 M416	R408-L412 WeakPolarHBondContact O-CG 3.44Å; R408-L412 PolarHBondContact O-N 3.34Å; N409-L412 WeakPolarHBondContact O-CB 3.46Å; N409-L412 PolarHBondContact O-N 3.36Å; N409-L412 VanDerWaalsContact O-N 3.16Å; L412-K415 CarbonylContact O-C 3.45Å; L412-K415 WeakPolarHBondContact O-CA 3.47Å; L412-K415 WeakPolarHBondContact O-CB 3.34Å; L412-K415 PolarHBondContact O-N 3.29Å; L412-M416 WeakPolarHBondContact O-CG 3.3Å; L412-M416 PolarHBondContact O-N 3.32Å
413	E	82.2	Confident	84.9	Confident	145 Å²	145	92.6 Å²	92.6	68%	0.678	48%	0.483	S	S	*	.	H	α-helix	trans	-61.4	-45	177.6	-170.2	171.2	-168	0	0	111.8	N409 A410 K415 M416	N409-E413 WeakPolarHBondContact O-CB 3.29Å; N409-E413 PolarHBondContact O-N 3.4Å; A410-E413 PolarHBondContact O-N 3.35Å; E413-K415 PolarHBondContact O-N 3.25Å; E413-M416 VanDerWaalsContact O-CB 3.22Å; E413-M416 WeakPolarHBondContact O-CB 3.44Å; E413-M416 PolarHBondContact O-N 3.39Å
414	A	84.1	Confident	84.1	Confident	77 Å²	77	90.5 Å²	90.5	64%	0.636	48%	0.48	S	S	*	.	H	α-helix	trans	-59.9	-28.7	173.6	0	0	0	0	0	112.9	A410	A410-A414 WeakPolarHBondContact O-CB 3.49Å; A410-A414 PolarHBondContact O-N 3.15Å
415	K	85.7	Confident	83.5	Confident	110 Å²	110	93.6 Å²	93.6	48%	0.478	49%	0.488	S	S	.	.	H	α-helix	trans	-85.9	-11.4	176.5	-69.3	165.8	-170.8	159.9	0	113	E411 L412 E413 V418 I419	E411-K415 WeakPolarHBondContact O-CD 2.77Å; E411-K415 VanDerWaalsContact O-CG 3.22Å; E411-K415 WeakPolarHBondContact O-CG 3.44Å; E411-K415 PolarHBondContact O-N 3.12Å; E411-K415 IonicContact OE2-NZ 3.15Å; L412-K415 CarbonylContact O-C 3.45Å; L412-K415 WeakPolarHBondContact O-CA 3.47Å; L412-K415 WeakPolarHBondContact O-CB 3.34Å; L412-K415 PolarHBondContact O-N 3.29Å; E413-K415 PolarHBondContact O-N 3.25Å; K415-V418 PolarHBondContact O-N 3.28Å; K415-V418 VanDerWaalsContact O-N 3.09Å; K415-I419 HydrophobicContact CB-CD1 4.13Å; K415-I419 WeakPolarHBondContact O-CG1 3.37Å; K415-I419 PolarHBondContact O-N 3.4Å
416	M	82.9	Confident	82.6	Confident	90 Å²	90	96.3 Å²	96.3	44%	0.443	50%	0.503	S	S	.	.	H	α-helix	trans	-54.8	-44.8	-177.2	-78.3	-65.5	-68.9	0	0	114.1	L412 E413 V418 I419 M420	L412-M416 WeakPolarHBondContact O-CG 3.3Å; L412-M416 PolarHBondContact O-N 3.32Å; E413-M416 VanDerWaalsContact O-CB 3.22Å; E413-M416 WeakPolarHBondContact O-CB 3.44Å; E413-M416 PolarHBondContact O-N 3.39Å; M416-V418 PolarHBondContact O-N 3.37Å; M416-I419 PolarHBondContact O-N 2.94Å; M416-I419 VanDerWaalsContact O-N 3.17Å; M416-M420 HydrophobicContact CE-CG 4.4Å; M416-M420 HydrophobicContact CE-SD 4.4Å; M416-M420 WeakPolarHBondContact O-CB 3.13Å; M416-M420 VanDerWaalsContact O-CG 3.3Å; M416-M420 WeakPolarHBondContact O-CG 3.48Å; M416-M420 PolarHBondContact O-N 3.02Å
417	P	81.8	Confident	81.5	Confident	87 Å²	87	100.3 Å²	100.3	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-58.8	-35.7	178.2	-25.9	35.5	0	0	0	113.2	K421	P417-K421 VanDerWaalsContact O-CB 3.3Å; P417-K421 WeakPolarHBondContact O-CB 3.43Å; P417-K421 PolarHBondContact O-N 2.91Å
418	V	81.8	Confident	80.8	Confident	85 Å²	85	101.5 Å²	101.5	52%	0.515	52%	0.518	S	S	.	.	H	α-helix	trans	-74.3	-42.5	178.1	-179.7	0	0	0	0	110.8	K415 M416 M420 K421 N422	K415-V418 PolarHBondContact O-N 3.28Å; K415-V418 VanDerWaalsContact O-N 3.09Å; M416-V418 PolarHBondContact O-N 3.37Å; V418-M420 VanDerWaalsContact C-N 3.34Å; V418-M420 PolarHBondContact O-N 3.33Å; V418-K421 PolarHBondContact O-N 3.23Å; V418-N422 WeakPolarHBondContact O-CB 3.46Å; V418-N422 PolarHBondContact O-N 3Å; V418-N422 PolarHBondContact O-ND2 3.16Å
419	I	80.9	Confident	79.9	Confident	85 Å²	85	97.2 Å²	97.2	44%	0.436	51%	0.507	S	S	.	.	H	α-helix	trans	-60.2	-45.5	176.1	-65.8	167.3	0	0	0	110.3	K415 M416 N422 S423	K415-I419 HydrophobicContact CB-CD1 4.13Å; K415-I419 WeakPolarHBondContact O-CG1 3.37Å; K415-I419 PolarHBondContact O-N 3.4Å; M416-I419 PolarHBondContact O-N 2.94Å; M416-I419 VanDerWaalsContact O-N 3.17Å; I419-N422 PolarHBondContact O-N 3.45Å; I419-S423 PolarHBondContact O-N 3.49Å
420	M	77.8	Confident	79.1	Confident	113 Å²	113	95.6 Å²	95.6	56%	0.557	50%	0.503	S	S	*	.	H	α-helix	trans	-64.9	-42.8	176.8	-69.2	178.2	75.6	0	0	112.3	M416 V418 N422 S423 V424	M416-M420 HydrophobicContact CE-CG 4.4Å; M416-M420 HydrophobicContact CE-SD 4.4Å; M416-M420 WeakPolarHBondContact O-CB 3.13Å; M416-M420 VanDerWaalsContact O-CG 3.3Å; M416-M420 WeakPolarHBondContact O-CG 3.48Å; M416-M420 PolarHBondContact O-N 3.02Å; V418-M420 VanDerWaalsContact C-N 3.34Å; V418-M420 PolarHBondContact O-N 3.33Å; M420-N422 VanDerWaalsContact C-N 3.27Å; M420-N422 PolarHBondContact O-N 3.14Å; M420-S423 PolarHBondContact O-N 3.28Å; M420-S423 PolarHBondContact O-OG 3.11Å; M420-V424 WeakPolarHBondContact O-CG2 3.26Å; M420-V424 PolarHBondContact O-N 3.22Å; M420-V424 VanDerWaalsContact O-N 3.1Å
