A0A3Q0KI95_SCHMA Loading...

Putative gtpase activating protein

AlphaFold DB , UniProt , Accession A0A3Q0KI95, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 710 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	30.6	Very low	28.7	Very low	230 Å²	230	138 Å²	138	100%	1.133	79%	0.786	S	S	*	*				0	92.6	0	-66.2	-174.1	-176.5	0	0	110.4
2	D	30.7	Very low	28.5	Very low	128 Å²	128	142.4 Å²	142.4	68%	0.684	79%	0.789	S	S	*	*			cis	170	129.8	-26.2	-98.3	-57.1	0	0	0	104.5
3	N	30.7	Very low	28.1	Very low	119 Å²	119	142.2 Å²	142.2	64%	0.636	79%	0.786	S	S	*	*			trans	61.7	124.6	147.9	-65.2	-36	0	0	0	121.9
4	M	30.6	Very low	27.9	Very low	161 Å²	161	148.2 Å²	148.2	79%	0.793	79%	0.793	S	S	*	*				74.7	138.6	127	-70.4	-175.3	-157.4	0	0	118.4
5	N	28.7	Very low	27.6	Very low	133 Å²	133	145.6 Å²	145.6	71%	0.711	79%	0.791	S	S	*	*			cis	-167.2	179.5	-10.5	-141.1	-22.3	0	0	0	110.1
6	I	30.9	Very low	27.5	Very low	137 Å²	137	151.6 Å²	151.6	70%	0.703	80%	0.799	S	S	*	*			trans	80.8	96.7	154.3	-64	152.2	0	0	0	118.5
7	H	27.4	Very low	27.3	Very low	159 Å²	159	151.5 Å²	151.5	74%	0.736	80%	0.799	S	S	*	*			trans	73.5	108.7	130.7	-77.4	-85.6	0	0	0	124.3
8	T	28.4	Very low	27	Very low	126 Å²	126	149.1 Å²	149.1	77%	0.773	80%	0.797	S	S	*	*			trans	75.8	102.6	132.7	50.9	0	0	0	0	119.8
9	N	26.8	Very low	26.9	Very low	177 Å²	177	147.8 Å²	147.8	95%	0.947	80%	0.795	S	S	*	*			trans	-66	143.1	173.8	-77.3	-31.4	0	0	0	114.3
10	G	26.8	Very low	26.8	Very low	77 Å²	77	147.5 Å²	147.5	79%	0.794	79%	0.793	S	S	*	*			trans	-138.1	120.8	160.7	0	0	0	0	0	111.9
11	G	23.8	Very low	26.8	Very low	71 Å²	71	147.9 Å²	147.9	73%	0.732	79%	0.794	S	S	*	*			trans	72	119.6	154.4	0	0	0	0	0	120.1
12	K	26.2	Very low	26.5	Very low	191 Å²	191	141.8 Å²	141.8	83%	0.83	77%	0.774	S	S	*	*				-173.6	131.2	122.3	-100.2	156.2	-173	176.2	0	113.7
13	N	24.2	Very low	26.4	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	78%	0.781	S	S	*	*			trans	27.5	125.1	146.7	-53.8	-2.9	0	0	0	121.2
14	Y	24.5	Very low	26.7	Very low	226 Å²	226	140.7 Å²	140.7	89%	0.886	79%	0.786	S	S	*	*			trans	-147.6	143.2	134	-75.8	-67.8	0	0	0	111.2
15	S	23.2	Very low	26.9	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	77%	0.773	S	S	*	*			trans	-101.9	138.7	174.1	56.7	0	0	0	0	110.8
16	W	25.9	Very low	27.3	Very low	241 Å²	241	132.2 Å²	132.2	91%	0.913	76%	0.759	S	S	*	*			trans	-142.2	138	164.6	-81.3	96.1	0	0	0	112.2
17	N	24.4	Very low	27.8	Very low	151 Å²	151	130.6 Å²	130.6	81%	0.807	76%	0.756	S	S	*	*			trans	-80.8	158.1	174.5	-77	-33.6	0	0	0	111.5
18	S	23	Very low	28.2	Very low	107 Å²	107	129 Å²	129	75%	0.748	75%	0.752	S	S	*	*			trans	-7.8	119.8	163.6	56.9	0	0	0	0	118.8
19	T	24.8	Very low	28.6	Very low	125 Å²	125	125.6 Å²	125.6	77%	0.767	73%	0.729	S	S	*	*				-173.2	144.4	126.3	16.5	0	0	0	0	112.2
20	N	24	Very low	29.1	Very low	141 Å²	141	121.3 Å²	121.3	75%	0.754	70%	0.702	S	S	*	*			trans	44.5	108	153.4	-56.7	-16.1	0	0	0	120.3
21	L	28	Very low	29.7	Very low	157 Å²	157	125.2 Å²	125.2	82%	0.822	70%	0.697	S	S	*	*			trans	-140.8	66.2	150.7	-150.3	79.9	0	0	0	112.5
22	S	24.5	Very low	30.3	Very low	101 Å²	101	124.6 Å²	124.6	71%	0.706	67%	0.674	S	S	*	*			trans	-65.9	155.6	149.5	50.1	0	0	0	0	109.9
23	S	28.8	Very low	30.8	Very low	120 Å²	120	117.3 Å²	117.3	84%	0.839	64%	0.644	S	S	*	*			trans	74.8	59.3	171.8	81	0	0	0	0	119.7
24	S	35.3	Very low	31.4	Very low	104 Å²	104	114.9 Å²	114.9	73%	0.727	63%	0.629	S	S	*	*			trans	-170.4	123.5	146.4	56.7	0	0	0	0	109.5
25	G	35	Very low	32.1	Very low	52 Å²	52	109 Å²	109	54%	0.536	61%	0.608	S	S	.	*			cis	156.2	127.9	4.8	0	0	0	0	0	107	T27	G25-T27 VanDerWaalsContact C-N 3.29Å; G25-T27 PolarHBondContact O-N 3.23Å
26	P	38	Very low	32.6	Very low	64 Å²	64	104.9 Å²	104.9	42%	0.416	58%	0.58	S	S	.	*	S	Bend	trans	-82	52.2	-155.8	33.6	-39	0	0	0	115	K30 I240	P26-K30 WeakPolarHBondContact O-CB 3.4Å; P26-I240 HydrophobicContact CG-CD1 4.08Å
27	T	40.4	Very low	33	Very low	103 Å²	103	94 Å²	94	63%	0.632	54%	0.542	S	S	*	.	S	Bend	trans	-95.1	-29.4	-171	52	0	0	0	0	115.4	G25 K30	G25-T27 VanDerWaalsContact C-N 3.29Å; G25-T27 PolarHBondContact O-N 3.23Å; T27-K30 WeakPolarHBondContact O-CB 3.46Å
28	L	36.7	Very low	33.4	Very low	125 Å²	125	91.5 Å²	91.5	65%	0.654	53%	0.525	S	S	*	.	H	α-helix	trans	-77	-47.4	174.4	-93.3	163.7	0	0	0	111.8	K30 K31 F32	L28-K30 PolarHBondContact O-N 2.98Å; L28-K30 VanDerWaalsContact O-N 3.15Å; L28-K31 PolarHBondContact O-N 3.32Å; L28-F32 PolarHBondContact O-N 3.16Å; L28-F32 VanDerWaalsContact O-N 3.11Å
29	L	35.8	Very low	33.9	Very low	55 Å²	55	88.1 Å²	88.1	29%	0.288	50%	0.5	S	S	.	.	H	α-helix	trans	-56	-30.6	172.1	-169.3	55.9	0	0	0	111.8	F32 L33 T239 M421	L29-F32 PolarHBondContact O-N 3.47Å; L29-L33 HydrophobicContact CD1-CD1 4.04Å; L29-L33 HydrophobicContact CD1-CG 4.32Å; L29-L33 HydrophobicContact CG-CD1 3.91Å; L29-L33 PolarHBondContact O-N 2.82Å; L29-L33 VanDerWaalsContact O-N 3.15Å; L29-T239 HydrophobicContact CD2-CG2 3.51Å; L29-T239 HydrophobicContact CG-CG2 4.23Å; L29-M421 HydrophobicContact CD1-CE 4.24Å
30	K	38.2	Very low	34.1	Very low	87 Å²	87	84.8 Å²	84.8	38%	0.378	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-39.8	173.2	-162.9	171.2	-173	176.4	0	113.5	P26 T27 L28 I240 P241	P26-K30 WeakPolarHBondContact O-CB 3.4Å; T27-K30 WeakPolarHBondContact O-CB 3.46Å; L28-K30 PolarHBondContact O-N 2.98Å; L28-K30 VanDerWaalsContact O-N 3.15Å; K30-I240 HydrophobicContact CD-CB 4.41Å; K30-P241 HydrophobicContact CB-CG 4.46Å; K30-P241 HydrophobicContact CG-CB 3.78Å; K30-P241 HydrophobicContact CG-CG 4.08Å; K30-P241 WeakPolarHBondContact O-CB 3.27Å
31	K	38.2	Very low	34.3	Very low	160 Å²	160	81.3 Å²	81.3	70%	0.696	47%	0.472	S	S	*	.	H	α-helix	trans	-75.7	-32	177	-67	-178.2	177.3	-177.6	0	112.2	L28 K35	L28-K31 PolarHBondContact O-N 3.32Å; K31-K35 PolarHBondContact O-N 3.22Å
32	F	38.2	Very low	34.4	Very low	57 Å²	57	77.2 Å²	77.2	25%	0.25	46%	0.456	C	S	.	.	H	α-helix	trans	-71.1	-48.9	-179.3	-87.4	-54.4	0	0	0	113.8	L28 L29 Q34 K35 A36 F475	L28-F32 PolarHBondContact O-N 3.16Å; L28-F32 VanDerWaalsContact O-N 3.11Å; L29-F32 PolarHBondContact O-N 3.47Å; F32-Q34 VanDerWaalsContact C-N 3.25Å; F32-Q34 PolarHBondContact O-N 3.06Å; F32-K35 PolarHBondContact O-N 3.24Å; F32-K35 VanDerWaalsContact O-N 3.13Å; F32-A36 PolarHBondContact O-N 2.96Å; F32-F475 HydrophobicContact CB-CE1 3.96Å; F32-F475 HydrophobicContact CB-CE2 4.15Å; F32-F475 HydrophobicContact CB-CZ 3.73Å; F32-F475 HydrophobicContact CD1-CB 3.97Å; F32-F475 AromaticContact CD1-CD1 3.33Å; F32-F475 HydrophobicContact CD1-CD1 3.33Å; F32-F475 AromaticContact CD1-CD2 3.51Å; F32-F475 HydrophobicContact CD1-CD2 3.51Å; F32-F475 AromaticContact CD1-CE1 3.58Å; F32-F475 HydrophobicContact CD1-CE1 3.58Å; F32-F475 AromaticContact CD1-CE2 3.74Å; F32-F475 HydrophobicContact CD1-CE2 3.74Å; F32-F475 AromaticContact CD1-CG 3.31Å; F32-F475 HydrophobicContact CD1-CG 3.31Å; F32-F475 AromaticContact CD1-CZ 3.79Å; F32-F475 HydrophobicContact CD1-CZ 3.79Å; F32-F475 HydrophobicContact CD2-CD2 4.46Å; F32-F475 HydrophobicContact CD2-CE2 4.33Å; F32-F475 HydrophobicContact CE1-CB 3.41Å; F32-F475 VanDerWaalsContact CE1-CB 3.41Å; F32-F475 AromaticContact CE1-CD1 3.75Å; F32-F475 HydrophobicContact CE1-CD1 3.75Å; F32-F475 AromaticContact CE1-CD2 3.49Å; F32-F475 HydrophobicContact CE1-CD2 3.49Å; F32-F475 VanDerWaalsContact CE1-CD2 3.49Å; F32-F475 HydrophobicContact CE1-CE1 4.39Å; F32-F475 HydrophobicContact CE1-CE2 4.16Å; F32-F475 AromaticContact CE1-CG 3.26Å; F32-F475 HydrophobicContact CE1-CG 3.26Å; F32-F475 HydrophobicContact CE2-CD2 4.41Å; F32-F475 HydrophobicContact CG-CD1 4.25Å; F32-F475 HydrophobicContact CG-CD2 4.03Å; F32-F475 HydrophobicContact CG-CE1 4.07Å; F32-F475 AromaticContact CG-CE2 3.84Å; F32-F475 HydrophobicContact CG-CE2 3.84Å; F32-F475 HydrophobicContact CG-CG 4.24Å; F32-F475 AromaticContact CG-CZ 3.88Å; F32-F475 HydrophobicContact CG-CZ 3.88Å; F32-F475 HydrophobicContact CZ-CB 4.2Å; F32-F475 AromaticContact CZ-CD2 3.94Å; F32-F475 HydrophobicContact CZ-CD2 3.94Å; F32-F475 HydrophobicContact CZ-CG 4.12Å
33	L	36.2	Very low	34.7	Very low	38 Å²	38	75.4 Å²	75.4	20%	0.199	44%	0.444	C	S	.	.	H	α-helix	trans	-66.2	-29.9	-178	-69.8	158.1	0	0	0	112.4	L29 A37 T239 P241 I242	L29-L33 HydrophobicContact CD1-CD1 4.04Å; L29-L33 HydrophobicContact CD1-CG 4.32Å; L29-L33 HydrophobicContact CG-CD1 3.91Å; L29-L33 PolarHBondContact O-N 2.82Å; L29-L33 VanDerWaalsContact O-N 3.15Å; L33-A37 WeakPolarHBondContact O-CB 3.33Å; L33-A37 PolarHBondContact O-N 3.3Å; L33-A37 VanDerWaalsContact O-N 3.08Å; L33-T239 VanDerWaalsContact CD1-OG1 3.31Å; L33-T239 WeakPolarHBondContact CD1-OG1 3.35Å; L33-P241 HydrophobicContact CB-CG 3.59Å; L33-P241 HydrophobicContact CD1-CG 3.84Å; L33-P241 HydrophobicContact CG-CG 4.35Å; L33-I242 HydrophobicContact CD1-CD1 4.01Å; L33-I242 HydrophobicContact CD1-CG1 3.99Å; L33-I242 HydrophobicContact CD2-CD1 4.25Å
34	Q	37.4	Very low	34.9	Very low	90 Å²	90	75.3 Å²	75.3	42%	0.421	43%	0.432	S	S	.	.	H	α-helix	trans	-63.3	-45.9	171.9	-172.7	-179.8	-28.1	0	0	111.3	F32 A36 A37 E38 E245	F32-Q34 VanDerWaalsContact C-N 3.25Å; F32-Q34 PolarHBondContact O-N 3.06Å; Q34-A36 VanDerWaalsContact C-N 3.34Å; Q34-A36 PolarHBondContact O-N 3.49Å; Q34-A37 PolarHBondContact O-N 3.28Å; Q34-E38 PolarHBondContact NE2-OE1 2.89Å; Q34-E38 VanDerWaalsContact NE2-OE1 3.1Å; Q34-E38 WeakPolarHBondContact O-CG 3.48Å; Q34-E38 PolarHBondContact O-N 3.03Å; Q34-E245 WeakPolarHBondContact CA-OE2 3.34Å
35	K	37.6	Very low	34.7	Very low	102 Å²	102	75.9 Å²	75.9	44%	0.443	43%	0.428	S	S	.	.	H	α-helix	trans	-69.3	-32	179.9	-155.8	169.4	176.9	-157.5	0	113.1	K31 F32 T39 D476	K31-K35 PolarHBondContact O-N 3.22Å; F32-K35 PolarHBondContact O-N 3.24Å; F32-K35 VanDerWaalsContact O-N 3.13Å; K35-T39 WeakPolarHBondContact O-CB 3.39Å; K35-T39 PolarHBondContact O-N 2.98Å; K35-T39 VanDerWaalsContact O-N 3.07Å; K35-T39 PolarHBondContact O-OG1 3.01Å; K35-D476 VanDerWaalsContact CD-OD1 3.27Å; K35-D476 WeakPolarHBondContact CD-OD1 3.42Å; K35-D476 WeakPolarHBondContact CD-OD2 3.41Å; K35-D476 WeakPolarHBondContact CE-OD2 3.26Å; K35-D476 WeakPolarHBondContact CG-OD1 3.18Å; K35-D476 IonicContact NZ-OD2 2.91Å; K35-D476 PolarHBondContact NZ-OD2 2.89Å
36	A	35	Very low	34.5	Very low	22 Å²	22	80.3 Å²	80.3	18%	0.182	43%	0.432	C	S	.	.	H	α-helix	trans	-65.7	-39.6	171.5	0	0	0	0	0	112.5	F32 Q34 T39 A40	F32-A36 PolarHBondContact O-N 2.96Å; Q34-A36 VanDerWaalsContact C-N 3.34Å; Q34-A36 PolarHBondContact O-N 3.49Å; A36-T39 PolarHBondContact O-N 3.5Å; A36-A40 PolarHBondContact O-N 3.38Å
37	A	33.2	Very low	34.2	Very low	13 Å²	13	82.1 Å²	82.1	11%	0.107	44%	0.438	C	S	.	.	H	α-helix	trans	-70.9	-39.8	176.6	0	0	0	0	0	113	L33 Q34 T39 A40 S41 E245	L33-A37 WeakPolarHBondContact O-CB 3.33Å; L33-A37 PolarHBondContact O-N 3.3Å; L33-A37 VanDerWaalsContact O-N 3.08Å; Q34-A37 PolarHBondContact O-N 3.28Å; A37-T39 PolarHBondContact O-N 3.48Å; A37-A40 PolarHBondContact O-N 2.96Å; A37-S41 PolarHBondContact O-N 3.45Å; A37-S41 PolarHBondContact O-OG 3.09Å; A37-E245 HydrophobicContact CB-CB 4.47Å; A37-E245 WeakPolarHBondContact CB-OE2 3.36Å
38	E	33.7	Very low	33.9	Very low	98 Å²	98	82.3 Å²	82.3	46%	0.458	44%	0.435	S	S	.	.	H	α-helix	trans	-55.4	-42.1	169.1	-72.2	168.2	-171	0	0	110.7	Q34 S42	Q34-E38 PolarHBondContact NE2-OE1 2.89Å; Q34-E38 VanDerWaalsContact NE2-OE1 3.1Å; Q34-E38 WeakPolarHBondContact O-CG 3.48Å; Q34-E38 PolarHBondContact O-N 3.03Å; E38-S42 PolarHBondContact O-N 3.17Å
39	T	32.7	Very low	33.7	Very low	36 Å²	36	79.2 Å²	79.2	22%	0.221	42%	0.424	C	S	.	.	H	α-helix	trans	-69.9	-42.6	177.9	-52.2	0	0	0	0	112.6	K35 A36 A37 S41 S42 S43	K35-T39 WeakPolarHBondContact O-CB 3.39Å; K35-T39 PolarHBondContact O-N 2.98Å; K35-T39 VanDerWaalsContact O-N 3.07Å; K35-T39 PolarHBondContact O-OG1 3.01Å; A36-T39 PolarHBondContact O-N 3.5Å; A37-T39 PolarHBondContact O-N 3.48Å; T39-S41 VanDerWaalsContact C-N 3.34Å; T39-S41 PolarHBondContact O-N 3.26Å; T39-S42 PolarHBondContact O-N 2.93Å; T39-S42 PolarHBondContact O-OG 3.38Å; T39-S43 PolarHBondContact O-N 3.48Å; T39-S43 PolarHBondContact O-OG 3.44Å; T39-S43 VanDerWaalsContact O-OG 3.11Å
40	A	29.4	Very low	33.5	Very low	56 Å²	56	81.3 Å²	81.3	46%	0.463	44%	0.435	S	S	.	.	H	α-helix	trans	-62.7	-39.1	175.9	0	0	0	0	0	112.3	A36 A37 S43 I44	A36-A40 PolarHBondContact O-N 3.38Å; A37-A40 PolarHBondContact O-N 2.96Å; A40-S43 WeakPolarHBondContact O-CB 3.39Å; A40-S43 PolarHBondContact O-N 3.45Å; A40-I44 PolarHBondContact O-N 2.93Å
41	S	28.1	Very low	33.2	Very low	68 Å²	68	86.3 Å²	86.3	48%	0.476	45%	0.451	S	S	.	.	H	α-helix	trans	-63.6	-42.4	176.2	-60.6	0	0	0	0	111.9	A37 T39 S43 I44	A37-S41 PolarHBondContact O-N 3.45Å; A37-S41 PolarHBondContact O-OG 3.09Å; T39-S41 VanDerWaalsContact C-N 3.34Å; T39-S41 PolarHBondContact O-N 3.26Å; S41-S43 PolarHBondContact O-N 2.77Å; S41-I44 PolarHBondContact O-N 3.3Å; S41-I44 VanDerWaalsContact O-N 3.11Å
42	S	30.2	Very low	32.9	Very low	70 Å²	70	87.7 Å²	87.7	49%	0.49	46%	0.457	S	S	.	.	H	α-helix	trans	-62.3	-24.9	175.4	78.1	0	0	0	0	113.9	E38 T39	E38-S42 PolarHBondContact O-N 3.17Å; T39-S42 PolarHBondContact O-N 2.93Å; T39-S42 PolarHBondContact O-OG 3.38Å
43	S	31.6	Very low	32.6	Very low	63 Å²	63	89 Å²	89	44%	0.441	48%	0.479	S	S	.	.	H	α-helix	trans	-77.9	-21.1	178.1	-57.9	0	0	0	0	113	T39 A40 S41 N47	T39-S43 PolarHBondContact O-N 3.48Å; T39-S43 PolarHBondContact O-OG 3.44Å; T39-S43 VanDerWaalsContact O-OG 3.11Å; A40-S43 WeakPolarHBondContact O-CB 3.39Å; A40-S43 PolarHBondContact O-N 3.45Å; S41-S43 PolarHBondContact O-N 2.77Å; S43-N47 PolarHBondContact O-ND2 3.16Å
44	I	33.1	Very low	32.4	Very low	118 Å²	118	93.4 Å²	93.4	61%	0.605	50%	0.498	S	S	*	.	H	α-helix	trans	-74	-42	176.7	-66.1	169.5	0	0	0	110.1	A40 S41 F46 N47	A40-I44 PolarHBondContact O-N 2.93Å; S41-I44 PolarHBondContact O-N 3.3Å; S41-I44 VanDerWaalsContact O-N 3.11Å; I44-F46 VanDerWaalsContact C-N 3.26Å; I44-F46 PolarHBondContact O-N 3.4Å; I44-N47 PolarHBondContact O-N 2.94Å
45	D	31.1	Very low	32	Very low	117 Å²	117	98.8 Å²	98.8	63%	0.626	52%	0.52	S	S	*	.	H	α-helix	trans	-64.1	-29.6	175.8	-80.3	-35.9	0	0	0	113	N47 L48	D45-N47 PolarHBondContact O-N 2.66Å; D45-L48 PolarHBondContact O-N 2.91Å
46	F	29.6	Very low	31.5	Very low	144 Å²	144	104.5 Å²	104.5	63%	0.632	54%	0.539	S	S	*	.	H	α-helix	trans	-63.7	-30.4	177	-150.8	-95.9	0	0	0	112.6	I44 L48 S49	I44-F46 VanDerWaalsContact C-N 3.26Å; I44-F46 PolarHBondContact O-N 3.4Å; F46-L48 VanDerWaalsContact C-N 3.31Å; F46-L48 PolarHBondContact O-N 3.12Å; F46-S49 WeakPolarHBondContact O-CB 3.46Å; F46-S49 PolarHBondContact O-N 3.36Å; F46-S49 VanDerWaalsContact O-N 3.11Å; F46-S49 PolarHBondContact O-OG 3.3Å
47	N	33	Very low	31.2	Very low	102 Å²	102	113.1 Å²	113.1	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-72	-20.4	178.8	-75.6	-67.7	0	0	0	113.7	S43 I44 D45 S49	S43-N47 PolarHBondContact O-ND2 3.16Å; I44-N47 PolarHBondContact O-N 2.94Å; D45-N47 PolarHBondContact O-N 2.66Å; N47-S49 VanDerWaalsContact C-N 3.28Å
48	L	33.3	Very low	30.9	Very low	108 Å²	108	119.8 Å²	119.8	57%	0.565	61%	0.607	S	S	*	*	H	α-helix	trans	-71.8	-22.1	169.8	-82.9	155	0	0	0	112.6	D45 F46	D45-L48 PolarHBondContact O-N 2.91Å; F46-L48 VanDerWaalsContact C-N 3.31Å; F46-L48 PolarHBondContact O-N 3.12Å
49	S	31.4	Very low	30.9	Very low	60 Å²	60	120.9 Å²	120.9	42%	0.42	61%	0.611	S	S	.	*	H	α-helix	trans	-76.6	-35.8	178	80.3	0	0	0	0	113	F46 N47 R51 K52	F46-S49 WeakPolarHBondContact O-CB 3.46Å; F46-S49 PolarHBondContact O-N 3.36Å; F46-S49 VanDerWaalsContact O-N 3.11Å; F46-S49 PolarHBondContact O-OG 3.3Å; N47-S49 VanDerWaalsContact C-N 3.28Å; S49-R51 VanDerWaalsContact C-N 3.35Å; S49-R51 PolarHBondContact O-N 3.39Å; S49-K52 PolarHBondContact O-N 3.32Å
50	L	31.9	Very low	30.9	Very low	98 Å²	98	126.5 Å²	126.5	51%	0.513	63%	0.634	S	S	.	*	H	α-helix	trans	-65.8	-32.7	-178	-81.2	162.7	0	0	0	113.3	K52 A53	L50-K52 PolarHBondContact O-N 3.45Å; L50-A53 PolarHBondContact O-N 2.94Å
51	R	32.2	Very low	31.1	Very low	192 Å²	192	126.4 Å²	126.4	73%	0.725	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-12.9	176.2	-69.5	-172.4	179.4	-174.2	1.3	114.6	S49	S49-R51 VanDerWaalsContact C-N 3.35Å; S49-R51 PolarHBondContact O-N 3.39Å
52	K	31.8	Very low	31.3	Very low	190 Å²	190	131 Å²	131	83%	0.826	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-10.5	175.1	-69.4	179.8	179.3	172.6	0	113.7	S49 L50	S49-K52 PolarHBondContact O-N 3.32Å; L50-K52 PolarHBondContact O-N 3.45Å
53	A	32.3	Very low	31.4	Very low	84 Å²	84	131 Å²	131	69%	0.694	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-17.2	-178.2	0	0	0	0	0	114.7	L50 K55	L50-A53 PolarHBondContact O-N 2.94Å; A53-K55 PolarHBondContact O-N 3.03Å
54	E	32.5	Very low	31.8	Very low	130 Å²	130	131 Å²	131	61%	0.607	64%	0.635	S	S	*	*			trans	-83.4	1.4	-161.7	-63.4	178	122	0	0	116.2	R56	E54-R56 PolarHBondContact O-N 3.23Å
55	K	27.8	Very low	31.8	Very low	204 Å²	204	126.4 Å²	126.4	89%	0.887	61%	0.613	S	S	*	*	S	Bend	trans	-73.2	20.7	-172	-79.4	-167.3	173.6	-175.1	0	116.6	A53	A53-K55 PolarHBondContact O-N 3.03Å
56	R	27	Very low	31.9	Very low	222 Å²	222	125.8 Å²	125.8	84%	0.838	61%	0.61	S	S	*	*	S	Bend	trans	-149.2	91.4	175.6	-66.4	-178.5	-176.6	158.5	0.8	110.6	E54	E54-R56 PolarHBondContact O-N 3.23Å
57	Y	29.4	Very low	32.4	Very low	202 Å²	202	120 Å²	120	79%	0.792	59%	0.585	S	S	*	*			trans	173.9	98.2	147.1	-86.6	-55	0	0	0	108.8	F59	Y57-F59 HydrophobicContact CD1-CD2 4.15Å; Y57-F59 AromaticContact CD1-CE2 3.47Å; Y57-F59 HydrophobicContact CD1-CE2 3.47Å; Y57-F59 VanDerWaalsContact CD1-CE2 3.47Å; Y57-F59 HydrophobicContact CD1-CZ 4.35Å; Y57-F59 HydrophobicContact CE1-CE2 4.1Å; Y57-F59 HydrophobicContact CG-CD2 4.44Å; Y57-F59 HydrophobicContact CG-CE2 4.1Å
58	V	26.8	Very low	32.9	Very low	153 Å²	153	115.6 Å²	115.6	93%	0.927	56%	0.561	S	S	*	*			trans	-98	111.2	170.6	-179.6	0	0	0	0	107.5
59	F	34.7	Very low	33.4	Very low	122 Å²	122	112.6 Å²	112.6	54%	0.535	55%	0.546	S	S	.	.			trans	-122.9	143.3	178.3	-86.5	-74.4	0	0	0	110.8	Y57 F64	Y57-F59 HydrophobicContact CD1-CD2 4.15Å; Y57-F59 AromaticContact CD1-CE2 3.47Å; Y57-F59 HydrophobicContact CD1-CE2 3.47Å; Y57-F59 VanDerWaalsContact CD1-CE2 3.47Å; Y57-F59 HydrophobicContact CD1-CZ 4.35Å; Y57-F59 HydrophobicContact CE1-CE2 4.1Å; Y57-F59 HydrophobicContact CG-CD2 4.44Å; Y57-F59 HydrophobicContact CG-CE2 4.1Å; F59-F64 HydrophobicContact CB-CE2 4.36Å
60	H	31.1	Very low	33.7	Very low	154 Å²	154	114.3 Å²	114.3	71%	0.713	55%	0.547	S	S	*	.			trans	-71.5	137.4	-174.3	-97.6	-90.3	0	0	0	113.1	E62	H60-E62 PolarHBondContact O-N 2.85Å
61	P	35.1	Very low	34.4	Very low	53 Å²	53	111.8 Å²	111.8	34%	0.344	53%	0.534	S	S	.	.	H	α-helix	trans	-65.6	-36	-172.1	-21.9	32.9	0	0	0	115.2	S63 F64	P61-S63 VanDerWaalsContact C-N 3.29Å; P61-S63 PolarHBondContact O-N 3.46Å; P61-F64 PolarHBondContact O-N 3.19Å
62	E	30.8	Very low	35.2	Very low	165 Å²	165	105.7 Å²	105.7	77%	0.771	51%	0.513	S	S	*	.	H	α-helix	trans	-71.2	-22.9	-172.4	-60.2	-174.2	163.3	0	0	113.7	H60	H60-E62 PolarHBondContact O-N 2.85Å
63	S	32.9	Very low	35.8	Very low	69 Å²	69	98.4 Å²	98.4	48%	0.483	49%	0.485	S	S	.	.	H	α-helix	trans	-71.5	-36.7	177.4	-157	0	0	0	0	111.1	P61 S65 N66 L67	P61-S63 VanDerWaalsContact C-N 3.29Å; P61-S63 PolarHBondContact O-N 3.46Å; S63-S65 PolarHBondContact O-N 3.41Å; S63-N66 PolarHBondContact O-N 3.09Å; S63-L67 VanDerWaalsContact O-CG 3.23Å; S63-L67 WeakPolarHBondContact O-CG 3.45Å; S63-L67 PolarHBondContact O-N 3.26Å
64	F	40	Very low	36.6	Very low	65 Å²	65	96.3 Å²	96.3	29%	0.285	46%	0.464	S	S	.	.	H	α-helix	trans	-67.3	-36.6	-172.9	-104.2	-88.8	0	0	0	114.1	F59 P61 N66 L67 I68 L318	F59-F64 HydrophobicContact CB-CE2 4.36Å; P61-F64 PolarHBondContact O-N 3.19Å; F64-N66 VanDerWaalsContact C-N 3.34Å; F64-N66 PolarHBondContact O-N 3.26Å; F64-L67 PolarHBondContact O-N 3.11Å; F64-L67 VanDerWaalsContact O-N 3.13Å; F64-I68 HydrophobicContact CB-CD1 4.37Å; F64-I68 HydrophobicContact CD1-CD1 3.8Å; F64-I68 HydrophobicContact CD1-CG1 4.22Å; F64-I68 WeakPolarHBondContact O-CB 3.25Å; F64-I68 WeakPolarHBondContact O-CD1 3.37Å; F64-I68 WeakPolarHBondContact O-CG1 3.01Å; F64-I68 PolarHBondContact O-N 2.93Å; F64-L318 HydrophobicContact CB-CD2 4.45Å; F64-L318 HydrophobicContact CD1-CD2 4.16Å
65	S	33.3	Very low	37.4	Very low	20 Å²	20	91.6 Å²	91.6	14%	0.14	44%	0.442	C	S	.	.	H	α-helix	trans	-58.9	-46.1	176.5	-56.6	0	0	0	0	111.6	S63 L67 I69	S63-S65 PolarHBondContact O-N 3.41Å; S65-L67 VanDerWaalsContact C-N 3.34Å; S65-L67 PolarHBondContact O-N 2.71Å; S65-I69 VanDerWaalsContact O-CD1 3.28Å; S65-I69 WeakPolarHBondContact O-CD1 3.49Å; S65-I69 VanDerWaalsContact O-CG1 3.23Å; S65-I69 WeakPolarHBondContact O-CG1 3.48Å; S65-I69 PolarHBondContact O-N 3.44Å
66	N	33.8	Very low	38.6	Very low	105 Å²	105	85.4 Å²	85.4	56%	0.561	42%	0.416	S	S	*	.	H	α-helix	trans	-70.7	-25.5	176.2	-74.7	-53	0	0	0	113.7	S63 F64 Q70	S63-N66 PolarHBondContact O-N 3.09Å; F64-N66 VanDerWaalsContact C-N 3.34Å; F64-N66 PolarHBondContact O-N 3.26Å; N66-Q70 VanDerWaalsContact O-CG 3.31Å; N66-Q70 WeakPolarHBondContact O-CG 3.49Å
67	L	38.5	Very low	40.1	Very low	21 Å²	21	83.7 Å²	83.7	11%	0.11	41%	0.41	C	S	.	.	H	α-helix	trans	-74.6	-44.3	175.6	-69.8	168	0	0	0	111.6	S63 F64 S65 Q70 K72	S63-L67 VanDerWaalsContact O-CG 3.23Å; S63-L67 WeakPolarHBondContact O-CG 3.45Å; S63-L67 PolarHBondContact O-N 3.26Å; F64-L67 PolarHBondContact O-N 3.11Å; F64-L67 VanDerWaalsContact O-N 3.13Å; S65-L67 VanDerWaalsContact C-N 3.34Å; S65-L67 PolarHBondContact O-N 2.71Å; L67-Q70 PolarHBondContact O-N 3.3Å; L67-K72 HydrophobicContact CB-CB 4.24Å; L67-K72 HydrophobicContact CD2-CB 4Å; L67-K72 HydrophobicContact CD2-CD 3.51Å; L67-K72 HydrophobicContact CD2-CG 4.41Å; L67-K72 WeakPolarHBondContact O-CB 3.43Å; L67-K72 PolarHBondContact O-N 3.32Å; L67-K72 VanDerWaalsContact O-N 3.13Å
68	I	44.1	Very low	41.7	Very low	10 Å²	10	75.1 Å²	75.1	5%	0.051	38%	0.378	C	S	.	.	H	α-helix	trans	-70.4	-39.1	-175.3	-71.1	158.7	0	0	0	112	F64 Q70 L318 I358	F64-I68 HydrophobicContact CB-CD1 4.37Å; F64-I68 HydrophobicContact CD1-CD1 3.8Å; F64-I68 HydrophobicContact CD1-CG1 4.22Å; F64-I68 WeakPolarHBondContact O-CB 3.25Å; F64-I68 WeakPolarHBondContact O-CD1 3.37Å; F64-I68 WeakPolarHBondContact O-CG1 3.01Å; F64-I68 PolarHBondContact O-N 2.93Å; I68-Q70 PolarHBondContact O-N 2.64Å; I68-L318 HydrophobicContact CD1-CD1 3.36Å; I68-L318 HydrophobicContact CD1-CD2 3.26Å; I68-L318 HydrophobicContact CD1-CG 3.9Å; I68-I358 HydrophobicContact CG2-CB 4.49Å; I68-I358 HydrophobicContact CG2-CG1 4.5Å; I68-I358 HydrophobicContact CG2-CG2 3.64Å
69	I	43.7	Very low	43.6	Very low	46 Å²	46	71.5 Å²	71.5	24%	0.236	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-3.1	177.7	-63.5	166.3	0	0	0	112.4	S65 S155 D361	S65-I69 VanDerWaalsContact O-CD1 3.28Å; S65-I69 WeakPolarHBondContact O-CD1 3.49Å; S65-I69 VanDerWaalsContact O-CG1 3.23Å; S65-I69 WeakPolarHBondContact O-CG1 3.48Å; S65-I69 PolarHBondContact O-N 3.44Å; I69-S155 WeakPolarHBondContact O-CB 3.25Å; I69-D361 HydrophobicContact CD1-CB 3.85Å
70	Q	37.8	Very low	45.1	Very low	95 Å²	95	67.7 Å²	67.7	44%	0.444	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	23.5	-173.2	-65.3	-175.3	-2.3	0	0	114.2	N66 L67 I68 K72	N66-Q70 VanDerWaalsContact O-CG 3.31Å; N66-Q70 WeakPolarHBondContact O-CG 3.49Å; L67-Q70 PolarHBondContact O-N 3.3Å; I68-Q70 PolarHBondContact O-N 2.64Å; Q70-K72 HydrophobicContact CB-CD 4Å; Q70-K72 HydrophobicContact CB-CG 3.88Å; Q70-K72 WeakPolarHBondContact O-CG 3.44Å; Q70-K72 PolarHBondContact O-N 3.46Å; Q70-K72 VanDerWaalsContact O-N 3.08Å
71	D	46.6	Very low	46.9	Very low	45 Å²	45	64.2 Å²	64.2	24%	0.241	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	26.1	-171.7	-68.4	-62.9	0	0	0	113	S155 R158	D71-S155 PolarHBondContact N-OG 2.89Å; D71-S155 PolarHBondContact OD1-OG 3.43Å; D71-S155 WeakPolarHBondContact OD2-CB 3.4Å; D71-S155 PolarHBondContact OD2-N 3.06Å; D71-S155 PolarHBondContact OD2-OG 3.31Å; D71-R158 IonicContact OD1-CZ 2.68Å; D71-R158 IonicContact OD1-NH1 2.88Å; D71-R158 IonicContact OD1-NH2 2.64Å; D71-R158 PolarHBondContact OD1-NH2 3.1Å; D71-R158 IonicContact OD2-NH2 3.77Å; D71-R158 PolarHBondContact OD2-NH2 2.91Å
72	K	49.4	Very low	48.8	Very low	65 Å²	65	62.7 Å²	62.7	28%	0.283	31%	0.312	S	S	.	.	H	α-helix	trans	-81	-1.8	-178	-57.5	176.8	170	166.5	0	117.2	L67 Q70 L75 H76	L67-K72 HydrophobicContact CB-CB 4.24Å; L67-K72 HydrophobicContact CD2-CB 4Å; L67-K72 HydrophobicContact CD2-CD 3.51Å; L67-K72 HydrophobicContact CD2-CG 4.41Å; L67-K72 WeakPolarHBondContact O-CB 3.43Å; L67-K72 PolarHBondContact O-N 3.32Å; L67-K72 VanDerWaalsContact O-N 3.13Å; Q70-K72 HydrophobicContact CB-CD 4Å; Q70-K72 HydrophobicContact CB-CG 3.88Å; Q70-K72 WeakPolarHBondContact O-CG 3.44Å; Q70-K72 PolarHBondContact O-N 3.46Å; Q70-K72 VanDerWaalsContact O-N 3.08Å; K72-L75 HydrophobicContact CG-CD2 4.4Å; K72-L75 PolarHBondContact O-N 3.43Å; K72-H76 HydrophobicContact CB-CB 4.31Å; K72-H76 WeakPolarHBondContact O-CA 3.31Å; K72-H76 WeakPolarHBondContact O-CB 3.45Å; K72-H76 PolarHBondContact O-N 3.21Å
73	P	45.2	Very low	50.9	Low	37 Å²	37	60.1 Å²	60.1	24%	0.24	30%	0.3	C	S	.	.	H	α-helix	trans	-58.4	-55.6	178.2	-22.5	32.8	0	0	0	113.1	R77 E438	P73-R77 WeakPolarHBondContact O-CB 3.46Å; P73-R77 PolarHBondContact O-N 3.3Å; P73-E438 WeakPolarHBondContact CB-OE1 3.33Å
74	T	47.5	Very low	53	Low	40 Å²	40	61.3 Å²	61.3	25%	0.245	30%	0.304	C	S	.	.	H	α-helix	trans	-72.7	-35.5	172.2	39.1	0	0	0	0	113.4	R77 N78 E438	T74-R77 PolarHBondContact O-N 2.88Å; T74-N78 WeakPolarHBondContact O-CB 3.07Å; T74-N78 PolarHBondContact O-N 2.95Å; T74-N78 PolarHBondContact O-ND2 3.31Å; T74-N78 PolarHBondContact O-OD1 3.42Å; T74-E438 VanDerWaalsContact CB-OE1 3.26Å; T74-E438 WeakPolarHBondContact CB-OE1 3.43Å; T74-E438 WeakPolarHBondContact CG2-OE1 3.44Å; T74-E438 WeakPolarHBondContact CG2-OE2 3.49Å; T74-E438 PolarHBondContact N-OE1 3.19Å; T74-E438 VanDerWaalsContact OG1-CD 3.26Å; T74-E438 PolarHBondContact OG1-OE1 3.42Å; T74-E438 PolarHBondContact OG1-OE2 2.85Å
75	L	50	Low	54.8	Low	30 Å²	30	60.4 Å²	60.4	16%	0.157	30%	0.3	C	S	.	.	H	α-helix	trans	-66.4	-40.7	-179.7	-164.6	66.6	0	0	0	111.8	K72 N78 K79 I114 E118	K72-L75 HydrophobicContact CG-CD2 4.4Å; K72-L75 PolarHBondContact O-N 3.43Å; L75-N78 PolarHBondContact O-N 3.29Å; L75-K79 WeakPolarHBondContact O-CB 3.19Å; L75-K79 VanDerWaalsContact O-CG 3.25Å; L75-K79 WeakPolarHBondContact O-CG 3.49Å; L75-K79 PolarHBondContact O-N 3.45Å; L75-I114 HydrophobicContact CD1-CG2 3.94Å; L75-E118 HydrophobicContact CD1-CG 3.85Å; L75-E118 HydrophobicContact CD2-CG 4Å; L75-E118 WeakPolarHBondContact CD2-OE1 3.37Å; L75-E118 HydrophobicContact CG-CG 4.49Å
76	H	54.1	Low	57	Low	75 Å²	75	62.8 Å²	62.8	35%	0.347	31%	0.31	S	S	.	.	H	α-helix	trans	-71.3	-38.4	172.5	-169.6	-79	0	0	0	111.5	K72 N78 K79 S80	K72-H76 HydrophobicContact CB-CB 4.31Å; K72-H76 WeakPolarHBondContact O-CA 3.31Å; K72-H76 WeakPolarHBondContact O-CB 3.45Å; K72-H76 PolarHBondContact O-N 3.21Å; H76-N78 VanDerWaalsContact C-N 3.33Å; H76-N78 PolarHBondContact O-N 2.9Å; H76-K79 PolarHBondContact O-N 3Å; H76-S80 WeakPolarHBondContact O-CB 3.4Å; H76-S80 PolarHBondContact O-N 3.19Å; H76-S80 PolarHBondContact O-OG 2.66Å; H76-S80 VanDerWaalsContact O-OG 3.05Å
77	R	57.6	Low	59.2	Low	186 Å²	186	62.4 Å²	62.4	70%	0.702	30%	0.304	S	S	*	.	H	α-helix	trans	-60.6	-44.4	171.3	-173.8	178.8	-178.6	-174.1	1.6	111.2	P73 T74 S80 M81	P73-R77 WeakPolarHBondContact O-CB 3.46Å; P73-R77 PolarHBondContact O-N 3.3Å; T74-R77 PolarHBondContact O-N 2.88Å; R77-S80 PolarHBondContact O-OG 2.99Å; R77-M81 WeakPolarHBondContact O-CB 3.34Å; R77-M81 PolarHBondContact O-N 3.4Å
78	N	63.5	Low	61.1	Low	22 Å²	22	62.3 Å²	62.3	12%	0.118	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-45.5	176.3	-70.7	-12.4	0	0	0	110.8	T74 L75 H76 M81 L82 I114 R609	T74-N78 WeakPolarHBondContact O-CB 3.07Å; T74-N78 PolarHBondContact O-N 2.95Å; T74-N78 PolarHBondContact O-ND2 3.31Å; T74-N78 PolarHBondContact O-OD1 3.42Å; L75-N78 PolarHBondContact O-N 3.29Å; H76-N78 VanDerWaalsContact C-N 3.33Å; H76-N78 PolarHBondContact O-N 2.9Å; N78-M81 CarbonylContact O-C 3.52Å; N78-M81 WeakPolarHBondContact O-CB 3.23Å; N78-M81 PolarHBondContact O-N 3.43Å; N78-L82 WeakPolarHBondContact O-CB 3.32Å; N78-L82 PolarHBondContact O-N 3.37Å; N78-I114 HydrophobicContact CB-CD1 3.74Å; N78-I114 HydrophobicContact CB-CG1 3.94Å; N78-R609 PolarHBondContact ND2-NH2 3.26Å; N78-R609 VanDerWaalsContact ND2-NH2 3.15Å
79	K	65.5	Low	62.7	Low	77 Å²	77	62.6 Å²	62.6	34%	0.335	31%	0.308	S	S	.	.	H	α-helix	trans	-62.4	-45.3	175.7	-76.5	177.1	-179.6	-170.1	0	112.8	L75 H76 M81 L82 E83 E118	L75-K79 WeakPolarHBondContact O-CB 3.19Å; L75-K79 VanDerWaalsContact O-CG 3.25Å; L75-K79 WeakPolarHBondContact O-CG 3.49Å; L75-K79 PolarHBondContact O-N 3.45Å; H76-K79 PolarHBondContact O-N 3Å; K79-M81 VanDerWaalsContact C-N 3.32Å; K79-M81 PolarHBondContact O-N 2.98Å; K79-L82 CarbonylContact O-C 3.57Å; K79-L82 WeakPolarHBondContact O-CA 3.43Å; K79-L82 WeakPolarHBondContact O-CB 3.45Å; K79-L82 PolarHBondContact O-N 3.17Å; K79-E83 WeakPolarHBondContact O-CG 3.21Å; K79-E83 PolarHBondContact O-N 2.96Å; K79-E118 WeakPolarHBondContact CE-OE1 3.42Å; K79-E118 IonicContact NZ-OE1 3.96Å; K79-E118 PolarHBondContact NZ-OE1 3.18Å; K79-E118 IonicContact NZ-OE2 3.82Å
80	S	67.6	Low	64.4	Low	41 Å²	41	64.3 Å²	64.3	29%	0.287	32%	0.315	S	S	.	.	H	α-helix	trans	-64.5	-35	174.5	67.7	0	0	0	0	112.4	H76 R77 L82 E83 V84	H76-S80 WeakPolarHBondContact O-CB 3.4Å; H76-S80 PolarHBondContact O-N 3.19Å; H76-S80 PolarHBondContact O-OG 2.66Å; H76-S80 VanDerWaalsContact O-OG 3.05Å; R77-S80 PolarHBondContact O-OG 2.99Å; S80-L82 VanDerWaalsContact C-N 3.32Å; S80-E83 PolarHBondContact O-N 2.84Å; S80-V84 VanDerWaalsContact O-CG2 3.3Å; S80-V84 WeakPolarHBondContact O-CG2 3.47Å; S80-V84 PolarHBondContact O-N 3.18Å
81	M	68.8	Low	66.2	Low	82 Å²	82	67.8 Å²	67.8	40%	0.404	32%	0.324	S	S	.	.	H	α-helix	trans	-66.5	-35.8	170.1	-174.7	178.7	63.7	0	0	111.6	R77 N78 K79 V84 K85 D110	R77-M81 WeakPolarHBondContact O-CB 3.34Å; R77-M81 PolarHBondContact O-N 3.4Å; N78-M81 CarbonylContact O-C 3.52Å; N78-M81 WeakPolarHBondContact O-CB 3.23Å; N78-M81 PolarHBondContact O-N 3.43Å; K79-M81 VanDerWaalsContact C-N 3.32Å; K79-M81 PolarHBondContact O-N 2.98Å; M81-V84 PolarHBondContact O-N 3.41Å; M81-K85 WeakPolarHBondContact O-CG 3.3Å; M81-K85 PolarHBondContact O-N 3Å; M81-D110 WeakPolarHBondContact CE-OD2 3.44Å
82	L	73.9	Confident	67.4	Low	21 Å²	21	65.9 Å²	65.9	11%	0.11	31%	0.314	C	S	.	.	H	α-helix	trans	-66.7	-42.7	175.4	-152.4	80.2	0	0	0	111.3	N78 K79 S80 K85 M86 Y107 D110 T111 I114	N78-L82 WeakPolarHBondContact O-CB 3.32Å; N78-L82 PolarHBondContact O-N 3.37Å; K79-L82 CarbonylContact O-C 3.57Å; K79-L82 WeakPolarHBondContact O-CA 3.43Å; K79-L82 WeakPolarHBondContact O-CB 3.45Å; K79-L82 PolarHBondContact O-N 3.17Å; S80-L82 VanDerWaalsContact C-N 3.32Å; L82-K85 CarbonylContact O-C 3.59Å; L82-K85 WeakPolarHBondContact O-CB 3.45Å; L82-K85 PolarHBondContact O-N 3.04Å; L82-M86 WeakPolarHBondContact O-CB 3.42Å; L82-M86 PolarHBondContact O-N 3.09Å; L82-Y107 HydrophobicContact CD1-CD2 4.2Å; L82-Y107 HydrophobicContact CD1-CE2 4.25Å; L82-Y107 HydrophobicContact CD2-CE2 4.22Å; L82-Y107 HydrophobicContact CG-CD2 4.1Å; L82-Y107 HydrophobicContact CG-CE2 3.68Å; L82-D110 HydrophobicContact CD1-CB 3.52Å; L82-T111 HydrophobicContact CD2-CG2 4.49Å; L82-I114 HydrophobicContact CB-CD1 4.32Å; L82-I114 HydrophobicContact CD1-CD1 4Å; L82-I114 HydrophobicContact CD2-CD1 4.15Å; L82-I114 HydrophobicContact CG-CD1 4.38Å
83	E	74.9	Confident	68.4	Low	111 Å²	111	68 Å²	68	52%	0.519	32%	0.323	S	S	.	.	H	α-helix	trans	-60.5	-44.1	171.8	-71.5	165.1	-175.2	0	0	111.4	K79 S80 K85 M86 H87	K79-E83 WeakPolarHBondContact O-CG 3.21Å; K79-E83 PolarHBondContact O-N 2.96Å; S80-E83 PolarHBondContact O-N 2.84Å; E83-K85 VanDerWaalsContact C-N 3.31Å; E83-K85 PolarHBondContact O-N 3.27Å; E83-M86 WeakPolarHBondContact O-CB 3.19Å; E83-M86 PolarHBondContact O-N 2.87Å; E83-H87 PolarHBondContact O-CD2 2.94Å; E83-H87 PolarHBondContact O-N 2.98Å
84	V	76.4	Confident	69.4	Low	94 Å²	94	75 Å²	75	57%	0.57	35%	0.352	S	S	*	.	H	α-helix	trans	-61.8	-38.9	173.6	169.6	0	0	0	0	111.4	S80 M81 A88	S80-V84 VanDerWaalsContact O-CG2 3.3Å; S80-V84 WeakPolarHBondContact O-CG2 3.47Å; S80-V84 PolarHBondContact O-N 3.18Å; M81-V84 PolarHBondContact O-N 3.41Å; V84-A88 WeakPolarHBondContact O-CB 3.43Å; V84-A88 PolarHBondContact O-N 3.3Å
85	K	78.9	Confident	70.1	Confident	45 Å²	45	78.4 Å²	78.4	20%	0.196	36%	0.364	C	S	.	.	H	α-helix	trans	-68.3	-37.8	173.5	-74.7	-179.4	-178.5	-169.5	0	112.1	M81 L82 E83 A88 L89 S106 Y107 D110	M81-K85 WeakPolarHBondContact O-CG 3.3Å; M81-K85 PolarHBondContact O-N 3Å; L82-K85 CarbonylContact O-C 3.59Å; L82-K85 WeakPolarHBondContact O-CB 3.45Å; L82-K85 PolarHBondContact O-N 3.04Å; E83-K85 VanDerWaalsContact C-N 3.31Å; E83-K85 PolarHBondContact O-N 3.27Å; K85-A88 WeakPolarHBondContact O-CB 3.28Å; K85-A88 PolarHBondContact O-N 3.29Å; K85-L89 WeakPolarHBondContact O-CG 3.38Å; K85-L89 PolarHBondContact O-N 2.91Å; K85-S106 PolarHBondContact NZ-OG 3.14Å; K85-Y107 HydrophobicContact CB-CD2 3.99Å; K85-D110 IonicContact NZ-OD1 2.72Å; K85-D110 PolarHBondContact NZ-OD1 3.5Å; K85-D110 IonicContact NZ-OD2 2.7Å; K85-D110 PolarHBondContact NZ-OD2 2.87Å
86	M	78.3	Confident	70.8	Confident	70 Å²	70	80.9 Å²	80.9	35%	0.345	38%	0.384	S	S	.	.	H	α-helix	trans	-61.8	-52.3	173.7	-172.8	-170.8	73.1	0	0	110.6	L82 E83 A88 L89 E90 Y107	L82-M86 WeakPolarHBondContact O-CB 3.42Å; L82-M86 PolarHBondContact O-N 3.09Å; E83-M86 WeakPolarHBondContact O-CB 3.19Å; E83-M86 PolarHBondContact O-N 2.87Å; M86-A88 PolarHBondContact O-N 3.09Å; M86-L89 CarbonylContact O-C 3.48Å; M86-L89 WeakPolarHBondContact O-CA 3.35Å; M86-L89 WeakPolarHBondContact O-CB 3.45Å; M86-L89 PolarHBondContact O-N 3.25Å; M86-E90 WeakPolarHBondContact O-CG 3.48Å; M86-E90 PolarHBondContact O-N 3.22Å; M86-Y107 HydrophobicContact CB-CE2 3.89Å
87	H	79.9	Confident	71.6	Confident	97 Å²	97	80.9 Å²	80.9	45%	0.449	39%	0.392	S	S	.	.	H	α-helix	trans	-63.7	-25.7	175	-72.1	-44.9	0	0	0	113.3	E83 E90 R91	E83-H87 PolarHBondContact O-CD2 2.94Å; E83-H87 PolarHBondContact O-N 2.98Å; H87-E90 IonicContact CE1-OE2 3.53Å; H87-E90 IonicContact CG-OE2 3.2Å; H87-E90 IonicContact ND1-OE2 3.73Å; H87-E90 PolarHBondContact ND1-OE2 3.07Å; H87-R91 WeakPolarHBondContact O-CB 3.45Å; H87-R91 VanDerWaalsContact O-CG 3.29Å; H87-R91 WeakPolarHBondContact O-CG 3.43Å; H87-R91 PolarHBondContact O-N 3.43Å; H87-R91 VanDerWaalsContact O-N 3.11Å; H87-R91 PolarHBondContact O-NE 3Å
88	A	79.4	Confident	72.5	Confident	19 Å²	19	75.6 Å²	75.6	16%	0.157	38%	0.383	C	S	.	.	H	α-helix	trans	-70.4	-40.9	169.3	0	0	0	0	0	112	V84 K85 M86 E90 R91 D92	V84-A88 WeakPolarHBondContact O-CB 3.43Å; V84-A88 PolarHBondContact O-N 3.3Å; K85-A88 WeakPolarHBondContact O-CB 3.28Å; K85-A88 PolarHBondContact O-N 3.29Å; M86-A88 PolarHBondContact O-N 3.09Å; A88-E90 VanDerWaalsContact C-N 3.34Å; A88-R91 PolarHBondContact O-N 3.36Å; A88-D92 WeakPolarHBondContact O-CB 3.44Å; A88-D92 PolarHBondContact O-N 3.28Å
89	L	78.1	Confident	73.1	Confident	16 Å²	16	81 Å²	81	8%	0.084	40%	0.402	C	S	.	.	H	α-helix	trans	-63.9	-36.7	173.4	-75.7	169.3	0	0	0	112.7	K85 M86 K93 R100 L103 Q104 Y107	K85-L89 WeakPolarHBondContact O-CG 3.38Å; K85-L89 PolarHBondContact O-N 2.91Å; M86-L89 CarbonylContact O-C 3.48Å; M86-L89 WeakPolarHBondContact O-CA 3.35Å; M86-L89 WeakPolarHBondContact O-CB 3.45Å; M86-L89 PolarHBondContact O-N 3.25Å; L89-K93 PolarHBondContact O-N 3.12Å; L89-R100 HydrophobicContact CD2-CG 4.45Å; L89-L103 HydrophobicContact CD2-CB 3.66Å; L89-L103 HydrophobicContact CG-CB 4.37Å; L89-Q104 HydrophobicContact CD2-CB 4.15Å; L89-Y107 HydrophobicContact CD1-CD1 4.12Å; L89-Y107 HydrophobicContact CD1-CD2 4.04Å; L89-Y107 HydrophobicContact CD1-CG 3.65Å
90	E	79.8	Confident	73.6	Confident	82 Å²	82	82 Å²	82	38%	0.383	40%	0.404	S	S	.	.	H	α-helix	trans	-67.5	-46.4	175	-68.4	-178	130.9	0	0	112.4	M86 H87 A88 D92 K93	M86-E90 WeakPolarHBondContact O-CG 3.48Å; M86-E90 PolarHBondContact O-N 3.22Å; H87-E90 IonicContact CE1-OE2 3.53Å; H87-E90 IonicContact CG-OE2 3.2Å; H87-E90 IonicContact ND1-OE2 3.73Å; H87-E90 PolarHBondContact ND1-OE2 3.07Å; A88-E90 VanDerWaalsContact C-N 3.34Å; E90-D92 VanDerWaalsContact C-N 3.33Å; E90-D92 PolarHBondContact O-N 3.32Å; E90-K93 VanDerWaalsContact O-CB 3.24Å; E90-K93 WeakPolarHBondContact O-CB 3.33Å; E90-K93 WeakPolarHBondContact O-CD 3.44Å; E90-K93 WeakPolarHBondContact O-CG 3.44Å; E90-K93 PolarHBondContact O-N 2.58Å
91	R	74.8	Confident	74.2	Confident	168 Å²	168	88.9 Å²	88.9	63%	0.634	42%	0.424	S	S	*	.	H	α-helix	trans	-67.1	-32.6	177	-73.4	175.9	-67.1	151	-3.8	113	H87 A88 K93	H87-R91 WeakPolarHBondContact O-CB 3.45Å; H87-R91 VanDerWaalsContact O-CG 3.29Å; H87-R91 WeakPolarHBondContact O-CG 3.43Å; H87-R91 PolarHBondContact O-N 3.43Å; H87-R91 VanDerWaalsContact O-N 3.11Å; H87-R91 PolarHBondContact O-NE 3Å; A88-R91 PolarHBondContact O-N 3.36Å; R91-K93 PolarHBondContact O-N 2.94Å
92	D	71.9	Confident	74.9	Confident	5 Å²	5	94.9 Å²	94.9	3%	0.027	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-86.3	13.3	176.8	-73.2	0.8	0	0	0	112.7	A88 E90 H94 K95 R99 L103	A88-D92 WeakPolarHBondContact O-CB 3.44Å; A88-D92 PolarHBondContact O-N 3.28Å; E90-D92 VanDerWaalsContact C-N 3.33Å; E90-D92 PolarHBondContact O-N 3.32Å; D92-H94 PolarHBondContact O-N 3.16Å; D92-H94 VanDerWaalsContact O-N 3.09Å; D92-K95 HydrophobicContact CB-CB 4.33Å; D92-K95 PolarHBondContact O-N 3.14Å; D92-K95 VanDerWaalsContact O-N 3.08Å; D92-K95 VanDerWaalsContact OD1-CD 3.3Å; D92-K95 WeakPolarHBondContact OD1-CD 3.34Å; D92-K95 WeakPolarHBondContact OD1-CE 3.45Å; D92-K95 IonicContact OD1-NZ 2.63Å; D92-K95 PolarHBondContact OD1-NZ 2.79Å; D92-R99 IonicContact OD1-NH2 3.86Å; D92-R99 IonicContact OD2-CZ 2.91Å; D92-R99 VanDerWaalsContact OD2-CZ 3.25Å; D92-R99 IonicContact OD2-NE 3.34Å; D92-R99 PolarHBondContact OD2-NE 3.38Å; D92-R99 IonicContact OD2-NH2 3.59Å; D92-R99 PolarHBondContact OD2-NH2 3.34Å; D92-L103 WeakPolarHBondContact OD2-CD1 3.36Å
93	K	69.4	Low	75.2	Confident	109 Å²	109	96 Å²	96	47%	0.474	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-49.9	-35.4	174.5	-86.8	171.3	-176.8	168.5	0	113.1	L89 E90 R91 R100	L89-K93 PolarHBondContact O-N 3.12Å; E90-K93 VanDerWaalsContact O-CB 3.24Å; E90-K93 WeakPolarHBondContact O-CB 3.33Å; E90-K93 WeakPolarHBondContact O-CD 3.44Å; E90-K93 WeakPolarHBondContact O-CG 3.44Å; E90-K93 PolarHBondContact O-N 2.58Å; R91-K93 PolarHBondContact O-N 2.94Å; K93-R100 PolarHBondContact O-NH1 3.44Å
94	H	66.7	Low	75.6	Confident	185 Å²	185	94.6 Å²	94.6	86%	0.856	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-103.4	8.3	-177.7	-60.4	-83.6	0	0	0	115	D92	D92-H94 PolarHBondContact O-N 3.16Å; D92-H94 VanDerWaalsContact O-N 3.09Å
95	K	63.4	Low	76	Confident	111 Å²	111	97.3 Å²	97.3	48%	0.483	45%	0.445	S	S	.	.	S	Bend	trans	-100.9	166.6	-178.8	-63.6	-171.2	-163.1	146.2	0	112.7	D92 S97	D92-K95 HydrophobicContact CB-CB 4.33Å; D92-K95 PolarHBondContact O-N 3.14Å; D92-K95 VanDerWaalsContact O-N 3.08Å; D92-K95 VanDerWaalsContact OD1-CD 3.3Å; D92-K95 WeakPolarHBondContact OD1-CD 3.34Å; D92-K95 WeakPolarHBondContact OD1-CE 3.45Å; D92-K95 IonicContact OD1-NZ 2.63Å; D92-K95 PolarHBondContact OD1-NZ 2.79Å; K95-S97 PolarHBondContact O-N 3.21Å
96	S	63.1	Low	76.1	Confident	83 Å²	83	97.3 Å²	97.3	58%	0.58	45%	0.451	S	S	*	.			trans	-51.2	134.8	-171	58.3	0	0	0	0	114.1	S98 R99 R100	S96-S98 VanDerWaalsContact C-N 3.26Å; S96-S98 PolarHBondContact O-N 3.09Å; S96-S98 VanDerWaalsContact O-N 3.11Å; S96-R99 PolarHBondContact O-N 2.97Å; S96-R100 PolarHBondContact O-N 3.29Å
97	S	72.2	Confident	76.3	Confident	75 Å²	75	96.6 Å²	96.6	52%	0.524	45%	0.445	S	S	.	.	H	α-helix	trans	-54.5	-36.4	-168.9	57.7	0	0	0	0	114	K95 R101	K95-S97 PolarHBondContact O-N 3.21Å; S97-R101 WeakPolarHBondContact O-CB 3.34Å; S97-R101 VanDerWaalsContact O-CG 3.26Å; S97-R101 WeakPolarHBondContact O-CG 3.34Å; S97-R101 PolarHBondContact O-N 3.28Å
98	S	76.7	Confident	76.5	Confident	74 Å²	74	94.7 Å²	94.7	52%	0.517	44%	0.44	S	S	.	.	H	α-helix	trans	-64.3	-40.1	178.4	-59.6	0	0	0	0	113.8	S96 R102	S96-S98 VanDerWaalsContact C-N 3.26Å; S96-S98 PolarHBondContact O-N 3.09Å; S96-S98 VanDerWaalsContact O-N 3.11Å; S98-R102 WeakPolarHBondContact O-CG 3.48Å; S98-R102 PolarHBondContact O-N 3.49Å
99	R	74.4	Confident	76.6	Confident	136 Å²	136	96.9 Å²	96.9	51%	0.513	45%	0.452	S	S	.	.	H	α-helix	trans	-69.5	-45.6	178.2	173.3	172.2	159.6	144	0.5	110.5	D92 S96 R101 R102 L103	D92-R99 IonicContact OD1-NH2 3.86Å; D92-R99 IonicContact OD2-CZ 2.91Å; D92-R99 VanDerWaalsContact OD2-CZ 3.25Å; D92-R99 IonicContact OD2-NE 3.34Å; D92-R99 PolarHBondContact OD2-NE 3.38Å; D92-R99 IonicContact OD2-NH2 3.59Å; D92-R99 PolarHBondContact OD2-NH2 3.34Å; S96-R99 PolarHBondContact O-N 2.97Å; R99-R101 PolarHBondContact O-N 2.89Å; R99-R102 PolarHBondContact O-N 3.45Å; R99-L103 HydrophobicContact CG-CD1 4.05Å; R99-L103 PolarHBondContact O-N 3.46Å
100	R	77.8	Confident	76.6	Confident	99 Å²	99	97.6 Å²	97.6	37%	0.374	46%	0.455	S	S	.	.	H	α-helix	trans	-60.5	-42.2	176.4	-173.1	171.5	174.8	-179.1	-4	112.2	L89 K93 S96 R102 L103 Q104	L89-R100 HydrophobicContact CD2-CG 4.45Å; K93-R100 PolarHBondContact O-NH1 3.44Å; S96-R100 PolarHBondContact O-N 3.29Å; R100-R102 PolarHBondContact O-N 2.87Å; R100-L103 PolarHBondContact O-N 3.47Å; R100-Q104 WeakPolarHBondContact O-CB 3.33Å; R100-Q104 PolarHBondContact O-N 2.89Å
101	R	80.1	Confident	76.7	Confident	185 Å²	185	95.9 Å²	95.9	70%	0.698	45%	0.45	S	S	*	.	H	α-helix	trans	-60.3	-39.7	175	-76.5	172	-178.9	178.1	0.5	113.1	S97 R99 K105	S97-R101 WeakPolarHBondContact O-CB 3.34Å; S97-R101 VanDerWaalsContact O-CG 3.26Å; S97-R101 WeakPolarHBondContact O-CG 3.34Å; S97-R101 PolarHBondContact O-N 3.28Å; R99-R101 PolarHBondContact O-N 2.89Å; R101-K105 WeakPolarHBondContact O-CB 3.49Å; R101-K105 PolarHBondContact O-N 2.67Å
102	R	82.7	Confident	77	Confident	207 Å²	207	92.5 Å²	92.5	78%	0.781	45%	0.445	S	S	*	.	H	α-helix	trans	-66.5	-46.5	176	-71.3	178.9	-177	-179.7	1.2	111.9	S98 R99 R100 K105 S106	S98-R102 WeakPolarHBondContact O-CG 3.48Å; S98-R102 PolarHBondContact O-N 3.49Å; R99-R102 PolarHBondContact O-N 3.45Å; R100-R102 PolarHBondContact O-N 2.87Å; R102-K105 PolarHBondContact O-N 3.46Å; R102-S106 PolarHBondContact O-N 2.95Å
103	L	80.2	Confident	77.4	Confident	45 Å²	45	95.2 Å²	95.2	24%	0.236	46%	0.459	C	S	.	.	H	α-helix	trans	-60.6	-43.9	175.1	-79.4	158.3	0	0	0	111.5	L89 D92 R99 R100 K105 S106 Y107	L89-L103 HydrophobicContact CD2-CB 3.66Å; L89-L103 HydrophobicContact CG-CB 4.37Å; D92-L103 WeakPolarHBondContact OD2-CD1 3.36Å; R99-L103 HydrophobicContact CG-CD1 4.05Å; R99-L103 PolarHBondContact O-N 3.46Å; R100-L103 PolarHBondContact O-N 3.47Å; L103-K105 PolarHBondContact O-N 2.7Å; L103-S106 PolarHBondContact O-N 3.22Å; L103-Y107 WeakPolarHBondContact O-CB 3.28Å; L103-Y107 PolarHBondContact O-N 3.37Å
104	Q	83.9	Confident	77.8	Confident	82 Å²	82	90.6 Å²	90.6	38%	0.383	44%	0.439	S	S	.	.	H	α-helix	trans	-62.8	-45	-179.8	-172.4	69.8	45.3	0	0	110.7	L89 R100 Y107 T108	L89-Q104 HydrophobicContact CD2-CB 4.15Å; R100-Q104 WeakPolarHBondContact O-CB 3.33Å; R100-Q104 PolarHBondContact O-N 2.89Å; Q104-Y107 PolarHBondContact O-N 3.08Å; Q104-T108 WeakPolarHBondContact O-CG2 3.21Å; Q104-T108 PolarHBondContact O-N 3.28Å; Q104-T108 PolarHBondContact O-OG1 3.32Å
105	K	85.1	Confident	78.4	Confident	151 Å²	151	84.1 Å²	84.1	66%	0.657	42%	0.415	S	S	*	.	H	α-helix	trans	-64.5	-39.5	177.8	-172.7	173.3	-178.7	176.7	0	112.4	R101 R102 L103 T108 T109	R101-K105 WeakPolarHBondContact O-CB 3.49Å; R101-K105 PolarHBondContact O-N 2.67Å; R102-K105 PolarHBondContact O-N 3.46Å; L103-K105 PolarHBondContact O-N 2.7Å; K105-T108 PolarHBondContact O-OG1 3.42Å; K105-T109 WeakPolarHBondContact O-CB 3.26Å; K105-T109 PolarHBondContact O-N 2.95Å; K105-T109 PolarHBondContact O-OG1 3.14Å; K105-T109 VanDerWaalsContact O-OG1 3.1Å
106	S	81.1	Confident	79.2	Confident	45 Å²	45	83 Å²	83	32%	0.315	41%	0.408	S	S	.	.	H	α-helix	trans	-65.6	-43.3	172.6	177.7	0	0	0	0	111.4	K85 R102 L103 T108 T109 D110	K85-S106 PolarHBondContact NZ-OG 3.14Å; R102-S106 PolarHBondContact O-N 2.95Å; L103-S106 PolarHBondContact O-N 3.22Å; S106-T108 PolarHBondContact O-N 3.33Å; S106-T109 PolarHBondContact O-N 2.81Å; S106-D110 WeakPolarHBondContact O-CB 3.39Å; S106-D110 PolarHBondContact O-N 3.01Å; S106-D110 PolarHBondContact OG-OD1 3.05Å
107	Y	81.6	Confident	79.9	Confident	55 Å²	55	81.8 Å²	81.8	22%	0.216	39%	0.393	C	S	.	.	H	α-helix	trans	-60.5	-45.3	177.5	175.9	-89.5	0	0	0	112.5	L82 K85 M86 L89 L103 Q104 D110 T111	L82-Y107 HydrophobicContact CD1-CD2 4.2Å; L82-Y107 HydrophobicContact CD1-CE2 4.25Å; L82-Y107 HydrophobicContact CD2-CE2 4.22Å; L82-Y107 HydrophobicContact CG-CD2 4.1Å; L82-Y107 HydrophobicContact CG-CE2 3.68Å; K85-Y107 HydrophobicContact CB-CD2 3.99Å; M86-Y107 HydrophobicContact CB-CE2 3.89Å; L89-Y107 HydrophobicContact CD1-CD1 4.12Å; L89-Y107 HydrophobicContact CD1-CD2 4.04Å; L89-Y107 HydrophobicContact CD1-CG 3.65Å; L103-Y107 WeakPolarHBondContact O-CB 3.28Å; L103-Y107 PolarHBondContact O-N 3.37Å; Q104-Y107 PolarHBondContact O-N 3.08Å; Y107-D110 PolarHBondContact O-N 3.46Å; Y107-T111 WeakPolarHBondContact O-CB 3.49Å; Y107-T111 PolarHBondContact O-N 3.26Å; Y107-T111 PolarHBondContact O-OG1 3.12Å
108	T	84	Confident	80.2	Confident	57 Å²	57	81.3 Å²	81.3	35%	0.35	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-47.9	177.2	52.9	0	0	0	0	110.8	Q104 K105 S106 D110 T111 D112	Q104-T108 WeakPolarHBondContact O-CG2 3.21Å; Q104-T108 PolarHBondContact O-N 3.28Å; Q104-T108 PolarHBondContact O-OG1 3.32Å; K105-T108 PolarHBondContact O-OG1 3.42Å; S106-T108 PolarHBondContact O-N 3.33Å; T108-D110 PolarHBondContact O-N 2.93Å; T108-T111 WeakPolarHBondContact O-CB 3.23Å; T108-T111 PolarHBondContact O-N 3.02Å; T108-T111 VanDerWaalsContact O-N 3.11Å; T108-D112 PolarHBondContact O-N 3.28Å; T108-D112 VanDerWaalsContact O-OD2 3.13Å
109	T	82.4	Confident	80.6	Confident	65 Å²	65	83.1 Å²	83.1	40%	0.399	39%	0.386	S	S	.	.	H	α-helix	trans	-62.5	-40	179.1	-63.8	0	0	0	0	112.9	K105 S106 D112 I113	K105-T109 WeakPolarHBondContact O-CB 3.26Å; K105-T109 PolarHBondContact O-N 2.95Å; K105-T109 PolarHBondContact O-OG1 3.14Å; K105-T109 VanDerWaalsContact O-OG1 3.1Å; S106-T109 PolarHBondContact O-N 2.81Å; T109-D112 PolarHBondContact O-N 2.8Å; T109-I113 HydrophobicContact CG2-CD1 3.94Å; T109-I113 WeakPolarHBondContact O-CD1 2.86Å; T109-I113 WeakPolarHBondContact O-CG1 3.43Å; T109-I113 PolarHBondContact O-N 3.39Å; T109-I113 VanDerWaalsContact O-N 3.07Å
110	D	77.6	Confident	81	Confident	31 Å²	31	78.3 Å²	78.3	17%	0.166	37%	0.368	C	S	.	.	H	α-helix	trans	-64.6	-41	173.5	-78.1	54.6	0	0	0	111.7	M81 L82 K85 S106 Y107 T108 I113 I114	M81-D110 WeakPolarHBondContact CE-OD2 3.44Å; L82-D110 HydrophobicContact CD1-CB 3.52Å; K85-D110 IonicContact NZ-OD1 2.72Å; K85-D110 PolarHBondContact NZ-OD1 3.5Å; K85-D110 IonicContact NZ-OD2 2.7Å; K85-D110 PolarHBondContact NZ-OD2 2.87Å; S106-D110 WeakPolarHBondContact O-CB 3.39Å; S106-D110 PolarHBondContact O-N 3.01Å; S106-D110 PolarHBondContact OG-OD1 3.05Å; Y107-D110 PolarHBondContact O-N 3.46Å; T108-D110 PolarHBondContact O-N 2.93Å; D110-I113 PolarHBondContact O-N 3.17Å; D110-I114 VanDerWaalsContact O-CG1 3.29Å; D110-I114 WeakPolarHBondContact O-CG1 3.09Å; D110-I114 PolarHBondContact O-N 3.45Å
111	T	80.8	Confident	81.2	Confident	45 Å²	45	76.1 Å²	76.1	28%	0.276	36%	0.363	S	S	.	.	H	α-helix	trans	-60.8	-48.5	175.1	-52.8	0	0	0	0	111.1	L82 Y107 T108 I113 I114 S115	L82-T111 HydrophobicContact CD2-CG2 4.49Å; Y107-T111 WeakPolarHBondContact O-CB 3.49Å; Y107-T111 PolarHBondContact O-N 3.26Å; Y107-T111 PolarHBondContact O-OG1 3.12Å; T108-T111 WeakPolarHBondContact O-CB 3.23Å; T108-T111 PolarHBondContact O-N 3.02Å; T108-T111 VanDerWaalsContact O-N 3.11Å; T111-I113 VanDerWaalsContact C-N 3.29Å; T111-I113 PolarHBondContact O-N 3.28Å; T111-I114 PolarHBondContact O-N 3.48Å; T111-I114 VanDerWaalsContact O-N 3.13Å; T111-S115 PolarHBondContact O-N 3.18Å; T111-S115 PolarHBondContact O-OG 2.82Å
112	D	82.6	Confident	81.4	Confident	97 Å²	97	72.4 Å²	72.4	52%	0.519	35%	0.353	S	S	.	.	H	α-helix	trans	-60.9	-38.3	-179.5	-58.2	-29.3	0	0	0	111.4	T108 T109 S115 Y116	T108-D112 PolarHBondContact O-N 3.28Å; T108-D112 VanDerWaalsContact O-OD2 3.13Å; T109-D112 PolarHBondContact O-N 2.8Å; D112-S115 PolarHBondContact O-OG 3.08Å; D112-Y116 WeakPolarHBondContact O-CB 3.47Å; D112-Y116 PolarHBondContact O-N 3.42Å