421	K	81.8	Confident	78.3	Confident	160 Å²	160	96.1 Å²	96.1	70%	0.696	50%	0.501	S	S	*	.	H	α-helix	trans	-60.3	-39.9	175.2	-174	176.8	179.4	178.4	0	111.5	P417 V418 Y425	P417-K421 VanDerWaalsContact O-CB 3.3Å; P417-K421 WeakPolarHBondContact O-CB 3.43Å; P417-K421 PolarHBondContact O-N 2.91Å; V418-K421 PolarHBondContact O-N 3.23Å; K421-Y425 WeakPolarHBondContact O-CB 3.34Å; K421-Y425 PolarHBondContact O-N 2.82Å
422	N	80.1	Confident	77.6	Confident	89 Å²	89	99.8 Å²	99.8	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-70.6	-39.9	178.5	-72	-14.2	0	0	0	112.5	V418 I419 M420 Y425 I426	V418-N422 WeakPolarHBondContact O-CB 3.46Å; V418-N422 PolarHBondContact O-N 3Å; V418-N422 PolarHBondContact O-ND2 3.16Å; I419-N422 PolarHBondContact O-N 3.45Å; M420-N422 VanDerWaalsContact C-N 3.27Å; M420-N422 PolarHBondContact O-N 3.14Å; N422-Y425 PolarHBondContact O-N 2.87Å; N422-I426 WeakPolarHBondContact O-CG1 3.07Å; N422-I426 PolarHBondContact O-N 2.82Å
423	S	75.6	Confident	76.9	Confident	56 Å²	56	103.4 Å²	103.4	39%	0.392	52%	0.518	S	S	.	.	H	α-helix	trans	-64.1	-42	177.1	67.9	0	0	0	0	111.8	I419 M420 Y425 I426 H427	I419-S423 PolarHBondContact O-N 3.49Å; M420-S423 PolarHBondContact O-N 3.28Å; M420-S423 PolarHBondContact O-OG 3.11Å; S423-Y425 VanDerWaalsContact C-N 3.34Å; S423-Y425 PolarHBondContact O-N 3.12Å; S423-I426 PolarHBondContact O-N 2.86Å; S423-H427 PolarHBondContact O-CD2 3.16Å; S423-H427 PolarHBondContact O-N 2.96Å
424	V	77.3	Confident	76.2	Confident	75 Å²	75	100.8 Å²	100.8	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-41.1	173.3	173.9	0	0	0	0	111.2	M420 H427 K428	M420-V424 WeakPolarHBondContact O-CG2 3.26Å; M420-V424 PolarHBondContact O-N 3.22Å; M420-V424 VanDerWaalsContact O-N 3.1Å; V424-H427 PolarHBondContact O-N 2.98Å; V424-K428 HydrophobicContact CG1-CD 4.14Å; V424-K428 HydrophobicContact CG1-CG 4.49Å; V424-K428 WeakPolarHBondContact O-CB 3.45Å; V424-K428 WeakPolarHBondContact O-CG 3.24Å; V424-K428 PolarHBondContact O-N 3.35Å
425	Y	79.2	Confident	75.3	Confident	164 Å²	164	103.2 Å²	103.2	64%	0.643	50%	0.504	S	S	*	.	H	α-helix	trans	-63.9	-41.6	176.8	-171	-94.9	0	0	0	112	K421 N422 S423 K428 A429	K421-Y425 WeakPolarHBondContact O-CB 3.34Å; K421-Y425 PolarHBondContact O-N 2.82Å; N422-Y425 PolarHBondContact O-N 2.87Å; S423-Y425 VanDerWaalsContact C-N 3.34Å; S423-Y425 PolarHBondContact O-N 3.12Å; Y425-K428 PolarHBondContact O-N 3.09Å; Y425-A429 VanDerWaalsContact O-CB 3.27Å; Y425-A429 WeakPolarHBondContact O-CB 3.13Å; Y425-A429 PolarHBondContact O-N 3.37Å
426	I	71.1	Confident	74.1	Confident	107 Å²	107	100.9 Å²	100.9	55%	0.549	50%	0.501	S	S	.	.	H	α-helix	trans	-62.1	-46.8	175.5	-71	171.9	0	0	0	110.7	N422 S423 K428 A429 A430	N422-I426 WeakPolarHBondContact O-CG1 3.07Å; N422-I426 PolarHBondContact O-N 2.82Å; S423-I426 PolarHBondContact O-N 2.86Å; I426-K428 PolarHBondContact O-N 3.45Å; I426-A429 PolarHBondContact O-N 3.07Å; I426-A430 VanDerWaalsContact O-CB 3.27Å; I426-A430 WeakPolarHBondContact O-CB 3.49Å; I426-A430 PolarHBondContact O-N 3.48Å
427	H	68.2	Low	72.9	Confident	135 Å²	135	100.7 Å²	100.7	63%	0.625	51%	0.508	S	S	*	.	H	α-helix	trans	-62.2	-41.6	175.9	-88	-73.6	0	0	0	112.5	S423 V424 A430 T431	S423-H427 PolarHBondContact O-CD2 3.16Å; S423-H427 PolarHBondContact O-N 2.96Å; V424-H427 PolarHBondContact O-N 2.98Å; H427-A430 PolarHBondContact O-N 3.48Å; H427-T431 VanDerWaalsContact O-CB 3.29Å; H427-T431 WeakPolarHBondContact O-CB 3.26Å; H427-T431 PolarHBondContact O-N 3.12Å; H427-T431 PolarHBondContact O-OG1 3.27Å
428	K	74.8	Confident	71.7	Confident	125 Å²	125	104.8 Å²	104.8	54%	0.543	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-43.2	174.6	-78	-179.7	178	176.3	0	111.6	V424 Y425 I426 T431 R432	V424-K428 HydrophobicContact CG1-CD 4.14Å; V424-K428 HydrophobicContact CG1-CG 4.49Å; V424-K428 WeakPolarHBondContact O-CB 3.45Å; V424-K428 WeakPolarHBondContact O-CG 3.24Å; V424-K428 PolarHBondContact O-N 3.35Å; Y425-K428 PolarHBondContact O-N 3.09Å; I426-K428 PolarHBondContact O-N 3.45Å; K428-T431 PolarHBondContact O-N 3.18Å; K428-R432 WeakPolarHBondContact O-CB 3.22Å; K428-R432 VanDerWaalsContact O-CG 3.25Å; K428-R432 WeakPolarHBondContact O-CG 3.3Å; K428-R432 PolarHBondContact O-N 2.81Å
429	A	70.1	Confident	70.3	Confident	26 Å²	26	108.2 Å²	108.2	22%	0.215	52%	0.52	C	S	.	.	H	α-helix	trans	-67	-40.6	177.7	0	0	0	0	0	112.3	Y425 I426 R432 R433	Y425-A429 VanDerWaalsContact O-CB 3.27Å; Y425-A429 WeakPolarHBondContact O-CB 3.13Å; Y425-A429 PolarHBondContact O-N 3.37Å; I426-A429 PolarHBondContact O-N 3.07Å; A429-R432 PolarHBondContact O-N 2.95Å; A429-R433 WeakPolarHBondContact O-CB 3.02Å; A429-R433 PolarHBondContact O-N 2.87Å