113	I	78.7	Confident	81.7	Confident	62 Å²	62	65.6 Å²	65.6	32%	0.318	34%	0.337	S	S	.	.	H	α-helix	trans	-67.6	-42	175.3	-70.2	164.8	0	0	0	111.1	T109 D110 T111 E117 R609	T109-I113 HydrophobicContact CG2-CD1 3.94Å; T109-I113 WeakPolarHBondContact O-CD1 2.86Å; T109-I113 WeakPolarHBondContact O-CG1 3.43Å; T109-I113 PolarHBondContact O-N 3.39Å; T109-I113 VanDerWaalsContact O-N 3.07Å; D110-I113 PolarHBondContact O-N 3.17Å; T111-I113 VanDerWaalsContact C-N 3.29Å; T111-I113 PolarHBondContact O-N 3.28Å; I113-E117 PolarHBondContact O-N 3.2Å; I113-E117 VanDerWaalsContact O-N 3.1Å; I113-R609 HydrophobicContact CG2-CG 4.44Å
114	I	77.5	Confident	82.1	Confident	12 Å²	12	64 Å²	64	6%	0.062	33%	0.329	C	S	.	.	H	α-helix	trans	-64.6	-49	177.7	-70.2	167.6	0	0	0	110.5	L75 N78 L82 D110 T111 Y116 E117 E118	L75-I114 HydrophobicContact CD1-CG2 3.94Å; N78-I114 HydrophobicContact CB-CD1 3.74Å; N78-I114 HydrophobicContact CB-CG1 3.94Å; L82-I114 HydrophobicContact CB-CD1 4.32Å; L82-I114 HydrophobicContact CD1-CD1 4Å; L82-I114 HydrophobicContact CD2-CD1 4.15Å; L82-I114 HydrophobicContact CG-CD1 4.38Å; D110-I114 VanDerWaalsContact O-CG1 3.29Å; D110-I114 WeakPolarHBondContact O-CG1 3.09Å; D110-I114 PolarHBondContact O-N 3.45Å; T111-I114 PolarHBondContact O-N 3.48Å; T111-I114 VanDerWaalsContact O-N 3.13Å; I114-Y116 VanDerWaalsContact C-N 3.34Å; I114-Y116 PolarHBondContact O-N 2.9Å; I114-E117 PolarHBondContact O-N 3.2Å; I114-E118 WeakPolarHBondContact O-CG 3.16Å; I114-E118 PolarHBondContact O-N 3.31Å
115	S	79.3	Confident	82.5	Confident	49 Å²	49	61.1 Å²	61.1	34%	0.343	32%	0.316	S	S	.	.	H	α-helix	trans	-64.6	-39.5	-179.2	62	0	0	0	0	111.9	T111 D112 E117 E118 D119	T111-S115 PolarHBondContact O-N 3.18Å; T111-S115 PolarHBondContact O-OG 2.82Å; D112-S115 PolarHBondContact O-OG 3.08Å; S115-E117 PolarHBondContact O-N 3.37Å; S115-E118 PolarHBondContact O-N 3.06Å; S115-D119 WeakPolarHBondContact O-CB 3.14Å; S115-D119 PolarHBondContact O-N 3.21Å
116	Y	81.7	Confident	82.8	Confident	89 Å²	89	59.9 Å²	59.9	35%	0.349	31%	0.311	S	S	.	.	H	α-helix	trans	-61.5	-42.1	175.9	179.9	-98.8	0	0	0	112.5	D112 I114 R120 I607	D112-Y116 WeakPolarHBondContact O-CB 3.47Å; D112-Y116 PolarHBondContact O-N 3.42Å; I114-Y116 VanDerWaalsContact C-N 3.34Å; I114-Y116 PolarHBondContact O-N 2.9Å; Y116-R120 VanDerWaalsContact O-CB 3.31Å; Y116-R120 WeakPolarHBondContact O-CB 3.12Å; Y116-R120 PolarHBondContact O-N 3.16Å; Y116-I607 HydrophobicContact CE1-CG2 4.02Å; Y116-I607 WeakPolarHBondContact OH-CD1 3.26Å
117	E	76.5	Confident	83.2	Confident	57 Å²	57	59.2 Å²	59.2	27%	0.266	30%	0.304	S	S	.	.	H	α-helix	trans	-69.7	-37.3	176.3	-170.4	57.6	-143.5	0	0	111.5	I113 I114 S115 R120 Q121	I113-E117 PolarHBondContact O-N 3.2Å; I113-E117 VanDerWaalsContact O-N 3.1Å; I114-E117 PolarHBondContact O-N 3.2Å; S115-E117 PolarHBondContact O-N 3.37Å; E117-R120 PolarHBondContact O-N 2.76Å; E117-R120 IonicContact OE1-NH1 2.75Å; E117-R120 PolarHBondContact OE1-NH1 2.99Å; E117-R120 IonicContact OE2-NH1 2.74Å; E117-R120 PolarHBondContact OE2-NH1 2.78Å; E117-R120 VanDerWaalsContact OE2-NH1 3.17Å; E117-Q121 HydrophobicContact CG-CG 4.49Å; E117-Q121 WeakPolarHBondContact O-CB 3.4Å; E117-Q121 VanDerWaalsContact O-CG 3.26Å; E117-Q121 WeakPolarHBondContact O-CG 3.42Å; E117-Q121 PolarHBondContact O-N 3.39Å; E117-Q121 PolarHBondContact OE1-NE2 2.99Å
118	E	79.5	Confident	83.7	Confident	65 Å²	65	56.6 Å²	56.6	30%	0.304	29%	0.294	S	S	.	.	H	α-helix	trans	-60.8	-46.5	172.5	-71.5	-173.4	148.5	0	0	112.3	L75 K79 I114 S115 Q121 Q122	L75-E118 HydrophobicContact CD1-CG 3.85Å; L75-E118 HydrophobicContact CD2-CG 4Å; L75-E118 WeakPolarHBondContact CD2-OE1 3.37Å; L75-E118 HydrophobicContact CG-CG 4.49Å; K79-E118 WeakPolarHBondContact CE-OE1 3.42Å; K79-E118 IonicContact NZ-OE1 3.96Å; K79-E118 PolarHBondContact NZ-OE1 3.18Å; K79-E118 IonicContact NZ-OE2 3.82Å; I114-E118 WeakPolarHBondContact O-CG 3.16Å; I114-E118 PolarHBondContact O-N 3.31Å; S115-E118 PolarHBondContact O-N 3.06Å; E118-Q121 PolarHBondContact O-N 3.2Å; E118-Q122 WeakPolarHBondContact O-CB 3.32Å; E118-Q122 VanDerWaalsContact O-CG 3.28Å; E118-Q122 WeakPolarHBondContact O-CG 3.48Å; E118-Q122 PolarHBondContact O-N 3.43Å
119	D	84.9	Confident	84	Confident	111 Å²	111	59.4 Å²	59.4	59%	0.594	30%	0.298	S	S	*	.	H	α-helix	trans	-63.1	-41.5	176.5	-77	-27.8	0	0	0	111.6	S115 Q122 S123	S115-D119 WeakPolarHBondContact O-CB 3.14Å; S115-D119 PolarHBondContact O-N 3.21Å; D119-Q122 PolarHBondContact O-N 3.03Å; D119-S123 WeakPolarHBondContact O-CB 3.21Å; D119-S123 PolarHBondContact O-N 2.74Å
120	R	83.6	Confident	84.4	Confident	35 Å²	35	63.8 Å²	63.8	13%	0.132	31%	0.309	C	S	.	.	H	α-helix	trans	-59.3	-51.3	174	-179.9	178.5	171.9	-129.4	1.8	110.8	Y116 E117 Q122 S123 L124 E151	Y116-R120 VanDerWaalsContact O-CB 3.31Å; Y116-R120 WeakPolarHBondContact O-CB 3.12Å; Y116-R120 PolarHBondContact O-N 3.16Å; E117-R120 PolarHBondContact O-N 2.76Å; E117-R120 IonicContact OE1-NH1 2.75Å; E117-R120 PolarHBondContact OE1-NH1 2.99Å; E117-R120 IonicContact OE2-NH1 2.74Å; E117-R120 PolarHBondContact OE2-NH1 2.78Å; E117-R120 VanDerWaalsContact OE2-NH1 3.17Å; R120-Q122 VanDerWaalsContact C-N 3.34Å; R120-Q122 PolarHBondContact O-N 3Å; R120-S123 PolarHBondContact O-N 3.2Å; R120-S123 PolarHBondContact O-OG 3.48Å; R120-L124 WeakPolarHBondContact O-CB 3.17Å; R120-L124 PolarHBondContact O-N 3.01Å; R120-E151 IonicContact CZ-OE2 3.6Å; R120-E151 IonicContact NE-OE2 3.25Å; R120-E151 IonicContact NH2-OE2 3.79Å; R120-E151 PolarHBondContact NH2-OE2 2.79Å
121	Q	80.7	Confident	84.8	Confident	54 Å²	54	66.6 Å²	66.6	25%	0.252	32%	0.324	S	S	.	.	H	α-helix	trans	-62.5	-38.6	178.8	-68	-60.9	-27.9	0	0	112.3	E117 E118 L124 L125	E117-Q121 HydrophobicContact CG-CG 4.49Å; E117-Q121 WeakPolarHBondContact O-CB 3.4Å; E117-Q121 VanDerWaalsContact O-CG 3.26Å; E117-Q121 WeakPolarHBondContact O-CG 3.42Å; E117-Q121 PolarHBondContact O-N 3.39Å; E117-Q121 PolarHBondContact OE1-NE2 2.99Å; E118-Q121 PolarHBondContact O-N 3.2Å; Q121-L124 PolarHBondContact O-N 3.06Å; Q121-L125 VanDerWaalsContact O-CB 3.27Å; Q121-L125 WeakPolarHBondContact O-CB 3.23Å; Q121-L125 PolarHBondContact O-N 2.98Å
122	Q	85.6	Confident	85.1	Confident	106 Å²	106	64.7 Å²	64.7	50%	0.495	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-39.2	173.9	-72.9	-68.9	-9.4	0	0	112.6	E118 D119 R120 K126	E118-Q122 WeakPolarHBondContact O-CB 3.32Å; E118-Q122 VanDerWaalsContact O-CG 3.28Å; E118-Q122 WeakPolarHBondContact O-CG 3.48Å; E118-Q122 PolarHBondContact O-N 3.43Å; D119-Q122 PolarHBondContact O-N 3.03Å; R120-Q122 VanDerWaalsContact C-N 3.34Å; R120-Q122 PolarHBondContact O-N 3Å; Q122-K126 WeakPolarHBondContact O-CG 3.49Å; Q122-K126 PolarHBondContact O-N 2.87Å; Q122-K126 VanDerWaalsContact O-N 3.13Å
123	S	89.1	Confident	85.4	Confident	64 Å²	64	61.5 Å²	61.5	45%	0.448	30%	0.295	S	S	.	.	H	α-helix	trans	-64.8	-43.6	175.5	77.3	0	0	0	0	111.6	D119 R120 K126 V127	D119-S123 WeakPolarHBondContact O-CB 3.21Å; D119-S123 PolarHBondContact O-N 2.74Å; R120-S123 PolarHBondContact O-N 3.2Å; R120-S123 PolarHBondContact O-OG 3.48Å; S123-K126 WeakPolarHBondContact O-CB 3.48Å; S123-K126 PolarHBondContact O-N 3.09Å; S123-V127 PolarHBondContact O-N 3.41Å
124	L	88.3	Confident	85.8	Confident	13 Å²	13	62.6 Å²	62.6	7%	0.068	30%	0.304	C	S	.	.	H	α-helix	trans	-65.3	-43.1	177.7	-171.7	54.9	0	0	0	111	R120 Q121 K126 V127 W128 Y148 E151 G152 P154	R120-L124 WeakPolarHBondContact O-CB 3.17Å; R120-L124 PolarHBondContact O-N 3.01Å; Q121-L124 PolarHBondContact O-N 3.06Å; L124-K126 VanDerWaalsContact C-N 3.3Å; L124-K126 PolarHBondContact O-N 3.21Å; L124-V127 PolarHBondContact O-N 3.03Å; L124-W128 VanDerWaalsContact O-CD1 3.22Å; L124-W128 PolarHBondContact O-N 2.91Å; L124-Y148 HydrophobicContact CD1-CD1 4.02Å; L124-E151 HydrophobicContact CD1-CB 4.36Å; L124-E151 HydrophobicContact CD2-CB 4.11Å; L124-G152 WeakPolarHBondContact CD2-O 3.42Å; L124-P154 HydrophobicContact CB-CG 4.4Å; L124-P154 HydrophobicContact CD2-CG 4.38Å; L124-P154 HydrophobicContact CG-CG 4Å
125	L	91	Very high	86.1	Confident	21 Å²	21	67.3 Å²	67.3	11%	0.11	33%	0.326	C	S	.	.	H	α-helix	trans	-59.9	-36.7	175.1	-179.4	62.4	0	0	0	113	Q121 R129 P154 A156 V157	Q121-L125 VanDerWaalsContact O-CB 3.27Å; Q121-L125 WeakPolarHBondContact O-CB 3.23Å; Q121-L125 PolarHBondContact O-N 2.98Å; L125-R129 HydrophobicContact CD1-CG 4.14Å; L125-R129 WeakPolarHBondContact O-CB 3.39Å; L125-R129 WeakPolarHBondContact O-CG 3.42Å; L125-R129 PolarHBondContact O-N 3.41Å; L125-P154 HydrophobicContact CB-CB 4.37Å; L125-P154 HydrophobicContact CB-CG 4.29Å; L125-P154 HydrophobicContact CD1-CB 4.12Å; L125-A156 HydrophobicContact CD1-CB 4.1Å; L125-A156 HydrophobicContact CD2-CB 4.42Å; L125-V157 HydrophobicContact CD1-CG1 3.82Å; L125-V157 HydrophobicContact CD1-CG2 4.3Å
126	K	91.4	Very high	86.4	Confident	125 Å²	125	66.9 Å²	66.9	54%	0.543	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-49.7	173.8	-71.5	167.5	-174.8	175.8	0	110.8	Q122 S123 L124 W128 R129 Y130	Q122-K126 WeakPolarHBondContact O-CG 3.49Å; Q122-K126 PolarHBondContact O-N 2.87Å; Q122-K126 VanDerWaalsContact O-N 3.13Å; S123-K126 WeakPolarHBondContact O-CB 3.48Å; S123-K126 PolarHBondContact O-N 3.09Å; L124-K126 VanDerWaalsContact C-N 3.3Å; L124-K126 PolarHBondContact O-N 3.21Å; K126-W128 PolarHBondContact O-N 3.39Å; K126-R129 PolarHBondContact O-N 3.03Å; K126-Y130 HydrophobicContact CB-CD2 4.18Å; K126-Y130 HydrophobicContact CB-CE2 4.47Å; K126-Y130 HydrophobicContact CG-CE2 4.4Å; K126-Y130 WeakPolarHBondContact O-CB 3.29Å; K126-Y130 VanDerWaalsContact O-CD2 3.23Å; K126-Y130 WeakPolarHBondContact O-CD2 3.36Å; K126-Y130 PolarHBondContact O-N 2.95Å
127	V	90.6	Very high	86.2	Confident	30 Å²	30	72.7 Å²	72.7	18%	0.182	34%	0.344	C	S	.	.	H	α-helix	trans	-58.2	-47.6	177.5	174.1	0	0	0	0	111.2	S123 L124 R129 D131 V132 Y148	S123-V127 PolarHBondContact O-N 3.41Å; L124-V127 PolarHBondContact O-N 3.03Å; V127-R129 PolarHBondContact O-N 3.11Å; V127-D131 WeakPolarHBondContact CA-OD2 3.46Å; V127-D131 HydrophobicContact CG1-CB 4.31Å; V127-D131 WeakPolarHBondContact O-CA 3.25Å; V127-D131 WeakPolarHBondContact O-CB 3.42Å; V127-D131 PolarHBondContact O-N 3.16Å; V127-V132 HydrophobicContact CG1-CG2 4.29Å; V127-V132 PolarHBondContact O-N 3.34Å; V127-Y148 HydrophobicContact CG1-CD1 4.38Å; V127-Y148 HydrophobicContact CG1-CD2 4.02Å; V127-Y148 HydrophobicContact CG1-CE1 3.96Å; V127-Y148 HydrophobicContact CG1-CE2 3.57Å; V127-Y148 HydrophobicContact CG1-CG 4.42Å
128	W	91.8	Very high	85.9	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	36%	0.364	C	S	.	.	I	π-helix	trans	-60.6	-41.8	177.8	-83.6	101.1	0	0	0	113.2	L124 K126 V132 L133 F149 G152 V153 P154 V157 V161	L124-W128 VanDerWaalsContact O-CD1 3.22Å; L124-W128 PolarHBondContact O-N 2.91Å; K126-W128 PolarHBondContact O-N 3.39Å; W128-V132 HydrophobicContact CD2-CG2 4.44Å; W128-V132 HydrophobicContact CE3-CB 3.94Å; W128-V132 HydrophobicContact CE3-CG1 3.7Å; W128-V132 HydrophobicContact CE3-CG2 4.28Å; W128-V132 HydrophobicContact CZ3-CB 4.47Å; W128-V132 HydrophobicContact CZ3-CG1 3.74Å; W128-L133 WeakPolarHBondContact O-CB 3.46Å; W128-L133 VanDerWaalsContact O-CG 3.32Å; W128-L133 WeakPolarHBondContact O-CG 3.44Å; W128-L133 PolarHBondContact O-N 3.17Å; W128-F149 HydrophobicContact CH2-CD1 4.15Å; W128-F149 AromaticContact CH2-CD2 3.77Å; W128-F149 HydrophobicContact CH2-CD2 3.77Å; W128-F149 AromaticContact CH2-CE1 3.87Å; W128-F149 HydrophobicContact CH2-CE1 3.87Å; W128-F149 AromaticContact CH2-CE2 3.51Å; W128-F149 HydrophobicContact CH2-CE2 3.51Å; W128-F149 HydrophobicContact CH2-CG 4.11Å; W128-F149 AromaticContact CH2-CZ 3.56Å; W128-F149 HydrophobicContact CH2-CZ 3.56Å; W128-F149 HydrophobicContact CZ2-CD2 4.3Å; W128-F149 HydrophobicContact CZ2-CE2 4.45Å; W128-F149 HydrophobicContact CZ2-CG 4.41Å; W128-F149 HydrophobicContact CZ3-CE2 4.22Å; W128-F149 HydrophobicContact CZ3-CZ 4.13Å; W128-G152 PolarHBondContact NE1-O 3.03Å; W128-V153 HydrophobicContact CH2-CG1 4.48Å; W128-V153 HydrophobicContact CH2-CG2 3.79Å; W128-V153 HydrophobicContact CZ2-CB 4.29Å; W128-V153 HydrophobicContact CZ2-CG1 4.45Å; W128-V153 HydrophobicContact CZ2-CG2 3.71Å; W128-P154 HydrophobicContact CG-CG 4.48Å; W128-V157 HydrophobicContact CB-CG2 4.06Å; W128-V157 HydrophobicContact CG-CG2 4.37Å; W128-V161 HydrophobicContact CE3-CG2 3.75Å; W128-V161 HydrophobicContact CH2-CG1 4.15Å; W128-V161 HydrophobicContact CH2-CG2 4.46Å; W128-V161 HydrophobicContact CZ3-CB 4.4Å; W128-V161 HydrophobicContact CZ3-CG1 3.86Å; W128-V161 HydrophobicContact CZ3-CG2 3.56Å
129	R	90.7	Very high	85	Confident	116 Å²	116	73.8 Å²	73.8	44%	0.438	37%	0.372	S	S	.	.	I	π-helix	trans	-73.8	-44.4	-179.4	-76.6	-178.8	171.7	178.4	-1	113.7	L125 K126 V127 V157	L125-R129 HydrophobicContact CD1-CG 4.14Å; L125-R129 WeakPolarHBondContact O-CB 3.39Å; L125-R129 WeakPolarHBondContact O-CG 3.42Å; L125-R129 PolarHBondContact O-N 3.41Å; K126-R129 PolarHBondContact O-N 3.03Å; V127-R129 PolarHBondContact O-N 3.11Å; R129-V157 HydrophobicContact CG-CG1 3.83Å
130	Y	89.6	Confident	84	Confident	157 Å²	157	75.4 Å²	75.4	62%	0.616	37%	0.371	S	S	*	.	I	π-helix	trans	-99.7	-26	-168.6	-61.7	-62.8	0	0	0	114.3	K126 T134	K126-Y130 HydrophobicContact CB-CD2 4.18Å; K126-Y130 HydrophobicContact CB-CE2 4.47Å; K126-Y130 HydrophobicContact CG-CE2 4.4Å; K126-Y130 WeakPolarHBondContact O-CB 3.29Å; K126-Y130 VanDerWaalsContact O-CD2 3.23Å; K126-Y130 WeakPolarHBondContact O-CD2 3.36Å; K126-Y130 PolarHBondContact O-N 2.95Å; Y130-T134 WeakPolarHBondContact O-CG2 3.42Å; Y130-T134 PolarHBondContact O-OG1 2.88Å
131	D	86.7	Confident	83.3	Confident	90 Å²	90	74 Å²	74	48%	0.481	37%	0.366	S	S	.	.	I	π-helix	trans	-107.7	-42.2	-178	-52.1	-40.4	0	0	0	112.3	V127 T134 H135	V127-D131 WeakPolarHBondContact CA-OD2 3.46Å; V127-D131 HydrophobicContact CG1-CB 4.31Å; V127-D131 WeakPolarHBondContact O-CA 3.25Å; V127-D131 WeakPolarHBondContact O-CB 3.42Å; V127-D131 PolarHBondContact O-N 3.16Å; D131-T134 PolarHBondContact O-OG1 3.09Å; D131-H135 PolarHBondContact O-ND1 3.5Å
132	V	88.3	Confident	83.2	Confident	5 Å²	5	74.2 Å²	74.2	3%	0.03	37%	0.374	C	S	.	.	I	π-helix	trans	-86.8	-56.1	-173.3	-175.1	0	0	0	0	112.8	V127 W128 H135 W136 V145 Y148	V127-V132 HydrophobicContact CG1-CG2 4.29Å; V127-V132 PolarHBondContact O-N 3.34Å; W128-V132 HydrophobicContact CD2-CG2 4.44Å; W128-V132 HydrophobicContact CE3-CB 3.94Å; W128-V132 HydrophobicContact CE3-CG1 3.7Å; W128-V132 HydrophobicContact CE3-CG2 4.28Å; W128-V132 HydrophobicContact CZ3-CB 4.47Å; W128-V132 HydrophobicContact CZ3-CG1 3.74Å; V132-H135 PolarHBondContact O-N 3.35Å; V132-W136 HydrophobicContact CG1-CE3 4.09Å; V132-W136 HydrophobicContact CG1-CZ3 4.09Å; V132-W136 PolarHBondContact O-N 3.15Å; V132-V145 HydrophobicContact CG1-CG1 3.61Å; V132-V145 HydrophobicContact CG1-CG2 4.3Å; V132-V145 HydrophobicContact CG2-CG1 4.46Å; V132-V145 HydrophobicContact CG2-CG2 4.35Å; V132-Y148 HydrophobicContact CG2-CD2 4.03Å; V132-Y148 HydrophobicContact CG2-CE2 4.44Å
133	L	88.4	Confident	82.8	Confident	30 Å²	30	74.5 Å²	74.5	16%	0.157	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-35	-173.4	-74.1	171.4	0	0	0	113.2	W128 H135 W136 V157 V161 L164	W128-L133 WeakPolarHBondContact O-CB 3.46Å; W128-L133 VanDerWaalsContact O-CG 3.32Å; W128-L133 WeakPolarHBondContact O-CG 3.44Å; W128-L133 PolarHBondContact O-N 3.17Å; L133-H135 VanDerWaalsContact C-N 3.3Å; L133-H135 PolarHBondContact O-N 3.14Å; L133-W136 HydrophobicContact CD2-CE3 4.4Å; L133-W136 WeakPolarHBondContact O-CB 3.47Å; L133-W136 PolarHBondContact O-N 3.42Å; L133-V157 HydrophobicContact CD1-CB 4.01Å; L133-V157 HydrophobicContact CD1-CG1 3.87Å; L133-V161 HydrophobicContact CD2-CG2 3.99Å; L133-L164 HydrophobicContact CD2-CD1 3.74Å
134	T	87.4	Confident	82.3	Confident	85 Å²	85	77 Å²	77	52%	0.521	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-41	172.7	42.4	0	0	0	0	112.6	Y130 D131	Y130-T134 WeakPolarHBondContact O-CG2 3.42Å; Y130-T134 PolarHBondContact O-OG1 2.88Å; D131-T134 PolarHBondContact O-OG1 3.09Å
135	H	83	Confident	82.1	Confident	112 Å²	112	77.5 Å²	77.5	52%	0.519	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	12.1	-176.7	-55.9	104.1	0	0	0	113.5	D131 V132 L133 K137 S138	D131-H135 PolarHBondContact O-ND1 3.5Å; V132-H135 PolarHBondContact O-N 3.35Å; L133-H135 VanDerWaalsContact C-N 3.3Å; L133-H135 PolarHBondContact O-N 3.14Å; H135-K137 PolarHBondContact O-N 3Å; H135-K137 VanDerWaalsContact O-N 3.09Å; H135-S138 PolarHBondContact O-N 3.4Å; H135-S138 PolarHBondContact O-OG 2.98Å
136	W	84.8	Confident	81.9	Confident	39 Å²	39	80.2 Å²	80.2	15%	0.148	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-56.3	-34.1	-174.8	-167.8	-90.2	0	0	0	113.6	V132 L133 F149 V161 L164 L165	V132-W136 HydrophobicContact CG1-CE3 4.09Å; V132-W136 HydrophobicContact CG1-CZ3 4.09Å; V132-W136 PolarHBondContact O-N 3.15Å; L133-W136 HydrophobicContact CD2-CE3 4.4Å; L133-W136 WeakPolarHBondContact O-CB 3.47Å; L133-W136 PolarHBondContact O-N 3.42Å; W136-F149 HydrophobicContact CH2-CZ 4.32Å; W136-V161 HydrophobicContact CH2-CG1 4.37Å; W136-L164 HydrophobicContact CD2-CB 4.49Å; W136-L164 HydrophobicContact CD2-CD1 4.05Å; W136-L164 HydrophobicContact CG-CD1 4.07Å; W136-L164 HydrophobicContact CZ2-CB 3.8Å; W136-L165 HydrophobicContact CH2-CD2 3.82Å; W136-L165 HydrophobicContact CH2-CG 3.89Å; W136-L165 HydrophobicContact CZ2-CD2 3.79Å; W136-L165 HydrophobicContact CZ2-CG 3.91Å
137	K	78.3	Confident	81.7	Confident	211 Å²	211	78.3 Å²	78.3	92%	0.917	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-76.5	-17.8	179.9	-66.1	-174.8	179.9	-179.8	0	114.5	H135	H135-K137 PolarHBondContact O-N 3Å; H135-K137 VanDerWaalsContact O-N 3.09Å
138	S	71.1	Confident	81.6	Confident	100 Å²	100	80.5 Å²	80.5	70%	0.699	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-87.7	-4.4	-175.9	55.6	0	0	0	0	114.4	H135	H135-S138 PolarHBondContact O-N 3.4Å; H135-S138 PolarHBondContact O-OG 2.98Å
139	G	59.4	Low	81.6	Confident	45 Å²	45	80.5 Å²	80.5	46%	0.464	39%	0.393	S	S	.	.	S	Bend	trans	170.9	120.5	172.7	0	0	0	0	0	113.1
140	Y	63.8	Low	81.6	Confident	146 Å²	146	75.3 Å²	75.3	57%	0.573	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	136.5	172.9	-171.9	-100.5	0	0	0	110.6	S142 L165	Y140-S142 PolarHBondContact O-N 3.47Å; Y140-L165 HydrophobicContact CE2-CD2 4.3Å
141	P	69.4	Low	81.5	Confident	4 Å²	4	69.4 Å²	69.4	3%	0.026	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.4	117.1	-141.8	9.1	-28.8	0	0	0	115.1	V145 R146 F149 L449	P141-V145 HydrophobicContact CB-CB 4.02Å; P141-V145 HydrophobicContact CB-CG1 3.66Å; P141-R146 HydrophobicContact CB-CG 4.29Å; P141-R146 PolarHBondContact O-NE 3.3Å; P141-F149 HydrophobicContact CB-CE2 4.43Å; P141-L449 HydrophobicContact CB-CD1 4.35Å; P141-L449 HydrophobicContact CG-CD1 3.56Å
142	S	78.5	Confident	81.6	Confident	60 Å²	60	65.3 Å²	65.3	42%	0.42	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-58.9	163.1	178	76.1	0	0	0	0	112.1	Y140 N144 V145 R146	Y140-S142 PolarHBondContact O-N 3.47Å; S142-N144 PolarHBondContact O-N 2.87Å; S142-N144 VanDerWaalsContact O-N 3.1Å; S142-V145 PolarHBondContact O-N 2.77Å; S142-V145 WeakPolarHBondContact OG-CG2 3.3Å; S142-V145 PolarHBondContact OG-N 2.6Å; S142-R146 WeakPolarHBondContact O-CG 3.39Å; S142-R146 PolarHBondContact O-N 2.96Å
143	K	78.1	Confident	81.8	Confident	111 Å²	111	65.1 Å²	65.1	48%	0.483	33%	0.329	S	S	.	.	H	α-helix	trans	-52.2	-36.7	-179.3	-169.1	165.5	-174.9	161	0	112.5	D590 F593	K143-D590 IonicContact NZ-OD1 3.68Å; K143-D590 PolarHBondContact NZ-OD1 2.91Å; K143-F593 VanDerWaalsContact CE-CE2 3.41Å
144	N	77.5	Confident	81.9	Confident	116 Å²	116	64 Å²	64	62%	0.62	32%	0.323	S	S	*	.	H	α-helix	trans	-72.3	-45.3	177	-60.7	0	0	0	0	111.8	S142 R146 Q147	S142-N144 PolarHBondContact O-N 2.87Å; S142-N144 VanDerWaalsContact O-N 3.1Å; N144-R146 VanDerWaalsContact C-N 3.26Å; N144-R146 PolarHBondContact O-N 3.13Å; N144-Q147 VanDerWaalsContact O-CB 3.29Å; N144-Q147 WeakPolarHBondContact O-CB 3.41Å; N144-Q147 PolarHBondContact O-N 3.09Å
145	V	84.4	Confident	81.9	Confident	24 Å²	24	60.3 Å²	60.3	15%	0.145	30%	0.302	C	S	.	.	H	α-helix	trans	-60.3	-37.9	177.8	174.9	0	0	0	0	111.2	V132 P141 S142 Q147 Y148 F149	V132-V145 HydrophobicContact CG1-CG1 3.61Å; V132-V145 HydrophobicContact CG1-CG2 4.3Å; V132-V145 HydrophobicContact CG2-CG1 4.46Å; V132-V145 HydrophobicContact CG2-CG2 4.35Å; P141-V145 HydrophobicContact CB-CB 4.02Å; P141-V145 HydrophobicContact CB-CG1 3.66Å; S142-V145 PolarHBondContact O-N 2.77Å; S142-V145 WeakPolarHBondContact OG-CG2 3.3Å; S142-V145 PolarHBondContact OG-N 2.6Å; V145-Q147 PolarHBondContact O-N 2.84Å; V145-Y148 PolarHBondContact O-N 3.42Å; V145-Y148 VanDerWaalsContact O-N 3.08Å; V145-F149 HydrophobicContact CG1-CE2 4.04Å; V145-F149 WeakPolarHBondContact O-CD2 3.38Å
146	R	86.9	Confident	82.2	Confident	79 Å²	79	57 Å²	57	30%	0.298	29%	0.293	S	S	.	.	H	α-helix	trans	-59.4	-26.7	175.5	-66.6	-178.4	-169.5	-175.3	-1.7	113.3	P141 S142 N144 L449	P141-R146 HydrophobicContact CB-CG 4.29Å; P141-R146 PolarHBondContact O-NE 3.3Å; S142-R146 WeakPolarHBondContact O-CG 3.39Å; S142-R146 PolarHBondContact O-N 2.96Å; N144-R146 VanDerWaalsContact C-N 3.26Å; N144-R146 PolarHBondContact O-N 3.13Å; R146-L449 HydrophobicContact CB-CD2 4.31Å; R146-L449 HydrophobicContact CG-CD1 4.39Å; R146-L449 HydrophobicContact CG-CD2 4.08Å
147	Q	86.3	Confident	82.5	Confident	85 Å²	85	55.1 Å²	55.1	40%	0.397	29%	0.286	S	S	.	.	H	α-helix	trans	-67.7	-38.9	175.2	-171.3	176.3	-17.1	0	0	111.6	N144 V145 F149 W150 E151	N144-Q147 VanDerWaalsContact O-CB 3.29Å; N144-Q147 WeakPolarHBondContact O-CB 3.41Å; N144-Q147 PolarHBondContact O-N 3.09Å; V145-Q147 PolarHBondContact O-N 2.84Å; Q147-F149 VanDerWaalsContact C-N 3.26Å; Q147-F149 PolarHBondContact O-N 2.81Å; Q147-W150 WeakPolarHBondContact O-CB 3.27Å; Q147-W150 PolarHBondContact O-N 3.03Å; Q147-E151 PolarHBondContact O-N 3.19Å
148	Y	89.4	Confident	83.3	Confident	76 Å²	76	45.5 Å²	45.5	30%	0.298	24%	0.244	S	C	.	.	H	α-helix	trans	-65.6	-25.4	179.1	-58.4	-53.6	0	0	0	113.5	L124 V127 V132 V145 W150 E151 G152	L124-Y148 HydrophobicContact CD1-CD1 4.02Å; V127-Y148 HydrophobicContact CG1-CD1 4.38Å; V127-Y148 HydrophobicContact CG1-CD2 4.02Å; V127-Y148 HydrophobicContact CG1-CE1 3.96Å; V127-Y148 HydrophobicContact CG1-CE2 3.57Å; V127-Y148 HydrophobicContact CG1-CG 4.42Å; V132-Y148 HydrophobicContact CG2-CD2 4.03Å; V132-Y148 HydrophobicContact CG2-CE2 4.44Å; V145-Y148 PolarHBondContact O-N 3.42Å; V145-Y148 VanDerWaalsContact O-N 3.08Å; Y148-W150 VanDerWaalsContact C-N 3.32Å; Y148-E151 PolarHBondContact O-N 3.48Å; Y148-G152 CarbonylContact O-C 3.56Å; Y148-G152 PolarHBondContact O-N 2.93Å; Y148-G152 VanDerWaalsContact O-O 3.09Å
149	F	91.3	Very high	84.3	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.1	-34.8	170.6	-78	-91.3	0	0	0	112.9	W128 W136 P141 V145 Q147 V153 V161 L165 R442 D445 L446 L449	W128-F149 HydrophobicContact CH2-CD1 4.15Å; W128-F149 AromaticContact CH2-CD2 3.77Å; W128-F149 HydrophobicContact CH2-CD2 3.77Å; W128-F149 AromaticContact CH2-CE1 3.87Å; W128-F149 HydrophobicContact CH2-CE1 3.87Å; W128-F149 AromaticContact CH2-CE2 3.51Å; W128-F149 HydrophobicContact CH2-CE2 3.51Å; W128-F149 HydrophobicContact CH2-CG 4.11Å; W128-F149 AromaticContact CH2-CZ 3.56Å; W128-F149 HydrophobicContact CH2-CZ 3.56Å; W128-F149 HydrophobicContact CZ2-CD2 4.3Å; W128-F149 HydrophobicContact CZ2-CE2 4.45Å; W128-F149 HydrophobicContact CZ2-CG 4.41Å; W128-F149 HydrophobicContact CZ3-CE2 4.22Å; W128-F149 HydrophobicContact CZ3-CZ 4.13Å; W136-F149 HydrophobicContact CH2-CZ 4.32Å; P141-F149 HydrophobicContact CB-CE2 4.43Å; V145-F149 HydrophobicContact CG1-CE2 4.04Å; V145-F149 WeakPolarHBondContact O-CD2 3.38Å; Q147-F149 VanDerWaalsContact C-N 3.26Å; Q147-F149 PolarHBondContact O-N 2.81Å; F149-V153 HydrophobicContact CD1-CG2 3.83Å; F149-V153 HydrophobicContact CE1-CG2 3.95Å; F149-V161 HydrophobicContact CE1-CG1 3.8Å; F149-V161 HydrophobicContact CZ-CG1 3.82Å; F149-L165 HydrophobicContact CE1-CD1 3.57Å; F149-L165 HydrophobicContact CZ-CD1 3.7Å; F149-R442 PolarHBondContact O-NH1 3.33Å; F149-R442 VanDerWaalsContact O-NH1 3.1Å; F149-R442 PolarHBondContact O-NH2 3.1Å; F149-D445 WeakPolarHBondContact CD1-O 3.41Å; F149-L446 HydrophobicContact CB-CD2 4.21Å; F149-L449 HydrophobicContact CB-CD2 3.77Å; F149-L449 HydrophobicContact CD1-CB 4.16Å; F149-L449 HydrophobicContact CD1-CD2 4.12Å; F149-L449 HydrophobicContact CD2-CD2 3.63Å; F149-L449 HydrophobicContact CE1-CB 4.25Å; F149-L449 HydrophobicContact CE2-CD1 4.42Å; F149-L449 HydrophobicContact CE2-CD2 4.17Å; F149-L449 HydrophobicContact CG-CB 4.47Å; F149-L449 HydrophobicContact CG-CD2 3.57Å
150	W	90.7	Very high	85.9	Confident	6 Å²	6	46 Å²	46	2%	0.023	23%	0.225	C	C	.	.	H	α-helix	trans	-73.5	-27.6	175.3	-68.9	101.2	0	0	0	112.7	Q147 Y148 R442 L446 Y450 Y457 I497 M500 Y501 H504	Q147-W150 WeakPolarHBondContact O-CB 3.27Å; Q147-W150 PolarHBondContact O-N 3.03Å; Y148-W150 VanDerWaalsContact C-N 3.32Å; W150-R442 PolarHBondContact O-NH2 3.22Å; W150-L446 HydrophobicContact CD2-CD1 4.34Å; W150-L446 HydrophobicContact CD2-CD2 3.67Å; W150-L446 HydrophobicContact CE3-CD1 3.71Å; W150-L446 HydrophobicContact CE3-CD2 3.91Å; W150-L446 HydrophobicContact CE3-CG 4.5Å; W150-L446 HydrophobicContact CG-CD2 4.16Å; W150-L446 HydrophobicContact CH2-CD1 3.87Å; W150-L446 HydrophobicContact CH2-CD2 4.3Å; W150-L446 HydrophobicContact CZ2-CD1 4.46Å; W150-L446 HydrophobicContact CZ2-CD2 4.06Å; W150-L446 HydrophobicContact CZ3-CD1 3.46Å; W150-L446 VanDerWaalsContact CZ3-CD1 3.46Å; W150-L446 HydrophobicContact CZ3-CD2 4.22Å; W150-Y450 AromaticContact CE2-CE2 3.79Å; W150-Y450 HydrophobicContact CZ2-CD2 4.34Å; W150-Y450 AromaticContact CZ2-CE2 3.72Å; W150-Y450 HydrophobicContact CZ2-CE2 3.72Å; W150-Y450 AromaticContact NE1-CE2 3.56Å; W150-Y450 AromaticContact NE1-CZ 3.7Å; W150-Y450 PolarHBondContact NE1-OH 2.91Å; W150-Y450 VanDerWaalsContact NE1-OH 3.08Å; W150-Y457 HydrophobicContact CH2-CD2 4.47Å; W150-I497 HydrophobicContact CE3-CG2 3.81Å; W150-I497 HydrophobicContact CZ3-CG2 4.35Å; W150-I497 WeakPolarHBondContact O-CG2 3.37Å; W150-M500 HydrophobicContact CH2-CB 4.37Å; W150-M500 HydrophobicContact CZ3-CB 3.95Å; W150-Y501 AromaticContact CD2-CD2 3.54Å; W150-Y501 HydrophobicContact CD2-CD2 3.54Å; W150-Y501 HydrophobicContact CD2-CE2 4.17Å; W150-Y501 AromaticContact CE2-CD2 3.83Å; W150-Y501 AromaticContact CE3-CD2 3.7Å; W150-Y501 HydrophobicContact CE3-CD2 3.7Å; W150-Y501 HydrophobicContact CE3-CG 4.38Å; W150-Y501 AromaticContact CG-CD2 3.89Å; W150-Y501 HydrophobicContact CG-CD2 3.89Å; W150-Y501 HydrophobicContact CG-CE2 4.12Å; W150-Y501 HydrophobicContact CH2-CD2 4.39Å; W150-Y501 HydrophobicContact CZ2-CD2 4.27Å; W150-Y501 HydrophobicContact CZ3-CD2 4.12Å; W150-H504 AromaticContact CE2-CD2 3.51Å; W150-H504 AromaticContact CE2-NE2 3.96Å; W150-H504 HydrophobicContact CH2-CB 4.32Å; W150-H504 HydrophobicContact CZ2-CB 4.05Å; W150-H504 AromaticContact CZ2-CD2 3.29Å; W150-H504 WeakPolarHBondContact CZ2-CD2 3.39Å; W150-H504 AromaticContact CZ2-CG 3.7Å; W150-H504 AromaticContact CZ2-NE2 3.9Å; W150-H504 AromaticContact NE1-CD2 3.47Å; W150-H504 PolarHBondContact NE1-CD2 3Å; W150-H504 AromaticContact NE1-NE2 3.51Å
151	E	87.2	Confident	87.3	Confident	33 Å²	33	39 Å²	39	15%	0.154	20%	0.197	C	C	.	.	H	α-helix	trans	-72.5	-55.5	169.3	-65.1	-70.4	167.4	0	0	111.6	R120 L124 Q147 Y148 R442 V605	R120-E151 IonicContact CZ-OE2 3.6Å; R120-E151 IonicContact NE-OE2 3.25Å; R120-E151 IonicContact NH2-OE2 3.79Å; R120-E151 PolarHBondContact NH2-OE2 2.79Å; L124-E151 HydrophobicContact CD1-CB 4.36Å; L124-E151 HydrophobicContact CD2-CB 4.11Å; Q147-E151 PolarHBondContact O-N 3.19Å; Y148-E151 PolarHBondContact O-N 3.48Å; E151-R442 PolarHBondContact O-NH2 3.11Å; E151-V605 VanDerWaalsContact OE1-O 3.06Å
152	G	90	Very high	88.5	Confident	4 Å²	4	38.8 Å²	38.8	4%	0.041	20%	0.196	C	C	.	.			trans	161.4	135.9	-172.9	0	0	0	0	0	112.2	L124 W128 Y148 P154 R442	L124-G152 WeakPolarHBondContact CD2-O 3.42Å; W128-G152 PolarHBondContact NE1-O 3.03Å; Y148-G152 CarbonylContact O-C 3.56Å; Y148-G152 PolarHBondContact O-N 2.93Å; Y148-G152 VanDerWaalsContact O-O 3.09Å; G152-P154 WeakPolarHBondContact O-CD 3.1Å; G152-R442 VanDerWaalsContact CA-CZ 3.45Å
153	V	91.6	Very high	89.2	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.196	C	C	.	.			trans	-87.2	117.2	155.3	-171.9	0	0	0	0	106.6	W128 F149 V157 R158 V161 D445	W128-V153 HydrophobicContact CH2-CG1 4.48Å; W128-V153 HydrophobicContact CH2-CG2 3.79Å; W128-V153 HydrophobicContact CZ2-CB 4.29Å; W128-V153 HydrophobicContact CZ2-CG1 4.45Å; W128-V153 HydrophobicContact CZ2-CG2 3.71Å; F149-V153 HydrophobicContact CD1-CG2 3.83Å; F149-V153 HydrophobicContact CE1-CG2 3.95Å; V153-V157 HydrophobicContact CG1-CG2 4.2Å; V153-R158 HydrophobicContact CB-CG 4.23Å; V153-R158 HydrophobicContact CG1-CB 4Å; V153-R158 HydrophobicContact CG1-CG 3.98Å; V153-R158 VanDerWaalsContact O-CZ 3.22Å; V153-R158 PolarHBondContact O-NE 3.32Å; V153-R158 PolarHBondContact O-NH2 3.42Å; V153-V161 HydrophobicContact CG1-CB 3.92Å; V153-V161 HydrophobicContact CG1-CG1 4.13Å; V153-V161 HydrophobicContact CG1-CG2 3.88Å; V153-V161 HydrophobicContact CG2-CG1 4.25Å; V153-D445 WeakPolarHBondContact CB-OD1 3.28Å; V153-D445 HydrophobicContact CG2-CB 3.89Å; V153-D445 VanDerWaalsContact CG2-CG 3.47Å; V153-D445 WeakPolarHBondContact CG2-OD1 3.35Å; V153-D445 PolarHBondContact N-OD2 3.32Å
154	P	91.5	Very high	89.8	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.039	19%	0.194	C	C	.	.			trans	-66.3	141.6	179	-23.1	34.5	0	0	0	111.7	L124 L125 W128 G152 A156 V157 R158	L124-P154 HydrophobicContact CB-CG 4.4Å; L124-P154 HydrophobicContact CD2-CG 4.38Å; L124-P154 HydrophobicContact CG-CG 4Å; L125-P154 HydrophobicContact CB-CB 4.37Å; L125-P154 HydrophobicContact CB-CG 4.29Å; L125-P154 HydrophobicContact CD1-CB 4.12Å; W128-P154 HydrophobicContact CG-CG 4.48Å; G152-P154 WeakPolarHBondContact O-CD 3.1Å; P154-A156 PolarHBondContact O-N 3.35Å; P154-A156 VanDerWaalsContact O-N 3.08Å; P154-V157 HydrophobicContact CB-CG2 4.3Å; P154-V157 HydrophobicContact CG-CG2 4.45Å; P154-V157 VanDerWaalsContact O-CG2 3.26Å; P154-V157 WeakPolarHBondContact O-CG2 3.05Å; P154-V157 PolarHBondContact O-N 3.05Å; P154-R158 PolarHBondContact O-N 3.48Å; P154-R158 VanDerWaalsContact O-N 3.15Å
155	S	87.3	Confident	90.5	Very high	9 Å²	9	32.8 Å²	32.8	6%	0.063	17%	0.169	C	C	.	.	H	α-helix	trans	-51.8	-40.6	-175.3	-67.2	0	0	0	0	113.8	I69 D71 V157 R158	I69-S155 WeakPolarHBondContact O-CB 3.25Å; D71-S155 PolarHBondContact N-OG 2.89Å; D71-S155 PolarHBondContact OD1-OG 3.43Å; D71-S155 WeakPolarHBondContact OD2-CB 3.4Å; D71-S155 PolarHBondContact OD2-N 3.06Å; D71-S155 PolarHBondContact OD2-OG 3.31Å; S155-V157 PolarHBondContact O-N 3.24Å; S155-R158 PolarHBondContact O-N 2.9Å; S155-R158 PolarHBondContact OG-NH1 3.4Å; S155-R158 PolarHBondContact OG-NH2 3.3Å
156	A	88	Confident	90.8	Very high	41 Å²	41	31.9 Å²	31.9	34%	0.339	16%	0.163	S	C	.	.	H	α-helix	trans	-65	-5	-176.9	0	0	0	0	0	115.3	L125 P154	L125-A156 HydrophobicContact CD1-CB 4.1Å; L125-A156 HydrophobicContact CD2-CB 4.42Å; P154-A156 PolarHBondContact O-N 3.35Å; P154-A156 VanDerWaalsContact O-N 3.08Å
157	V	91.9	Very high	91	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-130.3	-2.5	171.9	-67.6	0	0	0	0	112.9	L125 W128 R129 L133 V153 P154 S155 N159 Q160 V161	L125-V157 HydrophobicContact CD1-CG1 3.82Å; L125-V157 HydrophobicContact CD1-CG2 4.3Å; W128-V157 HydrophobicContact CB-CG2 4.06Å; W128-V157 HydrophobicContact CG-CG2 4.37Å; R129-V157 HydrophobicContact CG-CG1 3.83Å; L133-V157 HydrophobicContact CD1-CB 4.01Å; L133-V157 HydrophobicContact CD1-CG1 3.87Å; V153-V157 HydrophobicContact CG1-CG2 4.2Å; P154-V157 HydrophobicContact CB-CG2 4.3Å; P154-V157 HydrophobicContact CG-CG2 4.45Å; P154-V157 VanDerWaalsContact O-CG2 3.26Å; P154-V157 WeakPolarHBondContact O-CG2 3.05Å; P154-V157 PolarHBondContact O-N 3.05Å; S155-V157 PolarHBondContact O-N 3.24Å; V157-N159 PolarHBondContact O-N 3.25Å; V157-Q160 WeakPolarHBondContact O-CB 3.38Å; V157-Q160 PolarHBondContact O-N 3.2Å; V157-Q160 VanDerWaalsContact O-N 3.1Å; V157-V161 WeakPolarHBondContact O-CG2 3.29Å; V157-V161 PolarHBondContact O-N 3.45Å
158	R	94.3	Very high	91.3	Very high	8 Å²	8	28.7 Å²	28.7	3%	0.03	16%	0.162	C	C	.	.	H	α-helix	trans	-65.3	-39.6	-168.8	-165.2	176.8	-60	123.8	-3.8	112.6	D71 V153 P154 S155 Q160 V161 W162 V359 D445	D71-R158 IonicContact OD1-CZ 2.68Å; D71-R158 IonicContact OD1-NH1 2.88Å; D71-R158 IonicContact OD1-NH2 2.64Å; D71-R158 PolarHBondContact OD1-NH2 3.1Å; D71-R158 IonicContact OD2-NH2 3.77Å; D71-R158 PolarHBondContact OD2-NH2 2.91Å; V153-R158 HydrophobicContact CB-CG 4.23Å; V153-R158 HydrophobicContact CG1-CB 4Å; V153-R158 HydrophobicContact CG1-CG 3.98Å; V153-R158 VanDerWaalsContact O-CZ 3.22Å; V153-R158 PolarHBondContact O-NE 3.32Å; V153-R158 PolarHBondContact O-NH2 3.42Å; P154-R158 PolarHBondContact O-N 3.48Å; P154-R158 VanDerWaalsContact O-N 3.15Å; S155-R158 PolarHBondContact O-N 2.9Å; S155-R158 PolarHBondContact OG-NH1 3.4Å; S155-R158 PolarHBondContact OG-NH2 3.3Å; R158-Q160 VanDerWaalsContact C-N 3.33Å; R158-Q160 PolarHBondContact O-N 3.25Å; R158-V161 PolarHBondContact O-N 2.91Å; R158-W162 VanDerWaalsContact CD-CZ2 3.49Å; R158-W162 HydrophobicContact CG-CD2 3.98Å; R158-W162 VanDerWaalsContact CG-CE2 3.49Å; R158-W162 HydrophobicContact CG-CG 4.19Å; R158-W162 HydrophobicContact CG-CZ2 3.94Å; R158-W162 VanDerWaalsContact CG-NE1 3.3Å; R158-W162 WeakPolarHBondContact O-CB 3.18Å; R158-W162 VanDerWaalsContact O-CG 3.29Å; R158-W162 PolarHBondContact O-N 3.39Å; R158-V359 HydrophobicContact CB-CG1 4.16Å; R158-V359 HydrophobicContact CG-CG1 4.14Å; R158-D445 WeakPolarHBondContact CD-OD1 3.44Å; R158-D445 IonicContact NE-OD1 3.04Å; R158-D445 IonicContact NE-OD2 2.66Å
159	N	93.2	Very high	91.3	Very high	51 Å²	51	32.7 Å²	32.7	27%	0.273	18%	0.181	S	C	.	.	H	α-helix	trans	-57.3	-42.4	172.1	59.8	-11.3	0	0	0	112.9	V157 S163 V359 F360	V157-N159 PolarHBondContact O-N 3.25Å; N159-S163 WeakPolarHBondContact O-CB 3.48Å; N159-S163 PolarHBondContact O-N 3.38Å; N159-S163 VanDerWaalsContact O-N 3.08Å; N159-V359 HydrophobicContact CB-CG1 4.18Å; N159-F360 HydrophobicContact CB-CD1 3.74Å; N159-F360 HydrophobicContact CB-CE1 3.78Å; N159-F360 HydrophobicContact CB-CG 4.2Å; N159-F360 HydrophobicContact CB-CZ 4.24Å; N159-F360 VanDerWaalsContact O-CE1 3.27Å; N159-F360 WeakPolarHBondContact O-CE1 3.33Å; N159-F360 WeakPolarHBondContact O-CZ 3.47Å
160	Q	92.3	Very high	91.4	Very high	104 Å²	104	34.9 Å²	34.9	49%	0.486	19%	0.192	S	C	.	.	H	α-helix	trans	-66.9	-48.5	177.1	-61	178.1	20.5	0	0	111	V157 R158 S163 L164	V157-Q160 WeakPolarHBondContact O-CB 3.38Å; V157-Q160 PolarHBondContact O-N 3.2Å; V157-Q160 VanDerWaalsContact O-N 3.1Å; R158-Q160 VanDerWaalsContact C-N 3.33Å; R158-Q160 PolarHBondContact O-N 3.25Å; Q160-S163 PolarHBondContact O-N 3.02Å; Q160-L164 WeakPolarHBondContact O-CB 3.36Å; Q160-L164 WeakPolarHBondContact O-CG 3.34Å; Q160-L164 PolarHBondContact O-N 2.75Å
161	V	93.1	Very high	91.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.3	-45.7	-179	174.8	0	0	0	0	111.8	W128 L133 W136 F149 V153 V157 R158 L164 L165	W128-V161 HydrophobicContact CE3-CG2 3.75Å; W128-V161 HydrophobicContact CH2-CG1 4.15Å; W128-V161 HydrophobicContact CH2-CG2 4.46Å; W128-V161 HydrophobicContact CZ3-CB 4.4Å; W128-V161 HydrophobicContact CZ3-CG1 3.86Å; W128-V161 HydrophobicContact CZ3-CG2 3.56Å; L133-V161 HydrophobicContact CD2-CG2 3.99Å; W136-V161 HydrophobicContact CH2-CG1 4.37Å; F149-V161 HydrophobicContact CE1-CG1 3.8Å; F149-V161 HydrophobicContact CZ-CG1 3.82Å; V153-V161 HydrophobicContact CG1-CB 3.92Å; V153-V161 HydrophobicContact CG1-CG1 4.13Å; V153-V161 HydrophobicContact CG1-CG2 3.88Å; V153-V161 HydrophobicContact CG2-CG1 4.25Å; V157-V161 WeakPolarHBondContact O-CG2 3.29Å; V157-V161 PolarHBondContact O-N 3.45Å; R158-V161 PolarHBondContact O-N 2.91Å; V161-L164 PolarHBondContact O-N 3.11Å; V161-L165 HydrophobicContact CG1-CD1 3.93Å; V161-L165 WeakPolarHBondContact O-CG 3.22Å; V161-L165 PolarHBondContact O-N 3.45Å
162	W	94.5	Very high	91.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-42.7	178.6	-70.9	10.6	0	0	0	111.7	R158 L164 L165 L166 V359 F360 W444 D445 F448	R158-W162 VanDerWaalsContact CD-CZ2 3.49Å; R158-W162 HydrophobicContact CG-CD2 3.98Å; R158-W162 VanDerWaalsContact CG-CE2 3.49Å; R158-W162 HydrophobicContact CG-CG 4.19Å; R158-W162 HydrophobicContact CG-CZ2 3.94Å; R158-W162 VanDerWaalsContact CG-NE1 3.3Å; R158-W162 WeakPolarHBondContact O-CB 3.18Å; R158-W162 VanDerWaalsContact O-CG 3.29Å; R158-W162 PolarHBondContact O-N 3.39Å; W162-L164 PolarHBondContact O-N 3.47Å; W162-L165 PolarHBondContact O-N 3.42Å; W162-L166 WeakPolarHBondContact O-CB 3.33Å; W162-L166 PolarHBondContact O-N 3.44Å; W162-V359 HydrophobicContact CD2-CG1 4.33Å; W162-V359 HydrophobicContact CE3-CB 4.22Å; W162-V359 HydrophobicContact CE3-CG1 3.84Å; W162-V359 HydrophobicContact CE3-CG2 4.28Å; W162-V359 HydrophobicContact CH2-CG2 3.77Å; W162-V359 HydrophobicContact CZ3-CB 3.93Å; W162-V359 HydrophobicContact CZ3-CG1 4.01Å; W162-V359 HydrophobicContact CZ3-CG2 3.57Å; W162-F360 HydrophobicContact CB-CE2 4.5Å; W162-F360 HydrophobicContact CB-CZ 4.24Å; W162-F360 HydrophobicContact CE3-CE2 4.23Å; W162-W444 HydrophobicContact CE3-CE3 4.36Å; W162-W444 HydrophobicContact CH2-CB 3.57Å; W162-W444 HydrophobicContact CH2-CD2 4.09Å; W162-W444 AromaticContact CH2-CE3 3.55Å; W162-W444 HydrophobicContact CH2-CE3 3.55Å; W162-W444 HydrophobicContact CH2-CG 4.16Å; W162-W444 HydrophobicContact CH2-CZ3 4.49Å; W162-W444 HydrophobicContact CZ2-CB 3.46Å; W162-W444 VanDerWaalsContact CZ2-CB 3.46Å; W162-W444 HydrophobicContact CZ2-CE3 4.46Å; W162-W444 HydrophobicContact CZ2-CG 4.5Å; W162-W444 HydrophobicContact CZ3-CD2 4.46Å; W162-W444 AromaticContact CZ3-CE3 3.49Å; W162-W444 HydrophobicContact CZ3-CE3 3.49Å; W162-W444 VanDerWaalsContact CZ3-CE3 3.49Å; W162-W444 HydrophobicContact CZ3-CZ3 4.08Å; W162-D445 PolarHBondContact NE1-OD1 2.69Å; W162-F448 HydrophobicContact CB-CD2 4.05Å; W162-F448 HydrophobicContact CB-CE2 4.04Å; W162-F448 HydrophobicContact CB-CG 4.41Å; W162-F448 HydrophobicContact CB-CZ 4.36Å; W162-F448 AromaticContact CD1-CD2 3.58Å; W162-F448 AromaticContact CD2-CD2 3.55Å; W162-F448 HydrophobicContact CD2-CD2 3.55Å; W162-F448 AromaticContact CD2-CE2 3.22Å; W162-F448 HydrophobicContact CD2-CE2 3.22Å; W162-F448 HydrophobicContact CD2-CZ 4.12Å; W162-F448 AromaticContact CE2-CD2 3.67Å; W162-F448 AromaticContact CE2-CE2 3.62Å; W162-F448 HydrophobicContact CE3-CD2 4.2Å; W162-F448 AromaticContact CE3-CE2 3.39Å; W162-F448 HydrophobicContact CE3-CE2 3.39Å; W162-F448 AromaticContact CE3-CZ 3.99Å; W162-F448 HydrophobicContact CE3-CZ 3.99Å; W162-F448 AromaticContact CG-CD2 3.47Å; W162-F448 HydrophobicContact CG-CD2 3.47Å; W162-F448 VanDerWaalsContact CG-CD2 3.47Å; W162-F448 AromaticContact CG-CE2 3.55Å; W162-F448 HydrophobicContact CG-CE2 3.55Å; W162-F448 HydrophobicContact CG-CG 4.21Å; W162-F448 HydrophobicContact CG-CZ 4.32Å; W162-F448 HydrophobicContact CH2-CE2 4.26Å; W162-F448 HydrophobicContact CZ2-CD2 4.39Å; W162-F448 HydrophobicContact CZ2-CE2 4.13Å; W162-F448 AromaticContact CZ3-CE2 3.92Å; W162-F448 HydrophobicContact CZ3-CE2 3.92Å; W162-F448 AromaticContact NE1-CD2 3.71Å
163	S	92.8	Very high	92.2	Very high	59 Å²	59	38.1 Å²	38.1	41%	0.413	22%	0.224	S	C	.	.	H	α-helix	trans	-61.3	-42	175.2	-176.9	0	0	0	0	112.2	N159 Q160 G167	N159-S163 WeakPolarHBondContact O-CB 3.48Å; N159-S163 PolarHBondContact O-N 3.38Å; N159-S163 VanDerWaalsContact O-N 3.08Å; Q160-S163 PolarHBondContact O-N 3.02Å; S163-G167 WeakPolarHBondContact O-CA 3.41Å; S163-G167 PolarHBondContact O-N 2.89Å
164	L	91.9	Very high	92.4	Very high	84 Å²	84	43 Å²	43	44%	0.44	24%	0.242	S	C	.	.	H	α-helix	trans	-68.6	-31.2	177.8	-74.9	170.8	0	0	0	114	L133 W136 Q160 V161 W162	L133-L164 HydrophobicContact CD2-CD1 3.74Å; W136-L164 HydrophobicContact CD2-CB 4.49Å; W136-L164 HydrophobicContact CD2-CD1 4.05Å; W136-L164 HydrophobicContact CG-CD1 4.07Å; W136-L164 HydrophobicContact CZ2-CB 3.8Å; Q160-L164 WeakPolarHBondContact O-CB 3.36Å; Q160-L164 WeakPolarHBondContact O-CG 3.34Å; Q160-L164 PolarHBondContact O-N 2.75Å; V161-L164 PolarHBondContact O-N 3.11Å; W162-L164 PolarHBondContact O-N 3.47Å
165	L	91.8	Very high	92.6	Very high	17 Å²	17	48.6 Å²	48.6	9%	0.089	27%	0.268	C	S	.	.	H	α-helix	trans	-80.5	-43.1	177.4	-74.9	168.3	0	0	0	112.9	W136 Y140 F149 V161 W162 F448	W136-L165 HydrophobicContact CH2-CD2 3.82Å; W136-L165 HydrophobicContact CH2-CG 3.89Å; W136-L165 HydrophobicContact CZ2-CD2 3.79Å; W136-L165 HydrophobicContact CZ2-CG 3.91Å; Y140-L165 HydrophobicContact CE2-CD2 4.3Å; F149-L165 HydrophobicContact CE1-CD1 3.57Å; F149-L165 HydrophobicContact CZ-CD1 3.7Å; V161-L165 HydrophobicContact CG1-CD1 3.93Å; V161-L165 WeakPolarHBondContact O-CG 3.22Å; V161-L165 PolarHBondContact O-N 3.45Å; W162-L165 PolarHBondContact O-N 3.42Å; L165-F448 HydrophobicContact CB-CB 3.95Å; L165-F448 HydrophobicContact CD1-CB 3.55Å; L165-F448 HydrophobicContact CG-CB 4.41Å
166	L	91	Very high	93	Very high	6 Å²	6	51.2 Å²	51.2	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-74.5	-39.6	-179.5	-173.2	65.1	0	0	0	111.5	W162 T369 N372 I373 F448	W162-L166 WeakPolarHBondContact O-CB 3.33Å; W162-L166 PolarHBondContact O-N 3.44Å; L166-T369 HydrophobicContact CD2-CG2 3.92Å; L166-T369 WeakPolarHBondContact CD2-O 2.99Å; L166-N372 HydrophobicContact CD1-CB 4.29Å; L166-N372 HydrophobicContact CD2-CB 3.57Å; L166-N372 HydrophobicContact CG-CB 3.79Å; L166-I373 HydrophobicContact CD1-CG1 4.5Å; L166-I373 HydrophobicContact CD2-CG1 4.04Å; L166-F448 HydrophobicContact CB-CD1 4.08Å; L166-F448 HydrophobicContact CB-CE1 4.03Å; L166-F448 HydrophobicContact CD1-CD1 4.43Å; L166-F448 HydrophobicContact CD1-CE1 4.12Å; L166-F448 HydrophobicContact CD2-CE1 4.07Å; L166-F448 HydrophobicContact CG-CE1 4.3Å
167	G	90.3	Very high	93.4	Very high	31 Å²	31	49.7 Å²	49.7	32%	0.32	27%	0.267	S	S	.	.			trans	65	-175	-166.9	0	0	0	0	0	112.6	S163	S163-G167 WeakPolarHBondContact O-CA 3.41Å; S163-G167 PolarHBondContact O-N 2.89Å
168	N	92.4	Very high	93.5	Very high	65 Å²	65	53.2 Å²	53.2	35%	0.348	29%	0.285	S	S	.	.			trans	-116.8	67.3	171.5	-173.4	11.7	0	0	0	109.4	L170 G171 I172 V368 N372	N168-L170 PolarHBondContact O-N 2.77Å; N168-G171 PolarHBondContact O-N 2.96Å; N168-G171 PolarHBondContact OD1-N 3.38Å; N168-I172 PolarHBondContact ND2-N 3.01Å; N168-I172 PolarHBondContact ND2-O 3.26Å; N168-I172 PolarHBondContact OD1-N 3.09Å; N168-I172 VanDerWaalsContact OD1-N 3.12Å; N168-V368 HydrophobicContact CB-CG1 4.08Å; N168-N372 PolarHBondContact OD1-ND2 3.15Å
169	K	91.1	Very high	93.6	Very high	160 Å²	160	56.3 Å²	56.3	70%	0.696	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.6	-178.8	-63.1	-175.7	-178.2	-177.5	0	112.3	G171 N372	K169-G171 VanDerWaalsContact C-N 3.3Å; K169-N372 PolarHBondContact N-OD1 2.75Å
170	L	92.7	Very high	93.6	Very high	46 Å²	46	54.1 Å²	54.1	24%	0.241	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-8.6	175	-70.2	175.1	0	0	0	114.6	N168 I172 Y339 A371 N372 N375	N168-L170 PolarHBondContact O-N 2.77Å; L170-I172 HydrophobicContact CB-CD1 3.88Å; L170-I172 HydrophobicContact CB-CG1 3.8Å; L170-I172 HydrophobicContact CD1-CD1 3.76Å; L170-I172 PolarHBondContact O-N 2.9Å; L170-Y339 HydrophobicContact CD1-CE1 4.3Å; L170-A371 HydrophobicContact CD1-CB 3.83Å; L170-A371 WeakPolarHBondContact CD1-O 3.27Å; L170-N372 PolarHBondContact N-OD1 3.27Å; L170-N375 HydrophobicContact CD1-CB 3.93Å; L170-N375 HydrophobicContact CD2-CB 4.06Å; L170-N375 HydrophobicContact CG-CB 4.06Å
171	G	93.5	Very high	93.6	Very high	48 Å²	48	50.2 Å²	50.2	50%	0.495	28%	0.276	S	S	.	.			trans	62.7	21.7	-179.3	0	0	0	0	0	114.6	N168 K169 T173	N168-G171 PolarHBondContact O-N 2.96Å; N168-G171 PolarHBondContact OD1-N 3.38Å; K169-G171 VanDerWaalsContact C-N 3.3Å; G171-T173 WeakPolarHBondContact O-CG2 3.44Å; G171-T173 PolarHBondContact O-N 2.86Å
172	I	94.7	Very high	93.6	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.01	30%	0.302	C	S	.	.			trans	-60.8	126.6	-176.2	-66.6	165.7	0	0	0	109.7	N168 L170 L176 Y339 Y364 F367 V368 A371	N168-I172 PolarHBondContact ND2-N 3.01Å; N168-I172 PolarHBondContact ND2-O 3.26Å; N168-I172 PolarHBondContact OD1-N 3.09Å; N168-I172 VanDerWaalsContact OD1-N 3.12Å; L170-I172 HydrophobicContact CB-CD1 3.88Å; L170-I172 HydrophobicContact CB-CG1 3.8Å; L170-I172 HydrophobicContact CD1-CD1 3.76Å; L170-I172 PolarHBondContact O-N 2.9Å; I172-L176 HydrophobicContact CG1-CD2 4.47Å; I172-Y339 HydrophobicContact CD1-CE1 4.05Å; I172-Y339 HydrophobicContact CG1-CE2 4.5Å; I172-Y364 HydrophobicContact CG2-CE2 4.41Å; I172-Y364 PolarHBondContact O-OH 3.42Å; I172-Y364 VanDerWaalsContact O-OH 3.08Å; I172-F367 HydrophobicContact CD1-CE1 4.12Å; I172-F367 HydrophobicContact CG2-CD1 4.02Å; I172-F367 HydrophobicContact CG2-CE1 3.83Å; I172-V368 HydrophobicContact CB-CG2 4.17Å; I172-V368 HydrophobicContact CG2-CG2 3.82Å; I172-A371 HydrophobicContact CD1-CB 3.45Å; I172-A371 VanDerWaalsContact CD1-CB 3.45Å
173	T	96	Very high	93.4	Very high	61 Å²	61	58.1 Å²	58.1	37%	0.374	32%	0.321	S	S	.	.			trans	-106.1	165.9	176.6	84.8	0	0	0	0	111.7	G171 E175 L176 F177 Y364	G171-T173 WeakPolarHBondContact O-CG2 3.44Å; G171-T173 PolarHBondContact O-N 2.86Å; T173-E175 VanDerWaalsContact C-N 3.27Å; T173-E175 WeakPolarHBondContact CB-OE2 3.28Å; T173-E175 PolarHBondContact O-N 3.47Å; T173-E175 PolarHBondContact OG1-N 3.32Å; T173-E175 PolarHBondContact OG1-OE2 3.2Å; T173-L176 PolarHBondContact O-N 3.4Å; T173-L176 PolarHBondContact OG1-N 3.23Å; T173-F177 PolarHBondContact O-N 3.03Å; T173-F177 VanDerWaalsContact O-N 3.08Å; T173-Y364 VanDerWaalsContact C-CE2 3.47Å; T173-Y364 WeakPolarHBondContact O-CE2 3.37Å
174	R	95.5	Very high	93.2	Very high	103 Å²	103	55.4 Å²	55.4	39%	0.389	30%	0.302	S	S	.	.	H	α-helix	trans	-66.7	-32.4	179.6	-175.4	171	-71.9	-98.1	-3.8	111.7	N178 N362 Y364	R174-N178 WeakPolarHBondContact O-CB 3.49Å; R174-N178 PolarHBondContact O-N 3.16Å; R174-N178 PolarHBondContact O-ND2 2.98Å; R174-N362 PolarHBondContact NH2-ND2 3.4Å; R174-N362 VanDerWaalsContact NH2-ND2 3.11Å; R174-Y364 HydrophobicContact CB-CD2 4.21Å; R174-Y364 HydrophobicContact CB-CE2 3.93Å; R174-Y364 HydrophobicContact CG-CD2 4.37Å; R174-Y364 PolarHBondContact N-OH 2.99Å
175	E	96	Very high	93	Very high	124 Å²	124	54.9 Å²	54.9	58%	0.579	30%	0.297	S	S	*	.	H	α-helix	trans	-64.4	-49.1	175.1	-55.5	66.7	-139.6	0	0	109.7	T173 F177 N178 T179	T173-E175 VanDerWaalsContact C-N 3.27Å; T173-E175 WeakPolarHBondContact CB-OE2 3.28Å; T173-E175 PolarHBondContact O-N 3.47Å; T173-E175 PolarHBondContact OG1-N 3.32Å; T173-E175 PolarHBondContact OG1-OE2 3.2Å; E175-F177 PolarHBondContact O-N 3.35Å; E175-N178 PolarHBondContact O-N 2.86Å; E175-T179 PolarHBondContact O-N 2.95Å; E175-T179 PolarHBondContact O-OG1 3.08Å
176	L	95.5	Very high	92.8	Very high	65 Å²	65	59.4 Å²	59.4	34%	0.34	32%	0.317	S	S	.	.	H	α-helix	trans	-58.2	-48.4	176.6	179.3	62.3	0	0	0	111.9	I172 T173 N178 T179 C180 Y339	I172-L176 HydrophobicContact CG1-CD2 4.47Å; T173-L176 PolarHBondContact O-N 3.4Å; T173-L176 PolarHBondContact OG1-N 3.23Å; L176-N178 PolarHBondContact O-N 3.35Å; L176-T179 PolarHBondContact O-N 3.49Å; L176-C180 PolarHBondContact O-N 3.13Å; L176-C180 PolarHBondContact O-SG 3.36Å; L176-Y339 HydrophobicContact CD2-CD2 4.21Å; L176-Y339 HydrophobicContact CD2-CE2 3.87Å