430	A	69.2	Low	68.9	Low	31 Å²	31	110.5 Å²	110.5	26%	0.256	53%	0.529	S	S	.	.	H	α-helix	trans	-65.2	-44.6	174.9	0	0	0	0	0	111.2	I426 H427 R432 R433 I434	I426-A430 VanDerWaalsContact O-CB 3.27Å; I426-A430 WeakPolarHBondContact O-CB 3.49Å; I426-A430 PolarHBondContact O-N 3.48Å; H427-A430 PolarHBondContact O-N 3.48Å; A430-R432 VanDerWaalsContact C-N 3.34Å; A430-R432 PolarHBondContact O-N 2.89Å; A430-R433 PolarHBondContact O-N 2.78Å; A430-I434 VanDerWaalsContact O-CG1 3.32Å; A430-I434 WeakPolarHBondContact O-CG1 3.47Å; A430-I434 PolarHBondContact O-N 2.92Å
431	T	71.1	Confident	67.3	Low	67 Å²	67	114.6 Å²	114.6	41%	0.411	54%	0.538	S	S	.	.	H	α-helix	trans	-60.8	-42.6	175.3	-58.1	0	0	0	0	111.5	H427 K428 I434 K435	H427-T431 VanDerWaalsContact O-CB 3.29Å; H427-T431 WeakPolarHBondContact O-CB 3.26Å; H427-T431 PolarHBondContact O-N 3.12Å; H427-T431 PolarHBondContact O-OG1 3.27Å; K428-T431 PolarHBondContact O-N 3.18Å; T431-I434 PolarHBondContact O-N 2.78Å; T431-K435 HydrophobicContact CG2-CD 4.4Å; T431-K435 WeakPolarHBondContact O-CB 3.37Å; T431-K435 WeakPolarHBondContact O-CG 3.29Å; T431-K435 PolarHBondContact O-N 2.78Å
432	R	71.3	Confident	65.7	Low	179 Å²	179	116.4 Å²	116.4	68%	0.675	54%	0.54	S	S	*	.	H	α-helix	trans	-62.8	-42.5	174	-73.5	175.2	-168.5	-165.3	2.8	111.9	K428 A429 A430 K435 S436	K428-R432 WeakPolarHBondContact O-CB 3.22Å; K428-R432 VanDerWaalsContact O-CG 3.25Å; K428-R432 WeakPolarHBondContact O-CG 3.3Å; K428-R432 PolarHBondContact O-N 2.81Å; A429-R432 PolarHBondContact O-N 2.95Å; A430-R432 VanDerWaalsContact C-N 3.34Å; A430-R432 PolarHBondContact O-N 2.89Å; R432-K435 PolarHBondContact O-N 2.89Å; R432-S436 WeakPolarHBondContact O-CB 3.48Å; R432-S436 PolarHBondContact O-N 3.45Å
433	R	67.2	Low	64.1	Low	166 Å²	166	122 Å²	122	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-62	-45.5	174.1	-86.4	-175.1	-94.1	151.4	-8.6	112.2	A429 A430 K435 S436 C437	A429-R433 WeakPolarHBondContact O-CB 3.02Å; A429-R433 PolarHBondContact O-N 2.87Å; A430-R433 PolarHBondContact O-N 2.78Å; R433-K435 PolarHBondContact O-N 2.85Å; R433-S436 PolarHBondContact O-N 2.91Å; R433-C437 WeakPolarHBondContact O-CB 3.21Å; R433-C437 PolarHBondContact O-N 2.84Å; R433-C437 PolarHBondContact O-SG 2.67Å
434	I	68.9	Low	62.5	Low	90 Å²	90	122.4 Å²	122.4	46%	0.462	56%	0.557	S	S	.	*	H	α-helix	trans	-61.7	-44.2	176.8	-68	164.8	0	0	0	111	A430 T431 C437 R438	A430-I434 VanDerWaalsContact O-CG1 3.32Å; A430-I434 WeakPolarHBondContact O-CG1 3.47Å; A430-I434 PolarHBondContact O-N 2.92Å; T431-I434 PolarHBondContact O-N 2.78Å; I434-C437 PolarHBondContact O-N 2.88Å; I434-R438 WeakPolarHBondContact O-CG 3.45Å; I434-R438 PolarHBondContact O-N 3.41Å
435	K	65.4	Low	61	Low	128 Å²	128	123.2 Å²	123.2	56%	0.557	57%	0.566	S	S	*	*	H	α-helix	trans	-62.9	-41.5	174.8	-72.6	-177.4	179.9	-173.9	0	111.6	T431 R432 R433 R438 F439	T431-K435 HydrophobicContact CG2-CD 4.4Å; T431-K435 WeakPolarHBondContact O-CB 3.37Å; T431-K435 WeakPolarHBondContact O-CG 3.29Å; T431-K435 PolarHBondContact O-N 2.78Å; R432-K435 PolarHBondContact O-N 2.89Å; R433-K435 PolarHBondContact O-N 2.85Å; K435-R438 PolarHBondContact O-N 3.04Å; K435-F439 WeakPolarHBondContact O-CD2 3.33Å; K435-F439 PolarHBondContact O-N 3.3Å
436	S	60.1	Low	59.3	Low	61 Å²	61	121.1 Å²	121.1	43%	0.427	57%	0.571	S	S	.	*	H	α-helix	trans	-64.2	-41.8	176	-172.7	0	0	0	0	112.7	R432 R433 F439 H440	R432-S436 WeakPolarHBondContact O-CB 3.48Å; R432-S436 PolarHBondContact O-N 3.45Å; R433-S436 PolarHBondContact O-N 2.91Å; S436-F439 PolarHBondContact O-N 3.2Å; S436-H440 PolarHBondContact O-N 3.34Å; S436-H440 PolarHBondContact O-ND1 3.49Å
437	C	57.3	Low	57.7	Low	86 Å²	86	120.1 Å²	120.1	58%	0.581	57%	0.573	S	S	*	*	H	α-helix	trans	-66.1	-37.2	174.5	-66.9	0	0	0	0	112.3	R433 I434 H440 R441	R433-C437 WeakPolarHBondContact O-CB 3.21Å; R433-C437 PolarHBondContact O-N 2.84Å; R433-C437 PolarHBondContact O-SG 2.67Å; I434-C437 PolarHBondContact O-N 2.88Å; C437-H440 PolarHBondContact O-N 3.49Å; C437-R441 WeakPolarHBondContact O-CB 3.49Å; C437-R441 PolarHBondContact O-N 2.88Å
438	R	56.4	Low	56.2	Low	172 Å²	172	124.4 Å²	124.4	65%	0.649	58%	0.584	S	S	*	*	H	α-helix	trans	-65.7	-38.1	172.6	-76.6	-178.5	-176.7	164.7	1.7	112	I434 K435 R441 R442	I434-R438 WeakPolarHBondContact O-CG 3.45Å; I434-R438 PolarHBondContact O-N 3.41Å; K435-R438 PolarHBondContact O-N 3.04Å; R438-R441 PolarHBondContact O-N 2.98Å; R438-R442 PolarHBondContact O-N 3.38Å
439	F	51.5	Low	54.5	Low	157 Å²	157	125.8 Å²	125.8	69%	0.689	60%	0.598	S	S	*	*	H	α-helix	trans	-66.5	-41	173.7	-99.9	-86	0	0	0	112.2	K435 S436 R442 R443	K435-F439 WeakPolarHBondContact O-CD2 3.33Å; K435-F439 PolarHBondContact O-N 3.3Å; S436-F439 PolarHBondContact O-N 3.2Å; F439-R442 PolarHBondContact O-N 2.97Å; F439-R443 WeakPolarHBondContact O-CB 3.43Å; F439-R443 PolarHBondContact O-N 3.36Å
440	H	51.7	Low	52.8	Low	134 Å²	134	132 Å²	132	62%	0.62	63%	0.627	S	S	*	*	H	α-helix	trans	-65.3	-38.6	173.9	-82.2	66.4	0	0	0	112.2	S436 C437 R443 S444	S436-H440 PolarHBondContact O-N 3.34Å; S436-H440 PolarHBondContact O-ND1 3.49Å; C437-H440 PolarHBondContact O-N 3.49Å; H440-R443 PolarHBondContact O-N 3.13Å; H440-S444 WeakPolarHBondContact O-CB 3.49Å; H440-S444 PolarHBondContact O-N 3.48Å; H440-S444 PolarHBondContact O-OG 2.9Å