177	F	96	Very high	92.3	Very high	9 Å²	9	63.1 Å²	63.1	4%	0.039	33%	0.334	C	S	.	.	H	α-helix	trans	-58.7	-45.6	176	169.5	-105.9	0	0	0	112.1	T173 E175 T179 C180 L181 A335 T363 Y364 F367	T173-F177 PolarHBondContact O-N 3.03Å; T173-F177 VanDerWaalsContact O-N 3.08Å; E175-F177 PolarHBondContact O-N 3.35Å; F177-T179 VanDerWaalsContact C-N 3.33Å; F177-T179 PolarHBondContact O-N 3.25Å; F177-C180 PolarHBondContact O-N 2.92Å; F177-L181 HydrophobicContact CE1-CD2 4.17Å; F177-L181 HydrophobicContact CZ-CD2 4.09Å; F177-L181 VanDerWaalsContact O-CB 3.28Å; F177-L181 WeakPolarHBondContact O-CB 3.17Å; F177-L181 PolarHBondContact O-N 2.93Å; F177-A335 HydrophobicContact CD2-CB 4.17Å; F177-A335 HydrophobicContact CE2-CB 3.87Å; F177-T363 HydrophobicContact CE2-CG2 4.47Å; F177-T363 HydrophobicContact CZ-CG2 3.78Å; F177-Y364 HydrophobicContact CB-CD2 3.75Å; F177-Y364 HydrophobicContact CB-CE2 4.11Å; F177-Y364 AromaticContact CD1-CD2 3.94Å; F177-Y364 HydrophobicContact CD1-CD2 3.94Å; F177-Y364 AromaticContact CG-CD2 3.93Å; F177-Y364 HydrophobicContact CG-CD2 3.93Å; F177-F367 HydrophobicContact CB-CD1 4.28Å; F177-F367 HydrophobicContact CB-CE1 4.46Å; F177-F367 HydrophobicContact CD2-CB 3.8Å; F177-F367 AromaticContact CD2-CD1 3.56Å; F177-F367 HydrophobicContact CD2-CD1 3.56Å; F177-F367 AromaticContact CD2-CD2 3.76Å; F177-F367 HydrophobicContact CD2-CD2 3.76Å; F177-F367 HydrophobicContact CD2-CE1 4.02Å; F177-F367 HydrophobicContact CD2-CE2 4.19Å; F177-F367 AromaticContact CD2-CG 3.41Å; F177-F367 HydrophobicContact CD2-CG 3.41Å; F177-F367 VanDerWaalsContact CD2-CG 3.41Å; F177-F367 HydrophobicContact CD2-CZ 4.32Å; F177-F367 HydrophobicContact CE2-CB 3.8Å; F177-F367 HydrophobicContact CE2-CD1 4.35Å; F177-F367 AromaticContact CE2-CD2 3.85Å; F177-F367 HydrophobicContact CE2-CD2 3.85Å; F177-F367 AromaticContact CE2-CG 3.74Å; F177-F367 HydrophobicContact CE2-CG 3.74Å; F177-F367 HydrophobicContact CG-CD1 4.27Å; F177-F367 HydrophobicContact CG-CG 4.44Å
178	N	95.5	Very high	91.6	Very high	74 Å²	74	63.8 Å²	63.8	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-38.5	177.9	-72.7	-18.8	0	0	0	111.7	R174 E175 L176 L181 S182	R174-N178 WeakPolarHBondContact O-CB 3.49Å; R174-N178 PolarHBondContact O-N 3.16Å; R174-N178 PolarHBondContact O-ND2 2.98Å; E175-N178 PolarHBondContact O-N 2.86Å; L176-N178 PolarHBondContact O-N 3.35Å; N178-L181 PolarHBondContact O-N 3.25Å; N178-S182 WeakPolarHBondContact O-CB 3.37Å; N178-S182 PolarHBondContact O-N 3.44Å; N178-S182 PolarHBondContact O-OG 3.3Å
179	T	94.8	Very high	91	Very high	73 Å²	73	66.6 Å²	66.6	45%	0.448	34%	0.343	S	S	.	.	H	α-helix	trans	-62.9	-51.4	175.2	-62.2	0	0	0	0	111.2	E175 L176 F177 L181 S182 Q183	E175-T179 PolarHBondContact O-N 2.95Å; E175-T179 PolarHBondContact O-OG1 3.08Å; L176-T179 PolarHBondContact O-N 3.49Å; F177-T179 VanDerWaalsContact C-N 3.33Å; F177-T179 PolarHBondContact O-N 3.25Å; T179-L181 VanDerWaalsContact C-N 3.31Å; T179-L181 PolarHBondContact O-N 2.85Å; T179-S182 PolarHBondContact O-N 2.73Å; T179-S182 VanDerWaalsContact O-N 3.12Å; T179-Q183 WeakPolarHBondContact O-CG 3.37Å; T179-Q183 PolarHBondContact O-N 3.02Å
180	C	93.8	Very high	90.3	Very high	5 Å²	5	60.9 Å²	60.9	3%	0.034	32%	0.321	C	S	.	.	H	α-helix	trans	-59.3	-41.5	176.3	-65.3	0	0	0	0	111.7	L176 F177 S182 Q183 S184 A335 S338	L176-C180 PolarHBondContact O-N 3.13Å; L176-C180 PolarHBondContact O-SG 3.36Å; F177-C180 PolarHBondContact O-N 2.92Å; C180-S182 VanDerWaalsContact C-N 3.35Å; C180-S182 PolarHBondContact O-N 3.25Å; C180-Q183 PolarHBondContact O-N 2.72Å; C180-S184 VanDerWaalsContact O-CB 3.3Å; C180-S184 WeakPolarHBondContact O-CB 3.45Å; C180-S184 PolarHBondContact O-N 2.77Å; C180-A335 HydrophobicContact CB-CB 4.27Å; C180-A335 WeakPolarHBondContact CB-O 3.48Å; C180-S338 WeakPolarHBondContact O-CB 3.5Å; C180-S338 PolarHBondContact O-OG 3.07Å
181	L	93.4	Very high	89	Confident	22 Å²	22	60.3 Å²	60.3	12%	0.115	32%	0.319	C	S	.	.	H	α-helix	trans	-64.7	-37.4	175.6	-177.7	58.7	0	0	0	112.5	F177 N178 T179 S184 K185 D331 A335	F177-L181 HydrophobicContact CE1-CD2 4.17Å; F177-L181 HydrophobicContact CZ-CD2 4.09Å; F177-L181 VanDerWaalsContact O-CB 3.28Å; F177-L181 WeakPolarHBondContact O-CB 3.17Å; F177-L181 PolarHBondContact O-N 2.93Å; N178-L181 PolarHBondContact O-N 3.25Å; T179-L181 VanDerWaalsContact C-N 3.31Å; T179-L181 PolarHBondContact O-N 2.85Å; L181-S184 WeakPolarHBondContact CA-OG 3Å; L181-S184 PolarHBondContact O-N 3.14Å; L181-S184 PolarHBondContact O-OG 2.82Å; L181-K185 HydrophobicContact CD1-CD 4.36Å; L181-K185 HydrophobicContact CG-CD 4.36Å; L181-K185 WeakPolarHBondContact O-CG 3.06Å; L181-K185 PolarHBondContact O-N 3.27Å; L181-K185 VanDerWaalsContact O-N 3.16Å; L181-D331 HydrophobicContact CD1-CB 3.6Å; L181-D331 WeakPolarHBondContact CD1-O 3.45Å; L181-A335 HydrophobicContact CB-CB 4.11Å; L181-A335 HydrophobicContact CD1-CB 4.37Å
182	S	92.9	Very high	87.5	Confident	77 Å²	77	62.3 Å²	62.3	54%	0.538	32%	0.317	S	S	.	.	H	α-helix	trans	-70.1	-43.2	178.2	-56.7	0	0	0	0	111.3	N178 T179 C180 S184 K185 H186	N178-S182 WeakPolarHBondContact O-CB 3.37Å; N178-S182 PolarHBondContact O-N 3.44Å; N178-S182 PolarHBondContact O-OG 3.3Å; T179-S182 PolarHBondContact O-N 2.73Å; T179-S182 VanDerWaalsContact O-N 3.12Å; C180-S182 VanDerWaalsContact C-N 3.35Å; C180-S182 PolarHBondContact O-N 3.25Å; S182-S184 VanDerWaalsContact C-N 3.34Å; S182-S184 PolarHBondContact O-N 3.35Å; S182-K185 PolarHBondContact O-N 2.94Å; S182-H186 PolarHBondContact O-N 3.26Å
183	Q	90.2	Very high	85.3	Confident	89 Å²	89	65.4 Å²	65.4	42%	0.416	34%	0.339	S	S	.	.	H	α-helix	trans	-57.6	-46.8	170.9	-71.2	168.1	-23.1	0	0	111.2	T179 C180 K185 H186 H187	T179-Q183 WeakPolarHBondContact O-CG 3.37Å; T179-Q183 PolarHBondContact O-N 3.02Å; C180-Q183 PolarHBondContact O-N 2.72Å; Q183-K185 VanDerWaalsContact C-N 3.27Å; Q183-K185 PolarHBondContact O-N 3.32Å; Q183-H186 PolarHBondContact O-N 2.92Å; Q183-H187 PolarHBondContact O-CD2 2.92Å; Q183-H187 PolarHBondContact O-N 3.43Å
184	S	88.5	Confident	82.9	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.014	36%	0.355	C	S	.	.	H	α-helix	trans	-58.2	-37.9	179.9	83.6	0	0	0	0	112.9	C180 L181 S182 V188 Y298 A334 S338	C180-S184 VanDerWaalsContact O-CB 3.3Å; C180-S184 WeakPolarHBondContact O-CB 3.45Å; C180-S184 PolarHBondContact O-N 2.77Å; L181-S184 WeakPolarHBondContact CA-OG 3Å; L181-S184 PolarHBondContact O-N 3.14Å; L181-S184 PolarHBondContact O-OG 2.82Å; S182-S184 VanDerWaalsContact C-N 3.34Å; S182-S184 PolarHBondContact O-N 3.35Å; S184-V188 WeakPolarHBondContact O-CG2 3.33Å; S184-V188 PolarHBondContact O-N 2.94Å; S184-Y298 VanDerWaalsContact CA-OH 3.23Å; S184-Y298 WeakPolarHBondContact CA-OH 2.98Å; S184-Y298 WeakPolarHBondContact CB-OH 3.49Å; S184-Y298 PolarHBondContact O-OH 3.25Å; S184-Y298 VanDerWaalsContact O-OH 3.12Å; S184-A334 WeakPolarHBondContact CB-O 3.49Å; S184-S338 WeakPolarHBondContact CB-OG 3.49Å; S184-S338 PolarHBondContact N-OG 2.82Å
185	K	87.7	Confident	80.4	Confident	73 Å²	73	69.7 Å²	69.7	32%	0.317	36%	0.359	S	S	.	.	H	α-helix	trans	-74.5	-43.7	178	-75.1	167.9	178.2	165	0	111.7	L181 S182 Q183 H187 V188 E189 D331	L181-K185 HydrophobicContact CD1-CD 4.36Å; L181-K185 HydrophobicContact CG-CD 4.36Å; L181-K185 WeakPolarHBondContact O-CG 3.06Å; L181-K185 PolarHBondContact O-N 3.27Å; L181-K185 VanDerWaalsContact O-N 3.16Å; S182-K185 PolarHBondContact O-N 2.94Å; Q183-K185 VanDerWaalsContact C-N 3.27Å; Q183-K185 PolarHBondContact O-N 3.32Å; K185-H187 VanDerWaalsContact C-N 3.29Å; K185-H187 PolarHBondContact O-N 3.49Å; K185-V188 WeakPolarHBondContact O-CB 3.45Å; K185-V188 PolarHBondContact O-N 3.14Å; K185-E189 WeakPolarHBondContact O-CG 3.35Å; K185-E189 PolarHBondContact O-N 2.99Å; K185-D331 WeakPolarHBondContact CE-OD2 3.43Å; K185-D331 IonicContact NZ-OD1 2.66Å; K185-D331 IonicContact NZ-OD2 3.17Å; K185-D331 PolarHBondContact NZ-OD2 3.08Å
186	H	86.6	Confident	77.6	Confident	112 Å²	112	66.7 Å²	66.7	52%	0.519	35%	0.352	S	S	.	.	H	α-helix	trans	-57.4	-41.6	172.8	-174.8	-88.2	0	0	0	111.8	S182 Q183 V188 E189 T190	S182-H186 PolarHBondContact O-N 3.26Å; Q183-H186 PolarHBondContact O-N 2.92Å; H186-V188 VanDerWaalsContact C-N 3.35Å; H186-V188 PolarHBondContact O-N 3.5Å; H186-E189 PolarHBondContact O-N 3.23Å; H186-T190 VanDerWaalsContact CE1-CG2 3.46Å; H186-T190 WeakPolarHBondContact CE1-CG2 3.36Å; H186-T190 WeakPolarHBondContact O-CG2 3.35Å; H186-T190 PolarHBondContact O-N 3.35Å; H186-T190 PolarHBondContact O-OG1 2.9Å; H186-T190 VanDerWaalsContact O-OG1 3.09Å
187	H	81.5	Confident	74.5	Confident	85 Å²	85	66.6 Å²	66.6	39%	0.394	37%	0.366	S	S	.	.	H	α-helix	trans	-62.9	-36.1	174.6	-75.4	-60.8	0	0	0	113.5	Q183 K185 T190 N191 Y298	Q183-H187 PolarHBondContact O-CD2 2.92Å; Q183-H187 PolarHBondContact O-N 3.43Å; K185-H187 VanDerWaalsContact C-N 3.29Å; K185-H187 PolarHBondContact O-N 3.49Å; H187-T190 WeakPolarHBondContact CA-OG1 3.21Å; H187-T190 PolarHBondContact O-OG1 3.41Å; H187-N191 WeakPolarHBondContact O-CB 3.3Å; H187-N191 PolarHBondContact O-N 3.4Å; H187-N191 PolarHBondContact O-ND2 3.47Å; H187-N191 PolarHBondContact O-OD1 3.41Å; H187-Y298 HydrophobicContact CB-CD1 3.63Å; H187-Y298 HydrophobicContact CB-CE1 3.48Å; H187-Y298 VanDerWaalsContact CB-CE1 3.48Å; H187-Y298 HydrophobicContact CB-CG 4.25Å
188	V	76.3	Confident	71.6	Confident	44 Å²	44	73 Å²	73	27%	0.267	40%	0.4	S	S	.	.	H	α-helix	trans	-64.6	-46.3	172.4	174.6	0	0	0	0	110.7	S184 K185 H186 N191 I192 Y298 L302	S184-V188 WeakPolarHBondContact O-CG2 3.33Å; S184-V188 PolarHBondContact O-N 2.94Å; K185-V188 WeakPolarHBondContact O-CB 3.45Å; K185-V188 PolarHBondContact O-N 3.14Å; H186-V188 VanDerWaalsContact C-N 3.35Å; H186-V188 PolarHBondContact O-N 3.5Å; V188-N191 PolarHBondContact O-N 3.06Å; V188-I192 HydrophobicContact CG1-CD1 3.7Å; V188-I192 HydrophobicContact CG1-CG1 4.46Å; V188-I192 VanDerWaalsContact O-CG1 3.28Å; V188-I192 WeakPolarHBondContact O-CG1 3.35Å; V188-I192 PolarHBondContact O-N 3.13Å; V188-Y298 HydrophobicContact CG2-CE1 4.13Å; V188-L302 HydrophobicContact CG2-CD1 3.74Å
189	E	78	Confident	68.5	Low	125 Å²	125	73.7 Å²	73.7	58%	0.584	40%	0.402	S	S	*	.	H	α-helix	trans	-66.2	-40.6	-178.1	-70.1	166.6	-168.6	0	0	112.6	K185 H186 I192 S193	K185-E189 WeakPolarHBondContact O-CG 3.35Å; K185-E189 PolarHBondContact O-N 2.99Å; H186-E189 PolarHBondContact O-N 3.23Å; E189-I192 PolarHBondContact O-N 3.29Å; E189-S193 PolarHBondContact O-N 2.87Å; E189-S193 PolarHBondContact O-OG 3.08Å
190	T	77.1	Confident	65.3	Low	39 Å²	39	78.4 Å²	78.4	24%	0.239	42%	0.419	C	S	.	.	H	α-helix	trans	-65.7	-39.7	174.7	52.7	0	0	0	0	112.2	H186 H187 S193 Q194	H186-T190 VanDerWaalsContact CE1-CG2 3.46Å; H186-T190 WeakPolarHBondContact CE1-CG2 3.36Å; H186-T190 WeakPolarHBondContact O-CG2 3.35Å; H186-T190 PolarHBondContact O-N 3.35Å; H186-T190 PolarHBondContact O-OG1 2.9Å; H186-T190 VanDerWaalsContact O-OG1 3.09Å; H187-T190 WeakPolarHBondContact CA-OG1 3.21Å; H187-T190 PolarHBondContact O-OG1 3.41Å; T190-S193 WeakPolarHBondContact CA-OG 3.31Å; T190-S193 PolarHBondContact O-N 3.28Å; T190-S193 PolarHBondContact O-OG 3.04Å; T190-Q194 WeakPolarHBondContact O-CB 3.35Å; T190-Q194 WeakPolarHBondContact O-CG 3.16Å; T190-Q194 PolarHBondContact O-N 3.04Å
191	N	66	Low	62	Low	35 Å²	35	88.9 Å²	88.9	19%	0.187	46%	0.46	C	S	.	.	H	α-helix	trans	-69.3	-37.7	177.9	-67.4	-7.9	0	0	0	111.6	H187 V188 H195 T299	H187-N191 WeakPolarHBondContact O-CB 3.3Å; H187-N191 PolarHBondContact O-N 3.4Å; H187-N191 PolarHBondContact O-ND2 3.47Å; H187-N191 PolarHBondContact O-OD1 3.41Å; V188-N191 PolarHBondContact O-N 3.06Å; N191-H195 PolarHBondContact O-CD2 2.66Å; N191-H195 PolarHBondContact O-N 3.21Å; N191-T299 HydrophobicContact CB-CG2 4.39Å; N191-T299 WeakPolarHBondContact ND2-CG2 3.25Å
192	I	60.7	Low	58.8	Low	90 Å²	90	96.6 Å²	96.6	46%	0.462	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-42.6	174.6	-70.1	167.4	0	0	0	111.2	V188 E189 H195 S196	V188-I192 HydrophobicContact CG1-CD1 3.7Å; V188-I192 HydrophobicContact CG1-CG1 4.46Å; V188-I192 VanDerWaalsContact O-CG1 3.28Å; V188-I192 WeakPolarHBondContact O-CG1 3.35Å; V188-I192 PolarHBondContact O-N 3.13Å; E189-I192 PolarHBondContact O-N 3.29Å; I192-H195 PolarHBondContact O-N 3.28Å; I192-S196 WeakPolarHBondContact O-CB 3.26Å; I192-S196 PolarHBondContact O-N 3.04Å
193	S	49.1	Very low	55.6	Low	67 Å²	67	102.5 Å²	102.5	47%	0.469	51%	0.506	S	S	.	.	H	α-helix	trans	-69	-39.4	179.5	46.4	0	0	0	0	112.5	E189 T190 H195 S196	E189-S193 PolarHBondContact O-N 2.87Å; E189-S193 PolarHBondContact O-OG 3.08Å; T190-S193 WeakPolarHBondContact CA-OG 3.31Å; T190-S193 PolarHBondContact O-N 3.28Å; T190-S193 PolarHBondContact O-OG 3.04Å; S193-H195 VanDerWaalsContact C-N 3.33Å; S193-H195 PolarHBondContact O-N 2.92Å; S193-S196 WeakPolarHBondContact O-CB 3.35Å; S193-S196 PolarHBondContact O-N 3.37Å; S193-S196 PolarHBondContact O-OG 3.35Å
194	Q	46.1	Very low	52.6	Low	150 Å²	150	104.1 Å²	104.1	70%	0.701	52%	0.522	S	S	*	.	H	α-helix	trans	-63.7	-34.7	174.5	-73.3	178	-1.6	0	0	113.2	T190	T190-Q194 WeakPolarHBondContact O-CB 3.35Å; T190-Q194 WeakPolarHBondContact O-CG 3.16Å; T190-Q194 PolarHBondContact O-N 3.04Å
195	H	43.2	Very low	49.7	Very low	103 Å²	103	111.5 Å²	111.5	48%	0.477	56%	0.561	S	S	.	*	H	α-helix	trans	-88	-4.3	174.7	-66.7	-57.5	0	0	0	114.6	N191 I192 S193 G197 I198	N191-H195 PolarHBondContact O-CD2 2.66Å; N191-H195 PolarHBondContact O-N 3.21Å; I192-H195 PolarHBondContact O-N 3.28Å; S193-H195 VanDerWaalsContact C-N 3.33Å; S193-H195 PolarHBondContact O-N 2.92Å; H195-G197 PolarHBondContact O-N 2.93Å; H195-I198 PolarHBondContact O-N 3.47Å
196	S	37.1	Very low	47	Very low	61 Å²	61	113.6 Å²	113.6	43%	0.427	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-63.5	-25.8	-176.3	69.7	0	0	0	0	114	I192 S193 I198 I199	I192-S196 WeakPolarHBondContact O-CB 3.26Å; I192-S196 PolarHBondContact O-N 3.04Å; S193-S196 WeakPolarHBondContact O-CB 3.35Å; S193-S196 PolarHBondContact O-N 3.37Å; S193-S196 PolarHBondContact O-OG 3.35Å; S196-I198 PolarHBondContact O-N 2.88Å; S196-I199 PolarHBondContact O-N 3.33Å; S196-I199 VanDerWaalsContact O-N 3.16Å
197	G	30.2	Very low	44.2	Very low	63 Å²	63	115.2 Å²	115.2	65%	0.649	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-65	-14.3	173.8	0	0	0	0	0	114.9	H195	H195-G197 PolarHBondContact O-N 2.93Å
198	I	34.5	Very low	41.7	Very low	145 Å²	145	119.4 Å²	119.4	74%	0.744	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-96.9	-10.7	178.4	-57.1	176.2	0	0	0	111.2	H195 S196	H195-I198 PolarHBondContact O-N 3.47Å; S196-I198 PolarHBondContact O-N 2.88Å
199	I	29.8	Very low	39.3	Very low	88 Å²	88	124.2 Å²	124.2	45%	0.451	64%	0.641	S	S	.	*			trans	-106.4	3.4	-166.4	-64.1	166.5	0	0	0	112.9	S196 Y201	S196-I199 PolarHBondContact O-N 3.33Å; S196-I199 VanDerWaalsContact O-N 3.16Å; I199-Y201 VanDerWaalsContact C-N 3.29Å; I199-Y201 PolarHBondContact O-N 2.84Å; I199-Y201 VanDerWaalsContact O-N 3.16Å
200	Q	27.8	Very low	36.8	Very low	171 Å²	171	127.8 Å²	127.8	80%	0.799	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	0.6	-173.1	-80.3	-168.9	-19.7	0	0	117
201	Y	25.4	Very low	34.4	Very low	226 Å²	226	133.2 Å²	133.2	89%	0.886	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-2.7	-168.5	-132.9	-90.4	0	0	0	117.7	I199	I199-Y201 VanDerWaalsContact C-N 3.29Å; I199-Y201 PolarHBondContact O-N 2.84Å; I199-Y201 VanDerWaalsContact O-N 3.16Å
202	E	26	Very low	32.5	Very low	184 Å²	184	143.6 Å²	143.6	86%	0.86	72%	0.718	S	S	*	*	S	Bend	trans	-127.6	8.2	-175.2	-67.4	-169.3	152.7	0	0	116	T204	E202-T204 VanDerWaalsContact C-N 3.35Å; E202-T204 PolarHBondContact O-N 3.41Å
203	R	26	Very low	30.8	Very low	201 Å²	201	143.6 Å²	143.6	76%	0.758	73%	0.726	S	S	*	*			trans	-90	53	177.8	-78	-168.7	-178.8	167.2	2.4	114.7
204	T	26.8	Very low	29.8	Very low	123 Å²	123	146.5 Å²	146.5	76%	0.755	74%	0.736	S	S	*	*	S	Bend	trans	-141.9	64.1	165.2	58.3	0	0	0	0	112.5	E202	E202-T204 VanDerWaalsContact C-N 3.35Å; E202-T204 PolarHBondContact O-N 3.41Å
205	N	28.3	Very low	28.8	Very low	157 Å²	157	144.2 Å²	144.2	84%	0.84	73%	0.728	S	S	*	*	S	Bend	trans	-175.5	154.5	142.4	-98.3	-35.4	0	0	0	113.6
206	S	30.8	Very low	27.9	Very low	116 Å²	116	146.8 Å²	146.8	81%	0.811	75%	0.745	S	S	*	*			trans	66.6	107.3	175.3	65.2	0	0	0	0	118
207	N	27.5	Very low	27.4	Very low	146 Å²	146	148.2 Å²	148.2	78%	0.781	75%	0.748	S	S	*	*			trans	-68.7	137.7	157.3	-61.4	-46.4	0	0	0	109.6
208	H	28.6	Very low	27.2	Very low	174 Å²	174	149.7 Å²	149.7	81%	0.806	75%	0.748	S	S	*	*				159.4	139.1	127.9	-86.1	-66	0	0	0	112.5
209	N	27.2	Very low	26.7	Very low	145 Å²	145	149.7 Å²	149.7	78%	0.775	75%	0.75	S	S	*	*			trans	73.4	122.4	167.8	-60.6	-7.9	0	0	0	118.3	H211	N209-H211 PolarHBondContact O-N 3.09Å; N209-H211 VanDerWaalsContact O-N 3.12Å
210	E	24.5	Very low	26.7	Very low	199 Å²	199	149.1 Å²	149.1	93%	0.93	75%	0.75	S	S	*	*			trans	-68.6	99.7	177	-60.7	174.1	147.9	0	0	111
211	H	26.6	Very low	26.6	Very low	153 Å²	153	145.8 Å²	145.8	71%	0.708	74%	0.735	S	S	*	*			trans	-123.8	135.7	163.1	-92.3	-97.7	0	0	0	109.7	N209 S213	N209-H211 PolarHBondContact O-N 3.09Å; N209-H211 VanDerWaalsContact O-N 3.12Å; H211-S213 PolarHBondContact O-N 3.38Å; H211-S213 PolarHBondContact O-OG 3.5Å
212	Y	26.7	Very low	26.6	Very low	253 Å²	253	140 Å²	140	99%	0.992	72%	0.719	S	S	*	*			trans	-71.4	73	165.3	-87.2	-98.8	0	0	0	109.3
213	S	24.2	Very low	26.7	Very low	91 Å²	91	133.9 Å²	133.9	64%	0.636	70%	0.696	S	S	*	*			trans	-122.1	60.3	-179	56	0	0	0	0	110.6	H211	H211-S213 PolarHBondContact O-N 3.38Å; H211-S213 PolarHBondContact O-OG 3.5Å
214	L	27.7	Very low	26.8	Very low	128 Å²	128	129.1 Å²	129.1	67%	0.67	69%	0.69	S	S	*	*			trans	-136.7	94.6	175.1	-75.2	177.7	0	0	0	111.3
215	L	26.3	Very low	27	Very low	102 Å²	102	128.3 Å²	128.3	53%	0.534	68%	0.676	S	S	.	*			trans	-167.4	60.3	136.9	-100.7	164.2	0	0	0	107.9	L217	L215-L217 HydrophobicContact CD2-CD1 3.72Å; L215-L217 PolarHBondContact O-N 3.14Å
216	N	24	Very low	27.3	Very low	156 Å²	156	125.6 Å²	125.6	83%	0.834	66%	0.662	S	S	*	*			trans	-71.3	78.1	160.1	-91.7	-1.6	0	0	0	107.8	S218	N216-S218 PolarHBondContact O-N 2.82Å; N216-S218 VanDerWaalsContact O-N 3.12Å
217	L	27	Very low	27.5	Very low	92 Å²	92	122.2 Å²	122.2	48%	0.482	64%	0.638	S	S	.	*			trans	-83.9	60.5	166.6	-125.9	77.8	0	0	0	109.2	L215 N219 T220	L215-L217 HydrophobicContact CD2-CD1 3.72Å; L215-L217 PolarHBondContact O-N 3.14Å; L217-N219 PolarHBondContact O-N 3.16Å; L217-N219 VanDerWaalsContact O-N 3.08Å; L217-T220 HydrophobicContact CD2-CG2 3.57Å; L217-T220 HydrophobicContact CG-CG2 4.4Å; L217-T220 PolarHBondContact O-OG1 3.19Å
218	S	25.2	Very low	27.8	Very low	93 Å²	93	119.6 Å²	119.6	65%	0.65	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	14.2	173.2	49.8	0	0	0	0	113.3	N216	N216-S218 PolarHBondContact O-N 2.82Å; N216-S218 VanDerWaalsContact O-N 3.12Å
219	N	25.5	Very low	28.1	Very low	146 Å²	146	112.7 Å²	112.7	78%	0.781	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	2	-176.8	-78.7	-16.7	0	0	0	114.4	L217 E221	L217-N219 PolarHBondContact O-N 3.16Å; L217-N219 VanDerWaalsContact O-N 3.08Å; N219-E221 PolarHBondContact O-N 2.8Å
220	T	28.8	Very low	28.5	Very low	76 Å²	76	107.2 Å²	107.2	47%	0.466	57%	0.568	S	S	.	*			trans	-81	60.6	168.9	34.3	0	0	0	0	111.9	L217 N222	L217-T220 HydrophobicContact CD2-CG2 3.57Å; L217-T220 HydrophobicContact CG-CG2 4.4Å; L217-T220 PolarHBondContact O-OG1 3.19Å; T220-N222 PolarHBondContact O-N 2.75Å
221	E	26.7	Very low	29.1	Very low	101 Å²	101	101 Å²	101	47%	0.472	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	5.9	174.9	-73.3	-144.9	147.7	0	0	113.8	N219 F251	N219-E221 PolarHBondContact O-N 2.8Å; E221-F251 HydrophobicContact CB-CE1 3.53Å; E221-F251 HydrophobicContact CB-CZ 4.03Å; E221-F251 HydrophobicContact CG-CE1 3.74Å; E221-F251 HydrophobicContact CG-CZ 3.67Å; E221-F251 VanDerWaalsContact O-CD1 3.3Å; E221-F251 WeakPolarHBondContact O-CD1 3.46Å; E221-F251 VanDerWaalsContact O-CE1 3.23Å; E221-F251 WeakPolarHBondContact O-CE1 3.49Å
222	N	24.9	Very low	29.6	Very low	103 Å²	103	96.3 Å²	96.3	55%	0.551	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.5	3.1	-167.9	-78.5	-59.6	0	0	0	116.3	T220 N255	T220-N222 PolarHBondContact O-N 2.75Å; N222-N255 PolarHBondContact OD1-ND2 2.98Å
223	S	28.7	Very low	30.2	Very low	56 Å²	56	86.4 Å²	86.4	39%	0.392	48%	0.482	S	S	.	.			trans	-93.7	112.3	179.1	54	0	0	0	0	111.7	F225	S223-F225 PolarHBondContact O-N 3.26Å
224	T	27.5	Very low	30.9	Very low	102 Å²	102	84 Å²	84	63%	0.626	46%	0.46	S	S	*	.			trans	-66.8	95.5	172.9	47.4	0	0	0	0	110.6	N226 V252	T224-N226 VanDerWaalsContact C-N 3.28Å; T224-N226 PolarHBondContact O-N 3.49Å; T224-V252 HydrophobicContact CG2-CG2 4.4Å
225	F	30.2	Very low	31.3	Very low	105 Å²	105	81.9 Å²	81.9	46%	0.461	46%	0.457	S	S	.	.			trans	-71.7	82.2	175.7	-95.4	-84.3	0	0	0	111.3	S223 C227 V300 H303	S223-F225 PolarHBondContact O-N 3.26Å; F225-C227 VanDerWaalsContact C-N 3.33Å; F225-C227 PolarHBondContact O-N 3.34Å; F225-V300 HydrophobicContact CE1-CG1 4.47Å; F225-V300 HydrophobicContact CE1-CG2 4.37Å; F225-H303 HydrophobicContact CE1-CB 4.06Å; F225-H303 AromaticContact CE1-CD2 3.54Å; F225-H303 AromaticContact CE1-CG 3.84Å; F225-H303 HydrophobicContact CZ-CB 4.26Å; F225-H303 AromaticContact CZ-CD2 3.79Å; F225-H303 AromaticContact CZ-CG 3.85Å
226	N	34.3	Very low	31.9	Very low	101 Å²	101	82.5 Å²	82.5	54%	0.54	46%	0.455	S	S	.	.			trans	-67.2	89.8	166.7	-84	-7.9	0	0	0	109.6	T224 V228 N231	T224-N226 VanDerWaalsContact C-N 3.28Å; T224-N226 PolarHBondContact O-N 3.49Å; N226-V228 PolarHBondContact O-N 2.99Å; N226-N231 WeakPolarHBondContact CB-ND2 3.38Å; N226-N231 PolarHBondContact ND2-ND2 3.47Å
227	C	35.6	Very low	32.4	Very low	45 Å²	45	78.5 Å²	78.5	30%	0.304	43%	0.433	S	S	.	.			trans	-53.4	123.1	171	159.2	0	0	0	0	109.8	F225 C230 N231	F225-C227 VanDerWaalsContact C-N 3.33Å; F225-C227 PolarHBondContact O-N 3.34Å; C227-C230 HydrophobicContact CB-CB 3.49Å; C227-C230 VanDerWaalsContact CB-CB 3.49Å; C227-C230 WeakPolarHBondContact CB-SG 3.34Å; C227-C230 CarbonylContact O-C 3.44Å; C227-C230 WeakPolarHBondContact O-CB 3.47Å; C227-C230 PolarHBondContact O-N 3.48Å; C227-C230 WeakPolarHBondContact SG-CB 3.43Å; C227-C230 PolarHBondContact SG-N 2.94Å; C227-C230 CovalentContact SG-SG 2.04Å; C227-C230 PolarHBondContact SG-SG 3.43Å; C227-N231 WeakPolarHBondContact O-CB 3.22Å; C227-N231 PolarHBondContact O-N 2.88Å
228	V	34.8	Very low	32.7	Very low	90 Å²	90	81.3 Å²	81.3	55%	0.545	45%	0.449	S	S	.	.	H	α-helix	trans	-68.6	-45.8	-171.5	178.6	0	0	0	0	112.2	N226 C230 N231 F232	N226-V228 PolarHBondContact O-N 2.99Å; V228-C230 PolarHBondContact O-N 3.38Å; V228-N231 PolarHBondContact O-N 3.42Å; V228-F232 WeakPolarHBondContact O-CB 3.27Å; V228-F232 PolarHBondContact O-N 3.1Å
229	M	34.6	Very low	33.3	Very low	30 Å²	30	78.3 Å²	78.3	15%	0.148	43%	0.426	C	S	.	.	H	α-helix	trans	-60.7	-38.8	174.7	-165.2	-141.3	-53.7	0	0	110.9	F232 I233 I346 P347 M385 F424	M229-F232 PolarHBondContact O-N 3.3Å; M229-I233 HydrophobicContact CG-CD1 3.88Å; M229-I233 WeakPolarHBondContact O-CB 3.36Å; M229-I233 WeakPolarHBondContact O-CG1 3.17Å; M229-I233 PolarHBondContact O-N 3.03Å; M229-I233 HydrophobicContact SD-CD1 3.75Å; M229-I346 HydrophobicContact CB-CG2 4.11Å; M229-I346 HydrophobicContact CE-CG2 4.1Å; M229-I346 HydrophobicContact CG-CG2 3.98Å; M229-P347 HydrophobicContact CE-CB 3.72Å; M229-P347 HydrophobicContact CE-CG 4.1Å; M229-P347 WeakPolarHBondContact CE-O 3.41Å; M229-M385 HydrophobicContact CG-CE 3.84Å; M229-M385 HydrophobicContact CG-SD 4.46Å; M229-F424 HydrophobicContact SD-CE1 4.44Å
230	C	36	Very low	33.9	Very low	29 Å²	29	76.2 Å²	76.2	20%	0.196	41%	0.414	C	S	.	.	H	α-helix	trans	-63.6	-54.7	175.5	-47.9	0	0	0	0	110.5	C227 V228 F232 I233 F234	C227-C230 HydrophobicContact CB-CB 3.49Å; C227-C230 VanDerWaalsContact CB-CB 3.49Å; C227-C230 WeakPolarHBondContact CB-SG 3.34Å; C227-C230 CarbonylContact O-C 3.44Å; C227-C230 WeakPolarHBondContact O-CB 3.47Å; C227-C230 PolarHBondContact O-N 3.48Å; C227-C230 WeakPolarHBondContact SG-CB 3.43Å; C227-C230 PolarHBondContact SG-N 2.94Å; C227-C230 CovalentContact SG-SG 2.04Å; C227-C230 PolarHBondContact SG-SG 3.43Å; V228-C230 PolarHBondContact O-N 3.38Å; C230-F232 PolarHBondContact O-N 3Å; C230-I233 CarbonylContact O-C 3.59Å; C230-I233 PolarHBondContact O-N 3.08Å; C230-I233 VanDerWaalsContact O-N 3.14Å; C230-F234 HydrophobicContact CB-CD2 3.93Å; C230-F234 HydrophobicContact CB-CE2 3.42Å; C230-F234 VanDerWaalsContact CB-CE2 3.42Å; C230-F234 HydrophobicContact CB-CZ 4.09Å; C230-F234 VanDerWaalsContact O-CB 3.28Å; C230-F234 WeakPolarHBondContact O-CB 3.24Å; C230-F234 WeakPolarHBondContact O-CD2 3.45Å; C230-F234 WeakPolarHBondContact O-CG 3.5Å; C230-F234 PolarHBondContact O-N 2.89Å
231	N	36.5	Very low	34	Very low	69 Å²	69	73 Å²	73	37%	0.369	39%	0.394	S	S	.	.	H	α-helix	trans	-59.8	-32.2	176.9	-91.8	9.5	0	0	0	113.2	N226 C227 V228 S235	N226-N231 WeakPolarHBondContact CB-ND2 3.38Å; N226-N231 PolarHBondContact ND2-ND2 3.47Å; C227-N231 WeakPolarHBondContact O-CB 3.22Å; C227-N231 PolarHBondContact O-N 2.88Å; V228-N231 PolarHBondContact O-N 3.42Å; N231-S235 WeakPolarHBondContact O-CB 3.38Å; N231-S235 PolarHBondContact O-N 3.37Å; N231-S235 PolarHBondContact O-OG 3Å
232	F	37.4	Very low	34.2	Very low	54 Å²	54	69 Å²	69	24%	0.237	38%	0.376	C	S	.	.	H	α-helix	trans	-64.9	-56.3	171.7	-173.2	-80.1	0	0	0	110.7	V228 M229 C230 F234 S235 K236 M385	V228-F232 WeakPolarHBondContact O-CB 3.27Å; V228-F232 PolarHBondContact O-N 3.1Å; M229-F232 PolarHBondContact O-N 3.3Å; C230-F232 PolarHBondContact O-N 3Å; F232-F234 PolarHBondContact O-N 3.25Å; F232-S235 PolarHBondContact O-N 3.42Å; F232-S235 VanDerWaalsContact O-N 3.08Å; F232-S235 PolarHBondContact O-OG 3.18Å; F232-K236 HydrophobicContact CD1-CG 4.49Å; F232-K236 HydrophobicContact CE1-CB 4.1Å; F232-K236 HydrophobicContact CE1-CG 3.83Å; F232-K236 HydrophobicContact CE2-CG 4.25Å; F232-K236 HydrophobicContact CZ-CB 4.44Å; F232-K236 HydrophobicContact CZ-CG 3.68Å; F232-K236 PolarHBondContact O-N 3.43Å; F232-M385 HydrophobicContact CB-CE 4.12Å; F232-M385 HydrophobicContact CD1-CB 3.71Å; F232-M385 HydrophobicContact CD1-CE 3.42Å; F232-M385 VanDerWaalsContact CD1-CE 3.42Å; F232-M385 HydrophobicContact CD1-CG 4.27Å; F232-M385 HydrophobicContact CD2-CB 3.76Å; F232-M385 HydrophobicContact CD2-CG 4.27Å; F232-M385 HydrophobicContact CE1-CB 3.56Å; F232-M385 HydrophobicContact CE1-CE 4.16Å; F232-M385 WeakPolarHBondContact CE1-O 3.43Å; F232-M385 HydrophobicContact CE2-CB 3.59Å; F232-M385 HydrophobicContact CG-CB 3.83Å; F232-M385 HydrophobicContact CG-CE 3.85Å; F232-M385 HydrophobicContact CG-CG 4.13Å; F232-M385 HydrophobicContact CZ-CB 3.5Å; F232-M385 WeakPolarHBondContact CZ-O 3.07Å
233	I	39	Very low	34.4	Very low	46 Å²	46	71.9 Å²	71.9	24%	0.236	38%	0.384	C	S	.	.	H	α-helix	trans	-57.6	-37.5	177.4	-69.5	170.6	0	0	0	110.6	M229 C230 L237 M385	M229-I233 HydrophobicContact CG-CD1 3.88Å; M229-I233 WeakPolarHBondContact O-CB 3.36Å; M229-I233 WeakPolarHBondContact O-CG1 3.17Å; M229-I233 PolarHBondContact O-N 3.03Å; M229-I233 HydrophobicContact SD-CD1 3.75Å; C230-I233 CarbonylContact O-C 3.59Å; C230-I233 PolarHBondContact O-N 3.08Å; C230-I233 VanDerWaalsContact O-N 3.14Å; I233-L237 HydrophobicContact CG2-CD1 3.53Å; I233-L237 HydrophobicContact CG2-CG 4.04Å; I233-L237 WeakPolarHBondContact O-CB 3.46Å; I233-L237 WeakPolarHBondContact O-CG 3.28Å; I233-L237 PolarHBondContact O-N 3.01Å; I233-M385 HydrophobicContact CG1-CE 4.29Å
234	F	39	Very low	34.5	Very low	39 Å²	39	77.8 Å²	77.8	17%	0.171	40%	0.397	C	S	.	.	H	α-helix	trans	-78.2	-16.6	177.8	-62	-35.9	0	0	0	115.5	C230 F232 I242 F246	C230-F234 HydrophobicContact CB-CD2 3.93Å; C230-F234 HydrophobicContact CB-CE2 3.42Å; C230-F234 VanDerWaalsContact CB-CE2 3.42Å; C230-F234 HydrophobicContact CB-CZ 4.09Å; C230-F234 VanDerWaalsContact O-CB 3.28Å; C230-F234 WeakPolarHBondContact O-CB 3.24Å; C230-F234 WeakPolarHBondContact O-CD2 3.45Å; C230-F234 WeakPolarHBondContact O-CG 3.5Å; C230-F234 PolarHBondContact O-N 2.89Å; F232-F234 PolarHBondContact O-N 3.25Å; F234-I242 HydrophobicContact CD1-CB 3.77Å; F234-I242 HydrophobicContact CD1-CG2 4.14Å; F234-I242 HydrophobicContact CE1-CB 3.67Å; F234-I242 HydrophobicContact CE1-CG2 3.5Å; F234-I242 VanDerWaalsContact CE1-CG2 3.5Å; F234-I242 HydrophobicContact CZ-CG2 4.44Å; F234-F246 AromaticContact CE1-CD2 3.89Å; F234-F246 HydrophobicContact CE1-CD2 3.89Å; F234-F246 HydrophobicContact CE1-CE2 4.21Å; F234-F246 HydrophobicContact CE1-CG 4.28Å; F234-F246 HydrophobicContact CE2-CB 3.53Å; F234-F246 AromaticContact CE2-CD1 3.93Å; F234-F246 HydrophobicContact CE2-CD1 3.93Å; F234-F246 HydrophobicContact CE2-CD2 4.01Å; F234-F246 AromaticContact CE2-CG 3.54Å; F234-F246 HydrophobicContact CE2-CG 3.54Å; F234-F246 HydrophobicContact CZ-CB 3.7Å; F234-F246 AromaticContact CZ-CD1 3.7Å; F234-F246 HydrophobicContact CZ-CD1 3.7Å; F234-F246 AromaticContact CZ-CD2 3.22Å; F234-F246 HydrophobicContact CZ-CD2 3.22Å; F234-F246 HydrophobicContact CZ-CE1 4.1Å; F234-F246 AromaticContact CZ-CE2 3.68Å; F234-F246 HydrophobicContact CZ-CE2 3.68Å; F234-F246 AromaticContact CZ-CG 3.23Å; F234-F246 HydrophobicContact CZ-CG 3.23Å; F234-F246 HydrophobicContact CZ-CZ 4.09Å
235	S	36	Very low	34.7	Very low	85 Å²	85	75.2 Å²	75.2	59%	0.594	38%	0.378	S	S	*	.	H	α-helix	trans	-97.1	-20.9	175.3	56.4	0	0	0	0	112.7	N231 F232	N231-S235 WeakPolarHBondContact O-CB 3.38Å; N231-S235 PolarHBondContact O-N 3.37Å; N231-S235 PolarHBondContact O-OG 3Å; F232-S235 PolarHBondContact O-N 3.42Å; F232-S235 VanDerWaalsContact O-N 3.08Å; F232-S235 PolarHBondContact O-OG 3.18Å
236	K	39.5	Very low	34.7	Very low	114 Å²	114	75.8 Å²	75.8	50%	0.496	38%	0.381	S	S	.	.	H	α-helix	trans	-105.8	-40.7	-178.3	-72.3	-74.1	-175.5	167.1	0	114.3	F232 N238	F232-K236 HydrophobicContact CD1-CG 4.49Å; F232-K236 HydrophobicContact CE1-CB 4.1Å; F232-K236 HydrophobicContact CE1-CG 3.83Å; F232-K236 HydrophobicContact CE2-CG 4.25Å; F232-K236 HydrophobicContact CZ-CB 4.44Å; F232-K236 HydrophobicContact CZ-CG 3.68Å; F232-K236 PolarHBondContact O-N 3.43Å; K236-N238 VanDerWaalsContact C-N 3.35Å; K236-N238 PolarHBondContact O-N 2.63Å
237	L	33.9	Very low	34.5	Very low	73 Å²	73	76 Å²	76	38%	0.382	39%	0.386	S	S	.	.	S	Bend	trans	-69.4	95.9	169.6	-61.2	-173.9	0	0	0	109.1	I233 T239 I242	I233-L237 HydrophobicContact CG2-CD1 3.53Å; I233-L237 HydrophobicContact CG2-CG 4.04Å; I233-L237 WeakPolarHBondContact O-CB 3.46Å; I233-L237 WeakPolarHBondContact O-CG 3.28Å; I233-L237 PolarHBondContact O-N 3.01Å; L237-T239 PolarHBondContact O-N 3.46Å; L237-I242 HydrophobicContact CB-CD1 4.43Å; L237-I242 HydrophobicContact CD1-CD1 4.28Å
238	N	33.3	Very low	34.1	Very low	151 Å²	151	82.8 Å²	82.8	81%	0.807	41%	0.405	S	S	*	.			trans	-75.8	48.8	-169.8	-142.6	-14.1	0	0	0	112.6	K236	K236-N238 VanDerWaalsContact C-N 3.35Å; K236-N238 PolarHBondContact O-N 2.63Å
239	T	37.7	Very low	33.7	Very low	29 Å²	29	83.6 Å²	83.6	18%	0.178	41%	0.41	C	S	.	.			trans	-123.3	126.1	-172.1	72.1	0	0	0	0	108.5	L29 L33 L237 P241	L29-T239 HydrophobicContact CD2-CG2 3.51Å; L29-T239 HydrophobicContact CG-CG2 4.23Å; L33-T239 VanDerWaalsContact CD1-OG1 3.31Å; L33-T239 WeakPolarHBondContact CD1-OG1 3.35Å; L237-T239 PolarHBondContact O-N 3.46Å; T239-P241 VanDerWaalsContact O-CD 3.32Å; T239-P241 WeakPolarHBondContact O-CD 3.13Å
240	I	37.4	Very low	33.3	Very low	102 Å²	102	88.1 Å²	88.1	52%	0.523	44%	0.442	S	S	.	.	S	Bend	trans	-78.5	-9.2	-157.2	-59.6	171.2	0	0	0	116.2	P26 K30	P26-I240 HydrophobicContact CG-CD1 4.08Å; K30-I240 HydrophobicContact CD-CB 4.41Å
241	P	31.5	Very low	32.6	Very low	8 Å²	8	92.5 Å²	92.5	5%	0.052	46%	0.458	C	S	.	.	S	Bend	trans	-85.1	-37.1	-179	34.6	-34.7	0	0	0	114.4	K30 L33 T239 K243 R244	K30-P241 HydrophobicContact CB-CG 4.46Å; K30-P241 HydrophobicContact CG-CB 3.78Å; K30-P241 HydrophobicContact CG-CG 4.08Å; K30-P241 WeakPolarHBondContact O-CB 3.27Å; L33-P241 HydrophobicContact CB-CG 3.59Å; L33-P241 HydrophobicContact CD1-CG 3.84Å; L33-P241 HydrophobicContact CG-CG 4.35Å; T239-P241 VanDerWaalsContact O-CD 3.32Å; T239-P241 WeakPolarHBondContact O-CD 3.13Å; P241-K243 PolarHBondContact O-N 2.91Å; P241-R244 PolarHBondContact O-N 2.93Å
242	I	30.5	Very low	32.2	Very low	18 Å²	18	91.3 Å²	91.3	9%	0.092	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-66.5	-22	-161.5	-7.4	178	0	0	0	112.4	L33 F234 L237 R244 F246	L33-I242 HydrophobicContact CD1-CD1 4.01Å; L33-I242 HydrophobicContact CD1-CG1 3.99Å; L33-I242 HydrophobicContact CD2-CD1 4.25Å; F234-I242 HydrophobicContact CD1-CB 3.77Å; F234-I242 HydrophobicContact CD1-CG2 4.14Å; F234-I242 HydrophobicContact CE1-CB 3.67Å; F234-I242 HydrophobicContact CE1-CG2 3.5Å; F234-I242 VanDerWaalsContact CE1-CG2 3.5Å; F234-I242 HydrophobicContact CZ-CG2 4.44Å; L237-I242 HydrophobicContact CB-CD1 4.43Å; L237-I242 HydrophobicContact CD1-CD1 4.28Å; I242-R244 PolarHBondContact O-N 2.89Å; I242-F246 HydrophobicContact CG2-CD2 4.38Å; I242-F246 HydrophobicContact CG2-CE2 4.33Å
243	K	29.1	Very low	31.7	Very low	163 Å²	163	94.9 Å²	94.9	71%	0.709	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-64.7	-8.7	173.2	-147.1	175.3	-172.4	177.9	0	114.9	P241	P241-K243 PolarHBondContact O-N 2.91Å
244	R	31	Very low	31.2	Very low	180 Å²	180	101.9 Å²	101.9	68%	0.679	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-111.9	-16.1	-172.3	-139.4	175.8	-167.1	173.4	5.1	115.4	P241 I242 T247 R248	P241-R244 PolarHBondContact O-N 2.93Å; I242-R244 PolarHBondContact O-N 2.89Å; R244-T247 VanDerWaalsContact C-OG1 3.32Å; R244-T247 PolarHBondContact O-OG1 3.28Å; R244-T247 VanDerWaalsContact O-OG1 3.08Å; R244-R248 WeakPolarHBondContact O-CD 3.17Å; R244-R248 WeakPolarHBondContact O-CG 3.38Å
245	E	32	Very low	30.8	Very low	48 Å²	48	103.7 Å²	103.7	22%	0.224	51%	0.514	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-33.3	-179.1	-84	178.4	109.3	0	0	114.2	Q34 A37 T247 R248	Q34-E245 WeakPolarHBondContact CA-OE2 3.34Å; A37-E245 HydrophobicContact CB-CB 4.47Å; A37-E245 WeakPolarHBondContact CB-OE2 3.36Å; E245-T247 PolarHBondContact O-N 3.46Å; E245-R248 CarbonylContact O-C 3.46Å; E245-R248 WeakPolarHBondContact O-CA 3.35Å; E245-R248 PolarHBondContact O-N 3.37Å
246	F	29.6	Very low	30.6	Very low	118 Å²	118	106.9 Å²	106.9	52%	0.518	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.6	171.8	-79.8	-100.7	0	0	0	112.9	F234 I242 R248	F234-F246 AromaticContact CE1-CD2 3.89Å; F234-F246 HydrophobicContact CE1-CD2 3.89Å; F234-F246 HydrophobicContact CE1-CE2 4.21Å; F234-F246 HydrophobicContact CE1-CG 4.28Å; F234-F246 HydrophobicContact CE2-CB 3.53Å; F234-F246 AromaticContact CE2-CD1 3.93Å; F234-F246 HydrophobicContact CE2-CD1 3.93Å; F234-F246 HydrophobicContact CE2-CD2 4.01Å; F234-F246 AromaticContact CE2-CG 3.54Å; F234-F246 HydrophobicContact CE2-CG 3.54Å; F234-F246 HydrophobicContact CZ-CB 3.7Å; F234-F246 AromaticContact CZ-CD1 3.7Å; F234-F246 HydrophobicContact CZ-CD1 3.7Å; F234-F246 AromaticContact CZ-CD2 3.22Å; F234-F246 HydrophobicContact CZ-CD2 3.22Å; F234-F246 HydrophobicContact CZ-CE1 4.1Å; F234-F246 AromaticContact CZ-CE2 3.68Å; F234-F246 HydrophobicContact CZ-CE2 3.68Å; F234-F246 AromaticContact CZ-CG 3.23Å; F234-F246 HydrophobicContact CZ-CG 3.23Å; F234-F246 HydrophobicContact CZ-CZ 4.09Å; I242-F246 HydrophobicContact CG2-CD2 4.38Å; I242-F246 HydrophobicContact CG2-CE2 4.33Å; F246-R248 VanDerWaalsContact C-N 3.29Å
247	T	30.3	Very low	30.3	Very low	106 Å²	106	108.1 Å²	108.1	65%	0.65	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	5.2	164.4	53.6	0	0	0	0	113.6	R244 E245	R244-T247 VanDerWaalsContact C-OG1 3.32Å; R244-T247 PolarHBondContact O-OG1 3.28Å; R244-T247 VanDerWaalsContact O-OG1 3.08Å; E245-T247 PolarHBondContact O-N 3.46Å
248	R	27.2	Very low	30.3	Very low	187 Å²	187	111.8 Å²	111.8	71%	0.706	54%	0.536	S	S	*	.			trans	-132.7	33.3	-174.9	-71.7	-175.3	170.6	-171.1	-4.5	113.6	R244 E245 F246	R244-R248 WeakPolarHBondContact O-CD 3.17Å; R244-R248 WeakPolarHBondContact O-CG 3.38Å; E245-R248 CarbonylContact O-C 3.46Å; E245-R248 WeakPolarHBondContact O-CA 3.35Å; E245-R248 PolarHBondContact O-N 3.37Å; F246-R248 VanDerWaalsContact C-N 3.29Å
249	V	26.9	Very low	30.3	Very low	107 Å²	107	110.2 Å²	110.2	65%	0.648	53%	0.527	S	S	*	.	S	Bend	trans	-84.7	129.7	153.4	-175.2	0	0	0	0	106.7	F251	V249-F251 PolarHBondContact O-N 3.26Å
250	P	24.6	Very low	30.2	Very low	125 Å²	125	115 Å²	115	81%	0.812	55%	0.547	S	S	*	.	S	Bend	trans	-71.7	85.4	-159.8	26.5	-35.9	0	0	0	114.4
251	F	23.4	Very low	30.1	Very low	121 Å²	121	115.6 Å²	115.6	53%	0.531	55%	0.547	S	S	.	.			trans	-144.9	147.6	154.3	-121.1	-74.8	0	0	0	108.8	E221 V249	E221-F251 HydrophobicContact CB-CE1 3.53Å; E221-F251 HydrophobicContact CB-CZ 4.03Å; E221-F251 HydrophobicContact CG-CE1 3.74Å; E221-F251 HydrophobicContact CG-CZ 3.67Å; E221-F251 VanDerWaalsContact O-CD1 3.3Å; E221-F251 WeakPolarHBondContact O-CD1 3.46Å; E221-F251 VanDerWaalsContact O-CE1 3.23Å; E221-F251 WeakPolarHBondContact O-CE1 3.49Å; V249-F251 PolarHBondContact O-N 3.26Å
252	V	27.2	Very low	30.4	Very low	44 Å²	44	122.6 Å²	122.6	27%	0.267	58%	0.579	S	S	.	*			trans	74.4	61.5	-176.2	-158.9	0	0	0	0	116.3	T224	T224-V252 HydrophobicContact CG2-CG2 4.4Å
253	T	26.5	Very low	30.7	Very low	129 Å²	129	130.3 Å²	130.3	79%	0.791	61%	0.608	S	S	*	*			trans	-109.1	3	154.8	37	0	0	0	0	113.9
254	R	28.5	Very low	31.1	Very low	193 Å²	193	126.8 Å²	126.8	73%	0.728	60%	0.601	S	S	*	*	H	α-helix	trans	-87.1	-26.3	-177	-143.3	169.2	-168.3	156.4	2.8	114.8
255	N	31.5	Very low	31.5	Very low	77 Å²	77	127.2 Å²	127.2	41%	0.412	61%	0.608	S	S	.	*	H	α-helix	trans	-90.9	-34.1	-178.4	-65.8	-24	0	0	0	113.2	N222 K257 K258 L259	N222-N255 PolarHBondContact OD1-ND2 2.98Å; N255-K257 VanDerWaalsContact C-N 3.28Å; N255-K257 PolarHBondContact O-N 3.19Å; N255-K258 PolarHBondContact O-N 3.08Å; N255-L259 PolarHBondContact O-N 3.24Å; N255-L259 VanDerWaalsContact O-N 3.13Å
256	F	31.4	Very low	31.7	Very low	151 Å²	151	130.6 Å²	130.6	66%	0.662	63%	0.631	S	S	*	*	H	α-helix	trans	-64.1	-31.4	173.2	-88	-77.6	0	0	0	113	L259 H260	F256-L259 PolarHBondContact O-N 3.36Å; F256-H260 VanDerWaalsContact O-CB 3.23Å; F256-H260 WeakPolarHBondContact O-CB 3.46Å; F256-H260 PolarHBondContact O-N 3.08Å
257	K	33	Very low	31.7	Very low	140 Å²	140	130.2 Å²	130.2	61%	0.609	64%	0.644	S	S	*	*	H	α-helix	trans	-65.3	-40.4	176.4	-146.7	174.5	-176.7	179.8	0	112	N255 H260 E261	N255-K257 VanDerWaalsContact C-N 3.28Å; N255-K257 PolarHBondContact O-N 3.19Å; K257-H260 PolarHBondContact O-N 3.12Å; K257-E261 VanDerWaalsContact O-CB 3.31Å; K257-E261 WeakPolarHBondContact O-CB 3.38Å; K257-E261 VanDerWaalsContact O-CG 3.26Å; K257-E261 WeakPolarHBondContact O-CG 3.46Å; K257-E261 PolarHBondContact O-N 2.92Å
258	K	34.4	Very low	31.9	Very low	151 Å²	151	130.5 Å²	130.5	66%	0.657	65%	0.65	S	S	*	*	H	α-helix	trans	-67.4	-37.2	174	-73.2	-172.7	173.9	-175.7	0	113.5	N255 H262	N255-K258 PolarHBondContact O-N 3.08Å; K258-H262 PolarHBondContact O-N 3.18Å
259	L	33.7	Very low	32.1	Very low	117 Å²	117	130.3 Å²	130.3	61%	0.613	66%	0.657	S	S	*	*	H	α-helix	trans	-69.9	-41.1	175.6	-129.8	85	0	0	0	111.5	N255 F256 H262 Y263	N255-L259 PolarHBondContact O-N 3.24Å; N255-L259 VanDerWaalsContact O-N 3.13Å; F256-L259 PolarHBondContact O-N 3.36Å; L259-H262 PolarHBondContact O-N 2.96Å; L259-Y263 PolarHBondContact O-N 2.82Å
260	H	33.9	Very low	32.1	Very low	130 Å²	130	128.6 Å²	128.6	60%	0.602	66%	0.661	S	S	*	*	H	α-helix	trans	-70.3	-36.6	-179.4	-161.5	-11.1	0	0	0	112.3	F256 K257 H262 Y263 T264	F256-H260 VanDerWaalsContact O-CB 3.23Å; F256-H260 WeakPolarHBondContact O-CB 3.46Å; F256-H260 PolarHBondContact O-N 3.08Å; K257-H260 PolarHBondContact O-N 3.12Å; H260-H262 PolarHBondContact O-N 3.02Å; H260-Y263 PolarHBondContact O-N 2.04Å; H260-T264 VanDerWaalsContact CE1-CG2 3.45Å; H260-T264 WeakPolarHBondContact CE1-CG2 3.31Å; H260-T264 VanDerWaalsContact ND1-CG2 3.29Å; H260-T264 WeakPolarHBondContact ND1-CG2 3.29Å; H260-T264 VanDerWaalsContact O-CG2 3.31Å; H260-T264 WeakPolarHBondContact O-CG2 3.45Å; H260-T264 PolarHBondContact O-N 3.12Å; H260-T264 PolarHBondContact O-OG1 3.15Å
261	E	36.7	Very low	32.5	Very low	114 Å²	114	132 Å²	132	53%	0.533	67%	0.665	S	S	.	*	H	α-helix	trans	-67.6	-20.5	172.3	-76.3	167.6	-176.9	0	0	113.2	K257	K257-E261 VanDerWaalsContact O-CB 3.31Å; K257-E261 WeakPolarHBondContact O-CB 3.38Å; K257-E261 VanDerWaalsContact O-CG 3.26Å; K257-E261 WeakPolarHBondContact O-CG 3.46Å; K257-E261 PolarHBondContact O-N 2.92Å
262	H	36.7	Very low	32.9	Very low	156 Å²	156	134.5 Å²	134.5	72%	0.722	68%	0.679	S	S	*	*	H	α-helix	trans	-86.2	-25.2	178.2	-148.8	-49.6	0	0	0	113.5	K258 L259 H260	K258-H262 PolarHBondContact O-N 3.18Å; L259-H262 PolarHBondContact O-N 2.96Å; H260-H262 PolarHBondContact O-N 3.02Å
263	Y	36.7	Very low	33.1	Very low	179 Å²	179	138 Å²	138	70%	0.702	70%	0.696	S	S	*	*	H	α-helix	trans	-102.1	-10.1	-179.9	-89.9	-85.5	0	0	0	114.8	L259 H260 K265	L259-Y263 PolarHBondContact O-N 2.82Å; H260-Y263 PolarHBondContact O-N 2.04Å; Y263-K265 PolarHBondContact O-N 3.43Å
264	T	37.7	Very low	33.3	Very low	90 Å²	90	139.9 Å²	139.9	55%	0.552	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	7.5	175.9	44	0	0	0	0	115	H260	H260-T264 VanDerWaalsContact CE1-CG2 3.45Å; H260-T264 WeakPolarHBondContact CE1-CG2 3.31Å; H260-T264 VanDerWaalsContact ND1-CG2 3.29Å; H260-T264 WeakPolarHBondContact ND1-CG2 3.29Å; H260-T264 VanDerWaalsContact O-CG2 3.31Å; H260-T264 WeakPolarHBondContact O-CG2 3.45Å; H260-T264 PolarHBondContact O-N 3.12Å; H260-T264 PolarHBondContact O-OG1 3.15Å
265	K	39.7	Very low	33.4	Very low	189 Å²	189	138.6 Å²	138.6	82%	0.822	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-0.5	177.3	-85.7	-174.7	174.5	178.8	0	115.3	Y263	Y263-K265 PolarHBondContact O-N 3.43Å
266	T	36	Very low	33.3	Very low	118 Å²	118	137.6 Å²	137.6	72%	0.724	70%	0.7	S	S	*	*	S	Bend	trans	-120.6	101.2	173.6	45.8	0	0	0	0	109
267	S	30.3	Very low	33.3	Very low	111 Å²	111	134.8 Å²	134.8	78%	0.776	69%	0.691	S	S	*	*			trans	-90.5	173.1	179.9	53.5	0	0	0	0	112.3
268	S	33.5	Very low	33.2	Very low	111 Å²	111	133.4 Å²	133.4	78%	0.776	69%	0.694	S	S	*	*			trans	79.6	146.2	178.8	71.2	0	0	0	0	116.2
269	E	31.7	Very low	32.9	Very low	184 Å²	184	130.3 Å²	130.3	86%	0.86	69%	0.691	S	S	*	*			trans	69.8	67.1	-179.1	-59.7	178.5	-175.3	0	0	115.1
270	G	27.6	Very low	32.8	Very low	70 Å²	70	128.3 Å²	128.3	72%	0.722	69%	0.692	S	S	*	*			trans	-98	100.7	164.1	0	0	0	0	0	111.4
271	E	31.6	Very low	32.5	Very low	196 Å²	196	128.1 Å²	128.1	92%	0.916	70%	0.695	S	S	*	*	S	Bend	trans	-161.9	-24.7	152	-113	165.6	-161.5	0	0	112.1	L273	E271-L273 PolarHBondContact O-N 3.46Å
272	E	32.6	Very low	32	Very low	175 Å²	175	126.6 Å²	126.6	82%	0.818	70%	0.697	S	S	*	*	S	Bend	trans	-82.7	-3.8	175.8	-64.5	-171.4	149.1	0	0	115.2	E274 E275 A276	E272-E274 PolarHBondContact O-N 2.83Å; E272-E275 PolarHBondContact O-N 3.12Å; E272-A276 PolarHBondContact O-N 2.93Å
273	L	31.7	Very low	31.6	Very low	117 Å²	117	127.9 Å²	127.9	61%	0.613	70%	0.701	S	S	*	*	H	α-helix	trans	-70.6	-24.2	-166	-144.6	82.3	0	0	0	114.6	E271 I277	E271-L273 PolarHBondContact O-N 3.46Å; L273-I277 HydrophobicContact CD2-CD1 4.35Å; L273-I277 HydrophobicContact CG-CD1 4.43Å; L273-I277 WeakPolarHBondContact O-CD1 3.31Å; L273-I277 VanDerWaalsContact O-CG1 3.27Å; L273-I277 WeakPolarHBondContact O-CG1 3.26Å; L273-I277 PolarHBondContact O-N 3.43Å
274	E	30.7	Very low	31.1	Very low	168 Å²	168	128.5 Å²	128.5	79%	0.785	71%	0.707	S	S	*	*	H	α-helix	trans	-73.2	-36.7	-179.9	-68.8	-158.9	139.3	0	0	112.7	E272 V278	E272-E274 PolarHBondContact O-N 2.83Å; E274-V278 WeakPolarHBondContact O-CG2 3.23Å; E274-V278 PolarHBondContact O-N 3.25Å
275	E	30.4	Very low	30.5	Very low	167 Å²	167	128.3 Å²	128.3	78%	0.78	70%	0.702	S	S	*	*	H	α-helix	trans	-73.6	-35.5	175.3	-70.3	-163.9	140.2	0	0	112.1	E272 I277 V278 S279	E272-E275 PolarHBondContact O-N 3.12Å; E275-I277 VanDerWaalsContact C-N 3.33Å; E275-I277 PolarHBondContact O-N 3.31Å; E275-V278 PolarHBondContact O-N 3.08Å; E275-S279 PolarHBondContact O-N 3.39Å
276	A	29.7	Very low	29.8	Very low	55 Å²	55	123.8 Å²	123.8	46%	0.455	69%	0.687	S	S	.	*	H	α-helix	trans	-61.1	-39.9	173.8	0	0	0	0	0	112.3	E272 S279 A280	E272-A276 PolarHBondContact O-N 2.93Å; A276-S279 PolarHBondContact O-N 3.33Å; A276-A280 WeakPolarHBondContact O-CB 3.3Å; A276-A280 PolarHBondContact O-N 3.23Å
277	I	30.6	Very low	29.3	Very low	93 Å²	93	122.9 Å²	122.9	48%	0.477	68%	0.683	S	S	.	*	H	α-helix	trans	-68.3	-35.5	175.7	-68.8	166.3	0	0	0	111.2	L273 E275 N281	L273-I277 HydrophobicContact CD2-CD1 4.35Å; L273-I277 HydrophobicContact CG-CD1 4.43Å; L273-I277 WeakPolarHBondContact O-CD1 3.31Å; L273-I277 VanDerWaalsContact O-CG1 3.27Å; L273-I277 WeakPolarHBondContact O-CG1 3.26Å; L273-I277 PolarHBondContact O-N 3.43Å; E275-I277 VanDerWaalsContact C-N 3.33Å; E275-I277 PolarHBondContact O-N 3.31Å; I277-N281 PolarHBondContact O-N 2.68Å; I277-N281 PolarHBondContact O-ND2 3.23Å
278	V	30.7	Very low	29.3	Very low	110 Å²	110	120.4 Å²	120.4	67%	0.667	67%	0.665	S	S	*	*	H	α-helix	trans	-66.9	-41.1	174.1	173.5	0	0	0	0	111	E274 E275 N281	E274-V278 WeakPolarHBondContact O-CG2 3.23Å; E274-V278 PolarHBondContact O-N 3.25Å; E275-V278 PolarHBondContact O-N 3.08Å; V278-N281 PolarHBondContact O-N 3Å
279	S	29.2	Very low	29	Very low	87 Å²	87	121.4 Å²	121.4	61%	0.608	66%	0.658	S	S	*	*	H	α-helix	trans	-69.2	-38.6	176.9	-168.2	0	0	0	0	113	E275 A276 N281 S282	E275-S279 PolarHBondContact O-N 3.39Å; A276-S279 PolarHBondContact O-N 3.33Å; S279-N281 PolarHBondContact O-N 3.32Å; S279-S282 WeakPolarHBondContact O-CB 3.23Å; S279-S282 PolarHBondContact O-N 2.79Å
280	A	31.1	Very low	28.8	Very low	75 Å²	75	117.6 Å²	117.6	62%	0.62	64%	0.639	S	S	*	*	H	α-helix	trans	-67.2	-19.3	176.9	0	0	0	0	0	113.4	A276 S282	A276-A280 WeakPolarHBondContact O-CB 3.3Å; A276-A280 PolarHBondContact O-N 3.23Å; A280-S282 PolarHBondContact O-N 2.65Å
281	N	28.7	Very low	28.8	Very low	125 Å²	125	122 Å²	122	67%	0.668	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	0.1	170.3	-78.4	-64.5	0	0	0	113.4	I277 V278 S279 F283	I277-N281 PolarHBondContact O-N 2.68Å; I277-N281 PolarHBondContact O-ND2 3.23Å; V278-N281 PolarHBondContact O-N 3Å; S279-N281 PolarHBondContact O-N 3.32Å; N281-F283 PolarHBondContact O-N 2.87Å
282	S	25.1	Very low	28.6	Very low	83 Å²	83	120.3 Å²	120.3	58%	0.58	63%	0.632	S	S	*	*			trans	-76.3	65.1	166.7	-164.7	0	0	0	0	111.2	S279 A280 K284	S279-S282 WeakPolarHBondContact O-CB 3.23Å; S279-S282 PolarHBondContact O-N 2.79Å; A280-S282 PolarHBondContact O-N 2.65Å; S282-K284 VanDerWaalsContact C-N 3.29Å; S282-K284 PolarHBondContact O-N 3.47Å
283	F	28.1	Very low	28.4	Very low	182 Å²	182	115.5 Å²	115.5	80%	0.798	62%	0.618	S	S	*	*			trans	-67.2	92.9	164.3	-114.2	-92.4	0	0	0	108.3	N281 I285	N281-F283 PolarHBondContact O-N 2.87Å; F283-I285 HydrophobicContact CB-CG1 4.44Å; F283-I285 HydrophobicContact CD1-CG1 4.39Å; F283-I285 PolarHBondContact O-N 3.4Å
284	K	25.8	Very low	28.2	Very low	193 Å²	193	118 Å²	118	84%	0.839	62%	0.62	S	S	*	*			trans	-67.5	86.1	161	-74.2	-176.7	177.4	178.8	0	107.6	S282 D286	S282-K284 VanDerWaalsContact C-N 3.29Å; S282-K284 PolarHBondContact O-N 3.47Å; K284-D286 PolarHBondContact O-N 2.74Å
285	I	26.8	Very low	28.6	Very low	85 Å²	85	120.9 Å²	120.9	44%	0.436	62%	0.624	S	S	.	*			trans	-66.9	124.2	168.9	-55.1	172.2	0	0	0	106.5	F283 E289 F290	F283-I285 HydrophobicContact CB-CG1 4.44Å; F283-I285 HydrophobicContact CD1-CG1 4.39Å; F283-I285 PolarHBondContact O-N 3.4Å; I285-E289 HydrophobicContact CG2-CB 4.27Å; I285-F290 HydrophobicContact CB-CD2 4.45Å; I285-F290 HydrophobicContact CD1-CE2 4.28Å; I285-F290 HydrophobicContact CG2-CD2 3.89Å
286	D	23.3	Very low	29.7	Very low	95 Å²	95	115.4 Å²	115.4	51%	0.508	60%	0.599	S	S	.	*			trans	-64.2	129.3	178	-161.1	0.4	0	0	0	108.2	K284 S288 E289 F290	K284-D286 PolarHBondContact O-N 2.74Å; D286-S288 PolarHBondContact O-N 3.36Å; D286-S288 PolarHBondContact OD1-OG 2.88Å; D286-S288 PolarHBondContact OD2-OG 2.8Å; D286-S288 VanDerWaalsContact OD2-OG 3.06Å; D286-E289 HydrophobicContact CB-CG 4.25Å; D286-E289 WeakPolarHBondContact O-CB 3.32Å; D286-E289 PolarHBondContact O-N 3.29Å; D286-F290 PolarHBondContact O-N 3.5Å
287	P	26.4	Very low	31.3	Very low	98 Å²	98	116.6 Å²	116.6	64%	0.636	60%	0.598	S	S	*	*	H	α-helix	trans	-55.2	-27.5	-177.6	-30	37.4	0	0	0	113.9	F290 E291	P287-F290 WeakPolarHBondContact O-CB 3.31Å; P287-F290 PolarHBondContact O-N 2.83Å; P287-E291 PolarHBondContact O-N 3.34Å
288	S	30.1	Very low	33.3	Very low	59 Å²	59	113.5 Å²	113.5	41%	0.413	58%	0.581	S	S	.	*	H	α-helix	trans	-68.1	-30	174.1	57.1	0	0	0	0	114.2	D286 H292	D286-S288 PolarHBondContact O-N 3.36Å; D286-S288 PolarHBondContact OD1-OG 2.88Å; D286-S288 PolarHBondContact OD2-OG 2.8Å; D286-S288 VanDerWaalsContact OD2-OG 3.06Å; S288-H292 PolarHBondContact O-ND1 3.47Å
289	E	28.1	Very low	35.4	Very low	132 Å²	132	110.8 Å²	110.8	62%	0.617	57%	0.565	S	S	*	*	H	α-helix	trans	-74.4	-31.8	169.8	-69	-171.1	149.2	0	0	111.1	I285 D286 E291 H292 S293	I285-E289 HydrophobicContact CG2-CB 4.27Å; D286-E289 HydrophobicContact CB-CG 4.25Å; D286-E289 WeakPolarHBondContact O-CB 3.32Å; D286-E289 PolarHBondContact O-N 3.29Å; E289-E291 PolarHBondContact O-N 2.96Å; E289-H292 PolarHBondContact O-N 3.38Å; E289-S293 PolarHBondContact O-N 2.96Å
290	F	27.5	Very low	37.6	Very low	105 Å²	105	108.6 Å²	108.6	46%	0.461	55%	0.548	S	S	.	.	H	α-helix	trans	-65.7	-37	178.1	-137.3	-87	0	0	0	112.3	I285 D286 P287 H292 S293 Y294	I285-F290 HydrophobicContact CB-CD2 4.45Å; I285-F290 HydrophobicContact CD1-CE2 4.28Å; I285-F290 HydrophobicContact CG2-CD2 3.89Å; D286-F290 PolarHBondContact O-N 3.5Å; P287-F290 WeakPolarHBondContact O-CB 3.31Å; P287-F290 PolarHBondContact O-N 2.83Å; F290-H292 VanDerWaalsContact C-N 3.29Å; F290-H292 PolarHBondContact O-N 3.42Å; F290-S293 PolarHBondContact O-N 3.4Å; F290-S293 VanDerWaalsContact O-N 3.16Å; F290-S293 PolarHBondContact O-OG 3.07Å; F290-Y294 HydrophobicContact CD1-CE2 4.37Å; F290-Y294 HydrophobicContact CE1-CE2 4.14Å
291	E	26.7	Very low	40	Very low	162 Å²	162	105.4 Å²	105.4	76%	0.757	52%	0.52	S	S	*	.	H	α-helix	trans	-64	-30.1	176.2	-71.2	-170.9	145	0	0	113.3	P287 E289	P287-E291 PolarHBondContact O-N 3.34Å; E289-E291 PolarHBondContact O-N 2.96Å
292	H	27.8	Very low	42.5	Very low	161 Å²	161	100.1 Å²	100.1	75%	0.745	49%	0.492	S	S	*	.	H	α-helix	trans	-80.3	-22.6	174.8	-80.2	78.5	0	0	0	113.3	S288 E289 F290 Y294	S288-H292 PolarHBondContact O-ND1 3.47Å; E289-H292 PolarHBondContact O-N 3.38Å; F290-H292 VanDerWaalsContact C-N 3.29Å; F290-H292 PolarHBondContact O-N 3.42Å; H292-Y294 VanDerWaalsContact C-N 3.31Å; H292-Y294 PolarHBondContact O-N 3.31Å
293	S	27.3	Very low	45.1	Very low	73 Å²	73	100.3 Å²	100.3	51%	0.51	48%	0.483	S	S	.	.	H	α-helix	trans	-76	-12.3	-177.5	76.8	0	0	0	0	114.9	E289 F290 R295	E289-S293 PolarHBondContact O-N 2.96Å; F290-S293 PolarHBondContact O-N 3.4Å; F290-S293 VanDerWaalsContact O-N 3.16Å; F290-S293 PolarHBondContact O-OG 3.07Å; S293-R295 VanDerWaalsContact C-N 3.3Å; S293-R295 PolarHBondContact O-N 3.49Å
294	Y	28.1	Very low	47.5	Very low	170 Å²	170	92.8 Å²	92.8	67%	0.667	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-0.6	-177.9	-107.4	-81.4	0	0	0	115.5	F290 H292 I296	F290-Y294 HydrophobicContact CD1-CE2 4.37Å; F290-Y294 HydrophobicContact CE1-CE2 4.14Å; H292-Y294 VanDerWaalsContact C-N 3.31Å; H292-Y294 PolarHBondContact O-N 3.31Å; Y294-I296 VanDerWaalsContact C-N 3.26Å; Y294-I296 PolarHBondContact O-N 2.82Å
295	R	38.6	Very low	50.4	Low	228 Å²	228	83.6 Å²	83.6	86%	0.86	42%	0.415	S	S	*	.	S	Bend	trans	-70.7	88.2	159.5	-79.8	-171.5	172.6	-166.8	-0.1	108.6	S293 D297	S293-R295 VanDerWaalsContact C-N 3.3Å; S293-R295 PolarHBondContact O-N 3.49Å; R295-D297 PolarHBondContact O-N 3.26Å
296	I	53.2	Low	53.1	Low	52 Å²	52	84 Å²	84	27%	0.267	41%	0.413	S	S	.	.			trans	-52.2	111.5	171.8	-47.2	-178	0	0	0	107.5	Y294 Y298 N301 P341	Y294-I296 VanDerWaalsContact C-N 3.26Å; Y294-I296 PolarHBondContact O-N 2.82Å; I296-Y298 PolarHBondContact O-N 2.87Å; I296-N301 VanDerWaalsContact CG2-ND2 3.26Å; I296-N301 WeakPolarHBondContact CG2-ND2 3.04Å; I296-N301 PolarHBondContact O-ND2 3.23Å; I296-P341 WeakPolarHBondContact CD1-O 3.34Å
297	D	64.1	Low	55.8	Low	81 Å²	81	82.9 Å²	82.9	43%	0.433	41%	0.41	S	S	.	.			trans	-57.1	118.3	-167.7	-178.1	-12.3	0	0	0	110.1	R295 T299 V300 N301	R295-D297 PolarHBondContact O-N 3.26Å; D297-T299 PolarHBondContact O-N 3.14Å; D297-T299 WeakPolarHBondContact OD1-CB 3.42Å; D297-T299 WeakPolarHBondContact OD1-CG2 3.5Å; D297-T299 PolarHBondContact OD1-N 3.48Å; D297-T299 PolarHBondContact OD1-OG1 3.45Å; D297-T299 PolarHBondContact OD2-OG1 3.37Å; D297-V300 HydrophobicContact CB-CB 4.09Å; D297-V300 HydrophobicContact CB-CG2 3.8Å; D297-V300 PolarHBondContact O-N 3.35Å; D297-N301 PolarHBondContact O-N 3.3Å; D297-N301 PolarHBondContact O-ND2 3.3Å
298	Y	73.7	Confident	58.5	Low	27 Å²	27	78.8 Å²	78.8	11%	0.106	38%	0.383	C	S	.	.	H	α-helix	trans	-59	-32.3	-178.1	-164.4	-102.6	0	0	0	111.2	S184 H187 V188 I296 L302 I337	S184-Y298 VanDerWaalsContact CA-OH 3.23Å; S184-Y298 WeakPolarHBondContact CA-OH 2.98Å; S184-Y298 WeakPolarHBondContact CB-OH 3.49Å; S184-Y298 PolarHBondContact O-OH 3.25Å; S184-Y298 VanDerWaalsContact O-OH 3.12Å; H187-Y298 HydrophobicContact CB-CD1 3.63Å; H187-Y298 HydrophobicContact CB-CE1 3.48Å; H187-Y298 VanDerWaalsContact CB-CE1 3.48Å; H187-Y298 HydrophobicContact CB-CG 4.25Å; V188-Y298 HydrophobicContact CG2-CE1 4.13Å; I296-Y298 PolarHBondContact O-N 2.87Å; Y298-L302 HydrophobicContact CD1-CD1 3.71Å; Y298-L302 HydrophobicContact CD1-CG 4.19Å; Y298-L302 HydrophobicContact CE1-CD1 3.56Å; Y298-L302 HydrophobicContact CE1-CD2 4.24Å; Y298-L302 HydrophobicContact CE1-CG 3.97Å; Y298-L302 WeakPolarHBondContact O-CB 2.98Å; Y298-L302 VanDerWaalsContact O-CG 3.23Å; Y298-L302 WeakPolarHBondContact O-CG 3.28Å; Y298-L302 PolarHBondContact O-N 2.84Å; Y298-I337 HydrophobicContact CD2-CG2 3.66Å; Y298-I337 HydrophobicContact CE2-CB 4.01Å; Y298-I337 HydrophobicContact CE2-CD1 4.41Å; Y298-I337 HydrophobicContact CE2-CG2 3.6Å
299	T	73.1	Confident	61.2	Low	53 Å²	53	76.1 Å²	76.1	33%	0.325	36%	0.364	S	S	.	.	H	α-helix	trans	-68.4	-39.9	175.5	74.2	0	0	0	0	112.4	N191 D297 L302 H303	N191-T299 HydrophobicContact CB-CG2 4.39Å; N191-T299 WeakPolarHBondContact ND2-CG2 3.25Å; D297-T299 PolarHBondContact O-N 3.14Å; D297-T299 WeakPolarHBondContact OD1-CB 3.42Å; D297-T299 WeakPolarHBondContact OD1-CG2 3.5Å; D297-T299 PolarHBondContact OD1-N 3.48Å; D297-T299 PolarHBondContact OD1-OG1 3.45Å; D297-T299 PolarHBondContact OD2-OG1 3.37Å; T299-L302 PolarHBondContact O-N 2.99Å; T299-H303 WeakPolarHBondContact O-CB 3.25Å; T299-H303 PolarHBondContact O-N 3.46Å
300	V	76.4	Confident	63.5	Low	42 Å²	42	73.2 Å²	73.2	26%	0.255	36%	0.357	S	S	.	.	H	α-helix	trans	-66.2	-44.3	176.7	175.2	0	0	0	0	110.5	F225 D297 L302 H303 A304	F225-V300 HydrophobicContact CE1-CG1 4.47Å; F225-V300 HydrophobicContact CE1-CG2 4.37Å; D297-V300 HydrophobicContact CB-CB 4.09Å; D297-V300 HydrophobicContact CB-CG2 3.8Å; D297-V300 PolarHBondContact O-N 3.35Å; V300-L302 PolarHBondContact O-N 3.01Å; V300-H303 PolarHBondContact O-N 3.39Å; V300-A304 WeakPolarHBondContact O-CB 3.19Å; V300-A304 PolarHBondContact O-N 2.97Å
301	N	81.3	Confident	66.1	Low	7 Å²	7	72.4 Å²	72.4	4%	0.037	36%	0.355	C	S	.	.	H	α-helix	trans	-57.7	-48.6	174.1	-73.1	-64.6	0	0	0	111.8	I296 D297 H303 A304 I305 I337 Y345	I296-N301 VanDerWaalsContact CG2-ND2 3.26Å; I296-N301 WeakPolarHBondContact CG2-ND2 3.04Å; I296-N301 PolarHBondContact O-ND2 3.23Å; D297-N301 PolarHBondContact O-N 3.3Å; D297-N301 PolarHBondContact O-ND2 3.3Å; N301-H303 VanDerWaalsContact C-N 3.33Å; N301-H303 PolarHBondContact O-N 2.94Å; N301-A304 PolarHBondContact O-N 3.3Å; N301-I305 WeakPolarHBondContact O-CG1 3.36Å; N301-I305 PolarHBondContact O-N 2.95Å; N301-I337 HydrophobicContact CB-CD1 3.63Å; N301-I337 HydrophobicContact CB-CG1 4.38Å; N301-Y345 WeakPolarHBondContact OD1-CB 3.13Å; N301-Y345 PolarHBondContact OD1-N 3.39Å
302	L	81.5	Confident	68.8	Low	15 Å²	15	64.9 Å²	64.9	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-63.7	-35.6	177.4	-71.4	173.2	0	0	0	113.1	V188 Y298 T299 V300 K306 A334	V188-L302 HydrophobicContact CG2-CD1 3.74Å; Y298-L302 HydrophobicContact CD1-CD1 3.71Å; Y298-L302 HydrophobicContact CD1-CG 4.19Å; Y298-L302 HydrophobicContact CE1-CD1 3.56Å; Y298-L302 HydrophobicContact CE1-CD2 4.24Å; Y298-L302 HydrophobicContact CE1-CG 3.97Å; Y298-L302 WeakPolarHBondContact O-CB 2.98Å; Y298-L302 VanDerWaalsContact O-CG 3.23Å; Y298-L302 WeakPolarHBondContact O-CG 3.28Å; Y298-L302 PolarHBondContact O-N 2.84Å; T299-L302 PolarHBondContact O-N 2.99Å; V300-L302 PolarHBondContact O-N 3.01Å; L302-K306 WeakPolarHBondContact O-CG 3.44Å; L302-K306 PolarHBondContact O-N 2.92Å; L302-K306 VanDerWaalsContact O-N 3.14Å; L302-A334 HydrophobicContact CD2-CB 4.47Å
303	H	78.2	Confident	71.3	Confident	87 Å²	87	57.8 Å²	57.8	40%	0.403	29%	0.287	S	S	.	.	H	α-helix	trans	-65.7	-47.2	175.2	-174.4	80.5	0	0	0	110.9	F225 T299 V300 N301 I305 K306 V307	F225-H303 HydrophobicContact CE1-CB 4.06Å; F225-H303 AromaticContact CE1-CD2 3.54Å; F225-H303 AromaticContact CE1-CG 3.84Å; F225-H303 HydrophobicContact CZ-CB 4.26Å; F225-H303 AromaticContact CZ-CD2 3.79Å; F225-H303 AromaticContact CZ-CG 3.85Å; T299-H303 WeakPolarHBondContact O-CB 3.25Å; T299-H303 PolarHBondContact O-N 3.46Å; V300-H303 PolarHBondContact O-N 3.39Å; N301-H303 VanDerWaalsContact C-N 3.33Å; N301-H303 PolarHBondContact O-N 2.94Å; H303-I305 VanDerWaalsContact C-N 3.35Å; H303-I305 PolarHBondContact O-N 3.33Å; H303-K306 PolarHBondContact O-N 3.43Å; H303-K306 VanDerWaalsContact O-N 3.15Å; H303-V307 WeakPolarHBondContact O-CG2 3.37Å; H303-V307 PolarHBondContact O-N 3.38Å; H303-V307 VanDerWaalsContact O-N 3.12Å
304	A	80.4	Confident	73.6	Confident	24 Å²	24	57.9 Å²	57.9	20%	0.198	29%	0.285	C	S	.	.	H	α-helix	trans	-59.2	-42.9	176	0	0	0	0	0	112.2	V300 N301 K306 V307 D308 Y345	V300-A304 WeakPolarHBondContact O-CB 3.19Å; V300-A304 PolarHBondContact O-N 2.97Å; N301-A304 PolarHBondContact O-N 3.3Å; A304-K306 PolarHBondContact O-N 3.43Å; A304-V307 PolarHBondContact O-N 3.02Å; A304-D308 WeakPolarHBondContact O-CB 3.42Å; A304-D308 PolarHBondContact O-N 2.98Å; A304-D308 VanDerWaalsContact O-N 3.08Å; A304-Y345 HydrophobicContact CB-CD1 3.72Å; A304-Y345 HydrophobicContact CB-CE1 3.81Å
305	I	86.2	Confident	75.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-54.4	-50	172.7	-74.4	167.4	0	0	0	111.1	N301 H303 V307 D308 M309 L333 I337 Y345	N301-I305 WeakPolarHBondContact O-CG1 3.36Å; N301-I305 PolarHBondContact O-N 2.95Å; H303-I305 VanDerWaalsContact C-N 3.35Å; H303-I305 PolarHBondContact O-N 3.33Å; I305-V307 VanDerWaalsContact C-N 3.33Å; I305-V307 PolarHBondContact O-N 3.38Å; I305-D308 PolarHBondContact O-N 3.23Å; I305-M309 HydrophobicContact CG2-CG 4.04Å; I305-M309 HydrophobicContact CG2-SD 3.45Å; I305-M309 WeakPolarHBondContact CG2-SD 3.06Å; I305-M309 WeakPolarHBondContact O-CB 3.08Å; I305-M309 WeakPolarHBondContact O-CG 3.39Å; I305-M309 PolarHBondContact O-N 2.64Å; I305-L333 HydrophobicContact CD1-CB 3.65Å; I305-L333 HydrophobicContact CG1-CB 4.11Å; I305-L333 HydrophobicContact CG1-CD1 4.17Å; I305-L333 HydrophobicContact CG2-CB 4.48Å; I305-L333 HydrophobicContact CG2-CD1 3.94Å; I305-I337 HydrophobicContact CD1-CD1 3.53Å; I305-Y345 HydrophobicContact CD1-CD2 3.99Å; I305-Y345 HydrophobicContact CD1-CG 4.1Å; I305-Y345 HydrophobicContact CG1-CD1 3.83Å; I305-Y345 HydrophobicContact CG1-CD2 3.47Å; I305-Y345 VanDerWaalsContact CG1-CD2 3.47Å; I305-Y345 HydrophobicContact CG1-CE1 3.99Å; I305-Y345 HydrophobicContact CG1-CE2 3.63Å; I305-Y345 HydrophobicContact CG1-CG 3.57Å
306	K	82.3	Confident	77.8	Confident	93 Å²	93	46.1 Å²	46.1	40%	0.404	26%	0.256	S	S	.	.	H	α-helix	trans	-62.4	-37.7	-177.8	-73.3	171.1	-178.5	178.5	0	113.1	L302 H303 A304	L302-K306 WeakPolarHBondContact O-CG 3.44Å; L302-K306 PolarHBondContact O-N 2.92Å; L302-K306 VanDerWaalsContact O-N 3.14Å; H303-K306 PolarHBondContact O-N 3.43Å; H303-K306 VanDerWaalsContact O-N 3.15Å; A304-K306 PolarHBondContact O-N 3.43Å
307	V	80.8	Confident	79.1	Confident	71 Å²	71	46.4 Å²	46.4	43%	0.43	26%	0.258	S	S	.	.	H	α-helix	trans	-67.4	-44.6	177.6	172.7	0	0	0	0	111	H303 A304 I305 Q311	H303-V307 WeakPolarHBondContact O-CG2 3.37Å; H303-V307 PolarHBondContact O-N 3.38Å; H303-V307 VanDerWaalsContact O-N 3.12Å; A304-V307 PolarHBondContact O-N 3.02Å; I305-V307 VanDerWaalsContact C-N 3.33Å; I305-V307 PolarHBondContact O-N 3.38Å; V307-Q311 PolarHBondContact O-NE2 3.27Å
308	D	83.9	Confident	80	Confident	13 Å²	13	42.7 Å²	42.7	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-70.7	-41.1	-177.9	-102.2	32	0	0	0	113.2	A304 I305 C310 Q311 Y345 P347 G348 S350	A304-D308 WeakPolarHBondContact O-CB 3.42Å; A304-D308 PolarHBondContact O-N 2.98Å; A304-D308 VanDerWaalsContact O-N 3.08Å; I305-D308 PolarHBondContact O-N 3.23Å; D308-C310 PolarHBondContact O-N 2.72Å; D308-C310 VanDerWaalsContact O-N 3.15Å; D308-Q311 WeakPolarHBondContact O-CB 3.47Å; D308-Q311 PolarHBondContact O-N 3.41Å; D308-Y345 VanDerWaalsContact CB-OH 3.25Å; D308-Y345 WeakPolarHBondContact CB-OH 2.97Å; D308-Y345 VanDerWaalsContact CG-OH 3.26Å; D308-Y345 PolarHBondContact OD2-OH 3.15Å; D308-P347 VanDerWaalsContact OD2-CA 3.28Å; D308-P347 WeakPolarHBondContact OD2-CA 3.45Å; D308-G348 PolarHBondContact OD2-N 3.16Å; D308-S350 WeakPolarHBondContact CB-OG 3.18Å; D308-S350 PolarHBondContact OD2-OG 3.05Å
309	M	85.5	Confident	80.6	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-55.8	-34.2	-176.7	-79.2	175.6	64.5	0	0	113.4	I305 Q311 H326 L329 H330	I305-M309 HydrophobicContact CG2-CG 4.04Å; I305-M309 HydrophobicContact CG2-SD 3.45Å; I305-M309 WeakPolarHBondContact CG2-SD 3.06Å; I305-M309 WeakPolarHBondContact O-CB 3.08Å; I305-M309 WeakPolarHBondContact O-CG 3.39Å; I305-M309 PolarHBondContact O-N 2.64Å; M309-Q311 PolarHBondContact O-N 3.43Å; M309-H326 WeakPolarHBondContact CE-ND1 3.34Å; M309-H326 WeakPolarHBondContact CE-O 3.34Å; M309-L329 HydrophobicContact CB-CD2 4.45Å; M309-L329 HydrophobicContact CE-CB 4.18Å; M309-L329 HydrophobicContact CE-CD2 4.27Å; M309-L329 HydrophobicContact CE-CG 4.28Å; M309-L329 HydrophobicContact CG-CD2 3.72Å; M309-L329 HydrophobicContact CG-CG 4.11Å; M309-L329 HydrophobicContact SD-CG 4.43Å; M309-H330 HydrophobicContact CE-CB 4.03Å; M309-H330 HydrophobicContact SD-CB 4.04Å
310	C	77.5	Confident	81.1	Confident	71 Å²	71	40 Å²	40	48%	0.48	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.3	178.7	-65.8	0	0	0	0	113.9	D308	D308-C310 PolarHBondContact O-N 2.72Å; D308-C310 VanDerWaalsContact O-N 3.15Å
311	Q	80.9	Confident	81.4	Confident	89 Å²	89	42.3 Å²	42.3	42%	0.416	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-14.2	-174.7	-54.8	-179.9	26	0	0	113.2	V307 D308 M309 F313 P314 W351	V307-Q311 PolarHBondContact O-NE2 3.27Å; D308-Q311 WeakPolarHBondContact O-CB 3.47Å; D308-Q311 PolarHBondContact O-N 3.41Å; M309-Q311 PolarHBondContact O-N 3.43Å; Q311-F313 PolarHBondContact O-N 3.2Å; Q311-P314 WeakPolarHBondContact O-CD 3.38Å; Q311-W351 HydrophobicContact CB-CZ2 3.88Å; Q311-W351 WeakPolarHBondContact O-CH2 3.32Å; Q311-W351 VanDerWaalsContact O-CZ2 3.23Å; Q311-W351 WeakPolarHBondContact O-CZ2 3.43Å
312	I	83.7	Confident	81.4	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.015	28%	0.277	C	S	.	.	S	Bend	trans	-76.2	115	-171.3	-53.3	160.8	0	0	0	110.4	F319 L329 S350 W351	I312-F319 HydrophobicContact CB-CD2 3.74Å; I312-F319 HydrophobicContact CB-CE2 4.23Å; I312-F319 HydrophobicContact CB-CG 4.45Å; I312-F319 HydrophobicContact CD1-CD2 4.36Å; I312-F319 HydrophobicContact CD1-CG 4.37Å; I312-F319 HydrophobicContact CG2-CD2 3.62Å; I312-F319 HydrophobicContact CG2-CE2 3.56Å; I312-F319 HydrophobicContact CG2-CZ 4.49Å; I312-L329 HydrophobicContact CD1-CD2 3.3Å; I312-S350 WeakPolarHBondContact CD1-O 3.49Å; I312-W351 HydrophobicContact CB-CD2 4.49Å; I312-W351 HydrophobicContact CB-CE3 4.39Å; I312-W351 HydrophobicContact CG1-CD2 4.1Å; I312-W351 HydrophobicContact CG1-CE3 4.49Å; I312-W351 HydrophobicContact CG1-CG 4.27Å; I312-W351 HydrophobicContact CG2-CD2 4.43Å; I312-W351 HydrophobicContact CG2-CE3 4.04Å; I312-W351 HydrophobicContact CG2-CZ3 4.47Å
313	F	79.6	Confident	81.6	Confident	12 Å²	12	49 Å²	49	5%	0.053	29%	0.289	C	S	.	.	S	Bend	trans	41.4	61.7	-179.9	-54.7	-57.6	0	0	0	112.8	Q311 T315 L316 W351 M355 I358 S432 L437	Q311-F313 PolarHBondContact O-N 3.2Å; F313-T315 PolarHBondContact O-N 3.08Å; F313-T315 VanDerWaalsContact O-N 3.11Å; F313-L316 HydrophobicContact CB-CB 4.37Å; F313-L316 HydrophobicContact CB-CD1 3.82Å; F313-L316 HydrophobicContact CB-CG 4.1Å; F313-L316 HydrophobicContact CG-CD1 4.33Å; F313-L316 WeakPolarHBondContact O-CB 3.29Å; F313-L316 PolarHBondContact O-N 2.88Å; F313-W351 HydrophobicContact CD1-CZ3 4.33Å; F313-W351 HydrophobicContact CE1-CZ3 4.32Å; F313-M355 HydrophobicContact CE2-CG 4Å; F313-M355 HydrophobicContact CE2-SD 3.57Å; F313-M355 VanDerWaalsContact CE2-SD 3.57Å; F313-M355 HydrophobicContact CZ-CG 4.14Å; F313-M355 HydrophobicContact CZ-SD 3.51Å; F313-M355 VanDerWaalsContact CZ-SD 3.51Å; F313-I358 HydrophobicContact CD2-CD1 3.99Å; F313-I358 HydrophobicContact CE2-CD1 4.2Å; F313-S432 WeakPolarHBondContact CE1-O 3.23Å; F313-L437 HydrophobicContact CD1-CB 4.12Å; F313-L437 HydrophobicContact CD2-CD1 4.33Å; F313-L437 HydrophobicContact CE1-CB 4.07Å; F313-L437 HydrophobicContact CE2-CD1 3.85Å; F313-L437 HydrophobicContact CG-CB 4.38Å; F313-L437 HydrophobicContact CZ-CB 4.28Å; F313-L437 HydrophobicContact CZ-CD1 4.05Å
314	P	77	Confident	81.9	Confident	75 Å²	75	47.1 Å²	47.1	49%	0.487	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-63.4	-28.5	-167	27	-33.7	0	0	0	111.9	Q311 L316 N317	Q311-P314 WeakPolarHBondContact O-CD 3.38Å; P314-L316 PolarHBondContact O-N 3.4Å; P314-L316 VanDerWaalsContact O-N 3.16Å; P314-N317 PolarHBondContact O-N 3.16Å; P314-N317 VanDerWaalsContact O-N 3.11Å
315	T	74.9	Confident	82.3	Confident	120 Å²	120	46 Å²	46	74%	0.736	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-61.7	-17.1	173	52.9	0	0	0	0	114.6	F313	F313-T315 PolarHBondContact O-N 3.08Å; F313-T315 VanDerWaalsContact O-N 3.11Å
316	L	79.4	Confident	82.5	Confident	32 Å²	32	48.4 Å²	48.4	17%	0.168	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-101	-15.7	176.2	-53.7	179.9	0	0	0	112.9	F313 P314 L318 L437	F313-L316 HydrophobicContact CB-CB 4.37Å; F313-L316 HydrophobicContact CB-CD1 3.82Å; F313-L316 HydrophobicContact CB-CG 4.1Å; F313-L316 HydrophobicContact CG-CD1 4.33Å; F313-L316 WeakPolarHBondContact O-CB 3.29Å; F313-L316 PolarHBondContact O-N 2.88Å; P314-L316 PolarHBondContact O-N 3.4Å; P314-L316 VanDerWaalsContact O-N 3.16Å; L316-L318 HydrophobicContact CB-CD1 3.89Å; L316-L318 HydrophobicContact CB-CD2 4.39Å; L316-L318 HydrophobicContact CB-CG 3.72Å; L316-L318 HydrophobicContact CD1-CD1 4.09Å; L316-L318 VanDerWaalsContact O-CD2 3.32Å; L316-L318 WeakPolarHBondContact O-CD2 3.37Å; L316-L318 WeakPolarHBondContact O-CG 3.5Å; L316-L318 PolarHBondContact O-N 3.14Å; L316-L318 VanDerWaalsContact O-N 3.1Å; L316-L437 HydrophobicContact CD1-CB 4.09Å; L316-L437 HydrophobicContact CD1-CD2 3.38Å; L316-L437 HydrophobicContact CD1-CG 4.35Å
317	N	80.5	Confident	83	Confident	57 Å²	57	50.8 Å²	50.8	31%	0.305	30%	0.297	S	S	.	.			trans	53.4	23.6	178.7	-96	-46.1	0	0	0	116.5	P314 F319 S320 Y323	P314-N317 PolarHBondContact O-N 3.16Å; P314-N317 VanDerWaalsContact O-N 3.11Å; N317-F319 PolarHBondContact O-N 2.91Å; N317-S320 PolarHBondContact OD1-OG 3.02Å; N317-Y323 HydrophobicContact CB-CE1 4.05Å; N317-Y323 HydrophobicContact CB-CE2 4.31Å; N317-Y323 WeakPolarHBondContact O-CB 3.46Å; N317-Y323 WeakPolarHBondContact O-CD1 2.93Å; N317-Y323 VanDerWaalsContact O-CD2 3.32Å; N317-Y323 WeakPolarHBondContact O-CD2 3.31Å
318	L	83.4	Confident	83.6	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.016	29%	0.292	C	S	.	.	S	Bend	trans	-75.6	-29.7	-169.5	-54.9	173.6	0	0	0	115	F64 I68 L316 Y323 Y325 I358	F64-L318 HydrophobicContact CB-CD2 4.45Å; F64-L318 HydrophobicContact CD1-CD2 4.16Å; I68-L318 HydrophobicContact CD1-CD1 3.36Å; I68-L318 HydrophobicContact CD1-CD2 3.26Å; I68-L318 HydrophobicContact CD1-CG 3.9Å; L316-L318 HydrophobicContact CB-CD1 3.89Å; L316-L318 HydrophobicContact CB-CD2 4.39Å; L316-L318 HydrophobicContact CB-CG 3.72Å; L316-L318 HydrophobicContact CD1-CD1 4.09Å; L316-L318 VanDerWaalsContact O-CD2 3.32Å; L316-L318 WeakPolarHBondContact O-CD2 3.37Å; L316-L318 WeakPolarHBondContact O-CG 3.5Å; L316-L318 PolarHBondContact O-N 3.14Å; L316-L318 VanDerWaalsContact O-N 3.1Å; L318-Y323 WeakPolarHBondContact O-CB 3.45Å; L318-Y325 HydrophobicContact CB-CD2 4.16Å; L318-Y325 WeakPolarHBondContact O-CB 3.36Å; L318-Y325 PolarHBondContact O-N 2.92Å; L318-I358 HydrophobicContact CD1-CD1 4.01Å; L318-I358 HydrophobicContact CD1-CG1 4.07Å
319	F	86.1	Confident	84.1	Confident	2 Å²	2	51 Å²	51	1%	0.009	29%	0.288	C	S	.	.	S	Bend	trans	-108.1	1.6	-173.2	-53.8	-74.1	0	0	0	112.8	I312 N317 Y325 H326 L329 G354 I358	I312-F319 HydrophobicContact CB-CD2 3.74Å; I312-F319 HydrophobicContact CB-CE2 4.23Å; I312-F319 HydrophobicContact CB-CG 4.45Å; I312-F319 HydrophobicContact CD1-CD2 4.36Å; I312-F319 HydrophobicContact CD1-CG 4.37Å; I312-F319 HydrophobicContact CG2-CD2 3.62Å; I312-F319 HydrophobicContact CG2-CE2 3.56Å; I312-F319 HydrophobicContact CG2-CZ 4.49Å; N317-F319 PolarHBondContact O-N 2.91Å; F319-Y325 HydrophobicContact CE1-CG 4.31Å; F319-H326 PolarHBondContact O-ND1 2.91Å; F319-L329 HydrophobicContact CB-CD2 4.09Å; F319-L329 HydrophobicContact CD1-CB 3.92Å; F319-L329 HydrophobicContact CD1-CD2 3.41Å; F319-L329 VanDerWaalsContact CD1-CD2 3.41Å; F319-L329 HydrophobicContact CD1-CG 4.27Å; F319-L329 HydrophobicContact CE1-CB 4.29Å; F319-L329 HydrophobicContact CE1-CD2 3.97Å; F319-L329 HydrophobicContact CG-CD2 3.82Å; F319-G354 VanDerWaalsContact CZ-CA 3.48Å; F319-G354 WeakPolarHBondContact CZ-O 3.45Å; F319-I358 HydrophobicContact CE2-CD1 3.87Å; F319-I358 HydrophobicContact CE2-CG1 4.46Å; F319-I358 HydrophobicContact CZ-CD1 3.79Å; F319-I358 HydrophobicContact CZ-CG1 3.94Å
320	S	83.3	Confident	84.4	Confident	23 Å²	23	52.7 Å²	52.7	16%	0.161	30%	0.297	C	S	.	.	S	Bend	trans	-66.8	148	174.1	-59.3	0	0	0	0	110.8	N317 G322 Y323 H326	N317-S320 PolarHBondContact OD1-OG 3.02Å; S320-G322 PolarHBondContact O-N 3.1Å; S320-Y323 WeakPolarHBondContact O-CB 3.29Å; S320-Y323 PolarHBondContact O-N 3.15Å; S320-H326 WeakPolarHBondContact O-CB 3.05Å
321	P	82.9	Confident	85.2	Confident	89 Å²	89	50.4 Å²	50.4	58%	0.578	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	131.1	177.1	-27.2	34.7	0	0	0	112.4
322	G	82.2	Confident	85.9	Confident	77 Å²	77	46.1 Å²	46.1	79%	0.794	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	-10.9	-175.6	0	0	0	0	0	115.6	S320	S320-G322 PolarHBondContact O-N 3.1Å
323	Y	85.6	Confident	86.5	Confident	87 Å²	87	46 Å²	46	34%	0.341	26%	0.259	S	S	.	.	S	Bend	trans	-93.2	154.6	177.1	-72.9	-97.8	0	0	0	112.6	N317 L318 S320 Y325 H326	N317-Y323 HydrophobicContact CB-CE1 4.05Å; N317-Y323 HydrophobicContact CB-CE2 4.31Å; N317-Y323 WeakPolarHBondContact O-CB 3.46Å; N317-Y323 WeakPolarHBondContact O-CD1 2.93Å; N317-Y323 VanDerWaalsContact O-CD2 3.32Å; N317-Y323 WeakPolarHBondContact O-CD2 3.31Å; L318-Y323 WeakPolarHBondContact O-CB 3.45Å; S320-Y323 WeakPolarHBondContact O-CB 3.29Å; S320-Y323 PolarHBondContact O-N 3.15Å; Y323-Y325 VanDerWaalsContact C-N 3.3Å; Y323-Y325 PolarHBondContact O-N 2.79Å; Y323-Y325 VanDerWaalsContact O-N 3.17Å; Y323-H326 WeakPolarHBondContact O-CB 3.33Å; Y323-H326 PolarHBondContact O-N 3.21Å; Y323-H326 VanDerWaalsContact O-N 3.13Å
324	P	83.7	Confident	87.1	Confident	46 Å²	46	45.5 Å²	45.5	30%	0.299	26%	0.257	S	S	.	.	H	α-helix	trans	-63.5	-29.7	-163.2	21.3	-34.1	0	0	0	114.6
325	Y	89.2	Confident	87.9	Confident	1 Å²	1	42 Å²	42	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-89.5	-12.3	-179.1	-65	-79.8	0	0	0	113.8	L318 F319 Y323 K327 R328 L329 L357	L318-Y325 HydrophobicContact CB-CD2 4.16Å; L318-Y325 WeakPolarHBondContact O-CB 3.36Å; L318-Y325 PolarHBondContact O-N 2.92Å; F319-Y325 HydrophobicContact CE1-CG 4.31Å; Y323-Y325 VanDerWaalsContact C-N 3.3Å; Y323-Y325 PolarHBondContact O-N 2.79Å; Y323-Y325 VanDerWaalsContact O-N 3.17Å; Y325-K327 PolarHBondContact O-N 2.83Å; Y325-R328 PolarHBondContact O-N 3.4Å; Y325-L329 WeakPolarHBondContact O-CB 3.4Å; Y325-L329 PolarHBondContact O-N 3.34Å; Y325-L357 HydrophobicContact CD1-CB 4.22Å
326	H	90.3	Very high	88.8	Confident	51 Å²	51	36.5 Å²	36.5	24%	0.236	20%	0.2	C	C	.	.	H	α-helix	trans	-54.5	-56.8	-179.4	180	81.5	0	0	0	112	M309 F319 S320 Y323 R328 L329 H330	M309-H326 WeakPolarHBondContact CE-ND1 3.34Å; M309-H326 WeakPolarHBondContact CE-O 3.34Å; F319-H326 PolarHBondContact O-ND1 2.91Å; S320-H326 WeakPolarHBondContact O-CB 3.05Å; Y323-H326 WeakPolarHBondContact O-CB 3.33Å; Y323-H326 PolarHBondContact O-N 3.21Å; Y323-H326 VanDerWaalsContact O-N 3.13Å; H326-R328 VanDerWaalsContact C-N 3.33Å; H326-R328 PolarHBondContact O-N 3.07Å; H326-L329 PolarHBondContact O-N 3.26Å; H326-H330 PolarHBondContact O-N 3.05Å
327	K	91.9	Very high	89.4	Confident	143 Å²	143	35.3 Å²	35.3	62%	0.622	19%	0.194	S	C	*	.	H	α-helix	trans	-63.8	-38.1	179.3	-174.6	174.8	-179.6	176.3	0	112.2	Y325 H330 D331	Y325-K327 PolarHBondContact O-N 2.83Å; K327-H330 PolarHBondContact O-N 3.19Å; K327-D331 VanDerWaalsContact O-CB 3.31Å; K327-D331 WeakPolarHBondContact O-CB 3.49Å; K327-D331 PolarHBondContact O-N 3.05Å
328	R	93.9	Very high	90	Very high	87 Å²	87	33.8 Å²	33.8	33%	0.328	19%	0.187	S	C	.	.	H	α-helix	trans	-65.6	-39.9	179.9	-63.3	-171.1	-175.7	169	6.9	112	Y325 H326 L332 L357 D361 T363	Y325-R328 PolarHBondContact O-N 3.4Å; H326-R328 VanDerWaalsContact C-N 3.33Å; H326-R328 PolarHBondContact O-N 3.07Å; R328-L332 VanDerWaalsContact O-CB 3.27Å; R328-L332 WeakPolarHBondContact O-CB 3.28Å; R328-L332 PolarHBondContact O-N 3.04Å; R328-L357 HydrophobicContact CB-CD1 4.25Å; R328-L357 HydrophobicContact CB-CD2 3.99Å; R328-D361 IonicContact CZ-OD1 3.95Å; R328-D361 PolarHBondContact NH1-O 3.19Å; R328-D361 IonicContact NH1-OD1 2.59Å; R328-D361 PolarHBondContact NH1-OD1 3.39Å; R328-T363 HydrophobicContact CB-CG2 4.41Å; R328-T363 WeakPolarHBondContact O-CG2 3.49Å
329	L	94.4	Very high	90.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69.3	-42.9	176.8	177.8	61.9	0	0	0	112.1	M309 I312 F319 Y325 H326 L332 L333 A353 L357	M309-L329 HydrophobicContact CB-CD2 4.45Å; M309-L329 HydrophobicContact CE-CB 4.18Å; M309-L329 HydrophobicContact CE-CD2 4.27Å; M309-L329 HydrophobicContact CE-CG 4.28Å; M309-L329 HydrophobicContact CG-CD2 3.72Å; M309-L329 HydrophobicContact CG-CG 4.11Å; M309-L329 HydrophobicContact SD-CG 4.43Å; I312-L329 HydrophobicContact CD1-CD2 3.3Å; F319-L329 HydrophobicContact CB-CD2 4.09Å; F319-L329 HydrophobicContact CD1-CB 3.92Å; F319-L329 HydrophobicContact CD1-CD2 3.41Å; F319-L329 VanDerWaalsContact CD1-CD2 3.41Å; F319-L329 HydrophobicContact CD1-CG 4.27Å; F319-L329 HydrophobicContact CE1-CB 4.29Å; F319-L329 HydrophobicContact CE1-CD2 3.97Å; F319-L329 HydrophobicContact CG-CD2 3.82Å; Y325-L329 WeakPolarHBondContact O-CB 3.4Å; Y325-L329 PolarHBondContact O-N 3.34Å; H326-L329 PolarHBondContact O-N 3.26Å; L329-L332 PolarHBondContact O-N 3.15Å; L329-L333 HydrophobicContact CD1-CD1 3.76Å; L329-L333 HydrophobicContact CD1-CG 4.04Å; L329-L333 HydrophobicContact CG-CD1 3.99Å; L329-L333 WeakPolarHBondContact O-CG 3.25Å; L329-L333 PolarHBondContact O-N 3.31Å; L329-A353 HydrophobicContact CD1-CB 3.52Å; L329-L357 HydrophobicContact CB-CD1 3.63Å; L329-L357 HydrophobicContact CD1-CD1 3.95Å; L329-L357 HydrophobicContact CG-CD1 4.4Å
330	H	93.3	Very high	90.6	Very high	39 Å²	39	38.7 Å²	38.7	18%	0.181	21%	0.208	C	C	.	.	H	α-helix	trans	-58.7	-51.4	172.4	-178.8	-79.8	0	0	0	111.3	M309 H326 K327 L332 L333 A334	M309-H330 HydrophobicContact CE-CB 4.03Å; M309-H330 HydrophobicContact SD-CB 4.04Å; H326-H330 PolarHBondContact O-N 3.05Å; K327-H330 PolarHBondContact O-N 3.19Å; H330-L332 VanDerWaalsContact C-N 3.33Å; H330-L332 PolarHBondContact O-N 3.02Å; H330-L333 PolarHBondContact O-N 2.97Å; H330-A334 WeakPolarHBondContact O-CB 3.33Å; H330-A334 PolarHBondContact O-N 3.08Å
331	D	93.8	Very high	90.6	Very high	22 Å²	22	41.3 Å²	41.3	12%	0.118	22%	0.224	C	C	.	.	H	α-helix	trans	-60.7	-38.7	179.4	-82.5	15.4	0	0	0	112	L181 K185 K327 A335	L181-D331 HydrophobicContact CD1-CB 3.6Å; L181-D331 WeakPolarHBondContact CD1-O 3.45Å; K185-D331 WeakPolarHBondContact CE-OD2 3.43Å; K185-D331 IonicContact NZ-OD1 2.66Å; K185-D331 IonicContact NZ-OD2 3.17Å; K185-D331 PolarHBondContact NZ-OD2 3.08Å; K327-D331 VanDerWaalsContact O-CB 3.31Å; K327-D331 WeakPolarHBondContact O-CB 3.49Å; K327-D331 PolarHBondContact O-N 3.05Å; D331-A335 VanDerWaalsContact O-CB 3.23Å; D331-A335 WeakPolarHBondContact O-CB 3.39Å; D331-A335 PolarHBondContact O-N 3.19Å
332	L	96	Very high	90.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-50.5	176.2	-174.1	165.6	0	0	0	111.8	R328 L329 H330 A335 F336 A353 L357 T363 A366 F367 F370	R328-L332 VanDerWaalsContact O-CB 3.27Å; R328-L332 WeakPolarHBondContact O-CB 3.28Å; R328-L332 PolarHBondContact O-N 3.04Å; L329-L332 PolarHBondContact O-N 3.15Å; H330-L332 VanDerWaalsContact C-N 3.33Å; H330-L332 PolarHBondContact O-N 3.02Å; L332-A335 PolarHBondContact O-N 2.96Å; L332-F336 PolarHBondContact O-N 3.01Å; L332-A353 HydrophobicContact CD1-CB 4.41Å; L332-A353 HydrophobicContact CD2-CB 3.72Å; L332-L357 HydrophobicContact CD1-CD1 3.89Å; L332-L357 HydrophobicContact CD1-CD2 4.17Å; L332-L357 HydrophobicContact CD1-CG 3.76Å; L332-T363 HydrophobicContact CB-CG2 3.93Å; L332-A366 HydrophobicContact CD1-CB 3.77Å; L332-F367 HydrophobicContact CD2-CD2 4.33Å; L332-F367 HydrophobicContact CG-CB 4.11Å; L332-F367 HydrophobicContact CG-CD2 4.2Å; L332-F370 HydrophobicContact CD2-CB 4.38Å; L332-F370 HydrophobicContact CD2-CD1 3.57Å; L332-F370 HydrophobicContact CD2-CE1 4Å; L332-F370 HydrophobicContact CD2-CG 4.04Å
333	L	94.8	Very high	90.6	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-69.3	-39	-178.4	-66.8	169.7	0	0	0	111.8	I305 L329 H330 F336 I337 Y345 M349 A353 F370	I305-L333 HydrophobicContact CD1-CB 3.65Å; I305-L333 HydrophobicContact CG1-CB 4.11Å; I305-L333 HydrophobicContact CG1-CD1 4.17Å; I305-L333 HydrophobicContact CG2-CB 4.48Å; I305-L333 HydrophobicContact CG2-CD1 3.94Å; L329-L333 HydrophobicContact CD1-CD1 3.76Å; L329-L333 HydrophobicContact CD1-CG 4.04Å; L329-L333 HydrophobicContact CG-CD1 3.99Å; L329-L333 WeakPolarHBondContact O-CG 3.25Å; L329-L333 PolarHBondContact O-N 3.31Å; H330-L333 PolarHBondContact O-N 2.97Å; L333-F336 WeakPolarHBondContact O-CB 3.47Å; L333-F336 PolarHBondContact O-N 3.24Å; L333-F336 VanDerWaalsContact O-N 3.15Å; L333-I337 WeakPolarHBondContact O-CG1 3.42Å; L333-I337 PolarHBondContact O-N 3.46Å; L333-I337 VanDerWaalsContact O-N 3.09Å; L333-Y345 HydrophobicContact CD1-CE2 3.99Å; L333-Y345 HydrophobicContact CD2-CD2 4.19Å; L333-Y345 HydrophobicContact CD2-CE2 3.94Å; L333-Y345 HydrophobicContact CG-CE2 4.44Å; L333-M349 HydrophobicContact CD2-CB 4.35Å; L333-A353 HydrophobicContact CD2-CB 3.68Å; L333-A353 HydrophobicContact CG-CB 4.21Å; L333-F370 HydrophobicContact CD2-CE1 4.28Å; L333-F370 HydrophobicContact CD2-CZ 4.02Å
334	A	92.6	Very high	90.7	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-63.1	-44	175	0	0	0	0	0	111.7	S184 L302 H330 F336 I337 S338	S184-A334 WeakPolarHBondContact CB-O 3.49Å; L302-A334 HydrophobicContact CD2-CB 4.47Å; H330-A334 WeakPolarHBondContact O-CB 3.33Å; H330-A334 PolarHBondContact O-N 3.08Å; A334-F336 VanDerWaalsContact C-N 3.27Å; A334-F336 PolarHBondContact O-N 3.39Å; A334-I337 PolarHBondContact O-N 2.88Å; A334-S338 PolarHBondContact O-N 3.43Å
335	A	94.8	Very high	90.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.7	-31.9	172.5	0	0	0	0	0	112.4	F177 C180 L181 D331 L332 S338 Y339 F367	F177-A335 HydrophobicContact CD2-CB 4.17Å; F177-A335 HydrophobicContact CE2-CB 3.87Å; C180-A335 HydrophobicContact CB-CB 4.27Å; C180-A335 WeakPolarHBondContact CB-O 3.48Å; L181-A335 HydrophobicContact CB-CB 4.11Å; L181-A335 HydrophobicContact CD1-CB 4.37Å; D331-A335 VanDerWaalsContact O-CB 3.23Å; D331-A335 WeakPolarHBondContact O-CB 3.39Å; D331-A335 PolarHBondContact O-N 3.19Å; L332-A335 PolarHBondContact O-N 2.96Å; A335-S338 PolarHBondContact O-N 3.01Å; A335-Y339 WeakPolarHBondContact O-CB 3.35Å; A335-Y339 PolarHBondContact O-N 2.91Å; A335-F367 HydrophobicContact CB-CD2 4.43Å; A335-F367 HydrophobicContact CB-CE2 4.08Å
336	F	94.1	Very high	90.6	Very high	5 Å²	5	35.8 Å²	35.8	2%	0.022	17%	0.17	C	C	.	.	H	α-helix	trans	-68.4	-40.1	177.1	-175.1	-96.2	0	0	0	112.2	L332 L333 A334 S338 Y339 K340 M349 F367 F370 A371 L374	L332-F336 PolarHBondContact O-N 3.01Å; L333-F336 WeakPolarHBondContact O-CB 3.47Å; L333-F336 PolarHBondContact O-N 3.24Å; L333-F336 VanDerWaalsContact O-N 3.15Å; A334-F336 VanDerWaalsContact C-N 3.27Å; A334-F336 PolarHBondContact O-N 3.39Å; F336-S338 VanDerWaalsContact C-N 3.27Å; F336-S338 PolarHBondContact O-N 3.1Å; F336-Y339 HydrophobicContact CD2-CD1 4.19Å; F336-Y339 HydrophobicContact CE2-CD1 4.21Å; F336-Y339 CarbonylContact O-C 3.41Å; F336-Y339 PolarHBondContact O-N 2.87Å; F336-Y339 VanDerWaalsContact O-N 3.09Å; F336-K340 HydrophobicContact CE1-CB 3.95Å; F336-K340 HydrophobicContact CE2-CB 4.24Å; F336-K340 HydrophobicContact CE2-CG 4.12Å; F336-K340 HydrophobicContact CZ-CB 3.8Å; F336-K340 HydrophobicContact CZ-CG 3.98Å; F336-K340 PolarHBondContact O-N 2.82Å; F336-M349 HydrophobicContact CD1-SD 4.27Å; F336-M349 HydrophobicContact CE1-CE 3.89Å; F336-M349 HydrophobicContact CE1-SD 4.09Å; F336-F367 HydrophobicContact CB-CE2 3.94Å; F336-F367 HydrophobicContact CD2-CE2 4.29Å; F336-F370 HydrophobicContact CB-CE1 3.9Å; F336-F370 HydrophobicContact CD1-CE1 4.01Å; F336-F370 AromaticContact CD2-CD1 3.96Å; F336-F370 HydrophobicContact CD2-CD1 3.96Å; F336-F370 AromaticContact CD2-CE1 3.62Å; F336-F370 HydrophobicContact CD2-CE1 3.62Å; F336-F370 HydrophobicContact CE1-CE1 4.49Å; F336-F370 HydrophobicContact CE2-CE1 4.14Å; F336-F370 HydrophobicContact CG-CD1 4.27Å; F336-F370 AromaticContact CG-CE1 3.55Å; F336-F370 HydrophobicContact CG-CE1 3.55Å; F336-F370 HydrophobicContact CG-CZ 4.5Å; F336-A371 HydrophobicContact CD2-CB 4.41Å; F336-A371 HydrophobicContact CE2-CB 4.2Å; F336-L374 HydrophobicContact CE1-CD1 3.9Å; F336-L374 HydrophobicContact CE2-CD1 3.81Å; F336-L374 HydrophobicContact CZ-CD1 3.41Å; F336-L374 VanDerWaalsContact CZ-CD1 3.41Å
337	I	91.9	Very high	90.2	Very high	8 Å²	8	34.6 Å²	34.6	4%	0.041	17%	0.167	C	C	.	.	H	α-helix	trans	-60	-39.7	173.6	-62.1	155.4	0	0	0	110.7	Y298 N301 I305 L333 A334 K340 P341	Y298-I337 HydrophobicContact CD2-CG2 3.66Å; Y298-I337 HydrophobicContact CE2-CB 4.01Å; Y298-I337 HydrophobicContact CE2-CD1 4.41Å; Y298-I337 HydrophobicContact CE2-CG2 3.6Å; N301-I337 HydrophobicContact CB-CD1 3.63Å; N301-I337 HydrophobicContact CB-CG1 4.38Å; I305-I337 HydrophobicContact CD1-CD1 3.53Å; L333-I337 WeakPolarHBondContact O-CG1 3.42Å; L333-I337 PolarHBondContact O-N 3.46Å; L333-I337 VanDerWaalsContact O-N 3.09Å; A334-I337 PolarHBondContact O-N 2.88Å; I337-K340 CarbonylContact O-C 3.58Å; I337-P341 WeakPolarHBondContact O-CA 3.38Å
338	S	91.2	Very high	89.8	Confident	25 Å²	25	27.8 Å²	27.8	18%	0.175	14%	0.137	C	C	.	.	H	α-helix	trans	-69.2	-30.1	174.7	-58.3	0	0	0	0	113.6	C180 S184 A334 A335 F336	C180-S338 WeakPolarHBondContact O-CB 3.5Å; C180-S338 PolarHBondContact O-OG 3.07Å; S184-S338 WeakPolarHBondContact CB-OG 3.49Å; S184-S338 PolarHBondContact N-OG 2.82Å; A334-S338 PolarHBondContact O-N 3.43Å; A335-S338 PolarHBondContact O-N 3.01Å; F336-S338 VanDerWaalsContact C-N 3.27Å; F336-S338 PolarHBondContact O-N 3.1Å
339	Y	93	Very high	89.7	Confident	46 Å²	46	23.6 Å²	23.6	18%	0.18	12%	0.122	C	C	.	.	H	α-helix	trans	-79.5	-33	177.2	175.2	-117.5	0	0	0	113.2	L170 I172 L176 A335 F336 F367 A371	L170-Y339 HydrophobicContact CD1-CE1 4.3Å; I172-Y339 HydrophobicContact CD1-CE1 4.05Å; I172-Y339 HydrophobicContact CG1-CE2 4.5Å; L176-Y339 HydrophobicContact CD2-CD2 4.21Å; L176-Y339 HydrophobicContact CD2-CE2 3.87Å; A335-Y339 WeakPolarHBondContact O-CB 3.35Å; A335-Y339 PolarHBondContact O-N 2.91Å; F336-Y339 HydrophobicContact CD2-CD1 4.19Å; F336-Y339 HydrophobicContact CE2-CD1 4.21Å; F336-Y339 CarbonylContact O-C 3.41Å; F336-Y339 PolarHBondContact O-N 2.87Å; F336-Y339 VanDerWaalsContact O-N 3.09Å; Y339-F367 HydrophobicContact CD1-CZ 4.01Å; Y339-F367 HydrophobicContact CG-CZ 4.03Å; Y339-A371 HydrophobicContact CE1-CB 4.21Å
340	K	89.1	Confident	89.5	Confident	62 Å²	62	23.6 Å²	23.6	27%	0.27	12%	0.122	S	C	.	.			trans	-135.3	63.3	-176.1	-78.3	-65.2	-174.4	-172.6	0	112.1	F336 I337 E342 I343 G344	F336-K340 HydrophobicContact CE1-CB 3.95Å; F336-K340 HydrophobicContact CE2-CB 4.24Å; F336-K340 HydrophobicContact CE2-CG 4.12Å; F336-K340 HydrophobicContact CZ-CB 3.8Å; F336-K340 HydrophobicContact CZ-CG 3.98Å; F336-K340 PolarHBondContact O-N 2.82Å; I337-K340 CarbonylContact O-C 3.58Å; K340-E342 VanDerWaalsContact CA-OE2 3.25Å; K340-E342 WeakPolarHBondContact CA-OE2 3.48Å; K340-E342 WeakPolarHBondContact CD-OE1 3.29Å; K340-E342 WeakPolarHBondContact CD-OE2 3.37Å; K340-E342 WeakPolarHBondContact CE-OE1 3.46Å; K340-E342 IonicContact NZ-OE1 3.75Å; K340-E342 PolarHBondContact NZ-OE1 3.15Å; K340-E342 PolarHBondContact O-N 2.78Å; K340-I343 HydrophobicContact CB-CD1 4.41Å; K340-I343 HydrophobicContact CB-CG1 4.47Å; K340-I343 HydrophobicContact CD-CD1 4.39Å; K340-I343 PolarHBondContact O-N 3.37Å; K340-I343 VanDerWaalsContact O-N 3.14Å; K340-G344 PolarHBondContact O-N 3.15Å
341	P	85	Confident	89.5	Confident	77 Å²	77	22.5 Å²	22.5	50%	0.5	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-21.4	-176.9	28.5	-36.5	0	0	0	113.3	I296 I337 I343	I296-P341 WeakPolarHBondContact CD1-O 3.34Å; I337-P341 WeakPolarHBondContact O-CA 3.38Å; P341-I343 VanDerWaalsContact C-N 3.32Å
342	E	80.9	Confident	89.5	Confident	108 Å²	108	21.5 Å²	21.5	51%	0.505	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-23.4	176.9	77.1	-80.6	-156.1	0	0	113.4	K340	K340-E342 VanDerWaalsContact CA-OE2 3.25Å; K340-E342 WeakPolarHBondContact CA-OE2 3.48Å; K340-E342 WeakPolarHBondContact CD-OE1 3.29Å; K340-E342 WeakPolarHBondContact CD-OE2 3.37Å; K340-E342 WeakPolarHBondContact CE-OE1 3.46Å; K340-E342 IonicContact NZ-OE1 3.75Å; K340-E342 PolarHBondContact NZ-OE1 3.15Å; K340-E342 PolarHBondContact O-N 2.78Å
343	I	84.2	Confident	89.5	Confident	48 Å²	48	21.5 Å²	21.5	25%	0.246	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-37.1	172.9	-49.3	-179.6	0	0	0	109.9	K340 P341 I346 M349	K340-I343 HydrophobicContact CB-CD1 4.41Å; K340-I343 HydrophobicContact CB-CG1 4.47Å; K340-I343 HydrophobicContact CD-CD1 4.39Å; K340-I343 PolarHBondContact O-N 3.37Å; K340-I343 VanDerWaalsContact O-N 3.14Å; P341-I343 VanDerWaalsContact C-N 3.32Å; I343-I346 HydrophobicContact CG2-CD1 4.02Å; I343-I346 HydrophobicContact CG2-CG1 4.43Å; I343-M349 HydrophobicContact CG2-CE 3.58Å
344	G	86.2	Confident	89.5	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.01	11%	0.11	C	C	.	.			trans	62.6	-136.2	-174.4	0	0	0	0	0	111.5	K340	K340-G344 PolarHBondContact O-N 3.15Å
345	Y	85.9	Confident	89.5	Confident	12 Å²	12	21.4 Å²	21.4	5%	0.047	11%	0.11	C	C	.	.			trans	-118	123.5	176.1	176.6	-94.6	0	0	0	111.7	N301 A304 I305 D308 L333 P347 M349 S350	N301-Y345 WeakPolarHBondContact OD1-CB 3.13Å; N301-Y345 PolarHBondContact OD1-N 3.39Å; A304-Y345 HydrophobicContact CB-CD1 3.72Å; A304-Y345 HydrophobicContact CB-CE1 3.81Å; I305-Y345 HydrophobicContact CD1-CD2 3.99Å; I305-Y345 HydrophobicContact CD1-CG 4.1Å; I305-Y345 HydrophobicContact CG1-CD1 3.83Å; I305-Y345 HydrophobicContact CG1-CD2 3.47Å; I305-Y345 VanDerWaalsContact CG1-CD2 3.47Å; I305-Y345 HydrophobicContact CG1-CE1 3.99Å; I305-Y345 HydrophobicContact CG1-CE2 3.63Å; I305-Y345 HydrophobicContact CG1-CG 3.57Å; D308-Y345 VanDerWaalsContact CB-OH 3.25Å; D308-Y345 WeakPolarHBondContact CB-OH 2.97Å; D308-Y345 VanDerWaalsContact CG-OH 3.26Å; D308-Y345 PolarHBondContact OD2-OH 3.15Å; L333-Y345 HydrophobicContact CD1-CE2 3.99Å; L333-Y345 HydrophobicContact CD2-CD2 4.19Å; L333-Y345 HydrophobicContact CD2-CE2 3.94Å; L333-Y345 HydrophobicContact CG-CE2 4.44Å; Y345-P347 HydrophobicContact CE1-CB 4.46Å; Y345-P347 HydrophobicContact CE1-CG 4.29Å; Y345-M349 HydrophobicContact CD2-CB 4.03Å; Y345-M349 HydrophobicContact CD2-SD 4.13Å; Y345-M349 HydrophobicContact CE2-CB 3.67Å; Y345-S350 WeakPolarHBondContact OH-CB 3.37Å; Y345-S350 PolarHBondContact OH-OG 3.3Å
346	I	84.9	Confident	89.5	Confident	16 Å²	16	21.4 Å²	21.4	8%	0.082	11%	0.11	C	C	.	.			trans	-109.5	123.6	175.8	-52.6	-178	0	0	0	109	M229 I343 G348 M349 Y383 M385 F428	M229-I346 HydrophobicContact CB-CG2 4.11Å; M229-I346 HydrophobicContact CE-CG2 4.1Å; M229-I346 HydrophobicContact CG-CG2 3.98Å; I343-I346 HydrophobicContact CG2-CD1 4.02Å; I343-I346 HydrophobicContact CG2-CG1 4.43Å; I346-G348 PolarHBondContact O-N 3.17Å; I346-M349 HydrophobicContact CB-CE 4.18Å; I346-M349 HydrophobicContact CD1-CE 4.44Å; I346-M349 HydrophobicContact CG1-CE 4.08Å; I346-M349 PolarHBondContact N-SD 3.17Å; I346-M349 WeakPolarHBondContact O-CB 3.47Å; I346-M349 VanDerWaalsContact O-CG 3.3Å; I346-M349 WeakPolarHBondContact O-CG 3.43Å; I346-M349 PolarHBondContact O-N 3.37Å; I346-Y383 HydrophobicContact CB-CD1 4.5Å; I346-Y383 HydrophobicContact CD1-CD1 4.22Å; I346-Y383 WeakPolarHBondContact CD1-O 3.06Å; I346-M385 HydrophobicContact CD1-CG 4.25Å; I346-M385 HydrophobicContact CD1-SD 4.1Å; I346-M385 HydrophobicContact CG2-SD 4.43Å; I346-F428 HydrophobicContact CB-CZ 4.03Å; I346-F428 HydrophobicContact CG2-CE1 4.36Å; I346-F428 HydrophobicContact CG2-CE2 4.29Å; I346-F428 HydrophobicContact CG2-CZ 3.53Å
347	P	82.4	Confident	89.5	Confident	25 Å²	25	21.1 Å²	21.1	16%	0.162	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	122.3	-175.9	-26.6	33.1	0	0	0	113.5	M229 D308 Y345 F428 R433	M229-P347 HydrophobicContact CE-CB 3.72Å; M229-P347 HydrophobicContact CE-CG 4.1Å; M229-P347 WeakPolarHBondContact CE-O 3.41Å; D308-P347 VanDerWaalsContact OD2-CA 3.28Å; D308-P347 WeakPolarHBondContact OD2-CA 3.45Å; Y345-P347 HydrophobicContact CE1-CB 4.46Å; Y345-P347 HydrophobicContact CE1-CG 4.29Å; P347-F428 WeakPolarHBondContact O-CE1 3.33Å; P347-R433 PolarHBondContact O-NH2 3.25Å
348	G	84.2	Confident	89.5	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	115.4	-26.3	-167.2	0	0	0	0	0	114.1	D308 I346 S350 W351	D308-G348 PolarHBondContact OD2-N 3.16Å; I346-G348 PolarHBondContact O-N 3.17Å; G348-S350 PolarHBondContact O-N 3.13Å; G348-W351 WeakPolarHBondContact O-CB 3.32Å; G348-W351 PolarHBondContact O-N 2.74Å
349	M	90.1	Very high	89.5	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-52.1	-39.1	167.6	-81.3	-172.2	177.3	0	0	112.2	L333 F336 I343 Y345 I346 W351 I352 A353 F370 L374 Y383	L333-M349 HydrophobicContact CD2-CB 4.35Å; F336-M349 HydrophobicContact CD1-SD 4.27Å; F336-M349 HydrophobicContact CE1-CE 3.89Å; F336-M349 HydrophobicContact CE1-SD 4.09Å; I343-M349 HydrophobicContact CG2-CE 3.58Å; Y345-M349 HydrophobicContact CD2-CB 4.03Å; Y345-M349 HydrophobicContact CD2-SD 4.13Å; Y345-M349 HydrophobicContact CE2-CB 3.67Å; I346-M349 HydrophobicContact CB-CE 4.18Å; I346-M349 HydrophobicContact CD1-CE 4.44Å; I346-M349 HydrophobicContact CG1-CE 4.08Å; I346-M349 PolarHBondContact N-SD 3.17Å; I346-M349 WeakPolarHBondContact O-CB 3.47Å; I346-M349 VanDerWaalsContact O-CG 3.3Å; I346-M349 WeakPolarHBondContact O-CG 3.43Å; I346-M349 PolarHBondContact O-N 3.37Å; M349-W351 PolarHBondContact O-N 3.31Å; M349-I352 PolarHBondContact O-N 3.28Å; M349-A353 WeakPolarHBondContact O-CB 3.26Å; M349-A353 PolarHBondContact O-N 2.93Å; M349-F370 HydrophobicContact CB-CE2 4.24Å; M349-F370 HydrophobicContact CB-CZ 3.93Å; M349-F370 HydrophobicContact CG-CZ 4.16Å; M349-F370 WeakPolarHBondContact O-CE2 3.04Å; M349-F370 HydrophobicContact SD-CZ 4.28Å; M349-L374 HydrophobicContact CE-CD1 4.18Å; M349-Y383 HydrophobicContact CE-CD1 3.48Å; M349-Y383 VanDerWaalsContact CE-CD1 3.48Å; M349-Y383 HydrophobicContact CE-CE1 3.81Å; M349-Y383 HydrophobicContact CE-CG 4.5Å; M349-Y383 HydrophobicContact CG-CD1 4.15Å; M349-Y383 HydrophobicContact CG-CE1 3.45Å; M349-Y383 VanDerWaalsContact CG-CE1 3.45Å
350	S	92.2	Very high	89.4	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-53.7	-36.1	176.3	54.4	0	0	0	0	114.1	D308 I312 Y345 G348 G354	D308-S350 WeakPolarHBondContact CB-OG 3.18Å; D308-S350 PolarHBondContact OD2-OG 3.05Å; I312-S350 WeakPolarHBondContact CD1-O 3.49Å; Y345-S350 WeakPolarHBondContact OH-CB 3.37Å; Y345-S350 PolarHBondContact OH-OG 3.3Å; G348-S350 PolarHBondContact O-N 3.13Å; S350-G354 PolarHBondContact O-N 3.49Å
351	W	92.3	Very high	89	Confident	16 Å²	16	18.8 Å²	18.8	6%	0.061	10%	0.1	C	C	.	.	H	α-helix	trans	-72.1	-42.2	179.3	-67.4	76.6	0	0	0	111.5	Q311 I312 F313 G348 M349 G354 M355 S432 R433	Q311-W351 HydrophobicContact CB-CZ2 3.88Å; Q311-W351 WeakPolarHBondContact O-CH2 3.32Å; Q311-W351 VanDerWaalsContact O-CZ2 3.23Å; Q311-W351 WeakPolarHBondContact O-CZ2 3.43Å; I312-W351 HydrophobicContact CB-CD2 4.49Å; I312-W351 HydrophobicContact CB-CE3 4.39Å; I312-W351 HydrophobicContact CG1-CD2 4.1Å; I312-W351 HydrophobicContact CG1-CE3 4.49Å; I312-W351 HydrophobicContact CG1-CG 4.27Å; I312-W351 HydrophobicContact CG2-CD2 4.43Å; I312-W351 HydrophobicContact CG2-CE3 4.04Å; I312-W351 HydrophobicContact CG2-CZ3 4.47Å; F313-W351 HydrophobicContact CD1-CZ3 4.33Å; F313-W351 HydrophobicContact CE1-CZ3 4.32Å; G348-W351 WeakPolarHBondContact O-CB 3.32Å; G348-W351 PolarHBondContact O-N 2.74Å; M349-W351 PolarHBondContact O-N 3.31Å; W351-G354 PolarHBondContact O-N 3.2Å; W351-M355 WeakPolarHBondContact O-CB 3.37Å; W351-M355 WeakPolarHBondContact O-CG 3.47Å; W351-M355 PolarHBondContact O-N 2.61Å; W351-S432 VanDerWaalsContact CB-OG 3.29Å; W351-S432 WeakPolarHBondContact CB-OG 3.35Å; W351-S432 VanDerWaalsContact CZ3-O 3.22Å; W351-S432 WeakPolarHBondContact CZ3-O 3.44Å; W351-R433 HydrophobicContact CD2-CB 4.09Å; W351-R433 HydrophobicContact CD2-CG 4.4Å; W351-R433 HydrophobicContact CE3-CB 4.33Å; W351-R433 HydrophobicContact CG-CB 4.49Å; W351-R433 HydrophobicContact CH2-CG 4.3Å; W351-R433 HydrophobicContact CZ2-CB 4.42Å; W351-R433 HydrophobicContact CZ2-CG 3.9Å
352	I	94.2	Very high	89.2	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64.5	-44.3	173.2	-57.4	-171.5	0	0	0	110.5	M349 G354 M355 A356 F370 I373 L374 Y383 F428 L430 W444	M349-I352 PolarHBondContact O-N 3.28Å; I352-G354 PolarHBondContact O-N 3.49Å; I352-M355 WeakPolarHBondContact O-CB 3.36Å; I352-M355 PolarHBondContact O-N 3.5Å; I352-A356 PolarHBondContact O-N 3.06Å; I352-F370 HydrophobicContact CB-CD2 4.11Å; I352-F370 HydrophobicContact CB-CE2 4.12Å; I352-F370 HydrophobicContact CG2-CD2 3.77Å; I352-F370 HydrophobicContact CG2-CE2 4.21Å; I352-I373 HydrophobicContact CG2-CD1 4Å; I352-I373 HydrophobicContact CG2-CG2 4.18Å; I352-L374 HydrophobicContact CD1-CD2 4.43Å; I352-Y383 HydrophobicContact CD1-CE2 4.47Å; I352-Y383 VanDerWaalsContact CD1-OH 3.26Å; I352-Y383 WeakPolarHBondContact CD1-OH 3.45Å; I352-F428 WeakPolarHBondContact CD1-O 3.47Å; I352-L430 HydrophobicContact CD1-CD1 4.24Å; I352-L430 HydrophobicContact CD1-CG 4.33Å; I352-W444 HydrophobicContact CB-CH2 4.16Å; I352-W444 HydrophobicContact CG1-CZ2 4.44Å; I352-W444 HydrophobicContact CG2-CH2 3.63Å; I352-W444 HydrophobicContact CG2-CZ2 4.34Å; I352-W444 HydrophobicContact CG2-CZ3 4.48Å
353	A	95.5	Very high	89.9	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-64.1	-38.3	177.2	0	0	0	0	0	112.7	L329 L332 L333 M349 A356 L357 F370	L329-A353 HydrophobicContact CD1-CB 3.52Å; L332-A353 HydrophobicContact CD1-CB 4.41Å; L332-A353 HydrophobicContact CD2-CB 3.72Å; L333-A353 HydrophobicContact CD2-CB 3.68Å; L333-A353 HydrophobicContact CG-CB 4.21Å; M349-A353 WeakPolarHBondContact O-CB 3.26Å; M349-A353 PolarHBondContact O-N 2.93Å; A353-A356 PolarHBondContact O-N 2.9Å; A353-L357 PolarHBondContact O-N 2.94Å; A353-F370 HydrophobicContact CB-CD2 3.91Å; A353-F370 HydrophobicContact CB-CE2 3.97Å; A353-F370 HydrophobicContact CB-CG 4.29Å; A353-F370 HydrophobicContact CB-CZ 4.37Å
354	G	93.9	Very high	90.5	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.3	-45.9	174.2	0	0	0	0	0	112.3	F319 S350 W351 I352 A356 L357 I358	F319-G354 VanDerWaalsContact CZ-CA 3.48Å; F319-G354 WeakPolarHBondContact CZ-O 3.45Å; S350-G354 PolarHBondContact O-N 3.49Å; W351-G354 PolarHBondContact O-N 3.2Å; I352-G354 PolarHBondContact O-N 3.49Å; G354-A356 VanDerWaalsContact C-N 3.34Å; G354-A356 PolarHBondContact O-N 3.42Å; G354-L357 PolarHBondContact O-N 3.19Å; G354-I358 WeakPolarHBondContact O-CB 3.42Å; G354-I358 WeakPolarHBondContact O-CG1 3.46Å; G354-I358 PolarHBondContact O-N 2.58Å