441	R	45.8	Very low	51.1	Low	199 Å²	199	138.9 Å²	138.9	75%	0.751	66%	0.656	S	S	*	*	H	α-helix	trans	-69.5	-33.7	175.8	-167.1	-177.1	-98.1	-168.8	-5.5	112.9	C437 R438 S444 S445	C437-R441 WeakPolarHBondContact O-CB 3.49Å; C437-R441 PolarHBondContact O-N 2.88Å; R438-R441 PolarHBondContact O-N 2.98Å; R441-S444 WeakPolarHBondContact CA-OG 3.2Å; R441-S444 PolarHBondContact O-OG 2.76Å; R441-S445 WeakPolarHBondContact O-CB 3.25Å; R441-S445 PolarHBondContact O-N 2.97Å; R441-S445 VanDerWaalsContact O-N 3.13Å
442	R	48.5	Very low	49.3	Very low	198 Å²	198	145.1 Å²	145.1	75%	0.747	68%	0.677	S	S	*	*	H	α-helix	trans	-69.1	-43	171.4	-83.6	-171.5	178.8	-168.2	-0.5	111.5	R438 F439 S445 T446	R438-R442 PolarHBondContact O-N 3.38Å; F439-R442 PolarHBondContact O-N 2.97Å; R442-S445 WeakPolarHBondContact O-CB 3.39Å; R442-S445 PolarHBondContact O-N 3.01Å; R442-S445 VanDerWaalsContact O-N 3.14Å; R442-T446 PolarHBondContact O-N 3.24Å; R442-T446 VanDerWaalsContact O-N 3.14Å; R442-T446 PolarHBondContact O-OG1 3.39Å
443	R	45.4	Very low	47.8	Very low	207 Å²	207	141.8 Å²	141.8	78%	0.781	68%	0.679	S	S	*	*	H	α-helix	trans	-68.5	-33.6	178	-147.2	177.5	-172.7	-169.8	1.3	112.5	F439 H440 S445 T446 S447	F439-R443 WeakPolarHBondContact O-CB 3.43Å; F439-R443 PolarHBondContact O-N 3.36Å; H440-R443 PolarHBondContact O-N 3.13Å; R443-S445 VanDerWaalsContact C-N 3.31Å; R443-T446 PolarHBondContact O-N 3.28Å; R443-S447 WeakPolarHBondContact O-CB 3.17Å; R443-S447 PolarHBondContact O-N 3Å
444	S	43	Very low	46.3	Very low	63 Å²	63	139.2 Å²	139.2	44%	0.441	69%	0.687	S	S	.	*	H	α-helix	trans	-71.6	-24.3	171.5	67.5	0	0	0	0	113	H440 R441	H440-S444 WeakPolarHBondContact O-CB 3.49Å; H440-S444 PolarHBondContact O-N 3.48Å; H440-S444 PolarHBondContact O-OG 2.9Å; R441-S444 WeakPolarHBondContact CA-OG 3.2Å; R441-S444 PolarHBondContact O-OG 2.76Å
445	S	45.4	Very low	44.6	Very low	92 Å²	92	144.2 Å²	144.2	64%	0.643	71%	0.708	S	S	*	*	H	α-helix	trans	-78.8	-27.1	174.5	174.4	0	0	0	0	112.7	R441 R442 R443 S447	R441-S445 WeakPolarHBondContact O-CB 3.25Å; R441-S445 PolarHBondContact O-N 2.97Å; R441-S445 VanDerWaalsContact O-N 3.13Å; R442-S445 WeakPolarHBondContact O-CB 3.39Å; R442-S445 PolarHBondContact O-N 3.01Å; R442-S445 VanDerWaalsContact O-N 3.14Å; R443-S445 VanDerWaalsContact C-N 3.31Å; S445-S447 VanDerWaalsContact C-N 3.35Å
446	T	43.6	Very low	43.2	Very low	120 Å²	120	143 Å²	143	74%	0.736	72%	0.716	S	S	*	*	H	α-helix	trans	-86.8	-7.7	175.8	-16.2	0	0	0	0	112.9	R442 R443	R442-T446 PolarHBondContact O-N 3.24Å; R442-T446 VanDerWaalsContact O-N 3.14Å; R442-T446 PolarHBondContact O-OG1 3.39Å; R443-T446 PolarHBondContact O-N 3.28Å
447	S	37.6	Very low	42.4	Very low	86 Å²	86	149.6 Å²	149.6	60%	0.601	74%	0.737	S	S	*	*	S	Bend	trans	-90.8	2.8	-176.6	-176.5	0	0	0	0	114.5	R443 S445 N449	R443-S447 WeakPolarHBondContact O-CB 3.17Å; R443-S447 PolarHBondContact O-N 3Å; S445-S447 VanDerWaalsContact C-N 3.35Å; S447-N449 VanDerWaalsContact C-N 3.31Å; S447-N449 PolarHBondContact O-N 3.44Å
448	W	36.9	Very low	41.5	Very low	225 Å²	225	153.8 Å²	153.8	85%	0.852	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	9.2	-179.8	-81.2	74.8	0	0	0	114.8
449	N	39.1	Very low	40.4	Very low	155 Å²	155	151.4 Å²	151.4	83%	0.829	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	18.2	-179.4	-95.5	2	0	0	0	115.5	S447	S447-N449 VanDerWaalsContact C-N 3.31Å; S447-N449 PolarHBondContact O-N 3.44Å
450	D	32.9	Very low	40	Very low	155 Å²	155	150 Å²	150	83%	0.829	77%	0.765	S	S	*	*			trans	-146.4	96	163.4	-97.8	-37.7	0	0	0	111.1
451	M	34.3	Very low	39.5	Very low	177 Å²	177	151.6 Å²	151.6	87%	0.872	77%	0.772	S	S	*	*			trans	-83	109.6	164.9	-88.1	-91.7	90.4	0	0	109.3
452	K	33.8	Very low	39.3	Very low	197 Å²	197	147.7 Å²	147.7	86%	0.857	77%	0.766	S	S	*	*			trans	-141.4	148.7	139.3	-83.8	-161.4	178.9	175.6	0	110.7
453	P	39.1	Very low	39.3	Very low	109 Å²	109	145 Å²	145	71%	0.708	77%	0.766	S	S	*	*			trans	-93.1	151.9	-155.3	36	-32.9	0	0	0	113.4
454	S	35.4	Very low	39.6	Very low	113 Å²	113	138 Å²	138	79%	0.79	75%	0.753	S	S	*	*			trans	62.3	107.4	150.2	-57.5	0	0	0	0	118.8
455	Q	33	Very low	39.9	Very low	194 Å²	194	140.1 Å²	140.1	91%	0.907	76%	0.759	S	S	*	*				-152.2	136.6	103	-91.6	-150.5	-10.4	0	0	110.9
456	S	37.2	Very low	40.5	Very low	103 Å²	103	140.8 Å²	140.8	72%	0.72	76%	0.755	S	S	*	*			trans	-68.3	146.5	-179.2	48.2	0	0	0	0	113.4
457	F	41.8	Very low	41.5	Very low	200 Å²	200	140.2 Å²	140.2	88%	0.877	75%	0.746	S	S	*	*			trans	55.7	108.6	139.2	-126.2	-100.5	0	0	0	117.6
458	M	39	Very low	42.9	Very low	173 Å²	173	141.2 Å²	141.2	85%	0.852	74%	0.741	S	S	*	*			trans	158.6	114.9	133.6	-82.8	-144.7	-108	0	0	108.7