355	M	93.5	Very high	90.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-57.3	-44.1	172	-77.4	-70.6	-66.1	0	0	112.4	F313 W351 I352 I358 V359 L437 C440 I441 W444	F313-M355 HydrophobicContact CE2-CG 4Å; F313-M355 HydrophobicContact CE2-SD 3.57Å; F313-M355 VanDerWaalsContact CE2-SD 3.57Å; F313-M355 HydrophobicContact CZ-CG 4.14Å; F313-M355 HydrophobicContact CZ-SD 3.51Å; F313-M355 VanDerWaalsContact CZ-SD 3.51Å; W351-M355 WeakPolarHBondContact O-CB 3.37Å; W351-M355 WeakPolarHBondContact O-CG 3.47Å; W351-M355 PolarHBondContact O-N 2.61Å; I352-M355 WeakPolarHBondContact O-CB 3.36Å; I352-M355 PolarHBondContact O-N 3.5Å; M355-I358 PolarHBondContact O-N 3.43Å; M355-V359 PolarHBondContact O-N 2.82Å; M355-L437 HydrophobicContact CE-CD1 4.24Å; M355-L437 HydrophobicContact SD-CD1 3.37Å; M355-L437 WeakPolarHBondContact SD-CD1 3.49Å; M355-C440 HydrophobicContact CE-CB 3.73Å; M355-C440 HydrophobicContact SD-CB 4.11Å; M355-I441 HydrophobicContact CE-CG1 3.93Å; M355-W444 HydrophobicContact CB-CE3 4.37Å; M355-W444 HydrophobicContact CB-CH2 3.29Å; M355-W444 HydrophobicContact CB-CZ2 3.68Å; M355-W444 HydrophobicContact CB-CZ3 3.69Å; M355-W444 HydrophobicContact CE-CD2 3.77Å; M355-W444 HydrophobicContact CE-CE3 4.21Å; M355-W444 HydrophobicContact CE-CG 4.03Å; M355-W444 HydrophobicContact CE-CZ2 4.24Å; M355-W444 HydrophobicContact CG-CH2 3.92Å; M355-W444 HydrophobicContact CG-CZ2 3.74Å
356	A	95.1	Very high	91.4	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.4	-45.1	176.6	0	0	0	0	0	111.9	I352 A353 G354 I358 V359 F360 A366	I352-A356 PolarHBondContact O-N 3.06Å; A353-A356 PolarHBondContact O-N 2.9Å; G354-A356 VanDerWaalsContact C-N 3.34Å; G354-A356 PolarHBondContact O-N 3.42Å; A356-I358 VanDerWaalsContact C-N 3.34Å; A356-I358 PolarHBondContact O-N 3Å; A356-V359 PolarHBondContact O-N 3.45Å; A356-F360 WeakPolarHBondContact O-CD2 3.36Å; A356-F360 PolarHBondContact O-N 2.79Å; A356-A366 HydrophobicContact CB-CB 4.11Å
357	L	94.1	Very high	92	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-62.5	-38.4	177	-82.4	167	0	0	0	113.3	Y325 R328 L329 L332 A353 G354 V359 D361 T363 A366	Y325-L357 HydrophobicContact CD1-CB 4.22Å; R328-L357 HydrophobicContact CB-CD1 4.25Å; R328-L357 HydrophobicContact CB-CD2 3.99Å; L329-L357 HydrophobicContact CB-CD1 3.63Å; L329-L357 HydrophobicContact CD1-CD1 3.95Å; L329-L357 HydrophobicContact CG-CD1 4.4Å; L332-L357 HydrophobicContact CD1-CD1 3.89Å; L332-L357 HydrophobicContact CD1-CD2 4.17Å; L332-L357 HydrophobicContact CD1-CG 3.76Å; A353-L357 PolarHBondContact O-N 2.94Å; G354-L357 PolarHBondContact O-N 3.19Å; L357-V359 VanDerWaalsContact C-N 3.27Å; L357-V359 PolarHBondContact O-N 2.98Å; L357-D361 WeakPolarHBondContact O-CA 3.43Å; L357-D361 PolarHBondContact O-N 2.8Å; L357-T363 HydrophobicContact CD2-CG2 4.39Å; L357-A366 HydrophobicContact CB-CB 4.47Å; L357-A366 HydrophobicContact CD2-CB 3.69Å; L357-A366 HydrophobicContact CG-CB 3.83Å
358	I	90.7	Very high	92.7	Very high	5 Å²	5	14 Å²	14	3%	0.026	7%	0.072	C	C	.	.	H	α-helix	trans	-59.1	-37.3	175.7	-82.3	162.6	0	0	0	112.2	I68 F313 L318 F319 G354 M355 A356 L437	I68-I358 HydrophobicContact CG2-CB 4.49Å; I68-I358 HydrophobicContact CG2-CG1 4.5Å; I68-I358 HydrophobicContact CG2-CG2 3.64Å; F313-I358 HydrophobicContact CD2-CD1 3.99Å; F313-I358 HydrophobicContact CE2-CD1 4.2Å; L318-I358 HydrophobicContact CD1-CD1 4.01Å; L318-I358 HydrophobicContact CD1-CG1 4.07Å; F319-I358 HydrophobicContact CE2-CD1 3.87Å; F319-I358 HydrophobicContact CE2-CG1 4.46Å; F319-I358 HydrophobicContact CZ-CD1 3.79Å; F319-I358 HydrophobicContact CZ-CG1 3.94Å; G354-I358 WeakPolarHBondContact O-CB 3.42Å; G354-I358 WeakPolarHBondContact O-CG1 3.46Å; G354-I358 PolarHBondContact O-N 2.58Å; M355-I358 PolarHBondContact O-N 3.43Å; A356-I358 VanDerWaalsContact C-N 3.34Å; A356-I358 PolarHBondContact O-N 3Å; I358-L437 HydrophobicContact CD1-CD1 4Å; I358-L437 HydrophobicContact CD1-CD2 4.18Å; I358-L437 HydrophobicContact CG2-CD1 4.18Å; I358-L437 HydrophobicContact CG2-CD2 4.27Å
359	V	91.5	Very high	93.3	Very high	12 Å²	12	14.1 Å²	14.1	7%	0.073	7%	0.073	C	C	.	.	H	α-helix	trans	-89.4	-36.4	-176.1	174	0	0	0	0	112.8	R158 N159 W162 M355 A356 L357	R158-V359 HydrophobicContact CB-CG1 4.16Å; R158-V359 HydrophobicContact CG-CG1 4.14Å; N159-V359 HydrophobicContact CB-CG1 4.18Å; W162-V359 HydrophobicContact CD2-CG1 4.33Å; W162-V359 HydrophobicContact CE3-CB 4.22Å; W162-V359 HydrophobicContact CE3-CG1 3.84Å; W162-V359 HydrophobicContact CE3-CG2 4.28Å; W162-V359 HydrophobicContact CH2-CG2 3.77Å; W162-V359 HydrophobicContact CZ3-CB 3.93Å; W162-V359 HydrophobicContact CZ3-CG1 4.01Å; W162-V359 HydrophobicContact CZ3-CG2 3.57Å; M355-V359 PolarHBondContact O-N 2.82Å; A356-V359 PolarHBondContact O-N 3.45Å; L357-V359 VanDerWaalsContact C-N 3.27Å; L357-V359 PolarHBondContact O-N 2.98Å
360	F	91.3	Very high	93.6	Very high	17 Å²	17	14.1 Å²	14.1	8%	0.075	7%	0.073	C	C	.	.	H	α-helix	trans	-93	-21.1	-174.4	-76.8	-90.8	0	0	0	114.7	N159 W162 A356 N362 D365 A366 T369	N159-F360 HydrophobicContact CB-CD1 3.74Å; N159-F360 HydrophobicContact CB-CE1 3.78Å; N159-F360 HydrophobicContact CB-CG 4.2Å; N159-F360 HydrophobicContact CB-CZ 4.24Å; N159-F360 VanDerWaalsContact O-CE1 3.27Å; N159-F360 WeakPolarHBondContact O-CE1 3.33Å; N159-F360 WeakPolarHBondContact O-CZ 3.47Å; W162-F360 HydrophobicContact CB-CE2 4.5Å; W162-F360 HydrophobicContact CB-CZ 4.24Å; W162-F360 HydrophobicContact CE3-CE2 4.23Å; A356-F360 WeakPolarHBondContact O-CD2 3.36Å; A356-F360 PolarHBondContact O-N 2.79Å; F360-N362 PolarHBondContact O-N 3.37Å; F360-D365 HydrophobicContact CB-CB 4.2Å; F360-D365 HydrophobicContact CD1-CB 3.56Å; F360-D365 HydrophobicContact CE1-CB 4.33Å; F360-D365 HydrophobicContact CG-CB 4.17Å; F360-A366 HydrophobicContact CB-CB 4.16Å; F360-T369 HydrophobicContact CE2-CG2 3.75Å; F360-T369 VanDerWaalsContact CE2-OG1 3.24Å; F360-T369 WeakPolarHBondContact CE2-OG1 3.38Å; F360-T369 HydrophobicContact CZ-CG2 4.23Å; F360-T369 WeakPolarHBondContact CZ-OG1 3.34Å
361	D	80.1	Confident	93.8	Very high	58 Å²	58	14.2 Å²	14.2	31%	0.31	7%	0.074	S	C	.	.			trans	61.2	-52.6	-171	-170.3	27.1	0	0	0	113.5	I69 R328 L357 T363	I69-D361 HydrophobicContact CD1-CB 3.85Å; R328-D361 IonicContact CZ-OD1 3.95Å; R328-D361 PolarHBondContact NH1-O 3.19Å; R328-D361 IonicContact NH1-OD1 2.59Å; R328-D361 PolarHBondContact NH1-OD1 3.39Å; L357-D361 WeakPolarHBondContact O-CA 3.43Å; L357-D361 PolarHBondContact O-N 2.8Å; D361-T363 PolarHBondContact O-N 3.48Å
362	N	90.7	Very high	93.9	Very high	59 Å²	59	13.7 Å²	13.7	32%	0.316	7%	0.072	S	C	.	.	S	Bend	trans	-67.7	126.4	174.6	-167.1	-2.6	0	0	0	112.4	R174 F360 Y364 D365 A366	R174-N362 PolarHBondContact NH2-ND2 3.4Å; R174-N362 VanDerWaalsContact NH2-ND2 3.11Å; F360-N362 PolarHBondContact O-N 3.37Å; N362-Y364 PolarHBondContact O-N 2.95Å; N362-Y364 PolarHBondContact OD1-N 2.88Å; N362-D365 HydrophobicContact CB-CB 4.46Å; N362-D365 VanDerWaalsContact CB-OD2 3.29Å; N362-D365 WeakPolarHBondContact CB-OD2 3.31Å; N362-D365 VanDerWaalsContact CG-OD2 3.28Å; N362-D365 PolarHBondContact ND2-OD2 3.35Å; N362-D365 PolarHBondContact O-N 2.78Å; N362-A366 WeakPolarHBondContact O-CB 3.45Å; N362-A366 PolarHBondContact O-N 2.88Å; N362-A366 VanDerWaalsContact O-N 3.09Å
363	T	94.9	Very high	93.9	Very high	22 Å²	22	13.7 Å²	13.7	14%	0.135	7%	0.072	C	C	.	.	H	α-helix	trans	-57.8	-35.7	177.2	-40.5	0	0	0	0	112.9	F177 R328 L332 L357 D361 F367	F177-T363 HydrophobicContact CE2-CG2 4.47Å; F177-T363 HydrophobicContact CZ-CG2 3.78Å; R328-T363 HydrophobicContact CB-CG2 4.41Å; R328-T363 WeakPolarHBondContact O-CG2 3.49Å; L332-T363 HydrophobicContact CB-CG2 3.93Å; L357-T363 HydrophobicContact CD2-CG2 4.39Å; D361-T363 PolarHBondContact O-N 3.48Å; T363-F367 VanDerWaalsContact O-CB 3.27Å; T363-F367 WeakPolarHBondContact O-CB 3.33Å; T363-F367 PolarHBondContact O-N 2.85Å
364	Y	96	Very high	93.8	Very high	31 Å²	31	14.2 Å²	14.2	12%	0.122	8%	0.075	C	C	.	.	H	α-helix	trans	-66.6	-51.5	-180	169	-104.2	0	0	0	112.4	I172 T173 R174 F177 N362 A366 F367 V368	I172-Y364 HydrophobicContact CG2-CE2 4.41Å; I172-Y364 PolarHBondContact O-OH 3.42Å; I172-Y364 VanDerWaalsContact O-OH 3.08Å; T173-Y364 VanDerWaalsContact C-CE2 3.47Å; T173-Y364 WeakPolarHBondContact O-CE2 3.37Å; R174-Y364 HydrophobicContact CB-CD2 4.21Å; R174-Y364 HydrophobicContact CB-CE2 3.93Å; R174-Y364 HydrophobicContact CG-CD2 4.37Å; R174-Y364 PolarHBondContact N-OH 2.99Å; F177-Y364 HydrophobicContact CB-CD2 3.75Å; F177-Y364 HydrophobicContact CB-CE2 4.11Å; F177-Y364 AromaticContact CD1-CD2 3.94Å; F177-Y364 HydrophobicContact CD1-CD2 3.94Å; F177-Y364 AromaticContact CG-CD2 3.93Å; F177-Y364 HydrophobicContact CG-CD2 3.93Å; N362-Y364 PolarHBondContact O-N 2.95Å; N362-Y364 PolarHBondContact OD1-N 2.88Å; Y364-A366 VanDerWaalsContact C-N 3.29Å; Y364-A366 PolarHBondContact O-N 3.03Å; Y364-F367 WeakPolarHBondContact O-CB 3.39Å; Y364-F367 PolarHBondContact O-N 2.83Å; Y364-F367 VanDerWaalsContact O-N 3.1Å; Y364-V368 HydrophobicContact CD2-CG2 4.18Å; Y364-V368 HydrophobicContact CE1-CG2 4.04Å; Y364-V368 HydrophobicContact CE2-CG2 3.61Å; Y364-V368 WeakPolarHBondContact O-CG2 3.42Å; Y364-V368 PolarHBondContact O-N 3.12Å
365	D	95.4	Very high	93.6	Very high	57 Å²	57	17 Å²	17	31%	0.305	9%	0.09	S	C	.	.	H	α-helix	trans	-70.2	-31.8	-176.7	-54.9	-66	0	0	0	111	F360 N362 T369	F360-D365 HydrophobicContact CB-CB 4.2Å; F360-D365 HydrophobicContact CD1-CB 3.56Å; F360-D365 HydrophobicContact CE1-CB 4.33Å; F360-D365 HydrophobicContact CG-CB 4.17Å; N362-D365 HydrophobicContact CB-CB 4.46Å; N362-D365 VanDerWaalsContact CB-OD2 3.29Å; N362-D365 WeakPolarHBondContact CB-OD2 3.31Å; N362-D365 VanDerWaalsContact CG-OD2 3.28Å; N362-D365 PolarHBondContact ND2-OD2 3.35Å; N362-D365 PolarHBondContact O-N 2.78Å; D365-T369 WeakPolarHBondContact O-CB 3.23Å; D365-T369 PolarHBondContact O-N 3.29Å; D365-T369 PolarHBondContact O-OG1 3.32Å
366	A	96.8	Very high	93.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-63.4	-42.4	168	0	0	0	0	0	112.5	L332 A356 L357 F360 N362 Y364 T369 F370	L332-A366 HydrophobicContact CD1-CB 3.77Å; A356-A366 HydrophobicContact CB-CB 4.11Å; L357-A366 HydrophobicContact CB-CB 4.47Å; L357-A366 HydrophobicContact CD2-CB 3.69Å; L357-A366 HydrophobicContact CG-CB 3.83Å; F360-A366 HydrophobicContact CB-CB 4.16Å; N362-A366 WeakPolarHBondContact O-CB 3.45Å; N362-A366 PolarHBondContact O-N 2.88Å; N362-A366 VanDerWaalsContact O-N 3.09Å; Y364-A366 VanDerWaalsContact C-N 3.29Å; Y364-A366 PolarHBondContact O-N 3.03Å; A366-T369 PolarHBondContact O-N 3.18Å; A366-F370 WeakPolarHBondContact O-CB 3.33Å; A366-F370 PolarHBondContact O-N 3.47Å
367	F	97.5	Very high	92.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.6	-47.2	175.9	177	-92	0	0	0	112.1	I172 F177 L332 A335 F336 Y339 T363 Y364 T369 F370 A371	I172-F367 HydrophobicContact CD1-CE1 4.12Å; I172-F367 HydrophobicContact CG2-CD1 4.02Å; I172-F367 HydrophobicContact CG2-CE1 3.83Å; F177-F367 HydrophobicContact CB-CD1 4.28Å; F177-F367 HydrophobicContact CB-CE1 4.46Å; F177-F367 HydrophobicContact CD2-CB 3.8Å; F177-F367 AromaticContact CD2-CD1 3.56Å; F177-F367 HydrophobicContact CD2-CD1 3.56Å; F177-F367 AromaticContact CD2-CD2 3.76Å; F177-F367 HydrophobicContact CD2-CD2 3.76Å; F177-F367 HydrophobicContact CD2-CE1 4.02Å; F177-F367 HydrophobicContact CD2-CE2 4.19Å; F177-F367 AromaticContact CD2-CG 3.41Å; F177-F367 HydrophobicContact CD2-CG 3.41Å; F177-F367 VanDerWaalsContact CD2-CG 3.41Å; F177-F367 HydrophobicContact CD2-CZ 4.32Å; F177-F367 HydrophobicContact CE2-CB 3.8Å; F177-F367 HydrophobicContact CE2-CD1 4.35Å; F177-F367 AromaticContact CE2-CD2 3.85Å; F177-F367 HydrophobicContact CE2-CD2 3.85Å; F177-F367 AromaticContact CE2-CG 3.74Å; F177-F367 HydrophobicContact CE2-CG 3.74Å; F177-F367 HydrophobicContact CG-CD1 4.27Å; F177-F367 HydrophobicContact CG-CG 4.44Å; L332-F367 HydrophobicContact CD2-CD2 4.33Å; L332-F367 HydrophobicContact CG-CB 4.11Å; L332-F367 HydrophobicContact CG-CD2 4.2Å; A335-F367 HydrophobicContact CB-CD2 4.43Å; A335-F367 HydrophobicContact CB-CE2 4.08Å; F336-F367 HydrophobicContact CB-CE2 3.94Å; F336-F367 HydrophobicContact CD2-CE2 4.29Å; Y339-F367 HydrophobicContact CD1-CZ 4.01Å; Y339-F367 HydrophobicContact CG-CZ 4.03Å; T363-F367 VanDerWaalsContact O-CB 3.27Å; T363-F367 WeakPolarHBondContact O-CB 3.33Å; T363-F367 PolarHBondContact O-N 2.85Å; Y364-F367 WeakPolarHBondContact O-CB 3.39Å; Y364-F367 PolarHBondContact O-N 2.83Å; Y364-F367 VanDerWaalsContact O-N 3.1Å; F367-T369 VanDerWaalsContact C-N 3.29Å; F367-T369 PolarHBondContact O-N 3.14Å; F367-F370 PolarHBondContact O-N 3.15Å; F367-A371 WeakPolarHBondContact O-CB 3.37Å; F367-A371 PolarHBondContact O-N 2.87Å
368	V	97.1	Very high	92.4	Very high	16 Å²	16	21.7 Å²	21.7	10%	0.097	12%	0.119	C	C	.	.	H	α-helix	trans	-57.2	-45.8	175.7	173.1	0	0	0	0	110.3	N168 I172 Y364 N372	N168-V368 HydrophobicContact CB-CG1 4.08Å; I172-V368 HydrophobicContact CB-CG2 4.17Å; I172-V368 HydrophobicContact CG2-CG2 3.82Å; Y364-V368 HydrophobicContact CD2-CG2 4.18Å; Y364-V368 HydrophobicContact CE1-CG2 4.04Å; Y364-V368 HydrophobicContact CE2-CG2 3.61Å; Y364-V368 WeakPolarHBondContact O-CG2 3.42Å; Y364-V368 PolarHBondContact O-N 3.12Å; V368-N372 WeakPolarHBondContact O-CB 3.29Å; V368-N372 PolarHBondContact O-N 3.29Å; V368-N372 PolarHBondContact O-ND2 2.98Å
369	T	96.3	Very high	92.1	Very high	4 Å²	4	21.6 Å²	21.6	3%	0.025	12%	0.118	C	C	.	.	H	α-helix	trans	-63.6	-50.2	178.1	-58.5	0	0	0	0	111.4	L166 F360 D365 A366 F367 A371 N372 I373 F448	L166-T369 HydrophobicContact CD2-CG2 3.92Å; L166-T369 WeakPolarHBondContact CD2-O 2.99Å; F360-T369 HydrophobicContact CE2-CG2 3.75Å; F360-T369 VanDerWaalsContact CE2-OG1 3.24Å; F360-T369 WeakPolarHBondContact CE2-OG1 3.38Å; F360-T369 HydrophobicContact CZ-CG2 4.23Å; F360-T369 WeakPolarHBondContact CZ-OG1 3.34Å; D365-T369 WeakPolarHBondContact O-CB 3.23Å; D365-T369 PolarHBondContact O-N 3.29Å; D365-T369 PolarHBondContact O-OG1 3.32Å; A366-T369 PolarHBondContact O-N 3.18Å; F367-T369 VanDerWaalsContact C-N 3.29Å; F367-T369 PolarHBondContact O-N 3.14Å; T369-A371 PolarHBondContact O-N 3.23Å; T369-N372 PolarHBondContact O-N 3.35Å; T369-I373 HydrophobicContact CG2-CD1 3.96Å; T369-I373 HydrophobicContact CG2-CG1 4.44Å; T369-I373 VanDerWaalsContact O-CG1 3.3Å; T369-I373 WeakPolarHBondContact O-CG1 3.42Å; T369-I373 PolarHBondContact O-N 3.1Å; T369-F448 HydrophobicContact CG2-CZ 4.41Å
370	F	96.6	Very high	91.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-55.9	-52	178.8	172	-112.2	0	0	0	111.9	L332 L333 F336 M349 I352 A353 A366 F367 N372 I373 L374	L332-F370 HydrophobicContact CD2-CB 4.38Å; L332-F370 HydrophobicContact CD2-CD1 3.57Å; L332-F370 HydrophobicContact CD2-CE1 4Å; L332-F370 HydrophobicContact CD2-CG 4.04Å; L333-F370 HydrophobicContact CD2-CE1 4.28Å; L333-F370 HydrophobicContact CD2-CZ 4.02Å; F336-F370 HydrophobicContact CB-CE1 3.9Å; F336-F370 HydrophobicContact CD1-CE1 4.01Å; F336-F370 AromaticContact CD2-CD1 3.96Å; F336-F370 HydrophobicContact CD2-CD1 3.96Å; F336-F370 AromaticContact CD2-CE1 3.62Å; F336-F370 HydrophobicContact CD2-CE1 3.62Å; F336-F370 HydrophobicContact CE1-CE1 4.49Å; F336-F370 HydrophobicContact CE2-CE1 4.14Å; F336-F370 HydrophobicContact CG-CD1 4.27Å; F336-F370 AromaticContact CG-CE1 3.55Å; F336-F370 HydrophobicContact CG-CE1 3.55Å; F336-F370 HydrophobicContact CG-CZ 4.5Å; M349-F370 HydrophobicContact CB-CE2 4.24Å; M349-F370 HydrophobicContact CB-CZ 3.93Å; M349-F370 HydrophobicContact CG-CZ 4.16Å; M349-F370 WeakPolarHBondContact O-CE2 3.04Å; M349-F370 HydrophobicContact SD-CZ 4.28Å; I352-F370 HydrophobicContact CB-CD2 4.11Å; I352-F370 HydrophobicContact CB-CE2 4.12Å; I352-F370 HydrophobicContact CG2-CD2 3.77Å; I352-F370 HydrophobicContact CG2-CE2 4.21Å; A353-F370 HydrophobicContact CB-CD2 3.91Å; A353-F370 HydrophobicContact CB-CE2 3.97Å; A353-F370 HydrophobicContact CB-CG 4.29Å; A353-F370 HydrophobicContact CB-CZ 4.37Å; A366-F370 WeakPolarHBondContact O-CB 3.33Å; A366-F370 PolarHBondContact O-N 3.47Å; F367-F370 PolarHBondContact O-N 3.15Å; F370-N372 PolarHBondContact O-N 3.45Å; F370-I373 WeakPolarHBondContact O-CB 3.08Å; F370-I373 PolarHBondContact O-N 3.2Å; F370-L374 HydrophobicContact CD1-CD1 4.39Å; F370-L374 HydrophobicContact CD2-CD1 4.37Å; F370-L374 HydrophobicContact CD2-CG 4.47Å; F370-L374 HydrophobicContact CE1-CD1 3.81Å; F370-L374 HydrophobicContact CE2-CD1 3.76Å; F370-L374 HydrophobicContact CE2-CD2 4.44Å; F370-L374 HydrophobicContact CE2-CG 4.17Å; F370-L374 HydrophobicContact CZ-CD1 3.45Å; F370-L374 VanDerWaalsContact CZ-CD1 3.45Å; F370-L374 HydrophobicContact CZ-CG 4.35Å; F370-L374 WeakPolarHBondContact O-CG 3.22Å; F370-L374 PolarHBondContact O-N 2.91Å
371	A	95.7	Very high	91.4	Very high	2 Å²	2	23.5 Å²	23.5	2%	0.017	13%	0.127	C	C	.	.	H	α-helix	trans	-63.3	-40.3	179.4	0	0	0	0	0	112.7	L170 I172 F336 Y339 F367 T369 L374 N375	L170-A371 HydrophobicContact CD1-CB 3.83Å; L170-A371 WeakPolarHBondContact CD1-O 3.27Å; I172-A371 HydrophobicContact CD1-CB 3.45Å; I172-A371 VanDerWaalsContact CD1-CB 3.45Å; F336-A371 HydrophobicContact CD2-CB 4.41Å; F336-A371 HydrophobicContact CE2-CB 4.2Å; Y339-A371 HydrophobicContact CE1-CB 4.21Å; F367-A371 WeakPolarHBondContact O-CB 3.37Å; F367-A371 PolarHBondContact O-N 2.87Å; T369-A371 PolarHBondContact O-N 3.23Å; A371-L374 PolarHBondContact O-N 2.75Å; A371-N375 WeakPolarHBondContact O-CB 3.35Å; A371-N375 PolarHBondContact O-N 3.4Å
372	N	95	Very high	91.4	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.021	11%	0.112	C	C	.	.	H	α-helix	trans	-72.2	-27.4	177.4	-78.2	-85.2	0	0	0	113	L166 N168 K169 L170 V368 T369 F370	L166-N372 HydrophobicContact CD1-CB 4.29Å; L166-N372 HydrophobicContact CD2-CB 3.57Å; L166-N372 HydrophobicContact CG-CB 3.79Å; N168-N372 PolarHBondContact OD1-ND2 3.15Å; K169-N372 PolarHBondContact N-OD1 2.75Å; L170-N372 PolarHBondContact N-OD1 3.27Å; V368-N372 WeakPolarHBondContact O-CB 3.29Å; V368-N372 PolarHBondContact O-N 3.29Å; V368-N372 PolarHBondContact O-ND2 2.98Å; T369-N372 PolarHBondContact O-N 3.35Å; F370-N372 PolarHBondContact O-N 3.45Å
373	I	94.3	Very high	90.7	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-62.5	-53.1	167.6	-71.6	166.1	0	0	0	109.4	L166 I352 T369 F370 N375 R376 H379 L430 W444 F448	L166-I373 HydrophobicContact CD1-CG1 4.5Å; L166-I373 HydrophobicContact CD2-CG1 4.04Å; I352-I373 HydrophobicContact CG2-CD1 4Å; I352-I373 HydrophobicContact CG2-CG2 4.18Å; T369-I373 HydrophobicContact CG2-CD1 3.96Å; T369-I373 HydrophobicContact CG2-CG1 4.44Å; T369-I373 VanDerWaalsContact O-CG1 3.3Å; T369-I373 WeakPolarHBondContact O-CG1 3.42Å; T369-I373 PolarHBondContact O-N 3.1Å; F370-I373 WeakPolarHBondContact O-CB 3.08Å; F370-I373 PolarHBondContact O-N 3.2Å; I373-N375 PolarHBondContact O-N 2.78Å; I373-R376 WeakPolarHBondContact O-CB 3.26Å; I373-R376 PolarHBondContact O-N 3Å; I373-H379 WeakPolarHBondContact CG2-NE2 3.37Å; I373-H379 WeakPolarHBondContact O-CB 3.41Å; I373-H379 VanDerWaalsContact O-CG 3.28Å; I373-L430 HydrophobicContact CG2-CD1 4.02Å; I373-W444 HydrophobicContact CD1-CH2 4.35Å; I373-W444 HydrophobicContact CD1-CZ3 3.92Å; I373-F448 HydrophobicContact CD1-CE1 4.38Å; I373-F448 HydrophobicContact CD1-CZ 3.94Å; I373-F448 HydrophobicContact CG1-CE1 4.11Å; I373-F448 HydrophobicContact CG1-CZ 4.19Å
374	L	92.4	Very high	89.6	Confident	11 Å²	11	20.6 Å²	20.6	6%	0.058	12%	0.115	C	C	.	.	H	α-helix	trans	-61.2	-26.9	-178.6	-64.8	-174.5	0	0	0	113.1	F336 M349 I352 F370 A371 H379 Y383	F336-L374 HydrophobicContact CE1-CD1 3.9Å; F336-L374 HydrophobicContact CE2-CD1 3.81Å; F336-L374 HydrophobicContact CZ-CD1 3.41Å; F336-L374 VanDerWaalsContact CZ-CD1 3.41Å; M349-L374 HydrophobicContact CE-CD1 4.18Å; I352-L374 HydrophobicContact CD1-CD2 4.43Å; F370-L374 HydrophobicContact CD1-CD1 4.39Å; F370-L374 HydrophobicContact CD2-CD1 4.37Å; F370-L374 HydrophobicContact CD2-CG 4.47Å; F370-L374 HydrophobicContact CE1-CD1 3.81Å; F370-L374 HydrophobicContact CE2-CD1 3.76Å; F370-L374 HydrophobicContact CE2-CD2 4.44Å; F370-L374 HydrophobicContact CE2-CG 4.17Å; F370-L374 HydrophobicContact CZ-CD1 3.45Å; F370-L374 VanDerWaalsContact CZ-CD1 3.45Å; F370-L374 HydrophobicContact CZ-CG 4.35Å; F370-L374 WeakPolarHBondContact O-CG 3.22Å; F370-L374 PolarHBondContact O-N 2.91Å; A371-L374 PolarHBondContact O-N 2.75Å; L374-H379 WeakPolarHBondContact O-CB 3.42Å; L374-Y383 HydrophobicContact CD2-CD1 4.16Å; L374-Y383 HydrophobicContact CD2-CD2 3.57Å; L374-Y383 HydrophobicContact CD2-CE1 3.87Å; L374-Y383 HydrophobicContact CD2-CE2 3.25Å; L374-Y383 HydrophobicContact CD2-CG 4.03Å; L374-Y383 VanDerWaalsContact CD2-CZ 3.41Å
375	N	91.2	Very high	88.4	Confident	58 Å²	58	19.8 Å²	19.8	31%	0.31	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-4.6	176.8	-166.9	61.7	0	0	0	114.9	L170 A371 I373 Q380	L170-N375 HydrophobicContact CD1-CB 3.93Å; L170-N375 HydrophobicContact CD2-CB 4.06Å; L170-N375 HydrophobicContact CG-CB 4.06Å; A371-N375 WeakPolarHBondContact O-CB 3.35Å; A371-N375 PolarHBondContact O-N 3.4Å; I373-N375 PolarHBondContact O-N 2.78Å; N375-Q380 PolarHBondContact O-NE2 3.08Å; N375-Q380 PolarHBondContact OD1-NE2 3.47Å
376	R	89.3	Confident	87.4	Confident	24 Å²	24	19.2 Å²	19.2	9%	0.091	11%	0.11	C	C	.	.	S	Bend	trans	-67.3	139.1	170	-75.7	175.4	154	-170.1	-7.2	109.2	I373 Y378 H379 Q380 Y447 E451	I373-R376 WeakPolarHBondContact O-CB 3.26Å; I373-R376 PolarHBondContact O-N 3Å; R376-Y378 PolarHBondContact O-N 2.88Å; R376-Y378 VanDerWaalsContact O-N 3.1Å; R376-H379 WeakPolarHBondContact O-CA 3.31Å; R376-H379 PolarHBondContact O-N 2.98Å; R376-Q380 PolarHBondContact O-N 3.14Å; R376-Y447 WeakPolarHBondContact CD-OH 3.47Å; R376-Y447 VanDerWaalsContact NH1-CE1 3.35Å; R376-Y447 PolarHBondContact NH1-O 2.61Å; R376-Y447 PolarHBondContact NH1-OH 3.34Å; R376-Y447 VanDerWaalsContact NH1-OH 3.16Å; R376-E451 IonicContact CZ-OE1 3.38Å; R376-E451 IonicContact NE-OE1 3.23Å; R376-E451 PolarHBondContact NE-OE1 3.24Å; R376-E451 IonicContact NH2-OE1 3.23Å; R376-E451 PolarHBondContact NH2-OE1 2.97Å
377	S	83.3	Confident	86.4	Confident	73 Å²	73	21.9 Å²	21.9	51%	0.51	12%	0.122	S	C	.	.	H	α-helix	trans	-52	-37.6	-177.6	52.2	0	0	0	0	113.7	Q380 A381	S377-Q380 PolarHBondContact O-N 2.96Å; S377-A381 PolarHBondContact O-N 3.02Å; S377-A381 VanDerWaalsContact O-N 3.09Å
378	Y	83.8	Confident	85.5	Confident	3 Å²	3	29.5 Å²	29.5	1%	0.012	16%	0.158	C	C	.	.	H	α-helix	trans	-54.6	-51.8	170.2	-178.5	-88.7	0	0	0	112.4	R376 A381 F382 Y393 F427 E452 L455 F456	R376-Y378 PolarHBondContact O-N 2.88Å; R376-Y378 VanDerWaalsContact O-N 3.1Å; Y378-A381 WeakPolarHBondContact O-CB 3.18Å; Y378-A381 PolarHBondContact O-N 2.9Å; Y378-F382 HydrophobicContact CD1-CD2 4.25Å; Y378-F382 AromaticContact CD1-CE2 3.91Å; Y378-F382 HydrophobicContact CD1-CE2 3.91Å; Y378-F382 HydrophobicContact CD2-CE2 4.23Å; Y378-F382 HydrophobicContact CE1-CD2 4.14Å; Y378-F382 AromaticContact CE1-CE2 3.59Å; Y378-F382 HydrophobicContact CE1-CE2 3.59Å; Y378-F382 HydrophobicContact CE1-CZ 4.4Å; Y378-F382 AromaticContact CE2-CE2 3.89Å; Y378-F382 HydrophobicContact CE2-CE2 3.89Å; Y378-F382 HydrophobicContact CE2-CZ 4.37Å; Y378-F382 HydrophobicContact CG-CE2 4.27Å; Y378-F382 AromaticContact CZ-CE2 3.6Å; Y378-F382 WeakPolarHBondContact O-CD2 3.33Å; Y378-Y393 AromaticContact CD2-CD1 3.57Å; Y378-Y393 HydrophobicContact CD2-CD1 3.57Å; Y378-Y393 AromaticContact CD2-CE1 3.37Å; Y378-Y393 HydrophobicContact CD2-CE1 3.37Å; Y378-Y393 HydrophobicContact CD2-CE2 4.46Å; Y378-Y393 HydrophobicContact CD2-CG 4.2Å; Y378-Y393 AromaticContact CD2-CZ 3.85Å; Y378-Y393 AromaticContact CE2-CD1 3.67Å; Y378-Y393 HydrophobicContact CE2-CD1 3.67Å; Y378-Y393 AromaticContact CE2-CE1 3.99Å; Y378-Y393 HydrophobicContact CE2-CE1 3.99Å; Y378-Y393 HydrophobicContact CE2-CG 4.13Å; Y378-Y393 HydrophobicContact CG-CE1 4.38Å; Y378-F427 HydrophobicContact CE1-CB 4.42Å; Y378-F427 WeakPolarHBondContact OH-CB 3.44Å; Y378-F427 WeakPolarHBondContact OH-CD1 3.36Å; Y378-F427 VanDerWaalsContact OH-CD2 3.29Å; Y378-F427 WeakPolarHBondContact OH-CD2 3.5Å; Y378-F427 WeakPolarHBondContact OH-CG 3.41Å; Y378-E452 HydrophobicContact CD2-CB 3.29Å; Y378-E452 HydrophobicContact CD2-CG 3.93Å; Y378-E452 HydrophobicContact CE2-CB 3.52Å; Y378-E452 HydrophobicContact CE2-CG 4.3Å; Y378-E452 HydrophobicContact CG-CB 3.96Å; Y378-L455 HydrophobicContact CD1-CD1 4.24Å; Y378-L455 HydrophobicContact CE1-CD1 3.46Å; Y378-L455 VanDerWaalsContact CE1-CD1 3.46Å; Y378-L455 HydrophobicContact CE2-CD1 4.28Å; Y378-L455 VanDerWaalsContact CZ-CD1 3.45Å; Y378-L455 VanDerWaalsContact OH-CD1 3.31Å; Y378-L455 WeakPolarHBondContact OH-CD1 3.13Å; Y378-F456 HydrophobicContact CE2-CE2 4.29Å
379	H	85.4	Confident	84.8	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.009	17%	0.166	C	C	.	.	H	α-helix	trans	-69.1	-43.6	-177.7	-71.5	61.8	0	0	0	110	I373 L374 R376 A381 F382 Y383 L430 Y447	I373-H379 WeakPolarHBondContact CG2-NE2 3.37Å; I373-H379 WeakPolarHBondContact O-CB 3.41Å; I373-H379 VanDerWaalsContact O-CG 3.28Å; L374-H379 WeakPolarHBondContact O-CB 3.42Å; R376-H379 WeakPolarHBondContact O-CA 3.31Å; R376-H379 PolarHBondContact O-N 2.98Å; H379-A381 PolarHBondContact O-N 2.88Å; H379-A381 VanDerWaalsContact O-N 3.13Å; H379-F382 PolarHBondContact O-N 2.89Å; H379-Y383 HydrophobicContact CB-CD2 3.95Å; H379-Y383 HydrophobicContact CB-CE2 4.27Å; H379-Y383 AromaticContact CD2-CE2 3.91Å; H379-Y383 VanDerWaalsContact O-CD2 3.25Å; H379-Y383 WeakPolarHBondContact O-CD2 3.41Å; H379-Y383 PolarHBondContact O-N 3.08Å; H379-L430 WeakPolarHBondContact NE2-CD2 3.37Å; H379-Y447 AromaticContact CE1-CE2 3.96Å; H379-Y447 AromaticContact CE1-CZ 3.51Å; H379-Y447 PolarHBondContact CE1-OH 3Å; H379-Y447 PolarHBondContact ND1-OH 2.84Å
380	Q	84.7	Confident	84	Confident	67 Å²	67	32.4 Å²	32.4	31%	0.313	17%	0.169	S	C	.	.	H	α-helix	trans	-51.6	-37.9	174.4	-68.9	179.6	-19.3	0	0	112.2	N375 R376 S377 F382 S384	N375-Q380 PolarHBondContact O-NE2 3.08Å; N375-Q380 PolarHBondContact OD1-NE2 3.47Å; R376-Q380 PolarHBondContact O-N 3.14Å; S377-Q380 PolarHBondContact O-N 2.96Å; Q380-F382 PolarHBondContact O-N 3.33Å; Q380-S384 WeakPolarHBondContact O-CB 3.39Å; Q380-S384 PolarHBondContact O-N 3.01Å; Q380-S384 PolarHBondContact O-OG 2.91Å
381	A	82.4	Confident	83.5	Confident	2 Å²	2	35.1 Å²	35.1	2%	0.017	18%	0.183	C	C	.	.	H	α-helix	trans	-57.5	-43.9	175.1	0	0	0	0	0	113.3	S377 Y378 H379 D386 K389 F390 Y393	S377-A381 PolarHBondContact O-N 3.02Å; S377-A381 VanDerWaalsContact O-N 3.09Å; Y378-A381 WeakPolarHBondContact O-CB 3.18Å; Y378-A381 PolarHBondContact O-N 2.9Å; H379-A381 PolarHBondContact O-N 2.88Å; H379-A381 VanDerWaalsContact O-N 3.13Å; A381-D386 PolarHBondContact O-N 3.36Å; A381-K389 HydrophobicContact CB-CB 3.66Å; A381-F390 HydrophobicContact CB-CB 4.47Å; A381-Y393 HydrophobicContact CB-CD2 4.32Å; A381-Y393 HydrophobicContact CB-CE2 3.82Å
382	F	80.1	Confident	83.2	Confident	1 Å²	1	37.9 Å²	37.9	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-83	-35.9	178.5	-55.4	-97.2	0	0	0	113.1	Y378 H379 Q380 M385 F390 F394 F424 F427 F428	Y378-F382 HydrophobicContact CD1-CD2 4.25Å; Y378-F382 AromaticContact CD1-CE2 3.91Å; Y378-F382 HydrophobicContact CD1-CE2 3.91Å; Y378-F382 HydrophobicContact CD2-CE2 4.23Å; Y378-F382 HydrophobicContact CE1-CD2 4.14Å; Y378-F382 AromaticContact CE1-CE2 3.59Å; Y378-F382 HydrophobicContact CE1-CE2 3.59Å; Y378-F382 HydrophobicContact CE1-CZ 4.4Å; Y378-F382 AromaticContact CE2-CE2 3.89Å; Y378-F382 HydrophobicContact CE2-CE2 3.89Å; Y378-F382 HydrophobicContact CE2-CZ 4.37Å; Y378-F382 HydrophobicContact CG-CE2 4.27Å; Y378-F382 AromaticContact CZ-CE2 3.6Å; Y378-F382 WeakPolarHBondContact O-CD2 3.33Å; H379-F382 PolarHBondContact O-N 2.89Å; Q380-F382 PolarHBondContact O-N 3.33Å; F382-M385 WeakPolarHBondContact O-CA 3.37Å; F382-M385 PolarHBondContact O-N 3.45Å; F382-M385 VanDerWaalsContact O-N 3.14Å; F382-F390 HydrophobicContact CD1-CB 3.82Å; F382-F390 HydrophobicContact CD1-CG 4.37Å; F382-F390 HydrophobicContact CE1-CB 3.84Å; F382-F390 HydrophobicContact CG-CB 4.23Å; F382-F390 HydrophobicContact CZ-CB 4.24Å; F382-F394 AromaticContact CE1-CE1 3.9Å; F382-F394 HydrophobicContact CE1-CE1 3.9Å; F382-F394 AromaticContact CE1-CZ 3.77Å; F382-F394 HydrophobicContact CE1-CZ 3.77Å; F382-F394 HydrophobicContact CZ-CE1 4.38Å; F382-F424 AromaticContact CD1-CD2 3.95Å; F382-F424 HydrophobicContact CD1-CD2 3.95Å; F382-F424 AromaticContact CD1-CE2 3.89Å; F382-F424 HydrophobicContact CD1-CE2 3.89Å; F382-F424 HydrophobicContact CE1-CD2 4.43Å; F382-F427 HydrophobicContact CE1-CB 4Å; F382-F427 HydrophobicContact CE1-CD2 4.49Å; F382-F427 HydrophobicContact CE2-CB 4.4Å; F382-F427 HydrophobicContact CZ-CB 3.79Å; F382-F427 AromaticContact CZ-CD2 3.99Å; F382-F427 HydrophobicContact CZ-CD2 3.99Å; F382-F427 HydrophobicContact CZ-CG 4.4Å; F382-F428 HydrophobicContact CB-CD2 3.71Å; F382-F428 HydrophobicContact CB-CE2 4.37Å
383	Y	76.6	Confident	82.8	Confident	8 Å²	8	38.3 Å²	38.3	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-83.7	-23.4	-175.8	-75.1	-79.5	0	0	0	114.5	I346 M349 I352 L374 H379 M385 F428	I346-Y383 HydrophobicContact CB-CD1 4.5Å; I346-Y383 HydrophobicContact CD1-CD1 4.22Å; I346-Y383 WeakPolarHBondContact CD1-O 3.06Å; M349-Y383 HydrophobicContact CE-CD1 3.48Å; M349-Y383 VanDerWaalsContact CE-CD1 3.48Å; M349-Y383 HydrophobicContact CE-CE1 3.81Å; M349-Y383 HydrophobicContact CE-CG 4.5Å; M349-Y383 HydrophobicContact CG-CD1 4.15Å; M349-Y383 HydrophobicContact CG-CE1 3.45Å; M349-Y383 VanDerWaalsContact CG-CE1 3.45Å; I352-Y383 HydrophobicContact CD1-CE2 4.47Å; I352-Y383 VanDerWaalsContact CD1-OH 3.26Å; I352-Y383 WeakPolarHBondContact CD1-OH 3.45Å; L374-Y383 HydrophobicContact CD2-CD1 4.16Å; L374-Y383 HydrophobicContact CD2-CD2 3.57Å; L374-Y383 HydrophobicContact CD2-CE1 3.87Å; L374-Y383 HydrophobicContact CD2-CE2 3.25Å; L374-Y383 HydrophobicContact CD2-CG 4.03Å; L374-Y383 VanDerWaalsContact CD2-CZ 3.41Å; H379-Y383 HydrophobicContact CB-CD2 3.95Å; H379-Y383 HydrophobicContact CB-CE2 4.27Å; H379-Y383 AromaticContact CD2-CE2 3.91Å; H379-Y383 VanDerWaalsContact O-CD2 3.25Å; H379-Y383 WeakPolarHBondContact O-CD2 3.41Å; H379-Y383 PolarHBondContact O-N 3.08Å; Y383-M385 PolarHBondContact O-N 3.2Å; Y383-F428 HydrophobicContact CD1-CD2 4.42Å; Y383-F428 AromaticContact CD1-CE2 3.41Å; Y383-F428 HydrophobicContact CD1-CE2 3.41Å; Y383-F428 VanDerWaalsContact CD1-CE2 3.41Å; Y383-F428 AromaticContact CD1-CZ 3.67Å; Y383-F428 HydrophobicContact CD1-CZ 3.67Å; Y383-F428 HydrophobicContact CD2-CD2 4.36Å; Y383-F428 HydrophobicContact CD2-CE2 4.07Å; Y383-F428 HydrophobicContact CE1-CD2 4.01Å; Y383-F428 AromaticContact CE1-CE1 3.9Å; Y383-F428 HydrophobicContact CE1-CE1 3.9Å; Y383-F428 AromaticContact CE1-CE2 3.14Å; Y383-F428 HydrophobicContact CE1-CE2 3.14Å; Y383-F428 AromaticContact CE1-CZ 3.06Å; Y383-F428 HydrophobicContact CE1-CZ 3.06Å; Y383-F428 AromaticContact CE2-CD2 3.92Å; Y383-F428 HydrophobicContact CE2-CD2 3.92Å; Y383-F428 AromaticContact CE2-CE2 3.82Å; Y383-F428 HydrophobicContact CE2-CE2 3.82Å; Y383-F428 HydrophobicContact CE2-CZ 4.42Å; Y383-F428 AromaticContact CG-CE2 3.88Å; Y383-F428 HydrophobicContact CG-CE2 3.88Å; Y383-F428 AromaticContact CZ-CD2 3.74Å; Y383-F428 AromaticContact CZ-CE2 3.36Å; Y383-F428 AromaticContact CZ-CZ 3.52Å; Y383-F428 PolarHBondContact OH-O 3.27Å
384	S	71.9	Confident	82.6	Confident	69 Å²	69	38.5 Å²	38.5	48%	0.483	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-5.7	162.2	63.9	0	0	0	0	112.4	Q380 D386	Q380-S384 WeakPolarHBondContact O-CB 3.39Å; Q380-S384 PolarHBondContact O-N 3.01Å; Q380-S384 PolarHBondContact O-OG 2.91Å; S384-D386 PolarHBondContact O-N 3.13Å; S384-D386 VanDerWaalsContact O-N 3.17Å; S384-D386 WeakPolarHBondContact OG-CB 3.48Å; S384-D386 PolarHBondContact OG-N 3.28Å
385	M	69.9	Low	82.5	Confident	14 Å²	14	42.1 Å²	42.1	7%	0.069	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	18.1	-172.8	-53.3	-64.4	-60.5	0	0	113.6	M229 F232 I233 I346 F382 Y383 E387 F424	M229-M385 HydrophobicContact CG-CE 3.84Å; M229-M385 HydrophobicContact CG-SD 4.46Å; F232-M385 HydrophobicContact CB-CE 4.12Å; F232-M385 HydrophobicContact CD1-CB 3.71Å; F232-M385 HydrophobicContact CD1-CE 3.42Å; F232-M385 VanDerWaalsContact CD1-CE 3.42Å; F232-M385 HydrophobicContact CD1-CG 4.27Å; F232-M385 HydrophobicContact CD2-CB 3.76Å; F232-M385 HydrophobicContact CD2-CG 4.27Å; F232-M385 HydrophobicContact CE1-CB 3.56Å; F232-M385 HydrophobicContact CE1-CE 4.16Å; F232-M385 WeakPolarHBondContact CE1-O 3.43Å; F232-M385 HydrophobicContact CE2-CB 3.59Å; F232-M385 HydrophobicContact CG-CB 3.83Å; F232-M385 HydrophobicContact CG-CE 3.85Å; F232-M385 HydrophobicContact CG-CG 4.13Å; F232-M385 HydrophobicContact CZ-CB 3.5Å; F232-M385 WeakPolarHBondContact CZ-O 3.07Å; I233-M385 HydrophobicContact CG1-CE 4.29Å; I346-M385 HydrophobicContact CD1-CG 4.25Å; I346-M385 HydrophobicContact CD1-SD 4.1Å; I346-M385 HydrophobicContact CG2-SD 4.43Å; F382-M385 WeakPolarHBondContact O-CA 3.37Å; F382-M385 PolarHBondContact O-N 3.45Å; F382-M385 VanDerWaalsContact O-N 3.14Å; Y383-M385 PolarHBondContact O-N 3.2Å; M385-E387 PolarHBondContact O-N 3.1Å; M385-F424 HydrophobicContact CE-CZ 4.25Å
386	D	74.6	Confident	82.4	Confident	46 Å²	46	40.4 Å²	40.4	25%	0.246	21%	0.21	C	C	.	.			trans	-71.1	103.8	-177.7	-172.7	-34.9	0	0	0	111.5	A381 S384 E388 K389 F390	A381-D386 PolarHBondContact O-N 3.36Å; S384-D386 PolarHBondContact O-N 3.13Å; S384-D386 VanDerWaalsContact O-N 3.17Å; S384-D386 WeakPolarHBondContact OG-CB 3.48Å; S384-D386 PolarHBondContact OG-N 3.28Å; D386-E388 VanDerWaalsContact C-N 3.34Å; D386-E388 PolarHBondContact O-N 3.43Å; D386-E388 PolarHBondContact OD1-N 2.99Å; D386-E388 VanDerWaalsContact OD1-N 3.09Å; D386-K389 HydrophobicContact CB-CB 4.03Å; D386-K389 HydrophobicContact CB-CD 4.05Å; D386-K389 HydrophobicContact CB-CG 4.05Å; D386-K389 PolarHBondContact O-N 3.48Å; D386-K389 VanDerWaalsContact O-N 3.16Å; D386-K389 PolarHBondContact OD1-N 3.21Å; D386-K389 VanDerWaalsContact OD1-N 3.11Å; D386-K389 IonicContact OD2-NZ 2.78Å; D386-K389 PolarHBondContact OD2-NZ 3.3Å; D386-F390 WeakPolarHBondContact O-CD1 3.33Å; D386-F390 PolarHBondContact O-N 3Å
387	E	75.6	Confident	82.6	Confident	55 Å²	55	39.3 Å²	39.3	26%	0.257	21%	0.206	S	C	.	.	H	α-helix	trans	-57.5	-42.9	-177.9	-177.5	172.6	-166.4	0	0	112.7	M385 K389 F390 L391	M385-E387 PolarHBondContact O-N 3.1Å; E387-K389 VanDerWaalsContact C-N 3.3Å; E387-K389 PolarHBondContact O-N 2.95Å; E387-F390 VanDerWaalsContact CA-CE1 3.42Å; E387-F390 HydrophobicContact CB-CE1 4.12Å; E387-F390 HydrophobicContact CB-CE2 4.49Å; E387-F390 HydrophobicContact CB-CZ 3.92Å; E387-F390 HydrophobicContact CG-CE2 4.21Å; E387-F390 HydrophobicContact CG-CZ 4.01Å; E387-F390 PolarHBondContact O-N 2.96Å; E387-L391 HydrophobicContact CG-CD1 3.64Å; E387-L391 HydrophobicContact CG-CG 3.96Å; E387-L391 WeakPolarHBondContact O-CB 3.28Å; E387-L391 WeakPolarHBondContact O-CG 3.23Å; E387-L391 PolarHBondContact O-N 3.22Å
388	E	80.4	Confident	83.1	Confident	160 Å²	160	36.7 Å²	36.7	75%	0.748	19%	0.186	S	C	*	.	H	α-helix	trans	-62.7	-42	178.7	-61.7	-177.1	-173.9	0	0	110.3	D386 L392	D386-E388 VanDerWaalsContact C-N 3.34Å; D386-E388 PolarHBondContact O-N 3.43Å; D386-E388 PolarHBondContact OD1-N 2.99Å; D386-E388 VanDerWaalsContact OD1-N 3.09Å; E388-L392 WeakPolarHBondContact O-CG 3.27Å
389	K	80.5	Confident	83.5	Confident	62 Å²	62	42.6 Å²	42.6	27%	0.27	21%	0.212	S	C	.	.	H	α-helix	trans	-67.4	-46	177.7	-66.8	-173.6	-179.2	89.7	0	112.9	A381 D386 E387 Y393	A381-K389 HydrophobicContact CB-CB 3.66Å; D386-K389 HydrophobicContact CB-CB 4.03Å; D386-K389 HydrophobicContact CB-CD 4.05Å; D386-K389 HydrophobicContact CB-CG 4.05Å; D386-K389 PolarHBondContact O-N 3.48Å; D386-K389 VanDerWaalsContact O-N 3.16Å; D386-K389 PolarHBondContact OD1-N 3.21Å; D386-K389 VanDerWaalsContact OD1-N 3.11Å; D386-K389 IonicContact OD2-NZ 2.78Å; D386-K389 PolarHBondContact OD2-NZ 3.3Å; E387-K389 VanDerWaalsContact C-N 3.3Å; E387-K389 PolarHBondContact O-N 2.95Å; K389-Y393 VanDerWaalsContact O-CD2 3.29Å; K389-Y393 WeakPolarHBondContact O-CD2 3.24Å
390	F	81.1	Confident	83.8	Confident	20 Å²	20	42.9 Å²	42.9	9%	0.088	21%	0.214	C	C	.	.	H	α-helix	trans	-76.4	-31.4	-177.4	69.2	-117.8	0	0	0	113.3	A381 F382 D386 E387 L392 Y393 F394 F424	A381-F390 HydrophobicContact CB-CB 4.47Å; F382-F390 HydrophobicContact CD1-CB 3.82Å; F382-F390 HydrophobicContact CD1-CG 4.37Å; F382-F390 HydrophobicContact CE1-CB 3.84Å; F382-F390 HydrophobicContact CG-CB 4.23Å; F382-F390 HydrophobicContact CZ-CB 4.24Å; D386-F390 WeakPolarHBondContact O-CD1 3.33Å; D386-F390 PolarHBondContact O-N 3Å; E387-F390 VanDerWaalsContact CA-CE1 3.42Å; E387-F390 HydrophobicContact CB-CE1 4.12Å; E387-F390 HydrophobicContact CB-CE2 4.49Å; E387-F390 HydrophobicContact CB-CZ 3.92Å; E387-F390 HydrophobicContact CG-CE2 4.21Å; E387-F390 HydrophobicContact CG-CZ 4.01Å; E387-F390 PolarHBondContact O-N 2.96Å; F390-L392 PolarHBondContact O-N 3.08Å; F390-Y393 PolarHBondContact O-N 3.11Å; F390-Y393 VanDerWaalsContact O-N 3.08Å; F390-F394 HydrophobicContact CD2-CD2 4.12Å; F390-F394 AromaticContact CD2-CE2 3.54Å; F390-F394 HydrophobicContact CD2-CE2 3.54Å; F390-F394 HydrophobicContact CD2-CZ 4.29Å; F390-F394 AromaticContact CE2-CE2 3.98Å; F390-F394 HydrophobicContact CE2-CE2 3.98Å; F390-F394 PolarHBondContact O-N 3.13Å; F390-F424 HydrophobicContact CD1-CE2 4.34Å; F390-F424 HydrophobicContact CE1-CE2 4.2Å; F390-F424 HydrophobicContact CZ-CE2 4.39Å
391	L	86.3	Confident	84.3	Confident	56 Å²	56	39.7 Å²	39.7	29%	0.293	20%	0.199	S	C	.	.	H	α-helix	trans	-60.8	-31.2	174.7	-75.1	179.1	0	0	0	112.4	E387 Y393 F394 N395 T420	E387-L391 HydrophobicContact CG-CD1 3.64Å; E387-L391 HydrophobicContact CG-CG 3.96Å; E387-L391 WeakPolarHBondContact O-CB 3.28Å; E387-L391 WeakPolarHBondContact O-CG 3.23Å; E387-L391 PolarHBondContact O-N 3.22Å; L391-Y393 VanDerWaalsContact C-N 3.29Å; L391-Y393 PolarHBondContact O-N 3.42Å; L391-F394 HydrophobicContact CD2-CD2 4.14Å; L391-F394 PolarHBondContact O-N 3.33Å; L391-N395 WeakPolarHBondContact O-CB 3.38Å; L391-N395 VanDerWaalsContact O-CG 3.27Å; L391-N395 PolarHBondContact O-N 3.04Å; L391-N395 PolarHBondContact O-ND2 3.46Å; L391-N395 VanDerWaalsContact O-ND2 3.13Å; L391-T420 HydrophobicContact CD2-CG2 4.3Å
392	L	87.8	Confident	85	Confident	61 Å²	61	41.5 Å²	41.5	32%	0.319	21%	0.211	S	C	.	.	H	α-helix	trans	-57.2	-41.4	173.2	-70.1	170.1	0	0	0	112.2	E388 F390 N395 D396 T517	E388-L392 WeakPolarHBondContact O-CG 3.27Å; F390-L392 PolarHBondContact O-N 3.08Å; L392-N395 PolarHBondContact O-N 3.34Å; L392-D396 PolarHBondContact O-N 2.91Å; L392-T517 HydrophobicContact CD2-CG2 4.31Å
393	Y	87.6	Confident	85.6	Confident	12 Å²	12	47.6 Å²	47.6	5%	0.047	23%	0.234	C	C	.	.	H	α-helix	trans	-70	-37.8	179	-66.8	-84.4	0	0	0	112.2	Y378 A381 K389 F390 L391 F397 E452 F456 M514	Y378-Y393 AromaticContact CD2-CD1 3.57Å; Y378-Y393 HydrophobicContact CD2-CD1 3.57Å; Y378-Y393 AromaticContact CD2-CE1 3.37Å; Y378-Y393 HydrophobicContact CD2-CE1 3.37Å; Y378-Y393 HydrophobicContact CD2-CE2 4.46Å; Y378-Y393 HydrophobicContact CD2-CG 4.2Å; Y378-Y393 AromaticContact CD2-CZ 3.85Å; Y378-Y393 AromaticContact CE2-CD1 3.67Å; Y378-Y393 HydrophobicContact CE2-CD1 3.67Å; Y378-Y393 AromaticContact CE2-CE1 3.99Å; Y378-Y393 HydrophobicContact CE2-CE1 3.99Å; Y378-Y393 HydrophobicContact CE2-CG 4.13Å; Y378-Y393 HydrophobicContact CG-CE1 4.38Å; A381-Y393 HydrophobicContact CB-CD2 4.32Å; A381-Y393 HydrophobicContact CB-CE2 3.82Å; K389-Y393 VanDerWaalsContact O-CD2 3.29Å; K389-Y393 WeakPolarHBondContact O-CD2 3.24Å; F390-Y393 PolarHBondContact O-N 3.11Å; F390-Y393 VanDerWaalsContact O-N 3.08Å; L391-Y393 VanDerWaalsContact C-N 3.29Å; L391-Y393 PolarHBondContact O-N 3.42Å; Y393-F397 WeakPolarHBondContact O-CB 3.37Å; Y393-F397 PolarHBondContact O-N 3.46Å; Y393-E452 HydrophobicContact CE1-CG 4.28Å; Y393-F456 HydrophobicContact CD1-CE2 4.21Å; Y393-F456 HydrophobicContact CD1-CZ 4.14Å; Y393-F456 WeakPolarHBondContact O-CZ 3.44Å; Y393-M514 HydrophobicContact CD1-CE 3.83Å; Y393-M514 HydrophobicContact CE1-CE 4.11Å
394	F	89.9	Confident	86.4	Confident	5 Å²	5	48.8 Å²	48.8	2%	0.022	24%	0.243	C	C	.	.	H	α-helix	trans	-68.2	-41	173.9	-58.7	-35	0	0	0	112.1	F382 F390 L391 D396 F397 D398 T420 L423 F424 F427	F382-F394 AromaticContact CE1-CE1 3.9Å; F382-F394 HydrophobicContact CE1-CE1 3.9Å; F382-F394 AromaticContact CE1-CZ 3.77Å; F382-F394 HydrophobicContact CE1-CZ 3.77Å; F382-F394 HydrophobicContact CZ-CE1 4.38Å; F390-F394 HydrophobicContact CD2-CD2 4.12Å; F390-F394 AromaticContact CD2-CE2 3.54Å; F390-F394 HydrophobicContact CD2-CE2 3.54Å; F390-F394 HydrophobicContact CD2-CZ 4.29Å; F390-F394 AromaticContact CE2-CE2 3.98Å; F390-F394 HydrophobicContact CE2-CE2 3.98Å; F390-F394 PolarHBondContact O-N 3.13Å; L391-F394 HydrophobicContact CD2-CD2 4.14Å; L391-F394 PolarHBondContact O-N 3.33Å; F394-D396 PolarHBondContact O-N 3.3Å; F394-F397 WeakPolarHBondContact O-CB 3.01Å; F394-F397 PolarHBondContact O-N 3.17Å; F394-F397 VanDerWaalsContact O-N 3.14Å; F394-D398 PolarHBondContact O-N 3.44Å; F394-T420 HydrophobicContact CD2-CG2 3.78Å; F394-T420 HydrophobicContact CE2-CG2 4.33Å; F394-T420 HydrophobicContact CG-CG2 4.4Å; F394-L423 HydrophobicContact CD1-CB 3.74Å; F394-L423 HydrophobicContact CD1-CD1 3.91Å; F394-L423 HydrophobicContact CE1-CB 3.51Å; F394-L423 HydrophobicContact CZ-CB 4.44Å; F394-F424 HydrophobicContact CZ-CB 3.85Å; F394-F424 HydrophobicContact CZ-CD2 4.09Å; F394-F424 HydrophobicContact CZ-CG 4.46Å; F394-F427 HydrophobicContact CD1-CD2 4.11Å; F394-F427 HydrophobicContact CD1-CE2 4.2Å; F394-F427 AromaticContact CE1-CD2 3.81Å; F394-F427 HydrophobicContact CE1-CD2 3.81Å; F394-F427 HydrophobicContact CE1-CE2 4.34Å
395	N	90.8	Very high	87.5	Confident	87 Å²	87	45.9 Å²	45.9	47%	0.465	22%	0.222	S	C	.	.	H	α-helix	trans	-62.1	-40.8	176.9	-77.4	-36.3	0	0	0	112.4	L391 L392 D398 K399	L391-N395 WeakPolarHBondContact O-CB 3.38Å; L391-N395 VanDerWaalsContact O-CG 3.27Å; L391-N395 PolarHBondContact O-N 3.04Å; L391-N395 PolarHBondContact O-ND2 3.46Å; L391-N395 VanDerWaalsContact O-ND2 3.13Å; L392-N395 PolarHBondContact O-N 3.34Å; N395-D398 PolarHBondContact O-N 2.94Å; N395-K399 WeakPolarHBondContact O-CG 3.29Å; N395-K399 PolarHBondContact O-N 3.04Å
396	D	89.3	Confident	88.8	Confident	22 Å²	22	49 Å²	49	12%	0.118	24%	0.243	C	C	.	.	H	α-helix	trans	-74.7	-25.9	174.9	-75.2	-26.7	0	0	0	112.5	L392 F394 K399 L400 F456 M514	L392-D396 PolarHBondContact O-N 2.91Å; F394-D396 PolarHBondContact O-N 3.3Å; D396-K399 WeakPolarHBondContact OD1-CD 3.43Å; D396-K399 WeakPolarHBondContact OD1-CE 3.45Å; D396-K399 IonicContact OD1-NZ 2.69Å; D396-K399 PolarHBondContact OD1-NZ 3.3Å; D396-L400 WeakPolarHBondContact O-CG 3.44Å; D396-L400 PolarHBondContact O-N 3.37Å; D396-F456 HydrophobicContact CB-CE1 4.4Å; D396-M514 HydrophobicContact CB-CE 3.74Å; D396-M514 HydrophobicContact CB-CG 4.38Å; D396-M514 HydrophobicContact CB-SD 3.85Å; D396-M514 WeakPolarHBondContact OD2-CE 3.38Å; D396-M514 WeakPolarHBondContact OD2-CG 3.37Å
397	F	92.8	Very high	89.9	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68	-45.2	168.5	-176.4	-87.9	0	0	0	111.5	Y393 F394 K399 L400 F401 T419 L423 F427 F456 A459 L460 L463	Y393-F397 WeakPolarHBondContact O-CB 3.37Å; Y393-F397 PolarHBondContact O-N 3.46Å; F394-F397 WeakPolarHBondContact O-CB 3.01Å; F394-F397 PolarHBondContact O-N 3.17Å; F394-F397 VanDerWaalsContact O-N 3.14Å; F397-K399 VanDerWaalsContact C-N 3.27Å; F397-K399 PolarHBondContact O-N 3.07Å; F397-L400 CarbonylContact O-C 3.6Å; F397-L400 PolarHBondContact O-N 2.9Å; F397-F401 HydrophobicContact CD1-CB 4.08Å; F397-F401 HydrophobicContact CE1-CB 3.77Å; F397-F401 AromaticContact CE1-CD1 3.95Å; F397-F401 HydrophobicContact CE1-CD1 3.95Å; F397-F401 HydrophobicContact CE1-CG 4Å; F397-F401 HydrophobicContact CZ-CB 4.41Å; F397-F401 WeakPolarHBondContact O-CB 3.47Å; F397-F401 PolarHBondContact O-N 3.2Å; F397-T419 HydrophobicContact CD1-CG2 4.3Å; F397-T419 HydrophobicContact CE1-CG2 4.3Å; F397-L423 HydrophobicContact CB-CD1 4.04Å; F397-L423 HydrophobicContact CD1-CD1 3.37Å; F397-L423 HydrophobicContact CD1-CD2 4.46Å; F397-L423 HydrophobicContact CD1-CG 4.47Å; F397-L423 HydrophobicContact CD2-CD1 4.38Å; F397-L423 HydrophobicContact CE1-CD1 3.85Å; F397-L423 HydrophobicContact CE1-CD2 4.21Å; F397-L423 HydrophobicContact CE2-CD2 4.5Å; F397-L423 HydrophobicContact CG-CD1 3.65Å; F397-L423 HydrophobicContact CZ-CD2 4.23Å; F397-F427 AromaticContact CD2-CZ 3.97Å; F397-F427 HydrophobicContact CD2-CZ 3.97Å; F397-F427 HydrophobicContact CG-CZ 4.46Å; F397-F456 HydrophobicContact CB-CD1 4.02Å; F397-F456 HydrophobicContact CB-CE1 3.79Å; F397-F456 HydrophobicContact CD2-CB 4.47Å; F397-F456 AromaticContact CD2-CD1 3.77Å; F397-F456 HydrophobicContact CD2-CD1 3.77Å; F397-F456 HydrophobicContact CD2-CE1 4.39Å; F397-F456 HydrophobicContact CD2-CG 4.25Å; F397-F456 HydrophobicContact CG-CD1 4.39Å; F397-A459 HydrophobicContact CD2-CB 4.39Å; F397-A459 HydrophobicContact CE2-CB 3.44Å; F397-A459 VanDerWaalsContact CE2-CB 3.44Å; F397-A459 HydrophobicContact CZ-CB 3.74Å; F397-L460 HydrophobicContact CE2-CD2 4.03Å; F397-L460 HydrophobicContact CE2-CG 3.84Å; F397-L460 HydrophobicContact CZ-CD2 3.91Å; F397-L460 HydrophobicContact CZ-CG 4.16Å; F397-L463 HydrophobicContact CE1-CD1 4.04Å; F397-L463 HydrophobicContact CZ-CD1 3.82Å
398	D	93.2	Very high	90.9	Very high	18 Å²	18	52.4 Å²	52.4	10%	0.096	25%	0.25	C	S	.	.	H	α-helix	trans	-57.5	-38.8	178.5	-108	31.9	0	0	0	111.8	F394 N395 L400 F401 S402 Y409 K413 T419	F394-D398 PolarHBondContact O-N 3.44Å; N395-D398 PolarHBondContact O-N 2.94Å; D398-L400 VanDerWaalsContact C-N 3.33Å; D398-L400 PolarHBondContact O-N 2.88Å; D398-F401 PolarHBondContact O-N 2.98Å; D398-S402 VanDerWaalsContact O-CB 3.31Å; D398-S402 WeakPolarHBondContact O-CB 3.23Å; D398-S402 PolarHBondContact O-N 3.4Å; D398-S402 PolarHBondContact O-OG 3.09Å; D398-Y409 HydrophobicContact CB-CE2 4.13Å; D398-Y409 PolarHBondContact OD2-OH 3.13Å; D398-K413 IonicContact OD2-NZ 3.22Å; D398-K413 PolarHBondContact OD2-NZ 3.13Å; D398-T419 WeakPolarHBondContact OD1-CB 3.21Å; D398-T419 WeakPolarHBondContact OD1-CG2 3.31Å; D398-T419 PolarHBondContact OD1-OG1 3.42Å
399	K	92.8	Very high	91.7	Very high	128 Å²	128	47.3 Å²	47.3	56%	0.557	23%	0.225	S	C	*	.	H	α-helix	trans	-62.5	-36.4	173.6	-68.3	168.5	-159.7	165.9	0	112.9	N395 D396 F397 S402 R403	N395-K399 WeakPolarHBondContact O-CG 3.29Å; N395-K399 PolarHBondContact O-N 3.04Å; D396-K399 WeakPolarHBondContact OD1-CD 3.43Å; D396-K399 WeakPolarHBondContact OD1-CE 3.45Å; D396-K399 IonicContact OD1-NZ 2.69Å; D396-K399 PolarHBondContact OD1-NZ 3.3Å; F397-K399 VanDerWaalsContact C-N 3.27Å; F397-K399 PolarHBondContact O-N 3.07Å; K399-S402 PolarHBondContact O-OG 3.41Å; K399-S402 VanDerWaalsContact O-OG 3.06Å; K399-R403 WeakPolarHBondContact O-CB 3.48Å; K399-R403 PolarHBondContact O-N 3.29Å
400	L	92.3	Very high	92.5	Very high	8 Å²	8	50.3 Å²	50.3	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-79.3	-40.2	176.4	-64.1	166.8	0	0	0	111.5	D396 F397 D398 R403 C404 F456 L460 L506 N510	D396-L400 WeakPolarHBondContact O-CG 3.44Å; D396-L400 PolarHBondContact O-N 3.37Å; F397-L400 CarbonylContact O-C 3.6Å; F397-L400 PolarHBondContact O-N 2.9Å; D398-L400 VanDerWaalsContact C-N 3.33Å; D398-L400 PolarHBondContact O-N 2.88Å; L400-R403 PolarHBondContact O-N 2.97Å; L400-C404 WeakPolarHBondContact O-CB 3.43Å; L400-C404 PolarHBondContact O-N 2.92Å; L400-C404 PolarHBondContact O-SG 3.19Å; L400-C404 VanDerWaalsContact O-SG 3.4Å; L400-F456 HydrophobicContact CD1-CD1 3.7Å; L400-F456 HydrophobicContact CD1-CE1 4.33Å; L400-L460 HydrophobicContact CB-CD1 4.16Å; L400-L506 HydrophobicContact CD2-CD1 4.42Å; L400-N510 VanDerWaalsContact CD1-ND2 3.28Å; L400-N510 WeakPolarHBondContact CD1-ND2 3.29Å; L400-N510 WeakPolarHBondContact CD1-OD1 3.27Å