459	T	34.4	Very low	44.4	Very low	122 Å²	122	136.4 Å²	136.4	75%	0.748	73%	0.728	S	S	*	*			trans	-176.5	81.9	150.2	19.3	0	0	0	0	110.1	L462	T459-L462 HydrophobicContact CG2-CD1 3.7Å
460	S	42.6	Very low	45.8	Very low	128 Å²	128	135.3 Å²	135.3	90%	0.895	72%	0.721	S	S	*	*	S	Bend	trans	-106.2	36.9	167	60.3	0	0	0	0	111.4
461	Q	41.5	Very low	47.8	Very low	168 Å²	168	132.1 Å²	132.1	79%	0.785	70%	0.7	S	S	*	*	S	Bend	trans	-139.8	-2.1	-171.3	-133.4	166.9	4.3	0	0	115.7
462	L	41.1	Very low	49.7	Very low	116 Å²	116	128.8 Å²	128.8	61%	0.607	68%	0.682	S	S	*	*	S	Bend	trans	-89.2	-22.5	-177.9	-88.2	152.8	0	0	0	114.6	T459 A464	T459-L462 HydrophobicContact CG2-CD1 3.7Å; L462-A464 PolarHBondContact O-N 2.73Å
463	D	48.8	Very low	51.5	Low	141 Å²	141	123.2 Å²	123.2	75%	0.754	67%	0.665	S	S	*	*	H	α-helix	trans	-78.5	-18.3	-176.4	-73.5	-27.6	0	0	0	114.2
464	A	50.7	Low	53	Low	61 Å²	61	120.4 Å²	120.4	50%	0.504	65%	0.651	S	S	.	*	H	α-helix	trans	-73.3	-38.5	177.4	0	0	0	0	0	112	L462 M467 E468	L462-A464 PolarHBondContact O-N 2.73Å; A464-M467 PolarHBondContact O-N 2.82Å; A464-E468 PolarHBondContact O-N 3.06Å
465	N	50.2	Low	54.9	Low	108 Å²	108	121.4 Å²	121.4	58%	0.578	64%	0.641	S	S	*	*	H	α-helix	trans	-70.7	-38	-178.3	-73.9	-2.6	0	0	0	112.1	M467 E468 E469	N465-M467 VanDerWaalsContact C-N 3.33Å; N465-M467 PolarHBondContact O-N 2.85Å; N465-E468 PolarHBondContact O-N 2.91Å; N465-E469 PolarHBondContact O-N 2.91Å
466	N	58.1	Low	56.9	Low	105 Å²	105	120.3 Å²	120.3	56%	0.561	63%	0.628	S	S	*	*	H	α-helix	trans	-64.2	-35.9	177	-103.7	-16.5	0	0	0	112.7	L470	N466-L470 WeakPolarHBondContact O-CB 3.49Å; N466-L470 PolarHBondContact O-N 3.2Å; N466-L470 VanDerWaalsContact O-N 3.09Å
467	M	64.4	Low	58.4	Low	109 Å²	109	119 Å²	119	54%	0.537	61%	0.613	S	S	.	*	H	α-helix	trans	-71.8	-34.1	178.7	-154.6	-144	-51.5	0	0	111.9	A464 N465 K471	A464-M467 PolarHBondContact O-N 2.82Å; N465-M467 VanDerWaalsContact C-N 3.33Å; N465-M467 PolarHBondContact O-N 2.85Å; M467-K471 VanDerWaalsContact O-CG 3.3Å; M467-K471 WeakPolarHBondContact O-CG 3.4Å; M467-K471 PolarHBondContact O-N 2.81Å; M467-K471 VanDerWaalsContact O-N 3.09Å; M467-K471 VanDerWaalsContact SD-CE 3.51Å
468	E	67.4	Low	59.7	Low	106 Å²	106	112.6 Å²	112.6	50%	0.495	59%	0.593	S	S	.	*	H	α-helix	trans	-75.5	-38.3	179.9	-138.1	63.9	-155.7	0	0	111.4	A464 N465 K471 E472	A464-E468 PolarHBondContact O-N 3.06Å; N465-E468 PolarHBondContact O-N 2.91Å; E468-K471 PolarHBondContact O-N 2.85Å; E468-K471 IonicContact OE1-NZ 3.28Å; E468-K471 IonicContact OE2-NZ 2.65Å; E468-K471 PolarHBondContact OE2-NZ 2.97Å; E468-E472 PolarHBondContact O-N 3.4Å
469	E	67.8	Low	61.3	Low	125 Å²	125	114.1 Å²	114.1	58%	0.584	59%	0.589	S	S	*	*	H	α-helix	trans	-62.4	-41.3	170.3	-76.4	-178.7	-176.6	0	0	111.9	N465 K471 E472 V473	N465-E469 PolarHBondContact O-N 2.91Å; E469-K471 VanDerWaalsContact C-N 3.33Å; E469-K471 PolarHBondContact O-N 2.77Å; E469-E472 PolarHBondContact O-N 3.4Å; E469-V473 VanDerWaalsContact O-CG2 3.3Å; E469-V473 WeakPolarHBondContact O-CG2 3.23Å; E469-V473 PolarHBondContact O-N 2.73Å
470	L	68.6	Low	63.3	Low	131 Å²	131	112 Å²	112	69%	0.686	57%	0.573	S	S	*	*	H	α-helix	trans	-63.8	-38.9	176.2	-140.4	87.9	0	0	0	112.1	N466 A474	N466-L470 WeakPolarHBondContact O-CB 3.49Å; N466-L470 PolarHBondContact O-N 3.2Å; N466-L470 VanDerWaalsContact O-N 3.09Å; L470-A474 VanDerWaalsContact O-CB 3.29Å; L470-A474 WeakPolarHBondContact O-CB 3.35Å; L470-A474 PolarHBondContact O-N 2.87Å
471	K	74	Confident	64.7	Low	88 Å²	88	112.3 Å²	112.3	38%	0.383	56%	0.56	S	S	.	*	H	α-helix	trans	-67.6	-38.9	174.7	-74	171.6	-165.7	159.4	0	111.8	M467 E468 E469 A474 K475	M467-K471 VanDerWaalsContact O-CG 3.3Å; M467-K471 WeakPolarHBondContact O-CG 3.4Å; M467-K471 PolarHBondContact O-N 2.81Å; M467-K471 VanDerWaalsContact O-N 3.09Å; M467-K471 VanDerWaalsContact SD-CE 3.51Å; E468-K471 PolarHBondContact O-N 2.85Å; E468-K471 IonicContact OE1-NZ 3.28Å; E468-K471 IonicContact OE2-NZ 2.65Å; E468-K471 PolarHBondContact OE2-NZ 2.97Å; E469-K471 VanDerWaalsContact C-N 3.33Å; E469-K471 PolarHBondContact O-N 2.77Å; K471-A474 PolarHBondContact O-N 2.74Å; K471-K475 WeakPolarHBondContact O-CB 3.25Å; K471-K475 WeakPolarHBondContact O-CG 3.31Å; K471-K475 PolarHBondContact O-N 3.12Å
472	E	75.1	Confident	66.3	Low	107 Å²	107	113.9 Å²	113.9	50%	0.5	56%	0.559	S	S	.	*	H	α-helix	trans	-62.9	-46.5	174.3	-93.9	-126.8	163.8	0	0	111.4	E468 E469 K475 R476	E468-E472 PolarHBondContact O-N 3.4Å; E469-E472 PolarHBondContact O-N 3.4Å; E472-K475 PolarHBondContact O-N 2.92Å; E472-R476 WeakPolarHBondContact O-CG 3.49Å; E472-R476 PolarHBondContact O-N 2.98Å; E472-R476 IonicContact OE2-CZ 3.42Å; E472-R476 IonicContact OE2-NE 2.86Å; E472-R476 IonicContact OE2-NH2 3.69Å; E472-R476 PolarHBondContact OE2-NH2 2.77Å