401	F	95.2	Very high	93.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-46.5	179.1	-178	-159.9	0	0	0	110.9	F397 D398 R403 C404 L405 L408 Y409 F412 T419 L460 L463	F397-F401 HydrophobicContact CD1-CB 4.08Å; F397-F401 HydrophobicContact CE1-CB 3.77Å; F397-F401 AromaticContact CE1-CD1 3.95Å; F397-F401 HydrophobicContact CE1-CD1 3.95Å; F397-F401 HydrophobicContact CE1-CG 4Å; F397-F401 HydrophobicContact CZ-CB 4.41Å; F397-F401 WeakPolarHBondContact O-CB 3.47Å; F397-F401 PolarHBondContact O-N 3.2Å; D398-F401 PolarHBondContact O-N 2.98Å; F401-R403 VanDerWaalsContact C-N 3.31Å; F401-R403 PolarHBondContact O-N 3.19Å; F401-C404 PolarHBondContact O-N 3.09Å; F401-L405 HydrophobicContact CD2-CB 3.93Å; F401-L405 HydrophobicContact CD2-CD1 4.2Å; F401-L405 HydrophobicContact CE2-CB 3.9Å; F401-L405 HydrophobicContact CE2-CD1 4.12Å; F401-L405 CarbonylContact O-C 3.58Å; F401-L405 PolarHBondContact O-N 3.16Å; F401-L408 HydrophobicContact CE2-CB 4.05Å; F401-L408 HydrophobicContact CE2-CD2 3.89Å; F401-L408 HydrophobicContact CE2-CG 3.96Å; F401-L408 HydrophobicContact CZ-CB 4.38Å; F401-L408 HydrophobicContact CZ-CD2 4.09Å; F401-L408 HydrophobicContact CZ-CG 3.93Å; F401-Y409 HydrophobicContact CB-CD2 4.16Å; F401-Y409 AromaticContact CD1-CD2 3.55Å; F401-Y409 HydrophobicContact CD1-CD2 3.55Å; F401-Y409 HydrophobicContact CD1-CE2 4.27Å; F401-Y409 AromaticContact CE1-CD2 3.96Å; F401-Y409 HydrophobicContact CE1-CD2 3.96Å; F401-Y409 AromaticContact CG-CD2 3.83Å; F401-Y409 HydrophobicContact CG-CD2 3.83Å; F401-F412 AromaticContact CE1-CD2 3.61Å; F401-F412 HydrophobicContact CE1-CD2 3.61Å; F401-F412 AromaticContact CE1-CE2 3.86Å; F401-F412 HydrophobicContact CE1-CE2 3.86Å; F401-F412 HydrophobicContact CE1-CG 4.2Å; F401-F412 AromaticContact CZ-CD2 3.89Å; F401-F412 HydrophobicContact CZ-CD2 3.89Å; F401-F412 AromaticContact CZ-CE2 3.93Å; F401-F412 HydrophobicContact CZ-CE2 3.93Å; F401-F412 HydrophobicContact CZ-CG 4.18Å; F401-F412 HydrophobicContact CZ-CZ 4.28Å; F401-T419 HydrophobicContact CD1-CG2 3.67Å; F401-T419 HydrophobicContact CE1-CG2 3.88Å; F401-L460 HydrophobicContact CB-CD2 4.17Å; F401-L463 HydrophobicContact CD1-CD1 4.33Å; F401-L463 HydrophobicContact CD2-CD1 4.11Å; F401-L463 HydrophobicContact CE1-CD1 4.16Å; F401-L463 HydrophobicContact CE2-CD1 3.94Å; F401-L463 HydrophobicContact CG-CD1 4.34Å; F401-L463 HydrophobicContact CZ-CD1 3.97Å
402	S	95.5	Very high	93.8	Very high	39 Å²	39	48.3 Å²	48.3	27%	0.273	23%	0.227	S	C	.	.	H	α-helix	trans	-60.4	-35.2	172.9	58.3	0	0	0	0	113.9	D398 K399 P406 Y409	D398-S402 VanDerWaalsContact O-CB 3.31Å; D398-S402 WeakPolarHBondContact O-CB 3.23Å; D398-S402 PolarHBondContact O-N 3.4Å; D398-S402 PolarHBondContact O-OG 3.09Å; K399-S402 PolarHBondContact O-OG 3.41Å; K399-S402 VanDerWaalsContact O-OG 3.06Å; S402-P406 WeakPolarHBondContact O-CA 3.36Å; S402-P406 WeakPolarHBondContact O-CB 3.5Å; S402-Y409 VanDerWaalsContact CB-CD1 3.42Å; S402-Y409 VanDerWaalsContact CB-CE1 3.48Å
403	R	93.4	Very high	94.2	Very high	130 Å²	130	50 Å²	50	49%	0.491	23%	0.232	S	C	.	.	H	α-helix	trans	-77.1	-38.8	177.1	177.1	177.2	168.8	178.5	-4.5	113.4	K399 L400 F401 F509	K399-R403 WeakPolarHBondContact O-CB 3.48Å; K399-R403 PolarHBondContact O-N 3.29Å; L400-R403 PolarHBondContact O-N 2.97Å; F401-R403 VanDerWaalsContact C-N 3.31Å; F401-R403 PolarHBondContact O-N 3.19Å; R403-F509 VanDerWaalsContact NH2-CE2 3.31Å
404	C	93.5	Very high	94.6	Very high	32 Å²	32	55.7 Å²	55.7	22%	0.216	26%	0.259	C	S	.	.	H	α-helix	trans	-94.3	-31.8	-169.2	-71.8	0	0	0	0	113.8	L400 F401 P406 L460 F503	L400-C404 WeakPolarHBondContact O-CB 3.43Å; L400-C404 PolarHBondContact O-N 2.92Å; L400-C404 PolarHBondContact O-SG 3.19Å; L400-C404 VanDerWaalsContact O-SG 3.4Å; F401-C404 PolarHBondContact O-N 3.09Å; C404-P406 VanDerWaalsContact C-CD 3.49Å; C404-L460 HydrophobicContact CB-CD2 4.37Å; C404-F503 HydrophobicContact CB-CE1 3.84Å
405	L	94.9	Very high	94.8	Very high	9 Å²	9	57 Å²	57	5%	0.047	27%	0.267	C	S	.	.	S	Bend	trans	-133.6	58.8	178.2	-57.5	170.9	0	0	0	109.8	F401 R407 L408 Y409 L463 K464	F401-L405 HydrophobicContact CD2-CB 3.93Å; F401-L405 HydrophobicContact CD2-CD1 4.2Å; F401-L405 HydrophobicContact CE2-CB 3.9Å; F401-L405 HydrophobicContact CE2-CD1 4.12Å; F401-L405 CarbonylContact O-C 3.58Å; F401-L405 PolarHBondContact O-N 3.16Å; L405-R407 PolarHBondContact O-N 3.11Å; L405-R407 VanDerWaalsContact O-N 3.12Å; L405-L408 HydrophobicContact CB-CB 4.19Å; L405-L408 HydrophobicContact CD1-CD2 4.28Å; L405-L408 PolarHBondContact O-N 2.86Å; L405-Y409 PolarHBondContact O-N 2.97Å; L405-L463 HydrophobicContact CD1-CB 3.74Å; L405-K464 HydrophobicContact CD1-CB 4.11Å; L405-K464 HydrophobicContact CD2-CB 3.95Å; L405-K464 HydrophobicContact CD2-CD 4.49Å; L405-K464 HydrophobicContact CD2-CG 4.14Å
406	P	97.1	Very high	94.9	Very high	80 Å²	80	54.5 Å²	54.5	52%	0.519	26%	0.262	S	S	.	.	H	α-helix	trans	-57	-34.3	-170.2	20.9	-33.5	0	0	0	113.6	S402 C404 K410	S402-P406 WeakPolarHBondContact O-CA 3.36Å; S402-P406 WeakPolarHBondContact O-CB 3.5Å; C404-P406 VanDerWaalsContact C-CD 3.49Å; P406-K410 VanDerWaalsContact O-CB 3.26Å; P406-K410 WeakPolarHBondContact O-CB 3.38Å; P406-K410 PolarHBondContact O-N 3.5Å
407	R	97.6	Very high	95	Very high	172 Å²	172	53.6 Å²	53.6	65%	0.649	26%	0.257	S	S	*	.	H	α-helix	trans	-65.4	-47.2	177.5	-174	-173.1	171.5	-169.9	-5.6	111.8	L405 K410 H411 L471	L405-R407 PolarHBondContact O-N 3.11Å; L405-R407 VanDerWaalsContact O-N 3.12Å; R407-K410 PolarHBondContact O-N 2.92Å; R407-H411 PolarHBondContact O-N 3.04Å; R407-H411 VanDerWaalsContact O-N 3.09Å; R407-L471 HydrophobicContact CG-CD1 4.4Å; R407-L471 HydrophobicContact CG-CD2 3.91Å; R407-L471 VanDerWaalsContact CZ-CD1 3.49Å
408	L	97.3	Very high	94.9	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-71.2	-39.7	179.7	-173.8	66.4	0	0	0	111.6	F401 L405 K410 H411 F412 L463 E467 L470 L471	F401-L408 HydrophobicContact CE2-CB 4.05Å; F401-L408 HydrophobicContact CE2-CD2 3.89Å; F401-L408 HydrophobicContact CE2-CG 3.96Å; F401-L408 HydrophobicContact CZ-CB 4.38Å; F401-L408 HydrophobicContact CZ-CD2 4.09Å; F401-L408 HydrophobicContact CZ-CG 3.93Å; L405-L408 HydrophobicContact CB-CB 4.19Å; L405-L408 HydrophobicContact CD1-CD2 4.28Å; L405-L408 PolarHBondContact O-N 2.86Å; L408-K410 VanDerWaalsContact C-N 3.34Å; L408-K410 PolarHBondContact O-N 3.1Å; L408-H411 WeakPolarHBondContact O-CB 3.19Å; L408-H411 PolarHBondContact O-N 3.41Å; L408-F412 HydrophobicContact CD1-CD1 4.16Å; L408-F412 HydrophobicContact CD1-CE1 3.67Å; L408-F412 HydrophobicContact CG-CD1 4.26Å; L408-F412 HydrophobicContact CG-CE1 3.9Å; L408-F412 HydrophobicContact CG-CZ 4.46Å; L408-F412 VanDerWaalsContact O-CD1 3.31Å; L408-F412 WeakPolarHBondContact O-CD1 3.39Å; L408-F412 PolarHBondContact O-N 3.28Å; L408-L463 HydrophobicContact CD2-CB 4.07Å; L408-L463 HydrophobicContact CD2-CD2 4.48Å; L408-E467 HydrophobicContact CB-CG 4.32Å; L408-E467 HydrophobicContact CD2-CB 4.39Å; L408-E467 HydrophobicContact CD2-CG 4.4Å; L408-L470 HydrophobicContact CD1-CB 3.64Å; L408-L470 HydrophobicContact CD2-CD1 4.11Å; L408-L471 HydrophobicContact CB-CD2 4.37Å; L408-L471 HydrophobicContact CD1-CD2 3.95Å; L408-L471 HydrophobicContact CD1-CG 3.89Å
409	Y	97.3	Very high	94.8	Very high	53 Å²	53	57.5 Å²	57.5	21%	0.208	28%	0.275	C	S	.	.	H	α-helix	trans	-59.8	-44.5	173.4	-176.9	-98.8	0	0	0	111.9	D398 F401 S402 L405 F412 K413	D398-Y409 HydrophobicContact CB-CE2 4.13Å; D398-Y409 PolarHBondContact OD2-OH 3.13Å; F401-Y409 HydrophobicContact CB-CD2 4.16Å; F401-Y409 AromaticContact CD1-CD2 3.55Å; F401-Y409 HydrophobicContact CD1-CD2 3.55Å; F401-Y409 HydrophobicContact CD1-CE2 4.27Å; F401-Y409 AromaticContact CE1-CD2 3.96Å; F401-Y409 HydrophobicContact CE1-CD2 3.96Å; F401-Y409 AromaticContact CG-CD2 3.83Å; F401-Y409 HydrophobicContact CG-CD2 3.83Å; S402-Y409 VanDerWaalsContact CB-CD1 3.42Å; S402-Y409 VanDerWaalsContact CB-CE1 3.48Å; L405-Y409 PolarHBondContact O-N 2.97Å; Y409-F412 PolarHBondContact O-N 2.98Å; Y409-K413 HydrophobicContact CD1-CG 4.37Å; Y409-K413 HydrophobicContact CE1-CG 4.02Å; Y409-K413 PolarHBondContact O-N 3.1Å; Y409-K413 VanDerWaalsContact O-N 3.09Å; Y409-K413 WeakPolarHBondContact OH-CE 3.32Å
410	K	97.3	Very high	94.5	Very high	124 Å²	124	53.5 Å²	53.5	54%	0.539	26%	0.261	S	S	.	.	H	α-helix	trans	-60	-47	175.5	-178.1	-179.8	166.5	-173.7	0	111.3	P406 R407 L408 F412 K413 E414	P406-K410 VanDerWaalsContact O-CB 3.26Å; P406-K410 WeakPolarHBondContact O-CB 3.38Å; P406-K410 PolarHBondContact O-N 3.5Å; R407-K410 PolarHBondContact O-N 2.92Å; L408-K410 VanDerWaalsContact C-N 3.34Å; L408-K410 PolarHBondContact O-N 3.1Å; K410-F412 VanDerWaalsContact C-N 3.32Å; K410-F412 PolarHBondContact O-N 3.06Å; K410-K413 PolarHBondContact O-N 3.12Å; K410-E414 VanDerWaalsContact CE-CD 3.4Å; K410-E414 WeakPolarHBondContact CE-OE1 3.46Å; K410-E414 HydrophobicContact CG-CG 4.4Å; K410-E414 IonicContact NZ-OE1 3.68Å; K410-E414 PolarHBondContact NZ-OE1 3.34Å; K410-E414 WeakPolarHBondContact O-CG 3.44Å; K410-E414 PolarHBondContact O-N 3.42Å
411	H	97.7	Very high	94.2	Very high	33 Å²	33	55.6 Å²	55.6	15%	0.153	27%	0.272	C	S	.	.	H	α-helix	trans	-55.8	-45.2	175.3	-179	71.3	0	0	0	112	R407 L408 K413 E414 V415 L470 L471 C473	R407-H411 PolarHBondContact O-N 3.04Å; R407-H411 VanDerWaalsContact O-N 3.09Å; L408-H411 WeakPolarHBondContact O-CB 3.19Å; L408-H411 PolarHBondContact O-N 3.41Å; H411-K413 PolarHBondContact O-N 3.44Å; H411-E414 PolarHBondContact O-N 3.32Å; H411-V415 WeakPolarHBondContact O-CB 3.31Å; H411-V415 WeakPolarHBondContact O-CG2 3.45Å; H411-V415 PolarHBondContact O-N 3.39Å; H411-L470 PolarHBondContact CD2-O 3.42Å; H411-L470 PolarHBondContact NE2-O 3.26Å; H411-L471 HydrophobicContact CB-CD2 3.93Å; H411-C473 PolarHBondContact CE1-O 2.78Å; H411-C473 PolarHBondContact NE2-O 3.17Å
412	F	96.4	Very high	93.9	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.009	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-43.8	177.6	-82.7	32.7	0	0	0	111.9	F401 L408 Y409 K410 V415 G416 F417 F422 L463 L470 L478 L482	F401-F412 AromaticContact CE1-CD2 3.61Å; F401-F412 HydrophobicContact CE1-CD2 3.61Å; F401-F412 AromaticContact CE1-CE2 3.86Å; F401-F412 HydrophobicContact CE1-CE2 3.86Å; F401-F412 HydrophobicContact CE1-CG 4.2Å; F401-F412 AromaticContact CZ-CD2 3.89Å; F401-F412 HydrophobicContact CZ-CD2 3.89Å; F401-F412 AromaticContact CZ-CE2 3.93Å; F401-F412 HydrophobicContact CZ-CE2 3.93Å; F401-F412 HydrophobicContact CZ-CG 4.18Å; F401-F412 HydrophobicContact CZ-CZ 4.28Å; L408-F412 HydrophobicContact CD1-CD1 4.16Å; L408-F412 HydrophobicContact CD1-CE1 3.67Å; L408-F412 HydrophobicContact CG-CD1 4.26Å; L408-F412 HydrophobicContact CG-CE1 3.9Å; L408-F412 HydrophobicContact CG-CZ 4.46Å; L408-F412 VanDerWaalsContact O-CD1 3.31Å; L408-F412 WeakPolarHBondContact O-CD1 3.39Å; L408-F412 PolarHBondContact O-N 3.28Å; Y409-F412 PolarHBondContact O-N 2.98Å; K410-F412 VanDerWaalsContact C-N 3.32Å; K410-F412 PolarHBondContact O-N 3.06Å; F412-V415 PolarHBondContact O-N 2.93Å; F412-G416 PolarHBondContact O-N 2.89Å; F412-F417 AromaticContact CD2-CD1 3.76Å; F412-F417 HydrophobicContact CD2-CD1 3.76Å; F412-F417 AromaticContact CE2-CD1 3.79Å; F412-F417 HydrophobicContact CE2-CD1 3.79Å; F412-F417 HydrophobicContact CE2-CE1 4.12Å; F412-F417 HydrophobicContact CG-CD1 4.36Å; F412-F417 HydrophobicContact CZ-CD1 4.4Å; F412-F417 PolarHBondContact O-N 3.38Å; F412-F422 AromaticContact CE2-CE1 3.83Å; F412-F422 HydrophobicContact CE2-CE1 3.83Å; F412-F422 HydrophobicContact CE2-CZ 4.2Å; F412-L463 HydrophobicContact CE2-CD2 4.48Å; F412-L463 HydrophobicContact CZ-CD2 4.21Å; F412-L470 HydrophobicContact CE1-CB 4.49Å; F412-L478 HydrophobicContact CD1-CD1 3.99Å; F412-L478 HydrophobicContact CD1-CD2 4.44Å; F412-L478 HydrophobicContact CE1-CD1 3.95Å; F412-L478 HydrophobicContact CE1-CD2 3.61Å; F412-L478 HydrophobicContact CE1-CG 4.45Å; F412-L478 HydrophobicContact CZ-CD2 4Å; F412-L482 HydrophobicContact CE2-CD1 4.14Å; F412-L482 HydrophobicContact CZ-CD1 3.87Å
413	K	96.2	Very high	93.6	Very high	95 Å²	95	53.9 Å²	53.9	41%	0.413	26%	0.259	S	S	.	.	H	α-helix	trans	-69.3	-33.2	176.4	-60.3	-57.4	-177.9	-173.6	0	113	D398 Y409 K410 H411 G416	D398-K413 IonicContact OD2-NZ 3.22Å; D398-K413 PolarHBondContact OD2-NZ 3.13Å; Y409-K413 HydrophobicContact CD1-CG 4.37Å; Y409-K413 HydrophobicContact CE1-CG 4.02Å; Y409-K413 PolarHBondContact O-N 3.1Å; Y409-K413 VanDerWaalsContact O-N 3.09Å; Y409-K413 WeakPolarHBondContact OH-CE 3.32Å; K410-K413 PolarHBondContact O-N 3.12Å; H411-K413 PolarHBondContact O-N 3.44Å; K413-G416 PolarHBondContact O-N 2.9Å
414	E	96.2	Very high	93.3	Very high	133 Å²	133	49.2 Å²	49.2	62%	0.621	24%	0.243	S	C	*	.	H	α-helix	trans	-69.7	-35.4	174.3	-74.1	177	152	0	0	112.5	K410 H411	K410-E414 VanDerWaalsContact CE-CD 3.4Å; K410-E414 WeakPolarHBondContact CE-OE1 3.46Å; K410-E414 HydrophobicContact CG-CG 4.4Å; K410-E414 IonicContact NZ-OE1 3.68Å; K410-E414 PolarHBondContact NZ-OE1 3.34Å; K410-E414 WeakPolarHBondContact O-CG 3.44Å; K410-E414 PolarHBondContact O-N 3.42Å; H411-E414 PolarHBondContact O-N 3.32Å
415	V	94.4	Very high	92.8	Very high	32 Å²	32	49.4 Å²	49.4	19%	0.194	24%	0.241	C	C	.	.	H	α-helix	trans	-78.1	-19.9	175	173.3	0	0	0	0	112.6	H411 F412 F417 F475 L478	H411-V415 WeakPolarHBondContact O-CB 3.31Å; H411-V415 WeakPolarHBondContact O-CG2 3.45Å; H411-V415 PolarHBondContact O-N 3.39Å; F412-V415 PolarHBondContact O-N 2.93Å; V415-F417 HydrophobicContact CG1-CB 4.33Å; V415-F475 HydrophobicContact CG1-CB 3.71Å; V415-F475 HydrophobicContact CG1-CD2 4.42Å; V415-F475 VanDerWaalsContact CG1-N 3.34Å; V415-L478 HydrophobicContact CB-CD1 4.48Å; V415-L478 HydrophobicContact CG1-CD1 4.07Å
416	G	92.9	Very high	92.7	Very high	35 Å²	35	49 Å²	49	36%	0.361	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	23.8	-174.6	0	0	0	0	0	113.8	F412 K413	F412-G416 PolarHBondContact O-N 2.89Å; K413-G416 PolarHBondContact O-N 2.9Å
417	F	91.4	Very high	92.4	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.009	22%	0.215	C	C	.	.			trans	-94.1	119.8	-180	-165.8	-99.4	0	0	0	110.6	F412 V415 M421 F422 F475 L478 L482	F412-F417 AromaticContact CD2-CD1 3.76Å; F412-F417 HydrophobicContact CD2-CD1 3.76Å; F412-F417 AromaticContact CE2-CD1 3.79Å; F412-F417 HydrophobicContact CE2-CD1 3.79Å; F412-F417 HydrophobicContact CE2-CE1 4.12Å; F412-F417 HydrophobicContact CG-CD1 4.36Å; F412-F417 HydrophobicContact CZ-CD1 4.4Å; F412-F417 PolarHBondContact O-N 3.38Å; V415-F417 HydrophobicContact CG1-CB 4.33Å; F417-M421 HydrophobicContact CD2-SD 3.83Å; F417-M421 HydrophobicContact CE2-CB 4.39Å; F417-M421 HydrophobicContact CE2-SD 3.96Å; F417-M421 HydrophobicContact CG-SD 4.33Å; F417-M421 HydrophobicContact CZ-CB 4.23Å; F417-F422 AromaticContact CE1-CD1 3.58Å; F417-F422 HydrophobicContact CE1-CD1 3.58Å; F417-F422 AromaticContact CE1-CE1 3.92Å; F417-F422 HydrophobicContact CE1-CE1 3.92Å; F417-F422 HydrophobicContact CZ-CD1 4.21Å; F417-F475 HydrophobicContact CB-CD2 4.18Å; F417-F475 HydrophobicContact CB-CE2 4.45Å; F417-F475 AromaticContact CD2-CD2 3.77Å; F417-F475 HydrophobicContact CD2-CD2 3.77Å; F417-F475 AromaticContact CD2-CE2 3.74Å; F417-F475 HydrophobicContact CD2-CE2 3.74Å; F417-F475 HydrophobicContact CD2-CG 4.23Å; F417-F475 HydrophobicContact CD2-CZ 4.17Å; F417-F475 HydrophobicContact CG-CD2 4.49Å; F417-L478 HydrophobicContact CB-CD1 3.82Å; F417-L478 HydrophobicContact CD1-CB 4.18Å; F417-L478 HydrophobicContact CD1-CD1 4.07Å; F417-L478 HydrophobicContact CD2-CB 3.93Å; F417-L478 HydrophobicContact CD2-CD1 4.4Å; F417-L478 HydrophobicContact CE1-CB 4.15Å; F417-L478 HydrophobicContact CE2-CB 3.93Å; F417-L478 HydrophobicContact CG-CB 4.07Å; F417-L478 HydrophobicContact CG-CD1 3.85Å; F417-L478 HydrophobicContact CZ-CB 4.04Å; F417-L482 HydrophobicContact CE1-CD1 3.67Å; F417-L482 HydrophobicContact CZ-CD1 4.18Å
418	E	90.4	Very high	91.9	Very high	94 Å²	94	37 Å²	37	44%	0.439	18%	0.184	S	C	.	.			trans	-96.1	148	-177	-62.1	-176.4	172	0	0	112	T420 M421	E418-T420 VanDerWaalsContact C-N 3.27Å; E418-T420 VanDerWaalsContact CB-OG1 3.25Å; E418-T420 WeakPolarHBondContact CB-OG1 3.09Å; E418-T420 PolarHBondContact O-N 2.92Å; E418-T420 PolarHBondContact OE2-OG1 3.23Å; E418-M421 HydrophobicContact CB-CE 4.01Å; E418-M421 HydrophobicContact CB-CG 4.2Å; E418-M421 HydrophobicContact CB-SD 4.33Å; E418-M421 HydrophobicContact CG-CE 4.13Å; E418-M421 VanDerWaalsContact O-CB 3.31Å; E418-M421 WeakPolarHBondContact O-CB 3.26Å; E418-M421 WeakPolarHBondContact O-CG 3.33Å; E418-M421 PolarHBondContact O-N 3.44Å; E418-M421 VanDerWaalsContact O-N 3.17Å
419	T	90.2	Very high	91.6	Very high	6 Å²	6	37 Å²	37	4%	0.037	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-27.3	179.9	47.2	0	0	0	0	113.5	F397 D398 F401 M421 F422 L423	F397-T419 HydrophobicContact CD1-CG2 4.3Å; F397-T419 HydrophobicContact CE1-CG2 4.3Å; D398-T419 WeakPolarHBondContact OD1-CB 3.21Å; D398-T419 WeakPolarHBondContact OD1-CG2 3.31Å; D398-T419 PolarHBondContact OD1-OG1 3.42Å; F401-T419 HydrophobicContact CD1-CG2 3.67Å; F401-T419 HydrophobicContact CE1-CG2 3.88Å; T419-M421 PolarHBondContact O-N 3.03Å; T419-M421 VanDerWaalsContact O-N 3.16Å; T419-F422 HydrophobicContact CG2-CE1 4.03Å; T419-F422 HydrophobicContact CG2-CZ 4.1Å; T419-F422 PolarHBondContact O-N 3.13Å; T419-L423 HydrophobicContact CG2-CD1 4.43Å; T419-L423 VanDerWaalsContact O-CB 3.26Å; T419-L423 WeakPolarHBondContact O-CB 3.32Å; T419-L423 VanDerWaalsContact O-CG 3.29Å; T419-L423 WeakPolarHBondContact O-CG 3.46Å; T419-L423 PolarHBondContact O-N 2.91Å
420	T	87.7	Confident	91.5	Very high	44 Å²	44	34.5 Å²	34.5	27%	0.27	17%	0.174	S	C	.	.	H	α-helix	trans	-49.5	-34.4	169.2	52.2	0	0	0	0	112.8	L391 F394 E418 F422	L391-T420 HydrophobicContact CD2-CG2 4.3Å; F394-T420 HydrophobicContact CD2-CG2 3.78Å; F394-T420 HydrophobicContact CE2-CG2 4.33Å; F394-T420 HydrophobicContact CG-CG2 4.4Å; E418-T420 VanDerWaalsContact C-N 3.27Å; E418-T420 VanDerWaalsContact CB-OG1 3.25Å; E418-T420 WeakPolarHBondContact CB-OG1 3.09Å; E418-T420 PolarHBondContact O-N 2.92Å; E418-T420 PolarHBondContact OE2-OG1 3.23Å; T420-F422 VanDerWaalsContact C-N 3.31Å; T420-F422 PolarHBondContact O-N 3.26Å
421	M	85.7	Confident	91.3	Very high	53 Å²	53	28.6 Å²	28.6	26%	0.261	15%	0.148	S	C	.	.	H	α-helix	trans	-68.9	-22.8	-173.3	-60	176.2	176.3	0	0	114.1	L29 F417 E418 T419 F475	L29-M421 HydrophobicContact CD1-CE 4.24Å; F417-M421 HydrophobicContact CD2-SD 3.83Å; F417-M421 HydrophobicContact CE2-CB 4.39Å; F417-M421 HydrophobicContact CE2-SD 3.96Å; F417-M421 HydrophobicContact CG-SD 4.33Å; F417-M421 HydrophobicContact CZ-CB 4.23Å; E418-M421 HydrophobicContact CB-CE 4.01Å; E418-M421 HydrophobicContact CB-CG 4.2Å; E418-M421 HydrophobicContact CB-SD 4.33Å; E418-M421 HydrophobicContact CG-CE 4.13Å; E418-M421 VanDerWaalsContact O-CB 3.31Å; E418-M421 WeakPolarHBondContact O-CB 3.26Å; E418-M421 WeakPolarHBondContact O-CG 3.33Å; E418-M421 PolarHBondContact O-N 3.44Å; E418-M421 VanDerWaalsContact O-N 3.17Å; T419-M421 PolarHBondContact O-N 3.03Å; T419-M421 VanDerWaalsContact O-N 3.16Å; M421-F475 HydrophobicContact CE-CE2 3.97Å; M421-F475 HydrophobicContact CE-CZ 4.04Å; M421-F475 HydrophobicContact SD-CE2 3.82Å; M421-F475 HydrophobicContact SD-CZ 3.77Å
422	F	88.4	Confident	91	Very high	3 Å²	3	27 Å²	27	1%	0.013	14%	0.141	C	C	.	.	H	α-helix	trans	-126.6	-32.3	179.6	68.7	-87	0	0	0	113.7	F412 F417 T419 T420 F424 D425 W426 L463 L482	F412-F422 AromaticContact CE2-CE1 3.83Å; F412-F422 HydrophobicContact CE2-CE1 3.83Å; F412-F422 HydrophobicContact CE2-CZ 4.2Å; F417-F422 AromaticContact CE1-CD1 3.58Å; F417-F422 HydrophobicContact CE1-CD1 3.58Å; F417-F422 AromaticContact CE1-CE1 3.92Å; F417-F422 HydrophobicContact CE1-CE1 3.92Å; F417-F422 HydrophobicContact CZ-CD1 4.21Å; T419-F422 HydrophobicContact CG2-CE1 4.03Å; T419-F422 HydrophobicContact CG2-CZ 4.1Å; T419-F422 PolarHBondContact O-N 3.13Å; T420-F422 VanDerWaalsContact C-N 3.31Å; T420-F422 PolarHBondContact O-N 3.26Å; F422-F424 VanDerWaalsContact C-N 3.28Å; F422-F424 PolarHBondContact O-N 2.98Å; F422-D425 PolarHBondContact O-N 3.1Å; F422-W426 AromaticContact CD2-CD2 3.83Å; F422-W426 HydrophobicContact CD2-CD2 3.83Å; F422-W426 AromaticContact CD2-CE2 3.66Å; F422-W426 AromaticContact CD2-CE3 3.9Å; F422-W426 HydrophobicContact CD2-CE3 3.9Å; F422-W426 AromaticContact CD2-CH2 3.79Å; F422-W426 HydrophobicContact CD2-CH2 3.79Å; F422-W426 AromaticContact CD2-CZ2 3.67Å; F422-W426 HydrophobicContact CD2-CZ2 3.67Å; F422-W426 AromaticContact CD2-CZ3 3.9Å; F422-W426 HydrophobicContact CD2-CZ3 3.9Å; F422-W426 HydrophobicContact CE2-CD2 4.37Å; F422-W426 AromaticContact CE2-CE3 3.97Å; F422-W426 HydrophobicContact CE2-CE3 3.97Å; F422-W426 AromaticContact CE2-CH2 3.79Å; F422-W426 HydrophobicContact CE2-CH2 3.79Å; F422-W426 HydrophobicContact CE2-CZ2 4.16Å; F422-W426 AromaticContact CE2-CZ3 3.67Å; F422-W426 HydrophobicContact CE2-CZ3 3.67Å; F422-W426 VanDerWaalsContact O-CD1 3.23Å; F422-W426 PolarHBondContact O-N 3.29Å; F422-L463 HydrophobicContact CE2-CD1 4.47Å; F422-L463 HydrophobicContact CE2-CD2 4.29Å; F422-L463 HydrophobicContact CZ-CD1 4.18Å; F422-L463 HydrophobicContact CZ-CD2 4.14Å; F422-L482 HydrophobicContact CB-CB 4.01Å; F422-L482 HydrophobicContact CD1-CD1 4.04Å; F422-L482 HydrophobicContact CE1-CD1 4.14Å; F422-L482 HydrophobicContact CG-CB 4.2Å; F422-L482 HydrophobicContact CG-CD1 4.25Å; F422-L482 HydrophobicContact CZ-CD1 4.49Å
423	L	90.1	Very high	90.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65	-29.8	-176.5	-71.6	-179	0	0	0	113.3	F394 F397 T419 D425 W426 F427 A459	F394-L423 HydrophobicContact CD1-CB 3.74Å; F394-L423 HydrophobicContact CD1-CD1 3.91Å; F394-L423 HydrophobicContact CE1-CB 3.51Å; F394-L423 HydrophobicContact CZ-CB 4.44Å; F397-L423 HydrophobicContact CB-CD1 4.04Å; F397-L423 HydrophobicContact CD1-CD1 3.37Å; F397-L423 HydrophobicContact CD1-CD2 4.46Å; F397-L423 HydrophobicContact CD1-CG 4.47Å; F397-L423 HydrophobicContact CD2-CD1 4.38Å; F397-L423 HydrophobicContact CE1-CD1 3.85Å; F397-L423 HydrophobicContact CE1-CD2 4.21Å; F397-L423 HydrophobicContact CE2-CD2 4.5Å; F397-L423 HydrophobicContact CG-CD1 3.65Å; F397-L423 HydrophobicContact CZ-CD2 4.23Å; T419-L423 HydrophobicContact CG2-CD1 4.43Å; T419-L423 VanDerWaalsContact O-CB 3.26Å; T419-L423 WeakPolarHBondContact O-CB 3.32Å; T419-L423 VanDerWaalsContact O-CG 3.29Å; T419-L423 WeakPolarHBondContact O-CG 3.46Å; T419-L423 PolarHBondContact O-N 2.91Å; L423-D425 VanDerWaalsContact C-N 3.33Å; L423-D425 PolarHBondContact O-N 2.66Å; L423-W426 HydrophobicContact CD2-CE3 4.03Å; L423-W426 PolarHBondContact O-N 3.07Å; L423-F427 HydrophobicContact CB-CD2 4.23Å; L423-F427 HydrophobicContact CB-CE2 4.26Å; L423-F427 HydrophobicContact CD1-CE2 4.1Å; L423-F427 HydrophobicContact CD1-CZ 4.3Å; L423-F427 HydrophobicContact CD2-CE1 4.08Å; L423-F427 HydrophobicContact CD2-CE2 4.33Å; L423-F427 HydrophobicContact CD2-CZ 3.92Å; L423-F427 HydrophobicContact CG-CE2 4.49Å; L423-F427 WeakPolarHBondContact O-CB 3.49Å; L423-F427 WeakPolarHBondContact O-CG 3.27Å; L423-F427 PolarHBondContact O-N 3.21Å; L423-A459 HydrophobicContact CD2-CB 3.94Å
424	F	86.8	Confident	90.2	Very high	32 Å²	32	25.5 Å²	25.5	14%	0.14	13%	0.133	C	C	.	.	H	α-helix	trans	-54.8	-50.6	179.4	-173.6	-84.3	0	0	0	110.9	M229 F382 M385 F390 F394 F422 F428	M229-F424 HydrophobicContact SD-CE1 4.44Å; F382-F424 AromaticContact CD1-CD2 3.95Å; F382-F424 HydrophobicContact CD1-CD2 3.95Å; F382-F424 AromaticContact CD1-CE2 3.89Å; F382-F424 HydrophobicContact CD1-CE2 3.89Å; F382-F424 HydrophobicContact CE1-CD2 4.43Å; M385-F424 HydrophobicContact CE-CZ 4.25Å; F390-F424 HydrophobicContact CD1-CE2 4.34Å; F390-F424 HydrophobicContact CE1-CE2 4.2Å; F390-F424 HydrophobicContact CZ-CE2 4.39Å; F394-F424 HydrophobicContact CZ-CB 3.85Å; F394-F424 HydrophobicContact CZ-CD2 4.09Å; F394-F424 HydrophobicContact CZ-CG 4.46Å; F422-F424 VanDerWaalsContact C-N 3.28Å; F422-F424 PolarHBondContact O-N 2.98Å; F424-F428 HydrophobicContact CD1-CB 4.31Å; F424-F428 HydrophobicContact CE1-CB 4.16Å; F424-F428 HydrophobicContact CE1-CD2 4.22Å; F424-F428 HydrophobicContact CE1-CG 4.11Å; F424-F428 HydrophobicContact CZ-CD2 4.21Å; F424-F428 WeakPolarHBondContact O-CB 3.36Å; F424-F428 PolarHBondContact O-N 3.34Å
425	D	83.5	Confident	89.9	Confident	35 Å²	35	19.4 Å²	19.4	19%	0.187	11%	0.105	C	C	.	.	H	α-helix	trans	-64.9	-46.1	179.6	-177.7	27.6	0	0	0	112.7	F422 L423 F427 F428 T429 R433	F422-D425 PolarHBondContact O-N 3.1Å; L423-D425 VanDerWaalsContact C-N 3.33Å; L423-D425 PolarHBondContact O-N 2.66Å; D425-F427 VanDerWaalsContact C-N 3.29Å; D425-F427 PolarHBondContact O-N 3.48Å; D425-F428 PolarHBondContact O-N 3.41Å; D425-T429 PolarHBondContact O-N 2.95Å; D425-T429 PolarHBondContact O-OG1 3.27Å; D425-T429 WeakPolarHBondContact OD1-CG2 3.49Å; D425-R433 WeakPolarHBondContact OD1-CD 3.2Å; D425-R433 IonicContact OD1-CZ 2.66Å; D425-R433 IonicContact OD1-NE 2.82Å; D425-R433 IonicContact OD1-NH1 2.77Å; D425-R433 PolarHBondContact OD1-NH1 3.18Å; D425-R433 WeakPolarHBondContact OD2-CD 3.31Å
426	W	91.9	Very high	89.5	Confident	1 Å²	1	19.8 Å²	19.8	0%	0.004	11%	0.107	C	C	.	.	H	α-helix	trans	-59.5	-41.7	-179.1	-65.8	17	0	0	0	111.6	F422 L423 L430 F431 I434 A459 I462 L463 L482 L488	F422-W426 AromaticContact CD2-CD2 3.83Å; F422-W426 HydrophobicContact CD2-CD2 3.83Å; F422-W426 AromaticContact CD2-CE2 3.66Å; F422-W426 AromaticContact CD2-CE3 3.9Å; F422-W426 HydrophobicContact CD2-CE3 3.9Å; F422-W426 AromaticContact CD2-CH2 3.79Å; F422-W426 HydrophobicContact CD2-CH2 3.79Å; F422-W426 AromaticContact CD2-CZ2 3.67Å; F422-W426 HydrophobicContact CD2-CZ2 3.67Å; F422-W426 AromaticContact CD2-CZ3 3.9Å; F422-W426 HydrophobicContact CD2-CZ3 3.9Å; F422-W426 HydrophobicContact CE2-CD2 4.37Å; F422-W426 AromaticContact CE2-CE3 3.97Å; F422-W426 HydrophobicContact CE2-CE3 3.97Å; F422-W426 AromaticContact CE2-CH2 3.79Å; F422-W426 HydrophobicContact CE2-CH2 3.79Å; F422-W426 HydrophobicContact CE2-CZ2 4.16Å; F422-W426 AromaticContact CE2-CZ3 3.67Å; F422-W426 HydrophobicContact CE2-CZ3 3.67Å; F422-W426 VanDerWaalsContact O-CD1 3.23Å; F422-W426 PolarHBondContact O-N 3.29Å; L423-W426 HydrophobicContact CD2-CE3 4.03Å; L423-W426 PolarHBondContact O-N 3.07Å; W426-L430 PolarHBondContact O-N 3.08Å; W426-F431 HydrophobicContact CB-CD1 4.09Å; W426-F431 HydrophobicContact CB-CE1 3.84Å; W426-F431 HydrophobicContact CB-CZ 4.19Å; W426-F431 HydrophobicContact CD2-CD1 4.41Å; W426-F431 AromaticContact CD2-CE1 3.98Å; W426-F431 HydrophobicContact CD2-CE1 3.98Å; W426-F431 HydrophobicContact CE3-CD1 4.38Å; W426-F431 AromaticContact CE3-CE1 3.56Å; W426-F431 HydrophobicContact CE3-CE1 3.56Å; W426-F431 HydrophobicContact CE3-CZ 4.31Å; W426-F431 HydrophobicContact CG-CD1 4.34Å; W426-F431 HydrophobicContact CG-CE1 4.16Å; W426-F431 HydrophobicContact CZ3-CE1 4.35Å; W426-F431 PolarHBondContact O-N 3.41Å; W426-I434 HydrophobicContact CD2-CD1 3.81Å; W426-I434 HydrophobicContact CG-CD1 3.78Å; W426-I434 HydrophobicContact CG-CG1 4.4Å; W426-I434 HydrophobicContact CZ2-CD1 4.15Å; W426-A459 HydrophobicContact CE3-CB 3.87Å; W426-A459 HydrophobicContact CZ3-CB 3.98Å; W426-I462 HydrophobicContact CH2-CB 4.2Å; W426-I462 HydrophobicContact CH2-CG2 3.62Å; W426-I462 HydrophobicContact CZ2-CG2 4.38Å; W426-I462 HydrophobicContact CZ3-CB 4.22Å; W426-I462 HydrophobicContact CZ3-CD1 4.2Å; W426-I462 HydrophobicContact CZ3-CG2 4.15Å; W426-L463 HydrophobicContact CH2-CD2 4.48Å; W426-L482 HydrophobicContact CH2-CD2 3.93Å; W426-L482 HydrophobicContact CZ2-CB 4.34Å; W426-L482 HydrophobicContact CZ2-CD2 3.85Å; W426-L482 PolarHBondContact NE1-O 3.45Å; W426-L488 HydrophobicContact CZ2-CD1 4.13Å
427	F	90.8	Very high	89.3	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-80.4	-43.9	-178.4	-74.1	-3	0	0	0	112.2	Y378 F382 F394 F397 L423 D425 T429 L430 F431 L455 F456 A459	Y378-F427 HydrophobicContact CE1-CB 4.42Å; Y378-F427 WeakPolarHBondContact OH-CB 3.44Å; Y378-F427 WeakPolarHBondContact OH-CD1 3.36Å; Y378-F427 VanDerWaalsContact OH-CD2 3.29Å; Y378-F427 WeakPolarHBondContact OH-CD2 3.5Å; Y378-F427 WeakPolarHBondContact OH-CG 3.41Å; F382-F427 HydrophobicContact CE1-CB 4Å; F382-F427 HydrophobicContact CE1-CD2 4.49Å; F382-F427 HydrophobicContact CE2-CB 4.4Å; F382-F427 HydrophobicContact CZ-CB 3.79Å; F382-F427 AromaticContact CZ-CD2 3.99Å; F382-F427 HydrophobicContact CZ-CD2 3.99Å; F382-F427 HydrophobicContact CZ-CG 4.4Å; F394-F427 HydrophobicContact CD1-CD2 4.11Å; F394-F427 HydrophobicContact CD1-CE2 4.2Å; F394-F427 AromaticContact CE1-CD2 3.81Å; F394-F427 HydrophobicContact CE1-CD2 3.81Å; F394-F427 HydrophobicContact CE1-CE2 4.34Å; F397-F427 AromaticContact CD2-CZ 3.97Å; F397-F427 HydrophobicContact CD2-CZ 3.97Å; F397-F427 HydrophobicContact CG-CZ 4.46Å; L423-F427 HydrophobicContact CB-CD2 4.23Å; L423-F427 HydrophobicContact CB-CE2 4.26Å; L423-F427 HydrophobicContact CD1-CE2 4.1Å; L423-F427 HydrophobicContact CD1-CZ 4.3Å; L423-F427 HydrophobicContact CD2-CE1 4.08Å; L423-F427 HydrophobicContact CD2-CE2 4.33Å; L423-F427 HydrophobicContact CD2-CZ 3.92Å; L423-F427 HydrophobicContact CG-CE2 4.49Å; L423-F427 WeakPolarHBondContact O-CB 3.49Å; L423-F427 WeakPolarHBondContact O-CG 3.27Å; L423-F427 PolarHBondContact O-N 3.21Å; D425-F427 VanDerWaalsContact C-N 3.29Å; D425-F427 PolarHBondContact O-N 3.48Å; F427-T429 PolarHBondContact O-N 2.79Å; F427-L430 PolarHBondContact O-N 2.87Å; F427-F431 HydrophobicContact CD1-CE2 4.42Å; F427-F431 HydrophobicContact CD1-CZ 4.32Å; F427-F431 HydrophobicContact CE1-CZ 4.24Å; F427-L455 HydrophobicContact CD1-CB 4.27Å; F427-L455 HydrophobicContact CE1-CB 4.17Å; F427-F456 HydrophobicContact CE2-CE2 4.49Å; F427-F456 HydrophobicContact CZ-CD2 4.32Å; F427-F456 HydrophobicContact CZ-CE2 4.5Å; F427-A459 HydrophobicContact CE1-CB 4.02Å; F427-A459 HydrophobicContact CZ-CB 4.43Å
428	F	88.2	Confident	89.1	Confident	1 Å²	1	20.5 Å²	20.5	0%	0.004	10%	0.102	C	C	.	.	H	α-helix	trans	-61.5	-41.9	178	-176.5	-104.3	0	0	0	112.5	I346 P347 I352 F382 Y383 F424 D425	I346-F428 HydrophobicContact CB-CZ 4.03Å; I346-F428 HydrophobicContact CG2-CE1 4.36Å; I346-F428 HydrophobicContact CG2-CE2 4.29Å; I346-F428 HydrophobicContact CG2-CZ 3.53Å; P347-F428 WeakPolarHBondContact O-CE1 3.33Å; I352-F428 WeakPolarHBondContact CD1-O 3.47Å; F382-F428 HydrophobicContact CB-CD2 3.71Å; F382-F428 HydrophobicContact CB-CE2 4.37Å; Y383-F428 HydrophobicContact CD1-CD2 4.42Å; Y383-F428 AromaticContact CD1-CE2 3.41Å; Y383-F428 HydrophobicContact CD1-CE2 3.41Å; Y383-F428 VanDerWaalsContact CD1-CE2 3.41Å; Y383-F428 AromaticContact CD1-CZ 3.67Å; Y383-F428 HydrophobicContact CD1-CZ 3.67Å; Y383-F428 HydrophobicContact CD2-CD2 4.36Å; Y383-F428 HydrophobicContact CD2-CE2 4.07Å; Y383-F428 HydrophobicContact CE1-CD2 4.01Å; Y383-F428 AromaticContact CE1-CE1 3.9Å; Y383-F428 HydrophobicContact CE1-CE1 3.9Å; Y383-F428 AromaticContact CE1-CE2 3.14Å; Y383-F428 HydrophobicContact CE1-CE2 3.14Å; Y383-F428 AromaticContact CE1-CZ 3.06Å; Y383-F428 HydrophobicContact CE1-CZ 3.06Å; Y383-F428 AromaticContact CE2-CD2 3.92Å; Y383-F428 HydrophobicContact CE2-CD2 3.92Å; Y383-F428 AromaticContact CE2-CE2 3.82Å; Y383-F428 HydrophobicContact CE2-CE2 3.82Å; Y383-F428 HydrophobicContact CE2-CZ 4.42Å; Y383-F428 AromaticContact CG-CE2 3.88Å; Y383-F428 HydrophobicContact CG-CE2 3.88Å; Y383-F428 AromaticContact CZ-CD2 3.74Å; Y383-F428 AromaticContact CZ-CE2 3.36Å; Y383-F428 AromaticContact CZ-CZ 3.52Å; Y383-F428 PolarHBondContact OH-O 3.27Å; F424-F428 HydrophobicContact CD1-CB 4.31Å; F424-F428 HydrophobicContact CE1-CB 4.16Å; F424-F428 HydrophobicContact CE1-CD2 4.22Å; F424-F428 HydrophobicContact CE1-CG 4.11Å; F424-F428 HydrophobicContact CZ-CD2 4.21Å; F424-F428 WeakPolarHBondContact O-CB 3.36Å; F424-F428 PolarHBondContact O-N 3.34Å; D425-F428 PolarHBondContact O-N 3.41Å
429	T	91	Very high	89.1	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	6.1	-178.5	67.1	0	0	0	0	114	D425 F427 F431 S432 R433	D425-T429 PolarHBondContact O-N 2.95Å; D425-T429 PolarHBondContact O-OG1 3.27Å; D425-T429 WeakPolarHBondContact OD1-CG2 3.49Å; F427-T429 PolarHBondContact O-N 2.79Å; T429-F431 PolarHBondContact O-N 3.34Å; T429-S432 WeakPolarHBondContact O-CB 3.44Å; T429-S432 PolarHBondContact O-N 2.88Å; T429-S432 PolarHBondContact O-OG 3.08Å; T429-R433 HydrophobicContact CG2-CB 4.02Å; T429-R433 PolarHBondContact OG1-N 3.29Å
430	L	94.4	Very high	89.3	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	46.1	-171.9	-60.9	173.9	0	0	0	112	I352 I373 H379 W426 F427 S432 W444 Y447 L455	I352-L430 HydrophobicContact CD1-CD1 4.24Å; I352-L430 HydrophobicContact CD1-CG 4.33Å; I373-L430 HydrophobicContact CG2-CD1 4.02Å; H379-L430 WeakPolarHBondContact NE2-CD2 3.37Å; W426-L430 PolarHBondContact O-N 3.08Å; F427-L430 PolarHBondContact O-N 2.87Å; L430-S432 PolarHBondContact O-N 3.43Å; L430-W444 HydrophobicContact CB-CZ2 3.82Å; L430-W444 VanDerWaalsContact CB-NE1 3.31Å; L430-W444 HydrophobicContact CD1-CD2 4.45Å; L430-W444 HydrophobicContact CD1-CH2 4.18Å; L430-W444 HydrophobicContact CD1-CZ2 3.74Å; L430-W444 HydrophobicContact CG-CZ2 4.4Å; L430-W444 PolarHBondContact O-NE1 3.18Å; L430-Y447 HydrophobicContact CD1-CD1 4.15Å; L430-Y447 HydrophobicContact CD1-CE1 3.76Å; L430-Y447 HydrophobicContact CD2-CD1 4.36Å; L430-Y447 HydrophobicContact CD2-CD2 4.16Å; L430-Y447 HydrophobicContact CD2-CE1 4.19Å; L430-Y447 HydrophobicContact CD2-CE2 4.01Å; L430-Y447 HydrophobicContact CD2-CG 4.35Å; L430-L455 HydrophobicContact CD2-CD1 3.5Å; L430-L455 VanDerWaalsContact CD2-CD1 3.5Å; L430-L455 HydrophobicContact CD2-CD2 3.62Å; L430-L455 HydrophobicContact CD2-CG 4.2Å
431	F	93.3	Very high	89.6	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	-0.6	-175.3	-58.2	-100.4	0	0	0	116	W426 F427 T429 R433 I434 L435 I443 L455 A458 A459 I462	W426-F431 HydrophobicContact CB-CD1 4.09Å; W426-F431 HydrophobicContact CB-CE1 3.84Å; W426-F431 HydrophobicContact CB-CZ 4.19Å; W426-F431 HydrophobicContact CD2-CD1 4.41Å; W426-F431 AromaticContact CD2-CE1 3.98Å; W426-F431 HydrophobicContact CD2-CE1 3.98Å; W426-F431 HydrophobicContact CE3-CD1 4.38Å; W426-F431 AromaticContact CE3-CE1 3.56Å; W426-F431 HydrophobicContact CE3-CE1 3.56Å; W426-F431 HydrophobicContact CE3-CZ 4.31Å; W426-F431 HydrophobicContact CG-CD1 4.34Å; W426-F431 HydrophobicContact CG-CE1 4.16Å; W426-F431 HydrophobicContact CZ3-CE1 4.35Å; W426-F431 PolarHBondContact O-N 3.41Å; F427-F431 HydrophobicContact CD1-CE2 4.42Å; F427-F431 HydrophobicContact CD1-CZ 4.32Å; F427-F431 HydrophobicContact CE1-CZ 4.24Å; T429-F431 PolarHBondContact O-N 3.34Å; F431-R433 VanDerWaalsContact C-N 3.25Å; F431-R433 PolarHBondContact O-N 2.83Å; F431-I434 HydrophobicContact CB-CG1 4.42Å; F431-I434 HydrophobicContact CD1-CD1 3.92Å; F431-I434 HydrophobicContact CD1-CG1 4.45Å; F431-I434 PolarHBondContact O-N 2.79Å; F431-I434 VanDerWaalsContact O-N 3.16Å; F431-L435 HydrophobicContact CB-CD1 3.77Å; F431-L435 HydrophobicContact CB-CG 4.25Å; F431-L435 HydrophobicContact CD1-CD1 4.04Å; F431-L435 HydrophobicContact CG-CD1 4.22Å; F431-L435 PolarHBondContact O-N 2.88Å; F431-L435 VanDerWaalsContact O-N 3.09Å; F431-I443 HydrophobicContact CB-CD1 3.93Å; F431-I443 HydrophobicContact CD1-CD1 4.44Å; F431-I443 HydrophobicContact CD2-CD1 4.17Å; F431-I443 HydrophobicContact CD2-CG2 4.18Å; F431-I443 HydrophobicContact CG-CD1 3.93Å; F431-L455 HydrophobicContact CD2-CD2 4.12Å; F431-L455 HydrophobicContact CE2-CB 4.03Å; F431-L455 HydrophobicContact CE2-CD2 3.87Å; F431-L455 WeakPolarHBondContact CZ-O 3.41Å; F431-A458 HydrophobicContact CD2-CB 4.35Å; F431-A458 HydrophobicContact CE1-CB 4.08Å; F431-A458 HydrophobicContact CE2-CB 3.76Å; F431-A458 HydrophobicContact CZ-CB 3.61Å; F431-A459 HydrophobicContact CE1-CB 4.33Å; F431-A459 HydrophobicContact CZ-CB 4Å; F431-I462 HydrophobicContact CD1-CD1 3.74Å; F431-I462 HydrophobicContact CE1-CD1 3.61Å
432	S	91.7	Very high	90	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.5	-171	62.1	0	0	0	0	114.4	F313 W351 T429 L430	F313-S432 WeakPolarHBondContact CE1-O 3.23Å; W351-S432 VanDerWaalsContact CB-OG 3.29Å; W351-S432 WeakPolarHBondContact CB-OG 3.35Å; W351-S432 VanDerWaalsContact CZ3-O 3.22Å; W351-S432 WeakPolarHBondContact CZ3-O 3.44Å; T429-S432 WeakPolarHBondContact O-CB 3.44Å; T429-S432 PolarHBondContact O-N 2.88Å; T429-S432 PolarHBondContact O-OG 3.08Å; L430-S432 PolarHBondContact O-N 3.43Å
433	R	87.2	Confident	90.3	Very high	62 Å²	62	13 Å²	13	23%	0.234	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-34.6	174.4	-174.1	177	-73.4	145.8	-19.4	114	P347 W351 D425 T429 F431	P347-R433 PolarHBondContact O-NH2 3.25Å; W351-R433 HydrophobicContact CD2-CB 4.09Å; W351-R433 HydrophobicContact CD2-CG 4.4Å; W351-R433 HydrophobicContact CE3-CB 4.33Å; W351-R433 HydrophobicContact CG-CB 4.49Å; W351-R433 HydrophobicContact CH2-CG 4.3Å; W351-R433 HydrophobicContact CZ2-CB 4.42Å; W351-R433 HydrophobicContact CZ2-CG 3.9Å; D425-R433 WeakPolarHBondContact OD1-CD 3.2Å; D425-R433 IonicContact OD1-CZ 2.66Å; D425-R433 IonicContact OD1-NE 2.82Å; D425-R433 IonicContact OD1-NH1 2.77Å; D425-R433 PolarHBondContact OD1-NH1 3.18Å; D425-R433 WeakPolarHBondContact OD2-CD 3.31Å; T429-R433 HydrophobicContact CG2-CB 4.02Å; T429-R433 PolarHBondContact OG1-N 3.29Å; F431-R433 VanDerWaalsContact C-N 3.25Å; F431-R433 PolarHBondContact O-N 2.83Å
434	I	88	Confident	90.6	Very high	3 Å²	3	13 Å²	13	2%	0.015	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-21.4	-170.4	57.4	137.7	0	0	0	115.1	W426 F431 L488	W426-I434 HydrophobicContact CD2-CD1 3.81Å; W426-I434 HydrophobicContact CG-CD1 3.78Å; W426-I434 HydrophobicContact CG-CG1 4.4Å; W426-I434 HydrophobicContact CZ2-CD1 4.15Å; F431-I434 HydrophobicContact CB-CG1 4.42Å; F431-I434 HydrophobicContact CD1-CD1 3.92Å; F431-I434 HydrophobicContact CD1-CG1 4.45Å; F431-I434 PolarHBondContact O-N 2.79Å; F431-I434 VanDerWaalsContact O-N 3.16Å; I434-L488 HydrophobicContact CB-CD1 4.38Å; I434-L488 HydrophobicContact CD1-CD1 3.76Å
435	L	89.2	Confident	91	Very high	5 Å²	5	11.5 Å²	11.5	3%	0.026	6%	0.055	C	C	.	.	S	Bend	trans	-111	157.1	-176.8	-66	179.3	0	0	0	112.9	F431 T439 C440 I443 I462 L488 L496	F431-L435 HydrophobicContact CB-CD1 3.77Å; F431-L435 HydrophobicContact CB-CG 4.25Å; F431-L435 HydrophobicContact CD1-CD1 4.04Å; F431-L435 HydrophobicContact CG-CD1 4.22Å; F431-L435 PolarHBondContact O-N 2.88Å; F431-L435 VanDerWaalsContact O-N 3.09Å; L435-T439 HydrophobicContact CB-CG2 4.45Å; L435-T439 HydrophobicContact CD1-CG2 3.95Å; L435-C440 VanDerWaalsContact CB-SG 3.52Å; L435-C440 PolarHBondContact O-SG 3.35Å; L435-I443 HydrophobicContact CD1-CD1 3.42Å; L435-I443 VanDerWaalsContact CD1-CD1 3.42Å; L435-I462 HydrophobicContact CD1-CD1 4.08Å; L435-I462 HydrophobicContact CD2-CD1 4.5Å; L435-L488 HydrophobicContact CD2-CB 3.99Å; L435-L496 HydrophobicContact CD1-CD2 4.11Å
436	P	87.4	Confident	91.5	Very high	39 Å²	39	9.8 Å²	9.8	25%	0.253	5%	0.046	S	C	.	.			trans	-62.5	146.7	172	-20.7	33.3	0	0	0	112.2	E438 T439 C440 Q489	P436-E438 VanDerWaalsContact C-N 3.29Å; P436-E438 PolarHBondContact O-N 2.92Å; P436-E438 VanDerWaalsContact O-N 3.1Å; P436-T439 WeakPolarHBondContact O-CA 3.23Å; P436-T439 WeakPolarHBondContact O-CB 3.34Å; P436-T439 PolarHBondContact O-N 3.47Å; P436-C440 PolarHBondContact O-N 2.72Å; P436-C440 PolarHBondContact O-SG 3.31Å; P436-Q489 HydrophobicContact CG-CB 4.39Å; P436-Q489 HydrophobicContact CG-CG 4.4Å; P436-Q489 WeakPolarHBondContact CG-O 3.15Å
437	L	88.4	Confident	91.6	Very high	10 Å²	10	9.8 Å²	9.8	5%	0.052	5%	0.046	C	C	.	.	H	α-helix	trans	-43	-49.8	-179.3	173.1	61.2	0	0	0	113.9	F313 L316 M355 I358 T439 C440 I441	F313-L437 HydrophobicContact CD1-CB 4.12Å; F313-L437 HydrophobicContact CD2-CD1 4.33Å; F313-L437 HydrophobicContact CE1-CB 4.07Å; F313-L437 HydrophobicContact CE2-CD1 3.85Å; F313-L437 HydrophobicContact CG-CB 4.38Å; F313-L437 HydrophobicContact CZ-CB 4.28Å; F313-L437 HydrophobicContact CZ-CD1 4.05Å; L316-L437 HydrophobicContact CD1-CB 4.09Å; L316-L437 HydrophobicContact CD1-CD2 3.38Å; L316-L437 HydrophobicContact CD1-CG 4.35Å; M355-L437 HydrophobicContact CE-CD1 4.24Å; M355-L437 HydrophobicContact SD-CD1 3.37Å; M355-L437 WeakPolarHBondContact SD-CD1 3.49Å; I358-L437 HydrophobicContact CD1-CD1 4Å; I358-L437 HydrophobicContact CD1-CD2 4.18Å; I358-L437 HydrophobicContact CG2-CD1 4.18Å; I358-L437 HydrophobicContact CG2-CD2 4.27Å; L437-T439 VanDerWaalsContact C-N 3.34Å; L437-T439 PolarHBondContact O-N 3.39Å; L437-C440 WeakPolarHBondContact O-CB 3.49Å; L437-C440 PolarHBondContact O-N 2.9Å; L437-I441 HydrophobicContact CD1-CD1 3.79Å; L437-I441 HydrophobicContact CD1-CG1 4.02Å; L437-I441 HydrophobicContact CG-CD1 3.87Å; L437-I441 HydrophobicContact CG-CG1 4.48Å; L437-I441 WeakPolarHBondContact O-CG1 3.2Å; L437-I441 PolarHBondContact O-N 2.63Å
438	E	86.9	Confident	91.7	Very high	43 Å²	43	9.8 Å²	9.8	20%	0.201	5%	0.046	C	C	.	.	H	α-helix	trans	-64.2	-38.7	-177.6	-61.6	-178.9	160.9	0	0	112.5	P73 T74 P436 I441 R442 P493	P73-E438 WeakPolarHBondContact CB-OE1 3.33Å; T74-E438 VanDerWaalsContact CB-OE1 3.26Å; T74-E438 WeakPolarHBondContact CB-OE1 3.43Å; T74-E438 WeakPolarHBondContact CG2-OE1 3.44Å; T74-E438 WeakPolarHBondContact CG2-OE2 3.49Å; T74-E438 PolarHBondContact N-OE1 3.19Å; T74-E438 VanDerWaalsContact OG1-CD 3.26Å; T74-E438 PolarHBondContact OG1-OE1 3.42Å; T74-E438 PolarHBondContact OG1-OE2 2.85Å; P436-E438 VanDerWaalsContact C-N 3.29Å; P436-E438 PolarHBondContact O-N 2.92Å; P436-E438 VanDerWaalsContact O-N 3.1Å; E438-I441 PolarHBondContact O-N 3.42Å; E438-R442 WeakPolarHBondContact O-CG 3.43Å; E438-R442 PolarHBondContact O-N 2.74Å; E438-P493 HydrophobicContact CB-CG 4.04Å
439	T	91.5	Very high	91.8	Very high	3 Å²	3	10.4 Å²	10.4	2%	0.018	5%	0.05	C	C	.	.	H	α-helix	trans	-68.1	-41.5	176.2	-52.4	0	0	0	0	110.1	L435 P436 L437 R442 I443 L491 L496	L435-T439 HydrophobicContact CB-CG2 4.45Å; L435-T439 HydrophobicContact CD1-CG2 3.95Å; P436-T439 WeakPolarHBondContact O-CA 3.23Å; P436-T439 WeakPolarHBondContact O-CB 3.34Å; P436-T439 PolarHBondContact O-N 3.47Å; L437-T439 VanDerWaalsContact C-N 3.34Å; L437-T439 PolarHBondContact O-N 3.39Å; T439-R442 PolarHBondContact O-N 3.07Å; T439-I443 WeakPolarHBondContact O-CG1 3.44Å; T439-I443 PolarHBondContact O-N 3.29Å; T439-I443 VanDerWaalsContact O-N 3.15Å; T439-L491 PolarHBondContact OG1-O 2.68Å; T439-L491 VanDerWaalsContact OG1-O 3.09Å; T439-L496 HydrophobicContact CG2-CB 4.4Å; T439-L496 HydrophobicContact CG2-CD2 3.44Å; T439-L496 VanDerWaalsContact CG2-CD2 3.44Å
440	C	92.9	Very high	91.7	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.5	-47.7	173.6	-58.3	0	0	0	0	112	M355 L435 P436 L437 R442 I443 W444	M355-C440 HydrophobicContact CE-CB 3.73Å; M355-C440 HydrophobicContact SD-CB 4.11Å; L435-C440 VanDerWaalsContact CB-SG 3.52Å; L435-C440 PolarHBondContact O-SG 3.35Å; P436-C440 PolarHBondContact O-N 2.72Å; P436-C440 PolarHBondContact O-SG 3.31Å; L437-C440 WeakPolarHBondContact O-CB 3.49Å; L437-C440 PolarHBondContact O-N 2.9Å; C440-R442 VanDerWaalsContact C-N 3.28Å; C440-R442 PolarHBondContact O-N 2.75Å; C440-I443 PolarHBondContact O-N 3.11Å; C440-I443 VanDerWaalsContact O-N 3.12Å; C440-W444 WeakPolarHBondContact O-CB 3.46Å; C440-W444 PolarHBondContact O-N 3.4Å
441	I	93.7	Very high	91.5	Very high	11 Å²	11	15 Å²	15	6%	0.056	7%	0.07	C	C	.	.	H	α-helix	trans	-54.5	-43.9	177.8	-76.5	171.1	0	0	0	111.2	M355 L437 E438 W444 D445	M355-I441 HydrophobicContact CE-CG1 3.93Å; L437-I441 HydrophobicContact CD1-CD1 3.79Å; L437-I441 HydrophobicContact CD1-CG1 4.02Å; L437-I441 HydrophobicContact CG-CD1 3.87Å; L437-I441 HydrophobicContact CG-CG1 4.48Å; L437-I441 WeakPolarHBondContact O-CG1 3.2Å; L437-I441 PolarHBondContact O-N 2.63Å; E438-I441 PolarHBondContact O-N 3.42Å; I441-W444 PolarHBondContact O-N 3.21Å; I441-D445 PolarHBondContact O-N 3.29Å
442	R	94.2	Very high	91.3	Very high	28 Å²	28	16.1 Å²	16.1	11%	0.106	8%	0.075	C	C	.	.	H	α-helix	trans	-70	-32.4	179.6	-64	-61.6	-63.5	108.7	9	113.3	F149 W150 E151 G152 E438 T439 C440 D445 P493 I497	F149-R442 PolarHBondContact O-NH1 3.33Å; F149-R442 VanDerWaalsContact O-NH1 3.1Å; F149-R442 PolarHBondContact O-NH2 3.1Å; W150-R442 PolarHBondContact O-NH2 3.22Å; E151-R442 PolarHBondContact O-NH2 3.11Å; G152-R442 VanDerWaalsContact CA-CZ 3.45Å; E438-R442 WeakPolarHBondContact O-CG 3.43Å; E438-R442 PolarHBondContact O-N 2.74Å; T439-R442 PolarHBondContact O-N 3.07Å; C440-R442 VanDerWaalsContact C-N 3.28Å; C440-R442 PolarHBondContact O-N 2.75Å; R442-D445 IonicContact CZ-OD2 3.85Å; R442-D445 IonicContact NH1-OD2 2.83Å; R442-D445 PolarHBondContact NH1-OD2 3.29Å; R442-P493 HydrophobicContact CB-CB 4.41Å; R442-P493 HydrophobicContact CG-CB 3.89Å; R442-I497 HydrophobicContact CB-CD1 3.73Å; R442-I497 HydrophobicContact CB-CG1 3.9Å
443	I	95.4	Very high	91.2	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-65.7	-43.6	168.2	-62.6	167.8	0	0	0	110.1	F431 L435 T439 C440 L446 Y447 L455 A458 L496 M500	F431-I443 HydrophobicContact CB-CD1 3.93Å; F431-I443 HydrophobicContact CD1-CD1 4.44Å; F431-I443 HydrophobicContact CD2-CD1 4.17Å; F431-I443 HydrophobicContact CD2-CG2 4.18Å; F431-I443 HydrophobicContact CG-CD1 3.93Å; L435-I443 HydrophobicContact CD1-CD1 3.42Å; L435-I443 VanDerWaalsContact CD1-CD1 3.42Å; T439-I443 WeakPolarHBondContact O-CG1 3.44Å; T439-I443 PolarHBondContact O-N 3.29Å; T439-I443 VanDerWaalsContact O-N 3.15Å; C440-I443 PolarHBondContact O-N 3.11Å; C440-I443 VanDerWaalsContact O-N 3.12Å; I443-L446 CarbonylContact O-C 3.54Å; I443-L446 PolarHBondContact O-N 3.03Å; I443-L446 VanDerWaalsContact O-N 3.14Å; I443-Y447 WeakPolarHBondContact O-CB 3.41Å; I443-Y447 PolarHBondContact O-N 3.2Å; I443-L455 HydrophobicContact CG2-CD2 4.17Å; I443-A458 HydrophobicContact CD1-CB 4.08Å; I443-A458 HydrophobicContact CG1-CB 4.25Å; I443-A458 HydrophobicContact CG2-CB 4.2Å; I443-L496 HydrophobicContact CD1-CD2 3.77Å; I443-L496 HydrophobicContact CG1-CD2 3.98Å; I443-M500 HydrophobicContact CG1-SD 4.19Å
444	W	96.2	Very high	91.4	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.8	-41.3	-177	-78.3	42.6	0	0	0	112.2	W162 I352 M355 I373 L430 C440 I441 L446 Y447 F448	W162-W444 HydrophobicContact CE3-CE3 4.36Å; W162-W444 HydrophobicContact CH2-CB 3.57Å; W162-W444 HydrophobicContact CH2-CD2 4.09Å; W162-W444 AromaticContact CH2-CE3 3.55Å; W162-W444 HydrophobicContact CH2-CE3 3.55Å; W162-W444 HydrophobicContact CH2-CG 4.16Å; W162-W444 HydrophobicContact CH2-CZ3 4.49Å; W162-W444 HydrophobicContact CZ2-CB 3.46Å; W162-W444 VanDerWaalsContact CZ2-CB 3.46Å; W162-W444 HydrophobicContact CZ2-CE3 4.46Å; W162-W444 HydrophobicContact CZ2-CG 4.5Å; W162-W444 HydrophobicContact CZ3-CD2 4.46Å; W162-W444 AromaticContact CZ3-CE3 3.49Å; W162-W444 HydrophobicContact CZ3-CE3 3.49Å; W162-W444 VanDerWaalsContact CZ3-CE3 3.49Å; W162-W444 HydrophobicContact CZ3-CZ3 4.08Å; I352-W444 HydrophobicContact CB-CH2 4.16Å; I352-W444 HydrophobicContact CG1-CZ2 4.44Å; I352-W444 HydrophobicContact CG2-CH2 3.63Å; I352-W444 HydrophobicContact CG2-CZ2 4.34Å; I352-W444 HydrophobicContact CG2-CZ3 4.48Å; M355-W444 HydrophobicContact CB-CE3 4.37Å; M355-W444 HydrophobicContact CB-CH2 3.29Å; M355-W444 HydrophobicContact CB-CZ2 3.68Å; M355-W444 HydrophobicContact CB-CZ3 3.69Å; M355-W444 HydrophobicContact CE-CD2 3.77Å; M355-W444 HydrophobicContact CE-CE3 4.21Å; M355-W444 HydrophobicContact CE-CG 4.03Å; M355-W444 HydrophobicContact CE-CZ2 4.24Å; M355-W444 HydrophobicContact CG-CH2 3.92Å; M355-W444 HydrophobicContact CG-CZ2 3.74Å; I373-W444 HydrophobicContact CD1-CH2 4.35Å; I373-W444 HydrophobicContact CD1-CZ3 3.92Å; L430-W444 HydrophobicContact CB-CZ2 3.82Å; L430-W444 VanDerWaalsContact CB-NE1 3.31Å; L430-W444 HydrophobicContact CD1-CD2 4.45Å; L430-W444 HydrophobicContact CD1-CH2 4.18Å; L430-W444 HydrophobicContact CD1-CZ2 3.74Å; L430-W444 HydrophobicContact CG-CZ2 4.4Å; L430-W444 PolarHBondContact O-NE1 3.18Å; C440-W444 WeakPolarHBondContact O-CB 3.46Å; C440-W444 PolarHBondContact O-N 3.4Å; I441-W444 PolarHBondContact O-N 3.21Å; W444-L446 PolarHBondContact O-N 3.35Å; W444-Y447 PolarHBondContact O-N 2.83Å; W444-Y447 VanDerWaalsContact O-N 3.07Å; W444-F448 HydrophobicContact CB-CE2 4.38Å; W444-F448 HydrophobicContact CE3-CE2 4.01Å; W444-F448 HydrophobicContact CE3-CZ 4.33Å; W444-F448 WeakPolarHBondContact O-CD2 3.46Å; W444-F448 PolarHBondContact O-N 2.88Å
445	D	95	Very high	91.7	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-51.2	-43.4	170.9	-74.3	-19.9	0	0	0	112.1	F149 V153 R158 W162 I441 R442	F149-D445 WeakPolarHBondContact CD1-O 3.41Å; V153-D445 WeakPolarHBondContact CB-OD1 3.28Å; V153-D445 HydrophobicContact CG2-CB 3.89Å; V153-D445 VanDerWaalsContact CG2-CG 3.47Å; V153-D445 WeakPolarHBondContact CG2-OD1 3.35Å; V153-D445 PolarHBondContact N-OD2 3.32Å; R158-D445 WeakPolarHBondContact CD-OD1 3.44Å; R158-D445 IonicContact NE-OD1 3.04Å; R158-D445 IonicContact NE-OD2 2.66Å; W162-D445 PolarHBondContact NE1-OD1 2.69Å; I441-D445 PolarHBondContact O-N 3.29Å; R442-D445 IonicContact CZ-OD2 3.85Å; R442-D445 IonicContact NH1-OD2 2.83Å; R442-D445 PolarHBondContact NH1-OD2 3.29Å