473	V	72.4	Confident	67.9	Low	80 Å²	80	112.6 Å²	112.6	49%	0.485	55%	0.549	S	S	.	.	H	α-helix	trans	-63.3	-42.8	177	172.1	0	0	0	0	110.7	E469 K475 R476 L477	E469-V473 VanDerWaalsContact O-CG2 3.3Å; E469-V473 WeakPolarHBondContact O-CG2 3.23Å; E469-V473 PolarHBondContact O-N 2.73Å; V473-K475 VanDerWaalsContact C-N 3.34Å; V473-K475 PolarHBondContact O-N 3.21Å; V473-R476 PolarHBondContact O-N 2.76Å; V473-L477 HydrophobicContact CG1-CD1 3.86Å; V473-L477 HydrophobicContact CG1-CG 4.4Å; V473-L477 WeakPolarHBondContact O-CB 3.46Å; V473-L477 WeakPolarHBondContact O-CG 3.2Å; V473-L477 PolarHBondContact O-N 2.98Å
474	A	70.6	Confident	69	Low	50 Å²	50	112.4 Å²	112.4	41%	0.413	54%	0.538	S	S	.	.	H	α-helix	trans	-62.8	-38.3	175.2	0	0	0	0	0	112.5	L470 K471 S478	L470-A474 VanDerWaalsContact O-CB 3.29Å; L470-A474 WeakPolarHBondContact O-CB 3.35Å; L470-A474 PolarHBondContact O-N 2.87Å; K471-A474 PolarHBondContact O-N 2.74Å; A474-S478 VanDerWaalsContact O-CB 3.25Å; A474-S478 WeakPolarHBondContact O-CB 3Å; A474-S478 PolarHBondContact O-N 3.04Å; A474-S478 PolarHBondContact O-OG 3.45Å
475	K	74.6	Confident	70.1	Confident	135 Å²	135	114.3 Å²	114.3	59%	0.587	54%	0.536	S	S	*	.	H	α-helix	trans	-67.5	-38.3	173.8	-78.4	175.8	-178.6	174.4	0	112.1	K471 E472 V473 S478 R479	K471-K475 WeakPolarHBondContact O-CB 3.25Å; K471-K475 WeakPolarHBondContact O-CG 3.31Å; K471-K475 PolarHBondContact O-N 3.12Å; E472-K475 PolarHBondContact O-N 2.92Å; V473-K475 VanDerWaalsContact C-N 3.34Å; V473-K475 PolarHBondContact O-N 3.21Å; K475-S478 PolarHBondContact O-N 2.97Å; K475-R479 WeakPolarHBondContact O-CG 3.25Å; K475-R479 PolarHBondContact O-N 2.88Å
476	R	74.6	Confident	71.3	Confident	171 Å²	171	112.2 Å²	112.2	65%	0.645	53%	0.53	S	S	*	.	H	α-helix	trans	-66.4	-47.5	175.7	-72.9	-178.9	-165.8	-161.2	6.8	111.3	E472 V473 S478 R479 D480	E472-R476 WeakPolarHBondContact O-CG 3.49Å; E472-R476 PolarHBondContact O-N 2.98Å; E472-R476 IonicContact OE2-CZ 3.42Å; E472-R476 IonicContact OE2-NE 2.86Å; E472-R476 IonicContact OE2-NH2 3.69Å; E472-R476 PolarHBondContact OE2-NH2 2.77Å; V473-R476 PolarHBondContact O-N 2.76Å; R476-S478 VanDerWaalsContact C-N 3.3Å; R476-S478 PolarHBondContact O-N 3.46Å; R476-R479 PolarHBondContact O-N 2.86Å; R476-D480 PolarHBondContact O-N 2.68Å; R476-D480 VanDerWaalsContact O-N 3.08Å
477	L	69.3	Low	72	Confident	76 Å²	76	110.6 Å²	110.6	40%	0.398	52%	0.521	S	S	.	.	H	α-helix	trans	-61.4	-38.3	175.1	-72.2	167.9	0	0	0	112.1	V473 R479 D480 F483	V473-L477 HydrophobicContact CG1-CD1 3.86Å; V473-L477 HydrophobicContact CG1-CG 4.4Å; V473-L477 WeakPolarHBondContact O-CB 3.46Å; V473-L477 WeakPolarHBondContact O-CG 3.2Å; V473-L477 PolarHBondContact O-N 2.98Å; L477-R479 PolarHBondContact O-N 2.95Å; L477-D480 PolarHBondContact O-N 3.07Å; L477-F483 HydrophobicContact CB-CD1 4.41Å; L477-F483 HydrophobicContact CB-CE1 4.49Å; L477-F483 HydrophobicContact CD2-CD2 4.44Å; L477-F483 VanDerWaalsContact O-CD1 3.3Å; L477-F483 WeakPolarHBondContact O-CD1 3.49Å
478	S	68.4	Low	72.4	Confident	65 Å²	65	113.5 Å²	113.5	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-69.7	-18.3	176	-61.2	0	0	0	0	113.3	A474 K475 R476 R484	A474-S478 VanDerWaalsContact O-CB 3.25Å; A474-S478 WeakPolarHBondContact O-CB 3Å; A474-S478 PolarHBondContact O-N 3.04Å; A474-S478 PolarHBondContact O-OG 3.45Å; K475-S478 PolarHBondContact O-N 2.97Å; R476-S478 VanDerWaalsContact C-N 3.3Å; R476-S478 PolarHBondContact O-N 3.46Å; S478-R484 PolarHBondContact O-NE 2.81Å; S478-R484 PolarHBondContact O-NH2 3.44Å
479	R	72.6	Confident	72.6	Confident	204 Å²	204	114.8 Å²	114.8	77%	0.77	53%	0.533	S	S	*	.	H	α-helix	trans	-96	-12.6	175.4	-73.2	174.8	177.7	178.8	-1.3	112.7	K475 R476 L477 Q481	K475-R479 WeakPolarHBondContact O-CG 3.25Å; K475-R479 PolarHBondContact O-N 2.88Å; R476-R479 PolarHBondContact O-N 2.86Å; L477-R479 PolarHBondContact O-N 2.95Å; R479-Q481 PolarHBondContact O-N 3.13Å
480	D	76.8	Confident	72.8	Confident	77 Å²	77	113.2 Å²	113.2	41%	0.412	53%	0.527	S	S	.	.			trans	-74.3	114.9	177.9	-169.2	-18.6	0	0	0	110.3	R476 L477 R482 F483 R484	R476-D480 PolarHBondContact O-N 2.68Å; R476-D480 VanDerWaalsContact O-N 3.08Å; L477-D480 PolarHBondContact O-N 3.07Å; D480-R482 VanDerWaalsContact C-N 3.3Å; D480-R482 PolarHBondContact O-N 3.35Å; D480-R482 WeakPolarHBondContact OD1-CB 3.24Å; D480-R482 PolarHBondContact OD1-N 2.7Å; D480-F483 HydrophobicContact CB-CB 3.96Å; D480-F483 PolarHBondContact O-N 3.41Å; D480-R484 PolarHBondContact O-N 3.33Å; D480-R484 VanDerWaalsContact O-N 3.1Å
481	Q	72.4	Confident	72.8	Confident	135 Å²	135	113 Å²	113	63%	0.631	52%	0.524	S	S	*	.	H	α-helix	trans	-65.1	-34.1	-177.3	-178.6	156.8	-11.4	0	0	112.2	R479 F483 R484 E485	R479-Q481 PolarHBondContact O-N 3.13Å; Q481-F483 VanDerWaalsContact C-N 3.32Å; Q481-F483 PolarHBondContact O-N 2.77Å; Q481-R484 PolarHBondContact O-N 3.13Å; Q481-E485 HydrophobicContact CG-CG 4.5Å; Q481-E485 WeakPolarHBondContact CG-OE1 3.36Å; Q481-E485 PolarHBondContact NE2-OE1 2.75Å; Q481-E485 WeakPolarHBondContact O-CB 3.25Å; Q481-E485 WeakPolarHBondContact O-CG 3.01Å; Q481-E485 PolarHBondContact O-N 2.99Å
482	R	73.8	Confident	72.4	Confident	202 Å²	202	112.6 Å²	112.6	76%	0.762	54%	0.537	S	S	*	.	H	α-helix	trans	-67.3	-37.4	177.6	-65.9	-86.9	-118	180	-2	111.1	D480 S486	D480-R482 VanDerWaalsContact C-N 3.3Å; D480-R482 PolarHBondContact O-N 3.35Å; D480-R482 WeakPolarHBondContact OD1-CB 3.24Å; D480-R482 PolarHBondContact OD1-N 2.7Å; R482-S486 WeakPolarHBondContact O-CB 3.3Å; R482-S486 PolarHBondContact O-N 2.87Å
483	F	74.8	Confident	71.8	Confident	89 Å²	89	111.9 Å²	111.9	39%	0.39	54%	0.54	S	S	.	.	H	α-helix	trans	-67.2	-43.3	175.9	-174.6	-102.8	0	0	0	111.2	L477 D480 Q481 S486 I487	L477-F483 HydrophobicContact CB-CD1 4.41Å; L477-F483 HydrophobicContact CB-CE1 4.49Å; L477-F483 HydrophobicContact CD2-CD2 4.44Å; L477-F483 VanDerWaalsContact O-CD1 3.3Å; L477-F483 WeakPolarHBondContact O-CD1 3.49Å; D480-F483 HydrophobicContact CB-CB 3.96Å; D480-F483 PolarHBondContact O-N 3.41Å; Q481-F483 VanDerWaalsContact C-N 3.32Å; Q481-F483 PolarHBondContact O-N 2.77Å; F483-S486 PolarHBondContact O-N 3.45Å; F483-I487 HydrophobicContact CD1-CG1 4.33Å; F483-I487 HydrophobicContact CE1-CD1 4.47Å; F483-I487 HydrophobicContact CE1-CG1 4Å; F483-I487 HydrophobicContact CZ-CD1 4.14Å; F483-I487 HydrophobicContact CZ-CG1 4.1Å; F483-I487 VanDerWaalsContact O-CG1 3.31Å; F483-I487 WeakPolarHBondContact O-CG1 3.48Å; F483-I487 PolarHBondContact O-N 3.22Å
484	R	73.4	Confident	70.9	Confident	137 Å²	137	115.2 Å²	115.2	52%	0.517	55%	0.551	S	S	.	*	H	α-helix	trans	-60.8	-47.8	174.4	-70.2	-177.7	-179.7	-163	-0.4	111.9	S478 D480 Q481 S486 I487 Y488	S478-R484 PolarHBondContact O-NE 2.81Å; S478-R484 PolarHBondContact O-NH2 3.44Å; D480-R484 PolarHBondContact O-N 3.33Å; D480-R484 VanDerWaalsContact O-N 3.1Å; Q481-R484 PolarHBondContact O-N 3.13Å; R484-S486 VanDerWaalsContact C-N 3.3Å; R484-S486 PolarHBondContact O-N 2.99Å; R484-I487 PolarHBondContact O-N 3.29Å; R484-Y488 HydrophobicContact CB-CD2 4.5Å; R484-Y488 WeakPolarHBondContact O-CD2 3.17Å; R484-Y488 PolarHBondContact O-N 3.13Å
485	E	73.8	Confident	69.9	Low	101 Å²	101	119.3 Å²	119.3	47%	0.472	57%	0.573	S	S	.	*	H	α-helix	trans	-60.6	-40	178.4	-74	169.2	-172.1	0	0	111.6	Q481 Y488 H489	Q481-E485 HydrophobicContact CG-CG 4.5Å; Q481-E485 WeakPolarHBondContact CG-OE1 3.36Å; Q481-E485 PolarHBondContact NE2-OE1 2.75Å; Q481-E485 WeakPolarHBondContact O-CB 3.25Å; Q481-E485 WeakPolarHBondContact O-CG 3.01Å; Q481-E485 PolarHBondContact O-N 2.99Å; E485-Y488 PolarHBondContact O-N 3.43Å; E485-H489 WeakPolarHBondContact O-CB 3.28Å; E485-H489 PolarHBondContact O-N 3.02Å
486	S	75.2	Confident	69	Low	64 Å²	64	116.6 Å²	116.6	45%	0.448	58%	0.583	S	S	.	*	H	α-helix	trans	-64.2	-43.3	175	-176.4	0	0	0	0	112.5	R482 F483 R484 H489 I490	R482-S486 WeakPolarHBondContact O-CB 3.3Å; R482-S486 PolarHBondContact O-N 2.87Å; F483-S486 PolarHBondContact O-N 3.45Å; R484-S486 VanDerWaalsContact C-N 3.3Å; R484-S486 PolarHBondContact O-N 2.99Å; S486-H489 PolarHBondContact O-N 2.94Å; S486-I490 WeakPolarHBondContact O-CD1 2.86Å; S486-I490 VanDerWaalsContact O-CG1 3.24Å; S486-I490 WeakPolarHBondContact O-CG1 3.41Å; S486-I490 PolarHBondContact O-N 2.96Å
487	I	72.6	Confident	67.2	Low	71 Å²	71	113 Å²	113	36%	0.364	59%	0.59	S	S	.	*	H	α-helix	trans	-65.6	-42.9	176.3	-66.3	-70.5	0	0	0	111.2	F483 R484 H489 I490 M491	F483-I487 HydrophobicContact CD1-CG1 4.33Å; F483-I487 HydrophobicContact CE1-CD1 4.47Å; F483-I487 HydrophobicContact CE1-CG1 4Å; F483-I487 HydrophobicContact CZ-CD1 4.14Å; F483-I487 HydrophobicContact CZ-CG1 4.1Å; F483-I487 VanDerWaalsContact O-CG1 3.31Å; F483-I487 WeakPolarHBondContact O-CG1 3.48Å; F483-I487 PolarHBondContact O-N 3.22Å; R484-I487 PolarHBondContact O-N 3.29Å; I487-H489 VanDerWaalsContact C-N 3.29Å; I487-H489 PolarHBondContact O-N 3.32Å; I487-I490 PolarHBondContact O-N 3.37Å; I487-M491 HydrophobicContact CG2-CG 4.42Å; I487-M491 HydrophobicContact CG2-SD 4.05Å; I487-M491 WeakPolarHBondContact O-CB 3.37Å; I487-M491 WeakPolarHBondContact O-CG 3.03Å; I487-M491 PolarHBondContact O-N 3.13Å
488	Y	73.3	Confident	66	Low	170 Å²	170	115 Å²	115	67%	0.667	61%	0.608	S	S	*	*	H	α-helix	trans	-61.2	-39.4	175	-85.6	-67.6	0	0	0	112	R484 E485 M491 A492	R484-Y488 HydrophobicContact CB-CD2 4.5Å; R484-Y488 WeakPolarHBondContact O-CD2 3.17Å; R484-Y488 PolarHBondContact O-N 3.13Å; E485-Y488 PolarHBondContact O-N 3.43Å; Y488-M491 PolarHBondContact O-N 3.1Å; Y488-A492 VanDerWaalsContact O-CB 3.3Å; Y488-A492 WeakPolarHBondContact O-CB 3.39Å; Y488-A492 PolarHBondContact O-N 3.02Å