446	L	94.5	Very high	91.9	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-76.7	-33.8	177.6	-64.6	174.1	0	0	0	112.5	F149 W150 I443 W444 L449 Y450 A454 I497 M500	F149-L446 HydrophobicContact CB-CD2 4.21Å; W150-L446 HydrophobicContact CD2-CD1 4.34Å; W150-L446 HydrophobicContact CD2-CD2 3.67Å; W150-L446 HydrophobicContact CE3-CD1 3.71Å; W150-L446 HydrophobicContact CE3-CD2 3.91Å; W150-L446 HydrophobicContact CE3-CG 4.5Å; W150-L446 HydrophobicContact CG-CD2 4.16Å; W150-L446 HydrophobicContact CH2-CD1 3.87Å; W150-L446 HydrophobicContact CH2-CD2 4.3Å; W150-L446 HydrophobicContact CZ2-CD1 4.46Å; W150-L446 HydrophobicContact CZ2-CD2 4.06Å; W150-L446 HydrophobicContact CZ3-CD1 3.46Å; W150-L446 VanDerWaalsContact CZ3-CD1 3.46Å; W150-L446 HydrophobicContact CZ3-CD2 4.22Å; I443-L446 CarbonylContact O-C 3.54Å; I443-L446 PolarHBondContact O-N 3.03Å; I443-L446 VanDerWaalsContact O-N 3.14Å; W444-L446 PolarHBondContact O-N 3.35Å; L446-L449 PolarHBondContact O-N 2.78Å; L446-Y450 HydrophobicContact CB-CD2 4.33Å; L446-Y450 HydrophobicContact CD2-CD2 4.2Å; L446-Y450 HydrophobicContact CD2-CE2 3.94Å; L446-Y450 WeakPolarHBondContact O-CB 3.27Å; L446-Y450 WeakPolarHBondContact O-CD2 3.14Å; L446-Y450 PolarHBondContact O-N 3.14Å; L446-A454 HydrophobicContact CB-CB 4.01Å; L446-I497 HydrophobicContact CD1-CD1 3.53Å; L446-M500 HydrophobicContact CD1-CE 3.69Å; L446-M500 HydrophobicContact CD1-SD 4.45Å
447	Y	94.1	Very high	92.3	Very high	1 Å²	1	11.6 Å²	11.6	0%	0.004	5%	0.054	C	C	.	.	H	α-helix	trans	-68.8	-31.4	177.4	163.9	-102.1	0	0	0	113.2	R376 H379 L430 I443 W444 L449 E451 L455	R376-Y447 WeakPolarHBondContact CD-OH 3.47Å; R376-Y447 VanDerWaalsContact NH1-CE1 3.35Å; R376-Y447 PolarHBondContact NH1-O 2.61Å; R376-Y447 PolarHBondContact NH1-OH 3.34Å; R376-Y447 VanDerWaalsContact NH1-OH 3.16Å; H379-Y447 AromaticContact CE1-CE2 3.96Å; H379-Y447 AromaticContact CE1-CZ 3.51Å; H379-Y447 PolarHBondContact CE1-OH 3Å; H379-Y447 PolarHBondContact ND1-OH 2.84Å; L430-Y447 HydrophobicContact CD1-CD1 4.15Å; L430-Y447 HydrophobicContact CD1-CE1 3.76Å; L430-Y447 HydrophobicContact CD2-CD1 4.36Å; L430-Y447 HydrophobicContact CD2-CD2 4.16Å; L430-Y447 HydrophobicContact CD2-CE1 4.19Å; L430-Y447 HydrophobicContact CD2-CE2 4.01Å; L430-Y447 HydrophobicContact CD2-CG 4.35Å; I443-Y447 WeakPolarHBondContact O-CB 3.41Å; I443-Y447 PolarHBondContact O-N 3.2Å; W444-Y447 PolarHBondContact O-N 2.83Å; W444-Y447 VanDerWaalsContact O-N 3.07Å; Y447-L449 VanDerWaalsContact C-N 3.28Å; Y447-L449 PolarHBondContact O-N 3.39Å; Y447-E451 WeakPolarHBondContact CD2-O 3.46Å; Y447-E451 WeakPolarHBondContact O-CA 3.47Å; Y447-E451 PolarHBondContact O-N 2.89Å; Y447-L455 HydrophobicContact CD2-CD1 3.91Å; Y447-L455 HydrophobicContact CD2-CD2 3.96Å; Y447-L455 HydrophobicContact CD2-CG 3.91Å; Y447-L455 HydrophobicContact CE2-CD1 4.01Å; Y447-L455 HydrophobicContact CG-CD2 4.3Å
448	F	92.7	Very high	92.6	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-69.3	-27.9	171	-73.6	-68.6	0	0	0	112.6	W162 L165 L166 T369 I373 W444	W162-F448 HydrophobicContact CB-CD2 4.05Å; W162-F448 HydrophobicContact CB-CE2 4.04Å; W162-F448 HydrophobicContact CB-CG 4.41Å; W162-F448 HydrophobicContact CB-CZ 4.36Å; W162-F448 AromaticContact CD1-CD2 3.58Å; W162-F448 AromaticContact CD2-CD2 3.55Å; W162-F448 HydrophobicContact CD2-CD2 3.55Å; W162-F448 AromaticContact CD2-CE2 3.22Å; W162-F448 HydrophobicContact CD2-CE2 3.22Å; W162-F448 HydrophobicContact CD2-CZ 4.12Å; W162-F448 AromaticContact CE2-CD2 3.67Å; W162-F448 AromaticContact CE2-CE2 3.62Å; W162-F448 HydrophobicContact CE3-CD2 4.2Å; W162-F448 AromaticContact CE3-CE2 3.39Å; W162-F448 HydrophobicContact CE3-CE2 3.39Å; W162-F448 AromaticContact CE3-CZ 3.99Å; W162-F448 HydrophobicContact CE3-CZ 3.99Å; W162-F448 AromaticContact CG-CD2 3.47Å; W162-F448 HydrophobicContact CG-CD2 3.47Å; W162-F448 VanDerWaalsContact CG-CD2 3.47Å; W162-F448 AromaticContact CG-CE2 3.55Å; W162-F448 HydrophobicContact CG-CE2 3.55Å; W162-F448 HydrophobicContact CG-CG 4.21Å; W162-F448 HydrophobicContact CG-CZ 4.32Å; W162-F448 HydrophobicContact CH2-CE2 4.26Å; W162-F448 HydrophobicContact CZ2-CD2 4.39Å; W162-F448 HydrophobicContact CZ2-CE2 4.13Å; W162-F448 AromaticContact CZ3-CE2 3.92Å; W162-F448 HydrophobicContact CZ3-CE2 3.92Å; W162-F448 AromaticContact NE1-CD2 3.71Å; L165-F448 HydrophobicContact CB-CB 3.95Å; L165-F448 HydrophobicContact CD1-CB 3.55Å; L165-F448 HydrophobicContact CG-CB 4.41Å; L166-F448 HydrophobicContact CB-CD1 4.08Å; L166-F448 HydrophobicContact CB-CE1 4.03Å; L166-F448 HydrophobicContact CD1-CD1 4.43Å; L166-F448 HydrophobicContact CD1-CE1 4.12Å; L166-F448 HydrophobicContact CD2-CE1 4.07Å; L166-F448 HydrophobicContact CG-CE1 4.3Å; T369-F448 HydrophobicContact CG2-CZ 4.41Å; I373-F448 HydrophobicContact CD1-CE1 4.38Å; I373-F448 HydrophobicContact CD1-CZ 3.94Å; I373-F448 HydrophobicContact CG1-CE1 4.11Å; I373-F448 HydrophobicContact CG1-CZ 4.19Å; W444-F448 HydrophobicContact CB-CE2 4.38Å; W444-F448 HydrophobicContact CE3-CE2 4.01Å; W444-F448 HydrophobicContact CE3-CZ 4.33Å; W444-F448 WeakPolarHBondContact O-CD2 3.46Å; W444-F448 PolarHBondContact O-N 2.88Å
449	L	90.6	Very high	93	Very high	14 Å²	14	9 Å²	9	7%	0.073	4%	0.042	C	C	.	.	H	α-helix	trans	-89.8	-40.8	-179.9	176.8	63.7	0	0	0	114.6	P141 R146 F149 L446 Y447	P141-L449 HydrophobicContact CB-CD1 4.35Å; P141-L449 HydrophobicContact CG-CD1 3.56Å; R146-L449 HydrophobicContact CB-CD2 4.31Å; R146-L449 HydrophobicContact CG-CD1 4.39Å; R146-L449 HydrophobicContact CG-CD2 4.08Å; F149-L449 HydrophobicContact CB-CD2 3.77Å; F149-L449 HydrophobicContact CD1-CB 4.16Å; F149-L449 HydrophobicContact CD1-CD2 4.12Å; F149-L449 HydrophobicContact CD2-CD2 3.63Å; F149-L449 HydrophobicContact CE1-CB 4.25Å; F149-L449 HydrophobicContact CE2-CD1 4.42Å; F149-L449 HydrophobicContact CE2-CD2 4.17Å; F149-L449 HydrophobicContact CG-CB 4.47Å; F149-L449 HydrophobicContact CG-CD2 3.57Å; L446-L449 PolarHBondContact O-N 2.78Å; Y447-L449 VanDerWaalsContact C-N 3.28Å; Y447-L449 PolarHBondContact O-N 3.39Å
450	Y	89.2	Confident	93.2	Very high	16 Å²	16	8.9 Å²	8.9	6%	0.063	4%	0.042	C	C	.	.	H	α-helix	trans	-112.4	3.3	-173.4	-61.5	-68.8	0	0	0	113.6	W150 L446 S453 H504	W150-Y450 AromaticContact CE2-CE2 3.79Å; W150-Y450 HydrophobicContact CZ2-CD2 4.34Å; W150-Y450 AromaticContact CZ2-CE2 3.72Å; W150-Y450 HydrophobicContact CZ2-CE2 3.72Å; W150-Y450 AromaticContact NE1-CE2 3.56Å; W150-Y450 AromaticContact NE1-CZ 3.7Å; W150-Y450 PolarHBondContact NE1-OH 2.91Å; W150-Y450 VanDerWaalsContact NE1-OH 3.08Å; L446-Y450 HydrophobicContact CB-CD2 4.33Å; L446-Y450 HydrophobicContact CD2-CD2 4.2Å; L446-Y450 HydrophobicContact CD2-CE2 3.94Å; L446-Y450 WeakPolarHBondContact O-CB 3.27Å; L446-Y450 WeakPolarHBondContact O-CD2 3.14Å; L446-Y450 PolarHBondContact O-N 3.14Å; Y450-S453 WeakPolarHBondContact O-CB 3.34Å; Y450-S453 PolarHBondContact O-N 2.87Å; Y450-H504 AromaticContact CE1-CE1 3.59Å; Y450-H504 AromaticContact CE1-NE2 3.97Å; Y450-H504 AromaticContact CZ-CE1 3.67Å; Y450-H504 AromaticContact CZ-NE2 3.56Å; Y450-H504 PolarHBondContact OH-NE2 3.49Å
451	E	89.6	Confident	93.3	Very high	79 Å²	79	8.9 Å²	8.9	37%	0.369	4%	0.042	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	-140.1	-178.9	-51.4	-159.5	131.4	0	0	111	R376 Y447 S453 A454	R376-E451 IonicContact CZ-OE1 3.38Å; R376-E451 IonicContact NE-OE1 3.23Å; R376-E451 PolarHBondContact NE-OE1 3.24Å; R376-E451 IonicContact NH2-OE1 3.23Å; R376-E451 PolarHBondContact NH2-OE1 2.97Å; Y447-E451 WeakPolarHBondContact CD2-O 3.46Å; Y447-E451 WeakPolarHBondContact O-CA 3.47Å; Y447-E451 PolarHBondContact O-N 2.89Å; E451-S453 PolarHBondContact O-N 3.49Å; E451-S453 VanDerWaalsContact O-N 3.08Å; E451-A454 PolarHBondContact O-N 2.86Å; E451-A454 VanDerWaalsContact O-N 3.14Å
452	E	88.2	Confident	93.3	Very high	24 Å²	24	8.4 Å²	8.4	11%	0.112	4%	0.039	C	C	.	.	H	α-helix	trans	-61	-22.8	-175	73.7	-70.4	167.5	0	0	113.9	Y378 Y393 A454 L455 F456 R518	Y378-E452 HydrophobicContact CD2-CB 3.29Å; Y378-E452 HydrophobicContact CD2-CG 3.93Å; Y378-E452 HydrophobicContact CE2-CB 3.52Å; Y378-E452 HydrophobicContact CE2-CG 4.3Å; Y378-E452 HydrophobicContact CG-CB 3.96Å; Y393-E452 HydrophobicContact CE1-CG 4.28Å; E452-A454 PolarHBondContact O-N 3.47Å; E452-A454 VanDerWaalsContact O-N 3.16Å; E452-L455 HydrophobicContact CB-CD1 4.45Å; E452-L455 WeakPolarHBondContact O-CA 3.32Å; E452-L455 WeakPolarHBondContact O-CB 3.47Å; E452-L455 PolarHBondContact O-N 3.35Å; E452-F456 HydrophobicContact CB-CE2 4.39Å; E452-F456 HydrophobicContact CG-CE2 4.21Å; E452-F456 VanDerWaalsContact O-CD2 3.25Å; E452-F456 WeakPolarHBondContact O-CD2 3.35Å; E452-F456 PolarHBondContact O-N 3.16Å; E452-R518 IonicContact OE1-CZ 2.58Å; E452-R518 VanDerWaalsContact OE1-CZ 3.23Å; E452-R518 IonicContact OE1-NH1 2.77Å; E452-R518 PolarHBondContact OE1-NH1 2.85Å; E452-R518 IonicContact OE1-NH2 3.92Å; E452-R518 PolarHBondContact OE1-NH2 3.19Å; E452-R518 IonicContact OE2-NH1 3.87Å
453	S	90.4	Very high	93.4	Very high	11 Å²	11	7 Å²	7	8%	0.077	3%	0.034	C	C	.	.	H	α-helix	trans	-57.7	-33.8	177.5	-62.4	0	0	0	0	111.9	Y450 E451 L455 F456 Y457	Y450-S453 WeakPolarHBondContact O-CB 3.34Å; Y450-S453 PolarHBondContact O-N 2.87Å; E451-S453 PolarHBondContact O-N 3.49Å; E451-S453 VanDerWaalsContact O-N 3.08Å; S453-L455 VanDerWaalsContact C-N 3.29Å; S453-L455 PolarHBondContact O-N 3.11Å; S453-F456 PolarHBondContact O-N 3.34Å; S453-Y457 VanDerWaalsContact O-CD1 3.29Å; S453-Y457 WeakPolarHBondContact O-CD1 3.35Å; S453-Y457 WeakPolarHBondContact O-CD2 3.34Å; S453-Y457 PolarHBondContact O-N 3.27Å
454	A	92.5	Very high	93.3	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-63.5	-33.4	174.3	0	0	0	0	0	112.9	L446 E451 E452 Y457 A458 M500	L446-A454 HydrophobicContact CB-CB 4.01Å; E451-A454 PolarHBondContact O-N 2.86Å; E451-A454 VanDerWaalsContact O-N 3.14Å; E452-A454 PolarHBondContact O-N 3.47Å; E452-A454 VanDerWaalsContact O-N 3.16Å; A454-Y457 PolarHBondContact O-N 3.19Å; A454-A458 WeakPolarHBondContact O-CB 3.38Å; A454-A458 PolarHBondContact O-N 3.27Å; A454-M500 WeakPolarHBondContact O-CE 3.45Å
455	L	93.6	Very high	93.2	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-73.1	-39.4	-179.1	-51.8	176.3	0	0	0	111	Y378 F427 L430 F431 I443 Y447 E452 S453 A458 A459	Y378-L455 HydrophobicContact CD1-CD1 4.24Å; Y378-L455 HydrophobicContact CE1-CD1 3.46Å; Y378-L455 VanDerWaalsContact CE1-CD1 3.46Å; Y378-L455 HydrophobicContact CE2-CD1 4.28Å; Y378-L455 VanDerWaalsContact CZ-CD1 3.45Å; Y378-L455 VanDerWaalsContact OH-CD1 3.31Å; Y378-L455 WeakPolarHBondContact OH-CD1 3.13Å; F427-L455 HydrophobicContact CD1-CB 4.27Å; F427-L455 HydrophobicContact CE1-CB 4.17Å; L430-L455 HydrophobicContact CD2-CD1 3.5Å; L430-L455 VanDerWaalsContact CD2-CD1 3.5Å; L430-L455 HydrophobicContact CD2-CD2 3.62Å; L430-L455 HydrophobicContact CD2-CG 4.2Å; F431-L455 HydrophobicContact CD2-CD2 4.12Å; F431-L455 HydrophobicContact CE2-CB 4.03Å; F431-L455 HydrophobicContact CE2-CD2 3.87Å; F431-L455 WeakPolarHBondContact CZ-O 3.41Å; I443-L455 HydrophobicContact CG2-CD2 4.17Å; Y447-L455 HydrophobicContact CD2-CD1 3.91Å; Y447-L455 HydrophobicContact CD2-CD2 3.96Å; Y447-L455 HydrophobicContact CD2-CG 3.91Å; Y447-L455 HydrophobicContact CE2-CD1 4.01Å; Y447-L455 HydrophobicContact CG-CD2 4.3Å; E452-L455 HydrophobicContact CB-CD1 4.45Å; E452-L455 WeakPolarHBondContact O-CA 3.32Å; E452-L455 WeakPolarHBondContact O-CB 3.47Å; E452-L455 PolarHBondContact O-N 3.35Å; S453-L455 VanDerWaalsContact C-N 3.29Å; S453-L455 PolarHBondContact O-N 3.11Å; L455-A458 PolarHBondContact O-N 3.42Å; L455-A459 PolarHBondContact O-N 3.28Å
456	F	94	Very high	93	Very high	1 Å²	1	14.3 Å²	14.3	0%	0.004	7%	0.07	C	C	.	.	H	α-helix	trans	-63.9	-42.4	171.9	-74.8	-117.6	0	0	0	110.8	Y378 Y393 D396 F397 L400 F427 E452 S453 A459 L460 M514	Y378-F456 HydrophobicContact CE2-CE2 4.29Å; Y393-F456 HydrophobicContact CD1-CE2 4.21Å; Y393-F456 HydrophobicContact CD1-CZ 4.14Å; Y393-F456 WeakPolarHBondContact O-CZ 3.44Å; D396-F456 HydrophobicContact CB-CE1 4.4Å; F397-F456 HydrophobicContact CB-CD1 4.02Å; F397-F456 HydrophobicContact CB-CE1 3.79Å; F397-F456 HydrophobicContact CD2-CB 4.47Å; F397-F456 AromaticContact CD2-CD1 3.77Å; F397-F456 HydrophobicContact CD2-CD1 3.77Å; F397-F456 HydrophobicContact CD2-CE1 4.39Å; F397-F456 HydrophobicContact CD2-CG 4.25Å; F397-F456 HydrophobicContact CG-CD1 4.39Å; L400-F456 HydrophobicContact CD1-CD1 3.7Å; L400-F456 HydrophobicContact CD1-CE1 4.33Å; F427-F456 HydrophobicContact CE2-CE2 4.49Å; F427-F456 HydrophobicContact CZ-CD2 4.32Å; F427-F456 HydrophobicContact CZ-CE2 4.5Å; E452-F456 HydrophobicContact CB-CE2 4.39Å; E452-F456 HydrophobicContact CG-CE2 4.21Å; E452-F456 VanDerWaalsContact O-CD2 3.25Å; E452-F456 WeakPolarHBondContact O-CD2 3.35Å; E452-F456 PolarHBondContact O-N 3.16Å; S453-F456 PolarHBondContact O-N 3.34Å; F456-A459 PolarHBondContact O-N 2.91Å; F456-L460 WeakPolarHBondContact O-CB 3.44Å; F456-L460 WeakPolarHBondContact O-CG 3.33Å; F456-L460 PolarHBondContact O-N 3.09Å; F456-M514 HydrophobicContact CZ-CE 4.47Å; F456-M514 HydrophobicContact CZ-SD 4.28Å
457	Y	94.3	Very high	93	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.008	8%	0.081	C	C	.	.	H	α-helix	trans	-63.5	-41.4	175	-57.1	-19.6	0	0	0	112	W150 S453 A454 A461 F503 H504 L506 K507	W150-Y457 HydrophobicContact CH2-CD2 4.47Å; S453-Y457 VanDerWaalsContact O-CD1 3.29Å; S453-Y457 WeakPolarHBondContact O-CD1 3.35Å; S453-Y457 WeakPolarHBondContact O-CD2 3.34Å; S453-Y457 PolarHBondContact O-N 3.27Å; A454-Y457 PolarHBondContact O-N 3.19Å; Y457-A461 WeakPolarHBondContact O-CB 3.31Å; Y457-A461 PolarHBondContact O-N 3.33Å; Y457-F503 HydrophobicContact CD1-CB 3.91Å; Y457-F503 WeakPolarHBondContact CE1-O 3.2Å; Y457-F503 HydrophobicContact CG-CB 4.29Å; Y457-H504 PolarHBondContact OH-O 3.47Å; Y457-H504 VanDerWaalsContact OH-O 3.1Å; Y457-L506 HydrophobicContact CE1-CB 4.17Å; Y457-K507 WeakPolarHBondContact OH-CA 2.81Å; Y457-K507 WeakPolarHBondContact OH-CB 3.46Å; Y457-K507 PolarHBondContact OH-N 2.91Å; Y457-K507 VanDerWaalsContact OH-N 3.15Å
458	A	95.3	Very high	92.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62	-48.9	176.7	0	0	0	0	0	111.6	F431 I443 A454 L455 A461 I462 M500	F431-A458 HydrophobicContact CD2-CB 4.35Å; F431-A458 HydrophobicContact CE1-CB 4.08Å; F431-A458 HydrophobicContact CE2-CB 3.76Å; F431-A458 HydrophobicContact CZ-CB 3.61Å; I443-A458 HydrophobicContact CD1-CB 4.08Å; I443-A458 HydrophobicContact CG1-CB 4.25Å; I443-A458 HydrophobicContact CG2-CB 4.2Å; A454-A458 WeakPolarHBondContact O-CB 3.38Å; A454-A458 PolarHBondContact O-N 3.27Å; L455-A458 PolarHBondContact O-N 3.42Å; A458-A461 PolarHBondContact O-N 3.15Å; A458-I462 WeakPolarHBondContact O-CD1 3.18Å; A458-I462 VanDerWaalsContact O-CG1 3.27Å; A458-I462 WeakPolarHBondContact O-CG1 3.43Å; A458-I462 PolarHBondContact O-N 3.46Å; A458-M500 HydrophobicContact CB-CE 3.86Å; A458-M500 HydrophobicContact CB-SD 3.93Å
459	A	95.2	Very high	92.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-45.9	178.3	0	0	0	0	0	112.5	F397 L423 W426 F427 F431 L455 F456 A461 I462 L463	F397-A459 HydrophobicContact CD2-CB 4.39Å; F397-A459 HydrophobicContact CE2-CB 3.44Å; F397-A459 VanDerWaalsContact CE2-CB 3.44Å; F397-A459 HydrophobicContact CZ-CB 3.74Å; L423-A459 HydrophobicContact CD2-CB 3.94Å; W426-A459 HydrophobicContact CE3-CB 3.87Å; W426-A459 HydrophobicContact CZ3-CB 3.98Å; F427-A459 HydrophobicContact CE1-CB 4.02Å; F427-A459 HydrophobicContact CZ-CB 4.43Å; F431-A459 HydrophobicContact CE1-CB 4.33Å; F431-A459 HydrophobicContact CZ-CB 4Å; L455-A459 PolarHBondContact O-N 3.28Å; F456-A459 PolarHBondContact O-N 2.91Å; A459-A461 VanDerWaalsContact C-N 3.31Å; A459-A461 PolarHBondContact O-N 2.96Å; A459-I462 PolarHBondContact O-N 3.11Å; A459-L463 WeakPolarHBondContact O-CG 3.43Å; A459-L463 PolarHBondContact O-N 3.28Å
460	L	95.4	Very high	92.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.9	-38.1	174.2	-71	172.2	0	0	0	112.3	F397 L400 F401 C404 F456 K464 F503 L506	F397-L460 HydrophobicContact CE2-CD2 4.03Å; F397-L460 HydrophobicContact CE2-CG 3.84Å; F397-L460 HydrophobicContact CZ-CD2 3.91Å; F397-L460 HydrophobicContact CZ-CG 4.16Å; L400-L460 HydrophobicContact CB-CD1 4.16Å; F401-L460 HydrophobicContact CB-CD2 4.17Å; C404-L460 HydrophobicContact CB-CD2 4.37Å; F456-L460 WeakPolarHBondContact O-CB 3.44Å; F456-L460 WeakPolarHBondContact O-CG 3.33Å; F456-L460 PolarHBondContact O-N 3.09Å; L460-K464 VanDerWaalsContact O-CB 3.23Å; L460-K464 WeakPolarHBondContact O-CB 3.19Å; L460-K464 PolarHBondContact O-N 3.3Å; L460-F503 HydrophobicContact CB-CD2 3.89Å; L460-F503 HydrophobicContact CB-CE1 4.44Å; L460-F503 HydrophobicContact CB-CE2 3.72Å; L460-F503 HydrophobicContact CB-CG 4.3Å; L460-F503 HydrophobicContact CB-CZ 3.99Å; L460-F503 HydrophobicContact CD1-CD1 4.34Å; L460-F503 HydrophobicContact CD1-CG 4.4Å; L460-L506 HydrophobicContact CD1-CD1 4.15Å
461	A	95.3	Very high	93.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.9	-40.2	179.1	0	0	0	0	0	112.9	Y457 A458 A459 L465 L496 S499 M500 F503	Y457-A461 WeakPolarHBondContact O-CB 3.31Å; Y457-A461 PolarHBondContact O-N 3.33Å; A458-A461 PolarHBondContact O-N 3.15Å; A459-A461 VanDerWaalsContact C-N 3.31Å; A459-A461 PolarHBondContact O-N 2.96Å; A461-L465 WeakPolarHBondContact O-CB 3.41Å; A461-L465 WeakPolarHBondContact O-CD1 3.34Å; A461-L465 WeakPolarHBondContact O-CG 2.97Å; A461-L465 PolarHBondContact O-N 3.36Å; A461-L496 HydrophobicContact CB-CD1 3.58Å; A461-S499 WeakPolarHBondContact CA-OG 3.47Å; A461-S499 WeakPolarHBondContact CB-OG 3.34Å; A461-S499 PolarHBondContact O-OG 3.2Å; A461-M500 HydrophobicContact CB-CB 4.29Å; A461-M500 HydrophobicContact CB-CG 3.53Å; A461-F503 HydrophobicContact CB-CD2 4.41Å; A461-F503 HydrophobicContact CB-CE2 4.37Å
462	I	94.4	Very high	93.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.6	-51.4	173.4	-66.8	161.6	0	0	0	109.9	W426 F431 L435 A458 A459 K464 L465 C466 L488 L491 L496	W426-I462 HydrophobicContact CH2-CB 4.2Å; W426-I462 HydrophobicContact CH2-CG2 3.62Å; W426-I462 HydrophobicContact CZ2-CG2 4.38Å; W426-I462 HydrophobicContact CZ3-CB 4.22Å; W426-I462 HydrophobicContact CZ3-CD1 4.2Å; W426-I462 HydrophobicContact CZ3-CG2 4.15Å; F431-I462 HydrophobicContact CD1-CD1 3.74Å; F431-I462 HydrophobicContact CE1-CD1 3.61Å; L435-I462 HydrophobicContact CD1-CD1 4.08Å; L435-I462 HydrophobicContact CD2-CD1 4.5Å; A458-I462 WeakPolarHBondContact O-CD1 3.18Å; A458-I462 VanDerWaalsContact O-CG1 3.27Å; A458-I462 WeakPolarHBondContact O-CG1 3.43Å; A458-I462 PolarHBondContact O-N 3.46Å; A459-I462 PolarHBondContact O-N 3.11Å; I462-K464 VanDerWaalsContact C-N 3.29Å; I462-K464 PolarHBondContact O-N 3.03Å; I462-L465 PolarHBondContact O-N 3.3Å; I462-L465 VanDerWaalsContact O-N 3.11Å; I462-C466 PolarHBondContact O-N 3.21Å; I462-L488 HydrophobicContact CG2-CD2 3.6Å; I462-L491 HydrophobicContact CG1-CD2 4.11Å; I462-L496 HydrophobicContact CG1-CD1 3.83Å
463	L	94.7	Very high	93.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.7	-39.1	178.5	-68.8	174.2	0	0	0	112.4	F397 F401 L405 L408 F412 F422 W426 A459 E467 L470 L482	F397-L463 HydrophobicContact CE1-CD1 4.04Å; F397-L463 HydrophobicContact CZ-CD1 3.82Å; F401-L463 HydrophobicContact CD1-CD1 4.33Å; F401-L463 HydrophobicContact CD2-CD1 4.11Å; F401-L463 HydrophobicContact CE1-CD1 4.16Å; F401-L463 HydrophobicContact CE2-CD1 3.94Å; F401-L463 HydrophobicContact CG-CD1 4.34Å; F401-L463 HydrophobicContact CZ-CD1 3.97Å; L405-L463 HydrophobicContact CD1-CB 3.74Å; L408-L463 HydrophobicContact CD2-CB 4.07Å; L408-L463 HydrophobicContact CD2-CD2 4.48Å; F412-L463 HydrophobicContact CE2-CD2 4.48Å; F412-L463 HydrophobicContact CZ-CD2 4.21Å; F422-L463 HydrophobicContact CE2-CD1 4.47Å; F422-L463 HydrophobicContact CE2-CD2 4.29Å; F422-L463 HydrophobicContact CZ-CD1 4.18Å; F422-L463 HydrophobicContact CZ-CD2 4.14Å; W426-L463 HydrophobicContact CH2-CD2 4.48Å; A459-L463 WeakPolarHBondContact O-CG 3.43Å; A459-L463 PolarHBondContact O-N 3.28Å; L463-E467 WeakPolarHBondContact O-CA 3.37Å; L463-E467 WeakPolarHBondContact O-CB 3.26Å; L463-E467 PolarHBondContact O-N 3.09Å; L463-L470 HydrophobicContact CD2-CD1 3.9Å; L463-L482 HydrophobicContact CD2-CD2 4.11Å
464	K	94.7	Very high	93.7	Very high	69 Å²	69	32.6 Å²	32.6	30%	0.3	17%	0.17	S	C	.	.	H	α-helix	trans	-66.1	-39	175.5	178.6	169.3	170.9	178.6	0	113	L405 L460 I462 S502 F503	L405-K464 HydrophobicContact CD1-CB 4.11Å; L405-K464 HydrophobicContact CD2-CB 3.95Å; L405-K464 HydrophobicContact CD2-CD 4.49Å; L405-K464 HydrophobicContact CD2-CG 4.14Å; L460-K464 VanDerWaalsContact O-CB 3.23Å; L460-K464 WeakPolarHBondContact O-CB 3.19Å; L460-K464 PolarHBondContact O-N 3.3Å; I462-K464 VanDerWaalsContact C-N 3.29Å; I462-K464 PolarHBondContact O-N 3.03Å; K464-S502 PolarHBondContact NZ-OG 2.98Å; K464-F503 HydrophobicContact CB-CE2 4.32Å; K464-F503 HydrophobicContact CB-CZ 4.25Å; K464-F503 HydrophobicContact CD-CE2 3.77Å; K464-F503 HydrophobicContact CD-CZ 3.49Å; K464-F503 VanDerWaalsContact CD-CZ 3.49Å
465	L	92.9	Very high	93.6	Very high	69 Å²	69	33 Å²	33	36%	0.361	17%	0.171	S	C	.	.	H	α-helix	trans	-72.2	-35.7	179.3	-72.1	167.5	0	0	0	111.7	A461 I462 L491 T495 L496	A461-L465 WeakPolarHBondContact O-CB 3.41Å; A461-L465 WeakPolarHBondContact O-CD1 3.34Å; A461-L465 WeakPolarHBondContact O-CG 2.97Å; A461-L465 PolarHBondContact O-N 3.36Å; I462-L465 PolarHBondContact O-N 3.3Å; I462-L465 VanDerWaalsContact O-N 3.11Å; L465-L491 HydrophobicContact CD1-CD1 3.7Å; L465-L491 HydrophobicContact CD1-CD2 4.28Å; L465-T495 HydrophobicContact CD1-CG2 4.14Å; L465-T495 HydrophobicContact CD2-CG2 3.79Å; L465-L496 HydrophobicContact CD1-CD1 4.44Å
466	C	91.5	Very high	93.4	Very high	15 Å²	15	34.1 Å²	34.1	10%	0.101	18%	0.177	C	C	.	.	H	α-helix	trans	-89.3	-1.4	177.2	-63.6	0	0	0	0	114	I462 K468 D469 L470 Y481	I462-C466 PolarHBondContact O-N 3.21Å; C466-K468 PolarHBondContact O-N 3.21Å; C466-K468 VanDerWaalsContact O-N 3.07Å; C466-D469 PolarHBondContact O-N 2.66Å; C466-L470 HydrophobicContact CB-CD1 3.64Å; C466-L470 HydrophobicContact CB-CG 3.91Å; C466-L470 WeakPolarHBondContact O-CG 3.48Å; C466-L470 PolarHBondContact O-N 2.73Å; C466-Y481 HydrophobicContact CB-CE1 3.92Å; C466-Y481 PolarHBondContact SG-OH 2.88Å; C466-Y481 VanDerWaalsContact SG-OH 3.35Å
467	E	94.1	Very high	93.2	Very high	47 Å²	47	37.3 Å²	37.3	22%	0.22	19%	0.194	C	C	.	.	H	α-helix	trans	-51	-41.5	-170.7	177.3	177.1	-171.3	0	0	112.8	L408 L463 D469 L471	L408-E467 HydrophobicContact CB-CG 4.32Å; L408-E467 HydrophobicContact CD2-CB 4.39Å; L408-E467 HydrophobicContact CD2-CG 4.4Å; L463-E467 WeakPolarHBondContact O-CA 3.37Å; L463-E467 WeakPolarHBondContact O-CB 3.26Å; L463-E467 PolarHBondContact O-N 3.09Å; E467-D469 VanDerWaalsContact C-N 3.32Å; E467-D469 PolarHBondContact O-N 2.77Å; E467-L471 HydrophobicContact CG-CD1 3.59Å; E467-L471 HydrophobicContact CG-CG 4.11Å; E467-L471 WeakPolarHBondContact O-CB 3.19Å; E467-L471 WeakPolarHBondContact O-CD1 2.91Å; E467-L471 WeakPolarHBondContact O-CG 3.37Å; E467-L471 PolarHBondContact O-N 3.43Å
468	K	91.7	Very high	93	Very high	185 Å²	185	37.2 Å²	37.2	80%	0.804	19%	0.194	S	C	*	.	H	α-helix	trans	-62.3	-37.6	-178.7	-67	-180	-178.3	174.5	0	113.1	C466	C466-K468 PolarHBondContact O-N 3.21Å; C466-K468 VanDerWaalsContact O-N 3.07Å
469	D	90.7	Very high	92.6	Very high	82 Å²	82	38.1 Å²	38.1	44%	0.439	20%	0.2	S	C	.	.	H	α-helix	trans	-77.9	-51.3	179.7	-57.1	-17.2	0	0	0	109	C466 E467 L471 S472 C473 Y481	C466-D469 PolarHBondContact O-N 2.66Å; E467-D469 VanDerWaalsContact C-N 3.32Å; E467-D469 PolarHBondContact O-N 2.77Å; D469-L471 VanDerWaalsContact C-N 3.27Å; D469-L471 PolarHBondContact O-N 3.19Å; D469-S472 PolarHBondContact O-N 2.95Å; D469-S472 PolarHBondContact O-OG 2.96Å; D469-C473 PolarHBondContact O-N 3.25Å; D469-C473 PolarHBondContact O-SG 3.23Å; D469-C473 VanDerWaalsContact O-SG 3.37Å; D469-Y481 HydrophobicContact CB-CE2 3.75Å; D469-Y481 PolarHBondContact OD2-OH 2.95Å
470	L	93.3	Very high	92.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-31.9	-175.5	-62.9	171.7	0	0	0	113.3	L408 H411 F412 L463 C466 S472 C473 L478 Y481 L482	L408-L470 HydrophobicContact CD1-CB 3.64Å; L408-L470 HydrophobicContact CD2-CD1 4.11Å; H411-L470 PolarHBondContact CD2-O 3.42Å; H411-L470 PolarHBondContact NE2-O 3.26Å; F412-L470 HydrophobicContact CE1-CB 4.49Å; L463-L470 HydrophobicContact CD2-CD1 3.9Å; C466-L470 HydrophobicContact CB-CD1 3.64Å; C466-L470 HydrophobicContact CB-CG 3.91Å; C466-L470 WeakPolarHBondContact O-CG 3.48Å; C466-L470 PolarHBondContact O-N 2.73Å; L470-S472 PolarHBondContact O-N 3.46Å; L470-C473 WeakPolarHBondContact O-CB 3.45Å; L470-C473 PolarHBondContact O-N 3.36Å; L470-L478 HydrophobicContact CB-CD2 4.02Å; L470-L478 HydrophobicContact CD2-CD2 3.65Å; L470-L478 HydrophobicContact CG-CD2 4.43Å; L470-Y481 HydrophobicContact CD2-CD1 3.79Å; L470-Y481 HydrophobicContact CD2-CD2 4.5Å; L470-Y481 HydrophobicContact CD2-CE1 4.16Å; L470-Y481 HydrophobicContact CD2-CG 4.01Å; L470-L482 HydrophobicContact CD1-CD2 4.24Å; L470-L482 HydrophobicContact CD2-CD1 4.31Å; L470-L482 HydrophobicContact CD2-CD2 4Å; L470-L482 HydrophobicContact CD2-CG 4.07Å
471	L	95.5	Very high	91.7	Very high	32 Å²	32	42.3 Å²	42.3	17%	0.168	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.1	174.3	-76.2	168.6	0	0	0	114.4	R407 L408 H411 E467 D469	R407-L471 HydrophobicContact CG-CD1 4.4Å; R407-L471 HydrophobicContact CG-CD2 3.91Å; R407-L471 VanDerWaalsContact CZ-CD1 3.49Å; L408-L471 HydrophobicContact CB-CD2 4.37Å; L408-L471 HydrophobicContact CD1-CD2 3.95Å; L408-L471 HydrophobicContact CD1-CG 3.89Å; H411-L471 HydrophobicContact CB-CD2 3.93Å; E467-L471 HydrophobicContact CG-CD1 3.59Å; E467-L471 HydrophobicContact CG-CG 4.11Å; E467-L471 WeakPolarHBondContact O-CB 3.19Å; E467-L471 WeakPolarHBondContact O-CD1 2.91Å; E467-L471 WeakPolarHBondContact O-CG 3.37Å; E467-L471 PolarHBondContact O-N 3.43Å; D469-L471 VanDerWaalsContact C-N 3.27Å; D469-L471 PolarHBondContact O-N 3.19Å
472	S	92.5	Very high	91.3	Very high	97 Å²	97	42.3 Å²	42.3	68%	0.678	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-13.3	175	70.7	0	0	0	0	113.5	D469 L470	D469-S472 PolarHBondContact O-N 2.95Å; D469-S472 PolarHBondContact O-OG 2.96Å; L470-S472 PolarHBondContact O-N 3.46Å
473	C	92.8	Very high	90.5	Very high	12 Å²	12	45.4 Å²	45.4	8%	0.081	25%	0.247	C	C	.	.			trans	-75	138.6	-177	-69.2	0	0	0	0	112.8	H411 D469 L470 D477 L478	H411-C473 PolarHBondContact CE1-O 2.78Å; H411-C473 PolarHBondContact NE2-O 3.17Å; D469-C473 PolarHBondContact O-N 3.25Å; D469-C473 PolarHBondContact O-SG 3.23Å; D469-C473 VanDerWaalsContact O-SG 3.37Å; L470-C473 WeakPolarHBondContact O-CB 3.45Å; L470-C473 PolarHBondContact O-N 3.36Å; C473-D477 HydrophobicContact CB-CB 3.54Å; C473-L478 HydrophobicContact CB-CD2 3.64Å; C473-L478 HydrophobicContact CB-CG 3.71Å
474	N	92.7	Very high	89.2	Confident	74 Å²	74	46.5 Å²	46.5	40%	0.396	26%	0.257	S	S	.	.			trans	-79.8	-177.5	161.4	74.5	62.6	0	0	0	111	D476 D477 L478	N474-D476 PolarHBondContact O-N 3.28Å; N474-D476 WeakPolarHBondContact OD1-CB 3.36Å; N474-D476 PolarHBondContact OD1-N 3.29Å; N474-D476 PolarHBondContact OD1-OD2 2.93Å; N474-D477 PolarHBondContact N-OD2 2.67Å; N474-D477 PolarHBondContact ND2-OD1 3.22Å; N474-D477 PolarHBondContact ND2-OD2 2.88Å; N474-D477 PolarHBondContact O-N 3.27Å; N474-D477 PolarHBondContact OD1-N 3.22Å; N474-L478 WeakPolarHBondContact O-CB 3.41Å; N474-L478 VanDerWaalsContact O-CG 3.32Å; N474-L478 WeakPolarHBondContact O-CG 3.31Å; N474-L478 PolarHBondContact O-N 3.11Å
475	F	91.5	Very high	87.7	Confident	9 Å²	9	44.6 Å²	44.6	4%	0.039	26%	0.255	C	S	.	.	H	α-helix	trans	-56.8	-44.7	-178.6	-176.9	-81.4	0	0	0	113.8	F32 V415 F417 M421 L478 S479	F32-F475 HydrophobicContact CB-CE1 3.96Å; F32-F475 HydrophobicContact CB-CE2 4.15Å; F32-F475 HydrophobicContact CB-CZ 3.73Å; F32-F475 HydrophobicContact CD1-CB 3.97Å; F32-F475 AromaticContact CD1-CD1 3.33Å; F32-F475 HydrophobicContact CD1-CD1 3.33Å; F32-F475 AromaticContact CD1-CD2 3.51Å; F32-F475 HydrophobicContact CD1-CD2 3.51Å; F32-F475 AromaticContact CD1-CE1 3.58Å; F32-F475 HydrophobicContact CD1-CE1 3.58Å; F32-F475 AromaticContact CD1-CE2 3.74Å; F32-F475 HydrophobicContact CD1-CE2 3.74Å; F32-F475 AromaticContact CD1-CG 3.31Å; F32-F475 HydrophobicContact CD1-CG 3.31Å; F32-F475 AromaticContact CD1-CZ 3.79Å; F32-F475 HydrophobicContact CD1-CZ 3.79Å; F32-F475 HydrophobicContact CD2-CD2 4.46Å; F32-F475 HydrophobicContact CD2-CE2 4.33Å; F32-F475 HydrophobicContact CE1-CB 3.41Å; F32-F475 VanDerWaalsContact CE1-CB 3.41Å; F32-F475 AromaticContact CE1-CD1 3.75Å; F32-F475 HydrophobicContact CE1-CD1 3.75Å; F32-F475 AromaticContact CE1-CD2 3.49Å; F32-F475 HydrophobicContact CE1-CD2 3.49Å; F32-F475 VanDerWaalsContact CE1-CD2 3.49Å; F32-F475 HydrophobicContact CE1-CE1 4.39Å; F32-F475 HydrophobicContact CE1-CE2 4.16Å; F32-F475 AromaticContact CE1-CG 3.26Å; F32-F475 HydrophobicContact CE1-CG 3.26Å; F32-F475 HydrophobicContact CE2-CD2 4.41Å; F32-F475 HydrophobicContact CG-CD1 4.25Å; F32-F475 HydrophobicContact CG-CD2 4.03Å; F32-F475 HydrophobicContact CG-CE1 4.07Å; F32-F475 AromaticContact CG-CE2 3.84Å; F32-F475 HydrophobicContact CG-CE2 3.84Å; F32-F475 HydrophobicContact CG-CG 4.24Å; F32-F475 AromaticContact CG-CZ 3.88Å; F32-F475 HydrophobicContact CG-CZ 3.88Å; F32-F475 HydrophobicContact CZ-CB 4.2Å; F32-F475 AromaticContact CZ-CD2 3.94Å; F32-F475 HydrophobicContact CZ-CD2 3.94Å; F32-F475 HydrophobicContact CZ-CG 4.12Å; V415-F475 HydrophobicContact CG1-CB 3.71Å; V415-F475 HydrophobicContact CG1-CD2 4.42Å; V415-F475 VanDerWaalsContact CG1-N 3.34Å; F417-F475 HydrophobicContact CB-CD2 4.18Å; F417-F475 HydrophobicContact CB-CE2 4.45Å; F417-F475 AromaticContact CD2-CD2 3.77Å; F417-F475 HydrophobicContact CD2-CD2 3.77Å; F417-F475 AromaticContact CD2-CE2 3.74Å; F417-F475 HydrophobicContact CD2-CE2 3.74Å; F417-F475 HydrophobicContact CD2-CG 4.23Å; F417-F475 HydrophobicContact CD2-CZ 4.17Å; F417-F475 HydrophobicContact CG-CD2 4.49Å; M421-F475 HydrophobicContact CE-CE2 3.97Å; M421-F475 HydrophobicContact CE-CZ 4.04Å; M421-F475 HydrophobicContact SD-CE2 3.82Å; M421-F475 HydrophobicContact SD-CZ 3.77Å; F475-L478 PolarHBondContact O-N 3.37Å; F475-S479 WeakPolarHBondContact O-CB 3.4Å; F475-S479 PolarHBondContact O-N 2.95Å
476	D	89.2	Confident	86.1	Confident	23 Å²	23	47 Å²	47	12%	0.123	27%	0.273	C	S	.	.	H	α-helix	trans	-72.7	-36.6	-176.4	-47.9	-58.5	0	0	0	110.6	K35 N474 S479 S480	K35-D476 VanDerWaalsContact CD-OD1 3.27Å; K35-D476 WeakPolarHBondContact CD-OD1 3.42Å; K35-D476 WeakPolarHBondContact CD-OD2 3.41Å; K35-D476 WeakPolarHBondContact CE-OD2 3.26Å; K35-D476 WeakPolarHBondContact CG-OD1 3.18Å; K35-D476 IonicContact NZ-OD2 2.91Å; K35-D476 PolarHBondContact NZ-OD2 2.89Å; N474-D476 PolarHBondContact O-N 3.28Å; N474-D476 WeakPolarHBondContact OD1-CB 3.36Å; N474-D476 PolarHBondContact OD1-N 3.29Å; N474-D476 PolarHBondContact OD1-OD2 2.93Å; D476-S479 PolarHBondContact O-N 3.36Å; D476-S480 WeakPolarHBondContact O-CB 3.29Å; D476-S480 PolarHBondContact O-N 2.92Å; D476-S480 PolarHBondContact O-OG 3.28Å
477	D	90.2	Very high	84.6	Confident	67 Å²	67	50.6 Å²	50.6	36%	0.358	29%	0.29	S	S	.	.	H	α-helix	trans	-62.9	-45.3	171.4	-56	-26.5	0	0	0	110.5	C473 N474 S480 Y481	C473-D477 HydrophobicContact CB-CB 3.54Å; N474-D477 PolarHBondContact N-OD2 2.67Å; N474-D477 PolarHBondContact ND2-OD1 3.22Å; N474-D477 PolarHBondContact ND2-OD2 2.88Å; N474-D477 PolarHBondContact O-N 3.27Å; N474-D477 PolarHBondContact OD1-N 3.22Å; D477-S480 PolarHBondContact O-N 2.96Å; D477-S480 PolarHBondContact O-OG 2.74Å; D477-Y481 WeakPolarHBondContact O-CB 3.29Å; D477-Y481 PolarHBondContact O-N 2.96Å
478	L	90.3	Very high	83.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-45.6	176.8	-73.8	176.6	0	0	0	111.5	F412 V415 F417 L470 C473 N474 F475 Y481 L482	F412-L478 HydrophobicContact CD1-CD1 3.99Å; F412-L478 HydrophobicContact CD1-CD2 4.44Å; F412-L478 HydrophobicContact CE1-CD1 3.95Å; F412-L478 HydrophobicContact CE1-CD2 3.61Å; F412-L478 HydrophobicContact CE1-CG 4.45Å; F412-L478 HydrophobicContact CZ-CD2 4Å; V415-L478 HydrophobicContact CB-CD1 4.48Å; V415-L478 HydrophobicContact CG1-CD1 4.07Å; F417-L478 HydrophobicContact CB-CD1 3.82Å; F417-L478 HydrophobicContact CD1-CB 4.18Å; F417-L478 HydrophobicContact CD1-CD1 4.07Å; F417-L478 HydrophobicContact CD2-CB 3.93Å; F417-L478 HydrophobicContact CD2-CD1 4.4Å; F417-L478 HydrophobicContact CE1-CB 4.15Å; F417-L478 HydrophobicContact CE2-CB 3.93Å; F417-L478 HydrophobicContact CG-CB 4.07Å; F417-L478 HydrophobicContact CG-CD1 3.85Å; F417-L478 HydrophobicContact CZ-CB 4.04Å; L470-L478 HydrophobicContact CB-CD2 4.02Å; L470-L478 HydrophobicContact CD2-CD2 3.65Å; L470-L478 HydrophobicContact CG-CD2 4.43Å; C473-L478 HydrophobicContact CB-CD2 3.64Å; C473-L478 HydrophobicContact CB-CG 3.71Å; N474-L478 WeakPolarHBondContact O-CB 3.41Å; N474-L478 VanDerWaalsContact O-CG 3.32Å; N474-L478 WeakPolarHBondContact O-CG 3.31Å; N474-L478 PolarHBondContact O-N 3.11Å; F475-L478 PolarHBondContact O-N 3.37Å; L478-Y481 PolarHBondContact O-N 3.29Å; L478-L482 WeakPolarHBondContact O-CB 3.01Å; L478-L482 WeakPolarHBondContact O-CG 3.31Å; L478-L482 PolarHBondContact O-N 3.37Å
479	S	86.5	Confident	82.6	Confident	20 Å²	20	45 Å²	45	14%	0.14	27%	0.267	C	S	.	.	H	α-helix	trans	-61.5	-48	178.1	-166.4	0	0	0	0	111.2	F475 D476 S483	F475-S479 WeakPolarHBondContact O-CB 3.4Å; F475-S479 PolarHBondContact O-N 2.95Å; D476-S479 PolarHBondContact O-N 3.36Å; S479-S483 WeakPolarHBondContact O-CB 3.48Å; S479-S483 PolarHBondContact O-N 3.4Å; S479-S483 PolarHBondContact O-OG 3.27Å; S479-S483 VanDerWaalsContact O-OG 3.13Å
480	S	85.3	Confident	81.9	Confident	56 Å²	56	45.7 Å²	45.7	39%	0.392	28%	0.278	S	S	.	.	H	α-helix	trans	-70	-34.6	179.9	56.9	0	0	0	0	113.3	D476 D477 G484	D476-S480 WeakPolarHBondContact O-CB 3.29Å; D476-S480 PolarHBondContact O-N 2.92Å; D476-S480 PolarHBondContact O-OG 3.28Å; D477-S480 PolarHBondContact O-N 2.96Å; D477-S480 PolarHBondContact O-OG 2.74Å; S480-G484 VanDerWaalsContact O-CA 3.31Å; S480-G484 WeakPolarHBondContact O-CA 3.39Å; S480-G484 PolarHBondContact O-N 2.9Å
481	Y	85.8	Confident	81.4	Confident	32 Å²	32	46.8 Å²	46.8	13%	0.125	28%	0.284	C	S	.	.	H	α-helix	trans	-70.6	-43.8	177.5	-165.8	-63.3	0	0	0	112.1	C466 D469 L470 D477 L478 L487	C466-Y481 HydrophobicContact CB-CE1 3.92Å; C466-Y481 PolarHBondContact SG-OH 2.88Å; C466-Y481 VanDerWaalsContact SG-OH 3.35Å; D469-Y481 HydrophobicContact CB-CE2 3.75Å; D469-Y481 PolarHBondContact OD2-OH 2.95Å; L470-Y481 HydrophobicContact CD2-CD1 3.79Å; L470-Y481 HydrophobicContact CD2-CD2 4.5Å; L470-Y481 HydrophobicContact CD2-CE1 4.16Å; L470-Y481 HydrophobicContact CD2-CG 4.01Å; D477-Y481 WeakPolarHBondContact O-CB 3.29Å; D477-Y481 PolarHBondContact O-N 2.96Å; L478-Y481 PolarHBondContact O-N 3.29Å; Y481-L487 HydrophobicContact CD2-CD1 3.59Å; Y481-L487 HydrophobicContact CE1-CB 4.47Å; Y481-L487 HydrophobicContact CE2-CD1 3.37Å; Y481-L487 HydrophobicContact CG-CD1 4.28Å
482	L	86.8	Confident	81	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-89	-26.5	-172.5	-64.9	170.3	0	0	0	114.1	F412 F417 F422 W426 L463 L470 L478	F412-L482 HydrophobicContact CE2-CD1 4.14Å; F412-L482 HydrophobicContact CZ-CD1 3.87Å; F417-L482 HydrophobicContact CE1-CD1 3.67Å; F417-L482 HydrophobicContact CZ-CD1 4.18Å; F422-L482 HydrophobicContact CB-CB 4.01Å; F422-L482 HydrophobicContact CD1-CD1 4.04Å; F422-L482 HydrophobicContact CE1-CD1 4.14Å; F422-L482 HydrophobicContact CG-CB 4.2Å; F422-L482 HydrophobicContact CG-CD1 4.25Å; F422-L482 HydrophobicContact CZ-CD1 4.49Å; W426-L482 HydrophobicContact CH2-CD2 3.93Å; W426-L482 HydrophobicContact CZ2-CB 4.34Å; W426-L482 HydrophobicContact CZ2-CD2 3.85Å; W426-L482 PolarHBondContact NE1-O 3.45Å; L463-L482 HydrophobicContact CD2-CD2 4.11Å; L470-L482 HydrophobicContact CD1-CD2 4.24Å; L470-L482 HydrophobicContact CD2-CD1 4.31Å; L470-L482 HydrophobicContact CD2-CD2 4Å; L470-L482 HydrophobicContact CD2-CG 4.07Å; L478-L482 WeakPolarHBondContact O-CB 3.01Å; L478-L482 WeakPolarHBondContact O-CG 3.31Å; L478-L482 PolarHBondContact O-N 3.37Å
483	S	77.6	Confident	80.8	Confident	65 Å²	65	45 Å²	45	46%	0.455	27%	0.271	S	S	.	.	H	α-helix	trans	-87.4	-18.9	169.8	-53.4	0	0	0	0	112.7	S479	S479-S483 WeakPolarHBondContact O-CB 3.48Å; S479-S483 PolarHBondContact O-N 3.4Å; S479-S483 PolarHBondContact O-OG 3.27Å; S479-S483 VanDerWaalsContact O-OG 3.13Å
484	G	68.1	Low	80.5	Confident	22 Å²	22	47 Å²	47	23%	0.227	28%	0.281	C	S	.	.			trans	-88.1	131	-178.4	0	0	0	0	0	113.6	S480 T486	S480-G484 VanDerWaalsContact O-CA 3.31Å; S480-G484 WeakPolarHBondContact O-CA 3.39Å; S480-G484 PolarHBondContact O-N 2.9Å; G484-T486 VanDerWaalsContact C-N 3.29Å; G484-T486 PolarHBondContact O-N 3.26Å
485	A	62.2	Low	80.4	Confident	29 Å²	29	46.2 Å²	46.2	24%	0.24	28%	0.279	C	S	.	.	H	α-helix	trans	-71.9	-19.2	179.2	0	0	0	0	0	114.1	L487 L488 Q489	A485-L487 PolarHBondContact O-N 3.46Å; A485-L488 PolarHBondContact O-N 3.21Å; A485-Q489 HydrophobicContact CB-CG 4.39Å; A485-Q489 WeakPolarHBondContact O-CB 3.44Å; A485-Q489 WeakPolarHBondContact O-CG 3.36Å; A485-Q489 PolarHBondContact O-N 3.03Å
486	T	60.6	Low	80.5	Confident	121 Å²	121	45.8 Å²	45.8	74%	0.742	28%	0.277	S	S	*	.	H	α-helix	trans	-58.8	-42.1	-163.9	-48.1	0	0	0	0	114.7	G484	G484-T486 VanDerWaalsContact C-N 3.29Å; G484-T486 PolarHBondContact O-N 3.26Å
487	L	60	Low	80.7	Confident	89 Å²	89	44.9 Å²	44.9	47%	0.466	27%	0.272	S	S	.	.	H	α-helix	trans	-89.3	-37.9	-179.2	-70.6	172.1	0	0	0	112	Y481 A485 Q489 S490	Y481-L487 HydrophobicContact CD2-CD1 3.59Å; Y481-L487 HydrophobicContact CE1-CB 4.47Å; Y481-L487 HydrophobicContact CE2-CD1 3.37Å; Y481-L487 HydrophobicContact CG-CD1 4.28Å; A485-L487 PolarHBondContact O-N 3.46Å; L487-Q489 PolarHBondContact O-N 2.7Å; L487-S490 WeakPolarHBondContact O-CB 3.37Å; L487-S490 PolarHBondContact O-N 3.27Å; L487-S490 PolarHBondContact O-OG 2.91Å
488	L	72.6	Confident	80.8	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.016	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-26.4	176.3	-62.1	179.6	0	0	0	112.4	W426 I434 L435 I462 A485 S490 L491	W426-L488 HydrophobicContact CZ2-CD1 4.13Å; I434-L488 HydrophobicContact CB-CD1 4.38Å; I434-L488 HydrophobicContact CD1-CD1 3.76Å; L435-L488 HydrophobicContact CD2-CB 3.99Å; I462-L488 HydrophobicContact CG2-CD2 3.6Å; A485-L488 PolarHBondContact O-N 3.21Å; L488-S490 PolarHBondContact O-N 3.04Å; L488-L491 WeakPolarHBondContact O-CB 3.35Å; L488-L491 PolarHBondContact O-N 3.35Å; L488-L491 VanDerWaalsContact O-N 3.15Å
489	Q	70.8	Confident	80.9	Confident	112 Å²	112	44.9 Å²	44.9	52%	0.523	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-17	170.5	-82.2	177.1	30.4	0	0	114.9	P436 A485 L487 L491	P436-Q489 HydrophobicContact CG-CB 4.39Å; P436-Q489 HydrophobicContact CG-CG 4.4Å; P436-Q489 WeakPolarHBondContact CG-O 3.15Å; A485-Q489 HydrophobicContact CB-CG 4.39Å; A485-Q489 WeakPolarHBondContact O-CB 3.44Å; A485-Q489 WeakPolarHBondContact O-CG 3.36Å; A485-Q489 PolarHBondContact O-N 3.03Å; L487-Q489 PolarHBondContact O-N 2.7Å; Q489-L491 VanDerWaalsContact C-N 3.33Å
490	S	75.8	Confident	81.3	Confident	97 Å²	97	43.9 Å²	43.9	68%	0.678	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-14.2	175.6	72.6	0	0	0	0	113.7	L487 L488 T492	L487-S490 WeakPolarHBondContact O-CB 3.37Å; L487-S490 PolarHBondContact O-N 3.27Å; L487-S490 PolarHBondContact O-OG 2.91Å; L488-S490 PolarHBondContact O-N 3.04Å; S490-T492 PolarHBondContact O-N 2.74Å
491	L	82.7	Confident	81.6	Confident	22 Å²	22	44.9 Å²	44.9	12%	0.115	26%	0.261	C	S	.	.			trans	-74.9	114.1	-172.1	-179.3	54.5	0	0	0	111.9	T439 I462 L465 L488 Q489 T495 L496	T439-L491 PolarHBondContact OG1-O 2.68Å; T439-L491 VanDerWaalsContact OG1-O 3.09Å; I462-L491 HydrophobicContact CG1-CD2 4.11Å; L465-L491 HydrophobicContact CD1-CD1 3.7Å; L465-L491 HydrophobicContact CD1-CD2 4.28Å; L488-L491 WeakPolarHBondContact O-CB 3.35Å; L488-L491 PolarHBondContact O-N 3.35Å; L488-L491 VanDerWaalsContact O-N 3.15Å; Q489-L491 VanDerWaalsContact C-N 3.33Å; L491-T495 HydrophobicContact CD1-CG2 4.17Å; L491-L496 HydrophobicContact CD1-CB 4.26Å; L491-L496 HydrophobicContact CD2-CB 3.97Å; L491-L496 HydrophobicContact CD2-CD1 4.05Å; L491-L496 HydrophobicContact CD2-CD2 4.21Å; L491-L496 HydrophobicContact CD2-CG 4.29Å; L491-L496 HydrophobicContact CG-CB 4.06Å
492	T	86.5	Confident	81.8	Confident	67 Å²	67	45 Å²	45	41%	0.411	27%	0.266	S	S	.	.			trans	-72.6	146.8	177.1	63	0	0	0	0	111.8	S490 D494 T495 L496	S490-T492 PolarHBondContact O-N 2.74Å; T492-D494 PolarHBondContact O-N 3Å; T492-T495 PolarHBondContact O-N 3.39Å; T492-T495 WeakPolarHBondContact OG1-CB 3.49Å; T492-T495 PolarHBondContact OG1-OG1 3.07Å; T492-L496 PolarHBondContact O-N 2.98Å
493	P	88.5	Confident	81.9	Confident	25 Å²	25	45.4 Å²	45.4	16%	0.162	27%	0.268	C	S	.	.	H	α-helix	trans	-57.1	-45.3	-179.4	-22.2	30.2	0	0	0	112.8	E438 R442 T495 L496 I497	E438-P493 HydrophobicContact CB-CG 4.04Å; R442-P493 HydrophobicContact CB-CB 4.41Å; R442-P493 HydrophobicContact CG-CB 3.89Å; P493-T495 VanDerWaalsContact C-N 3.35Å; P493-T495 PolarHBondContact O-N 3.3Å; P493-L496 PolarHBondContact O-N 2.74Å; P493-I497 WeakPolarHBondContact O-CB 3.06Å; P493-I497 WeakPolarHBondContact O-CG1 3.21Å; P493-I497 PolarHBondContact O-N 3.49Å
494	D	87.8	Confident	82.1	Confident	53 Å²	53	44.2 Å²	44.2	28%	0.283	26%	0.255	S	S	.	.	H	α-helix	trans	-56.6	-46.6	180	-57.1	-33.6	0	0	0	112.2	T492 L496 I497 I498	T492-D494 PolarHBondContact O-N 3Å; D494-L496 VanDerWaalsContact C-N 3.34Å; D494-L496 PolarHBondContact O-N 3.4Å; D494-I497 PolarHBondContact O-N 2.92Å; D494-I498 WeakPolarHBondContact O-CB 3.34Å; D494-I498 WeakPolarHBondContact O-CD1 3.32Å; D494-I498 WeakPolarHBondContact O-CG1 3.2Å; D494-I498 PolarHBondContact O-N 2.9Å
495	T	90.6	Very high	82.4	Confident	59 Å²	59	49 Å²	49	36%	0.362	27%	0.272	S	S	.	.	H	α-helix	trans	-63.8	-42	-178.2	-52.5	0	0	0	0	111.1	L465 L491 T492 P493 S499	L465-T495 HydrophobicContact CD1-CG2 4.14Å; L465-T495 HydrophobicContact CD2-CG2 3.79Å; L491-T495 HydrophobicContact CD1-CG2 4.17Å; T492-T495 PolarHBondContact O-N 3.39Å; T492-T495 WeakPolarHBondContact OG1-CB 3.49Å; T492-T495 PolarHBondContact OG1-OG1 3.07Å; P493-T495 VanDerWaalsContact C-N 3.35Å; P493-T495 PolarHBondContact O-N 3.3Å; T495-S499 WeakPolarHBondContact O-CB 3.47Å; T495-S499 PolarHBondContact O-N 3.33Å
496	L	93.2	Very high	82.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.3	-48.6	175.9	178.8	57.8	0	0	0	111.3	L435 T439 I443 A461 I462 L465 L491 T492 P493 D494 I498 S499 M500	L435-L496 HydrophobicContact CD1-CD2 4.11Å; T439-L496 HydrophobicContact CG2-CB 4.4Å; T439-L496 HydrophobicContact CG2-CD2 3.44Å; T439-L496 VanDerWaalsContact CG2-CD2 3.44Å; I443-L496 HydrophobicContact CD1-CD2 3.77Å; I443-L496 HydrophobicContact CG1-CD2 3.98Å; A461-L496 HydrophobicContact CB-CD1 3.58Å; I462-L496 HydrophobicContact CG1-CD1 3.83Å; L465-L496 HydrophobicContact CD1-CD1 4.44Å; L491-L496 HydrophobicContact CD1-CB 4.26Å; L491-L496 HydrophobicContact CD2-CB 3.97Å; L491-L496 HydrophobicContact CD2-CD1 4.05Å; L491-L496 HydrophobicContact CD2-CD2 4.21Å; L491-L496 HydrophobicContact CD2-CG 4.29Å; L491-L496 HydrophobicContact CG-CB 4.06Å; T492-L496 PolarHBondContact O-N 2.98Å; P493-L496 PolarHBondContact O-N 2.74Å; D494-L496 VanDerWaalsContact C-N 3.34Å; D494-L496 PolarHBondContact O-N 3.4Å; L496-I498 PolarHBondContact O-N 2.74Å; L496-S499 CarbonylContact O-C 3.5Å; L496-S499 WeakPolarHBondContact O-CA 3.25Å; L496-S499 WeakPolarHBondContact O-CB 3.35Å; L496-S499 PolarHBondContact O-N 3.49Å; L496-S499 VanDerWaalsContact O-N 3.08Å; L496-M500 HydrophobicContact CD1-CG 4.01Å; L496-M500 HydrophobicContact CD1-SD 4.19Å; L496-M500 HydrophobicContact CD2-SD 4.29Å; L496-M500 HydrophobicContact CG-CG 4.18Å; L496-M500 HydrophobicContact CG-SD 3.83Å; L496-M500 WeakPolarHBondContact O-CG 3.41Å; L496-M500 PolarHBondContact O-N 2.79Å
497	I	93.3	Very high	82.8	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-36.7	-175	-64	-72	0	0	0	111.6	W150 R442 L446 P493 D494 M500 Y501 F606	W150-I497 HydrophobicContact CE3-CG2 3.81Å; W150-I497 HydrophobicContact CZ3-CG2 4.35Å; W150-I497 WeakPolarHBondContact O-CG2 3.37Å; R442-I497 HydrophobicContact CB-CD1 3.73Å; R442-I497 HydrophobicContact CB-CG1 3.9Å; L446-I497 HydrophobicContact CD1-CD1 3.53Å; P493-I497 WeakPolarHBondContact O-CB 3.06Å; P493-I497 WeakPolarHBondContact O-CG1 3.21Å; P493-I497 PolarHBondContact O-N 3.49Å; D494-I497 PolarHBondContact O-N 2.92Å; I497-M500 HydrophobicContact CD1-SD 3.93Å; I497-M500 PolarHBondContact O-N 3.37Å; I497-Y501 WeakPolarHBondContact O-CB 3.21Å; I497-Y501 PolarHBondContact O-N 2.59Å; I497-F606 HydrophobicContact CG2-CE1 4.14Å
498	I	91.9	Very high	82.2	Confident	57 Å²	57	49 Å²	49	29%	0.292	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-45.7	170.2	-69.2	163	0	0	0	110.9	D494 L496 Y501 S502 F606 T608	D494-I498 WeakPolarHBondContact O-CB 3.34Å; D494-I498 WeakPolarHBondContact O-CD1 3.32Å; D494-I498 WeakPolarHBondContact O-CG1 3.2Å; D494-I498 PolarHBondContact O-N 2.9Å; L496-I498 PolarHBondContact O-N 2.74Å; I498-Y501 PolarHBondContact O-N 3.18Å; I498-S502 PolarHBondContact O-N 3.23Å; I498-F606 HydrophobicContact CD1-CB 3.95Å; I498-F606 HydrophobicContact CD1-CD1 4.09Å; I498-F606 HydrophobicContact CD1-CG 4.06Å; I498-F606 HydrophobicContact CG1-CB 3.95Å; I498-F606 HydrophobicContact CG1-CD1 3.36Å; I498-F606 HydrophobicContact CG1-CD2 3.98Å; I498-F606 HydrophobicContact CG1-CE1 3.77Å; I498-F606 HydrophobicContact CG1-CE2 4.32Å; I498-F606 HydrophobicContact CG1-CG 3.48Å; I498-F606 VanDerWaalsContact CG1-CG 3.48Å; I498-F606 HydrophobicContact CG1-CZ 4.23Å; I498-T608 HydrophobicContact CD1-CG2 3.69Å
499	S	93.4	Very high	80.9	Confident	9 Å²	9	53.7 Å²	53.7	6%	0.063	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-42.1	178.4	-172.8	0	0	0	0	111.6	A461 T495 L496 Y501 S502 F503	A461-S499 WeakPolarHBondContact CA-OG 3.47Å; A461-S499 WeakPolarHBondContact CB-OG 3.34Å; A461-S499 PolarHBondContact O-OG 3.2Å; T495-S499 WeakPolarHBondContact O-CB 3.47Å; T495-S499 PolarHBondContact O-N 3.33Å; L496-S499 CarbonylContact O-C 3.5Å; L496-S499 WeakPolarHBondContact O-CA 3.25Å; L496-S499 WeakPolarHBondContact O-CB 3.35Å; L496-S499 PolarHBondContact O-N 3.49Å; L496-S499 VanDerWaalsContact O-N 3.08Å; S499-Y501 PolarHBondContact O-N 3.41Å; S499-S502 WeakPolarHBondContact O-CB 3.38Å; S499-S502 PolarHBondContact O-N 3.05Å; S499-S502 PolarHBondContact O-OG 2.87Å; S499-F503 WeakPolarHBondContact O-CD2 3.37Å
500	M	94.4	Very high	79.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-42.3	173.1	-71.1	176.3	66.2	0	0	112.3	W150 I443 L446 A454 A458 A461 L496 I497 S502 F503 H504	W150-M500 HydrophobicContact CH2-CB 4.37Å; W150-M500 HydrophobicContact CZ3-CB 3.95Å; I443-M500 HydrophobicContact CG1-SD 4.19Å; L446-M500 HydrophobicContact CD1-CE 3.69Å; L446-M500 HydrophobicContact CD1-SD 4.45Å; A454-M500 WeakPolarHBondContact O-CE 3.45Å; A458-M500 HydrophobicContact CB-CE 3.86Å; A458-M500 HydrophobicContact CB-SD 3.93Å; A461-M500 HydrophobicContact CB-CB 4.29Å; A461-M500 HydrophobicContact CB-CG 3.53Å; L496-M500 HydrophobicContact CD1-CG 4.01Å; L496-M500 HydrophobicContact CD1-SD 4.19Å; L496-M500 HydrophobicContact CD2-SD 4.29Å; L496-M500 HydrophobicContact CG-CG 4.18Å; L496-M500 HydrophobicContact CG-SD 3.83Å; L496-M500 WeakPolarHBondContact O-CG 3.41Å; L496-M500 PolarHBondContact O-N 2.79Å; I497-M500 HydrophobicContact CD1-SD 3.93Å; I497-M500 PolarHBondContact O-N 3.37Å; M500-S502 PolarHBondContact O-N 3.15Å; M500-F503 PolarHBondContact O-N 3.1Å; M500-H504 PolarHBondContact O-N 2.83Å
501	Y	90.9	Very high	78.3	Confident	77 Å²	77	46.5 Å²	46.5	30%	0.302	23%	0.227	S	C	.	.	H	α-helix	trans	-59.5	-34.6	178.1	-169.3	-95.1	0	0	0	111.7	W150 I497 I498 S499 F503 H504 Y602 F606	W150-Y501 AromaticContact CD2-CD2 3.54Å; W150-Y501 HydrophobicContact CD2-CD2 3.54Å; W150-Y501 HydrophobicContact CD2-CE2 4.17Å; W150-Y501 AromaticContact CE2-CD2 3.83Å; W150-Y501 AromaticContact CE3-CD2 3.7Å; W150-Y501 HydrophobicContact CE3-CD2 3.7Å; W150-Y501 HydrophobicContact CE3-CG 4.38Å; W150-Y501 AromaticContact CG-CD2 3.89Å; W150-Y501 HydrophobicContact CG-CD2 3.89Å; W150-Y501 HydrophobicContact CG-CE2 4.12Å; W150-Y501 HydrophobicContact CH2-CD2 4.39Å; W150-Y501 HydrophobicContact CZ2-CD2 4.27Å; W150-Y501 HydrophobicContact CZ3-CD2 4.12Å; I497-Y501 WeakPolarHBondContact O-CB 3.21Å; I497-Y501 PolarHBondContact O-N 2.59Å; I498-Y501 PolarHBondContact O-N 3.18Å; S499-Y501 PolarHBondContact O-N 3.41Å; Y501-F503 PolarHBondContact O-N 3.47Å; Y501-F503 VanDerWaalsContact O-N 3.1Å; Y501-H504 VanDerWaalsContact O-CB 3.31Å; Y501-H504 WeakPolarHBondContact O-CB 3.29Å; Y501-H504 PolarHBondContact O-N 3.45Å; Y501-H504 VanDerWaalsContact O-N 3.08Å; Y501-Y602 HydrophobicContact CE1-CE1 4.42Å; Y501-F606 HydrophobicContact CD1-CE2 4.14Å; Y501-F606 HydrophobicContact CD2-CZ 4.3Å; Y501-F606 HydrophobicContact CG-CE2 4.03Å; Y501-F606 HydrophobicContact CG-CZ 4.06Å