489	H	70.8	Confident	64.5	Low	133 Å²	133	117.1 Å²	117.1	62%	0.616	62%	0.622	S	S	*	*	H	α-helix	trans	-66.6	-43.1	177.2	-157	39.6	0	0	0	111.5	E485 S486 I487 M491 A492 T493	E485-H489 WeakPolarHBondContact O-CB 3.28Å; E485-H489 PolarHBondContact O-N 3.02Å; S486-H489 PolarHBondContact O-N 2.94Å; I487-H489 VanDerWaalsContact C-N 3.29Å; I487-H489 PolarHBondContact O-N 3.32Å; H489-M491 VanDerWaalsContact C-N 3.35Å; H489-M491 PolarHBondContact O-N 3.18Å; H489-A492 PolarHBondContact O-N 2.76Å; H489-T493 WeakPolarHBondContact O-CG2 3.43Å; H489-T493 PolarHBondContact O-N 3.44Å; H489-T493 PolarHBondContact O-OG1 3.05Å
490	I	72.3	Confident	63	Low	91 Å²	91	114.1 Å²	114.1	47%	0.467	63%	0.626	S	S	.	*	H	α-helix	trans	-60.8	-44	175.6	-67.7	163.9	0	0	0	111	S486 I487 T493 Q494	S486-I490 WeakPolarHBondContact O-CD1 2.86Å; S486-I490 VanDerWaalsContact O-CG1 3.24Å; S486-I490 WeakPolarHBondContact O-CG1 3.41Å; S486-I490 PolarHBondContact O-N 2.96Å; I487-I490 PolarHBondContact O-N 3.37Å; I490-T493 WeakPolarHBondContact CA-OG1 3.37Å; I490-T493 PolarHBondContact O-N 3.41Å; I490-T493 PolarHBondContact O-OG1 3.22Å; I490-Q494 PolarHBondContact O-N 3.22Å
491	M	68.6	Low	61.3	Low	127 Å²	127	118.1 Å²	118.1	63%	0.626	65%	0.647	S	S	*	*	H	α-helix	trans	-66.3	-37	177.2	-71.2	-178.6	69	0	0	112.7	I487 Y488 H489 T493	I487-M491 HydrophobicContact CG2-CG 4.42Å; I487-M491 HydrophobicContact CG2-SD 4.05Å; I487-M491 WeakPolarHBondContact O-CB 3.37Å; I487-M491 WeakPolarHBondContact O-CG 3.03Å; I487-M491 PolarHBondContact O-N 3.13Å; Y488-M491 PolarHBondContact O-N 3.1Å; H489-M491 VanDerWaalsContact C-N 3.35Å; H489-M491 PolarHBondContact O-N 3.18Å; M491-T493 VanDerWaalsContact C-N 3.32Å
492	A	64.9	Low	59.6	Low	79 Å²	79	117.4 Å²	117.4	65%	0.653	66%	0.657	S	S	*	*	H	α-helix	trans	-72.3	-24.9	177.4	0	0	0	0	0	113.2	Y488 H489	Y488-A492 VanDerWaalsContact O-CB 3.3Å; Y488-A492 WeakPolarHBondContact O-CB 3.39Å; Y488-A492 PolarHBondContact O-N 3.02Å; H489-A492 PolarHBondContact O-N 2.76Å
493	T	62	Low	58	Low	93 Å²	93	119.9 Å²	119.9	57%	0.571	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-3.2	178.8	54.9	0	0	0	0	114.6	H489 I490 M491 P495	H489-T493 WeakPolarHBondContact O-CG2 3.43Å; H489-T493 PolarHBondContact O-N 3.44Å; H489-T493 PolarHBondContact O-OG1 3.05Å; I490-T493 WeakPolarHBondContact CA-OG1 3.37Å; I490-T493 PolarHBondContact O-N 3.41Å; I490-T493 PolarHBondContact O-OG1 3.22Å; M491-T493 VanDerWaalsContact C-N 3.32Å; T493-P495 WeakPolarHBondContact O-CD 3.41Å
494	Q	53.8	Low	56.1	Low	150 Å²	150	119.1 Å²	119.1	70%	0.701	68%	0.683	S	S	*	*	S	Bend	trans	-78.4	119.3	171.8	-78.5	-166.1	-4.2	0	0	110.5	I490 G496	I490-Q494 PolarHBondContact O-N 3.22Å; Q494-G496 PolarHBondContact O-N 2.85Å; Q494-G496 VanDerWaalsContact O-N 3.17Å
495	P	49.8	Very low	54.5	Low	136 Å²	136	116.3 Å²	116.3	88%	0.883	70%	0.696	S	S	*	*			trans	-79.6	102.2	176.4	30.6	-28.6	0	0	0	109.1	T493	T493-P495 WeakPolarHBondContact O-CD 3.41Å
496	G	56	Low	52.7	Low	77 Å²	77	125.2 Å²	125.2	79%	0.794	73%	0.734	S	S	*	*			trans	150.8	66.5	167.7	0	0	0	0	0	116.5	Q494	Q494-G496 PolarHBondContact O-N 2.85Å; Q494-G496 VanDerWaalsContact O-N 3.17Å
497	A	37.3	Very low	51.6	Low	96 Å²	96	128.3 Å²	128.3	79%	0.793	75%	0.748	S	S	*	*			trans	-163.1	148.8	145.1	0	0	0	0	0	110.9
498	P	43.3	Very low	50.5	Low	119 Å²	119	131.3 Å²	131.3	77%	0.773	77%	0.768	S	S	*	*			trans	-82.3	144	-161.4	19.9	-9.3	0	0	0	113.7	V500	P498-V500 PolarHBondContact O-N 2.67Å; P498-V500 VanDerWaalsContact O-N 3.11Å
499	S	37.9	Very low	49.2	Very low	109 Å²	109	129.2 Å²	129.2	76%	0.762	77%	0.774	S	S	*	*			trans	-64.6	102.3	170.5	51.6	0	0	0	0	111.1	L501	S499-L501 PolarHBondContact O-N 3.11Å
500	V	39.4	Very low	47.9	Very low	141 Å²	141	128.9 Å²	128.9	86%	0.855	78%	0.783	S	S	*	*			trans	-75.3	99.7	161.5	178.1	0	0	0	0	107.2	P498 S502	P498-V500 PolarHBondContact O-N 2.67Å; P498-V500 VanDerWaalsContact O-N 3.11Å; V500-S502 PolarHBondContact O-N 2.74Å
501	L	42	Very low	46.4	Very low	161 Å²	161	131.3 Å²	131.3	84%	0.843	80%	0.803	S	S	*	*			trans	-70.8	122.7	170	-84.5	166.1	0	0	0	109.6	S499	S499-L501 PolarHBondContact O-N 3.11Å
502	S	35.8	Very low	45	Very low	119 Å²	119	131.6 Å²	131.6	83%	0.832	82%	0.815	S	S	*	*			trans	-65.5	125.7	176.9	-158.2	0	0	0	0	111.1	V500	V500-S502 PolarHBondContact O-N 2.74Å
503	R	40.5	Very low	43.5	Very low	255 Å²	255	135.4 Å²	135.4	96%	0.962	83%	0.827	S	S	*	*			trans	-105.2	107.2	164.8	-161.3	-180	-171.4	-165.2	2.3	107.6
504	G	36.1	Very low	42.1	Very low	72 Å²	72	138.6 Å²	138.6	74%	0.742	85%	0.846	S	S	*	*			trans	-172.1	111.2	174.6	0	0	0	0	0	113.2
505	G	40.1	Very low	41.1	Very low	78 Å²	78	137.7 Å²	137.7	80%	0.804	86%	0.858	S	S	*	*			trans	92.2	93.8	144.2	0	0	0	0	0	118.4
506	K	35.4	Very low	40.3	Very low	289 Å²	289	137.8 Å²	137.8	100%	1.257	86%	0.856	S	S	*	*				-154.8	0	109.9	-103.2	-177.6	-176.7	-178.5	0	109.9

Retrieved 506 of 506 residues in 1400.8 ms (Link to these results)

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