502	S	90.5	Very high	76.4	Confident	33 Å²	33	48.4 Å²	48.4	23%	0.231	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.9	175.9	80.3	0	0	0	0	113.8	K464 I498 S499 M500 H505	K464-S502 PolarHBondContact NZ-OG 2.98Å; I498-S502 PolarHBondContact O-N 3.23Å; S499-S502 WeakPolarHBondContact O-CB 3.38Å; S499-S502 PolarHBondContact O-N 3.05Å; S499-S502 PolarHBondContact O-OG 2.87Å; M500-S502 PolarHBondContact O-N 3.15Å; S502-H505 PolarHBondContact O-CE1 3.32Å; S502-H505 PolarHBondContact O-ND1 3.39Å
503	F	88.5	Confident	74.2	Confident	9 Å²	9	50.4 Å²	50.4	4%	0.039	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-6.8	177.2	-63.3	-61.7	0	0	0	114.6	C404 Y457 L460 A461 K464 S499 M500 Y501 H505 L506	C404-F503 HydrophobicContact CB-CE1 3.84Å; Y457-F503 HydrophobicContact CD1-CB 3.91Å; Y457-F503 WeakPolarHBondContact CE1-O 3.2Å; Y457-F503 HydrophobicContact CG-CB 4.29Å; L460-F503 HydrophobicContact CB-CD2 3.89Å; L460-F503 HydrophobicContact CB-CE1 4.44Å; L460-F503 HydrophobicContact CB-CE2 3.72Å; L460-F503 HydrophobicContact CB-CG 4.3Å; L460-F503 HydrophobicContact CB-CZ 3.99Å; L460-F503 HydrophobicContact CD1-CD1 4.34Å; L460-F503 HydrophobicContact CD1-CG 4.4Å; A461-F503 HydrophobicContact CB-CD2 4.41Å; A461-F503 HydrophobicContact CB-CE2 4.37Å; K464-F503 HydrophobicContact CB-CE2 4.32Å; K464-F503 HydrophobicContact CB-CZ 4.25Å; K464-F503 HydrophobicContact CD-CE2 3.77Å; K464-F503 HydrophobicContact CD-CZ 3.49Å; K464-F503 VanDerWaalsContact CD-CZ 3.49Å; S499-F503 WeakPolarHBondContact O-CD2 3.37Å; M500-F503 PolarHBondContact O-N 3.1Å; Y501-F503 PolarHBondContact O-N 3.47Å; Y501-F503 VanDerWaalsContact O-N 3.1Å; F503-H505 PolarHBondContact O-N 3.29Å; F503-H505 VanDerWaalsContact O-N 3.15Å; F503-L506 HydrophobicContact CB-CD1 4.04Å; F503-L506 HydrophobicContact CD1-CD1 3.95Å; F503-L506 HydrophobicContact CG-CD1 4.42Å; F503-L506 VanDerWaalsContact O-CB 3.24Å; F503-L506 WeakPolarHBondContact O-CB 3.21Å; F503-L506 VanDerWaalsContact O-CG 3.27Å; F503-L506 WeakPolarHBondContact O-CG 3.42Å; F503-L506 PolarHBondContact O-N 2.9Å
504	H	81.1	Confident	72.3	Confident	41 Å²	41	49.6 Å²	49.6	19%	0.19	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-54.8	-38.1	-176.4	-174.6	-7.4	0	0	0	113.2	W150 Y450 Y457 M500 Y501 L506 K507	W150-H504 AromaticContact CE2-CD2 3.51Å; W150-H504 AromaticContact CE2-NE2 3.96Å; W150-H504 HydrophobicContact CH2-CB 4.32Å; W150-H504 HydrophobicContact CZ2-CB 4.05Å; W150-H504 AromaticContact CZ2-CD2 3.29Å; W150-H504 WeakPolarHBondContact CZ2-CD2 3.39Å; W150-H504 AromaticContact CZ2-CG 3.7Å; W150-H504 AromaticContact CZ2-NE2 3.9Å; W150-H504 AromaticContact NE1-CD2 3.47Å; W150-H504 PolarHBondContact NE1-CD2 3Å; W150-H504 AromaticContact NE1-NE2 3.51Å; Y450-H504 AromaticContact CE1-CE1 3.59Å; Y450-H504 AromaticContact CE1-NE2 3.97Å; Y450-H504 AromaticContact CZ-CE1 3.67Å; Y450-H504 AromaticContact CZ-NE2 3.56Å; Y450-H504 PolarHBondContact OH-NE2 3.49Å; Y457-H504 PolarHBondContact OH-O 3.47Å; Y457-H504 VanDerWaalsContact OH-O 3.1Å; M500-H504 PolarHBondContact O-N 2.83Å; Y501-H504 VanDerWaalsContact O-CB 3.31Å; Y501-H504 WeakPolarHBondContact O-CB 3.29Å; Y501-H504 PolarHBondContact O-N 3.45Å; Y501-H504 VanDerWaalsContact O-N 3.08Å; H504-L506 PolarHBondContact O-N 3.04Å; H504-K507 WeakPolarHBondContact O-CB 3.42Å; H504-K507 PolarHBondContact O-N 3.01Å
505	H	75.1	Confident	70.4	Confident	122 Å²	122	49.7 Å²	49.7	57%	0.565	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-56.8	-20.1	177.5	73.2	-88.5	0	0	0	114.4	S502 F503 K507	S502-H505 PolarHBondContact O-CE1 3.32Å; S502-H505 PolarHBondContact O-ND1 3.39Å; F503-H505 PolarHBondContact O-N 3.29Å; F503-H505 VanDerWaalsContact O-N 3.15Å; H505-K507 PolarHBondContact O-N 3.27Å
506	L	73.2	Confident	68.3	Low	1 Å²	1	53.9 Å²	53.9	1%	0.005	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-67	-11	176	-60.9	174.4	0	0	0	113.3	L400 Y457 L460 F503 H504 R508 F509 N510	L400-L506 HydrophobicContact CD2-CD1 4.42Å; Y457-L506 HydrophobicContact CE1-CB 4.17Å; L460-L506 HydrophobicContact CD1-CD1 4.15Å; F503-L506 HydrophobicContact CB-CD1 4.04Å; F503-L506 HydrophobicContact CD1-CD1 3.95Å; F503-L506 HydrophobicContact CG-CD1 4.42Å; F503-L506 VanDerWaalsContact O-CB 3.24Å; F503-L506 WeakPolarHBondContact O-CB 3.21Å; F503-L506 VanDerWaalsContact O-CG 3.27Å; F503-L506 WeakPolarHBondContact O-CG 3.42Å; F503-L506 PolarHBondContact O-N 2.9Å; H504-L506 PolarHBondContact O-N 3.04Å; L506-R508 PolarHBondContact O-N 2.88Å; L506-F509 PolarHBondContact O-N 2.81Å; L506-N510 PolarHBondContact O-N 2.8Å
507	K	58.9	Low	66.1	Low	77 Å²	77	57.3 Å²	57.3	34%	0.335	28%	0.28	S	S	.	.	H	α-helix	trans	-46.2	-38	175.7	-167.3	-179.1	-178.1	-169.2	0	112.6	Y457 H504 H505 F509 T511	Y457-K507 WeakPolarHBondContact OH-CA 2.81Å; Y457-K507 WeakPolarHBondContact OH-CB 3.46Å; Y457-K507 PolarHBondContact OH-N 2.91Å; Y457-K507 VanDerWaalsContact OH-N 3.15Å; H504-K507 WeakPolarHBondContact O-CB 3.42Å; H504-K507 PolarHBondContact O-N 3.01Å; H505-K507 PolarHBondContact O-N 3.27Å; K507-F509 VanDerWaalsContact C-N 3.27Å; K507-F509 PolarHBondContact O-N 3.41Å; K507-T511 PolarHBondContact O-OG1 3.47Å
508	R	46.8	Very low	64.2	Low	162 Å²	162	59 Å²	59	61%	0.611	29%	0.286	S	S	*	.	H	α-helix	trans	-66.5	-22.6	-178.7	-158.7	172.8	-169	162.7	8.3	114.3	L506	L506-R508 PolarHBondContact O-N 2.88Å
509	F	44.3	Very low	62.1	Low	101 Å²	101	62.3 Å²	62.3	44%	0.443	30%	0.3	S	S	.	.	H	α-helix	trans	-96	-35.4	-175.7	-72.6	-82.5	0	0	0	113.8	R403 L506 K507	R403-F509 VanDerWaalsContact NH2-CE2 3.31Å; L506-F509 PolarHBondContact O-N 2.81Å; K507-F509 VanDerWaalsContact C-N 3.27Å; K507-F509 PolarHBondContact O-N 3.41Å
510	N	46.1	Very low	59.7	Low	17 Å²	17	65.9 Å²	65.9	9%	0.091	32%	0.321	C	S	.	.	H	α-helix	trans	-77.5	-43.5	-178.7	-74.4	-2	0	0	0	112.6	L400 L506 S512 N513 M514	L400-N510 VanDerWaalsContact CD1-ND2 3.28Å; L400-N510 WeakPolarHBondContact CD1-ND2 3.29Å; L400-N510 WeakPolarHBondContact CD1-OD1 3.27Å; L506-N510 PolarHBondContact O-N 2.8Å; N510-S512 VanDerWaalsContact C-N 3.3Å; N510-S512 PolarHBondContact O-N 3.07Å; N510-N513 PolarHBondContact O-N 3.37Å; N510-M514 VanDerWaalsContact O-CB 3.28Å; N510-M514 WeakPolarHBondContact O-CB 3.28Å; N510-M514 WeakPolarHBondContact O-CG 3.46Å; N510-M514 PolarHBondContact O-N 3.02Å
511	T	46.9	Very low	57	Low	40 Å²	40	67.3 Å²	67.3	25%	0.245	33%	0.333	C	S	.	.	H	α-helix	trans	-64	-32.8	-169.6	-46.8	0	0	0	0	112.9	K507 N515	K507-T511 PolarHBondContact O-OG1 3.47Å; T511-N515 WeakPolarHBondContact CG2-ND2 3.37Å; T511-N515 WeakPolarHBondContact O-CB 3.4Å; T511-N515 PolarHBondContact O-N 3.37Å; T511-N515 PolarHBondContact O-ND2 2.97Å
512	S	41.6	Very low	54.5	Low	63 Å²	63	66 Å²	66	44%	0.441	34%	0.335	S	S	.	.	H	α-helix	trans	-79.6	-38.2	-178.2	55.7	0	0	0	0	114	N510 K516	N510-S512 VanDerWaalsContact C-N 3.3Å; N510-S512 PolarHBondContact O-N 3.07Å; S512-K516 WeakPolarHBondContact O-CD 3.41Å; S512-K516 WeakPolarHBondContact O-CG 3.47Å
513	N	41.4	Very low	51.8	Low	109 Å²	109	73.8 Å²	73.8	58%	0.583	36%	0.359	S	S	*	.	H	α-helix	trans	-84.6	-45.5	178.9	-82.5	-10.9	0	0	0	112.2	N510 N515 K516 T517	N510-N513 PolarHBondContact O-N 3.37Å; N513-N515 PolarHBondContact O-N 3.44Å; N513-K516 PolarHBondContact O-N 3.13Å; N513-T517 PolarHBondContact O-N 3.11Å; N513-T517 PolarHBondContact O-OG1 3.1Å
514	M	47.8	Very low	49.2	Very low	7 Å²	7	79.5 Å²	79.5	3%	0.034	39%	0.386	C	S	.	.	H	α-helix	trans	-67.2	-38.5	-178.1	-65	-153.4	77.8	0	0	112	Y393 D396 F456 N510 K516 T517 R518	Y393-M514 HydrophobicContact CD1-CE 3.83Å; Y393-M514 HydrophobicContact CE1-CE 4.11Å; D396-M514 HydrophobicContact CB-CE 3.74Å; D396-M514 HydrophobicContact CB-CG 4.38Å; D396-M514 HydrophobicContact CB-SD 3.85Å; D396-M514 WeakPolarHBondContact OD2-CE 3.38Å; D396-M514 WeakPolarHBondContact OD2-CG 3.37Å; F456-M514 HydrophobicContact CZ-CE 4.47Å; F456-M514 HydrophobicContact CZ-SD 4.28Å; N510-M514 VanDerWaalsContact O-CB 3.28Å; N510-M514 WeakPolarHBondContact O-CB 3.28Å; N510-M514 WeakPolarHBondContact O-CG 3.46Å; N510-M514 PolarHBondContact O-N 3.02Å; M514-K516 VanDerWaalsContact C-N 3.34Å; M514-K516 PolarHBondContact O-N 2.84Å; M514-T517 PolarHBondContact O-N 2.93Å; M514-R518 VanDerWaalsContact CE-NH2 3.25Å; M514-R518 VanDerWaalsContact O-CB 3.25Å; M514-R518 WeakPolarHBondContact O-CB 3.29Å; M514-R518 WeakPolarHBondContact O-CD 3.3Å; M514-R518 WeakPolarHBondContact O-CG 3.34Å; M514-R518 PolarHBondContact O-N 2.93Å; M514-R518 PolarHBondContact SD-NH2 3.49Å
515	N	49.1	Very low	47	Very low	56 Å²	56	78.8 Å²	78.8	30%	0.299	39%	0.386	S	S	.	.	H	α-helix	trans	-66	-35.7	179.1	-69.9	-1.9	0	0	0	112.5	T511 N513 R518 Q519	T511-N515 WeakPolarHBondContact CG2-ND2 3.37Å; T511-N515 WeakPolarHBondContact O-CB 3.4Å; T511-N515 PolarHBondContact O-N 3.37Å; T511-N515 PolarHBondContact O-ND2 2.97Å; N513-N515 PolarHBondContact O-N 3.44Å; N515-R518 PolarHBondContact O-N 3.18Å; N515-Q519 WeakPolarHBondContact O-CB 3.43Å; N515-Q519 WeakPolarHBondContact O-CG 3.44Å; N515-Q519 PolarHBondContact O-N 2.76Å
516	K	46.7	Very low	44.8	Very low	147 Å²	147	77.2 Å²	77.2	64%	0.639	38%	0.381	S	S	*	.	H	α-helix	trans	-64.4	-49.3	176.2	-74.4	178.9	179.9	-176.9	0	111.8	S512 N513 M514 R518	S512-K516 WeakPolarHBondContact O-CD 3.41Å; S512-K516 WeakPolarHBondContact O-CG 3.47Å; N513-K516 PolarHBondContact O-N 3.13Å; M514-K516 VanDerWaalsContact C-N 3.34Å; M514-K516 PolarHBondContact O-N 2.84Å; K516-R518 VanDerWaalsContact C-N 3.33Å; K516-R518 PolarHBondContact O-N 2.93Å
517	T	47.1	Very low	42.9	Very low	72 Å²	72	84.1 Å²	84.1	44%	0.442	41%	0.412	S	S	.	.	H	α-helix	trans	-64.3	-38.8	178	-48	0	0	0	0	111.8	L392 N513 M514	L392-T517 HydrophobicContact CD2-CG2 4.31Å; N513-T517 PolarHBondContact O-N 3.11Å; N513-T517 PolarHBondContact O-OG1 3.1Å; M514-T517 PolarHBondContact O-N 2.93Å
518	R	53	Low	41.7	Very low	39 Å²	39	83.3 Å²	83.3	15%	0.147	42%	0.419	C	S	.	.	H	α-helix	trans	-74.3	-32.6	-178.8	-68.5	170.3	-167.8	171.1	4.7	114	E452 M514 N515 K516 V520 A521 S522	E452-R518 IonicContact OE1-CZ 2.58Å; E452-R518 VanDerWaalsContact OE1-CZ 3.23Å; E452-R518 IonicContact OE1-NH1 2.77Å; E452-R518 PolarHBondContact OE1-NH1 2.85Å; E452-R518 IonicContact OE1-NH2 3.92Å; E452-R518 PolarHBondContact OE1-NH2 3.19Å; E452-R518 IonicContact OE2-NH1 3.87Å; M514-R518 VanDerWaalsContact CE-NH2 3.25Å; M514-R518 VanDerWaalsContact O-CB 3.25Å; M514-R518 WeakPolarHBondContact O-CB 3.29Å; M514-R518 WeakPolarHBondContact O-CD 3.3Å; M514-R518 WeakPolarHBondContact O-CG 3.34Å; M514-R518 PolarHBondContact O-N 2.93Å; M514-R518 PolarHBondContact SD-NH2 3.49Å; N515-R518 PolarHBondContact O-N 3.18Å; K516-R518 VanDerWaalsContact C-N 3.33Å; K516-R518 PolarHBondContact O-N 2.93Å; R518-V520 PolarHBondContact O-N 3.18Å; R518-A521 PolarHBondContact O-N 2.83Å; R518-S522 WeakPolarHBondContact O-CB 3.45Å; R518-S522 PolarHBondContact O-N 2.66Å; R518-S522 PolarHBondContact O-OG 3.42Å
519	Q	46.7	Very low	40.9	Very low	126 Å²	126	80.3 Å²	80.3	59%	0.589	41%	0.413	S	S	*	.	H	α-helix	trans	-61.8	-31	177.5	-85.2	-179.3	-3.1	0	0	112.7	N515 S522 R523	N515-Q519 WeakPolarHBondContact O-CB 3.43Å; N515-Q519 WeakPolarHBondContact O-CG 3.44Å; N515-Q519 PolarHBondContact O-N 2.76Å; Q519-S522 WeakPolarHBondContact CA-OG 3.44Å; Q519-S522 PolarHBondContact O-OG 3.41Å; Q519-R523 PolarHBondContact O-N 3.04Å
520	V	43.7	Very low	40.4	Very low	85 Å²	85	82 Å²	82	52%	0.515	43%	0.427	S	S	.	.	H	α-helix	trans	-68	-57.6	173.7	-177.6	0	0	0	0	109.7	R518 S522 R523 E524	R518-V520 PolarHBondContact O-N 3.18Å; V520-S522 VanDerWaalsContact C-N 3.3Å; V520-S522 PolarHBondContact O-N 2.95Å; V520-R523 PolarHBondContact O-N 3.43Å; V520-R523 VanDerWaalsContact O-N 3.11Å; V520-E524 PolarHBondContact O-N 2.87Å
521	A	36.8	Very low	39.9	Very low	29 Å²	29	87.7 Å²	87.7	24%	0.24	45%	0.453	C	S	.	.	H	α-helix	trans	-62.1	-31.5	-179.8	0	0	0	0	0	113.9	R518 S525	R518-A521 PolarHBondContact O-N 2.83Å; A521-S525 PolarHBondContact O-N 3.49Å; A521-S525 VanDerWaalsContact O-N 3.09Å; A521-S525 PolarHBondContact O-OG 2.92Å
522	S	39.6	Very low	39	Very low	51 Å²	51	92 Å²	92	36%	0.357	47%	0.473	S	S	.	.	H	α-helix	trans	-72.9	-34.4	176.2	66.8	0	0	0	0	112.4	R518 Q519 V520 S525 L526	R518-S522 WeakPolarHBondContact O-CB 3.45Å; R518-S522 PolarHBondContact O-N 2.66Å; R518-S522 PolarHBondContact O-OG 3.42Å; Q519-S522 WeakPolarHBondContact CA-OG 3.44Å; Q519-S522 PolarHBondContact O-OG 3.41Å; V520-S522 VanDerWaalsContact C-N 3.3Å; V520-S522 PolarHBondContact O-N 2.95Å; S522-S525 WeakPolarHBondContact CA-OG 3.49Å; S522-S525 PolarHBondContact O-OG 3.39Å; S522-L526 VanDerWaalsContact O-CB 3.31Å; S522-L526 WeakPolarHBondContact O-CB 3.45Å; S522-L526 PolarHBondContact O-N 3.5Å
523	R	32.6	Very low	38.3	Very low	195 Å²	195	93.1 Å²	93.1	74%	0.736	48%	0.479	S	S	*	.	H	α-helix	trans	-65.5	-44.2	174.1	-94.4	-175.6	162.1	172.3	-3	111.3	Q519 V520 L526 F527	Q519-R523 PolarHBondContact O-N 3.04Å; V520-R523 PolarHBondContact O-N 3.43Å; V520-R523 VanDerWaalsContact O-N 3.11Å; R523-L526 PolarHBondContact O-N 3.27Å; R523-F527 WeakPolarHBondContact O-CB 3.34Å; R523-F527 PolarHBondContact O-N 3.1Å
524	E	34.5	Very low	37.7	Very low	129 Å²	129	96.5 Å²	96.5	60%	0.603	50%	0.496	S	S	*	.	H	α-helix	trans	-64.9	-41.4	179.1	-68.7	164.4	167.4	0	0	111.7	V520 F527 A528	V520-E524 PolarHBondContact O-N 2.87Å; E524-F527 WeakPolarHBondContact O-CB 3.44Å; E524-F527 PolarHBondContact O-N 3.39Å; E524-A528 PolarHBondContact O-N 3.06Å
525	S	34.3	Very low	36.7	Very low	27 Å²	27	106 Å²	106	19%	0.189	53%	0.534	C	S	.	.	H	α-helix	trans	-75.4	-29.7	177.1	48.9	0	0	0	0	114.5	A521 S522 M529	A521-S525 PolarHBondContact O-N 3.49Å; A521-S525 VanDerWaalsContact O-N 3.09Å; A521-S525 PolarHBondContact O-OG 2.92Å; S522-S525 WeakPolarHBondContact CA-OG 3.49Å; S522-S525 PolarHBondContact O-OG 3.39Å; S525-M529 WeakPolarHBondContact O-CB 3.34Å; S525-M529 WeakPolarHBondContact O-CE 3.42Å; S525-M529 PolarHBondContact O-N 2.73Å
526	L	30.7	Very low	35.7	Very low	89 Å²	89	111.1 Å²	111.1	47%	0.466	56%	0.56	S	S	.	*	H	α-helix	trans	-66.2	-38.4	166.2	-91.1	157.3	0	0	0	111.8	S522 R523 M529 N530	S522-L526 VanDerWaalsContact O-CB 3.31Å; S522-L526 WeakPolarHBondContact O-CB 3.45Å; S522-L526 PolarHBondContact O-N 3.5Å; R523-L526 PolarHBondContact O-N 3.27Å; L526-M529 PolarHBondContact O-N 2.89Å; L526-N530 WeakPolarHBondContact O-CB 3.34Å; L526-N530 PolarHBondContact O-N 2.9Å; L526-N530 PolarHBondContact O-ND2 2.91Å
527	F	32.1	Very low	34.7	Very low	146 Å²	146	108.7 Å²	108.7	64%	0.64	56%	0.562	S	S	*	*	H	α-helix	trans	-64.8	-40.5	175.9	-149.7	-99.8	0	0	0	111.4	R523 E524 Q531	R523-F527 WeakPolarHBondContact O-CB 3.34Å; R523-F527 PolarHBondContact O-N 3.1Å; E524-F527 WeakPolarHBondContact O-CB 3.44Å; E524-F527 PolarHBondContact O-N 3.39Å; F527-Q531 WeakPolarHBondContact O-CG 3.24Å
528	A	34.2	Very low	33.7	Very low	59 Å²	59	114.5 Å²	114.5	49%	0.488	58%	0.581	S	S	.	*	H	α-helix	trans	-67.1	-43.5	174.2	0	0	0	0	0	113.1	E524 N530 Q531	E524-A528 PolarHBondContact O-N 3.06Å; A528-N530 VanDerWaalsContact C-N 3.33Å; A528-N530 PolarHBondContact O-N 2.99Å; A528-Q531 PolarHBondContact O-N 3.24Å; A528-Q531 VanDerWaalsContact O-N 3.16Å
529	M	30.9	Very low	32.6	Very low	100 Å²	100	119.1 Å²	119.1	49%	0.493	61%	0.608	S	S	.	*	H	α-helix	trans	-66.1	-32.9	177.5	-82.8	-175.4	-84.9	0	0	113.1	S525 L526 Q531 L532	S525-M529 WeakPolarHBondContact O-CB 3.34Å; S525-M529 WeakPolarHBondContact O-CE 3.42Å; S525-M529 PolarHBondContact O-N 2.73Å; L526-M529 PolarHBondContact O-N 2.89Å; M529-Q531 PolarHBondContact O-N 3.26Å; M529-L532 PolarHBondContact O-N 2.89Å
530	N	33.8	Very low	31.8	Very low	135 Å²	135	121.3 Å²	121.3	72%	0.722	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-2.9	175.1	-73.1	-27.5	0	0	0	114.1	L526 A528	L526-N530 WeakPolarHBondContact O-CB 3.34Å; L526-N530 PolarHBondContact O-N 2.9Å; L526-N530 PolarHBondContact O-ND2 2.91Å; A528-N530 VanDerWaalsContact C-N 3.33Å; A528-N530 PolarHBondContact O-N 2.99Å
531	Q	34.2	Very low	31	Very low	137 Å²	137	123.8 Å²	123.8	64%	0.64	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	1.1	175.1	-71.1	-171.7	15.5	0	0	114	F527 A528 M529 P533	F527-Q531 WeakPolarHBondContact O-CG 3.24Å; A528-Q531 PolarHBondContact O-N 3.24Å; A528-Q531 VanDerWaalsContact O-N 3.16Å; M529-Q531 PolarHBondContact O-N 3.26Å; Q531-P533 WeakPolarHBondContact O-CD 3.14Å
532	L	28.4	Very low	30.6	Very low	130 Å²	130	129.3 Å²	129.3	68%	0.681	67%	0.67	S	S	*	*	S	Bend	trans	-74.6	119.4	171.3	-92.1	150.1	0	0	0	110.3	M529 L534	M529-L532 PolarHBondContact O-N 2.89Å; L532-L534 PolarHBondContact O-N 3.03Å
533	P	27.4	Very low	29.9	Very low	87 Å²	87	130.6 Å²	130.6	57%	0.565	69%	0.692	S	S	*	*			trans	-69.6	132.2	-177.7	26.6	-33.2	0	0	0	111.6	Q531 Y535	Q531-P533 WeakPolarHBondContact O-CD 3.14Å; P533-Y535 HydrophobicContact CB-CD2 3.7Å; P533-Y535 HydrophobicContact CB-CE2 3.7Å; P533-Y535 HydrophobicContact CG-CD2 3.73Å; P533-Y535 HydrophobicContact CG-CE2 3.75Å; P533-Y535 PolarHBondContact O-N 3.11Å
534	L	28.6	Very low	29.7	Very low	180 Å²	180	127 Å²	127	94%	0.942	70%	0.696	S	S	*	*			trans	-70.2	72	174.8	-74.7	167.7	0	0	0	111.7	L532 L536	L532-L534 PolarHBondContact O-N 3.03Å; L534-L536 VanDerWaalsContact C-N 3.27Å; L534-L536 PolarHBondContact O-N 3.3Å
535	Y	26.4	Very low	29.2	Very low	208 Å²	208	127 Å²	127	82%	0.816	71%	0.705	S	S	*	*			trans	-77.7	76.2	170.7	-84.1	-82.3	0	0	0	111.6	P533	P533-Y535 HydrophobicContact CB-CD2 3.7Å; P533-Y535 HydrophobicContact CB-CE2 3.7Å; P533-Y535 HydrophobicContact CG-CD2 3.73Å; P533-Y535 HydrophobicContact CG-CE2 3.75Å; P533-Y535 PolarHBondContact O-N 3.11Å
536	L	27.7	Very low	28.8	Very low	162 Å²	162	135.7 Å²	135.7	85%	0.848	74%	0.74	S	S	*	*			trans	-96.1	97.9	148.8	-101.6	161.6	0	0	0	107	L534 K538	L534-L536 VanDerWaalsContact C-N 3.27Å; L534-L536 PolarHBondContact O-N 3.3Å; L536-K538 PolarHBondContact O-N 3.42Å
537	S	27.2	Very low	28.5	Very low	97 Å²	97	142.8 Å²	142.8	68%	0.678	76%	0.761	S	S	*	*			trans	-54.4	123.5	-178.1	-173.7	0	0	0	0	111
538	K	25.8	Very low	28	Very low	194 Å²	194	145.7 Å²	145.7	84%	0.843	77%	0.773	S	S	*	*			trans	-104.1	67.6	166.1	-75.7	-177.1	174.9	176.9	0	108.9	L536	L536-K538 PolarHBondContact O-N 3.42Å
539	D	28.7	Very low	27.7	Very low	136 Å²	136	148.8 Å²	148.8	73%	0.727	79%	0.788	S	S	*	*			trans	-150.3	97.1	167.4	-84.8	-48.3	0	0	0	109.7
540	D	29.8	Very low	27.4	Very low	172 Å²	172	149.2 Å²	149.2	92%	0.92	80%	0.801	S	S	*	*			trans	-168.5	74.7	148.7	-104.5	-22.8	0	0	0	108
541	V	27.8	Very low	27	Very low	137 Å²	137	148.5 Å²	148.5	83%	0.83	80%	0.802	S	S	*	*			trans	-103.3	98.6	177	177.7	0	0	0	0	109.6
542	T	27.8	Very low	26.8	Very low	144 Å²	144	152.9 Å²	152.9	88%	0.883	81%	0.814	S	S	*	*			trans	-161.8	128.1	142.8	40.1	0	0	0	0	111.8
543	G	26.1	Very low	26.8	Very low	79 Å²	79	151.6 Å²	151.6	81%	0.814	82%	0.816	S	S	*	*			trans	93.7	66.5	143.4	0	0	0	0	0	120.1
544	S	27.5	Very low	26.7	Very low	119 Å²	119	155.1 Å²	155.1	83%	0.832	83%	0.829	S	S	*	*				-173.1	119.3	122.9	60.9	0	0	0	0	112.6
545	T	23.4	Very low	26.7	Very low	128 Å²	128	152.3 Å²	152.3	79%	0.785	82%	0.821	S	S	*	*			trans	-64	137.5	169.1	41.5	0	0	0	0	113
546	F	25.6	Very low	26.7	Very low	211 Å²	211	152.8 Å²	152.8	93%	0.925	82%	0.821	S	S	*	*			trans	-153.9	150.2	135.2	-106	-73.1	0	0	0	111.4
547	R	26	Very low	26.8	Very low	238 Å²	238	151.9 Å²	151.9	90%	0.898	82%	0.817	S	S	*	*			trans	-93.7	147.6	-164.4	-65.2	175.1	176.5	167	-2.4	113.5
548	F	21.6	Very low	26.9	Very low	207 Å²	207	151.5 Å²	151.5	91%	0.908	82%	0.815	S	S	*	*			trans	-74.1	149.7	159.6	-76.9	-90.4	0	0	0	111.9
549	P	28.1	Very low	27.1	Very low	123 Å²	123	150.6 Å²	150.6	80%	0.799	81%	0.811	S	S	*	*			trans	-114.1	122.6	151.9	19.5	-0.9	0	0	0	111.4
550	S	23.9	Very low	27	Very low	109 Å²	109	151 Å²	151	76%	0.762	81%	0.808	S	S	*	*			trans	-93.6	123.7	168.5	54.8	0	0	0	0	110.9
551	T	25.8	Very low	27	Very low	121 Å²	121	149.1 Å²	149.1	74%	0.742	81%	0.807	S	S	*	*			trans	-178.8	133.5	151.5	28.7	0	0	0	0	109.2
552	Y	29.4	Very low	27	Very low	229 Å²	229	149.1 Å²	149.1	90%	0.898	80%	0.801	S	S	*	*				-168.2	155.6	116.3	-102.9	-68.8	0	0	0	110.3
553	S	29.3	Very low	27.4	Very low	103 Å²	103	147.3 Å²	147.3	72%	0.72	79%	0.791	S	S	*	*			trans	-122.5	159.1	-148.7	37.9	0	0	0	0	114.5
554	I	24	Very low	27.7	Very low	161 Å²	161	153 Å²	153	83%	0.826	79%	0.794	S	S	*	*			trans	-78.9	136.8	178.6	-60.4	163.7	0	0	0	110.8
555	P	29	Very low	28.1	Very low	121 Å²	121	153 Å²	153	79%	0.786	79%	0.793	S	S	*	*			trans	-91.9	148.1	157.2	-4.9	24.8	0	0	0	111.9
556	R	26.5	Very low	28.4	Very low	218 Å²	218	150.3 Å²	150.3	82%	0.823	79%	0.792	S	S	*	*			trans	-110.3	172.5	-179	-131	-174.3	-161.6	-175.4	4.7	111
557	D	29	Very low	28.9	Very low	142 Å²	142	146.2 Å²	146.2	76%	0.759	79%	0.786	S	S	*	*			trans	77.2	143.2	166.9	-43.8	-32.2	0	0	0	114.9
558	S	29.1	Very low	29.2	Very low	89 Å²	89	142.7 Å²	142.7	62%	0.622	78%	0.784	S	S	*	*			cis	-162.7	168.1	12.9	-150.6	0	0	0	0	115.5
559	F	30.2	Very low	29.5	Very low	176 Å²	176	139.1 Å²	139.1	77%	0.772	77%	0.774	S	S	*	*			trans	79.1	102.2	163.2	-60.1	-70.7	0	0	0	123.2
560	H	27.7	Very low	29.7	Very low	145 Å²	145	141.9 Å²	141.9	67%	0.671	78%	0.776	S	S	*	*				30.4	132.7	128	-64	-85.4	0	0	0	120.5
561	C	28.4	Very low	29.9	Very low	132 Å²	132	140.9 Å²	140.9	89%	0.892	77%	0.769	S	S	*	*				-143.8	170.5	65.3	-87.2	0	0	0	0	115.8
562	I	29.1	Very low	30	Very low	137 Å²	137	142 Å²	142	70%	0.703	78%	0.775	S	S	*	*			trans	-118.7	-175.6	-155.5	-15.1	178.3	0	0	0	112.6
563	P	36.5	Very low	29.9	Very low	105 Å²	105	141.1 Å²	141.1	68%	0.682	77%	0.77	S	S	*	*				-133.8	-164.6	-110.6	47.8	-29.7	0	0	0	115.2
564	K	32.1	Very low	29.7	Very low	200 Å²	200	140.6 Å²	140.6	87%	0.87	77%	0.766	S	S	*	*			trans	164.8	138.4	141.3	-88.1	153	-172.6	-178.8	0	107.6
565	S	35.4	Very low	30	Very low	117 Å²	117	139 Å²	139	82%	0.818	77%	0.767	S	S	*	*			cis	-155.8	142	5.4	46.3	0	0	0	0	109.8
566	G	30.8	Very low	29.9	Very low	73 Å²	73	142.4 Å²	142.4	75%	0.753	76%	0.764	S	S	*	*			trans	-97.7	-140.9	173.4	0	0	0	0	0	112.3
567	P	34.4	Very low	29.8	Very low	124 Å²	124	136.7 Å²	136.7	81%	0.805	76%	0.757	S	S	*	*			cis	-138.4	150.3	-26.5	37.8	-21.9	0	0	0	113.8
568	I	33	Very low	29.7	Very low	165 Å²	165	136.9 Å²	136.9	85%	0.846	76%	0.757	S	S	*	*			trans	-137	124.6	150.7	-61.8	-175.1	0	0	0	108.4
569	D	27.8	Very low	29.6	Very low	132 Å²	132	136.5 Å²	136.5	71%	0.706	75%	0.754	S	S	*	*			trans	-86.7	147.7	179.6	-172.9	1.4	0	0	0	110.3
570	H	32	Very low	29.5	Very low	181 Å²	181	134.4 Å²	134.4	84%	0.838	75%	0.751	S	S	*	*			trans	-172.2	100.7	149.2	-86.6	-29.2	0	0	0	111.8
571	S	29.1	Very low	29.4	Very low	88 Å²	88	136.2 Å²	136.2	62%	0.615	76%	0.76	S	S	*	*			trans	-29	145.1	159.5	60.1	0	0	0	0	117.9
572	V	28.1	Very low	29.5	Very low	144 Å²	144	135 Å²	135	87%	0.873	75%	0.753	S	S	*	*			trans	39	89.4	137.4	-170.8	0	0	0	0	115.8
573	R	27.1	Very low	29.4	Very low	210 Å²	210	134.5 Å²	134.5	79%	0.792	75%	0.752	S	S	*	*			trans	-133.6	114.7	159.3	-109.4	-178.2	-176.5	-173	3.2	111.6
574	S	25.5	Very low	29.1	Very low	92 Å²	92	133.4 Å²	133.4	64%	0.643	76%	0.759	S	S	*	*			trans	-50.9	134.9	156	167.8	0	0	0	0	109.3	R576	S574-R576 PolarHBondContact O-N 2.86Å
575	P	29.7	Very low	28.8	Very low	128 Å²	128	126.9 Å²	126.9	83%	0.831	74%	0.743	S	S	*	*			trans	-62.8	103.6	163.6	-16.4	30.7	0	0	0	107.5
576	R	26.8	Very low	28.4	Very low	192 Å²	192	128.7 Å²	128.7	73%	0.725	74%	0.742	S	S	*	*			trans	-54.4	148.4	176.7	-70.3	177.1	168.7	-164.1	-6.9	110	S574 I578	S574-R576 PolarHBondContact O-N 2.86Å; R576-I578 PolarHBondContact O-N 3.25Å
577	S	24.9	Very low	28.3	Very low	98 Å²	98	132 Å²	132	69%	0.685	74%	0.742	S	S	*	*			trans	-39	117.3	162.4	48.3	0	0	0	0	112.1	S579	S577-S579 PolarHBondContact O-N 2.83Å; S577-S579 VanDerWaalsContact O-N 3.09Å
578	I	27	Very low	28.1	Very low	147 Å²	147	133 Å²	133	75%	0.754	74%	0.74	S	S	*	*			trans	-77.3	79.4	147.1	-72.1	175	0	0	0	105.6	R576	R576-I578 PolarHBondContact O-N 3.25Å
579	S	26	Very low	27.9	Very low	81 Å²	81	128.9 Å²	128.9	57%	0.566	72%	0.72	S	S	*	*			trans	-73.1	126.9	153	47.9	0	0	0	0	107.5	S577	S577-S579 PolarHBondContact O-N 2.83Å; S577-S579 VanDerWaalsContact O-N 3.09Å
580	D	27.8	Very low	28.3	Very low	131 Å²	131	127.4 Å²	127.4	70%	0.701	71%	0.712	S	S	*	*	S	Bend	trans	55.7	150.7	169.2	-56.9	-34.8	0	0	0	116.8
581	E	26.8	Very low	28.3	Very low	184 Å²	184	126 Å²	126	86%	0.86	71%	0.705	S	S	*	*			trans	67.6	78.6	-178	-53.3	-177.6	175.1	0	0	115.8
582	S	29.3	Very low	28.3	Very low	107 Å²	107	132 Å²	132	75%	0.748	72%	0.716	S	S	*	*			trans	-137.1	98.2	147.5	48.7	0	0	0	0	110.9	G584	S582-G584 PolarHBondContact O-N 3.48Å
583	D	27.2	Very low	28.4	Very low	126 Å²	126	132.2 Å²	132.2	67%	0.674	71%	0.706	S	S	*	*			trans	-65.6	108.5	-178.4	-65	-68.9	0	0	0	112.6	A585	D583-A585 PolarHBondContact O-N 3.04Å
584	G	30	Very low	28.5	Very low	81 Å²	81	131.1 Å²	131.1	84%	0.835	71%	0.707	S	S	*	*			trans	-76.2	-2	167.2	0	0	0	0	0	114.1	S582	S582-G584 PolarHBondContact O-N 3.48Å
585	A	26	Very low	28.7	Very low	64 Å²	64	131 Å²	131	53%	0.529	70%	0.703	S	S	.	*			trans	-101.8	61.4	-174.7	0	0	0	0	0	112	D583	D583-A585 PolarHBondContact O-N 3.04Å
586	L	27.9	Very low	28.9	Very low	154 Å²	154	135.3 Å²	135.3	81%	0.806	71%	0.709	S	S	*	*			trans	-90.9	120.4	171.9	-71.7	176.4	0	0	0	111.9
587	D	27.3	Very low	29.3	Very low	142 Å²	142	129.8 Å²	129.8	76%	0.759	70%	0.7	S	S	*	*			trans	-54.2	132.2	172.2	-94.9	-46.4	0	0	0	112.5
588	I	29.8	Very low	29.8	Very low	146 Å²	146	129.7 Å²	129.7	75%	0.749	71%	0.714	S	S	*	*			trans	-142.1	121	154.4	-59.6	-176.2	0	0	0	107.7
589	D	29.1	Very low	30	Very low	79 Å²	79	129.3 Å²	129.3	42%	0.422	71%	0.709	S	S	.	*			trans	-63.6	129.4	177.9	-87.2	-68	0	0	0	113.4	Q591	D589-Q591 VanDerWaalsContact C-N 3.26Å; D589-Q591 HydrophobicContact CB-CB 4.47Å; D589-Q591 HydrophobicContact CB-CG 4.33Å; D589-Q591 PolarHBondContact O-N 2.7Å; D589-Q591 PolarHBondContact OD1-NE2 3.23Å
590	D	36.2	Very low	30.4	Very low	101 Å²	101	128 Å²	128	54%	0.54	70%	0.696	S	S	.	*			trans	-86.9	14.8	167.8	-88.5	-36.8	0	0	0	113.4	K143 Y592 F593	K143-D590 IonicContact NZ-OD1 3.68Å; K143-D590 PolarHBondContact NZ-OD1 2.91Å; D590-Y592 PolarHBondContact O-N 3.04Å; D590-F593 PolarHBondContact O-N 2.56Å
591	Q	31.7	Very low	30.5	Very low	151 Å²	151	125.3 Å²	125.3	71%	0.706	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-3.4	-179.9	-62.7	-168.9	50.4	0	0	114.6	D589	D589-Q591 VanDerWaalsContact C-N 3.26Å; D589-Q591 HydrophobicContact CB-CB 4.47Å; D589-Q591 HydrophobicContact CB-CG 4.33Å; D589-Q591 PolarHBondContact O-N 2.7Å; D589-Q591 PolarHBondContact OD1-NE2 3.23Å
592	Y	30	Very low	30.8	Very low	215 Å²	215	123.7 Å²	123.7	84%	0.843	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	3.8	-178	-84.1	-84.6	0	0	0	115.9	D590 K594	D590-Y592 PolarHBondContact O-N 3.04Å; Y592-K594 VanDerWaalsContact C-N 3.35Å; Y592-K594 PolarHBondContact O-N 2.72Å
593	F	30.3	Very low	30.8	Very low	148 Å²	148	119.9 Å²	119.9	65%	0.649	65%	0.647	S	S	*	*			trans	-91.2	42.5	177.6	-80	-60	0	0	0	115.1	K143 D590	K143-F593 VanDerWaalsContact CE-CE2 3.41Å; D590-F593 PolarHBondContact O-N 2.56Å
594	K	29.5	Very low	31	Very low	187 Å²	187	121.9 Å²	121.9	81%	0.813	65%	0.65	S	S	*	*			trans	-90.3	114.3	157.4	-78.4	-172.8	177.3	179.9	0	108.7	Y592 K596	Y592-K594 VanDerWaalsContact C-N 3.35Å; Y592-K594 PolarHBondContact O-N 2.72Å; K594-K596 PolarHBondContact O-N 2.94Å
595	P	29.4	Very low	31.2	Very low	88 Å²	88	118.6 Å²	118.6	57%	0.571	61%	0.614	S	S	*	*			trans	-67.3	128	178.3	29.3	-34.3	0	0	0	109.7	S597	P595-S597 PolarHBondContact O-N 3.47Å
596	K	33.5	Very low	31.6	Very low	220 Å²	220	117.4 Å²	117.4	96%	0.957	60%	0.597	S	S	*	*	S	Bend	trans	-78.3	4.4	177.7	-80.6	-171.7	173.3	-177.4	0	113.8	K594	K594-K596 PolarHBondContact O-N 2.94Å
597	S	36.1	Very low	31.9	Very low	76 Å²	76	113 Å²	113	53%	0.531	57%	0.573	S	S	.	*	S	Bend	trans	-148.3	151.9	176.5	50.8	0	0	0	0	109	P595 E599	P595-S597 PolarHBondContact O-N 3.47Å; S597-E599 PolarHBondContact O-N 3.46Å
598	G	35.3	Very low	32.4	Very low	95 Å²	95	107.9 Å²	107.9	98%	0.979	55%	0.547	S	S	*	.	S	Bend	trans	-72	25.2	-173.2	0	0	0	0	0	116.4
599	E	31	Very low	32.7	Very low	140 Å²	140	107 Å²	107	65%	0.654	53%	0.534	S	S	*	.			trans	-87.2	127.3	174.7	-67.9	-168.4	164.8	0	0	110.6	S597 P601	S597-E599 PolarHBondContact O-N 3.46Å; E599-P601 VanDerWaalsContact O-CD 3.29Å; E599-P601 WeakPolarHBondContact O-CD 3.32Å
600	N	33.9	Very low	33.1	Very low	53 Å²	53	113.1 Å²	113.1	28%	0.283	55%	0.553	S	S	.	*			trans	-70.3	114.6	175.9	-179.2	-8.9	0	0	0	110.3	Y602 A603 T618	N600-Y602 PolarHBondContact O-N 3.22Å; N600-Y602 VanDerWaalsContact OD1-CB 3.31Å; N600-Y602 WeakPolarHBondContact OD1-CB 3.36Å; N600-Y602 WeakPolarHBondContact OD1-CD2 3.3Å; N600-Y602 PolarHBondContact OD1-N 3.41Å; N600-A603 VanDerWaalsContact O-CB 3.29Å; N600-A603 WeakPolarHBondContact O-CB 3.48Å; N600-A603 PolarHBondContact O-N 3.36Å; N600-T618 HydrophobicContact CB-CG2 4.35Å
601	P	31.3	Very low	33.4	Very low	74 Å²	74	110.1 Å²	110.1	48%	0.481	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-66.1	-22.2	-178.3	28.2	-35.4	0	0	0	113.3	E599 A603	E599-P601 VanDerWaalsContact O-CD 3.29Å; E599-P601 WeakPolarHBondContact O-CD 3.32Å; P601-A603 PolarHBondContact O-N 3.06Å
602	Y	32.9	Very low	33.5	Very low	151 Å²	151	109.9 Å²	109.9	59%	0.592	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-70.1	-15.9	179.1	-52.8	-58.1	0	0	0	113.1	Y501 N600 K604	Y501-Y602 HydrophobicContact CE1-CE1 4.42Å; N600-Y602 PolarHBondContact O-N 3.22Å; N600-Y602 VanDerWaalsContact OD1-CB 3.31Å; N600-Y602 WeakPolarHBondContact OD1-CB 3.36Å; N600-Y602 WeakPolarHBondContact OD1-CD2 3.3Å; N600-Y602 PolarHBondContact OD1-N 3.41Å; Y602-K604 VanDerWaalsContact C-N 3.27Å; Y602-K604 PolarHBondContact O-N 3.34Å
603	A	28.2	Very low	33.6	Very low	26 Å²	26	104.9 Å²	104.9	22%	0.215	53%	0.528	C	S	.	.	G	3₁₀ helix	trans	-67.7	-20.5	-177.6	0	0	0	0	0	114.9	N600 P601 T616	N600-A603 VanDerWaalsContact O-CB 3.29Å; N600-A603 WeakPolarHBondContact O-CB 3.48Å; N600-A603 PolarHBondContact O-N 3.36Å; P601-A603 PolarHBondContact O-N 3.06Å; A603-T616 HydrophobicContact CB-CG2 3.66Å
604	K	31.3	Very low	33.7	Very low	169 Å²	169	101.8 Å²	101.8	74%	0.735	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-99.2	-12.5	-177.3	-77.9	179.4	177.7	167.1	0	114.8	Y602	Y602-K604 VanDerWaalsContact C-N 3.27Å; Y602-K604 PolarHBondContact O-N 3.34Å
605	V	34.8	Very low	33.8	Very low	12 Å²	12	98.2 Å²	98.2	7%	0.073	52%	0.523	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-17.9	-170.9	-167.4	0	0	0	0	112.6	E151	E151-V605 VanDerWaalsContact OE1-O 3.06Å
606	F	33.5	Very low	33.8	Very low	39 Å²	39	98.7 Å²	98.7	17%	0.171	53%	0.525	C	S	.	.			trans	-143.2	94.7	-175.5	-63.4	-68.3	0	0	0	111.9	I497 I498 Y501	I497-F606 HydrophobicContact CG2-CE1 4.14Å; I498-F606 HydrophobicContact CD1-CB 3.95Å; I498-F606 HydrophobicContact CD1-CD1 4.09Å; I498-F606 HydrophobicContact CD1-CG 4.06Å; I498-F606 HydrophobicContact CG1-CB 3.95Å; I498-F606 HydrophobicContact CG1-CD1 3.36Å; I498-F606 HydrophobicContact CG1-CD2 3.98Å; I498-F606 HydrophobicContact CG1-CE1 3.77Å; I498-F606 HydrophobicContact CG1-CE2 4.32Å; I498-F606 HydrophobicContact CG1-CG 3.48Å; I498-F606 VanDerWaalsContact CG1-CG 3.48Å; I498-F606 HydrophobicContact CG1-CZ 4.23Å; Y501-F606 HydrophobicContact CD1-CE2 4.14Å; Y501-F606 HydrophobicContact CD2-CZ 4.3Å; Y501-F606 HydrophobicContact CG-CE2 4.03Å; Y501-F606 HydrophobicContact CG-CZ 4.06Å
607	I	34.2	Very low	33.7	Very low	62 Å²	62	91.3 Å²	91.3	32%	0.318	50%	0.498	S	S	.	.			trans	-97.4	102.9	169	-58	176.3	0	0	0	107.1	Y116	Y116-I607 HydrophobicContact CE1-CG2 4.02Å; Y116-I607 WeakPolarHBondContact OH-CD1 3.26Å
608	T	37.7	Very low	33.3	Very low	34 Å²	34	91.7 Å²	91.7	21%	0.209	50%	0.497	C	S	.	.			trans	-85.6	161.1	-179.8	69	0	0	0	0	111.3	I498 Y610 N611	I498-T608 HydrophobicContact CD1-CG2 3.69Å; T608-Y610 PolarHBondContact O-N 3.43Å; T608-N611 PolarHBondContact O-N 3.22Å
609	R	36.8	Very low	33.1	Very low	127 Å²	127	94 Å²	94	48%	0.479	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-16	174.1	-76.3	-169.8	-177.1	-175.9	4.2	115.6	N78 I113	N78-R609 PolarHBondContact ND2-NH2 3.26Å; N78-R609 VanDerWaalsContact ND2-NH2 3.15Å; I113-R609 HydrophobicContact CG2-CG 4.44Å
610	Y	38.5	Very low	32.9	Very low	208 Å²	208	94.5 Å²	94.5	82%	0.816	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-11.7	-178	-59.7	-74.1	0	0	0	113.6	T608	T608-Y610 PolarHBondContact O-N 3.43Å
611	N	40.8	Very low	32.7	Very low	38 Å²	38	98.6 Å²	98.6	20%	0.203	51%	0.509	C	S	.	.	S	Bend	trans	-90.9	126.2	179	-66.8	-7.2	0	0	0	109.8	T608 V617	T608-N611 PolarHBondContact O-N 3.22Å; N611-V617 VanDerWaalsContact OD1-CG2 3.28Å; N611-V617 WeakPolarHBondContact OD1-CG2 3.42Å
612	K	34.5	Very low	32.6	Very low	146 Å²	146	101.9 Å²	101.9	64%	0.635	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-66.6	153	168.2	-66.8	178.8	-179.1	174.1	0	110.1	G614 Q615	K612-G614 PolarHBondContact O-N 3.46Å; K612-G614 VanDerWaalsContact O-N 3.1Å; K612-Q615 HydrophobicContact CB-CG 4.14Å; K612-Q615 PolarHBondContact O-N 2.94Å
613	P	32	Very low	32.2	Very low	110 Å²	110	98.9 Å²	98.9	71%	0.714	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	120.7	168.2	-25.7	34.5	0	0	0	110.5
614	G	32.4	Very low	32.2	Very low	83 Å²	83	104.8 Å²	104.8	86%	0.856	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	88.8	0.7	-177.9	0	0	0	0	0	117	K612	K612-G614 PolarHBondContact O-N 3.46Å; K612-G614 VanDerWaalsContact O-N 3.1Å
615	Q	32.2	Very low	31.9	Very low	111 Å²	111	101.1 Å²	101.1	52%	0.519	56%	0.561	S	S	.	*			trans	-91.3	109.5	170.6	-73.5	-168.6	-67.9	0	0	111.7	K612	K612-Q615 HydrophobicContact CB-CG 4.14Å; K612-Q615 PolarHBondContact O-N 2.94Å
616	T	28.3	Very low	31.6	Very low	98 Å²	98	107.6 Å²	107.6	60%	0.601	60%	0.595	S	S	*	*			trans	-83.2	121.5	170.7	48.7	0	0	0	0	110.2	A603	A603-T616 HydrophobicContact CB-CG2 3.66Å
617	V	31.8	Very low	31.2	Very low	65 Å²	65	111.4 Å²	111.4	39%	0.394	63%	0.627	S	S	.	*			trans	-98.3	105.3	173.5	179.6	0	0	0	0	109.1	N611 H619	N611-V617 VanDerWaalsContact OD1-CG2 3.28Å; N611-V617 WeakPolarHBondContact OD1-CG2 3.42Å; V617-H619 PolarHBondContact O-N 3.08Å
618	T	27.7	Very low	30.9	Very low	84 Å²	84	112.2 Å²	112.2	52%	0.515	64%	0.642	S	S	.	*			trans	-75.9	102.2	164.8	47.8	0	0	0	0	108.8	N600 D620	N600-T618 HydrophobicContact CB-CG2 4.35Å; T618-D620 PolarHBondContact O-N 3.09Å
619	H	31.5	Very low	30.5	Very low	143 Å²	143	118.6 Å²	118.6	66%	0.662	68%	0.675	S	S	*	*			trans	-81.2	104.3	161.4	-81.1	-69	0	0	0	108.6	V617 M621	V617-H619 PolarHBondContact O-N 3.08Å; H619-M621 PolarHBondContact O-N 3.34Å
620	D	27.1	Very low	30	Very low	151 Å²	151	116 Å²	116	81%	0.807	69%	0.688	S	S	*	*			trans	-65.7	101.3	171.5	-79.6	-36.8	0	0	0	109.8	T618 N622	T618-D620 PolarHBondContact O-N 3.09Å; D620-N622 PolarHBondContact O-N 3.05Å
621	M	28.7	Very low	29.7	Very low	139 Å²	139	112.8 Å²	112.8	69%	0.685	69%	0.691	S	S	*	*			trans	-88.5	52.8	176.4	-70.3	-78.3	-162.6	0	0	110.6	H619	H619-M621 PolarHBondContact O-N 3.34Å
622	N	29.7	Very low	28.8	Very low	143 Å²	143	117.6 Å²	117.6	77%	0.765	72%	0.715	S	S	*	*			trans	-142.6	105.3	168.9	-84.7	-34.5	0	0	0	109.3	D620 D624	D620-N622 PolarHBondContact O-N 3.05Å; N622-D624 VanDerWaalsContact C-N 3.32Å; N622-D624 PolarHBondContact O-N 3.11Å
623	G	25.5	Very low	28.5	Very low	88 Å²	88	122.9 Å²	122.9	91%	0.907	73%	0.731	S	S	*	*			trans	-82.5	80.3	166.4	0	0	0	0	0	109.6
624	D	27.4	Very low	28.2	Very low	150 Å²	150	126 Å²	126	80%	0.802	73%	0.733	S	S	*	*			trans	-138	145.9	170.1	-98	-42.8	0	0	0	111.7	N622	N622-D624 VanDerWaalsContact C-N 3.32Å; N622-D624 PolarHBondContact O-N 3.11Å
625	S	26	Very low	28	Very low	93 Å²	93	129 Å²	129	65%	0.65	74%	0.735	S	S	*	*			trans	-82.2	153.9	-169.2	54.7	0	0	0	0	114.7
626	N	26.6	Very low	27.9	Very low	147 Å²	147	131.1 Å²	131.1	79%	0.786	75%	0.75	S	S	*	*			trans	104.9	119.2	151.3	-58.1	-39.3	0	0	0	119.9
627	S	25.4	Very low	27.7	Very low	120 Å²	120	136.2 Å²	136.2	84%	0.839	76%	0.764	S	S	*	*				83.8	132.7	127.2	-163	0	0	0	0	121.9
628	A	29.4	Very low	27.4	Very low	78 Å²	78	138.6 Å²	138.6	65%	0.645	78%	0.784	S	S	*	*			trans	95.7	94.5	147.6	0	0	0	0	0	121.4
629	N	27.3	Very low	27.5	Very low	169 Å²	169	141.4 Å²	141.4	90%	0.904	80%	0.8	S	S	*	*				60.7	128.6	121.5	-64.7	-17.7	0	0	0	123.3
630	G	27.4	Very low	27.1	Very low	73 Å²	73	141.6 Å²	141.6	75%	0.753	80%	0.802	S	S	*	*			trans	105.9	134.4	156.4	0	0	0	0	0	114.3
631	T	31.2	Very low	27	Very low	140 Å²	140	141.9 Å²	141.9	86%	0.859	80%	0.796	S	S	*	*			cis	-152.4	152.1	-0.7	-53.1	0	0	0	0	109.6
632	L	23.7	Very low	26.8	Very low	138 Å²	138	141.5 Å²	141.5	72%	0.723	80%	0.801	S	S	*	*			trans	-64.1	147.3	-174.8	-67.6	83	0	0	0	114.4
633	R	27.7	Very low	26.4	Very low	257 Å²	257	142.7 Å²	142.7	97%	0.97	81%	0.808	S	S	*	*			trans	-141	133	130.8	-106.1	177.1	-173	-172.3	1.6	111.5
634	K	24.8	Very low	26.3	Very low	175 Å²	175	149.2 Å²	149.2	76%	0.761	81%	0.805	S	S	*	*			trans	-86.8	139.9	-173.1	-61.2	168.5	177.1	172.4	0	111.5
635	V	28.6	Very low	26.1	Very low	148 Å²	148	147.9 Å²	147.9	90%	0.897	81%	0.806	S	S	*	*			trans	-136.9	142.2	145.4	-176.9	0	0	0	0	109.2
636	N	29.2	Very low	26.1	Very low	155 Å²	155	149.5 Å²	149.5	83%	0.829	81%	0.812	S	S	*	*			trans	-70.9	166.3	-151.5	-70.7	-38.2	0	0	0	119.7
637	K	24.8	Very low	25.8	Very low	205 Å²	205	148.8 Å²	148.8	89%	0.891	81%	0.809	S	S	*	*			trans	-74.9	140.1	178.7	-58.5	168.5	174.3	178.4	0	114.3
638	S	26.4	Very low	25.9	Very low	115 Å²	115	148.8 Å²	148.8	80%	0.804	81%	0.806	S	S	*	*			trans	174.7	144.6	136.2	57.9	0	0	0	0	107.6
639	T	28.3	Very low	25.6	Very low	142 Å²	142	150 Å²	150	87%	0.871	81%	0.808	S	S	*	*			cis	-138.2	172.1	1.6	35.5	0	0	0	0	110.9
640	E	24.3	Very low	25.5	Very low	148 Å²	148	150.6 Å²	150.6	69%	0.692	80%	0.803	S	S	*	*			trans	-63.6	169.7	-173.4	-46	172.4	114.2	0	0	118.1
641	K	23.8	Very low	25.5	Very low	156 Å²	156	153.9 Å²	153.9	68%	0.678	80%	0.797	S	S	*	*			trans	67.7	99.9	149.8	-69.2	150.5	-173.8	158.4	0	118.4
642	T	24.3	Very low	25.2	Very low	131 Å²	131	156.7 Å²	156.7	80%	0.804	79%	0.792	S	S	*	*				176.8	130.4	96.5	30.5	0	0	0	0	112.7
643	N	22.8	Very low	25.2	Very low	169 Å²	169	158.4 Å²	158.4	90%	0.904	80%	0.796	S	S	*	*			trans	-76.2	119.7	162.5	-72	-23	0	0	0	109.2
644	R	23.7	Very low	25.1	Very low	224 Å²	224	151.9 Å²	151.9	85%	0.845	79%	0.785	S	S	*	*			trans	-143.1	109	156	-74	-161.4	176.6	172.7	1	112.2
645	C	22.2	Very low	25.1	Very low	122 Å²	122	151.6 Å²	151.6	82%	0.824	79%	0.786	S	S	*	*			trans	-65.9	141.4	153	-178	0	0	0	0	108.7
646	T	25.2	Very low	24.9	Very low	127 Å²	127	150.1 Å²	150.1	78%	0.779	77%	0.772	S	S	*	*			trans	-137.1	85.6	171.4	54	0	0	0	0	110.3
647	N	21.4	Very low	24.7	Very low	133 Å²	133	150.5 Å²	150.5	71%	0.711	77%	0.769	S	S	*	*			trans	-124.7	116.8	163.8	-161.7	12.8	0	0	0	107.4
648	P	27.9	Very low	24.7	Very low	119 Å²	119	145.6 Å²	145.6	77%	0.773	76%	0.76	S	S	*	*			trans	-100.8	104.5	179.6	32.2	-24.2	0	0	0	111.8
649	C	23.2	Very low	24.7	Very low	104 Å²	104	148.8 Å²	148.8	70%	0.703	76%	0.76	S	S	*	*			trans	-101.3	126.5	165.9	-55.7	0	0	0	0	110.3
650	F	25.1	Very low	24.4	Very low	182 Å²	182	151 Å²	151	80%	0.798	76%	0.761	S	S	*	*			trans	-156	139.4	167.5	-100.1	-98.6	0	0	0	106
651	F	26.4	Very low	24.5	Very low	142 Å²	142	150.2 Å²	150.2	62%	0.623	76%	0.757	S	S	*	*			cis	-160.5	125.5	-3.6	-143.3	-131	0	0	0	104.3
652	R	25.7	Very low	24.6	Very low	198 Å²	198	152 Å²	152	75%	0.747	76%	0.76	S	S	*	*				97.9	129.8	77.5	-161.6	-179.7	-154.8	-166.4	8.2	112.9
653	H	22.9	Very low	24.7	Very low	174 Å²	174	152.5 Å²	152.5	81%	0.806	76%	0.756	S	S	*	*			trans	-42.4	152.6	176.7	-56.4	-102.1	0	0	0	115.9
654	T	25.8	Very low	24.8	Very low	121 Å²	121	152.3 Å²	152.3	74%	0.742	75%	0.75	S	S	*	*				-178.8	150.2	101.2	32.6	0	0	0	0	111.9
655	H	25.7	Very low	24.9	Very low	168 Å²	168	147.2 Å²	147.2	78%	0.778	74%	0.743	S	S	*	*			trans	40.2	143.7	143.7	-76.7	-119.6	0	0	0	120.2
656	L	24.2	Very low	25.2	Very low	117 Å²	117	148.4 Å²	148.4	61%	0.613	74%	0.742	S	S	*	*			cis	171.5	153.4	-8.8	-142	150.8	0	0	0	102.9
657	Q	24.4	Very low	25.3	Very low	163 Å²	163	146.8 Å²	146.8	76%	0.762	73%	0.734	S	S	*	*			trans	60.6	103.6	155.8	-97.2	160.2	-1.3	0	0	120.7
658	S	25.1	Very low	25.5	Very low	102 Å²	102	148.9 Å²	148.9	71%	0.713	74%	0.739	S	S	*	*				76.8	157.6	119.6	71.1	0	0	0	0	121.6
659	F	25.4	Very low	25.4	Very low	183 Å²	183	154.8 Å²	154.8	80%	0.803	75%	0.745	S	S	*	*			trans	71.9	91.7	173.4	-83.8	-89.8	0	0	0	117.7
660	E	22.7	Very low	25.7	Very low	188 Å²	188	158.1 Å²	158.1	88%	0.879	75%	0.753	S	S	*	*			trans	-49.9	126.7	134	-60.1	171.5	118.1	0	0	109.3
661	E	26.4	Very low	25.7	Very low	132 Å²	132	156.1 Å²	156.1	62%	0.617	75%	0.75	S	S	*	*			trans	-173.8	144.9	138.4	-114.4	-176.6	-169.6	0	0	112.1
662	R	26.6	Very low	25.8	Very low	194 Å²	194	155.2 Å²	155.2	73%	0.732	76%	0.758	S	S	*	*			trans	68.1	99.4	161.2	-56.7	163.7	-149.7	-134.7	4	115
663	L	25.1	Very low	25.8	Very low	140 Å²	140	152.3 Å²	152.3	73%	0.733	75%	0.753	S	S	*	*				81	117.9	83	-78.1	163.9	0	0	0	113.3
664	E	25	Very low	26	Very low	166 Å²	166	153.7 Å²	153.7	78%	0.776	76%	0.757	S	S	*	*			trans	74.6	128.6	136.3	-72.5	177.9	173.3	0	0	122
665	V	27.5	Very low	26.1	Very low	116 Å²	116	157.2 Å²	157.2	70%	0.703	76%	0.758	S	S	*	*			trans	72.5	91	141.7	-179.8	0	0	0	0	118
666	N	27.9	Very low	26.2	Very low	147 Å²	147	154.3 Å²	154.3	79%	0.786	76%	0.757	S	S	*	*				-178.1	140.7	104.8	-102.6	-61.2	0	0	0	113.8
667	P	27.2	Very low	26.2	Very low	94 Å²	94	153 Å²	153	61%	0.61	76%	0.757	S	S	*	*			trans	-84.3	169.2	163.2	33.7	-30.1	0	0	0	112.5
668	H	25.3	Very low	26.5	Very low	177 Å²	177	155.7 Å²	155.7	82%	0.819	76%	0.762	S	S	*	*			trans	76.7	95.1	171.4	-51.1	-76.6	0	0	0	119.3
669	R	27	Very low	26.7	Very low	242 Å²	242	155.2 Å²	155.2	91%	0.913	76%	0.759	S	S	*	*			trans	-178.1	148.8	133.3	-100.1	158.8	179.8	-164.8	0.4	108.3
670	M	28.3	Very low	26.9	Very low	174 Å²	174	153 Å²	153	86%	0.857	75%	0.751	S	S	*	*			cis	-168.8	146.5	-28.3	-102.1	-148	82.7	0	0	104.3
671	L	25.1	Very low	27.3	Very low	141 Å²	141	151 Å²	151	74%	0.738	75%	0.747	S	S	*	*			trans	-75.9	170	-179.1	-80	151.7	0	0	0	113.1	Q673	L671-Q673 HydrophobicContact CB-CG 4.4Å
672	P	27.9	Very low	27.4	Very low	123 Å²	123	152.3 Å²	152.3	80%	0.799	75%	0.752	S	S	*	*				-136.8	116.3	100.1	27.8	-11.1	0	0	0	112.2
673	Q	25.9	Very low	27.4	Very low	137 Å²	137	150 Å²	150	64%	0.64	75%	0.754	S	S	*	*				53.3	112	83.3	-77.1	-161.8	-2.5	0	0	116.5	L671	L671-Q673 HydrophobicContact CB-CG 4.4Å
674	F	27.3	Very low	27.5	Very low	203 Å²	203	150 Å²	150	89%	0.89	76%	0.759	S	S	*	*			trans	-136.8	118.8	141.9	-94.1	-81.9	0	0	0	110.5
675	Y	28.3	Very low	27.6	Very low	195 Å²	195	146.5 Å²	146.5	77%	0.765	76%	0.759	S	S	*	*			trans	-18.2	159.4	162.1	-61.8	-96.4	0	0	0	118.9
676	S	26.8	Very low	27.4	Very low	106 Å²	106	151.9 Å²	151.9	74%	0.741	77%	0.768	S	S	*	*			cis	-178.5	-174.8	-18.1	67.1	0	0	0	0	106.8
677	S	26	Very low	27.3	Very low	90 Å²	90	153.2 Å²	153.2	63%	0.629	77%	0.77	S	S	*	*			cis	-155.5	155.2	-3.2	54.3	0	0	0	0	109.7
678	Y	29.8	Very low	27.4	Very low	219 Å²	219	156.5 Å²	156.5	86%	0.859	78%	0.78	S	S	*	*				175.9	142.8	125.8	-108.7	-84.3	0	0	0	109.8
679	S	29.8	Very low	27.5	Very low	92 Å²	92	153.2 Å²	153.2	64%	0.643	78%	0.775	S	S	*	*			trans	-63.9	147.9	-166.9	43	0	0	0	0	115.2
680	Q	28.3	Very low	27.6	Very low	137 Å²	137	146 Å²	146	64%	0.64	77%	0.767	S	S	*	*				51.5	129.5	77.8	-68.3	177.1	-59.3	0	0	112.2	H682	Q680-H682 PolarHBondContact NE2-NE2 3.48Å
681	D	32.5	Very low	27.5	Very low	147 Å²	147	145.8 Å²	145.8	79%	0.786	77%	0.768	S	S	*	*			cis	-128	144.9	43.4	-68.4	-47.7	0	0	0	113.5
682	H	28.6	Very low	27.5	Very low	158 Å²	158	149.1 Å²	149.1	73%	0.731	77%	0.771	S	S	*	*				86.7	115.6	58.1	-83.9	-58.1	0	0	0	116.4	Q680	Q680-H682 PolarHBondContact NE2-NE2 3.48Å
683	L	26.3	Very low	27.3	Very low	147 Å²	147	151.1 Å²	151.1	77%	0.77	77%	0.77	S	S	*	*			trans	52.7	113.6	144.9	-69.6	155.9	0	0	0	121.2
684	T	27.3	Very low	27.3	Very low	138 Å²	138	152.4 Å²	152.4	85%	0.847	78%	0.781	S	S	*	*				165.4	118.6	124.2	34.1	0	0	0	0	108.6
685	A	25.4	Very low	27.2	Very low	94 Å²	94	149.9 Å²	149.9	78%	0.777	78%	0.775	S	S	*	*				87.6	139.3	86.3	0	0	0	0	0	113.4
686	Y	24.2	Very low	27.1	Very low	228 Å²	228	152 Å²	152	89%	0.894	78%	0.782	S	S	*	*			trans	-58.4	138	-174.4	-74.4	-105.6	0	0	0	113.2
687	H	26.2	Very low	27	Very low	176 Å²	176	154 Å²	154	82%	0.815	78%	0.783	S	S	*	*			trans	-160.9	117.5	139.4	-109.7	-70	0	0	0	112
688	I	28.8	Very low	27.1	Very low	163 Å²	163	155.1 Å²	155.1	84%	0.836	79%	0.79	S	S	*	*			trans	-87.1	131.1	151	-64	171.6	0	0	0	106
689	P	28.4	Very low	26.9	Very low	107 Å²	107	150.7 Å²	150.7	70%	0.695	78%	0.782	S	S	*	*			trans	-135.7	149.7	136.8	15.6	5.7	0	0	0	113
690	A	27.9	Very low	26.8	Very low	91 Å²	91	155.2 Å²	155.2	75%	0.752	80%	0.795	S	S	*	*			trans	-78	146.2	176.6	0	0	0	0	0	112.9
691	L	26.8	Very low	26.7	Very low	170 Å²	170	155 Å²	155	89%	0.89	80%	0.797	S	S	*	*			trans	-153.3	86	163.5	-103.1	153.6	0	0	0	106.5
692	R	23.9	Very low	26.6	Very low	211 Å²	211	153.2 Å²	153.2	80%	0.796	80%	0.796	S	S	*	*				34.7	115.4	93	-84.1	-164	177.9	-168.3	1.6	114.9
693	Q	25.4	Very low	26.6	Very low	164 Å²	164	156.4 Å²	156.4	77%	0.766	80%	0.802	S	S	*	*			trans	55	108.4	145.8	-65.3	172.7	-35.3	0	0	117.8
694	N	25.5	Very low	27	Very low	164 Å²	164	155.3 Å²	155.3	88%	0.877	80%	0.801	S	S	*	*				-154.4	122	125.4	-105	-47.8	0	0	0	112.5
695	I	24.7	Very low	27.1	Very low	151 Å²	151	154.4 Å²	154.4	77%	0.774	80%	0.8	S	S	*	*			trans	-75.4	122.2	170.1	-65.9	162.1	0	0	0	107.6
696	R	25.5	Very low	27.6	Very low	239 Å²	239	153.6 Å²	153.6	90%	0.902	79%	0.794	S	S	*	*			trans	-138.4	90.3	157.4	-82.4	-164.5	173.8	170	-0.8	111	S698	R696-S698 PolarHBondContact O-N 3.02Å
697	I	24.9	Very low	28.1	Very low	149 Å²	149	151.2 Å²	151.2	76%	0.764	79%	0.791	S	S	*	*			trans	-59.6	126.8	151	-62	167	0	0	0	106.4
698	S	28.5	Very low	28.5	Very low	112 Å²	112	148.8 Å²	148.8	78%	0.783	78%	0.782	S	S	*	*			trans	-134.6	106.1	167.7	-165.4	0	0	0	0	109.6	R696	R696-S698 PolarHBondContact O-N 3.02Å
699	N	25.7	Very low	28.7	Very low	126 Å²	126	147.9 Å²	147.9	67%	0.674	78%	0.778	S	S	*	*			trans	-60.6	142.5	169.4	-66.3	-42.7	0	0	0	110.3
700	M	28.1	Very low	29.6	Very low	188 Å²	188	152.1 Å²	152.1	93%	0.926	81%	0.805	S	S	*	*			trans	-130	113.1	142.1	-79.1	-145.8	84.7	0	0	109.7
701	I	25.9	Very low	29.7	Very low	131 Å²	131	155.2 Å²	155.2	67%	0.672	81%	0.808	S	S	*	*			trans	-90.9	135.3	174.7	-68.5	163.3	0	0	0	108.5	R703	I701-R703 HydrophobicContact CG2-CG 4.45Å
702	S	31.6	Very low	29.8	Very low	111 Å²	111	154.4 Å²	154.4	78%	0.776	80%	0.803	S	S	*	*			trans	-157.9	96.8	152.7	-79.6	0	0	0	0	106.6
703	R	28.5	Very low	30.2	Very low	225 Å²	225	151.2 Å²	151.2	85%	0.849	80%	0.804	S	S	*	*				53	123.6	95.3	-66.7	-174.3	174.5	-172.9	-1.5	111.8	I701	I701-R703 HydrophobicContact CG2-CG 4.45Å
704	T	33.5	Very low	30.5	Very low	123 Å²	123	150.5 Å²	150.5	76%	0.755	81%	0.806	S	S	*	*			cis	-155.4	143.7	45.9	44.8	0	0	0	0	115.1
705	S	30.8	Very low	30.8	Very low	119 Å²	119	149.6 Å²	149.6	83%	0.832	80%	0.802	S	S	*	*			trans	53.5	140.3	135.1	-47	0	0	0	0	121.4
706	A	34.8	Very low	31.2	Very low	77 Å²	77	149.5 Å²	149.5	64%	0.636	80%	0.803	S	S	*	*			cis	-164.5	152.3	2.6	0	0	0	0	0	112.1
707	E	34.4	Very low	31.6	Very low	178 Å²	178	143.1 Å²	143.1	83%	0.832	80%	0.796	S	S	*	*			trans	59.7	147.3	143	-64.7	173.3	-171	0	0	121.3
708	I	35.6	Very low	32.1	Very low	125 Å²	125	142.7 Å²	142.7	64%	0.641	80%	0.799	S	S	*	*			cis	-163.7	136.9	-9.8	-112.8	165.8	0	0	0	109.3
709	I	32.1	Very low	32.4	Very low	145 Å²	145	145.3 Å²	145.3	74%	0.744	80%	0.8	S	S	*	*			trans	46.8	144.2	139.4	-54	174.4	0	0	0	120.3
710	P	47.7	Very low	33	Very low	195 Å²	195	147 Å²	147	100%	1.266	81%	0.812	S	S	*	*			cis	-105.7	0	7.6	10.3	12.8	0	0	0	116.1

Retrieved 710 of 710 residues in 145.8 ms (Link to these results)

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